data_2jcl
_entry.id                         2jcl

_cell.entry_id                    2jcl
_cell.length_a                    95.93
_cell.length_b                    103.26
_cell.length_c                    121.49
_cell.angle_alpha                 90
_cell.angle_beta                  90
_cell.angle_gamma                 90

_symmetry.entry_id                2jcl
_symmetry.space_group_name_H-M    "P 21 21 21"
_symmetry.Int_Tables_number       19

loop_
_entity.id
_entity.type
A    polymer
B    polymer
SO4! non-polymer

loop_
_entity_poly_seq.entity_id
_entity_poly_seq.num
_entity_poly_seq.mon_id
_entity_poly_seq.hetero
A 1   LYS ?
A 2   LEU ?
A 3   LYS ?
A 4   LEU ?
A 5   SER ?
A 6   ASP ?
A 7   TRP ?
A 8   PHE ?
A 9   ASN ?
A 10  PRO ?
A 11  PHE ?
A 12  LYS ?
A 13  ARG ?
A 14  PRO ?
A 15  GLU ?
A 16  VAL ?
A 17  VAL ?
A 18  THR ?
A 19  MET ?
A 20  THR ?
A 21  LYS ?
A 22  TRP ?
A 23  LYS ?
A 24  ALA ?
A 25  PRO ?
A 26  VAL ?
A 27  VAL ?
A 28  TRP ?
A 29  GLU ?
A 30  GLY ?
A 31  THR ?
A 32  TYR ?
A 33  ASN ?
A 34  ARG ?
A 35  ALA ?
A 36  VAL ?
A 37  LEU ?
A 38  ASP ?
A 39  ASN ?
A 40  TYR ?
A 41  TYR ?
A 42  ALA ?
A 43  LYS ?
A 44  GLN ?
A 45  LYS ?
A 46  ILE ?
A 47  THR ?
A 48  VAL ?
A 49  GLY ?
A 50  LEU ?
A 51  THR ?
A 52  VAL ?
A 53  PHE ?
A 54  ALA ?
A 55  VAL ?
A 56  GLY ?
A 57  ARG ?
A 58  TYR ?
A 59  ILE ?
A 60  GLU ?
A 61  HIS ?
A 62  TYR ?
A 63  LEU ?
A 64  GLU ?
A 65  GLU ?
A 66  PHE ?
A 67  LEU ?
A 68  THR ?
A 69  SER ?
A 70  ALA ?
A 71  ASN ?
A 72  LYS ?
A 73  HIS ?
A 74  PHE ?
A 75  MET ?
A 76  VAL ?
A 77  GLY ?
A 78  HIS ?
A 79  PRO ?
A 80  VAL ?
A 81  ILE ?
A 82  PHE ?
A 83  TYR ?
A 84  ILE ?
A 85  MET ?
A 86  VAL ?
A 87  ASP ?
A 88  ASP ?
A 89  VAL ?
A 90  SER ?
A 91  ARG ?
A 92  MET ?
A 93  PRO ?
A 94  LEU ?
A 95  ILE ?
A 96  GLU ?
A 97  LEU ?
A 98  GLY ?
A 99  PRO ?
A 100 LEU ?
A 101 ARG ?
A 102 SER ?
A 103 PHE ?
A 104 LYS ?
A 105 VAL ?
A 106 PHE ?
A 107 LYS ?
A 108 ILE ?
A 109 LYS ?
A 110 PRO ?
A 111 GLU ?
A 112 LYS ?
A 113 ARG ?
A 114 TRP ?
A 115 GLN ?
A 116 ASP ?
A 117 ILE ?
A 118 SER ?
A 119 MET ?
A 120 MET ?
A 121 ARG ?
A 122 MET ?
A 123 LYS ?
A 124 THR ?
A 125 ILE ?
A 126 GLY ?
A 127 GLU ?
A 128 HIS ?
A 129 ILE ?
A 130 VAL ?
A 131 ALA ?
A 132 HIS ?
A 133 ILE ?
A 134 GLN ?
A 135 HIS ?
A 136 GLU ?
A 137 VAL ?
A 138 ASP ?
A 139 PHE ?
A 140 LEU ?
A 141 PHE ?
A 142 CYS ?
A 143 MET ?
A 144 ASP ?
A 145 VAL ?
A 146 ASP ?
A 147 GLN ?
A 148 VAL ?
A 149 PHE ?
A 150 GLN ?
A 151 ASP ?
A 152 LYS ?
A 153 PHE ?
A 154 GLY ?
A 155 VAL ?
A 156 GLU ?
A 157 THR ?
A 158 LEU ?
A 159 GLY ?
A 160 GLU ?
A 161 SER ?
A 162 VAL ?
A 163 ALA ?
A 164 GLN ?
A 165 LEU ?
A 166 GLN ?
A 167 ALA ?
A 168 TRP ?
A 169 TRP ?
A 170 TYR ?
A 171 LYS ?
A 172 ALA ?
A 173 ASP ?
A 174 PRO ?
A 175 ASN ?
A 176 ASP ?
A 177 PHE ?
A 178 THR ?
A 179 TYR ?
A 180 GLU ?
A 181 ARG ?
A 182 ARG ?
A 183 LYS ?
A 184 GLU ?
A 185 SER ?
A 186 ALA ?
A 187 ALA ?
A 188 TYR ?
A 189 ILE ?
A 190 PRO ?
A 191 PHE ?
A 192 GLY ?
A 193 GLU ?
A 194 GLY ?
A 195 ASP ?
A 196 PHE ?
A 197 TYR ?
A 198 TYR ?
A 199 HIS ?
A 200 ALA ?
A 201 ALA ?
A 202 ILE ?
A 203 PHE ?
A 204 GLY ?
A 205 GLY ?
A 206 THR ?
A 207 PRO ?
A 208 THR ?
A 209 GLN ?
A 210 VAL ?
A 211 LEU ?
A 212 ASN ?
A 213 ILE ?
A 214 THR ?
A 215 GLN ?
A 216 GLU ?
A 217 CYS ?
A 218 PHE ?
A 219 LYS ?
A 220 GLY ?
A 221 ILE ?
A 222 LEU ?
A 223 LYS ?
A 224 ASP ?
A 225 LYS ?
A 226 LYS ?
A 227 ASN ?
A 228 ASP ?
A 229 ILE ?
A 230 GLU ?
A 231 ALA ?
A 232 GLN ?
A 233 TRP ?
A 234 HIS ?
A 235 ASP ?
A 236 GLU ?
A 237 SER ?
A 238 HIS ?
A 239 LEU ?
A 240 ASN ?
A 241 LYS ?
A 242 TYR ?
A 243 PHE ?
A 244 LEU ?
A 245 LEU ?
A 246 ASN ?
A 247 LYS ?
A 248 PRO ?
A 249 THR ?
A 250 LYS ?
A 251 ILE ?
A 252 LEU ?
A 253 SER ?
A 254 PRO ?
A 255 GLU ?
A 256 TYR ?
A 257 CYS ?
A 258 TRP ?
A 259 ASP ?
A 260 TYR ?
A 261 HIS ?
A 262 ILE ?
A 263 GLY ?
A 264 LEU ?
A 265 PRO ?
A 266 ALA ?
A 267 ASP ?
A 268 ILE ?
A 269 LYS ?
A 270 LEU ?
A 271 VAL ?
A 272 LYS ?
A 273 MET ?
A 274 SER ?
A 275 TRP ?
A 276 GLN ?
A 277 THR ?
B 1   LYS ?
B 2   LEU ?
B 3   LYS ?
B 4   LEU ?
B 5   SER ?
B 6   ASP ?
B 7   TRP ?
B 8   PHE ?
B 9   ASN ?
B 10  PRO ?
B 11  PHE ?
B 12  LYS ?
B 13  ARG ?
B 14  PRO ?
B 15  GLU ?
B 16  VAL ?
B 17  VAL ?
B 18  THR ?
B 19  MET ?
B 20  THR ?
B 21  LYS ?
B 22  TRP ?
B 23  LYS ?
B 24  ALA ?
B 25  PRO ?
B 26  VAL ?
B 27  VAL ?
B 28  TRP ?
B 29  GLU ?
B 30  GLY ?
B 31  THR ?
B 32  TYR ?
B 33  ASN ?
B 34  ARG ?
B 35  ALA ?
B 36  VAL ?
B 37  LEU ?
B 38  ASP ?
B 39  ASN ?
B 40  TYR ?
B 41  TYR ?
B 42  ALA ?
B 43  LYS ?
B 44  GLN ?
B 45  LYS ?
B 46  ILE ?
B 47  THR ?
B 48  VAL ?
B 49  GLY ?
B 50  LEU ?
B 51  THR ?
B 52  VAL ?
B 53  PHE ?
B 54  ALA ?
B 55  VAL ?
B 56  GLY ?
B 57  ARG ?
B 58  TYR ?
B 59  ILE ?
B 60  GLU ?
B 61  HIS ?
B 62  TYR ?
B 63  LEU ?
B 64  GLU ?
B 65  GLU ?
B 66  PHE ?
B 67  LEU ?
B 68  THR ?
B 69  SER ?
B 70  ALA ?
B 71  ASN ?
B 72  LYS ?
B 73  HIS ?
B 74  PHE ?
B 75  MET ?
B 76  VAL ?
B 77  GLY ?
B 78  HIS ?
B 79  PRO ?
B 80  VAL ?
B 81  ILE ?
B 82  PHE ?
B 83  TYR ?
B 84  ILE ?
B 85  MET ?
B 86  VAL ?
B 87  ASP ?
B 88  ASP ?
B 89  VAL ?
B 90  SER ?
B 91  ARG ?
B 92  MET ?
B 93  PRO ?
B 94  LEU ?
B 95  ILE ?
B 96  GLU ?
B 97  LEU ?
B 98  GLY ?
B 99  PRO ?
B 100 LEU ?
B 101 ARG ?
B 102 SER ?
B 103 PHE ?
B 104 LYS ?
B 105 VAL ?
B 106 PHE ?
B 107 LYS ?
B 108 ILE ?
B 109 LYS ?
B 110 PRO ?
B 111 GLU ?
B 112 LYS ?
B 113 ARG ?
B 114 TRP ?
B 115 GLN ?
B 116 ASP ?
B 117 ILE ?
B 118 SER ?
B 119 MET ?
B 120 MET ?
B 121 ARG ?
B 122 MET ?
B 123 LYS ?
B 124 THR ?
B 125 ILE ?
B 126 GLY ?
B 127 GLU ?
B 128 HIS ?
B 129 ILE ?
B 130 VAL ?
B 131 ALA ?
B 132 HIS ?
B 133 ILE ?
B 134 GLN ?
B 135 HIS ?
B 136 GLU ?
B 137 VAL ?
B 138 ASP ?
B 139 PHE ?
B 140 LEU ?
B 141 PHE ?
B 142 CYS ?
B 143 MET ?
B 144 ASP ?
B 145 VAL ?
B 146 ASP ?
B 147 GLN ?
B 148 VAL ?
B 149 PHE ?
B 150 GLN ?
B 151 ASP ?
B 152 LYS ?
B 153 PHE ?
B 154 GLY ?
B 155 VAL ?
B 156 GLU ?
B 157 THR ?
B 158 LEU ?
B 159 GLY ?
B 160 GLU ?
B 161 SER ?
B 162 VAL ?
B 163 ALA ?
B 164 GLN ?
B 165 LEU ?
B 166 GLN ?
B 167 ALA ?
B 168 TRP ?
B 169 TRP ?
B 170 TYR ?
B 171 LYS ?
B 172 ALA ?
B 173 ASP ?
B 174 PRO ?
B 175 ASN ?
B 176 ASP ?
B 177 PHE ?
B 178 THR ?
B 179 TYR ?
B 180 GLU ?
B 181 ARG ?
B 182 ARG ?
B 183 LYS ?
B 184 GLU ?
B 185 SER ?
B 186 ALA ?
B 187 ALA ?
B 188 TYR ?
B 189 ILE ?
B 190 PRO ?
B 191 PHE ?
B 192 GLY ?
B 193 GLU ?
B 194 GLY ?
B 195 ASP ?
B 196 PHE ?
B 197 TYR ?
B 198 TYR ?
B 199 HIS ?
B 200 ALA ?
B 201 ALA ?
B 202 ILE ?
B 203 PHE ?
B 204 GLY ?
B 205 GLY ?
B 206 THR ?
B 207 PRO ?
B 208 THR ?
B 209 GLN ?
B 210 VAL ?
B 211 LEU ?
B 212 ASN ?
B 213 ILE ?
B 214 THR ?
B 215 GLN ?
B 216 GLU ?
B 217 CYS ?
B 218 PHE ?
B 219 LYS ?
B 220 GLY ?
B 221 ILE ?
B 222 LEU ?
B 223 LYS ?
B 224 ASP ?
B 225 LYS ?
B 226 LYS ?
B 227 ASN ?
B 228 ASP ?
B 229 ILE ?
B 230 GLU ?
B 231 ALA ?
B 232 GLN ?
B 233 TRP ?
B 234 HIS ?
B 235 ASP ?
B 236 GLU ?
B 237 SER ?
B 238 HIS ?
B 239 LEU ?
B 240 ASN ?
B 241 LYS ?
B 242 TYR ?
B 243 PHE ?
B 244 LEU ?
B 245 LEU ?
B 246 ASN ?
B 247 LYS ?
B 248 PRO ?
B 249 THR ?
B 250 LYS ?
B 251 ILE ?
B 252 LEU ?
B 253 SER ?
B 254 PRO ?
B 255 GLU ?
B 256 TYR ?
B 257 CYS ?
B 258 TRP ?
B 259 ASP ?
B 260 TYR ?
B 261 HIS ?
B 262 ILE ?
B 263 GLY ?
B 264 LEU ?
B 265 PRO ?
B 266 ALA ?
B 267 ASP ?
B 268 ILE ?
B 269 LYS ?
B 270 LEU ?
B 271 VAL ?
B 272 LYS ?
B 273 MET ?
B 274 SER ?
B 275 TRP ?
B 276 GLN ?
B 277 THR ?

loop_
_software.pdbx_ordinal
_software.classification
_software.name
_software.version
_software.date
_software.description
1 refinement refmac '5.8.0430 (refmacat 0.4.77)' 2024-05-20 '(un)restrained refinement or idealisation of macromolecular structures'

_refine.details                   "Hydrogens have been added in their riding positions"
_refine.B_iso_mean                46.600
_refine.aniso_B[1][1]             0.682
_refine.aniso_B[2][2]             -1.686
_refine.aniso_B[3][3]             1.003
_refine.aniso_B[1][2]             -0.000
_refine.aniso_B[1][3]             -0.000
_refine.aniso_B[2][3]             0.000
_refine.solvent_model_details     "MASK BULK SOLVENT"
_refine.pdbx_solvent_vdw_probe_radii 1.200
_refine.pdbx_solvent_ion_probe_radii 0.800
_refine.pdbx_solvent_shrinkage_radii 0.800
_refine.ls_d_res_high             3.291
_refine.ls_d_res_low              25.828
_refine.ls_number_reflns_R_work   17708
_refine.ls_number_reflns_R_free   960
_refine.ls_number_reflns_obs      18668
_refine.ls_R_factor_R_work        0.1953
_refine.ls_R_factor_R_free        0.2551
_refine.ls_R_factor_all           0.198
_refine.ls_wR_factor_R_work       0.171
_refine.ls_wR_factor_R_free       0.220
_refine.ls_percent_reflns_obs     98.814
_refine.ls_percent_reflns_R_free  5.142
_refine.correlation_coeff_Fo_to_Fc 0.913
_refine.correlation_coeff_Fo_to_Fc_free 0.869
_refine.pdbx_overall_ESU_R        ?
_refine.pdbx_overall_ESU_R_Free   0.439
_refine.overall_SU_ML             0.312
_refine.overall_SU_B              19.274
_refine.pdbx_average_fsc_overall  ?
_refine.pdbx_average_fsc_work     0.9705
_refine.pdbx_average_fsc_free     0.9522
_refine.entry_id                  2jcl
_refine.pdbx_refine_id            "X-RAY DIFFRACTION"

loop_
_refine_ls_shell.pdbx_total_number_of_bins_used
_refine_ls_shell.d_res_low
_refine_ls_shell.d_res_high
_refine_ls_shell.number_reflns_all
_refine_ls_shell.percent_reflns_obs
_refine_ls_shell.number_reflns_R_work
_refine_ls_shell.R_factor_R_work
_refine_ls_shell.R_factor_all
_refine_ls_shell.number_reflns_R_free
_refine_ls_shell.R_factor_R_free
_refine_ls_shell.wR_factor_R_work
_refine_ls_shell.pdbx_fsc_work
_refine_ls_shell.pdbx_fsc_free
_refine_ls_shell.pdbx_refine_id
20 25.828 12.866 319  67.7116  208  1.363 1.398 8  2.940 1.408 0.662 0.430 "X-RAY DIFFRACTION"
20 12.866 9.721  450  98.4444  418  0.256 0.254 25 0.237 0.249 0.962 0.980 "X-RAY DIFFRACTION"
20 9.721  8.131  541  100.0000 520  0.188 0.189 21 0.209 0.180 0.982 0.982 "X-RAY DIFFRACTION"
20 8.131  7.131  628  100.0000 607  0.195 0.197 21 0.235 0.173 0.975 0.966 "X-RAY DIFFRACTION"
20 7.131  6.427  684  100.0000 649  0.217 0.223 35 0.332 0.179 0.969 0.932 "X-RAY DIFFRACTION"
20 6.427  5.898  768  100.0000 728  0.182 0.185 40 0.246 0.149 0.977 0.957 "X-RAY DIFFRACTION"
20 5.898  5.481  820  100.0000 778  0.173 0.176 42 0.224 0.142 0.981 0.967 "X-RAY DIFFRACTION"
20 5.481  5.141  870  99.8851  833  0.180 0.185 36 0.330 0.154 0.978 0.939 "X-RAY DIFFRACTION"
20 5.141  4.858  906  100.0000 859  0.165 0.170 47 0.263 0.141 0.983 0.956 "X-RAY DIFFRACTION"
20 4.858  4.617  982  100.0000 920  0.149 0.151 62 0.169 0.128 0.985 0.983 "X-RAY DIFFRACTION"
20 4.617  4.408  1013 100.0000 959  0.146 0.149 54 0.213 0.124 0.986 0.976 "X-RAY DIFFRACTION"
20 4.408  4.226  1051 100.0000 1001 0.158 0.159 50 0.190 0.132 0.984 0.975 "X-RAY DIFFRACTION"
20 4.226  4.064  1099 100.0000 1037 0.151 0.154 62 0.215 0.129 0.985 0.970 "X-RAY DIFFRACTION"
20 4.064  3.920  1132 100.0000 1066 0.170 0.175 66 0.276 0.144 0.982 0.949 "X-RAY DIFFRACTION"
20 3.920  3.790  1164 100.0000 1106 0.173 0.174 58 0.202 0.144 0.981 0.976 "X-RAY DIFFRACTION"
20 3.790  3.672  1214 100.0000 1155 0.209 0.213 59 0.282 0.180 0.971 0.947 "X-RAY DIFFRACTION"
20 3.672  3.564  1259 100.0000 1206 0.228 0.231 53 0.304 0.197 0.965 0.935 "X-RAY DIFFRACTION"
20 3.564  3.466  1266 100.0000 1179 0.216 0.220 87 0.273 0.184 0.968 0.949 "X-RAY DIFFRACTION"
20 3.466  3.375  1323 100.0000 1266 0.242 0.249 57 0.397 0.209 0.958 0.915 "X-RAY DIFFRACTION"
20 3.375  3.291  1352 95.4142  1213 0.264 0.266 77 0.280 0.233 0.950 0.948 "X-RAY DIFFRACTION"

loop_
_refine_ls_restr.type
_refine_ls_restr.number
_refine_ls_restr.dev_ideal
_refine_ls_restr.dev_ideal_target
_refine_ls_restr.pdbx_refine_id
r_bond_refined_d             4778  0.006  0.012  "X-RAY DIFFRACTION"
r_bond_other_d               4436  0.001  0.016  "X-RAY DIFFRACTION"
r_angle_refined_deg          6478  1.628  1.820  "X-RAY DIFFRACTION"
r_angle_other_deg            10236 0.568  1.773  "X-RAY DIFFRACTION"
r_dihedral_angle_1_deg       552   7.754  5.000  "X-RAY DIFFRACTION"
r_dihedral_angle_2_deg       18    5.532  5.000  "X-RAY DIFFRACTION"
r_dihedral_angle_3_deg       826   19.380 10.000 "X-RAY DIFFRACTION"
r_dihedral_angle_6_deg       230   15.626 10.000 "X-RAY DIFFRACTION"
r_chiral_restr               677   0.075  0.200  "X-RAY DIFFRACTION"
r_gen_planes_refined         5500  0.006  0.020  "X-RAY DIFFRACTION"
r_gen_planes_other           1136  0.002  0.020  "X-RAY DIFFRACTION"
r_nbd_refined                1340  0.251  0.200  "X-RAY DIFFRACTION"
r_symmetry_nbd_other         5037  0.226  0.200  "X-RAY DIFFRACTION"
r_nbtor_refined              2309  0.207  0.200  "X-RAY DIFFRACTION"
r_symmetry_nbtor_other       2714  0.089  0.200  "X-RAY DIFFRACTION"
r_xyhbond_nbd_refined        180   0.164  0.200  "X-RAY DIFFRACTION"
r_symmetry_xyhbond_nbd_other 8     0.034  0.200  "X-RAY DIFFRACTION"
r_symmetry_nbd_refined       10    0.151  0.200  "X-RAY DIFFRACTION"
r_nbd_other                  42    0.189  0.200  "X-RAY DIFFRACTION"
r_mcbond_it                  2214  3.088  4.422  "X-RAY DIFFRACTION"
r_mcbond_other               2214  3.088  4.422  "X-RAY DIFFRACTION"
r_mcangle_it                 2764  5.066  7.928  "X-RAY DIFFRACTION"
r_mcangle_other              2765  5.065  7.930  "X-RAY DIFFRACTION"
r_scbond_it                  2564  3.328  4.846  "X-RAY DIFFRACTION"
r_scbond_other               2545  3.225  4.804  "X-RAY DIFFRACTION"
r_scangle_it                 3714  5.408  8.741  "X-RAY DIFFRACTION"
r_scangle_other              3685  5.272  8.666  "X-RAY DIFFRACTION"
r_lrange_it                  21341 9.933  53.440 "X-RAY DIFFRACTION"
r_lrange_other               21342 9.933  53.441 "X-RAY DIFFRACTION"

_ccp4_form_factor.scat_method     'Sum of Gaussians'
_ccp4_form_factor.scat_data_source X-ray

loop_
_atom_type.symbol
_atom_type.pdbx_scat_Z
_atom_type.pdbx_N_electrons
_atom_type.scat_Cromer_Mann_a1
_atom_type.scat_Cromer_Mann_b1
_atom_type.scat_Cromer_Mann_a2
_atom_type.scat_Cromer_Mann_b2
_atom_type.scat_Cromer_Mann_a3
_atom_type.scat_Cromer_Mann_b3
_atom_type.scat_Cromer_Mann_a4
_atom_type.scat_Cromer_Mann_b4
_atom_type.scat_Cromer_Mann_c
N 7  7  12.2220 0.0057  3.1346 9.8933  2.0141 28.9975 1.1672 0.5826  -11.5379
C 6  6  2.3103  20.8439 1.0201 10.2075 1.5888 0.5687  0.8651 51.6512 0.2156
O 8  8  3.0487  13.2771 2.2870 5.7011  1.5464 0.3239  0.8671 32.9089 0.2508
H 1  1  0.4930  10.5109 0.3229 26.1257 0.1402 3.1424  0.0408 57.7997 0.0030
S 16 16 6.9054  1.4679  5.2035 22.2151 1.4379 0.2536  1.5863 56.1720 1.0173

_ccp4_reflns_twin.number_of_domains 1

_ccp4_refine_ls.jelly_body        yes
_ccp4_refine_ls.jelly_body_dist   4.200
_ccp4_refine_ls.jelly_body_sigma  0.010

_ccp4_refine.details              "U values: refined individually"

loop_
_atom_site.group_PDB
_atom_site.id
_atom_site.type_symbol
_atom_site.label_atom_id
_atom_site.label_alt_id
_atom_site.label_comp_id
_atom_site.label_asym_id
_atom_site.label_entity_id
_atom_site.label_seq_id
_atom_site.pdbx_PDB_ins_code
_atom_site.Cartn_x
_atom_site.Cartn_y
_atom_site.Cartn_z
_atom_site.occupancy
_atom_site.B_iso_or_equiv
_atom_site.pdbx_formal_charge
_atom_site.auth_seq_id
_atom_site.auth_asym_id
_atom_site.pdbx_PDB_model_num
_atom_site.calc_flag
ATOM 1    N N    . LYS Axp A    1   ? 38.772 15.636  37.484  1    99.488  ? 1082 A 1 .
ATOM 2    C CA   . LYS Axp A    1   ? 38.212 15.538  36.108  1    97.809  ? 1082 A 1 .
ATOM 3    C C    . LYS Axp A    1   ? 38.628 16.786  35.336  1    85.941  ? 1082 A 1 .
ATOM 4    O O    . LYS Axp A    1   ? 39.813 17.097  35.259  1    84.282  ? 1082 A 1 .
ATOM 5    C CB   . LYS Axp A    1   ? 36.684 15.364  36.089  1    102.743 ? 1082 A 1 .
ATOM 6    C CG   . LYS Axp A    1   ? 36.113 14.032  36.568  1    108.971 ? 1082 A 1 .
ATOM 7    C CD   . LYS Axp A    1   ? 35.682 13.992  38.032  1    106.426 ? 1082 A 1 .
ATOM 8    C CE   . LYS Axp A    1   ? 35.021 12.701  38.421  1    100.374 ? 1082 A 1 .
ATOM 9    N NZ   . LYS Axp A    1   ? 34.579 12.737  39.817  1    96.212  ? 1082 A 1 .
ATOM 10   H H    . LYS Axp A    1   ? 38.604 14.876  37.939  1    98.975  ? 1082 A 1 c
ATOM 11   H H2   . LYS Axp A    1   ? 38.394 16.329  37.921  1    98.883  ? 1082 A 1 c
ATOM 12   H H3   . LYS Axp A    1   ? 39.664 15.764  37.448  1    98.879  ? 1082 A 1 c
ATOM 13   H HA   . LYS Axp A    1   ? 38.62  14.749  35.667  1    96.675  ? 1082 A 1 c
ATOM 14   H HB3  . LYS Axp A    1   ? 36.373 15.497  35.169  1    102.318 ? 1082 A 1 c
ATOM 15   H HB2  . LYS Axp A    1   ? 36.29  16.075  36.638  1    102.477 ? 1082 A 1 c
ATOM 16   H HG3  . LYS Axp A    1   ? 36.791 13.337  36.421  1    106.939 ? 1082 A 1 c
ATOM 17   H HG2  . LYS Axp A    1   ? 35.339 13.81   36.007  1    106.939 ? 1082 A 1 c
ATOM 18   H HD3  . LYS Axp A    1   ? 35.059 14.732  38.2    1    105.55  ? 1082 A 1 c
ATOM 19   H HD2  . LYS Axp A    1   ? 36.471 14.129  38.6    1    105.514 ? 1082 A 1 c
ATOM 20   H HE3  . LYS Axp A    1   ? 35.648 11.964  38.304  1    100.707 ? 1082 A 1 c
ATOM 21   H HE2  . LYS Axp A    1   ? 34.251 12.541  37.847  1    100.706 ? 1082 A 1 c
ATOM 22   H HZ1  . LYS Axp A    1   ? 34.024 13.442  39.945  1    97.523  ? 1082 A 1 c
ATOM 23   H HZ2  . LYS Axp A    1   ? 35.297 12.82   40.364  1    97.486  ? 1082 A 1 c
ATOM 24   H HZ3  . LYS Axp A    1   ? 34.138 11.972  40.019  1    97.486  ? 1082 A 1 c
ATOM 25   N N    . LEU Axp A    2   ? 37.635 17.486  34.774  1    75.331  ? 1083 A 1 .
ATOM 26   C CA   . LEU Axp A    2   ? 37.833 18.744  34.082  1    63.538  ? 1083 A 1 .
ATOM 27   C C    . LEU Axp A    2   ? 36.51  19.496  34.094  1    55.172  ? 1083 A 1 .
ATOM 28   O O    . LEU Axp A    2   ? 35.648 19.203  33.278  1    54.363  ? 1083 A 1 .
ATOM 29   C CB   . LEU Axp A    2   ? 38.267 18.493  32.642  1    62.068  ? 1083 A 1 .
ATOM 30   C CG   . LEU Axp A    2   ? 38.207 19.73   31.737  1    61.036  ? 1083 A 1 .
ATOM 31   C CD1  . LEU Axp A    2   ? 39.488 20.55   31.865  1    59.989  ? 1083 A 1 .
ATOM 32   C CD2  . LEU Axp A    2   ? 37.89  19.398  30.288  1    57.463  ? 1083 A 1 .
ATOM 33   H H    . LEU Axp A    2   ? 36.785 17.16   34.821  1    75.397  ? 1083 A 1 c
ATOM 34   H HA   . LEU Axp A    2   ? 38.524 19.273  34.556  1    63.865  ? 1083 A 1 c
ATOM 35   H HB3  . LEU Axp A    2   ? 37.688 17.793  32.262  1    62.064  ? 1083 A 1 c
ATOM 36   H HB2  . LEU Axp A    2   ? 39.193 18.156  32.652  1    62.133  ? 1083 A 1 c
ATOM 37   H HG   . LEU Axp A    2   ? 37.47  20.306  32.061  1    60.281  ? 1083 A 1 c
ATOM 38   H HD11 . LEU Axp A    2   ? 39.627 20.792  32.796  1    60.295  ? 1083 A 1 c
ATOM 39   H HD12 . LEU Axp A    2   ? 39.412 21.358  31.33   1    60.295  ? 1083 A 1 c
ATOM 40   H HD13 . LEU Axp A    2   ? 40.243 20.025  31.552  1    60.295  ? 1083 A 1 c
ATOM 41   H HD21 . LEU Axp A    2   ? 37.389 18.566  30.244  1    58.497  ? 1083 A 1 c
ATOM 42   H HD22 . LEU Axp A    2   ? 38.717 19.304  29.788  1    58.313  ? 1083 A 1 c
ATOM 43   H HD23 . LEU Axp A    2   ? 37.359 20.114  29.9    1    58.461  ? 1083 A 1 c
ATOM 44   N N    . LYS Axp A    3   ? 36.358 20.462  35.003  1    53.489  ? 1084 A 1 .
ATOM 45   C CA   . LYS Axp A    3   ? 35.105 21.193  35.14   1    52.46   ? 1084 A 1 .
ATOM 46   C C    . LYS Axp A    3   ? 34.839 22.005  33.874  1    46.751  ? 1084 A 1 .
ATOM 47   O O    . LYS Axp A    3   ? 35.746 22.278  33.095  1    41.428  ? 1084 A 1 .
ATOM 48   C CB   . LYS Axp A    3   ? 35.067 22.203  36.296  1    55.519  ? 1084 A 1 .
ATOM 49   C CG   . LYS Axp A    3   ? 35.357 21.691  37.695  1    58.46   ? 1084 A 1 .
ATOM 50   C CD   . LYS Axp A    3   ? 35.789 22.819  38.628  1    63.105  ? 1084 A 1 .
ATOM 51   C CE   . LYS Axp A    3   ? 36.415 22.344  39.909  1    67.287  ? 1084 A 1 .
ATOM 52   N NZ   . LYS Axp A    3   ? 37.825 21.999  39.686  1    70.225  ? 1084 A 1 .
ATOM 53   H H    . LYS Axp A    3   ? 37.055 20.674  35.555  1    53.828  ? 1084 A 1 c
ATOM 54   H HA   . LYS Axp A    3   ? 34.372 20.536  35.259  1    52.061  ? 1084 A 1 c
ATOM 55   H HB3  . LYS Axp A    3   ? 34.177 22.615  36.307  1    55.345  ? 1084 A 1 c
ATOM 56   H HB2  . LYS Axp A    3   ? 35.711 22.915  36.095  1    55.416  ? 1084 A 1 c
ATOM 57   H HG3  . LYS Axp A    3   ? 36.067 21.015  37.648  1    58.784  ? 1084 A 1 c
ATOM 58   H HG2  . LYS Axp A    3   ? 34.547 21.265  38.053  1    58.782  ? 1084 A 1 c
ATOM 59   H HD3  . LYS Axp A    3   ? 35.004 23.368  38.843  1    62.942  ? 1084 A 1 c
ATOM 60   H HD2  . LYS Axp A    3   ? 36.431 23.392  38.156  1    62.927  ? 1084 A 1 c
ATOM 61   H HE3  . LYS Axp A    3   ? 35.941 21.56   40.238  1    66.985  ? 1084 A 1 c
ATOM 62   H HE2  . LYS Axp A    3   ? 36.359 23.045  40.584  1    66.985  ? 1084 A 1 c
ATOM 63   H HZ1  . LYS Axp A    3   ? 38.288 22.739  39.446  1    69.222  ? 1084 A 1 c
ATOM 64   H HZ2  . LYS Axp A    3   ? 37.893 21.379  39.03   1    69.126  ? 1084 A 1 c
ATOM 65   H HZ3  . LYS Axp A    3   ? 38.18  21.662  40.449  1    69.257  ? 1084 A 1 c
ATOM 66   N N    . LEU Axp A    4   ? 33.575 22.401  33.698  1    44.147  ? 1085 A 1 .
ATOM 67   C CA   . LEU Axp A    4   ? 33.183 23.274  32.608  1    40.995  ? 1085 A 1 .
ATOM 68   C C    . LEU Axp A    4   ? 33.855 24.632  32.787  1    42.666  ? 1085 A 1 .
ATOM 69   O O    . LEU Axp A    4   ? 34.445 25.169  31.85   1    39.747  ? 1085 A 1 .
ATOM 70   C CB   . LEU Axp A    4   ? 31.665 23.41   32.615  1    37.706  ? 1085 A 1 .
ATOM 71   C CG   . LEU Axp A    4   ? 31.087 24.18   31.43   1    36.465  ? 1085 A 1 .
ATOM 72   C CD1  . LEU Axp A    4   ? 31.581 23.58   30.128  1    37.278  ? 1085 A 1 .
ATOM 73   C CD2  . LEU Axp A    4   ? 29.582 24.184  31.475  1    36.343  ? 1085 A 1 .
ATOM 74   H H    . LEU Axp A    4   ? 32.934 22.114  34.283  1    44.025  ? 1085 A 1 c
ATOM 75   H HA   . LEU Axp A    4   ? 33.481 22.87   31.754  1    41.217  ? 1085 A 1 c
ATOM 76   H HB3  . LEU Axp A    4   ? 31.398 23.867  33.446  1    38.207  ? 1085 A 1 c
ATOM 77   H HB2  . LEU Axp A    4   ? 31.273 22.506  32.622  1    38.189  ? 1085 A 1 c
ATOM 78   H HG   . LEU Axp A    4   ? 31.404 25.118  31.479  1    36.843  ? 1085 A 1 c
ATOM 79   H HD11 . LEU Axp A    4   ? 32.456 23.945  29.913  1    37.056  ? 1085 A 1 c
ATOM 80   H HD12 . LEU Axp A    4   ? 30.958 23.794  29.414  1    37.037  ? 1085 A 1 c
ATOM 81   H HD13 . LEU Axp A    4   ? 31.648 22.615  30.22   1    37.043  ? 1085 A 1 c
ATOM 82   H HD21 . LEU Axp A    4   ? 29.284 24.462  32.358  1    36.38   ? 1085 A 1 c
ATOM 83   H HD22 . LEU Axp A    4   ? 29.249 23.29   31.289  1    36.38   ? 1085 A 1 c
ATOM 84   H HD23 . LEU Axp A    4   ? 29.238 24.802  30.809  1    36.38   ? 1085 A 1 c
ATOM 85   N N    . SER Axp A    5   ? 33.74  25.154  34.019  1    43.929  ? 1086 A 1 .
ATOM 86   C CA   . SER Axp A    5   ? 34.346 26.409  34.437  1    42.279  ? 1086 A 1 .
ATOM 87   C C    . SER Axp A    5   ? 35.814 26.483  34.02   1    39.442  ? 1086 A 1 .
ATOM 88   O O    . SER Axp A    5   ? 36.378 27.559  33.938  1    40.413  ? 1086 A 1 .
ATOM 89   C CB   . SER Axp A    5   ? 34.203 26.605  35.942  1    42.659  ? 1086 A 1 .
ATOM 90   O OG   . SER Axp A    5   ? 35.323 26.088  36.651  1    41.526  ? 1086 A 1 .
ATOM 91   H H    . SER Axp A    5   ? 33.245 24.694  34.635  1    43.155  ? 1086 A 1 c
ATOM 92   H HA   . SER Axp A    5   ? 33.864 27.145  33.982  1    42.125  ? 1086 A 1 c
ATOM 93   H HB3  . SER Axp A    5   ? 33.391 26.16   36.25   1    42.317  ? 1086 A 1 c
ATOM 94   H HB2  . SER Axp A    5   ? 34.113 27.558  36.133  1    42.304  ? 1086 A 1 c
ATOM 95   H HG   . SER Axp A    5   ? 35.262 26.217  37.436  0    38.6    ? 1086 A 1 c
ATOM 96   N N    . ASP Axp A    6   ? 36.447 25.334  33.783  1    39      ? 1087 A 1 .
ATOM 97   C CA   . ASP Axp A    6   ? 37.884 25.279  33.608  1    37.202  ? 1087 A 1 .
ATOM 98   C C    . ASP Axp A    6   ? 38.271 25.685  32.193  1    34.681  ? 1087 A 1 .
ATOM 99   O O    . ASP Axp A    6   ? 39.446 25.917  31.957  1    37.025  ? 1087 A 1 .
ATOM 100  C CB   . ASP Axp A    6   ? 38.436 23.9    33.93   1    39.027  ? 1087 A 1 .
ATOM 101  C CG   . ASP Axp A    6   ? 38.345 23.46   35.387  1    43.222  ? 1087 A 1 .
ATOM 102  O OD1  . ASP Axp A    6   ? 38.165 24.33   36.276  1    46.727  ? 1087 A 1 .
ATOM 103  O OD2  . ASP Axp A    6   ? 38.444 22.241  35.625  1    45.36   ? 1087 A 1 .
ATOM 104  H H    . ASP Axp A    6   ? 35.975 24.553  33.751  1    38.82   ? 1087 A 1 c
ATOM 105  H HA   . ASP Axp A    6   ? 38.296 25.915  34.236  1    37.465  ? 1087 A 1 c
ATOM 106  H HB3  . ASP Axp A    6   ? 39.383 23.88   33.677  1    39.48   ? 1087 A 1 c
ATOM 107  H HB2  . ASP Axp A    6   ? 37.972 23.238  33.379  1    39.519  ? 1087 A 1 c
ATOM 108  N N    . TRP Axp A    7   ? 37.319 25.756  31.256  1    32.793  ? 1088 A 1 .
ATOM 109  C CA   . TRP Axp A    7   ? 37.649 26.168  29.895  1    33.256  ? 1088 A 1 .
ATOM 110  C C    . TRP Axp A    7   ? 36.559 27.028  29.266  1    32.886  ? 1088 A 1 .
ATOM 111  O O    . TRP Axp A    7   ? 36.783 27.677  28.244  1    31.839  ? 1088 A 1 .
ATOM 112  C CB   . TRP Axp A    7   ? 37.879 24.937  29.013  1    33.994  ? 1088 A 1 .
ATOM 113  C CG   . TRP Axp A    7   ? 36.628 24.132  28.824  1    32.483  ? 1088 A 1 .
ATOM 114  C CD1  . TRP Axp A    7   ? 36.185 23.1    29.591  1    32.264  ? 1088 A 1 .
ATOM 115  C CD2  . TRP Axp A    7   ? 35.637 24.339  27.807  1    31.323  ? 1088 A 1 .
ATOM 116  N NE1  . TRP Axp A    7   ? 34.981 22.657  29.123  1    33.012  ? 1088 A 1 .
ATOM 117  C CE2  . TRP Axp A    7   ? 34.624 23.389  28.025  1    31.991  ? 1088 A 1 .
ATOM 118  C CE3  . TRP Axp A    7   ? 35.517 25.223  26.738  1    31.889  ? 1088 A 1 .
ATOM 119  C CZ2  . TRP Axp A    7   ? 33.502 23.297  27.209  1    32.329  ? 1088 A 1 .
ATOM 120  C CZ3  . TRP Axp A    7   ? 34.413 25.119  25.922  1    32.85   ? 1088 A 1 .
ATOM 121  C CH2  . TRP Axp A    7   ? 33.42  24.175  26.158  1    32.122  ? 1088 A 1 .
ATOM 122  H H    . TRP Axp A    7   ? 36.465 25.501  31.453  1    33.445  ? 1088 A 1 c
ATOM 123  H HA   . TRP Axp A    7   ? 38.491 26.697  29.919  1    33.261  ? 1088 A 1 c
ATOM 124  H HB3  . TRP Axp A    7   ? 38.564 24.373  29.431  1    33.472  ? 1088 A 1 c
ATOM 125  H HB2  . TRP Axp A    7   ? 38.205 25.234  28.137  1    33.472  ? 1088 A 1 c
ATOM 126  H HD1  . TRP Axp A    7   ? 36.624 22.751  30.35   1    32.483  ? 1088 A 1 c
ATOM 127  H HE1  . TRP Axp A    7   ? 34.524 21.994  29.46   1    32.586  ? 1088 A 1 c
ATOM 128  H HE3  . TRP Axp A    7   ? 36.188 25.859  26.563  1    31.989  ? 1088 A 1 c
ATOM 129  H HZ2  . TRP Axp A    7   ? 32.831 22.656  27.369  1    32.207  ? 1088 A 1 c
ATOM 130  H HZ3  . TRP Axp A    7   ? 34.318 25.715  25.198  1    32.442  ? 1088 A 1 c
ATOM 131  H HH2  . TRP Axp A    7   ? 32.67  24.147  25.594  1    32.311  ? 1088 A 1 c
ATOM 132  N N    . PHE Axp A    8   ? 35.357 26.969  29.832  1    33.873  ? 1089 A 1 .
ATOM 133  C CA   . PHE Axp A    8   ? 34.245 27.696  29.259  1    36.228  ? 1089 A 1 .
ATOM 134  C C    . PHE Axp A    8   ? 33.921 28.9    30.137  1    37.744  ? 1089 A 1 .
ATOM 135  O O    . PHE Axp A    8   ? 33.563 28.756  31.308  1    38.006  ? 1089 A 1 .
ATOM 136  C CB   . PHE Axp A    8   ? 33.049 26.754  29.127  1    37.279  ? 1089 A 1 .
ATOM 137  C CG   . PHE Axp A    8   ? 31.927 27.334  28.281  1    36.981  ? 1089 A 1 .
ATOM 138  C CD1  . PHE Axp A    8   ? 32.165 27.745  26.977  1    38.151  ? 1089 A 1 .
ATOM 139  C CD2  . PHE Axp A    8   ? 30.658 27.515  28.813  1    36.719  ? 1089 A 1 .
ATOM 140  C CE1  . PHE Axp A    8   ? 31.144 28.274  26.209  1    39.547  ? 1089 A 1 .
ATOM 141  C CE2  . PHE Axp A    8   ? 29.641 28.049  28.044  1    37.827  ? 1089 A 1 .
ATOM 142  C CZ   . PHE Axp A    8   ? 29.889 28.442  26.75   1    39.335  ? 1089 A 1 .
ATOM 143  H H    . PHE Axp A    8   ? 35.218 26.467  30.582  1    34.127  ? 1089 A 1 c
ATOM 144  H HA   . PHE Axp A    8   ? 34.5   28.013  28.356  1    36.163  ? 1089 A 1 c
ATOM 145  H HB3  . PHE Axp A    8   ? 32.705 26.554  30.025  1    36.969  ? 1089 A 1 c
ATOM 146  H HB2  . PHE Axp A    8   ? 33.354 25.913  28.721  1    36.922  ? 1089 A 1 c
ATOM 147  H HD1  . PHE Axp A    8   ? 33.023 27.632  26.601  1    38.174  ? 1089 A 1 c
ATOM 148  H HD2  . PHE Axp A    8   ? 30.483 27.249  29.702  1    37.075  ? 1089 A 1 c
ATOM 149  H HE1  . PHE Axp A    8   ? 31.313 28.541  25.32   1    38.874  ? 1089 A 1 c
ATOM 150  H HE2  . PHE Axp A    8   ? 28.78  28.16   28.414  1    37.918  ? 1089 A 1 c
ATOM 151  H HZ   . PHE Axp A    8   ? 29.194 28.806  26.227  1    38.961  ? 1089 A 1 c
ATOM 152  N N    . ASN Axp A    9   ? 34.046 30.098  29.564  1    36.892  ? 1090 A 1 .
ATOM 153  C CA   . ASN Axp A    9   ? 33.591 31.278  30.27   1    35.218  ? 1090 A 1 .
ATOM 154  C C    . ASN Axp A    9   ? 32.459 31.922  29.48   1    37.756  ? 1090 A 1 .
ATOM 155  O O    . ASN Axp A    9   ? 32.682 32.811  28.669  1    37.618  ? 1090 A 1 .
ATOM 156  C CB   . ASN Axp A    9   ? 34.707 32.26   30.578  1    32.149  ? 1090 A 1 .
ATOM 157  C CG   . ASN Axp A    9   ? 34.171 33.425  31.37   1    31.47   ? 1090 A 1 .
ATOM 158  O OD1  . ASN Axp A    9   ? 32.991 33.435  31.76   1    32.423  ? 1090 A 1 .
ATOM 159  N ND2  . ASN Axp A    9   ? 35.022 34.406  31.63   1    30.733  ? 1090 A 1 .
ATOM 160  H H    . ASN Axp A    9   ? 34.419 30.183  28.734  1    36.675  ? 1090 A 1 c
ATOM 161  H HA   . ASN Axp A    9   ? 33.229 30.988  31.134  1    35.485  ? 1090 A 1 c
ATOM 162  H HB3  . ASN Axp A    9   ? 35.098 32.585  29.742  1    32.686  ? 1090 A 1 c
ATOM 163  H HB2  . ASN Axp A    9   ? 35.406 31.81   31.092  1    32.666  ? 1090 A 1 c
ATOM 164  H HD21 . ASN Axp A    9   ? 34.846 34.982  32.281  1    30.971  ? 1090 A 1 c
ATOM 165  H HD22 . ASN Axp A    9   ? 35.765 34.487  31.153  1    31.012  ? 1090 A 1 c
ATOM 166  N N    . PRO Axp A    10  ? 31.19  31.568  29.77   1    40.658  ? 1091 A 1 .
ATOM 167  C CA   . PRO Axp A    10  ? 30.065 32.128  29.039  1    41.312  ? 1091 A 1 .
ATOM 168  C C    . PRO Axp A    10  ? 29.891 33.622  29.294  1    43.014  ? 1091 A 1 .
ATOM 169  O O    . PRO Axp A    10  ? 29.127 34.287  28.599  1    45.802  ? 1091 A 1 .
ATOM 170  C CB   . PRO Axp A    10  ? 28.883 31.315  29.554  1    41.856  ? 1091 A 1 .
ATOM 171  C CG   . PRO Axp A    10  ? 29.304 31.007  30.974  1    43.54   ? 1091 A 1 .
ATOM 172  C CD   . PRO Axp A    10  ? 30.767 30.715  30.89   1    42.512  ? 1091 A 1 .
ATOM 173  H HA   . PRO Axp A    10  ? 30.185 31.969  28.082  1    41.434  ? 1091 A 1 c
ATOM 174  H HB3  . PRO Axp A    10  ? 28.767 30.496  29.037  1    42.114  ? 1091 A 1 c
ATOM 175  H HB2  . PRO Axp A    10  ? 28.058 31.838  29.536  1    42.119  ? 1091 A 1 c
ATOM 176  H HG3  . PRO Axp A    10  ? 28.818 30.232  31.321  1    42.96   ? 1091 A 1 c
ATOM 177  H HG2  . PRO Axp A    10  ? 29.138 31.771  31.559  1    43.13   ? 1091 A 1 c
ATOM 178  H HD3  . PRO Axp A    10  ? 31.225 30.965  31.715  1    42.204  ? 1091 A 1 c
ATOM 179  H HD2  . PRO Axp A    10  ? 30.936 29.773  30.695  1    42.282  ? 1091 A 1 c
ATOM 180  N N    . PHE Axp A    11  ? 30.598 34.146  30.301  1    43.09   ? 1092 A 1 .
ATOM 181  C CA   . PHE Axp A    11  ? 30.377 35.521  30.711  1    45.845  ? 1092 A 1 .
ATOM 182  C C    . PHE Axp A    11  ? 31.167 36.42   29.789  1    37.684  ? 1092 A 1 .
ATOM 183  O O    . PHE Axp A    11  ? 30.954 37.625  29.785  1    36.395  ? 1092 A 1 .
ATOM 184  C CB   . PHE Axp A    11  ? 30.636 35.738  32.207  1    55.544  ? 1092 A 1 .
ATOM 185  C CG   . PHE Axp A    11  ? 29.552 34.983  32.959  1    67.318  ? 1092 A 1 .
ATOM 186  C CD1  . PHE Axp A    11  ? 28.27  35.53   33.069  1    72.493  ? 1092 A 1 .
ATOM 187  C CD2  . PHE Axp A    11  ? 29.768 33.688  33.434  1    67.857  ? 1092 A 1 .
ATOM 188  C CE1  . PHE Axp A    11  ? 27.244 34.821  33.677  1    75.439  ? 1092 A 1 .
ATOM 189  C CE2  . PHE Axp A    11  ? 28.738 32.99   34.054  1    73.284  ? 1092 A 1 .
ATOM 190  C CZ   . PHE Axp A    11  ? 27.48  33.556  34.175  1    75.879  ? 1092 A 1 .
ATOM 191  H H    . PHE Axp A    11  ? 31.206 33.64   30.758  1    43.53   ? 1092 A 1 c
ATOM 192  H HA   . PHE Axp A    11  ? 29.415 35.721  30.555  1    45.427  ? 1092 A 1 c
ATOM 193  H HB3  . PHE Axp A    11  ? 30.584 36.698  32.415  1    55.528  ? 1092 A 1 c
ATOM 194  H HB2  . PHE Axp A    11  ? 31.52  35.385  32.445  1    55.384  ? 1092 A 1 c
ATOM 195  H HD1  . PHE Axp A    11  ? 28.101 36.391  32.72   1    71.84   ? 1092 A 1 c
ATOM 196  H HD2  . PHE Axp A    11  ? 30.622 33.294  33.347  1    68.98   ? 1092 A 1 c
ATOM 197  H HE1  . PHE Axp A    11  ? 26.391 35.214  33.771  1    74.702  ? 1092 A 1 c
ATOM 198  H HE2  . PHE Axp A    11  ? 28.898 32.131  34.398  1    72.516  ? 1092 A 1 c
ATOM 199  H HZ   . PHE Axp A    11  ? 26.788 33.083  34.611  1    75.016  ? 1092 A 1 c
ATOM 200  N N    . LYS Axp A    12  ? 32.036 35.79   29.003  1    36.171  ? 1093 A 1 .
ATOM 201  C CA   . LYS Axp A    12  ? 32.764 36.465  27.947  1    36.018  ? 1093 A 1 .
ATOM 202  C C    . LYS Axp A    12  ? 31.866 36.695  26.737  1    33.785  ? 1093 A 1 .
ATOM 203  O O    . LYS Axp A    12  ? 32.292 37.349  25.799  1    31.071  ? 1093 A 1 .
ATOM 204  C CB   . LYS Axp A    12  ? 33.987 35.648  27.522  1    36.403  ? 1093 A 1 .
ATOM 205  C CG   . LYS Axp A    12  ? 35.156 35.691  28.469  1    36.741  ? 1093 A 1 .
ATOM 206  C CD   . LYS Axp A    12  ? 36.092 36.841  28.158  1    39.962  ? 1093 A 1 .
ATOM 207  C CE   . LYS Axp A    12  ? 37.355 36.753  28.941  1    43.226  ? 1093 A 1 .
ATOM 208  N NZ   . LYS Axp A    12  ? 38.375 37.55   28.265  1    46.354  ? 1093 A 1 .
ATOM 209  H H    . LYS Axp A    12  ? 32.207 34.904  29.145  1    36.69   ? 1093 A 1 c
ATOM 210  H HA   . LYS Axp A    12  ? 33.069 37.342  28.287  1    35.71   ? 1093 A 1 c
ATOM 211  H HB3  . LYS Axp A    12  ? 34.29  35.971  26.647  1    36.392  ? 1093 A 1 c
ATOM 212  H HB2  . LYS Axp A    12  ? 33.715 34.713  27.411  1    36.402  ? 1093 A 1 c
ATOM 213  H HG3  . LYS Axp A    12  ? 35.647 34.843  28.406  1    37.388  ? 1093 A 1 c
ATOM 214  H HG2  . LYS Axp A    12  ? 34.818 35.785  29.386  1    37.286  ? 1093 A 1 c
ATOM 215  H HD3  . LYS Axp A    12  ? 35.642 37.688  28.363  1    39.936  ? 1093 A 1 c
ATOM 216  H HD2  . LYS Axp A    12  ? 36.306 36.833  27.2    1    39.972  ? 1093 A 1 c
ATOM 217  H HE3  . LYS Axp A    12  ? 37.654 35.828  29      1    43.085  ? 1093 A 1 c
ATOM 218  H HE2  . LYS Axp A    12  ? 37.218 37.096  29.842  1    43.149  ? 1093 A 1 c
ATOM 219  H HZ1  . LYS Axp A    12  ? 38.059 38.383  28.102  1    45.323  ? 1093 A 1 c
ATOM 220  H HZ2  . LYS Axp A    12  ? 38.602 37.158  27.48   1    45.319  ? 1093 A 1 c
ATOM 221  H HZ3  . LYS Axp A    12  ? 39.111 37.61   28.79   1    45.35   ? 1093 A 1 c
ATOM 222  N N    . ARG Axp A    13  ? 30.65  36.142  26.731  1    35.169  ? 1094 A 1 .
ATOM 223  C CA   . ARG Axp A    13  ? 29.703 36.433  25.662  1    38.618  ? 1094 A 1 .
ATOM 224  C C    . ARG Axp A    13  ? 28.299 36.601  26.247  1    40.716  ? 1094 A 1 .
ATOM 225  O O    . ARG Axp A    13  ? 27.468 35.704  26.169  1    41.652  ? 1094 A 1 .
ATOM 226  C CB   . ARG Axp A    13  ? 29.741 35.341  24.586  1    36.548  ? 1094 A 1 .
ATOM 227  C CG   . ARG Axp A    13  ? 31.086 35.115  23.909  1    34.63   ? 1094 A 1 .
ATOM 228  C CD   . ARG Axp A    13  ? 31.501 36.244  22.986  1    33.94   ? 1094 A 1 .
ATOM 229  N NE   . ARG Axp A    13  ? 30.451 36.633  22.045  1    32.092  ? 1094 A 1 .
ATOM 230  C CZ   . ARG Axp A    13  ? 30.377 36.32   20.762  1    32.16   ? 1094 A 1 .
ATOM 231  N NH1  . ARG Axp A    13  ? 31.221 35.474  20.199  1    31.286  ? 1094 A 1 .
ATOM 232  N NH2  . ARG Axp A    13  ? 29.405 36.851  20.045  1    34.082  ? 1094 A 1 .
ATOM 233  H H    . ARG Axp A    13  ? 30.407 35.558  27.389  1    35.661  ? 1094 A 1 c
ATOM 234  H HA   . ARG Axp A    13  ? 29.966 37.286  25.234  1    37.864  ? 1094 A 1 c
ATOM 235  H HB3  . ARG Axp A    13  ? 29.078 35.563  23.898  1    36.504  ? 1094 A 1 c
ATOM 236  H HB2  . ARG Axp A    13  ? 29.461 34.497  24.999  1    36.569  ? 1094 A 1 c
ATOM 237  H HG3  . ARG Axp A    13  ? 31.042 34.285  23.386  1    34.862  ? 1094 A 1 c
ATOM 238  H HG2  . ARG Axp A    13  ? 31.777 34.994  24.594  1    34.865  ? 1094 A 1 c
ATOM 239  H HD3  . ARG Axp A    13  ? 32.3   35.987  22.491  1    33.551  ? 1094 A 1 c
ATOM 240  H HD2  . ARG Axp A    13  ? 31.736 37.021  23.531  1    33.61   ? 1094 A 1 c
ATOM 241  H HE   . ARG Axp A    13  ? 29.807 37.125  22.361  1    32.726  ? 1094 A 1 c
ATOM 242  H HH11 . ARG Axp A    13  ? 31.663 34.89   20.692  1    31.619  ? 1094 A 1 c
ATOM 243  H HH12 . ARG Axp A    13  ? 31.33  35.482  19.322  1    31.74   ? 1094 A 1 c
ATOM 244  H HH21 . ARG Axp A    13  ? 28.614 36.992  20.413  1    33.606  ? 1094 A 1 c
ATOM 245  H HH22 . ARG Axp A    13  ? 29.543 37.056  19.199  1    33.629  ? 1094 A 1 c
ATOM 246  N N    . PRO Axp A    14  ? 27.987 37.746  26.886  1    40.33   ? 1095 A 1 .
ATOM 247  C CA   . PRO Axp A    14  ? 26.669 37.934  27.482  1    40.673  ? 1095 A 1 .
ATOM 248  C C    . PRO Axp A    14  ? 25.569 38.062  26.44   1    41.404  ? 1095 A 1 .
ATOM 249  O O    . PRO Axp A    14  ? 24.501 37.469  26.578  1    38.201  ? 1095 A 1 .
ATOM 250  C CB   . PRO Axp A    14  ? 26.813 39.211  28.285  1    42.481  ? 1095 A 1 .
ATOM 251  C CG   . PRO Axp A    14  ? 28.001 39.916  27.64   1    43.041  ? 1095 A 1 .
ATOM 252  C CD   . PRO Axp A    14  ? 28.901 38.879  27.08   1    40.155  ? 1095 A 1 .
ATOM 253  H HA   . PRO Axp A    14  ? 26.469 37.186  28.082  1    41.069  ? 1095 A 1 c
ATOM 254  H HB3  . PRO Axp A    14  ? 26.993 39.013  29.225  1    42.188  ? 1095 A 1 c
ATOM 255  H HB2  . PRO Axp A    14  ? 26.006 39.758  28.224  1    42.185  ? 1095 A 1 c
ATOM 256  H HG3  . PRO Axp A    14  ? 28.48  40.449  28.305  1    42.231  ? 1095 A 1 c
ATOM 257  H HG2  . PRO Axp A    14  ? 27.698 40.516  26.931  1    42.249  ? 1095 A 1 c
ATOM 258  H HD3  . PRO Axp A    14  ? 29.29  39.166  26.232  1    40.8    ? 1095 A 1 c
ATOM 259  H HD2  . PRO Axp A    14  ? 29.615 38.648  27.705  1    40.806  ? 1095 A 1 c
ATOM 260  N N    . GLU Axp A    15  ? 25.889 38.845  25.404  1    45.656  ? 1096 A 1 .
ATOM 261  C CA   . GLU Axp A    15  ? 25.084 39.062  24.21   1    47.442  ? 1096 A 1 .
ATOM 262  C C    . GLU Axp A    15  ? 24.278 37.836  23.753  1    47.432  ? 1096 A 1 .
ATOM 263  O O    . GLU Axp A    15  ? 23.222 38.039  23.175  1    45.757  ? 1096 A 1 .
ATOM 264  C CB   . GLU Axp A    15  ? 26.019 39.587  23.115  1    50.172  ? 1096 A 1 .
ATOM 265  C CG   . GLU Axp A    15  ? 27.406 38.933  23.104  1    54.596  ? 1096 A 1 .
ATOM 266  C CD   . GLU Axp A    15  ? 28.37  39.416  22.025  1    61.857  ? 1096 A 1 .
ATOM 267  O OE1  . GLU Axp A    15  ? 28.045 39.234  20.822  1    64.167  ? 1096 A 1 .
ATOM 268  O OE2  . GLU Axp A    15  ? 29.448 39.971  22.378  1    66.621  ? 1096 A 1 .
ATOM 269  H H    . GLU Axp A    15  ? 26.667 39.317  25.469  1    45.042  ? 1096 A 1 c
ATOM 270  H HA   . GLU Axp A    15  ? 24.438 39.785  24.414  1    47.564  ? 1096 A 1 c
ATOM 271  H HB3  . GLU Axp A    15  ? 26.129 40.553  23.234  1    50.495  ? 1096 A 1 c
ATOM 272  H HB2  . GLU Axp A    15  ? 25.596 39.442  22.243  1    50.481  ? 1096 A 1 c
ATOM 273  H HG3  . GLU Axp A    15  ? 27.294 37.964  23.001  1    55.101  ? 1096 A 1 c
ATOM 274  H HG2  . GLU Axp A    15  ? 27.833 39.081  23.972  1    55.027  ? 1096 A 1 c
ATOM 275  N N    . VAL Axp A    16  ? 24.738 36.583  23.961  1    49.952  ? 1097 A 1 .
ATOM 276  C CA   . VAL Axp A    16  ? 24.067 35.422  23.37   1    50.743  ? 1097 A 1 .
ATOM 277  C C    . VAL Axp A    16  ? 23.973 34.216  24.302  1    51.139  ? 1097 A 1 .
ATOM 278  O O    . VAL Axp A    16  ? 24.62  34.121  25.341  1    57.245  ? 1097 A 1 .
ATOM 279  C CB   . VAL Axp A    16  ? 24.684 34.952  22.041  1    51.955  ? 1097 A 1 .
ATOM 280  C CG1  . VAL Axp A    16  ? 24.176 35.814  20.896  1    60.097  ? 1097 A 1 .
ATOM 281  C CG2  . VAL Axp A    16  ? 26.209 34.871  22.09   1    46.714  ? 1097 A 1 .
ATOM 282  H H    . VAL Axp A    16  ? 25.488 36.45   24.466  1    49.417  ? 1097 A 1 c
ATOM 283  H HA   . VAL Axp A    16  ? 23.15  35.696  23.175  1    50.904  ? 1097 A 1 c
ATOM 284  H HB   . VAL Axp A    16  ? 24.357 34.039  21.874  1    52.07   ? 1097 A 1 c
ATOM 285  H HG11 . VAL Axp A    16  ? 24.409 36.743  21.06   1    57.487  ? 1097 A 1 c
ATOM 286  H HG12 . VAL Axp A    16  ? 23.21  35.73   20.83   1    57.488  ? 1097 A 1 c
ATOM 287  H HG13 . VAL Axp A    16  ? 24.582 35.521  20.063  1    57.472  ? 1097 A 1 c
ATOM 288  H HG21 . VAL Axp A    16  ? 26.56  34.827  21.185  1    48.152  ? 1097 A 1 c
ATOM 289  H HG22 . VAL Axp A    16  ? 26.477 34.076  22.579  1    48.19   ? 1097 A 1 c
ATOM 290  H HG23 . VAL Axp A    16  ? 26.564 35.659  22.534  1    48.204  ? 1097 A 1 c
ATOM 291  N N    . VAL Axp A    17  ? 23.146 33.266  23.862  1    48.546  ? 1098 A 1 .
ATOM 292  C CA   . VAL Axp A    17  ? 22.84  32.063  24.612  1    47.542  ? 1098 A 1 .
ATOM 293  C C    . VAL Axp A    17  ? 24.086 31.193  24.716  1    47.232  ? 1098 A 1 .
ATOM 294  O O    . VAL Axp A    17  ? 24.468 30.529  23.756  1    45.4    ? 1098 A 1 .
ATOM 295  C CB   . VAL Axp A    17  ? 21.677 31.302  23.953  1    50.334  ? 1098 A 1 .
ATOM 296  C CG1  . VAL Axp A    17  ? 20.466 31.247  24.872  1    50.684  ? 1098 A 1 .
ATOM 297  C CG2  . VAL Axp A    17  ? 21.327 31.846  22.558  1    52.928  ? 1098 A 1 .
ATOM 298  H H    . VAL Axp A    17  ? 22.745 33.391  23.052  1    49.097  ? 1098 A 1 c
ATOM 299  H HA   . VAL Axp A    17  ? 22.567 32.326  25.513  1    48.198  ? 1098 A 1 c
ATOM 300  H HB   . VAL Axp A    17  ? 21.977 30.372  23.828  1    50.289  ? 1098 A 1 c
ATOM 301  H HG11 . VAL Axp A    17  ? 20.197 32.15   25.111  1    50.581  ? 1098 A 1 c
ATOM 302  H HG12 . VAL Axp A    17  ? 20.692 30.754  25.678  1    50.581  ? 1098 A 1 c
ATOM 303  H HG13 . VAL Axp A    17  ? 19.732 30.802  24.416  1    50.581  ? 1098 A 1 c
ATOM 304  H HG21 . VAL Axp A    17  ? 20.665 31.266  22.145  1    52.13   ? 1098 A 1 c
ATOM 305  H HG22 . VAL Axp A    17  ? 22.125 31.863  22.002  1    52.092  ? 1098 A 1 c
ATOM 306  H HG23 . VAL Axp A    17  ? 20.961 32.743  22.636  1    52.093  ? 1098 A 1 c
ATOM 307  N N    . THR Axp A    18  ? 24.703 31.208  25.902  1    47.559  ? 1099 A 1 .
ATOM 308  C CA   . THR Axp A    18  ? 25.948 30.499  26.15   1    47.563  ? 1099 A 1 .
ATOM 309  C C    . THR Axp A    18  ? 25.71  29.221  26.945  1    50.901  ? 1099 A 1 .
ATOM 310  O O    . THR Axp A    18  ? 26.524 28.298  26.894  1    52.2    ? 1099 A 1 .
ATOM 311  C CB   . THR Axp A    18  ? 26.919 31.4    26.899  1    44.986  ? 1099 A 1 .
ATOM 312  O OG1  . THR Axp A    18  ? 26.185 32.147  27.861  1    43.102  ? 1099 A 1 .
ATOM 313  C CG2  . THR Axp A    18  ? 27.609 32.369  25.966  1    45.574  ? 1099 A 1 .
ATOM 314  H H    . THR Axp A    18  ? 24.339 31.697  26.583  1    47.529  ? 1099 A 1 c
ATOM 315  H HA   . THR Axp A    18  ? 26.349 30.26   25.286  1    47.639  ? 1099 A 1 c
ATOM 316  H HB   . THR Axp A    18  ? 27.597 30.847  27.352  1    45.161  ? 1099 A 1 c
ATOM 317  H HG1  . THR Axp A    18  ? 25.562 32.658  27.459  0    39.75   ? 1099 A 1 c
ATOM 318  H HG21 . THR Axp A    18  ? 28.049 33.062  26.486  1    45.415  ? 1099 A 1 c
ATOM 319  H HG22 . THR Axp A    18  ? 26.952 32.775  25.376  1    45.456  ? 1099 A 1 c
ATOM 320  H HG23 . THR Axp A    18  ? 28.27  31.894  25.436  1    45.413  ? 1099 A 1 c
ATOM 321  N N    . MET Axp A    19  ? 24.616 29.19   27.707  1    51.594  ? 1100 A 1 .
ATOM 322  C CA   . MET Axp A    19  ? 24.234 27.991  28.427  1    54.562  ? 1100 A 1 .
ATOM 323  C C    . MET Axp A    19  ? 22.806 27.64   28.039  1    52.52   ? 1100 A 1 .
ATOM 324  O O    . MET Axp A    19  ? 21.948 28.507  27.929  1    56.334  ? 1100 A 1 .
ATOM 325  C CB   . MET Axp A    19  ? 24.373 28.204  29.936  1    58.237  ? 1100 A 1 .
ATOM 326  C CG   . MET Axp A    19  ? 25.821 28.294  30.376  1    62.65   ? 1100 A 1 .
ATOM 327  S SD   . MET Axp A    19  ? 26.6   26.673  30.501  1    63.761  ? 1100 A 1 .
ATOM 328  C CE   . MET Axp A    19  ? 26.045 26.306  32.175  1    62.706  ? 1100 A 1 .
ATOM 329  H H    . MET Axp A    19  ? 24.098 29.938  27.793  1    51.975  ? 1100 A 1 c
ATOM 330  H HA   . MET Axp A    19  ? 24.828 27.251  28.144  1    54.186  ? 1100 A 1 c
ATOM 331  H HB3  . MET Axp A    19  ? 23.939 27.459  30.404  1    58.341  ? 1100 A 1 c
ATOM 332  H HB2  . MET Axp A    19  ? 23.907 29.031  30.185  1    58.348  ? 1100 A 1 c
ATOM 333  H HG3  . MET Axp A    19  ? 25.868 28.736  31.247  1    61.754  ? 1100 A 1 c
ATOM 334  H HG2  . MET Axp A    19  ? 26.323 28.837  29.736  1    61.656  ? 1100 A 1 c
ATOM 335  H HE3  . MET Axp A    19  ? 25.074 26.229  32.185  1    62.879  ? 1100 A 1 c
ATOM 336  H HE2  . MET Axp A    19  ? 26.318 27.024  32.773  1    62.937  ? 1100 A 1 c
ATOM 337  H HE1  . MET Axp A    19  ? 26.442 25.466  32.472  1    62.943  ? 1100 A 1 c
ATOM 338  N N    . THR Axp A    20  ? 22.567 26.362  27.766  1    50.992  ? 1101 A 1 .
ATOM 339  C CA   . THR Axp A    20  ? 21.222 25.949  27.43   1    49.934  ? 1101 A 1 .
ATOM 340  C C    . THR Axp A    20  ? 20.452 25.874  28.733  1    49.632  ? 1101 A 1 .
ATOM 341  O O    . THR Axp A    20  ? 21.033 25.778  29.805  1    44.507  ? 1101 A 1 .
ATOM 342  C CB   . THR Axp A    20  ? 21.188 24.61   26.698  1    47.552  ? 1101 A 1 .
ATOM 343  O OG1  . THR Axp A    20  ? 21.735 23.655  27.605  1    46.986  ? 1101 A 1 .
ATOM 344  C CG2  . THR Axp A    20  ? 21.95  24.644  25.386  1    45.358  ? 1101 A 1 .
ATOM 345  H H    . THR Axp A    20  ? 23.239 25.742  27.79   1    51.135  ? 1101 A 1 c
ATOM 346  H HA   . THR Axp A    20  ? 20.815 26.633  26.855  1    49.719  ? 1101 A 1 c
ATOM 347  H HB   . THR Axp A    20  ? 20.249 24.376  26.509  1    47.348  ? 1101 A 1 c
ATOM 348  H HG1  . THR Axp A    20  ? 22.569 23.849  27.755  0    38.86   ? 1101 A 1 c
ATOM 349  H HG21 . THR Axp A    20  ? 21.595 23.964  24.79   1    45.652  ? 1101 A 1 c
ATOM 350  H HG22 . THR Axp A    20  ? 22.891 24.468  25.552  1    45.895  ? 1101 A 1 c
ATOM 351  H HG23 . THR Axp A    20  ? 21.851 25.519  24.975  1    45.898  ? 1101 A 1 c
ATOM 352  N N    . LYS Axp A    21  ? 19.137 25.824  28.58   1    55.535  ? 1102 A 1 .
ATOM 353  C CA   . LYS Axp A    21  ? 18.207 25.643  29.677  1    55.564  ? 1102 A 1 .
ATOM 354  C C    . LYS Axp A    21  ? 18.458 24.284  30.332  1    51.392  ? 1102 A 1 .
ATOM 355  O O    . LYS Axp A    21  ? 17.639 23.862  31.133  1    57.557  ? 1102 A 1 .
ATOM 356  C CB   . LYS Axp A    21  ? 16.786 25.897  29.143  1    59.903  ? 1102 A 1 .
ATOM 357  C CG   . LYS Axp A    21  ? 16.6   25.854  27.589  1    71.5    ? 1102 A 1 .
ATOM 358  C CD   . LYS Axp A    21  ? 17.215 26.987  26.737  1    69.234  ? 1102 A 1 .
ATOM 359  C CE   . LYS Axp A    21  ? 16.752 27.095  25.295  1    61.76   ? 1102 A 1 .
ATOM 360  N NZ   . LYS Axp A    21  ? 17.135 28.373  24.684  1    57.188  ? 1102 A 1 .
ATOM 361  H H    . LYS Axp A    21  ? 18.811 25.844  27.731  1    54.444  ? 1102 A 1 c
ATOM 362  H HA   . LYS Axp A    21  ? 18.398 26.343  30.351  1    55.526  ? 1102 A 1 c
ATOM 363  H HB3  . LYS Axp A    21  ? 16.494 26.778  29.458  1    61.249  ? 1102 A 1 c
ATOM 364  H HB2  . LYS Axp A    21  ? 16.183 25.232  29.538  1    61.187  ? 1102 A 1 c
ATOM 365  H HG3  . LYS Axp A    21  ? 15.635 25.833  27.409  1    68.167  ? 1102 A 1 c
ATOM 366  H HG2  . LYS Axp A    21  ? 16.958 24.998  27.267  1    68.009  ? 1102 A 1 c
ATOM 367  H HD3  . LYS Axp A    21  ? 18.189 26.89   26.733  1    67.681  ? 1102 A 1 c
ATOM 368  H HD2  . LYS Axp A    21  ? 17.022 27.838  27.187  1    67.88   ? 1102 A 1 c
ATOM 369  H HE3  . LYS Axp A    21  ? 15.783 27.005  25.259  1    62.219  ? 1102 A 1 c
ATOM 370  H HE2  . LYS Axp A    21  ? 17.143 26.369  24.777  1    62.177  ? 1102 A 1 c
ATOM 371  H HZ1  . LYS Axp A    21  ? 18.022 28.516  24.803  1    58.537  ? 1102 A 1 c
ATOM 372  H HZ2  . LYS Axp A    21  ? 16.671 29.048  25.07   1    58.553  ? 1102 A 1 c
ATOM 373  H HZ3  . LYS Axp A    21  ? 16.953 28.355  23.797  1    58.553  ? 1102 A 1 c
ATOM 374  N N    . TRP Axp A    22  ? 19.581 23.611  30.006  1    48.503  ? 1103 A 1 .
ATOM 375  C CA   . TRP Axp A    22  ? 19.967 22.356  30.65   1    45.216  ? 1103 A 1 .
ATOM 376  C C    . TRP Axp A    22  ? 21.473 22.298  30.916  1    46.532  ? 1103 A 1 .
ATOM 377  O O    . TRP Axp A    22  ? 22.101 21.249  30.784  1    45.262  ? 1103 A 1 .
ATOM 378  C CB   . TRP Axp A    22  ? 19.485 21.133  29.845  1    41.328  ? 1103 A 1 .
ATOM 379  C CG   . TRP Axp A    22  ? 20.068 20.914  28.471  1    36.65   ? 1103 A 1 .
ATOM 380  C CD1  . TRP Axp A    22  ? 21.104 20.096  28.13   1    36.635  ? 1103 A 1 .
ATOM 381  C CD2  . TRP Axp A    22  ? 19.586 21.467  27.232  1    34.183  ? 1103 A 1 .
ATOM 382  N NE1  . TRP Axp A    22  ? 21.319 20.118  26.777  1    34.194  ? 1103 A 1 .
ATOM 383  C CE2  . TRP Axp A    22  ? 20.405 20.955  26.206  1    34.052  ? 1103 A 1 .
ATOM 384  C CE3  . TRP Axp A    22  ? 18.563 22.359  26.9    1    35.378  ? 1103 A 1 .
ATOM 385  C CZ2  . TRP Axp A    22  ? 20.221 21.301  24.874  1    35.65   ? 1103 A 1 .
ATOM 386  C CZ3  . TRP Axp A    22  ? 18.38  22.706  25.581  1    34.945  ? 1103 A 1 .
ATOM 387  C CH2  . TRP Axp A    22  ? 19.195 22.174  24.585  1    36.162  ? 1103 A 1 .
ATOM 388  H H    . TRP Axp A    22  ? 20.118 23.932  29.342  1    48.5    ? 1103 A 1 c
ATOM 389  H HA   . TRP Axp A    22  ? 19.511 22.324  31.533  1    45.425  ? 1103 A 1 c
ATOM 390  H HB3  . TRP Axp A    22  ? 18.51  21.195  29.759  1    41.022  ? 1103 A 1 c
ATOM 391  H HB2  . TRP Axp A    22  ? 19.655 20.331  30.383  1    41.039  ? 1103 A 1 c
ATOM 392  H HD1  . TRP Axp A    22  ? 21.613 19.585  28.739  1    36.11   ? 1103 A 1 c
ATOM 393  H HE1  . TRP Axp A    22  ? 21.943 19.678  26.355  1    34.752  ? 1103 A 1 c
ATOM 394  H HE3  . TRP Axp A    22  ? 18.01  22.72   27.571  1    35.015  ? 1103 A 1 c
ATOM 395  H HZ2  . TRP Axp A    22  ? 20.768 20.944  24.196  1    35.447  ? 1103 A 1 c
ATOM 396  H HZ3  . TRP Axp A    22  ? 17.689 23.302  25.348  1    35.475  ? 1103 A 1 c
ATOM 397  H HH2  . TRP Axp A    22  ? 19.048 22.426  23.691  1    35.715  ? 1103 A 1 c
ATOM 398  N N    . LYS Axp A    23  ? 22.032 23.437  31.326  1    49.392  ? 1104 A 1 .
ATOM 399  C CA   . LYS Axp A    23  ? 23.387 23.523  31.843  1    52.676  ? 1104 A 1 .
ATOM 400  C C    . LYS Axp A    23  ? 24.4   22.996  30.83   1    47.418  ? 1104 A 1 .
ATOM 401  O O    . LYS Axp A    23  ? 25.428 22.467  31.23   1    48.818  ? 1104 A 1 .
ATOM 402  C CB   . LYS Axp A    23  ? 23.576 22.72   33.139  1    62.283  ? 1104 A 1 .
ATOM 403  C CG   . LYS Axp A    23  ? 22.472 22.803  34.2    1    72.332  ? 1104 A 1 .
ATOM 404  C CD   . LYS Axp A    23  ? 22.211 21.437  34.836  1    81.644  ? 1104 A 1 .
ATOM 405  C CE   . LYS Axp A    23  ? 20.856 21.23   35.457  1    85.302  ? 1104 A 1 .
ATOM 406  N NZ   . LYS Axp A    23  ? 20.741 21.921  36.742  1    93.989  ? 1104 A 1 .
ATOM 407  H H    . LYS Axp A    23  ? 21.54  24.206  31.283  1    49.376  ? 1104 A 1 c
ATOM 408  H HA   . LYS Axp A    23  ? 23.589 24.475  32.026  1    52.666  ? 1104 A 1 c
ATOM 409  H HB3  . LYS Axp A    23  ? 24.413 23.015  33.556  1    61.942  ? 1104 A 1 c
ATOM 410  H HB2  . LYS Axp A    23  ? 23.69  21.777  32.896  1    61.965  ? 1104 A 1 c
ATOM 411  H HG3  . LYS Axp A    23  ? 21.647 23.133  33.784  1    71.703  ? 1104 A 1 c
ATOM 412  H HG2  . LYS Axp A    23  ? 22.745 23.44   34.896  1    71.83   ? 1104 A 1 c
ATOM 413  H HD3  . LYS Axp A    23  ? 22.894 21.286  35.524  1    80.245  ? 1104 A 1 c
ATOM 414  H HD2  . LYS Axp A    23  ? 22.343 20.747  34.149  1    79.967  ? 1104 A 1 c
ATOM 415  H HE3  . LYS Axp A    23  ? 20.703 20.278  35.593  1    86.42   ? 1104 A 1 c
ATOM 416  H HE2  . LYS Axp A    23  ? 20.168 21.565  34.854  1    86.421  ? 1104 A 1 c
ATOM 417  H HZ1  . LYS Axp A    23  ? 20.901 22.805  36.631  1    91.109  ? 1104 A 1 c
ATOM 418  H HZ2  . LYS Axp A    23  ? 21.343 21.581  37.328  1    91.124  ? 1104 A 1 c
ATOM 419  H HZ3  . LYS Axp A    23  ? 19.906 21.809  37.076  1    91.183  ? 1104 A 1 c
ATOM 420  N N    . ALA Axp A    24  ? 24.137 23.147  29.531  1    44.684  ? 1105 A 1 .
ATOM 421  C CA   . ALA Axp A    24  ? 25.078 22.658  28.539  1    44.682  ? 1105 A 1 .
ATOM 422  C C    . ALA Axp A    24  ? 25.635 23.822  27.736  1    42.615  ? 1105 A 1 .
ATOM 423  O O    . ALA Axp A    24  ? 24.881 24.658  27.261  1    42.881  ? 1105 A 1 .
ATOM 424  C CB   . ALA Axp A    24  ? 24.43  21.643  27.638  1    45.291  ? 1105 A 1 .
ATOM 425  H H    . ALA Axp A    24  ? 23.374 23.568  29.256  1    45.399  ? 1105 A 1 c
ATOM 426  H HA   . ALA Axp A    24  ? 25.833 22.222  29.018  1    44.392  ? 1105 A 1 c
ATOM 427  H HB3  . ALA Axp A    24  ? 24.676 21.818  26.714  1    45.084  ? 1105 A 1 c
ATOM 428  H HB2  . ALA Axp A    24  ? 23.464 21.694  27.728  1    45.069  ? 1105 A 1 c
ATOM 429  H HB1  . ALA Axp A    24  ? 24.727 20.751  27.885  1    45.096  ? 1105 A 1 c
ATOM 430  N N    . PRO Axp A    25  ? 26.964 23.881  27.527  1    40.914  ? 1106 A 1 .
ATOM 431  C CA   . PRO Axp A    25  ? 27.586 25.006  26.859  1    40.169  ? 1106 A 1 .
ATOM 432  C C    . PRO Axp A    25  ? 27.101 25.164  25.433  1    38.248  ? 1106 A 1 .
ATOM 433  O O    . PRO Axp A    25  ? 26.825 24.176  24.765  1    41.337  ? 1106 A 1 .
ATOM 434  C CB   . PRO Axp A    25  ? 29.063 24.636  26.832  1    40.825  ? 1106 A 1 .
ATOM 435  C CG   . PRO Axp A    25  ? 29.007 23.126  26.821  1    40.5    ? 1106 A 1 .
ATOM 436  C CD   . PRO Axp A    25  ? 27.941 22.829  27.824  1    41.596  ? 1106 A 1 .
ATOM 437  H HA   . PRO Axp A    25  ? 27.437 25.829  27.369  1    40.073  ? 1106 A 1 c
ATOM 438  H HB3  . PRO Axp A    25  ? 29.525 24.968  27.627  1    40.601  ? 1106 A 1 c
ATOM 439  H HB2  . PRO Axp A    25  ? 29.502 24.981  26.03   1    40.589  ? 1106 A 1 c
ATOM 440  H HG3  . PRO Axp A    25  ? 29.862 22.737  27.093  1    40.803  ? 1106 A 1 c
ATOM 441  H HG2  . PRO Axp A    25  ? 28.763 22.785  25.938  1    40.726  ? 1106 A 1 c
ATOM 442  H HD3  . PRO Axp A    25  ? 27.559 21.943  27.688  1    41.17   ? 1106 A 1 c
ATOM 443  H HD2  . PRO Axp A    25  ? 28.274 22.907  28.739  1    41.184  ? 1106 A 1 c
ATOM 444  N N    . VAL Axp A    26  ? 26.987 26.415  25.004  1    36.122  ? 1107 A 1 .
ATOM 445  C CA   . VAL Axp A    26  ? 26.88  26.743  23.601  1    35.374  ? 1107 A 1 .
ATOM 446  C C    . VAL Axp A    26  ? 28.139 27.533  23.305  1    34.324  ? 1107 A 1 .
ATOM 447  O O    . VAL Axp A    26  ? 28.31  28.61   23.863  1    35.174  ? 1107 A 1 .
ATOM 448  C CB   . VAL Axp A    26  ? 25.608 27.549  23.289  1    36.722  ? 1107 A 1 .
ATOM 449  C CG1  . VAL Axp A    26  ? 25.542 27.997  21.839  1    36.967  ? 1107 A 1 .
ATOM 450  C CG2  . VAL Axp A    26  ? 24.353 26.77   23.648  1    38.877  ? 1107 A 1 .
ATOM 451  H H    . VAL Axp A    26  ? 26.976 27.095  25.614  1    36.55   ? 1107 A 1 c
ATOM 452  H HA   . VAL Axp A    26  ? 26.878 25.923  23.078  1    35.56   ? 1107 A 1 c
ATOM 453  H HB   . VAL Axp A    26  ? 25.632 28.355  23.854  1    36.941  ? 1107 A 1 c
ATOM 454  H HG11 . VAL Axp A    26  ? 25.548 27.218  21.259  1    36.842  ? 1107 A 1 c
ATOM 455  H HG12 . VAL Axp A    26  ? 26.31  28.556  21.634  1    36.835  ? 1107 A 1 c
ATOM 456  H HG13 . VAL Axp A    26  ? 24.726 28.503  21.691  1    36.826  ? 1107 A 1 c
ATOM 457  H HG21 . VAL Axp A    26  ? 23.795 26.668  22.859  1    38.193  ? 1107 A 1 c
ATOM 458  H HG22 . VAL Axp A    26  ? 23.859 27.25   24.333  1    38.206  ? 1107 A 1 c
ATOM 459  H HG23 . VAL Axp A    26  ? 24.599 25.892  23.984  1    38.152  ? 1107 A 1 c
ATOM 460  N N    . VAL Axp A    27  ? 29.029 26.97   22.486  1    33.277  ? 1108 A 1 .
ATOM 461  C CA   . VAL Axp A    27  ? 30.369 27.506  22.348  1    32.455  ? 1108 A 1 .
ATOM 462  C C    . VAL Axp A    27  ? 30.379 28.635  21.33   1    31.935  ? 1108 A 1 .
ATOM 463  O O    . VAL Axp A    27  ? 30.119 28.417  20.151  1    31.586  ? 1108 A 1 .
ATOM 464  C CB   . VAL Axp A    27  ? 31.361 26.418  21.931  1    34.322  ? 1108 A 1 .
ATOM 465  C CG1  . VAL Axp A    27  ? 32.754 27.002  21.751  1    35.154  ? 1108 A 1 .
ATOM 466  C CG2  . VAL Axp A    27  ? 31.362 25.276  22.935  1    36.372  ? 1108 A 1 .
ATOM 467  H H    . VAL Axp A    27  ? 28.794 26.233  21.998  1    33.379  ? 1108 A 1 c
ATOM 468  H HA   . VAL Axp A    27  ? 30.649 27.861  23.213  1    32.904  ? 1108 A 1 c
ATOM 469  H HB   . VAL Axp A    27  ? 31.061 26.064  21.061  1    34.473  ? 1108 A 1 c
ATOM 470  H HG11 . VAL Axp A    27  ? 32.899 27.706  22.406  1    34.863  ? 1108 A 1 c
ATOM 471  H HG12 . VAL Axp A    27  ? 32.84  27.371  20.856  1    34.885  ? 1108 A 1 c
ATOM 472  H HG13 . VAL Axp A    27  ? 33.419 26.304  21.876  1    34.908  ? 1108 A 1 c
ATOM 473  H HG21 . VAL Axp A    27  ? 32.082 24.657  22.724  1    35.745  ? 1108 A 1 c
ATOM 474  H HG22 . VAL Axp A    27  ? 30.512 24.806  22.894  1    35.739  ? 1108 A 1 c
ATOM 475  H HG23 . VAL Axp A    27  ? 31.493 25.63   23.83   1    35.75   ? 1108 A 1 c
ATOM 476  N N    . TRP Axp A    28  ? 30.754 29.824  21.805  1    31.804  ? 1109 A 1 .
ATOM 477  C CA   . TRP Axp A    28  ? 30.876 31.003  20.971  1    31.127  ? 1109 A 1 .
ATOM 478  C C    . TRP Axp A    28  ? 32.324 31.457  20.972  1    30.593  ? 1109 A 1 .
ATOM 479  O O    . TRP Axp A    28  ? 33.124 30.967  21.761  1    31.152  ? 1109 A 1 .
ATOM 480  C CB   . TRP Axp A    28  ? 29.991 32.119  21.524  1    32.608  ? 1109 A 1 .
ATOM 481  C CG   . TRP Axp A    28  ? 28.526 31.907  21.298  1    33.542  ? 1109 A 1 .
ATOM 482  C CD1  . TRP Axp A    28  ? 27.675 31.152  22.043  1    34.709  ? 1109 A 1 .
ATOM 483  C CD2  . TRP Axp A    28  ? 27.741 32.478  20.238  1    33.318  ? 1109 A 1 .
ATOM 484  N NE1  . TRP Axp A    28  ? 26.414 31.208  21.519  1    35.217  ? 1109 A 1 .
ATOM 485  C CE2  . TRP Axp A    28  ? 26.424 32.011  20.411  1    33.456  ? 1109 A 1 .
ATOM 486  C CE3  . TRP Axp A    28  ? 28.029 33.316  19.165  1    32.406  ? 1109 A 1 .
ATOM 487  C CZ2  . TRP Axp A    28  ? 25.393 32.361  19.55   1    32.063  ? 1109 A 1 .
ATOM 488  C CZ3  . TRP Axp A    28  ? 27.008 33.662  18.317  1    33.326  ? 1109 A 1 .
ATOM 489  C CH2  . TRP Axp A    28  ? 25.714 33.185  18.502  1    32.472  ? 1109 A 1 .
ATOM 490  H H    . TRP Axp A    28  ? 30.943 29.903  22.696  1    31.697  ? 1109 A 1 c
ATOM 491  H HA   . TRP Axp A    28  ? 30.593 30.786  20.044  1    31.427  ? 1109 A 1 c
ATOM 492  H HB3  . TRP Axp A    28  ? 30.256 32.965  21.105  1    32.441  ? 1109 A 1 c
ATOM 493  H HB2  . TRP Axp A    28  ? 30.155 32.196  22.488  1    32.471  ? 1109 A 1 c
ATOM 494  H HD1  . TRP Axp A    28  ? 27.911 30.664  22.812  1    34.528  ? 1109 A 1 c
ATOM 495  H HE1  . TRP Axp A    28  ? 25.713 30.8    21.842  1    34.668  ? 1109 A 1 c
ATOM 496  H HE3  . TRP Axp A    28  ? 28.902 33.641  19.029  1    32.821  ? 1109 A 1 c
ATOM 497  H HZ2  . TRP Axp A    28  ? 24.517 32.04   19.675  1    32.499  ? 1109 A 1 c
ATOM 498  H HZ3  . TRP Axp A    28  ? 27.188 34.229  17.587  1    32.991  ? 1109 A 1 c
ATOM 499  H HH2  . TRP Axp A    28  ? 25.042 33.445  17.904  1    32.609  ? 1109 A 1 c
ATOM 500  N N    . GLU Axp A    29  ? 32.646 32.432  20.125  1    30.315  ? 1110 A 1 .
ATOM 501  C CA   . GLU Axp A    29  ? 34.004 32.933  20.1    1    29.772  ? 1110 A 1 .
ATOM 502  C C    . GLU Axp A    29  ? 34.273 33.64   21.421  1    29.894  ? 1110 A 1 .
ATOM 503  O O    . GLU Axp A    29  ? 33.402 34.333  21.932  1    27.86   ? 1110 A 1 .
ATOM 504  C CB   . GLU Axp A    29  ? 34.313 33.854  18.924  1    29.452  ? 1110 A 1 .
ATOM 505  C CG   . GLU Axp A    29  ? 35.767 34.316  18.937  1    28.949  ? 1110 A 1 .
ATOM 506  C CD   . GLU Axp A    29  ? 36.724 33.147  19.026  1    29.144  ? 1110 A 1 .
ATOM 507  O OE1  . GLU Axp A    29  ? 36.224 32.023  19.101  1    30.564  ? 1110 A 1 .
ATOM 508  O OE2  . GLU Axp A    29  ? 37.946 33.316  19.004  1    30.029  ? 1110 A 1 .
ATOM 509  H H    . GLU Axp A    29  ? 32.018 32.796  19.571  1    30.301  ? 1110 A 1 c
ATOM 510  H HA   . GLU Axp A    29  ? 34.599 32.15   20.046  1    29.885  ? 1110 A 1 c
ATOM 511  H HB3  . GLU Axp A    29  ? 33.723 34.634  18.972  1    29.496  ? 1110 A 1 c
ATOM 512  H HB2  . GLU Axp A    29  ? 34.121 33.381  18.087  1    29.432  ? 1110 A 1 c
ATOM 513  H HG3  . GLU Axp A    29  ? 35.917 34.91   19.703  1    29.108  ? 1110 A 1 c
ATOM 514  H HG2  . GLU Axp A    29  ? 35.957 34.821  18.118  1    29.096  ? 1110 A 1 c
ATOM 515  N N    . GLY Axp A    30  ? 35.461 33.393  21.989  1    32.992  ? 1111 A 1 .
ATOM 516  C CA   . GLY Axp A    30  ? 35.883 34.038  23.221  1    32.246  ? 1111 A 1 .
ATOM 517  C C    . GLY Axp A    30  ? 35.418 33.317  24.489  1    31.16   ? 1111 A 1 .
ATOM 518  O O    . GLY Axp A    30  ? 35.97  33.575  25.545  1    32.729  ? 1111 A 1 .
ATOM 519  H H    . GLY Axp A    30  ? 36.026 32.79   21.598  1    32.006  ? 1111 A 1 c
ATOM 520  H HA3  . GLY Axp A    30  ? 35.538 34.961  23.231  1    32.138  ? 1111 A 1 c
ATOM 521  H HA2  . GLY Axp A    30  ? 36.868 34.09   23.226  1    32.169  ? 1111 A 1 c
ATOM 522  N N    . THR Axp A    31  ? 34.431 32.415  24.416  1    29.773  ? 1112 A 1 .
ATOM 523  C CA   . THR Axp A    31  ? 34.016 31.668  25.595  1    30.304  ? 1112 A 1 .
ATOM 524  C C    . THR Axp A    31  ? 34.982 30.545  25.96   1    32.326  ? 1112 A 1 .
ATOM 525  O O    . THR Axp A    31  ? 34.985 30.066  27.096  1    31.904  ? 1112 A 1 .
ATOM 526  C CB   . THR Axp A    31  ? 32.639 31.068  25.376  1    30.149  ? 1112 A 1 .
ATOM 527  O OG1  . THR Axp A    31  ? 32.619 30.541  24.054  1    28.833  ? 1112 A 1 .
ATOM 528  C CG2  . THR Axp A    31  ? 31.555 32.102  25.57   1    31.673  ? 1112 A 1 .
ATOM 529  H H    . THR Axp A    31  ? 34.007 32.261  23.622  1    30.234  ? 1112 A 1 c
ATOM 530  H HA   . THR Axp A    31  ? 33.965 32.291  26.352  1    30.588  ? 1112 A 1 c
ATOM 531  H HB   . THR Axp A    31  ? 32.499 30.338  26.024  1    30.341  ? 1112 A 1 c
ATOM 532  H HG1  . THR Axp A    31  ? 32.63  31.229  23.505  0    22      ? 1112 A 1 c
ATOM 533  H HG21 . THR Axp A    31  ? 30.763 31.676  25.938  1    31.292  ? 1112 A 1 c
ATOM 534  H HG22 . THR Axp A    31  ? 31.335 32.503  24.714  1    31.26   ? 1112 A 1 c
ATOM 535  H HG23 . THR Axp A    31  ? 31.862 32.792  26.18   1    31.257  ? 1112 A 1 c
ATOM 536  N N    . TYR Axp A    32  ? 35.764 30.089  24.985  1    34.132  ? 1113 A 1 .
ATOM 537  C CA   . TYR Axp A    32  ? 36.508 28.859  25.161  1    34.952  ? 1113 A 1 .
ATOM 538  C C    . TYR Axp A    32  ? 37.993 29.155  25.319  1    35.619  ? 1113 A 1 .
ATOM 539  O O    . TYR Axp A    32  ? 38.542 29.995  24.616  1    36.777  ? 1113 A 1 .
ATOM 540  C CB   . TYR Axp A    32  ? 36.27  27.936  23.967  1    33.379  ? 1113 A 1 .
ATOM 541  C CG   . TYR Axp A    32  ? 36.77  28.512  22.656  1    32.778  ? 1113 A 1 .
ATOM 542  C CD1  . TYR Axp A    32  ? 38.112 28.469  22.319  1    32.357  ? 1113 A 1 .
ATOM 543  C CD2  . TYR Axp A    32  ? 35.894 29.106  21.761  1    33.672  ? 1113 A 1 .
ATOM 544  C CE1  . TYR Axp A    32  ? 38.565 28.987  21.119  1    33.647  ? 1113 A 1 .
ATOM 545  C CE2  . TYR Axp A    32  ? 36.332 29.618  20.552  1    33.036  ? 1113 A 1 .
ATOM 546  C CZ   . TYR Axp A    32  ? 37.676 29.566  20.226  1    33.182  ? 1113 A 1 .
ATOM 547  O OH   . TYR Axp A    32  ? 38.137 30.09   19.043  1    32.256  ? 1113 A 1 .
ATOM 548  H H    . TYR Axp A    32  ? 35.842 30.55   24.2    1    33.792  ? 1113 A 1 c
ATOM 549  H HA   . TYR Axp A    32  ? 36.182 28.403  25.979  1    34.589  ? 1113 A 1 c
ATOM 550  H HB3  . TYR Axp A    32  ? 35.306 27.76   23.893  1    33.581  ? 1113 A 1 c
ATOM 551  H HB2  . TYR Axp A    32  ? 36.725 27.081  24.136  1    33.545  ? 1113 A 1 c
ATOM 552  H HD1  . TYR Axp A    32  ? 38.728 28.069  22.911  1    32.798  ? 1113 A 1 c
ATOM 553  H HD2  . TYR Axp A    32  ? 34.974 29.137  21.968  1    33.294  ? 1113 A 1 c
ATOM 554  H HE1  . TYR Axp A    32  ? 39.481 28.948  20.906  1    33.213  ? 1113 A 1 c
ATOM 555  H HE2  . TYR Axp A    32  ? 35.719 30.012  19.958  1    33.185  ? 1113 A 1 c
ATOM 556  H HH   . TYR Axp A    32  ? 38.926 29.959  19.023  0    26.71   ? 1113 A 1 c
ATOM 557  N N    . ASN Axp A    33  ? 38.63  28.387  26.206  1    36.341  ? 1114 A 1 .
ATOM 558  C CA   . ASN Axp A    33  ? 40.074 28.374  26.338  1    35.923  ? 1114 A 1 .
ATOM 559  C C    . ASN Axp A    33  ? 40.64  27.142  25.631  1    35.016  ? 1114 A 1 .
ATOM 560  O O    . ASN Axp A    33  ? 40.932 26.11   26.24   1    35.78   ? 1114 A 1 .
ATOM 561  C CB   . ASN Axp A    33  ? 40.48  28.444  27.802  1    35.471  ? 1114 A 1 .
ATOM 562  C CG   . ASN Axp A    33  ? 41.965 28.664  27.943  1    38.096  ? 1114 A 1 .
ATOM 563  O OD1  . ASN Axp A    33  ? 42.724 28.6    26.971  1    38.582  ? 1114 A 1 .
ATOM 564  N ND2  . ASN Axp A    33  ? 42.41  28.938  29.153  1    43.654  ? 1114 A 1 .
ATOM 565  H H    . ASN Axp A    33  ? 38.14  27.846  26.755  1    36.051  ? 1114 A 1 c
ATOM 566  H HA   . ASN Axp A    33  ? 40.431 29.177  25.896  1    35.766  ? 1114 A 1 c
ATOM 567  H HB3  . ASN Axp A    33  ? 40.231 27.611  28.249  1    36.159  ? 1114 A 1 c
ATOM 568  H HB2  . ASN Axp A    33  ? 40.002 29.179  28.236  1    36.161  ? 1114 A 1 c
ATOM 569  H HD21 . ASN Axp A    33  ? 43.251 29.197  29.267  1    41.797  ? 1114 A 1 c
ATOM 570  H HD22 . ASN Axp A    33  ? 41.869 28.865  29.852  1    41.697  ? 1114 A 1 c
ATOM 571  N N    . ARG Axp A    34  ? 40.838 27.266  24.323  1    33.003  ? 1115 A 1 .
ATOM 572  C CA   . ARG Axp A    34  ? 41.247 26.114  23.538  1    32.174  ? 1115 A 1 .
ATOM 573  C C    . ARG Axp A    34  ? 42.615 25.634  24.003  1    31.653  ? 1115 A 1 .
ATOM 574  O O    . ARG Axp A    34  ? 42.967 24.468  23.854  1    31.363  ? 1115 A 1 .
ATOM 575  C CB   . ARG Axp A    34  ? 41.297 26.484  22.053  1    31.259  ? 1115 A 1 .
ATOM 576  C CG   . ARG Axp A    34  ? 41.622 25.316  21.139  1    29.682  ? 1115 A 1 .
ATOM 577  C CD   . ARG Axp A    34  ? 41.736 25.784  19.732  1    28.873  ? 1115 A 1 .
ATOM 578  N NE   . ARG Axp A    34  ? 40.424 26.237  19.275  1    28.941  ? 1115 A 1 .
ATOM 579  C CZ   . ARG Axp A    34  ? 40.214 27.368  18.633  1    31.077  ? 1115 A 1 .
ATOM 580  N NH1  . ARG Axp A    34  ? 41.195 28.224  18.506  1    33.149  ? 1115 A 1 .
ATOM 581  N NH2  . ARG Axp A    34  ? 39.035 27.662  18.128  1    32.754  ? 1115 A 1 .
ATOM 582  H H    . ARG Axp A    34  ? 40.73  28.075  23.913  1    33.3    ? 1115 A 1 c
ATOM 583  H HA   . ARG Axp A    34  ? 40.586 25.388  23.675  1    32.102  ? 1115 A 1 c
ATOM 584  H HB3  . ARG Axp A    34  ? 41.973 27.184  21.925  1    31.081  ? 1115 A 1 c
ATOM 585  H HB2  . ARG Axp A    34  ? 40.428 26.858  21.793  1    31.095  ? 1115 A 1 c
ATOM 586  H HG3  . ARG Axp A    34  ? 40.911 24.641  21.2    1    29.846  ? 1115 A 1 c
ATOM 587  H HG2  . ARG Axp A    34  ? 42.47  24.906  21.41   1    29.891  ? 1115 A 1 c
ATOM 588  H HD3  . ARG Axp A    34  ? 42.048 25.054  19.16   1    29.085  ? 1115 A 1 c
ATOM 589  H HD2  . ARG Axp A    34  ? 42.38  26.519  19.677  1    29.14   ? 1115 A 1 c
ATOM 590  H HE   . ARG Axp A    34  ? 39.74  25.726  19.435  1    29.451  ? 1115 A 1 c
ATOM 591  H HH11 . ARG Axp A    34  ? 41.842 28.067  17.925  1    32.469  ? 1115 A 1 c
ATOM 592  H HH12 . ARG Axp A    34  ? 41.206 28.956  19.002  1    32.49   ? 1115 A 1 c
ATOM 593  H HH21 . ARG Axp A    34  ? 38.46  27.017  17.947  1    32.152  ? 1115 A 1 c
ATOM 594  H HH22 . ARG Axp A    34  ? 38.829 28.503  17.956  1    32.223  ? 1115 A 1 c
ATOM 595  N N    . ALA Axp A    35  ? 43.402 26.573  24.513  1    32.178  ? 1116 A 1 .
ATOM 596  C CA   . ALA Axp A    35  ? 44.744 26.27   24.953  1    32.781  ? 1116 A 1 .
ATOM 597  C C    . ALA Axp A    35  ? 44.679 25.311  26.13   1    29.348  ? 1116 A 1 .
ATOM 598  O O    . ALA Axp A    35  ? 45.46  24.367  26.214  1    28.316  ? 1116 A 1 .
ATOM 599  C CB   . ALA Axp A    35  ? 45.437 27.552  25.324  1    36.818  ? 1116 A 1 .
ATOM 600  H H    . ALA Axp A    35  ? 43.104 27.435  24.573  1    32.265  ? 1116 A 1 c
ATOM 601  H HA   . ALA Axp A    35  ? 45.234 25.827  24.206  1    32.685  ? 1116 A 1 c
ATOM 602  H HB3  . ALA Axp A    35  ? 46.393 27.394  25.408  1    35.554  ? 1116 A 1 c
ATOM 603  H HB2  . ALA Axp A    35  ? 45.091 27.88   26.17   1    35.537  ? 1116 A 1 c
ATOM 604  H HB1  . ALA Axp A    35  ? 45.283 28.219  24.634  1    35.536  ? 1116 A 1 c
ATOM 605  N N    . VAL Axp A    36  ? 43.745 25.583  27.035  1    27.868  ? 1117 A 1 .
ATOM 606  C CA   . VAL Axp A    36  ? 43.562 24.71   28.173  1    30.413  ? 1117 A 1 .
ATOM 607  C C    . VAL Axp A    36  ? 43.169 23.338  27.649  1    33.044  ? 1117 A 1 .
ATOM 608  O O    . VAL Axp A    36  ? 43.784 22.336  28.015  1    36.186  ? 1117 A 1 .
ATOM 609  C CB   . VAL Axp A    36  ? 42.532 25.223  29.19   1    29.974  ? 1117 A 1 .
ATOM 610  C CG1  . VAL Axp A    36  ? 41.825 24.08   29.911  1    29.852  ? 1117 A 1 .
ATOM 611  C CG2  . VAL Axp A    36  ? 43.19  26.163  30.184  1    30.313  ? 1117 A 1 .
ATOM 612  H H    . VAL Axp A    36  ? 43.218 26.325  26.95   1    28.885  ? 1117 A 1 c
ATOM 613  H HA   . VAL Axp A    36  ? 44.423 24.626  28.629  1    30.3    ? 1117 A 1 c
ATOM 614  H HB   . VAL Axp A    36  ? 41.853 25.734  28.69   1    30.114  ? 1117 A 1 c
ATOM 615  H HG11 . VAL Axp A    36  ? 42.476 23.408  30.177  1    29.914  ? 1117 A 1 c
ATOM 616  H HG12 . VAL Axp A    36  ? 41.166 23.678  29.32   1    29.929  ? 1117 A 1 c
ATOM 617  H HG13 . VAL Axp A    36  ? 41.378 24.424  30.702  1    29.903  ? 1117 A 1 c
ATOM 618  H HG21 . VAL Axp A    36  ? 42.51  26.697  30.626  1    30.354  ? 1117 A 1 c
ATOM 619  H HG22 . VAL Axp A    36  ? 43.809 26.749  29.717  1    30.305  ? 1117 A 1 c
ATOM 620  H HG23 . VAL Axp A    36  ? 43.675 25.645  30.848  1    30.256  ? 1117 A 1 c
ATOM 621  N N    . LEU Axp A    37  ? 42.134 23.334  26.802  1    33.903  ? 1118 A 1 .
ATOM 622  C CA   . LEU Axp A    37  ? 41.567 22.115  26.256  1    34.033  ? 1118 A 1 .
ATOM 623  C C    . LEU Axp A    37  ? 42.622 21.34   25.478  1    34.554  ? 1118 A 1 .
ATOM 624  O O    . LEU Axp A    37  ? 42.751 20.134  25.661  1    37.41   ? 1118 A 1 .
ATOM 625  C CB   . LEU Axp A    37  ? 40.405 22.446  25.331  1    34.547  ? 1118 A 1 .
ATOM 626  C CG   . LEU Axp A    37  ? 39.088 22.857  25.982  1    34.713  ? 1118 A 1 .
ATOM 627  C CD1  . LEU Axp A    37  ? 38.074 22.88   24.863  1    35.166  ? 1118 A 1 .
ATOM 628  C CD2  . LEU Axp A    37  ? 38.655 21.927  27.097  1    35.297  ? 1118 A 1 .
ATOM 629  H H    . LEU Axp A    37  ? 41.76  24.132  26.56   1    33.669  ? 1118 A 1 c
ATOM 630  H HA   . LEU Axp A    37  ? 41.246 21.553  27.005  1    34.224  ? 1118 A 1 c
ATOM 631  H HB3  . LEU Axp A    37  ? 40.233 21.656  24.768  1    34.478  ? 1118 A 1 c
ATOM 632  H HB2  . LEU Axp A    37  ? 40.691 23.171  24.729  1    34.466  ? 1118 A 1 c
ATOM 633  H HG   . LEU Axp A    37  ? 39.185 23.775  26.346  1    34.874  ? 1118 A 1 c
ATOM 634  H HD11 . LEU Axp A    37  ? 38.404 23.44   24.141  1    34.879  ? 1118 A 1 c
ATOM 635  H HD12 . LEU Axp A    37  ? 37.234 23.24   25.195  1    34.917  ? 1118 A 1 c
ATOM 636  H HD13 . LEU Axp A    37  ? 37.932 21.976  24.534  1    34.921  ? 1118 A 1 c
ATOM 637  H HD21 . LEU Axp A    37  ? 39.081 22.196  27.928  1    35.118  ? 1118 A 1 c
ATOM 638  H HD22 . LEU Axp A    37  ? 38.915 21.016  26.88   1    35.111  ? 1118 A 1 c
ATOM 639  H HD23 . LEU Axp A    37  ? 37.689 21.971  27.201  1    35.109  ? 1118 A 1 c
ATOM 640  N N    . ASP Axp A    38  ? 43.327 22.024  24.572  1    32.953  ? 1119 A 1 .
ATOM 641  C CA   . ASP Axp A    38  ? 44.311 21.348  23.754  1    33.96   ? 1119 A 1 .
ATOM 642  C C    . ASP Axp A    38  ? 45.22  20.553  24.673  1    36.16   ? 1119 A 1 .
ATOM 643  O O    . ASP Axp A    38  ? 45.374 19.349  24.507  1    37.265  ? 1119 A 1 .
ATOM 644  C CB   . ASP Axp A    38  ? 45.102 22.309  22.89   1    34.126  ? 1119 A 1 .
ATOM 645  C CG   . ASP Axp A    38  ? 44.455 22.687  21.57   1    35.439  ? 1119 A 1 .
ATOM 646  O OD1  . ASP Axp A    38  ? 43.584 21.932  21.08   1    35.649  ? 1119 A 1 .
ATOM 647  O OD2  . ASP Axp A    38  ? 44.821 23.753  21.053  1    37.805  ? 1119 A 1 .
ATOM 648  H H    . ASP Axp A    38  ? 43.189 22.92   24.46   1    33.56   ? 1119 A 1 c
ATOM 649  H HA   . ASP Axp A    38  ? 43.838 20.718  23.165  1    34.218  ? 1119 A 1 c
ATOM 650  H HB3  . ASP Axp A    38  ? 45.974 21.908  22.691  1    34.396  ? 1119 A 1 c
ATOM 651  H HB2  . ASP Axp A    38  ? 45.261 23.132  23.398  1    34.385  ? 1119 A 1 c
ATOM 652  N N    . ASN Axp A    39  ? 45.798 21.234  25.66   1    39.095  ? 1120 A 1 .
ATOM 653  C CA   . ASN Axp A    39  ? 46.678 20.561  26.595  1    41.8    ? 1120 A 1 .
ATOM 654  C C    . ASN Axp A    39  ? 45.962 19.326  27.144  1    38.814  ? 1120 A 1 .
ATOM 655  O O    . ASN Axp A    39  ? 46.486 18.22   27.077  1    36.84   ? 1120 A 1 .
ATOM 656  C CB   . ASN Axp A    39  ? 47.144 21.512  27.689  1    45.782  ? 1120 A 1 .
ATOM 657  C CG   . ASN Axp A    39  ? 47.732 20.753  28.85   1    48.868  ? 1120 A 1 .
ATOM 658  O OD1  . ASN Axp A    39  ? 48.903 20.359  28.808  1    49.752  ? 1120 A 1 .
ATOM 659  N ND2  . ASN Axp A    39  ? 46.93  20.536  29.884  1    51.486  ? 1120 A 1 .
ATOM 660  H H    . ASN Axp A    39  ? 45.649 22.131  25.751  1    38.967  ? 1120 A 1 c
ATOM 661  H HA   . ASN Axp A    39  ? 47.476 20.263  26.103  1    41.371  ? 1120 A 1 c
ATOM 662  H HB3  . ASN Axp A    39  ? 46.387 22.046  28      1    45.456  ? 1120 A 1 c
ATOM 663  H HB2  . ASN Axp A    39  ? 47.818 22.12   27.324  1    45.511  ? 1120 A 1 c
ATOM 664  H HD21 . ASN Axp A    39  ? 46.759 21.191  30.457  1    50.649  ? 1120 A 1 c
ATOM 665  H HD22 . ASN Axp A    39  ? 46.567 19.735  30.001  1    50.594  ? 1120 A 1 c
ATOM 666  N N    . TYR Axp A    40  ? 44.74  19.534  27.646  1    39.9    ? 1121 A 1 .
ATOM 667  C CA   . TYR Axp A    40  ? 43.984 18.52   28.371  1    39.959  ? 1121 A 1 .
ATOM 668  C C    . TYR Axp A    40  ? 43.656 17.292  27.52   1    39.014  ? 1121 A 1 .
ATOM 669  O O    . TYR Axp A    40  ? 43.796 16.167  27.998  1    39.099  ? 1121 A 1 .
ATOM 670  C CB   . TYR Axp A    40  ? 42.677 19.115  28.891  1    38.916  ? 1121 A 1 .
ATOM 671  C CG   . TYR Axp A    40  ? 41.654 18.059  29.272  1    39.531  ? 1121 A 1 .
ATOM 672  C CD1  . TYR Axp A    40  ? 41.757 17.358  30.466  1    41.346  ? 1121 A 1 .
ATOM 673  C CD2  . TYR Axp A    40  ? 40.592 17.763  28.436  1    40.416  ? 1121 A 1 .
ATOM 674  C CE1  . TYR Axp A    40  ? 40.821 16.404  30.825  1    41.344  ? 1121 A 1 .
ATOM 675  C CE2  . TYR Axp A    40  ? 39.651 16.812  28.783  1    42.019  ? 1121 A 1 .
ATOM 676  C CZ   . TYR Axp A    40  ? 39.761 16.137  29.982  1    41.165  ? 1121 A 1 .
ATOM 677  O OH   . TYR Axp A    40  ? 38.812 15.213  30.294  1    44.896  ? 1121 A 1 .
ATOM 678  H H    . TYR Axp A    40  ? 44.361 20.358  27.538  1    39.626  ? 1121 A 1 c
ATOM 679  H HA   . TYR Axp A    40  ? 44.527 18.226  29.15   1    39.579  ? 1121 A 1 c
ATOM 680  H HB3  . TYR Axp A    40  ? 42.295 19.695  28.196  1    39.297  ? 1121 A 1 c
ATOM 681  H HB2  . TYR Axp A    40  ? 42.875 19.669  29.678  1    39.292  ? 1121 A 1 c
ATOM 682  H HD1  . TYR Axp A    40  ? 42.473 17.545  31.053  1    40.919  ? 1121 A 1 c
ATOM 683  H HD2  . TYR Axp A    40  ? 40.5   18.229  27.62   1    40.581  ? 1121 A 1 c
ATOM 684  H HE1  . TYR Axp A    40  ? 40.9   15.945  31.644  1    41.308  ? 1121 A 1 c
ATOM 685  H HE2  . TYR Axp A    40  ? 38.928 16.632  28.209  1    41.39   ? 1121 A 1 c
ATOM 686  H HH   . TYR Axp A    40  ? 39.124 14.821  31.135  0    31.44   ? 1121 A 1 c
ATOM 687  N N    . TYR Axp A    41  ? 43.16  17.514  26.295  1    38.036  ? 1122 A 1 .
ATOM 688  C CA   . TYR Axp A    41  ? 42.833 16.43   25.377  1    36.644  ? 1122 A 1 .
ATOM 689  C C    . TYR Axp A    41  ? 44.124 15.75   24.892  1    33.989  ? 1122 A 1 .
ATOM 690  O O    . TYR Axp A    41  ? 44.189 14.528  24.751  1    31.825  ? 1122 A 1 .
ATOM 691  C CB   . TYR Axp A    41  ? 41.93  16.992  24.264  1    36.566  ? 1122 A 1 .
ATOM 692  C CG   . TYR Axp A    41  ? 40.468 17.225  24.639  1    34.912  ? 1122 A 1 .
ATOM 693  C CD1  . TYR Axp A    41  ? 39.705 16.216  25.214  1    33.294  ? 1122 A 1 .
ATOM 694  C CD2  . TYR Axp A    41  ? 39.858 18.461  24.444  1    34.682  ? 1122 A 1 .
ATOM 695  C CE1  . TYR Axp A    41  ? 38.384 16.421  25.573  1    33.314  ? 1122 A 1 .
ATOM 696  C CE2  . TYR Axp A    41  ? 38.534 18.68   24.793  1    34.191  ? 1122 A 1 .
ATOM 697  C CZ   . TYR Axp A    41  ? 37.8   17.655  25.363  1    35.387  ? 1122 A 1 .
ATOM 698  O OH   . TYR Axp A    41  ? 36.502 17.831  25.736  1    43.105  ? 1122 A 1 .
ATOM 699  H H    . TYR Axp A    41  ? 43.019 18.376  26.024  1    37.947  ? 1122 A 1 c
ATOM 700  H HA   . TYR Axp A    41  ? 42.309 15.755  25.882  1    36.387  ? 1122 A 1 c
ATOM 701  H HB3  . TYR Axp A    41  ? 41.96  16.371  23.508  1    36.155  ? 1122 A 1 c
ATOM 702  H HB2  . TYR Axp A    41  ? 42.314 17.843  23.955  1    36.184  ? 1122 A 1 c
ATOM 703  H HD1  . TYR Axp A    41  ? 40.095 15.37   25.362  1    33.879  ? 1122 A 1 c
ATOM 704  H HD2  . TYR Axp A    41  ? 40.356 19.165  24.062  1    34.651  ? 1122 A 1 c
ATOM 705  H HE1  . TYR Axp A    41  ? 37.884 15.723  25.96   1    33.854  ? 1122 A 1 c
ATOM 706  H HE2  . TYR Axp A    41  ? 38.14  19.524  24.656  1    34.621  ? 1122 A 1 c
ATOM 707  H HH   . TYR Axp A    41  ? 36.169 17.279  26.094  0    27.1    ? 1122 A 1 c
ATOM 708  N N    . ALA Axp A    42  ? 45.171 16.536  24.639  1    32.89   ? 1123 A 1 .
ATOM 709  C CA   . ALA Axp A    42  ? 46.419 15.97   24.16   1    33.394  ? 1123 A 1 .
ATOM 710  C C    . ALA Axp A    42  ? 46.959 14.972  25.175  1    34.598  ? 1123 A 1 .
ATOM 711  O O    . ALA Axp A    42  ? 47.483 13.928  24.802  1    33.948  ? 1123 A 1 .
ATOM 712  C CB   . ALA Axp A    42  ? 47.419 17.056  23.901  1    33.444  ? 1123 A 1 .
ATOM 713  H H    . ALA Axp A    42  ? 45.108 17.44   24.76   1    33.316  ? 1123 A 1 c
ATOM 714  H HA   . ALA Axp A    42  ? 46.235 15.483  23.309  1    33.513  ? 1123 A 1 c
ATOM 715  H HB3  . ALA Axp A    42  ? 48.25  16.666  23.582  1    33.438  ? 1123 A 1 c
ATOM 716  H HB2  . ALA Axp A    42  ? 47.59  17.547  24.723  1    33.451  ? 1123 A 1 c
ATOM 717  H HB1  . ALA Axp A    42  ? 47.073 17.667  23.229  1    33.452  ? 1123 A 1 c
ATOM 718  N N    . LYS Axp A    43  ? 46.818 15.319  26.455  1    37.167  ? 1124 A 1 .
ATOM 719  C CA   . LYS Axp A    43  ? 47.14  14.409  27.537  1    40.485  ? 1124 A 1 .
ATOM 720  C C    . LYS Axp A    43  ? 46.382 13.101  27.343  1    42.115  ? 1124 A 1 .
ATOM 721  O O    . LYS Axp A    43  ? 46.979 12.039  27.458  1    45.26   ? 1124 A 1 .
ATOM 722  C CB   . LYS Axp A    43  ? 46.892 15.04   28.914  1    44.732  ? 1124 A 1 .
ATOM 723  C CG   . LYS Axp A    43  ? 48.059 15.917  29.361  1    50.761  ? 1124 A 1 .
ATOM 724  C CD   . LYS Axp A    43  ? 48.02  16.565  30.742  1    56.207  ? 1124 A 1 .
ATOM 725  C CE   . LYS Axp A    43  ? 49.271 17.398  30.912  1    64.653  ? 1124 A 1 .
ATOM 726  N NZ   . LYS Axp A    43  ? 49.115 18.581  31.769  1    69.232  ? 1124 A 1 .
ATOM 727  H H    . LYS Axp A    43  ? 46.522 16.158  26.662  1    37.293  ? 1124 A 1 c
ATOM 728  H HA   . LYS Axp A    43  ? 48.108 14.205  27.476  1    40.979  ? 1124 A 1 c
ATOM 729  H HB3  . LYS Axp A    43  ? 46.757 14.33   29.578  1    44.984  ? 1124 A 1 c
ATOM 730  H HB2  . LYS Axp A    43  ? 46.079 15.586  28.882  1    44.922  ? 1124 A 1 c
ATOM 731  H HG3  . LYS Axp A    43  ? 48.159 16.632  28.695  1    50.607  ? 1124 A 1 c
ATOM 732  H HG2  . LYS Axp A    43  ? 48.875 15.373  29.308  1    50.427  ? 1124 A 1 c
ATOM 733  H HD3  . LYS Axp A    43  ? 47.989 15.871  31.437  1    56.733  ? 1124 A 1 c
ATOM 734  H HD2  . LYS Axp A    43  ? 47.227 17.138  30.821  1    56.788  ? 1124 A 1 c
ATOM 735  H HE3  . LYS Axp A    43  ? 49.582 17.695  30.038  1    63.466  ? 1124 A 1 c
ATOM 736  H HE2  . LYS Axp A    43  ? 49.969 16.835  31.293  1    63.611  ? 1124 A 1 c
ATOM 737  H HZ1  . LYS Axp A    43  ? 49.069 18.326  32.637  1    67.745  ? 1124 A 1 c
ATOM 738  H HZ2  . LYS Axp A    43  ? 48.357 19.025  31.55   1    67.603  ? 1124 A 1 c
ATOM 739  H HZ3  . LYS Axp A    43  ? 49.824 19.134  31.659  1    67.745  ? 1124 A 1 c
ATOM 740  N N    . GLN Axp A    44  ? 45.082 13.18   27.021  1    45.248  ? 1125 A 1 .
ATOM 741  C CA   . GLN Axp A    44  ? 44.268 11.988  26.796  1    45.144  ? 1125 A 1 .
ATOM 742  C C    . GLN Axp A    44  ? 44.616 11.329  25.455  1    45.325  ? 1125 A 1 .
ATOM 743  O O    . GLN Axp A    44  ? 44.184 10.208  25.179  1    40.605  ? 1125 A 1 .
ATOM 744  C CB   . GLN Axp A    44  ? 42.777 12.299  26.934  1    44.206  ? 1125 A 1 .
ATOM 745  C CG   . GLN Axp A    44  ? 42.346 12.635  28.357  1    46.44   ? 1125 A 1 .
ATOM 746  C CD   . GLN Axp A    44  ? 40.855 12.831  28.487  1    52.868  ? 1125 A 1 .
ATOM 747  O OE1  . GLN Axp A    44  ? 40.227 12.386  29.449  1    61.262  ? 1125 A 1 .
ATOM 748  N NE2  . GLN Axp A    44  ? 40.266 13.52   27.525  1    58.538  ? 1125 A 1 .
ATOM 749  H H    . GLN Axp A    44  ? 44.686 14.001  26.954  1    44.308  ? 1125 A 1 c
ATOM 750  H HA   . GLN Axp A    44  ? 44.488 11.338  27.512  1    45.007  ? 1125 A 1 c
ATOM 751  H HB3  . GLN Axp A    44  ? 42.265 11.525  26.621  1    44.918  ? 1125 A 1 c
ATOM 752  H HB2  . GLN Axp A    44  ? 42.561 13.055  26.349  1    44.905  ? 1125 A 1 c
ATOM 753  H HG3  . GLN Axp A    44  ? 42.799 13.455  28.648  1    47.319  ? 1125 A 1 c
ATOM 754  H HG2  . GLN Axp A    44  ? 42.623 11.911  28.959  1    47.319  ? 1125 A 1 c
ATOM 755  H HE21 . GLN Axp A    44  ? 39.728 13.11   26.952  1    56.648  ? 1125 A 1 c
ATOM 756  H HE22 . GLN Axp A    44  ? 40.409 14.392  27.456  1    56.383  ? 1125 A 1 c
ATOM 757  N N    . LYS Axp A    45  ? 45.422 12.013  24.631  1    46.903  ? 1126 A 1 .
ATOM 758  C CA   . LYS Axp A    45  ? 45.988 11.405  23.438  1    46.988  ? 1126 A 1 .
ATOM 759  C C    . LYS Axp A    45  ? 44.834 11.082  22.491  1    44.266  ? 1126 A 1 .
ATOM 760  O O    . LYS Axp A    45  ? 44.822 10.012  21.878  1    45.605  ? 1126 A 1 .
ATOM 761  C CB   . LYS Axp A    45  ? 46.808 10.17   23.851  1    49.047  ? 1126 A 1 .
ATOM 762  C CG   . LYS Axp A    45  ? 48.062 9.818   23.029  1    52.321  ? 1126 A 1 .
ATOM 763  C CD   . LYS Axp A    45  ? 48.928 8.73    23.678  1    55.041  ? 1126 A 1 .
ATOM 764  C CE   . LYS Axp A    45  ? 50.413 8.696   23.371  1    57.788  ? 1126 A 1 .
ATOM 765  N NZ   . LYS Axp A    45  ? 50.782 8.232   22.027  1    61.458  ? 1126 A 1 .
ATOM 766  H H    . LYS Axp A    45  ? 45.596 12.894  24.797  1    46.4    ? 1126 A 1 c
ATOM 767  H HA   . LYS Axp A    45  ? 46.586 12.064  23.003  1    46.822  ? 1126 A 1 c
ATOM 768  H HB3  . LYS Axp A    45  ? 46.214 9.391   23.836  1    49.192  ? 1126 A 1 c
ATOM 769  H HB2  . LYS Axp A    45  ? 47.091 10.297  24.781  1    49.274  ? 1126 A 1 c
ATOM 770  H HG3  . LYS Axp A    45  ? 48.601 10.631  22.915  1    52.156  ? 1126 A 1 c
ATOM 771  H HG2  . LYS Axp A    45  ? 47.779 9.515   22.139  1    52.156  ? 1126 A 1 c
ATOM 772  H HD3  . LYS Axp A    45  ? 48.546 7.864   23.425  1    54.747  ? 1126 A 1 c
ATOM 773  H HD2  . LYS Axp A    45  ? 48.819 8.804   24.651  1    54.895  ? 1126 A 1 c
ATOM 774  H HE3  . LYS Axp A    45  ? 50.849 8.118   24.023  1    57.995  ? 1126 A 1 c
ATOM 775  H HE2  . LYS Axp A    45  ? 50.774 9.593   23.494  1    57.995  ? 1126 A 1 c
ATOM 776  H HZ1  . LYS Axp A    45  ? 50.511 8.837   21.409  1    60.304  ? 1126 A 1 c
ATOM 777  H HZ2  . LYS Axp A    45  ? 50.385 7.436   21.858  1    60.304  ? 1126 A 1 c
ATOM 778  H HZ3  . LYS Axp A    45  ? 51.681 8.135   21.973  1    60.304  ? 1126 A 1 c
ATOM 779  N N    . ILE Axp A    46  ? 43.864 12.012  22.389  1    38.476  ? 1127 A 1 .
ATOM 780  C CA   . ILE Axp A    46  ? 42.634 11.713  21.672  1    35.04   ? 1127 A 1 .
ATOM 781  C C    . ILE Axp A    46  ? 42.861 11.982  20.193  1    32.138  ? 1127 A 1 .
ATOM 782  O O    . ILE Axp A    46  ? 43.597 12.898  19.834  1    29.618  ? 1127 A 1 .
ATOM 783  C CB   . ILE Axp A    46  ? 41.373 12.446  22.187  1    34.549  ? 1127 A 1 .
ATOM 784  C CG1  . ILE Axp A    46  ? 40.962 13.68   21.357  1    33.909  ? 1127 A 1 .
ATOM 785  C CG2  . ILE Axp A    46  ? 41.461 12.75   23.678  1    34.585  ? 1127 A 1 .
ATOM 786  C CD1  . ILE Axp A    46  ? 41.938 14.833  21.398  1    34.984  ? 1127 A 1 .
ATOM 787  H H    . ILE Axp A    46  ? 43.983 12.843  22.75   1    38.958  ? 1127 A 1 c
ATOM 788  H HA   . ILE Axp A    46  ? 42.47  10.759  21.776  1    35.109  ? 1127 A 1 c
ATOM 789  H HB   . ILE Axp A    46  ? 40.642 11.812  22.09   1    34.528  ? 1127 A 1 c
ATOM 790  H HG12 . ILE Axp A    46  ? 40.096 13.998  21.687  1    34.296  ? 1127 A 1 c
ATOM 791  H HG13 . ILE Axp A    46  ? 40.837 13.407  20.425  1    34.285  ? 1127 A 1 c
ATOM 792  H HG21 . ILE Axp A    46  ? 40.573 12.937  24.025  1    34.583  ? 1127 A 1 c
ATOM 793  H HG22 . ILE Axp A    46  ? 42.031 13.521  23.824  1    34.594  ? 1127 A 1 c
ATOM 794  H HG23 . ILE Axp A    46  ? 41.833 11.982  24.146  1    34.598  ? 1127 A 1 c
ATOM 795  H HD11 . ILE Axp A    46  ? 42.659 14.651  22.03   1    34.695  ? 1127 A 1 c
ATOM 796  H HD12 . ILE Axp A    46  ? 41.464 15.641  21.67   1    34.676  ? 1127 A 1 c
ATOM 797  H HD13 . ILE Axp A    46  ? 42.316 14.969  20.509  1    34.641  ? 1127 A 1 c
ATOM 798  N N    . THR Axp A    47  ? 42.198 11.147  19.38   1    30.755  ? 1128 A 1 .
ATOM 799  C CA   . THR Axp A    47  ? 42.067 11.346  17.949  1    29.795  ? 1128 A 1 .
ATOM 800  C C    . THR Axp A    47  ? 40.642 11.776  17.627  1    28.712  ? 1128 A 1 .
ATOM 801  O O    . THR Axp A    47  ? 39.696 11.09   17.973  1    29.127  ? 1128 A 1 .
ATOM 802  C CB   . THR Axp A    47  ? 42.365 10.046  17.212  1    28.976  ? 1128 A 1 .
ATOM 803  O OG1  . THR Axp A    47  ? 43.723 9.725   17.497  1    29.932  ? 1128 A 1 .
ATOM 804  C CG2  . THR Axp A    47  ? 42.104 10.185  15.722  1    28.086  ? 1128 A 1 .
ATOM 805  H H    . THR Axp A    47  ? 41.804 10.408  19.746  1    30.919  ? 1128 A 1 c
ATOM 806  H HA   . THR Axp A    47  ? 42.697 12.036  17.659  1    29.612  ? 1128 A 1 c
ATOM 807  H HB   . THR Axp A    47  ? 41.784 9.332   17.568  1    29.152  ? 1128 A 1 c
ATOM 808  H HG1  . THR Axp A    47  ? 44.21  10.268  17.134  0    24.18   ? 1128 A 1 c
ATOM 809  H HG21 . THR Axp A    47  ? 42.596 9.498   15.242  1    28.362  ? 1128 A 1 c
ATOM 810  H HG22 . THR Axp A    47  ? 42.395 11.06   15.42   1    28.376  ? 1128 A 1 c
ATOM 811  H HG23 . THR Axp A    47  ? 41.154 10.083  15.547  1    28.398  ? 1128 A 1 c
ATOM 812  N N    . VAL Axp A    48  ? 40.482 12.877  16.91   1    27.543  ? 1129 A 1 .
ATOM 813  C CA   . VAL Axp A    48  ? 39.178 13.177  16.377  1    26.315  ? 1129 A 1 .
ATOM 814  C C    . VAL Axp A    48  ? 39.173 12.743  14.929  1    27.036  ? 1129 A 1 .
ATOM 815  O O    . VAL Axp A    48  ? 40.209 12.752  14.275  1    28.652  ? 1129 A 1 .
ATOM 816  C CB   . VAL Axp A    48  ? 38.854 14.661  16.501  1    27.173  ? 1129 A 1 .
ATOM 817  C CG1  . VAL Axp A    48  ? 37.451 14.955  15.994  1    28.042  ? 1129 A 1 .
ATOM 818  C CG2  . VAL Axp A    48  ? 39.032 15.099  17.94   1    28.5    ? 1129 A 1 .
ATOM 819  H H    . VAL Axp A    48  ? 41.181 13.445  16.753  1    27.564  ? 1129 A 1 c
ATOM 820  H HA   . VAL Axp A    48  ? 38.507 12.667  16.866  1    26.88   ? 1129 A 1 c
ATOM 821  H HB   . VAL Axp A    48  ? 39.5   15.153  15.942  1    27.429  ? 1129 A 1 c
ATOM 822  H HG11 . VAL Axp A    48  ? 36.823 14.333  16.395  1    27.803  ? 1129 A 1 c
ATOM 823  H HG12 . VAL Axp A    48  ? 37.426 14.861  15.027  1    27.793  ? 1129 A 1 c
ATOM 824  H HG13 . VAL Axp A    48  ? 37.203 15.862  16.235  1    27.821  ? 1129 A 1 c
ATOM 825  H HG21 . VAL Axp A    48  ? 38.944 16.065  17.997  1    28.068  ? 1129 A 1 c
ATOM 826  H HG22 . VAL Axp A    48  ? 39.913 14.838  18.256  1    28.091  ? 1129 A 1 c
ATOM 827  H HG23 . VAL Axp A    48  ? 38.353 14.68   18.495  1    28.1    ? 1129 A 1 c
ATOM 828  N N    . GLY Axp A    49  ? 38.001 12.315  14.478  1    26.838  ? 1130 A 1 .
ATOM 829  C CA   . GLY Axp A    49  ? 37.785 11.964  13.093  1    26.416  ? 1130 A 1 .
ATOM 830  C C    . GLY Axp A    49  ? 36.511 12.641  12.63   1    27.513  ? 1130 A 1 .
ATOM 831  O O    . GLY Axp A    49  ? 35.758 13.153  13.449  1    28.576  ? 1130 A 1 .
ATOM 832  H H    . GLY Axp A    49  ? 37.302 12.236  15.061  1    26.796  ? 1130 A 1 c
ATOM 833  H HA3  . GLY Axp A    49  ? 37.702 10.99   13.007  1    26.803  ? 1130 A 1 c
ATOM 834  H HA2  . GLY Axp A    49  ? 38.544 12.265  12.546  1    26.801  ? 1130 A 1 c
ATOM 835  N N    . LEU Axp A    50  ? 36.3   12.643  11.318  1    28.833  ? 1131 A 1 .
ATOM 836  C CA   . LEU Axp A    50  ? 35.345 13.526  10.686  1    27.884  ? 1131 A 1 .
ATOM 837  C C    . LEU Axp A    50  ? 34.937 12.886  9.378   1    27.349  ? 1131 A 1 .
ATOM 838  O O    . LEU Axp A    50  ? 35.809 12.468  8.629   1    25.522  ? 1131 A 1 .
ATOM 839  C CB   . LEU Axp A    50  ? 36.056 14.861  10.489  1    27.686  ? 1131 A 1 .
ATOM 840  C CG   . LEU Axp A    50  ? 35.374 15.875  9.578   1    27.504  ? 1131 A 1 .
ATOM 841  C CD1  . LEU Axp A    50  ? 35.523 17.251  10.181  1    28.381  ? 1131 A 1 .
ATOM 842  C CD2  . LEU Axp A    50  ? 35.994 15.857  8.218   1    27.617  ? 1131 A 1 .
ATOM 843  H H    . LEU Axp A    50  ? 36.789 12.078  10.792  1    28.228  ? 1131 A 1 c
ATOM 844  H HA   . LEU Axp A    50  ? 34.565 13.639  11.277  1    28.005  ? 1131 A 1 c
ATOM 845  H HB3  . LEU Axp A    50  ? 36.957 14.679  10.133  1    27.697  ? 1131 A 1 c
ATOM 846  H HB2  . LEU Axp A    50  ? 36.178 15.273  11.376  1    27.7    ? 1131 A 1 c
ATOM 847  H HG   . LEU Axp A    50  ? 34.41  15.652  9.505   1    27.718  ? 1131 A 1 c
ATOM 848  H HD11 . LEU Axp A    50  ? 35.023 17.297  11.012  1    28.163  ? 1131 A 1 c
ATOM 849  H HD12 . LEU Axp A    50  ? 35.182 17.917  9.561   1    28.148  ? 1131 A 1 c
ATOM 850  H HD13 . LEU Axp A    50  ? 36.462 17.428  10.359  1    28.126  ? 1131 A 1 c
ATOM 851  H HD21 . LEU Axp A    50  ? 36.235 14.947  7.98    1    27.611  ? 1131 A 1 c
ATOM 852  H HD22 . LEU Axp A    50  ? 36.79  16.414  8.215   1    27.626  ? 1131 A 1 c
ATOM 853  H HD23 . LEU Axp A    50  ? 35.358 16.2    7.57    1    27.657  ? 1131 A 1 c
ATOM 854  N N    . THR Axp A    51  ? 33.623 12.798  9.151   1    30.101  ? 1132 A 1 .
ATOM 855  C CA   . THR Axp A    51  ? 33.065 12.008  8.058   1    31.944  ? 1132 A 1 .
ATOM 856  C C    . THR Axp A    51  ? 32.454 12.936  7.033   1    30.621  ? 1132 A 1 .
ATOM 857  O O    . THR Axp A    51  ? 31.41  13.527  7.284   1    31.577  ? 1132 A 1 .
ATOM 858  C CB   . THR Axp A    51  ? 31.961 11.041  8.488   1    33.538  ? 1132 A 1 .
ATOM 859  O OG1  . THR Axp A    51  ? 30.946 11.836  9.108   1    32.243  ? 1132 A 1 .
ATOM 860  C CG2  . THR Axp A    51  ? 32.475 9.901   9.35    1    34.558  ? 1132 A 1 .
ATOM 861  H H    . THR Axp A    51  ? 33.047 13.251  9.696   1    29.787  ? 1132 A 1 c
ATOM 862  H HA   . THR Axp A    51  ? 33.784 11.496  7.64    1    31.481  ? 1132 A 1 c
ATOM 863  H HB   . THR Axp A    51  ? 31.579 10.633  7.674   1    33.159  ? 1132 A 1 c
ATOM 864  H HG1  . THR Axp A    51  ? 31.326 12.147  9.914   0    22.73   ? 1132 A 1 c
ATOM 865  H HG21 . THR Axp A    51  ? 31.814 9.683   10.028  1    34.245  ? 1132 A 1 c
ATOM 866  H HG22 . THR Axp A    51  ? 33.305 10.167  9.781   1    34.216  ? 1132 A 1 c
ATOM 867  H HG23 . THR Axp A    51  ? 32.636 9.12    8.794   1    34.245  ? 1132 A 1 c
ATOM 868  N N    . VAL Axp A    52  ? 33.048 12.95   5.853   1    29.906  ? 1133 A 1 .
ATOM 869  C CA   . VAL Axp A    52  ? 32.512 13.769  4.796   1    30.902  ? 1133 A 1 .
ATOM 870  C C    . VAL Axp A    52  ? 32.149 12.878  3.616   1    33.4    ? 1133 A 1 .
ATOM 871  O O    . VAL Axp A    52  ? 32.874 11.947  3.26    1    33.226  ? 1133 A 1 .
ATOM 872  C CB   . VAL Axp A    52  ? 33.514 14.862  4.423   1    30.932  ? 1133 A 1 .
ATOM 873  C CG1  . VAL Axp A    52  ? 34.826 14.277  3.916   1    32.854  ? 1133 A 1 .
ATOM 874  C CG2  . VAL Axp A    52  ? 32.906 15.81   3.411   1    31.039  ? 1133 A 1 .
ATOM 875  H H    . VAL Axp A    52  ? 33.784 12.432  5.696   1    30.351  ? 1133 A 1 c
ATOM 876  H HA   . VAL Axp A    52  ? 31.698 14.199  5.121   1    31.199  ? 1133 A 1 c
ATOM 877  H HB   . VAL Axp A    52  ? 33.707 15.374  5.243   1    31.295  ? 1133 A 1 c
ATOM 878  H HG11 . VAL Axp A    52  ? 34.68  13.84   3.061   1    32.271  ? 1133 A 1 c
ATOM 879  H HG12 . VAL Axp A    52  ? 35.167 13.631  4.556   1    32.246  ? 1133 A 1 c
ATOM 880  H HG13 . VAL Axp A    52  ? 35.476 14.992  3.805   1    32.268  ? 1133 A 1 c
ATOM 881  H HG21 . VAL Axp A    52  ? 33.389 16.653  3.426   1    31.014  ? 1133 A 1 c
ATOM 882  H HG22 . VAL Axp A    52  ? 31.973 15.969  3.633   1    31.015  ? 1133 A 1 c
ATOM 883  H HG23 . VAL Axp A    52  ? 32.965 15.42   2.523   1    31.036  ? 1133 A 1 c
ATOM 884  N N    . PHE Axp A    53  ? 30.969 13.154  3.063   1    34.857  ? 1134 A 1 .
ATOM 885  C CA   . PHE Axp A    53  ? 30.471 12.441  1.911   1    35.637  ? 1134 A 1 .
ATOM 886  C C    . PHE Axp A    53  ? 30.451 13.403  0.739   1    35.789  ? 1134 A 1 .
ATOM 887  O O    . PHE Axp A    53  ? 30.162 14.573  0.915   1    33.861  ? 1134 A 1 .
ATOM 888  C CB   . PHE Axp A    53  ? 29.047 11.956  2.151   1    38.797  ? 1134 A 1 .
ATOM 889  C CG   . PHE Axp A    53  ? 28.914 10.793  3.115   1    43.78   ? 1134 A 1 .
ATOM 890  C CD1  . PHE Axp A    53  ? 28.847 11.006  4.485   1    48.874  ? 1134 A 1 .
ATOM 891  C CD2  . PHE Axp A    53  ? 28.795 9.493   2.647   1    47.549  ? 1134 A 1 .
ATOM 892  C CE1  . PHE Axp A    53  ? 28.706 9.942   5.364   1    50.428  ? 1134 A 1 .
ATOM 893  C CE2  . PHE Axp A    53  ? 28.65  8.433   3.53    1    49.71   ? 1134 A 1 .
ATOM 894  C CZ   . PHE Axp A    53  ? 28.612 8.658   4.889   1    50.196  ? 1134 A 1 .
ATOM 895  H H    . PHE Axp A    53  ? 30.453 13.818  3.421   1    34.617  ? 1134 A 1 c
ATOM 896  H HA   . PHE Axp A    53  ? 31.059 11.671  1.71    1    36.082  ? 1134 A 1 c
ATOM 897  H HB3  . PHE Axp A    53  ? 28.66  11.692  1.286   1    39.141  ? 1134 A 1 c
ATOM 898  H HB2  . PHE Axp A    53  ? 28.517 12.71   2.493   1    39.123  ? 1134 A 1 c
ATOM 899  H HD1  . PHE Axp A    53  ? 28.92  11.885  4.822   1    47.958  ? 1134 A 1 c
ATOM 900  H HD2  . PHE Axp A    53  ? 28.824 9.328   1.718   1    47.049  ? 1134 A 1 c
ATOM 901  H HE1  . PHE Axp A    53  ? 28.684 10.101  6.288   1    49.984  ? 1134 A 1 c
ATOM 902  H HE2  . PHE Axp A    53  ? 28.586 7.552   3.198   1    49.255  ? 1134 A 1 c
ATOM 903  H HZ   . PHE Axp A    53  ? 28.514 7.935   5.488   1    50.059  ? 1134 A 1 c
ATOM 904  N N    . ALA Axp A    54  ? 30.752 12.892  -0.449  1    41.275  ? 1135 A 1 .
ATOM 905  C CA   . ALA Axp A    54  ? 30.599 13.638  -1.684  1    45.857  ? 1135 A 1 .
ATOM 906  C C    . ALA Axp A    54  ? 30.389 12.637  -2.808  1    48.638  ? 1135 A 1 .
ATOM 907  O O    . ALA Axp A    54  ? 31.198 11.72   -2.963  1    48.724  ? 1135 A 1 .
ATOM 908  C CB   . ALA Axp A    54  ? 31.82  14.488  -1.945  1    48.431  ? 1135 A 1 .
ATOM 909  H H    . ALA Axp A    54  ? 31.072 12.037  -0.494  1    40.825  ? 1135 A 1 c
ATOM 910  H HA   . ALA Axp A    54  ? 29.792 14.219  -1.612  1    45.744  ? 1135 A 1 c
ATOM 911  H HB3  . ALA Axp A    54  ? 31.687 15.012  -2.753  1    47.652  ? 1135 A 1 c
ATOM 912  H HB2  . ALA Axp A    54  ? 32.598 13.916  -2.058  1    47.652  ? 1135 A 1 c
ATOM 913  H HB1  . ALA Axp A    54  ? 31.969 15.087  -1.194  1    47.652  ? 1135 A 1 c
ATOM 914  N N    . VAL Axp A    55  ? 29.303 12.823  -3.569  1    46.472  ? 1136 A 1 .
ATOM 915  C CA   . VAL Axp A    55  ? 28.976 11.932  -4.663  1    46.433  ? 1136 A 1 .
ATOM 916  C C    . VAL Axp A    55  ? 28.915 12.731  -5.956  1    47.559  ? 1136 A 1 .
ATOM 917  O O    . VAL Axp A    55  ? 28.455 13.866  -5.946  1    48.841  ? 1136 A 1 .
ATOM 918  C CB   . VAL Axp A    55  ? 27.647 11.249  -4.321  1    49.702  ? 1136 A 1 .
ATOM 919  C CG1  . VAL Axp A    55  ? 27.083 10.451  -5.5    1    53.047  ? 1136 A 1 .
ATOM 920  C CG2  . VAL Axp A    55  ? 27.828 10.389  -3.075  1    52.97   ? 1136 A 1 .
ATOM 921  H H    . VAL Axp A    55  ? 28.749 13.531  -3.399  1    46.951  ? 1136 A 1 c
ATOM 922  H HA   . VAL Axp A    55  ? 29.672 11.252  -4.741  1    47.29   ? 1136 A 1 c
ATOM 923  H HB   . VAL Axp A    55  ? 27.002 11.962  -4.104  1    50.264  ? 1136 A 1 c
ATOM 924  H HG11 . VAL Axp A    55  ? 27.809 10.153  -6.069  1    51.92   ? 1136 A 1 c
ATOM 925  H HG12 . VAL Axp A    55  ? 26.482 11.016  -6.014  1    52.014  ? 1136 A 1 c
ATOM 926  H HG13 . VAL Axp A    55  ? 26.595 9.679   -5.169  1    52.019  ? 1136 A 1 c
ATOM 927  H HG21 . VAL Axp A    55  ? 27.078 9.777   -2.99   1    51.962  ? 1136 A 1 c
ATOM 928  H HG22 . VAL Axp A    55  ? 27.868 10.96   -2.29   1    51.933  ? 1136 A 1 c
ATOM 929  H HG23 . VAL Axp A    55  ? 28.653 9.88    -3.146  1    51.883  ? 1136 A 1 c
ATOM 930  N N    . GLY Axp A    56  ? 29.413 12.145  -7.052  1    50.002  ? 1137 A 1 .
ATOM 931  C CA   . GLY Axp A    56  ? 29.348 12.769  -8.368  1    54.261  ? 1137 A 1 .
ATOM 932  C C    . GLY Axp A    56  ? 29.826 14.228  -8.374  1    56.661  ? 1137 A 1 .
ATOM 933  O O    . GLY Axp A    56  ? 30.909 14.544  -7.89   1    53.989  ? 1137 A 1 .
ATOM 934  H H    . GLY Axp A    56  ? 29.82  11.331  -6.975  1    50.272  ? 1137 A 1 c
ATOM 935  H HA3  . GLY Axp A    56  ? 28.417 12.729  -8.691  1    53.844  ? 1137 A 1 c
ATOM 936  H HA2  . GLY Axp A    56  ? 29.903 12.245  -8.993  1    53.748  ? 1137 A 1 c
ATOM 937  N N    . ARG Axp A    57  ? 29     15.126  -8.932  1    63.854  ? 1138 A 1 .
ATOM 938  C CA   . ARG Axp A    57  ? 29.375 16.517  -9.154  1    67.113  ? 1138 A 1 .
ATOM 939  C C    . ARG Axp A    57  ? 29.927 17.147  -7.876  1    64.211  ? 1138 A 1 .
ATOM 940  O O    . ARG Axp A    57  ? 30.774 18.031  -7.966  1    62.418  ? 1138 A 1 .
ATOM 941  C CB   . ARG Axp A    57  ? 28.228 17.372  -9.724  1    77.497  ? 1138 A 1 .
ATOM 942  C CG   . ARG Axp A    57  ? 26.892 17.383  -8.98   1    86.439  ? 1138 A 1 .
ATOM 943  C CD   . ARG Axp A    57  ? 25.822 18.291  -9.607  1    87.733  ? 1138 A 1 .
ATOM 944  N NE   . ARG Axp A    57  ? 25.51  17.898  -10.987 1    88.418  ? 1138 A 1 .
ATOM 945  C CZ   . ARG Axp A    57  ? 24.903 16.769  -11.348 1    86.549  ? 1138 A 1 .
ATOM 946  N NH1  . ARG Axp A    57  ? 24.391 15.971  -10.43  1    93.052  ? 1138 A 1 .
ATOM 947  N NH2  . ARG Axp A    57  ? 24.788 16.447  -12.624 1    79.796  ? 1138 A 1 .
ATOM 948  H H    . ARG Axp A    57  ? 28.166 14.855  -9.188  1    62.958  ? 1138 A 1 c
ATOM 949  H HA   . ARG Axp A    57  ? 30.096 16.524  -9.83   1    67.796  ? 1138 A 1 c
ATOM 950  H HB3  . ARG Axp A    57  ? 28.061 17.069  -10.641 1    76.933  ? 1138 A 1 c
ATOM 951  H HB2  . ARG Axp A    57  ? 28.549 18.298  -9.782  1    76.831  ? 1138 A 1 c
ATOM 952  H HG3  . ARG Axp A    57  ? 27.048 17.674  -8.055  1    84.474  ? 1138 A 1 c
ATOM 953  H HG2  . ARG Axp A    57  ? 26.543 16.467  -8.941  1    84.456  ? 1138 A 1 c
ATOM 954  H HD3  . ARG Axp A    57  ? 26.14  19.216  -9.599  1    87.609  ? 1138 A 1 c
ATOM 955  H HD2  . ARG Axp A    57  ? 25.006 18.248  -9.067  1    87.63   ? 1138 A 1 c
ATOM 956  H HE   . ARG Axp A    57  ? 25.739 18.447  -11.624 1    87.707  ? 1138 A 1 c
ATOM 957  H HH11 . ARG Axp A    57  ? 23.758 16.271  -9.891  1    91      ? 1138 A 1 c
ATOM 958  H HH12 . ARG Axp A    57  ? 24.684 15.14   -10.358 1    91      ? 1138 A 1 c
ATOM 959  H HH21 . ARG Axp A    57  ? 24.588 17.071  -13.218 1    81.861  ? 1138 A 1 c
ATOM 960  H HH22 . ARG Axp A    57  ? 24.91  15.609  -12.878 1    81.827  ? 1138 A 1 c
ATOM 961  N N    . TYR Axp A    58  ? 29.452 16.677  -6.707  1    66.366  ? 1139 A 1 .
ATOM 962  C CA   . TYR Axp A    58  ? 29.726 17.278  -5.402  1    64.426  ? 1139 A 1 .
ATOM 963  C C    . TYR Axp A    58  ? 31.205 17.191  -5.038  1    55.506  ? 1139 A 1 .
ATOM 964  O O    . TYR Axp A    58  ? 31.696 18.039  -4.309  1    54.022  ? 1139 A 1 .
ATOM 965  C CB   . TYR Axp A    58  ? 28.891 16.658  -4.268  1    70.594  ? 1139 A 1 .
ATOM 966  C CG   . TYR Axp A    58  ? 27.565 17.376  -4.057  1    73.314  ? 1139 A 1 .
ATOM 967  C CD1  . TYR Axp A    58  ? 27.541 18.586  -3.37   1    75.772  ? 1139 A 1 .
ATOM 968  C CD2  . TYR Axp A    58  ? 26.363 16.892  -4.573  1    70.551  ? 1139 A 1 .
ATOM 969  C CE1  . TYR Axp A    58  ? 26.367 19.292  -3.18   1    75.306  ? 1139 A 1 .
ATOM 970  C CE2  . TYR Axp A    58  ? 25.178 17.591  -4.393  1    75.641  ? 1139 A 1 .
ATOM 971  C CZ   . TYR Axp A    58  ? 25.184 18.793  -3.694  1    79.097  ? 1139 A 1 .
ATOM 972  O OH   . TYR Axp A    58  ? 24.064 19.541  -3.479  1    76.04   ? 1139 A 1 .
ATOM 973  H H    . TYR Axp A    58  ? 28.905 15.946  -6.728  1    65.409  ? 1139 A 1 c
ATOM 974  H HA   . TYR Axp A    58  ? 29.487 18.241  -5.462  1    64.192  ? 1139 A 1 c
ATOM 975  H HB3  . TYR Axp A    58  ? 29.411 16.695  -3.435  1    69.614  ? 1139 A 1 c
ATOM 976  H HB2  . TYR Axp A    58  ? 28.717 15.716  -4.479  1    69.535  ? 1139 A 1 c
ATOM 977  H HD1  . TYR Axp A    58  ? 28.345 18.93   -3.022  1    74.545  ? 1139 A 1 c
ATOM 978  H HD2  . TYR Axp A    58  ? 26.356 16.08   -5.055  1    72.422  ? 1139 A 1 c
ATOM 979  H HE1  . TYR Axp A    58  ? 26.372 20.107  -2.707  1    76.207  ? 1139 A 1 c
ATOM 980  H HE2  . TYR Axp A    58  ? 24.371 17.253  -4.742  1    75.173  ? 1139 A 1 c
ATOM 981  H HH   . TYR Axp A    58  ? 24.2   20.242  -3.1    0    54.52   ? 1139 A 1 c
ATOM 982  N N    . ILE Axp A    59  ? 31.896 16.166  -5.538  1    53.645  ? 1140 A 1 .
ATOM 983  C CA   . ILE Axp A    59  ? 33.33  16.012  -5.352  1    53.461  ? 1140 A 1 .
ATOM 984  C C    . ILE Axp A    59  ? 34.11  17.17   -5.981  1    56.558  ? 1140 A 1 .
ATOM 985  O O    . ILE Axp A    59  ? 34.839 17.874  -5.285  1    57.114  ? 1140 A 1 .
ATOM 986  C CB   . ILE Axp A    59  ? 33.767 14.662  -5.939  1    51.635  ? 1140 A 1 .
ATOM 987  C CG1  . ILE Axp A    59  ? 33.211 13.518  -5.091  1    52.105  ? 1140 A 1 .
ATOM 988  C CG2  . ILE Axp A    59  ? 35.289 14.594  -6.106  1    50.086  ? 1140 A 1 .
ATOM 989  C CD1  . ILE Axp A    59  ? 33.333 12.149  -5.731  1    53.847  ? 1140 A 1 .
ATOM 990  H H    . ILE Axp A    59  ? 31.449 15.528  -6.015  1    54.171  ? 1140 A 1 c
ATOM 991  H HA   . ILE Axp A    59  ? 33.514 16.001  -4.392  1    53.72   ? 1140 A 1 c
ATOM 992  H HB   . ILE Axp A    59  ? 33.37  14.586  -6.83   1    51.799  ? 1140 A 1 c
ATOM 993  H HG12 . ILE Axp A    59  ? 32.267 13.693  -4.906  1    52.417  ? 1140 A 1 c
ATOM 994  H HG13 . ILE Axp A    59  ? 33.685 13.506  -4.234  1    52.397  ? 1140 A 1 c
ATOM 995  H HG21 . ILE Axp A    59  ? 35.573 13.666  -6.139  1    50.733  ? 1140 A 1 c
ATOM 996  H HG22 . ILE Axp A    59  ? 35.721 15.034  -5.354  1    50.63   ? 1140 A 1 c
ATOM 997  H HG23 . ILE Axp A    59  ? 35.548 15.038  -6.932  1    50.618  ? 1140 A 1 c
ATOM 998  H HD11 . ILE Axp A    59  ? 33.199 12.224  -6.695  1    53.312  ? 1140 A 1 c
ATOM 999  H HD12 . ILE Axp A    59  ? 32.658 11.552  -5.356  1    53.32   ? 1140 A 1 c
ATOM 1000 H HD13 . ILE Axp A    59  ? 34.221 11.783  -5.555  1    53.306  ? 1140 A 1 c
ATOM 1001 N N    . GLU Axp A    60  ? 33.976 17.342  -7.305  1    59.586  ? 1141 A 1 .
ATOM 1002 C CA   . GLU Axp A    60  ? 34.804 18.274  -8.06   1    61.638  ? 1141 A 1 .
ATOM 1003 C C    . GLU Axp A    60  ? 34.51  19.697  -7.6    1    57.574  ? 1141 A 1 .
ATOM 1004 O O    . GLU Axp A    60  ? 35.331 20.585  -7.812  1    59.813  ? 1141 A 1 .
ATOM 1005 C CB   . GLU Axp A    60  ? 34.629 18.23   -9.585  1    69.543  ? 1141 A 1 .
ATOM 1006 C CG   . GLU Axp A    60  ? 34.772 16.843  -10.218 1    74.193  ? 1141 A 1 .
ATOM 1007 C CD   . GLU Axp A    60  ? 33.514 15.985  -10.2   1    80.728  ? 1141 A 1 .
ATOM 1008 O OE1  . GLU Axp A    60  ? 32.403 16.541  -10.043 1    83.017  ? 1141 A 1 .
ATOM 1009 O OE2  . GLU Axp A    60  ? 33.642 14.75   -10.32  1    79.618  ? 1141 A 1 .
ATOM 1010 H H    . GLU Axp A    60  ? 33.335 16.867  -7.749  1    59.369  ? 1141 A 1 c
ATOM 1011 H HA   . GLU Axp A    60  ? 35.752 18.073  -7.855  1    61.817  ? 1141 A 1 c
ATOM 1012 H HB3  . GLU Axp A    60  ? 35.299 18.818  -9.991  1    68.687  ? 1141 A 1 c
ATOM 1013 H HB2  . GLU Axp A    60  ? 33.746 18.591  -9.81   1    68.738  ? 1141 A 1 c
ATOM 1014 H HG3  . GLU Axp A    60  ? 35.483 16.355  -9.749  1    74.543  ? 1141 A 1 c
ATOM 1015 H HG2  . GLU Axp A    60  ? 35.059 16.95   -11.15  1    74.543  ? 1141 A 1 c
ATOM 1016 N N    . HIS Axp A    61  ? 33.33  19.892  -6.991  1    58.905  ? 1142 A 1 .
ATOM 1017 C CA   . HIS Axp A    61  ? 32.86  21.201  -6.557  1    61.691  ? 1142 A 1 .
ATOM 1018 C C    . HIS Axp A    61  ? 33.362 21.555  -5.154  1    52.902  ? 1142 A 1 .
ATOM 1019 O O    . HIS Axp A    61  ? 33.712 22.703  -4.912  1    47.432  ? 1142 A 1 .
ATOM 1020 C CB   . HIS Axp A    61  ? 31.327 21.315  -6.673  1    68.554  ? 1142 A 1 .
ATOM 1021 C CG   . HIS Axp A    61  ? 30.82  22.135  -7.834  1    76.919  ? 1142 A 1 .
ATOM 1022 N ND1  . HIS Axp A    61  ? 30.602 23.501  -7.759  1    76.862  ? 1142 A 1 .
ATOM 1023 C CD2  . HIS Axp A    61  ? 30.475 21.775  -9.086  1    75.812  ? 1142 A 1 .
ATOM 1024 C CE1  . HIS Axp A    61  ? 30.166 23.946  -8.931  1    76.253  ? 1142 A 1 .
ATOM 1025 N NE2  . HIS Axp A    61  ? 30.078 22.914  -9.751  1    81.234  ? 1142 A 1 .
ATOM 1026 H H    . HIS Axp A    61  ? 32.782 19.175  -6.855  1    59.333  ? 1142 A 1 c
ATOM 1027 H HA   . HIS Axp A    61  ? 33.244 21.862  -7.185  1    60.57   ? 1142 A 1 c
ATOM 1028 H HB3  . HIS Axp A    61  ? 30.981 21.705  -5.84   1    68.61   ? 1142 A 1 c
ATOM 1029 H HB2  . HIS Axp A    61  ? 30.951 20.411  -6.74   1    68.558  ? 1142 A 1 c
ATOM 1030 H HD1  . HIS Axp A    61  ? 30.639 23.884  -7.028  0    54.48   ? 1142 A 1 c
ATOM 1031 H HD2  . HIS Axp A    61  ? 30.51  20.913  -9.451  1    77.208  ? 1142 A 1 c
ATOM 1032 H HE1  . HIS Axp A    61  ? 29.945 24.839  -9.137  1    77.494  ? 1142 A 1 c
ATOM 1033 H HE2  . HIS Axp A    61  ? 29.81  22.878  -10.609 0    56.34   ? 1142 A 1 c
ATOM 1034 N N    . TYR Axp A    62  ? 33.4   20.593  -4.221  1    51.669  ? 1143 A 1 .
ATOM 1035 C CA   . TYR Axp A    62  ? 33.495 20.942  -2.808  1    50.255  ? 1143 A 1 .
ATOM 1036 C C    . TYR Axp A    62  ? 34.533 20.124  -2.043  1    45.937  ? 1143 A 1 .
ATOM 1037 O O    . TYR Axp A    62  ? 35.264 20.683  -1.226  1    47.918  ? 1143 A 1 .
ATOM 1038 C CB   . TYR Axp A    62  ? 32.111 20.769  -2.178  1    49.959  ? 1143 A 1 .
ATOM 1039 C CG   . TYR Axp A    62  ? 31.043 21.741  -2.663  1    49.127  ? 1143 A 1 .
ATOM 1040 C CD1  . TYR Axp A    62  ? 31.344 23.073  -2.92   1    51.154  ? 1143 A 1 .
ATOM 1041 C CD2  . TYR Axp A    62  ? 29.731 21.327  -2.848  1    48.357  ? 1143 A 1 .
ATOM 1042 C CE1  . TYR Axp A    62  ? 30.374 23.965  -3.343  1    52.749  ? 1143 A 1 .
ATOM 1043 C CE2  . TYR Axp A    62  ? 28.747 22.207  -3.27   1    50.782  ? 1143 A 1 .
ATOM 1044 C CZ   . TYR Axp A    62  ? 29.072 23.533  -3.513  1    52.495  ? 1143 A 1 .
ATOM 1045 O OH   . TYR Axp A    62  ? 28.159 24.46   -3.921  1    52.115  ? 1143 A 1 .
ATOM 1046 H H    . TYR Axp A    62  ? 33.353 19.714  -4.466  1    51.523  ? 1143 A 1 c
ATOM 1047 H HA   . TYR Axp A    62  ? 33.752 21.897  -2.739  1    49.654  ? 1143 A 1 c
ATOM 1048 H HB3  . TYR Axp A    62  ? 32.202 20.864  -1.204  1    49.764  ? 1143 A 1 c
ATOM 1049 H HB2  . TYR Axp A    62  ? 31.805 19.852  -2.356  1    49.802  ? 1143 A 1 c
ATOM 1050 H HD1  . TYR Axp A    62  ? 32.226 23.383  -2.795  1    50.999  ? 1143 A 1 c
ATOM 1051 H HD2  . TYR Axp A    62  ? 29.503 20.43   -2.673  1    49.497  ? 1143 A 1 c
ATOM 1052 H HE1  . TYR Axp A    62  ? 30.597 24.865  -3.505  1    52.257  ? 1143 A 1 c
ATOM 1053 H HE2  . TYR Axp A    62  ? 27.861 21.909  -3.385  1    50.606  ? 1143 A 1 c
ATOM 1054 H HH   . TYR Axp A    62  ? 28.457 25.202  -3.979  0    41.66   ? 1143 A 1 c
ATOM 1055 N N    . LEU Axp A    63  ? 34.572 18.81   -2.284  1    41.975  ? 1144 A 1 .
ATOM 1056 C CA   . LEU Axp A    63  ? 35.321 17.892  -1.438  1    41.29   ? 1144 A 1 .
ATOM 1057 C C    . LEU Axp A    63  ? 36.744 18.388  -1.204  1    43.116  ? 1144 A 1 .
ATOM 1058 O O    . LEU Axp A    63  ? 37.282 18.171  -0.126  1    41.036  ? 1144 A 1 .
ATOM 1059 C CB   . LEU Axp A    63  ? 35.342 16.485  -2.03   1    38.316  ? 1144 A 1 .
ATOM 1060 C CG   . LEU Axp A    63  ? 36.097 15.435  -1.214  1    35.165  ? 1144 A 1 .
ATOM 1061 C CD1  . LEU Axp A    63  ? 35.556 15.384  0.188   1    34.852  ? 1144 A 1 .
ATOM 1062 C CD2  . LEU Axp A    63  ? 35.996 14.078  -1.859  1    34.873  ? 1144 A 1 .
ATOM 1063 H H    . LEU Axp A    63  ? 34.111 18.47   -2.995  1    42.876  ? 1144 A 1 c
ATOM 1064 H HA   . LEU Axp A    63  ? 34.873 17.86   -0.561  1    41.183  ? 1144 A 1 c
ATOM 1065 H HB3  . LEU Axp A    63  ? 35.748 16.534  -2.926  1    38.222  ? 1144 A 1 c
ATOM 1066 H HB2  . LEU Axp A    63  ? 34.41  16.183  -2.138  1    38.222  ? 1144 A 1 c
ATOM 1067 H HG   . LEU Axp A    63  ? 37.054 15.693  -1.175  1    35.665  ? 1144 A 1 c
ATOM 1068 H HD11 . LEU Axp A    63  ? 35.928 16.115  0.708   1    35.009  ? 1144 A 1 c
ATOM 1069 H HD12 . LEU Axp A    63  ? 35.801 14.538  0.601   1    34.963  ? 1144 A 1 c
ATOM 1070 H HD13 . LEU Axp A    63  ? 34.588 15.463  0.166   1    34.978  ? 1144 A 1 c
ATOM 1071 H HD21 . LEU Axp A    63  ? 36.264 14.141  -2.792  1    34.96   ? 1144 A 1 c
ATOM 1072 H HD22 . LEU Axp A    63  ? 35.079 13.761  -1.807  1    34.96   ? 1144 A 1 c
ATOM 1073 H HD23 . LEU Axp A    63  ? 36.581 13.454  -1.397  1    34.96   ? 1144 A 1 c
ATOM 1074 N N    . GLU Axp A    64  ? 37.358 19.019  -2.212  1    45.744  ? 1145 A 1 .
ATOM 1075 C CA   . GLU Axp A    64  ? 38.731 19.463  -2.07   1    47.281  ? 1145 A 1 .
ATOM 1076 C C    . GLU Axp A    64  ? 38.771 20.616  -1.08   1    45.269  ? 1145 A 1 .
ATOM 1077 O O    . GLU Axp A    64  ? 39.265 20.462  0.028   1    50.284  ? 1145 A 1 .
ATOM 1078 C CB   . GLU Axp A    64  ? 39.358 19.863  -3.399  1    51.621  ? 1145 A 1 .
ATOM 1079 C CG   . GLU Axp A    64  ? 40.715 20.543  -3.244  1    54.699  ? 1145 A 1 .
ATOM 1080 C CD   . GLU Axp A    64  ? 41.397 20.66   -4.592  1    61.471  ? 1145 A 1 .
ATOM 1081 O OE1  . GLU Axp A    64  ? 40.678 20.839  -5.604  1    60.973  ? 1145 A 1 .
ATOM 1082 O OE2  . GLU Axp A    64  ? 42.645 20.578  -4.625  1    66.769  ? 1145 A 1 .
ATOM 1083 H H    . GLU Axp A    64  ? 36.923 19.16   -3.004  1    45.428  ? 1145 A 1 c
ATOM 1084 H HA   . GLU Axp A    64  ? 39.261 18.713  -1.697  1    47.321  ? 1145 A 1 c
ATOM 1085 H HB3  . GLU Axp A    64  ? 38.746 20.47   -3.867  1    51.282  ? 1145 A 1 c
ATOM 1086 H HB2  . GLU Axp A    64  ? 39.464 19.063  -3.953  1    51.385  ? 1145 A 1 c
ATOM 1087 H HG3  . GLU Axp A    64  ? 41.281 20.017  -2.639  1    55.441  ? 1145 A 1 c
ATOM 1088 H HG2  . GLU Axp A    64  ? 40.596 21.44   -2.866  1    55.396  ? 1145 A 1 c
ATOM 1089 N N    . GLU Axp A    65  ? 38.202 21.755  -1.466  1    43.838  ? 1146 A 1 .
ATOM 1090 C CA   . GLU Axp A    65  ? 38.23  22.942  -0.626  1    43.089  ? 1146 A 1 .
ATOM 1091 C C    . GLU Axp A    65  ? 37.9   22.567  0.817   1    37.315  ? 1146 A 1 .
ATOM 1092 O O    . GLU Axp A    65  ? 38.477 23.119  1.749   1    33.773  ? 1146 A 1 .
ATOM 1093 C CB   . GLU Axp A    65  ? 37.244 23.997  -1.137  1    46.997  ? 1146 A 1 .
ATOM 1094 C CG   . GLU Axp A    65  ? 37.655 25.432  -0.803  1    49.192  ? 1146 A 1 .
ATOM 1095 C CD   . GLU Axp A    65  ? 36.778 26.516  -1.413  1    50.413  ? 1146 A 1 .
ATOM 1096 O OE1  . GLU Axp A    65  ? 36.393 26.344  -2.596  1    53.848  ? 1146 A 1 .
ATOM 1097 O OE2  . GLU Axp A    65  ? 36.503 27.533  -0.725  1    47.618  ? 1146 A 1 .
ATOM 1098 H H    . GLU Axp A    65  ? 37.776 21.795  -2.273  1    44.16   ? 1146 A 1 c
ATOM 1099 H HA   . GLU Axp A    65  ? 39.145 23.32   -0.653  1    42.847  ? 1146 A 1 c
ATOM 1100 H HB3  . GLU Axp A    65  ? 36.361 23.82   -0.751  1    46.5    ? 1146 A 1 c
ATOM 1101 H HB2  . GLU Axp A    65  ? 37.167 23.911  -2.11   1    46.55   ? 1146 A 1 c
ATOM 1102 H HG3  . GLU Axp A    65  ? 38.577 25.576  -1.106  1    48.899  ? 1146 A 1 c
ATOM 1103 H HG2  . GLU Axp A    65  ? 37.649 25.544  0.172   1    48.853  ? 1146 A 1 c
ATOM 1104 N N    . PHE Axp A    66  ? 36.966 21.627  0.988   1    35.165  ? 1147 A 1 .
ATOM 1105 C CA   . PHE Axp A    66  ? 36.539 21.187  2.306   1    31.756  ? 1147 A 1 .
ATOM 1106 C C    . PHE Axp A    66  ? 37.686 20.522  3.041   1    28.392  ? 1147 A 1 .
ATOM 1107 O O    . PHE Axp A    66  ? 37.971 20.884  4.161   1    29.07   ? 1147 A 1 .
ATOM 1108 C CB   . PHE Axp A    66  ? 35.378 20.197  2.246   1    30.891  ? 1147 A 1 .
ATOM 1109 C CG   . PHE Axp A    66  ? 35.01  19.602  3.59    1    29.126  ? 1147 A 1 .
ATOM 1110 C CD1  . PHE Axp A    66  ? 35.632 18.453  4.043   1    30.766  ? 1147 A 1 .
ATOM 1111 C CD2  . PHE Axp A    66  ? 34.043 20.187  4.392   1    29.31   ? 1147 A 1 .
ATOM 1112 C CE1  . PHE Axp A    66  ? 35.293 17.904  5.27    1    32.057  ? 1147 A 1 .
ATOM 1113 C CE2  . PHE Axp A    66  ? 33.706 19.635  5.617   1    30.193  ? 1147 A 1 .
ATOM 1114 C CZ   . PHE Axp A    66  ? 34.336 18.501  6.06    1    30.539  ? 1147 A 1 .
ATOM 1115 H H    . PHE Axp A    66  ? 36.561 21.26   0.255   1    34.987  ? 1147 A 1 c
ATOM 1116 H HA   . PHE Axp A    66  ? 36.248 21.984  2.824   1    31.558  ? 1147 A 1 c
ATOM 1117 H HB3  . PHE Axp A    66  ? 35.619 19.469  1.631   1    30.67   ? 1147 A 1 c
ATOM 1118 H HB2  . PHE Axp A    66  ? 34.593 20.658  1.875   1    30.67   ? 1147 A 1 c
ATOM 1119 H HD1  . PHE Axp A    66  ? 36.292 18.039  3.51    1    30.634  ? 1147 A 1 c
ATOM 1120 H HD2  . PHE Axp A    66  ? 33.607 20.969  4.097   1    29.607  ? 1147 A 1 c
ATOM 1121 H HE1  . PHE Axp A    66  ? 35.729 17.123  5.568   1    31.323  ? 1147 A 1 c
ATOM 1122 H HE2  . PHE Axp A    66  ? 33.049 20.048  6.154   1    30.081  ? 1147 A 1 c
ATOM 1123 H HZ   . PHE Axp A    66  ? 34.108 18.125  6.893   1    30.807  ? 1147 A 1 c
ATOM 1124 N N    . LEU Axp A    67  ? 38.313 19.53   2.425   1    27.824  ? 1148 A 1 .
ATOM 1125 C CA   . LEU Axp A    67  ? 39.439 18.862  3.049   1    27.988  ? 1148 A 1 .
ATOM 1126 C C    . LEU Axp A    67  ? 40.549 19.87   3.315   1    27.877  ? 1148 A 1 .
ATOM 1127 O O    . LEU Axp A    67  ? 40.874 20.133  4.464   1    29.913  ? 1148 A 1 .
ATOM 1128 C CB   . LEU Axp A    67  ? 39.919 17.726  2.159   1    28.116  ? 1148 A 1 .
ATOM 1129 C CG   . LEU Axp A    67  ? 38.887 16.624  1.937   1    28.724  ? 1148 A 1 .
ATOM 1130 C CD1  . LEU Axp A    67  ? 39.362 15.745  0.798   1    29.208  ? 1148 A 1 .
ATOM 1131 C CD2  . LEU Axp A    67  ? 38.634 15.853  3.231   1    29.08   ? 1148 A 1 .
ATOM 1132 H H    . LEU Axp A    67  ? 38.042 19.267  1.593   1    28.082  ? 1148 A 1 c
ATOM 1133 H HA   . LEU Axp A    67  ? 39.138 18.491  3.917   1    27.989  ? 1148 A 1 c
ATOM 1134 H HB3  . LEU Axp A    67  ? 40.721 17.328  2.569   1    28.227  ? 1148 A 1 c
ATOM 1135 H HB2  . LEU Axp A    67  ? 40.17  18.101  1.284   1    28.22   ? 1148 A 1 c
ATOM 1136 H HG   . LEU Axp A    67  ? 38.033 17.044  1.665   1    28.83   ? 1148 A 1 c
ATOM 1137 H HD11 . LEU Axp A    67  ? 39.365 16.256  -0.028  1    29.064  ? 1148 A 1 c
ATOM 1138 H HD12 . LEU Axp A    67  ? 38.765 14.983  0.705   1    29.064  ? 1148 A 1 c
ATOM 1139 H HD13 . LEU Axp A    67  ? 40.262 15.429  0.986   1    29.064  ? 1148 A 1 c
ATOM 1140 H HD21 . LEU Axp A    67  ? 38.103 16.398  3.837   1    28.983  ? 1148 A 1 c
ATOM 1141 H HD22 . LEU Axp A    67  ? 39.482 15.635  3.652   1    28.985  ? 1148 A 1 c
ATOM 1142 H HD23 . LEU Axp A    67  ? 38.153 15.033  3.032   1    29.042  ? 1148 A 1 c
ATOM 1143 N N    . THR Axp A    68  ? 41.106 20.46   2.261   1    27.126  ? 1149 A 1 .
ATOM 1144 C CA   . THR Axp A    68  ? 42.113 21.491  2.425   1    28.248  ? 1149 A 1 .
ATOM 1145 C C    . THR Axp A    68  ? 41.848 22.296  3.696   1    29.258  ? 1149 A 1 .
ATOM 1146 O O    . THR Axp A    68  ? 42.712 22.394  4.565   1    34.804  ? 1149 A 1 .
ATOM 1147 C CB   . THR Axp A    68  ? 42.116 22.409  1.213   1    29.328  ? 1149 A 1 .
ATOM 1148 O OG1  . THR Axp A    68  ? 41.946 21.608  0.044   1    30.827  ? 1149 A 1 .
ATOM 1149 C CG2  . THR Axp A    68  ? 43.403 23.204  1.17    1    31.036  ? 1149 A 1 .
ATOM 1150 H H    . THR Axp A    68  ? 40.849 20.222  1.417   1    27.577  ? 1149 A 1 c
ATOM 1151 H HA   . THR Axp A    68  ? 42.991 21.059  2.498   1    28.428  ? 1149 A 1 c
ATOM 1152 H HB   . THR Axp A    68  ? 41.361 23.042  1.278   1    29.708  ? 1149 A 1 c
ATOM 1153 H HG1  . THR Axp A    68  ? 42.524 21.215  -0.116  0    24.4    ? 1149 A 1 c
ATOM 1154 H HG21 . THR Axp A    68  ? 43.466 23.672  0.321   1    30.514  ? 1149 A 1 c
ATOM 1155 H HG22 . THR Axp A    68  ? 44.16  22.602  1.264   1    30.502  ? 1149 A 1 c
ATOM 1156 H HG23 . THR Axp A    68  ? 43.412 23.85   1.896   1    30.51   ? 1149 A 1 c
ATOM 1157 N N    . SER Axp A    69  ? 40.641 22.854  3.8     1    28.666  ? 1150 A 1 .
ATOM 1158 C CA   . SER Axp A    69  ? 40.264 23.732  4.898   1    28.531  ? 1150 A 1 .
ATOM 1159 C C    . SER Axp A    69  ? 40.206 22.979  6.227   1    27.293  ? 1150 A 1 .
ATOM 1160 O O    . SER Axp A    69  ? 40.626 23.485  7.261   1    27.076  ? 1150 A 1 .
ATOM 1161 C CB   . SER Axp A    69  ? 38.95  24.452  4.592   1    29.751  ? 1150 A 1 .
ATOM 1162 O OG   . SER Axp A    69  ? 37.858 23.563  4.403   1    28.644  ? 1150 A 1 .
ATOM 1163 H H    . SER Axp A    69  ? 40.019 22.68   3.153   1    28.773  ? 1150 A 1 c
ATOM 1164 H HA   . SER Axp A    69  ? 40.971 24.422  4.979   1    28.575  ? 1150 A 1 c
ATOM 1165 H HB3  . SER Axp A    69  ? 39.066 24.988  3.784   1    29.235  ? 1150 A 1 c
ATOM 1166 H HB2  . SER Axp A    69  ? 38.748 25.061  5.319   1    29.352  ? 1150 A 1 c
ATOM 1167 H HG   . SER Axp A    69  ? 37.158 23.969  4.265   0    21.24   ? 1150 A 1 c
ATOM 1168 N N    . ALA Axp A    70  ? 39.644 21.777  6.212   1    28.204  ? 1151 A 1 .
ATOM 1169 C CA   . ALA Axp A    70  ? 39.654 20.935  7.396   1    28.919  ? 1151 A 1 .
ATOM 1170 C C    . ALA Axp A    70  ? 41.104 20.646  7.771   1    27.404  ? 1151 A 1 .
ATOM 1171 O O    . ALA Axp A    70  ? 41.527 20.824  8.907   1    26.79   ? 1151 A 1 .
ATOM 1172 C CB   . ALA Axp A    70  ? 38.878 19.654  7.134   1    29.847  ? 1151 A 1 .
ATOM 1173 H H    . ALA Axp A    70  ? 39.24  21.471  5.451   1    28.17   ? 1151 A 1 c
ATOM 1174 H HA   . ALA Axp A    70  ? 39.228 21.434  8.145   1    28.653  ? 1151 A 1 c
ATOM 1175 H HB3  . ALA Axp A    70  ? 38.679 19.215  7.978   1    29.573  ? 1151 A 1 c
ATOM 1176 H HB2  . ALA Axp A    70  ? 39.407 19.057  6.579   1    29.557  ? 1151 A 1 c
ATOM 1177 H HB1  . ALA Axp A    70  ? 38.045 19.863  6.679   1    29.557  ? 1151 A 1 c
ATOM 1178 N N    . ASN Axp A    71  ? 41.883 20.239  6.783   1    26.687  ? 1152 A 1 .
ATOM 1179 C CA   . ASN Axp A    71  ? 43.254 19.874  7.05    1    27.506  ? 1152 A 1 .
ATOM 1180 C C    . ASN Axp A    71  ? 43.944 20.996  7.805   1    27.584  ? 1152 A 1 .
ATOM 1181 O O    . ASN Axp A    71  ? 44.717 20.728  8.713   1    27.61   ? 1152 A 1 .
ATOM 1182 C CB   . ASN Axp A    71  ? 43.991 19.54   5.768   1    27.922  ? 1152 A 1 .
ATOM 1183 C CG   . ASN Axp A    71  ? 45.477 19.519  5.991   1    27.846  ? 1152 A 1 .
ATOM 1184 O OD1  . ASN Axp A    71  ? 45.979 18.755  6.822   1    25.117  ? 1152 A 1 .
ATOM 1185 N ND2  . ASN Axp A    71  ? 46.178 20.372  5.263   1    30.171  ? 1152 A 1 .
ATOM 1186 H H    . ASN Axp A    71  ? 41.559 20.178  5.931   1    27.105  ? 1152 A 1 c
ATOM 1187 H HA   . ASN Axp A    71  ? 43.255 19.068  7.614   1    27.436  ? 1152 A 1 c
ATOM 1188 H HB3  . ASN Axp A    71  ? 43.775 20.204  5.085   1    27.866  ? 1152 A 1 c
ATOM 1189 H HB2  . ASN Axp A    71  ? 43.7   18.664  5.445   1    27.82   ? 1152 A 1 c
ATOM 1190 H HD21 . ASN Axp A    71  ? 46.764 20.91   5.654   1    29.432  ? 1152 A 1 c
ATOM 1191 H HD22 . ASN Axp A    71  ? 46.062 20.404  4.384   1    29.423  ? 1152 A 1 c
ATOM 1192 N N    . LYS Axp A    72  ? 43.632 22.238  7.425   1    29.354  ? 1153 A 1 .
ATOM 1193 C CA   . LYS Axp A    72  ? 44.26  23.425  7.984   1    31.028  ? 1153 A 1 .
ATOM 1194 C C    . LYS Axp A    72  ? 43.687 23.835  9.343   1    28.535  ? 1153 A 1 .
ATOM 1195 O O    . LYS Axp A    72  ? 44.407 24.41   10.15   1    26.087  ? 1153 A 1 .
ATOM 1196 C CB   . LYS Axp A    72  ? 44.147 24.582  6.983   1    34.424  ? 1153 A 1 .
ATOM 1197 C CG   . LYS Axp A    72  ? 44.576 25.945  7.526   1    39.577  ? 1153 A 1 .
ATOM 1198 C CD   . LYS Axp A    72  ? 45.055 26.941  6.471   1    43.561  ? 1153 A 1 .
ATOM 1199 C CE   . LYS Axp A    72  ? 45.796 28.1    7.068   1    47.474  ? 1153 A 1 .
ATOM 1200 N NZ   . LYS Axp A    72  ? 46.067 29.102  6.036   1    51.691  ? 1153 A 1 .
ATOM 1201 H H    . LYS Axp A    72  ? 43.005 22.351  6.77    1    29.305  ? 1153 A 1 c
ATOM 1202 H HA   . LYS Axp A    72  ? 45.224 23.23   8.106   1    30.773  ? 1153 A 1 c
ATOM 1203 H HB3  . LYS Axp A    72  ? 43.215 24.649  6.683   1    34.682  ? 1153 A 1 c
ATOM 1204 H HB2  . LYS Axp A    72  ? 44.697 24.373  6.198   1    34.757  ? 1153 A 1 c
ATOM 1205 H HG3  . LYS Axp A    72  ? 45.302 25.804  8.173   1    39.041  ? 1153 A 1 c
ATOM 1206 H HG2  . LYS Axp A    72  ? 43.823 26.336  8.012   1    38.983  ? 1153 A 1 c
ATOM 1207 H HD3  . LYS Axp A    72  ? 44.279 27.278  5.974   1    43.513  ? 1153 A 1 c
ATOM 1208 H HD2  . LYS Axp A    72  ? 45.644 26.478  5.836   1    43.427  ? 1153 A 1 c
ATOM 1209 H HE3  . LYS Axp A    72  ? 46.639 27.794  7.449   1    47.5    ? 1153 A 1 c
ATOM 1210 H HE2  . LYS Axp A    72  ? 45.264 28.504  7.777   1    47.5    ? 1153 A 1 c
ATOM 1211 H HZ1  . LYS Axp A    72  ? 45.286 29.42   5.705   1    50.295  ? 1153 A 1 c
ATOM 1212 H HZ2  . LYS Axp A    72  ? 46.546 28.728  5.364   1    50.301  ? 1153 A 1 c
ATOM 1213 H HZ3  . LYS Axp A    72  ? 46.54  29.787  6.392   1    50.333  ? 1153 A 1 c
ATOM 1214 N N    . HIS Axp A    73  ? 42.407 23.55   9.603   1    29.628  ? 1154 A 1 .
ATOM 1215 C CA   . HIS Axp A    73  ? 41.701 24.183  10.712  1    30.584  ? 1154 A 1 .
ATOM 1216 C C    . HIS Axp A    73  ? 41.05  23.231  11.723  1    29.922  ? 1154 A 1 .
ATOM 1217 O O    . HIS Axp A    73  ? 40.806 23.624  12.871  1    27.771  ? 1154 A 1 .
ATOM 1218 C CB   . HIS Axp A    73  ? 40.59  25.065  10.158  1    30.745  ? 1154 A 1 .
ATOM 1219 C CG   . HIS Axp A    73  ? 41.105 26.188  9.354   1    30.358  ? 1154 A 1 .
ATOM 1220 N ND1  . HIS Axp A    73  ? 41.84  27.183  9.944   1    31.217  ? 1154 A 1 .
ATOM 1221 C CD2  . HIS Axp A    73  ? 41.015 26.491  8.064   1    31.073  ? 1154 A 1 .
ATOM 1222 C CE1  . HIS Axp A    73  ? 42.169 28.067  9.021   1    32.841  ? 1154 A 1 .
ATOM 1223 N NE2  . HIS Axp A    73  ? 41.672 27.67   7.87    1    32.612  ? 1154 A 1 .
ATOM 1224 H H    . HIS Axp A    73  ? 41.955 22.964  9.067   1    29.574  ? 1154 A 1 c
ATOM 1225 H HA   . HIS Axp A    73  ? 42.337 24.758  11.201  1    30.345  ? 1154 A 1 c
ATOM 1226 H HB3  . HIS Axp A    73  ? 40.065 25.417  10.905  1    30.664  ? 1154 A 1 c
ATOM 1227 H HB2  . HIS Axp A    73  ? 40.002 24.514  9.6     1    30.628  ? 1154 A 1 c
ATOM 1228 H HD1  . HIS Axp A    73  ? 42.073 27.262  10.767  0    21.97   ? 1154 A 1 c
ATOM 1229 H HD2  . HIS Axp A    73  ? 40.565 26.004  7.402   1    31.225  ? 1154 A 1 c
ATOM 1230 H HE1  . HIS Axp A    73  ? 42.676 28.848  9.164   1    32.38   ? 1154 A 1 c
ATOM 1231 H HE2  . HIS Axp A    73  ? 41.779 28.121  7.069   0    23.19   ? 1154 A 1 c
ATOM 1232 N N    . PHE Axp A    74  ? 40.739 22      11.3    1    29.8    ? 1155 A 1 .
ATOM 1233 C CA   . PHE Axp A    74  ? 39.975 21.088  12.136  1    30.664  ? 1155 A 1 .
ATOM 1234 C C    . PHE Axp A    74  ? 40.9   20.448  13.167  1    30.866  ? 1155 A 1 .
ATOM 1235 O O    . PHE Axp A    74  ? 41.862 19.789  12.788  1    28.848  ? 1155 A 1 .
ATOM 1236 C CB   . PHE Axp A    74  ? 39.275 20.024  11.287  1    30.082  ? 1155 A 1 .
ATOM 1237 C CG   . PHE Axp A    74  ? 38.417 19.068  12.095  1    28.16   ? 1155 A 1 .
ATOM 1238 C CD1  . PHE Axp A    74  ? 37.173 19.458  12.572  1    27.97   ? 1155 A 1 .
ATOM 1239 C CD2  . PHE Axp A    74  ? 38.861 17.788  12.373  1    27.363  ? 1155 A 1 .
ATOM 1240 C CE1  . PHE Axp A    74  ? 36.389 18.586  13.303  1    28.235  ? 1155 A 1 .
ATOM 1241 C CE2  . PHE Axp A    74  ? 38.075 16.92   13.109  1    28.27   ? 1155 A 1 .
ATOM 1242 C CZ   . PHE Axp A    74  ? 36.843 17.319  13.575  1    28.305  ? 1155 A 1 .
ATOM 1243 H H    . PHE Axp A    74  ? 41.008 21.719  10.474  1    30.005  ? 1155 A 1 c
ATOM 1244 H HA   . PHE Axp A    74  ? 39.279 21.61   12.614  1    30.417  ? 1155 A 1 c
ATOM 1245 H HB3  . PHE Axp A    74  ? 39.958 19.51   10.803  1    29.734  ? 1155 A 1 c
ATOM 1246 H HB2  . PHE Axp A    74  ? 38.709 20.477  10.622  1    29.756  ? 1155 A 1 c
ATOM 1247 H HD1  . PHE Axp A    74  ? 36.857 20.328  12.387  1    28.086  ? 1155 A 1 c
ATOM 1248 H HD2  . PHE Axp A    74  ? 39.705 17.507  12.058  1    27.783  ? 1155 A 1 c
ATOM 1249 H HE1  . PHE Axp A    74  ? 35.545 18.865  13.622  1    28.19   ? 1155 A 1 c
ATOM 1250 H HE2  . PHE Axp A    74  ? 38.387 16.048  13.293  1    28.067  ? 1155 A 1 c
ATOM 1251 H HZ   . PHE Axp A    74  ? 36.31  16.723  14.075  1    28.265  ? 1155 A 1 c
ATOM 1252 N N    . MET Axp A    75  ? 40.59  20.678  14.454  1    31.921  ? 1156 A 1 .
ATOM 1253 C CA   . MET Axp A    75  ? 41.28  20.098  15.6    1    30.593  ? 1156 A 1 .
ATOM 1254 C C    . MET Axp A    75  ? 42.799 20.17   15.447  1    29.196  ? 1156 A 1 .
ATOM 1255 O O    . MET Axp A    75  ? 43.5   19.193  15.688  1    26.098  ? 1156 A 1 .
ATOM 1256 C CB   . MET Axp A    75  ? 40.868 18.637  15.823  1    30.463  ? 1156 A 1 .
ATOM 1257 C CG   . MET Axp A    75  ? 39.386 18.418  15.882  1    30.491  ? 1156 A 1 .
ATOM 1258 S SD   . MET Axp A    75  ? 38.698 19.152  17.371  1    32.171  ? 1156 A 1 .
ATOM 1259 C CE   . MET Axp A    75  ? 36.96  19.008  16.925  1    33.503  ? 1156 A 1 .
ATOM 1260 H H    . MET Axp A    75  ? 39.892 21.243  14.627  1    31.348  ? 1156 A 1 c
ATOM 1261 H HA   . MET Axp A    75  ? 41.033 20.627  16.399  1    30.565  ? 1156 A 1 c
ATOM 1262 H HB3  . MET Axp A    75  ? 41.268 18.325  16.663  1    30.455  ? 1156 A 1 c
ATOM 1263 H HB2  . MET Axp A    75  ? 41.238 18.095  15.097  1    30.401  ? 1156 A 1 c
ATOM 1264 H HG3  . MET Axp A    75  ? 39.194 17.46   15.879  1    30.752  ? 1156 A 1 c
ATOM 1265 H HG2  . MET Axp A    75  ? 38.959 18.818  15.1    1    30.782  ? 1156 A 1 c
ATOM 1266 H HE3  . MET Axp A    75  ? 36.773 18.097  16.636  1    33.067  ? 1156 A 1 c
ATOM 1267 H HE2  . MET Axp A    75  ? 36.759 19.628  16.2    1    33.1    ? 1156 A 1 c
ATOM 1268 H HE1  . MET Axp A    75  ? 36.411 19.224  17.699  1    32.934  ? 1156 A 1 c
ATOM 1269 N N    . VAL Axp A    76  ? 43.323 21.356  15.143  1    31.193  ? 1157 A 1 .
ATOM 1270 C CA   . VAL Axp A    76  ? 44.755 21.491  14.918  1    31.836  ? 1157 A 1 .
ATOM 1271 C C    . VAL Axp A    76  ? 45.514 20.993  16.145  1    31.218  ? 1157 A 1 .
ATOM 1272 O O    . VAL Axp A    76  ? 45.116 21.251  17.283  1    29.469  ? 1157 A 1 .
ATOM 1273 C CB   . VAL Axp A    76  ? 45.108 22.946  14.588  1    33.207  ? 1157 A 1 .
ATOM 1274 C CG1  . VAL Axp A    76  ? 46.566 23.115  14.208  1    33.477  ? 1157 A 1 .
ATOM 1275 C CG2  . VAL Axp A    76  ? 44.212 23.465  13.482  1    35.207  ? 1157 A 1 .
ATOM 1276 H H    . VAL Axp A    76  ? 42.786 22.094  15.095  1    30.922  ? 1157 A 1 c
ATOM 1277 H HA   . VAL Axp A    76  ? 44.996 20.934  14.153  1    31.841  ? 1157 A 1 c
ATOM 1278 H HB   . VAL Axp A    76  ? 44.937 23.481  15.398  1    33.36   ? 1157 A 1 c
ATOM 1279 H HG11 . VAL Axp A    76  ? 46.794 22.483  13.506  1    33.399  ? 1157 A 1 c
ATOM 1280 H HG12 . VAL Axp A    76  ? 47.126 22.95   14.985  1    33.391  ? 1157 A 1 c
ATOM 1281 H HG13 . VAL Axp A    76  ? 46.717 24.021  13.89   1    33.415  ? 1157 A 1 c
ATOM 1282 H HG21 . VAL Axp A    76  ? 44.666 24.173  12.997  1    34.748  ? 1157 A 1 c
ATOM 1283 H HG22 . VAL Axp A    76  ? 43.39  23.812  13.865  1    34.706  ? 1157 A 1 c
ATOM 1284 H HG23 . VAL Axp A    76  ? 44     22.74   12.869  1    34.617  ? 1157 A 1 c
ATOM 1285 N N    . GLY Axp A    77  ? 46.593 20.247  15.877  1    31.901  ? 1158 A 1 .
ATOM 1286 C CA   . GLY Axp A    77  ? 47.46  19.719  16.916  1    32.055  ? 1158 A 1 .
ATOM 1287 C C    . GLY Axp A    77  ? 46.845 18.535  17.664  1    31.389  ? 1158 A 1 .
ATOM 1288 O O    . GLY Axp A    77  ? 47.195 18.29   18.819  1    32.015  ? 1158 A 1 .
ATOM 1289 H H    . GLY Axp A    77  ? 46.797 20.06   15.005  1    31.773  ? 1158 A 1 c
ATOM 1290 H HA3  . GLY Axp A    77  ? 47.656 20.44   17.559  1    31.877  ? 1158 A 1 c
ATOM 1291 H HA2  . GLY Axp A    77  ? 48.312 19.446  16.511  1    31.991  ? 1158 A 1 c
ATOM 1292 N N    . HIS Axp A    78  ? 45.935 17.804  17.008  1    29.491  ? 1159 A 1 .
ATOM 1293 C CA   . HIS Axp A    78  ? 45.545 16.49   17.486  1    27.29   ? 1159 A 1 .
ATOM 1294 C C    . HIS Axp A    78  ? 45.433 15.535  16.315  1    25.787  ? 1159 A 1 .
ATOM 1295 O O    . HIS Axp A    78  ? 45.167 15.916  15.189  1    23.83   ? 1159 A 1 .
ATOM 1296 C CB   . HIS Axp A    78  ? 44.214 16.532  18.225  1    26.716  ? 1159 A 1 .
ATOM 1297 C CG   . HIS Axp A    78  ? 44.254 17.489  19.348  1    25.861  ? 1159 A 1 .
ATOM 1298 N ND1  . HIS Axp A    78  ? 44.633 17.104  20.61   1    24.983  ? 1159 A 1 .
ATOM 1299 C CD2  . HIS Axp A    78  ? 44.019 18.8    19.396  1    25.43   ? 1159 A 1 .
ATOM 1300 C CE1  . HIS Axp A    78  ? 44.593 18.162  21.399  1    25.144  ? 1159 A 1 .
ATOM 1301 N NE2  . HIS Axp A    78  ? 44.228 19.203  20.682  1    25.263  ? 1159 A 1 .
ATOM 1302 H H    . HIS Axp A    78  ? 45.55  18.129  16.246  1    29.432  ? 1159 A 1 c
ATOM 1303 H HA   . HIS Axp A    78  ? 46.246 16.16   18.096  1    27.391  ? 1159 A 1 c
ATOM 1304 H HB3  . HIS Axp A    78  ? 44.01  15.636  18.569  1    26.639  ? 1159 A 1 c
ATOM 1305 H HB2  . HIS Axp A    78  ? 43.507 16.799  17.597  1    26.636  ? 1159 A 1 c
ATOM 1306 H HD1  . HIS Axp A    78  ? 44.907 16.29   20.815  0    17.72   ? 1159 A 1 c
ATOM 1307 H HD2  . HIS Axp A    78  ? 43.748 19.349  18.687  1    25.493  ? 1159 A 1 c
ATOM 1308 H HE1  . HIS Axp A    78  ? 44.799 18.168  22.317  1    25.209  ? 1159 A 1 c
ATOM 1309 H HE2  . HIS Axp A    78  ? 44.059 20.001  20.936  0    17.76   ? 1159 A 1 c
ATOM 1310 N N    . PRO Axp A    79  ? 45.646 14.24   16.537  1    27.217  ? 1160 A 1 .
ATOM 1311 C CA   . PRO Axp A    79  ? 45.408 13.296  15.479  1    27.9    ? 1160 A 1 .
ATOM 1312 C C    . PRO Axp A    79  ? 43.968 13.43   15.021  1    28.704  ? 1160 A 1 .
ATOM 1313 O O    . PRO Axp A    79  ? 43.044 13.452  15.827  1    29.485  ? 1160 A 1 .
ATOM 1314 C CB   . PRO Axp A    79  ? 45.733 11.959  16.102  1    28.81   ? 1160 A 1 .
ATOM 1315 C CG   . PRO Axp A    79  ? 46.641 12.334  17.255  1    30.858  ? 1160 A 1 .
ATOM 1316 C CD   . PRO Axp A    79  ? 46.085 13.612  17.783  1    30.302  ? 1160 A 1 .
ATOM 1317 H HA   . PRO Axp A    79  ? 46.018 13.475  14.735  1    28.122  ? 1160 A 1 c
ATOM 1318 H HB3  . PRO Axp A    79  ? 46.194 11.378  15.465  1    29.049  ? 1160 A 1 c
ATOM 1319 H HB2  . PRO Axp A    79  ? 44.925 11.515  16.42   1    29.052  ? 1160 A 1 c
ATOM 1320 H HG3  . PRO Axp A    79  ? 47.561 12.459  16.948  1    30.258  ? 1160 A 1 c
ATOM 1321 H HG2  . PRO Axp A    79  ? 46.629 11.642  17.946  1    30.258  ? 1160 A 1 c
ATOM 1322 H HD3  . PRO Axp A    79  ? 45.337 13.463  18.386  1    29.667  ? 1160 A 1 c
ATOM 1323 H HD2  . PRO Axp A    79  ? 46.771 14.145  18.229  1    29.644  ? 1160 A 1 c
ATOM 1324 N N    . VAL Axp A    80  ? 43.831 13.581  13.713  1    27.662  ? 1161 A 1 .
ATOM 1325 C CA   . VAL Axp A    80  ? 42.553 13.659  13.063  1    25.879  ? 1161 A 1 .
ATOM 1326 C C    . VAL Axp A    80  ? 42.536 12.627  11.951  1    25.73   ? 1161 A 1 .
ATOM 1327 O O    . VAL Axp A    80  ? 43.575 12.362  11.357  1    25.09   ? 1161 A 1 .
ATOM 1328 C CB   . VAL Axp A    80  ? 42.47  15.106  12.566  1    25.901  ? 1161 A 1 .
ATOM 1329 C CG1  . VAL Axp A    80  ? 41.552 15.249  11.368  1    26.913  ? 1161 A 1 .
ATOM 1330 C CG2  . VAL Axp A    80  ? 42.039 16.018  13.697  1    26.083  ? 1161 A 1 .
ATOM 1331 H H    . VAL Axp A    80  ? 44.583 13.635  13.195  1    27.469  ? 1161 A 1 c
ATOM 1332 H HA   . VAL Axp A    80  ? 41.845 13.482  13.701  1    26.247  ? 1161 A 1 c
ATOM 1333 H HB   . VAL Axp A    80  ? 43.376 15.374  12.286  1    26.136  ? 1161 A 1 c
ATOM 1334 H HG11 . VAL Axp A    80  ? 40.718 14.778  11.538  1    26.604  ? 1161 A 1 c
ATOM 1335 H HG12 . VAL Axp A    80  ? 41.981 14.873  10.581  1    26.604  ? 1161 A 1 c
ATOM 1336 H HG13 . VAL Axp A    80  ? 41.365 16.189  11.214  1    26.609  ? 1161 A 1 c
ATOM 1337 H HG21 . VAL Axp A    80  ? 41.969 16.929  13.367  1    26.115  ? 1161 A 1 c
ATOM 1338 H HG22 . VAL Axp A    80  ? 42.694 15.982  14.412  1    26.056  ? 1161 A 1 c
ATOM 1339 H HG23 . VAL Axp A    80  ? 41.174 15.73   14.035  1    26.052  ? 1161 A 1 c
ATOM 1340 N N    . ILE Axp A    81  ? 41.363 12.048  11.692  1    26.483  ? 1162 A 1 .
ATOM 1341 C CA   . ILE Axp A    81  ? 41.234 11.093  10.612  1    27.622  ? 1162 A 1 .
ATOM 1342 C C    . ILE Axp A    81  ? 40.058 11.474  9.73    1    29.921  ? 1162 A 1 .
ATOM 1343 O O    . ILE Axp A    81  ? 38.911 11.319  10.134  1    31.834  ? 1162 A 1 .
ATOM 1344 C CB   . ILE Axp A    81  ? 41.058 9.673   11.148  1    28.527  ? 1162 A 1 .
ATOM 1345 C CG1  . ILE Axp A    81  ? 42.302 9.203   11.869  1    31.182  ? 1162 A 1 .
ATOM 1346 C CG2  . ILE Axp A    81  ? 40.667 8.728   10.017  1    28.831  ? 1162 A 1 .
ATOM 1347 C CD1  . ILE Axp A    81  ? 42.166 7.822   12.491  1    32.939  ? 1162 A 1 .
ATOM 1348 H H    . ILE Axp A    81  ? 40.631 12.251  12.2    1    26.548  ? 1162 A 1 c
ATOM 1349 H HA   . ILE Axp A    81  ? 42.046 11.118  10.078  1    28.057  ? 1162 A 1 c
ATOM 1350 H HB   . ILE Axp A    81  ? 40.325 9.687   11.796  1    28.893  ? 1162 A 1 c
ATOM 1351 H HG12 . ILE Axp A    81  ? 42.52  9.845   12.575  1    30.888  ? 1162 A 1 c
ATOM 1352 H HG13 . ILE Axp A    81  ? 43.047 9.191   11.235  1    30.943  ? 1162 A 1 c
ATOM 1353 H HG21 . ILE Axp A    81  ? 40.78  7.807   10.305  1    28.799  ? 1162 A 1 c
ATOM 1354 H HG22 . ILE Axp A    81  ? 41.232 8.894   9.244   1    28.754  ? 1162 A 1 c
ATOM 1355 H HG23 . ILE Axp A    81  ? 39.738 8.873   9.773   1    28.754  ? 1162 A 1 c
ATOM 1356 H HD11 . ILE Axp A    81  ? 41.231 7.654   12.717  1    32.381  ? 1162 A 1 c
ATOM 1357 H HD12 . ILE Axp A    81  ? 42.708 7.775   13.301  1    32.399  ? 1162 A 1 c
ATOM 1358 H HD13 . ILE Axp A    81  ? 42.472 7.147   11.857  1    32.38   ? 1162 A 1 c
ATOM 1359 N N    . PHE Axp A    82  ? 40.351 11.88   8.491   1    30.722  ? 1163 A 1 .
ATOM 1360 C CA   . PHE Axp A    82  ? 39.291 12.207  7.554   1    29.235  ? 1163 A 1 .
ATOM 1361 C C    . PHE Axp A    82  ? 38.661 10.95   6.973   1    28.936  ? 1163 A 1 .
ATOM 1362 O O    . PHE Axp A    82  ? 39.272 10.207  6.207   1    27.848  ? 1163 A 1 .
ATOM 1363 C CB   . PHE Axp A    82  ? 39.838 13.086  6.444   1    28.138  ? 1163 A 1 .
ATOM 1364 C CG   . PHE Axp A    82  ? 40.308 14.39   7.039   1    27.715  ? 1163 A 1 .
ATOM 1365 C CD1  . PHE Axp A    82  ? 39.408 15.246  7.652   1    30.886  ? 1163 A 1 .
ATOM 1366 C CD2  . PHE Axp A    82  ? 41.637 14.734  7.018   1    27.536  ? 1163 A 1 .
ATOM 1367 C CE1  . PHE Axp A    82  ? 39.826 16.451  8.193   1    31.482  ? 1163 A 1 .
ATOM 1368 C CE2  . PHE Axp A    82  ? 42.05  15.94   7.552   1    29.349  ? 1163 A 1 .
ATOM 1369 C CZ   . PHE Axp A    82  ? 41.15  16.799  8.137   1    29.659  ? 1163 A 1 .
ATOM 1370 H H    . PHE Axp A    82  ? 41.222 11.951  8.224   1    30.125  ? 1163 A 1 c
ATOM 1371 H HA   . PHE Axp A    82  ? 38.59  12.716  8.04    1    29.278  ? 1163 A 1 c
ATOM 1372 H HB3  . PHE Axp A    82  ? 39.129 13.259  5.786   1    28.301  ? 1163 A 1 c
ATOM 1373 H HB2  . PHE Axp A    82  ? 40.59  12.629  6.007   1    28.346  ? 1163 A 1 c
ATOM 1374 H HD1  . PHE Axp A    82  ? 38.495 15.015  7.674   1    30.15   ? 1163 A 1 c
ATOM 1375 H HD2  . PHE Axp A    82  ? 42.262 14.163  6.603   1    28.267  ? 1163 A 1 c
ATOM 1376 H HE1  . PHE Axp A    82  ? 39.2   17.031  8.596   1    30.839  ? 1163 A 1 c
ATOM 1377 H HE2  . PHE Axp A    82  ? 42.962 16.172  7.52    1    29.233  ? 1163 A 1 c
ATOM 1378 H HZ   . PHE Axp A    82  ? 41.446 17.611  8.518   1    29.981  ? 1163 A 1 c
ATOM 1379 N N    . TYR Axp A    83  ? 37.397 10.748  7.329   1    29.365  ? 1164 A 1 .
ATOM 1380 C CA   . TYR Axp A    83  ? 36.622 9.674   6.745   1    28.71   ? 1164 A 1 .
ATOM 1381 C C    . TYR Axp A    83  ? 35.908 10.223  5.537   1    29.099  ? 1164 A 1 .
ATOM 1382 O O    . TYR Axp A    83  ? 34.918 10.939  5.682   1    30.571  ? 1164 A 1 .
ATOM 1383 C CB   . TYR Axp A    83  ? 35.618 9.127   7.744   1    26.82   ? 1164 A 1 .
ATOM 1384 C CG   . TYR Axp A    83  ? 36.361 8.567   8.935   1    24.774  ? 1164 A 1 .
ATOM 1385 C CD1  . TYR Axp A    83  ? 36.96  7.327   8.869   1    23.059  ? 1164 A 1 .
ATOM 1386 C CD2  . TYR Axp A    83  ? 36.481 9.302   10.092  1    25.076  ? 1164 A 1 .
ATOM 1387 C CE1  . TYR Axp A    83  ? 37.636 6.813   9.948   1    23.111  ? 1164 A 1 .
ATOM 1388 C CE2  . TYR Axp A    83  ? 37.141 8.793   11.188  1    24.833  ? 1164 A 1 .
ATOM 1389 C CZ   . TYR Axp A    83  ? 37.712 7.545   11.11   1    24.318  ? 1164 A 1 .
ATOM 1390 O OH   . TYR Axp A    83  ? 38.347 7.052   12.2    1    27.333  ? 1164 A 1 .
ATOM 1391 H H    . TYR Axp A    83  ? 37.005 11.289  7.954   1    29.1    ? 1164 A 1 c
ATOM 1392 H HA   . TYR Axp A    83  ? 37.232 8.941   6.465   1    28.569  ? 1164 A 1 c
ATOM 1393 H HB3  . TYR Axp A    83  ? 35.089 8.417   7.319   1    26.763  ? 1164 A 1 c
ATOM 1394 H HB2  . TYR Axp A    83  ? 35.024 9.85    8.039   1    26.813  ? 1164 A 1 c
ATOM 1395 H HD1  . TYR Axp A    83  ? 36.894 6.819   8.076   1    23.507  ? 1164 A 1 c
ATOM 1396 H HD2  . TYR Axp A    83  ? 36.067 10.147  10.151  1    24.98   ? 1164 A 1 c
ATOM 1397 H HE1  . TYR Axp A    83  ? 38.021 5.956   9.901   1    23.508  ? 1164 A 1 c
ATOM 1398 H HE2  . TYR Axp A    83  ? 37.195 9.289   11.984  1    24.791  ? 1164 A 1 c
ATOM 1399 H HH   . TYR Axp A    83  ? 38.638 6.249   12.011  0    17.24   ? 1164 A 1 c
ATOM 1400 N N    . ILE Axp A    84  ? 36.466 9.907   4.375   1    29.929  ? 1165 A 1 .
ATOM 1401 C CA   . ILE Axp A    84  ? 35.937 10.448  3.149   1    33.518  ? 1165 A 1 .
ATOM 1402 C C    . ILE Axp A    84  ? 35.154 9.358   2.452   1    34.06   ? 1165 A 1 .
ATOM 1403 O O    . ILE Axp A    84  ? 35.74  8.363   2.055   1    35.014  ? 1165 A 1 .
ATOM 1404 C CB   . ILE Axp A    84  ? 37.063 10.966  2.259   1    37.361  ? 1165 A 1 .
ATOM 1405 C CG1  . ILE Axp A    84  ? 37.845 12.068  2.966   1    39.691  ? 1165 A 1 .
ATOM 1406 C CG2  . ILE Axp A    84  ? 36.484 11.419  0.922   1    37.982  ? 1165 A 1 .
ATOM 1407 C CD1  . ILE Axp A    84  ? 39.303 12.128  2.559   1    42.106  ? 1165 A 1 .
ATOM 1408 H H    . ILE Axp A    84  ? 37.188 9.347   4.343   1    30.471  ? 1165 A 1 c
ATOM 1409 H HA   . ILE Axp A    84  ? 35.339 11.19   3.359   1    33.541  ? 1165 A 1 c
ATOM 1410 H HB   . ILE Axp A    84  ? 37.676 10.224  2.088   1    37.181  ? 1165 A 1 c
ATOM 1411 H HG12 . ILE Axp A    84  ? 37.794 11.928  3.933   1    39.554  ? 1165 A 1 c
ATOM 1412 H HG13 . ILE Axp A    84  ? 37.425 12.929  2.765   1    39.549  ? 1165 A 1 c
ATOM 1413 H HG21 . ILE Axp A    84  ? 37.039 12.125  0.549   1    37.808  ? 1165 A 1 c
ATOM 1414 H HG22 . ILE Axp A    84  ? 35.581 11.756  1.051   1    37.732  ? 1165 A 1 c
ATOM 1415 H HG23 . ILE Axp A    84  ? 36.463 10.668  0.305   1    37.809  ? 1165 A 1 c
ATOM 1416 H HD11 . ILE Axp A    84  ? 39.689 11.233  2.586   1    41.377  ? 1165 A 1 c
ATOM 1417 H HD12 . ILE Axp A    84  ? 39.789 12.709  3.174   1    41.377  ? 1165 A 1 c
ATOM 1418 H HD13 . ILE Axp A    84  ? 39.374 12.484  1.653   1    41.377  ? 1165 A 1 c
ATOM 1419 N N    . MET Axp A    85  ? 33.853 9.594   2.287   1    34.933  ? 1166 A 1 .
ATOM 1420 C CA   . MET Axp A    85  ? 32.99  8.66    1.6     1    35.08   ? 1166 A 1 .
ATOM 1421 C C    . MET Axp A    85  ? 32.584 9.231   0.251   1    35.15   ? 1166 A 1 .
ATOM 1422 O O    . MET Axp A    85  ? 31.896 10.243  0.195   1    35.064  ? 1166 A 1 .
ATOM 1423 C CB   . MET Axp A    85  ? 31.724 8.411   2.407   1    36.933  ? 1166 A 1 .
ATOM 1424 C CG   . MET Axp A    85  ? 31.778 7.154   3.251   1    39.626  ? 1166 A 1 .
ATOM 1425 S SD   . MET Axp A    85  ? 32.937 7.196   4.624   1    40.419  ? 1166 A 1 .
ATOM 1426 C CE   . MET Axp A    85  ? 32.581 8.879   5.146   1    47.557  ? 1166 A 1 .
ATOM 1427 H H    . MET Axp A    85  ? 33.495 10.374  2.6     1    34.837  ? 1166 A 1 c
ATOM 1428 H HA   . MET Axp A    85  ? 33.476 7.808   1.465   1    35.435  ? 1166 A 1 c
ATOM 1429 H HB3  . MET Axp A    85  ? 30.971 8.334   1.784   1    37.214  ? 1166 A 1 c
ATOM 1430 H HB2  . MET Axp A    85  ? 31.554 9.186   2.981   1    37.293  ? 1166 A 1 c
ATOM 1431 H HG3  . MET Axp A    85  ? 32.013 6.4     2.675   1    39.079  ? 1166 A 1 c
ATOM 1432 H HG2  . MET Axp A    85  ? 30.887 6.978   3.61    1    39.152  ? 1166 A 1 c
ATOM 1433 H HE3  . MET Axp A    85  ? 31.621 9.04    5.098   1    45.428  ? 1166 A 1 c
ATOM 1434 H HE2  . MET Axp A    85  ? 33.056 9.508   4.574   1    45.216  ? 1166 A 1 c
ATOM 1435 H HE1  . MET Axp A    85  ? 32.878 9       6.067   1    45.525  ? 1166 A 1 c
ATOM 1436 N N    . VAL Axp A    86  ? 32.978 8.551   -0.829  1    35.844  ? 1167 A 1 .
ATOM 1437 C CA   . VAL Axp A    86  ? 32.693 9.044   -2.162  1    38.734  ? 1167 A 1 .
ATOM 1438 C C    . VAL Axp A    86  ? 32.187 7.913   -3.038  1    40.331  ? 1167 A 1 .
ATOM 1439 O O    . VAL Axp A    86  ? 32.448 6.744   -2.783  1    38.56   ? 1167 A 1 .
ATOM 1440 C CB   . VAL Axp A    86  ? 33.925 9.671   -2.822  1    42.165  ? 1167 A 1 .
ATOM 1441 C CG1  . VAL Axp A    86  ? 34.429 10.864  -2.023  1    44.95   ? 1167 A 1 .
ATOM 1442 C CG2  . VAL Axp A    86  ? 35.016 8.631   -3.048  1    41.652  ? 1167 A 1 .
ATOM 1443 H H    . VAL Axp A    86  ? 33.426 7.761   -0.732  1    36.356  ? 1167 A 1 c
ATOM 1444 H HA   . VAL Axp A    86  ? 31.995 9.72    -2.1    1    39.075  ? 1167 A 1 c
ATOM 1445 H HB   . VAL Axp A    86  ? 33.642 10.003  -3.706  1    41.904  ? 1167 A 1 c
ATOM 1446 H HG11 . VAL Axp A    86  ? 34.736 10.566  -1.152  1    43.93   ? 1167 A 1 c
ATOM 1447 H HG12 . VAL Axp A    86  ? 33.709 11.507  -1.91   1    44.064  ? 1167 A 1 c
ATOM 1448 H HG13 . VAL Axp A    86  ? 35.166 11.285  -2.498  1    44.052  ? 1167 A 1 c
ATOM 1449 H HG21 . VAL Axp A    86  ? 35.882 9.072   -3.08   1    41.809  ? 1167 A 1 c
ATOM 1450 H HG22 . VAL Axp A    86  ? 34.858 8.172   -3.89   1    41.778  ? 1167 A 1 c
ATOM 1451 H HG23 . VAL Axp A    86  ? 35.011 7.986   -2.322  1    41.702  ? 1167 A 1 c
ATOM 1452 N N    . ASP Axp A    87  ? 31.515 8.311   -4.116  1    43.109  ? 1168 A 1 .
ATOM 1453 C CA   . ASP Axp A    87  ? 30.873 7.373   -5.006  1    45.52   ? 1168 A 1 .
ATOM 1454 C C    . ASP Axp A    87  ? 31.885 6.887   -6.036  1    47.925  ? 1168 A 1 .
ATOM 1455 O O    . ASP Axp A    87  ? 31.736 5.794   -6.556  1    51.159  ? 1168 A 1 .
ATOM 1456 C CB   . ASP Axp A    87  ? 29.638 8.001   -5.626  1    48.329  ? 1168 A 1 .
ATOM 1457 C CG   . ASP Axp A    87  ? 29.868 8.833   -6.878  1    50.038  ? 1168 A 1 .
ATOM 1458 O OD1  . ASP Axp A    87  ? 30.601 9.847   -6.804  1    43.678  ? 1168 A 1 .
ATOM 1459 O OD2  . ASP Axp A    87  ? 29.289 8.456   -7.917  1    58.076  ? 1168 A 1 .
ATOM 1460 H H    . ASP Axp A    87  ? 31.454 9.205   -4.3    1    42.991  ? 1168 A 1 c
ATOM 1461 H HA   . ASP Axp A    87  ? 30.573 6.601   -4.477  1    45.978  ? 1168 A 1 c
ATOM 1462 H HB3  . ASP Axp A    87  ? 29.21  8.574   -4.956  1    48.139  ? 1168 A 1 c
ATOM 1463 H HB2  . ASP Axp A    87  ? 29.009 7.283   -5.848  1    48.313  ? 1168 A 1 c
ATOM 1464 N N    . ASP Axp A    88  ? 32.895 7.706   -6.342  1    51.648  ? 1169 A 1 .
ATOM 1465 C CA   . ASP Axp A    88  ? 33.91  7.346   -7.321  1    55.89   ? 1169 A 1 .
ATOM 1466 C C    . ASP Axp A    88  ? 35.27  7.867   -6.863  1    55.774  ? 1169 A 1 .
ATOM 1467 O O    . ASP Axp A    88  ? 35.555 9.063   -7.001  1    53.812  ? 1169 A 1 .
ATOM 1468 C CB   . ASP Axp A    88  ? 33.58  7.905   -8.697  1    60.583  ? 1169 A 1 .
ATOM 1469 C CG   . ASP Axp A    88  ? 34.569 7.54    -9.796  1    66.906  ? 1169 A 1 .
ATOM 1470 O OD1  . ASP Axp A    88  ? 34.437 6.436   -10.36  1    74.292  ? 1169 A 1 .
ATOM 1471 O OD2  . ASP Axp A    88  ? 35.485 8.345   -10.059 1    67.844  ? 1169 A 1 .
ATOM 1472 H H    . ASP Axp A    88  ? 32.951 8.522   -5.936  1    51.482  ? 1169 A 1 c
ATOM 1473 H HA   . ASP Axp A    88  ? 33.951 6.365   -7.386  1    55.734  ? 1169 A 1 c
ATOM 1474 H HB3  . ASP Axp A    88  ? 33.531 8.882   -8.64   1    60.81   ? 1169 A 1 c
ATOM 1475 H HB2  . ASP Axp A    88  ? 32.696 7.576   -8.963  1    60.841  ? 1169 A 1 c
ATOM 1476 N N    . VAL Axp A    89  ? 36.123 6.95    -6.378  1    53.834  ? 1170 A 1 .
ATOM 1477 C CA   . VAL Axp A    89  ? 37.331 7.347   -5.666  1    49.704  ? 1170 A 1 .
ATOM 1478 C C    . VAL Axp A    89  ? 38.314 7.984   -6.658  1    49.293  ? 1170 A 1 .
ATOM 1479 O O    . VAL Axp A    89  ? 39.151 8.781   -6.261  1    53.726  ? 1170 A 1 .
ATOM 1480 C CB   . VAL Axp A    89  ? 37.989 6.235   -4.817  1    46.964  ? 1170 A 1 .
ATOM 1481 C CG1  . VAL Axp A    89  ? 36.961 5.264   -4.236  1    43.749  ? 1170 A 1 .
ATOM 1482 C CG2  . VAL Axp A    89  ? 39.075 5.475   -5.574  1    51.225  ? 1170 A 1 .
ATOM 1483 H H    . VAL Axp A    89  ? 35.956 6.061   -6.509  1    53.223  ? 1170 A 1 c
ATOM 1484 H HA   . VAL Axp A    89  ? 37.066 8.052   -5.043  1    49.925  ? 1170 A 1 c
ATOM 1485 H HB   . VAL Axp A    89  ? 38.427 6.682   -4.056  1    47.601  ? 1170 A 1 c
ATOM 1486 H HG11 . VAL Axp A    89  ? 36.743 4.587   -4.897  1    44.779  ? 1170 A 1 c
ATOM 1487 H HG12 . VAL Axp A    89  ? 36.156 5.751   -3.992  1    44.764  ? 1170 A 1 c
ATOM 1488 H HG13 . VAL Axp A    89  ? 37.331 4.836   -3.445  1    44.709  ? 1170 A 1 c
ATOM 1489 H HG21 . VAL Axp A    89  ? 39.27  4.642   -5.112  1    49.892  ? 1170 A 1 c
ATOM 1490 H HG22 . VAL Axp A    89  ? 39.882 6.015   -5.617  1    49.92   ? 1170 A 1 c
ATOM 1491 H HG23 . VAL Axp A    89  ? 38.768 5.278   -6.476  1    49.92   ? 1170 A 1 c
ATOM 1492 N N    . SER Axp A    90  ? 38.192 7.693   -7.956  1    50.072  ? 1171 A 1 .
ATOM 1493 C CA   . SER Axp A    90  ? 38.995 8.386   -8.955  1    56.085  ? 1171 A 1 .
ATOM 1494 C C    . SER Axp A    90  ? 38.929 9.913   -8.778  1    57.772  ? 1171 A 1 .
ATOM 1495 O O    . SER Axp A    90  ? 39.959 10.585  -8.75   1    53.073  ? 1171 A 1 .
ATOM 1496 C CB   . SER Axp A    90  ? 38.594 7.937   -10.358 1    61.984  ? 1171 A 1 .
ATOM 1497 O OG   . SER Axp A    90  ? 38.841 8.922   -11.357 1    66.752  ? 1171 A 1 .
ATOM 1498 H H    . SER Axp A    90  ? 37.614 7.039   -8.225  1    51.352  ? 1171 A 1 c
ATOM 1499 H HA   . SER Axp A    90  ? 39.937 8.114   -8.813  1    56.184  ? 1171 A 1 c
ATOM 1500 H HB3  . SER Axp A    90  ? 37.648 7.71    -10.362 1    61.57   ? 1171 A 1 c
ATOM 1501 H HB2  . SER Axp A    90  ? 39.09  7.127   -10.583 1    61.663  ? 1171 A 1 c
ATOM 1502 H HG   . SER Axp A    90  ? 38.613 8.564   -12.158 0    50.27   ? 1171 A 1 c
ATOM 1503 N N    . ARG Axp A    91  ? 37.721 10.479  -8.652  1    63.242  ? 1172 A 1 .
ATOM 1504 C CA   . ARG Axp A    91  ? 37.561 11.929  -8.679  1    69.307  ? 1172 A 1 .
ATOM 1505 C C    . ARG Axp A    91  ? 38.08  12.531  -7.372  1    65.95   ? 1172 A 1 .
ATOM 1506 O O    . ARG Axp A    91  ? 38.444 13.708  -7.309  1    61.859  ? 1172 A 1 .
ATOM 1507 C CB   . ARG Axp A    91  ? 36.111 12.345  -8.985  1    76.706  ? 1172 A 1 .
ATOM 1508 C CG   . ARG Axp A    91  ? 35.787 12.682  -10.439 1    79.288  ? 1172 A 1 .
ATOM 1509 C CD   . ARG Axp A    91  ? 35.432 11.472  -11.304 1    87.378  ? 1172 A 1 .
ATOM 1510 N NE   . ARG Axp A    91  ? 34.066 10.951  -11.133 1    93.678  ? 1172 A 1 .
ATOM 1511 C CZ   . ARG Axp A    91  ? 33.527 9.957   -11.847 1    96.55   ? 1172 A 1 .
ATOM 1512 N NH1  . ARG Axp A    91  ? 34.247 9.334   -12.764 1    100.981 ? 1172 A 1 .
ATOM 1513 N NH2  . ARG Axp A    91  ? 32.275 9.577   -11.647 1    92.151  ? 1172 A 1 .
ATOM 1514 H H    . ARG Axp A    91  ? 36.982 9.952   -8.546  1    63.208  ? 1172 A 1 c
ATOM 1515 H HA   . ARG Axp A    91  ? 38.125 12.279  -9.415  1    68.699  ? 1172 A 1 c
ATOM 1516 H HB3  . ARG Axp A    91  ? 35.897 13.128  -8.436  1    75.093  ? 1172 A 1 c
ATOM 1517 H HB2  . ARG Axp A    91  ? 35.517 11.619  -8.699  1    75.274  ? 1172 A 1 c
ATOM 1518 H HG3  . ARG Axp A    91  ? 36.558 13.139  -10.84  1    80.362  ? 1172 A 1 c
ATOM 1519 H HG2  . ARG Axp A    91  ? 35.037 13.308  -10.458 1    80.43   ? 1172 A 1 c
ATOM 1520 H HD3  . ARG Axp A    91  ? 36.069 10.756  -11.103 1    86.784  ? 1172 A 1 c
ATOM 1521 H HD2  . ARG Axp A    91  ? 35.559 11.719  -12.242 1    86.872  ? 1172 A 1 c
ATOM 1522 H HE   . ARG Axp A    91  ? 33.567 11.318  -10.519 1    92.845  ? 1172 A 1 c
ATOM 1523 H HH11 . ARG Axp A    91  ? 34.961 8.873   -12.522 1    99.596  ? 1172 A 1 c
ATOM 1524 H HH12 . ARG Axp A    91  ? 34.01  9.381   -13.614 1    99.596  ? 1172 A 1 c
ATOM 1525 H HH21 . ARG Axp A    91  ? 31.659 10.181  -11.454 1    93.482  ? 1172 A 1 c
ATOM 1526 H HH22 . ARG Axp A    91  ? 32.061 8.722   -11.708 1    93.482  ? 1172 A 1 c
ATOM 1527 N N    . MET Axp A    92  ? 38.072 11.699  -6.328  1    64.194  ? 1173 A 1 .
ATOM 1528 C CA   . MET Axp A    92  ? 38.59  12.02   -5.008  1    58.09   ? 1173 A 1 .
ATOM 1529 C C    . MET Axp A    92  ? 39.987 12.625  -5.138  1    56.227  ? 1173 A 1 .
ATOM 1530 O O    . MET Axp A    92  ? 40.913 11.929  -5.556  1    60.604  ? 1173 A 1 .
ATOM 1531 C CB   . MET Axp A    92  ? 38.551 10.733  -4.174  1    57.943  ? 1173 A 1 .
ATOM 1532 C CG   . MET Axp A    92  ? 39.609 10.574  -3.135  1    59.724  ? 1173 A 1 .
ATOM 1533 S SD   . MET Axp A    92  ? 39.291 11.727  -1.796  1    69.795  ? 1173 A 1 .
ATOM 1534 C CE   . MET Axp A    92  ? 40.914 11.554  -1.032  1    78.337  ? 1173 A 1 .
ATOM 1535 H H    . MET Axp A    92  ? 37.691 10.877  -6.444  1    63.078  ? 1173 A 1 c
ATOM 1536 H HA   . MET Axp A    92  ? 37.988 12.689  -4.599  1    58.76   ? 1173 A 1 c
ATOM 1537 H HB3  . MET Axp A    92  ? 38.605 9.971   -4.782  1    58.38   ? 1173 A 1 c
ATOM 1538 H HB2  . MET Axp A    92  ? 37.676 10.687  -3.732  1    58.436  ? 1173 A 1 c
ATOM 1539 H HG3  . MET Axp A    92  ? 40.49  10.746  -3.514  1    61.034  ? 1173 A 1 c
ATOM 1540 H HG2  . MET Axp A    92  ? 39.596 9.661   -2.784  1    61.059  ? 1173 A 1 c
ATOM 1541 H HE3  . MET Axp A    92  ? 41.595 11.909  -1.632  1    75.951  ? 1173 A 1 c
ATOM 1542 H HE2  . MET Axp A    92  ? 41.093 10.611  -0.859  1    75.541  ? 1173 A 1 c
ATOM 1543 H HE1  . MET Axp A    92  ? 40.932 12.047  -0.191  1    75.969  ? 1173 A 1 c
ATOM 1544 N N    . PRO Axp A    93  ? 40.177 13.928  -4.802  1    55.179  ? 1174 A 1 .
ATOM 1545 C CA   . PRO Axp A    93  ? 41.473 14.589  -4.909  1    57.631  ? 1174 A 1 .
ATOM 1546 C C    . PRO Axp A    93  ? 42.367 14.301  -3.71   1    64.837  ? 1174 A 1 .
ATOM 1547 O O    . PRO Axp A    93  ? 41.945 14.437  -2.56   1    71.709  ? 1174 A 1 .
ATOM 1548 C CB   . PRO Axp A    93  ? 41.101 16.057  -4.997  1    55.803  ? 1174 A 1 .
ATOM 1549 C CG   . PRO Axp A    93  ? 39.906 16.115  -4.061  1    54.303  ? 1174 A 1 .
ATOM 1550 C CD   . PRO Axp A    93  ? 39.151 14.834  -4.268  1    54.845  ? 1174 A 1 .
ATOM 1551 H HA   . PRO Axp A    93  ? 41.92  14.308  -5.735  1    58.172  ? 1174 A 1 c
ATOM 1552 H HB3  . PRO Axp A    93  ? 40.852 16.306  -5.908  1    55.876  ? 1174 A 1 c
ATOM 1553 H HB2  . PRO Axp A    93  ? 41.829 16.628  -4.682  1    55.913  ? 1174 A 1 c
ATOM 1554 H HG3  . PRO Axp A    93  ? 39.339 16.88   -4.276  1    54.76   ? 1174 A 1 c
ATOM 1555 H HG2  . PRO Axp A    93  ? 40.197 16.194  -3.131  1    54.882  ? 1174 A 1 c
ATOM 1556 H HD3  . PRO Axp A    93  ? 38.791 14.494  -3.425  1    54.838  ? 1174 A 1 c
ATOM 1557 H HD2  . PRO Axp A    93  ? 38.422 14.95   -4.908  1    54.865  ? 1174 A 1 c
ATOM 1558 N N    . LEU Axp A    94  ? 43.587 13.842  -3.989  1    68.323  ? 1175 A 1 .
ATOM 1559 C CA   . LEU Axp A    94  ? 44.478 13.389  -2.934  1    70.779  ? 1175 A 1 .
ATOM 1560 C C    . LEU Axp A    94  ? 45.358 14.575  -2.566  1    70.248  ? 1175 A 1 .
ATOM 1561 O O    . LEU Axp A    94  ? 46.518 14.638  -2.952  1    73.877  ? 1175 A 1 .
ATOM 1562 C CB   . LEU Axp A    94  ? 45.309 12.18   -3.375  1    73.779  ? 1175 A 1 .
ATOM 1563 C CG   . LEU Axp A    94  ? 44.576 10.842  -3.548  1    78.943  ? 1175 A 1 .
ATOM 1564 C CD1  . LEU Axp A    94  ? 43.896 10.658  -4.916  1    78.473  ? 1175 A 1 .
ATOM 1565 C CD2  . LEU Axp A    94  ? 45.541 9.69    -3.281  1    77.268  ? 1175 A 1 .
ATOM 1566 H H    . LEU Axp A    94  ? 43.877 13.815  -4.855  1    67.92   ? 1175 A 1 c
ATOM 1567 H HA   . LEU Axp A    94  ? 43.934 13.138  -2.145  1    70.678  ? 1175 A 1 c
ATOM 1568 H HB3  . LEU Axp A    94  ? 46.03  12.052  -2.716  1    74.207  ? 1175 A 1 c
ATOM 1569 H HB2  . LEU Axp A    94  ? 45.742 12.405  -4.23   1    74.211  ? 1175 A 1 c
ATOM 1570 H HG   . LEU Axp A    94  ? 43.865 10.797  -2.858  1    77.565  ? 1175 A 1 c
ATOM 1571 H HD11 . LEU Axp A    94  ? 43.769 11.525  -5.335  1    78.408  ? 1175 A 1 c
ATOM 1572 H HD12 . LEU Axp A    94  ? 43.032 10.23   -4.794  1    78.435  ? 1175 A 1 c
ATOM 1573 H HD13 . LEU Axp A    94  ? 44.454 10.103  -5.486  1    78.524  ? 1175 A 1 c
ATOM 1574 H HD21 . LEU Axp A    94  ? 45.686 9.603   -2.324  1    77.731  ? 1175 A 1 c
ATOM 1575 H HD22 . LEU Axp A    94  ? 46.39  9.868   -3.721  1    77.713  ? 1175 A 1 c
ATOM 1576 H HD23 . LEU Axp A    94  ? 45.166 8.863   -3.627  1    77.666  ? 1175 A 1 c
ATOM 1577 N N    . ILE Axp A    95  ? 44.788 15.539  -1.848  1    68.38   ? 1176 A 1 .
ATOM 1578 C CA   . ILE Axp A    95  ? 45.534 16.737  -1.502  1    64.064  ? 1176 A 1 .
ATOM 1579 C C    . ILE Axp A    95  ? 46.421 16.455  -0.305  1    57.721  ? 1176 A 1 .
ATOM 1580 O O    . ILE Axp A    95  ? 46.035 15.658  0.536   1    54.818  ? 1176 A 1 .
ATOM 1581 C CB   . ILE Axp A    95  ? 44.646 17.957  -1.211  1    67.965  ? 1176 A 1 .
ATOM 1582 C CG1  . ILE Axp A    95  ? 43.306 17.612  -0.521  1    55.968  ? 1176 A 1 .
ATOM 1583 C CG2  . ILE Axp A    95  ? 44.468 18.761  -2.497  1    78.683  ? 1176 A 1 .
ATOM 1584 C CD1  . ILE Axp A    95  ? 43.386 17.507  0.99    1    51.916  ? 1176 A 1 .
ATOM 1585 H H    . ILE Axp A    95  ? 43.928 15.44   -1.559  1    67.642  ? 1176 A 1 c
ATOM 1586 H HA   . ILE Axp A    95  ? 46.109 16.962  -2.259  1    64.445  ? 1176 A 1 c
ATOM 1587 H HB   . ILE Axp A    95  ? 45.143 18.527  -0.589  1    66.41   ? 1176 A 1 c
ATOM 1588 H HG12 . ILE Axp A    95  ? 42.969 16.767  -0.877  1    57.646  ? 1176 A 1 c
ATOM 1589 H HG13 . ILE Axp A    95  ? 42.655 18.307  -0.747  1    57.702  ? 1176 A 1 c
ATOM 1590 H HG21 . ILE Axp A    95  ? 43.86  19.502  -2.337  1    75.202  ? 1176 A 1 c
ATOM 1591 H HG22 . ILE Axp A    95  ? 44.1   18.188  -3.191  1    75.312  ? 1176 A 1 c
ATOM 1592 H HG23 . ILE Axp A    95  ? 45.328 19.107  -2.787  1    75.249  ? 1176 A 1 c
ATOM 1593 H HD11 . ILE Axp A    95  ? 44.311 17.384  1.273   1    53.268  ? 1176 A 1 c
ATOM 1594 H HD12 . ILE Axp A    95  ? 42.852 16.746  1.291   1    53.126  ? 1176 A 1 c
ATOM 1595 H HD13 . ILE Axp A    95  ? 43.033 18.326  1.389   1    53.127  ? 1176 A 1 c
ATOM 1596 N N    . GLU Axp A    96  ? 47.554 17.179  -0.241  1    56.416  ? 1177 A 1 .
ATOM 1597 C CA   . GLU Axp A    96  ? 48.578 16.995  0.778   1    56.747  ? 1177 A 1 .
ATOM 1598 C C    . GLU Axp A    96  ? 47.986 17.371  2.128   1    50.157  ? 1177 A 1 .
ATOM 1599 O O    . GLU Axp A    96  ? 47.513 18.489  2.304   1    47.03   ? 1177 A 1 .
ATOM 1600 C CB   . GLU Axp A    96  ? 49.871 17.8    0.562   1    64.769  ? 1177 A 1 .
ATOM 1601 C CG   . GLU Axp A    96  ? 51.058 16.961  0.085   1    72.084  ? 1177 A 1 .
ATOM 1602 C CD   . GLU Axp A    96  ? 51.007 16.396  -1.341  1    75.991  ? 1177 A 1 .
ATOM 1603 O OE1  . GLU Axp A    96  ? 51.465 17.127  -2.24   1    85.909  ? 1177 A 1 .
ATOM 1604 O OE2  . GLU Axp A    96  ? 50.54  15.259  -1.6    1    63.174  ? 1177 A 1 .
ATOM 1605 H H    . GLU Axp A    96  ? 47.689 17.826  -0.873  1    56.965  ? 1177 A 1 c
ATOM 1606 H HA   . GLU Axp A    96  ? 48.816 16.033  0.798   1    56.76   ? 1177 A 1 c
ATOM 1607 H HB3  . GLU Axp A    96  ? 50.118 18.236  1.405   1    64.302  ? 1177 A 1 c
ATOM 1608 H HB2  . GLU Axp A    96  ? 49.698 18.504  -0.097  1    64.335  ? 1177 A 1 c
ATOM 1609 H HG3  . GLU Axp A    96  ? 51.165 16.207  0.701   1    70.397  ? 1177 A 1 c
ATOM 1610 H HG2  . GLU Axp A    96  ? 51.871 17.505  0.163   1    71.122  ? 1177 A 1 c
ATOM 1611 N N    . LEU Axp A    97  ? 48.035 16.428  3.072   1    45.936  ? 1178 A 1 .
ATOM 1612 C CA   . LEU Axp A    97  ? 47.523 16.671  4.403   1    44.284  ? 1178 A 1 .
ATOM 1613 C C    . LEU Axp A    97  ? 48.692 17.035  5.298   1    42.264  ? 1178 A 1 .
ATOM 1614 O O    . LEU Axp A    97  ? 49.784 16.503  5.109   1    43.246  ? 1178 A 1 .
ATOM 1615 C CB   . LEU Axp A    97  ? 46.81  15.436  4.929   1    46.138  ? 1178 A 1 .
ATOM 1616 C CG   . LEU Axp A    97  ? 45.514 15.067  4.211   1    49.588  ? 1178 A 1 .
ATOM 1617 C CD1  . LEU Axp A    97  ? 45.754 14.012  3.144   1    55.231  ? 1178 A 1 .
ATOM 1618 C CD2  . LEU Axp A    97  ? 44.506 14.594  5.216   1    49.8    ? 1178 A 1 .
ATOM 1619 H H    . LEU Axp A    97  ? 48.402 15.613  2.881   1    46.715  ? 1178 A 1 c
ATOM 1620 H HA   . LEU Axp A    97  ? 46.886 17.43   4.371   1    44.596  ? 1178 A 1 c
ATOM 1621 H HB3  . LEU Axp A    97  ? 46.609 15.58   5.882   1    46.405  ? 1178 A 1 c
ATOM 1622 H HB2  . LEU Axp A    97  ? 47.43  14.673  4.866   1    46.496  ? 1178 A 1 c
ATOM 1623 H HG   . LEU Axp A    97  ? 45.157 15.882  3.77    1    49.893  ? 1178 A 1 c
ATOM 1624 H HD11 . LEU Axp A    97  ? 46.535 14.253  2.618   1    53.447  ? 1178 A 1 c
ATOM 1625 H HD12 . LEU Axp A    97  ? 44.978 13.954  2.561   1    53.555  ? 1178 A 1 c
ATOM 1626 H HD13 . LEU Axp A    97  ? 45.907 13.151  3.568   1    53.589  ? 1178 A 1 c
ATOM 1627 H HD21 . LEU Axp A    97  ? 44.231 15.34   5.775   1    49.342  ? 1178 A 1 c
ATOM 1628 H HD22 . LEU Axp A    97  ? 44.901 13.902  5.772   1    49.571  ? 1178 A 1 c
ATOM 1629 H HD23 . LEU Axp A    97  ? 43.731 14.234  4.754   1    49.473  ? 1178 A 1 c
ATOM 1630 N N    . GLY Axp A    98  ? 48.42  17.888  6.293   1    39.228  ? 1179 A 1 .
ATOM 1631 C CA   . GLY Axp A    98  ? 49.449 18.412  7.172   1    39.679  ? 1179 A 1 .
ATOM 1632 C C    . GLY Axp A    98  ? 49.861 17.4    8.237   1    39.143  ? 1179 A 1 .
ATOM 1633 O O    . GLY Axp A    98  ? 49.609 16.209  8.093   1    42.086  ? 1179 A 1 .
ATOM 1634 H H    . GLY Axp A    98  ? 47.554 18.139  6.438   1    39.998  ? 1179 A 1 c
ATOM 1635 H HA3  . GLY Axp A    98  ? 49.111 19.229  7.608   1    39.449  ? 1179 A 1 c
ATOM 1636 H HA2  . GLY Axp A    98  ? 50.237 18.661  6.633   1    39.483  ? 1179 A 1 c
ATOM 1637 N N    . PRO Axp A    99  ? 50.511 17.829  9.339   1    37.681  ? 1180 A 1 .
ATOM 1638 C CA   . PRO Axp A    99  ? 50.806 16.934  10.441  1    37.129  ? 1180 A 1 .
ATOM 1639 C C    . PRO Axp A    99  ? 49.56  16.612  11.245  1    37.912  ? 1180 A 1 .
ATOM 1640 O O    . PRO Axp A    99  ? 48.648 17.432  11.315  1    36.609  ? 1180 A 1 .
ATOM 1641 C CB   . PRO Axp A    99  ? 51.815 17.693  11.285  1    36.83   ? 1180 A 1 .
ATOM 1642 C CG   . PRO Axp A    99  ? 52.164 18.911  10.449  1    38.463  ? 1180 A 1 .
ATOM 1643 C CD   . PRO Axp A    99  ? 50.982 19.19   9.603   1    37.843  ? 1180 A 1 .
ATOM 1644 H HA   . PRO Axp A    99  ? 51.207 16.109  10.099  1    37.363  ? 1180 A 1 c
ATOM 1645 H HB3  . PRO Axp A    99  ? 52.608 17.148  11.454  1    37.261  ? 1180 A 1 c
ATOM 1646 H HB2  . PRO Axp A    99  ? 51.426 17.959  12.141  1    37.264  ? 1180 A 1 c
ATOM 1647 H HG3  . PRO Axp A    99  ? 52.947 18.731  9.89    1    37.946  ? 1180 A 1 c
ATOM 1648 H HG2  . PRO Axp A    99  ? 52.361 19.678  11.022  1    37.946  ? 1180 A 1 c
ATOM 1649 H HD3  . PRO Axp A    99  ? 50.307 19.711  10.082  1    37.947  ? 1180 A 1 c
ATOM 1650 H HD2  . PRO Axp A    99  ? 51.228 19.647  8.776   1    37.954  ? 1180 A 1 c
ATOM 1651 N N    . LEU Axp A    100 ? 49.557 15.4    11.81   1    40.148  ? 1181 A 1 .
ATOM 1652 C CA   . LEU Axp A    100 ? 48.486 14.867  12.639  1    41.475  ? 1181 A 1 .
ATOM 1653 C C    . LEU Axp A    100 ? 47.209 14.689  11.827  1    40.81   ? 1181 A 1 .
ATOM 1654 O O    . LEU Axp A    100 ? 46.152 14.457  12.406  1    45.674  ? 1181 A 1 .
ATOM 1655 C CB   . LEU Axp A    100 ? 48.23  15.746  13.859  1    42.282  ? 1181 A 1 .
ATOM 1656 C CG   . LEU Axp A    100 ? 49.454 16.033  14.728  1    42.114  ? 1181 A 1 .
ATOM 1657 C CD1  . LEU Axp A    100 ? 49.138 17.195  15.651  1    42.329  ? 1181 A 1 .
ATOM 1658 C CD2  . LEU Axp A    100 ? 49.88  14.79   15.486  1    42.052  ? 1181 A 1 .
ATOM 1659 H H    . LEU Axp A    100 ? 50.285 14.866  11.67   1    39.788  ? 1181 A 1 c
ATOM 1660 H HA   . LEU Axp A    100 ? 48.77  13.971  12.952  1    41.239  ? 1181 A 1 c
ATOM 1661 H HB3  . LEU Axp A    100 ? 47.552 15.303  14.418  1    41.835  ? 1181 A 1 c
ATOM 1662 H HB2  . LEU Axp A    100 ? 47.853 16.602  13.552  1    41.966  ? 1181 A 1 c
ATOM 1663 H HG   . LEU Axp A    100 ? 50.201 16.305  14.136  1    42.162  ? 1181 A 1 c
ATOM 1664 H HD11 . LEU Axp A    100 ? 48.851 17.958  15.122  1    42.072  ? 1181 A 1 c
ATOM 1665 H HD12 . LEU Axp A    100 ? 49.932 17.433  16.158  1    42.192  ? 1181 A 1 c
ATOM 1666 H HD13 . LEU Axp A    100 ? 48.428 16.938  16.262  1    42.079  ? 1181 A 1 c
ATOM 1667 H HD21 . LEU Axp A    100 ? 50.264 14.147  14.866  1    42.053  ? 1181 A 1 c
ATOM 1668 H HD22 . LEU Axp A    100 ? 49.108 14.395  15.924  1    42.052  ? 1181 A 1 c
ATOM 1669 H HD23 . LEU Axp A    100 ? 50.543 15.03   16.155  1    41.998  ? 1181 A 1 c
ATOM 1670 N N    . ARG Axp A    101 ? 47.304 14.783  10.499  1    38.018  ? 1182 A 1 .
ATOM 1671 C CA   . ARG Axp A    101 ? 46.162 14.48   9.656   1    38.832  ? 1182 A 1 .
ATOM 1672 C C    . ARG Axp A    101 ? 46.411 13.192  8.879   1    39.939  ? 1182 A 1 .
ATOM 1673 O O    . ARG Axp A    101 ? 47.512 12.983  8.384   1    44.482  ? 1182 A 1 .
ATOM 1674 C CB   . ARG Axp A    101 ? 45.919 15.591  8.638   1    38.462  ? 1182 A 1 .
ATOM 1675 C CG   . ARG Axp A    101 ? 45.107 16.77   9.144   1    37.506  ? 1182 A 1 .
ATOM 1676 C CD   . ARG Axp A    101 ? 45.912 17.751  9.95    1    36.758  ? 1182 A 1 .
ATOM 1677 N NE   . ARG Axp A    101 ? 45.659 17.618  11.385  1    34.108  ? 1182 A 1 .
ATOM 1678 C CZ   . ARG Axp A    101 ? 44.759 18.345  12.009  1    32.658  ? 1182 A 1 .
ATOM 1679 N NH1  . ARG Axp A    101 ? 43.934 19.114  11.321  1    31.371  ? 1182 A 1 .
ATOM 1680 N NH2  . ARG Axp A    101 ? 44.676 18.274  13.319  1    34.645  ? 1182 A 1 .
ATOM 1681 H H    . ARG Axp A    101 ? 48.093 15.02   10.106  1    38.867  ? 1182 A 1 c
ATOM 1682 H HA   . ARG Axp A    101 ? 45.359 14.37   10.225  1    38.834  ? 1182 A 1 c
ATOM 1683 H HB3  . ARG Axp A    101 ? 45.453 15.206  7.865   1    38.425  ? 1182 A 1 c
ATOM 1684 H HB2  . ARG Axp A    101 ? 46.787 15.92   8.323   1    38.332  ? 1182 A 1 c
ATOM 1685 H HG3  . ARG Axp A    101 ? 44.368 16.436  9.698   1    37.502  ? 1182 A 1 c
ATOM 1686 H HG2  . ARG Axp A    101 ? 44.713 17.239  8.378   1    37.384  ? 1182 A 1 c
ATOM 1687 H HD3  . ARG Axp A    101 ? 45.693 18.66   9.664   1    36.175  ? 1182 A 1 c
ATOM 1688 H HD2  . ARG Axp A    101 ? 46.863 17.607  9.775   1    36.288  ? 1182 A 1 c
ATOM 1689 H HE   . ARG Axp A    101 ? 46.124 17.045  11.843  1    34.384  ? 1182 A 1 c
ATOM 1690 H HH11 . ARG Axp A    101 ? 43.319 18.747  10.804  1    31.761  ? 1182 A 1 c
ATOM 1691 H HH12 . ARG Axp A    101 ? 44.002 19.994  11.382  1    31.761  ? 1182 A 1 c
ATOM 1692 H HH21 . ARG Axp A    101 ? 45.412 18.313  13.808  1    33.985  ? 1182 A 1 c
ATOM 1693 H HH22 . ARG Axp A    101 ? 43.887 18.189  13.705  1    33.866  ? 1182 A 1 c
ATOM 1694 N N    . SER Axp A    102 ? 45.378 12.344  8.789   1    37.609  ? 1183 A 1 .
ATOM 1695 C CA   . SER Axp A    102 ? 45.363 11.187  7.908   1    36.459  ? 1183 A 1 .
ATOM 1696 C C    . SER Axp A    102 ? 43.936 10.94   7.435   1    40.72   ? 1183 A 1 .
ATOM 1697 O O    . SER Axp A    102 ? 42.972 11.335  8.089   1    43.119  ? 1183 A 1 .
ATOM 1698 C CB   . SER Axp A    102 ? 45.9   9.956   8.575   1    34.55   ? 1183 A 1 .
ATOM 1699 O OG   . SER Axp A    102 ? 45.097 9.59    9.686   1    34.522  ? 1183 A 1 .
ATOM 1700 H H    . SER Axp A    102 ? 44.643 12.496  9.311   1    37.916  ? 1183 A 1 c
ATOM 1701 H HA   . SER Axp A    102 ? 45.924 11.388  7.116   1    37.139  ? 1183 A 1 c
ATOM 1702 H HB3  . SER Axp A    102 ? 46.813 10.123  8.875   1    34.968  ? 1183 A 1 c
ATOM 1703 H HB2  . SER Axp A    102 ? 45.918 9.222   7.933   1    34.964  ? 1183 A 1 c
ATOM 1704 H HG   . SER Axp A    102 ? 45.429 8.879   10.076  0    32.16   ? 1183 A 1 c
ATOM 1705 N N    . PHE Axp A    103 ? 43.802 10.27   6.292   1    43.261  ? 1184 A 1 .
ATOM 1706 C CA   . PHE Axp A    103 ? 42.485 10.015  5.75    1    43.672  ? 1184 A 1 .
ATOM 1707 C C    . PHE Axp A    103 ? 42.387 8.537   5.43    1    43.046  ? 1184 A 1 .
ATOM 1708 O O    . PHE Axp A    103 ? 43.41  7.87    5.336   1    44.028  ? 1184 A 1 .
ATOM 1709 C CB   . PHE Axp A    103 ? 42.184 10.802  4.475   1    46.092  ? 1184 A 1 .
ATOM 1710 C CG   . PHE Axp A    103 ? 42.984 10.356  3.27    1    48.666  ? 1184 A 1 .
ATOM 1711 C CD1  . PHE Axp A    103 ? 42.716 9.159   2.631   1    51.836  ? 1184 A 1 .
ATOM 1712 C CD2  . PHE Axp A    103 ? 43.997 11.154  2.776   1    62.788  ? 1184 A 1 .
ATOM 1713 C CE1  . PHE Axp A    103 ? 43.458 8.76    1.531   1    59.207  ? 1184 A 1 .
ATOM 1714 C CE2  . PHE Axp A    103 ? 44.741 10.758  1.673   1    72.098  ? 1184 A 1 .
ATOM 1715 C CZ   . PHE Axp A    103 ? 44.467 9.558   1.049   1    67.198  ? 1184 A 1 .
ATOM 1716 H H    . PHE Axp A    103 ? 44.539 9.969   5.843   1    42.642  ? 1184 A 1 c
ATOM 1717 H HA   . PHE Axp A    103 ? 41.803 10.24   6.435   1    43.749  ? 1184 A 1 c
ATOM 1718 H HB3  . PHE Axp A    103 ? 42.366 11.753  4.645   1    46.262  ? 1184 A 1 c
ATOM 1719 H HB2  . PHE Axp A    103 ? 41.226 10.711  4.272   1    46.1    ? 1184 A 1 c
ATOM 1720 H HD1  . PHE Axp A    103 ? 42.021 8.609   2.945   1    52.505  ? 1184 A 1 c
ATOM 1721 H HD2  . PHE Axp A    103 ? 44.191 11.97   3.203   1    60.669  ? 1184 A 1 c
ATOM 1722 H HE1  . PHE Axp A    103 ? 43.258 7.944   1.103   1    59.024  ? 1184 A 1 c
ATOM 1723 H HE2  . PHE Axp A    103 ? 45.436 11.309  1.351   1    68.288  ? 1184 A 1 c
ATOM 1724 H HZ   . PHE Axp A    103 ? 44.968 9.288   0.296   1    66.034  ? 1184 A 1 c
ATOM 1725 N N    . LYS Axp A    104 ? 41.139 8.067   5.287   1    41.611  ? 1185 A 1 .
ATOM 1726 C CA   . LYS Axp A    104 ? 40.832 6.874   4.516   1    38.347  ? 1185 A 1 .
ATOM 1727 C C    . LYS Axp A    104 ? 39.524 7.087   3.757   1    36.542  ? 1185 A 1 .
ATOM 1728 O O    . LYS Axp A    104 ? 38.617 7.759   4.242   1    36.656  ? 1185 A 1 .
ATOM 1729 C CB   . LYS Axp A    104 ? 40.809 5.64    5.41    1    37.306  ? 1185 A 1 .
ATOM 1730 C CG   . LYS Axp A    104 ? 39.956 5.829   6.618   1    38.253  ? 1185 A 1 .
ATOM 1731 C CD   . LYS Axp A    104 ? 39.409 4.525   7.179   1    41.679  ? 1185 A 1 .
ATOM 1732 C CE   . LYS Axp A    104 ? 40.285 3.75    8.113   1    41.974  ? 1185 A 1 .
ATOM 1733 N NZ   . LYS Axp A    104 ? 39.458 2.724   8.76    1    44.343  ? 1185 A 1 .
ATOM 1734 H H    . LYS Axp A    104 ? 40.451 8.512   5.692   1    41.169  ? 1185 A 1 c
ATOM 1735 H HA   . LYS Axp A    104 ? 41.556 6.745   3.852   1    38.544  ? 1185 A 1 c
ATOM 1736 H HB3  . LYS Axp A    104 ? 41.724 5.431   5.697   1    37.766  ? 1185 A 1 c
ATOM 1737 H HB2  . LYS Axp A    104 ? 40.47  4.876   4.895   1    37.802  ? 1185 A 1 c
ATOM 1738 H HG3  . LYS Axp A    104 ? 39.205 6.418   6.388   1    38.751  ? 1185 A 1 c
ATOM 1739 H HG2  . LYS Axp A    104 ? 40.488 6.278   7.311   1    38.77   ? 1185 A 1 c
ATOM 1740 H HD3  . LYS Axp A    104 ? 39.177 3.945   6.423   1    40.876  ? 1185 A 1 c
ATOM 1741 H HD2  . LYS Axp A    104 ? 38.568 4.73    7.643   1    40.959  ? 1185 A 1 c
ATOM 1742 H HE3  . LYS Axp A    104 ? 40.664 4.34    8.789   1    42.374  ? 1185 A 1 c
ATOM 1743 H HE2  . LYS Axp A    104 ? 41.003 3.322   7.614   1    42.368  ? 1185 A 1 c
ATOM 1744 H HZ1  . LYS Axp A    104 ? 39.096 2.179   8.132   1    43.569  ? 1185 A 1 c
ATOM 1745 H HZ2  . LYS Axp A    104 ? 38.792 3.116   9.232   1    43.516  ? 1185 A 1 c
ATOM 1746 H HZ3  . LYS Axp A    104 ? 39.968 2.23    9.322   1    43.578  ? 1185 A 1 c
ATOM 1747 N N    . VAL Axp A    105 ? 39.47  6.507   2.552   1    36.655  ? 1186 A 1 .
ATOM 1748 C CA   . VAL Axp A    105 ? 38.407 6.74    1.591   1    36.976  ? 1186 A 1 .
ATOM 1749 C C    . VAL Axp A    105 ? 37.504 5.513   1.524   1    36.185  ? 1186 A 1 .
ATOM 1750 O O    . VAL Axp A    105 ? 37.912 4.413   1.876   1    35.746  ? 1186 A 1 .
ATOM 1751 C CB   . VAL Axp A    105 ? 38.974 7.041   0.194   1    39.213  ? 1186 A 1 .
ATOM 1752 C CG1  . VAL Axp A    105 ? 37.867 7.392   -0.783  1    42.259  ? 1186 A 1 .
ATOM 1753 C CG2  . VAL Axp A    105 ? 40.004 8.162   0.215   1    42.26   ? 1186 A 1 .
ATOM 1754 H H    . VAL Axp A    105 ? 40.137 5.926   2.321   1    36.727  ? 1186 A 1 c
ATOM 1755 H HA   . VAL Axp A    105 ? 37.882 7.504   1.886   1    37.167  ? 1186 A 1 c
ATOM 1756 H HB   . VAL Axp A    105 ? 39.419 6.221   -0.126  1    39.864  ? 1186 A 1 c
ATOM 1757 H HG11 . VAL Axp A    105 ? 37.215 7.965   -0.346  1    41.235  ? 1186 A 1 c
ATOM 1758 H HG12 . VAL Axp A    105 ? 37.43  6.579   -1.088  1    41.261  ? 1186 A 1 c
ATOM 1759 H HG13 . VAL Axp A    105 ? 38.243 7.859   -1.548  1    41.308  ? 1186 A 1 c
ATOM 1760 H HG21 . VAL Axp A    105 ? 40.288 8.361   -0.693  1    41.508  ? 1186 A 1 c
ATOM 1761 H HG22 . VAL Axp A    105 ? 40.775 7.886   0.74    1    41.351  ? 1186 A 1 c
ATOM 1762 H HG23 . VAL Axp A    105 ? 39.611 8.957   0.612   1    41.373  ? 1186 A 1 c
ATOM 1763 N N    . PHE Axp A    106 ? 36.277 5.72    1.046   1    36.764  ? 1187 A 1 .
ATOM 1764 C CA   . PHE Axp A    106 ? 35.357 4.629   0.802   1    39.442  ? 1187 A 1 .
ATOM 1765 C C    . PHE Axp A    106 ? 34.5   4.891   -0.425  1    46.194  ? 1187 A 1 .
ATOM 1766 O O    . PHE Axp A    106 ? 33.932 5.971   -0.585  1    49.137  ? 1187 A 1 .
ATOM 1767 C CB   . PHE Axp A    106 ? 34.433 4.463   1.999   1    37.032  ? 1187 A 1 .
ATOM 1768 C CG   . PHE Axp A    106 ? 35.209 4.048   3.23    1    35.758  ? 1187 A 1 .
ATOM 1769 C CD1  . PHE Axp A    106 ? 35.744 2.777   3.32    1    35.97   ? 1187 A 1 .
ATOM 1770 C CD2  . PHE Axp A    106 ? 35.381 4.921   4.289   1    37.951  ? 1187 A 1 .
ATOM 1771 C CE1  . PHE Axp A    106 ? 36.449 2.391   4.437   1    36.833  ? 1187 A 1 .
ATOM 1772 C CE2  . PHE Axp A    106 ? 36.068 4.527   5.415   1    39.031  ? 1187 A 1 .
ATOM 1773 C CZ   . PHE Axp A    106 ? 36.61  3.266   5.479   1    39.411  ? 1187 A 1 .
ATOM 1774 H H    . PHE Axp A    106 ? 35.993 6.575   0.89    1    37.324  ? 1187 A 1 c
ATOM 1775 H HA   . PHE Axp A    106 ? 35.873 3.79    0.67    1    39.654  ? 1187 A 1 c
ATOM 1776 H HB3  . PHE Axp A    106 ? 33.759 3.778   1.792   1    37.316  ? 1187 A 1 c
ATOM 1777 H HB2  . PHE Axp A    106 ? 33.978 5.317   2.172   1    37.296  ? 1187 A 1 c
ATOM 1778 H HD1  . PHE Axp A    106 ? 35.636 2.174   2.602   1    36.178  ? 1187 A 1 c
ATOM 1779 H HD2  . PHE Axp A    106 ? 35.015 5.788   4.243   1    37.69   ? 1187 A 1 c
ATOM 1780 H HE1  . PHE Axp A    106 ? 36.813 1.522   4.489   1    37.225  ? 1187 A 1 c
ATOM 1781 H HE2  . PHE Axp A    106 ? 36.19  5.132   6.13    1    38.81   ? 1187 A 1 c
ATOM 1782 H HZ   . PHE Axp A    106 ? 37.089 2.998   6.247   1    38.704  ? 1187 A 1 c
ATOM 1783 N N    . LYS Axp A    107 ? 34.393 3.862   -1.267  1    50.54   ? 1188 A 1 .
ATOM 1784 C CA   . LYS Axp A    107 ? 33.399 3.854   -2.318  1    52.289  ? 1188 A 1 .
ATOM 1785 C C    . LYS Axp A    107 ? 32.06  3.544   -1.675  1    49.365  ? 1188 A 1 .
ATOM 1786 O O    . LYS Axp A    107 ? 31.981 2.629   -0.867  1    47.73   ? 1188 A 1 .
ATOM 1787 C CB   . LYS Axp A    107 ? 33.711 2.817   -3.398  1    58.584  ? 1188 A 1 .
ATOM 1788 C CG   . LYS Axp A    107 ? 32.661 2.711   -4.499  1    62.548  ? 1188 A 1 .
ATOM 1789 C CD   . LYS Axp A    107 ? 33.285 2.604   -5.892  1    65.131  ? 1188 A 1 .
ATOM 1790 C CE   . LYS Axp A    107 ? 32.312 2.478   -7.028  1    65.117  ? 1188 A 1 .
ATOM 1791 N NZ   . LYS Axp A    107 ? 31.8   1.117   -7.213  1    67.758  ? 1188 A 1 .
ATOM 1792 H H    . LYS Axp A    107 ? 34.956 3.146   -1.186  1    49.72   ? 1188 A 1 c
ATOM 1793 H HA   . LYS Axp A    107 ? 33.368 4.749   -2.732  1    52.294  ? 1188 A 1 c
ATOM 1794 H HB3  . LYS Axp A    107 ? 33.804 1.938   -2.973  1    57.966  ? 1188 A 1 c
ATOM 1795 H HB2  . LYS Axp A    107 ? 34.573 3.042   -3.809  1    58.029  ? 1188 A 1 c
ATOM 1796 H HG3  . LYS Axp A    107 ? 32.083 3.504   -4.466  1    62.059  ? 1188 A 1 c
ATOM 1797 H HG2  . LYS Axp A    107 ? 32.105 1.919   -4.332  1    62.162  ? 1188 A 1 c
ATOM 1798 H HD3  . LYS Axp A    107 ? 33.883 1.824   -5.903  1    64.524  ? 1188 A 1 c
ATOM 1799 H HD2  . LYS Axp A    107 ? 33.842 3.398   -6.043  1    64.488  ? 1188 A 1 c
ATOM 1800 H HE3  . LYS Axp A    107 ? 32.747 2.763   -7.852  1    65.737  ? 1188 A 1 c
ATOM 1801 H HE2  . LYS Axp A    107 ? 31.559 3.075   -6.868  1    65.737  ? 1188 A 1 c
ATOM 1802 H HZ1  . LYS Axp A    107 ? 31.503 0.791   -6.422  1    66.924  ? 1188 A 1 c
ATOM 1803 H HZ2  . LYS Axp A    107 ? 32.461 0.582   -7.527  1    66.932  ? 1188 A 1 c
ATOM 1804 H HZ3  . LYS Axp A    107 ? 31.117 1.125   -7.808  1    66.932  ? 1188 A 1 c
ATOM 1805 N N    . ILE Axp A    108 ? 31.04  4.32    -2.048  1    51.375  ? 1189 A 1 .
ATOM 1806 C CA   . ILE Axp A    108 ? 29.663 4.058   -1.662  1    56.135  ? 1189 A 1 .
ATOM 1807 C C    . ILE Axp A    108 ? 28.796 3.941   -2.918  1    64.712  ? 1189 A 1 .
ATOM 1808 O O    . ILE Axp A    108 ? 29.123 4.494   -3.971  1    63.014  ? 1189 A 1 .
ATOM 1809 C CB   . ILE Axp A    108 ? 29.138 5.156   -0.721  1    53.727  ? 1189 A 1 .
ATOM 1810 C CG1  . ILE Axp A    108 ? 29.64  6.537   -1.161  1    51.484  ? 1189 A 1 .
ATOM 1811 C CG2  . ILE Axp A    108 ? 29.495 4.836   0.732   1    54.595  ? 1189 A 1 .
ATOM 1812 C CD1  . ILE Axp A    108 ? 28.793 7.712   -0.701  1    48.705  ? 1189 A 1 .
ATOM 1813 H H    . ILE Axp A    108 ? 31.212 5.037   -2.588  1    51.918  ? 1189 A 1 c
ATOM 1814 H HA   . ILE Axp A    108 ? 29.632 3.206   -1.186  1    56.143  ? 1189 A 1 c
ATOM 1815 H HB   . ILE Axp A    108 ? 28.163 5.163   -0.792  1    53.953  ? 1189 A 1 c
ATOM 1816 H HG12 . ILE Axp A    108 ? 29.683 6.556   -2.139  1    51.407  ? 1189 A 1 c
ATOM 1817 H HG13 . ILE Axp A    108 ? 30.55  6.66    -0.823  1    51.342  ? 1189 A 1 c
ATOM 1818 H HG21 . ILE Axp A    108 ? 29.196 5.56    1.308   1    54.307  ? 1189 A 1 c
ATOM 1819 H HG22 . ILE Axp A    108 ? 30.457 4.733   0.816   1    54.333  ? 1189 A 1 c
ATOM 1820 H HG23 . ILE Axp A    108 ? 29.058 4.01    1       1    54.342  ? 1189 A 1 c
ATOM 1821 H HD11 . ILE Axp A    108 ? 28.066 7.859   -1.335  1    49.516  ? 1189 A 1 c
ATOM 1822 H HD12 . ILE Axp A    108 ? 29.347 8.515   -0.653  1    49.516  ? 1189 A 1 c
ATOM 1823 H HD13 . ILE Axp A    108 ? 28.421 7.522   0.181   1    49.539  ? 1189 A 1 c
ATOM 1824 N N    . LYS Axp A    109 ? 27.682 3.204   -2.796  1    68.243  ? 1190 A 1 .
ATOM 1825 C CA   . LYS Axp A    109 ? 26.639 3.26    -3.803  1    72.304  ? 1190 A 1 .
ATOM 1826 C C    . LYS Axp A    109 ? 26.134 4.703   -3.872  1    80.865  ? 1190 A 1 .
ATOM 1827 O O    . LYS Axp A    109 ? 25.804 5.291   -2.84   1    71.703  ? 1190 A 1 .
ATOM 1828 C CB   . LYS Axp A    109 ? 25.495 2.282   -3.51   1    72.18   ? 1190 A 1 .
ATOM 1829 C CG   . LYS Axp A    109 ? 24.366 2.366   -4.53   1    75.616  ? 1190 A 1 .
ATOM 1830 C CD   . LYS Axp A    109 ? 23.397 1.194   -4.595  1    73.918  ? 1190 A 1 .
ATOM 1831 C CE   . LYS Axp A    109 ? 22.582 1.324   -5.837  1    73.993  ? 1190 A 1 .
ATOM 1832 N NZ   . LYS Axp A    109 ? 21.782 0.132   -6.111  1    75.573  ? 1190 A 1 .
ATOM 1833 H H    . LYS Axp A    109 ? 27.573 2.658   -2.072  1    68.095  ? 1190 A 1 c
ATOM 1834 H HA   . LYS Axp A    109 ? 27.041 3.018   -4.674  1    73.183  ? 1190 A 1 c
ATOM 1835 H HB3  . LYS Axp A    109 ? 25.13  2.472   -2.619  1    72.979  ? 1190 A 1 c
ATOM 1836 H HB2  . LYS Axp A    109 ? 25.847 1.367   -3.504  1    72.979  ? 1190 A 1 c
ATOM 1837 H HG3  . LYS Axp A    109 ? 24.772 2.48    -5.416  1    74.515  ? 1190 A 1 c
ATOM 1838 H HG2  . LYS Axp A    109 ? 23.851 3.181   -4.345  1    74.472  ? 1190 A 1 c
ATOM 1839 H HD3  . LYS Axp A    109 ? 22.806 1.204   -3.81   1    74.314  ? 1190 A 1 c
ATOM 1840 H HD2  . LYS Axp A    109 ? 23.895 0.348   -4.614  1    74.318  ? 1190 A 1 c
ATOM 1841 H HE3  . LYS Axp A    109 ? 23.169 1.485   -6.597  1    74.355  ? 1190 A 1 c
ATOM 1842 H HE2  . LYS Axp A    109 ? 21.986 2.09    -5.751  1    74.348  ? 1190 A 1 c
ATOM 1843 H HZ1  . LYS Axp A    109 ? 21.136 0.045   -5.481  1    75.08   ? 1190 A 1 c
ATOM 1844 H HZ2  . LYS Axp A    109 ? 22.311 -0.604  -6.099  1    75.071  ? 1190 A 1 c
ATOM 1845 H HZ3  . LYS Axp A    109 ? 21.394 0.206   -6.927  1    75.08   ? 1190 A 1 c
ATOM 1846 N N    . PRO Axp A    110 ? 26.075 5.334   -5.075  1    92.175  ? 1191 A 1 .
ATOM 1847 C CA   . PRO Axp A    110 ? 25.665 6.737   -5.171  1    90.049  ? 1191 A 1 .
ATOM 1848 C C    . PRO Axp A    110 ? 24.226 6.961   -4.692  1    93.498  ? 1191 A 1 .
ATOM 1849 O O    . PRO Axp A    110 ? 23.642 6.089   -4.054  1    75.983  ? 1191 A 1 .
ATOM 1850 C CB   . PRO Axp A    110 ? 25.984 7.109   -6.627  1    83.808  ? 1191 A 1 .
ATOM 1851 C CG   . PRO Axp A    110 ? 25.97  5.776   -7.363  1    85.667  ? 1191 A 1 .
ATOM 1852 C CD   . PRO Axp A    110 ? 26.415 4.735   -6.379  1    87.731  ? 1191 A 1 .
ATOM 1853 H HA   . PRO Axp A    110 ? 26.258 7.266   -4.598  1    89.785  ? 1191 A 1 c
ATOM 1854 H HB3  . PRO Axp A    110 ? 26.86  7.535   -6.694  1    85.293  ? 1191 A 1 c
ATOM 1855 H HB2  . PRO Axp A    110 ? 25.311 7.714   -6.993  1    85.841  ? 1191 A 1 c
ATOM 1856 H HG3  . PRO Axp A    110 ? 26.577 5.801   -8.129  1    85.713  ? 1191 A 1 c
ATOM 1857 H HG2  . PRO Axp A    110 ? 25.07  5.573   -7.687  1    85.713  ? 1191 A 1 c
ATOM 1858 H HD3  . PRO Axp A    110 ? 25.936 3.896   -6.513  1    87.936  ? 1191 A 1 c
ATOM 1859 H HD2  . PRO Axp A    110 ? 27.376 4.572   -6.445  1    88.099  ? 1191 A 1 c
ATOM 1860 N N    . GLU Axp A    111 ? 23.661 8.137   -5.007  1    113.74  ? 1192 A 1 .
ATOM 1861 C CA   . GLU Axp A    111 ? 22.5   8.682   -4.306  1    122.579 ? 1192 A 1 .
ATOM 1862 C C    . GLU Axp A    111 ? 21.251 7.818   -4.552  1    109.635 ? 1192 A 1 .
ATOM 1863 O O    . GLU Axp A    111 ? 21.057 6.874   -3.787  1    96.867  ? 1192 A 1 .
ATOM 1864 C CB   . GLU Axp A    111 ? 22.489 10.191  -4.581  1    132.766 ? 1192 A 1 .
ATOM 1865 C CG   . GLU Axp A    111 ? 23.689 10.958  -4.018  1    128.164 ? 1192 A 1 .
ATOM 1866 C CD   . GLU Axp A    111 ? 24.058 10.861  -2.535  1    128.738 ? 1192 A 1 .
ATOM 1867 O OE1  . GLU Axp A    111 ? 23.581 9.984   -1.771  1    127.882 ? 1192 A 1 .
ATOM 1868 O OE2  . GLU Axp A    111 ? 24.87  11.724  -2.131  1    112.161 ? 1192 A 1 .
ATOM 1869 H H    . GLU Axp A    111 ? 24.019 8.625   -5.691  1    110.137 ? 1192 A 1 c
ATOM 1870 H HA   . GLU Axp A    111 ? 22.693 8.6     -3.341  1    119.914 ? 1192 A 1 c
ATOM 1871 H HB3  . GLU Axp A    111 ? 21.667 10.577  -4.224  1    128.599 ? 1192 A 1 c
ATOM 1872 H HB2  . GLU Axp A    111 ? 22.492 10.333  -5.551  1    128.871 ? 1192 A 1 c
ATOM 1873 H HG3  . GLU Axp A    111 ? 23.554 11.909  -4.219  1    129.198 ? 1192 A 1 c
ATOM 1874 H HG2  . GLU Axp A    111 ? 24.48  10.689  -4.53   1    128.635 ? 1192 A 1 c
ATOM 1875 N N    . LYS Axp A    112 ? 20.341 8.136   -5.502  1    112.058 ? 1193 A 1 .
ATOM 1876 C CA   . LYS Axp A    112 ? 19.994 9.467   -5.993  1    118.23  ? 1193 A 1 .
ATOM 1877 C C    . LYS Axp A    112 ? 18.664 9.913   -5.373  1    117.538 ? 1193 A 1 .
ATOM 1878 O O    . LYS Axp A    112 ? 18.39  11.111  -5.287  1    104.936 ? 1193 A 1 .
ATOM 1879 C CB   . LYS Axp A    112 ? 19.906 9.527   -7.528  1    108.345 ? 1193 A 1 .
ATOM 1880 C CG   . LYS Axp A    112 ? 19.479 10.894  -8.089  1    101.17  ? 1193 A 1 .
ATOM 1881 C CD   . LYS Axp A    112 ? 18.605 10.857  -9.336  1    95.587  ? 1193 A 1 .
ATOM 1882 C CE   . LYS Axp A    112 ? 19.298 11.337  -10.571 1    96.291  ? 1193 A 1 .
ATOM 1883 N NZ   . LYS Axp A    112 ? 20.655 10.805  -10.718 1    98.33   ? 1193 A 1 .
ATOM 1884 H H    . LYS Axp A    112 ? 19.908 7.431   -5.89   1    112.825 ? 1193 A 1 c
ATOM 1885 H HA   . LYS Axp A    112 ? 20.683 10.098  -5.713  1    115.371 ? 1193 A 1 c
ATOM 1886 H HB3  . LYS Axp A    112 ? 19.264 8.85    -7.831  1    108.635 ? 1193 A 1 c
ATOM 1887 H HB2  . LYS Axp A    112 ? 20.782 9.297   -7.903  1    108.769 ? 1193 A 1 c
ATOM 1888 H HG3  . LYS Axp A    112 ? 20.291 11.409  -8.287  1    101.393 ? 1193 A 1 c
ATOM 1889 H HG2  . LYS Axp A    112 ? 18.998 11.382  -7.391  1    101.604 ? 1193 A 1 c
ATOM 1890 H HD3  . LYS Axp A    112 ? 17.812 11.415  -9.18   1    97.018  ? 1193 A 1 c
ATOM 1891 H HD2  . LYS Axp A    112 ? 18.296 9.937   -9.483  1    97.13   ? 1193 A 1 c
ATOM 1892 H HE3  . LYS Axp A    112 ? 19.345 12.31   -10.553 1    96.607  ? 1193 A 1 c
ATOM 1893 H HE2  . LYS Axp A    112 ? 18.775 11.079  -11.351 1    96.607  ? 1193 A 1 c
ATOM 1894 H HZ1  . LYS Axp A    112 ? 20.71  9.975   -10.356 1    97.712  ? 1193 A 1 c
ATOM 1895 H HZ2  . LYS Axp A    112 ? 21.25  11.351  -10.308 1    97.742  ? 1193 A 1 c
ATOM 1896 H HZ3  . LYS Axp A    112 ? 20.864 10.753  -11.598 1    97.709  ? 1193 A 1 c
ATOM 1897 N N    . ARG Axp A    113 ? 17.845 8.946   -4.93   1    118.905 ? 1194 A 1 .
ATOM 1898 C CA   . ARG Axp A    113 ? 16.495 9.216   -4.458  1    123.704 ? 1194 A 1 .
ATOM 1899 C C    . ARG Axp A    113 ? 16.518 10.31   -3.389  1    123.586 ? 1194 A 1 .
ATOM 1900 O O    . ARG Axp A    113 ? 17.131 10.137  -2.342  1    121.863 ? 1194 A 1 .
ATOM 1901 C CB   . ARG Axp A    113 ? 15.881 7.887   -3.997  1    125.147 ? 1194 A 1 .
ATOM 1902 C CG   . ARG Axp A    113 ? 14.624 8.013   -3.145  1    126.985 ? 1194 A 1 .
ATOM 1903 C CD   . ARG Axp A    113 ? 13.609 6.893   -3.373  1    120.969 ? 1194 A 1 .
ATOM 1904 N NE   . ARG Axp A    113 ? 12.833 7.133   -4.596  1    122.284 ? 1194 A 1 .
ATOM 1905 C CZ   . ARG Axp A    113 ? 11.871 8.042   -4.728  1    120.36  ? 1194 A 1 .
ATOM 1906 N NH1  . ARG Axp A    113 ? 11.398 8.655   -3.661  1    122.945 ? 1194 A 1 .
ATOM 1907 N NH2  . ARG Axp A    113 ? 11.36  8.308   -5.918  1    121.489 ? 1194 A 1 .
ATOM 1908 H H    . ARG Axp A    113 ? 18.14  8.081   -4.925  1    119.585 ? 1194 A 1 c
ATOM 1909 H HA   . ARG Axp A    113 ? 15.965 9.543   -5.229  1    123.117 ? 1194 A 1 c
ATOM 1910 H HB3  . ARG Axp A    113 ? 16.557 7.395   -3.487  1    124.656 ? 1194 A 1 c
ATOM 1911 H HB2  . ARG Axp A    113 ? 15.667 7.354   -4.792  1    125.099 ? 1194 A 1 c
ATOM 1912 H HG3  . ARG Axp A    113 ? 14.192 8.873   -3.34   1    125.098 ? 1194 A 1 c
ATOM 1913 H HG2  . ARG Axp A    113 ? 14.878 8.022   -2.197  1    125.063 ? 1194 A 1 c
ATOM 1914 H HD3  . ARG Axp A    113 ? 13     6.842   -2.608  1    122.367 ? 1194 A 1 c
ATOM 1915 H HD2  . ARG Axp A    113 ? 14.077 6.037   -3.449  1    122.465 ? 1194 A 1 c
ATOM 1916 H HE   . ARG Axp A    113 ? 13.016 6.642   -5.293  1    121.522 ? 1194 A 1 c
ATOM 1917 H HH11 . ARG Axp A    113 ? 11.938 9.126   -3.145  1    122.363 ? 1194 A 1 c
ATOM 1918 H HH12 . ARG Axp A    113 ? 10.538 8.59    -3.466  1    122.196 ? 1194 A 1 c
ATOM 1919 H HH21 . ARG Axp A    113 ? 11.89  8.348   -6.624  1    121.141 ? 1194 A 1 c
ATOM 1920 H HH22 . ARG Axp A    113 ? 10.491 8.445   -6.002  1    121.141 ? 1194 A 1 c
ATOM 1921 N N    . TRP Axp A    114 ? 15.792 11.409  -3.65   1    133.672 ? 1195 A 1 .
ATOM 1922 C CA   . TRP Axp A    114 ? 15.9   12.66   -2.903  1    136.331 ? 1195 A 1 .
ATOM 1923 C C    . TRP Axp A    114 ? 16.226 12.452  -1.413  1    128.415 ? 1195 A 1 .
ATOM 1924 O O    . TRP Axp A    114 ? 17.113 13.133  -0.902  1    121.569 ? 1195 A 1 .
ATOM 1925 C CB   . TRP Axp A    114 ? 14.695 13.606  -3.141  1    141.635 ? 1195 A 1 .
ATOM 1926 C CG   . TRP Axp A    114 ? 13.406 13.028  -3.692  1    149.53  ? 1195 A 1 .
ATOM 1927 C CD1  . TRP Axp A    114 ? 12.712 11.947  -3.227  1    147.244 ? 1195 A 1 .
ATOM 1928 C CD2  . TRP Axp A    114 ? 12.64  13.523  -4.827  1    152.364 ? 1195 A 1 .
ATOM 1929 N NE1  . TRP Axp A    114 ? 11.587 11.734  -3.982  1    148.985 ? 1195 A 1 .
ATOM 1930 C CE2  . TRP Axp A    114 ? 11.511 12.68   -4.97   1    148.863 ? 1195 A 1 .
ATOM 1931 C CE3  . TRP Axp A    114 ? 12.792 14.583  -5.735  1    138.29  ? 1195 A 1 .
ATOM 1932 C CZ2  . TRP Axp A    114 ? 10.551 12.864  -5.969  1    129.938 ? 1195 A 1 .
ATOM 1933 C CZ3  . TRP Axp A    114 ? 11.842 14.764  -6.722  1    130.242 ? 1195 A 1 .
ATOM 1934 C CH2  . TRP Axp A    114 ? 10.736 13.917  -6.836  1    125.892 ? 1195 A 1 .
ATOM 1935 H H    . TRP Axp A    114 ? 15.203 11.376  -4.347  1    131.894 ? 1195 A 1 c
ATOM 1936 H HA   . TRP Axp A    114 ? 16.687 13.132  -3.288  1    135.174 ? 1195 A 1 c
ATOM 1937 H HB3  . TRP Axp A    114 ? 14.99  14.321  -3.744  1    142.177 ? 1195 A 1 c
ATOM 1938 H HB2  . TRP Axp A    114 ? 14.49  14.052  -2.292  1    142.11  ? 1195 A 1 c
ATOM 1939 H HD1  . TRP Axp A    114 ? 12.965 11.416  -2.488  1    148.08  ? 1195 A 1 c
ATOM 1940 H HE1  . TRP Axp A    114 ? 11.005 11.099  -3.853  1    148.003 ? 1195 A 1 c
ATOM 1941 H HE3  . TRP Axp A    114 ? 13.531 15.163  -5.67   1    139.342 ? 1195 A 1 c
ATOM 1942 H HZ2  . TRP Axp A    114 ? 9.807  12.291  -6.044  1    133.217 ? 1195 A 1 c
ATOM 1943 H HZ3  . TRP Axp A    114 ? 11.941 15.476  -7.332  1    131.285 ? 1195 A 1 c
ATOM 1944 H HH2  . TRP Axp A    114 ? 10.108 14.066  -7.52   1    128.184 ? 1195 A 1 c
ATOM 1945 N N    . GLN Axp A    115 ? 15.568 11.513  -0.709  1    121.325 ? 1196 A 1 .
ATOM 1946 C CA   . GLN Axp A    115 ? 15.835 11.321  0.717   1    105.808 ? 1196 A 1 .
ATOM 1947 C C    . GLN Axp A    115 ? 16.295 9.899   1.042   1    97.138  ? 1196 A 1 .
ATOM 1948 O O    . GLN Axp A    115 ? 16.178 9.465   2.185   1    88.077  ? 1196 A 1 .
ATOM 1949 C CB   . GLN Axp A    115 ? 14.629 11.75   1.555   1    99.326  ? 1196 A 1 .
ATOM 1950 C CG   . GLN Axp A    115 ? 14.593 13.25   1.816   1    94.44   ? 1196 A 1 .
ATOM 1951 C CD   . GLN Axp A    115 ? 13.266 13.729  2.353   1    93.82   ? 1196 A 1 .
ATOM 1952 O OE1  . GLN Axp A    115 ? 12.694 14.717  1.881   1    104.741 ? 1196 A 1 .
ATOM 1953 N NE2  . GLN Axp A    115 ? 12.769 13.035  3.362   1    95.122  ? 1196 A 1 .
ATOM 1954 H H    . GLN Axp A    115 ? 14.937 10.994  -1.119  1    119.205 ? 1196 A 1 c
ATOM 1955 H HA   . GLN Axp A    115 ? 16.576 11.928  0.967   1    105.859 ? 1196 A 1 c
ATOM 1956 H HB3  . GLN Axp A    115 ? 14.647 11.279  2.413   1    99.482  ? 1196 A 1 c
ATOM 1957 H HB2  . GLN Axp A    115 ? 13.809 11.487  1.087   1    99.555  ? 1196 A 1 c
ATOM 1958 H HG3  . GLN Axp A    115 ? 14.783 13.726  0.98    1    95.187  ? 1196 A 1 c
ATOM 1959 H HG2  . GLN Axp A    115 ? 15.296 13.483  2.459   1    95.343  ? 1196 A 1 c
ATOM 1960 H HE21 . GLN Axp A    115 ? 12.132 12.435  3.216   1    94.72   ? 1196 A 1 c
ATOM 1961 H HE22 . GLN Axp A    115 ? 13.073 13.171  4.185   1    94.72   ? 1196 A 1 c
ATOM 1962 N N    . ASP Axp A    116 ? 16.827 9.188   0.042   1    97.599  ? 1197 A 1 .
ATOM 1963 C CA   . ASP Axp A    116 ? 17.709 8.056   0.28    1    103.613 ? 1197 A 1 .
ATOM 1964 C C    . ASP Axp A    116 ? 19.129 8.571   0.526   1    109.337 ? 1197 A 1 .
ATOM 1965 O O    . ASP Axp A    116 ? 19.801 8.084   1.434   1    109.801 ? 1197 A 1 .
ATOM 1966 C CB   . ASP Axp A    116 ? 17.67  7.051   -0.863  1    104.551 ? 1197 A 1 .
ATOM 1967 C CG   . ASP Axp A    116 ? 16.438 6.161   -0.923  1    106.076 ? 1197 A 1 .
ATOM 1968 O OD1  . ASP Axp A    116 ? 15.67  6.148   0.071   1    102.845 ? 1197 A 1 .
ATOM 1969 O OD2  . ASP Axp A    116 ? 16.258 5.492   -1.968  1    105.336 ? 1197 A 1 .
ATOM 1970 H H    . ASP Axp A    116 ? 16.628 9.412   -0.821  1    99.362  ? 1197 A 1 c
ATOM 1971 H HA   . ASP Axp A    116 ? 17.405 7.593   1.091   1    103.482 ? 1197 A 1 c
ATOM 1972 H HB3  . ASP Axp A    116 ? 18.454 6.468   -0.79   1    104.731 ? 1197 A 1 c
ATOM 1973 H HB2  . ASP Axp A    116 ? 17.742 7.54    -1.707  1    104.797 ? 1197 A 1 c
ATOM 1974 N N    . ILE Axp A    117 ? 19.577 9.547   -0.288  1    107.502 ? 1198 A 1 .
ATOM 1975 C CA   . ILE Axp A    117 ? 20.842 10.238  -0.073  1    91.953  ? 1198 A 1 .
ATOM 1976 C C    . ILE Axp A    117 ? 21.134 10.207  1.418   1    90.46   ? 1198 A 1 .
ATOM 1977 O O    . ILE Axp A    117 ? 21.937 9.399   1.867   1    81.407  ? 1198 A 1 .
ATOM 1978 C CB   . ILE Axp A    117 ? 20.822 11.696  -0.585  1    92.041  ? 1198 A 1 .
ATOM 1979 C CG1  . ILE Axp A    117 ? 20.907 11.766  -2.108  1    100.048 ? 1198 A 1 .
ATOM 1980 C CG2  . ILE Axp A    117 ? 21.91  12.554  0.075   1    84.884  ? 1198 A 1 .
ATOM 1981 C CD1  . ILE Axp A    117 ? 19.623 12.197  -2.798  1    106.393 ? 1198 A 1 .
ATOM 1982 H H    . ILE Axp A    117 ? 19.072 9.784   -1.012  1    104.141 ? 1198 A 1 c
ATOM 1983 H HA   . ILE Axp A    117 ? 21.545 9.751   -0.539  1    94.665  ? 1198 A 1 c
ATOM 1984 H HB   . ILE Axp A    117 ? 19.959 12.078  -0.329  1    92.339  ? 1198 A 1 c
ATOM 1985 H HG12 . ILE Axp A    117 ? 21.151 10.88   -2.44   1    100.073 ? 1198 A 1 c
ATOM 1986 H HG13 . ILE Axp A    117 ? 21.621 12.386  -2.359  1    99.577  ? 1198 A 1 c
ATOM 1987 H HG21 . ILE Axp A    117 ? 22.108 13.321  -0.489  1    87.136  ? 1198 A 1 c
ATOM 1988 H HG22 . ILE Axp A    117 ? 22.718 12.025  0.191   1    87.019  ? 1198 A 1 c
ATOM 1989 H HG23 . ILE Axp A    117 ? 21.601 12.867  0.941   1    87.143  ? 1198 A 1 c
ATOM 1990 H HD11 . ILE Axp A    117 ? 18.991 11.458  -2.796  1    104.683 ? 1198 A 1 c
ATOM 1991 H HD12 . ILE Axp A    117 ? 19.822 12.452  -3.719  1    104.53  ? 1198 A 1 c
ATOM 1992 H HD13 . ILE Axp A    117 ? 19.235 12.96   -2.329  1    104.531 ? 1198 A 1 c
ATOM 1993 N N    . SER Axp A    118 ? 20.41  11.055  2.16    1    102.616 ? 1199 A 1 .
ATOM 1994 C CA   . SER Axp A    118 ? 20.72  11.357  3.548   1    109.253 ? 1199 A 1 .
ATOM 1995 C C    . SER Axp A    118 ? 20.042 10.347  4.473   1    94.01   ? 1199 A 1 .
ATOM 1996 O O    . SER Axp A    118 ? 19.996 10.545  5.684   1    93.404  ? 1199 A 1 .
ATOM 1997 C CB   . SER Axp A    118 ? 20.357 12.797  3.895   1    111.239 ? 1199 A 1 .
ATOM 1998 O OG   . SER Axp A    118 ? 21.369 13.715  3.485   1    101.969 ? 1199 A 1 .
ATOM 1999 H H    . SER Axp A    118 ? 19.676 11.45   1.787   1    100.923 ? 1199 A 1 c
ATOM 2000 H HA   . SER Axp A    118 ? 21.697 11.259  3.663   1    104.857 ? 1199 A 1 c
ATOM 2001 H HB3  . SER Axp A    118 ? 20.228 12.868  4.854   1    107.966 ? 1199 A 1 c
ATOM 2002 H HB2  . SER Axp A    118 ? 19.515 13.03   3.461   1    108.355 ? 1199 A 1 c
ATOM 2003 H HG   . SER Axp A    118 ? 21.093 14.568  3.624   0    80.21   ? 1199 A 1 c
ATOM 2004 N N    . MET Axp A    119 ? 19.513 9.27    3.887   1    87.283  ? 1200 A 1 .
ATOM 2005 C CA   . MET Axp A    119 ? 19.144 8.086   4.642   1    94.772  ? 1200 A 1 .
ATOM 2006 C C    . MET Axp A    119 ? 20.32  7.106   4.627   1    91.425  ? 1200 A 1 .
ATOM 2007 O O    . MET Axp A    119 ? 20.608 6.483   5.648   1    87.324  ? 1200 A 1 .
ATOM 2008 C CB   . MET Axp A    119 ? 17.877 7.438   4.066   1    103.034 ? 1200 A 1 .
ATOM 2009 C CG   . MET Axp A    119 ? 17.22  6.427   5.007   1    100.979 ? 1200 A 1 .
ATOM 2010 S SD   . MET Axp A    119 ? 15.901 5.426   4.286   1    92.636  ? 1200 A 1 .
ATOM 2011 C CE   . MET Axp A    119 ? 16.713 4.615   2.899   1    88.588  ? 1200 A 1 .
ATOM 2012 H H    . MET Axp A    119 ? 19.345 9.283   2.991   1    90.862  ? 1200 A 1 c
ATOM 2013 H HA   . MET Axp A    119 ? 18.974 8.354   5.58    1    93.957  ? 1200 A 1 c
ATOM 2014 H HB3  . MET Axp A    119 ? 18.108 6.99    3.226   1    100.492 ? 1200 A 1 c
ATOM 2015 H HB2  . MET Axp A    119 ? 17.23  8.145   3.861   1    100.523 ? 1200 A 1 c
ATOM 2016 H HG3  . MET Axp A    119 ? 16.854 6.906   5.776   1    99.104  ? 1200 A 1 c
ATOM 2017 H HG2  . MET Axp A    119 ? 17.905 5.83    5.339   1    98.301  ? 1200 A 1 c
ATOM 2018 H HE3  . MET Axp A    119 ? 17.532 4.186   3.208   1    89.617  ? 1200 A 1 c
ATOM 2019 H HE2  . MET Axp A    119 ? 16.93  5.276   2.217   1    89.729  ? 1200 A 1 c
ATOM 2020 H HE1  . MET Axp A    119 ? 16.117 3.942   2.522   1    89.617  ? 1200 A 1 c
ATOM 2021 N N    . MET Axp A    120 ? 20.987 6.973   3.465   1    86.861  ? 1201 A 1 .
ATOM 2022 C CA   . MET Axp A    120 ? 22.228 6.218   3.37    1    77.101  ? 1201 A 1 .
ATOM 2023 C C    . MET Axp A    120 ? 23.254 6.865   4.292   1    77.906  ? 1201 A 1 .
ATOM 2024 O O    . MET Axp A    120 ? 23.89  6.162   5.065   1    81.919  ? 1201 A 1 .
ATOM 2025 C CB   . MET Axp A    120 ? 22.825 6.19    1.953   1    76.419  ? 1201 A 1 .
ATOM 2026 C CG   . MET Axp A    120 ? 24.322 5.783   1.894   1    77.283  ? 1201 A 1 .
ATOM 2027 S SD   . MET Axp A    120 ? 25.447 6.697   0.803   1    78.558  ? 1201 A 1 .
ATOM 2028 C CE   . MET Axp A    120 ? 25.003 8.444   0.869   1    71.415  ? 1201 A 1 .
ATOM 2029 H H    . MET Axp A    120 ? 20.65  7.358   2.708   1    85.675  ? 1201 A 1 c
ATOM 2030 H HA   . MET Axp A    120 ? 22.058 5.291   3.678   1    78.961  ? 1201 A 1 c
ATOM 2031 H HB3  . MET Axp A    120 ? 22.723 7.079   1.554   1    76.798  ? 1201 A 1 c
ATOM 2032 H HB2  . MET Axp A    120 ? 22.306 5.56    1.41    1    76.773  ? 1201 A 1 c
ATOM 2033 H HG3  . MET Axp A    120 ? 24.364 4.842   1.631   1    77.272  ? 1201 A 1 c
ATOM 2034 H HG2  . MET Axp A    120 ? 24.688 5.836   2.792   1    77.084  ? 1201 A 1 c
ATOM 2035 H HE3  . MET Axp A    120 ? 24.935 8.726   1.8     1    73.196  ? 1201 A 1 c
ATOM 2036 H HE2  . MET Axp A    120 ? 24.145 8.578   0.425   1    73.398  ? 1201 A 1 c
ATOM 2037 H HE1  . MET Axp A    120 ? 25.688 8.971   0.418   1    73.196  ? 1201 A 1 c
ATOM 2038 N N    . ARG Axp A    121 ? 23.439 8.191   4.172   1    76.08   ? 1202 A 1 .
ATOM 2039 C CA   . ARG Axp A    121 ? 24.432 8.888   4.97    1    70.056  ? 1202 A 1 .
ATOM 2040 C C    . ARG Axp A    121 ? 24.369 8.253   6.356   1    65.29   ? 1202 A 1 .
ATOM 2041 O O    . ARG Axp A    121 ? 25.35  7.661   6.795   1    72.12   ? 1202 A 1 .
ATOM 2042 C CB   . ARG Axp A    121 ? 24.273 10.419  5.004   1    79.567  ? 1202 A 1 .
ATOM 2043 C CG   . ARG Axp A    121 ? 25.053 11.322  4.043   1    81.934  ? 1202 A 1 .
ATOM 2044 C CD   . ARG Axp A    121 ? 24.877 12.857  4.339   1    86.98   ? 1202 A 1 .
ATOM 2045 N NE   . ARG Axp A    121 ? 25.758 13.482  5.348   1    88.717  ? 1202 A 1 .
ATOM 2046 C CZ   . ARG Axp A    121 ? 25.448 13.943  6.576   1    80.856  ? 1202 A 1 .
ATOM 2047 N NH1  . ARG Axp A    121 ? 24.203 13.903  7.018   1    82.242  ? 1202 A 1 .
ATOM 2048 N NH2  . ARG Axp A    121 ? 26.39  14.43   7.371   1    70.614  ? 1202 A 1 .
ATOM 2049 H H    . ARG Axp A    121 ? 22.937 8.667   3.574   1    75.206  ? 1202 A 1 c
ATOM 2050 H HA   . ARG Axp A    121 ? 25.323 8.689   4.583   1    71.929  ? 1202 A 1 c
ATOM 2051 H HB3  . ARG Axp A    121 ? 24.492 10.708  5.916   1    77.753  ? 1202 A 1 c
ATOM 2052 H HB2  . ARG Axp A    121 ? 23.32  10.608  4.876   1    77.956  ? 1202 A 1 c
ATOM 2053 H HG3  . ARG Axp A    121 ? 24.759 11.141  3.124   1    82.429  ? 1202 A 1 c
ATOM 2054 H HG2  . ARG Axp A    121 ? 26.008 11.097  4.098   1    82.265  ? 1202 A 1 c
ATOM 2055 H HD3  . ARG Axp A    121 ? 23.947 12.995  4.61    1    86.187  ? 1202 A 1 c
ATOM 2056 H HD2  . ARG Axp A    121 ? 24.996 13.33   3.49    1    86.229  ? 1202 A 1 c
ATOM 2057 H HE   . ARG Axp A    121 ? 26.596 13.568  5.123   1    86.266  ? 1202 A 1 c
ATOM 2058 H HH11 . ARG Axp A    121 ? 23.757 13.14   7.004   1    81.813  ? 1202 A 1 c
ATOM 2059 H HH12 . ARG Axp A    121 ? 23.822 14.64   7.325   1    81.813  ? 1202 A 1 c
ATOM 2060 H HH21 . ARG Axp A    121 ? 27.178 14.032  7.414   1    73.621  ? 1202 A 1 c
ATOM 2061 H HH22 . ARG Axp A    121 ? 26.226 15.151  7.855   1    73.621  ? 1202 A 1 c
ATOM 2062 N N    . MET Axp A    122 ? 23.182 8.267   6.977   1    54.035  ? 1203 A 1 .
ATOM 2063 C CA   . MET Axp A    122 ? 23.041 7.87    8.37    1    49.695  ? 1203 A 1 .
ATOM 2064 C C    . MET Axp A    122 ? 23.372 6.393   8.607   1    47.521  ? 1203 A 1 .
ATOM 2065 O O    . MET Axp A    122 ? 23.979 6.055   9.617   1    44.915  ? 1203 A 1 .
ATOM 2066 C CB   . MET Axp A    122 ? 21.621 8.161   8.845   1    50.749  ? 1203 A 1 .
ATOM 2067 C CG   . MET Axp A    122 ? 21.292 9.626   8.836   1    55.049  ? 1203 A 1 .
ATOM 2068 S SD   . MET Axp A    122 ? 22.147 10.526  10.14   1    63.153  ? 1203 A 1 .
ATOM 2069 C CE   . MET Axp A    122 ? 21.694 12.188  9.616   1    63.17   ? 1203 A 1 .
ATOM 2070 H H    . MET Axp A    122 ? 22.438 8.528   6.515   1    55.737  ? 1203 A 1 c
ATOM 2071 H HA   . MET Axp A    122 ? 23.677 8.411   8.903   1    50.409  ? 1203 A 1 c
ATOM 2072 H HB3  . MET Axp A    122 ? 21.516 7.814   9.755   1    51.44   ? 1203 A 1 c
ATOM 2073 H HB2  . MET Axp A    122 ? 20.99  7.685   8.265   1    51.459  ? 1203 A 1 c
ATOM 2074 H HG3  . MET Axp A    122 ? 20.328 9.742   8.953   1    55.403  ? 1203 A 1 c
ATOM 2075 H HG2  . MET Axp A    122 ? 21.538 10.012  7.972   1    55.401  ? 1203 A 1 c
ATOM 2076 H HE3  . MET Axp A    122 ? 20.724 12.284  9.645   1    63.166  ? 1203 A 1 c
ATOM 2077 H HE2  . MET Axp A    122 ? 22.009 12.339  8.706   1    63.166  ? 1203 A 1 c
ATOM 2078 H HE1  . MET Axp A    122 ? 22.103 12.84   10.214  1    63.166  ? 1203 A 1 c
ATOM 2079 N N    . LYS Axp A    123 ? 22.953 5.504   7.702   1    49.204  ? 1204 A 1 .
ATOM 2080 C CA   . LYS Axp A    123 ? 23.291 4.092   7.801   1    49.699  ? 1204 A 1 .
ATOM 2081 C C    . LYS Axp A    123 ? 24.812 3.94    7.759   1    47.77   ? 1204 A 1 .
ATOM 2082 O O    . LYS Axp A    123 ? 25.407 3.394   8.681   1    45.813  ? 1204 A 1 .
ATOM 2083 C CB   . LYS Axp A    123 ? 22.621 3.333   6.65    1    59.851  ? 1204 A 1 .
ATOM 2084 C CG   . LYS Axp A    123 ? 22.662 1.803   6.666   1    70.554  ? 1204 A 1 .
ATOM 2085 C CD   . LYS Axp A    123 ? 22.593 1.181   5.267   1    74.261  ? 1204 A 1 .
ATOM 2086 C CE   . LYS Axp A    123 ? 22.326 -0.299  5.233   1    77.315  ? 1204 A 1 .
ATOM 2087 N NZ   . LYS Axp A    123 ? 20.985 -0.626  5.733   1    81.723  ? 1204 A 1 .
ATOM 2088 H H    . LYS Axp A    123 ? 22.437 5.786   7.003   1    49.087  ? 1204 A 1 c
ATOM 2089 H HA   . LYS Axp A    123 ? 22.955 3.746   8.666   1    50.901  ? 1204 A 1 c
ATOM 2090 H HB3  . LYS Axp A    123 ? 23.032 3.634   5.812   1    59.491  ? 1204 A 1 c
ATOM 2091 H HB2  . LYS Axp A    123 ? 21.679 3.605   6.622   1    59.475  ? 1204 A 1 c
ATOM 2092 H HG3  . LYS Axp A    123 ? 21.907 1.476   7.201   1    68.826  ? 1204 A 1 c
ATOM 2093 H HG2  . LYS Axp A    123 ? 23.49  1.515   7.107   1    68.519  ? 1204 A 1 c
ATOM 2094 H HD3  . LYS Axp A    123 ? 23.443 1.357   4.808   1    74.1    ? 1204 A 1 c
ATOM 2095 H HD2  . LYS Axp A    123 ? 21.889 1.64    4.758   1    74.132  ? 1204 A 1 c
ATOM 2096 H HE3  . LYS Axp A    123 ? 22.988 -0.76   5.778   1    77.62   ? 1204 A 1 c
ATOM 2097 H HE2  . LYS Axp A    123 ? 22.409 -0.622  4.318   1    77.62   ? 1204 A 1 c
ATOM 2098 H HZ1  . LYS Axp A    123 ? 20.38  -0.03   5.417   1    80.238  ? 1204 A 1 c
ATOM 2099 H HZ2  . LYS Axp A    123 ? 20.981 -0.603  6.638   1    80.235  ? 1204 A 1 c
ATOM 2100 H HZ3  . LYS Axp A    123 ? 20.752 -1.457  5.457   1    80.301  ? 1204 A 1 c
ATOM 2101 N N    . THR Axp A    124 ? 25.436 4.472   6.7     1    49.389  ? 1205 A 1 .
ATOM 2102 C CA   . THR Axp A    124 ? 26.859 4.291   6.45    1    49.45   ? 1205 A 1 .
ATOM 2103 C C    . THR Axp A    124 ? 27.656 4.791   7.657   1    47.338  ? 1205 A 1 .
ATOM 2104 O O    . THR Axp A    124 ? 28.468 4.044   8.211   1    44.512  ? 1205 A 1 .
ATOM 2105 C CB   . THR Axp A    124 ? 27.269 4.971   5.138   1    50.777  ? 1205 A 1 .
ATOM 2106 O OG1  . THR Axp A    124 ? 26.314 4.628   4.138   1    45.912  ? 1205 A 1 .
ATOM 2107 C CG2  . THR Axp A    124 ? 28.622 4.503   4.622   1    54.46   ? 1205 A 1 .
ATOM 2108 H H    . THR Axp A    124 ? 24.951 4.97    6.106   1    49.152  ? 1205 A 1 c
ATOM 2109 H HA   . THR Axp A    124 ? 27.024 3.327   6.355   1    49.277  ? 1205 A 1 c
ATOM 2110 H HB   . THR Axp A    124 ? 27.283 5.951   5.257   1    50.183  ? 1205 A 1 c
ATOM 2111 H HG1  . THR Axp A    124 ? 26.254 3.696   4.031   0    45.16   ? 1205 A 1 c
ATOM 2112 H HG21 . THR Axp A    124 ? 28.733 4.784   3.698   1    53.284  ? 1205 A 1 c
ATOM 2113 H HG22 . THR Axp A    124 ? 28.672 3.533   4.672   1    53.3    ? 1205 A 1 c
ATOM 2114 H HG23 . THR Axp A    124 ? 29.329 4.891   5.165   1    53.308  ? 1205 A 1 c
ATOM 2115 N N    . ILE Axp A    125 ? 27.397 6.037   8.08    1    45.509  ? 1206 A 1 .
ATOM 2116 C CA   . ILE Axp A    125 ? 28.098 6.619   9.219   1    45.782  ? 1206 A 1 .
ATOM 2117 C C    . ILE Axp A    125 ? 28.139 5.586   10.344  1    43.059  ? 1206 A 1 .
ATOM 2118 O O    . ILE Axp A    125 ? 29.207 5.175   10.791  1    40.918  ? 1206 A 1 .
ATOM 2119 C CB   . ILE Axp A    125 ? 27.426 7.915   9.708   1    45.957  ? 1206 A 1 .
ATOM 2120 C CG1  . ILE Axp A    125 ? 27.2   8.941   8.57    1    49.073  ? 1206 A 1 .
ATOM 2121 C CG2  . ILE Axp A    125 ? 28.206 8.488   10.895  1    43.381  ? 1206 A 1 .
ATOM 2122 C CD1  . ILE Axp A    125 ? 28     10.228  8.659   1    53.465  ? 1206 A 1 .
ATOM 2123 H H    . ILE Axp A    125 ? 26.757 6.53    7.653   1    46.093  ? 1206 A 1 c
ATOM 2124 H HA   . ILE Axp A    125 ? 29.013 6.826   8.948   1    45.248  ? 1206 A 1 c
ATOM 2125 H HB   . ILE Axp A    125 ? 26.541 7.668   10.04   1    45.918  ? 1206 A 1 c
ATOM 2126 H HG12 . ILE Axp A    125 ? 26.249 9.173   8.551   1    49.447  ? 1206 A 1 c
ATOM 2127 H HG13 . ILE Axp A    125 ? 27.416 8.513   7.718   1    49.396  ? 1206 A 1 c
ATOM 2128 H HG21 . ILE Axp A    125 ? 27.78  9.305   11.203  1    44.121  ? 1206 A 1 c
ATOM 2129 H HG22 . ILE Axp A    125 ? 29.119 8.681   10.624  1    44.105  ? 1206 A 1 c
ATOM 2130 H HG23 . ILE Axp A    125 ? 28.216 7.843   11.62   1    43.833  ? 1206 A 1 c
ATOM 2131 H HD11 . ILE Axp A    125 ? 27.793 10.686  9.494   1    51.886  ? 1206 A 1 c
ATOM 2132 H HD12 . ILE Axp A    125 ? 27.762 10.808  7.912   1    52.033  ? 1206 A 1 c
ATOM 2133 H HD13 . ILE Axp A    125 ? 28.955 10.029  8.625   1    52.012  ? 1206 A 1 c
ATOM 2134 N N    . GLY Axp A    126 ? 26.947 5.164   10.776  1    41.901  ? 1207 A 1 .
ATOM 2135 C CA   . GLY Axp A    126 ? 26.802 4.225   11.873  1    41.427  ? 1207 A 1 .
ATOM 2136 C C    . GLY Axp A    126 ? 27.486 2.894   11.575  1    39.67   ? 1207 A 1 .
ATOM 2137 O O    . GLY Axp A    126 ? 28.16  2.343   12.44   1    35.674  ? 1207 A 1 .
ATOM 2138 H H    . GLY Axp A    126 ? 26.191 5.471   10.364  1    42.161  ? 1207 A 1 c
ATOM 2139 H HA3  . GLY Axp A    126 ? 25.842 4.071   12.04   1    41.105  ? 1207 A 1 c
ATOM 2140 H HA2  . GLY Axp A    126 ? 27.192 4.619   12.686  1    40.956  ? 1207 A 1 c
ATOM 2141 N N    . GLU Axp A    127 ? 27.301 2.409   10.342  1    42.204  ? 1208 A 1 .
ATOM 2142 C CA   . GLU Axp A    127 ? 27.921 1.181   9.857   1    48.768  ? 1208 A 1 .
ATOM 2143 C C    . GLU Axp A    127 ? 29.429 1.229   10.085  1    45.898  ? 1208 A 1 .
ATOM 2144 O O    . GLU Axp A    127 ? 30.031 0.223   10.473  1    38.74   ? 1208 A 1 .
ATOM 2145 C CB   . GLU Axp A    127 ? 27.656 1.062   8.354   1    54.68   ? 1208 A 1 .
ATOM 2146 C CG   . GLU Axp A    127 ? 27.457 -0.358  7.837   1    55.845  ? 1208 A 1 .
ATOM 2147 C CD   . GLU Axp A    127 ? 26.446 -0.387  6.697   1    57.27   ? 1208 A 1 .
ATOM 2148 O OE1  . GLU Axp A    127 ? 25.762 0.62    6.462   1    49.185  ? 1208 A 1 .
ATOM 2149 O OE2  . GLU Axp A    127 ? 26.334 -1.417  6.015   1    74.403  ? 1208 A 1 .
ATOM 2150 H H    . GLU Axp A    127 ? 26.751 2.868   9.775   1    43.113  ? 1208 A 1 c
ATOM 2151 H HA   . GLU Axp A    127 ? 27.534 0.41    10.344  1    47.916  ? 1208 A 1 c
ATOM 2152 H HB3  . GLU Axp A    127 ? 28.412 1.454   7.869   1    53.338  ? 1208 A 1 c
ATOM 2153 H HB2  . GLU Axp A    127 ? 26.863 1.588   8.135   1    53.262  ? 1208 A 1 c
ATOM 2154 H HG3  . GLU Axp A    127 ? 27.135 -0.932  8.564   1    55.796  ? 1208 A 1 c
ATOM 2155 H HG2  . GLU Axp A    127 ? 28.313 -0.713  7.515   1    55.879  ? 1208 A 1 c
ATOM 2156 N N    . HIS Axp A    128 ? 29.993 2.42    9.812   1    44.461  ? 1209 A 1 .
ATOM 2157 C CA   . HIS Axp A    128 ? 31.407 2.7     9.979   1    42.082  ? 1209 A 1 .
ATOM 2158 C C    . HIS Axp A    128 ? 31.731 2.866   11.456  1    36.166  ? 1209 A 1 .
ATOM 2159 O O    . HIS Axp A    128 ? 32.61  2.191   11.975  1    35.156  ? 1209 A 1 .
ATOM 2160 C CB   . HIS Axp A    128 ? 31.818 3.907   9.133   1    43.724  ? 1209 A 1 .
ATOM 2161 C CG   . HIS Axp A    128 ? 32.108 3.53    7.722   1    48.349  ? 1209 A 1 .
ATOM 2162 N ND1  . HIS Axp A    128 ? 31.55  4.169   6.636   1    49.797  ? 1209 A 1 .
ATOM 2163 C CD2  . HIS Axp A    128 ? 32.869 2.546   7.226   1    50.829  ? 1209 A 1 .
ATOM 2164 C CE1  . HIS Axp A    128 ? 31.983 3.601   5.524   1    50.754  ? 1209 A 1 .
ATOM 2165 N NE2  . HIS Axp A    128 ? 32.79  2.617   5.86    1    53.233  ? 1209 A 1 .
ATOM 2166 H H    . HIS Axp A    128 ? 29.459 3.089   9.491   1    44.224  ? 1209 A 1 c
ATOM 2167 H HA   . HIS Axp A    128 ? 31.901 1.912   9.648   1    41.701  ? 1209 A 1 c
ATOM 2168 H HB3  . HIS Axp A    128 ? 32.619 4.315   9.528   1    44.321  ? 1209 A 1 c
ATOM 2169 H HB2  . HIS Axp A    128 ? 31.095 4.571   9.147   1    44.346  ? 1209 A 1 c
ATOM 2170 H HD1  . HIS Axp A    128 ? 31.058 4.896   6.745   0    39.8    ? 1209 A 1 c
ATOM 2171 H HD2  . HIS Axp A    128 ? 33.379 1.93    7.714   1    50.683  ? 1209 A 1 c
ATOM 2172 H HE1  . HIS Axp A    128 ? 31.758 3.859   4.646   1    51.063  ? 1209 A 1 c
ATOM 2173 H HE2  . HIS Axp A    128 ? 33.218 2.118   5.288   0    39.98   ? 1209 A 1 c
ATOM 2174 N N    . ILE Axp A    129 ? 31.023 3.756   12.139  1    32.524  ? 1210 A 1 .
ATOM 2175 C CA   . ILE Axp A    129 ? 31.265 3.894   13.558  1    32.783  ? 1210 A 1 .
ATOM 2176 C C    . ILE Axp A    129 ? 31.501 2.498   14.121  1    35.103  ? 1210 A 1 .
ATOM 2177 O O    . ILE Axp A    129 ? 32.525 2.247   14.749  1    35.013  ? 1210 A 1 .
ATOM 2178 C CB   . ILE Axp A    129 ? 30.131 4.658   14.262  1    31.484  ? 1210 A 1 .
ATOM 2179 C CG1  . ILE Axp A    129 ? 30.219 6.134   13.942  1    30.652  ? 1210 A 1 .
ATOM 2180 C CG2  . ILE Axp A    129 ? 30.145 4.429   15.773  1    31      ? 1210 A 1 .
ATOM 2181 C CD1  . ILE Axp A    129 ? 28.914 6.88    14.091  1    30.554  ? 1210 A 1 .
ATOM 2182 H H    . ILE Axp A    129 ? 30.393 4.276   11.728  1    33.477  ? 1210 A 1 c
ATOM 2183 H HA   . ILE Axp A    129 ? 32.08  4.405   13.674  1    32.936  ? 1210 A 1 c
ATOM 2184 H HB   . ILE Axp A    129 ? 29.281 4.324   13.912  1    31.484  ? 1210 A 1 c
ATOM 2185 H HG12 . ILE Axp A    129 ? 30.536 6.238   13.021  1    30.854  ? 1210 A 1 c
ATOM 2186 H HG13 . ILE Axp A    129 ? 30.883 6.543   14.533  1    30.826  ? 1210 A 1 c
ATOM 2187 H HG21 . ILE Axp A    129 ? 29.727 5.182   16.219  1    31.184  ? 1210 A 1 c
ATOM 2188 H HG22 . ILE Axp A    129 ? 31.062 4.343   16.083  1    31.182  ? 1210 A 1 c
ATOM 2189 H HG23 . ILE Axp A    129 ? 29.655 3.617   15.986  1    31.173  ? 1210 A 1 c
ATOM 2190 H HD11 . ILE Axp A    129 ? 28.228 6.461   13.538  1    30.757  ? 1210 A 1 c
ATOM 2191 H HD12 . ILE Axp A    129 ? 29.033 7.807   13.811  1    30.708  ? 1210 A 1 c
ATOM 2192 H HD13 . ILE Axp A    129 ? 28.637 6.857   15.024  1    30.684  ? 1210 A 1 c
ATOM 2193 N N    . VAL Axp A    130 ? 30.584 1.574   13.83   1    37.699  ? 1211 A 1 .
ATOM 2194 C CA   . VAL Axp A    130 ? 30.664 0.247   14.416  1    38.898  ? 1211 A 1 .
ATOM 2195 C C    . VAL Axp A    130 ? 31.888 -0.466  13.869  1    39.107  ? 1211 A 1 .
ATOM 2196 O O    . VAL Axp A    130 ? 32.647 -1.049  14.637  1    38.792  ? 1211 A 1 .
ATOM 2197 C CB   . VAL Axp A    130 ? 29.431 -0.634  14.175  1    38.51   ? 1211 A 1 .
ATOM 2198 C CG1  . VAL Axp A    130 ? 29.505 -1.907  15.01   1    37.217  ? 1211 A 1 .
ATOM 2199 C CG2  . VAL Axp A    130 ? 28.141 0.128   14.451  1    40.506  ? 1211 A 1 .
ATOM 2200 H H    . VAL Axp A    130 ? 29.899 1.77    13.258  1    37.29   ? 1211 A 1 c
ATOM 2201 H HA   . VAL Axp A    130 ? 30.778 0.351   15.381  1    38.586  ? 1211 A 1 c
ATOM 2202 H HB   . VAL Axp A    130 ? 29.435 -0.891  13.223  1    38.71   ? 1211 A 1 c
ATOM 2203 H HG11 . VAL Axp A    130 ? 29.726 -1.68   15.929  1    37.609  ? 1211 A 1 c
ATOM 2204 H HG12 . VAL Axp A    130 ? 30.188 -2.495  14.649  1    37.61   ? 1211 A 1 c
ATOM 2205 H HG13 . VAL Axp A    130 ? 28.646 -2.361  14.988  1    37.629  ? 1211 A 1 c
ATOM 2206 H HG21 . VAL Axp A    130 ? 27.622 -0.342  15.124  1    39.851  ? 1211 A 1 c
ATOM 2207 H HG22 . VAL Axp A    130 ? 27.621 0.192   13.632  1    39.857  ? 1211 A 1 c
ATOM 2208 H HG23 . VAL Axp A    130 ? 28.348 1.021   14.772  1    39.83   ? 1211 A 1 c
ATOM 2209 N N    . ALA Axp A    131 ? 32.035 -0.411  12.542  1    40.301  ? 1212 A 1 .
ATOM 2210 C CA   . ALA Axp A    131 ? 33.01  -1.216  11.82   1    41.897  ? 1212 A 1 .
ATOM 2211 C C    . ALA Axp A    131 ? 34.455 -0.857  12.19   1    38.448  ? 1212 A 1 .
ATOM 2212 O O    . ALA Axp A    131 ? 35.287 -1.749  12.359  1    34.604  ? 1212 A 1 .
ATOM 2213 C CB   . ALA Axp A    131 ? 32.762 -1.072  10.331  1    44.929  ? 1212 A 1 .
ATOM 2214 H H    . ALA Axp A    131 ? 31.492 0.145   12.062  1    40.369  ? 1212 A 1 c
ATOM 2215 H HA   . ALA Axp A    131 ? 32.862 -2.169  12.074  1    41.462  ? 1212 A 1 c
ATOM 2216 H HB3  . ALA Axp A    131 ? 33.495 -1.478  9.837   1    43.958  ? 1212 A 1 c
ATOM 2217 H HB2  . ALA Axp A    131 ? 32.703 -0.131  10.098  1    43.95   ? 1212 A 1 c
ATOM 2218 H HB1  . ALA Axp A    131 ? 31.931 -1.516  10.093  1    43.96   ? 1212 A 1 c
ATOM 2219 N N    . HIS Axp A    132 ? 34.771 0.441   12.279  1    37.32   ? 1213 A 1 .
ATOM 2220 C CA   . HIS Axp A    132 ? 36.104 0.85    12.685  1    37.818  ? 1213 A 1 .
ATOM 2221 C C    . HIS Axp A    132 ? 36.098 2.134   13.505  1    37.558  ? 1213 A 1 .
ATOM 2222 O O    . HIS Axp A    132 ? 36.764 2.166   14.529  1    39.618  ? 1213 A 1 .
ATOM 2223 C CB   . HIS Axp A    132 ? 37.025 0.999   11.475  1    40.853  ? 1213 A 1 .
ATOM 2224 C CG   . HIS Axp A    132 ? 36.462 1.838   10.383  1    41.669  ? 1213 A 1 .
ATOM 2225 N ND1  . HIS Axp A    132 ? 35.924 3.089   10.574  1    40.912  ? 1213 A 1 .
ATOM 2226 C CD2  . HIS Axp A    132 ? 36.364 1.588   9.075   1    42.603  ? 1213 A 1 .
ATOM 2227 C CE1  . HIS Axp A    132 ? 35.511 3.567   9.412   1    41.603  ? 1213 A 1 .
ATOM 2228 N NE2  . HIS Axp A    132 ? 35.766 2.67    8.494   1    43.836  ? 1213 A 1 .
ATOM 2229 H H    . HIS Axp A    132 ? 34.148 1.077   12.075  1    37.709  ? 1213 A 1 c
ATOM 2230 H HA   . HIS Axp A    132 ? 36.474 0.132   13.256  1    38.198  ? 1213 A 1 c
ATOM 2231 H HB3  . HIS Axp A    132 ? 37.215 0.106   11.116  1    40.211  ? 1213 A 1 c
ATOM 2232 H HB2  . HIS Axp A    132 ? 37.874 1.386   11.772  1    40.197  ? 1213 A 1 c
ATOM 2233 H HD1  . HIS Axp A    132 ? 35.84  3.445   11.381  0    32.11   ? 1213 A 1 c
ATOM 2234 H HD2  . HIS Axp A    132 ? 36.641 0.811   8.63    1    42.635  ? 1213 A 1 c
ATOM 2235 H HE1  . HIS Axp A    132 ? 35.107 4.404   9.267   1    41.865  ? 1213 A 1 c
ATOM 2236 H HE2  . HIS Axp A    132 ? 35.632 2.772   7.644   0    34.09   ? 1213 A 1 c
ATOM 2237 N N    . ILE Axp A    133 ? 35.36  3.173   13.079  1    35.818  ? 1214 A 1 .
ATOM 2238 C CA   . ILE Axp A    133 ? 35.547 4.51    13.629  1    34.546  ? 1214 A 1 .
ATOM 2239 C C    . ILE Axp A    133 ? 35.565 4.454   15.152  1    34.43   ? 1214 A 1 .
ATOM 2240 O O    . ILE Axp A    133 ? 36.33  5.174   15.776  1    35.091  ? 1214 A 1 .
ATOM 2241 C CB   . ILE Axp A    133 ? 34.487 5.521   13.156  1    35.298  ? 1214 A 1 .
ATOM 2242 C CG1  . ILE Axp A    133 ? 34.589 5.824   11.674  1    36.428  ? 1214 A 1 .
ATOM 2243 C CG2  . ILE Axp A    133 ? 34.57  6.806   13.978  1    35.491  ? 1214 A 1 .
ATOM 2244 C CD1  . ILE Axp A    133 ? 33.635 6.898   11.182  1    35.629  ? 1214 A 1 .
ATOM 2245 H H    . ILE Axp A    133 ? 34.704 3.04    12.458  1    35.996  ? 1214 A 1 c
ATOM 2246 H HA   . ILE Axp A    133 ? 36.419 4.833   13.33   1    34.905  ? 1214 A 1 c
ATOM 2247 H HB   . ILE Axp A    133 ? 33.615 5.126   13.314  1    35.367  ? 1214 A 1 c
ATOM 2248 H HG12 . ILE Axp A    133 ? 34.404 5.002   11.181  1    36.051  ? 1214 A 1 c
ATOM 2249 H HG13 . ILE Axp A    133 ? 35.505 6.096   11.471  1    35.845  ? 1214 A 1 c
ATOM 2250 H HG21 . ILE Axp A    133 ? 34.055 7.507   13.548  1    35.445  ? 1214 A 1 c
ATOM 2251 H HG22 . ILE Axp A    133 ? 35.498 7.087   14.05   1    35.429  ? 1214 A 1 c
ATOM 2252 H HG23 . ILE Axp A    133 ? 34.212 6.649   14.868  1    35.43   ? 1214 A 1 c
ATOM 2253 H HD11 . ILE Axp A    133 ? 32.817 6.883   11.714  1    35.862  ? 1214 A 1 c
ATOM 2254 H HD12 . ILE Axp A    133 ? 33.414 6.729   10.246  1    35.869  ? 1214 A 1 c
ATOM 2255 H HD13 . ILE Axp A    133 ? 34.058 7.774   11.261  1    35.893  ? 1214 A 1 c
ATOM 2256 N N    . GLN Axp A    134 ? 34.731 3.616   15.765  1    34.753  ? 1215 A 1 .
ATOM 2257 C CA   . GLN Axp A    134 ? 34.685 3.588   17.213  1    36.63   ? 1215 A 1 .
ATOM 2258 C C    . GLN Axp A    134 ? 36.053 3.233   17.784  1    36.27   ? 1215 A 1 .
ATOM 2259 O O    . GLN Axp A    134 ? 36.368 3.678   18.873  1    43.247  ? 1215 A 1 .
ATOM 2260 C CB   . GLN Axp A    134 ? 33.611 2.673   17.79   1    41.279  ? 1215 A 1 .
ATOM 2261 C CG   . GLN Axp A    134 ? 33.831 1.191   17.506  1    46.717  ? 1215 A 1 .
ATOM 2262 C CD   . GLN Axp A    134 ? 32.841 0.294   18.221  1    49.513  ? 1215 A 1 .
ATOM 2263 O OE1  . GLN Axp A    134 ? 32.315 0.615   19.298  1    47.597  ? 1215 A 1 .
ATOM 2264 N NE2  . GLN Axp A    134 ? 32.61  -0.871  17.632  1    51.89   ? 1215 A 1 .
ATOM 2265 H H    . GLN Axp A    134 ? 34.177 3.07    15.285  1    35.139  ? 1215 A 1 c
ATOM 2266 H HA   . GLN Axp A    134 ? 34.466 4.505   17.518  1    36.984  ? 1215 A 1 c
ATOM 2267 H HB3  . GLN Axp A    134 ? 32.742 2.94    17.423  1    41.322  ? 1215 A 1 c
ATOM 2268 H HB2  . GLN Axp A    134 ? 33.576 2.808   18.76   1    41.346  ? 1215 A 1 c
ATOM 2269 H HG3  . GLN Axp A    134 ? 34.735 0.937   17.785  1    45.92   ? 1215 A 1 c
ATOM 2270 H HG2  . GLN Axp A    134 ? 33.763 1.033   16.541  1    46.003  ? 1215 A 1 c
ATOM 2271 H HE21 . GLN Axp A    134 ? 31.966 -1.398  17.937  1    51.091  ? 1215 A 1 c
ATOM 2272 H HE22 . GLN Axp A    134 ? 33.097 -1.125  16.936  1    51.022  ? 1215 A 1 c
ATOM 2273 N N    . HIS Axp A    135 ? 36.876 2.451   17.082  1    35.743  ? 1216 A 1 .
ATOM 2274 C CA   . HIS Axp A    135 ? 38.189 2.115   17.619  1    37.501  ? 1216 A 1 .
ATOM 2275 C C    . HIS Axp A    135 ? 39.223 3.165   17.222  1    34.077  ? 1216 A 1 .
ATOM 2276 O O    . HIS Axp A    135 ? 40.283 3.259   17.824  1    33.832  ? 1216 A 1 .
ATOM 2277 C CB   . HIS Axp A    135 ? 38.598 0.689   17.236  1    41.099  ? 1216 A 1 .
ATOM 2278 C CG   . HIS Axp A    135 ? 37.533 -0.288  17.583  1    43.867  ? 1216 A 1 .
ATOM 2279 N ND1  . HIS Axp A    135 ? 36.749 -0.892  16.623  1    46.323  ? 1216 A 1 .
ATOM 2280 C CD2  . HIS Axp A    135 ? 37.1   -0.729  18.765  1    45.003  ? 1216 A 1 .
ATOM 2281 C CE1  . HIS Axp A    135 ? 35.872 -1.689  17.213  1    48.199  ? 1216 A 1 .
ATOM 2282 N NE2  . HIS Axp A    135 ? 36.062 -1.593  18.516  1    50.943  ? 1216 A 1 .
ATOM 2283 H H    . HIS Axp A    135 ? 36.62  2.11    16.274  1    36.278  ? 1216 A 1 c
ATOM 2284 H HA   . HIS Axp A    135 ? 38.113 2.129   18.604  1    37.161  ? 1216 A 1 c
ATOM 2285 H HB3  . HIS Axp A    135 ? 39.423 0.453   17.713  1    40.878  ? 1216 A 1 c
ATOM 2286 H HB2  . HIS Axp A    135 ? 38.768 0.653   16.269  1    40.878  ? 1216 A 1 c
ATOM 2287 H HD1  . HIS Axp A    135 ? 36.822 -0.784  15.801  0    36.18   ? 1216 A 1 c
ATOM 2288 H HD2  . HIS Axp A    135 ? 37.428 -0.49   19.61   1    45.997  ? 1216 A 1 c
ATOM 2289 H HE1  . HIS Axp A    135 ? 35.226 -2.222  16.783  1    48.336  ? 1216 A 1 c
ATOM 2290 H HE2  . HIS Axp A    135 ? 35.513 -2.038  19.156  0    37.75   ? 1216 A 1 c
ATOM 2291 N N    . GLU Axp A    136 ? 38.893 3.986   16.23   1    33.507  ? 1217 A 1 .
ATOM 2292 C CA   . GLU Axp A    136 ? 39.885 4.837   15.601  1    33.751  ? 1217 A 1 .
ATOM 2293 C C    . GLU Axp A    136 ? 39.92  6.199   16.283  1    32.354  ? 1217 A 1 .
ATOM 2294 O O    . GLU Axp A    136 ? 40.952 6.855   16.237  1    35.282  ? 1217 A 1 .
ATOM 2295 C CB   . GLU Axp A    136 ? 39.616 4.926   14.098  1    34.107  ? 1217 A 1 .
ATOM 2296 C CG   . GLU Axp A    136 ? 39.284 3.558   13.513  1    35.546  ? 1217 A 1 .
ATOM 2297 C CD   . GLU Axp A    136 ? 39.337 3.409   12.013  1    36.385  ? 1217 A 1 .
ATOM 2298 O OE1  . GLU Axp A    136 ? 38.478 3.943   11.28   1    37.887  ? 1217 A 1 .
ATOM 2299 O OE2  . GLU Axp A    136 ? 40.275 2.714   11.594  1    36.008  ? 1217 A 1 .
ATOM 2300 H H    . GLU Axp A    136 ? 38.029 4.026   15.939  1    33.754  ? 1217 A 1 c
ATOM 2301 H HA   . GLU Axp A    136 ? 40.773 4.413   15.717  1    33.512  ? 1217 A 1 c
ATOM 2302 H HB3  . GLU Axp A    136 ? 40.404 5.3     13.651  1    34.333  ? 1217 A 1 c
ATOM 2303 H HB2  . GLU Axp A    136 ? 38.865 5.535   13.947  1    34.287  ? 1217 A 1 c
ATOM 2304 H HG3  . GLU Axp A    136 ? 38.385 3.315   13.801  1    35.424  ? 1217 A 1 c
ATOM 2305 H HG2  . GLU Axp A    136 ? 39.892 2.897   13.905  1    35.4    ? 1217 A 1 c
ATOM 2306 N N    . VAL Axp A    137 ? 38.817 6.632   16.903  1    29.659  ? 1218 A 1 .
ATOM 2307 C CA   . VAL Axp A    137 ? 38.726 8.018   17.331  1    30.679  ? 1218 A 1 .
ATOM 2308 C C    . VAL Axp A    137 ? 37.915 8.127   18.618  1    30.231  ? 1218 A 1 .
ATOM 2309 O O    . VAL Axp A    137 ? 37.041 7.313   18.886  1    29.69   ? 1218 A 1 .
ATOM 2310 C CB   . VAL Axp A    137 ? 38.111 8.938   16.256  1    34.131  ? 1218 A 1 .
ATOM 2311 C CG1  . VAL Axp A    137 ? 38.636 8.643   14.853  1    35.407  ? 1218 A 1 .
ATOM 2312 C CG2  . VAL Axp A    137 ? 36.585 8.904   16.273  1    34.731  ? 1218 A 1 .
ATOM 2313 H H    . VAL Axp A    137 ? 38.117 6.067   17.06   1    30.556  ? 1218 A 1 c
ATOM 2314 H HA   . VAL Axp A    137 ? 39.63  8.336   17.519  1    31.006  ? 1218 A 1 c
ATOM 2315 H HB   . VAL Axp A    137 ? 38.381 9.857   16.478  1    33.771  ? 1218 A 1 c
ATOM 2316 H HG11 . VAL Axp A    137 ? 38.302 7.78    14.558  1    34.888  ? 1218 A 1 c
ATOM 2317 H HG12 . VAL Axp A    137 ? 39.607 8.628   14.863  1    34.916  ? 1218 A 1 c
ATOM 2318 H HG13 . VAL Axp A    137 ? 38.332 9.332   14.242  1    34.908  ? 1218 A 1 c
ATOM 2319 H HG21 . VAL Axp A    137 ? 36.243 9.324   15.466  1    34.537  ? 1218 A 1 c
ATOM 2320 H HG22 . VAL Axp A    137 ? 36.256 9.385   17.05   1    34.481  ? 1218 A 1 c
ATOM 2321 H HG23 . VAL Axp A    137 ? 36.28  7.982   16.31   1    34.516  ? 1218 A 1 c
ATOM 2322 N N    . ASP Axp A    138 ? 38.176 9.208   19.363  1    29.913  ? 1219 A 1 .
ATOM 2323 C CA   . ASP Axp A    138 ? 37.556 9.457   20.647  1    29.124  ? 1219 A 1 .
ATOM 2324 C C    . ASP Axp A    138 ? 36.328 10.331  20.441  1    29.924  ? 1219 A 1 .
ATOM 2325 O O    . ASP Axp A    138 ? 35.435 10.319  21.279  1    31.307  ? 1219 A 1 .
ATOM 2326 C CB   . ASP Axp A    138 ? 38.572 10.05   21.604  1    30.362  ? 1219 A 1 .
ATOM 2327 C CG   . ASP Axp A    138 ? 39.87  9.261   21.701  1    36.058  ? 1219 A 1 .
ATOM 2328 O OD1  . ASP Axp A    138 ? 40.752 9.465   20.831  1    43.75   ? 1219 A 1 .
ATOM 2329 O OD2  . ASP Axp A    138 ? 39.971 8.393   22.601  1    38.905  ? 1219 A 1 .
ATOM 2330 H H    . ASP Axp A    138 ? 38.784 9.816   19.051  1    29.863  ? 1219 A 1 c
ATOM 2331 H HA   . ASP Axp A    138 ? 37.266 8.595   21.024  1    29.654  ? 1219 A 1 c
ATOM 2332 H HB3  . ASP Axp A    138 ? 38.174 10.102  22.499  1    31.287  ? 1219 A 1 c
ATOM 2333 H HB2  . ASP Axp A    138 ? 38.78  10.961  21.31   1    31.302  ? 1219 A 1 c
ATOM 2334 N N    . PHE Axp A    139 ? 36.323 11.103  19.342  1    31.354  ? 1220 A 1 .
ATOM 2335 C CA   . PHE Axp A    139 ? 35.219 11.971  18.954  1    30.675  ? 1220 A 1 .
ATOM 2336 C C    . PHE Axp A    139 ? 35.067 11.943  17.435  1    31.759  ? 1220 A 1 .
ATOM 2337 O O    . PHE Axp A    139 ? 36.048 11.99   16.688  1    29.75   ? 1220 A 1 .
ATOM 2338 C CB   . PHE Axp A    139 ? 35.403 13.427  19.391  1    29.075  ? 1220 A 1 .
ATOM 2339 C CG   . PHE Axp A    139 ? 35.402 13.582  20.897  1    28.7    ? 1220 A 1 .
ATOM 2340 C CD1  . PHE Axp A    139 ? 36.568 13.428  21.629  1    28.484  ? 1220 A 1 .
ATOM 2341 C CD2  . PHE Axp A    139 ? 34.222 13.823  21.578  1    30.912  ? 1220 A 1 .
ATOM 2342 C CE1  . PHE Axp A    139 ? 36.559 13.542  23.006  1    28.762  ? 1220 A 1 .
ATOM 2343 C CE2  . PHE Axp A    139 ? 34.217 13.937  22.962  1    31.949  ? 1220 A 1 .
ATOM 2344 C CZ   . PHE Axp A    139 ? 35.384 13.798  23.67   1    30.425  ? 1220 A 1 .
ATOM 2345 H H    . PHE Axp A    139 ? 37.062 11.096  18.806  1    30.831  ? 1220 A 1 c
ATOM 2346 H HA   . PHE Axp A    139 ? 34.384 11.622  19.365  1    30.725  ? 1220 A 1 c
ATOM 2347 H HB3  . PHE Axp A    139 ? 34.675 13.967  19.011  1    29.353  ? 1220 A 1 c
ATOM 2348 H HB2  . PHE Axp A    139 ? 36.256 13.759  19.034  1    29.336  ? 1220 A 1 c
ATOM 2349 H HD1  . PHE Axp A    139 ? 37.38  13.253  21.18   1    28.646  ? 1220 A 1 c
ATOM 2350 H HD2  . PHE Axp A    139 ? 33.416 13.918  21.096  1    30.565  ? 1220 A 1 c
ATOM 2351 H HE1  . PHE Axp A    139 ? 37.364 13.449  23.491  1    29.106  ? 1220 A 1 c
ATOM 2352 H HE2  . PHE Axp A    139 ? 33.411 14.112  23.417  1    31.235  ? 1220 A 1 c
ATOM 2353 H HZ   . PHE Axp A    139 ? 35.38  13.879  24.611  1    30.352  ? 1220 A 1 c
ATOM 2354 N N    . LEU Axp A    140 ? 33.808 11.873  16.998  1    33.674  ? 1221 A 1 .
ATOM 2355 C CA   . LEU Axp A    140 ? 33.497 11.923  15.588  1    34.236  ? 1221 A 1 .
ATOM 2356 C C    . LEU Axp A    140 ? 32.7   13.184  15.27   1    32.557  ? 1221 A 1 .
ATOM 2357 O O    . LEU Axp A    140 ? 31.84  13.594  16.041  1    31.805  ? 1221 A 1 .
ATOM 2358 C CB   . LEU Axp A    140 ? 32.726 10.678  15.174  1    35.927  ? 1221 A 1 .
ATOM 2359 C CG   . LEU Axp A    140 ? 32.333 10.68   13.694  1    40.603  ? 1221 A 1 .
ATOM 2360 C CD1  . LEU Axp A    140 ? 33.552 10.639  12.752  1    41.761  ? 1221 A 1 .
ATOM 2361 C CD2  . LEU Axp A    140 ? 31.382 9.544   13.414  1    42.023  ? 1221 A 1 .
ATOM 2362 H H    . LEU Axp A    140 ? 33.123 11.794  17.598  1    33.289  ? 1221 A 1 c
ATOM 2363 H HA   . LEU Axp A    140 ? 34.347 11.954  15.086  1    34.074  ? 1221 A 1 c
ATOM 2364 H HB3  . LEU Axp A    140 ? 31.909 10.622  15.72   1    36.59   ? 1221 A 1 c
ATOM 2365 H HB2  . LEU Axp A    140 ? 33.287 9.889   15.352  1    36.542  ? 1221 A 1 c
ATOM 2366 H HG   . LEU Axp A    140 ? 31.843 11.521  13.509  1    40.065  ? 1221 A 1 c
ATOM 2367 H HD11 . LEU Axp A    140 ? 34.368 10.55   13.276  1    41.276  ? 1221 A 1 c
ATOM 2368 H HD12 . LEU Axp A    140 ? 33.589 11.461  12.233  1    41.379  ? 1221 A 1 c
ATOM 2369 H HD13 . LEU Axp A    140 ? 33.473 9.88    12.149  1    41.352  ? 1221 A 1 c
ATOM 2370 H HD21 . LEU Axp A    140 ? 30.731 9.479   14.132  1    41.438  ? 1221 A 1 c
ATOM 2371 H HD22 . LEU Axp A    140 ? 31.879 8.711   13.354  1    41.557  ? 1221 A 1 c
ATOM 2372 H HD23 . LEU Axp A    140 ? 30.921 9.706   12.574  1    41.558  ? 1221 A 1 c
ATOM 2373 N N    . PHE Axp A    141 ? 32.983 13.753  14.094  1    31.471  ? 1222 A 1 .
ATOM 2374 C CA   . PHE Axp A    141 ? 32.197 14.826  13.52   1    30.152  ? 1222 A 1 .
ATOM 2375 C C    . PHE Axp A    141 ? 31.75  14.448  12.117  1    31.621  ? 1222 A 1 .
ATOM 2376 O O    . PHE Axp A    141 ? 32.562 14.047  11.288  1    34.116  ? 1222 A 1 .
ATOM 2377 C CB   . PHE Axp A    141 ? 33.038 16.096  13.453  1    28.719  ? 1222 A 1 .
ATOM 2378 C CG   . PHE Axp A    141 ? 32.8   17.008  14.638  1    27.59   ? 1222 A 1 .
ATOM 2379 C CD1  . PHE Axp A    141 ? 31.649 17.777  14.697  1    26.882  ? 1222 A 1 .
ATOM 2380 C CD2  . PHE Axp A    141 ? 33.734 17.11   15.661  1    27.908  ? 1222 A 1 .
ATOM 2381 C CE1  . PHE Axp A    141 ? 31.431 18.614  15.765  1    27.873  ? 1222 A 1 .
ATOM 2382 C CE2  . PHE Axp A    141 ? 33.517 17.957  16.728  1    27.803  ? 1222 A 1 .
ATOM 2383 C CZ   . PHE Axp A    141 ? 32.363 18.699  16.781  1    28.837  ? 1222 A 1 .
ATOM 2384 H H    . PHE Axp A    141 ? 33.708 13.452  13.625  1    31.46   ? 1222 A 1 c
ATOM 2385 H HA   . PHE Axp A    141 ? 31.398 14.99   14.087  1    30.414  ? 1222 A 1 c
ATOM 2386 H HB3  . PHE Axp A    141 ? 32.819 16.58   12.625  1    28.825  ? 1222 A 1 c
ATOM 2387 H HB2  . PHE Axp A    141 ? 33.988 15.846  13.423  1    28.788  ? 1222 A 1 c
ATOM 2388 H HD1  . PHE Axp A    141 ? 31.009 17.717  14.006  1    27.303  ? 1222 A 1 c
ATOM 2389 H HD2  . PHE Axp A    141 ? 34.524 16.596  15.623  1    27.827  ? 1222 A 1 c
ATOM 2390 H HE1  . PHE Axp A    141 ? 30.642 19.13   15.805  1    27.857  ? 1222 A 1 c
ATOM 2391 H HE2  . PHE Axp A    141 ? 34.15  18.015  17.423  1    28.02   ? 1222 A 1 c
ATOM 2392 H HZ   . PHE Axp A    141 ? 32.211 19.278  17.51   1    28.314  ? 1222 A 1 c
ATOM 2393 N N    . CYS Axp A    142 ? 30.456 14.608  11.844  1    32.661  ? 1223 A 1 .
ATOM 2394 C CA   . CYS Axp A    142 ? 29.962 14.378  10.502  1    34.65   ? 1223 A 1 .
ATOM 2395 C C    . CYS Axp A    142 ? 29.471 15.703  9.945   1    36.61   ? 1223 A 1 .
ATOM 2396 O O    . CYS Axp A    142 ? 28.547 16.317  10.497  1    38.107  ? 1223 A 1 .
ATOM 2397 C CB   . CYS Axp A    142 ? 28.824 13.37   10.453  1    35.053  ? 1223 A 1 .
ATOM 2398 S SG   . CYS Axp A    142 ? 28.861 12.15   11.787  1    34.119  ? 1223 A 1 .
ATOM 2399 H H    . CYS Axp A    142 ? 29.872 14.862  12.5    1    32.803  ? 1223 A 1 c
ATOM 2400 H HA   . CYS Axp A    142 ? 30.71  14.056  9.941   1    34.656  ? 1223 A 1 c
ATOM 2401 H HB3  . CYS Axp A    142 ? 28.852 12.894  9.594   1    34.766  ? 1223 A 1 c
ATOM 2402 H HB2  . CYS Axp A    142 ? 27.967 13.85   10.5    1    34.804  ? 1223 A 1 c
ATOM 2403 H HG   . CYS Axp A    142 ? 27.887 11.572  11.427  0    24.35   ? 1223 A 1 c
ATOM 2404 N N    . MET Axp A    143 ? 30.1   16.12   8.845   1    36.17   ? 1224 A 1 .
ATOM 2405 C CA   . MET Axp A    143 ? 29.698 17.356  8.212   1    36.117  ? 1224 A 1 .
ATOM 2406 C C    . MET Axp A    143 ? 29.436 17.179  6.72    1    35.478  ? 1224 A 1 .
ATOM 2407 O O    . MET Axp A    143 ? 30.088 16.405  6.037   1    35.09   ? 1224 A 1 .
ATOM 2408 C CB   . MET Axp A    143 ? 30.692 18.498  8.476   1    36.855  ? 1224 A 1 .
ATOM 2409 C CG   . MET Axp A    143 ? 32.074 18.147  8.982   1    35.632  ? 1224 A 1 .
ATOM 2410 S SD   . MET Axp A    143 ? 32.775 19.68   9.634   1    34.552  ? 1224 A 1 .
ATOM 2411 C CE   . MET Axp A    143 ? 32.73  19.388  11.408  1    34.79   ? 1224 A 1 .
ATOM 2412 H H    . MET Axp A    143 ? 30.784 15.632  8.484   1    36.233  ? 1224 A 1 c
ATOM 2413 H HA   . MET Axp A    143 ? 28.834 17.611  8.617   1    36.195  ? 1224 A 1 c
ATOM 2414 H HB3  . MET Axp A    143 ? 30.278 19.105  9.124   1    36.42   ? 1224 A 1 c
ATOM 2415 H HB2  . MET Axp A    143 ? 30.797 19.002  7.641   1    36.474  ? 1224 A 1 c
ATOM 2416 H HG3  . MET Axp A    143 ? 32.629 17.804  8.257   1    35.638  ? 1224 A 1 c
ATOM 2417 H HG2  . MET Axp A    143 ? 32.023 17.477  9.692   1    35.7    ? 1224 A 1 c
ATOM 2418 H HE3  . MET Axp A    143 ? 33.371 18.692  11.64   1    34.627  ? 1224 A 1 c
ATOM 2419 H HE2  . MET Axp A    143 ? 31.834 19.104  11.667  1    34.704  ? 1224 A 1 c
ATOM 2420 H HE1  . MET Axp A    143 ? 32.959 20.211  11.878  1    34.704  ? 1224 A 1 c
ATOM 2421 N N    . ASP Axp A    144 ? 28.455 17.936  6.233   1    38.919  ? 1225 A 1 .
ATOM 2422 C CA   . ASP Axp A    144 ? 28.259 18.151  4.81    1    44.216  ? 1225 A 1 .
ATOM 2423 C C    . ASP Axp A    144 ? 29.546 18.708  4.183   1    45.395  ? 1225 A 1 .
ATOM 2424 O O    . ASP Axp A    144 ? 30.335 19.409  4.82    1    44.479  ? 1225 A 1 .
ATOM 2425 C CB   . ASP Axp A    144 ? 27.055 19.059  4.581   1    46.524  ? 1225 A 1 .
ATOM 2426 C CG   . ASP Axp A    144 ? 25.685 18.492  4.938   1    50.006  ? 1225 A 1 .
ATOM 2427 O OD1  . ASP Axp A    144 ? 25.588 17.27   5.225   1    57.497  ? 1225 A 1 .
ATOM 2428 O OD2  . ASP Axp A    144 ? 24.715 19.275  4.928   1    51.134  ? 1225 A 1 .
ATOM 2429 H H    . ASP Axp A    144 ? 27.879 18.341  6.816   1    39.232  ? 1225 A 1 c
ATOM 2430 H HA   . ASP Axp A    144 ? 28.063 17.281  4.394   1    43.81   ? 1225 A 1 c
ATOM 2431 H HB3  . ASP Axp A    144 ? 27.035 19.295  3.632   1    46.765  ? 1225 A 1 c
ATOM 2432 H HB2  . ASP Axp A    144 ? 27.184 19.885  5.093   1    46.757  ? 1225 A 1 c
ATOM 2433 N N    . VAL Axp A    145 ? 29.748 18.423  2.895   1    43.678  ? 1226 A 1 .
ATOM 2434 C CA   . VAL Axp A    145 ? 30.961 18.842  2.21    1    43.257  ? 1226 A 1 .
ATOM 2435 C C    . VAL Axp A    145 ? 30.857 20.288  1.725   1    45.804  ? 1226 A 1 .
ATOM 2436 O O    . VAL Axp A    145 ? 31.88  20.922  1.464   1    50.727  ? 1226 A 1 .
ATOM 2437 C CB   . VAL Axp A    145 ? 31.233 17.894  1.031   1    43.196  ? 1226 A 1 .
ATOM 2438 C CG1  . VAL Axp A    145 ? 30.221 18.087  -0.084  1    46.207  ? 1226 A 1 .
ATOM 2439 C CG2  . VAL Axp A    145 ? 32.64  18.035  0.483   1    42.43   ? 1226 A 1 .
ATOM 2440 H H    . VAL Axp A    145 ? 29.116 17.951  2.434   1    44.004  ? 1226 A 1 c
ATOM 2441 H HA   . VAL Axp A    145 ? 31.709 18.778  2.836   1    43.791  ? 1226 A 1 c
ATOM 2442 H HB   . VAL Axp A    145 ? 31.134 16.974  1.371   1    43.551  ? 1226 A 1 c
ATOM 2443 H HG11 . VAL Axp A    145 ? 30.508 18.812  -0.664  1    45.285  ? 1226 A 1 c
ATOM 2444 H HG12 . VAL Axp A    145 ? 29.352 18.302  0.294   1    45.266  ? 1226 A 1 c
ATOM 2445 H HG13 . VAL Axp A    145 ? 30.152 17.268  -0.603  1    45.287  ? 1226 A 1 c
ATOM 2446 H HG21 . VAL Axp A    145 ? 32.829 17.291  -0.113  1    42.663  ? 1226 A 1 c
ATOM 2447 H HG22 . VAL Axp A    145 ? 33.277 18.03   1.217   1    42.676  ? 1226 A 1 c
ATOM 2448 H HG23 . VAL Axp A    145 ? 32.719 18.87   -0.007  1    42.766  ? 1226 A 1 c
ATOM 2449 N N    . ASP Axp A    146 ? 29.628 20.802  1.57    1    47.044  ? 1227 A 1 .
ATOM 2450 C CA   . ASP Axp A    146 ? 29.41  22.088  0.92    1    45.983  ? 1227 A 1 .
ATOM 2451 C C    . ASP Axp A    146 ? 29.66  23.215  1.919   1    44.923  ? 1227 A 1 .
ATOM 2452 O O    . ASP Axp A    146 ? 28.865 24.146  2.035   1    46.696  ? 1227 A 1 .
ATOM 2453 C CB   . ASP Axp A    146 ? 28.048 22.164  0.247   1    45.179  ? 1227 A 1 .
ATOM 2454 C CG   . ASP Axp A    146 ? 26.866 21.818  1.138   1    46.89   ? 1227 A 1 .
ATOM 2455 O OD1  . ASP Axp A    146 ? 27.097 21.234  2.218   1    49.321  ? 1227 A 1 .
ATOM 2456 O OD2  . ASP Axp A    146 ? 25.728 22.146  0.754   1    49.285  ? 1227 A 1 .
ATOM 2457 H H    . ASP Axp A    146 ? 28.905 20.336  1.877   1    46.449  ? 1227 A 1 c
ATOM 2458 H HA   . ASP Axp A    146 ? 30.072 22.176  0.197   1    45.862  ? 1227 A 1 c
ATOM 2459 H HB3  . ASP Axp A    146 ? 28.044 21.544  -0.513  1    45.763  ? 1227 A 1 c
ATOM 2460 H HB2  . ASP Axp A    146 ? 27.915 23.068  -0.106  1    45.757  ? 1227 A 1 c
ATOM 2461 N N    . GLN Axp A    147 ? 30.804 23.137  2.6     1    42.4    ? 1228 A 1 .
ATOM 2462 C CA   . GLN Axp A    147 ? 31.233 24.171  3.516   1    41.726  ? 1228 A 1 .
ATOM 2463 C C    . GLN Axp A    147 ? 32.745 24.125  3.584   1    40.993  ? 1228 A 1 .
ATOM 2464 O O    . GLN Axp A    147 ? 33.321 23.153  3.115   1    45.944  ? 1228 A 1 .
ATOM 2465 C CB   . GLN Axp A    147 ? 30.608 23.937  4.882   1    42.423  ? 1228 A 1 .
ATOM 2466 C CG   . GLN Axp A    147 ? 30.334 22.475  5.198   1    41.868  ? 1228 A 1 .
ATOM 2467 C CD   . GLN Axp A    147 ? 29.422 22.329  6.395   1    42.609  ? 1228 A 1 .
ATOM 2468 O OE1  . GLN Axp A    147 ? 28.719 23.264  6.805   1    40.237  ? 1228 A 1 .
ATOM 2469 N NE2  . GLN Axp A    147 ? 29.434 21.138  6.968   1    43.868  ? 1228 A 1 .
ATOM 2470 H H    . GLN Axp A    147 ? 31.348 22.414  2.477   1    42.888  ? 1228 A 1 c
ATOM 2471 H HA   . GLN Axp A    147 ? 30.951 25.053  3.161   1    41.887  ? 1228 A 1 c
ATOM 2472 H HB3  . GLN Axp A    147 ? 29.765 24.435  4.923   1    42.122  ? 1228 A 1 c
ATOM 2473 H HB2  . GLN Axp A    147 ? 31.202 24.306  5.567   1    42.112  ? 1228 A 1 c
ATOM 2474 H HG3  . GLN Axp A    147 ? 31.181 22.015  5.38    1    42.167  ? 1228 A 1 c
ATOM 2475 H HG2  . GLN Axp A    147 ? 29.914 22.041  4.427   1    42.188  ? 1228 A 1 c
ATOM 2476 H HE21 . GLN Axp A    147 ? 29.584 21.068  7.84    1    43.417  ? 1228 A 1 c
ATOM 2477 H HE22 . GLN Axp A    147 ? 29.292 20.413  6.481   1    43.385  ? 1228 A 1 c
ATOM 2478 N N    . VAL Axp A    148 ? 33.354 25.173  4.146   1    38.629  ? 1229 A 1 .
ATOM 2479 C CA   . VAL Axp A    148 ? 34.8   25.313  4.146   1    36.909  ? 1229 A 1 .
ATOM 2480 C C    . VAL Axp A    148 ? 35.227 25.909  5.467   1    35.935  ? 1229 A 1 .
ATOM 2481 O O    . VAL Axp A    148 ? 34.635 26.875  5.934   1    37.707  ? 1229 A 1 .
ATOM 2482 C CB   . VAL Axp A    148 ? 35.313 26.202  3.012   1    37.624  ? 1229 A 1 .
ATOM 2483 C CG1  . VAL Axp A    148 ? 35.188 25.506  1.672   1    41.954  ? 1229 A 1 .
ATOM 2484 C CG2  . VAL Axp A    148 ? 34.561 27.518  2.988   1    40.667  ? 1229 A 1 .
ATOM 2485 H H    . VAL Axp A    148 ? 32.849 25.819  4.55    1    38.796  ? 1229 A 1 c
ATOM 2486 H HA   . VAL Axp A    148 ? 35.201 24.427  4.055   1    37.215  ? 1229 A 1 c
ATOM 2487 H HB   . VAL Axp A    148 ? 36.266 26.386  3.183   1    38.799  ? 1229 A 1 c
ATOM 2488 H HG11 . VAL Axp A    148 ? 34.263 25.248  1.524   1    40.662  ? 1229 A 1 c
ATOM 2489 H HG12 . VAL Axp A    148 ? 35.749 24.713  1.663   1    40.661  ? 1229 A 1 c
ATOM 2490 H HG13 . VAL Axp A    148 ? 35.47  26.108  0.967   1    40.785  ? 1229 A 1 c
ATOM 2491 H HG21 . VAL Axp A    148 ? 34.744 27.981  2.153   1    39.75   ? 1229 A 1 c
ATOM 2492 H HG22 . VAL Axp A    148 ? 34.85  28.073  3.731   1    39.711  ? 1229 A 1 c
ATOM 2493 H HG23 . VAL Axp A    148 ? 33.607 27.353  3.06    1    39.725  ? 1229 A 1 c
ATOM 2494 N N    . PHE Axp A    149 ? 36.256 25.307  6.051   1    34.957  ? 1230 A 1 .
ATOM 2495 C CA   . PHE Axp A    149 ? 36.788 25.79   7.306   1    33.016  ? 1230 A 1 .
ATOM 2496 C C    . PHE Axp A    149 ? 37.498 27.111  7.071   1    33.506  ? 1230 A 1 .
ATOM 2497 O O    . PHE Axp A    149 ? 38.364 27.227  6.209   1    33.825  ? 1230 A 1 .
ATOM 2498 C CB   . PHE Axp A    149 ? 37.763 24.792  7.915   1    32.489  ? 1230 A 1 .
ATOM 2499 C CG   . PHE Axp A    149 ? 37.067 23.573  8.476   1    31.414  ? 1230 A 1 .
ATOM 2500 C CD1  . PHE Axp A    149 ? 36.743 22.511  7.657   1    30.571  ? 1230 A 1 .
ATOM 2501 C CD2  . PHE Axp A    149 ? 36.729 23.517  9.819   1    32.856  ? 1230 A 1 .
ATOM 2502 C CE1  . PHE Axp A    149 ? 36.1   21.412  8.175   1    32.347  ? 1230 A 1 .
ATOM 2503 C CE2  . PHE Axp A    149 ? 36.085 22.413  10.334  1    33.559  ? 1230 A 1 .
ATOM 2504 C CZ   . PHE Axp A    149 ? 35.771 21.366  9.509   1    33.978  ? 1230 A 1 .
ATOM 2505 H H    . PHE Axp A    149 ? 36.623 24.563  5.669   1    34.603  ? 1230 A 1 c
ATOM 2506 H HA   . PHE Axp A    149 ? 36.037 25.931  7.94    1    33.455  ? 1230 A 1 c
ATOM 2507 H HB3  . PHE Axp A    149 ? 38.259 25.238  8.635   1    32.328  ? 1230 A 1 c
ATOM 2508 H HB2  . PHE Axp A    149 ? 38.399 24.511  7.229   1    32.263  ? 1230 A 1 c
ATOM 2509 H HD1  . PHE Axp A    149 ? 36.965 22.54   6.74    1    31.236  ? 1230 A 1 c
ATOM 2510 H HD2  . PHE Axp A    149 ? 36.944 24.241  10.384  1    32.674  ? 1230 A 1 c
ATOM 2511 H HE1  . PHE Axp A    149 ? 35.884 20.686  7.612   1    32.299  ? 1230 A 1 c
ATOM 2512 H HE2  . PHE Axp A    149 ? 35.862 22.378  11.249  1    33.378  ? 1230 A 1 c
ATOM 2513 H HZ   . PHE Axp A    149 ? 35.338 20.606  9.859   1    33.457  ? 1230 A 1 c
ATOM 2514 N N    . GLN Axp A    150 ? 37.14  28.086  7.897   1    35.331  ? 1231 A 1 .
ATOM 2515 C CA   . GLN Axp A    150 ? 37.665 29.429  7.783   1    37.291  ? 1231 A 1 .
ATOM 2516 C C    . GLN Axp A    150 ? 38.726 29.658  8.848   1    35.365  ? 1231 A 1 .
ATOM 2517 O O    . GLN Axp A    150 ? 39.729 30.303  8.57    1    36.818  ? 1231 A 1 .
ATOM 2518 C CB   . GLN Axp A    150 ? 36.484 30.383  7.895   1    39.848  ? 1231 A 1 .
ATOM 2519 C CG   . GLN Axp A    150 ? 35.512 30.206  6.741   1    42.22   ? 1231 A 1 .
ATOM 2520 C CD   . GLN Axp A    150 ? 35.924 30.99   5.523   1    45.699  ? 1231 A 1 .
ATOM 2521 O OE1  . GLN Axp A    150 ? 35.635 32.189  5.421   1    58.586  ? 1231 A 1 .
ATOM 2522 N NE2  . GLN Axp A    150 ? 36.584 30.32   4.59    1    43.539  ? 1231 A 1 .
ATOM 2523 H H    . GLN Axp A    150 ? 36.54  27.907  8.561   1    35.272  ? 1231 A 1 c
ATOM 2524 H HA   . GLN Axp A    150 ? 38.081 29.535  6.891   1    37.022  ? 1231 A 1 c
ATOM 2525 H HB3  . GLN Axp A    150 ? 36.813 31.306  7.907   1    39.779  ? 1231 A 1 c
ATOM 2526 H HB2  . GLN Axp A    150 ? 36.016 30.216  8.738   1    39.658  ? 1231 A 1 c
ATOM 2527 H HG3  . GLN Axp A    150 ? 34.62  30.5    7.021   1    42.421  ? 1231 A 1 c
ATOM 2528 H HG2  . GLN Axp A    150 ? 35.453 29.257  6.505   1    42.352  ? 1231 A 1 c
ATOM 2529 H HE21 . GLN Axp A    150 ? 36.562 30.599  3.748   1    44.17   ? 1231 A 1 c
ATOM 2530 H HE22 . GLN Axp A    150 ? 37.048 29.596  4.805   1    44.099  ? 1231 A 1 c
ATOM 2531 N N    . ASP Axp A    151 ? 38.492 29.161  10.062  1    33.066  ? 1232 A 1 .
ATOM 2532 C CA   . ASP Axp A    151 ? 39.456 29.379  11.119  1    34.769  ? 1232 A 1 .
ATOM 2533 C C    . ASP Axp A    151 ? 39.53  28.144  12.003  1    37.222  ? 1232 A 1 .
ATOM 2534 O O    . ASP Axp A    151 ? 38.92  27.124  11.711  1    38.145  ? 1232 A 1 .
ATOM 2535 C CB   . ASP Axp A    151 ? 39.123 30.624  11.919  1    34.594  ? 1232 A 1 .
ATOM 2536 C CG   . ASP Axp A    151 ? 40.325 31.389  12.451  1    33.799  ? 1232 A 1 .
ATOM 2537 O OD1  . ASP Axp A    151 ? 41.34  30.741  12.802  1    32.362  ? 1232 A 1 .
ATOM 2538 O OD2  . ASP Axp A    151 ? 40.217 32.625  12.535  1    34.079  ? 1232 A 1 .
ATOM 2539 H H    . ASP Axp A    151 ? 37.728 28.693  10.239  1    34.023  ? 1232 A 1 c
ATOM 2540 H HA   . ASP Axp A    151 ? 40.34  29.514  10.709  1    34.823  ? 1232 A 1 c
ATOM 2541 H HB3  . ASP Axp A    151 ? 38.56  30.373  12.682  1    34.463  ? 1232 A 1 c
ATOM 2542 H HB2  . ASP Axp A    151 ? 38.604 31.231  11.352  1    34.441  ? 1232 A 1 c
ATOM 2543 N N    . LYS Axp A    152 ? 40.315 28.236  13.075  1    39.081  ? 1233 A 1 .
ATOM 2544 C CA   . LYS Axp A    152 ? 40.469 27.114  13.977  1    38.506  ? 1233 A 1 .
ATOM 2545 C C    . LYS Axp A    152 ? 39.077 26.693  14.439  1    33.19   ? 1233 A 1 .
ATOM 2546 O O    . LYS Axp A    152 ? 38.33  27.504  14.974  1    29.452  ? 1233 A 1 .
ATOM 2547 C CB   . LYS Axp A    152 ? 41.446 27.448  15.115  1    43.117  ? 1233 A 1 .
ATOM 2548 C CG   . LYS Axp A    152 ? 42.889 27.779  14.702  1    44.786  ? 1233 A 1 .
ATOM 2549 C CD   . LYS Axp A    152 ? 43.649 26.607  14.091  1    44.709  ? 1233 A 1 .
ATOM 2550 C CE   . LYS Axp A    152 ? 44.648 27.022  13.048  1    45.372  ? 1233 A 1 .
ATOM 2551 N NZ   . LYS Axp A    152 ? 44.007 27.244  11.749  1    43.282  ? 1233 A 1 .
ATOM 2552 H H    . LYS Axp A    152 ? 40.772 29.009  13.245  1    38.52   ? 1233 A 1 c
ATOM 2553 H HA   . LYS Axp A    152 ? 40.86  26.367  13.459  1    38.329  ? 1233 A 1 c
ATOM 2554 H HB3  . LYS Axp A    152 ? 41.473 26.684  15.73   1    42.386  ? 1233 A 1 c
ATOM 2555 H HB2  . LYS Axp A    152 ? 41.087 28.213  15.613  1    42.386  ? 1233 A 1 c
ATOM 2556 H HG3  . LYS Axp A    152 ? 43.374 28.094  15.495  1    44.371  ? 1233 A 1 c
ATOM 2557 H HG2  . LYS Axp A    152 ? 42.866 28.517  14.055  1    44.316  ? 1233 A 1 c
ATOM 2558 H HD3  . LYS Axp A    152 ? 43.006 25.989  13.684  1    44.649  ? 1233 A 1 c
ATOM 2559 H HD2  . LYS Axp A    152 ? 44.117 26.124  14.806  1    44.834  ? 1233 A 1 c
ATOM 2560 H HE3  . LYS Axp A    152 ? 45.331 26.334  12.953  1    44.638  ? 1233 A 1 c
ATOM 2561 H HE2  . LYS Axp A    152 ? 45.086 27.845  13.329  1    44.703  ? 1233 A 1 c
ATOM 2562 H HZ1  . LYS Axp A    152 ? 43.224 27.682  11.869  1    43.78   ? 1233 A 1 c
ATOM 2563 H HZ2  . LYS Axp A    152 ? 43.855 26.447  11.348  1    43.686  ? 1233 A 1 c
ATOM 2564 H HZ3  . LYS Axp A    152 ? 44.549 27.743  11.222  1    43.845  ? 1233 A 1 c
ATOM 2565 N N    . PHE Axp A    153 ? 38.754 25.435  14.119  1    31.888  ? 1234 A 1 .
ATOM 2566 C CA   . PHE Axp A    153 ? 37.602 24.703  14.61   1    30.226  ? 1234 A 1 .
ATOM 2567 C C    . PHE Axp A    153 ? 38.121 23.553  15.469  1    30.69   ? 1234 A 1 .
ATOM 2568 O O    . PHE Axp A    153 ? 38.411 22.467  14.96   1    29.572  ? 1234 A 1 .
ATOM 2569 C CB   . PHE Axp A    153 ? 36.872 24.192  13.366  1    29.543  ? 1234 A 1 .
ATOM 2570 C CG   . PHE Axp A    153 ? 35.535 23.518  13.618  1    27.647  ? 1234 A 1 .
ATOM 2571 C CD1  . PHE Axp A    153 ? 35.45  22.342  14.343  1    27.458  ? 1234 A 1 .
ATOM 2572 C CD2  . PHE Axp A    153 ? 34.374 24.049  13.089  1    26.867  ? 1234 A 1 .
ATOM 2573 C CE1  . PHE Axp A    153 ? 34.233 21.738  14.563  1    27.099  ? 1234 A 1 .
ATOM 2574 C CE2  . PHE Axp A    153 ? 33.162 23.443  13.319  1    26.522  ? 1234 A 1 .
ATOM 2575 C CZ   . PHE Axp A    153 ? 33.097 22.285  14.042  1    26.939  ? 1234 A 1 .
ATOM 2576 H H    . PHE Axp A    153 ? 39.305 24.998  13.536  1    31.887  ? 1234 A 1 c
ATOM 2577 H HA   . PHE Axp A    153 ? 37.011 25.3    15.141  1    30.505  ? 1234 A 1 c
ATOM 2578 H HB3  . PHE Axp A    153 ? 37.461 23.557  12.901  1    29.248  ? 1234 A 1 c
ATOM 2579 H HB2  . PHE Axp A    153 ? 36.73  24.953  12.76   1    29.235  ? 1234 A 1 c
ATOM 2580 H HD1  . PHE Axp A    153 ? 36.23  21.957  14.703  1    27.452  ? 1234 A 1 c
ATOM 2581 H HD2  . PHE Axp A    153 ? 34.411 24.85   12.591  1    26.998  ? 1234 A 1 c
ATOM 2582 H HE1  . PHE Axp A    153 ? 34.187 20.939  15.064  1    27.147  ? 1234 A 1 c
ATOM 2583 H HE2  . PHE Axp A    153 ? 32.374 23.818  12.96   1    26.714  ? 1234 A 1 c
ATOM 2584 H HZ   . PHE Axp A    153 ? 32.262 21.869  14.192  1    26.889  ? 1234 A 1 c
ATOM 2585 N N    . GLY Axp A    154 ? 38.257 23.8    16.774  1    30.052  ? 1235 A 1 .
ATOM 2586 C CA   . GLY Axp A    154 ? 39.091 22.948  17.605  1    30.136  ? 1235 A 1 .
ATOM 2587 C C    . GLY Axp A    154 ? 38.34  22.222  18.716  1    31.246  ? 1235 A 1 .
ATOM 2588 O O    . GLY Axp A    154 ? 37.113 22.202  18.799  1    32.907  ? 1235 A 1 .
ATOM 2589 H H    . GLY Axp A    154 ? 37.826 24.511  17.152  1    30.207  ? 1235 A 1 c
ATOM 2590 H HA3  . GLY Axp A    154 ? 39.798 23.505  18.008  1    30.354  ? 1235 A 1 c
ATOM 2591 H HA2  . GLY Axp A    154 ? 39.536 22.282  17.032  1    30.358  ? 1235 A 1 c
ATOM 2592 N N    . VAL Axp A    155 ? 39.127 21.659  19.624  1    31.663  ? 1236 A 1 .
ATOM 2593 C CA   . VAL Axp A    155 ? 38.61  20.733  20.612  1    31.866  ? 1236 A 1 .
ATOM 2594 C C    . VAL Axp A    155 ? 37.58  21.396  21.518  1    29.963  ? 1236 A 1 .
ATOM 2595 O O    . VAL Axp A    155 ? 36.843 20.712  22.228  1    31.558  ? 1236 A 1 .
ATOM 2596 C CB   . VAL Axp A    155 ? 39.798 20.201  21.416  1    34.768  ? 1236 A 1 .
ATOM 2597 C CG1  . VAL Axp A    155 ? 40.688 19.328  20.548  1    37.959  ? 1236 A 1 .
ATOM 2598 C CG2  . VAL Axp A    155 ? 40.605 21.335  22.024  1    34.822  ? 1236 A 1 .
ATOM 2599 H H    . VAL Axp A    155 ? 40.02  21.851  19.617  1    31.729  ? 1236 A 1 c
ATOM 2600 H HA   . VAL Axp A    155 ? 38.188 19.992  20.148  1    31.892  ? 1236 A 1 c
ATOM 2601 H HB   . VAL Axp A    155 ? 39.435 19.648  22.143  1    34.752  ? 1236 A 1 c
ATOM 2602 H HG11 . VAL Axp A    155 ? 41.183 19.884  19.924  1    36.887  ? 1236 A 1 c
ATOM 2603 H HG12 . VAL Axp A    155 ? 40.14  18.696  20.053  1    36.907  ? 1236 A 1 c
ATOM 2604 H HG13 . VAL Axp A    155 ? 41.313 18.84   21.111  1    36.952  ? 1236 A 1 c
ATOM 2605 H HG21 . VAL Axp A    155 ? 41.194 20.98   22.71   1    34.784  ? 1236 A 1 c
ATOM 2606 H HG22 . VAL Axp A    155 ? 40.005 21.987  22.421  1    34.729  ? 1236 A 1 c
ATOM 2607 H HG23 . VAL Axp A    155 ? 41.137 21.764  21.335  1    34.777  ? 1236 A 1 c
ATOM 2608 N N    . GLU Axp A    156 ? 37.536 22.727  21.499  1    27.265  ? 1237 A 1 .
ATOM 2609 C CA   . GLU Axp A    156 ? 36.454 23.416  22.168  1    27.27   ? 1237 A 1 .
ATOM 2610 C C    . GLU Axp A    156 ? 35.124 22.88   21.654  1    26.3    ? 1237 A 1 .
ATOM 2611 O O    . GLU Axp A    156 ? 34.151 22.902  22.404  1    26.103  ? 1237 A 1 .
ATOM 2612 C CB   . GLU Axp A    156 ? 36.517 24.936  22.036  1    27.376  ? 1237 A 1 .
ATOM 2613 C CG   . GLU Axp A    156 ? 36.113 25.469  20.667  1    27.06   ? 1237 A 1 .
ATOM 2614 C CD   . GLU Axp A    156 ? 37.166 25.265  19.604  1    27.507  ? 1237 A 1 .
ATOM 2615 O OE1  . GLU Axp A    156 ? 38.189 24.592  19.856  1    27.536  ? 1237 A 1 .
ATOM 2616 O OE2  . GLU Axp A    156 ? 36.963 25.814  18.509  1    28.123  ? 1237 A 1 .
ATOM 2617 H H    . GLU Axp A    156 ? 38.204 23.213  21.107  1    27.953  ? 1237 A 1 c
ATOM 2618 H HA   . GLU Axp A    156 ? 36.504 23.201  23.126  1    27.326  ? 1237 A 1 c
ATOM 2619 H HB3  . GLU Axp A    156 ? 37.43  25.232  22.236  1    27.289  ? 1237 A 1 c
ATOM 2620 H HB2  . GLU Axp A    156 ? 35.924 25.332  22.708  1    27.316  ? 1237 A 1 c
ATOM 2621 H HG3  . GLU Axp A    156 ? 35.931 26.43   20.742  1    27.233  ? 1237 A 1 c
ATOM 2622 H HG2  . GLU Axp A    156 ? 35.284 25.034  20.377  1    27.21   ? 1237 A 1 c
ATOM 2623 N N    . THR Axp A    157 ? 35.103 22.398  20.403  1    23.967  ? 1238 A 1 .
ATOM 2624 C CA   . THR Axp A    157 ? 33.884 21.877  19.819  1    23.647  ? 1238 A 1 .
ATOM 2625 C C    . THR Axp A    157 ? 33.642 20.45   20.259  1    23.302  ? 1238 A 1 .
ATOM 2626 O O    . THR Axp A    157 ? 32.584 19.927  19.948  1    23.82   ? 1238 A 1 .
ATOM 2627 C CB   . THR Axp A    157 ? 33.883 21.883  18.295  1    24.342  ? 1238 A 1 .
ATOM 2628 O OG1  . THR Axp A    157 ? 34.815 20.898  17.862  1    24.648  ? 1238 A 1 .
ATOM 2629 C CG2  . THR Axp A    157 ? 34.191 23.248  17.717  1    25.153  ? 1238 A 1 .
ATOM 2630 H H    . THR Axp A    157 ? 35.859 22.422  19.891  1    24.535  ? 1238 A 1 c
ATOM 2631 H HA   . THR Axp A    157 ? 33.135 22.43   20.129  1    23.846  ? 1238 A 1 c
ATOM 2632 H HB   . THR Axp A    157 ? 32.984 21.624  17.981  1    24.489  ? 1238 A 1 c
ATOM 2633 H HG1  . THR Axp A    157 ? 35.636 21.147  18.097  0    17.94   ? 1238 A 1 c
ATOM 2634 H HG21 . THR Axp A    157 ? 33.612 23.415  16.954  1    24.952  ? 1238 A 1 c
ATOM 2635 H HG22 . THR Axp A    157 ? 35.119 23.279  17.431  1    24.952  ? 1238 A 1 c
ATOM 2636 H HG23 . THR Axp A    157 ? 34.038 23.93   18.393  1    24.914  ? 1238 A 1 c
ATOM 2637 N N    . LEU Axp A    158 ? 34.621 19.807  20.898  1    24.104  ? 1239 A 1 .
ATOM 2638 C CA   . LEU Axp A    158 ? 34.468 18.404  21.253  1    24.794  ? 1239 A 1 .
ATOM 2639 C C    . LEU Axp A    158 ? 33.41  18.297  22.335  1    24.822  ? 1239 A 1 .
ATOM 2640 O O    . LEU Axp A    158 ? 33.263 19.218  23.128  1    25.012  ? 1239 A 1 .
ATOM 2641 C CB   . LEU Axp A    158 ? 35.765 17.749  21.713  1    24.38   ? 1239 A 1 .
ATOM 2642 C CG   . LEU Axp A    158 ? 36.818 17.545  20.622  1    24.471  ? 1239 A 1 .
ATOM 2643 C CD1  . LEU Axp A    158 ? 37.94  16.679  21.171  1    25.203  ? 1239 A 1 .
ATOM 2644 C CD2  . LEU Axp A    158 ? 36.22  16.953  19.354  1    23.764  ? 1239 A 1 .
ATOM 2645 H H    . LEU Axp A    158 ? 35.397 20.237  21.112  1    24.109  ? 1239 A 1 c
ATOM 2646 H HA   . LEU Axp A    158 ? 34.132 17.925  20.455  1    24.58   ? 1239 A 1 c
ATOM 2647 H HB3  . LEU Axp A    158 ? 35.545 16.87   22.1    1    24.511  ? 1239 A 1 c
ATOM 2648 H HB2  . LEU Axp A    158 ? 36.156 18.302  22.427  1    24.533  ? 1239 A 1 c
ATOM 2649 H HG   . LEU Axp A    158 ? 37.197 18.428  20.393  1    24.545  ? 1239 A 1 c
ATOM 2650 H HD11 . LEU Axp A    158 ? 38.48  17.201  21.789  1    24.988  ? 1239 A 1 c
ATOM 2651 H HD12 . LEU Axp A    158 ? 38.499 16.367  20.44   1    24.989  ? 1239 A 1 c
ATOM 2652 H HD13 . LEU Axp A    158 ? 37.565 15.916  21.639  1    24.996  ? 1239 A 1 c
ATOM 2653 H HD21 . LEU Axp A    158 ? 35.645 17.608  18.929  1    24.135  ? 1239 A 1 c
ATOM 2654 H HD22 . LEU Axp A    158 ? 35.699 16.165  19.578  1    24.06   ? 1239 A 1 c
ATOM 2655 H HD23 . LEU Axp A    158 ? 36.932 16.706  18.742  1    24.07   ? 1239 A 1 c
ATOM 2656 N N    . GLY Axp A    159 ? 32.682 17.175  22.337  1    25.451  ? 1240 A 1 .
ATOM 2657 C CA   . GLY Axp A    159 ? 31.657 16.933  23.338  1    26.245  ? 1240 A 1 .
ATOM 2658 C C    . GLY Axp A    159 ? 31.065 15.525  23.258  1    27.548  ? 1240 A 1 .
ATOM 2659 O O    . GLY Axp A    159 ? 31.238 14.793  22.28   1    27.537  ? 1240 A 1 .
ATOM 2660 H H    . GLY Axp A    159 ? 32.831 16.54   21.695  1    25.476  ? 1240 A 1 c
ATOM 2661 H HA3  . GLY Axp A    159 ? 30.937 17.595  23.222  1    26.334  ? 1240 A 1 c
ATOM 2662 H HA2  . GLY Axp A    159 ? 32.049 17.07   24.233  1    26.33   ? 1240 A 1 c
ATOM 2663 N N    . GLU Axp A    160 ? 30.351 15.158  24.323  1    28.233  ? 1241 A 1 .
ATOM 2664 C CA   . GLU Axp A    160 ? 29.603 13.916  24.352  0.68 27.639  ? 1241 A 1 .
ATOM 2665 C C    . GLU Axp A    160 ? 28.742 13.793  23.102  1    27.835  ? 1241 A 1 .
ATOM 2666 O O    . GLU Axp A    160 ? 28.848 12.836  22.36   1    27.545  ? 1241 A 1 .
ATOM 2667 C CB   . GLU Axp A    160 ? 28.746 13.934  25.613  0.68 27.577  ? 1241 A 1 .
ATOM 2668 C CG   . GLU Axp A    160 ? 29.33  13.082  26.725  0.68 26.74   ? 1241 A 1 .
ATOM 2669 C CD   . GLU Axp A    160 ? 28.877 11.681  26.449  0.68 25.458  ? 1241 A 1 .
ATOM 2670 O OE1  . GLU Axp A    160 ? 27.625 11.537  26.45   0.68 23.521  ? 1241 A 1 .
ATOM 2671 O OE2  . GLU Axp A    160 ? 29.75  10.814  26.189  0.68 24.989  ? 1241 A 1 .
ATOM 2672 H H    . GLU Axp A    160 ? 30.338 15.701  25.058  1    27.902  ? 1241 A 1 c
ATOM 2673 H HA   . GLU Axp A    160 ? 30.244 13.16   24.382  0.68 27.755  ? 1241 A 1 c
ATOM 2674 H HB3  . GLU Axp A    160 ? 27.842 13.63   25.388  0.68 27.376  ? 1241 A 1 c
ATOM 2675 H HB2  . GLU Axp A    160 ? 28.675 14.853  25.94   0.68 27.463  ? 1241 A 1 c
ATOM 2676 H HG3  . GLU Axp A    160 ? 28.991 13.377  27.597  0.68 26.623  ? 1241 A 1 c
ATOM 2677 H HG2  . GLU Axp A    160 ? 30.31  13.126  26.713  0.68 26.625  ? 1241 A 1 c
ATOM 2678 N N    . SER Axp A    161 ? 27.882 14.785  22.889  1    30.61   ? 1242 A 1 .
ATOM 2679 C CA   . SER Axp A    161 ? 27.061 14.882  21.696  1    32.777  ? 1242 A 1 .
ATOM 2680 C C    . SER Axp A    161 ? 26.911 16.358  21.338  1    31.642  ? 1242 A 1 .
ATOM 2681 O O    . SER Axp A    161 ? 26.556 17.165  22.199  1    28.975  ? 1242 A 1 .
ATOM 2682 C CB   . SER Axp A    161 ? 25.714 14.245  21.903  1    36.23   ? 1242 A 1 .
ATOM 2683 O OG   . SER Axp A    161 ? 24.91  15.065  22.742  1    39.267  ? 1242 A 1 .
ATOM 2684 H H    . SER Axp A    161 ? 27.801 15.438  23.523  1    30.351  ? 1242 A 1 c
ATOM 2685 H HA   . SER Axp A    161 ? 27.523 14.421  20.952  1    32.607  ? 1242 A 1 c
ATOM 2686 H HB3  . SER Axp A    161 ? 25.829 13.368  22.316  1    36.1    ? 1242 A 1 c
ATOM 2687 H HB2  . SER Axp A    161 ? 25.274 14.127  21.041  1    36.1    ? 1242 A 1 c
ATOM 2688 H HG   . SER Axp A    161 ? 24.15  14.681  22.814  0    23.46   ? 1242 A 1 c
ATOM 2689 N N    . VAL Axp A    162 ? 27.164 16.684  20.063  1    32.004  ? 1243 A 1 .
ATOM 2690 C CA   . VAL Axp A    162 ? 27.407 18.06   19.671  1    32.072  ? 1243 A 1 .
ATOM 2691 C C    . VAL Axp A    162 ? 26.532 18.436  18.486  1    30.509  ? 1243 A 1 .
ATOM 2692 O O    . VAL Axp A    162 ? 26.713 17.937  17.384  1    29.649  ? 1243 A 1 .
ATOM 2693 C CB   . VAL Axp A    162 ? 28.873 18.359  19.325  1    32.929  ? 1243 A 1 .
ATOM 2694 C CG1  . VAL Axp A    162 ? 29.036 19.811  18.888  1    34.017  ? 1243 A 1 .
ATOM 2695 C CG2  . VAL Axp A    162 ? 29.801 18.057  20.487  1    33.437  ? 1243 A 1 .
ATOM 2696 H H    . VAL Axp A    162 ? 27.172 16.033  19.422  1    31.853  ? 1243 A 1 c
ATOM 2697 H HA   . VAL Axp A    162 ? 27.159 18.628  20.42   1    31.863  ? 1243 A 1 c
ATOM 2698 H HB   . VAL Axp A    162 ? 29.124 17.778  18.569  1    33.008  ? 1243 A 1 c
ATOM 2699 H HG11 . VAL Axp A    162 ? 28.421 20.373  19.389  1    33.623  ? 1243 A 1 c
ATOM 2700 H HG12 . VAL Axp A    162 ? 28.844 19.888  17.938  1    33.66   ? 1243 A 1 c
ATOM 2701 H HG13 . VAL Axp A    162 ? 29.948 20.101  19.056  1    33.672  ? 1243 A 1 c
ATOM 2702 H HG21 . VAL Axp A    162 ? 30.72  18.042  20.172  1    33.214  ? 1243 A 1 c
ATOM 2703 H HG22 . VAL Axp A    162 ? 29.578 17.192  20.869  1    33.249  ? 1243 A 1 c
ATOM 2704 H HG23 . VAL Axp A    162 ? 29.705 18.744  21.166  1    33.24   ? 1243 A 1 c
ATOM 2705 N N    . ALA Axp A    163 ? 25.677 19.425  18.714  1    30.288  ? 1244 A 1 .
ATOM 2706 C CA   . ALA Axp A    163 ? 24.83  19.943  17.666  1    30.935  ? 1244 A 1 .
ATOM 2707 C C    . ALA Axp A    163 ? 25.369 21.284  17.203  1    28.556  ? 1244 A 1 .
ATOM 2708 O O    . ALA Axp A    163 ? 26.16  21.922  17.891  1    24.524  ? 1244 A 1 .
ATOM 2709 C CB   . ALA Axp A    163 ? 23.426 20.077  18.188  1    33.677  ? 1244 A 1 .
ATOM 2710 H H    . ALA Axp A    163 ? 25.617 19.79   19.55   1    30.529  ? 1244 A 1 c
ATOM 2711 H HA   . ALA Axp A    163 ? 24.841 19.31   16.896  1    30.817  ? 1244 A 1 c
ATOM 2712 H HB3  . ALA Axp A    163 ? 22.806 20.145  17.442  1    32.835  ? 1244 A 1 c
ATOM 2713 H HB2  . ALA Axp A    163 ? 23.355 20.875  18.738  1    32.807  ? 1244 A 1 c
ATOM 2714 H HB1  . ALA Axp A    163 ? 23.2   19.298  18.723  1    32.815  ? 1244 A 1 c
ATOM 2715 N N    . GLN Axp A    164 ? 24.883 21.698  16.036  1    29.344  ? 1245 A 1 .
ATOM 2716 C CA   . GLN Axp A    164 ? 25.238 22.987  15.486  1    29.65   ? 1245 A 1 .
ATOM 2717 C C    . GLN Axp A    164 ? 24.01  23.875  15.358  1    29.906  ? 1245 A 1 .
ATOM 2718 O O    . GLN Axp A    164 ? 23.134 23.561  14.562  1    31.662  ? 1245 A 1 .
ATOM 2719 C CB   . GLN Axp A    164 ? 25.756 22.752  14.076  1    29.565  ? 1245 A 1 .
ATOM 2720 C CG   . GLN Axp A    164 ? 25.991 24.048  13.321  1    29.621  ? 1245 A 1 .
ATOM 2721 C CD   . GLN Axp A    164 ? 27.086 24.857  13.96   1    29.718  ? 1245 A 1 .
ATOM 2722 O OE1  . GLN Axp A    164 ? 28.251 24.463  13.953  1    31.023  ? 1245 A 1 .
ATOM 2723 N NE2  . GLN Axp A    164 ? 26.724 25.993  14.523  1    30.567  ? 1245 A 1 .
ATOM 2724 H H    . GLN Axp A    164 ? 24.31  21.161  15.569  1    29.249  ? 1245 A 1 c
ATOM 2725 H HA   . GLN Axp A    164 ? 25.921 23.422  16.056  1    29.584  ? 1245 A 1 c
ATOM 2726 H HB3  . GLN Axp A    164 ? 25.11  22.204  13.583  1    29.612  ? 1245 A 1 c
ATOM 2727 H HB2  . GLN Axp A    164 ? 26.597 22.252  14.126  1    29.632  ? 1245 A 1 c
ATOM 2728 H HG3  . GLN Axp A    164 ? 25.166 24.575  13.296  1    29.675  ? 1245 A 1 c
ATOM 2729 H HG2  . GLN Axp A    164 ? 26.245 23.843  12.396  1    29.639  ? 1245 A 1 c
ATOM 2730 H HE21 . GLN Axp A    164 ? 26.865 26.76   14.1    1    30.301  ? 1245 A 1 c
ATOM 2731 H HE22 . GLN Axp A    164 ? 26.342 25.989  15.322  1    30.295  ? 1245 A 1 c
ATOM 2732 N N    . LEU Axp A    165 ? 23.97  24.987  16.104  1    30.105  ? 1246 A 1 .
ATOM 2733 C CA   . LEU Axp A    165 ? 22.967 26.023  15.89   1    30.447  ? 1246 A 1 .
ATOM 2734 C C    . LEU Axp A    165 ? 22.936 26.385  14.416  1    34.272  ? 1246 A 1 .
ATOM 2735 O O    . LEU Axp A    165 ? 23.952 26.767  13.846  1    34.826  ? 1246 A 1 .
ATOM 2736 C CB   . LEU Axp A    165 ? 23.194 27.295  16.694  1    27.911  ? 1246 A 1 .
ATOM 2737 C CG   . LEU Axp A    165 ? 23.025 27.095  18.194  1    28.841  ? 1246 A 1 .
ATOM 2738 C CD1  . LEU Axp A    165 ? 23.239 28.364  18.973  1    29.189  ? 1246 A 1 .
ATOM 2739 C CD2  . LEU Axp A    165 ? 21.657 26.518  18.469  1    29.968  ? 1246 A 1 .
ATOM 2740 H H    . LEU Axp A    165 ? 24.587 25.103  16.768  1    30.103  ? 1246 A 1 c
ATOM 2741 H HA   . LEU Axp A    165 ? 22.086 25.643  16.131  1    30.626  ? 1246 A 1 c
ATOM 2742 H HB3  . LEU Axp A    165 ? 22.551 27.977  16.391  1    28.72   ? 1246 A 1 c
ATOM 2743 H HB2  . LEU Axp A    165 ? 24.109 27.616  16.519  1    28.699  ? 1246 A 1 c
ATOM 2744 H HG   . LEU Axp A    165 ? 23.701 26.44   18.488  1    29.03   ? 1246 A 1 c
ATOM 2745 H HD11 . LEU Axp A    165 ? 24.111 28.735  18.757  1    29.1    ? 1246 A 1 c
ATOM 2746 H HD12 . LEU Axp A    165 ? 23.197 28.172  19.925  1    29.138  ? 1246 A 1 c
ATOM 2747 H HD13 . LEU Axp A    165 ? 22.548 29.008  18.743  1    29.098  ? 1246 A 1 c
ATOM 2748 H HD21 . LEU Axp A    165 ? 21.688 25.551  18.38   1    29.676  ? 1246 A 1 c
ATOM 2749 H HD22 . LEU Axp A    165 ? 21.015 26.881  17.837  1    29.719  ? 1246 A 1 c
ATOM 2750 H HD23 . LEU Axp A    165 ? 21.385 26.748  19.373  1    29.736  ? 1246 A 1 c
ATOM 2751 N N    . GLN Axp A    166 ? 21.753 26.256  13.813  1    37.295  ? 1247 A 1 .
ATOM 2752 C CA   . GLN Axp A    166 ? 21.598 26.612  12.417  1    36.848  ? 1247 A 1 .
ATOM 2753 C C    . GLN Axp A    166 ? 21.639 28.13   12.328  1    35.575  ? 1247 A 1 .
ATOM 2754 O O    . GLN Axp A    166 ? 20.88  28.815  13.013  1    33.045  ? 1247 A 1 .
ATOM 2755 C CB   . GLN Axp A    166 ? 20.321 26.01   11.831  1    37.845  ? 1247 A 1 .
ATOM 2756 C CG   . GLN Axp A    166 ? 20.396 25.74   10.332  1    37.064  ? 1247 A 1 .
ATOM 2757 C CD   . GLN Axp A    166 ? 19.977 26.928  9.504   1    37.056  ? 1247 A 1 .
ATOM 2758 O OE1  . GLN Axp A    166 ? 20.009 28.071  9.963   1    39.954  ? 1247 A 1 .
ATOM 2759 N NE2  . GLN Axp A    166 ? 19.577 26.667  8.272   1    39.321  ? 1247 A 1 .
ATOM 2760 H H    . GLN Axp A    166 ? 21.03  25.945  14.278  1    36.366  ? 1247 A 1 c
ATOM 2761 H HA   . GLN Axp A    166 ? 22.372 26.247  11.919  1    36.807  ? 1247 A 1 c
ATOM 2762 H HB3  . GLN Axp A    166 ? 19.572 26.616  12.012  1    37.458  ? 1247 A 1 c
ATOM 2763 H HB2  . GLN Axp A    166 ? 20.136 25.165  12.29   1    37.445  ? 1247 A 1 c
ATOM 2764 H HG3  . GLN Axp A    166 ? 19.818 24.979  10.11   1    37.233  ? 1247 A 1 c
ATOM 2765 H HG2  . GLN Axp A    166 ? 21.314 25.498  10.091  1    37.215  ? 1247 A 1 c
ATOM 2766 H HE21 . GLN Axp A    166 ? 18.883 27.102  7.931   1    38.607  ? 1247 A 1 c
ATOM 2767 H HE22 . GLN Axp A    166 ? 20.003 26.058  7.788   1    38.599  ? 1247 A 1 c
ATOM 2768 N N    . ALA Axp A    167 ? 22.515 28.612  11.442  1    34.89   ? 1248 A 1 .
ATOM 2769 C CA   . ALA Axp A    167 ? 22.949 30.002  11.395  1    34.185  ? 1248 A 1 .
ATOM 2770 C C    . ALA Axp A    167 ? 21.81  31.018  11.201  1    31.845  ? 1248 A 1 .
ATOM 2771 O O    . ALA Axp A    167 ? 21.89  32.157  11.662  1    29.245  ? 1248 A 1 .
ATOM 2772 C CB   . ALA Axp A    167 ? 23.989 30.098  10.299  1    35.226  ? 1248 A 1 .
ATOM 2773 H H    . ALA Axp A    167 ? 22.86  28.036  10.822  1    34.923  ? 1248 A 1 c
ATOM 2774 H HA   . ALA Axp A    167 ? 23.387 30.207  12.265  1    34.034  ? 1248 A 1 c
ATOM 2775 H HB3  . ALA Axp A    167 ? 24.278 31.021  10.203  1    34.938  ? 1248 A 1 c
ATOM 2776 H HB2  . ALA Axp A    167 ? 23.609 29.792  9.458   1    34.923  ? 1248 A 1 c
ATOM 2777 H HB1  . ALA Axp A    167 ? 24.753 29.545  10.527  1    34.932  ? 1248 A 1 c
ATOM 2778 N N    . TRP Axp A    168 ? 20.748 30.627  10.496  1    31.917  ? 1249 A 1 .
ATOM 2779 C CA   . TRP Axp A    168 ? 19.684 31.55   10.148  1    32.995  ? 1249 A 1 .
ATOM 2780 C C    . TRP Axp A    168 ? 18.682 31.705  11.281  1    35.73   ? 1249 A 1 .
ATOM 2781 O O    . TRP Axp A    168 ? 18.006 32.725  11.357  1    37.849  ? 1249 A 1 .
ATOM 2782 C CB   . TRP Axp A    168 ? 18.97  31.065  8.889   1    32.448  ? 1249 A 1 .
ATOM 2783 C CG   . TRP Axp A    168 ? 19.797 31.222  7.642   1    31.376  ? 1249 A 1 .
ATOM 2784 C CD1  . TRP Axp A    168 ? 20.754 30.387  7.136   1    31.422  ? 1249 A 1 .
ATOM 2785 C CD2  . TRP Axp A    168 ? 19.689 32.315  6.711   1    28.265  ? 1249 A 1 .
ATOM 2786 N NE1  . TRP Axp A    168 ? 21.261 30.894  5.966   1    31.136  ? 1249 A 1 .
ATOM 2787 C CE2  . TRP Axp A    168 ? 20.616 32.07   5.68    1    28.439  ? 1249 A 1 .
ATOM 2788 C CE3  . TRP Axp A    168 ? 18.893 33.458  6.657   1    26.623  ? 1249 A 1 .
ATOM 2789 C CZ2  . TRP Axp A    168 ? 20.76  32.935  4.607   1    27.551  ? 1249 A 1 .
ATOM 2790 C CZ3  . TRP Axp A    168 ? 19.032 34.306  5.59    1    25.727  ? 1249 A 1 .
ATOM 2791 C CH2  . TRP Axp A    168 ? 19.949 34.043  4.582   1    26.445  ? 1249 A 1 .
ATOM 2792 H H    . TRP Axp A    168 ? 20.687 29.759  10.217  1    32.192  ? 1249 A 1 c
ATOM 2793 H HA   . TRP Axp A    168 ? 20.087 32.44   9.955   1    33.122  ? 1249 A 1 c
ATOM 2794 H HB3  . TRP Axp A    168 ? 18.138 31.574  8.784   1    32.345  ? 1249 A 1 c
ATOM 2795 H HB2  . TRP Axp A    168 ? 18.738 30.119  9.002   1    32.36   ? 1249 A 1 c
ATOM 2796 H HD1  . TRP Axp A    168 ? 21.045 29.585  7.54    1    31.298  ? 1249 A 1 c
ATOM 2797 H HE1  . TRP Axp A    168 ? 21.88  30.521  5.479   1    30.548  ? 1249 A 1 c
ATOM 2798 H HE3  . TRP Axp A    168 ? 18.262 33.636  7.335   1    26.81   ? 1249 A 1 c
ATOM 2799 H HZ2  . TRP Axp A    168 ? 21.378 32.763  3.918   1    27.591  ? 1249 A 1 c
ATOM 2800 H HZ3  . TRP Axp A    168 ? 18.501 35.084  5.541   1    26.152  ? 1249 A 1 c
ATOM 2801 H HH2  . TRP Axp A    168 ? 20.03  34.648  3.869   1    26.567  ? 1249 A 1 c
ATOM 2802 N N    . TRP Axp A    169 ? 18.6   30.701  12.158  1    37.963  ? 1250 A 1 .
ATOM 2803 C CA   . TRP Axp A    169 ? 17.522 30.655  13.13   1    40.87   ? 1250 A 1 .
ATOM 2804 C C    . TRP Axp A    169 ? 17.998 30.858  14.569  1    38.497  ? 1250 A 1 .
ATOM 2805 O O    . TRP Axp A    169 ? 17.193 30.884  15.5    1    39.657  ? 1250 A 1 .
ATOM 2806 C CB   . TRP Axp A    169 ? 16.772 29.33   12.983  1    43.291  ? 1250 A 1 .
ATOM 2807 C CG   . TRP Axp A    169 ? 16.147 29.146  11.625  1    44.948  ? 1250 A 1 .
ATOM 2808 C CD1  . TRP Axp A    169 ? 16.671 28.471  10.566  1    43.344  ? 1250 A 1 .
ATOM 2809 C CD2  . TRP Axp A    169 ? 14.869 29.646  11.179  1    44.066  ? 1250 A 1 .
ATOM 2810 N NE1  . TRP Axp A    169 ? 15.802 28.488  9.509   1    41.443  ? 1250 A 1 .
ATOM 2811 C CE2  . TRP Axp A    169 ? 14.697 29.209  9.852   1    41.174  ? 1250 A 1 .
ATOM 2812 C CE3  . TRP Axp A    169 ? 13.863 30.415  11.771  1    44.84   ? 1250 A 1 .
ATOM 2813 C CZ2  . TRP Axp A    169 ? 13.566 29.521  9.112   1    43.859  ? 1250 A 1 .
ATOM 2814 C CZ3  . TRP Axp A    169 ? 12.747 30.734  11.034  1    43.946  ? 1250 A 1 .
ATOM 2815 C CH2  . TRP Axp A    169 ? 12.603 30.29   9.724   1    45.603  ? 1250 A 1 .
ATOM 2816 H H    . TRP Axp A    169 ? 19.221 30.031  12.151  1    37.9    ? 1250 A 1 c
ATOM 2817 H HA   . TRP Axp A    169 ? 16.883 31.386  12.916  1    40.227  ? 1250 A 1 c
ATOM 2818 H HB3  . TRP Axp A    169 ? 16.069 29.291  13.666  1    43.057  ? 1250 A 1 c
ATOM 2819 H HB2  . TRP Axp A    169 ? 17.401 28.595  13.147  1    43.093  ? 1250 A 1 c
ATOM 2820 H HD1  . TRP Axp A    169 ? 17.496 28.015  10.569  1    43.193  ? 1250 A 1 c
ATOM 2821 H HE1  . TRP Axp A    169 ? 15.945 28.117  8.731   1    41.871  ? 1250 A 1 c
ATOM 2822 H HE3  . TRP Axp A    169 ? 13.958 30.723  12.655  1    44.466  ? 1250 A 1 c
ATOM 2823 H HZ2  . TRP Axp A    169 ? 13.467 29.225  8.223   1    43.629  ? 1250 A 1 c
ATOM 2824 H HZ3  . TRP Axp A    169 ? 12.063 31.251  11.427  1    44.512  ? 1250 A 1 c
ATOM 2825 H HH2  . TRP Axp A    169 ? 11.823 30.513  9.246   1    44.765  ? 1250 A 1 c
ATOM 2826 N N    . TYR Axp A    170 ? 19.291 31.065  14.786  1    34.687  ? 1251 A 1 .
ATOM 2827 C CA   . TYR Axp A    170 ? 19.739 31.071  16.162  1    32.399  ? 1251 A 1 .
ATOM 2828 C C    . TYR Axp A    170 ? 19.008 32.168  16.92   1    33.635  ? 1251 A 1 .
ATOM 2829 O O    . TYR Axp A    170 ? 18.696 31.979  18.079  1    34.904  ? 1251 A 1 .
ATOM 2830 C CB   . TYR Axp A    170 ? 21.253 31.145  16.322  1    30.265  ? 1251 A 1 .
ATOM 2831 C CG   . TYR Axp A    170 ? 21.882 32.509  16.139  1    30.504  ? 1251 A 1 .
ATOM 2832 C CD1  . TYR Axp A    170 ? 22.076 33.056  14.882  1    33.207  ? 1251 A 1 .
ATOM 2833 C CD2  . TYR Axp A    170 ? 22.344 33.215  17.227  1    32.263  ? 1251 A 1 .
ATOM 2834 C CE1  . TYR Axp A    170 ? 22.684 34.289  14.718  1    35.936  ? 1251 A 1 .
ATOM 2835 C CE2  . TYR Axp A    170 ? 22.97  34.44   17.08   1    34.285  ? 1251 A 1 .
ATOM 2836 C CZ   . TYR Axp A    170 ? 23.143 34.984  15.823  1    36.402  ? 1251 A 1 .
ATOM 2837 O OH   . TYR Axp A    170 ? 23.731 36.209  15.672  1    39.086  ? 1251 A 1 .
ATOM 2838 H H    . TYR Axp A    170 ? 19.883 31.204  14.105  1    35.05   ? 1251 A 1 c
ATOM 2839 H HA   . TYR Axp A    170 ? 19.453 30.206  16.56   1    32.718  ? 1251 A 1 c
ATOM 2840 H HB3  . TYR Axp A    170 ? 21.658 30.526  15.674  1    30.799  ? 1251 A 1 c
ATOM 2841 H HB2  . TYR Axp A    170 ? 21.481 30.813  17.218  1    30.813  ? 1251 A 1 c
ATOM 2842 H HD1  . TYR Axp A    170 ? 21.775 32.586  14.123  1    33.17   ? 1251 A 1 c
ATOM 2843 H HD2  . TYR Axp A    170 ? 22.243 32.85   18.092  1    32.339  ? 1251 A 1 c
ATOM 2844 H HE1  . TYR Axp A    170 ? 22.795 34.651  13.856  1    35.338  ? 1251 A 1 c
ATOM 2845 H HE2  . TYR Axp A    170 ? 23.263 34.912  17.84   1    34.367  ? 1251 A 1 c
ATOM 2846 H HH   . TYR Axp A    170 ? 23.738 36.387  14.973  0    31.14   ? 1251 A 1 c
ATOM 2847 N N    . LYS Axp A    171 ? 18.68  33.288  16.278  1    37.862  ? 1252 A 1 .
ATOM 2848 C CA   . LYS Axp A    171 ? 18.096 34.386  17.033  1    40.053  ? 1252 A 1 .
ATOM 2849 C C    . LYS Axp A    171 ? 16.579 34.293  17.013  1    40.327  ? 1252 A 1 .
ATOM 2850 O O    . LYS Axp A    171 ? 15.924 35.182  17.541  1    37.533  ? 1252 A 1 .
ATOM 2851 C CB   . LYS Axp A    171 ? 18.561 35.777  16.584  1    42.084  ? 1252 A 1 .
ATOM 2852 C CG   . LYS Axp A    171 ? 19.962 36.119  17.053  1    45.152  ? 1252 A 1 .
ATOM 2853 C CD   . LYS Axp A    171 ? 20.55  37.424  16.523  1    51.376  ? 1252 A 1 .
ATOM 2854 C CE   . LYS Axp A    171 ? 19.809 38.657  16.939  1    58.804  ? 1252 A 1 .
ATOM 2855 N NZ   . LYS Axp A    171 ? 19.594 38.711  18.388  1    64.589  ? 1252 A 1 .
ATOM 2856 H H    . LYS Axp A    171 ? 18.828 33.383  15.381  1    37.258  ? 1252 A 1 c
ATOM 2857 H HA   . LYS Axp A    171 ? 18.386 34.291  17.976  1    39.984  ? 1252 A 1 c
ATOM 2858 H HB3  . LYS Axp A    171 ? 17.942 36.454  16.93   1    42.318  ? 1252 A 1 c
ATOM 2859 H HB2  . LYS Axp A    171 ? 18.538 35.821  15.604  1    42.3    ? 1252 A 1 c
ATOM 2860 H HG3  . LYS Axp A    171 ? 20.554 35.383  16.792  1    45.589  ? 1252 A 1 c
ATOM 2861 H HG2  . LYS Axp A    171 ? 19.957 36.152  18.034  1    45.89   ? 1252 A 1 c
ATOM 2862 H HD3  . LYS Axp A    171 ? 20.567 37.383  15.542  1    51.484  ? 1252 A 1 c
ATOM 2863 H HD2  . LYS Axp A    171 ? 21.479 37.495  16.83   1    51.498  ? 1252 A 1 c
ATOM 2864 H HE3  . LYS Axp A    171 ? 18.944 38.68   16.495  1    58.295  ? 1252 A 1 c
ATOM 2865 H HE2  . LYS Axp A    171 ? 20.312 39.445  16.665  1    58.293  ? 1252 A 1 c
ATOM 2866 H HZ1  . LYS Axp A    171 ? 20.317 38.38   18.823  1    62.425  ? 1252 A 1 c
ATOM 2867 H HZ2  . LYS Axp A    171 ? 18.863 38.223  18.609  1    62.579  ? 1252 A 1 c
ATOM 2868 H HZ3  . LYS Axp A    171 ? 19.464 39.571  18.644  1    62.655  ? 1252 A 1 c
ATOM 2869 N N    . ALA Axp A    172 ? 16.03  33.203  16.466  1    45.287  ? 1253 A 1 .
ATOM 2870 C CA   . ALA Axp A    172 ? 14.598 33.12   16.215  1    51.451  ? 1253 A 1 .
ATOM 2871 C C    . ALA Axp A    172 ? 13.878 32.359  17.326  1    57.902  ? 1253 A 1 .
ATOM 2872 O O    . ALA Axp A    172 ? 14.502 31.654  18.118  1    59.319  ? 1253 A 1 .
ATOM 2873 C CB   . ALA Axp A    172 ? 14.338 32.473  14.876  1    50.514  ? 1253 A 1 .
ATOM 2874 H H    . ALA Axp A    172 ? 16.554 32.487  16.251  1    45.104  ? 1253 A 1 c
ATOM 2875 H HA   . ALA Axp A    172 ? 14.232 34.046  16.197  1    51.017  ? 1253 A 1 c
ATOM 2876 H HB3  . ALA Axp A    172 ? 13.47  32.754  14.54   1    50.791  ? 1253 A 1 c
ATOM 2877 H HB2  . ALA Axp A    172 ? 14.347 31.506  14.971  1    50.822  ? 1253 A 1 c
ATOM 2878 H HB1  . ALA Axp A    172 ? 15.028 32.739  14.245  1    50.763  ? 1253 A 1 c
ATOM 2879 N N    . ASP Axp A    173 ? 12.543 32.487  17.331  1    62.372  ? 1254 A 1 .
ATOM 2880 C CA   . ASP Axp A    173 ? 11.706 31.875  18.347  1    67.323  ? 1254 A 1 .
ATOM 2881 C C    . ASP Axp A    173 ? 11.145 30.535  17.85   1    70.334  ? 1254 A 1 .
ATOM 2882 O O    . ASP Axp A    173 ? 10.481 30.483  16.81   1    67.31   ? 1254 A 1 .
ATOM 2883 C CB   . ASP Axp A    173 ? 10.622 32.83   18.812  1    69.441  ? 1254 A 1 .
ATOM 2884 C CG   . ASP Axp A    173 ? 9.839  32.337  20.02   1    77.217  ? 1254 A 1 .
ATOM 2885 O OD1  . ASP Axp A    173 ? 9.082  31.332  19.877  1    71.984  ? 1254 A 1 .
ATOM 2886 O OD2  . ASP Axp A    173 ? 10.029 32.935  21.103  1    82.58   ? 1254 A 1 .
ATOM 2887 H H    . ASP Axp A    173 ? 12.142 32.978  16.673  1    62.101  ? 1254 A 1 c
ATOM 2888 H HA   . ASP Axp A    173 ? 12.265 31.706  19.134  1    67.188  ? 1254 A 1 c
ATOM 2889 H HB3  . ASP Axp A    173 ? 9.992  32.978  18.076  1    70.663  ? 1254 A 1 c
ATOM 2890 H HB2  . ASP Axp A    173 ? 11.032 33.691  19.038  1    70.717  ? 1254 A 1 c
ATOM 2891 N N    . PRO Axp A    174 ? 11.36  29.435  18.624  1    68.12   ? 1255 A 1 .
ATOM 2892 C CA   . PRO Axp A    174 ? 11.054 28.063  18.227  1    66.156  ? 1255 A 1 .
ATOM 2893 C C    . PRO Axp A    174 ? 9.83   27.852  17.349  1    65.725  ? 1255 A 1 .
ATOM 2894 O O    . PRO Axp A    174 ? 9.893  27.13   16.355  1    65.492  ? 1255 A 1 .
ATOM 2895 C CB   . PRO Axp A    174 ? 10.863 27.355  19.562  1    66.133  ? 1255 A 1 .
ATOM 2896 C CG   . PRO Axp A    174 ? 11.947 28.018  20.39   1    67.262  ? 1255 A 1 .
ATOM 2897 C CD   . PRO Axp A    174 ? 11.984 29.462  19.957  1    69.25   ? 1255 A 1 .
ATOM 2898 H HA   . PRO Axp A    174 ? 11.828 27.69   17.779  1    65.843  ? 1255 A 1 c
ATOM 2899 H HB3  . PRO Axp A    174 ? 11.014 26.393  19.479  1    66.391  ? 1255 A 1 c
ATOM 2900 H HB2  . PRO Axp A    174 ? 9.975  27.526  19.933  1    66.39   ? 1255 A 1 c
ATOM 2901 H HG3  . PRO Axp A    174 ? 12.813 27.592  20.23   1    67.317  ? 1255 A 1 c
ATOM 2902 H HG2  . PRO Axp A    174 ? 11.74  27.954  21.344  1    67.426  ? 1255 A 1 c
ATOM 2903 H HD3  . PRO Axp A    174 ? 11.475 30.028  20.568  1    68.554  ? 1255 A 1 c
ATOM 2904 H HD2  . PRO Axp A    174 ? 12.904 29.789  19.904  1    68.523  ? 1255 A 1 c
ATOM 2905 N N    . ASN Axp A    175 ? 8.722  28.491  17.713  1    66.939  ? 1256 A 1 .
ATOM 2906 C CA   . ASN Axp A    175 ? 7.48   28.283  16.989  1    67.84   ? 1256 A 1 .
ATOM 2907 C C    . ASN Axp A    175 ? 7.606  28.8    15.557  1    62.272  ? 1256 A 1 .
ATOM 2908 O O    . ASN Axp A    175 ? 6.633  28.757  14.806  1    61.085  ? 1256 A 1 .
ATOM 2909 C CB   . ASN Axp A    175 ? 6.303  28.896  17.735  1    66.192  ? 1256 A 1 .
ATOM 2910 C CG   . ASN Axp A    175 ? 6.282  28.394  19.153  1    70.716  ? 1256 A 1 .
ATOM 2911 O OD1  . ASN Axp A    175 ? 5.592  27.411  19.442  1    74.416  ? 1256 A 1 .
ATOM 2912 N ND2  . ASN Axp A    175 ? 7.092  28.99   20.018  1    71.691  ? 1256 A 1 .
ATOM 2913 H H    . ASN Axp A    175 ? 8.745  29.085  18.406  1    66.954  ? 1256 A 1 c
ATOM 2914 H HA   . ASN Axp A    175 ? 7.318  27.313  16.945  1    66.293  ? 1256 A 1 c
ATOM 2915 H HB3  . ASN Axp A    175 ? 5.468  28.654  17.288  1    67.58   ? 1256 A 1 c
ATOM 2916 H HB2  . ASN Axp A    175 ? 6.385  29.871  17.733  1    67.58   ? 1256 A 1 c
ATOM 2917 H HD21 . ASN Axp A    175 ? 7.565  28.503  20.589  1    71.381  ? 1256 A 1 c
ATOM 2918 H HD22 . ASN Axp A    175 ? 7.159  29.874  20.024  1    71.354  ? 1256 A 1 c
ATOM 2919 N N    . ASP Axp A    176 ? 8.794  29.286  15.173  1    53.432  ? 1257 A 1 .
ATOM 2920 C CA   . ASP Axp A    176 ? 9.003  29.669  13.793  1    52.63   ? 1257 A 1 .
ATOM 2921 C C    . ASP Axp A    176 ? 10.056 28.764  13.148  1    47.44   ? 1257 A 1 .
ATOM 2922 O O    . ASP Axp A    176 ? 10.324 28.892  11.954  1    43.201  ? 1257 A 1 .
ATOM 2923 C CB   . ASP Axp A    176 ? 9.249  31.167  13.703  1    56.967  ? 1257 A 1 .
ATOM 2924 C CG   . ASP Axp A    176 ? 8.378  31.903  12.69   1    59.909  ? 1257 A 1 .
ATOM 2925 O OD1  . ASP Axp A    176 ? 8.189  31.377  11.568  1    58.174  ? 1257 A 1 .
ATOM 2926 O OD2  . ASP Axp A    176 ? 7.9    33.006  13.025  1    59.876  ? 1257 A 1 .
ATOM 2927 H H    . ASP Axp A    176 ? 9.461  29.43   15.78   1    55.385  ? 1257 A 1 c
ATOM 2928 H HA   . ASP Axp A    176 ? 8.161  29.516  13.311  1    52.74   ? 1257 A 1 c
ATOM 2929 H HB3  . ASP Axp A    176 ? 10.187 31.319  13.465  1    56.54   ? 1257 A 1 c
ATOM 2930 H HB2  . ASP Axp A    176 ? 9.096  31.567  14.585  1    56.585  ? 1257 A 1 c
ATOM 2931 N N    . PHE Axp A    177 ? 10.617 27.82   13.916  1    45.496  ? 1258 A 1 .
ATOM 2932 C CA   . PHE Axp A    177 ? 11.612 26.9    13.387  1    45.326  ? 1258 A 1 .
ATOM 2933 C C    . PHE Axp A    177 ? 10.968 26.052  12.302  1    45.519  ? 1258 A 1 .
ATOM 2934 O O    . PHE Axp A    177 ? 9.905  25.479  12.526  1    47.231  ? 1258 A 1 .
ATOM 2935 C CB   . PHE Axp A    177 ? 12.173 25.926  14.43   1    44.239  ? 1258 A 1 .
ATOM 2936 C CG   . PHE Axp A    177 ? 12.999 26.536  15.558  1    44.722  ? 1258 A 1 .
ATOM 2937 C CD1  . PHE Axp A    177 ? 13.659 27.756  15.412  1    45.253  ? 1258 A 1 .
ATOM 2938 C CD2  . PHE Axp A    177 ? 13.135 25.87   16.77   1    43.418  ? 1258 A 1 .
ATOM 2939 C CE1  . PHE Axp A    177 ? 14.4   28.298  16.453  1    42.817  ? 1258 A 1 .
ATOM 2940 C CE2  . PHE Axp A    177 ? 13.881 26.415  17.805  1    43.463  ? 1258 A 1 .
ATOM 2941 C CZ   . PHE Axp A    177 ? 14.507 27.63   17.646  1    43.454  ? 1258 A 1 .
ATOM 2942 H H    . PHE Axp A    177 ? 10.37  27.74   14.791  1    46.183  ? 1258 A 1 c
ATOM 2943 H HA   . PHE Axp A    177 ? 12.358 27.422  12.992  1    45.193  ? 1258 A 1 c
ATOM 2944 H HB3  . PHE Axp A    177 ? 12.73  25.265  13.961  1    44.601  ? 1258 A 1 c
ATOM 2945 H HB2  . PHE Axp A    177 ? 11.419 25.436  14.827  1    44.6    ? 1258 A 1 c
ATOM 2946 H HD1  . PHE Axp A    177 ? 13.586 28.231  14.6    1    44.534  ? 1258 A 1 c
ATOM 2947 H HD2  . PHE Axp A    177 ? 12.697 25.048  16.895  1    43.956  ? 1258 A 1 c
ATOM 2948 H HE1  . PHE Axp A    177 ? 14.835 29.128  16.337  1    43.53   ? 1258 A 1 c
ATOM 2949 H HE2  . PHE Axp A    177 ? 13.953 25.954  18.626  1    43.465  ? 1258 A 1 c
ATOM 2950 H HZ   . PHE Axp A    177 ? 15.021 27.995  18.349  1    43.328  ? 1258 A 1 c
ATOM 2951 N N    . THR Axp A    178 ? 11.632 25.943  11.149  1    45.865  ? 1259 A 1 .
ATOM 2952 C CA   . THR Axp A    178 ? 11.2   24.985  10.147  1    48.056  ? 1259 A 1 .
ATOM 2953 C C    . THR Axp A    178 ? 11.418 23.572  10.686  1    47.609  ? 1259 A 1 .
ATOM 2954 O O    . THR Axp A    178 ? 12.025 22.727  10.028  1    48.203  ? 1259 A 1 .
ATOM 2955 C CB   . THR Axp A    178 ? 11.898 25.221  8.806   1    51.261  ? 1259 A 1 .
ATOM 2956 O OG1  . THR Axp A    178 ? 13.284 25.498  8.987   1    49.408  ? 1259 A 1 .
ATOM 2957 C CG2  . THR Axp A    178 ? 11.29  26.385  8.044   1    55.377  ? 1259 A 1 .
ATOM 2958 H H    . THR Axp A    178 ? 12.361 26.47   10.982  1    46.28   ? 1259 A 1 c
ATOM 2959 H HA   . THR Axp A    178 ? 10.236 25.112  10.008  1    48.127  ? 1259 A 1 c
ATOM 2960 H HB   . THR Axp A    178 ? 11.795 24.414  8.252   1    51.121  ? 1259 A 1 c
ATOM 2961 H HG1  . THR Axp A    178 ? 13.356 26.216  9.465   0    41.26   ? 1259 A 1 c
ATOM 2962 H HG21 . THR Axp A    178 ? 11.881 26.641  7.316   1    54.114  ? 1259 A 1 c
ATOM 2963 H HG22 . THR Axp A    178 ? 11.171 27.14   8.644   1    54.123  ? 1259 A 1 c
ATOM 2964 H HG23 . THR Axp A    178 ? 10.427 26.121  7.682   1    54.123  ? 1259 A 1 c
ATOM 2965 N N    . TYR Axp A    179 ? 10.897 23.322  11.895  1    46.895  ? 1260 A 1 .
ATOM 2966 C CA   . TYR Axp A    179 ? 10.779 21.967  12.395  1    51.036  ? 1260 A 1 .
ATOM 2967 C C    . TYR Axp A    179 ? 9.767  21.253  11.517  1    62.009  ? 1260 A 1 .
ATOM 2968 O O    . TYR Axp A    179 ? 9.033  21.888  10.76   1    70.407  ? 1260 A 1 .
ATOM 2969 C CB   . TYR Axp A    179 ? 10.245 21.805  13.819  1    48.602  ? 1260 A 1 .
ATOM 2970 C CG   . TYR Axp A    179 ? 11.186 22.135  14.967  1    48.27   ? 1260 A 1 .
ATOM 2971 C CD1  . TYR Axp A    179 ? 12.563 22.088  14.832  1    48.719  ? 1260 A 1 .
ATOM 2972 C CD2  . TYR Axp A    179 ? 10.678 22.465  16.214  1    50.221  ? 1260 A 1 .
ATOM 2973 C CE1  . TYR Axp A    179 ? 13.4   22.389  15.892  1    50.722  ? 1260 A 1 .
ATOM 2974 C CE2  . TYR Axp A    179 ? 11.501 22.759  17.284  1    50.074  ? 1260 A 1 .
ATOM 2975 C CZ   . TYR Axp A    179 ? 12.869 22.721  17.123  1    53.179  ? 1260 A 1 .
ATOM 2976 O OH   . TYR Axp A    179 ? 13.683 23.008  18.182  1    68.243  ? 1260 A 1 .
ATOM 2977 H H    . TYR Axp A    179 ? 10.592 24.007  12.414  1    47.937  ? 1260 A 1 c
ATOM 2978 H HA   . TYR Axp A    179 ? 11.658 21.511  12.316  1    51.59   ? 1260 A 1 c
ATOM 2979 H HB3  . TYR Axp A    179 ? 9.946  20.875  13.93   1    49.372  ? 1260 A 1 c
ATOM 2980 H HB2  . TYR Axp A    179 ? 9.446  22.369  13.906  1    49.266  ? 1260 A 1 c
ATOM 2981 H HD1  . TYR Axp A    179 ? 12.941 21.867  13.997  1    49.141  ? 1260 A 1 c
ATOM 2982 H HD2  . TYR Axp A    179 ? 9.743  22.495  16.335  1    49.947  ? 1260 A 1 c
ATOM 2983 H HE1  . TYR Axp A    179 ? 14.332 22.36   15.778  1    50.724  ? 1260 A 1 c
ATOM 2984 H HE2  . TYR Axp A    179 ? 11.128 22.986  18.115  1    50.982  ? 1260 A 1 c
ATOM 2985 H HH   . TYR Axp A    179 ? 14.513 22.943  17.927  0    44.09   ? 1260 A 1 c
ATOM 2986 N N    . GLU Axp A    180 ? 9.738  19.926  11.64   1    69.902  ? 1261 A 1 .
ATOM 2987 C CA   . GLU Axp A    180 ? 8.659  19.147  11.067  1    66.653  ? 1261 A 1 .
ATOM 2988 C C    . GLU Axp A    180 ? 7.425  19.305  11.95   1    65.632  ? 1261 A 1 .
ATOM 2989 O O    . GLU Axp A    180 ? 7.464  19.019  13.15   1    56.441  ? 1261 A 1 .
ATOM 2990 C CB   . GLU Axp A    180 ? 9.058  17.679  10.947  1    67.791  ? 1261 A 1 .
ATOM 2991 C CG   . GLU Axp A    180 ? 7.971  16.848  10.282  1    65.6    ? 1261 A 1 .
ATOM 2992 C CD   . GLU Axp A    180 ? 7.549  17.5    8.991   1    62.062  ? 1261 A 1 .
ATOM 2993 O OE1  . GLU Axp A    180 ? 8.304  17.325  8.003   1    57.796  ? 1261 A 1 .
ATOM 2994 O OE2  . GLU Axp A    180 ? 6.515  18.214  9.017   1    60.75   ? 1261 A 1 .
ATOM 2995 H H    . GLU Axp A    180 ? 10.408 19.496  12.089  1    66.682  ? 1261 A 1 c
ATOM 2996 H HA   . GLU Axp A    180 ? 8.463  19.508  10.167  1    67.193  ? 1261 A 1 c
ATOM 2997 H HB3  . GLU Axp A    180 ? 9.24   17.328  11.84   1    66.866  ? 1261 A 1 c
ATOM 2998 H HB2  . GLU Axp A    180 ? 9.883  17.615  10.424  1    66.94   ? 1261 A 1 c
ATOM 2999 H HG3  . GLU Axp A    180 ? 7.195  16.773  10.878  1    65.218  ? 1261 A 1 c
ATOM 3000 H HG2  . GLU Axp A    180 ? 8.312  15.948  10.093  1    65.211  ? 1261 A 1 c
ATOM 3001 N N    . ARG Axp A    181 ? 6.327  19.759  11.341  1    65.2    ? 1262 A 1 .
ATOM 3002 C CA   . ARG Axp A    181 ? 5.17   20.154  12.124  1    66.795  ? 1262 A 1 .
ATOM 3003 C C    . ARG Axp A    181 ? 4.021  19.152  11.975  1    69.171  ? 1262 A 1 .
ATOM 3004 O O    . ARG Axp A    181 ? 3.002  19.288  12.657  1    70.081  ? 1262 A 1 .
ATOM 3005 C CB   . ARG Axp A    181 ? 4.843  21.606  11.752  1    63.903  ? 1262 A 1 .
ATOM 3006 C CG   . ARG Axp A    181 ? 5.949  22.602  12.07   1    62.949  ? 1262 A 1 .
ATOM 3007 C CD   . ARG Axp A    181 ? 6.471  22.478  13.495  1    62.787  ? 1262 A 1 .
ATOM 3008 N NE   . ARG Axp A    181 ? 7.153  23.695  13.955  1    64.949  ? 1262 A 1 .
ATOM 3009 C CZ   . ARG Axp A    181 ? 7.447  23.974  15.229  1    67.369  ? 1262 A 1 .
ATOM 3010 N NH1  . ARG Axp A    181 ? 7.13   23.136  16.205  1    69.15   ? 1262 A 1 .
ATOM 3011 N NH2  . ARG Axp A    181 ? 8.051  25.105  15.539  1    65.683  ? 1262 A 1 .
ATOM 3012 H H    . ARG Axp A    181 ? 6.298  19.83   10.43   1    65.69   ? 1262 A 1 c
ATOM 3013 H HA   . ARG Axp A    181 ? 5.433  20.153  13.077  1    66.238  ? 1262 A 1 c
ATOM 3014 H HB3  . ARG Axp A    181 ? 4.03   21.875  12.23   1    64.253  ? 1262 A 1 c
ATOM 3015 H HB2  . ARG Axp A    181 ? 4.65   21.647  10.791  1    64.312  ? 1262 A 1 c
ATOM 3016 H HG3  . ARG Axp A    181 ? 5.609  23.514  11.935  1    63.149  ? 1262 A 1 c
ATOM 3017 H HG2  . ARG Axp A    181 ? 6.693  22.466  11.445  1    63.181  ? 1262 A 1 c
ATOM 3018 H HD3  . ARG Axp A    181 ? 7.093  21.725  13.545  1    63.387  ? 1262 A 1 c
ATOM 3019 H HD2  . ARG Axp A    181 ? 5.718  22.287  14.091  1    63.418  ? 1262 A 1 c
ATOM 3020 H HE   . ARG Axp A    181 ? 7.385  24.282  13.354  1    64.982  ? 1262 A 1 c
ATOM 3021 H HH11 . ARG Axp A    181 ? 6.964  22.286  16.032  1    68.469  ? 1262 A 1 c
ATOM 3022 H HH12 . ARG Axp A    181 ? 7.1    23.431  17.037  1    68.398  ? 1262 A 1 c
ATOM 3023 H HH21 . ARG Axp A    181 ? 7.833  25.85   15.115  1    66.198  ? 1262 A 1 c
ATOM 3024 H HH22 . ARG Axp A    181 ? 8.672  25.114  16.168  1    66.198  ? 1262 A 1 c
ATOM 3025 N N    . ARG Axp A    182 ? 4.197  18.116  11.144  1    65.485  ? 1263 A 1 .
ATOM 3026 C CA   . ARG Axp A    182 ? 3.138  17.145  10.909  1    68.593  ? 1263 A 1 .
ATOM 3027 C C    . ARG Axp A    182 ? 3.22   15.952  11.863  1    74.762  ? 1263 A 1 .
ATOM 3028 O O    . ARG Axp A    182 ? 4.119  15.124  11.739  1    80.842  ? 1263 A 1 .
ATOM 3029 C CB   . ARG Axp A    182 ? 3.245  16.632  9.477   1    65.165  ? 1263 A 1 .
ATOM 3030 C CG   . ARG Axp A    182 ? 2.744  17.676  8.499   1    65.323  ? 1263 A 1 .
ATOM 3031 C CD   . ARG Axp A    182 ? 3.022  17.191  7.107   1    65.961  ? 1263 A 1 .
ATOM 3032 N NE   . ARG Axp A    182 ? 4.469  17.084  6.908   1    64.697  ? 1263 A 1 .
ATOM 3033 C CZ   . ARG Axp A    182 ? 5.032  16.618  5.815   1    67.421  ? 1263 A 1 .
ATOM 3034 N NH1  . ARG Axp A    182 ? 4.279  16.225  4.805   1    67.873  ? 1263 A 1 .
ATOM 3035 N NH2  . ARG Axp A    182 ? 6.348  16.555  5.738   1    72.87   ? 1263 A 1 .
ATOM 3036 H H    . ARG Axp A    182 ? 4.998  18.006  10.718  1    66.993  ? 1263 A 1 c
ATOM 3037 H HA   . ARG Axp A    182 ? 2.263  17.595  11.024  1    68.507  ? 1263 A 1 c
ATOM 3038 H HB3  . ARG Axp A    182 ? 2.711  15.815  9.38    1    66.008  ? 1263 A 1 c
ATOM 3039 H HB2  . ARG Axp A    182 ? 4.18   16.413  9.278   1    65.969  ? 1263 A 1 c
ATOM 3040 H HG3  . ARG Axp A    182 ? 3.209  18.527  8.65    1    65.434  ? 1263 A 1 c
ATOM 3041 H HG2  . ARG Axp A    182 ? 1.778  17.808  8.615   1    65.434  ? 1263 A 1 c
ATOM 3042 H HD3  . ARG Axp A    182 ? 2.648  17.819  6.455   1    65.534  ? 1263 A 1 c
ATOM 3043 H HD2  . ARG Axp A    182 ? 2.607  16.315  6.968   1    65.531  ? 1263 A 1 c
ATOM 3044 H HE   . ARG Axp A    182 ? 4.997  17.364  7.541   1    65.655  ? 1263 A 1 c
ATOM 3045 H HH11 . ARG Axp A    182 ? 3.489  16.594  4.664   1    67.784  ? 1263 A 1 c
ATOM 3046 H HH12 . ARG Axp A    182 ? 4.577  15.6    4.258   1    68.172  ? 1263 A 1 c
ATOM 3047 H HH21 . ARG Axp A    182 ? 6.827  17.297  5.794   1    71.176  ? 1263 A 1 c
ATOM 3048 H HH22 . ARG Axp A    182 ? 6.745  15.773  5.63    1    71.272  ? 1263 A 1 c
ATOM 3049 N N    . LYS Axp A    183 ? 2.211  15.813  12.739  1    77.824  ? 1264 A 1 .
ATOM 3050 C CA   . LYS Axp A    183 ? 2.153  14.775  13.767  1    73.312  ? 1264 A 1 .
ATOM 3051 C C    . LYS Axp A    183 ? 2.368  13.394  13.144  1    65.555  ? 1264 A 1 .
ATOM 3052 O O    . LYS Axp A    183 ? 2.761  12.469  13.847  1    61.576  ? 1264 A 1 .
ATOM 3053 C CB   . LYS Axp A    183 ? 0.884  14.881  14.635  1    78.864  ? 1264 A 1 .
ATOM 3054 C CG   . LYS Axp A    183 ? -0.402 15.429  13.973  1    87.858  ? 1264 A 1 .
ATOM 3055 C CD   . LYS Axp A    183 ? -0.583 16.95   13.923  1    87.406  ? 1264 A 1 .
ATOM 3056 C CE   . LYS Axp A    183 ? -1.026 17.512  12.584  1    84.947  ? 1264 A 1 .
ATOM 3057 N NZ   . LYS Axp A    183 ? -2.468 17.448  12.356  1    85.661  ? 1264 A 1 .
ATOM 3058 H H    . LYS Axp A    183 ? 1.522  16.409  12.689  1    76.355  ? 1264 A 1 c
ATOM 3059 H HA   . LYS Axp A    183 ? 2.907  14.926  14.379  1    73.402  ? 1264 A 1 c
ATOM 3060 H HB3  . LYS Axp A    183 ? 1.093  15.455  15.403  1    79.471  ? 1264 A 1 c
ATOM 3061 H HB2  . LYS Axp A    183 ? 0.683  13.988  14.988  1    79.403  ? 1264 A 1 c
ATOM 3062 H HG3  . LYS Axp A    183 ? -1.171 15.043  14.447  1    85.591  ? 1264 A 1 c
ATOM 3063 H HG2  . LYS Axp A    183 ? -0.433 15.086  13.057  1    85.417  ? 1264 A 1 c
ATOM 3064 H HD3  . LYS Axp A    183 ? 0.264  17.375  14.179  1    86.848  ? 1264 A 1 c
ATOM 3065 H HD2  . LYS Axp A    183 ? -1.246 17.202  14.602  1    86.911  ? 1264 A 1 c
ATOM 3066 H HE3  . LYS Axp A    183 ? -0.578 17.027  11.868  1    85.6    ? 1264 A 1 c
ATOM 3067 H HE2  . LYS Axp A    183 ? -0.746 18.443  12.528  1    85.655  ? 1264 A 1 c
ATOM 3068 H HZ1  . LYS Axp A    183 ? -2.902 17.899  13.012  1    85.451  ? 1264 A 1 c
ATOM 3069 H HZ2  . LYS Axp A    183 ? -2.741 16.584  12.359  1    85.443  ? 1264 A 1 c
ATOM 3070 H HZ3  . LYS Axp A    183 ? -2.669 17.82   11.555  1    85.443  ? 1264 A 1 c
ATOM 3071 N N    . GLU Axp A    184 ? 2.183  13.299  11.819  1    63.408  ? 1265 A 1 .
ATOM 3072 C CA   . GLU Axp A    184 ? 2.253  12.056  11.062  1    68.284  ? 1265 A 1 .
ATOM 3073 C C    . GLU Axp A    184 ? 3.691  11.544  10.904  1    69.264  ? 1265 A 1 .
ATOM 3074 O O    . GLU Axp A    184 ? 3.887  10.385  10.552  1    67.664  ? 1265 A 1 .
ATOM 3075 C CB   . GLU Axp A    184 ? 1.583  12.271  9.698   1    71.187  ? 1265 A 1 .
ATOM 3076 C CG   . GLU Axp A    184 ? 0.072  12.496  9.773   1    76.244  ? 1265 A 1 .
ATOM 3077 C CD   . GLU Axp A    184 ? -0.402 13.911  10.086  1    81.989  ? 1265 A 1 .
ATOM 3078 O OE1  . GLU Axp A    184 ? -0.194 14.78   9.214   1    95.218  ? 1265 A 1 .
ATOM 3079 O OE2  . GLU Axp A    184 ? -0.952 14.172  11.185  1    69.135  ? 1265 A 1 .
ATOM 3080 H H    . GLU Axp A    184 ? 1.983  14.061  11.357  1    65.396  ? 1265 A 1 c
ATOM 3081 H HA   . GLU Axp A    184 ? 1.734  11.37   11.555  1    68.029  ? 1265 A 1 c
ATOM 3082 H HB3  . GLU Axp A    184 ? 1.755  11.487  9.137   1    71.608  ? 1265 A 1 c
ATOM 3083 H HB2  . GLU Axp A    184 ? 1.997  13.045  9.262   1    71.581  ? 1265 A 1 c
ATOM 3084 H HG3  . GLU Axp A    184 ? -0.298 11.896  10.456  1    76.269  ? 1265 A 1 c
ATOM 3085 H HG2  . GLU Axp A    184 ? -0.324 12.227  8.917   1    76.315  ? 1265 A 1 c
ATOM 3086 N N    . SER Axp A    185 ? 4.7    12.39   11.152  1    72.52   ? 1266 A 1 .
ATOM 3087 C CA   . SER Axp A    185 ? 6.091  12.061  10.856  1    66.819  ? 1266 A 1 .
ATOM 3088 C C    . SER Axp A    185 ? 6.859  11.724  12.132  1    64.936  ? 1266 A 1 .
ATOM 3089 O O    . SER Axp A    185 ? 6.498  12.187  13.213  1    69.318  ? 1266 A 1 .
ATOM 3090 C CB   . SER Axp A    185 ? 6.765  13.19   10.121  1    63.509  ? 1266 A 1 .
ATOM 3091 O OG   . SER Axp A    185 ? 8.131  13.285  10.499  1    58.75   ? 1266 A 1 .
ATOM 3092 H H    . SER Axp A    185 ? 4.516  13.207  11.517  1    70.257  ? 1266 A 1 c
ATOM 3093 H HA   . SER Axp A    185 ? 6.101  11.262  10.271  1    66.854  ? 1266 A 1 c
ATOM 3094 H HB3  . SER Axp A    185 ? 6.311  14.029  10.325  1    63.163  ? 1266 A 1 c
ATOM 3095 H HB2  . SER Axp A    185 ? 6.702  13.033  9.159   1    63.083  ? 1266 A 1 c
ATOM 3096 H HG   . SER Axp A    185 ? 8.42   13.891  10.128  0    51.15   ? 1266 A 1 c
ATOM 3097 N N    . ALA Axp A    186 ? 7.949  10.953  11.987  1    59.759  ? 1267 A 1 .
ATOM 3098 C CA   . ALA Axp A    186 ? 8.783  10.557  13.119  1    61.311  ? 1267 A 1 .
ATOM 3099 C C    . ALA Axp A    186 ? 9.55   11.762  13.66   1    60.869  ? 1267 A 1 .
ATOM 3100 O O    . ALA Axp A    186 ? 10.094 11.742  14.765  1    52.643  ? 1267 A 1 .
ATOM 3101 C CB   . ALA Axp A    186 ? 9.741  9.47    12.696  1    63.547  ? 1267 A 1 .
ATOM 3102 H H    . ALA Axp A    186 ? 8.178  10.661  11.153  1    61.439  ? 1267 A 1 c
ATOM 3103 H HA   . ALA Axp A    186 ? 8.189  10.21   13.842  1    61.385  ? 1267 A 1 c
ATOM 3104 H HB3  . ALA Axp A    186 ? 10.127 9.05    13.483  1    62.892  ? 1267 A 1 c
ATOM 3105 H HB2  . ALA Axp A    186 ? 10.452 9.852   12.155  1    62.883  ? 1267 A 1 c
ATOM 3106 H HB1  . ALA Axp A    186 ? 9.266  8.8     12.176  1    62.957  ? 1267 A 1 c
ATOM 3107 N N    . ALA Axp A    187 ? 9.582  12.803  12.826  1    62.834  ? 1268 A 1 .
ATOM 3108 C CA   . ALA Axp A    187 ? 10.255 14.049  13.116  1    59.419  ? 1268 A 1 .
ATOM 3109 C C    . ALA Axp A    187 ? 9.284  15.091  13.671  1    55.576  ? 1268 A 1 .
ATOM 3110 O O    . ALA Axp A    187 ? 9.64   16.263  13.768  1    55.354  ? 1268 A 1 .
ATOM 3111 C CB   . ALA Axp A    187 ? 10.893 14.518  11.832  1    60.228  ? 1268 A 1 .
ATOM 3112 H H    . ALA Axp A    187 ? 9.177  12.722  12.012  1    61.551  ? 1268 A 1 c
ATOM 3113 H HA   . ALA Axp A    187 ? 10.964 13.881  13.797  1    59.457  ? 1268 A 1 c
ATOM 3114 H HB3  . ALA Axp A    187 ? 11.4   15.33   11.997  1    59.859  ? 1268 A 1 c
ATOM 3115 H HB2  . ALA Axp A    187 ? 10.205 14.699  11.171  1    59.927  ? 1268 A 1 c
ATOM 3116 H HB1  . ALA Axp A    187 ? 11.491 13.832  11.494  1    59.787  ? 1268 A 1 c
ATOM 3117 N N    . TYR Axp A    188 ? 8.064  14.681  14.042  1    54.723  ? 1269 A 1 .
ATOM 3118 C CA   . TYR Axp A    188 ? 7.074  15.634  14.517  1    57.132  ? 1269 A 1 .
ATOM 3119 C C    . TYR Axp A    188 ? 7.606  16.327  15.767  1    54.665  ? 1269 A 1 .
ATOM 3120 O O    . TYR Axp A    188 ? 7.847  15.688  16.792  1    53.385  ? 1269 A 1 .
ATOM 3121 C CB   . TYR Axp A    188 ? 5.698  15.047  14.865  1    60.475  ? 1269 A 1 .
ATOM 3122 C CG   . TYR Axp A    188 ? 4.697  16.056  15.429  1    59.788  ? 1269 A 1 .
ATOM 3123 C CD1  . TYR Axp A    188 ? 4.153  17.047  14.612  1    62.742  ? 1269 A 1 .
ATOM 3124 C CD2  . TYR Axp A    188 ? 4.297  16.029  16.768  1    54.499  ? 1269 A 1 .
ATOM 3125 C CE1  . TYR Axp A    188 ? 3.238  17.971  15.098  1    61.25   ? 1269 A 1 .
ATOM 3126 C CE2  . TYR Axp A    188 ? 3.396  16.959  17.271  1    55.244  ? 1269 A 1 .
ATOM 3127 C CZ   . TYR Axp A    188 ? 2.86   17.925  16.429  1    58.943  ? 1269 A 1 .
ATOM 3128 O OH   . TYR Axp A    188 ? 1.969  18.864  16.856  1    56.413  ? 1269 A 1 .
ATOM 3129 H H    . TYR Axp A    188 ? 7.843  13.796  14.001  1    55.571  ? 1269 A 1 c
ATOM 3130 H HA   . TYR Axp A    188 ? 6.945  16.319  13.809  1    56.701  ? 1269 A 1 c
ATOM 3131 H HB3  . TYR Axp A    188 ? 5.825  14.327  15.522  1    59.564  ? 1269 A 1 c
ATOM 3132 H HB2  . TYR Axp A    188 ? 5.318  14.644  14.053  1    59.642  ? 1269 A 1 c
ATOM 3133 H HD1  . TYR Axp A    188 ? 4.408  17.086  13.707  1    61.787  ? 1269 A 1 c
ATOM 3134 H HD2  . TYR Axp A    188 ? 4.653  15.373  17.345  1    55.959  ? 1269 A 1 c
ATOM 3135 H HE1  . TYR Axp A    188 ? 2.885  18.631  14.535  1    61.069  ? 1269 A 1 c
ATOM 3136 H HE2  . TYR Axp A    188 ? 3.132  16.922  18.174  1    56.039  ? 1269 A 1 c
ATOM 3137 H HH   . TYR Axp A    188 ? 1.786  19.475  16.055  0    49.37   ? 1269 A 1 c
ATOM 3138 N N    . ILE Axp A    189 ? 7.776  17.644  15.665  1    51.094  ? 1270 A 1 .
ATOM 3139 C CA   . ILE Axp A    189 ? 7.905  18.458  16.853  1    53.323  ? 1270 A 1 .
ATOM 3140 C C    . ILE Axp A    189 ? 6.715  19.402  16.869  1    52.765  ? 1270 A 1 .
ATOM 3141 O O    . ILE Axp A    189 ? 6.501  20.157  15.919  1    49.482  ? 1270 A 1 .
ATOM 3142 C CB   . ILE Axp A    189 ? 9.252  19.199  16.903  1    59.933  ? 1270 A 1 .
ATOM 3143 C CG1  . ILE Axp A    189 ? 10.433 18.234  16.696  1    64.334  ? 1270 A 1 .
ATOM 3144 C CG2  . ILE Axp A    189 ? 9.373  19.995  18.208  1    59.211  ? 1270 A 1 .
ATOM 3145 C CD1  . ILE Axp A    189 ? 11.775 18.908  16.483  1    65.275  ? 1270 A 1 .
ATOM 3146 H H    . ILE Axp A    189 ? 7.816  18.043  14.844  1    52.493  ? 1270 A 1 c
ATOM 3147 H HA   . ILE Axp A    189 ? 7.853  17.875  17.631  1    54.051  ? 1270 A 1 c
ATOM 3148 H HB   . ILE Axp A    189 ? 9.263  19.839  16.164  1    59.287  ? 1270 A 1 c
ATOM 3149 H HG12 . ILE Axp A    189 ? 10.243 17.67   15.919  1    63.37   ? 1270 A 1 c
ATOM 3150 H HG13 . ILE Axp A    189 ? 10.498 17.649  17.478  1    63.362  ? 1270 A 1 c
ATOM 3151 H HG21 . ILE Axp A    189 ? 10.309 20.183  18.391  1    59.452  ? 1270 A 1 c
ATOM 3152 H HG22 . ILE Axp A    189 ? 8.999  19.479  18.941  1    59.353  ? 1270 A 1 c
ATOM 3153 H HG23 . ILE Axp A    189 ? 8.888  20.834  18.124  1    59.384  ? 1270 A 1 c
ATOM 3154 H HD11 . ILE Axp A    189 ? 11.651 19.872  16.413  1    64.663  ? 1270 A 1 c
ATOM 3155 H HD12 . ILE Axp A    189 ? 12.183 18.573  15.661  1    64.893  ? 1270 A 1 c
ATOM 3156 H HD13 . ILE Axp A    189 ? 12.361 18.712  17.238  1    64.796  ? 1270 A 1 c
ATOM 3157 N N    . PRO Axp A    190 ? 5.883  19.347  17.931  1    57.446  ? 1271 A 1 .
ATOM 3158 C CA   . PRO Axp A    190 ? 4.766  20.265  18.057  1    61.039  ? 1271 A 1 .
ATOM 3159 C C    . PRO Axp A    190 ? 5.232  21.675  18.379  1    61.41   ? 1271 A 1 .
ATOM 3160 O O    . PRO Axp A    190 ? 6.346  21.87   18.879  1    65.582  ? 1271 A 1 .
ATOM 3161 C CB   . PRO Axp A    190 ? 3.945  19.694  19.21   1    62.295  ? 1271 A 1 .
ATOM 3162 C CG   . PRO Axp A    190 ? 4.989  18.983  20.045  1    61.402  ? 1271 A 1 .
ATOM 3163 C CD   . PRO Axp A    190 ? 5.999  18.436  19.08   1    60.121  ? 1271 A 1 .
ATOM 3164 H HA   . PRO Axp A    190 ? 4.24   20.267  17.231  1    60.464  ? 1271 A 1 c
ATOM 3165 H HB3  . PRO Axp A    190 ? 3.267  19.073  18.89   1    61.68   ? 1271 A 1 c
ATOM 3166 H HB2  . PRO Axp A    190 ? 3.513  20.406  19.721  1    61.781  ? 1271 A 1 c
ATOM 3167 H HG3  . PRO Axp A    190 ? 4.582  18.257  20.559  1    61.306  ? 1271 A 1 c
ATOM 3168 H HG2  . PRO Axp A    190 ? 5.414  19.605  20.667  1    61.311  ? 1271 A 1 c
ATOM 3169 H HD3  . PRO Axp A    190 ? 6.899  18.465  19.459  1    59.69   ? 1271 A 1 c
ATOM 3170 H HD2  . PRO Axp A    190 ? 5.785  17.519  18.819  1    59.755  ? 1271 A 1 c
ATOM 3171 N N    . PHE Axp A    191 ? 4.346  22.636  18.114  1    58.112  ? 1272 A 1 .
ATOM 3172 C CA   . PHE Axp A    191 ? 4.558  24.003  18.546  1    56.551  ? 1272 A 1 .
ATOM 3173 C C    . PHE Axp A    191 ? 4.695  23.96   20.061  1    58.712  ? 1272 A 1 .
ATOM 3174 O O    . PHE Axp A    191 ? 4.24   22.999  20.687  1    56.986  ? 1272 A 1 .
ATOM 3175 C CB   . PHE Axp A    191 ? 3.43   24.923  18.075  1    54.627  ? 1272 A 1 .
ATOM 3176 C CG   . PHE Axp A    191 ? 3.449  25.201  16.578  1    54.741  ? 1272 A 1 .
ATOM 3177 C CD1  . PHE Axp A    191 ? 3.551  24.17   15.654  1    52.093  ? 1272 A 1 .
ATOM 3178 C CD2  . PHE Axp A    191 ? 3.387  26.504  16.098  1    61.363  ? 1272 A 1 .
ATOM 3179 C CE1  . PHE Axp A    191 ? 3.584  24.433  14.296  1    53.468  ? 1272 A 1 .
ATOM 3180 C CE2  . PHE Axp A    191 ? 3.423  26.763  14.737  1    60.997  ? 1272 A 1 .
ATOM 3181 C CZ   . PHE Axp A    191 ? 3.538  25.726  13.84   1    56.963  ? 1272 A 1 .
ATOM 3182 H H    . PHE Axp A    191 ? 3.566  22.422  17.688  1    58.402  ? 1272 A 1 c
ATOM 3183 H HA   . PHE Axp A    191 ? 5.412  24.327  18.158  1    56.979  ? 1272 A 1 c
ATOM 3184 H HB3  . PHE Axp A    191 ? 3.499  25.776  18.559  1    55.168  ? 1272 A 1 c
ATOM 3185 H HB2  . PHE Axp A    191 ? 2.57   24.51   18.311  1    55.121  ? 1272 A 1 c
ATOM 3186 H HD1  . PHE Axp A    191 ? 3.597  23.278  15.952  1    53.246  ? 1272 A 1 c
ATOM 3187 H HD2  . PHE Axp A    191 ? 3.326  27.222  16.708  1    59.512  ? 1272 A 1 c
ATOM 3188 H HE1  . PHE Axp A    191 ? 3.654  23.72   13.681  1    54.106  ? 1272 A 1 c
ATOM 3189 H HE2  . PHE Axp A    191 ? 3.382  27.654  14.426  1    59.964  ? 1272 A 1 c
ATOM 3190 H HZ   . PHE Axp A    191 ? 3.547  25.901  12.913  1    57.007  ? 1272 A 1 c
ATOM 3191 N N    . GLY Axp A    192 ? 5.374  24.973  20.619  1    60.994  ? 1273 A 1 .
ATOM 3192 C CA   . GLY Axp A    192 ? 5.625  25.053  22.05   1    58.437  ? 1273 A 1 .
ATOM 3193 C C    . GLY Axp A    192 ? 6.867  24.261  22.437  1    56.891  ? 1273 A 1 .
ATOM 3194 O O    . GLY Axp A    192 ? 7.665  24.729  23.234  1    55.529  ? 1273 A 1 .
ATOM 3195 H H    . GLY Axp A    192 ? 5.692  25.642  20.083  1    59.815  ? 1273 A 1 c
ATOM 3196 H HA3  . GLY Axp A    192 ? 4.843  24.703  22.538  1    58.674  ? 1273 A 1 c
ATOM 3197 H HA2  . GLY Axp A    192 ? 5.745  25.998  22.304  1    58.682  ? 1273 A 1 c
ATOM 3198 N N    . GLU Axp A    193 ? 7.018  23.058  21.873  1    58.931  ? 1274 A 1 .
ATOM 3199 C CA   . GLU Axp A    193 ? 8.237  22.292  22.045  1    59.55   ? 1274 A 1 .
ATOM 3200 C C    . GLU Axp A    193 ? 9.339  22.843  21.141  1    59.696  ? 1274 A 1 .
ATOM 3201 O O    . GLU Axp A    193 ? 9.056  23.513  20.135  1    50.435  ? 1274 A 1 .
ATOM 3202 C CB   . GLU Axp A    193 ? 7.979  20.808  21.806  1    62.149  ? 1274 A 1 .
ATOM 3203 C CG   . GLU Axp A    193 ? 7.25   20.146  22.971  1    64.949  ? 1274 A 1 .
ATOM 3204 C CD   . GLU Axp A    193 ? 7.481  18.647  23.022  1    70.673  ? 1274 A 1 .
ATOM 3205 O OE1  . GLU Axp A    193 ? 6.717  17.91   22.364  1    69.451  ? 1274 A 1 .
ATOM 3206 O OE2  . GLU Axp A    193 ? 8.463  18.217  23.677  1    76.122  ? 1274 A 1 .
ATOM 3207 H H    . GLU Axp A    193 ? 6.336  22.696  21.385  1    58.642  ? 1274 A 1 c
ATOM 3208 H HA   . GLU Axp A    193 ? 8.532  22.396  22.985  1    59.951  ? 1274 A 1 c
ATOM 3209 H HB3  . GLU Axp A    193 ? 8.838  20.356  21.665  1    62.116  ? 1274 A 1 c
ATOM 3210 H HB2  . GLU Axp A    193 ? 7.449  20.704  20.988  1    62.143  ? 1274 A 1 c
ATOM 3211 H HG3  . GLU Axp A    193 ? 6.287  20.314  22.888  1    65.547  ? 1274 A 1 c
ATOM 3212 H HG2  . GLU Axp A    193 ? 7.556  20.541  23.814  1    65.486  ? 1274 A 1 c
ATOM 3213 N N    . GLY Axp A    194 ? 10.585 22.563  21.581  1    60.867  ? 1275 A 1 .
ATOM 3214 C CA   . GLY Axp A    194 ? 11.816 22.876  20.865  1    57.999  ? 1275 A 1 .
ATOM 3215 C C    . GLY Axp A    194 ? 12.68  23.902  21.596  1    54.416  ? 1275 A 1 .
ATOM 3216 O O    . GLY Axp A    194 ? 12.145 24.882  22.104  1    52.232  ? 1275 A 1 .
ATOM 3217 H H    . GLY Axp A    194 ? 10.664 22.145  22.39   1    59.923  ? 1275 A 1 c
ATOM 3218 H HA3  . GLY Axp A    194 ? 11.588 23.224  19.977  1    57.695  ? 1275 A 1 c
ATOM 3219 H HA2  . GLY Axp A    194 ? 12.33  22.044  20.739  1    57.791  ? 1275 A 1 c
ATOM 3220 N N    . ASP Axp A    195 ? 14.012 23.716  21.574  1    54.532  ? 1276 A 1 .
ATOM 3221 C CA   . ASP Axp A    195 ? 14.932 24.644  22.227  1    54.867  ? 1276 A 1 .
ATOM 3222 C C    . ASP Axp A    195 ? 15.754 25.436  21.213  1    49.12   ? 1276 A 1 .
ATOM 3223 O O    . ASP Axp A    195 ? 15.92  26.645  21.358  1    52.387  ? 1276 A 1 .
ATOM 3224 C CB   . ASP Axp A    195 ? 15.927 23.951  23.139  1    55.821  ? 1276 A 1 .
ATOM 3225 C CG   . ASP Axp A    195 ? 15.546 22.541  23.538  1    53.205  ? 1276 A 1 .
ATOM 3226 O OD1  . ASP Axp A    195 ? 15.891 21.604  22.762  1    51.089  ? 1276 A 1 .
ATOM 3227 O OD2  . ASP Axp A    195 ? 14.875 22.432  24.58   1    48.437  ? 1276 A 1 .
ATOM 3228 H H    . ASP Axp A    195 ? 14.355 22.994  21.131  1    54.536  ? 1276 A 1 c
ATOM 3229 H HA   . ASP Axp A    195 ? 14.409 25.276  22.771  1    53.869  ? 1276 A 1 c
ATOM 3230 H HB3  . ASP Axp A    195 ? 16.021 24.482  23.957  1    54.971  ? 1276 A 1 c
ATOM 3231 H HB2  . ASP Axp A    195 ? 16.804 23.913  22.704  1    54.887  ? 1276 A 1 c
ATOM 3232 N N    . PHE Axp A    196 ? 16.319 24.742  20.225  1    44.302  ? 1277 A 1 .
ATOM 3233 C CA   . PHE Axp A    196 ? 17.043 25.404  19.151  1    43.877  ? 1277 A 1 .
ATOM 3234 C C    . PHE Axp A    196 ? 16.732 24.706  17.844  1    41.453  ? 1277 A 1 .
ATOM 3235 O O    . PHE Axp A    196 ? 16.222 23.592  17.845  1    47.489  ? 1277 A 1 .
ATOM 3236 C CB   . PHE Axp A    196 ? 18.563 25.366  19.304  1    43.916  ? 1277 A 1 .
ATOM 3237 C CG   . PHE Axp A    196 ? 19.012 25.978  20.614  1    40.977  ? 1277 A 1 .
ATOM 3238 C CD1  . PHE Axp A    196 ? 19.045 27.354  20.766  1    41.079  ? 1277 A 1 .
ATOM 3239 C CD2  . PHE Axp A    196 ? 19.367 25.172  21.682  1    38.585  ? 1277 A 1 .
ATOM 3240 C CE1  . PHE Axp A    196 ? 19.437 27.908  21.965  1    43.776  ? 1277 A 1 .
ATOM 3241 C CE2  . PHE Axp A    196 ? 19.781 25.729  22.87   1    40.924  ? 1277 A 1 .
ATOM 3242 C CZ   . PHE Axp A    196 ? 19.805 27.093  23.016  1    44.173  ? 1277 A 1 .
ATOM 3243 H H    . PHE Axp A    196 ? 16.263 23.83   20.223  1    45.461  ? 1277 A 1 c
ATOM 3244 H HA   . PHE Axp A    196 ? 16.746 26.35   19.091  1    43.557  ? 1277 A 1 c
ATOM 3245 H HB3  . PHE Axp A    196 ? 18.969 25.862  18.559  1    42.979  ? 1277 A 1 c
ATOM 3246 H HB2  . PHE Axp A    196 ? 18.864 24.432  19.261  1    43.072  ? 1277 A 1 c
ATOM 3247 H HD1  . PHE Axp A    196 ? 18.793 27.911  20.047  1    41.684  ? 1277 A 1 c
ATOM 3248 H HD2  . PHE Axp A    196 ? 19.35  24.234  21.585  1    39.728  ? 1277 A 1 c
ATOM 3249 H HE1  . PHE Axp A    196 ? 19.466 28.847  22.063  1    43.166  ? 1277 A 1 c
ATOM 3250 H HE2  . PHE Axp A    196 ? 20.019 25.172  23.591  1    41.211  ? 1277 A 1 c
ATOM 3251 H HZ   . PHE Axp A    196 ? 20.08  27.474  23.835  1    43.233  ? 1277 A 1 c
ATOM 3252 N N    . TYR Axp A    197 ? 17.069 25.361  16.741  1    37.957  ? 1278 A 1 .
ATOM 3253 C CA   . TYR Axp A    197 ? 16.927 24.71   15.46   1    38.567  ? 1278 A 1 .
ATOM 3254 C C    . TYR Axp A    197 ? 18.322 24.352  14.984  1    38.75   ? 1278 A 1 .
ATOM 3255 O O    . TYR Axp A    197 ? 19.072 25.189  14.493  1    39.452  ? 1278 A 1 .
ATOM 3256 C CB   . TYR Axp A    197 ? 16.181 25.538  14.418  1    41.934  ? 1278 A 1 .
ATOM 3257 C CG   . TYR Axp A    197 ? 16.043 24.776  13.114  1    40.386  ? 1278 A 1 .
ATOM 3258 C CD1  . TYR Axp A    197 ? 15.241 23.656  13.052  1    44.026  ? 1278 A 1 .
ATOM 3259 C CD2  . TYR Axp A    197 ? 16.735 25.14   11.976  1    39.511  ? 1278 A 1 .
ATOM 3260 C CE1  . TYR Axp A    197 ? 15.108 22.92   11.89   1    47.252  ? 1278 A 1 .
ATOM 3261 C CE2  . TYR Axp A    197 ? 16.612 24.416  10.804  1    42.13   ? 1278 A 1 .
ATOM 3262 C CZ   . TYR Axp A    197 ? 15.796 23.3    10.76   1    45.265  ? 1278 A 1 .
ATOM 3263 O OH   . TYR Axp A    197 ? 15.626 22.52   9.654   1    48.733  ? 1278 A 1 .
ATOM 3264 H H    . TYR Axp A    197 ? 17.389 26.216  16.783  1    38.967  ? 1278 A 1 c
ATOM 3265 H HA   . TYR Axp A    197 ? 16.419 23.868  15.595  1    39.16   ? 1278 A 1 c
ATOM 3266 H HB3  . TYR Axp A    197 ? 16.672 26.374  14.259  1    40.785  ? 1278 A 1 c
ATOM 3267 H HB2  . TYR Axp A    197 ? 15.289 25.752  14.762  1    40.831  ? 1278 A 1 c
ATOM 3268 H HD1  . TYR Axp A    197 ? 14.769 23.387  13.821  1    43.996  ? 1278 A 1 c
ATOM 3269 H HD2  . TYR Axp A    197 ? 17.297 25.899  11.996  1    40.404  ? 1278 A 1 c
ATOM 3270 H HE1  . TYR Axp A    197 ? 14.552 22.16   11.871  1    45.93   ? 1278 A 1 c
ATOM 3271 H HE2  . TYR Axp A    197 ? 17.088 24.68   10.035  1    42.257  ? 1278 A 1 c
ATOM 3272 H HH   . TYR Axp A    197 ? 15.082 21.929  9.795   0    32.06   ? 1278 A 1 c
ATOM 3273 N N    . TYR Axp A    198 ? 18.656 23.081  15.159  1    39.17   ? 1279 A 1 .
ATOM 3274 C CA   . TYR Axp A    198 ? 19.989 22.602  14.865  1    36.728  ? 1279 A 1 .
ATOM 3275 C C    . TYR Axp A    198 ? 20.169 22.399  13.37   1    34.871  ? 1279 A 1 .
ATOM 3276 O O    . TYR Axp A    198 ? 19.22  22.109  12.644  1    34.138  ? 1279 A 1 .
ATOM 3277 C CB   . TYR Axp A    198 ? 20.187 21.289  15.611  1    35.953  ? 1279 A 1 .
ATOM 3278 C CG   . TYR Axp A    198 ? 20.05  21.459  17.113  1    35.651  ? 1279 A 1 .
ATOM 3279 C CD1  . TYR Axp A    198 ? 20.941 22.26   17.815  1    35.115  ? 1279 A 1 .
ATOM 3280 C CD2  . TYR Axp A    198 ? 19.056 20.803  17.826  1    36.365  ? 1279 A 1 .
ATOM 3281 C CE1  . TYR Axp A    198 ? 20.855 22.395  19.189  1    34.544  ? 1279 A 1 .
ATOM 3282 C CE2  . TYR Axp A    198 ? 18.954 20.937  19.202  1    37.842  ? 1279 A 1 .
ATOM 3283 C CZ   . TYR Axp A    198 ? 19.861 21.732  19.884  1    35.101  ? 1279 A 1 .
ATOM 3284 O OH   . TYR Axp A    198 ? 19.767 21.865  21.233  1    32.687  ? 1279 A 1 .
ATOM 3285 H H    . TYR Axp A    198 ? 18.032 22.489  15.465  1    38.56   ? 1279 A 1 c
ATOM 3286 H HA   . TYR Axp A    198 ? 20.651 23.266  15.192  1    36.655  ? 1279 A 1 c
ATOM 3287 H HB3  . TYR Axp A    198 ? 21.082 20.939  15.405  1    36.063  ? 1279 A 1 c
ATOM 3288 H HB2  . TYR Axp A    198 ? 19.518 20.64   15.296  1    36.079  ? 1279 A 1 c
ATOM 3289 H HD1  . TYR Axp A    198 ? 21.633 22.703  17.35   1    35.121  ? 1279 A 1 c
ATOM 3290 H HD2  . TYR Axp A    198 ? 18.443 20.249  17.368  1    36.562  ? 1279 A 1 c
ATOM 3291 H HE1  . TYR Axp A    198 ? 21.469 22.939  19.648  1    34.787  ? 1279 A 1 c
ATOM 3292 H HE2  . TYR Axp A    198 ? 18.276 20.484  19.674  1    36.821  ? 1279 A 1 c
ATOM 3293 H HH   . TYR Axp A    198 ? 20.401 22.43   21.473  0    27.47   ? 1279 A 1 c
ATOM 3294 N N    . HIS Axp A    199 ? 21.432 22.502  12.956  1    34.109  ? 1280 A 1 .
ATOM 3295 C CA   . HIS Axp A    199 ? 21.84  22.304  11.58   1    33.347  ? 1280 A 1 .
ATOM 3296 C C    . HIS Axp A    199 ? 22.353 20.879  11.387  1    33.58   ? 1280 A 1 .
ATOM 3297 O O    . HIS Axp A    199 ? 23.174 20.388  12.169  1    32.8    ? 1280 A 1 .
ATOM 3298 C CB   . HIS Axp A    199 ? 22.955 23.291  11.262  1    34.509  ? 1280 A 1 .
ATOM 3299 C CG   . HIS Axp A    199 ? 23.143 23.573  9.822   1    34.006  ? 1280 A 1 .
ATOM 3300 N ND1  . HIS Axp A    199 ? 23.948 24.618  9.409   1    35.276  ? 1280 A 1 .
ATOM 3301 C CD2  . HIS Axp A    199 ? 22.679 22.985  8.734   1    32.797  ? 1280 A 1 .
ATOM 3302 C CE1  . HIS Axp A    199 ? 23.975 24.632  8.093   1    35.064  ? 1280 A 1 .
ATOM 3303 N NE2  . HIS Axp A    199 ? 23.213 23.648  7.664   1    34.883  ? 1280 A 1 .
ATOM 3304 H H    . HIS Axp A    199 ? 22.077 22.704  13.571  1    34.131  ? 1280 A 1 c
ATOM 3305 H HA   . HIS Axp A    199 ? 21.069 22.455  10.98   1    33.734  ? 1280 A 1 c
ATOM 3306 H HB3  . HIS Axp A    199 ? 23.797 22.941  11.628  1    34.121  ? 1280 A 1 c
ATOM 3307 H HB2  . HIS Axp A    199 ? 22.767 24.133  11.726  1    34.154  ? 1280 A 1 c
ATOM 3308 H HD1  . HIS Axp A    199 ? 24.398 25.145  10.027  0    24.72   ? 1280 A 1 c
ATOM 3309 H HD2  . HIS Axp A    199 ? 22.109 22.245  8.684   1    33.636  ? 1280 A 1 c
ATOM 3310 H HE1  . HIS Axp A    199 ? 24.446 25.239  7.557   1    35.188  ? 1280 A 1 c
ATOM 3311 H HE2  . HIS Axp A    199 ? 23.012 23.493  6.892   0    25.22   ? 1280 A 1 c
ATOM 3312 N N    . ALA Axp A    200 ? 21.85  20.229  10.332  1    32.515  ? 1281 A 1 .
ATOM 3313 C CA   . ALA Axp A    200 ? 22.221 18.866  10.004  1    31.353  ? 1281 A 1 .
ATOM 3314 C C    . ALA Axp A    200 ? 23.618 18.836  9.405   1    32.745  ? 1281 A 1 .
ATOM 3315 O O    . ALA Axp A    200 ? 24.253 17.787  9.341   1    34.372  ? 1281 A 1 .
ATOM 3316 C CB   . ALA Axp A    200 ? 21.217 18.28   9.051   1    32.131  ? 1281 A 1 .
ATOM 3317 H H    . ALA Axp A    200 ? 21.238 20.652  9.802   1    32.589  ? 1281 A 1 c
ATOM 3318 H HA   . ALA Axp A    200 ? 22.234 18.336  10.83   1    32.372  ? 1281 A 1 c
ATOM 3319 H HB3  . ALA Axp A    200 ? 21.529 17.415  8.737   1    32.046  ? 1281 A 1 c
ATOM 3320 H HB2  . ALA Axp A    200 ? 21.099 18.875  8.291   1    32.177  ? 1281 A 1 c
ATOM 3321 H HB1  . ALA Axp A    200 ? 20.37  18.169  9.506   1    32.377  ? 1281 A 1 c
ATOM 3322 N N    . ALA Axp A    201 ? 24.101 19.999  8.964   1    33.762  ? 1282 A 1 .
ATOM 3323 C CA   . ALA Axp A    201 ? 25.34  20.046  8.208   1    33.423  ? 1282 A 1 .
ATOM 3324 C C    . ALA Axp A    201 ? 26.533 19.771  9.114   1    32.459  ? 1282 A 1 .
ATOM 3325 O O    . ALA Axp A    201 ? 27.61  19.571  8.599   1    36.545  ? 1282 A 1 .
ATOM 3326 C CB   . ALA Axp A    201 ? 25.481 21.367  7.49    1    33.176  ? 1282 A 1 .
ATOM 3327 H H    . ALA Axp A    201 ? 23.659 20.778  9.137   1    33.418  ? 1282 A 1 c
ATOM 3328 H HA   . ALA Axp A    201 ? 25.306 19.32   7.528   1    33.404  ? 1282 A 1 c
ATOM 3329 H HB3  . ALA Axp A    201 ? 26.324 21.387  7.005   1    33.253  ? 1282 A 1 c
ATOM 3330 H HB2  . ALA Axp A    201 ? 25.465 22.094  8.135   1    33.259  ? 1282 A 1 c
ATOM 3331 H HB1  . ALA Axp A    201 ? 24.747 21.478  6.863   1    33.259  ? 1282 A 1 c
ATOM 3332 N N    . ILE Axp A    202 ? 26.348 19.825  10.436  1    32.864  ? 1283 A 1 .
ATOM 3333 C CA   . ILE Axp A    202 ? 27.349 19.397  11.398  1    33.544  ? 1283 A 1 .
ATOM 3334 C C    . ILE Axp A    202 ? 26.688 18.77   12.616  1    35.318  ? 1283 A 1 .
ATOM 3335 O O    . ILE Axp A    202 ? 25.766 19.318  13.242  1    38.176  ? 1283 A 1 .
ATOM 3336 C CB   . ILE Axp A    202 ? 28.232 20.543  11.9    1    34.704  ? 1283 A 1 .
ATOM 3337 C CG1  . ILE Axp A    202 ? 29.018 21.147  10.782  1    38.307  ? 1283 A 1 .
ATOM 3338 C CG2  . ILE Axp A    202 ? 29.136 20.043  13.035  1    34.625  ? 1283 A 1 .
ATOM 3339 C CD1  . ILE Axp A    202 ? 30.102 22.094  11.249  1    42.011  ? 1283 A 1 .
ATOM 3340 H H    . ILE Axp A    202 ? 25.564 20.168  10.757  1    32.944  ? 1283 A 1 c
ATOM 3341 H HA   . ILE Axp A    202 ? 27.922 18.732  10.973  1    33.984  ? 1283 A 1 c
ATOM 3342 H HB   . ILE Axp A    202 ? 27.646 21.237  12.263  1    35.091  ? 1283 A 1 c
ATOM 3343 H HG12 . ILE Axp A    202 ? 28.407 21.633  10.192  1    38.192  ? 1283 A 1 c
ATOM 3344 H HG13 . ILE Axp A    202 ? 29.43  20.429  10.263  1    38.149  ? 1283 A 1 c
ATOM 3345 H HG21 . ILE Axp A    202 ? 29.827 20.698  13.222  1    34.778  ? 1283 A 1 c
ATOM 3346 H HG22 . ILE Axp A    202 ? 29.552 19.204  12.773  1    34.681  ? 1283 A 1 c
ATOM 3347 H HG23 . ILE Axp A    202 ? 28.607 19.903  13.837  1    34.676  ? 1283 A 1 c
ATOM 3348 H HD11 . ILE Axp A    202 ? 29.814 22.563  12.055  1    40.749  ? 1283 A 1 c
ATOM 3349 H HD12 . ILE Axp A    202 ? 30.27  22.745  10.542  1    40.878  ? 1283 A 1 c
ATOM 3350 H HD13 . ILE Axp A    202 ? 30.922 21.599  11.435  1    40.78   ? 1283 A 1 c
ATOM 3351 N N    . PHE Axp A    203 ? 27.264 17.65   13.012  1    33.258  ? 1284 A 1 .
ATOM 3352 C CA   . PHE Axp A    203 ? 26.886 17.06   14.269  1    32.387  ? 1284 A 1 .
ATOM 3353 C C    . PHE Axp A    203 ? 27.997 16.09   14.602  1    30.925  ? 1284 A 1 .
ATOM 3354 O O    . PHE Axp A    203 ? 28.691 15.621  13.701  1    32.756  ? 1284 A 1 .
ATOM 3355 C CB   . PHE Axp A    203 ? 25.497 16.422  14.164  1    32.242  ? 1284 A 1 .
ATOM 3356 C CG   . PHE Axp A    203 ? 25.412 15.258  13.19   1    31.211  ? 1284 A 1 .
ATOM 3357 C CD1  . PHE Axp A    203 ? 25.148 15.475  11.848  1    31.915  ? 1284 A 1 .
ATOM 3358 C CD2  . PHE Axp A    203 ? 25.611 13.954  13.615  1    31.95   ? 1284 A 1 .
ATOM 3359 C CE1  . PHE Axp A    203 ? 25.055 14.415  10.959  1    32.167  ? 1284 A 1 .
ATOM 3360 C CE2  . PHE Axp A    203 ? 25.521 12.897  12.723  1    32.053  ? 1284 A 1 .
ATOM 3361 C CZ   . PHE Axp A    203 ? 25.244 13.129  11.4    1    32.269  ? 1284 A 1 .
ATOM 3362 H H    . PHE Axp A    203 ? 27.898 17.242  12.494  1    33.52   ? 1284 A 1 c
ATOM 3363 H HA   . PHE Axp A    203 ? 26.862 17.771  14.96   1    32.254  ? 1284 A 1 c
ATOM 3364 H HB3  . PHE Axp A    203 ? 24.852 17.111  13.891  1    32.085  ? 1284 A 1 c
ATOM 3365 H HB2  . PHE Axp A    203 ? 25.233 16.106  15.057  1    32.045  ? 1284 A 1 c
ATOM 3366 H HD1  . PHE Axp A    203 ? 25.007 16.356  11.54   1    31.817  ? 1284 A 1 c
ATOM 3367 H HD2  . PHE Axp A    203 ? 25.792 13.783  14.525  1    31.81   ? 1284 A 1 c
ATOM 3368 H HE1  . PHE Axp A    203 ? 24.87  14.579  10.049  1    32.125  ? 1284 A 1 c
ATOM 3369 H HE2  . PHE Axp A    203 ? 25.653 12.013  13.028  1    32.074  ? 1284 A 1 c
ATOM 3370 H HZ   . PHE Axp A    203 ? 25.193 12.408  10.793  1    32.186  ? 1284 A 1 c
ATOM 3371 N N    . GLY Axp A    204 ? 28.148 15.829  15.891  1    27.619  ? 1285 A 1 .
ATOM 3372 C CA   . GLY Axp A    204 ? 29.192 14.945  16.335  1    26.538  ? 1285 A 1 .
ATOM 3373 C C    . GLY Axp A    204 ? 29.019 14.677  17.81   1    26.621  ? 1285 A 1 .
ATOM 3374 O O    . GLY Axp A    204 ? 28.181 15.286  18.46   1    26.775  ? 1285 A 1 .
ATOM 3375 H H    . GLY Axp A    204 ? 27.589 16.209  16.507  1    28.164  ? 1285 A 1 c
ATOM 3376 H HA3  . GLY Axp A    204 ? 30.068 15.364  16.169  1    26.856  ? 1285 A 1 c
ATOM 3377 H HA2  . GLY Axp A    204 ? 29.148 14.1    15.829  1    26.909  ? 1285 A 1 c
ATOM 3378 N N    . GLY Axp A    205 ? 29.831 13.742  18.275  1    27.133  ? 1286 A 1 .
ATOM 3379 C CA   . GLY Axp A    205 ? 29.965 13.392  19.666  1    28.076  ? 1286 A 1 .
ATOM 3380 C C    . GLY Axp A    205 ? 31.038 12.318  19.736  1    29.619  ? 1286 A 1 .
ATOM 3381 O O    . GLY Axp A    205 ? 31.83  12.186  18.812  1    28.919  ? 1286 A 1 .
ATOM 3382 H H    . GLY Axp A    205 ? 30.35  13.292  17.671  1    27.273  ? 1286 A 1 c
ATOM 3383 H HA3  . GLY Axp A    205 ? 29.109 13.047  20.009  1    28.203  ? 1286 A 1 c
ATOM 3384 H HA2  . GLY Axp A    205 ? 30.227 14.182  20.19   1    28.18   ? 1286 A 1 c
ATOM 3385 N N    . THR Axp A    206 ? 31.029 11.542  20.819  1    32.964  ? 1287 A 1 .
ATOM 3386 C CA   . THR Axp A    206 ? 31.71  10.262  20.847  1    33.642  ? 1287 A 1 .
ATOM 3387 C C    . THR Axp A    206 ? 31.076 9.424   19.753  1    32.438  ? 1287 A 1 .
ATOM 3388 O O    . THR Axp A    206 ? 29.905 9.624   19.463  1    32.845  ? 1287 A 1 .
ATOM 3389 C CB   . THR Axp A    206 ? 31.566 9.563   22.203  1    37.077  ? 1287 A 1 .
ATOM 3390 O OG1  . THR Axp A    206 ? 30.248 9.02    22.245  1    38.109  ? 1287 A 1 .
ATOM 3391 C CG2  . THR Axp A    206 ? 31.82  10.481  23.392  1    39.389  ? 1287 A 1 .
ATOM 3392 H H    . THR Axp A    206 ? 30.574 11.819  21.561  1    32.366  ? 1287 A 1 c
ATOM 3393 H HA   . THR Axp A    206 ? 32.661 10.402  20.651  1    33.877  ? 1287 A 1 c
ATOM 3394 H HB   . THR Axp A    206 ? 32.216 8.822   22.247  1    37.033  ? 1287 A 1 c
ATOM 3395 H HG1  . THR Axp A    206 ? 29.65  9.641   22.229  0    24.72   ? 1287 A 1 c
ATOM 3396 H HG21 . THR Axp A    206 ? 32.213 9.969   24.119  1    38.665  ? 1287 A 1 c
ATOM 3397 H HG22 . THR Axp A    206 ? 30.979 10.868  23.689  1    38.626  ? 1287 A 1 c
ATOM 3398 H HG23 . THR Axp A    206 ? 32.429 11.191  23.131  1    38.617  ? 1287 A 1 c
ATOM 3399 N N    . PRO Axp A    207 ? 31.779 8.439   19.161  1    34.697  ? 1288 A 1 .
ATOM 3400 C CA   . PRO Axp A    207 ? 31.175 7.618   18.118  1    37.33   ? 1288 A 1 .
ATOM 3401 C C    . PRO Axp A    207 ? 29.967 6.825   18.621  1    36.957  ? 1288 A 1 .
ATOM 3402 O O    . PRO Axp A    207 ? 28.978 6.701   17.893  1    33.755  ? 1288 A 1 .
ATOM 3403 C CB   . PRO Axp A    207 ? 32.324 6.745   17.628  1    37.653  ? 1288 A 1 .
ATOM 3404 C CG   . PRO Axp A    207 ? 33.571 7.387   18.211  1    37.068  ? 1288 A 1 .
ATOM 3405 C CD   . PRO Axp A    207 ? 33.15  8.028   19.482  1    35.93   ? 1288 A 1 .
ATOM 3406 H HA   . PRO Axp A    207 ? 30.889 8.2     17.384  1    36.773  ? 1288 A 1 c
ATOM 3407 H HB3  . PRO Axp A    207 ? 32.362 6.736   16.652  1    37.447  ? 1288 A 1 c
ATOM 3408 H HB2  . PRO Axp A    207 ? 32.225 5.827   17.947  1    37.445  ? 1288 A 1 c
ATOM 3409 H HG3  . PRO Axp A    207 ? 33.934 8.055   17.597  1    36.931  ? 1288 A 1 c
ATOM 3410 H HG2  . PRO Axp A    207 ? 34.259 6.713   18.382  1    36.931  ? 1288 A 1 c
ATOM 3411 H HD3  . PRO Axp A    207 ? 33.161 7.396   20.227  1    35.888  ? 1288 A 1 c
ATOM 3412 H HD2  . PRO Axp A    207 ? 33.71  8.798   19.696  1    35.866  ? 1288 A 1 c
ATOM 3413 N N    . THR Axp A    208 ? 30.066 6.323   19.868  1    35.581  ? 1289 A 1 .
ATOM 3414 C CA   . THR Axp A    208 ? 28.931 5.779   20.601  1    35.982  ? 1289 A 1 .
ATOM 3415 C C    . THR Axp A    208 ? 27.687 6.632   20.391  1    35.827  ? 1289 A 1 .
ATOM 3416 O O    . THR Axp A    208 ? 26.606 6.112   20.148  1    38.707  ? 1289 A 1 .
ATOM 3417 C CB   . THR Axp A    208 ? 29.245 5.734   22.09   1    37.727  ? 1289 A 1 .
ATOM 3418 O OG1  . THR Axp A    208 ? 30.047 4.57    22.2    1    43.375  ? 1289 A 1 .
ATOM 3419 C CG2  . THR Axp A    208 ? 28.005 5.621   22.96   1    36.474  ? 1289 A 1 .
ATOM 3420 H H    . THR Axp A    208 ? 30.887 6.313   20.272  1    36.023  ? 1289 A 1 c
ATOM 3421 H HA   . THR Axp A    208 ? 28.755 4.867   20.281  1    36.231  ? 1289 A 1 c
ATOM 3422 H HB   . THR Axp A    208 ? 29.772 6.526   22.354  1    38.194  ? 1289 A 1 c
ATOM 3423 H HG1  . THR Axp A    208 ? 29.725 3.917   22.09   0    28.81   ? 1289 A 1 c
ATOM 3424 H HG21 . THR Axp A    208 ? 28.251 5.256   23.826  1    36.837  ? 1289 A 1 c
ATOM 3425 H HG22 . THR Axp A    208 ? 27.36  5.032   22.534  1    36.833  ? 1289 A 1 c
ATOM 3426 H HG23 . THR Axp A    208 ? 27.61  6.501   23.082  1    36.833  ? 1289 A 1 c
ATOM 3427 N N    . GLN Axp A    209 ? 27.842 7.94    20.574  1    34.263  ? 1290 A 1 .
ATOM 3428 C CA   . GLN Axp A    209 ? 26.737 8.865   20.45   1    33.693  ? 1290 A 1 .
ATOM 3429 C C    . GLN Axp A    209 ? 26.328 9.036   18.998  1    31.645  ? 1290 A 1 .
ATOM 3430 O O    . GLN Axp A    209 ? 25.157 8.909   18.682  1    32.066  ? 1290 A 1 .
ATOM 3431 C CB   . GLN Axp A    209 ? 27.174 10.184  21.069  1    36.018  ? 1290 A 1 .
ATOM 3432 C CG   . GLN Axp A    209 ? 26.927 10.199  22.567  1    35.822  ? 1290 A 1 .
ATOM 3433 C CD   . GLN Axp A    209 ? 25.447 10.264  22.837  1    36.864  ? 1290 A 1 .
ATOM 3434 O OE1  . GLN Axp A    209 ? 24.661 10.737  22.003  1    38.349  ? 1290 A 1 .
ATOM 3435 N NE2  . GLN Axp A    209 ? 25.062 9.798   24.01   1    38.074  ? 1290 A 1 .
ATOM 3436 H H    . GLN Axp A    209 ? 28.667 8.265   20.793  1    34.533  ? 1290 A 1 c
ATOM 3437 H HA   . GLN Axp A    209 ? 25.967 8.501   20.955  1    33.871  ? 1290 A 1 c
ATOM 3438 H HB3  . GLN Axp A    209 ? 26.68  10.92   20.65   1    35.428  ? 1290 A 1 c
ATOM 3439 H HB2  . GLN Axp A    209 ? 28.126 10.328  20.899  1    35.401  ? 1290 A 1 c
ATOM 3440 H HG3  . GLN Axp A    209 ? 27.369 10.974  22.971  1    36.045  ? 1290 A 1 c
ATOM 3441 H HG2  . GLN Axp A    209 ? 27.299 9.387   22.973  1    36.103  ? 1290 A 1 c
ATOM 3442 H HE21 . GLN Axp A    209 ? 24.357 9.263   24.064  1    37.698  ? 1290 A 1 c
ATOM 3443 H HE22 . GLN Axp A    209 ? 25.51  10.02   24.743  1    37.698  ? 1290 A 1 c
ATOM 3444 N N    . VAL Axp A    210 ? 27.292 9.351   18.137  1    31.432  ? 1291 A 1 .
ATOM 3445 C CA   . VAL Axp A    210 ? 26.996 9.656   16.747  1    32.142  ? 1291 A 1 .
ATOM 3446 C C    . VAL Axp A    210 ? 26.274 8.456   16.143  1    32.688  ? 1291 A 1 .
ATOM 3447 O O    . VAL Axp A    210 ? 25.321 8.622   15.385  1    31.186  ? 1291 A 1 .
ATOM 3448 C CB   . VAL Axp A    210 ? 28.262 10.008  15.943  1    32.565  ? 1291 A 1 .
ATOM 3449 C CG1  . VAL Axp A    210 ? 27.949 10.443  14.523  1    31.598  ? 1291 A 1 .
ATOM 3450 C CG2  . VAL Axp A    210 ? 29.083 11.088  16.633  1    35.393  ? 1291 A 1 .
ATOM 3451 H H    . VAL Axp A    210 ? 28.161 9.373   18.42   1    31.698  ? 1291 A 1 c
ATOM 3452 H HA   . VAL Axp A    210 ? 26.392 10.423  16.724  1    32.302  ? 1291 A 1 c
ATOM 3453 H HB   . VAL Axp A    210 ? 28.813 9.192   15.896  1    32.809  ? 1291 A 1 c
ATOM 3454 H HG11 . VAL Axp A    210 ? 27.422 11.259  14.541  1    31.913  ? 1291 A 1 c
ATOM 3455 H HG12 . VAL Axp A    210 ? 27.449 9.745   14.069  1    31.916  ? 1291 A 1 c
ATOM 3456 H HG13 . VAL Axp A    210 ? 28.779 10.605  14.046  1    32.015  ? 1291 A 1 c
ATOM 3457 H HG21 . VAL Axp A    210 ? 29.402 11.727  15.974  1    34.418  ? 1291 A 1 c
ATOM 3458 H HG22 . VAL Axp A    210 ? 29.844 10.68   17.08   1    34.483  ? 1291 A 1 c
ATOM 3459 H HG23 . VAL Axp A    210 ? 28.532 11.548  17.288  1    34.434  ? 1291 A 1 c
ATOM 3460 N N    . LEU Axp A    211 ? 26.728 7.249   16.505  1    34.317  ? 1292 A 1 .
ATOM 3461 C CA   . LEU Axp A    211 ? 26.052 6.025   16.103  1    34.306  ? 1292 A 1 .
ATOM 3462 C C    . LEU Axp A    211 ? 24.569 6.186   16.384  1    37.966  ? 1292 A 1 .
ATOM 3463 O O    . LEU Axp A    211 ? 23.72  6.082   15.497  1    42.053  ? 1292 A 1 .
ATOM 3464 C CB   . LEU Axp A    211 ? 26.606 4.84    16.884  1    30.946  ? 1292 A 1 .
ATOM 3465 C CG   . LEU Axp A    211 ? 26.034 3.473   16.525  1    28.825  ? 1292 A 1 .
ATOM 3466 C CD1  . LEU Axp A    211 ? 26.127 3.238   15.038  1    29.062  ? 1292 A 1 .
ATOM 3467 C CD2  . LEU Axp A    211 ? 26.799 2.414   17.296  1    28.768  ? 1292 A 1 .
ATOM 3468 H H    . LEU Axp A    211 ? 27.486 7.187   17.014  1    33.809  ? 1292 A 1 c
ATOM 3469 H HA   . LEU Axp A    211 ? 26.192 5.887   15.132  1    34.238  ? 1292 A 1 c
ATOM 3470 H HB3  . LEU Axp A    211 ? 26.449 4.999   17.843  1    31.309  ? 1292 A 1 c
ATOM 3471 H HB2  . LEU Axp A    211 ? 27.579 4.811   16.747  1    31.214  ? 1292 A 1 c
ATOM 3472 H HG   . LEU Axp A    211 ? 25.08  3.442   16.798  1    29.273  ? 1292 A 1 c
ATOM 3473 H HD11 . LEU Axp A    211 ? 25.411 3.717   14.586  1    29.098  ? 1292 A 1 c
ATOM 3474 H HD12 . LEU Axp A    211 ? 26.045 2.287   14.853  1    29.152  ? 1292 A 1 c
ATOM 3475 H HD13 . LEU Axp A    211 ? 26.985 3.557   14.712  1    29.12   ? 1292 A 1 c
ATOM 3476 H HD21 . LEU Axp A    211 ? 26.731 2.592   18.249  1    28.785  ? 1292 A 1 c
ATOM 3477 H HD22 . LEU Axp A    211 ? 27.734 2.431   17.031  1    28.785  ? 1292 A 1 c
ATOM 3478 H HD23 . LEU Axp A    211 ? 26.425 1.538   17.104  1    28.785  ? 1292 A 1 c
ATOM 3479 N N    . ASN Axp A    212 ? 24.312 6.521   17.646  1    40.043  ? 1293 A 1 .
ATOM 3480 C CA   . ASN Axp A    212 ? 22.97  6.643   18.161  1    40.841  ? 1293 A 1 .
ATOM 3481 C C    . ASN Axp A    212 ? 22.204 7.785   17.492  1    41.334  ? 1293 A 1 .
ATOM 3482 O O    . ASN Axp A    212 ? 20.982 7.762   17.458  1    41.757  ? 1293 A 1 .
ATOM 3483 C CB   . ASN Axp A    212 ? 23     6.791   19.671  1    39.504  ? 1293 A 1 .
ATOM 3484 C CG   . ASN Axp A    212 ? 21.68  6.323   20.198  1    42.492  ? 1293 A 1 .
ATOM 3485 O OD1  . ASN Axp A    212 ? 21.389 5.123   20.133  1    46.209  ? 1293 A 1 .
ATOM 3486 N ND2  . ASN Axp A    212 ? 20.845 7.264   20.601  1    44.086  ? 1293 A 1 .
ATOM 3487 H H    . ASN Axp A    212 ? 25.01  6.683   18.213  1    39.462  ? 1293 A 1 c
ATOM 3488 H HA   . ASN Axp A    212 ? 22.497 5.805   17.958  1    40.55   ? 1293 A 1 c
ATOM 3489 H HB3  . ASN Axp A    212 ? 23.145 7.727   19.915  1    40.45   ? 1293 A 1 c
ATOM 3490 H HB2  . ASN Axp A    212 ? 23.721 6.249   20.048  1    40.462  ? 1293 A 1 c
ATOM 3491 H HD21 . ASN Axp A    212 ? 20.387 7.156   21.353  1    43.582  ? 1293 A 1 c
ATOM 3492 H HD22 . ASN Axp A    212 ? 20.744 8.001   20.119  1    43.56   ? 1293 A 1 c
ATOM 3493 N N    . ILE Axp A    213 ? 22.903 8.803   16.99   1    43.866  ? 1294 A 1 .
ATOM 3494 C CA   . ILE Axp A    213 ? 22.222 9.874   16.285  1    42.366  ? 1294 A 1 .
ATOM 3495 C C    . ILE Axp A    213 ? 21.853 9.324   14.921  1    40.398  ? 1294 A 1 .
ATOM 3496 O O    . ILE Axp A    213 ? 20.693 9.34    14.56   1    40.57   ? 1294 A 1 .
ATOM 3497 C CB   . ILE Axp A    213 ? 23.055 11.162  16.16   1    42.867  ? 1294 A 1 .
ATOM 3498 C CG1  . ILE Axp A    213 ? 23.502 11.711  17.518  1    44.68   ? 1294 A 1 .
ATOM 3499 C CG2  . ILE Axp A    213 ? 22.28  12.212  15.367  1    41.989  ? 1294 A 1 .
ATOM 3500 C CD1  . ILE Axp A    213 ? 24.698 12.641  17.43   1    46.139  ? 1294 A 1 .
ATOM 3501 H H    . ILE Axp A    213 ? 23.809 8.846   17.102  1    42.791  ? 1294 A 1 c
ATOM 3502 H HA   . ILE Axp A    213 ? 21.401 10.088  16.765  1    42.34   ? 1294 A 1 c
ATOM 3503 H HB   . ILE Axp A    213 ? 23.861 10.941  15.652  1    42.973  ? 1294 A 1 c
ATOM 3504 H HG12 . ILE Axp A    213 ? 23.726 10.962  18.107  1    44.49   ? 1294 A 1 c
ATOM 3505 H HG13 . ILE Axp A    213 ? 22.755 12.196  17.922  1    44.561  ? 1294 A 1 c
ATOM 3506 H HG21 . ILE Axp A    213 ? 22.578 13.101  15.622  1    42.273  ? 1294 A 1 c
ATOM 3507 H HG22 . ILE Axp A    213 ? 21.33  12.126  15.553  1    42.243  ? 1294 A 1 c
ATOM 3508 H HG23 . ILE Axp A    213 ? 22.435 12.082  14.416  1    42.242  ? 1294 A 1 c
ATOM 3509 H HD11 . ILE Axp A    213 ? 25.203 12.463  16.614  1    45.551  ? 1294 A 1 c
ATOM 3510 H HD12 . ILE Axp A    213 ? 25.276 12.5    18.204  1    45.663  ? 1294 A 1 c
ATOM 3511 H HD13 . ILE Axp A    213 ? 24.389 13.566  17.423  1    45.645  ? 1294 A 1 c
ATOM 3512 N N    . THR Axp A    214 ? 22.851 8.803   14.21   1    43.17   ? 1295 A 1 .
ATOM 3513 C CA   . THR Axp A    214 ? 22.652 8.296   12.863  1    47.284  ? 1295 A 1 .
ATOM 3514 C C    . THR Axp A    214 ? 21.542 7.25    12.864  1    50.353  ? 1295 A 1 .
ATOM 3515 O O    . THR Axp A    214 ? 20.685 7.274   11.982  1    51.05   ? 1295 A 1 .
ATOM 3516 C CB   . THR Axp A    214 ? 23.933 7.703   12.269  1    47.247  ? 1295 A 1 .
ATOM 3517 O OG1  . THR Axp A    214 ? 24.095 6.341   12.7    1    42.326  ? 1295 A 1 .
ATOM 3518 C CG2  . THR Axp A    214 ? 25.129 8.613   12.497  1    44.761  ? 1295 A 1 .
ATOM 3519 H H    . THR Axp A    214 ? 23.682 8.745   14.586  1    43.42   ? 1295 A 1 c
ATOM 3520 H HA   . THR Axp A    214 ? 22.37  9.044   12.3    1    47.083  ? 1295 A 1 c
ATOM 3521 H HB   . THR Axp A    214 ? 23.803 7.692   11.291  1    45.783  ? 1295 A 1 c
ATOM 3522 H HG1  . THR Axp A    214 ? 24.228 6.413   13.552  0    36.34   ? 1295 A 1 c
ATOM 3523 H HG21 . THR Axp A    214 ? 25.517 8.854   11.64   1    45.416  ? 1295 A 1 c
ATOM 3524 H HG22 . THR Axp A    214 ? 25.794 8.149   13.031  1    45.336  ? 1295 A 1 c
ATOM 3525 H HG23 . THR Axp A    214 ? 24.849 9.422   12.956  1    45.33   ? 1295 A 1 c
ATOM 3526 N N    . GLN Axp A    215 ? 21.582 6.332   13.84   1    49.542  ? 1296 A 1 .
ATOM 3527 C CA   . GLN Axp A    215 ? 20.603 5.26    13.903  1    50.149  ? 1296 A 1 .
ATOM 3528 C C    . GLN Axp A    215 ? 19.192 5.844   14.02   1    46.779  ? 1296 A 1 .
ATOM 3529 O O    . GLN Axp A    215 ? 18.404 5.735   13.084  1    46.737  ? 1296 A 1 .
ATOM 3530 C CB   . GLN Axp A    215 ? 20.954 4.263   15.008  1    53.05   ? 1296 A 1 .
ATOM 3531 C CG   . GLN Axp A    215 ? 22.111 3.329   14.661  1    53.781  ? 1296 A 1 .
ATOM 3532 C CD   . GLN Axp A    215 ? 22.462 2.36    15.775  1    54.318  ? 1296 A 1 .
ATOM 3533 O OE1  . GLN Axp A    215 ? 22.101 2.543   16.951  1    48.094  ? 1296 A 1 .
ATOM 3534 N NE2  . GLN Axp A    215 ? 23.199 1.318   15.406  1    54.268  ? 1296 A 1 .
ATOM 3535 H H    . GLN Axp A    215 ? 22.237 6.372   14.476  1    49.845  ? 1296 A 1 c
ATOM 3536 H HA   . GLN Axp A    215 ? 20.65  4.765   13.045  1    49.896  ? 1296 A 1 c
ATOM 3537 H HB3  . GLN Axp A    215 ? 20.16  3.724   15.206  1    52.497  ? 1296 A 1 c
ATOM 3538 H HB2  . GLN Axp A    215 ? 21.182 4.764   15.819  1    52.489  ? 1296 A 1 c
ATOM 3539 H HG3  . GLN Axp A    215 ? 22.905 3.864   14.449  1    53.663  ? 1296 A 1 c
ATOM 3540 H HG2  . GLN Axp A    215 ? 21.878 2.813   13.86   1    53.723  ? 1296 A 1 c
ATOM 3541 H HE21 . GLN Axp A    215 ? 23.065 0.526   15.782  1    54.216  ? 1296 A 1 c
ATOM 3542 H HE22 . GLN Axp A    215 ? 23.825 1.416   14.785  1    53.996  ? 1296 A 1 c
ATOM 3543 N N    . GLU Axp A    216 ? 18.87  6.478   15.156  1    43.966  ? 1297 A 1 .
ATOM 3544 C CA   . GLU Axp A    216 ? 17.529 7.001   15.39   1    42.903  ? 1297 A 1 .
ATOM 3545 C C    . GLU Axp A    216 ? 17.044 7.833   14.202  1    41.716  ? 1297 A 1 .
ATOM 3546 O O    . GLU Axp A    216 ? 15.883 7.74    13.814  1    43.091  ? 1297 A 1 .
ATOM 3547 C CB   . GLU Axp A    216 ? 17.445 7.865   16.648  1    43.797  ? 1297 A 1 .
ATOM 3548 C CG   . GLU Axp A    216 ? 17.599 7.102   17.961  1    43.683  ? 1297 A 1 .
ATOM 3549 C CD   . GLU Axp A    216 ? 16.684 5.912   18.107  1    44.704  ? 1297 A 1 .
ATOM 3550 O OE1  . GLU Axp A    216 ? 15.451 6.053   18.225  1    45.545  ? 1297 A 1 .
ATOM 3551 O OE2  . GLU Axp A    216 ? 17.247 4.809   18.064  1    49.108  ? 1297 A 1 .
ATOM 3552 H H    . GLU Axp A    216 ? 19.506 6.588   15.803  1    44.451  ? 1297 A 1 c
ATOM 3553 H HA   . GLU Axp A    216 ? 16.916 6.23    15.495  1    43.057  ? 1297 A 1 c
ATOM 3554 H HB3  . GLU Axp A    216 ? 16.581 8.328   16.655  1    43.55   ? 1297 A 1 c
ATOM 3555 H HB2  . GLU Axp A    216 ? 18.147 8.547   16.603  1    43.536  ? 1297 A 1 c
ATOM 3556 H HG3  . GLU Axp A    216 ? 17.429 7.716   18.707  1    43.947  ? 1297 A 1 c
ATOM 3557 H HG2  . GLU Axp A    216 ? 18.527 6.792   18.042  1    43.964  ? 1297 A 1 c
ATOM 3558 N N    . CYS Axp A    217 ? 17.923 8.675   13.654  1    43.929  ? 1298 A 1 .
ATOM 3559 C CA   . CYS Axp A    217 ? 17.584 9.448   12.472  1    45.9    ? 1298 A 1 .
ATOM 3560 C C    . CYS Axp A    217 ? 17.211 8.481   11.364  1    46.972  ? 1298 A 1 .
ATOM 3561 O O    . CYS Axp A    217 ? 16.174 8.639   10.749  1    54.379  ? 1298 A 1 .
ATOM 3562 C CB   . CYS Axp A    217 ? 18.712 10.355  11.989  1    47.892  ? 1298 A 1 .
ATOM 3563 S SG   . CYS Axp A    217 ? 18.958 11.833  13.01   1    50.857  ? 1298 A 1 .
ATOM 3564 H H    . CYS Axp A    217 ? 18.751 8.775   14.027  1    43.842  ? 1298 A 1 c
ATOM 3565 H HA   . CYS Axp A    217 ? 16.792 10.005  12.685  1    46.087  ? 1298 A 1 c
ATOM 3566 H HB3  . CYS Axp A    217 ? 18.521 10.642  11.068  1    47.946  ? 1298 A 1 c
ATOM 3567 H HB2  . CYS Axp A    217 ? 19.551 9.843   11.976  1    47.95   ? 1298 A 1 c
ATOM 3568 H HG   . CYS Axp A    217 ? 19.934 12.276  12.4    0    41.77   ? 1298 A 1 c
ATOM 3569 N N    . PHE Axp A    218 ? 18.044 7.464   11.141  1    50.093  ? 1299 A 1 .
ATOM 3570 C CA   . PHE Axp A    218 ? 17.78  6.507   10.081  1    52.611  ? 1299 A 1 .
ATOM 3571 C C    . PHE Axp A    218 ? 16.408 5.884   10.31   1    53.617  ? 1299 A 1 .
ATOM 3572 O O    . PHE Axp A    218 ? 15.573 5.907   9.412   1    54.276  ? 1299 A 1 .
ATOM 3573 C CB   . PHE Axp A    218 ? 18.868 5.435   9.999   1    52.955  ? 1299 A 1 .
ATOM 3574 C CG   . PHE Axp A    218 ? 18.64  4.424   8.89    1    55.056  ? 1299 A 1 .
ATOM 3575 C CD1  . PHE Axp A    218 ? 18.834 4.784   7.56    1    58.535  ? 1299 A 1 .
ATOM 3576 C CD2  . PHE Axp A    218 ? 18.243 3.123   9.181   1    58.744  ? 1299 A 1 .
ATOM 3577 C CE1  . PHE Axp A    218 ? 18.637 3.863   6.54    1    63.638  ? 1299 A 1 .
ATOM 3578 C CE2  . PHE Axp A    218 ? 18.054 2.2     8.161   1    64.964  ? 1299 A 1 .
ATOM 3579 C CZ   . PHE Axp A    218 ? 18.252 2.571   6.843   1    67.34   ? 1299 A 1 .
ATOM 3580 H H    . PHE Axp A    218 ? 18.797 7.369   11.65   1    49.811  ? 1299 A 1 c
ATOM 3581 H HA   . PHE Axp A    218 ? 17.761 6.998   9.218   1    52.625  ? 1299 A 1 c
ATOM 3582 H HB3  . PHE Axp A    218 ? 18.908 4.961   10.857  1    53.367  ? 1299 A 1 c
ATOM 3583 H HB2  . PHE Axp A    218 ? 19.734 5.878   9.854   1    53.341  ? 1299 A 1 c
ATOM 3584 H HD1  . PHE Axp A    218 ? 19.104 5.664   7.353   1    59.321  ? 1299 A 1 c
ATOM 3585 H HD2  . PHE Axp A    218 ? 18.113 2.864   10.079  1    59.249  ? 1299 A 1 c
ATOM 3586 H HE1  . PHE Axp A    218 ? 18.778 4.114   5.642   1    63.621  ? 1299 A 1 c
ATOM 3587 H HE2  . PHE Axp A    218 ? 17.784 1.319   8.368   1    63.881  ? 1299 A 1 c
ATOM 3588 H HZ   . PHE Axp A    218 ? 18.114 1.945   6.15    1    65.72   ? 1299 A 1 c
ATOM 3589 N N    . LYS Axp A    219 ? 16.187 5.371   11.528  1    53.308  ? 1300 A 1 .
ATOM 3590 C CA   . LYS Axp A    219 ? 14.931 4.742   11.887  1    51.341  ? 1300 A 1 .
ATOM 3591 C C    . LYS Axp A    219 ? 13.786 5.716   11.647  1    54.741  ? 1300 A 1 .
ATOM 3592 O O    . LYS Axp A    219 ? 12.812 5.349   11.005  1    65.762  ? 1300 A 1 .
ATOM 3593 C CB   . LYS Axp A    219 ? 14.975 4.264   13.335  1    49.47   ? 1300 A 1 .
ATOM 3594 C CG   . LYS Axp A    219 ? 15.92  3.096   13.52   1    52.336  ? 1300 A 1 .
ATOM 3595 C CD   . LYS Axp A    219 ? 16.424 2.983   14.953  1    56.957  ? 1300 A 1 .
ATOM 3596 C CE   . LYS Axp A    219 ? 15.327 3.07    15.971  1    58.789  ? 1300 A 1 .
ATOM 3597 N NZ   . LYS Axp A    219 ? 15.817 2.699   17.301  1    58.599  ? 1300 A 1 .
ATOM 3598 H H    . LYS Axp A    219 ? 16.849 5.417   12.156  1    52.879  ? 1300 A 1 c
ATOM 3599 H HA   . LYS Axp A    219 ? 14.801 3.955   11.3    1    52.05   ? 1300 A 1 c
ATOM 3600 H HB3  . LYS Axp A    219 ? 14.074 3.992   13.614  1    50.616  ? 1300 A 1 c
ATOM 3601 H HB2  . LYS Axp A    219 ? 15.264 5.003   13.911  1    50.664  ? 1300 A 1 c
ATOM 3602 H HG3  . LYS Axp A    219 ? 16.685 3.205   12.915  1    52.663  ? 1300 A 1 c
ATOM 3603 H HG2  . LYS Axp A    219 ? 15.451 2.268   13.276  1    52.663  ? 1300 A 1 c
ATOM 3604 H HD3  . LYS Axp A    219 ? 17.072 3.702   15.119  1    56.284  ? 1300 A 1 c
ATOM 3605 H HD2  . LYS Axp A    219 ? 16.891 2.126   15.059  1    56.284  ? 1300 A 1 c
ATOM 3606 H HE3  . LYS Axp A    219 ? 14.599 2.474   15.721  1    58.303  ? 1300 A 1 c
ATOM 3607 H HE2  . LYS Axp A    219 ? 14.979 3.979   16.009  1    58.221  ? 1300 A 1 c
ATOM 3608 H HZ1  . LYS Axp A    219 ? 16.625 3.08    17.451  1    58.574  ? 1300 A 1 c
ATOM 3609 H HZ2  . LYS Axp A    219 ? 15.899 1.798   17.355  1    58.638  ? 1300 A 1 c
ATOM 3610 H HZ3  . LYS Axp A    219 ? 15.233 2.983   17.932  1    58.638  ? 1300 A 1 c
ATOM 3611 N N    . GLY Axp A    220 ? 13.918 6.947   12.153  1    54.721  ? 1301 A 1 .
ATOM 3612 C CA   . GLY Axp A    220 ? 13.031 8.039   11.775  1    55.715  ? 1301 A 1 .
ATOM 3613 C C    . GLY Axp A    220 ? 12.806 8.11    10.259  1    55.97   ? 1301 A 1 .
ATOM 3614 O O    . GLY Axp A    220 ? 11.714 7.846   9.78    1    56.881  ? 1301 A 1 .
ATOM 3615 H H    . GLY Axp A    220 ? 14.582 7.111   12.759  1    54.837  ? 1301 A 1 c
ATOM 3616 H HA3  . GLY Axp A    220 ? 13.42  8.889   12.087  1    55.532  ? 1301 A 1 c
ATOM 3617 H HA2  . GLY Axp A    220 ? 12.164 7.918   12.228  1    55.532  ? 1301 A 1 c
ATOM 3618 N N    . ILE Axp A    221 ? 13.851 8.432   9.493   1    59.375  ? 1302 A 1 .
ATOM 3619 C CA   . ILE Axp A    221 ? 13.731 8.679   8.063   1    61.252  ? 1302 A 1 .
ATOM 3620 C C    . ILE Axp A    221 ? 12.952 7.556   7.398   1    61.195  ? 1302 A 1 .
ATOM 3621 O O    . ILE Axp A    221 ? 12.089 7.819   6.568   1    55.732  ? 1302 A 1 .
ATOM 3622 C CB   . ILE Axp A    221 ? 15.105 8.761   7.382   1    68.842  ? 1302 A 1 .
ATOM 3623 C CG1  . ILE Axp A    221 ? 16.034 9.782   8.024   1    75.899  ? 1302 A 1 .
ATOM 3624 C CG2  . ILE Axp A    221 ? 14.935 9.025   5.884   1    70.444  ? 1302 A 1 .
ATOM 3625 C CD1  . ILE Axp A    221 ? 17.506 9.441   7.873   1    83.222  ? 1302 A 1 .
ATOM 3626 H H    . ILE Axp A    221 ? 14.677 8.48    9.88    1    59.171  ? 1302 A 1 c
ATOM 3627 H HA   . ILE Axp A    221 ? 13.257 9.523   7.926   1    62.225  ? 1302 A 1 c
ATOM 3628 H HB   . ILE Axp A    221 ? 15.527 7.885   7.478   1    69.156  ? 1302 A 1 c
ATOM 3629 H HG12 . ILE Axp A    221 ? 15.822 9.863   8.973   1    75.242  ? 1302 A 1 c
ATOM 3630 H HG13 . ILE Axp A    221 ? 15.872 10.654  7.61    1    75.631  ? 1302 A 1 c
ATOM 3631 H HG21 . ILE Axp A    221 ? 15.723 9.482   5.543   1    69.994  ? 1302 A 1 c
ATOM 3632 H HG22 . ILE Axp A    221 ? 14.152 9.582   5.736   1    69.821  ? 1302 A 1 c
ATOM 3633 H HG23 . ILE Axp A    221 ? 14.825 8.182   5.414   1    69.904  ? 1302 A 1 c
ATOM 3634 H HD11 . ILE Axp A    221 ? 17.609 8.562   7.462   1    80.621  ? 1302 A 1 c
ATOM 3635 H HD12 . ILE Axp A    221 ? 17.932 9.439   8.751   1    80.709  ? 1302 A 1 c
ATOM 3636 H HD13 . ILE Axp A    221 ? 17.935 10.112  7.309   1    80.92   ? 1302 A 1 c
ATOM 3637 N N    . LEU Axp A    222 ? 13.371 6.319   7.708   1    69.33   ? 1303 A 1 .
ATOM 3638 C CA   . LEU Axp A    222 ? 12.831 5.098   7.128   1    67.764  ? 1303 A 1 .
ATOM 3639 C C    . LEU Axp A    222 ? 11.342 5.045   7.446   1    64.23   ? 1303 A 1 .
ATOM 3640 O O    . LEU Axp A    222 ? 10.531 5.025   6.533   1    68.48   ? 1303 A 1 .
ATOM 3641 C CB   . LEU Axp A    222 ? 13.581 3.887   7.688   1    67.622  ? 1303 A 1 .
ATOM 3642 C CG   . LEU Axp A    222 ? 13.711 2.661   6.781   1    67.586  ? 1303 A 1 .
ATOM 3643 C CD1  . LEU Axp A    222 ? 14.515 1.61    7.529   1    66.832  ? 1303 A 1 .
ATOM 3644 C CD2  . LEU Axp A    222 ? 12.366 2.093   6.334   1    69.377  ? 1303 A 1 .
ATOM 3645 H H    . LEU Axp A    222 ? 14.041 6.238   8.325   1    66.892  ? 1303 A 1 c
ATOM 3646 H HA   . LEU Axp A    222 ? 12.951 5.135   6.145   1    67.384  ? 1303 A 1 c
ATOM 3647 H HB3  . LEU Axp A    222 ? 13.138 3.607   8.521   1    67.508  ? 1303 A 1 c
ATOM 3648 H HB2  . LEU Axp A    222 ? 14.489 4.178   7.933   1    67.534  ? 1303 A 1 c
ATOM 3649 H HG   . LEU Axp A    222 ? 14.221 2.925   5.972   1    67.779  ? 1303 A 1 c
ATOM 3650 H HD11 . LEU Axp A    222 ? 15.294 2.024   7.936   1    67.05   ? 1303 A 1 c
ATOM 3651 H HD12 . LEU Axp A    222 ? 14.803 0.92    6.909   1    67.053  ? 1303 A 1 c
ATOM 3652 H HD13 . LEU Axp A    222 ? 13.963 1.211   8.222   1    67.053  ? 1303 A 1 c
ATOM 3653 H HD21 . LEU Axp A    222 ? 11.932 2.721   5.732   1    68.819  ? 1303 A 1 c
ATOM 3654 H HD22 . LEU Axp A    222 ? 11.8   1.947   7.11    1    68.839  ? 1303 A 1 c
ATOM 3655 H HD23 . LEU Axp A    222 ? 12.506 1.249   5.873   1    68.839  ? 1303 A 1 c
ATOM 3656 N N    . LYS Axp A    223 ? 11.003 5.071   8.738   1    59.569  ? 1304 A 1 .
ATOM 3657 C CA   . LYS Axp A    223 ? 9.623  5.186   9.179   1    59.297  ? 1304 A 1 .
ATOM 3658 C C    . LYS Axp A    223 ? 8.844  6.15    8.288   1    60.31   ? 1304 A 1 .
ATOM 3659 O O    . LYS Axp A    223 ? 7.794  5.8     7.771   1    64.547  ? 1304 A 1 .
ATOM 3660 C CB   . LYS Axp A    223 ? 9.588  5.631   10.643  1    58.415  ? 1304 A 1 .
ATOM 3661 C CG   . LYS Axp A    223 ? 9.002  4.613   11.583  1    62.695  ? 1304 A 1 .
ATOM 3662 C CD   . LYS Axp A    223 ? 7.51   4.815   11.848  1    71.1    ? 1304 A 1 .
ATOM 3663 C CE   . LYS Axp A    223 ? 7.168  5.335   13.232  1    75.655  ? 1304 A 1 .
ATOM 3664 N NZ   . LYS Axp A    223 ? 7.1    6.793   13.409  1    79.643  ? 1304 A 1 .
ATOM 3665 H H    . LYS Axp A    223 ? 11.661 5.016   9.37    1    60.745  ? 1304 A 1 c
ATOM 3666 H HA   . LYS Axp A    223 ? 9.204  4.291   9.107   1    59.449  ? 1304 A 1 c
ATOM 3667 H HB3  . LYS Axp A    223 ? 9.063  6.456   10.711  1    59.723  ? 1304 A 1 c
ATOM 3668 H HB2  . LYS Axp A    223 ? 10.498 5.836   10.939  1    59.642  ? 1304 A 1 c
ATOM 3669 H HG3  . LYS Axp A    223 ? 9.489  4.659   12.434  1    63.584  ? 1304 A 1 c
ATOM 3670 H HG2  . LYS Axp A    223 ? 9.142  3.717   11.207  1    63.426  ? 1304 A 1 c
ATOM 3671 H HD3  . LYS Axp A    223 ? 7.054  3.955   11.715  1    70.05   ? 1304 A 1 c
ATOM 3672 H HD2  . LYS Axp A    223 ? 7.151  5.439   11.18   1    69.928  ? 1304 A 1 c
ATOM 3673 H HE3  . LYS Axp A    223 ? 7.821  4.985   13.864  1    75.34   ? 1304 A 1 c
ATOM 3674 H HE2  . LYS Axp A    223 ? 6.304  4.963   13.486  1    75.473  ? 1304 A 1 c
ATOM 3675 H HZ1  . LYS Axp A    223 ? 6.25   7.078   13.279  1    78.356  ? 1304 A 1 c
ATOM 3676 H HZ2  . LYS Axp A    223 ? 7.645  7.2     12.812  1    78.232  ? 1304 A 1 c
ATOM 3677 H HZ3  . LYS Axp A    223 ? 7.362  7.012   14.249  1    78.356  ? 1304 A 1 c
ATOM 3678 N N    . ASP Axp A    224 ? 9.378  7.353   8.073   1    62.686  ? 1305 A 1 .
ATOM 3679 C CA   . ASP Axp A    224 ? 8.691  8.365   7.287   1    67.063  ? 1305 A 1 .
ATOM 3680 C C    . ASP Axp A    224 ? 8.619  7.996   5.804   1    70.05   ? 1305 A 1 .
ATOM 3681 O O    . ASP Axp A    224 ? 7.915  8.673   5.061   1    71.444  ? 1305 A 1 .
ATOM 3682 C CB   . ASP Axp A    224 ? 9.316  9.743   7.467   1    67.773  ? 1305 A 1 .
ATOM 3683 C CG   . ASP Axp A    224 ? 8.828  10.525  8.677   1    65.821  ? 1305 A 1 .
ATOM 3684 O OD1  . ASP Axp A    224 ? 8.165  9.919   9.542   1    62.004  ? 1305 A 1 .
ATOM 3685 O OD2  . ASP Axp A    224 ? 9.088  11.741  8.726   1    67.212  ? 1305 A 1 .
ATOM 3686 H H    . ASP Axp A    224 ? 10.195 7.552   8.432   1    63.074  ? 1305 A 1 c
ATOM 3687 H HA   . ASP Axp A    224 ? 7.768  8.428   7.621   1    66.774  ? 1305 A 1 c
ATOM 3688 H HB3  . ASP Axp A    224 ? 9.142  10.286  6.672   1    67.293  ? 1305 A 1 c
ATOM 3689 H HB2  . ASP Axp A    224 ? 10.287 9.64    7.546   1    67.155  ? 1305 A 1 c
ATOM 3690 N N    . LYS Axp A    225 ? 9.367  6.98    5.352   1    71.413  ? 1306 A 1 .
ATOM 3691 C CA   . LYS Axp A    225 ? 9.271  6.539   3.967   1    73.387  ? 1306 A 1 .
ATOM 3692 C C    . LYS Axp A    225 ? 8.162  5.492   3.862   1    75.181  ? 1306 A 1 .
ATOM 3693 O O    . LYS Axp A    225 ? 7.303  5.594   2.988   1    75.097  ? 1306 A 1 .
ATOM 3694 C CB   . LYS Axp A    225 ? 10.603 6.02    3.412   1    73.283  ? 1306 A 1 .
ATOM 3695 C CG   . LYS Axp A    225 ? 10.677 6.074   1.889   1    78.077  ? 1306 A 1 .
ATOM 3696 C CD   . LYS Axp A    225 ? 11.82  5.266   1.285   1    83.565  ? 1306 A 1 .
ATOM 3697 C CE   . LYS Axp A    225 ? 12.059 5.571   -0.167  1    90.079  ? 1306 A 1 .
ATOM 3698 N NZ   . LYS Axp A    225 ? 13.2   4.809   -0.68   1    96.631  ? 1306 A 1 .
ATOM 3699 H H    . LYS Axp A    225 ? 9.965  6.569   5.906   1    71.3    ? 1306 A 1 c
ATOM 3700 H HA   . LYS Axp A    225 ? 9.009  7.318   3.415   1    73.308  ? 1306 A 1 c
ATOM 3701 H HB3  . LYS Axp A    225 ? 10.732 5.092   3.701   1    74.379  ? 1306 A 1 c
ATOM 3702 H HB2  . LYS Axp A    225 ? 11.336 6.557   3.782   1    74.376  ? 1306 A 1 c
ATOM 3703 H HG3  . LYS Axp A    225 ? 10.772 7.012   1.616   1    78.152  ? 1306 A 1 c
ATOM 3704 H HG2  . LYS Axp A    225 ? 9.827  5.743   1.524   1    78.142  ? 1306 A 1 c
ATOM 3705 H HD3  . LYS Axp A    225 ? 11.618 4.31    1.381   1    83.791  ? 1306 A 1 c
ATOM 3706 H HD2  . LYS Axp A    225 ? 12.641 5.452   1.79    1    83.738  ? 1306 A 1 c
ATOM 3707 H HE3  . LYS Axp A    225 ? 12.236 6.523   -0.278  1    90.038  ? 1306 A 1 c
ATOM 3708 H HE2  . LYS Axp A    225 ? 11.266 5.345   -0.685  1    90.038  ? 1306 A 1 c
ATOM 3709 H HZ1  . LYS Axp A    225 ? 13.171 3.96    -0.366  1    94.498  ? 1306 A 1 c
ATOM 3710 H HZ2  . LYS Axp A    225 ? 13.97  5.198   -0.409  1    94.656  ? 1306 A 1 c
ATOM 3711 H HZ3  . LYS Axp A    225 ? 13.176 4.787   -1.585  1    94.835  ? 1306 A 1 c
ATOM 3712 N N    . LYS Axp A    226 ? 8.174  4.514   4.782   1    78.974  ? 1307 A 1 .
ATOM 3713 C CA   . LYS Axp A    226 ? 7.126  3.509   4.915   1    79.454  ? 1307 A 1 .
ATOM 3714 C C    . LYS Axp A    226 ? 5.757  4.176   5.083   1    70.093  ? 1307 A 1 .
ATOM 3715 O O    . LYS Axp A    226 ? 4.748  3.58    4.732   1    74.89   ? 1307 A 1 .
ATOM 3716 C CB   . LYS Axp A    226 ? 7.381  2.539   6.086   1    86.058  ? 1307 A 1 .
ATOM 3717 C CG   . LYS Axp A    226 ? 8.443  1.449   5.911   1    93.564  ? 1307 A 1 .
ATOM 3718 C CD   . LYS Axp A    226 ? 8.045  0.366   4.908   1    99.789  ? 1307 A 1 .
ATOM 3719 C CE   . LYS Axp A    226 ? 8.959  -0.83   4.844   1    101.085 ? 1307 A 1 .
ATOM 3720 N NZ   . LYS Axp A    226 ? 10.27  -0.545  4.249   1    102.498 ? 1307 A 1 .
ATOM 3721 H H    . LYS Axp A    226 ? 8.884  4.47    5.356   1    78.131  ? 1307 A 1 c
ATOM 3722 H HA   . LYS Axp A    226 ? 7.108  2.978   4.079   1    78.882  ? 1307 A 1 c
ATOM 3723 H HB3  . LYS Axp A    226 ? 6.532  2.095   6.3     1    86.046  ? 1307 A 1 c
ATOM 3724 H HB2  . LYS Axp A    226 ? 7.63   3.075   6.869   1    86.127  ? 1307 A 1 c
ATOM 3725 H HG3  . LYS Axp A    226 ? 8.611  1.031   6.784   1    93.152  ? 1307 A 1 c
ATOM 3726 H HG2  . LYS Axp A    226 ? 9.278  1.871   5.613   1    93.152  ? 1307 A 1 c
ATOM 3727 H HD3  . LYS Axp A    226 ? 8      0.774   4.016   1    98.489  ? 1307 A 1 c
ATOM 3728 H HD2  . LYS Axp A    226 ? 7.14   0.057   5.131   1    98.605  ? 1307 A 1 c
ATOM 3729 H HE3  . LYS Axp A    226 ? 8.527  -1.53   4.323   1    101.12  ? 1307 A 1 c
ATOM 3730 H HE2  . LYS Axp A    226 ? 9.095  -1.173  5.745   1    101.12  ? 1307 A 1 c
ATOM 3731 H HZ1  . LYS Axp A    226 ? 10.692 0.096   4.729   1    102.02  ? 1307 A 1 c
ATOM 3732 H HZ2  . LYS Axp A    226 ? 10.163 -0.257  3.397   1    102.051 ? 1307 A 1 c
ATOM 3733 H HZ3  . LYS Axp A    226 ? 10.775 -1.297  4.248   1    102.051 ? 1307 A 1 c
ATOM 3734 N N    . ASN Axp A    227 ? 5.706  5.397   5.632   1    65.287  ? 1308 A 1 .
ATOM 3735 C CA   . ASN Axp A    227 ? 4.442  6.107   5.775   1    62.053  ? 1308 A 1 .
ATOM 3736 C C    . ASN Axp A    227 ? 4.308  7.173   4.682   1    65.097  ? 1308 A 1 .
ATOM 3737 O O    . ASN Axp A    227 ? 3.619  8.169   4.88    1    61.132  ? 1308 A 1 .
ATOM 3738 C CB   . ASN Axp A    227 ? 4.272  6.693   7.177   1    60.477  ? 1308 A 1 .
ATOM 3739 C CG   . ASN Axp A    227 ? 4.108  5.645   8.257   1    60.244  ? 1308 A 1 .
ATOM 3740 O OD1  . ASN Axp A    227 ? 4.446  4.473   8.066   1    59.277  ? 1308 A 1 .
ATOM 3741 N ND2  . ASN Axp A    227 ? 3.602  6.044   9.413   1    58.65   ? 1308 A 1 .
ATOM 3742 H H    . ASN Axp A    227 ? 6.47   5.789   5.945   1    65.87   ? 1308 A 1 c
ATOM 3743 H HA   . ASN Axp A    227 ? 3.714  5.459   5.649   1    62.997  ? 1308 A 1 c
ATOM 3744 H HB3  . ASN Axp A    227 ? 3.487  7.276   7.185   1    60.801  ? 1308 A 1 c
ATOM 3745 H HB2  . ASN Axp A    227 ? 5.053  7.243   7.387   1    60.782  ? 1308 A 1 c
ATOM 3746 H HD21 . ASN Axp A    227 ? 3.072  5.502   9.874   1    59.138  ? 1308 A 1 c
ATOM 3747 H HD22 . ASN Axp A    227 ? 3.794  6.852   9.725   1    59.144  ? 1308 A 1 c
ATOM 3748 N N    . ASP Axp A    228 ? 4.98   6.96    3.537   1    72.928  ? 1309 A 1 .
ATOM 3749 C CA   . ASP Axp A    228 ? 4.814  7.741   2.317   1    76.571  ? 1309 A 1 .
ATOM 3750 C C    . ASP Axp A    228 ? 4.839  9.25    2.596   1    78.649  ? 1309 A 1 .
ATOM 3751 O O    . ASP Axp A    228 ? 4.039  9.992   2.032   1    71.945  ? 1309 A 1 .
ATOM 3752 C CB   . ASP Axp A    228 ? 3.554  7.269   1.6     1    81.004  ? 1309 A 1 .
ATOM 3753 C CG   . ASP Axp A    228 ? 3.689  6.967   0.113   1    81.638  ? 1309 A 1 .
ATOM 3754 O OD1  . ASP Axp A    228 ? 4.563  6.151   -0.233  1    79.38   ? 1309 A 1 .
ATOM 3755 O OD2  . ASP Axp A    228 ? 2.896  7.521   -0.681  1    83.105  ? 1309 A 1 .
ATOM 3756 H H    . ASP Axp A    228 ? 5.583  6.275   3.516   1    71.659  ? 1309 A 1 c
ATOM 3757 H HA   . ASP Axp A    228 ? 5.573  7.534   1.726   1    77.063  ? 1309 A 1 c
ATOM 3758 H HB3  . ASP Axp A    228 ? 2.846  7.938   1.71    1    80.054  ? 1309 A 1 c
ATOM 3759 H HB2  . ASP Axp A    228 ? 3.245  6.447   2.035   1    79.987  ? 1309 A 1 c
ATOM 3760 N N    . ILE Axp A    229 ? 5.784  9.726   3.427   1    93.208  ? 1310 A 1 .
ATOM 3761 C CA   . ILE Axp A    229 ? 5.847  11.146  3.772   1    98.696  ? 1310 A 1 .
ATOM 3762 C C    . ILE Axp A    229 ? 7.301  11.643  3.891   1    95.247  ? 1310 A 1 .
ATOM 3763 O O    . ILE Axp A    229 ? 8.077  11.236  4.748   1    85.239  ? 1310 A 1 .
ATOM 3764 C CB   . ILE Axp A    229 ? 4.961  11.451  5.004   1    95.875  ? 1310 A 1 .
ATOM 3765 C CG1  . ILE Axp A    229 ? 4.797  12.957  5.214   1    101.564 ? 1310 A 1 .
ATOM 3766 C CG2  . ILE Axp A    229 ? 5.441  10.75   6.28    1    88.036  ? 1310 A 1 .
ATOM 3767 C CD1  . ILE Axp A    229 ? 3.454  13.357  5.802   1    109.031 ? 1310 A 1 .
ATOM 3768 H H    . ILE Axp A    229 ? 6.403  9.156   3.782   1    90.452  ? 1310 A 1 c
ATOM 3769 H HA   . ILE Axp A    229 ? 5.449  11.631  3.024   1    96.153  ? 1310 A 1 c
ATOM 3770 H HB   . ILE Axp A    229 ? 4.072  11.097  4.804   1    96.029  ? 1310 A 1 c
ATOM 3771 H HG12 . ILE Axp A    229 ? 4.909  13.408  4.352   1    101.483 ? 1310 A 1 c
ATOM 3772 H HG13 . ILE Axp A    229 ? 5.508  13.271  5.81    1    101.647 ? 1310 A 1 c
ATOM 3773 H HG21 . ILE Axp A    229 ? 4.733  10.763  6.945   1    90.252  ? 1310 A 1 c
ATOM 3774 H HG22 . ILE Axp A    229 ? 6.222  11.21   6.632   1    90.288  ? 1310 A 1 c
ATOM 3775 H HG23 . ILE Axp A    229 ? 5.675  9.828   6.077   1    90.179  ? 1310 A 1 c
ATOM 3776 H HD11 . ILE Axp A    229 ? 2.839  13.592  5.081   1    106.624 ? 1310 A 1 c
ATOM 3777 H HD12 . ILE Axp A    229 ? 3.572  14.127  6.391   1    106.255 ? 1310 A 1 c
ATOM 3778 H HD13 . ILE Axp A    229 ? 3.083  12.613  6.314   1    106.516 ? 1310 A 1 c
ATOM 3779 N N    . GLU Axp A    230 ? 7.684  12.529  2.967   1    92.742  ? 1311 A 1 .
ATOM 3780 C CA   . GLU Axp A    230 ? 8.934  13.264  3.059   1    93.465  ? 1311 A 1 .
ATOM 3781 C C    . GLU Axp A    230 ? 8.839  14.234  4.235   1    98.924  ? 1311 A 1 .
ATOM 3782 O O    . GLU Axp A    230 ? 7.773  14.806  4.449   1    107.858 ? 1311 A 1 .
ATOM 3783 C CB   . GLU Axp A    230 ? 9.12   14.049  1.759   1    98.478  ? 1311 A 1 .
ATOM 3784 C CG   . GLU Axp A    230 ? 9.845  13.293  0.647   1    100.008 ? 1311 A 1 .
ATOM 3785 C CD   . GLU Axp A    230 ? 9.802  14.031  -0.683  1    100.947 ? 1311 A 1 .
ATOM 3786 O OE1  . GLU Axp A    230 ? 8.727  14.037  -1.329  1    90.115  ? 1311 A 1 .
ATOM 3787 O OE2  . GLU Axp A    230 ? 10.83  14.639  -1.05   1    101.396 ? 1311 A 1 .
ATOM 3788 H H    . GLU Axp A    230 ? 7.142  12.675  2.246   1    93.626  ? 1311 A 1 c
ATOM 3789 H HA   . GLU Axp A    230 ? 9.68   12.628  3.2     1    95.096  ? 1311 A 1 c
ATOM 3790 H HB3  . GLU Axp A    230 ? 9.633  14.861  1.955   1    97.659  ? 1311 A 1 c
ATOM 3791 H HB2  . GLU Axp A    230 ? 8.241  14.329  1.428   1    97.614  ? 1311 A 1 c
ATOM 3792 H HG3  . GLU Axp A    230 ? 9.431  12.411  0.532   1    99.874  ? 1311 A 1 c
ATOM 3793 H HG2  . GLU Axp A    230 ? 10.782 13.157  0.904   1    99.88   ? 1311 A 1 c
ATOM 3794 N N    . ALA Axp A    231 ? 9.937  14.426  4.987   1    91.91   ? 1312 A 1 .
ATOM 3795 C CA   . ALA Axp A    231 ? 9.981  15.442  6.038   1    83.259  ? 1312 A 1 .
ATOM 3796 C C    . ALA Axp A    231 ? 10.35  16.807  5.448   1    78.152  ? 1312 A 1 .
ATOM 3797 O O    . ALA Axp A    231 ? 11.109 16.88   4.485   1    82.813  ? 1312 A 1 .
ATOM 3798 C CB   . ALA Axp A    231 ? 10.956 15.026  7.113   1    83.354  ? 1312 A 1 .
ATOM 3799 H H    . ALA Axp A    231 ? 10.677 13.911  4.84    1    91.493  ? 1312 A 1 c
ATOM 3800 H HA   . ALA Axp A    231 ? 9.072  15.513  6.438   1    83.877  ? 1312 A 1 c
ATOM 3801 H HB3  . ALA Axp A    231 ? 10.967 15.693  7.82    1    83.326  ? 1312 A 1 c
ATOM 3802 H HB2  . ALA Axp A    231 ? 11.847 14.945  6.733   1    83.326  ? 1312 A 1 c
ATOM 3803 H HB1  . ALA Axp A    231 ? 10.686 14.169  7.485   1    83.326  ? 1312 A 1 c
ATOM 3804 N N    . GLN Axp A    232 ? 9.842  17.897  6.041   1    74.098  ? 1313 A 1 .
ATOM 3805 C CA   . GLN Axp A    232 ? 9.916  19.216  5.415   1    75.962  ? 1313 A 1 .
ATOM 3806 C C    . GLN Axp A    232 ? 11.368 19.544  5.073   1    69.209  ? 1313 A 1 .
ATOM 3807 O O    . GLN Axp A    232 ? 11.645 19.957  3.949   1    73.391  ? 1313 A 1 .
ATOM 3808 C CB   . GLN Axp A    232 ? 9.308  20.333  6.272   1    81.069  ? 1313 A 1 .
ATOM 3809 C CG   . GLN Axp A    232 ? 8.978  21.636  5.54    1    77.347  ? 1313 A 1 .
ATOM 3810 C CD   . GLN Axp A    232 ? 8.686  22.792  6.482   1    79.254  ? 1313 A 1 .
ATOM 3811 O OE1  . GLN Axp A    232 ? 8.814  23.965  6.124   1    82.483  ? 1313 A 1 .
ATOM 3812 N NE2  . GLN Axp A    232 ? 8.31   22.494  7.717   1    78.383  ? 1313 A 1 .
ATOM 3813 H H    . GLN Axp A    232 ? 9.44   17.818  6.858   1    75.557  ? 1313 A 1 c
ATOM 3814 H HA   . GLN Axp A    232 ? 9.404  19.177  4.567   1    75.195  ? 1313 A 1 c
ATOM 3815 H HB3  . GLN Axp A    232 ? 9.934  20.534  6.999   1    78.962  ? 1313 A 1 c
ATOM 3816 H HB2  . GLN Axp A    232 ? 8.486  19.99   6.681   1    78.988  ? 1313 A 1 c
ATOM 3817 H HG3  . GLN Axp A    232 ? 8.197  21.494  4.963   1    78.6    ? 1313 A 1 c
ATOM 3818 H HG2  . GLN Axp A    232 ? 9.733  21.884  4.963   1    78.564  ? 1313 A 1 c
ATOM 3819 H HE21 . GLN Axp A    232 ? 8.803  22.76   8.405   1    78.653  ? 1313 A 1 c
ATOM 3820 H HE22 . GLN Axp A    232 ? 7.567  22.029  7.853   1    78.663  ? 1313 A 1 c
ATOM 3821 N N    . TRP Axp A    233 ? 12.285 19.34   6.031   1    64.944  ? 1314 A 1 .
ATOM 3822 C CA   . TRP Axp A    233 ? 13.7   19.609  5.798   1    64.432  ? 1314 A 1 .
ATOM 3823 C C    . TRP Axp A    233 ? 14.58  18.366  5.981   1    68.081  ? 1314 A 1 .
ATOM 3824 O O    . TRP Axp A    233 ? 15.747 18.476  6.355   1    66.713  ? 1314 A 1 .
ATOM 3825 C CB   . TRP Axp A    233 ? 14.164 20.786  6.662   1    58.701  ? 1314 A 1 .
ATOM 3826 C CG   . TRP Axp A    233 ? 13.677 22.091  6.107   1    56.408  ? 1314 A 1 .
ATOM 3827 C CD1  . TRP Axp A    233 ? 12.743 22.929  6.637   1    55.817  ? 1314 A 1 .
ATOM 3828 C CD2  . TRP Axp A    233 ? 14.075 22.668  4.85    1    58.695  ? 1314 A 1 .
ATOM 3829 N NE1  . TRP Axp A    233 ? 12.548 24.003  5.812   1    55.92   ? 1314 A 1 .
ATOM 3830 C CE2  . TRP Axp A    233 ? 13.349 23.872  4.705   1    60.941  ? 1314 A 1 .
ATOM 3831 C CE3  . TRP Axp A    233 ? 14.969 22.288  3.842   1    63.217  ? 1314 A 1 .
ATOM 3832 C CZ2  . TRP Axp A    233 ? 13.495 24.696  3.586   1    64.142  ? 1314 A 1 .
ATOM 3833 C CZ3  . TRP Axp A    233 ? 15.111 23.106  2.738   1    67.007  ? 1314 A 1 .
ATOM 3834 C CH2  . TRP Axp A    233 ? 14.384 24.293  2.612   1    65.368  ? 1314 A 1 .
ATOM 3835 H H    . TRP Axp A    233 ? 12.024 19.031  6.851   1    65.934  ? 1314 A 1 c
ATOM 3836 H HA   . TRP Axp A    233 ? 13.793 19.89   4.849   1    64.091  ? 1314 A 1 c
ATOM 3837 H HB3  . TRP Axp A    233 ? 15.144 20.796  6.69    1    59.485  ? 1314 A 1 c
ATOM 3838 H HB2  . TRP Axp A    233 ? 13.814 20.672  7.571   1    59.426  ? 1314 A 1 c
ATOM 3839 H HD1  . TRP Axp A    233 ? 12.304 22.795  7.459   1    55.925  ? 1314 A 1 c
ATOM 3840 H HE1  . TRP Axp A    233 ? 12     24.665  5.963   1    56.973  ? 1314 A 1 c
ATOM 3841 H HE3  . TRP Axp A    233 ? 15.466 21.492  3.919   1    62.977  ? 1314 A 1 c
ATOM 3842 H HZ2  . TRP Axp A    233 ? 13.002 25.494  3.5     1    63.62   ? 1314 A 1 c
ATOM 3843 H HZ3  . TRP Axp A    233 ? 15.714 22.859  2.055   1    65.605  ? 1314 A 1 c
ATOM 3844 H HH2  . TRP Axp A    233 ? 14.502 24.829  1.847   1    65.343  ? 1314 A 1 c
ATOM 3845 N N    . HIS Axp A    234 ? 14.038 17.19   5.631   1    70.198  ? 1315 A 1 .
ATOM 3846 C CA   . HIS Axp A    234 ? 14.82  15.983  5.386   1    67.044  ? 1315 A 1 .
ATOM 3847 C C    . HIS Axp A    234 ? 15.514 15.549  6.681   1    66.471  ? 1315 A 1 .
ATOM 3848 O O    . HIS Axp A    234 ? 15.019 15.841  7.769   1    65.236  ? 1315 A 1 .
ATOM 3849 C CB   . HIS Axp A    234 ? 15.761 16.18   4.185   1    74.153  ? 1315 A 1 .
ATOM 3850 C CG   . HIS Axp A    234 ? 15.152 16.747  2.927   1    80.443  ? 1315 A 1 .
ATOM 3851 N ND1  . HIS Axp A    234 ? 14.277 17.812  2.873   1    81.264  ? 1315 A 1 .
ATOM 3852 C CD2  . HIS Axp A    234 ? 15.374 16.41   1.649   1    79.558  ? 1315 A 1 .
ATOM 3853 C CE1  . HIS Axp A    234 ? 13.957 18.079  1.619   1    74.132  ? 1315 A 1 .
ATOM 3854 N NE2  . HIS Axp A    234 ? 14.613 17.237  0.859   1    79.591  ? 1315 A 1 .
ATOM 3855 H H    . HIS Axp A    234 ? 13.13  17.138  5.541   1    68.953  ? 1315 A 1 c
ATOM 3856 H HA   . HIS Axp A    234 ? 14.175 15.275  5.139   1    68.802  ? 1315 A 1 c
ATOM 3857 H HB3  . HIS Axp A    234 ? 16.161 15.312  3.965   1    73.84   ? 1315 A 1 c
ATOM 3858 H HB2  . HIS Axp A    234 ? 16.499 16.764  4.465   1    73.794  ? 1315 A 1 c
ATOM 3859 H HD1  . HIS Axp A    234 ? 14.059 18.212  3.613   0    62.68   ? 1315 A 1 c
ATOM 3860 H HD2  . HIS Axp A    234 ? 15.931 15.723  1.341   1    79.896  ? 1315 A 1 c
ATOM 3861 H HE1  . HIS Axp A    234 ? 13.365 18.75   1.324   1    77.021  ? 1315 A 1 c
ATOM 3862 H HE2  . HIS Axp A    234 ? 14.591 17.155  -0.007  0    62.93   ? 1315 A 1 c
ATOM 3863 N N    . ASP Axp A    235 ? 16.662 14.857  6.559   1    73.562  ? 1316 A 1 .
ATOM 3864 C CA   . ASP Axp A    235 ? 17.401 14.3    7.69    1    77.154  ? 1316 A 1 .
ATOM 3865 C C    . ASP Axp A    235 ? 17.703 15.37   8.744   1    70.337  ? 1316 A 1 .
ATOM 3866 O O    . ASP Axp A    235 ? 17.929 15.047  9.911   1    65.882  ? 1316 A 1 .
ATOM 3867 C CB   . ASP Axp A    235 ? 18.667 13.588  7.227   1    78.072  ? 1316 A 1 .
ATOM 3868 C CG   . ASP Axp A    235 ? 19.691 14.476  6.538   1    81.736  ? 1316 A 1 .
ATOM 3869 O OD1  . ASP Axp A    235 ? 19.263 15.447  5.867   1    77.309  ? 1316 A 1 .
ATOM 3870 O OD2  . ASP Axp A    235 ? 20.899 14.158  6.64    1    87.137  ? 1316 A 1 .
ATOM 3871 H H    . ASP Axp A    235 ? 16.998 14.718  5.722   1    72.651  ? 1316 A 1 c
ATOM 3872 H HA   . ASP Axp A    235 ? 16.834 13.614  8.109   1    75.061  ? 1316 A 1 c
ATOM 3873 H HB3  . ASP Axp A    235 ? 18.416 12.873  6.605   1    78.696  ? 1316 A 1 c
ATOM 3874 H HB2  . ASP Axp A    235 ? 19.097 13.173  8.005   1    78.736  ? 1316 A 1 c
ATOM 3875 N N    . GLU Axp A    236 ? 17.695 16.643  8.333   1    60.888  ? 1317 A 1 .
ATOM 3876 C CA   . GLU Axp A    236 ? 17.797 17.746  9.274   1    54.786  ? 1317 A 1 .
ATOM 3877 C C    . GLU Axp A    236 ? 16.614 17.807  10.241  1    53.146  ? 1317 A 1 .
ATOM 3878 O O    . GLU Axp A    236 ? 16.753 18.268  11.377  1    49.052  ? 1317 A 1 .
ATOM 3879 C CB   . GLU Axp A    236 ? 17.888 19.063  8.516   1    50.062  ? 1317 A 1 .
ATOM 3880 C CG   . GLU Axp A    236 ? 17.8   20.276  9.434   1    48.288  ? 1317 A 1 .
ATOM 3881 C CD   . GLU Axp A    236 ? 18.611 21.43   8.888   1    49.557  ? 1317 A 1 .
ATOM 3882 O OE1  . GLU Axp A    236 ? 19.847 21.238  8.777   1    48.837  ? 1317 A 1 .
ATOM 3883 O OE2  . GLU Axp A    236 ? 18.02  22.483  8.546   1    50.051  ? 1317 A 1 .
ATOM 3884 H H    . GLU Axp A    236 ? 17.656 16.831  7.44    1    61.56   ? 1317 A 1 c
ATOM 3885 H HA   . GLU Axp A    236 ? 18.619 17.622  9.805   1    54.357  ? 1317 A 1 c
ATOM 3886 H HB3  . GLU Axp A    236 ? 17.155 19.109  7.873   1    50.777  ? 1317 A 1 c
ATOM 3887 H HB2  . GLU Axp A    236 ? 18.728 19.081  8.013   1    50.301  ? 1317 A 1 c
ATOM 3888 H HG3  . GLU Axp A    236 ? 18.143 20.044  10.323  1    49.03   ? 1317 A 1 c
ATOM 3889 H HG2  . GLU Axp A    236 ? 16.865 20.553  9.523   1    49.007  ? 1317 A 1 c
ATOM 3890 N N    . SER Axp A    237 ? 15.437 17.402  9.769   1    55.366  ? 1318 A 1 .
ATOM 3891 C CA   . SER Axp A    237 ? 14.241 17.491  10.585  1    57.544  ? 1318 A 1 .
ATOM 3892 C C    . SER Axp A    237 ? 14.235 16.348  11.592  1    52.999  ? 1318 A 1 .
ATOM 3893 O O    . SER Axp A    237 ? 13.642 16.447  12.667  1    50.356  ? 1318 A 1 .
ATOM 3894 C CB   . SER Axp A    237 ? 13.01  17.52   9.731   1    58.172  ? 1318 A 1 .
ATOM 3895 O OG   . SER Axp A    237 ? 12.98  18.726  8.978   1    61.659  ? 1318 A 1 .
ATOM 3896 H H    . SER Axp A    237 ? 15.371 17.075  8.918   1    55.464  ? 1318 A 1 c
ATOM 3897 H HA   . SER Axp A    237 ? 14.28  18.342  11.091  1    56.312  ? 1318 A 1 c
ATOM 3898 H HB3  . SER Axp A    237 ? 12.218 17.467  10.298  1    58.857  ? 1318 A 1 c
ATOM 3899 H HB2  . SER Axp A    237 ? 13.012 16.754  9.127   1    58.851  ? 1318 A 1 c
ATOM 3900 H HG   . SER Axp A    237 ? 12.257 18.594  8.464   0    47.94   ? 1318 A 1 c
ATOM 3901 N N    . HIS Axp A    238 ? 14.923 15.266  11.238  1    47.947  ? 1319 A 1 .
ATOM 3902 C CA   . HIS Axp A    238 ? 15.056 14.169  12.167  1    47.994  ? 1319 A 1 .
ATOM 3903 C C    . HIS Axp A    238 ? 16.189 14.518  13.108  1    47.947  ? 1319 A 1 .
ATOM 3904 O O    . HIS Axp A    238 ? 16.057 14.357  14.316  1    48.054  ? 1319 A 1 .
ATOM 3905 C CB   . HIS Axp A    238 ? 15.308 12.847  11.44   1    48.757  ? 1319 A 1 .
ATOM 3906 C CG   . HIS Axp A    238 ? 14.198 12.481  10.525  1    46.262  ? 1319 A 1 .
ATOM 3907 N ND1  . HIS Axp A    238 ? 13.074 11.832  10.977  1    43.4    ? 1319 A 1 .
ATOM 3908 C CD2  . HIS Axp A    238 ? 14.025 12.697  9.208   1    44.065  ? 1319 A 1 .
ATOM 3909 C CE1  . HIS Axp A    238 ? 12.256 11.665  9.946   1    47.855  ? 1319 A 1 .
ATOM 3910 N NE2  . HIS Axp A    238 ? 12.813 12.176  8.862   1    44.304  ? 1319 A 1 .
ATOM 3911 H H    . HIS Axp A    238 ? 15.3   15.201  10.408  1    49.339  ? 1319 A 1 c
ATOM 3912 H HA   . HIS Axp A    238 ? 14.223 14.09   12.695  1    48.153  ? 1319 A 1 c
ATOM 3913 H HB3  . HIS Axp A    238 ? 15.423 12.135  12.107  1    47.992  ? 1319 A 1 c
ATOM 3914 H HB2  . HIS Axp A    238 ? 16.14  12.923  10.923  1    47.992  ? 1319 A 1 c
ATOM 3915 H HD1  . HIS Axp A    238 ? 12.93  11.665  11.793  0    40.5    ? 1319 A 1 c
ATOM 3916 H HD2  . HIS Axp A    238 ? 14.623 13.123  8.626   1    44.842  ? 1319 A 1 c
ATOM 3917 H HE1  . HIS Axp A    238 ? 11.419 11.236  9.984   1    46.048  ? 1319 A 1 c
ATOM 3918 H HE2  . HIS Axp A    238 ? 12.535 12.192  8.039   0    40.94   ? 1319 A 1 c
ATOM 3919 N N    . LEU Axp A    239 ? 17.295 15.005  12.535  1    48.039  ? 1320 A 1 .
ATOM 3920 C CA   . LEU Axp A    239 ? 18.435 15.363  13.357  1    47.902  ? 1320 A 1 .
ATOM 3921 C C    . LEU Axp A    239 ? 17.921 16.193  14.522  1    45.709  ? 1320 A 1 .
ATOM 3922 O O    . LEU Axp A    239 ? 18.469 16.152  15.621  1    42.173  ? 1320 A 1 .
ATOM 3923 C CB   . LEU Axp A    239 ? 19.521 16.133  12.621  1    47.033  ? 1320 A 1 .
ATOM 3924 C CG   . LEU Axp A    239 ? 20.608 16.683  13.549  1    49.937  ? 1320 A 1 .
ATOM 3925 C CD1  . LEU Axp A    239 ? 21.276 15.533  14.301  1    49.229  ? 1320 A 1 .
ATOM 3926 C CD2  . LEU Axp A    239 ? 21.632 17.539  12.827  1    52.589  ? 1320 A 1 .
ATOM 3927 H H    . LEU Axp A    239 ? 17.345 15.107  11.628  1    48.09   ? 1320 A 1 c
ATOM 3928 H HA   . LEU Axp A    239 ? 18.822 14.53   13.721  1    47.394  ? 1320 A 1 c
ATOM 3929 H HB3  . LEU Axp A    239 ? 19.102 16.886  12.144  1    47.877  ? 1320 A 1 c
ATOM 3930 H HB2  . LEU Axp A    239 ? 19.941 15.532  11.963  1    47.884  ? 1320 A 1 c
ATOM 3931 H HG   . LEU Axp A    239 ? 20.17  17.265  14.221  1    49.67   ? 1320 A 1 c
ATOM 3932 H HD11 . LEU Axp A    239 ? 20.864 15.432  15.175  1    49.328  ? 1320 A 1 c
ATOM 3933 H HD12 . LEU Axp A    239 ? 22.223 15.722  14.411  1    49.35   ? 1320 A 1 c
ATOM 3934 H HD13 . LEU Axp A    239 ? 21.17  14.709  13.798  1    49.356  ? 1320 A 1 c
ATOM 3935 H HD21 . LEU Axp A    239 ? 21.188 18.308  12.435  1    51.316  ? 1320 A 1 c
ATOM 3936 H HD22 . LEU Axp A    239 ? 22.057 17.012  12.13   1    51.325  ? 1320 A 1 c
ATOM 3937 H HD23 . LEU Axp A    239 ? 22.306 17.842  13.458  1    51.594  ? 1320 A 1 c
ATOM 3938 N N    . ASN Axp A    240 ? 16.833 16.911  14.25   1    45.505  ? 1321 A 1 .
ATOM 3939 C CA   . ASN Axp A    240 ? 16.368 17.95   15.143  1    45.757  ? 1321 A 1 .
ATOM 3940 C C    . ASN Axp A    240 ? 15.439 17.391  16.222  1    45.781  ? 1321 A 1 .
ATOM 3941 O O    . ASN Axp A    240 ? 15.6   17.704  17.4    1    40.841  ? 1321 A 1 .
ATOM 3942 C CB   . ASN Axp A    240 ? 15.736 19.055  14.319  1    45.227  ? 1321 A 1 .
ATOM 3943 C CG   . ASN Axp A    240 ? 16.249 20.384  14.784  1    46.788  ? 1321 A 1 .
ATOM 3944 O OD1  . ASN Axp A    240 ? 16.922 21.07   14.005  1    48.608  ? 1321 A 1 .
ATOM 3945 N ND2  . ASN Axp A    240 ? 15.991 20.696  16.052  1    46.577  ? 1321 A 1 .
ATOM 3946 H H    . ASN Axp A    240 ? 16.377 16.77   13.472  1    45.697  ? 1321 A 1 c
ATOM 3947 H HA   . ASN Axp A    240 ? 17.154 18.335  15.593  1    45.577  ? 1321 A 1 c
ATOM 3948 H HB3  . ASN Axp A    240 ? 14.763 19.027  14.417  1    45.711  ? 1321 A 1 c
ATOM 3949 H HB2  . ASN Axp A    240 ? 15.955 18.934  13.376  1    45.742  ? 1321 A 1 c
ATOM 3950 H HD21 . ASN Axp A    240 ? 16.494 21.29   16.476  1    46.477  ? 1321 A 1 c
ATOM 3951 H HD22 . ASN Axp A    240 ? 15.314 20.309  16.474  1    46.639  ? 1321 A 1 c
ATOM 3952 N N    . LYS Axp A    241 ? 14.44  16.603  15.796  1    51.168  ? 1322 A 1 .
ATOM 3953 C CA   . LYS Axp A    241 ? 13.572 15.875  16.709  1    50.157  ? 1322 A 1 .
ATOM 3954 C C    . LYS Axp A    241 ? 14.468 15.132  17.687  1    47.016  ? 1322 A 1 .
ATOM 3955 O O    . LYS Axp A    241 ? 14.259 15.131  18.898  1    44.795  ? 1322 A 1 .
ATOM 3956 C CB   . LYS Axp A    241 ? 12.699 14.875  15.941  1    50.262  ? 1322 A 1 .
ATOM 3957 C CG   . LYS Axp A    241 ? 11.913 13.898  16.801  1    53.584  ? 1322 A 1 .
ATOM 3958 C CD   . LYS Axp A    241 ? 10.878 14.561  17.706  1    57.144  ? 1322 A 1 .
ATOM 3959 C CE   . LYS Axp A    241 ? 9.799  13.632  18.195  1    61.415  ? 1322 A 1 .
ATOM 3960 N NZ   . LYS Axp A    241 ? 9.082  12.987  17.086  1    65.482  ? 1322 A 1 .
ATOM 3961 H H    . LYS Axp A    241 ? 14.293 16.521  14.897  1    49.556  ? 1322 A 1 c
ATOM 3962 H HA   . LYS Axp A    241 ? 13.007 16.519  17.203  1    49.931  ? 1322 A 1 c
ATOM 3963 H HB3  . LYS Axp A    241 ? 13.274 14.359  15.337  1    50.983  ? 1322 A 1 c
ATOM 3964 H HB2  . LYS Axp A    241 ? 12.064 15.377  15.387  1    50.983  ? 1322 A 1 c
ATOM 3965 H HG3  . LYS Axp A    241 ? 12.543 13.389  17.354  1    53.521  ? 1322 A 1 c
ATOM 3966 H HG2  . LYS Axp A    241 ? 11.459 13.263  16.209  1    53.739  ? 1322 A 1 c
ATOM 3967 H HD3  . LYS Axp A    241 ? 10.459 15.301  17.215  1    57.278  ? 1322 A 1 c
ATOM 3968 H HD2  . LYS Axp A    241 ? 11.34  14.946  18.483  1    57.265  ? 1322 A 1 c
ATOM 3969 H HE3  . LYS Axp A    241 ? 9.161  14.134  18.733  1    61.313  ? 1322 A 1 c
ATOM 3970 H HE2  . LYS Axp A    241 ? 10.193 12.943  18.759  1    61.216  ? 1322 A 1 c
ATOM 3971 H HZ1  . LYS Axp A    241 ? 9.482  12.201  16.878  1    64.082  ? 1322 A 1 c
ATOM 3972 H HZ2  . LYS Axp A    241 ? 9.086  13.526  16.357  1    64.009  ? 1322 A 1 c
ATOM 3973 H HZ3  . LYS Axp A    241 ? 8.225  12.827  17.331  1    64.142  ? 1322 A 1 c
ATOM 3974 N N    . TYR Axp A    242 ? 15.503 14.526  17.111  1    46.145  ? 1323 A 1 .
ATOM 3975 C CA   . TYR Axp A    242 ? 16.464 13.775  17.885  1    45.024  ? 1323 A 1 .
ATOM 3976 C C    . TYR Axp A    242 ? 16.959 14.643  19.04   1    46.962  ? 1323 A 1 .
ATOM 3977 O O    . TYR Axp A    242 ? 16.69  14.332  20.202  1    48.426  ? 1323 A 1 .
ATOM 3978 C CB   . TYR Axp A    242 ? 17.586 13.264  16.979  1    40.571  ? 1323 A 1 .
ATOM 3979 C CG   . TYR Axp A    242 ? 18.612 12.514  17.809  1    41.977  ? 1323 A 1 .
ATOM 3980 C CD1  . TYR Axp A    242 ? 19.522 13.198  18.613  1    46.469  ? 1323 A 1 .
ATOM 3981 C CD2  . TYR Axp A    242 ? 18.643 11.126  17.83   1    41.204  ? 1323 A 1 .
ATOM 3982 C CE1  . TYR Axp A    242 ? 20.448 12.521  19.394  1    47.048  ? 1323 A 1 .
ATOM 3983 C CE2  . TYR Axp A    242 ? 19.564 10.435  18.606  1    40.691  ? 1323 A 1 .
ATOM 3984 C CZ   . TYR Axp A    242 ? 20.469 11.137  19.383  1    43.044  ? 1323 A 1 .
ATOM 3985 O OH   . TYR Axp A    242 ? 21.389 10.485  20.131  1    40.391  ? 1323 A 1 .
ATOM 3986 H H    . TYR Axp A    242 ? 15.604 14.567  16.204  1    46.114  ? 1323 A 1 c
ATOM 3987 H HA   . TYR Axp A    242 ? 15.997 12.986  18.269  1    44.751  ? 1323 A 1 c
ATOM 3988 H HB3  . TYR Axp A    242 ? 18.016 14.024  16.533  1    41.884  ? 1323 A 1 c
ATOM 3989 H HB2  . TYR Axp A    242 ? 17.207 12.661  16.302  1    41.859  ? 1323 A 1 c
ATOM 3990 H HD1  . TYR Axp A    242 ? 19.521 14.141  18.618  1    45.43   ? 1323 A 1 c
ATOM 3991 H HD2  . TYR Axp A    242 ? 18.027 10.642  17.304  1    41.342  ? 1323 A 1 c
ATOM 3992 H HE1  . TYR Axp A    242 ? 21.071 12.999  19.915  1    45.824  ? 1323 A 1 c
ATOM 3993 H HE2  . TYR Axp A    242 ? 19.578 9.495   18.599  1    41.398  ? 1323 A 1 c
ATOM 3994 H HH   . TYR Axp A    242 ? 21.905 11.133  20.532  0    36.13   ? 1323 A 1 c
ATOM 3995 N N    . PHE Axp A    243 ? 17.672 15.73   18.706  1    45.963  ? 1324 A 1 .
ATOM 3996 C CA   . PHE Axp A    243 ? 18.327 16.565  19.702  1    42.63   ? 1324 A 1 .
ATOM 3997 C C    . PHE Axp A    243 ? 17.305 17.206  20.637  1    43.332  ? 1324 A 1 .
ATOM 3998 O O    . PHE Axp A    243 ? 17.69  17.789  21.654  1    38.789  ? 1324 A 1 .
ATOM 3999 C CB   . PHE Axp A    243 ? 19.198 17.624  19.024  1    41.335  ? 1324 A 1 .
ATOM 4000 C CG   . PHE Axp A    243 ? 20.57  17.117  18.605  1    42.482  ? 1324 A 1 .
ATOM 4001 C CD1  . PHE Axp A    243 ? 21.341 16.332  19.462  1    44.325  ? 1324 A 1 .
ATOM 4002 C CD2  . PHE Axp A    243 ? 21.08  17.408  17.347  1    42.86   ? 1324 A 1 .
ATOM 4003 C CE1  . PHE Axp A    243 ? 22.586 15.863  19.07   1    42.972  ? 1324 A 1 .
ATOM 4004 C CE2  . PHE Axp A    243 ? 22.328 16.943  16.967  1    42.662  ? 1324 A 1 .
ATOM 4005 C CZ   . PHE Axp A    243 ? 23.074 16.17   17.826  1    42.2    ? 1324 A 1 .
ATOM 4006 H H    . PHE Axp A    243 ? 17.746 15.958  17.824  1    45.305  ? 1324 A 1 c
ATOM 4007 H HA   . PHE Axp A    243 ? 18.912 15.982  20.246  1    43.152  ? 1324 A 1 c
ATOM 4008 H HB3  . PHE Axp A    243 ? 19.315 18.376  19.643  1    41.843  ? 1324 A 1 c
ATOM 4009 H HB2  . PHE Axp A    243 ? 18.725 17.958  18.23   1    41.886  ? 1324 A 1 c
ATOM 4010 H HD1  . PHE Axp A    243 ? 21.013 16.117  20.319  1    43.539  ? 1324 A 1 c
ATOM 4011 H HD2  . PHE Axp A    243 ? 20.576 17.938  16.751  1    42.719  ? 1324 A 1 c
ATOM 4012 H HE1  . PHE Axp A    243 ? 23.099 15.337  19.662  1    43.086  ? 1324 A 1 c
ATOM 4013 H HE2  . PHE Axp A    243 ? 22.666 17.153  16.112  1    42.69   ? 1324 A 1 c
ATOM 4014 H HZ   . PHE Axp A    243 ? 23.923 15.855  17.562  1    42.526  ? 1324 A 1 c
ATOM 4015 N N    . LEU Axp A    244 ? 16.012 17.105  20.277  1    46.889  ? 1325 A 1 .
ATOM 4016 C CA   . LEU Axp A    244 ? 14.933 17.5    21.171  1    47.07   ? 1325 A 1 .
ATOM 4017 C C    . LEU Axp A    244 ? 14.858 16.462  22.28   1    43.567  ? 1325 A 1 .
ATOM 4018 O O    . LEU Axp A    244 ? 14.952 16.8    23.462  1    41.345  ? 1325 A 1 .
ATOM 4019 C CB   . LEU Axp A    244 ? 13.579 17.624  20.471  1    48.486  ? 1325 A 1 .
ATOM 4020 C CG   . LEU Axp A    244 ? 12.626 18.719  20.977  1    50.1    ? 1325 A 1 .
ATOM 4021 C CD1  . LEU Axp A    244 ? 11.224 18.313  20.579  1    51.575  ? 1325 A 1 .
ATOM 4022 C CD2  . LEU Axp A    244 ? 12.642 19.067  22.465  1    50.165  ? 1325 A 1 .
ATOM 4023 H H    . LEU Axp A    244 ? 15.799 16.815  19.438  1    46.077  ? 1325 A 1 c
ATOM 4024 H HA   . LEU Axp A    244 ? 15.169 18.374  21.574  1    46.562  ? 1325 A 1 c
ATOM 4025 H HB3  . LEU Axp A    244 ? 13.116 16.757  20.542  1    48.456  ? 1325 A 1 c
ATOM 4026 H HB2  . LEU Axp A    244 ? 13.745 17.781  19.513  1    48.479  ? 1325 A 1 c
ATOM 4027 H HG   . LEU Axp A    244 ? 12.84  19.551  20.482  1    50.085  ? 1325 A 1 c
ATOM 4028 H HD11 . LEU Axp A    244 ? 11.214 18.051  19.644  1    51.206  ? 1325 A 1 c
ATOM 4029 H HD12 . LEU Axp A    244 ? 10.619 19.062  20.711  1    51.204  ? 1325 A 1 c
ATOM 4030 H HD13 . LEU Axp A    244 ? 10.934 17.564  21.127  1    51.144  ? 1325 A 1 c
ATOM 4031 H HD21 . LEU Axp A    244 ? 13.436 19.59   22.667  1    50.11   ? 1325 A 1 c
ATOM 4032 H HD22 . LEU Axp A    244 ? 12.651 18.25   22.99   1    50.11   ? 1325 A 1 c
ATOM 4033 H HD23 . LEU Axp A    244 ? 11.85  19.585  22.687  1    50.146  ? 1325 A 1 c
ATOM 4034 N N    . LEU Axp A    245 ? 14.731 15.197  21.864  1    41.73   ? 1326 A 1 .
ATOM 4035 C CA   . LEU Axp A    245 ? 14.51  14.113  22.804  1    43.307  ? 1326 A 1 .
ATOM 4036 C C    . LEU Axp A    245 ? 15.818 13.82   23.54   1    42.415  ? 1326 A 1 .
ATOM 4037 O O    . LEU Axp A    245 ? 15.83  13.747  24.764  1    43.059  ? 1326 A 1 .
ATOM 4038 C CB   . LEU Axp A    245 ? 13.942 12.898  22.074  1    44.92   ? 1326 A 1 .
ATOM 4039 C CG   . LEU Axp A    245 ? 12.799 13.171  21.086  1    45.944  ? 1326 A 1 .
ATOM 4040 C CD1  . LEU Axp A    245 ? 12.533 11.956  20.194  1    46.384  ? 1326 A 1 .
ATOM 4041 C CD2  . LEU Axp A    245 ? 11.522 13.612  21.791  1    46.933  ? 1326 A 1 .
ATOM 4042 H H    . LEU Axp A    245 ? 14.804 15.005  20.974  1    42.658  ? 1326 A 1 c
ATOM 4043 H HA   . LEU Axp A    245 ? 13.845 14.42   23.472  1    43.11   ? 1326 A 1 c
ATOM 4044 H HB3  . LEU Axp A    245 ? 13.62  12.258  22.75   1    44.773  ? 1326 A 1 c
ATOM 4045 H HB2  . LEU Axp A    245 ? 14.679 12.465  21.585  1    44.771  ? 1326 A 1 c
ATOM 4046 H HG   . LEU Axp A    245 ? 13.076 13.912  20.494  1    45.958  ? 1326 A 1 c
ATOM 4047 H HD11 . LEU Axp A    245 ? 13.333 11.406  20.143  1    46.271  ? 1326 A 1 c
ATOM 4048 H HD12 . LEU Axp A    245 ? 12.292 12.255  19.303  1    46.399  ? 1326 A 1 c
ATOM 4049 H HD13 . LEU Axp A    245 ? 11.805 11.432  20.567  1    46.289  ? 1326 A 1 c
ATOM 4050 H HD21 . LEU Axp A    245 ? 11.686 14.441  22.272  1    46.624  ? 1326 A 1 c
ATOM 4051 H HD22 . LEU Axp A    245 ? 11.243 12.924  22.419  1    46.636  ? 1326 A 1 c
ATOM 4052 H HD23 . LEU Axp A    245 ? 10.82  13.753  21.134  1    46.636  ? 1326 A 1 c
ATOM 4053 N N    . ASN Axp A    246 ? 16.925 13.707  22.799  1    41.795  ? 1327 A 1 .
ATOM 4054 C CA   . ASN Axp A    246 ? 18.236 13.542  23.408  1    43.075  ? 1327 A 1 .
ATOM 4055 C C    . ASN Axp A    246 ? 19.047 14.83   23.253  1    45.048  ? 1327 A 1 .
ATOM 4056 O O    . ASN Axp A    246 ? 19.864 14.961  22.338  1    43.072  ? 1327 A 1 .
ATOM 4057 C CB   . ASN Axp A    246 ? 18.971 12.361  22.798  1    44.418  ? 1327 A 1 .
ATOM 4058 C CG   . ASN Axp A    246 ? 18.014 11.277  22.382  1    44.365  ? 1327 A 1 .
ATOM 4059 O OD1  . ASN Axp A    246 ? 17.617 10.434  23.195  1    47.348  ? 1327 A 1 .
ATOM 4060 N ND2  . ASN Axp A    246 ? 17.647 11.284  21.111  1    44.431  ? 1327 A 1 .
ATOM 4061 H H    . ASN Axp A    246 ? 16.864 13.747  21.888  1    42.272  ? 1327 A 1 c
ATOM 4062 H HA   . ASN Axp A    246 ? 18.119 13.355  24.366  1    43.429  ? 1327 A 1 c
ATOM 4063 H HB3  . ASN Axp A    246 ? 19.602 12      23.452  1    44.1    ? 1327 A 1 c
ATOM 4064 H HB2  . ASN Axp A    246 ? 19.479 12.659  22.018  1    44.113  ? 1327 A 1 c
ATOM 4065 H HD21 . ASN Axp A    246 ? 17.288 10.556  20.754  1    44.427  ? 1327 A 1 c
ATOM 4066 H HD22 . ASN Axp A    246 ? 17.76  12.012  20.616  1    44.395  ? 1327 A 1 c
ATOM 4067 N N    . LYS Axp A    247 ? 18.821 15.762  24.189  1    46.664  ? 1328 A 1 .
ATOM 4068 C CA   . LYS Axp A    247 ? 19.458 17.069  24.199  1    44.567  ? 1328 A 1 .
ATOM 4069 C C    . LYS Axp A    247 ? 20.951 16.899  23.951  1    42.727  ? 1328 A 1 .
ATOM 4070 O O    . LYS Axp A    247 ? 21.566 16.043  24.571  1    41.57   ? 1328 A 1 .
ATOM 4071 C CB   . LYS Axp A    247 ? 19.263 17.78   25.548  1    47.069  ? 1328 A 1 .
ATOM 4072 C CG   . LYS Axp A    247 ? 17.817 18.05   26.015  1    48.279  ? 1328 A 1 .
ATOM 4073 C CD   . LYS Axp A    247 ? 17.053 19.067  25.166  1    48.89   ? 1328 A 1 .
ATOM 4074 C CE   . LYS Axp A    247 ? 15.784 19.571  25.788  1    48.623  ? 1328 A 1 .
ATOM 4075 N NZ   . LYS Axp A    247 ? 14.594 18.795  25.426  1    49.405  ? 1328 A 1 .
ATOM 4076 H H    . LYS Axp A    247 ? 18.235 15.563  24.861  1    45.797  ? 1328 A 1 c
ATOM 4077 H HA   . LYS Axp A    247 ? 19.063 17.615  23.481  1    45.022  ? 1328 A 1 c
ATOM 4078 H HB3  . LYS Axp A    247 ? 19.728 18.638  25.5    1    46.495  ? 1328 A 1 c
ATOM 4079 H HB2  . LYS Axp A    247 ? 19.708 17.246  26.24   1    46.683  ? 1328 A 1 c
ATOM 4080 H HG3  . LYS Axp A    247 ? 17.847 18.371  26.942  1    48.142  ? 1328 A 1 c
ATOM 4081 H HG2  . LYS Axp A    247 ? 17.324 17.201  26.012  1    48.123  ? 1328 A 1 c
ATOM 4082 H HD3  . LYS Axp A    247 ? 16.84  18.655  24.301  1    48.68   ? 1328 A 1 c
ATOM 4083 H HD2  . LYS Axp A    247 ? 17.643 19.831  24.99   1    48.623  ? 1328 A 1 c
ATOM 4084 H HE3  . LYS Axp A    247 ? 15.648 20.495  25.52   1    48.883  ? 1328 A 1 c
ATOM 4085 H HE2  . LYS Axp A    247 ? 15.877 19.559  26.757  1    48.863  ? 1328 A 1 c
ATOM 4086 H HZ1  . LYS Axp A    247 ? 14.625 17.983  25.827  1    49.165  ? 1328 A 1 c
ATOM 4087 H HZ2  . LYS Axp A    247 ? 14.56  18.682  24.529  1    49.17   ? 1328 A 1 c
ATOM 4088 H HZ3  . LYS Axp A    247 ? 13.849 19.233  25.699  1    49.165  ? 1328 A 1 c
ATOM 4089 N N    . PRO Axp A    248 ? 21.577 17.697  23.051  1    44.406  ? 1329 A 1 .
ATOM 4090 C CA   . PRO Axp A    248 ? 23.03  17.73   22.934  1    42.759  ? 1329 A 1 .
ATOM 4091 C C    . PRO Axp A    248 ? 23.692 18.196  24.228  1    41.517  ? 1329 A 1 .
ATOM 4092 O O    . PRO Axp A    248 ? 23.068 18.913  25.017  1    39.696  ? 1329 A 1 .
ATOM 4093 C CB   . PRO Axp A    248 ? 23.287 18.715  21.794  1    43.155  ? 1329 A 1 .
ATOM 4094 C CG   . PRO Axp A    248 ? 22.055 19.599  21.814  1    43.635  ? 1329 A 1 .
ATOM 4095 C CD   . PRO Axp A    248 ? 20.93  18.664  22.15   1    45.328  ? 1329 A 1 .
ATOM 4096 H HA   . PRO Axp A    248 ? 23.359 16.843  22.691  1    42.85   ? 1329 A 1 c
ATOM 4097 H HB3  . PRO Axp A    248 ? 23.37  18.249  20.94   1    43.172  ? 1329 A 1 c
ATOM 4098 H HB2  . PRO Axp A    248 ? 24.096 19.238  21.956  1    43.164  ? 1329 A 1 c
ATOM 4099 H HG3  . PRO Axp A    248 ? 21.909 20.016  20.942  1    43.85   ? 1329 A 1 c
ATOM 4100 H HG2  . PRO Axp A    248 ? 22.137 20.299  22.491  1    43.831  ? 1329 A 1 c
ATOM 4101 H HD3  . PRO Axp A    248 ? 20.204 19.134  22.602  1    44.718  ? 1329 A 1 c
ATOM 4102 H HD2  . PRO Axp A    248 ? 20.586 18.22   21.356  1    44.677  ? 1329 A 1 c
ATOM 4103 N N    . THR Axp A    249 ? 24.939 17.758  24.439  1    37.445  ? 1330 A 1 .
ATOM 4104 C CA   . THR Axp A    249 ? 25.7   18.151  25.611  1    35.981  ? 1330 A 1 .
ATOM 4105 C C    . THR Axp A    249 ? 26.478 19.429  25.314  1    34.372  ? 1330 A 1 .
ATOM 4106 O O    . THR Axp A    249 ? 26.835 20.145  26.24   1    33.174  ? 1330 A 1 .
ATOM 4107 C CB   . THR Axp A    249 ? 26.619 17.01   26.037  1    36.926  ? 1330 A 1 .
ATOM 4108 O OG1  . THR Axp A    249 ? 27.498 16.684  24.965  1    39.354  ? 1330 A 1 .
ATOM 4109 C CG2  . THR Axp A    249 ? 25.821 15.773  26.393  1    38.102  ? 1330 A 1 .
ATOM 4110 H H    . THR Axp A    249 ? 25.324 17.191  23.834  1    38.045  ? 1330 A 1 c
ATOM 4111 H HA   . THR Axp A    249 ? 25.071 18.33   26.343  1    36.187  ? 1330 A 1 c
ATOM 4112 H HB   . THR Axp A    249 ? 27.151 17.289  26.821  1    37.428  ? 1330 A 1 c
ATOM 4113 H HG1  . THR Axp A    249 ? 26.949 16.33   24.24   0    28.23   ? 1330 A 1 c
ATOM 4114 H HG21 . THR Axp A    249 ? 26.384 15.155  26.888  1    37.744  ? 1330 A 1 c
ATOM 4115 H HG22 . THR Axp A    249 ? 25.508 15.343  25.579  1    37.743  ? 1330 A 1 c
ATOM 4116 H HG23 . THR Axp A    249 ? 25.058 16.024  26.94   1    37.728  ? 1330 A 1 c
ATOM 4117 N N    . LYS Axp A    250 ? 26.749 19.689  24.028  1    32.677  ? 1331 A 1 .
ATOM 4118 C CA   . LYS Axp A    250 ? 27.478 20.872  23.607  1    30.779  ? 1331 A 1 .
ATOM 4119 C C    . LYS Axp A    250 ? 26.881 21.35   22.293  1    30.043  ? 1331 A 1 .
ATOM 4120 O O    . LYS Axp A    250 ? 26.597 20.564  21.397  1    28.727  ? 1331 A 1 .
ATOM 4121 C CB   . LYS Axp A    250 ? 28.977 20.606  23.44   1    30.445  ? 1331 A 1 .
ATOM 4122 C CG   . LYS Axp A    250 ? 29.843 21.82   23.141  1    29.881  ? 1331 A 1 .
ATOM 4123 C CD   . LYS Axp A    250 ? 31.318 21.505  22.9    1    29.998  ? 1331 A 1 .
ATOM 4124 C CE   . LYS Axp A    250 ? 32.277 21.858  24.005  1    30.887  ? 1331 A 1 .
ATOM 4125 N NZ   . LYS Axp A    250 ? 32.351 20.933  25.139  1    32.485  ? 1331 A 1 .
ATOM 4126 H H    . LYS Axp A    250 ? 26.476 19.098  23.387  1    32.708  ? 1331 A 1 c
ATOM 4127 H HA   . LYS Axp A    250 ? 27.352 21.578  24.29   1    31.014  ? 1331 A 1 c
ATOM 4128 H HB3  . LYS Axp A    250 ? 29.096 19.959  22.715  1    30.41   ? 1331 A 1 c
ATOM 4129 H HB2  . LYS Axp A    250 ? 29.31  20.189  24.263  1    30.394  ? 1331 A 1 c
ATOM 4130 H HG3  . LYS Axp A    250 ? 29.77  22.445  23.893  1    30.111  ? 1331 A 1 c
ATOM 4131 H HG2  . LYS Axp A    250 ? 29.483 22.27   22.346  1    30.05   ? 1331 A 1 c
ATOM 4132 H HD3  . LYS Axp A    250 ? 31.598 21.975  22.085  1    30.169  ? 1331 A 1 c
ATOM 4133 H HD2  . LYS Axp A    250 ? 31.394 20.546  22.713  1    30.15   ? 1331 A 1 c
ATOM 4134 H HE3  . LYS Axp A    250 ? 32.033 22.737  24.34   1    31.045  ? 1331 A 1 c
ATOM 4135 H HE2  . LYS Axp A    250 ? 33.169 21.924  23.629  1    30.981  ? 1331 A 1 c
ATOM 4136 H HZ1  . LYS Axp A    250 ? 32.215 20.083  24.855  1    31.96   ? 1331 A 1 c
ATOM 4137 H HZ2  . LYS Axp A    250 ? 31.717 21.147  25.75   1    31.979  ? 1331 A 1 c
ATOM 4138 H HZ3  . LYS Axp A    250 ? 33.168 20.988  25.526  1    31.981  ? 1331 A 1 c
ATOM 4139 N N    . ILE Axp A    251 ? 26.673 22.658  22.215  1    30.852  ? 1332 A 1 .
ATOM 4140 C CA   . ILE Axp A    251 ? 26.154 23.276  21.018  1    31.701  ? 1332 A 1 .
ATOM 4141 C C    . ILE Axp A    251 ? 27.191 24.26   20.503  1    31.719  ? 1332 A 1 .
ATOM 4142 O O    . ILE Axp A    251 ? 27.738 25.052  21.266  1    32.966  ? 1332 A 1 .
ATOM 4143 C CB   . ILE Axp A    251 ? 24.825 23.984  21.295  1    32.662  ? 1332 A 1 .
ATOM 4144 C CG1  . ILE Axp A    251 ? 23.761 22.993  21.745  1    32.588  ? 1332 A 1 .
ATOM 4145 C CG2  . ILE Axp A    251 ? 24.4   24.778  20.059  1    33.482  ? 1332 A 1 .
ATOM 4146 C CD1  . ILE Axp A    251 ? 22.464 23.651  22.173  1    32.319  ? 1332 A 1 .
ATOM 4147 H H    . ILE Axp A    251 ? 26.863 23.189  22.934  1    30.848  ? 1332 A 1 c
ATOM 4148 H HA   . ILE Axp A    251 ? 26.005 22.587  20.344  1    31.623  ? 1332 A 1 c
ATOM 4149 H HB   . ILE Axp A    251 ? 24.971 24.617  22.024  1    32.676  ? 1332 A 1 c
ATOM 4150 H HG12 . ILE Axp A    251 ? 24.112 22.471  22.496  1    32.534  ? 1332 A 1 c
ATOM 4151 H HG13 . ILE Axp A    251 ? 23.574 22.374  21.01   1    32.541  ? 1332 A 1 c
ATOM 4152 H HG21 . ILE Axp A    251 ? 23.488 25.09   20.17   1    33.15   ? 1332 A 1 c
ATOM 4153 H HG22 . ILE Axp A    251 ? 24.453 24.21   19.272  1    33.214  ? 1332 A 1 c
ATOM 4154 H HG23 . ILE Axp A    251 ? 24.988 25.542  19.944  1    33.2    ? 1332 A 1 c
ATOM 4155 H HD11 . ILE Axp A    251 ? 22.666 24.423  22.734  1    32.565  ? 1332 A 1 c
ATOM 4156 H HD12 . ILE Axp A    251 ? 21.926 23.014  22.68   1    32.523  ? 1332 A 1 c
ATOM 4157 H HD13 . ILE Axp A    251 ? 21.963 23.946  21.39   1    32.505  ? 1332 A 1 c
ATOM 4158 N N    . LEU Axp A    252 ? 27.413 24.198  19.191  1    30.651  ? 1333 A 1 .
ATOM 4159 C CA   . LEU Axp A    252 ? 28.296 25.117  18.51   1    29.691  ? 1333 A 1 .
ATOM 4160 C C    . LEU Axp A    252 ? 27.444 26.253  17.986  1    29.068  ? 1333 A 1 .
ATOM 4161 O O    . LEU Axp A    252 ? 26.435 25.999  17.351  1    31.681  ? 1333 A 1 .
ATOM 4162 C CB   . LEU Axp A    252 ? 28.993 24.393  17.366  1    29.903  ? 1333 A 1 .
ATOM 4163 C CG   . LEU Axp A    252 ? 29.691 23.094  17.756  1    31.304  ? 1333 A 1 .
ATOM 4164 C CD1  . LEU Axp A    252 ? 30.537 22.564  16.625  1    30.801  ? 1333 A 1 .
ATOM 4165 C CD2  . LEU Axp A    252 ? 30.517 23.328  19.01   1    32.364  ? 1333 A 1 .
ATOM 4166 H H    . LEU Axp A    252 ? 26.992 23.554  18.698  1    30.692  ? 1333 A 1 c
ATOM 4167 H HA   . LEU Axp A    252 ? 28.967 25.465  19.15   1    29.838  ? 1333 A 1 c
ATOM 4168 H HB3  . LEU Axp A    252 ? 29.662 25.003  16.978  1    30.138  ? 1333 A 1 c
ATOM 4169 H HB2  . LEU Axp A    252 ? 28.323 24.192  16.673  1    30.163  ? 1333 A 1 c
ATOM 4170 H HG   . LEU Axp A    252 ? 28.996 22.419  17.964  1    31.149  ? 1333 A 1 c
ATOM 4171 H HD11 . LEU Axp A    252 ? 30     22.503  15.817  1    30.927  ? 1333 A 1 c
ATOM 4172 H HD12 . LEU Axp A    252 ? 30.873 21.682  16.856  1    30.89   ? 1333 A 1 c
ATOM 4173 H HD13 . LEU Axp A    252 ? 31.286 23.164  16.47   1    30.893  ? 1333 A 1 c
ATOM 4174 H HD21 . LEU Axp A    252 ? 29.934 23.337  19.787  1    31.985  ? 1333 A 1 c
ATOM 4175 H HD22 . LEU Axp A    252 ? 30.979 24.18   18.942  1    31.97   ? 1333 A 1 c
ATOM 4176 H HD23 . LEU Axp A    252 ? 31.168 22.614  19.105  1    31.892  ? 1333 A 1 c
ATOM 4177 N N    . SER Axp A    253 ? 27.889 27.478  18.249  1    28.799  ? 1334 A 1 .
ATOM 4178 C CA   . SER Axp A    253 ? 27.268 28.677  17.73   1    28.453  ? 1334 A 1 .
ATOM 4179 C C    . SER Axp A    253 ? 27.427 28.768  16.217  1    27.58   ? 1334 A 1 .
ATOM 4180 O O    . SER Axp A    253 ? 28.287 28.127  15.617  1    27.082  ? 1334 A 1 .
ATOM 4181 C CB   . SER Axp A    253 ? 27.872 29.887  18.359  1    30.823  ? 1334 A 1 .
ATOM 4182 O OG   . SER Axp A    253 ? 29.103 30.223  17.727  1    31.541  ? 1334 A 1 .
ATOM 4183 H H    . SER Axp A    253 ? 28.626 27.569  18.781  1    28.825  ? 1334 A 1 c
ATOM 4184 H HA   . SER Axp A    253 ? 26.305 28.648  17.951  1    28.818  ? 1334 A 1 c
ATOM 4185 H HB3  . SER Axp A    253 ? 28.026 29.719  19.307  1    30.431  ? 1334 A 1 c
ATOM 4186 H HB2  . SER Axp A    253 ? 27.255 30.633  18.277  1    30.457  ? 1334 A 1 c
ATOM 4187 H HG   . SER Axp A    253 ? 29.406 30.882  18.112  0    20.44   ? 1334 A 1 c
ATOM 4188 N N    . PRO Axp A    254 ? 26.607 29.622  15.573  1    28.695  ? 1335 A 1 .
ATOM 4189 C CA   . PRO Axp A    254 ? 26.681 29.876  14.14   1    28.651  ? 1335 A 1 .
ATOM 4190 C C    . PRO Axp A    254 ? 28.06  30.259  13.62   1    27.037  ? 1335 A 1 .
ATOM 4191 O O    . PRO Axp A    254 ? 28.29  30.219  12.414  1    24.943  ? 1335 A 1 .
ATOM 4192 C CB   . PRO Axp A    254 ? 25.723 31.049  13.953  1    29.704  ? 1335 A 1 .
ATOM 4193 C CG   . PRO Axp A    254 ? 24.711 30.829  15.044  1    30.317  ? 1335 A 1 .
ATOM 4194 C CD   . PRO Axp A    254 ? 25.512 30.366  16.209  1    30.287  ? 1335 A 1 .
ATOM 4195 H HA   . PRO Axp A    254 ? 26.35  29.094  13.651  1    28.544  ? 1335 A 1 c
ATOM 4196 H HB3  . PRO Axp A    254 ? 25.304 31.023  13.072  1    29.664  ? 1335 A 1 c
ATOM 4197 H HB2  . PRO Axp A    254 ? 26.184 31.902  14.068  1    29.663  ? 1335 A 1 c
ATOM 4198 H HG3  . PRO Axp A    254 ? 24.054 30.153  14.783  1    30.174  ? 1335 A 1 c
ATOM 4199 H HG2  . PRO Axp A    254 ? 24.246 31.658  15.256  1    30.187  ? 1335 A 1 c
ATOM 4200 H HD3  . PRO Axp A    254 ? 25.856 31.119  16.723  1    29.93   ? 1335 A 1 c
ATOM 4201 H HD2  . PRO Axp A    254 ? 24.985 29.787  16.791  1    29.89   ? 1335 A 1 c
ATOM 4202 N N    . GLU Axp A    255 ? 28.937 30.68   14.539  1    27.31   ? 1336 A 1 .
ATOM 4203 C CA   . GLU Axp A    255 ? 30.317 30.98   14.206  1    27.825  ? 1336 A 1 .
ATOM 4204 C C    . GLU Axp A    255 ? 30.954 29.723  13.616  1    26.982  ? 1336 A 1 .
ATOM 4205 O O    . GLU Axp A    255 ? 31.827 29.803  12.76   1    26.763  ? 1336 A 1 .
ATOM 4206 C CB   . GLU Axp A    255 ? 31.064 31.506  15.436  1    29.156  ? 1336 A 1 .
ATOM 4207 C CG   . GLU Axp A    255 ? 30.63  32.896  15.904  1    30.178  ? 1336 A 1 .
ATOM 4208 C CD   . GLU Axp A    255 ? 31.119 33.255  17.305  1    31.734  ? 1336 A 1 .
ATOM 4209 O OE1  . GLU Axp A    255 ? 31.101 32.35   18.177  1    31.597  ? 1336 A 1 .
ATOM 4210 O OE2  . GLU Axp A    255 ? 31.471 34.436  17.552  1    32.114  ? 1336 A 1 .
ATOM 4211 H H    . GLU Axp A    255 ? 28.658 30.814  15.398  1    27.392  ? 1336 A 1 c
ATOM 4212 H HA   . GLU Axp A    255 ? 30.32  31.687  13.512  1    27.804  ? 1336 A 1 c
ATOM 4213 H HB3  . GLU Axp A    255 ? 32.021 31.538  15.227  1    29.095  ? 1336 A 1 c
ATOM 4214 H HB2  . GLU Axp A    255 ? 30.944 30.868  16.168  1    29.117  ? 1336 A 1 c
ATOM 4215 H HG3  . GLU Axp A    255 ? 29.65  32.946  15.893  1    30.274  ? 1336 A 1 c
ATOM 4216 H HG2  . GLU Axp A    255 ? 30.97  33.567  15.273  1    30.286  ? 1336 A 1 c
ATOM 4217 N N    . TYR Axp A    256 ? 30.49  28.558  14.061  1    26.777  ? 1337 A 1 .
ATOM 4218 C CA   . TYR Axp A    256 ? 31.033 27.313  13.572  1    26.799  ? 1337 A 1 .
ATOM 4219 C C    . TYR Axp A    256 ? 30.329 26.9    12.29   1    30.537  ? 1337 A 1 .
ATOM 4220 O O    . TYR Axp A    256 ? 30.789 25.972  11.62   1    34.633  ? 1337 A 1 .
ATOM 4221 C CB   . TYR Axp A    256 ? 30.918 26.251  14.655  1    25.575  ? 1337 A 1 .
ATOM 4222 C CG   . TYR Axp A    256 ? 31.892 26.567  15.767  1    26.205  ? 1337 A 1 .
ATOM 4223 C CD1  . TYR Axp A    256 ? 31.561 27.417  16.816  1    26.313  ? 1337 A 1 .
ATOM 4224 C CD2  . TYR Axp A    256 ? 33.171 26.052  15.727  1    27.356  ? 1337 A 1 .
ATOM 4225 C CE1  . TYR Axp A    256 ? 32.467 27.705  17.824  1    25.401  ? 1337 A 1 .
ATOM 4226 C CE2  . TYR Axp A    256 ? 34.089 26.34   16.722  1    26.943  ? 1337 A 1 .
ATOM 4227 C CZ   . TYR Axp A    256 ? 33.74  27.17   17.768  1    25.01   ? 1337 A 1 .
ATOM 4228 O OH   . TYR Axp A    256 ? 34.699 27.41   18.699  1    23.47   ? 1337 A 1 .
ATOM 4229 H H    . TYR Axp A    256 ? 29.837 28.537  14.699  1    26.831  ? 1337 A 1 c
ATOM 4230 H HA   . TYR Axp A    256 ? 31.993 27.447  13.371  1    27.234  ? 1337 A 1 c
ATOM 4231 H HB3  . TYR Axp A    256 ? 31.129 25.371  14.271  1    26.037  ? 1337 A 1 c
ATOM 4232 H HB2  . TYR Axp A    256 ? 30.002 26.244  15.009  1    26.057  ? 1337 A 1 c
ATOM 4233 H HD1  . TYR Axp A    256 ? 30.692 27.784  16.859  1    26.067  ? 1337 A 1 c
ATOM 4234 H HD2  . TYR Axp A    256 ? 33.421 25.484  15.019  1    26.943  ? 1337 A 1 c
ATOM 4235 H HE1  . TYR Axp A    256 ? 32.225 28.277  18.531  1    25.56   ? 1337 A 1 c
ATOM 4236 H HE2  . TYR Axp A    256 ? 34.955 25.97   16.686  1    26.588  ? 1337 A 1 c
ATOM 4237 H HH   . TYR Axp A    256 ? 34.384 27.913  19.264  0    16.22   ? 1337 A 1 c
ATOM 4238 N N    . CYS Axp A    257 ? 29.221 27.556  11.93   1    30.198  ? 1338 A 1 .
ATOM 4239 C CA   . CYS Axp A    257 ? 28.604 27.155  10.678  1    32.456  ? 1338 A 1 .
ATOM 4240 C C    . CYS Axp A    257 ? 27.85  28.303  10.03   1    33.107  ? 1338 A 1 .
ATOM 4241 O O    . CYS Axp A    257 ? 26.653 28.23   9.76    1    36.899  ? 1338 A 1 .
ATOM 4242 C CB   . CYS Axp A    257 ? 27.725 25.929  10.857  1    34.572  ? 1338 A 1 .
ATOM 4243 S SG   . CYS Axp A    257 ? 27.483 25.078  9.28    1    38.217  ? 1338 A 1 .
ATOM 4244 H H    . CYS Axp A    257 ? 28.848 28.212  12.443  1    30.701  ? 1338 A 1 c
ATOM 4245 H HA   . CYS Axp A    257 ? 29.333 26.895  10.059  1    32.529  ? 1338 A 1 c
ATOM 4246 H HB3  . CYS Axp A    257 ? 26.851 26.194  11.219  1    34.697  ? 1338 A 1 c
ATOM 4247 H HB2  . CYS Axp A    257 ? 28.15  25.309  11.489  1    34.638  ? 1338 A 1 c
ATOM 4248 H HG   . CYS Axp A    257 ? 26.728 24.307  9.823   0    24.17   ? 1338 A 1 c
ATOM 4249 N N    . TRP Axp A    258 ? 28.608 29.321  9.674   1    33.593  ? 1339 A 1 .
ATOM 4250 C CA   . TRP Axp A    258 ? 28.027 30.583  9.292   1    33.31   ? 1339 A 1 .
ATOM 4251 C C    . TRP Axp A    258 ? 27.708 30.613  7.8     1    36.016  ? 1339 A 1 .
ATOM 4252 O O    . TRP Axp A    258 ? 28.553 30.228  6.988   1    36.657  ? 1339 A 1 .
ATOM 4253 C CB   . TRP Axp A    258 ? 29.01  31.691  9.655   1    31.973  ? 1339 A 1 .
ATOM 4254 C CG   . TRP Axp A    258 ? 28.357 32.99   9.379   1    31.668  ? 1339 A 1 .
ATOM 4255 C CD1  . TRP Axp A    258 ? 28.6   33.853  8.366   1    34.505  ? 1339 A 1 .
ATOM 4256 C CD2  . TRP Axp A    258 ? 27.194 33.459  10.061  1    32.095  ? 1339 A 1 .
ATOM 4257 N NE1  . TRP Axp A    258 ? 27.713 34.89   8.434   1    38.04   ? 1339 A 1 .
ATOM 4258 C CE2  . TRP Axp A    258 ? 26.826 34.668  9.45    1    34.468  ? 1339 A 1 .
ATOM 4259 C CE3  . TRP Axp A    258 ? 26.457 32.987  11.134  1    32.695  ? 1339 A 1 .
ATOM 4260 C CZ2  . TRP Axp A    258 ? 25.744 35.425  9.877   1    33.941  ? 1339 A 1 .
ATOM 4261 C CZ3  . TRP Axp A    258 ? 25.377 33.726  11.55   1    34.361  ? 1339 A 1 .
ATOM 4262 C CH2  . TRP Axp A    258 ? 25.022 34.921  10.926  1    35.055  ? 1339 A 1 .
ATOM 4263 H H    . TRP Axp A    258 ? 29.518 29.23   9.666   1    33.389  ? 1339 A 1 c
ATOM 4264 H HA   . TRP Axp A    258 ? 27.188 30.717  9.808   1    33.612  ? 1339 A 1 c
ATOM 4265 H HB3  . TRP Axp A    258 ? 29.814 31.603  9.1     1    32.204  ? 1339 A 1 c
ATOM 4266 H HB2  . TRP Axp A    258 ? 29.234 31.63   10.608  1    32.151  ? 1339 A 1 c
ATOM 4267 H HD1  . TRP Axp A    258 ? 29.314 33.797  7.751   1    34.577  ? 1339 A 1 c
ATOM 4268 H HE1  . TRP Axp A    258 ? 27.701 35.579  7.899   1    36.21   ? 1339 A 1 c
ATOM 4269 H HE3  . TRP Axp A    258 ? 26.689 32.182  11.562  1    32.878  ? 1339 A 1 c
ATOM 4270 H HZ2  . TRP Axp A    258 ? 25.501 36.226  9.446   1    34.326  ? 1339 A 1 c
ATOM 4271 H HZ3  . TRP Axp A    258 ? 24.862 33.418  12.278  1    34.106  ? 1339 A 1 c
ATOM 4272 H HH2  . TRP Axp A    258 ? 24.277 35.401  11.243  1    34.603  ? 1339 A 1 c
ATOM 4273 N N    . ASP Axp A    259 ? 26.485 31.066  7.458   1    36.78   ? 1340 A 1 .
ATOM 4274 C CA   . ASP Axp A    259 ? 26.13  31.422  6.086   1    34.196  ? 1340 A 1 .
ATOM 4275 C C    . ASP Axp A    259 ? 26.394 32.91   5.939   1    32.407  ? 1340 A 1 .
ATOM 4276 O O    . ASP Axp A    259 ? 25.769 33.705  6.623   1    31.745  ? 1340 A 1 .
ATOM 4277 C CB   . ASP Axp A    259 ? 24.683 31.123  5.689   1    32.942  ? 1340 A 1 .
ATOM 4278 C CG   . ASP Axp A    259 ? 24.363 31.254  4.196   1    33.1    ? 1340 A 1 .
ATOM 4279 O OD1  . ASP Axp A    259 ? 25.242 31.754  3.455   1    32.729  ? 1340 A 1 .
ATOM 4280 O OD2  . ASP Axp A    259 ? 23.245 30.842  3.76    1    30.43   ? 1340 A 1 .
ATOM 4281 H H    . ASP Axp A    259 ? 25.848 31.155  8.108   1    35.961  ? 1340 A 1 c
ATOM 4282 H HA   . ASP Axp A    259 ? 26.721 30.929  5.473   1    34.111  ? 1340 A 1 c
ATOM 4283 H HB3  . ASP Axp A    259 ? 24.091 31.733  6.173   1    33.353  ? 1340 A 1 c
ATOM 4284 H HB2  . ASP Axp A    259 ? 24.46  30.213  5.971   1    33.361  ? 1340 A 1 c
ATOM 4285 N N    . TYR Axp A    260 ? 27.321 33.272  5.05    1    33.174  ? 1341 A 1 .
ATOM 4286 C CA   . TYR Axp A    260 ? 27.689 34.669  4.86    1    33.179  ? 1341 A 1 .
ATOM 4287 C C    . TYR Axp A    260 ? 26.542 35.443  4.209   1    34.989  ? 1341 A 1 .
ATOM 4288 O O    . TYR Axp A    260 ? 26.442 36.654  4.409   1    32.838  ? 1341 A 1 .
ATOM 4289 C CB   . TYR Axp A    260 ? 29.001 34.781  4.08    1    31.709  ? 1341 A 1 .
ATOM 4290 C CG   . TYR Axp A    260 ? 30.221 34.838  4.987   1    31.225  ? 1341 A 1 .
ATOM 4291 C CD1  . TYR Axp A    260 ? 30.35  35.847  5.935   1    32.412  ? 1341 A 1 .
ATOM 4292 C CD2  . TYR Axp A    260 ? 31.215 33.865  4.933   1    31.661  ? 1341 A 1 .
ATOM 4293 C CE1  . TYR Axp A    260 ? 31.452 35.911  6.774   1    33.898  ? 1341 A 1 .
ATOM 4294 C CE2  . TYR Axp A    260 ? 32.319 33.908  5.774   1    32.836  ? 1341 A 1 .
ATOM 4295 C CZ   . TYR Axp A    260 ? 32.435 34.934  6.7     1    34.714  ? 1341 A 1 .
ATOM 4296 O OH   . TYR Axp A    260 ? 33.505 35.001  7.544   1    35.59   ? 1341 A 1 .
ATOM 4297 H H    . TYR Axp A    260 ? 27.735 32.633  4.545   1    32.99   ? 1341 A 1 c
ATOM 4298 H HA   . TYR Axp A    260 ? 27.839 35.061  5.758   1    33.236  ? 1341 A 1 c
ATOM 4299 H HB3  . TYR Axp A    260 ? 28.973 35.595  3.53    1    31.944  ? 1341 A 1 c
ATOM 4300 H HB2  . TYR Axp A    260 ? 29.081 34.007  3.479   1    31.941  ? 1341 A 1 c
ATOM 4301 H HD1  . TYR Axp A    260 ? 29.687 36.517  5.991   1    32.493  ? 1341 A 1 c
ATOM 4302 H HD2  . TYR Axp A    260 ? 31.142 33.163  4.306   1    31.87   ? 1341 A 1 c
ATOM 4303 H HE1  . TYR Axp A    260 ? 31.526 36.606  7.404   1    33.734  ? 1341 A 1 c
ATOM 4304 H HE2  . TYR Axp A    260 ? 32.985 33.244  5.718   1    32.983  ? 1341 A 1 c
ATOM 4305 H HH   . TYR Axp A    260 ? 33.48  35.662  8.049   0    24.91   ? 1341 A 1 c
ATOM 4306 N N    . HIS Axp A    261 ? 25.674 34.725  3.47    1    37.011  ? 1342 A 1 .
ATOM 4307 C CA   . HIS Axp A    261 ? 24.452 35.275  2.898   1    36.971  ? 1342 A 1 .
ATOM 4308 C C    . HIS Axp A    261 ? 23.652 36.017  3.964   1    34.771  ? 1342 A 1 .
ATOM 4309 O O    . HIS Axp A    261 ? 23.092 37.075  3.695   1    35.026  ? 1342 A 1 .
ATOM 4310 C CB   . HIS Axp A    261 ? 23.563 34.18   2.303   1    39.572  ? 1342 A 1 .
ATOM 4311 C CG   . HIS Axp A    261 ? 24.099 33.529  1.073   1    42.8    ? 1342 A 1 .
ATOM 4312 N ND1  . HIS Axp A    261 ? 25.423 33.589  0.704   1    46.149  ? 1342 A 1 .
ATOM 4313 C CD2  . HIS Axp A    261 ? 23.491 32.813  0.125   1    46.271  ? 1342 A 1 .
ATOM 4314 C CE1  . HIS Axp A    261 ? 25.605 32.91   -0.42   1    47.183  ? 1342 A 1 .
ATOM 4315 N NE2  . HIS Axp A    261 ? 24.445 32.426  -0.784  1    48.109  ? 1342 A 1 .
ATOM 4316 H H    . HIS Axp A    261 ? 25.864 33.846  3.309   1    36.539  ? 1342 A 1 c
ATOM 4317 H HA   . HIS Axp A    261 ? 24.7   35.918  2.189   1    37.016  ? 1342 A 1 c
ATOM 4318 H HB3  . HIS Axp A    261 ? 22.686 34.571  2.093   1    39.626  ? 1342 A 1 c
ATOM 4319 H HB2  . HIS Axp A    261 ? 23.413 33.493  2.986   1    39.508  ? 1342 A 1 c
ATOM 4320 H HD1  . HIS Axp A    261 ? 25.991 33.86   1.226   0    31.51   ? 1342 A 1 c
ATOM 4321 H HD2  . HIS Axp A    261 ? 22.582 32.587  0.092   1    45.818  ? 1342 A 1 c
ATOM 4322 H HE1  . HIS Axp A    261 ? 26.421 32.801  -0.878  1    47.111  ? 1342 A 1 c
ATOM 4323 H HE2  . HIS Axp A    261 ? 24.06  32.034  -1.495  0    33.38   ? 1342 A 1 c
ATOM 4324 N N    . ILE Axp A    262 ? 23.622 35.473  5.181   1    32.682  ? 1343 A 1 .
ATOM 4325 C CA   . ILE Axp A    262 ? 22.948 36.142  6.282   1    35.009  ? 1343 A 1 .
ATOM 4326 C C    . ILE Axp A    262 ? 23.526 37.537  6.468   1    36.413  ? 1343 A 1 .
ATOM 4327 O O    . ILE Axp A    262 ? 22.855 38.43   6.977   1    38.325  ? 1343 A 1 .
ATOM 4328 C CB   . ILE Axp A    262 ? 23.089 35.356  7.59    1    35.792  ? 1343 A 1 .
ATOM 4329 C CG1  . ILE Axp A    262 ? 22.596 33.943  7.422   1    37.773  ? 1343 A 1 .
ATOM 4330 C CG2  . ILE Axp A    262 ? 22.381 36.067  8.748   1    34.735  ? 1343 A 1 .
ATOM 4331 C CD1  . ILE Axp A    262 ? 23.177 32.971  8.428   1    39.628  ? 1343 A 1 .
ATOM 4332 H H    . ILE Axp A    262 ? 24.04  34.674  5.331   1    33.808  ? 1343 A 1 c
ATOM 4333 H HA   . ILE Axp A    262 ? 21.998 36.22   6.065   1    34.935  ? 1343 A 1 c
ATOM 4334 H HB   . ILE Axp A    262 ? 24.04  35.313  7.804   1    35.813  ? 1343 A 1 c
ATOM 4335 H HG12 . ILE Axp A    262 ? 22.812 33.63   6.522   1    37.482  ? 1343 A 1 c
ATOM 4336 H HG13 . ILE Axp A    262 ? 21.622 33.943  7.514   1    37.554  ? 1343 A 1 c
ATOM 4337 H HG21 . ILE Axp A    262 ? 22.12  35.417  9.421   1    35.11   ? 1343 A 1 c
ATOM 4338 H HG22 . ILE Axp A    262 ? 21.589 36.521  8.415   1    35.08   ? 1343 A 1 c
ATOM 4339 H HG23 . ILE Axp A    262 ? 22.982 36.719  9.147   1    35.068  ? 1343 A 1 c
ATOM 4340 H HD11 . ILE Axp A    262 ? 24.147 33.061  8.456   1    38.968  ? 1343 A 1 c
ATOM 4341 H HD12 . ILE Axp A    262 ? 22.943 32.059  8.172   1    38.988  ? 1343 A 1 c
ATOM 4342 H HD13 . ILE Axp A    262 ? 22.81  33.162  9.312   1    38.954  ? 1343 A 1 c
ATOM 4343 N N    . GLY Axp A    263 ? 24.784 37.704  6.073   1    36.385  ? 1344 A 1 .
ATOM 4344 C CA   . GLY Axp A    263 ? 25.539 38.871  6.473   1    37.828  ? 1344 A 1 .
ATOM 4345 C C    . GLY Axp A    263 ? 26.606 38.472  7.486   1    36.267  ? 1344 A 1 .
ATOM 4346 O O    . GLY Axp A    263 ? 27.243 37.435  7.325   1    34.297  ? 1344 A 1 .
ATOM 4347 H H    . GLY Axp A    263 ? 25.193 37.072  5.559   1    36.642  ? 1344 A 1 c
ATOM 4348 H HA3  . GLY Axp A    263 ? 24.935 39.543  6.867   1    37.1    ? 1344 A 1 c
ATOM 4349 H HA2  . GLY Axp A    263 ? 25.967 39.268  5.683   1    37.123  ? 1344 A 1 c
ATOM 4350 N N    . LEU Axp A    264 ? 26.792 39.311  8.509   1    34.451  ? 1345 A 1 .
ATOM 4351 C CA   . LEU Axp A    264 ? 27.831 39.081  9.49    1    33.895  ? 1345 A 1 .
ATOM 4352 C C    . LEU Axp A    264 ? 27.637 40.055  10.639  1    33.602  ? 1345 A 1 .
ATOM 4353 O O    . LEU Axp A    264 ? 28.379 41.023  10.755  1    31.138  ? 1345 A 1 .
ATOM 4354 C CB   . LEU Axp A    264 ? 29.216 39.245  8.876   1    34.934  ? 1345 A 1 .
ATOM 4355 C CG   . LEU Axp A    264 ? 30.396 39.054  9.836   1    36.916  ? 1345 A 1 .
ATOM 4356 C CD1  . LEU Axp A    264 ? 30.647 37.589  10.221  1    37.645  ? 1345 A 1 .
ATOM 4357 C CD2  . LEU Axp A    264 ? 31.645 39.674  9.227   1    37.303  ? 1345 A 1 .
ATOM 4358 H H    . LEU Axp A    264 ? 26.257 40.047  8.594   1    34.778  ? 1345 A 1 c
ATOM 4359 H HA   . LEU Axp A    264 ? 27.739 38.158  9.832   1    34.209  ? 1345 A 1 c
ATOM 4360 H HB3  . LEU Axp A    264 ? 29.275 40.147  8.484   1    35.131  ? 1345 A 1 c
ATOM 4361 H HB2  . LEU Axp A    264 ? 29.308 38.596  8.141   1    35.131  ? 1345 A 1 c
ATOM 4362 H HG   . LEU Axp A    264 ? 30.2   39.548  10.671  1    36.691  ? 1345 A 1 c
ATOM 4363 H HD11 . LEU Axp A    264 ? 29.799 37.117  10.274  1    37.38   ? 1345 A 1 c
ATOM 4364 H HD12 . LEU Axp A    264 ? 31.091 37.552  11.084  1    37.401  ? 1345 A 1 c
ATOM 4365 H HD13 . LEU Axp A    264 ? 31.209 37.168  9.551   1    37.387  ? 1345 A 1 c
ATOM 4366 H HD21 . LEU Axp A    264 ? 31.527 40.636  9.154   1    37.174  ? 1345 A 1 c
ATOM 4367 H HD22 . LEU Axp A    264 ? 31.796 39.299  8.343   1    37.185  ? 1345 A 1 c
ATOM 4368 H HD23 . LEU Axp A    264 ? 32.411 39.484  9.793   1    37.185  ? 1345 A 1 c
ATOM 4369 N N    . PRO Axp A    265 ? 26.652 39.798  11.523  1    36.13   ? 1346 A 1 .
ATOM 4370 C CA   . PRO Axp A    265 ? 26.398 40.658  12.669  1    39.398  ? 1346 A 1 .
ATOM 4371 C C    . PRO Axp A    265 ? 27.469 40.606  13.749  1    44.405  ? 1346 A 1 .
ATOM 4372 O O    . PRO Axp A    265 ? 28.373 39.779  13.702  1    43.701  ? 1346 A 1 .
ATOM 4373 C CB   . PRO Axp A    265 ? 25.112 40.098  13.261  1    40.747  ? 1346 A 1 .
ATOM 4374 C CG   . PRO Axp A    265 ? 25.078 38.651  12.796  1    38.994  ? 1346 A 1 .
ATOM 4375 C CD   . PRO Axp A    265 ? 25.74  38.643  11.455  1    37.625  ? 1346 A 1 .
ATOM 4376 H HA   . PRO Axp A    265 ? 26.265 41.582  12.371  1    39.793  ? 1346 A 1 c
ATOM 4377 H HB3  . PRO Axp A    265 ? 24.335 40.588  12.928  1    40.071  ? 1346 A 1 c
ATOM 4378 H HB2  . PRO Axp A    265 ? 25.119 40.15   14.236  1    40.203  ? 1346 A 1 c
ATOM 4379 H HG3  . PRO Axp A    265 ? 24.156 38.331  12.724  1    39.057  ? 1346 A 1 c
ATOM 4380 H HG2  . PRO Axp A    265 ? 25.56  38.076  13.421  1    39.049  ? 1346 A 1 c
ATOM 4381 H HD3  . PRO Axp A    265 ? 26.237 37.815  11.314  1    37.512  ? 1346 A 1 c
ATOM 4382 H HD2  . PRO Axp A    265 ? 25.09  38.758  10.735  1    37.562  ? 1346 A 1 c
ATOM 4383 N N    . ALA Axp A    266 ? 27.283 41.452  14.767  1    53.554  ? 1347 A 1 .
ATOM 4384 C CA   . ALA Axp A    266 ? 28.151 41.507  15.938  1    57.313  ? 1347 A 1 .
ATOM 4385 C C    . ALA Axp A    266 ? 28.2   40.172  16.691  1    55.001  ? 1347 A 1 .
ATOM 4386 O O    . ALA Axp A    266 ? 29.157 39.925  17.429  1    54.553  ? 1347 A 1 .
ATOM 4387 C CB   . ALA Axp A    266 ? 27.703 42.635  16.859  1    57.222  ? 1347 A 1 .
ATOM 4388 H H    . ALA Axp A    266 ? 26.576 42.03   14.728  1    51.865  ? 1347 A 1 c
ATOM 4389 H HA   . ALA Axp A    266 ? 29.075 41.707  15.619  1    56.118  ? 1347 A 1 c
ATOM 4390 H HB3  . ALA Axp A    266 ? 28.243 42.631  17.667  1    57.236  ? 1347 A 1 c
ATOM 4391 H HB2  . ALA Axp A    266 ? 26.769 42.512  17.096  1    57.246  ? 1347 A 1 c
ATOM 4392 H HB1  . ALA Axp A    266 ? 27.81  43.489  16.406  1    57.246  ? 1347 A 1 c
ATOM 4393 N N    . ASP Axp A    267 ? 27.172 39.325  16.53   1    51.778  ? 1348 A 1 .
ATOM 4394 C CA   . ASP Axp A    267 ? 27.17  38.021  17.176  1    49.302  ? 1348 A 1 .
ATOM 4395 C C    . ASP Axp A    267 ? 28.242 37.121  16.567  1    45.979  ? 1348 A 1 .
ATOM 4396 O O    . ASP Axp A    267 ? 28.764 36.26   17.259  1    48.569  ? 1348 A 1 .
ATOM 4397 C CB   . ASP Axp A    267 ? 25.806 37.353  17.144  1    50.654  ? 1348 A 1 .
ATOM 4398 C CG   . ASP Axp A    267 ? 24.753 37.98   18.045  1    56.145  ? 1348 A 1 .
ATOM 4399 O OD1  . ASP Axp A    267 ? 25.019 39.079  18.573  1    64.856  ? 1348 A 1 .
ATOM 4400 O OD2  . ASP Axp A    267 ? 23.679 37.361  18.221  1    54.657  ? 1348 A 1 .
ATOM 4401 H H    . ASP Axp A    267 ? 26.45  39.57   16.027  1    51.831  ? 1348 A 1 c
ATOM 4402 H HA   . ASP Axp A    267 ? 27.393 38.155  18.125  1    49.543  ? 1348 A 1 c
ATOM 4403 H HB3  . ASP Axp A    267 ? 25.901 36.409  17.389  1    51.491  ? 1348 A 1 c
ATOM 4404 H HB2  . ASP Axp A    267 ? 25.484 37.398  16.221  1    51.424  ? 1348 A 1 c
ATOM 4405 N N    . ILE Axp A    268 ? 28.585 37.309  15.289  1    43.379  ? 1349 A 1 .
ATOM 4406 C CA   . ILE Axp A    268 ? 29.491 36.394  14.612  1    40.491  ? 1349 A 1 .
ATOM 4407 C C    . ILE Axp A    268 ? 30.889 37.015  14.578  1    40.254  ? 1349 A 1 .
ATOM 4408 O O    . ILE Axp A    268 ? 31.232 37.777  13.67   1    35.356  ? 1349 A 1 .
ATOM 4409 C CB   . ILE Axp A    268 ? 28.949 36.034  13.218  1    39.975  ? 1349 A 1 .
ATOM 4410 C CG1  . ILE Axp A    268 ? 27.463 35.711  13.255  1    37.702  ? 1349 A 1 .
ATOM 4411 C CG2  . ILE Axp A    268 ? 29.734 34.88   12.61   1    43.157  ? 1349 A 1 .
ATOM 4412 C CD1  . ILE Axp A    268 ? 27.084 34.631  14.247  1    35.854  ? 1349 A 1 .
ATOM 4413 H H    . ILE Axp A    268 ? 28.243 38.017  14.823  1    43.386  ? 1349 A 1 c
ATOM 4414 H HA   . ILE Axp A    268 ? 29.537 35.57   15.133  1    40.906  ? 1349 A 1 c
ATOM 4415 H HB   . ILE Axp A    268 ? 29.068 36.814  12.641  1    40.176  ? 1349 A 1 c
ATOM 4416 H HG12 . ILE Axp A    268 ? 27.187 35.429  12.361  1    37.739  ? 1349 A 1 c
ATOM 4417 H HG13 . ILE Axp A    268 ? 26.97  36.526  13.474  1    37.836  ? 1349 A 1 c
ATOM 4418 H HG21 . ILE Axp A    268 ? 29.299 34.584  11.793  1    42.127  ? 1349 A 1 c
ATOM 4419 H HG22 . ILE Axp A    268 ? 29.77  34.141  13.241  1    42.113  ? 1349 A 1 c
ATOM 4420 H HG23 . ILE Axp A    268 ? 30.637 35.174  12.407  1    42.084  ? 1349 A 1 c
ATOM 4421 H HD11 . ILE Axp A    268 ? 27.603 33.824  14.071  1    36.434  ? 1349 A 1 c
ATOM 4422 H HD12 . ILE Axp A    268 ? 26.134 34.428  14.153  1    36.414  ? 1349 A 1 c
ATOM 4423 H HD13 . ILE Axp A    268 ? 27.258 34.935  15.157  1    36.515  ? 1349 A 1 c
ATOM 4424 N N    . LYS Axp A    269 ? 31.686 36.638  15.589  1    40.174  ? 1350 A 1 .
ATOM 4425 C CA   . LYS Axp A    269 ? 32.904 37.338  15.949  1    37.285  ? 1350 A 1 .
ATOM 4426 C C    . LYS Axp A    269 ? 34.106 36.741  15.238  1    33.046  ? 1350 A 1 .
ATOM 4427 O O    . LYS Axp A    269 ? 35.088 37.438  15.035  1    35.658  ? 1350 A 1 .
ATOM 4428 C CB   . LYS Axp A    269 ? 33.184 37.208  17.445  1    39.344  ? 1350 A 1 .
ATOM 4429 C CG   . LYS Axp A    269 ? 32.211 37.902  18.382  1    43.816  ? 1350 A 1 .
ATOM 4430 C CD   . LYS Axp A    269 ? 32.288 39.425  18.446  1    48.111  ? 1350 A 1 .
ATOM 4431 C CE   . LYS Axp A    269 ? 32.072 39.936  19.846  1    52.32   ? 1350 A 1 .
ATOM 4432 N NZ   . LYS Axp A    269 ? 31.055 40.986  19.879  1    56.833  ? 1350 A 1 .
ATOM 4433 H H    . LYS Axp A    269 ? 31.449 35.905  16.082  1    39.414  ? 1350 A 1 c
ATOM 4434 H HA   . LYS Axp A    269 ? 32.814 38.293  15.701  1    37.368  ? 1350 A 1 c
ATOM 4435 H HB3  . LYS Axp A    269 ? 34.081 37.564  17.622  1    39.81   ? 1350 A 1 c
ATOM 4436 H HB2  . LYS Axp A    269 ? 33.198 36.256  17.672  1    39.655  ? 1350 A 1 c
ATOM 4437 H HG3  . LYS Axp A    269 ? 32.361 37.547  19.283  1    43.507  ? 1350 A 1 c
ATOM 4438 H HG2  . LYS Axp A    269 ? 31.302 37.648  18.116  1    43.527  ? 1350 A 1 c
ATOM 4439 H HD3  . LYS Axp A    269 ? 31.609 39.81   17.852  1    48.184  ? 1350 A 1 c
ATOM 4440 H HD2  . LYS Axp A    269 ? 33.171 39.717  18.13   1    47.997  ? 1350 A 1 c
ATOM 4441 H HE3  . LYS Axp A    269 ? 32.909 40.295  20.192  1    52.326  ? 1350 A 1 c
ATOM 4442 H HE2  . LYS Axp A    269 ? 31.79  39.211  20.432  1    52.227  ? 1350 A 1 c
ATOM 4443 H HZ1  . LYS Axp A    269 ? 30.256 40.648  19.621  1    55.329  ? 1350 A 1 c
ATOM 4444 H HZ2  . LYS Axp A    269 ? 31.29  41.658  19.318  1    55.296  ? 1350 A 1 c
ATOM 4445 H HZ3  . LYS Axp A    269 ? 30.981 41.314  20.72   1    55.369  ? 1350 A 1 c
ATOM 4446 N N    . LEU Axp A    270 ? 34.032 35.449  14.915  1    30.446  ? 1351 A 1 .
ATOM 4447 C CA   . LEU Axp A    270 ? 35.127 34.753  14.264  1    29.5    ? 1351 A 1 .
ATOM 4448 C C    . LEU Axp A    270 ? 34.603 33.467  13.639  1    29.431  ? 1351 A 1 .
ATOM 4449 O O    . LEU Axp A    270 ? 34.36  32.497  14.334  1    31.432  ? 1351 A 1 .
ATOM 4450 C CB   . LEU Axp A    270 ? 36.199 34.462  15.307  1    28.019  ? 1351 A 1 .
ATOM 4451 C CG   . LEU Axp A    270 ? 37.423 33.688  14.811  1    27.425  ? 1351 A 1 .
ATOM 4452 C CD1  . LEU Axp A    270 ? 38.415 34.525  14.03   1    26.964  ? 1351 A 1 .
ATOM 4453 C CD2  . LEU Axp A    270 ? 38.083 33.048  16.007  1    28.754  ? 1351 A 1 .
ATOM 4454 H H    . LEU Axp A    270 ? 33.275 34.979  15.116  1    30.981  ? 1351 A 1 c
ATOM 4455 H HA   . LEU Axp A    270 ? 35.502 35.335  13.555  1    29.436  ? 1351 A 1 c
ATOM 4456 H HB3  . LEU Axp A    270 ? 35.78  33.951  16.037  1    28.251  ? 1351 A 1 c
ATOM 4457 H HB2  . LEU Axp A    270 ? 36.505 35.319  15.683  1    28.267  ? 1351 A 1 c
ATOM 4458 H HG   . LEU Axp A    270 ? 37.109 32.96   14.216  1    27.7    ? 1351 A 1 c
ATOM 4459 H HD11 . LEU Axp A    270 ? 38.297 34.364  13.079  1    27.15   ? 1351 A 1 c
ATOM 4460 H HD12 . LEU Axp A    270 ? 39.321 34.285  14.289  1    27.166  ? 1351 A 1 c
ATOM 4461 H HD13 . LEU Axp A    270 ? 38.266 35.467  14.217  1    27.134  ? 1351 A 1 c
ATOM 4462 H HD21 . LEU Axp A    270 ? 37.406 32.74   16.624  1    28.424  ? 1351 A 1 c
ATOM 4463 H HD22 . LEU Axp A    270 ? 38.652 33.698  16.452  1    28.361  ? 1351 A 1 c
ATOM 4464 H HD23 . LEU Axp A    270 ? 38.622 32.293  15.716  1    28.368  ? 1351 A 1 c
ATOM 4465 N N    . VAL Axp A    271 ? 34.447 33.463  12.322  1    28.907  ? 1352 A 1 .
ATOM 4466 C CA   . VAL Axp A    271 ? 33.789 32.366  11.651  1    29.193  ? 1352 A 1 .
ATOM 4467 C C    . VAL Axp A    271 ? 34.771 31.218  11.536  1    28.137  ? 1352 A 1 .
ATOM 4468 O O    . VAL Axp A    271 ? 35.799 31.355  10.89   1    27.924  ? 1352 A 1 .
ATOM 4469 C CB   . VAL Axp A    271 ? 33.313 32.785  10.252  1    32.971  ? 1352 A 1 .
ATOM 4470 C CG1  . VAL Axp A    271 ? 32.607 31.636  9.537   1    33.794  ? 1352 A 1 .
ATOM 4471 C CG2  . VAL Axp A    271 ? 32.45  34.042  10.308  1    33.764  ? 1352 A 1 .
ATOM 4472 H H    . VAL Axp A    271 ? 34.77  34.159  11.824  1    29.18   ? 1352 A 1 c
ATOM 4473 H HA   . VAL Axp A    271 ? 33.018 32.085  12.18   1    29.577  ? 1352 A 1 c
ATOM 4474 H HB   . VAL Axp A    271 ? 34.119 33.006  9.728   1    32.475  ? 1352 A 1 c
ATOM 4475 H HG11 . VAL Axp A    271 ? 32.006 31.188  10.157  1    33.541  ? 1352 A 1 c
ATOM 4476 H HG12 . VAL Axp A    271 ? 33.266 31.001  9.211   1    33.518  ? 1352 A 1 c
ATOM 4477 H HG13 . VAL Axp A    271 ? 32.096 31.984  8.787   1    33.535  ? 1352 A 1 c
ATOM 4478 H HG21 . VAL Axp A    271 ? 31.937 34.123  9.487   1    33.546  ? 1352 A 1 c
ATOM 4479 H HG22 . VAL Axp A    271 ? 33.019 34.823  10.413  1    33.492  ? 1352 A 1 c
ATOM 4480 H HG23 . VAL Axp A    271 ? 31.843 33.981  11.063  1    33.597  ? 1352 A 1 c
ATOM 4481 N N    . LYS Axp A    272 ? 34.387 30.078  12.096  1    29.203  ? 1353 A 1 .
ATOM 4482 C CA   . LYS Axp A    272 ? 35.209 28.883  12.07   1    30.546  ? 1353 A 1 .
ATOM 4483 C C    . LYS Axp A    272 ? 35.034 28.176  10.736  1    30.536  ? 1353 A 1 .
ATOM 4484 O O    . LYS Axp A    272 ? 36.01  27.735  10.152  1    32.864  ? 1353 A 1 .
ATOM 4485 C CB   . LYS Axp A    272 ? 34.854 27.908  13.199  1    31.128  ? 1353 A 1 .
ATOM 4486 C CG   . LYS Axp A    272 ? 35.239 28.402  14.586  1    32.191  ? 1353 A 1 .
ATOM 4487 C CD   . LYS Axp A    272 ? 34.327 29.436  15.252  1    31.882  ? 1353 A 1 .
ATOM 4488 C CE   . LYS Axp A    272 ? 34.928 30.135  16.448  1    31.541  ? 1353 A 1 .
ATOM 4489 N NZ   . LYS Axp A    272 ? 36.344 30.47   16.242  1    31.453  ? 1353 A 1 .
ATOM 4490 H H    . LYS Axp A    272 ? 33.568 30.034  12.499  1    29.267  ? 1353 A 1 c
ATOM 4491 H HA   . LYS Axp A    272 ? 36.159 29.151  12.166  1    30.377  ? 1353 A 1 c
ATOM 4492 H HB3  . LYS Axp A    272 ? 35.307 27.053  13.035  1    31.223  ? 1353 A 1 c
ATOM 4493 H HB2  . LYS Axp A    272 ? 33.89  27.743  13.182  1    31.194  ? 1353 A 1 c
ATOM 4494 H HG3  . LYS Axp A    272 ? 36.137 28.786  14.517  1    31.821  ? 1353 A 1 c
ATOM 4495 H HG2  . LYS Axp A    272 ? 35.312 27.625  15.174  1    31.766  ? 1353 A 1 c
ATOM 4496 H HD3  . LYS Axp A    272 ? 33.501 28.988  15.531  1    31.743  ? 1353 A 1 c
ATOM 4497 H HD2  . LYS Axp A    272 ? 34.079 30.11   14.587  1    31.809  ? 1353 A 1 c
ATOM 4498 H HE3  . LYS Axp A    272 ? 34.851 29.568  17.235  1    31.509  ? 1353 A 1 c
ATOM 4499 H HE2  . LYS Axp A    272 ? 34.434 30.956  16.621  1    31.58   ? 1353 A 1 c
ATOM 4500 H HZ1  . LYS Axp A    272 ? 36.453 30.896  15.451  1    31.44   ? 1353 A 1 c
ATOM 4501 H HZ2  . LYS Axp A    272 ? 36.853 29.721  16.261  1    31.469  ? 1353 A 1 c
ATOM 4502 H HZ3  . LYS Axp A    272 ? 36.61  31.005  16.919  1    31.429  ? 1353 A 1 c
ATOM 4503 N N    . MET Axp A    273 ? 33.788 28.068  10.272  1    30.611  ? 1354 A 1 .
ATOM 4504 C CA   . MET Axp A    273 ? 33.506 27.434  9.003   1    31.604  ? 1354 A 1 .
ATOM 4505 C C    . MET Axp A    273 ? 32.3   28.112  8.378   1    31.316  ? 1354 A 1 .
ATOM 4506 O O    . MET Axp A    273 ? 31.341 28.407  9.074   1    31.062  ? 1354 A 1 .
ATOM 4507 C CB   . MET Axp A    273 ? 33.181 25.956  9.196   1    34.198  ? 1354 A 1 .
ATOM 4508 C CG   . MET Axp A    273 ? 33.107 25.182  7.902   1    37.905  ? 1354 A 1 .
ATOM 4509 S SD   . MET Axp A    273 ? 32.414 23.527  8.071   1    42.806  ? 1354 A 1 .
ATOM 4510 C CE   . MET Axp A    273 ? 32.803 23.205  9.793   1    45.929  ? 1354 A 1 .
ATOM 4511 H H    . MET Axp A    273 ? 33.092 28.392  10.768  1    30.805  ? 1354 A 1 c
ATOM 4512 H HA   . MET Axp A    273 ? 34.289 27.536  8.407   1    31.867  ? 1354 A 1 c
ATOM 4513 H HB3  . MET Axp A    273 ? 32.321 25.884  9.661   1    34.516  ? 1354 A 1 c
ATOM 4514 H HB2  . MET Axp A    273 ? 33.87  25.56   9.77    1    34.534  ? 1354 A 1 c
ATOM 4515 H HG3  . MET Axp A    273 ? 34.003 25.097  7.536   1    37.744  ? 1354 A 1 c
ATOM 4516 H HG2  . MET Axp A    273 ? 32.568 25.68   7.256   1    37.761  ? 1354 A 1 c
ATOM 4517 H HE3  . MET Axp A    273 ? 32.257 23.775  10.365  1    44.804  ? 1354 A 1 c
ATOM 4518 H HE2  . MET Axp A    273 ? 33.747 23.387  9.953   1    44.734  ? 1354 A 1 c
ATOM 4519 H HE1  . MET Axp A    273 ? 32.617 22.272  9.998   1    44.877  ? 1354 A 1 c
ATOM 4520 N N    . SER Axp A    274 ? 32.373 28.331  7.064   1    32.829  ? 1355 A 1 .
ATOM 4521 C CA   . SER Axp A    274 ? 31.32  28.994  6.318   1    34.889  ? 1355 A 1 .
ATOM 4522 C C    . SER Axp A    274 ? 30.7   27.972  5.379   1    37.425  ? 1355 A 1 .
ATOM 4523 O O    . SER Axp A    274 ? 31.373 27      5.031   1    35.093  ? 1355 A 1 .
ATOM 4524 C CB   . SER Axp A    274 ? 31.836 30.2    5.537   1    35.299  ? 1355 A 1 .
ATOM 4525 O OG   . SER Axp A    274 ? 32.658 29.843  4.424   1    32.036  ? 1355 A 1 .
ATOM 4526 H H    . SER Axp A    274 ? 33.115 28.052  6.61    1    32.895  ? 1355 A 1 c
ATOM 4527 H HA   . SER Axp A    274 ? 30.628 29.299  6.953   1    34.994  ? 1355 A 1 c
ATOM 4528 H HB3  . SER Axp A    274 ? 32.349 30.77   6.141   1    34.401  ? 1355 A 1 c
ATOM 4529 H HB2  . SER Axp A    274 ? 31.074 30.719  5.217   1    34.401  ? 1355 A 1 c
ATOM 4530 H HG   . SER Axp A    274 ? 32.979 30.559  4.156   0    29.62   ? 1355 A 1 c
ATOM 4531 N N    . TRP Axp A    275 ? 29.442 28.223  4.971   1    40.868  ? 1356 A 1 .
ATOM 4532 C CA   . TRP Axp A    275 ? 28.8   27.454  3.917   1    41.66   ? 1356 A 1 .
ATOM 4533 C C    . TRP Axp A    275 ? 29.481 27.803  2.602   1    45.37   ? 1356 A 1 .
ATOM 4534 O O    . TRP Axp A    275 ? 30.146 28.83   2.498   1    45.348  ? 1356 A 1 .
ATOM 4535 C CB   . TRP Axp A    275 ? 27.307 27.773  3.786   1    41.386  ? 1356 A 1 .
ATOM 4536 C CG   . TRP Axp A    275 ? 26.461 27.637  5.02    1    42.796  ? 1356 A 1 .
ATOM 4537 C CD1  . TRP Axp A    275 ? 26.848 27.569  6.324   1    44.582  ? 1356 A 1 .
ATOM 4538 C CD2  . TRP Axp A    275 ? 25.017 27.64   5.039   1    43.247  ? 1356 A 1 .
ATOM 4539 N NE1  . TRP Axp A    275 ? 25.755 27.496  7.147   1    45.216  ? 1356 A 1 .
ATOM 4540 C CE2  . TRP Axp A    275 ? 24.618 27.546  6.388   1    43.348  ? 1356 A 1 .
ATOM 4541 C CE3  . TRP Axp A    275 ? 24.031 27.71   4.052   1    42.929  ? 1356 A 1 .
ATOM 4542 C CZ2  . TRP Axp A    275 ? 23.282 27.521  6.773   1    41.747  ? 1356 A 1 .
ATOM 4543 C CZ3  . TRP Axp A    275 ? 22.709 27.693  4.437   1    42.966  ? 1356 A 1 .
ATOM 4544 C CH2  . TRP Axp A    275 ? 22.341 27.609  5.777   1    40.888  ? 1356 A 1 .
ATOM 4545 H H    . TRP Axp A    275 ? 28.983 28.917  5.35    1    40.189  ? 1356 A 1 c
ATOM 4546 H HA   . TRP Axp A    275 ? 28.913 26.484  4.103   1    42.068  ? 1356 A 1 c
ATOM 4547 H HB3  . TRP Axp A    275 ? 26.933 27.192  3.089   1    41.775  ? 1356 A 1 c
ATOM 4548 H HB2  . TRP Axp A    275 ? 27.221 28.691  3.452   1    41.79   ? 1356 A 1 c
ATOM 4549 H HD1  . TRP Axp A    275 ? 27.739 27.547  6.63    1    44.22   ? 1356 A 1 c
ATOM 4550 H HE1  . TRP Axp A    275 ? 25.781 27.434  8.017   1    44.578  ? 1356 A 1 c
ATOM 4551 H HE3  . TRP Axp A    275 ? 24.267 27.774  3.143   1    42.993  ? 1356 A 1 c
ATOM 4552 H HZ2  . TRP Axp A    275 ? 23.034 27.467  7.68    1    41.938  ? 1356 A 1 c
ATOM 4553 H HZ3  . TRP Axp A    275 ? 22.037 27.741  3.778   1    42.471  ? 1356 A 1 c
ATOM 4554 H HH2  . TRP Axp A    275 ? 21.428 27.59   6.004   1    41.602  ? 1356 A 1 c
ATOM 4555 N N    . GLN Axp A    276 ? 29.275 26.978  1.579   1    50.082  ? 1357 A 1 .
ATOM 4556 C CA   . GLN Axp A    276 ? 29.849 27.283  0.283   1    58.329  ? 1357 A 1 .
ATOM 4557 C C    . GLN Axp A    276 ? 28.904 28.2    -0.495  1    65.881  ? 1357 A 1 .
ATOM 4558 O O    . GLN Axp A    276 ? 27.742 28.388  -0.129  1    58.047  ? 1357 A 1 .
ATOM 4559 C CB   . GLN Axp A    276 ? 30.221 26.001  -0.464  1    62.005  ? 1357 A 1 .
ATOM 4560 C CG   . GLN Axp A    276 ? 31.667 25.561  -0.256  1    66.752  ? 1357 A 1 .
ATOM 4561 C CD   . GLN Axp A    276 ? 32.661 26.349  -1.084  1    72.899  ? 1357 A 1 .
ATOM 4562 O OE1  . GLN Axp A    276 ? 32.664 27.585  -1.08   1    83.133  ? 1357 A 1 .
ATOM 4563 N NE2  . GLN Axp A    276 ? 33.508 25.639  -1.816  1    73.62   ? 1357 A 1 .
ATOM 4564 H H    . GLN Axp A    276 ? 28.771 26.223  1.686   1    50.64   ? 1357 A 1 c
ATOM 4565 H HA   . GLN Axp A    276 ? 30.689 27.782  0.436   1    58.596  ? 1357 A 1 c
ATOM 4566 H HB3  . GLN Axp A    276 ? 30.068 26.141  -1.422  1    62.273  ? 1357 A 1 c
ATOM 4567 H HB2  . GLN Axp A    276 ? 29.625 25.281  -0.173  1    61.86   ? 1357 A 1 c
ATOM 4568 H HG3  . GLN Axp A    276 ? 31.75  24.611  -0.484  1    67.029  ? 1357 A 1 c
ATOM 4569 H HG2  . GLN Axp A    276 ? 31.9   25.661  0.692   1    66.998  ? 1357 A 1 c
ATOM 4570 H HE21 . GLN Axp A    276 ? 33.648 25.854  -2.665  1    73.397  ? 1357 A 1 c
ATOM 4571 H HE22 . GLN Axp A    276 ? 33.934 24.949  -1.455  1    73.397  ? 1357 A 1 c
ATOM 4572 N N    . THR Axp A    277 ? 29.42  28.777  -1.59   1    81.135  ? 1358 A 1 .
ATOM 4573 C CA   . THR Axp A    277 ? 28.587 29.547  -2.513  1    87.437  ? 1358 A 1 .
ATOM 4574 C C    . THR Axp A    277 ? 28.136 28.648  -3.68   1    83.269  ? 1358 A 1 .
ATOM 4575 O O    . THR Axp A    277 ? 28.972 28.379  -4.582  1    71.28   ? 1358 A 1 .
ATOM 4576 C CB   . THR Axp A    277 ? 29.342 30.811  -2.947  1    86.437  ? 1358 A 1 .
ATOM 4577 O OG1  . THR Axp A    277 ? 29.432 31.664  -1.806  1    80.351  ? 1358 A 1 .
ATOM 4578 C CG2  . THR Axp A    277 ? 28.622 31.591  -4.035  1    86.618  ? 1358 A 1 .
ATOM 4579 O OXT  . THR Axp A    277 ? 26.944 28.221  -3.661  1    73.642  ? 1358 A 1 .
ATOM 4580 H H    . THR Axp A    277 ? 30.313 28.689  -1.768  1    78.328  ? 1358 A 1 c
ATOM 4581 H HA   . THR Axp A    277 ? 27.785 29.834  -2.026  1    84.822  ? 1358 A 1 c
ATOM 4582 H HB   . THR Axp A    277 ? 30.249 30.574  -3.254  1    85.416  ? 1358 A 1 c
ATOM 4583 H HG1  . THR Axp A    277 ? 28.875 31.961  -1.762  0    49.76   ? 1358 A 1 c
ATOM 4584 H HG21 . THR Axp A    277 ? 28.911 32.519  -4.014  1    86.516  ? 1358 A 1 c
ATOM 4585 H HG22 . THR Axp A    277 ? 27.663 31.548  -3.886  1    86.541  ? 1358 A 1 c
ATOM 4586 H HG23 . THR Axp A    277 ? 28.832 31.207  -4.903  1    86.537  ? 1358 A 1 c
ATOM 4587 N N    . LYS Bxp B    1   ? 56.931 -0.88   32.632  1    84.558  ? 2082 B 1 .
ATOM 4588 C CA   . LYS Bxp B    1   ? 58.356 -1.05   32.243  1    82.092  ? 2082 B 1 .
ATOM 4589 C C    . LYS Bxp B    1   ? 58.542 -2.445  31.667  1    76.345  ? 2082 B 1 .
ATOM 4590 O O    . LYS Bxp B    1   ? 58.584 -3.414  32.42   1    77.692  ? 2082 B 1 .
ATOM 4591 C CB   . LYS Bxp B    1   ? 59.267 -0.891  33.465  1    86.834  ? 2082 B 1 .
ATOM 4592 C CG   . LYS Bxp B    1   ? 60.726 -1.305  33.261  1    90.878  ? 2082 B 1 .
ATOM 4593 C CD   . LYS Bxp B    1   ? 61.545 -1.342  34.553  1    91.387  ? 2082 B 1 .
ATOM 4594 C CE   . LYS Bxp B    1   ? 62.747 -2.262  34.545  1    86.367  ? 2082 B 1 .
ATOM 4595 N NZ   . LYS Bxp B    1   ? 63.908 -1.754  33.804  1    85.366  ? 2082 B 1 .
ATOM 4596 H H    . LYS Bxp B    1   ? 56.804 -0.057  32.98   1    83.775  ? 2082 B 1 c
ATOM 4597 H H2   . LYS Bxp B    1   ? 56.703 -1.497  33.25   1    83.756  ? 2082 B 1 c
ATOM 4598 H H3   . LYS Bxp B    1   ? 56.4   -0.977  31.91   1    83.742  ? 2082 B 1 c
ATOM 4599 H HA   . LYS Bxp B    1   ? 58.585 -0.372  31.558  1    82.125  ? 2082 B 1 c
ATOM 4600 H HB3  . LYS Bxp B    1   ? 58.896 -1.425  34.2    1    86.583  ? 2082 B 1 c
ATOM 4601 H HB2  . LYS Bxp B    1   ? 59.25  0.049   33.745  1    86.619  ? 2082 B 1 c
ATOM 4602 H HG3  . LYS Bxp B    1   ? 61.144 -0.672  32.637  1    90.02   ? 2082 B 1 c
ATOM 4603 H HG2  . LYS Bxp B    1   ? 60.75  -2.193  32.846  1    89.876  ? 2082 B 1 c
ATOM 4604 H HD3  . LYS Bxp B    1   ? 60.952 -1.611  35.287  1    90.05   ? 2082 B 1 c
ATOM 4605 H HD2  . LYS Bxp B    1   ? 61.851 -0.43   34.749  1    90.084  ? 2082 B 1 c
ATOM 4606 H HE3  . LYS Bxp B    1   ? 62.485 -3.116  34.158  1    87.259  ? 2082 B 1 c
ATOM 4607 H HE2  . LYS Bxp B    1   ? 63.018 -2.428  35.465  1    87.246  ? 2082 B 1 c
ATOM 4608 H HZ1  . LYS Bxp B    1   ? 64.148 -0.943  34.129  1    85.673  ? 2082 B 1 c
ATOM 4609 H HZ2  . LYS Bxp B    1   ? 63.7   -1.674  32.926  1    85.673  ? 2082 B 1 c
ATOM 4610 H HZ3  . LYS Bxp B    1   ? 64.604 -2.328  33.895  1    85.673  ? 2082 B 1 c
ATOM 4611 N N    . LEU Bxp B    2   ? 58.683 -2.528  30.34   1    70.482  ? 2083 B 1 .
ATOM 4612 C CA   . LEU Bxp B    2   ? 58.617 -3.797  29.624  1    63.515  ? 2083 B 1 .
ATOM 4613 C C    . LEU Bxp B    2   ? 59.962 -4.52   29.658  1    57.864  ? 2083 B 1 .
ATOM 4614 O O    . LEU Bxp B    2   ? 60.942 -4.056  29.086  1    48.435  ? 2083 B 1 .
ATOM 4615 C CB   . LEU Bxp B    2   ? 58.181 -3.563  28.181  1    62.156  ? 2083 B 1 .
ATOM 4616 C CG   . LEU Bxp B    2   ? 58.211 -4.792  27.267  1    61.046  ? 2083 B 1 .
ATOM 4617 C CD1  . LEU Bxp B    2   ? 56.988 -5.657  27.501  1    58.996  ? 2083 B 1 .
ATOM 4618 C CD2  . LEU Bxp B    2   ? 58.332 -4.387  25.808  1    59.752  ? 2083 B 1 .
ATOM 4619 H H    . LEU Bxp B    2   ? 58.83  -1.763  29.86   1    70.222  ? 2083 B 1 c
ATOM 4620 H HA   . LEU Bxp B    2   ? 57.941 -4.367  30.072  1    63.545  ? 2083 B 1 c
ATOM 4621 H HB3  . LEU Bxp B    2   ? 58.764 -2.871  27.792  1    62.176  ? 2083 B 1 c
ATOM 4622 H HB2  . LEU Bxp B    2   ? 57.263 -3.212  28.194  1    61.925  ? 2083 B 1 c
ATOM 4623 H HG   . LEU Bxp B    2   ? 59.01  -5.331  27.495  1    60.598  ? 2083 B 1 c
ATOM 4624 H HD11 . LEU Bxp B    2   ? 56.957 -5.93   28.434  1    59.599  ? 2083 B 1 c
ATOM 4625 H HD12 . LEU Bxp B    2   ? 57.035 -6.446  26.935  1    59.599  ? 2083 B 1 c
ATOM 4626 H HD13 . LEU Bxp B    2   ? 56.186 -5.152  27.286  1    59.611  ? 2083 B 1 c
ATOM 4627 H HD21 . LEU Bxp B    2   ? 59.136 -3.856  25.684  1    60.088  ? 2083 B 1 c
ATOM 4628 H HD22 . LEU Bxp B    2   ? 57.555 -3.862  25.551  1    60.01   ? 2083 B 1 c
ATOM 4629 H HD23 . LEU Bxp B    2   ? 58.382 -5.183  25.253  1    59.959  ? 2083 B 1 c
ATOM 4630 N N    . LYS Bxp B    3   ? 59.972 -5.706  30.271  1    59.832  ? 2084 B 1 .
ATOM 4631 C CA   . LYS Bxp B    3   ? 61.175 -6.512  30.392  1    57.594  ? 2084 B 1 .
ATOM 4632 C C    . LYS Bxp B    3   ? 61.253 -7.46   29.199  1    52.84   ? 2084 B 1 .
ATOM 4633 O O    . LYS Bxp B    3   ? 60.253 -8.051  28.814  1    50.409  ? 2084 B 1 .
ATOM 4634 C CB   . LYS Bxp B    3   ? 61.197 -7.324  31.696  1    61.505  ? 2084 B 1 .
ATOM 4635 C CG   . LYS Bxp B    3   ? 61.973 -6.752  32.885  1    67.378  ? 2084 B 1 .
ATOM 4636 C CD   . LYS Bxp B    3   ? 63.022 -7.715  33.452  1    79.454  ? 2084 B 1 .
ATOM 4637 C CE   . LYS Bxp B    3   ? 64.275 -7.867  32.583  1    86.071  ? 2084 B 1 .
ATOM 4638 N NZ   . LYS Bxp B    3   ? 65.157 -9.003  32.883  1    81.516  ? 2084 B 1 .
ATOM 4639 H H    . LYS Bxp B    3   ? 59.194 -6.028  30.626  1    58.943  ? 2084 B 1 c
ATOM 4640 H HA   . LYS Bxp B    3   ? 61.961 -5.91   30.375  1    57.726  ? 2084 B 1 c
ATOM 4641 H HB3  . LYS Bxp B    3   ? 61.568 -8.21   31.494  1    61.942  ? 2084 B 1 c
ATOM 4642 H HB2  . LYS Bxp B    3   ? 60.27  -7.46   31.984  1    61.611  ? 2084 B 1 c
ATOM 4643 H HG3  . LYS Bxp B    3   ? 61.333 -6.522  33.594  1    68.488  ? 2084 B 1 c
ATOM 4644 H HG2  . LYS Bxp B    3   ? 62.418 -5.924  32.602  1    68.422  ? 2084 B 1 c
ATOM 4645 H HD3  . LYS Bxp B    3   ? 62.608 -8.598  33.567  1    77.809  ? 2084 B 1 c
ATOM 4646 H HD2  . LYS Bxp B    3   ? 63.291 -7.398  34.341  1    77.904  ? 2084 B 1 c
ATOM 4647 H HE3  . LYS Bxp B    3   ? 64.799 -7.05   32.66   1    83.422  ? 2084 B 1 c
ATOM 4648 H HE2  . LYS Bxp B    3   ? 63.994 -7.941  31.653  1    83.33   ? 2084 B 1 c
ATOM 4649 H HZ1  . LYS Bxp B    3   ? 64.721 -9.781  32.72   1    82.891  ? 2084 B 1 c
ATOM 4650 H HZ2  . LYS Bxp B    3   ? 65.404 -8.977  33.754  1    82.891  ? 2084 B 1 c
ATOM 4651 H HZ3  . LYS Bxp B    3   ? 65.897 -8.963  32.362  1    82.891  ? 2084 B 1 c
ATOM 4652 N N    . LEU Bxp B    4   ? 62.455 -7.626  28.638  1    51.72   ? 2085 B 1 .
ATOM 4653 C CA   . LEU Bxp B    4   ? 62.646 -8.465  27.464  1    49.481  ? 2085 B 1 .
ATOM 4654 C C    . LEU Bxp B    4   ? 62.037 -9.844  27.707  1    50.346  ? 2085 B 1 .
ATOM 4655 O O    . LEU Bxp B    4   ? 61.284 -10.392 26.89   1    46.121  ? 2085 B 1 .
ATOM 4656 C CB   . LEU Bxp B    4   ? 64.149 -8.545  27.217  1    45.555  ? 2085 B 1 .
ATOM 4657 C CG   . LEU Bxp B    4   ? 64.573 -9.185  25.895  1    42.911  ? 2085 B 1 .
ATOM 4658 C CD1  . LEU Bxp B    4   ? 63.627 -8.789  24.781  1    41.223  ? 2085 B 1 .
ATOM 4659 C CD2  . LEU Bxp B    4   ? 65.998 -8.76   25.579  1    43.969  ? 2085 B 1 .
ATOM 4660 H H    . LEU Bxp B    4   ? 63.18  -7.204  29.002  1    51.462  ? 2085 B 1 c
ATOM 4661 H HA   . LEU Bxp B    4   ? 62.197 -8.035  26.694  1    49.163  ? 2085 B 1 c
ATOM 4662 H HB3  . LEU Bxp B    4   ? 64.556 -9.056  27.954  1    45.861  ? 2085 B 1 c
ATOM 4663 H HB2  . LEU Bxp B    4   ? 64.515 -7.631  27.249  1    45.854  ? 2085 B 1 c
ATOM 4664 H HG   . LEU Bxp B    4   ? 64.549 -10.171 25.998  1    43.258  ? 2085 B 1 c
ATOM 4665 H HD11 . LEU Bxp B    4   ? 62.771 -9.23   24.905  1    41.777  ? 2085 B 1 c
ATOM 4666 H HD12 . LEU Bxp B    4   ? 64.005 -9.054  23.926  1    41.746  ? 2085 B 1 c
ATOM 4667 H HD13 . LEU Bxp B    4   ? 63.499 -7.825  24.792  1    41.809  ? 2085 B 1 c
ATOM 4668 H HD21 . LEU Bxp B    4   ? 66.571 -8.95   26.341  1    43.658  ? 2085 B 1 c
ATOM 4669 H HD22 . LEU Bxp B    4   ? 66.019 -7.807  25.39   1    43.669  ? 2085 B 1 c
ATOM 4670 H HD23 . LEU Bxp B    4   ? 66.32  -9.251  24.804  1    43.658  ? 2085 B 1 c
ATOM 4671 N N    . SER Bxp B    5   ? 62.363 -10.356 28.896  1    51.437  ? 2086 B 1 .
ATOM 4672 C CA   . SER Bxp B    5   ? 61.916 -11.644 29.388  1    48.13   ? 2086 B 1 .
ATOM 4673 C C    . SER Bxp B    5   ? 60.428 -11.617 29.699  1    43.425  ? 2086 B 1 .
ATOM 4674 O O    . SER Bxp B    5   ? 60.002 -12.209 30.68   1    44.367  ? 2086 B 1 .
ATOM 4675 C CB   . SER Bxp B    5   ? 62.711 -11.982 30.619  1    48.794  ? 2086 B 1 .
ATOM 4676 O OG   . SER Bxp B    5   ? 62.671 -10.923 31.565  1    44.147  ? 2086 B 1 .
ATOM 4677 H H    . SER Bxp B    5   ? 62.91  -9.864  29.438  1    50.346  ? 2086 B 1 c
ATOM 4678 H HA   . SER Bxp B    5   ? 62.087 -12.329 28.692  1    47.969  ? 2086 B 1 c
ATOM 4679 H HB3  . SER Bxp B    5   ? 63.636 -12.149 30.363  1    47.49   ? 2086 B 1 c
ATOM 4680 H HB2  . SER Bxp B    5   ? 62.355 -12.794 31.022  1    47.455  ? 2086 B 1 c
ATOM 4681 H HG   . SER Bxp B    5   ? 62.962 -11.35  32.309  0    42.29   ? 2086 B 1 c
ATOM 4682 N N    . ASP Bxp B    6   ? 59.668 -10.869 28.907  1    40.286  ? 2087 B 1 .
ATOM 4683 C CA   . ASP Bxp B    6   ? 58.245 -10.718 29.136  1    39.738  ? 2087 B 1 .
ATOM 4684 C C    . ASP Bxp B    6   ? 57.495 -11.049 27.869  1    36.616  ? 2087 B 1 .
ATOM 4685 O O    . ASP Bxp B    6   ? 56.31  -11.356 27.925  1    34.123  ? 2087 B 1 .
ATOM 4686 C CB   . ASP Bxp B    6   ? 57.836 -9.286  29.414  1    40.47   ? 2087 B 1 .
ATOM 4687 C CG   . ASP Bxp B    6   ? 58.034 -8.838  30.844  1    41.074  ? 2087 B 1 .
ATOM 4688 O OD1  . ASP Bxp B    6   ? 58.341 -9.71   31.682  1    43.217  ? 2087 B 1 .
ATOM 4689 O OD2  . ASP Bxp B    6   ? 57.869 -7.63   31.083  1    41.595  ? 2087 B 1 .
ATOM 4690 H H    . ASP Bxp B    6   ? 60.05  -10.42  28.212  1    40.977  ? 2087 B 1 c
ATOM 4691 H HA   . ASP Bxp B    6   ? 57.956 -11.321 29.857  1    39.447  ? 2087 B 1 c
ATOM 4692 H HB3  . ASP Bxp B    6   ? 56.882 -9.185  29.214  1    40.394  ? 2087 B 1 c
ATOM 4693 H HB2  . ASP Bxp B    6   ? 58.322 -8.684  28.816  1    40.508  ? 2087 B 1 c
ATOM 4694 N N    . TRP Bxp B    7   ? 58.187 -10.847 26.749  1    35.354  ? 2088 B 1 .
ATOM 4695 C CA   . TRP Bxp B    7   ? 57.65  -11.155 25.442  1    35.691  ? 2088 B 1 .
ATOM 4696 C C    . TRP Bxp B    7   ? 58.615 -12.059 24.693  1    35.486  ? 2088 B 1 .
ATOM 4697 O O    . TRP Bxp B    7   ? 58.181 -12.834 23.845  1    34.998  ? 2088 B 1 .
ATOM 4698 C CB   . TRP Bxp B    7   ? 57.37  -9.866  24.654  1    37.724  ? 2088 B 1 .
ATOM 4699 C CG   . TRP Bxp B    7   ? 58.596 -9.065  24.302  1    38.026  ? 2088 B 1 .
ATOM 4700 C CD1  . TRP Bxp B    7   ? 59.19  -8.066  25.016  1    37.931  ? 2088 B 1 .
ATOM 4701 C CD2  . TRP Bxp B    7   ? 59.378 -9.222  23.104  1    37.461  ? 2088 B 1 .
ATOM 4702 N NE1  . TRP Bxp B    7   ? 60.295 -7.606  24.355  1    38.531  ? 2088 B 1 .
ATOM 4703 C CE2  . TRP Bxp B    7   ? 60.435 -8.298  23.183  1    37.705  ? 2088 B 1 .
ATOM 4704 C CE3  . TRP Bxp B    7   ? 59.291 -10.07  21.997  1    37.251  ? 2088 B 1 .
ATOM 4705 C CZ2  . TRP Bxp B    7   ? 61.391 -8.195  22.183  1    38.86   ? 2088 B 1 .
ATOM 4706 C CZ3  . TRP Bxp B    7   ? 60.236 -9.965  21.008  1    36.501  ? 2088 B 1 .
ATOM 4707 C CH2  . TRP Bxp B    7   ? 61.271 -9.042  21.108  1    38.514  ? 2088 B 1 .
ATOM 4708 H H    . TRP Bxp B    7   ? 59.005 -10.444 26.797  1    35.874  ? 2088 B 1 c
ATOM 4709 H HA   . TRP Bxp B    7   ? 56.793 -11.639 25.561  1    35.953  ? 2088 B 1 c
ATOM 4710 H HB3  . TRP Bxp B    7   ? 56.767 -9.304  25.185  1    37.374  ? 2088 B 1 c
ATOM 4711 H HB2  . TRP Bxp B    7   ? 56.903 -10.107 23.826  1    37.355  ? 2088 B 1 c
ATOM 4712 H HD1  . TRP Bxp B    7   ? 58.897 -7.743  25.853  1    38.083  ? 2088 B 1 c
ATOM 4713 H HE1  . TRP Bxp B    7   ? 60.822 -6.969  24.635  1    38.19   ? 2088 B 1 c
ATOM 4714 H HE3  . TRP Bxp B    7   ? 58.592 -10.697 21.929  1    37.148  ? 2088 B 1 c
ATOM 4715 H HZ2  . TRP Bxp B    7   ? 62.095 -7.571  22.242  1    38.484  ? 2088 B 1 c
ATOM 4716 H HZ3  . TRP Bxp B    7   ? 60.186 -10.529 20.255  1    37.145  ? 2088 B 1 c
ATOM 4717 H HH2  . TRP Bxp B    7   ? 61.906 -8.992  20.418  1    38.006  ? 2088 B 1 c
ATOM 4718 N N    . PHE Bxp B    8   ? 59.912 -11.963 25.016  1    37.131  ? 2089 B 1 .
ATOM 4719 C CA   . PHE Bxp B    8   ? 60.922 -12.613 24.196  1    39.346  ? 2089 B 1 .
ATOM 4720 C C    . PHE Bxp B    8   ? 61.523 -13.823 24.904  1    39.481  ? 2089 B 1 .
ATOM 4721 O O    . PHE Bxp B    8   ? 62.233 -13.707 25.899  1    40.912  ? 2089 B 1 .
ATOM 4722 C CB   . PHE Bxp B    8   ? 62.046 -11.654 23.812  1    39.571  ? 2089 B 1 .
ATOM 4723 C CG   . PHE Bxp B    8   ? 62.939 -12.183 22.704  1    37.832  ? 2089 B 1 .
ATOM 4724 C CD1  . PHE Bxp B    8   ? 62.401 -12.644 21.511  1    38.537  ? 2089 B 1 .
ATOM 4725 C CD2  . PHE Bxp B    8   ? 64.314 -12.243 22.876  1    37.771  ? 2089 B 1 .
ATOM 4726 C CE1  . PHE Bxp B    8   ? 63.226 -13.101 20.497  1    39.29   ? 2089 B 1 .
ATOM 4727 C CE2  . PHE Bxp B    8   ? 65.134 -12.709 21.864  1    37.589  ? 2089 B 1 .
ATOM 4728 C CZ   . PHE Bxp B    8   ? 64.584 -13.141 20.677  1    38.758  ? 2089 B 1 .
ATOM 4729 H H    . PHE Bxp B    8   ? 60.175 -11.492 25.753  1    37.175  ? 2089 B 1 c
ATOM 4730 H HA   . PHE Bxp B    8   ? 60.486 -12.925 23.362  1    38.936  ? 2089 B 1 c
ATOM 4731 H HB3  . PHE Bxp B    8   ? 62.594 -11.477 24.609  1    39.139  ? 2089 B 1 c
ATOM 4732 H HB2  . PHE Bxp B    8   ? 61.649 -10.804 23.523  1    39.122  ? 2089 B 1 c
ATOM 4733 H HD1  . PHE Bxp B    8   ? 61.468 -12.602 21.371  1    38.554  ? 2089 B 1 c
ATOM 4734 H HD2  . PHE Bxp B    8   ? 64.695 -11.938 23.683  1    37.783  ? 2089 B 1 c
ATOM 4735 H HE1  . PHE Bxp B    8   ? 62.854 -13.397 19.686  1    38.971  ? 2089 B 1 c
ATOM 4736 H HE2  . PHE Bxp B    8   ? 66.069 -12.739 21.991  1    37.92   ? 2089 B 1 c
ATOM 4737 H HZ   . PHE Bxp B    8   ? 65.142 -13.471 19.99   1    38.677  ? 2089 B 1 c
ATOM 4738 N N    . ASN Bxp B    9   ? 61.279 -14.995 24.324  1    40.376  ? 2090 B 1 .
ATOM 4739 C CA   . ASN Bxp B    9   ? 61.845 -16.224 24.843  1    41.261  ? 2090 B 1 .
ATOM 4740 C C    . ASN Bxp B    9   ? 62.74  -16.866 23.783  1    40.827  ? 2090 B 1 .
ATOM 4741 O O    . ASN Bxp B    9   ? 62.325 -17.76  23.054  1    37.891  ? 2090 B 1 .
ATOM 4742 C CB   . ASN Bxp B    9   ? 60.762 -17.17  25.333  1    42.749  ? 2090 B 1 .
ATOM 4743 C CG   . ASN Bxp B    9   ? 61.376 -18.435 25.869  1    43.242  ? 2090 B 1 .
ATOM 4744 O OD1  . ASN Bxp B    9   ? 62.598 -18.603 25.786  1    44.529  ? 2090 B 1 .
ATOM 4745 N ND2  . ASN Bxp B    9   ? 60.556 -19.315 26.425  1    43.739  ? 2090 B 1 .
ATOM 4746 H H    . ASN Bxp B    9   ? 60.744 -15.033 23.585  1    40.338  ? 2090 B 1 c
ATOM 4747 H HA   . ASN Bxp B    9   ? 62.398 -16.001 25.621  1    41.35   ? 2090 B 1 c
ATOM 4748 H HB3  . ASN Bxp B    9   ? 60.159 -17.388 24.594  1    42.494  ? 2090 B 1 c
ATOM 4749 H HB2  . ASN Bxp B    9   ? 60.242 -16.736 26.038  1    42.514  ? 2090 B 1 c
ATOM 4750 H HD21 . ASN Bxp B    9   ? 60.85  -19.844 27.073  1    43.584  ? 2090 B 1 c
ATOM 4751 H HD22 . ASN Bxp B    9   ? 59.716 -19.375 26.147  1    43.58   ? 2090 B 1 c
ATOM 4752 N N    . PRO Bxp B    10  ? 64.029 -16.481 23.722  1    42.711  ? 2091 B 1 .
ATOM 4753 C CA   . PRO Bxp B    10  ? 64.957 -17.065 22.759  1    43.149  ? 2091 B 1 .
ATOM 4754 C C    . PRO Bxp B    10  ? 65.031 -18.59  22.783  1    44.874  ? 2091 B 1 .
ATOM 4755 O O    . PRO Bxp B    10  ? 65.39  -19.194 21.773  1    44.718  ? 2091 B 1 .
ATOM 4756 C CB   . PRO Bxp B    10  ? 66.318 -16.475 23.134  1    44.181  ? 2091 B 1 .
ATOM 4757 C CG   . PRO Bxp B    10  ? 66.114 -15.78  24.471  1    47.351  ? 2091 B 1 .
ATOM 4758 C CD   . PRO Bxp B    10  ? 64.651 -15.485 24.61   1    45.906  ? 2091 B 1 .
ATOM 4759 H HA   . PRO Bxp B    10  ? 64.713 -16.768 21.858  1    43.561  ? 2091 B 1 c
ATOM 4760 H HB3  . PRO Bxp B    10  ? 66.615 -15.836 22.457  1    44.694  ? 2091 B 1 c
ATOM 4761 H HB2  . PRO Bxp B    10  ? 66.993 -17.178 23.21   1    44.654  ? 2091 B 1 c
ATOM 4762 H HG3  . PRO Bxp B    10  ? 66.629 -14.95  24.505  1    46.287  ? 2091 B 1 c
ATOM 4763 H HG2  . PRO Bxp B    10  ? 66.411 -16.355 25.197  1    46.285  ? 2091 B 1 c
ATOM 4764 H HD3  . PRO Bxp B    10  ? 64.357 -15.604 25.532  1    45.393  ? 2091 B 1 c
ATOM 4765 H HD2  . PRO Bxp B    10  ? 64.44  -14.578 24.317  1    45.406  ? 2091 B 1 c
ATOM 4766 N N    . PHE Bxp B    11  ? 64.686 -19.193 23.935  1    46.589  ? 2092 B 1 .
ATOM 4767 C CA   . PHE Bxp B    11  ? 64.866 -20.619 24.188  1    46.38   ? 2092 B 1 .
ATOM 4768 C C    . PHE Bxp B    11  ? 63.915 -21.461 23.337  1    45.385  ? 2092 B 1 .
ATOM 4769 O O    . PHE Bxp B    11  ? 64.063 -22.68  23.285  1    40.545  ? 2092 B 1 .
ATOM 4770 C CB   . PHE Bxp B    11  ? 64.613 -20.914 25.67   1    47.776  ? 2092 B 1 .
ATOM 4771 C CG   . PHE Bxp B    11  ? 65.386 -22.076 26.283  1    52.744  ? 2092 B 1 .
ATOM 4772 C CD1  . PHE Bxp B    11  ? 66.775 -22.153 26.189  1    56.876  ? 2092 B 1 .
ATOM 4773 C CD2  . PHE Bxp B    11  ? 64.721 -23.083 26.982  1    53.547  ? 2092 B 1 .
ATOM 4774 C CE1  . PHE Bxp B    11  ? 67.47  -23.205 26.771  1    58.044  ? 2092 B 1 .
ATOM 4775 C CE2  . PHE Bxp B    11  ? 65.418 -24.135 27.555  1    53.496  ? 2092 B 1 .
ATOM 4776 C CZ   . PHE Bxp B    11  ? 66.789 -24.196 27.448  1    57.126  ? 2092 B 1 .
ATOM 4777 H H    . PHE Bxp B    11  ? 64.33  -18.683 24.603  1    46.076  ? 2092 B 1 c
ATOM 4778 H HA   . PHE Bxp B    11  ? 65.802 -20.866 23.964  1    46.588  ? 2092 B 1 c
ATOM 4779 H HB3  . PHE Bxp B    11  ? 63.652 -21.085 25.786  1    48.546  ? 2092 B 1 c
ATOM 4780 H HB2  . PHE Bxp B    11  ? 64.819 -20.104 26.182  1    48.493  ? 2092 B 1 c
ATOM 4781 H HD1  . PHE Bxp B    11  ? 67.248 -21.481 25.726  1    56.01   ? 2092 B 1 c
ATOM 4782 H HD2  . PHE Bxp B    11  ? 63.781 -23.047 27.063  1    53.347  ? 2092 B 1 c
ATOM 4783 H HE1  . PHE Bxp B    11  ? 68.409 -23.249 26.69   1    57.448  ? 2092 B 1 c
ATOM 4784 H HE2  . PHE Bxp B    11  ? 64.951 -24.809 28.019  1    54.354  ? 2092 B 1 c
ATOM 4785 H HZ   . PHE Bxp B    11  ? 67.261 -24.914 27.837  1    56.412  ? 2092 B 1 c
ATOM 4786 N N    . LYS Bxp B    12  ? 62.927 -20.806 22.704  1    49.037  ? 2093 B 1 .
ATOM 4787 C CA   . LYS Bxp B    12  ? 61.961 -21.466 21.833  1    47.812  ? 2093 B 1 .
ATOM 4788 C C    . LYS Bxp B    12  ? 62.494 -21.584 20.407  1    46.554  ? 2093 B 1 .
ATOM 4789 O O    . LYS Bxp B    12  ? 61.785 -22.105 19.56   1    50.679  ? 2093 B 1 .
ATOM 4790 C CB   . LYS Bxp B    12  ? 60.614 -20.737 21.726  1    48.082  ? 2093 B 1 .
ATOM 4791 C CG   . LYS Bxp B    12  ? 59.726 -20.699 22.971  1    52.264  ? 2093 B 1 .
ATOM 4792 C CD   . LYS Bxp B    12  ? 58.951 -21.979 23.285  1    55.733  ? 2093 B 1 .
ATOM 4793 C CE   . LYS Bxp B    12  ? 57.859 -21.79  24.31   1    58.146  ? 2093 B 1 .
ATOM 4794 N NZ   . LYS Bxp B    12  ? 57.457 -23.053 24.946  1    60.898  ? 2093 B 1 .
ATOM 4795 H H    . LYS Bxp B    12  ? 62.836 -19.907 22.838  1    47.825  ? 2093 B 1 c
ATOM 4796 H HA   . LYS Bxp B    12  ? 61.797 -22.378 22.185  1    47.806  ? 2093 B 1 c
ATOM 4797 H HB3  . LYS Bxp B    12  ? 60.096 -21.154 21.005  1    48.945  ? 2093 B 1 c
ATOM 4798 H HB2  . LYS Bxp B    12  ? 60.793 -19.811 21.456  1    48.946  ? 2093 B 1 c
ATOM 4799 H HG3  . LYS Bxp B    12  ? 59.083 -19.964 22.865  1    52.033  ? 2093 B 1 c
ATOM 4800 H HG2  . LYS Bxp B    12  ? 60.292 -20.48  23.743  1    52.033  ? 2093 B 1 c
ATOM 4801 H HD3  . LYS Bxp B    12  ? 59.581 -22.657 23.612  1    55.465  ? 2093 B 1 c
ATOM 4802 H HD2  . LYS Bxp B    12  ? 58.553 -22.318 22.454  1    55.465  ? 2093 B 1 c
ATOM 4803 H HE3  . LYS Bxp B    12  ? 57.08  -21.393 23.88   1    58.223  ? 2093 B 1 c
ATOM 4804 H HE2  . LYS Bxp B    12  ? 58.168 -21.176 24.999  1    58.223  ? 2093 B 1 c
ATOM 4805 H HZ1  . LYS Bxp B    12  ? 58.154 -23.397 25.411  1    60.038  ? 2093 B 1 c
ATOM 4806 H HZ2  . LYS Bxp B    12  ? 57.2   -23.647 24.312  1    60.038  ? 2093 B 1 c
ATOM 4807 H HZ3  . LYS Bxp B    12  ? 56.766 -22.904 25.512  1    60.038  ? 2093 B 1 c
ATOM 4808 N N    . ARG Bxp B    13  ? 63.697 -21.07  20.125  1    46.319  ? 2094 B 1 .
ATOM 4809 C CA   . ARG Bxp B    13  ? 64.367 -21.319 18.857  1    48.649  ? 2094 B 1 .
ATOM 4810 C C    . ARG Bxp B    13  ? 65.873 -21.294 19.088  1    50.311  ? 2094 B 1 .
ATOM 4811 O O    . ARG Bxp B    13  ? 66.494 -20.236 19.025  1    48.012  ? 2094 B 1 .
ATOM 4812 C CB   . ARG Bxp B    13  ? 64.047 -20.248 17.809  1    51.879  ? 2094 B 1 .
ATOM 4813 C CG   . ARG Bxp B    13  ? 62.601 -20.09  17.355  1    54.782  ? 2094 B 1 .
ATOM 4814 C CD   . ARG Bxp B    13  ? 62.124 -21.18  16.398  1    57.008  ? 2094 B 1 .
ATOM 4815 N NE   . ARG Bxp B    13  ? 62.87  -21.202 15.138  1    58.24   ? 2094 B 1 .
ATOM 4816 C CZ   . ARG Bxp B    13  ? 62.712 -20.323 14.161  1    61.516  ? 2094 B 1 .
ATOM 4817 N NH1  . ARG Bxp B    13  ? 61.781 -19.392 14.236  1    59.726  ? 2094 B 1 .
ATOM 4818 N NH2  . ARG Bxp B    13  ? 63.481 -20.389 13.091  1    68.428  ? 2094 B 1 .
ATOM 4819 H H    . ARG Bxp B    13  ? 64.108 -20.531 20.737  1    46.928  ? 2094 B 1 c
ATOM 4820 H HA   . ARG Bxp B    13  ? 64.101 -22.212 18.519  1    49.043  ? 2094 B 1 c
ATOM 4821 H HB3  . ARG Bxp B    13  ? 64.595 -20.433 17.016  1    51.783  ? 2094 B 1 c
ATOM 4822 H HB2  . ARG Bxp B    13  ? 64.343 -19.384 18.166  1    51.741  ? 2094 B 1 c
ATOM 4823 H HG3  . ARG Bxp B    13  ? 62.504 -19.219 16.914  1    54.625  ? 2094 B 1 c
ATOM 4824 H HG2  . ARG Bxp B    13  ? 62.016 -20.081 18.142  1    54.541  ? 2094 B 1 c
ATOM 4825 H HD3  . ARG Bxp B    13  ? 61.173 -21.045 16.207  1    56.822  ? 2094 B 1 c
ATOM 4826 H HD2  . ARG Bxp B    13  ? 62.218 -22.049 16.839  1    56.793  ? 2094 B 1 c
ATOM 4827 H HE   . ARG Bxp B    13  ? 63.457 -21.836 15.023  1    58.83   ? 2094 B 1 c
ATOM 4828 H HH11 . ARG Bxp B    13  ? 61.501 -19.09  15.016  1    59.881  ? 2094 B 1 c
ATOM 4829 H HH12 . ARG Bxp B    13  ? 61.431 -19.068 13.492  1    60.166  ? 2094 B 1 c
ATOM 4830 H HH21 . ARG Bxp B    13  ? 64.258 -20.809 13.129  1    65.888  ? 2094 B 1 c
ATOM 4831 H HH22 . ARG Bxp B    13  ? 63.216 -20.01  12.339  1    65.518  ? 2094 B 1 c
ATOM 4832 N N    . PRO Bxp B    14  ? 66.502 -22.426 19.466  1    49.971  ? 2095 B 1 .
ATOM 4833 C CA   . PRO Bxp B    14  ? 67.954 -22.492 19.549  1    49.74   ? 2095 B 1 .
ATOM 4834 C C    . PRO Bxp B    14  ? 68.545 -22.868 18.202  1    50.764  ? 2095 B 1 .
ATOM 4835 O O    . PRO Bxp B    14  ? 69.718 -22.644 17.933  1    51.412  ? 2095 B 1 .
ATOM 4836 C CB   . PRO Bxp B    14  ? 68.212 -23.516 20.642  1    50.829  ? 2095 B 1 .
ATOM 4837 C CG   . PRO Bxp B    14  ? 66.854 -24.155 20.931  1    51.502  ? 2095 B 1 .
ATOM 4838 C CD   . PRO Bxp B    14  ? 65.857 -23.658 19.928  1    48.441  ? 2095 B 1 .
ATOM 4839 H HA   . PRO Bxp B    14  ? 68.308 -21.622 19.83   1    50.157  ? 2095 B 1 c
ATOM 4840 H HB3  . PRO Bxp B    14  ? 68.568 -23.084 21.443  1    50.73   ? 2095 B 1 c
ATOM 4841 H HB2  . PRO Bxp B    14  ? 68.854 -24.189 20.342  1    50.731  ? 2095 B 1 c
ATOM 4842 H HG3  . PRO Bxp B    14  ? 66.56  -23.923 21.834  1    50.629  ? 2095 B 1 c
ATOM 4843 H HG2  . PRO Bxp B    14  ? 66.923 -25.129 20.875  1    50.629  ? 2095 B 1 c
ATOM 4844 H HD3  . PRO Bxp B    14  ? 65.734 -24.291 19.196  1    49.509  ? 2095 B 1 c
ATOM 4845 H HD2  . PRO Bxp B    14  ? 64.995 -23.468 20.346  1    49.457  ? 2095 B 1 c
ATOM 4846 N N    . GLU Bxp B    15  ? 67.68  -23.404 17.348  1    53.883  ? 2096 B 1 .
ATOM 4847 C CA   . GLU Bxp B    15  ? 67.942 -23.56  15.928  1    59.533  ? 2096 B 1 .
ATOM 4848 C C    . GLU Bxp B    15  ? 68.817 -22.445 15.33   1    57.182  ? 2096 B 1 .
ATOM 4849 O O    . GLU Bxp B    15  ? 69.567 -22.71  14.393  1    56.721  ? 2096 B 1 .
ATOM 4850 C CB   . GLU Bxp B    15  ? 66.549 -23.573 15.295  1    68.09   ? 2096 B 1 .
ATOM 4851 C CG   . GLU Bxp B    15  ? 66.532 -24.113 13.867  1    81.056  ? 2096 B 1 .
ATOM 4852 C CD   . GLU Bxp B    15  ? 65.161 -24.108 13.205  1    89.713  ? 2096 B 1 .
ATOM 4853 O OE1  . GLU Bxp B    15  ? 64.258 -23.44  13.763  1    91.247  ? 2096 B 1 .
ATOM 4854 O OE2  . GLU Bxp B    15  ? 64.983 -24.785 12.16   1    87.621  ? 2096 B 1 .
ATOM 4855 H H    . GLU Bxp B    15  ? 66.884 -23.712 17.669  1    54.39   ? 2096 B 1 c
ATOM 4856 H HA   . GLU Bxp B    15  ? 68.383 -24.435 15.782  1    59.385  ? 2096 B 1 c
ATOM 4857 H HB3  . GLU Bxp B    15  ? 66.194 -22.66  15.298  1    68.707  ? 2096 B 1 c
ATOM 4858 H HB2  . GLU Bxp B    15  ? 65.954 -24.128 15.841  1    68.505  ? 2096 B 1 c
ATOM 4859 H HG3  . GLU Bxp B    15  ? 66.87  -25.034 13.872  1    79.713  ? 2096 B 1 c
ATOM 4860 H HG2  . GLU Bxp B    15  ? 67.143 -23.579 13.317  1    79.617  ? 2096 B 1 c
ATOM 4861 N N    . VAL Bxp B    16  ? 68.699 -21.202 15.836  1    54.181  ? 2097 B 1 .
ATOM 4862 C CA   . VAL Bxp B    16  ? 69.119 -19.992 15.134  1    51.676  ? 2097 B 1 .
ATOM 4863 C C    . VAL Bxp B    16  ? 69.634 -18.952 16.117  1    53.317  ? 2097 B 1 .
ATOM 4864 O O    . VAL Bxp B    16  ? 69.53  -19.142 17.322  1    57.018  ? 2097 B 1 .
ATOM 4865 C CB   . VAL Bxp B    16  ? 67.946 -19.339 14.391  1    54.548  ? 2097 B 1 .
ATOM 4866 C CG1  . VAL Bxp B    16  ? 67.435 -20.204 13.254  1    62.435  ? 2097 B 1 .
ATOM 4867 C CG2  . VAL Bxp B    16  ? 66.833 -18.962 15.361  1    51.53   ? 2097 B 1 .
ATOM 4868 H H    . VAL Bxp B    16  ? 68.326 -21.104 16.663  1    54.273  ? 2097 B 1 c
ATOM 4869 H HA   . VAL Bxp B    16  ? 69.825 -20.213 14.497  1    53.054  ? 2097 B 1 c
ATOM 4870 H HB   . VAL Bxp B    16  ? 68.281 -18.506 13.989  1    54.779  ? 2097 B 1 c
ATOM 4871 H HG11 . VAL Bxp B    16  ? 66.618 -20.655 13.527  1    59.826  ? 2097 B 1 c
ATOM 4872 H HG12 . VAL Bxp B    16  ? 68.107 -20.867 13.024  1    59.751  ? 2097 B 1 c
ATOM 4873 H HG13 . VAL Bxp B    16  ? 67.252 -19.647 12.479  1    59.726  ? 2097 B 1 c
ATOM 4874 H HG21 . VAL Bxp B    16  ? 65.99  -18.901 14.881  1    52.4    ? 2097 B 1 c
ATOM 4875 H HG22 . VAL Bxp B    16  ? 67.033 -18.103 15.768  1    52.275  ? 2097 B 1 c
ATOM 4876 H HG23 . VAL Bxp B    16  ? 66.758 -19.638 16.055  1    52.395  ? 2097 B 1 c
ATOM 4877 N N    . VAL Bxp B    17  ? 70.082 -17.807 15.577  1    53.14   ? 2098 B 1 .
ATOM 4878 C CA   . VAL Bxp B    17  ? 70.611 -16.721 16.388  1    50.287  ? 2098 B 1 .
ATOM 4879 C C    . VAL Bxp B    17  ? 69.46  -15.851 16.872  1    51.569  ? 2098 B 1 .
ATOM 4880 O O    . VAL Bxp B    17  ? 68.794 -15.22  16.065  1    53.366  ? 2098 B 1 .
ATOM 4881 C CB   . VAL Bxp B    17  ? 71.609 -15.825 15.645  1    49.407  ? 2098 B 1 .
ATOM 4882 C CG1  . VAL Bxp B    17  ? 72.586 -15.219 16.644  1    48.961  ? 2098 B 1 .
ATOM 4883 C CG2  . VAL Bxp B    17  ? 72.315 -16.558 14.507  1    51.467  ? 2098 B 1 .
ATOM 4884 H H    . VAL Bxp B    17  ? 70.054 -17.702 14.67   1    52.531  ? 2098 B 1 c
ATOM 4885 H HA   . VAL Bxp B    17  ? 71.06  -17.107 17.165  1    50.925  ? 2098 B 1 c
ATOM 4886 H HB   . VAL Bxp B    17  ? 71.097 -15.084 15.244  1    49.894  ? 2098 B 1 c
ATOM 4887 H HG11 . VAL Bxp B    17  ? 73.117 -15.925 17.049  1    49.107  ? 2098 B 1 c
ATOM 4888 H HG12 . VAL Bxp B    17  ? 72.094 -14.747 17.336  1    49.106  ? 2098 B 1 c
ATOM 4889 H HG13 . VAL Bxp B    17  ? 73.174 -14.596 16.185  1    49.098  ? 2098 B 1 c
ATOM 4890 H HG21 . VAL Bxp B    17  ? 73.145 -16.099 14.292  1    50.847  ? 2098 B 1 c
ATOM 4891 H HG22 . VAL Bxp B    17  ? 71.742 -16.57  13.722  1    50.866  ? 2098 B 1 c
ATOM 4892 H HG23 . VAL Bxp B    17  ? 72.512 -17.47  14.779  1    50.866  ? 2098 B 1 c
ATOM 4893 N N    . THR Bxp B    18  ? 69.263 -15.784 18.19   1    51.288  ? 2099 B 1 .
ATOM 4894 C CA   . THR Bxp B    18  ? 68.123 -15.085 18.758  1    49.269  ? 2099 B 1 .
ATOM 4895 C C    . THR Bxp B    18  ? 68.557 -13.882 19.578  1    49.338  ? 2099 B 1 .
ATOM 4896 O O    . THR Bxp B    18  ? 67.763 -12.981 19.787  1    54.642  ? 2099 B 1 .
ATOM 4897 C CB   . THR Bxp B    18  ? 67.332 -16.047 19.628  1    52.021  ? 2099 B 1 .
ATOM 4898 O OG1  . THR Bxp B    18  ? 68.274 -16.72  20.459  1    53.737  ? 2099 B 1 .
ATOM 4899 C CG2  . THR Bxp B    18  ? 66.557 -17.043 18.789  1    55.709  ? 2099 B 1 .
ATOM 4900 H H    . THR Bxp B    18  ? 69.846 -16.208 18.753  1    50.882  ? 2099 B 1 c
ATOM 4901 H HA   . THR Bxp B    18  ? 67.544 -14.778 18.028  1    50.088  ? 2099 B 1 c
ATOM 4902 H HB   . THR Bxp B    18  ? 66.7   -15.541 20.191  1    52.418  ? 2099 B 1 c
ATOM 4903 H HG1  . THR Bxp B    18  ? 68.832 -17.205 19.975  0    48.31   ? 2099 B 1 c
ATOM 4904 H HG21 . THR Bxp B    18  ? 66.013 -17.602 19.369  1    54.545  ? 2099 B 1 c
ATOM 4905 H HG22 . THR Bxp B    18  ? 67.177 -17.601 18.291  1    54.573  ? 2099 B 1 c
ATOM 4906 H HG23 . THR Bxp B    18  ? 65.981 -16.566 18.168  1    54.549  ? 2099 B 1 c
ATOM 4907 N N    . MET Bxp B    19  ? 69.783 -13.906 20.091  1    50.369  ? 2100 B 1 .
ATOM 4908 C CA   . MET Bxp B    19  ? 70.337 -12.771 20.797  1    52.781  ? 2100 B 1 .
ATOM 4909 C C    . MET Bxp B    19  ? 71.603 -12.321 20.081  1    54.782  ? 2100 B 1 .
ATOM 4910 O O    . MET Bxp B    19  ? 72.432 -13.128 19.674  1    60.618  ? 2100 B 1 .
ATOM 4911 C CB   . MET Bxp B    19  ? 70.664 -13.146 22.244  1    55.467  ? 2100 B 1 .
ATOM 4912 C CG   . MET Bxp B    19  ? 69.473 -13.131 23.167  1    59.464  ? 2100 B 1 .
ATOM 4913 S SD   . MET Bxp B    19  ? 69.075 -11.459 23.716  1    64.686  ? 2100 B 1 .
ATOM 4914 C CE   . MET Bxp B    19  ? 67.977 -11.883 25.076  1    64.72   ? 2100 B 1 .
ATOM 4915 H H    . MET Bxp B    19  ? 70.291 -14.661 20.013  1    50.655  ? 2100 B 1 c
ATOM 4916 H HA   . MET Bxp B    19  ? 69.678 -12.032 20.785  1    53.182  ? 2100 B 1 c
ATOM 4917 H HB3  . MET Bxp B    19  ? 71.338 -12.52  22.585  1    55.768  ? 2100 B 1 c
ATOM 4918 H HB2  . MET Bxp B    19  ? 71.061 -14.043 22.252  1    55.739  ? 2100 B 1 c
ATOM 4919 H HG3  . MET Bxp B    19  ? 69.659 -13.687 23.95   1    59.416  ? 2100 B 1 c
ATOM 4920 H HG2  . MET Bxp B    19  ? 68.697 -13.507 22.705  1    59.416  ? 2100 B 1 c
ATOM 4921 H HE3  . MET Bxp B    19  ? 68.434 -12.493 25.684  1    64.68   ? 2100 B 1 c
ATOM 4922 H HE2  . MET Bxp B    19  ? 67.176 -12.314 24.725  1    64.68   ? 2100 B 1 c
ATOM 4923 H HE1  . MET Bxp B    19  ? 67.726 -11.072 25.556  1    64.586  ? 2100 B 1 c
ATOM 4924 N N    . THR Bxp B    20  ? 71.738 -11.012 19.926  1    55.34   ? 2101 B 1 .
ATOM 4925 C CA   . THR Bxp B    20  ? 72.973 -10.441 19.435  1    53.327  ? 2101 B 1 .
ATOM 4926 C C    . THR Bxp B    20  ? 73.938 -10.421 20.6    1    52.934  ? 2101 B 1 .
ATOM 4927 O O    . THR Bxp B    20  ? 73.511 -10.299 21.748  1    49.1    ? 2101 B 1 .
ATOM 4928 C CB   . THR Bxp B    20  ? 72.74  -9.023  18.936  1    55.944  ? 2101 B 1 .
ATOM 4929 O OG1  . THR Bxp B    20  ? 72.522 -8.295  20.142  1    57.454  ? 2101 B 1 .
ATOM 4930 C CG2  . THR Bxp B    20  ? 71.569 -8.931  17.974  1    58.982  ? 2101 B 1 .
ATOM 4931 H H    . THR Bxp B    20  ? 71.048 -10.454 20.145  1    54.773  ? 2101 B 1 c
ATOM 4932 H HA   . THR Bxp B    20  ? 73.331 -10.996 18.708  1    54.167  ? 2101 B 1 c
ATOM 4933 H HB   . THR Bxp B    20  ? 73.556 -8.689  18.493  1    56.172  ? 2101 B 1 c
ATOM 4934 H HG1  . THR Bxp B    20  ? 71.777 -8.577  20.513  0    46.4    ? 2101 B 1 c
ATOM 4935 H HG21 . THR Bxp B    20  ? 70.93  -8.277  18.302  1    57.782  ? 2101 B 1 c
ATOM 4936 H HG22 . THR Bxp B    20  ? 71.135 -9.797  17.897  1    57.84   ? 2101 B 1 c
ATOM 4937 H HG23 . THR Bxp B    20  ? 71.892 -8.654  17.101  1    57.491  ? 2101 B 1 c
ATOM 4938 N N    . LYS Bxp B    21  ? 75.228 -10.466 20.269  1    58.441  ? 2102 B 1 .
ATOM 4939 C CA   . LYS Bxp B    21  ? 76.274 -10.408 21.277  1    56.823  ? 2102 B 1 .
ATOM 4940 C C    . LYS Bxp B    21  ? 76.22  -9.072  22.019  1    48.837  ? 2102 B 1 .
ATOM 4941 O O    . LYS Bxp B    21  ? 76.763 -8.986  23.101  1    52.087  ? 2102 B 1 .
ATOM 4942 C CB   . LYS Bxp B    21  ? 77.671 -10.798 20.764  1    59.889  ? 2102 B 1 .
ATOM 4943 C CG   . LYS Bxp B    21  ? 77.885 -10.818 19.249  1    68.599  ? 2102 B 1 .
ATOM 4944 C CD   . LYS Bxp B    21  ? 79.269 -10.343 18.818  1    75.149  ? 2102 B 1 .
ATOM 4945 C CE   . LYS Bxp B    21  ? 79.378 -8.841  18.886  1    76.471  ? 2102 B 1 .
ATOM 4946 N NZ   . LYS Bxp B    21  ? 80.758 -8.366  18.772  1    74.722  ? 2102 B 1 .
ATOM 4947 H H    . LYS Bxp B    21  ? 75.459 -10.539 19.388  1    56.857  ? 2102 B 1 c
ATOM 4948 H HA   . LYS Bxp B    21  ? 76.056 -11.104 21.948  1    56.082  ? 2102 B 1 c
ATOM 4949 H HB3  . LYS Bxp B    21  ? 77.879 -11.693 21.108  1    61.035  ? 2102 B 1 c
ATOM 4950 H HB2  . LYS Bxp B    21  ? 78.323 -10.18  21.156  1    61.187  ? 2102 B 1 c
ATOM 4951 H HG3  . LYS Bxp B    21  ? 77.214 -10.241 18.827  1    67.787  ? 2102 B 1 c
ATOM 4952 H HG2  . LYS Bxp B    21  ? 77.744 -11.733 18.924  1    67.88   ? 2102 B 1 c
ATOM 4953 H HD3  . LYS Bxp B    21  ? 79.442 -10.638 17.897  1    73.911  ? 2102 B 1 c
ATOM 4954 H HD2  . LYS Bxp B    21  ? 79.948 -10.743 19.404  1    73.911  ? 2102 B 1 c
ATOM 4955 H HE3  . LYS Bxp B    21  ? 79.007 -8.525  19.729  1    75.519  ? 2102 B 1 c
ATOM 4956 H HE2  . LYS Bxp B    21  ? 78.853 -8.451  18.164  1    75.707  ? 2102 B 1 c
ATOM 4957 H HZ1  . LYS Bxp B    21  ? 81.14  -8.709  18.026  1    75.256  ? 2102 B 1 c
ATOM 4958 H HZ2  . LYS Bxp B    21  ? 81.233 -8.629  19.498  1    75.256  ? 2102 B 1 c
ATOM 4959 H HZ3  . LYS Bxp B    21  ? 80.767 -7.461  18.723  1    75.256  ? 2102 B 1 c
ATOM 4960 N N    . TRP Bxp B    22  ? 75.511 -8.056  21.513  1    46.015  ? 2103 B 1 .
ATOM 4961 C CA   . TRP Bxp B    22  ? 75.293 -6.836  22.29   1    45.375  ? 2103 B 1 .
ATOM 4962 C C    . TRP Bxp B    22  ? 73.931 -6.873  22.992  1    43.34   ? 2103 B 1 .
ATOM 4963 O O    . TRP Bxp B    22  ? 73.345 -5.834  23.302  1    40.868  ? 2103 B 1 .
ATOM 4964 C CB   . TRP Bxp B    22  ? 75.488 -5.576  21.421  1    45.49   ? 2103 B 1 .
ATOM 4965 C CG   . TRP Bxp B    22  ? 74.477 -5.375  20.323  1    42.969  ? 2103 B 1 .
ATOM 4966 C CD1  . TRP Bxp B    22  ? 73.321 -4.666  20.431  1    42.745  ? 2103 B 1 .
ATOM 4967 C CD2  . TRP Bxp B    22  ? 74.521 -5.871  18.967  1    41.22   ? 2103 B 1 .
ATOM 4968 N NE1  . TRP Bxp B    22  ? 72.638 -4.704  19.25   1    42.594  ? 2103 B 1 .
ATOM 4969 C CE2  . TRP Bxp B    22  ? 73.343 -5.433  18.336  1    39.686  ? 2103 B 1 .
ATOM 4970 C CE3  . TRP Bxp B    22  ? 75.42  -6.646  18.228  1    45.297  ? 2103 B 1 .
ATOM 4971 C CZ2  . TRP Bxp B    22  ? 73.047 -5.731  17.013  1    40.154  ? 2103 B 1 .
ATOM 4972 C CZ3  . TRP Bxp B    22  ? 75.124 -6.949  16.917  1    44.387  ? 2103 B 1 .
ATOM 4973 C CH2  . TRP Bxp B    22  ? 73.956 -6.491  16.317  1    41.737  ? 2103 B 1 .
ATOM 4974 H H    . TRP Bxp B    22  ? 75.173 -8.109  20.666  1    46.59   ? 2103 B 1 c
ATOM 4975 H HA   . TRP Bxp B    22  ? 75.989 -6.806  22.999  1    45.201  ? 2103 B 1 c
ATOM 4976 H HB3  . TRP Bxp B    22  ? 76.382 -5.614  21.021  1    44.864  ? 2103 B 1 c
ATOM 4977 H HB2  . TRP Bxp B    22  ? 75.471 -4.791  22.01   1    44.846  ? 2103 B 1 c
ATOM 4978 H HD1  . TRP Bxp B    22  ? 73.017 -4.228  21.209  1    42.736  ? 2103 B 1 c
ATOM 4979 H HE1  . TRP Bxp B    22  ? 71.87  -4.316  19.101  1    41.938  ? 2103 B 1 c
ATOM 4980 H HE3  . TRP Bxp B    22  ? 76.214 -6.961  18.625  1    44.054  ? 2103 B 1 c
ATOM 4981 H HZ2  . TRP Bxp B    22  ? 72.256 -5.423  16.61   1    40.348  ? 2103 B 1 c
ATOM 4982 H HZ3  . TRP Bxp B    22  ? 75.726 -7.47   16.418  1    43.97   ? 2103 B 1 c
ATOM 4983 H HH2  . TRP Bxp B    22  ? 73.78  -6.713  15.421  1    42.083  ? 2103 B 1 c
ATOM 4984 N N    . LYS Bxp B    23  ? 73.449 -8.095  23.244  1    45.211  ? 2104 B 1 .
ATOM 4985 C CA   . LYS Bxp B    23  ? 72.295 -8.361  24.09   1    50.032  ? 2104 B 1 .
ATOM 4986 C C    . LYS Bxp B    23  ? 70.989 -7.82   23.505  1    46.65   ? 2104 B 1 .
ATOM 4987 O O    . LYS Bxp B    23  ? 70.115 -7.419  24.272  1    46.638  ? 2104 B 1 .
ATOM 4988 C CB   . LYS Bxp B    23  ? 72.351 -7.742  25.494  1    56.234  ? 2104 B 1 .
ATOM 4989 C CG   . LYS Bxp B    23  ? 73.505 -8.09   26.441  1    64.8    ? 2104 B 1 .
ATOM 4990 C CD   . LYS Bxp B    23  ? 73.246 -7.524  27.849  1    75.853  ? 2104 B 1 .
ATOM 4991 C CE   . LYS Bxp B    23  ? 74.371 -6.786  28.575  1    82.834  ? 2104 B 1 .
ATOM 4992 N NZ   . LYS Bxp B    23  ? 75.623 -7.541  28.716  1    88.693  ? 2104 B 1 .
ATOM 4993 H H    . LYS Bxp B    23  ? 73.865 -8.812  22.863  1    45.86   ? 2104 B 1 c
ATOM 4994 H HA   . LYS Bxp B    23  ? 72.208 -9.343  24.188  1    49.471  ? 2104 B 1 c
ATOM 4995 H HB3  . LYS Bxp B    23  ? 71.52  -7.987  25.955  1    56.495  ? 2104 B 1 c
ATOM 4996 H HB2  . LYS Bxp B    23  ? 72.341 -6.767  25.392  1    56.367  ? 2104 B 1 c
ATOM 4997 H HG3  . LYS Bxp B    23  ? 74.339 -7.715  26.083  1    65.009  ? 2104 B 1 c
ATOM 4998 H HG2  . LYS Bxp B    23  ? 73.595 -9.067  26.491  1    65.009  ? 2104 B 1 c
ATOM 4999 H HD3  . LYS Bxp B    23  ? 72.955 -8.271  28.416  1    74.575  ? 2104 B 1 c
ATOM 5000 H HD2  . LYS Bxp B    23  ? 72.477 -6.915  27.787  1    74.257  ? 2104 B 1 c
ATOM 5001 H HE3  . LYS Bxp B    23  ? 74.059 -6.537  29.464  1    82.542  ? 2104 B 1 c
ATOM 5002 H HE2  . LYS Bxp B    23  ? 74.565 -5.962  28.092  1    82.542  ? 2104 B 1 c
ATOM 5003 H HZ1  . LYS Bxp B    23  ? 76.046 -7.586  27.916  1    86.847  ? 2104 B 1 c
ATOM 5004 H HZ2  . LYS Bxp B    23  ? 75.442 -8.382  29.004  1    86.847  ? 2104 B 1 c
ATOM 5005 H HZ3  . LYS Bxp B    23  ? 76.164 -7.131  29.316  1    86.847  ? 2104 B 1 c
ATOM 5006 N N    . ALA Bxp B    24  ? 70.816 -7.866  22.176  1    45.443  ? 2105 B 1 .
ATOM 5007 C CA   . ALA Bxp B    24  ? 69.622 -7.314  21.539  1    44.153  ? 2105 B 1 .
ATOM 5008 C C    . ALA Bxp B    24  ? 68.837 -8.409  20.829  1    37.267  ? 2105 B 1 .
ATOM 5009 O O    . ALA Bxp B    24  ? 69.406 -9.217  20.117  1    38.815  ? 2105 B 1 .
ATOM 5010 C CB   . ALA Bxp B    24  ? 69.981 -6.219  20.56   1    46.204  ? 2105 B 1 .
ATOM 5011 H H    . ALA Bxp B    24  ? 71.455 -8.254  21.651  1    45.46   ? 2105 B 1 c
ATOM 5012 H HA   . ALA Bxp B    24  ? 69.041 -6.928  22.25   1    43.262  ? 2105 B 1 c
ATOM 5013 H HB3  . ALA Bxp B    24  ? 69.364 -6.233  19.809  1    45.509  ? 2105 B 1 c
ATOM 5014 H HB2  . ALA Bxp B    24  ? 70.885 -6.355  20.234  1    45.61   ? 2105 B 1 c
ATOM 5015 H HB1  . ALA Bxp B    24  ? 69.927 -5.355  21.002  1    45.576  ? 2105 B 1 c
ATOM 5016 N N    . PRO Bxp B    25  ? 67.499 -8.447  20.954  1    33.482  ? 2106 B 1 .
ATOM 5017 C CA   . PRO Bxp B    25  ? 66.738 -9.574  20.459  1    32.595  ? 2106 B 1 .
ATOM 5018 C C    . PRO Bxp B    25  ? 66.837 -9.699  18.953  1    32.947  ? 2106 B 1 .
ATOM 5019 O O    . PRO Bxp B    25  ? 66.975 -8.699  18.269  1    36.769  ? 2106 B 1 .
ATOM 5020 C CB   . PRO Bxp B    25  ? 65.305 -9.258  20.858  1    33.301  ? 2106 B 1 .
ATOM 5021 C CG   . PRO Bxp B    25  ? 65.299 -7.747  20.952  1    34.381  ? 2106 B 1 .
ATOM 5022 C CD   . PRO Bxp B    25  ? 66.645 -7.391  21.512  1    35.08   ? 2106 B 1 .
ATOM 5023 H HA   . PRO Bxp B    25  ? 67.043 -10.4   20.889  1    32.957  ? 2106 B 1 c
ATOM 5024 H HB3  . PRO Bxp B    25  ? 65.084 -9.665  21.718  1    33.381  ? 2106 B 1 c
ATOM 5025 H HB2  . PRO Bxp B    25  ? 64.673 -9.571  20.182  1    33.379  ? 2106 B 1 c
ATOM 5026 H HG3  . PRO Bxp B    25  ? 64.585 -7.437  21.545  1    34.286  ? 2106 B 1 c
ATOM 5027 H HG2  . PRO Bxp B    25  ? 65.176 -7.344  20.072  1    34.259  ? 2106 B 1 c
ATOM 5028 H HD3  . PRO Bxp B    25  ? 66.936 -6.513  21.213  1    34.677  ? 2106 B 1 c
ATOM 5029 H HD2  . PRO Bxp B    25  ? 66.646 -7.42   22.488  1    34.57   ? 2106 B 1 c
ATOM 5030 N N    . VAL Bxp B    26  ? 66.781 -10.935 18.468  1    33.013  ? 2107 B 1 .
ATOM 5031 C CA   . VAL Bxp B    26  ? 66.547 -11.209 17.068  1    31.856  ? 2107 B 1 .
ATOM 5032 C C    . VAL Bxp B    26  ? 65.254 -12.006 16.99   1    32.72   ? 2107 B 1 .
ATOM 5033 O O    . VAL Bxp B    26  ? 65.235 -13.202 17.272  1    31.225  ? 2107 B 1 .
ATOM 5034 C CB   . VAL Bxp B    26  ? 67.72  -11.971 16.444  1    31.492  ? 2107 B 1 .
ATOM 5035 C CG1  . VAL Bxp B    26  ? 67.351 -12.463 15.053  1    30.502  ? 2107 B 1 .
ATOM 5036 C CG2  . VAL Bxp B    26  ? 68.996 -11.131 16.451  1    31.634  ? 2107 B 1 .
ATOM 5037 H H    . VAL Bxp B    26  ? 66.892 -11.641 19.037  1    32.804  ? 2107 B 1 c
ATOM 5038 H HA   . VAL Bxp B    26  ? 66.433 -10.366 16.595  1    32.255  ? 2107 B 1 c
ATOM 5039 H HB   . VAL Bxp B    26  ? 67.882 -12.762 17.007  1    31.562  ? 2107 B 1 c
ATOM 5040 H HG11 . VAL Bxp B    26  ? 66.879 -11.762 14.574  1    30.843  ? 2107 B 1 c
ATOM 5041 H HG12 . VAL Bxp B    26  ? 66.781 -13.245 15.124  1    30.948  ? 2107 B 1 c
ATOM 5042 H HG13 . VAL Bxp B    26  ? 68.16  -12.697 14.567  1    30.84   ? 2107 B 1 c
ATOM 5043 H HG21 . VAL Bxp B    26  ? 69.748 -11.686 16.717  1    31.593  ? 2107 B 1 c
ATOM 5044 H HG22 . VAL Bxp B    26  ? 68.901 -10.394 17.077  1    31.605  ? 2107 B 1 c
ATOM 5045 H HG23 . VAL Bxp B    26  ? 69.157 -10.777 15.56   1    31.586  ? 2107 B 1 c
ATOM 5046 N N    . VAL Bxp B    27  ? 64.174 -11.306 16.641  1    34.467  ? 2108 B 1 .
ATOM 5047 C CA   . VAL Bxp B    27  ? 62.838 -11.868 16.697  1    35.181  ? 2108 B 1 .
ATOM 5048 C C    . VAL Bxp B    27  ? 62.66  -12.851 15.55   1    36.534  ? 2108 B 1 .
ATOM 5049 O O    . VAL Bxp B    27  ? 62.58  -12.439 14.392  1    34.296  ? 2108 B 1 .
ATOM 5050 C CB   . VAL Bxp B    27  ? 61.744 -10.791 16.642  1    35.184  ? 2108 B 1 .
ATOM 5051 C CG1  . VAL Bxp B    27  ? 60.35  -11.4   16.589  1    35.672  ? 2108 B 1 .
ATOM 5052 C CG2  . VAL Bxp B    27  ? 61.863 -9.833  17.814  1    35.633  ? 2108 B 1 .
ATOM 5053 H H    . VAL Bxp B    27  ? 64.274 -10.444 16.355  1    34.189  ? 2108 B 1 c
ATOM 5054 H HA   . VAL Bxp B    27  ? 62.747 -12.353 17.541  1    35.299  ? 2108 B 1 c
ATOM 5055 H HB   . VAL Bxp B    27  ? 61.883 -10.275 15.813  1    35.352  ? 2108 B 1 c
ATOM 5056 H HG11 . VAL Bxp B    27  ? 60.324 -12.202 17.139  1    35.531  ? 2108 B 1 c
ATOM 5057 H HG12 . VAL Bxp B    27  ? 60.13  -11.631 15.671  1    35.533  ? 2108 B 1 c
ATOM 5058 H HG13 . VAL Bxp B    27  ? 59.7   -10.759 16.924  1    35.529  ? 2108 B 1 c
ATOM 5059 H HG21 . VAL Bxp B    27  ? 61.099 -9.234  17.825  1    35.457  ? 2108 B 1 c
ATOM 5060 H HG22 . VAL Bxp B    27  ? 62.68  -9.313  17.727  1    35.484  ? 2108 B 1 c
ATOM 5061 H HG23 . VAL Bxp B    27  ? 61.89  -10.339 18.643  1    35.528  ? 2108 B 1 c
ATOM 5062 N N    . TRP Bxp B    28  ? 62.611 -14.138 15.923  1    37.456  ? 2109 B 1 .
ATOM 5063 C CA   . TRP Bxp B    28  ? 62.181 -15.219 15.054  1    37.239  ? 2109 B 1 .
ATOM 5064 C C    . TRP Bxp B    28  ? 60.766 -15.634 15.432  1    35.446  ? 2109 B 1 .
ATOM 5065 O O    . TRP Bxp B    28  ? 60.306 -15.319 16.521  1    35.254  ? 2109 B 1 .
ATOM 5066 C CB   . TRP Bxp B    28  ? 63.1   -16.437 15.208  1    38.436  ? 2109 B 1 .
ATOM 5067 C CG   . TRP Bxp B    28  ? 64.48  -16.273 14.641  1    38.515  ? 2109 B 1 .
ATOM 5068 C CD1  . TRP Bxp B    28  ? 65.55  -15.689 15.248  1    39.374  ? 2109 B 1 .
ATOM 5069 C CD2  . TRP Bxp B    28  ? 64.937 -16.727 13.352  1    38.138  ? 2109 B 1 .
ATOM 5070 N NE1  . TRP Bxp B    28  ? 66.641 -15.743 14.427  1    40.138  ? 2109 B 1 .
ATOM 5071 C CE2  . TRP Bxp B    28  ? 66.3   -16.368 13.256  1    39.111  ? 2109 B 1 .
ATOM 5072 C CE3  . TRP Bxp B    28  ? 64.33  -17.383 12.278  1    37.901  ? 2109 B 1 .
ATOM 5073 C CZ2  . TRP Bxp B    28  ? 67.07  -16.641 12.127  1    37.959  ? 2109 B 1 .
ATOM 5074 C CZ3  . TRP Bxp B    28  ? 65.089 -17.647 11.16   1    39.909  ? 2109 B 1 .
ATOM 5075 C CH2  . TRP Bxp B    28  ? 66.437 -17.277 11.086  1    39.305  ? 2109 B 1 .
ATOM 5076 H H    . TRP Bxp B    28  ? 62.867 -14.352 16.774  1    37.161  ? 2109 B 1 c
ATOM 5077 H HA   . TRP Bxp B    28  ? 62.199 -14.911 14.11   1    37.163  ? 2109 B 1 c
ATOM 5078 H HB3  . TRP Bxp B    28  ? 62.673 -17.202 14.77   1    38.38   ? 2109 B 1 c
ATOM 5079 H HB2  . TRP Bxp B    28  ? 63.175 -16.649 16.163  1    38.232  ? 2109 B 1 c
ATOM 5080 H HD1  . TRP Bxp B    28  ? 65.551 -15.31  16.11   1    39.267  ? 2109 B 1 c
ATOM 5081 H HE1  . TRP Bxp B    28  ? 67.431 -15.423 14.617  1    39.605  ? 2109 B 1 c
ATOM 5082 H HE3  . TRP Bxp B    28  ? 63.427 -17.632 12.318  1    38.631  ? 2109 B 1 c
ATOM 5083 H HZ2  . TRP Bxp B    28  ? 67.976 -16.391 12.077  1    38.547  ? 2109 B 1 c
ATOM 5084 H HZ3  . TRP Bxp B    28  ? 64.693 -18.092 10.429  1    39.272  ? 2109 B 1 c
ATOM 5085 H HH2  . TRP Bxp B    28  ? 66.927 -17.484 10.311  1    39.196  ? 2109 B 1 c
ATOM 5086 N N    . GLU Bxp B    29  ? 60.121 -16.405 14.555  1    33.686  ? 2110 B 1 .
ATOM 5087 C CA   . GLU Bxp B    29  ? 58.822 -16.966 14.852  1    32.147  ? 2110 B 1 .
ATOM 5088 C C    . GLU Bxp B    29  ? 58.926 -17.882 16.061  1    34.512  ? 2110 B 1 .
ATOM 5089 O O    . GLU Bxp B    29  ? 59.887 -18.631 16.187  1    32.57   ? 2110 B 1 .
ATOM 5090 C CB   . GLU Bxp B    29  ? 58.302 -17.813 13.701  1    31.535  ? 2110 B 1 .
ATOM 5091 C CG   . GLU Bxp B    29  ? 56.973 -18.482 14.033  1    31.258  ? 2110 B 1 .
ATOM 5092 C CD   . GLU Bxp B    29  ? 55.87  -17.496 14.347  1    29.489  ? 2110 B 1 .
ATOM 5093 O OE1  . GLU Bxp B    29  ? 56.072 -16.312 14.034  1    30.458  ? 2110 B 1 .
ATOM 5094 O OE2  . GLU Bxp B    29  ? 54.833 -17.885 14.897  1    27.084  ? 2110 B 1 .
ATOM 5095 H H    . GLU Bxp B    29  ? 60.509 -16.589 13.749  1    33.801  ? 2110 B 1 c
ATOM 5096 H HA   . GLU Bxp B    29  ? 58.203 -16.23  15.049  1    32.859  ? 2110 B 1 c
ATOM 5097 H HB3  . GLU Bxp B    29  ? 58.96  -18.508 13.505  1    31.826  ? 2110 B 1 c
ATOM 5098 H HB2  . GLU Bxp B    29  ? 58.209 -17.252 12.903  1    31.703  ? 2110 B 1 c
ATOM 5099 H HG3  . GLU Bxp B    29  ? 57.089 -19.082 14.8    1    30.984  ? 2110 B 1 c
ATOM 5100 H HG2  . GLU Bxp B    29  ? 56.692 -19.03  13.27   1    30.989  ? 2110 B 1 c
ATOM 5101 N N    . GLY Bxp B    30  ? 57.92  -17.81  16.94   1    40.978  ? 2111 B 1 .
ATOM 5102 C CA   . GLY Bxp B    30  ? 57.892 -18.64  18.132  1    42.144  ? 2111 B 1 .
ATOM 5103 C C    . GLY Bxp B    30  ? 58.553 -17.966 19.332  1    42.59   ? 2111 B 1 .
ATOM 5104 O O    . GLY Bxp B    30  ? 58.146 -18.242 20.447  1    46.809  ? 2111 B 1 .
ATOM 5105 H H    . GLY Bxp B    30  ? 57.234 -17.224 16.797  1    39.398  ? 2111 B 1 c
ATOM 5106 H HA3  . GLY Bxp B    30  ? 58.35  -19.493 17.943  1    41.851  ? 2111 B 1 c
ATOM 5107 H HA2  . GLY Bxp B    30  ? 56.953 -18.847 18.352  1    41.939  ? 2111 B 1 c
ATOM 5108 N N    . THR Bxp B    31  ? 59.544 -17.081 19.124  1    43.475  ? 2112 B 1 .
ATOM 5109 C CA   . THR Bxp B    31  ? 60.266 -16.443 20.229  1    43.814  ? 2112 B 1 .
ATOM 5110 C C    . THR Bxp B    31  ? 59.406 -15.379 20.912  1    46.134  ? 2112 B 1 .
ATOM 5111 O O    . THR Bxp B    31  ? 59.513 -15.186 22.124  1    47.371  ? 2112 B 1 .
ATOM 5112 C CB   . THR Bxp B    31  ? 61.582 -15.802 19.783  1    40.955  ? 2112 B 1 .
ATOM 5113 O OG1  . THR Bxp B    31  ? 61.24  -14.751 18.888  1    39.698  ? 2112 B 1 .
ATOM 5114 C CG2  . THR Bxp B    31  ? 62.525 -16.759 19.079  1    41.596  ? 2112 B 1 .
ATOM 5115 H H    . THR Bxp B    31  ? 59.779 -16.864 18.269  1    43.21   ? 2112 B 1 c
ATOM 5116 H HA   . THR Bxp B    31  ? 60.477 -17.138 20.891  1    43.629  ? 2112 B 1 c
ATOM 5117 H HB   . THR Bxp B    31  ? 62.041 -15.426 20.571  1    41.3    ? 2112 B 1 c
ATOM 5118 H HG1  . THR Bxp B    31  ? 60.838 -15.076 18.201  0    28.61   ? 2112 B 1 c
ATOM 5119 H HG21 . THR Bxp B    31  ? 63.37  -16.312 18.902  1    41.405  ? 2112 B 1 c
ATOM 5120 H HG22 . THR Bxp B    31  ? 62.129 -17.047 18.239  1    41.405  ? 2112 B 1 c
ATOM 5121 H HG23 . THR Bxp B    31  ? 62.682 -17.534 19.644  1    41.405  ? 2112 B 1 c
ATOM 5122 N N    . TYR Bxp B    32  ? 58.573 -14.686 20.12   1    45.614  ? 2113 B 1 .
ATOM 5123 C CA   . TYR Bxp B    32  ? 57.89  -13.474 20.557  1    41.395  ? 2113 B 1 .
ATOM 5124 C C    . TYR Bxp B    32  ? 56.515 -13.819 21.123  1    38.693  ? 2113 B 1 .
ATOM 5125 O O    . TYR Bxp B    32  ? 55.808 -14.659 20.58   1    39.833  ? 2113 B 1 .
ATOM 5126 C CB   . TYR Bxp B    32  ? 57.775 -12.497 19.381  1    40.242  ? 2113 B 1 .
ATOM 5127 C CG   . TYR Bxp B    32  ? 56.915 -13.012 18.236  1    39.873  ? 2113 B 1 .
ATOM 5128 C CD1  . TYR Bxp B    32  ? 57.431 -13.843 17.253  1    37.749  ? 2113 B 1 .
ATOM 5129 C CD2  . TYR Bxp B    32  ? 55.574 -12.672 18.151  1    42.396  ? 2113 B 1 .
ATOM 5130 C CE1  . TYR Bxp B    32  ? 56.645 -14.315 16.217  1    36.531  ? 2113 B 1 .
ATOM 5131 C CE2  . TYR Bxp B    32  ? 54.775 -13.143 17.124  1    41.794  ? 2113 B 1 .
ATOM 5132 C CZ   . TYR Bxp B    32  ? 55.311 -13.964 16.154  1    38.252  ? 2113 B 1 .
ATOM 5133 O OH   . TYR Bxp B    32  ? 54.465 -14.409 15.185  1    38.837  ? 2113 B 1 .
ATOM 5134 H H    . TYR Bxp B    32  ? 58.416 -14.994 19.275  1    44.558  ? 2113 B 1 c
ATOM 5135 H HA   . TYR Bxp B    32  ? 58.432 -13.045 21.27   1    41.418  ? 2113 B 1 c
ATOM 5136 H HB3  . TYR Bxp B    32  ? 58.678 -12.309 19.042  1    40.404  ? 2113 B 1 c
ATOM 5137 H HB2  . TYR Bxp B    32  ? 57.394 -11.654 19.713  1    40.354  ? 2113 B 1 c
ATOM 5138 H HD1  . TYR Bxp B    32  ? 58.342 -14.082 17.283  1    38.027  ? 2113 B 1 c
ATOM 5139 H HD2  . TYR Bxp B    32  ? 55.194 -12.118 18.814  1    41.549  ? 2113 B 1 c
ATOM 5140 H HE1  . TYR Bxp B    32  ? 57.015 -14.873 15.562  1    37.154  ? 2113 B 1 c
ATOM 5141 H HE2  . TYR Bxp B    32  ? 53.865 -12.912 17.094  1    40.96   ? 2113 B 1 c
ATOM 5142 H HH   . TYR Bxp B    32  ? 54.899 -14.967 14.697  0    30.74   ? 2113 B 1 c
ATOM 5143 N N    . ASN Bxp B    33  ? 56.139 -13.149 22.213  1    37.301  ? 2114 B 1 .
ATOM 5144 C CA   . ASN Bxp B    33  ? 54.807 -13.293 22.779  1    37.848  ? 2114 B 1 .
ATOM 5145 C C    . ASN Bxp B    33  ? 53.951 -12.093 22.387  1    38.131  ? 2114 B 1 .
ATOM 5146 O O    . ASN Bxp B    33  ? 53.843 -11.122 23.136  1    35.571  ? 2114 B 1 .
ATOM 5147 C CB   . ASN Bxp B    33  ? 54.856 -13.405 24.296  1    37.676  ? 2114 B 1 .
ATOM 5148 C CG   . ASN Bxp B    33  ? 53.512 -13.7   24.919  1    37.207  ? 2114 B 1 .
ATOM 5149 O OD1  . ASN Bxp B    33  ? 52.45  -13.292 24.426  1    33.573  ? 2114 B 1 .
ATOM 5150 N ND2  . ASN Bxp B    33  ? 53.556 -14.416 26.028  1    39.656  ? 2114 B 1 .
ATOM 5151 H H    . ASN Bxp B    33  ? 56.728 -12.579 22.617  1    37.794  ? 2114 B 1 c
ATOM 5152 H HA   . ASN Bxp B    33  ? 54.394 -14.115 22.429  1    37.785  ? 2114 B 1 c
ATOM 5153 H HB3  . ASN Bxp B    33  ? 55.198 -12.568 24.665  1    37.585  ? 2114 B 1 c
ATOM 5154 H HB2  . ASN Bxp B    33  ? 55.481 -14.116 24.541  1    37.614  ? 2114 B 1 c
ATOM 5155 H HD21 . ASN Bxp B    33  ? 52.996 -15.095 26.138  1    38.883  ? 2114 B 1 c
ATOM 5156 H HD22 . ASN Bxp B    33  ? 54.144 -14.216 26.661  1    38.877  ? 2114 B 1 c
ATOM 5157 N N    . ARG Bxp B    34  ? 53.305 -12.169 21.221  1    39.086  ? 2115 B 1 .
ATOM 5158 C CA   . ARG Bxp B    34  ? 52.651 -10.987 20.684  1    39.239  ? 2115 B 1 .
ATOM 5159 C C    . ARG Bxp B    34  ? 51.414 -10.58  21.489  1    38.457  ? 2115 B 1 .
ATOM 5160 O O    . ARG Bxp B    34  ? 51.003 -9.43   21.434  1    36.406  ? 2115 B 1 .
ATOM 5161 C CB   . ARG Bxp B    34  ? 52.257 -11.201 19.225  1    39.319  ? 2115 B 1 .
ATOM 5162 C CG   . ARG Bxp B    34  ? 51.474 -10.009 18.699  1    38.449  ? 2115 B 1 .
ATOM 5163 C CD   . ARG Bxp B    34  ? 51.106 -10.188 17.263  1    37.961  ? 2115 B 1 .
ATOM 5164 N NE   . ARG Bxp B    34  ? 52.286 -10.584 16.491  1    36.921  ? 2115 B 1 .
ATOM 5165 C CZ   . ARG Bxp B    34  ? 52.27  -11.527 15.57   1    38.494  ? 2115 B 1 .
ATOM 5166 N NH1  . ARG Bxp B    34  ? 51.14  -12.163 15.318  1    42.262  ? 2115 B 1 .
ATOM 5167 N NH2  . ARG Bxp B    34  ? 53.367 -11.825 14.9    1    37.891  ? 2115 B 1 .
ATOM 5168 H H    . ARG Bxp B    34  ? 53.27  -12.956 20.758  1    38.877  ? 2115 B 1 c
ATOM 5169 H HA   . ARG Bxp B    34  ? 53.299 -10.238 20.716  1    39.056  ? 2115 B 1 c
ATOM 5170 H HB3  . ARG Bxp B    34  ? 51.709 -12.01  19.148  1    39.105  ? 2115 B 1 c
ATOM 5171 H HB2  . ARG Bxp B    34  ? 53.066 -11.325 18.685  1    39.119  ? 2115 B 1 c
ATOM 5172 H HG3  . ARG Bxp B    34  ? 52.012 -9.193  18.797  1    38.534  ? 2115 B 1 c
ATOM 5173 H HG2  . ARG Bxp B    34  ? 50.652 -9.906  19.22   1    38.552  ? 2115 B 1 c
ATOM 5174 H HD3  . ARG Bxp B    34  ? 50.749 -9.35   16.905  1    37.835  ? 2115 B 1 c
ATOM 5175 H HD2  . ARG Bxp B    34  ? 50.414 -10.875 17.19   1    37.878  ? 2115 B 1 c
ATOM 5176 H HE   . ARG Bxp B    34  ? 53.036 -10.174 16.649  1    37.537  ? 2115 B 1 c
ATOM 5177 H HH11 . ARG Bxp B    34  ? 50.41  -11.71  15.111  1    41.059  ? 2115 B 1 c
ATOM 5178 H HH12 . ARG Bxp B    34  ? 51.118 -13.045 15.359  1    41.063  ? 2115 B 1 c
ATOM 5179 H HH21 . ARG Bxp B    34  ? 54.11  -11.373 15.037  1    38.055  ? 2115 B 1 c
ATOM 5180 H HH22 . ARG Bxp B    34  ? 53.352 -12.484 14.31   1    38.099  ? 2115 B 1 c
ATOM 5181 N N    . ALA Bxp B    35  ? 50.776 -11.517 22.193  1    39.72   ? 2116 B 1 .
ATOM 5182 C CA   . ALA Bxp B    35  ? 49.678 -11.148 23.067  1    38.354  ? 2116 B 1 .
ATOM 5183 C C    . ALA Bxp B    35  ? 50.139 -10.04  24.006  1    35.666  ? 2116 B 1 .
ATOM 5184 O O    . ALA Bxp B    35  ? 49.56  -8.964  24.016  1    36.657  ? 2116 B 1 .
ATOM 5185 C CB   . ALA Bxp B    35  ? 49.188 -12.352 23.839  1    41.393  ? 2116 B 1 .
ATOM 5186 H H    . ALA Bxp B    35  ? 51.021 -12.395 22.124  1    39.132  ? 2116 B 1 c
ATOM 5187 H HA   . ALA Bxp B    35  ? 48.934 -10.793 22.505  1    38.618  ? 2116 B 1 c
ATOM 5188 H HB3  . ALA Bxp B    35  ? 48.373 -12.123 24.318  1    40.431  ? 2116 B 1 c
ATOM 5189 H HB2  . ALA Bxp B    35  ? 49.866 -12.632 24.475  1    40.321  ? 2116 B 1 c
ATOM 5190 H HB1  . ALA Bxp B    35  ? 49.004 -13.081 23.224  1    40.424  ? 2116 B 1 c
ATOM 5191 N N    . VAL Bxp B    36  ? 51.206 -10.314 24.764  1    34.548  ? 2117 B 1 .
ATOM 5192 C CA   . VAL Bxp B    36  ? 51.689 -9.431  25.817  1    33.312  ? 2117 B 1 .
ATOM 5193 C C    . VAL Bxp B    36  ? 51.976 -8.042  25.269  1    33.48   ? 2117 B 1 .
ATOM 5194 O O    . VAL Bxp B    36  ? 51.513 -7.049  25.823  1    34.738  ? 2117 B 1 .
ATOM 5195 C CB   . VAL Bxp B    36  ? 52.977 -9.977  26.448  1    31.517  ? 2117 B 1 .
ATOM 5196 C CG1  . VAL Bxp B    36  ? 53.632 -8.941  27.346  1    30.908  ? 2117 B 1 .
ATOM 5197 C CG2  . VAL Bxp B    36  ? 52.731 -11.286 27.179  1    32.229  ? 2117 B 1 .
ATOM 5198 H H    . VAL Bxp B    36  ? 51.662 -11.091 24.608  1    34.597  ? 2117 B 1 c
ATOM 5199 H HA   . VAL Bxp B    36  ? 51.002 -9.364  26.508  1    33.252  ? 2117 B 1 c
ATOM 5200 H HB   . VAL Bxp B    36  ? 53.602 -10.166 25.709  1    31.881  ? 2117 B 1 c
ATOM 5201 H HG11 . VAL Bxp B    36  ? 52.946 -8.43   27.809  1    31.115  ? 2117 B 1 c
ATOM 5202 H HG12 . VAL Bxp B    36  ? 54.176 -8.341  26.809  1    31.106  ? 2117 B 1 c
ATOM 5203 H HG13 . VAL Bxp B    36  ? 54.196 -9.388  27.999  1    31.102  ? 2117 B 1 c
ATOM 5204 H HG21 . VAL Bxp B    36  ? 53.563 -11.786 27.236  1    32.025  ? 2117 B 1 c
ATOM 5205 H HG22 . VAL Bxp B    36  ? 52.071 -11.812 26.698  1    32.056  ? 2117 B 1 c
ATOM 5206 H HG23 . VAL Bxp B    36  ? 52.405 -11.1   28.075  1    32.02   ? 2117 B 1 c
ATOM 5207 N N    . LEU Bxp B    37  ? 52.813 -8.004  24.231  1    33.652  ? 2118 B 1 .
ATOM 5208 C CA   . LEU Bxp B    37  ? 53.235 -6.751  23.652  1    35.167  ? 2118 B 1 .
ATOM 5209 C C    . LEU Bxp B    37  ? 51.979 -6.03   23.199  1    36.18   ? 2118 B 1 .
ATOM 5210 O O    . LEU Bxp B    37  ? 51.747 -4.909  23.611  1    39.947  ? 2118 B 1 .
ATOM 5211 C CB   . LEU Bxp B    37  ? 54.218 -6.959  22.501  1    38.576  ? 2118 B 1 .
ATOM 5212 C CG   . LEU Bxp B    37  ? 55.604 -7.51   22.859  1    40.856  ? 2118 B 1 .
ATOM 5213 C CD1  . LEU Bxp B    37  ? 56.534 -7.484  21.656  1    41.93   ? 2118 B 1 .
ATOM 5214 C CD2  . LEU Bxp B    37  ? 56.216 -6.731  24.008  1    41.952  ? 2118 B 1 .
ATOM 5215 H H    . LEU Bxp B    37  ? 53.129 -8.784  23.874  1    33.947  ? 2118 B 1 c
ATOM 5216 H HA   . LEU Bxp B    37  ? 53.668 -6.212  24.36   1    35.775  ? 2118 B 1 c
ATOM 5217 H HB3  . LEU Bxp B    37  ? 54.342 -6.09   22.055  1    38.218  ? 2118 B 1 c
ATOM 5218 H HB2  . LEU Bxp B    37  ? 53.801 -7.572  21.853  1    38.226  ? 2118 B 1 c
ATOM 5219 H HG   . LEU Bxp B    37  ? 55.495 -8.452  23.146  1    40.783  ? 2118 B 1 c
ATOM 5220 H HD11 . LEU Bxp B    37  ? 56.419 -8.303  21.146  1    41.464  ? 2118 B 1 c
ATOM 5221 H HD12 . LEU Bxp B    37  ? 57.456 -7.419  21.955  1    41.536  ? 2118 B 1 c
ATOM 5222 H HD13 . LEU Bxp B    37  ? 56.321 -6.72   21.095  1    41.45   ? 2118 B 1 c
ATOM 5223 H HD21 . LEU Bxp B    37  ? 55.96  -7.141  24.851  1    41.586  ? 2118 B 1 c
ATOM 5224 H HD22 . LEU Bxp B    37  ? 55.897 -5.813  23.986  1    41.535  ? 2118 B 1 c
ATOM 5225 H HD23 . LEU Bxp B    37  ? 57.183 -6.734  23.929  1    41.661  ? 2118 B 1 c
ATOM 5226 N N    . ASP Bxp B    38  ? 51.141 -6.711  22.413  1    38.954  ? 2119 B 1 .
ATOM 5227 C CA   . ASP Bxp B    38  ? 49.955 -6.096  21.832  1    40.326  ? 2119 B 1 .
ATOM 5228 C C    . ASP Bxp B    38  ? 49.165 -5.326  22.878  1    41.8    ? 2119 B 1 .
ATOM 5229 O O    . ASP Bxp B    38  ? 48.647 -4.252  22.595  1    43.055  ? 2119 B 1 .
ATOM 5230 C CB   . ASP Bxp B    38  ? 49.011 -7.098  21.183  1    40.605  ? 2119 B 1 .
ATOM 5231 C CG   . ASP Bxp B    38  ? 48.98  -7.014  19.671  1    40.805  ? 2119 B 1 .
ATOM 5232 O OD1  . ASP Bxp B    38  ? 48.634 -5.948  19.17   1    44.339  ? 2119 B 1 .
ATOM 5233 O OD2  . ASP Bxp B    38  ? 49.336 -7.994  19.019  1    44.705  ? 2119 B 1 .
ATOM 5234 H H    . ASP Bxp B    38  ? 51.318 -7.587  22.225  1    38.543  ? 2119 B 1 c
ATOM 5235 H HA   . ASP Bxp B    38  ? 50.25  -5.462  21.14   1    40.395  ? 2119 B 1 c
ATOM 5236 H HB3  . ASP Bxp B    38  ? 48.1   -6.935  21.506  1    40.59   ? 2119 B 1 c
ATOM 5237 H HB2  . ASP Bxp B    38  ? 49.256 -8.007  21.444  1    40.557  ? 2119 B 1 c
ATOM 5238 N N    . ASN Bxp B    39  ? 49.031 -5.911  24.067  1    44.708  ? 2120 B 1 .
ATOM 5239 C CA   . ASN Bxp B    39  ? 48.26  -5.292  25.125  1    47.941  ? 2120 B 1 .
ATOM 5240 C C    . ASN Bxp B    39  ? 49.123 -4.195  25.756  1    45.505  ? 2120 B 1 .
ATOM 5241 O O    . ASN Bxp B    39  ? 48.655 -3.086  26.003  1    44.648  ? 2120 B 1 .
ATOM 5242 C CB   . ASN Bxp B    39  ? 47.684 -6.362  26.052  1    50.668  ? 2120 B 1 .
ATOM 5243 C CG   . ASN Bxp B    39  ? 47.273 -5.786  27.385  1    57.888  ? 2120 B 1 .
ATOM 5244 O OD1  . ASN Bxp B    39  ? 46.301 -5.026  27.48   1    59.551  ? 2120 B 1 .
ATOM 5245 N ND2  . ASN Bxp B    39  ? 48.013 -6.13   28.428  1    63.786  ? 2120 B 1 .
ATOM 5246 H H    . ASN Bxp B    39  ? 49.423 -6.722  24.221  1    44.664  ? 2120 B 1 c
ATOM 5247 H HA   . ASN Bxp B    39  ? 47.49  -4.849  24.706  1    47.191  ? 2120 B 1 c
ATOM 5248 H HB3  . ASN Bxp B    39  ? 48.354 -7.06   26.197  1    51.612  ? 2120 B 1 c
ATOM 5249 H HB2  . ASN Bxp B    39  ? 46.905 -6.773  25.626  1    51.6    ? 2120 B 1 c
ATOM 5250 H HD21 . ASN Bxp B    39  ? 47.647 -6.572  29.104  1    61.909  ? 2120 B 1 c
ATOM 5251 H HD22 . ASN Bxp B    39  ? 48.874 -5.917  28.448  1    61.909  ? 2120 B 1 c
ATOM 5252 N N    . TYR Bxp B    40  ? 50.402 -4.501  25.998  1    45.888  ? 2121 B 1 .
ATOM 5253 C CA   . TYR Bxp B    40  ? 51.326 -3.527  26.569  1    44.327  ? 2121 B 1 .
ATOM 5254 C C    . TYR Bxp B    40  ? 51.283 -2.248  25.742  1    41.338  ? 2121 B 1 .
ATOM 5255 O O    . TYR Bxp B    40  ? 51.028 -1.176  26.277  1    44.077  ? 2121 B 1 .
ATOM 5256 C CB   . TYR Bxp B    40  ? 52.756 -4.075  26.665  1    43.053  ? 2121 B 1 .
ATOM 5257 C CG   . TYR Bxp B    40  ? 53.853 -3.047  26.904  1    42.015  ? 2121 B 1 .
ATOM 5258 C CD1  . TYR Bxp B    40  ? 54.059 -2.487  28.158  1    42.738  ? 2121 B 1 .
ATOM 5259 C CD2  . TYR Bxp B    40  ? 54.705 -2.66   25.876  1    43.836  ? 2121 B 1 .
ATOM 5260 C CE1  . TYR Bxp B    40  ? 55.078 -1.572  28.383  1    42.491  ? 2121 B 1 .
ATOM 5261 C CE2  . TYR Bxp B    40  ? 55.712 -1.733  26.084  1    44.212  ? 2121 B 1 .
ATOM 5262 C CZ   . TYR Bxp B    40  ? 55.906 -1.199  27.342  1    42.005  ? 2121 B 1 .
ATOM 5263 O OH   . TYR Bxp B    40  ? 56.912 -0.304  27.51   1    44.428  ? 2121 B 1 .
ATOM 5264 H H    . TYR Bxp B    40  ? 50.708 -5.341  25.81   1    45.418  ? 2121 B 1 c
ATOM 5265 H HA   . TYR Bxp B    40  ? 51.015 -3.312  27.489  1    43.827  ? 2121 B 1 c
ATOM 5266 H HB3  . TYR Bxp B    40  ? 52.956 -4.556  25.833  1    43.047  ? 2121 B 1 c
ATOM 5267 H HB2  . TYR Bxp B    40  ? 52.782 -4.734  27.394  1    43.088  ? 2121 B 1 c
ATOM 5268 H HD1  . TYR Bxp B    40  ? 53.504 -2.744  28.877  1    42.532  ? 2121 B 1 c
ATOM 5269 H HD2  . TYR Bxp B    40  ? 54.585 -3.026  25.014  1    43.474  ? 2121 B 1 c
ATOM 5270 H HE1  . TYR Bxp B    40  ? 55.202 -1.201  29.24   1    42.463  ? 2121 B 1 c
ATOM 5271 H HE2  . TYR Bxp B    40  ? 56.28  -1.486  25.374  1    43.587  ? 2121 B 1 c
ATOM 5272 H HH   . TYR Bxp B    40  ? 56.935 -0.019  28.283  0    33.14   ? 2121 B 1 c
ATOM 5273 N N    . TYR Bxp B    41  ? 51.547 -2.379  24.441  1    38.694  ? 2122 B 1 .
ATOM 5274 C CA   . TYR Bxp B    41  ? 51.55  -1.238  23.548  1    36.19   ? 2122 B 1 .
ATOM 5275 C C    . TYR Bxp B    41  ? 50.148 -0.657  23.515  1    35.688  ? 2122 B 1 .
ATOM 5276 O O    . TYR Bxp B    41  ? 49.999 0.544   23.643  1    36.904  ? 2122 B 1 .
ATOM 5277 C CB   . TYR Bxp B    41  ? 52.069 -1.602  22.157  1    36.558  ? 2122 B 1 .
ATOM 5278 C CG   . TYR Bxp B    41  ? 53.569 -1.86   22.136  1    36.569  ? 2122 B 1 .
ATOM 5279 C CD1  . TYR Bxp B    41  ? 54.455 -0.855  22.5    1    37.688  ? 2122 B 1 .
ATOM 5280 C CD2  . TYR Bxp B    41  ? 54.092 -3.089  21.754  1    34.035  ? 2122 B 1 .
ATOM 5281 C CE1  . TYR Bxp B    41  ? 55.821 -1.062  22.495  1    37.708  ? 2122 B 1 .
ATOM 5282 C CE2  . TYR Bxp B    41  ? 55.458 -3.303  21.72   1    34.024  ? 2122 B 1 .
ATOM 5283 C CZ   . TYR Bxp B    41  ? 56.323 -2.282  22.091  1    35.981  ? 2122 B 1 .
ATOM 5284 O OH   . TYR Bxp B    41  ? 57.685 -2.371  22.126  1    37.275  ? 2122 B 1 .
ATOM 5285 H H    . TYR Bxp B    41  ? 51.733 -3.206  24.1    1    38.781  ? 2122 B 1 c
ATOM 5286 H HA   . TYR Bxp B    41  ? 52.156 -0.552  23.933  1    36.704  ? 2122 B 1 c
ATOM 5287 H HB3  . TYR Bxp B    41  ? 51.857 -0.873  21.539  1    36.394  ? 2122 B 1 c
ATOM 5288 H HB2  . TYR Bxp B    41  ? 51.6   -2.41   21.848  1    36.45   ? 2122 B 1 c
ATOM 5289 H HD1  . TYR Bxp B    41  ? 54.118 -0.015  22.769  1    37.374  ? 2122 B 1 c
ATOM 5290 H HD2  . TYR Bxp B    41  ? 53.507 -3.783  21.494  1    34.694  ? 2122 B 1 c
ATOM 5291 H HE1  . TYR Bxp B    41  ? 56.408 -0.367  22.741  1    37.254  ? 2122 B 1 c
ATOM 5292 H HE2  . TYR Bxp B    41  ? 55.801 -4.142  21.461  1    34.534  ? 2122 B 1 c
ATOM 5293 H HH   . TYR Bxp B    41  ? 58.016 -1.908  22.267  0    28.11   ? 2122 B 1 c
ATOM 5294 N N    . ALA Bxp B    42  ? 49.126 -1.509  23.422  1    37.824  ? 2123 B 1 .
ATOM 5295 C CA   . ALA Bxp B    42  ? 47.758 -1.015  23.39   1    37.891  ? 2123 B 1 .
ATOM 5296 C C    . ALA Bxp B    42  ? 47.569 -0.011  24.525  1    38.807  ? 2123 B 1 .
ATOM 5297 O O    . ALA Bxp B    42  ? 46.996 1.05    24.314  1    36.062  ? 2123 B 1 .
ATOM 5298 C CB   . ALA Bxp B    42  ? 46.761 -2.157  23.46   1    36.876  ? 2123 B 1 .
ATOM 5299 H H    . ALA Bxp B    42  ? 49.278 -2.409  23.369  1    37.316  ? 2123 B 1 c
ATOM 5300 H HA   . ALA Bxp B    42  ? 47.629 -0.53   22.529  1    37.845  ? 2123 B 1 c
ATOM 5301 H HB3  . ALA Bxp B    42  ? 45.886 -1.812  23.707  1    37.224  ? 2123 B 1 c
ATOM 5302 H HB2  . ALA Bxp B    42  ? 47.048 -2.803  24.124  1    37.327  ? 2123 B 1 c
ATOM 5303 H HB1  . ALA Bxp B    42  ? 46.699 -2.592  22.593  1    37.241  ? 2123 B 1 c
ATOM 5304 N N    . LYS Bxp B    43  ? 48.103 -0.338  25.71   1    43.812  ? 2124 B 1 .
ATOM 5305 C CA   . LYS Bxp B    43  ? 47.99  0.517   26.882  1    47.66   ? 2124 B 1 .
ATOM 5306 C C    . LYS Bxp B    43  ? 48.687 1.846   26.622  1    44.056  ? 2124 B 1 .
ATOM 5307 O O    . LYS Bxp B    43  ? 48.168 2.893   26.972  1    43.516  ? 2124 B 1 .
ATOM 5308 C CB   . LYS Bxp B    43  ? 48.575 -0.124  28.147  1    56.708  ? 2124 B 1 .
ATOM 5309 C CG   . LYS Bxp B    43  ? 47.677 -1.087  28.917  1    65.757  ? 2124 B 1 .
ATOM 5310 C CD   . LYS Bxp B    43  ? 48.352 -1.686  30.153  1    77.439  ? 2124 B 1 .
ATOM 5311 C CE   . LYS Bxp B    43  ? 47.507 -2.663  30.93   1    86.216  ? 2124 B 1 .
ATOM 5312 N NZ   . LYS Bxp B    43  ? 47.218 -3.913  30.208  1    89.761  ? 2124 B 1 .
ATOM 5313 H H    . LYS Bxp B    43  ? 48.543 -1.134  25.794  1    43.419  ? 2124 B 1 c
ATOM 5314 H HA   . LYS Bxp B    43  ? 47.028 0.695   27.04   1    47.701  ? 2124 B 1 c
ATOM 5315 H HB3  . LYS Bxp B    43  ? 48.84  0.595   28.76   1    56.275  ? 2124 B 1 c
ATOM 5316 H HB2  . LYS Bxp B    43  ? 49.39  -0.607  27.898  1    56.19   ? 2124 B 1 c
ATOM 5317 H HG3  . LYS Bxp B    43  ? 47.406 -1.812  28.314  1    66.107  ? 2124 B 1 c
ATOM 5318 H HG2  . LYS Bxp B    43  ? 46.867 -0.606  29.195  1    65.995  ? 2124 B 1 c
ATOM 5319 H HD3  . LYS Bxp B    43  ? 48.614 -0.952  30.751  1    76.485  ? 2124 B 1 c
ATOM 5320 H HD2  . LYS Bxp B    43  ? 49.176 -2.138  29.868  1    76.485  ? 2124 B 1 c
ATOM 5321 H HE3  . LYS Bxp B    43  ? 46.663 -2.236  31.162  1    84.933  ? 2124 B 1 c
ATOM 5322 H HE2  . LYS Bxp B    43  ? 47.965 -2.884  31.761  1    84.933  ? 2124 B 1 c
ATOM 5323 H HZ1  . LYS Bxp B    43  ? 47.916 -4.48   30.307  1    88.303  ? 2124 B 1 c
ATOM 5324 H HZ2  . LYS Bxp B    43  ? 47.086 -3.748  29.329  1    87.882  ? 2124 B 1 c
ATOM 5325 H HZ3  . LYS Bxp B    43  ? 46.473 -4.297  30.552  1    88.44   ? 2124 B 1 c
ATOM 5326 N N    . GLN Bxp B    44  ? 49.854 1.8     25.986  1    45.833  ? 2125 B 1 .
ATOM 5327 C CA   . GLN Bxp B    44  ? 50.649 2.995   25.745  1    50.631  ? 2125 B 1 .
ATOM 5328 C C    . GLN Bxp B    44  ? 50.054 3.862   24.63   1    50.198  ? 2125 B 1 .
ATOM 5329 O O    . GLN Bxp B    44  ? 50.577 4.941   24.342  1    51.923  ? 2125 B 1 .
ATOM 5330 C CB   . GLN Bxp B    44  ? 52.054 2.528   25.378  1    54.387  ? 2125 B 1 .
ATOM 5331 C CG   . GLN Bxp B    44  ? 53.183 3.307   26.041  1    58.002  ? 2125 B 1 .
ATOM 5332 C CD   . GLN Bxp B    44  ? 54.386 2.421   26.258  1    62.804  ? 2125 B 1 .
ATOM 5333 O OE1  . GLN Bxp B    44  ? 55.442 2.593   25.636  1    77.11   ? 2125 B 1 .
ATOM 5334 N NE2  . GLN Bxp B    44  ? 54.2   1.408   27.093  1    60.841  ? 2125 B 1 .
ATOM 5335 H H    . GLN Bxp B    44  ? 50.171 0.994   25.695  1    46.477  ? 2125 B 1 c
ATOM 5336 H HA   . GLN Bxp B    44  ? 50.683 3.525   26.582  1    50.246  ? 2125 B 1 c
ATOM 5337 H HB3  . GLN Bxp B    44  ? 52.158 2.594   24.407  1    54.079  ? 2125 B 1 c
ATOM 5338 H HB2  . GLN Bxp B    44  ? 52.141 1.583   25.617  1    54.249  ? 2125 B 1 c
ATOM 5339 H HG3  . GLN Bxp B    44  ? 52.88  3.659   26.905  1    58.154  ? 2125 B 1 c
ATOM 5340 H HG2  . GLN Bxp B    44  ? 53.436 4.067   25.474  1    58.204  ? 2125 B 1 c
ATOM 5341 H HE21 . GLN Bxp B    44  ? 53.839 0.653   26.8    1    61.237  ? 2125 B 1 c
ATOM 5342 H HE22 . GLN Bxp B    44  ? 54.437 1.488   27.944  1    61.391  ? 2125 B 1 c
ATOM 5343 N N    . LYS Bxp B    45  ? 48.971 3.38    23.999  1    45.613  ? 2126 B 1 .
ATOM 5344 C CA   . LYS Bxp B    45  ? 48.315 4.055   22.887  1    41.058  ? 2126 B 1 .
ATOM 5345 C C    . LYS Bxp B    45  ? 49.325 4.417   21.8    1    34.359  ? 2126 B 1 .
ATOM 5346 O O    . LYS Bxp B    45  ? 49.421 5.573   21.416  1    32.399  ? 2126 B 1 .
ATOM 5347 C CB   . LYS Bxp B    45  ? 47.551 5.302   23.352  1    42.573  ? 2126 B 1 .
ATOM 5348 C CG   . LYS Bxp B    45  ? 46.11  5.117   23.814  1    44.622  ? 2126 B 1 .
ATOM 5349 C CD   . LYS Bxp B    45  ? 45.297 6.389   23.582  1    49.775  ? 2126 B 1 .
ATOM 5350 C CE   . LYS Bxp B    45  ? 43.885 6.39    24.085  1    55.791  ? 2126 B 1 .
ATOM 5351 N NZ   . LYS Bxp B    45  ? 43.19  7.609   23.644  1    58.395  ? 2126 B 1 .
ATOM 5352 H H    . LYS Bxp B    45  ? 48.629 2.577   24.267  1    45.545  ? 2126 B 1 c
ATOM 5353 H HA   . LYS Bxp B    45  ? 47.658 3.425   22.496  1    40.851  ? 2126 B 1 c
ATOM 5354 H HB3  . LYS Bxp B    45  ? 47.546 5.949   22.616  1    42.728  ? 2126 B 1 c
ATOM 5355 H HB2  . LYS Bxp B    45  ? 48.053 5.708   24.091  1    42.836  ? 2126 B 1 c
ATOM 5356 H HG3  . LYS Bxp B    45  ? 46.105 4.894   24.771  1    45.247  ? 2126 B 1 c
ATOM 5357 H HG2  . LYS Bxp B    45  ? 45.704 4.374   23.317  1    45.221  ? 2126 B 1 c
ATOM 5358 H HD3  . LYS Bxp B    45  ? 45.283 6.569   22.617  1    49.848  ? 2126 B 1 c
ATOM 5359 H HD2  . LYS Bxp B    45  ? 45.777 7.135   24.003  1    49.847  ? 2126 B 1 c
ATOM 5360 H HE3  . LYS Bxp B    45  ? 43.88  6.352   25.058  1    54.944  ? 2126 B 1 c
ATOM 5361 H HE2  . LYS Bxp B    45  ? 43.412 5.61    23.744  1    54.944  ? 2126 B 1 c
ATOM 5362 H HZ1  . LYS Bxp B    45  ? 43.15  7.629   22.739  1    57.514  ? 2126 B 1 c
ATOM 5363 H HZ2  . LYS Bxp B    45  ? 43.637 8.34    23.939  1    57.52   ? 2126 B 1 c
ATOM 5364 H HZ3  . LYS Bxp B    45  ? 42.348 7.62    23.979  1    57.557  ? 2126 B 1 c
ATOM 5365 N N    . ILE Bxp B    46  ? 50.064 3.43    21.289  1    31.466  ? 2127 B 1 .
ATOM 5366 C CA   . ILE Bxp B    46  ? 51.058 3.726   20.271  1    32.237  ? 2127 B 1 .
ATOM 5367 C C    . ILE Bxp B    46  ? 50.423 3.602   18.893  1    30.41   ? 2127 B 1 .
ATOM 5368 O O    . ILE Bxp B    46  ? 49.538 2.776   18.69   1    30.653  ? 2127 B 1 .
ATOM 5369 C CB   . ILE Bxp B    46  ? 52.352 2.884   20.361  1    33.363  ? 2127 B 1 .
ATOM 5370 C CG1  . ILE Bxp B    46  ? 52.1   1.388   20.266  1    32.7    ? 2127 B 1 .
ATOM 5371 C CG2  . ILE Bxp B    46  ? 53.189 3.228   21.594  1    34.577  ? 2127 B 1 .
ATOM 5372 C CD1  . ILE Bxp B    46  ? 52.096 0.854   18.849  1    32.928  ? 2127 B 1 .
ATOM 5373 H H    . ILE Bxp B    46  ? 49.946 2.569   21.574  1    32.432  ? 2127 B 1 c
ATOM 5374 H HA   . ILE Bxp B    46  ? 51.32  4.658   20.389  1    31.953  ? 2127 B 1 c
ATOM 5375 H HB   . ILE Bxp B    46  ? 52.893 3.126   19.584  1    33.228  ? 2127 B 1 c
ATOM 5376 H HG12 . ILE Bxp B    46  ? 51.239 1.183   20.681  1    32.918  ? 2127 B 1 c
ATOM 5377 H HG13 . ILE Bxp B    46  ? 52.795 0.922   20.772  1    32.949  ? 2127 B 1 c
ATOM 5378 H HG21 . ILE Bxp B    46  ? 54.132 3.113   21.389  1    34.235  ? 2127 B 1 c
ATOM 5379 H HG22 . ILE Bxp B    46  ? 52.945 2.641   22.328  1    34.316  ? 2127 B 1 c
ATOM 5380 H HG23 . ILE Bxp B    46  ? 53.026 4.151   21.853  1    34.213  ? 2127 B 1 c
ATOM 5381 H HD11 . ILE Bxp B    46  ? 51.182 0.626   18.592  1    32.841  ? 2127 B 1 c
ATOM 5382 H HD12 . ILE Bxp B    46  ? 52.653 0.055   18.803  1    32.85   ? 2127 B 1 c
ATOM 5383 H HD13 . ILE Bxp B    46  ? 52.445 1.527   18.235  1    32.826  ? 2127 B 1 c
ATOM 5384 N N    . THR Bxp B    47  ? 50.908 4.466   17.986  1    29.49   ? 2128 B 1 .
ATOM 5385 C CA   . THR Bxp B    47  ? 50.611 4.45    16.564  1    28.205  ? 2128 B 1 .
ATOM 5386 C C    . THR Bxp B    47  ? 51.894 4.094   15.826  1    25.933  ? 2128 B 1 .
ATOM 5387 O O    . THR Bxp B    47  ? 52.927 4.697   16.066  1    26.014  ? 2128 B 1 .
ATOM 5388 C CB   . THR Bxp B    47  ? 50.093 5.815   16.096  1    28.903  ? 2128 B 1 .
ATOM 5389 O OG1  . THR Bxp B    47  ? 48.935 6.173   16.849  1    29.547  ? 2128 B 1 .
ATOM 5390 C CG2  . THR Bxp B    47  ? 49.73  5.83    14.621  1    28.674  ? 2128 B 1 .
ATOM 5391 H H    . THR Bxp B    47  ? 51.472 5.119   18.287  1    29.447  ? 2128 B 1 c
ATOM 5392 H HA   . THR Bxp B    47  ? 49.93  3.768   16.388  1    28.169  ? 2128 B 1 c
ATOM 5393 H HB   . THR Bxp B    47  ? 50.795 6.491   16.25   1    28.839  ? 2128 B 1 c
ATOM 5394 H HG1  . THR Bxp B    47  ? 48.335 5.629   16.74   0    21.67   ? 2128 B 1 c
ATOM 5395 H HG21 . THR Bxp B    47  ? 49.465 6.728   14.362  1    28.758  ? 2128 B 1 c
ATOM 5396 H HG22 . THR Bxp B    47  ? 48.992 5.219   14.462  1    28.817  ? 2128 B 1 c
ATOM 5397 H HG23 . THR Bxp B    47  ? 50.496 5.555   14.092  1    28.754  ? 2128 B 1 c
ATOM 5398 N N    . VAL Bxp B    48  ? 51.817 3.132   14.911  1    25.365  ? 2129 B 1 .
ATOM 5399 C CA   . VAL Bxp B    48  ? 52.972 2.759   14.121  1    26.062  ? 2129 B 1 .
ATOM 5400 C C    . VAL Bxp B    48  ? 52.782 3.328   12.723  1    25.477  ? 2129 B 1 .
ATOM 5401 O O    . VAL Bxp B    48  ? 51.704 3.235   12.144  1    24.556  ? 2129 B 1 .
ATOM 5402 C CB   . VAL Bxp B    48  ? 53.203 1.239   14.056  1    27.939  ? 2129 B 1 .
ATOM 5403 C CG1  . VAL Bxp B    48  ? 54.618 0.9     13.588  1    28.261  ? 2129 B 1 .
ATOM 5404 C CG2  . VAL Bxp B    48  ? 52.902 0.562   15.388  1    28.072  ? 2129 B 1 .
ATOM 5405 H H    . VAL Bxp B    48  ? 51.026 2.696   14.773  1    25.693  ? 2129 B 1 c
ATOM 5406 H HA   . VAL Bxp B    48  ? 53.762 3.17    14.519  1    26.156  ? 2129 B 1 c
ATOM 5407 H HB   . VAL Bxp B    48  ? 52.574 0.877   13.389  1    27.65   ? 2129 B 1 c
ATOM 5408 H HG11 . VAL Bxp B    48  ? 55.263 1.24    14.229  1    28.149  ? 2129 B 1 c
ATOM 5409 H HG12 . VAL Bxp B    48  ? 54.781 1.306   12.72   1    28.149  ? 2129 B 1 c
ATOM 5410 H HG13 . VAL Bxp B    48  ? 54.714 -0.065  13.514  1    28.159  ? 2129 B 1 c
ATOM 5411 H HG21 . VAL Bxp B    48  ? 53.335 -0.307  15.418  1    28.028  ? 2129 B 1 c
ATOM 5412 H HG22 . VAL Bxp B    48  ? 51.941 0.448   15.485  1    28.019  ? 2129 B 1 c
ATOM 5413 H HG23 . VAL Bxp B    48  ? 53.236 1.114   16.115  1    28.035  ? 2129 B 1 c
ATOM 5414 N N    . GLY Bxp B    49  ? 53.861 3.903   12.197  1    25.711  ? 2130 B 1 .
ATOM 5415 C CA   . GLY Bxp B    49  ? 53.87  4.439   10.854  1    26.08   ? 2130 B 1 .
ATOM 5416 C C    . GLY Bxp B    49  ? 54.715 3.559   9.948   1    26.725  ? 2130 B 1 .
ATOM 5417 O O    . GLY Bxp B    49  ? 55.712 2.987   10.377  1    26.86   ? 2130 B 1 .
ATOM 5418 H H    . GLY Bxp B    49  ? 54.624 3.963   12.696  1    25.745  ? 2130 B 1 c
ATOM 5419 H HA3  . GLY Bxp B    49  ? 54.243 5.349   10.871  1    26.188  ? 2130 B 1 c
ATOM 5420 H HA2  . GLY Bxp B    49  ? 52.948 4.49    10.511  1    26.175  ? 2130 B 1 c
ATOM 5421 N N    . LEU Bxp B    50  ? 54.31  3.485   8.682   1    28.268  ? 2131 B 1 .
ATOM 5422 C CA   . LEU Bxp B    50  ? 55.035 2.72    7.684   1    27.811  ? 2131 B 1 .
ATOM 5423 C C    . LEU Bxp B    50  ? 55.101 3.546   6.399   1    27.281  ? 2131 B 1 .
ATOM 5424 O O    . LEU Bxp B    50  ? 54.069 4.003   5.889   1    26.98   ? 2131 B 1 .
ATOM 5425 C CB   . LEU Bxp B    50  ? 54.332 1.366   7.555   1    27.189  ? 2131 B 1 .
ATOM 5426 C CG   . LEU Bxp B    50  ? 54.43  0.641   6.216   1    26.639  ? 2131 B 1 .
ATOM 5427 C CD1  . LEU Bxp B    50  ? 55.854 0.543   5.747   1    27.869  ? 2131 B 1 .
ATOM 5428 C CD2  . LEU Bxp B    50  ? 53.827 -0.729  6.348   1    26.263  ? 2131 B 1 .
ATOM 5429 H H    . LEU Bxp B    50  ? 53.552 3.927   8.428   1    27.761  ? 2131 B 1 c
ATOM 5430 H HA   . LEU Bxp B    50  ? 55.953 2.573   8.013   1    27.714  ? 2131 B 1 c
ATOM 5431 H HB3  . LEU Bxp B    50  ? 53.379 1.499   7.762   1    27.21   ? 2131 B 1 c
ATOM 5432 H HB2  . LEU Bxp B    50  ? 54.694 0.772   8.251   1    27.234  ? 2131 B 1 c
ATOM 5433 H HG   . LEU Bxp B    50  ? 53.91  1.149   5.542   1    26.896  ? 2131 B 1 c
ATOM 5434 H HD11 . LEU Bxp B    50  ? 55.995 1.158   5.007   1    27.518  ? 2131 B 1 c
ATOM 5435 H HD12 . LEU Bxp B    50  ? 56.04  -0.363  5.451   1    27.595  ? 2131 B 1 c
ATOM 5436 H HD13 . LEU Bxp B    50  ? 56.455 0.771   6.475   1    27.519  ? 2131 B 1 c
ATOM 5437 H HD21 . LEU Bxp B    50  ? 53.101 -0.704  6.993   1    26.448  ? 2131 B 1 c
ATOM 5438 H HD22 . LEU Bxp B    50  ? 54.503 -1.357  6.652   1    26.409  ? 2131 B 1 c
ATOM 5439 H HD23 . LEU Bxp B    50  ? 53.482 -1.017  5.486   1    26.395  ? 2131 B 1 c
ATOM 5440 N N    . THR Bxp B    51  ? 56.339 3.772   5.934   1    25.993  ? 2132 B 1 .
ATOM 5441 C CA   . THR Bxp B    51  ? 56.6   4.639   4.803   1    26.287  ? 2132 B 1 .
ATOM 5442 C C    . THR Bxp B    51  ? 56.913 3.77    3.614   1    27.495  ? 2132 B 1 .
ATOM 5443 O O    . THR Bxp B    51  ? 57.937 3.109   3.6     1    28.674  ? 2132 B 1 .
ATOM 5444 C CB   . THR Bxp B    51  ? 57.791 5.551   5.044   1    26.573  ? 2132 B 1 .
ATOM 5445 O OG1  . THR Bxp B    51  ? 58.981 4.777   4.971   1    24.406  ? 2132 B 1 .
ATOM 5446 C CG2  . THR Bxp B    51  ? 57.735 6.176   6.415   1    28.961  ? 2132 B 1 .
ATOM 5447 H H    . THR Bxp B    51  ? 57.048 3.363   6.34    1    26.395  ? 2132 B 1 c
ATOM 5448 H HA   . THR Bxp B    51  ? 55.807 5.184   4.62    1    26.581  ? 2132 B 1 c
ATOM 5449 H HB   . THR Bxp B    51  ? 57.817 6.261   4.358   1    26.5    ? 2132 B 1 c
ATOM 5450 H HG1  . THR Bxp B    51  ? 58.937 4.125   5.569   0    16.52   ? 2132 B 1 c
ATOM 5451 H HG21 . THR Bxp B    51  ? 58.29  6.974   6.431   1    28.219  ? 2132 B 1 c
ATOM 5452 H HG22 . THR Bxp B    51  ? 58.063 5.542   7.075   1    28.199  ? 2132 B 1 c
ATOM 5453 H HG23 . THR Bxp B    51  ? 56.817 6.416   6.626   1    28.21   ? 2132 B 1 c
ATOM 5454 N N    . VAL Bxp B    52  ? 56.065 3.839   2.605   1    29.286  ? 2133 B 1 .
ATOM 5455 C CA   . VAL Bxp B    52  ? 56.331 3.098   1.396   1    31.334  ? 2133 B 1 .
ATOM 5456 C C    . VAL Bxp B    52  ? 56.546 4.101   0.277   1    32.776  ? 2133 B 1 .
ATOM 5457 O O    . VAL Bxp B    52  ? 55.858 5.118   0.22    1    34.552  ? 2133 B 1 .
ATOM 5458 C CB   . VAL Bxp B    52  ? 55.166 2.155   1.09    1    33.077  ? 2133 B 1 .
ATOM 5459 C CG1  . VAL Bxp B    52  ? 53.873 2.933   0.89    1    34.705  ? 2133 B 1 .
ATOM 5460 C CG2  . VAL Bxp B    52  ? 55.482 1.284   -0.114  1    33.958  ? 2133 B 1 .
ATOM 5461 H H    . VAL Bxp B    52  ? 55.321 4.367   2.659   1    29.32   ? 2133 B 1 c
ATOM 5462 H HA   . VAL Bxp B    52  ? 57.144 2.571   1.514   1    31.484  ? 2133 B 1 c
ATOM 5463 H HB   . VAL Bxp B    52  ? 55.053 1.568   1.874   1    33.218  ? 2133 B 1 c
ATOM 5464 H HG11 . VAL Bxp B    52  ? 53.915 3.428   0.055   1    34.192  ? 2133 B 1 c
ATOM 5465 H HG12 . VAL Bxp B    52  ? 53.741 3.55    1.627   1    34.138  ? 2133 B 1 c
ATOM 5466 H HG13 . VAL Bxp B    52  ? 53.127 2.311   0.855   1    34.206  ? 2133 B 1 c
ATOM 5467 H HG21 . VAL Bxp B    52  ? 54.908 0.499   -0.106  1    33.707  ? 2133 B 1 c
ATOM 5468 H HG22 . VAL Bxp B    52  ? 56.412 1.004   -0.078  1    33.69   ? 2133 B 1 c
ATOM 5469 H HG23 . VAL Bxp B    52  ? 55.327 1.789   -0.93   1    33.716  ? 2133 B 1 c
ATOM 5470 N N    . PHE Bxp B    53  ? 57.508 3.798   -0.596  1    33.525  ? 2134 B 1 .
ATOM 5471 C CA   . PHE Bxp B    53  ? 57.767 4.622   -1.762  1    33.925  ? 2134 B 1 .
ATOM 5472 C C    . PHE Bxp B    53  ? 57.393 3.868   -3.027  1    35.827  ? 2134 B 1 .
ATOM 5473 O O    . PHE Bxp B    53  ? 57.732 2.693   -3.159  1    34.815  ? 2134 B 1 .
ATOM 5474 C CB   . PHE Bxp B    53  ? 59.241 4.961   -1.924  1    32.148  ? 2134 B 1 .
ATOM 5475 C CG   . PHE Bxp B    53  ? 59.678 6.168   -1.131  1    30.839  ? 2134 B 1 .
ATOM 5476 C CD1  . PHE Bxp B    53  ? 60.054 6.038   0.193   1    32.34   ? 2134 B 1 .
ATOM 5477 C CD2  . PHE Bxp B    53  ? 59.725 7.416   -1.723  1    31.823  ? 2134 B 1 .
ATOM 5478 C CE1  . PHE Bxp B    53  ? 60.477 7.14    0.916   1    33.644  ? 2134 B 1 .
ATOM 5479 C CE2  . PHE Bxp B    53  ? 60.146 8.517   -0.997  1    33.774  ? 2134 B 1 .
ATOM 5480 C CZ   . PHE Bxp B    53  ? 60.522 8.377   0.322   1    34.212  ? 2134 B 1 .
ATOM 5481 H H    . PHE Bxp B    53  ? 58.02  3.052   -0.462  1    33.395  ? 2134 B 1 c
ATOM 5482 H HA   . PHE Bxp B    53  ? 57.241 5.459   -1.701  1    33.903  ? 2134 B 1 c
ATOM 5483 H HB3  . PHE Bxp B    53  ? 59.425 5.123   -2.877  1    32.306  ? 2134 B 1 c
ATOM 5484 H HB2  . PHE Bxp B    53  ? 59.77  4.185   -1.639  1    32.51   ? 2134 B 1 c
ATOM 5485 H HD1  . PHE Bxp B    53  ? 60.032 5.188   0.603   1    32.303  ? 2134 B 1 c
ATOM 5486 H HD2  . PHE Bxp B    53  ? 59.475 7.515   -2.628  1    32.064  ? 2134 B 1 c
ATOM 5487 H HE1  . PHE Bxp B    53  ? 60.727 7.04    1.817   1    33.402  ? 2134 B 1 c
ATOM 5488 H HE2  . PHE Bxp B    53  ? 60.173 9.367   -1.407  1    33.386  ? 2134 B 1 c
ATOM 5489 H HZ   . PHE Bxp B    53  ? 60.799 9.123   0.817   1    33.918  ? 2134 B 1 c
ATOM 5490 N N    . ALA Bxp B    54  ? 56.768 4.587   -3.969  1    38.386  ? 2135 B 1 .
ATOM 5491 C CA   . ALA Bxp B    54  ? 56.418 4.024   -5.261  1    41.063  ? 2135 B 1 .
ATOM 5492 C C    . ALA Bxp B    54  ? 56.662 5.047   -6.369  1    43.543  ? 2135 B 1 .
ATOM 5493 O O    . ALA Bxp B    54  ? 56.133 6.157   -6.337  1    41.861  ? 2135 B 1 .
ATOM 5494 C CB   . ALA Bxp B    54  ? 54.978 3.561   -5.233  1    41.63   ? 2135 B 1 .
ATOM 5495 H H    . ALA Bxp B    54  ? 56.552 5.458   -3.798  1    38.297  ? 2135 B 1 c
ATOM 5496 H HA   . ALA Bxp B    54  ? 57.007 3.237   -5.429  1    41.072  ? 2135 B 1 c
ATOM 5497 H HB3  . ALA Bxp B    54  ? 54.854 2.841   -5.875  1    41.484  ? 2135 B 1 c
ATOM 5498 H HB2  . ALA Bxp B    54  ? 54.391 4.3     -5.464  1    41.572  ? 2135 B 1 c
ATOM 5499 H HB1  . ALA Bxp B    54  ? 54.754 3.24    -4.344  1    41.468  ? 2135 B 1 c
ATOM 5500 N N    . VAL Bxp B    55  ? 57.444 4.644   -7.377  1    47.254  ? 2136 B 1 .
ATOM 5501 C CA   . VAL Bxp B    55  ? 57.685 5.494   -8.533  1    51.17   ? 2136 B 1 .
ATOM 5502 C C    . VAL Bxp B    55  ? 57.424 4.716   -9.826  1    53.312  ? 2136 B 1 .
ATOM 5503 O O    . VAL Bxp B    55  ? 57.882 3.589   -9.994  1    55.281  ? 2136 B 1 .
ATOM 5504 C CB   . VAL Bxp B    55  ? 59.109 6.086   -8.504  1    53.093  ? 2136 B 1 .
ATOM 5505 C CG1  . VAL Bxp B    55  ? 59.19  7.32    -7.614  1    52.677  ? 2136 B 1 .
ATOM 5506 C CG2  . VAL Bxp B    55  ? 60.169 5.055   -8.107  1    56.052  ? 2136 B 1 .
ATOM 5507 H H    . VAL Bxp B    55  ? 57.832 3.817   -7.348  1    47.121  ? 2136 B 1 c
ATOM 5508 H HA   . VAL Bxp B    55  ? 57.052 6.234   -8.498  1    51.053  ? 2136 B 1 c
ATOM 5509 H HB   . VAL Bxp B    55  ? 59.316 6.377   -9.423  1    53.189  ? 2136 B 1 c
ATOM 5510 H HG11 . VAL Bxp B    55  ? 59.102 7.056   -6.683  1    52.782  ? 2136 B 1 c
ATOM 5511 H HG12 . VAL Bxp B    55  ? 58.474 7.935   -7.844  1    52.729  ? 2136 B 1 c
ATOM 5512 H HG13 . VAL Bxp B    55  ? 60.047 7.76    -7.745  1    52.782  ? 2136 B 1 c
ATOM 5513 H HG21 . VAL Bxp B    55  ? 61.048 5.377   -8.369  1    55.154  ? 2136 B 1 c
ATOM 5514 H HG22 . VAL Bxp B    55  ? 59.988 4.212   -8.555  1    55.149  ? 2136 B 1 c
ATOM 5515 H HG23 . VAL Bxp B    55  ? 60.147 4.921   -7.145  1    55.12   ? 2136 B 1 c
ATOM 5516 N N    . GLY Bxp B    56  ? 56.693 5.333   -10.758 1    55.352  ? 2137 B 1 .
ATOM 5517 C CA   . GLY Bxp B    56  ? 56.549 4.774   -12.089 1    60.009  ? 2137 B 1 .
ATOM 5518 C C    . GLY Bxp B    56  ? 55.814 3.438   -12.036 1    69.353  ? 2137 B 1 .
ATOM 5519 O O    . GLY Bxp B    56  ? 54.978 3.243   -11.158 1    72.498  ? 2137 B 1 .
ATOM 5520 H H    . GLY Bxp B    56  ? 56.263 6.113   -10.558 1    55.726  ? 2137 B 1 c
ATOM 5521 H HA3  . GLY Bxp B    56  ? 57.444 4.643   -12.48  1    60.957  ? 2137 B 1 c
ATOM 5522 H HA2  . GLY Bxp B    56  ? 56.062 5.401   -12.659 1    61.108  ? 2137 B 1 c
ATOM 5523 N N    . ARG Bxp B    57  ? 56.195 2.527   -12.953 1    80.527  ? 2138 B 1 .
ATOM 5524 C CA   . ARG Bxp B    57  ? 55.716 1.15    -13.045 1    81.527  ? 2138 B 1 .
ATOM 5525 C C    . ARG Bxp B    57  ? 55.477 0.514   -11.674 1    76.924  ? 2138 B 1 .
ATOM 5526 O O    . ARG Bxp B    57  ? 54.539 -0.27   -11.52  1    67.849  ? 2138 B 1 .
ATOM 5527 C CB   . ARG Bxp B    57  ? 56.774 0.289   -13.751 1    90.097  ? 2138 B 1 .
ATOM 5528 C CG   . ARG Bxp B    57  ? 56.909 0.502   -15.25  1    95.922  ? 2138 B 1 .
ATOM 5529 C CD   . ARG Bxp B    57  ? 55.733 -0.097  -16.01  1    100.715 ? 2138 B 1 .
ATOM 5530 N NE   . ARG Bxp B    57  ? 55.357 0.756   -17.144 1    106.991 ? 2138 B 1 .
ATOM 5531 C CZ   . ARG Bxp B    57  ? 54.12  1.127   -17.488 1    102.662 ? 2138 B 1 .
ATOM 5532 N NH1  . ARG Bxp B    57  ? 53.067 0.554   -16.93  1    102.3   ? 2138 B 1 .
ATOM 5533 N NH2  . ARG Bxp B    57  ? 53.942 2.046   -18.424 1    95.099  ? 2138 B 1 .
ATOM 5534 H H    . ARG Bxp B    57  ? 56.808 2.798   -13.574 1    77.915  ? 2138 B 1 c
ATOM 5535 H HA   . ARG Bxp B    57  ? 54.871 1.141   -13.56  1    82.124  ? 2138 B 1 c
ATOM 5536 H HB3  . ARG Bxp B    57  ? 56.56  -0.656  -13.592 1    89.276  ? 2138 B 1 c
ATOM 5537 H HB2  . ARG Bxp B    57  ? 57.644 0.466   -13.334 1    89.338  ? 2138 B 1 c
ATOM 5538 H HG3  . ARG Bxp B    57  ? 57.74  0.084   -15.564 1    95.606  ? 2138 B 1 c
ATOM 5539 H HG2  . ARG Bxp B    57  ? 56.958 1.464   -15.44  1    95.549  ? 2138 B 1 c
ATOM 5540 H HD3  . ARG Bxp B    57  ? 54.967 -0.198  -15.409 1    100.756 ? 2138 B 1 c
ATOM 5541 H HD2  . ARG Bxp B    57  ? 55.978 -0.985  -16.341 1    100.991 ? 2138 B 1 c
ATOM 5542 H HE   . ARG Bxp B    57  ? 56.004 1.053   -17.647 1    104.404 ? 2138 B 1 c
ATOM 5543 H HH11 . ARG Bxp B    57  ? 52.99  -0.326  -16.94  1    102.412 ? 2138 B 1 c
ATOM 5544 H HH12 . ARG Bxp B    57  ? 52.446 1.055   -16.549 1    102.412 ? 2138 B 1 c
ATOM 5545 H HH21 . ARG Bxp B    57  ? 54.451 2.769   -18.433 1    97.366  ? 2138 B 1 c
ATOM 5546 H HH22 . ARG Bxp B    57  ? 53.315 1.933   -19.037 1    97.366  ? 2138 B 1 c
ATOM 5547 N N    . TYR Bxp B    58  ? 56.358 0.847   -10.71  1    75.352  ? 2139 B 1 .
ATOM 5548 C CA   . TYR Bxp B    58  ? 56.371 0.298   -9.357  1    68.882  ? 2139 B 1 .
ATOM 5549 C C    . TYR Bxp B    58  ? 54.997 0.435   -8.704  1    59.336  ? 2139 B 1 .
ATOM 5550 O O    . TYR Bxp B    58  ? 54.582 -0.467  -7.981  1    61.11   ? 2139 B 1 .
ATOM 5551 C CB   . TYR Bxp B    58  ? 57.509 0.882   -8.496  1    70.119  ? 2139 B 1 .
ATOM 5552 C CG   . TYR Bxp B    58  ? 58.815 0.094   -8.605  1    69.921  ? 2139 B 1 .
ATOM 5553 C CD1  . TYR Bxp B    58  ? 59.006 -1.047  -7.827  1    68.215  ? 2139 B 1 .
ATOM 5554 C CD2  . TYR Bxp B    58  ? 59.824 0.433   -9.509  1    65.088  ? 2139 B 1 .
ATOM 5555 C CE1  . TYR Bxp B    58  ? 60.158 -1.809  -7.918  1    61.924  ? 2139 B 1 .
ATOM 5556 C CE2  . TYR Bxp B    58  ? 60.976 -0.331  -9.62   1    61.27   ? 2139 B 1 .
ATOM 5557 C CZ   . TYR Bxp B    58  ? 61.141 -1.45   -8.819  1    60.139  ? 2139 B 1 .
ATOM 5558 O OH   . TYR Bxp B    58  ? 62.249 -2.233  -8.884  1    56.963  ? 2139 B 1 .
ATOM 5559 H H    . TYR Bxp B    58  ? 57.014 1.445   -10.925 1    74.187  ? 2139 B 1 c
ATOM 5560 H HA   . TYR Bxp B    58  ? 56.55  -0.676  -9.447  1    68.366  ? 2139 B 1 c
ATOM 5561 H HB3  . TYR Bxp B    58  ? 57.22  0.891   -7.556  1    69.709  ? 2139 B 1 c
ATOM 5562 H HB2  . TYR Bxp B    58  ? 57.67  1.809   -8.77   1    69.682  ? 2139 B 1 c
ATOM 5563 H HD1  . TYR Bxp B    58  ? 58.341 -1.296  -7.209  1    66.902  ? 2139 B 1 c
ATOM 5564 H HD2  . TYR Bxp B    58  ? 59.714 1.187   -10.066 1    65.207  ? 2139 B 1 c
ATOM 5565 H HE1  . TYR Bxp B    58  ? 60.268 -2.571  -7.375  1    62.929  ? 2139 B 1 c
ATOM 5566 H HE2  . TYR Bxp B    58  ? 61.65  -0.086  -10.231 1    61.935  ? 2139 B 1 c
ATOM 5567 H HH   . TYR Bxp B    58  ? 62.187 -2.911  -8.384  0    55.6    ? 2139 B 1 c
ATOM 5568 N N    . ILE Bxp B    59  ? 54.289 1.532   -8.985  1    55.386  ? 2140 B 1 .
ATOM 5569 C CA   . ILE Bxp B    59  ? 52.95  1.725   -8.453  1    58.531  ? 2140 B 1 .
ATOM 5570 C C    . ILE Bxp B    59  ? 52.052 0.569   -8.902  1    61.336  ? 2140 B 1 .
ATOM 5571 O O    . ILE Bxp B    59  ? 51.585 -0.217  -8.072  1    60.07   ? 2140 B 1 .
ATOM 5572 C CB   . ILE Bxp B    59  ? 52.356 3.087   -8.868  1    63.185  ? 2140 B 1 .
ATOM 5573 C CG1  . ILE Bxp B    59  ? 53.259 4.273   -8.486  1    66.226  ? 2140 B 1 .
ATOM 5574 C CG2  . ILE Bxp B    59  ? 50.946 3.26    -8.297  1    60.985  ? 2140 B 1 .
ATOM 5575 C CD1  . ILE Bxp B    59  ? 52.757 5.623   -8.981  1    65.906  ? 2140 B 1 .
ATOM 5576 H H    . ILE Bxp B    59  ? 54.649 2.174   -9.526  1    57.439  ? 2140 B 1 c
ATOM 5577 H HA   . ILE Bxp B    59  ? 53.008 1.705   -7.478  1    59.233  ? 2140 B 1 c
ATOM 5578 H HB   . ILE Bxp B    59  ? 52.279 3.086   -9.842  1    62.492  ? 2140 B 1 c
ATOM 5579 H HG12 . ILE Bxp B    59  ? 54.154 4.122   -8.849  1    65.322  ? 2140 B 1 c
ATOM 5580 H HG13 . ILE Bxp B    59  ? 53.335 4.306   -7.511  1    65.223  ? 2140 B 1 c
ATOM 5581 H HG21 . ILE Bxp B    59  ? 50.46  3.914   -8.826  1    61.637  ? 2140 B 1 c
ATOM 5582 H HG22 . ILE Bxp B    59  ? 51.004 3.57    -7.378  1    61.47   ? 2140 B 1 c
ATOM 5583 H HG23 . ILE Bxp B    59  ? 50.473 2.412   -8.321  1    61.576  ? 2140 B 1 c
ATOM 5584 H HD11 . ILE Bxp B    59  ? 52.673 5.605   -9.953  1    65.953  ? 2140 B 1 c
ATOM 5585 H HD12 . ILE Bxp B    59  ? 53.392 6.317   -8.723  1    65.845  ? 2140 B 1 c
ATOM 5586 H HD13 . ILE Bxp B    59  ? 51.887 5.819   -8.585  1    65.909  ? 2140 B 1 c
ATOM 5587 N N    . GLU Bxp B    60  ? 51.797 0.481   -10.216 1    68      ? 2141 B 1 .
ATOM 5588 C CA   . GLU Bxp B    60  ? 50.833 -0.478  -10.743 1    75.863  ? 2141 B 1 .
ATOM 5589 C C    . GLU Bxp B    60  ? 51.193 -1.85   -10.19  1    77.143  ? 2141 B 1 .
ATOM 5590 O O    . GLU Bxp B    60  ? 50.44  -2.416  -9.397  1    68.815  ? 2141 B 1 .
ATOM 5591 C CB   . GLU Bxp B    60  ? 50.782 -0.586  -12.273 1    81.278  ? 2141 B 1 .
ATOM 5592 C CG   . GLU Bxp B    60  ? 50.114 0.585   -12.987 1    82.979  ? 2141 B 1 .
ATOM 5593 C CD   . GLU Bxp B    60  ? 50.873 1.893   -12.861 1    88.92   ? 2141 B 1 .
ATOM 5594 O OE1  . GLU Bxp B    60  ? 52.091 1.923   -13.163 1    83.143  ? 2141 B 1 .
ATOM 5595 O OE2  . GLU Bxp B    60  ? 50.229 2.882   -12.447 1    90.228  ? 2141 B 1 .
ATOM 5596 H H    . GLU Bxp B    60  ? 52.251 1.018   -10.799 1    67.97   ? 2141 B 1 c
ATOM 5597 H HA   . GLU Bxp B    60  ? 49.934 -0.228  -10.41  1    75.384  ? 2141 B 1 c
ATOM 5598 H HB3  . GLU Bxp B    60  ? 50.303 -1.407  -12.514 1    80.384  ? 2141 B 1 c
ATOM 5599 H HB2  . GLU Bxp B    60  ? 51.696 -0.665  -12.614 1    80.418  ? 2141 B 1 c
ATOM 5600 H HG3  . GLU Bxp B    60  ? 49.212 0.711   -12.621 1    83.951  ? 2141 B 1 c
ATOM 5601 H HG2  . GLU Bxp B    60  ? 50.021 0.369   -13.939 1    83.92   ? 2141 B 1 c
ATOM 5602 N N    . HIS Bxp B    61  ? 52.37  -2.326  -10.625 1    82.149  ? 2142 B 1 .
ATOM 5603 C CA   . HIS Bxp B    61  ? 52.958 -3.574  -10.178 1    78.435  ? 2142 B 1 .
ATOM 5604 C C    . HIS Bxp B    61  ? 52.612 -3.819  -8.716  1    69.879  ? 2142 B 1 .
ATOM 5605 O O    . HIS Bxp B    61  ? 51.745 -4.63   -8.412  1    67.126  ? 2142 B 1 .
ATOM 5606 C CB   . HIS Bxp B    61  ? 54.471 -3.559  -10.412 1    77.074  ? 2142 B 1 .
ATOM 5607 C CG   . HIS Bxp B    61  ? 54.863 -3.937  -11.805 1    79.926  ? 2142 B 1 .
ATOM 5608 N ND1  . HIS Bxp B    61  ? 55.956 -3.401  -12.455 1    82.769  ? 2142 B 1 .
ATOM 5609 C CD2  . HIS Bxp B    61  ? 54.32  -4.818  -12.658 1    77.78   ? 2142 B 1 .
ATOM 5610 C CE1  . HIS Bxp B    61  ? 56.061 -3.94   -13.658 1    81.352  ? 2142 B 1 .
ATOM 5611 N NE2  . HIS Bxp B    61  ? 55.078 -4.805  -13.798 1    84.383  ? 2142 B 1 .
ATOM 5612 H H    . HIS Bxp B    61  ? 52.84  -1.829  -11.231 1    79.953  ? 2142 B 1 c
ATOM 5613 H HA   . HIS Bxp B    61  ? 52.557 -4.301  -10.712 1    77.197  ? 2142 B 1 c
ATOM 5614 H HB3  . HIS Bxp B    61  ? 54.894 -4.182  -9.782  1    77.991  ? 2142 B 1 c
ATOM 5615 H HB2  . HIS Bxp B    61  ? 54.811 -2.658  -10.218 1    78.06   ? 2142 B 1 c
ATOM 5616 H HD1  . HIS Bxp B    61  ? 56.746 -2.673  -11.681 0    60.34   ? 2142 B 1 c
ATOM 5617 H HD2  . HIS Bxp B    61  ? 53.566 -5.353  -12.51  1    79.725  ? 2142 B 1 c
ATOM 5618 H HE1  . HIS Bxp B    61  ? 56.719 -3.738  -14.301 1    82.326  ? 2142 B 1 c
ATOM 5619 H HE2  . HIS Bxp B    61  ? 55.395 -4.916  -14.435 0    61.98   ? 2142 B 1 c
ATOM 5620 N N    . TYR Bxp B    62  ? 53.287 -3.099  -7.821  1    64.312  ? 2143 B 1 .
ATOM 5621 C CA   . TYR Bxp B    62  ? 53.33  -3.496  -6.426  1    62.419  ? 2143 B 1 .
ATOM 5622 C C    . TYR Bxp B    62  ? 52.308 -2.693  -5.629  1    58.55   ? 2143 B 1 .
ATOM 5623 O O    . TYR Bxp B    62  ? 51.154 -3.094  -5.508  1    59.751  ? 2143 B 1 .
ATOM 5624 C CB   . TYR Bxp B    62  ? 54.767 -3.351  -5.921  1    64.376  ? 2143 B 1 .
ATOM 5625 C CG   . TYR Bxp B    62  ? 55.79  -4.128  -6.742  1    65.723  ? 2143 B 1 .
ATOM 5626 C CD1  . TYR Bxp B    62  ? 55.705 -5.509  -6.848  1    65.745  ? 2143 B 1 .
ATOM 5627 C CD2  . TYR Bxp B    62  ? 56.853 -3.494  -7.378  1    63.568  ? 2143 B 1 .
ATOM 5628 C CE1  . TYR Bxp B    62  ? 56.62  -6.238  -7.583  1    61.961  ? 2143 B 1 .
ATOM 5629 C CE2  . TYR Bxp B    62  ? 57.793 -4.212  -8.1    1    61.084  ? 2143 B 1 .
ATOM 5630 C CZ   . TYR Bxp B    62  ? 57.668 -5.587  -8.201  1    60.553  ? 2143 B 1 .
ATOM 5631 O OH   . TYR Bxp B    62  ? 58.538 -6.364  -8.894  1    65.405  ? 2143 B 1 .
ATOM 5632 H H    . TYR Bxp B    62  ? 53.724 -2.339  -8.081  1    65.302  ? 2143 B 1 c
ATOM 5633 H HA   . TYR Bxp B    62  ? 53.081 -4.457  -6.368  1    62.484  ? 2143 B 1 c
ATOM 5634 H HB3  . TYR Bxp B    62  ? 54.804 -3.66   -4.988  1    64.142  ? 2143 B 1 c
ATOM 5635 H HB2  . TYR Bxp B    62  ? 55.012 -2.401  -5.937  1    63.789  ? 2143 B 1 c
ATOM 5636 H HD1  . TYR Bxp B    62  ? 54.992 -5.96   -6.426  1    64.771  ? 2143 B 1 c
ATOM 5637 H HD2  . TYR Bxp B    62  ? 56.936 -2.559  -7.311  1    63.524  ? 2143 B 1 c
ATOM 5638 H HE1  . TYR Bxp B    62  ? 56.543 -7.175  -7.643  1    62.571  ? 2143 B 1 c
ATOM 5639 H HE2  . TYR Bxp B    62  ? 58.5   -3.77   -8.535  1    61.642  ? 2143 B 1 c
ATOM 5640 H HH   . TYR Bxp B    62  ? 58.57  -7.087  -8.637  0    50.44   ? 2143 B 1 c
ATOM 5641 N N    . LEU Bxp B    63  ? 52.742 -1.542  -5.116  1    54.749  ? 2144 B 1 .
ATOM 5642 C CA   . LEU Bxp B    63  ? 52.022 -0.777  -4.112  1    50.851  ? 2144 B 1 .
ATOM 5643 C C    . LEU Bxp B    63  ? 50.797 -1.535  -3.62   1    53.455  ? 2144 B 1 .
ATOM 5644 O O    . LEU Bxp B    63  ? 50.838 -2.111  -2.543  1    63.031  ? 2144 B 1 .
ATOM 5645 C CB   . LEU Bxp B    63  ? 51.652 0.588   -4.676  1    46.105  ? 2144 B 1 .
ATOM 5646 C CG   . LEU Bxp B    63  ? 51.209 1.628   -3.651  1    42.392  ? 2144 B 1 .
ATOM 5647 C CD1  . LEU Bxp B    63  ? 52.257 1.824   -2.598  1    41.025  ? 2144 B 1 .
ATOM 5648 C CD2  . LEU Bxp B    63  ? 50.949 2.936   -4.348  1    43.628  ? 2144 B 1 .
ATOM 5649 H H    . LEU Bxp B    63  ? 53.524 -1.192  -5.435  1    54.596  ? 2144 B 1 c
ATOM 5650 H HA   . LEU Bxp B    63  ? 52.628 -0.65   -3.342  1    50.876  ? 2144 B 1 c
ATOM 5651 H HB3  . LEU Bxp B    63  ? 50.93  0.47    -5.335  1    46.357  ? 2144 B 1 c
ATOM 5652 H HB2  . LEU Bxp B    63  ? 52.434 0.942   -5.158  1    46.278  ? 2144 B 1 c
ATOM 5653 H HG   . LEU Bxp B    63  ? 50.371 1.318   -3.223  1    42.979  ? 2144 B 1 c
ATOM 5654 H HD11 . LEU Bxp B    63  ? 52.196 1.11    -1.942  1    41.525  ? 2144 B 1 c
ATOM 5655 H HD12 . LEU Bxp B    63  ? 52.119 2.678   -2.158  1    41.409  ? 2144 B 1 c
ATOM 5656 H HD13 . LEU Bxp B    63  ? 53.138 1.811   -3.009  1    41.468  ? 2144 B 1 c
ATOM 5657 H HD21 . LEU Bxp B    63  ? 50.672 2.769   -5.263  1    43.578  ? 2144 B 1 c
ATOM 5658 H HD22 . LEU Bxp B    63  ? 51.762 3.469   -4.352  1    43.341  ? 2144 B 1 c
ATOM 5659 H HD23 . LEU Bxp B    63  ? 50.25  3.42    -3.878  1    43.514  ? 2144 B 1 c
ATOM 5660 N N    . GLU Bxp B    64  ? 49.731 -1.571  -4.429  1    53.062  ? 2145 B 1 .
ATOM 5661 C CA   . GLU Bxp B    64  ? 48.486 -2.174  -3.991  1    50.046  ? 2145 B 1 .
ATOM 5662 C C    . GLU Bxp B    64  ? 48.819 -3.373  -3.112  1    53.117  ? 2145 B 1 .
ATOM 5663 O O    . GLU Bxp B    64  ? 48.746 -3.301  -1.885  1    61.589  ? 2145 B 1 .
ATOM 5664 C CB   . GLU Bxp B    64  ? 47.574 -2.602  -5.139  0.48 42.671  ? 2145 B 1 .
ATOM 5665 C CG   . GLU Bxp B    64  ? 46.536 -3.62   -4.682  0.48 37.825  ? 2145 B 1 .
ATOM 5666 C CD   . GLU Bxp B    64  ? 45.261 -3.54   -5.475  0.48 33.801  ? 2145 B 1 .
ATOM 5667 O OE1  . GLU Bxp B    64  ? 44.848 -2.428  -5.816  0.48 29.935  ? 2145 B 1 .
ATOM 5668 O OE2  . GLU Bxp B    64  ? 44.658 -4.59   -5.7    0.48 34.132  ? 2145 B 1 .
ATOM 5669 H H    . GLU Bxp B    64  ? 49.786 -1.234  -5.277  1    52.37   ? 2145 B 1 c
ATOM 5670 H HA   . GLU Bxp B    64  ? 48.001 -1.508  -3.439  1    49.701  ? 2145 B 1 c
ATOM 5671 H HB3  . GLU Bxp B    64  ? 48.119 -2.983  -5.857  0.48 43.109  ? 2145 B 1 c
ATOM 5672 H HB2  . GLU Bxp B    64  ? 47.118 -1.81   -5.495  0.48 43.064  ? 2145 B 1 c
ATOM 5673 H HG3  . GLU Bxp B    64  ? 46.325 -3.47   -3.736  0.48 38.023  ? 2145 B 1 c
ATOM 5674 H HG2  . GLU Bxp B    64  ? 46.905 -4.524  -4.773  0.48 38.018  ? 2145 B 1 c
ATOM 5675 N N    . GLU Bxp B    65  ? 49.245 -4.459  -3.752  1    50.83   ? 2146 B 1 .
ATOM 5676 C CA   . GLU Bxp B    65  ? 49.51  -5.668  -3.006  1    50.165  ? 2146 B 1 .
ATOM 5677 C C    . GLU Bxp B    65  ? 50.2   -5.295  -1.7    1    45.7    ? 2146 B 1 .
ATOM 5678 O O    . GLU Bxp B    65  ? 49.816 -5.783  -0.65   1    42.061  ? 2146 B 1 .
ATOM 5679 C CB   . GLU Bxp B    65  ? 50.351 -6.662  -3.793  1    54.908  ? 2146 B 1 .
ATOM 5680 C CG   . GLU Bxp B    65  ? 49.703 -8.042  -3.8    1    59.691  ? 2146 B 1 .
ATOM 5681 C CD   . GLU Bxp B    65  ? 50.63  -9.095  -4.363  1    64.75   ? 2146 B 1 .
ATOM 5682 O OE1  . GLU Bxp B    65  ? 51.288 -8.814  -5.393  1    65.098  ? 2146 B 1 .
ATOM 5683 O OE2  . GLU Bxp B    65  ? 50.677 -10.189 -3.758  1    67.169  ? 2146 B 1 .
ATOM 5684 H H    . GLU Bxp B    65  ? 49.382 -4.446  -4.655  1    51.129  ? 2146 B 1 c
ATOM 5685 H HA   . GLU Bxp B    65  ? 48.64  -6.091  -2.789  1    50.172  ? 2146 B 1 c
ATOM 5686 H HB3  . GLU Bxp B    65  ? 51.244 -6.719  -3.393  1    54.723  ? 2146 B 1 c
ATOM 5687 H HB2  . GLU Bxp B    65  ? 50.454 -6.344  -4.714  1    54.792  ? 2146 B 1 c
ATOM 5688 H HG3  . GLU Bxp B    65  ? 48.886 -8.016  -4.342  1    59.676  ? 2146 B 1 c
ATOM 5689 H HG2  . GLU Bxp B    65  ? 49.456 -8.292  -2.884  1    59.656  ? 2146 B 1 c
ATOM 5690 N N    . PHE Bxp B    66  ? 51.186 -4.396  -1.76   1    44.972  ? 2147 B 1 .
ATOM 5691 C CA   . PHE Bxp B    66  ? 51.86  -3.972  -0.541  1    39.982  ? 2147 B 1 .
ATOM 5692 C C    . PHE Bxp B    66  ? 50.861 -3.426  0.476   1    34.957  ? 2147 B 1 .
ATOM 5693 O O    . PHE Bxp B    66  ? 50.605 -4.07   1.488   1    34.304  ? 2147 B 1 .
ATOM 5694 C CB   . PHE Bxp B    66  ? 52.945 -2.926  -0.798  1    40.235  ? 2147 B 1 .
ATOM 5695 C CG   . PHE Bxp B    66  ? 53.581 -2.376  0.469   1    36.756  ? 2147 B 1 .
ATOM 5696 C CD1  . PHE Bxp B    66  ? 53.024 -1.297  1.142   1    35.936  ? 2147 B 1 .
ATOM 5697 C CD2  . PHE Bxp B    66  ? 54.747 -2.939  0.976   1    36.032  ? 2147 B 1 .
ATOM 5698 C CE1  . PHE Bxp B    66  ? 53.626 -0.795  2.283   1    37.413  ? 2147 B 1 .
ATOM 5699 C CE2  . PHE Bxp B    66  ? 55.337 -2.443  2.125   1    35.509  ? 2147 B 1 .
ATOM 5700 C CZ   . PHE Bxp B    66  ? 54.781 -1.371  2.772   1    36.608  ? 2147 B 1 .
ATOM 5701 H H    . PHE Bxp B    66  ? 51.46  -4.061  -2.565  1    44.117  ? 2147 B 1 c
ATOM 5702 H HA   . PHE Bxp B    66  ? 52.296 -4.772  -0.143  1    39.923  ? 2147 B 1 c
ATOM 5703 H HB3  . PHE Bxp B    66  ? 52.558 -2.182  -1.305  1    39.438  ? 2147 B 1 c
ATOM 5704 H HB2  . PHE Bxp B    66  ? 53.646 -3.334  -1.353  1    39.404  ? 2147 B 1 c
ATOM 5705 H HD1  . PHE Bxp B    66  ? 52.241 -0.891  0.808   1    36.451  ? 2147 B 1 c
ATOM 5706 H HD2  . PHE Bxp B    66  ? 55.137 -3.674  0.532   1    36.152  ? 2147 B 1 c
ATOM 5707 H HE1  . PHE Bxp B    66  ? 53.239 -0.061  2.734   1    36.865  ? 2147 B 1 c
ATOM 5708 H HE2  . PHE Bxp B    66  ? 56.128 -2.838  2.456   1    35.912  ? 2147 B 1 c
ATOM 5709 H HZ   . PHE Bxp B    66  ? 55.181 -1.034  3.555   1    36.386  ? 2147 B 1 c
ATOM 5710 N N    . LEU Bxp B    67  ? 50.308 -2.243  0.197   1    33.294  ? 2148 B 1 .
ATOM 5711 C CA   . LEU Bxp B    67  ? 49.385 -1.579  1.105   1    32.8    ? 2148 B 1 .
ATOM 5712 C C    . LEU Bxp B    67  ? 48.284 -2.539  1.531   1    30.738  ? 2148 B 1 .
ATOM 5713 O O    . LEU Bxp B    67  ? 47.877 -2.535  2.684   1    30.293  ? 2148 B 1 .
ATOM 5714 C CB   . LEU Bxp B    67  ? 48.746 -0.35   0.47    1    33.496  ? 2148 B 1 .
ATOM 5715 C CG   . LEU Bxp B    67  ? 49.704 0.759   0.043   1    35.21   ? 2148 B 1 .
ATOM 5716 C CD1  . LEU Bxp B    67  ? 48.963 1.694   -0.876  1    36.894  ? 2148 B 1 .
ATOM 5717 C CD2  . LEU Bxp B    67  ? 50.258 1.492   1.238   1    35.806  ? 2148 B 1 .
ATOM 5718 H H    . LEU Bxp B    67  ? 50.497 -1.843  -0.603  1    33.713  ? 2148 B 1 c
ATOM 5719 H HA   . LEU Bxp B    67  ? 49.89  -1.302  1.911   1    32.662  ? 2148 B 1 c
ATOM 5720 H HB3  . LEU Bxp B    67  ? 48.102 0.028   1.112   1    33.707  ? 2148 B 1 c
ATOM 5721 H HB2  . LEU Bxp B    67  ? 48.238 -0.644  -0.321  1    33.748  ? 2148 B 1 c
ATOM 5722 H HG   . LEU Bxp B    67  ? 50.458 0.355   -0.458  1    35.284  ? 2148 B 1 c
ATOM 5723 H HD11 . LEU Bxp B    67  ? 48.652 1.205   -1.656  1    36.428  ? 2148 B 1 c
ATOM 5724 H HD12 . LEU Bxp B    67  ? 49.557 2.41    -1.159  1    36.41   ? 2148 B 1 c
ATOM 5725 H HD13 . LEU Bxp B    67  ? 48.201 2.074   -0.408  1    36.474  ? 2148 B 1 c
ATOM 5726 H HD21 . LEU Bxp B    67  ? 50.678 0.859   1.843   1    35.585  ? 2148 B 1 c
ATOM 5727 H HD22 . LEU Bxp B    67  ? 49.537 1.952   1.7     1    35.613  ? 2148 B 1 c
ATOM 5728 H HD23 . LEU Bxp B    67  ? 50.916 2.14    0.942   1    35.592  ? 2148 B 1 c
ATOM 5729 N N    . THR Bxp B    68  ? 47.769 -3.333  0.596   1    29.201  ? 2149 B 1 .
ATOM 5730 C CA   . THR Bxp B    68  ? 46.599 -4.12   0.911   1    29.292  ? 2149 B 1 .
ATOM 5731 C C    . THR Bxp B    68  ? 46.986 -5.234  1.881   1    28.609  ? 2149 B 1 .
ATOM 5732 O O    . THR Bxp B    68  ? 46.172 -5.583  2.725   1    31.075  ? 2149 B 1 .
ATOM 5733 C CB   . THR Bxp B    68  ? 45.914 -4.586  -0.373  1    31.008  ? 2149 B 1 .
ATOM 5734 O OG1  . THR Bxp B    68  ? 44.555 -4.659  0.028   1    34.497  ? 2149 B 1 .
ATOM 5735 C CG2  . THR Bxp B    68  ? 46.39  -5.922  -0.913  1    32.214  ? 2149 B 1 .
ATOM 5736 H H    . THR Bxp B    68  ? 48.137 -3.38   -0.239  1    29.675  ? 2149 B 1 c
ATOM 5737 H HA   . THR Bxp B    68  ? 45.969 -3.533  1.379   1    29.714  ? 2149 B 1 c
ATOM 5738 H HB   . THR Bxp B    68  ? 46.012 -3.897  -1.074  1    31.531  ? 2149 B 1 c
ATOM 5739 H HG1  . THR Bxp B    68  ? 44.491 -5.399  0.638   0    24.1    ? 2149 B 1 c
ATOM 5740 H HG21 . THR Bxp B    68  ? 46.162 -5.991  -1.855  1    31.882  ? 2149 B 1 c
ATOM 5741 H HG22 . THR Bxp B    68  ? 45.96  -6.642  -0.423  1    31.87   ? 2149 B 1 c
ATOM 5742 H HG23 . THR Bxp B    68  ? 47.353 -5.991  -0.809  1    31.99   ? 2149 B 1 c
ATOM 5743 N N    . SER Bxp B    69  ? 48.225 -5.737  1.795   1    28.538  ? 2150 B 1 .
ATOM 5744 C CA   . SER Bxp B    69  ? 48.715 -6.79   2.675   1    29.291  ? 2150 B 1 .
ATOM 5745 C C    . SER Bxp B    69  ? 49.226 -6.187  3.988   1    30.801  ? 2150 B 1 .
ATOM 5746 O O    . SER Bxp B    69  ? 49.27  -6.858  5.027   1    29.986  ? 2150 B 1 .
ATOM 5747 C CB   . SER Bxp B    69  ? 49.775 -7.664  1.981   1    29.442  ? 2150 B 1 .
ATOM 5748 O OG   . SER Bxp B    69  ? 51.12  -7.217  2.131   1    27.385  ? 2150 B 1 .
ATOM 5749 H H    . SER Bxp B    69  ? 48.788 -5.416  1.151   1    28.765  ? 2150 B 1 c
ATOM 5750 H HA   . SER Bxp B    69  ? 47.946 -7.375  2.897   1    29.445  ? 2150 B 1 c
ATOM 5751 H HB3  . SER Bxp B    69  ? 49.565 -7.711  1.03    1    28.971  ? 2150 B 1 c
ATOM 5752 H HB2  . SER Bxp B    69  ? 49.706 -8.571  2.334   1    28.947  ? 2150 B 1 c
ATOM 5753 H HG   . SER Bxp B    69  ? 51.647 -7.756  1.719   0    22.36   ? 2150 B 1 c
ATOM 5754 N N    . ALA Bxp B    70  ? 49.617 -4.91   3.933   1    31.702  ? 2151 B 1 .
ATOM 5755 C CA   . ALA Bxp B    70  ? 49.971 -4.177  5.139   1    32.256  ? 2151 B 1 .
ATOM 5756 C C    . ALA Bxp B    70  ? 48.706 -3.912  5.945   1    31.971  ? 2151 B 1 .
ATOM 5757 O O    . ALA Bxp B    70  ? 48.708 -3.96   7.169   1    31.483  ? 2151 B 1 .
ATOM 5758 C CB   . ALA Bxp B    70  ? 50.675 -2.889  4.791   1    31.805  ? 2151 B 1 .
ATOM 5759 H H    . ALA Bxp B    70  ? 49.678 -4.487  3.126   1    31.545  ? 2151 B 1 c
ATOM 5760 H HA   . ALA Bxp B    70  ? 50.579 -4.746  5.687   1    32.012  ? 2151 B 1 c
ATOM 5761 H HB3  . ALA Bxp B    70  ? 51.186 -2.578  5.556   1    31.985  ? 2151 B 1 c
ATOM 5762 H HB2  . ALA Bxp B    70  ? 50.02  -2.215  4.544   1    31.982  ? 2151 B 1 c
ATOM 5763 H HB1  . ALA Bxp B    70  ? 51.276 -3.037  4.042   1    32.002  ? 2151 B 1 c
ATOM 5764 N N    . ASN Bxp B    71  ? 47.622 -3.632  5.231   1    32.755  ? 2152 B 1 .
ATOM 5765 C CA   . ASN Bxp B    71  ? 46.357 -3.361  5.875   1    34.368  ? 2152 B 1 .
ATOM 5766 C C    . ASN Bxp B    71  ? 45.954 -4.588  6.663   1    33.37   ? 2152 B 1 .
ATOM 5767 O O    . ASN Bxp B    71  ? 45.375 -4.481  7.737   1    31.894  ? 2152 B 1 .
ATOM 5768 C CB   . ASN Bxp B    71  ? 45.267 -3.019  4.872   1    36.813  ? 2152 B 1 .
ATOM 5769 C CG   . ASN Bxp B    71  ? 43.938 -2.794  5.547   1    39.573  ? 2152 B 1 .
ATOM 5770 O OD1  . ASN Bxp B    71  ? 43.747 -1.824  6.288   1    39.173  ? 2152 B 1 .
ATOM 5771 N ND2  . ASN Bxp B    71  ? 42.991 -3.678  5.296   1    45.172  ? 2152 B 1 .
ATOM 5772 H H    . ASN Bxp B    71  ? 47.67  -3.599  4.319   1    32.934  ? 2152 B 1 c
ATOM 5773 H HA   . ASN Bxp B    71  ? 46.466 -2.598  6.486   1    34.296  ? 2152 B 1 c
ATOM 5774 H HB3  . ASN Bxp B    71  ? 45.181 -3.748  4.227   1    36.862  ? 2152 B 1 c
ATOM 5775 H HB2  . ASN Bxp B    71  ? 45.52  -2.21   4.384   1    36.852  ? 2152 B 1 c
ATOM 5776 H HD21 . ASN Bxp B    71  ? 42.551 -4.058  5.967   1    43.368  ? 2152 B 1 c
ATOM 5777 H HD22 . ASN Bxp B    71  ? 42.795 -3.89   4.458   1    43.368  ? 2152 B 1 c
ATOM 5778 N N    . LYS Bxp B    72  ? 46.266 -5.745  6.09    1    36.064  ? 2153 B 1 .
ATOM 5779 C CA   . LYS Bxp B    72  ? 45.854 -6.991  6.695   1    41.698  ? 2153 B 1 .
ATOM 5780 C C    . LYS Bxp B    72  ? 46.747 -7.303  7.894   1    42.116  ? 2153 B 1 .
ATOM 5781 O O    . LYS Bxp B    72  ? 46.215 -7.616  8.96    1    39.694  ? 2153 B 1 .
ATOM 5782 C CB   . LYS Bxp B    72  ? 45.807 -8.127  5.669   1    45.552  ? 2153 B 1 .
ATOM 5783 C CG   . LYS Bxp B    72  ? 44.717 -9.141  5.987   1    51.073  ? 2153 B 1 .
ATOM 5784 C CD   . LYS Bxp B    72  ? 44.739 -10.417 5.157   1    55.105  ? 2153 B 1 .
ATOM 5785 C CE   . LYS Bxp B    72  ? 43.941 -11.491 5.819   1    59.73   ? 2153 B 1 .
ATOM 5786 N NZ   . LYS Bxp B    72  ? 44.212 -12.772 5.165   1    65.236  ? 2153 B 1 .
ATOM 5787 H H    . LYS Bxp B    72  ? 46.726 -5.763  5.301   1    36.595  ? 2153 B 1 c
ATOM 5788 H HA   . LYS Bxp B    72  ? 44.929 -6.87   7.032   1    41.211  ? 2153 B 1 c
ATOM 5789 H HB3  . LYS Bxp B    72  ? 46.674 -8.587  5.652   1    45.788  ? 2153 B 1 c
ATOM 5790 H HB2  . LYS Bxp B    72  ? 45.643 -7.754  4.777   1    45.696  ? 2153 B 1 c
ATOM 5791 H HG3  . LYS Bxp B    72  ? 43.846 -8.703  5.864   1    50.64   ? 2153 B 1 c
ATOM 5792 H HG2  . LYS Bxp B    72  ? 44.791 -9.381  6.936   1    50.726  ? 2153 B 1 c
ATOM 5793 H HD3  . LYS Bxp B    72  ? 45.666 -10.72  5.047   1    55.219  ? 2153 B 1 c
ATOM 5794 H HD2  . LYS Bxp B    72  ? 44.363 -10.235 4.268   1    55.195  ? 2153 B 1 c
ATOM 5795 H HE3  . LYS Bxp B    72  ? 42.991 -11.29  5.753   1    59.853  ? 2153 B 1 c
ATOM 5796 H HE2  . LYS Bxp B    72  ? 44.18  -11.557 6.761   1    59.758  ? 2153 B 1 c
ATOM 5797 H HZ1  . LYS Bxp B    72  ? 45.082 -12.998 5.279   1    63.416  ? 2153 B 1 c
ATOM 5798 H HZ2  . LYS Bxp B    72  ? 44.035 -12.708 4.278   1    63.422  ? 2153 B 1 c
ATOM 5799 H HZ3  . LYS Bxp B    72  ? 43.688 -13.416 5.526   1    63.463  ? 2153 B 1 c
ATOM 5800 N N    . HIS Bxp B    73  ? 48.078 -7.168  7.733   1    41.64   ? 2154 B 1 .
ATOM 5801 C CA   . HIS Bxp B    73  ? 49.027 -7.835  8.623   1    43.024  ? 2154 B 1 .
ATOM 5802 C C    . HIS Bxp B    73  ? 49.836 -6.903  9.54    1    40.652  ? 2154 B 1 .
ATOM 5803 O O    . HIS Bxp B    73  ? 50.303 -7.328  10.607  1    36.159  ? 2154 B 1 .
ATOM 5804 C CB   . HIS Bxp B    73  ? 49.973 -8.691  7.78    1    45.019  ? 2154 B 1 .
ATOM 5805 C CG   . HIS Bxp B    73  ? 49.286 -9.797  7.049   1    48.093  ? 2154 B 1 .
ATOM 5806 N ND1  . HIS Bxp B    73  ? 48.211 -10.476 7.575   1    50.945  ? 2154 B 1 .
ATOM 5807 C CD2  . HIS Bxp B    73  ? 49.528 -10.37  5.861   1    49.57   ? 2154 B 1 .
ATOM 5808 C CE1  . HIS Bxp B    73  ? 47.815 -11.412 6.718   1    50.893  ? 2154 B 1 .
ATOM 5809 N NE2  . HIS Bxp B    73  ? 48.604 -11.368 5.669   1    48.511  ? 2154 B 1 .
ATOM 5810 H H    . HIS Bxp B    73  ? 48.4   -6.658  7.046   1    41.983  ? 2154 B 1 c
ATOM 5811 H HA   . HIS Bxp B    73  ? 48.51  -8.447  9.201   1    42.683  ? 2154 B 1 c
ATOM 5812 H HB3  . HIS Bxp B    73  ? 50.657 -9.073  8.37    1    45.093  ? 2154 B 1 c
ATOM 5813 H HB2  . HIS Bxp B    73  ? 50.426 -8.111  7.13    1    45.083  ? 2154 B 1 c
ATOM 5814 H HD1  . HIS Bxp B    73  ? 47.856 -10.312 8.327   0    36.03   ? 2154 B 1 c
ATOM 5815 H HD2  . HIS Bxp B    73  ? 50.203 -10.13  5.26    1    48.676  ? 2154 B 1 c
ATOM 5816 H HE1  . HIS Bxp B    73  ? 47.094 -12.006 6.844   1    50.307  ? 2154 B 1 c
ATOM 5817 H HE2  . HIS Bxp B    73  ? 48.583 -11.87  4.928   0    35.8    ? 2154 B 1 c
ATOM 5818 N N    . PHE Bxp B    74  ? 50.01  -5.64   9.129   1    39.208  ? 2155 B 1 .
ATOM 5819 C CA   . PHE Bxp B    74  ? 50.954 -4.74   9.774   1    35.28   ? 2155 B 1 .
ATOM 5820 C C    . PHE Bxp B    74  ? 50.351 -4.204  11.061  1    32.731  ? 2155 B 1 .
ATOM 5821 O O    . PHE Bxp B    74  ? 49.446 -3.389  11.01   1    29.934  ? 2155 B 1 .
ATOM 5822 C CB   . PHE Bxp B    74  ? 51.332 -3.561  8.876   1    34.051  ? 2155 B 1 .
ATOM 5823 C CG   . PHE Bxp B    74  ? 52.423 -2.66   9.435   1    33.266  ? 2155 B 1 .
ATOM 5824 C CD1  . PHE Bxp B    74  ? 53.74  -3.1    9.514   1    33.027  ? 2155 B 1 .
ATOM 5825 C CD2  . PHE Bxp B    74  ? 52.145 -1.358  9.827   1    32.047  ? 2155 B 1 .
ATOM 5826 C CE1  . PHE Bxp B    74  ? 54.737 -2.269  9.993   1    31.929  ? 2155 B 1 .
ATOM 5827 C CE2  . PHE Bxp B    74  ? 53.152 -0.533  10.302  1    31.874  ? 2155 B 1 .
ATOM 5828 C CZ   . PHE Bxp B    74  ? 54.442 -0.987  10.381  1    31.156  ? 2155 B 1 .
ATOM 5829 H H    . PHE Bxp B    74  ? 49.522 -5.327  8.423   1    38.658  ? 2155 B 1 c
ATOM 5830 H HA   . PHE Bxp B    74  ? 51.778 -5.248  9.989   1    35.302  ? 2155 B 1 c
ATOM 5831 H HB3  . PHE Bxp B    74  ? 50.528 -3.021  8.716   1    34.072  ? 2155 B 1 c
ATOM 5832 H HB2  . PHE Bxp B    74  ? 51.629 -3.916  8.009   1    34.131  ? 2155 B 1 c
ATOM 5833 H HD1  . PHE Bxp B    74  ? 53.953 -3.978  9.242   1    32.803  ? 2155 B 1 c
ATOM 5834 H HD2  . PHE Bxp B    74  ? 51.261 -1.035  9.77    1    32.199  ? 2155 B 1 c
ATOM 5835 H HE1  . PHE Bxp B    74  ? 55.625 -2.585  10.05   1    32.007  ? 2155 B 1 c
ATOM 5836 H HE2  . PHE Bxp B    74  ? 52.946 0.347   10.576  1    31.764  ? 2155 B 1 c
ATOM 5837 H HZ   . PHE Bxp B    74  ? 55.122 -0.425  10.716  1    31.54   ? 2155 B 1 c
ATOM 5838 N N    . MET Bxp B    75  ? 50.862 -4.696  12.194  1    34.168  ? 2156 B 1 .
ATOM 5839 C CA   . MET Bxp B    75  ? 50.563 -4.148  13.505  1    32.492  ? 2156 B 1 .
ATOM 5840 C C    . MET Bxp B    75  ? 49.051 -4.146  13.712  1    35.114  ? 2156 B 1 .
ATOM 5841 O O    . MET Bxp B    75  ? 48.467 -3.121  14.059  1    36.133  ? 2156 B 1 .
ATOM 5842 C CB   . MET Bxp B    75  ? 51.126 -2.73   13.625  1    30.168  ? 2156 B 1 .
ATOM 5843 C CG   . MET Bxp B    75  ? 52.556 -2.598  13.186  1    28.002  ? 2156 B 1 .
ATOM 5844 S SD   . MET Bxp B    75  ? 53.634 -3.067  14.54   1    26.88   ? 2156 B 1 .
ATOM 5845 C CE   . MET Bxp B    75  ? 55.081 -3.391  13.522  1    28.695  ? 2156 B 1 .
ATOM 5846 H H    . MET Bxp B    75  ? 51.424 -5.415  12.146  1    33.465  ? 2156 B 1 c
ATOM 5847 H HA   . MET Bxp B    75  ? 50.978 -4.73   14.191  1    32.858  ? 2156 B 1 c
ATOM 5848 H HB3  . MET Bxp B    75  ? 51.051 -2.442  14.56   1    30.17   ? 2156 B 1 c
ATOM 5849 H HB2  . MET Bxp B    75  ? 50.574 -2.129  13.084  1    30.184  ? 2156 B 1 c
ATOM 5850 H HG3  . MET Bxp B    75  ? 52.742 -1.673  12.929  1    28.314  ? 2156 B 1 c
ATOM 5851 H HG2  . MET Bxp B    75  ? 52.729 -3.176  12.417  1    28.343  ? 2156 B 1 c
ATOM 5852 H HE3  . MET Bxp B    75  ? 55.189 -2.672  12.873  1    28.256  ? 2156 B 1 c
ATOM 5853 H HE2  . MET Bxp B    75  ? 54.965 -4.238  13.053  1    28.256  ? 2156 B 1 c
ATOM 5854 H HE1  . MET Bxp B    75  ? 55.871 -3.439  14.09   1    28.331  ? 2156 B 1 c
ATOM 5855 N N    . VAL Bxp B    76  ? 48.427 -5.306  13.477  1    37.496  ? 2157 B 1 .
ATOM 5856 C CA   . VAL Bxp B    76  ? 46.993 -5.465  13.639  1    38.441  ? 2157 B 1 .
ATOM 5857 C C    . VAL Bxp B    76  ? 46.598 -5.003  15.038  1    37.249  ? 2157 B 1 .
ATOM 5858 O O    . VAL Bxp B    76  ? 47.299 -5.276  16.01   1    34.531  ? 2157 B 1 .
ATOM 5859 C CB   . VAL Bxp B    76  ? 46.591 -6.932  13.393  1    42.543  ? 2157 B 1 .
ATOM 5860 C CG1  . VAL Bxp B    76  ? 45.158 -7.228  13.826  1    44.365  ? 2157 B 1 .
ATOM 5861 C CG2  . VAL Bxp B    76  ? 46.805 -7.336  11.941  1    42.907  ? 2157 B 1 .
ATOM 5862 H H    . VAL Bxp B    76  ? 48.92  -6.029  13.212  1    37.168  ? 2157 B 1 c
ATOM 5863 H HA   . VAL Bxp B    76  ? 46.542 -4.901  12.982  1    38.771  ? 2157 B 1 c
ATOM 5864 H HB   . VAL Bxp B    76  ? 47.188 -7.49   13.945  1    42.112  ? 2157 B 1 c
ATOM 5865 H HG11 . VAL Bxp B    76  ? 44.575 -6.508  13.533  1    43.777  ? 2157 B 1 c
ATOM 5866 H HG12 . VAL Bxp B    76  ? 45.119 -7.301  14.795  1    43.773  ? 2157 B 1 c
ATOM 5867 H HG13 . VAL Bxp B    76  ? 44.862 -8.065  13.43   1    43.791  ? 2157 B 1 c
ATOM 5868 H HG21 . VAL Bxp B    76  ? 46.026 -7.817  11.616  1    42.807  ? 2157 B 1 c
ATOM 5869 H HG22 . VAL Bxp B    76  ? 47.588 -7.906  11.875  1    42.827  ? 2157 B 1 c
ATOM 5870 H HG23 . VAL Bxp B    76  ? 46.94  -6.54   11.399  1    42.752  ? 2157 B 1 c
ATOM 5871 N N    . GLY Bxp B    77  ? 45.464 -4.301  15.119  1    39.269  ? 2158 B 1 .
ATOM 5872 C CA   . GLY Bxp B    77  ? 44.885 -3.919  16.4    1    40.201  ? 2158 B 1 .
ATOM 5873 C C    . GLY Bxp B    77  ? 45.592 -2.712  17.011  1    36.87   ? 2158 B 1 .
ATOM 5874 O O    . GLY Bxp B    77  ? 45.604 -2.547  18.222  1    34.001  ? 2158 B 1 .
ATOM 5875 H H    . GLY Bxp B    77  ? 45.035 -4.052  14.352  1    38.978  ? 2158 B 1 c
ATOM 5876 H HA3  . GLY Bxp B    77  ? 44.944 -4.683  17.021  1    39.17   ? 2158 B 1 c
ATOM 5877 H HA2  . GLY Bxp B    77  ? 43.931 -3.709  16.27   1    39.174  ? 2158 B 1 c
ATOM 5878 N N    . HIS Bxp B    78  ? 46.161 -1.871  16.146  1    37.087  ? 2159 B 1 .
ATOM 5879 C CA   . HIS Bxp B    78  ? 46.842 -0.663  16.559  1    36.348  ? 2159 B 1 .
ATOM 5880 C C    . HIS Bxp B    78  ? 46.778 0.394   15.474  1    34.387  ? 2159 B 1 .
ATOM 5881 O O    . HIS Bxp B    78  ? 47.001 0.114   14.3    1    35.21   ? 2159 B 1 .
ATOM 5882 C CB   . HIS Bxp B    78  ? 48.337 -0.895  16.715  1    37.315  ? 2159 B 1 .
ATOM 5883 C CG   . HIS Bxp B    78  ? 48.636 -1.833  17.807  1    38.121  ? 2159 B 1 .
ATOM 5884 N ND1  . HIS Bxp B    78  ? 48.579 -1.425  19.121  1    39.053  ? 2159 B 1 .
ATOM 5885 C CD2  . HIS Bxp B    78  ? 48.941 -3.124  17.802  1    37.628  ? 2159 B 1 .
ATOM 5886 C CE1  . HIS Bxp B    78  ? 48.876 -2.457  19.886  1    40.262  ? 2159 B 1 .
ATOM 5887 N NE2  . HIS Bxp B    78  ? 49.115 -3.494  19.103  1    39.462  ? 2159 B 1 .
ATOM 5888 H H    . HIS Bxp B    78  ? 46.118 -2.06   15.253  1    36.895  ? 2159 B 1 c
ATOM 5889 H HA   . HIS Bxp B    78  ? 46.445 -0.311  17.39   1    36.24   ? 2159 B 1 c
ATOM 5890 H HB3  . HIS Bxp B    78  ? 48.777 -0.036  16.9    1    37.258  ? 2159 B 1 c
ATOM 5891 H HB2  . HIS Bxp B    78  ? 48.695 -1.254  15.875  1    37.245  ? 2159 B 1 c
ATOM 5892 H HD1  . HIS Bxp B    78  ? 48.407 -0.592  19.369  0    29.26   ? 2159 B 1 c
ATOM 5893 H HD2  . HIS Bxp B    78  ? 49.059 -3.672  17.052  1    38.14   ? 2159 B 1 c
ATOM 5894 H HE1  . HIS Bxp B    78  ? 48.922 -2.45   20.825  1    39.784  ? 2159 B 1 c
ATOM 5895 H HE2  . HIS Bxp B    78  ? 49.369 -4.279  19.34   0    30.4    ? 2159 B 1 c
ATOM 5896 N N    . PRO Bxp B    79  ? 46.565 1.66    15.853  1    32.047  ? 2160 B 1 .
ATOM 5897 C CA   . PRO Bxp B    79  ? 46.572 2.729   14.888  1    31.745  ? 2160 B 1 .
ATOM 5898 C C    . PRO Bxp B    79  ? 47.822 2.63    14.053  1    31.828  ? 2160 B 1 .
ATOM 5899 O O    . PRO Bxp B    79  ? 48.902 2.551   14.608  1    34.752  ? 2160 B 1 .
ATOM 5900 C CB   . PRO Bxp B    79  ? 46.614 3.975   15.728  1    33.505  ? 2160 B 1 .
ATOM 5901 C CG   . PRO Bxp B    79  ? 45.881 3.509   16.967  1    36.773  ? 2160 B 1 .
ATOM 5902 C CD   . PRO Bxp B    79  ? 46.396 2.136   17.222  1    35.518  ? 2160 B 1 .
ATOM 5903 H HA   . PRO Bxp B    79  ? 45.769 2.696   14.329  1    32.135  ? 2160 B 1 c
ATOM 5904 H HB3  . PRO Bxp B    79  ? 46.146 4.713   15.293  1    33.785  ? 2160 B 1 c
ATOM 5905 H HB2  . PRO Bxp B    79  ? 47.531 4.235   15.937  1    33.731  ? 2160 B 1 c
ATOM 5906 H HG3  . PRO Bxp B    79  ? 44.915 3.492   16.815  1    35.723  ? 2160 B 1 c
ATOM 5907 H HG2  . PRO Bxp B    79  ? 46.071 4.095   17.726  1    35.723  ? 2160 B 1 c
ATOM 5908 H HD3  . PRO Bxp B    79  ? 47.246 2.148   17.7    1    34.926  ? 2160 B 1 c
ATOM 5909 H HD2  . PRO Bxp B    79  ? 45.747 1.595   17.71   1    34.963  ? 2160 B 1 c
ATOM 5910 N N    . VAL Bxp B    80  ? 47.647 2.547   12.742  1    31.311  ? 2161 B 1 .
ATOM 5911 C CA   . VAL Bxp B    80  ? 48.772 2.557   11.84   1    29.426  ? 2161 B 1 .
ATOM 5912 C C    . VAL Bxp B    80  ? 48.533 3.64    10.808  1    30.455  ? 2161 B 1 .
ATOM 5913 O O    . VAL Bxp B    80  ? 47.411 3.875   10.365  1    31.571  ? 2161 B 1 .
ATOM 5914 C CB   . VAL Bxp B    80  ? 48.968 1.179   11.195  1    28.183  ? 2161 B 1 .
ATOM 5915 C CG1  . VAL Bxp B    80  ? 49.561 1.275   9.796   1    28.015  ? 2161 B 1 .
ATOM 5916 C CG2  . VAL Bxp B    80  ? 49.799 0.284   12.097  1    27.114  ? 2161 B 1 .
ATOM 5917 H H    . VAL Bxp B    80  ? 46.803 2.48    12.397  1    31.012  ? 2161 B 1 c
ATOM 5918 H HA   . VAL Bxp B    80  ? 49.572 2.78    12.347  1    29.73   ? 2161 B 1 c
ATOM 5919 H HB   . VAL Bxp B    80  ? 48.075 0.77    11.111  1    28.191  ? 2161 B 1 c
ATOM 5920 H HG11 . VAL Bxp B    80  ? 50.406 1.755   9.831   1    28.105  ? 2161 B 1 c
ATOM 5921 H HG12 . VAL Bxp B    80  ? 48.945 1.745   9.209   1    28.093  ? 2161 B 1 c
ATOM 5922 H HG13 . VAL Bxp B    80  ? 49.712 0.381   9.448   1    28.108  ? 2161 B 1 c
ATOM 5923 H HG21 . VAL Bxp B    80  ? 49.899 -0.588  11.681  1    27.489  ? 2161 B 1 c
ATOM 5924 H HG22 . VAL Bxp B    80  ? 49.355 0.184   12.956  1    27.478  ? 2161 B 1 c
ATOM 5925 H HG23 . VAL Bxp B    80  ? 50.675 0.681   12.23   1    27.463  ? 2161 B 1 c
ATOM 5926 N N    . ILE Bxp B    81  ? 49.619 4.296   10.433  1    31.748  ? 2162 B 1 .
ATOM 5927 C CA   . ILE Bxp B    81  ? 49.558 5.207   9.318   1    31.609  ? 2162 B 1 .
ATOM 5928 C C    . ILE Bxp B    81  ? 50.445 4.7     8.184   1    32.626  ? 2162 B 1 .
ATOM 5929 O O    . ILE Bxp B    81  ? 51.643 4.464   8.341   1    30.667  ? 2162 B 1 .
ATOM 5930 C CB   . ILE Bxp B    81  ? 49.942 6.612   9.769   1    29.87   ? 2162 B 1 .
ATOM 5931 C CG1  . ILE Bxp B    81  ? 48.915 7.148   10.721  1    27.511  ? 2162 B 1 .
ATOM 5932 C CG2  . ILE Bxp B    81  ? 50.134 7.502   8.545   1    32.09   ? 2162 B 1 .
ATOM 5933 C CD1  . ILE Bxp B    81  ? 49.256 8.527   11.238  1    28.386  ? 2162 B 1 .
ATOM 5934 H H    . ILE Bxp B    81  ? 50.411 4.177   10.874  1    31.374  ? 2162 B 1 c
ATOM 5935 H HA   . ILE Bxp B    81  ? 48.638 5.238   8.998   1    31.485  ? 2162 B 1 c
ATOM 5936 H HB   . ILE Bxp B    81  ? 50.795 6.556   10.244  1    30.101  ? 2162 B 1 c
ATOM 5937 H HG12 . ILE Bxp B    81  ? 48.834 6.535   11.48   1    28.262  ? 2162 B 1 c
ATOM 5938 H HG13 . ILE Bxp B    81  ? 48.049 7.184   10.266  1    28.264  ? 2162 B 1 c
ATOM 5939 H HG21 . ILE Bxp B    81  ? 50.129 8.436   8.814   1    31.377  ? 2162 B 1 c
ATOM 5940 H HG22 . ILE Bxp B    81  ? 49.411 7.348   7.913   1    31.414  ? 2162 B 1 c
ATOM 5941 H HG23 . ILE Bxp B    81  ? 50.983 7.296   8.12    1    31.396  ? 2162 B 1 c
ATOM 5942 H HD11 . ILE Bxp B    81  ? 50.225 8.648   11.242  1    28.152  ? 2162 B 1 c
ATOM 5943 H HD12 . ILE Bxp B    81  ? 48.914 8.627   12.147  1    28.135  ? 2162 B 1 c
ATOM 5944 H HD13 . ILE Bxp B    81  ? 48.848 9.201   10.664  1    28.151  ? 2162 B 1 c
ATOM 5945 N N    . PHE Bxp B    82  ? 49.816 4.555   7.022   1    32.995  ? 2163 B 1 .
ATOM 5946 C CA   . PHE Bxp B    82  ? 50.547 4.332   5.797   1    33.512  ? 2163 B 1 .
ATOM 5947 C C    . PHE Bxp B    82  ? 50.92  5.686   5.225   1    33.58   ? 2163 B 1 .
ATOM 5948 O O    . PHE Bxp B    82  ? 50.043 6.455   4.845   1    33.642  ? 2163 B 1 .
ATOM 5949 C CB   . PHE Bxp B    82  ? 49.656 3.525   4.857   1    33.857  ? 2163 B 1 .
ATOM 5950 C CG   . PHE Bxp B    82  ? 49.43  2.119   5.378   1    34.165  ? 2163 B 1 .
ATOM 5951 C CD1  . PHE Bxp B    82  ? 50.498 1.332   5.806   1    34.394  ? 2163 B 1 .
ATOM 5952 C CD2  . PHE Bxp B    82  ? 48.148 1.603   5.466   1    34.666  ? 2163 B 1 .
ATOM 5953 C CE1  . PHE Bxp B    82  ? 50.283 0.056   6.296   1    34.626  ? 2163 B 1 .
ATOM 5954 C CE2  . PHE Bxp B    82  ? 47.945 0.325   5.958   1    35.781  ? 2163 B 1 .
ATOM 5955 C CZ   . PHE Bxp B    82  ? 49.009 -0.448  6.368   1    34.697  ? 2163 B 1 .
ATOM 5956 H H    . PHE Bxp B    82  ? 48.904 4.595   6.992   1    33.01   ? 2163 B 1 c
ATOM 5957 H HA   . PHE Bxp B    82  ? 51.372 3.818   5.993   1    33.436  ? 2163 B 1 c
ATOM 5958 H HB3  . PHE Bxp B    82  ? 50.084 3.479   3.974   1    33.849  ? 2163 B 1 c
ATOM 5959 H HB2  . PHE Bxp B    82  ? 48.791 3.983   4.765   1    33.853  ? 2163 B 1 c
ATOM 5960 H HD1  . PHE Bxp B    82  ? 51.377 1.67    5.757   1    34.389  ? 2163 B 1 c
ATOM 5961 H HD2  . PHE Bxp B    82  ? 47.412 2.123   5.187   1    34.79   ? 2163 B 1 c
ATOM 5962 H HE1  . PHE Bxp B    82  ? 51.013 -0.469  6.575   1    34.439  ? 2163 B 1 c
ATOM 5963 H HE2  . PHE Bxp B    82  ? 47.069 -0.022  6.007   1    35.251  ? 2163 B 1 c
ATOM 5964 H HZ   . PHE Bxp B    82  ? 48.862 -1.317  6.702   1    34.88   ? 2163 B 1 c
ATOM 5965 N N    . TYR Bxp B    83  ? 52.219 5.969   5.205   1    33.112  ? 2164 B 1 .
ATOM 5966 C CA   . TYR Bxp B    83  ? 52.72  7.126   4.489   1    32.945  ? 2164 B 1 .
ATOM 5967 C C    . TYR Bxp B    83  ? 53.222 6.652   3.138   1    32.691  ? 2164 B 1 .
ATOM 5968 O O    . TYR Bxp B    83  ? 54.221 5.935   3.043   1    33.527  ? 2164 B 1 .
ATOM 5969 C CB   . TYR Bxp B    83  ? 53.869 7.835   5.203   1    32.39   ? 2164 B 1 .
ATOM 5970 C CG   . TYR Bxp B    83  ? 53.569 8.221   6.64    1    30.065  ? 2164 B 1 .
ATOM 5971 C CD1  . TYR Bxp B    83  ? 52.961 9.432   6.934   1    28.749  ? 2164 B 1 .
ATOM 5972 C CD2  . TYR Bxp B    83  ? 53.922 7.389   7.692   1    28.893  ? 2164 B 1 .
ATOM 5973 C CE1  . TYR Bxp B    83  ? 52.715 9.815   8.237   1    28.331  ? 2164 B 1 .
ATOM 5974 C CE2  . TYR Bxp B    83  ? 53.666 7.75    9.001   1    28.977  ? 2164 B 1 .
ATOM 5975 C CZ   . TYR Bxp B    83  ? 53.073 8.97    9.271   1    29.045  ? 2164 B 1 .
ATOM 5976 O OH   . TYR Bxp B    83  ? 52.837 9.326   10.562  1    29.34   ? 2164 B 1 .
ATOM 5977 H H    . TYR Bxp B    83  ? 52.811 5.433   5.65    1    33.189  ? 2164 B 1 c
ATOM 5978 H HA   . TYR Bxp B    83  ? 51.98  7.772   4.357   1    32.841  ? 2164 B 1 c
ATOM 5979 H HB3  . TYR Bxp B    83  ? 54.096 8.646   4.697   1    31.969  ? 2164 B 1 c
ATOM 5980 H HB2  . TYR Bxp B    83  ? 54.655 7.245   5.193   1    31.978  ? 2164 B 1 c
ATOM 5981 H HD1  . TYR Bxp B    83  ? 52.728 10.016  6.229   1    28.969  ? 2164 B 1 c
ATOM 5982 H HD2  . TYR Bxp B    83  ? 54.339 6.561   7.511   1    29.19   ? 2164 B 1 c
ATOM 5983 H HE1  . TYR Bxp B    83  ? 52.301 10.639  8.419   1    28.673  ? 2164 B 1 c
ATOM 5984 H HE2  . TYR Bxp B    83  ? 53.916 7.181   9.707   1    28.958  ? 2164 B 1 c
ATOM 5985 H HH   . TYR Bxp B    83  ? 52.449 10.167  10.531  0    23.2    ? 2164 B 1 c
ATOM 5986 N N    . ILE Bxp B    84  ? 52.515 7.062   2.096   1    32.081  ? 2165 B 1 .
ATOM 5987 C CA   . ILE Bxp B    84  ? 52.851 6.587   0.776   1    32.635  ? 2165 B 1 .
ATOM 5988 C C    . ILE Bxp B    84  ? 53.487 7.721   -0.001  1    33.455  ? 2165 B 1 .
ATOM 5989 O O    . ILE Bxp B    84  ? 52.853 8.734   -0.246  1    34.08   ? 2165 B 1 .
ATOM 5990 C CB   . ILE Bxp B    84  ? 51.593 6.081   0.075   1    33.198  ? 2165 B 1 .
ATOM 5991 C CG1  . ILE Bxp B    84  ? 50.837 5.112   0.966   1    33.589  ? 2165 B 1 .
ATOM 5992 C CG2  . ILE Bxp B    84  ? 51.965 5.477   -1.272  1    33.51   ? 2165 B 1 .
ATOM 5993 C CD1  . ILE Bxp B    84  ? 49.359 5.067   0.662   1    35.161  ? 2165 B 1 .
ATOM 5994 H H    . ILE Bxp B    84  ? 51.817 7.642   2.202   1    32.359  ? 2165 B 1 c
ATOM 5995 H HA   . ILE Bxp B    84  ? 53.486 5.85    0.85    1    32.821  ? 2165 B 1 c
ATOM 5996 H HB   . ILE Bxp B    84  ? 51.012 6.85    -0.089  1    33.239  ? 2165 B 1 c
ATOM 5997 H HG12 . ILE Bxp B    84  ? 50.958 5.372   1.901   1    33.831  ? 2165 B 1 c
ATOM 5998 H HG13 . ILE Bxp B    84  ? 51.213 4.217   0.852   1    33.858  ? 2165 B 1 c
ATOM 5999 H HG21 . ILE Bxp B    84  ? 51.235 5.607   -1.899  1    33.544  ? 2165 B 1 c
ATOM 6000 H HG22 . ILE Bxp B    84  ? 52.133 4.527   -1.166  1    33.52   ? 2165 B 1 c
ATOM 6001 H HG23 . ILE Bxp B    84  ? 52.764 5.907   -1.617  1    33.511  ? 2165 B 1 c
ATOM 6002 H HD11 . ILE Bxp B    84  ? 48.899 5.767   1.162   1    34.956  ? 2165 B 1 c
ATOM 6003 H HD12 . ILE Bxp B    84  ? 49.004 4.195   0.914   1    35.073  ? 2165 B 1 c
ATOM 6004 H HD13 . ILE Bxp B    84  ? 49.226 5.209   -0.292  1    35.118  ? 2165 B 1 c
ATOM 6005 N N    . MET Bxp B    85  ? 54.736 7.54    -0.408  1    35.252  ? 2166 B 1 .
ATOM 6006 C CA   . MET Bxp B    85  ? 55.332 8.501   -1.312  1    36.668  ? 2166 B 1 .
ATOM 6007 C C    . MET Bxp B    85  ? 55.334 7.929   -2.725  1    37.785  ? 2166 B 1 .
ATOM 6008 O O    . MET Bxp B    85  ? 55.878 6.852   -2.987  1    36.585  ? 2166 B 1 .
ATOM 6009 C CB   . MET Bxp B    85  ? 56.735 8.89    -0.856  1    38.184  ? 2166 B 1 .
ATOM 6010 C CG   . MET Bxp B    85  ? 56.731 9.975   0.193   1    39.633  ? 2166 B 1 .
ATOM 6011 S SD   . MET Bxp B    85  ? 56.225 9.365   1.811   1    42.192  ? 2166 B 1 .
ATOM 6012 C CE   . MET Bxp B    85  ? 57.211 10.52   2.774   1    43.265  ? 2166 B 1 .
ATOM 6013 H H    . MET Bxp B    85  ? 55.223 6.82    -0.126  1    35.109  ? 2166 B 1 c
ATOM 6014 H HA   . MET Bxp B    85  ? 54.765 9.313   -1.312  1    36.869  ? 2166 B 1 c
ATOM 6015 H HB3  . MET Bxp B    85  ? 57.248 9.197   -1.634  1    38.153  ? 2166 B 1 c
ATOM 6016 H HB2  . MET Bxp B    85  ? 57.182 8.095   -0.496  1    38.138  ? 2166 B 1 c
ATOM 6017 H HG3  . MET Bxp B    85  ? 56.124 10.69   -0.08   1    39.689  ? 2166 B 1 c
ATOM 6018 H HG2  . MET Bxp B    85  ? 57.629 10.355  0.266   1    39.739  ? 2166 B 1 c
ATOM 6019 H HE3  . MET Bxp B    85  ? 57.343 11.339  2.263   1    42.904  ? 2166 B 1 c
ATOM 6020 H HE2  . MET Bxp B    85  ? 58.075 10.117  2.976   1    42.894  ? 2166 B 1 c
ATOM 6021 H HE1  . MET Bxp B    85  ? 56.746 10.726  3.606   1    42.912  ? 2166 B 1 c
ATOM 6022 N N    . VAL Bxp B    86  ? 54.703 8.681   -3.63   1    38.115  ? 2167 B 1 .
ATOM 6023 C CA   . VAL Bxp B    86  ? 54.634 8.297   -5.027  1    38.481  ? 2167 B 1 .
ATOM 6024 C C    . VAL Bxp B    86  ? 54.921 9.505   -5.908  1    40.5    ? 2167 B 1 .
ATOM 6025 O O    . VAL Bxp B    86  ? 54.82  10.641  -5.459  1    40.736  ? 2167 B 1 .
ATOM 6026 C CB   . VAL Bxp B    86  ? 53.244 7.731   -5.317  1    38.219  ? 2167 B 1 .
ATOM 6027 C CG1  . VAL Bxp B    86  ? 52.949 6.553   -4.408  1    38.625  ? 2167 B 1 .
ATOM 6028 C CG2  . VAL Bxp B    86  ? 52.181 8.807   -5.161  1    40.378  ? 2167 B 1 .
ATOM 6029 H H    . VAL Bxp B    86  ? 54.313 9.465   -3.37   1    38.135  ? 2167 B 1 c
ATOM 6030 H HA   . VAL Bxp B    86  ? 55.3   7.613   -5.201  1    38.755  ? 2167 B 1 c
ATOM 6031 H HB   . VAL Bxp B    86  ? 53.24  7.417   -6.251  1    38.735  ? 2167 B 1 c
ATOM 6032 H HG11 . VAL Bxp B    86  ? 52.573 6.876   -3.574  1    38.448  ? 2167 B 1 c
ATOM 6033 H HG12 . VAL Bxp B    86  ? 53.77  6.067   -4.226  1    38.5    ? 2167 B 1 c
ATOM 6034 H HG13 . VAL Bxp B    86  ? 52.312 5.961   -4.842  1    38.492  ? 2167 B 1 c
ATOM 6035 H HG21 . VAL Bxp B    86  ? 51.306 8.39    -5.09   1    39.702  ? 2167 B 1 c
ATOM 6036 H HG22 . VAL Bxp B    86  ? 52.194 9.393   -5.937  1    39.711  ? 2167 B 1 c
ATOM 6037 H HG23 . VAL Bxp B    86  ? 52.354 9.328   -4.361  1    39.642  ? 2167 B 1 c
ATOM 6038 N N    . ASP Bxp B    87  ? 55.254 9.239   -7.174  1    43.41   ? 2168 B 1 .
ATOM 6039 C CA   . ASP Bxp B    87  ? 55.619 10.296  -8.105  1    44.366  ? 2168 B 1 .
ATOM 6040 C C    . ASP Bxp B    87  ? 54.371 10.834  -8.773  1    44.585  ? 2168 B 1 .
ATOM 6041 O O    . ASP Bxp B    87  ? 54.351 12.01   -9.116  1    46.793  ? 2168 B 1 .
ATOM 6042 C CB   . ASP Bxp B    87  ? 56.586 9.84    -9.183  1    45.607  ? 2168 B 1 .
ATOM 6043 C CG   . ASP Bxp B    87  ? 56.212 8.528   -9.845  1    46.866  ? 2168 B 1 .
ATOM 6044 O OD1  . ASP Bxp B    87  ? 55.103 8.024   -9.542  1    46.28   ? 2168 B 1 .
ATOM 6045 O OD2  . ASP Bxp B    87  ? 57.046 8.014   -10.62  1    50.919  ? 2168 B 1 .
ATOM 6046 H H    . ASP Bxp B    87  ? 55.259 8.372   -7.462  1    42.907  ? 2168 B 1 c
ATOM 6047 H HA   . ASP Bxp B    87  ? 56.047 11.024  -7.601  1    44.364  ? 2168 B 1 c
ATOM 6048 H HB3  . ASP Bxp B    87  ? 57.477 9.744   -8.789  1    45.652  ? 2168 B 1 c
ATOM 6049 H HB2  . ASP Bxp B    87  ? 56.638 10.529  -9.878  1    45.61   ? 2168 B 1 c
ATOM 6050 N N    . ASP Bxp B    88  ? 53.37  9.957   -8.955  1    47.994  ? 2169 B 1 .
ATOM 6051 C CA   . ASP Bxp B    88  ? 52.108 10.325  -9.584  1    52.263  ? 2169 B 1 .
ATOM 6052 C C    . ASP Bxp B    88  ? 50.921 9.875   -8.725  1    47.841  ? 2169 B 1 .
ATOM 6053 O O    . ASP Bxp B    88  ? 50.525 8.71    -8.739  1    43.648  ? 2169 B 1 .
ATOM 6054 C CB   . ASP Bxp B    88  ? 52.031 9.807   -11.014 1    57.049  ? 2169 B 1 .
ATOM 6055 C CG   . ASP Bxp B    88  ? 50.829 10.303  -11.809 1    59.7    ? 2169 B 1 .
ATOM 6056 O OD1  . ASP Bxp B    88  ? 50.317 11.399  -11.486 1    62.696  ? 2169 B 1 .
ATOM 6057 O OD2  . ASP Bxp B    88  ? 50.379 9.566   -12.707 1    58.566  ? 2169 B 1 .
ATOM 6058 H H    . ASP Bxp B    88  ? 53.482 9.091   -8.686  1    47.967  ? 2169 B 1 c
ATOM 6059 H HA   . ASP Bxp B    88  ? 52.08  11.306  -9.648  1    51.391  ? 2169 B 1 c
ATOM 6060 H HB3  . ASP Bxp B    88  ? 52.002 8.828   -10.995 1    56.433  ? 2169 B 1 c
ATOM 6061 H HB2  . ASP Bxp B    88  ? 52.844 10.075  -11.49  1    56.492  ? 2169 B 1 c
ATOM 6062 N N    . VAL Bxp B    89  ? 50.316 10.843  -8.029  1    49.548  ? 2170 B 1 .
ATOM 6063 C CA   . VAL Bxp B    89  ? 49.244 10.579  -7.082  1    52.724  ? 2170 B 1 .
ATOM 6064 C C    . VAL Bxp B    89  ? 48.022 10.01   -7.793  1    52.811  ? 2170 B 1 .
ATOM 6065 O O    . VAL Bxp B    89  ? 47.259 9.284   -7.17   1    53.272  ? 2170 B 1 .
ATOM 6066 C CB   . VAL Bxp B    89  ? 48.835 11.789  -6.214  1    57.355  ? 2170 B 1 .
ATOM 6067 C CG1  . VAL Bxp B    89  ? 49.518 11.73   -4.862  1    61.065  ? 2170 B 1 .
ATOM 6068 C CG2  . VAL Bxp B    89  ? 49.088 13.146  -6.87   1    58.8    ? 2170 B 1 .
ATOM 6069 H H    . VAL Bxp B    89  ? 50.591 11.705  -8.15   1    50.049  ? 2170 B 1 c
ATOM 6070 H HA   . VAL Bxp B    89  ? 49.569 9.886   -6.476  1    52.98   ? 2170 B 1 c
ATOM 6071 H HB   . VAL Bxp B    89  ? 47.865 11.716  -6.055  1    57.379  ? 2170 B 1 c
ATOM 6072 H HG11 . VAL Bxp B    89  ? 50.452 11.981  -4.958  1    59.75   ? 2170 B 1 c
ATOM 6073 H HG12 . VAL Bxp B    89  ? 49.461 10.828  -4.509  1    59.18   ? 2170 B 1 c
ATOM 6074 H HG13 . VAL Bxp B    89  ? 49.08  12.345  -4.249  1    59.758  ? 2170 B 1 c
ATOM 6075 H HG21 . VAL Bxp B    89  ? 48.559 13.827  -6.42   1    58.333  ? 2170 B 1 c
ATOM 6076 H HG22 . VAL Bxp B    89  ? 48.833 13.108  -7.807  1    58.244  ? 2170 B 1 c
ATOM 6077 H HG23 . VAL Bxp B    89  ? 50.031 13.373  -6.799  1    58.299  ? 2170 B 1 c
ATOM 6078 N N    . SER Bxp B    90  ? 47.824 10.341  -9.076  1    55.177  ? 2171 B 1 .
ATOM 6079 C CA   . SER Bxp B    90  ? 46.683 9.816   -9.811  1    56.232  ? 2171 B 1 .
ATOM 6080 C C    . SER Bxp B    90  ? 46.79  8.295   -9.945  1    58.526  ? 2171 B 1 .
ATOM 6081 O O    . SER Bxp B    90  ? 45.767 7.619   -9.979  1    63.078  ? 2171 B 1 .
ATOM 6082 C CB   . SER Bxp B    90  ? 46.506 10.487  -11.157 1    54.351  ? 2171 B 1 .
ATOM 6083 O OG   . SER Bxp B    90  ? 47.479 10.042  -12.09  1    54.077  ? 2171 B 1 .
ATOM 6084 H H    . SER Bxp B    90  ? 48.399 10.912  -9.497  1    54.738  ? 2171 B 1 c
ATOM 6085 H HA   . SER Bxp B    90  ? 45.872 10.009  -9.274  1    56.05   ? 2171 B 1 c
ATOM 6086 H HB3  . SER Bxp B    90  ? 46.581 11.454  -11.047 1    54.704  ? 2171 B 1 c
ATOM 6087 H HB2  . SER Bxp B    90  ? 45.614 10.289  -11.501 1    54.704  ? 2171 B 1 c
ATOM 6088 H HG   . SER Bxp B    90  ? 47.385 10.655  -12.763 0    47.51   ? 2171 B 1 c
ATOM 6089 N N    . ARG Bxp B    91  ? 48.017 7.752   -9.994  1    58.633  ? 2172 B 1 .
ATOM 6090 C CA   . ARG Bxp B    91  ? 48.197 6.316   -10.163 1    61.791  ? 2172 B 1 .
ATOM 6091 C C    . ARG Bxp B    91  ? 48.048 5.596   -8.821  1    58.514  ? 2172 B 1 .
ATOM 6092 O O    . ARG Bxp B    91  ? 47.809 4.391   -8.795  1    59.503  ? 2172 B 1 .
ATOM 6093 C CB   . ARG Bxp B    91  ? 49.499 5.962   -10.902 1    67.704  ? 2172 B 1 .
ATOM 6094 C CG   . ARG Bxp B    91  ? 49.5   6.3     -12.395 1    72.627  ? 2172 B 1 .
ATOM 6095 C CD   . ARG Bxp B    91  ? 50.464 5.514   -13.317 1    73.583  ? 2172 B 1 .
ATOM 6096 N NE   . ARG Bxp B    91  ? 51.886 5.538   -12.937 1    78.671  ? 2172 B 1 .
ATOM 6097 C CZ   . ARG Bxp B    91  ? 52.783 6.474   -13.263 1    77.494  ? 2172 B 1 .
ATOM 6098 N NH1  . ARG Bxp B    91  ? 52.456 7.46    -14.08  1    76.986  ? 2172 B 1 .
ATOM 6099 N NH2  . ARG Bxp B    91  ? 54.013 6.42    -12.78  1    73.96   ? 2172 B 1 .
ATOM 6100 H H    . ARG Bxp B    91  ? 48.756 8.286   -9.933  1    59.151  ? 2172 B 1 c
ATOM 6101 H HA   . ARG Bxp B    91  ? 47.462 5.995   -10.746 1    61.645  ? 2172 B 1 c
ATOM 6102 H HB3  . ARG Bxp B    91  ? 49.665 5       -10.799 1    67.297  ? 2172 B 1 c
ATOM 6103 H HB2  . ARG Bxp B    91  ? 50.242 6.438   -10.473 1    67.369  ? 2172 B 1 c
ATOM 6104 H HG3  . ARG Bxp B    91  ? 49.7   7.254   -12.49  1    71.573  ? 2172 B 1 c
ATOM 6105 H HG2  . ARG Bxp B    91  ? 48.588 6.178   -12.736 1    71.587  ? 2172 B 1 c
ATOM 6106 H HD3  . ARG Bxp B    91  ? 50.376 5.883   -14.22  1    74.588  ? 2172 B 1 c
ATOM 6107 H HD2  . ARG Bxp B    91  ? 50.162 4.59    -13.359 1    74.732  ? 2172 B 1 c
ATOM 6108 H HE   . ARG Bxp B    91  ? 52.175 4.877   -12.449 1    77.144  ? 2172 B 1 c
ATOM 6109 H HH11 . ARG Bxp B    91  ? 51.82  8.029   -13.848 1    77.142  ? 2172 B 1 c
ATOM 6110 H HH12 . ARG Bxp B    91  ? 52.874 7.546   -14.854 1    77.142  ? 2172 B 1 c
ATOM 6111 H HH21 . ARG Bxp B    91  ? 54.145 6.108   -11.963 1    74.762  ? 2172 B 1 c
ATOM 6112 H HH22 . ARG Bxp B    91  ? 54.685 6.716   -13.27  1    74.817  ? 2172 B 1 c
ATOM 6113 N N    . MET Bxp B    92  ? 48.171 6.338   -7.716  1    59.854  ? 2173 B 1 .
ATOM 6114 C CA   . MET Bxp B    92  ? 48.071 5.795   -6.366  1    58.38   ? 2173 B 1 .
ATOM 6115 C C    . MET Bxp B    92  ? 46.78  4.993   -6.191  1    56.114  ? 2173 B 1 .
ATOM 6116 O O    . MET Bxp B    92  ? 45.69  5.553   -6.219  1    56.288  ? 2173 B 1 .
ATOM 6117 C CB   . MET Bxp B    92  ? 48.122 6.938   -5.346  1    58.327  ? 2173 B 1 .
ATOM 6118 C CG   . MET Bxp B    92  ? 47.419 6.676   -4.046  1    58.512  ? 2173 B 1 .
ATOM 6119 S SD   . MET Bxp B    92  ? 48.46  5.693   -2.958  1    62.296  ? 2173 B 1 .
ATOM 6120 C CE   . MET Bxp B    92  ? 47.14  5.085   -1.888  1    59.078  ? 2173 B 1 .
ATOM 6121 H H    . MET Bxp B    92  ? 48.344 7.23    -7.807  1    59.156  ? 2173 B 1 c
ATOM 6122 H HA   . MET Bxp B    92  ? 48.845 5.198   -6.221  1    58.118  ? 2173 B 1 c
ATOM 6123 H HB3  . MET Bxp B    92  ? 47.727 7.734   -5.754  1    58.359  ? 2173 B 1 c
ATOM 6124 H HB2  . MET Bxp B    92  ? 49.063 7.141   -5.159  1    58.396  ? 2173 B 1 c
ATOM 6125 H HG3  . MET Bxp B    92  ? 46.58  6.208   -4.201  1    59.145  ? 2173 B 1 c
ATOM 6126 H HG2  . MET Bxp B    92  ? 47.216 7.526   -3.608  1    59.24   ? 2173 B 1 c
ATOM 6127 H HE3  . MET Bxp B    92  ? 46.351 4.884   -2.424  1    59.754  ? 2173 B 1 c
ATOM 6128 H HE2  . MET Bxp B    92  ? 46.919 5.766   -1.226  1    59.787  ? 2173 B 1 c
ATOM 6129 H HE1  . MET Bxp B    92  ? 47.437 4.275   -1.434  1    59.599  ? 2173 B 1 c
ATOM 6130 N N    . PRO Bxp B    93  ? 46.871 3.664   -5.956  1    53.773  ? 2174 B 1 .
ATOM 6131 C CA   . PRO Bxp B    93  ? 45.71  2.815   -5.769  1    51.773  ? 2174 B 1 .
ATOM 6132 C C    . PRO Bxp B    93  ? 45.178 2.904   -4.354  1    52.196  ? 2174 B 1 .
ATOM 6133 O O    . PRO Bxp B    93  ? 45.834 2.417   -3.44   1    53.098  ? 2174 B 1 .
ATOM 6134 C CB   . PRO Bxp B    93  ? 46.284 1.425   -5.979  1    52.98   ? 2174 B 1 .
ATOM 6135 C CG   . PRO Bxp B    93  ? 47.669 1.552   -5.383  1    51.542  ? 2174 B 1 .
ATOM 6136 C CD   . PRO Bxp B    93  ? 48.123 2.92    -5.773  1    54.381  ? 2174 B 1 .
ATOM 6137 H HA   . PRO Bxp B    93  ? 45.013 3.024   -6.425  1    52.49   ? 2174 B 1 c
ATOM 6138 H HB3  . PRO Bxp B    93  ? 46.328 1.202   -6.929  1    52.379  ? 2174 B 1 c
ATOM 6139 H HB2  . PRO Bxp B    93  ? 45.757 0.749   -5.51   1    52.382  ? 2174 B 1 c
ATOM 6140 H HG3  . PRO Bxp B    93  ? 48.269 0.873   -5.752  1    52.507  ? 2174 B 1 c
ATOM 6141 H HG2  . PRO Bxp B    93  ? 47.647 1.457   -4.411  1    52.508  ? 2174 B 1 c
ATOM 6142 H HD3  . PRO Bxp B    93  ? 48.652 3.326   -5.07   1    53.39   ? 2174 B 1 c
ATOM 6143 H HD2  . PRO Bxp B    93  ? 48.641 2.902   -6.601  1    53.605  ? 2174 B 1 c
ATOM 6144 N N    . LEU Bxp B    94  ? 44.028 3.554   -4.178  1    55.988  ? 2175 B 1 .
ATOM 6145 C CA   . LEU Bxp B    94  ? 43.466 3.724   -2.846  1    58.966  ? 2175 B 1 .
ATOM 6146 C C    . LEU Bxp B    94  ? 42.642 2.492   -2.484  1    54.681  ? 2175 B 1 .
ATOM 6147 O O    . LEU Bxp B    94  ? 41.484 2.362   -2.86   1    54.347  ? 2175 B 1 .
ATOM 6148 C CB   . LEU Bxp B    94  ? 42.624 4.993   -2.784  1    59.704  ? 2175 B 1 .
ATOM 6149 C CG   . LEU Bxp B    94  ? 43.388 6.293   -3.024  1    62.117  ? 2175 B 1 .
ATOM 6150 C CD1  . LEU Bxp B    94  ? 42.463 7.283   -3.705  1    61.89   ? 2175 B 1 .
ATOM 6151 C CD2  . LEU Bxp B    94  ? 43.924 6.836   -1.714  1    66.811  ? 2175 B 1 .
ATOM 6152 H H    . LEU Bxp B    94  ? 43.582 3.898   -4.898  1    55.673  ? 2175 B 1 c
ATOM 6153 H HA   . LEU Bxp B    94  ? 44.214 3.806   -2.2    1    57.533  ? 2175 B 1 c
ATOM 6154 H HB3  . LEU Bxp B    94  ? 42.198 5.038   -1.897  1    60.139  ? 2175 B 1 c
ATOM 6155 H HB2  . LEU Bxp B    94  ? 41.909 4.92    -3.459  1    60.066  ? 2175 B 1 c
ATOM 6156 H HG   . LEU Bxp B    94  ? 44.153 6.106   -3.627  1    62.409  ? 2175 B 1 c
ATOM 6157 H HD11 . LEU Bxp B    94  ? 42.333 7.021   -4.632  1    61.985  ? 2175 B 1 c
ATOM 6158 H HD12 . LEU Bxp B    94  ? 42.857 8.17    -3.672  1    62.083  ? 2175 B 1 c
ATOM 6159 H HD13 . LEU Bxp B    94  ? 41.605 7.294   -3.249  1    61.974  ? 2175 B 1 c
ATOM 6160 H HD21 . LEU Bxp B    94  ? 44.175 6.098   -1.134  1    65.276  ? 2175 B 1 c
ATOM 6161 H HD22 . LEU Bxp B    94  ? 43.238 7.37    -1.278  1    65.364  ? 2175 B 1 c
ATOM 6162 H HD23 . LEU Bxp B    94  ? 44.703 7.39    -1.885  1    65.482  ? 2175 B 1 c
ATOM 6163 N N    . ILE Bxp B    95  ? 43.257 1.575   -1.754  1    48.512  ? 2176 B 1 .
ATOM 6164 C CA   . ILE Bxp B    95  ? 42.548 0.392   -1.334  1    49.364  ? 2176 B 1 .
ATOM 6165 C C    . ILE Bxp B    95  ? 41.767 0.753   -0.092  1    45.086  ? 2176 B 1 .
ATOM 6166 O O    . ILE Bxp B    95  ? 42.257 1.519   0.721   1    44.728  ? 2176 B 1 .
ATOM 6167 C CB   . ILE Bxp B    95  ? 43.501 -0.783  -1.09   1    59.44   ? 2176 B 1 .
ATOM 6168 C CG1  . ILE Bxp B    95  ? 44.802 -0.35   -0.417  1    62.391  ? 2176 B 1 .
ATOM 6169 C CG2  . ILE Bxp B    95  ? 43.772 -1.535  -2.391  1    69.37   ? 2176 B 1 .
ATOM 6170 C CD1  . ILE Bxp B    95  ? 44.931 -0.792  1.026   1    64.339  ? 2176 B 1 .
ATOM 6171 H H    . ILE Bxp B    95  ? 44.132 1.689   -1.52   1    50.472  ? 2176 B 1 c
ATOM 6172 H HA   . ILE Bxp B    95  ? 41.92  0.138   -2.039  1    50.251  ? 2176 B 1 c
ATOM 6173 H HB   . ILE Bxp B    95  ? 43.05  -1.404  -0.484  1    59.593  ? 2176 B 1 c
ATOM 6174 H HG12 . ILE Bxp B    95  ? 44.873 0.623   -0.448  1    61.776  ? 2176 B 1 c
ATOM 6175 H HG13 . ILE Bxp B    95  ? 45.555 -0.718  -0.923  1    62.14   ? 2176 B 1 c
ATOM 6176 H HG21 . ILE Bxp B    95  ? 44.36  -2.289  -2.216  1    66.228  ? 2176 B 1 c
ATOM 6177 H HG22 . ILE Bxp B    95  ? 44.196 -0.938  -3.031  1    66.251  ? 2176 B 1 c
ATOM 6178 H HG23 . ILE Bxp B    95  ? 42.934 -1.86   -2.761  1    66.152  ? 2176 B 1 c
ATOM 6179 H HD11 . ILE Bxp B    95  ? 44.05  -0.98   1.4     1    63.007  ? 2176 B 1 c
ATOM 6180 H HD12 . ILE Bxp B    95  ? 45.358 -0.079  1.535   1    62.9    ? 2176 B 1 c
ATOM 6181 H HD13 . ILE Bxp B    95  ? 45.481 -1.594  1.072   1    62.753  ? 2176 B 1 c
ATOM 6182 N N    . GLU Bxp B    96  ? 40.56  0.195   0.013   1    47.601  ? 2177 B 1 .
ATOM 6183 C CA   . GLU Bxp B    96  ? 39.757 0.302   1.219   1    52.456  ? 2177 B 1 .
ATOM 6184 C C    . GLU Bxp B    96  ? 40.579 -0.23   2.395   1    52.048  ? 2177 B 1 .
ATOM 6185 O O    . GLU Bxp B    96  ? 41.06  -1.362  2.366   1    57.691  ? 2177 B 1 .
ATOM 6186 C CB   . GLU Bxp B    96  ? 38.394 -0.382  1.055   1    55.706  ? 2177 B 1 .
ATOM 6187 C CG   . GLU Bxp B    96  ? 37.84  -0.973  2.355   1    59.778  ? 2177 B 1 .
ATOM 6188 C CD   . GLU Bxp B    96  ? 36.329 -1.074  2.508   1    59.287  ? 2177 B 1 .
ATOM 6189 O OE1  . GLU Bxp B    96  ? 35.582 -0.731  1.568   1    60.738  ? 2177 B 1 .
ATOM 6190 O OE2  . GLU Bxp B    96  ? 35.902 -1.477  3.61    1    54.73   ? 2177 B 1 .
ATOM 6191 H H    . GLU Bxp B    96  ? 40.222 -0.27   -0.697  1    48.169  ? 2177 B 1 c
ATOM 6192 H HA   . GLU Bxp B    96  ? 39.584 1.265   1.377   1    51.87   ? 2177 B 1 c
ATOM 6193 H HB3  . GLU Bxp B    96  ? 38.477 -1.103  0.397   1    55.732  ? 2177 B 1 c
ATOM 6194 H HB2  . GLU Bxp B    96  ? 37.756 0.272   0.702   1    55.841  ? 2177 B 1 c
ATOM 6195 H HG3  . GLU Bxp B    96  ? 38.174 -0.437  3.105   1    58.633  ? 2177 B 1 c
ATOM 6196 H HG2  . GLU Bxp B    96  ? 38.212 -1.873  2.467   1    58.67   ? 2177 B 1 c
ATOM 6197 N N    . LEU Bxp B    97  ? 40.722 0.601   3.432   1    44.912  ? 2178 B 1 .
ATOM 6198 C CA   . LEU Bxp B    97  ? 41.54  0.247   4.567   1    38.951  ? 2178 B 1 .
ATOM 6199 C C    . LEU Bxp B    97  ? 40.696 -0.293  5.695   1    37.299  ? 2178 B 1 .
ATOM 6200 O O    . LEU Bxp B    97  ? 39.557 0.121   5.902   1    36.94   ? 2178 B 1 .
ATOM 6201 C CB   . LEU Bxp B    97  ? 42.333 1.468   4.994   1    38.955  ? 2178 B 1 .
ATOM 6202 C CG   . LEU Bxp B    97  ? 43.445 1.779   4.005   1    40.512  ? 2178 B 1 .
ATOM 6203 C CD1  . LEU Bxp B    97  ? 44.392 2.836   4.47    1    42.132  ? 2178 B 1 .
ATOM 6204 C CD2  . LEU Bxp B    97  ? 44.14  0.455   3.819   1    41.881  ? 2178 B 1 .
ATOM 6205 H H    . LEU Bxp B    97  ? 40.292 1.407   3.43    1    45.05   ? 2178 B 1 c
ATOM 6206 H HA   . LEU Bxp B    97  ? 42.159 -0.466  4.289   1    39.871  ? 2178 B 1 c
ATOM 6207 H HB3  . LEU Bxp B    97  ? 42.729 1.296   5.879   1    39.295  ? 2178 B 1 c
ATOM 6208 H HB2  . LEU Bxp B    97  ? 41.724 2.24    5.045   1    39.337  ? 2178 B 1 c
ATOM 6209 H HG   . LEU Bxp B    97  ? 43.041 2.059   3.144   1    40.789  ? 2178 B 1 c
ATOM 6210 H HD11 . LEU Bxp B    97  ? 43.97  3.708   4.393   1    41.646  ? 2178 B 1 c
ATOM 6211 H HD12 . LEU Bxp B    97  ? 45.195 2.818   3.923   1    41.681  ? 2178 B 1 c
ATOM 6212 H HD13 . LEU Bxp B    97  ? 44.631 2.673   5.398   1    41.634  ? 2178 B 1 c
ATOM 6213 H HD21 . LEU Bxp B    97  ? 43.637 -0.094  3.198   1    41.855  ? 2178 B 1 c
ATOM 6214 H HD22 . LEU Bxp B    97  ? 44.214 -0.001  4.673   1    41.523  ? 2178 B 1 c
ATOM 6215 H HD23 . LEU Bxp B    97  ? 45.031 0.607   3.464   1    41.78   ? 2178 B 1 c
ATOM 6216 N N    . GLY Bxp B    98  ? 41.324 -1.205  6.432   1    36.195  ? 2179 B 1 .
ATOM 6217 C CA   . GLY Bxp B    98  ? 40.689 -1.853  7.56    1    35.955  ? 2179 B 1 .
ATOM 6218 C C    . GLY Bxp B    98  ? 40.607 -0.904  8.746   1    31.816  ? 2179 B 1 .
ATOM 6219 O O    . GLY Bxp B    98  ? 40.929 0.267   8.631   1    31.476  ? 2179 B 1 .
ATOM 6220 H H    . GLY Bxp B    98  ? 42.193 -1.41   6.242   1    36.548  ? 2179 B 1 c
ATOM 6221 H HA3  . GLY Bxp B    98  ? 41.209 -2.653  7.809   1    35.039  ? 2179 B 1 c
ATOM 6222 H HA2  . GLY Bxp B    98  ? 39.783 -2.144  7.303   1    35.051  ? 2179 B 1 c
ATOM 6223 N N    . PRO Bxp B    99  ? 40.219 -1.398  9.932   1    31.077  ? 2180 B 1 .
ATOM 6224 C CA   . PRO Bxp B    99  ? 40.184 -0.591  11.131  1    31.823  ? 2180 B 1 .
ATOM 6225 C C    . PRO Bxp B    99  ? 41.572 -0.351  11.699  1    31.442  ? 2180 B 1 .
ATOM 6226 O O    . PRO Bxp B    99  ? 42.392 -1.26   11.724  1    31.975  ? 2180 B 1 .
ATOM 6227 C CB   . PRO Bxp B    99  ? 39.359 -1.423  12.098  1    32.93   ? 2180 B 1 .
ATOM 6228 C CG   . PRO Bxp B    99  ? 38.809 -2.56   11.259  1    33.899  ? 2180 B 1 .
ATOM 6229 C CD   . PRO Bxp B    99  ? 39.826 -2.779  10.208  1    33.761  ? 2180 B 1 .
ATOM 6230 H HA   . PRO Bxp B    99  ? 39.739 0.261   10.947  1    31.904  ? 2180 B 1 c
ATOM 6231 H HB3  . PRO Bxp B    99  ? 38.637 -0.895  12.487  1    32.977  ? 2180 B 1 c
ATOM 6232 H HB2  . PRO Bxp B    99  ? 39.916 -1.768  12.823  1    32.9    ? 2180 B 1 c
ATOM 6233 H HG3  . PRO Bxp B    99  ? 37.949 -2.316  10.862  1    33.648  ? 2180 B 1 c
ATOM 6234 H HG2  . PRO Bxp B    99  ? 38.692 -3.367  11.799  1    33.648  ? 2180 B 1 c
ATOM 6235 H HD3  . PRO Bxp B    99  ? 40.582 -3.304  10.535  1    33.152  ? 2180 B 1 c
ATOM 6236 H HD2  . PRO Bxp B    99  ? 39.443 -3.206  9.417   1    33.174  ? 2180 B 1 c
ATOM 6237 N N    . LEU Bxp B    100 ? 41.787 0.885   12.149  1    31.708  ? 2181 B 1 .
ATOM 6238 C CA   . LEU Bxp B    100 ? 43.03  1.337   12.748  1    32.35   ? 2181 B 1 .
ATOM 6239 C C    . LEU Bxp B    100 ? 44.115 1.497   11.685  1    32.438  ? 2181 B 1 .
ATOM 6240 O O    . LEU Bxp B    100 ? 45.289 1.59    12.025  1    34.322  ? 2181 B 1 .
ATOM 6241 C CB   . LEU Bxp B    100 ? 43.486 0.416   13.877  1    32.602  ? 2181 B 1 .
ATOM 6242 C CG   . LEU Bxp B    100 ? 42.471 0.149   14.99   1    34.108  ? 2181 B 1 .
ATOM 6243 C CD1  . LEU Bxp B    100 ? 43.064 -0.82   15.988  1    35.075  ? 2181 B 1 .
ATOM 6244 C CD2  . LEU Bxp B    100 ? 42.042 1.423   15.695  1    35.466  ? 2181 B 1 .
ATOM 6245 H H    . LEU Bxp B    100 ? 41.106 1.49    12.081  1    31.859  ? 2181 B 1 c
ATOM 6246 H HA   . LEU Bxp B    100 ? 42.862 2.235   13.13   1    32.316  ? 2181 B 1 c
ATOM 6247 H HB3  . LEU Bxp B    100 ? 44.289 0.812   14.286  1    32.89   ? 2181 B 1 c
ATOM 6248 H HB2  . LEU Bxp B    100 ? 43.757 -0.446  13.487  1    32.881  ? 2181 B 1 c
ATOM 6249 H HG   . LEU Bxp B    100 ? 41.667 -0.271  14.588  1    34.226  ? 2181 B 1 c
ATOM 6250 H HD11 . LEU Bxp B    100 ? 43.334 -1.633  15.528  1    34.837  ? 2181 B 1 c
ATOM 6251 H HD12 . LEU Bxp B    100 ? 42.402 -1.037  16.665  1    34.799  ? 2181 B 1 c
ATOM 6252 H HD13 . LEU Bxp B    100 ? 43.84  -0.416  16.412  1    34.806  ? 2181 B 1 c
ATOM 6253 H HD21 . LEU Bxp B    100 ? 41.542 1.983   15.08   1    35.029  ? 2181 B 1 c
ATOM 6254 H HD22 . LEU Bxp B    100 ? 42.828 1.904   16.004  1    35.052  ? 2181 B 1 c
ATOM 6255 H HD23 . LEU Bxp B    100 ? 41.481 1.199   16.457  1    35.052  ? 2181 B 1 c
ATOM 6256 N N    . ARG Bxp B    101 ? 43.735 1.534   10.406  1    30.806  ? 2182 B 1 .
ATOM 6257 C CA   . ARG Bxp B    101 ? 44.669 1.94    9.377   1    32.007  ? 2182 B 1 .
ATOM 6258 C C    . ARG Bxp B    101 ? 44.209 3.281   8.835   1    32.029  ? 2182 B 1 .
ATOM 6259 O O    . ARG Bxp B    101 ? 43.009 3.515   8.812   1    33.14   ? 2182 B 1 .
ATOM 6260 C CB   . ARG Bxp B    101 ? 44.674 0.962   8.202   1    34.849  ? 2182 B 1 .
ATOM 6261 C CG   . ARG Bxp B    101 ? 45.417 -0.347  8.418   1    36.467  ? 2182 B 1 .
ATOM 6262 C CD   . ARG Bxp B    101 ? 44.633 -1.3    9.285   1    37.483  ? 2182 B 1 .
ATOM 6263 N NE   . ARG Bxp B    101 ? 45.158 -1.229  10.647  1    37.359  ? 2182 B 1 .
ATOM 6264 C CZ   . ARG Bxp B    101 ? 46.247 -1.859  11.043  1    36.549  ? 2182 B 1 .
ATOM 6265 N NH1  . ARG Bxp B    101 ? 46.86  -2.688  10.215  1    34.953  ? 2182 B 1 .
ATOM 6266 N NH2  . ARG Bxp B    101 ? 46.686 -1.69   12.279  1    38.145  ? 2182 B 1 .
ATOM 6267 H H    . ARG Bxp B    101 ? 42.882 1.313   10.168  1    31.465  ? 2182 B 1 c
ATOM 6268 H HA   . ARG Bxp B    101 ? 45.576 2.026   9.764   1    32.268  ? 2182 B 1 c
ATOM 6269 H HB3  . ARG Bxp B    101 ? 45.071 1.415   7.428   1    34.533  ? 2182 B 1 c
ATOM 6270 H HB2  . ARG Bxp B    101 ? 43.743 0.756   7.972   1    34.595  ? 2182 B 1 c
ATOM 6271 H HG3  . ARG Bxp B    101 ? 46.283 -0.161  8.842   1    36.328  ? 2182 B 1 c
ATOM 6272 H HG2  . ARG Bxp B    101 ? 45.589 -0.769  7.551   1    36.318  ? 2182 B 1 c
ATOM 6273 H HD3  . ARG Bxp B    101 ? 44.718 -2.214  8.945   1    37.17   ? 2182 B 1 c
ATOM 6274 H HD2  . ARG Bxp B    101 ? 43.684 -1.059  9.288   1    37.18   ? 2182 B 1 c
ATOM 6275 H HE   . ARG Bxp B    101 ? 44.718 -0.771  11.236  1    37.124  ? 2182 B 1 c
ATOM 6276 H HH11 . ARG Bxp B    101 ? 47.318 -2.366  9.531   1    35.447  ? 2182 B 1 c
ATOM 6277 H HH12 . ARG Bxp B    101 ? 46.809 -3.56   10.35   1    35.439  ? 2182 B 1 c
ATOM 6278 H HH21 . ARG Bxp B    101 ? 46.109 -1.633  12.945  1    37.636  ? 2182 B 1 c
ATOM 6279 H HH22 . ARG Bxp B    101 ? 47.555 -1.636  12.432  1    37.644  ? 2182 B 1 c
ATOM 6280 N N    . SER Bxp B    102 ? 45.152 4.126   8.39    1    31.31   ? 2183 B 1 .
ATOM 6281 C CA   . SER Bxp B    102 ? 44.82  5.288   7.58    1    31.543  ? 2183 B 1 .
ATOM 6282 C C    . SER Bxp B    102 ? 45.989 5.664   6.68    1    33.897  ? 2183 B 1 .
ATOM 6283 O O    . SER Bxp B    102 ? 47.149 5.382   6.983   1    36.292  ? 2183 B 1 .
ATOM 6284 C CB   . SER Bxp B    102 ? 44.426 6.451   8.424   1    31.836  ? 2183 B 1 .
ATOM 6285 O OG   . SER Bxp B    102 ? 45.31  6.549   9.528   1    33.486  ? 2183 B 1 .
ATOM 6286 H H    . SER Bxp B    102 ? 46.028 3.971   8.601   1    31.556  ? 2183 B 1 c
ATOM 6287 H HA   . SER Bxp B    102 ? 44.052 5.049   7.001   1    32.021  ? 2183 B 1 c
ATOM 6288 H HB3  . SER Bxp B    102 ? 43.512 6.328   8.745   1    32.154  ? 2183 B 1 c
ATOM 6289 H HB2  . SER Bxp B    102 ? 44.465 7.271   7.896   1    32.162  ? 2183 B 1 c
ATOM 6290 H HG   . SER Bxp B    102 ? 45.028 7.239   9.872   0    23.49   ? 2183 B 1 c
ATOM 6291 N N    . PHE Bxp B    103 ? 45.648 6.326   5.571   1    35.934  ? 2184 B 1 .
ATOM 6292 C CA   . PHE Bxp B    103 ? 46.618 6.756   4.581   1    36.335  ? 2184 B 1 .
ATOM 6293 C C    . PHE Bxp B    103 ? 47.112 8.162   4.876   1    34.942  ? 2184 B 1 .
ATOM 6294 O O    . PHE Bxp B    103 ? 46.411 8.987   5.449   1    34.086  ? 2184 B 1 .
ATOM 6295 C CB   . PHE Bxp B    103 ? 46.035 6.927   3.181   1    38.965  ? 2184 B 1 .
ATOM 6296 C CG   . PHE Bxp B    103 ? 45.775 5.649   2.414   1    42.783  ? 2184 B 1 .
ATOM 6297 C CD1  . PHE Bxp B    103 ? 46.751 4.671   2.321   1    45.517  ? 2184 B 1 .
ATOM 6298 C CD2  . PHE Bxp B    103 ? 44.543 5.431   1.805   1    48.681  ? 2184 B 1 .
ATOM 6299 C CE1  . PHE Bxp B    103 ? 46.513 3.511   1.599   1    51.285  ? 2184 B 1 .
ATOM 6300 C CE2  . PHE Bxp B    103 ? 44.301 4.262   1.1     1    52.986  ? 2184 B 1 .
ATOM 6301 C CZ   . PHE Bxp B    103 ? 45.292 3.309   0.986   1    53.386  ? 2184 B 1 .
ATOM 6302 H H    . PHE Bxp B    103 ? 44.767 6.521   5.428   1    35.495  ? 2184 B 1 c
ATOM 6303 H HA   . PHE Bxp B    103 ? 47.383 6.124   4.558   1    36.519  ? 2184 B 1 c
ATOM 6304 H HB3  . PHE Bxp B    103 ? 46.651 7.484   2.654   1    39.162  ? 2184 B 1 c
ATOM 6305 H HB2  . PHE Bxp B    103 ? 45.191 7.422   3.26    1    39.302  ? 2184 B 1 c
ATOM 6306 H HD1  . PHE Bxp B    103 ? 47.592 4.809   2.725   1    45.787  ? 2184 B 1 c
ATOM 6307 H HD2  . PHE Bxp B    103 ? 43.868 6.085   1.869   1    48.251  ? 2184 B 1 c
ATOM 6308 H HE1  . PHE Bxp B    103 ? 47.185 2.852   1.536   1    50.014  ? 2184 B 1 c
ATOM 6309 H HE2  . PHE Bxp B    103 ? 43.466 4.128   0.681   1    51.907  ? 2184 B 1 c
ATOM 6310 H HZ   . PHE Bxp B    103 ? 45.126 2.51    0.516   1    52.707  ? 2184 B 1 c
ATOM 6311 N N    . LYS Bxp B    104 ? 48.327 8.408   4.411   1    35.967  ? 2185 B 1 .
ATOM 6312 C CA   . LYS Bxp B    104 ? 48.823 9.738   4.132   1    38.345  ? 2185 B 1 .
ATOM 6313 C C    . LYS Bxp B    104 ? 49.566 9.622   2.806   1    36.837  ? 2185 B 1 .
ATOM 6314 O O    . LYS Bxp B    104 ? 50.507 8.831   2.661   1    34.795  ? 2185 B 1 .
ATOM 6315 C CB   . LYS Bxp B    104 ? 49.759 10.141  5.276   1    42.749  ? 2185 B 1 .
ATOM 6316 C CG   . LYS Bxp B    104 ? 50.093 11.611  5.458   1    44.598  ? 2185 B 1 .
ATOM 6317 C CD   . LYS Bxp B    104 ? 49.605 12.208  6.774   1    47.022  ? 2185 B 1 .
ATOM 6318 C CE   . LYS Bxp B    104 ? 50.594 13.142  7.432   1    50.037  ? 2185 B 1 .
ATOM 6319 N NZ   . LYS Bxp B    104 ? 50.808 14.444  6.782   1    51.074  ? 2185 B 1 .
ATOM 6320 H H    . LYS Bxp B    104 ? 48.888 7.702   4.265   1    36.253  ? 2185 B 1 c
ATOM 6321 H HA   . LYS Bxp B    104 ? 48.061 10.366  4.047   1    38.245  ? 2185 B 1 c
ATOM 6322 H HB3  . LYS Bxp B    104 ? 50.604 9.658   5.155   1    42.042  ? 2185 B 1 c
ATOM 6323 H HB2  . LYS Bxp B    104 ? 49.361 9.817   6.112   1    42.119  ? 2185 B 1 c
ATOM 6324 H HG3  . LYS Bxp B    104 ? 49.696 12.115  4.713   1    44.656  ? 2185 B 1 c
ATOM 6325 H HG2  . LYS Bxp B    104 ? 51.066 11.716  5.404   1    44.657  ? 2185 B 1 c
ATOM 6326 H HD3  . LYS Bxp B    104 ? 49.394 11.481  7.398   1    47.042  ? 2185 B 1 c
ATOM 6327 H HD2  . LYS Bxp B    104 ? 48.776 12.701  6.596   1    47.088  ? 2185 B 1 c
ATOM 6328 H HE3  . LYS Bxp B    104 ? 51.453 12.689  7.5     1    49.524  ? 2185 B 1 c
ATOM 6329 H HE2  . LYS Bxp B    104 ? 50.283 13.31   8.338   1    49.491  ? 2185 B 1 c
ATOM 6330 H HZ1  . LYS Bxp B    104 ? 50.267 15.058  7.165   1    50.502  ? 2185 B 1 c
ATOM 6331 H HZ2  . LYS Bxp B    104 ? 50.605 14.388  5.902   1    50.434  ? 2185 B 1 c
ATOM 6332 H HZ3  . LYS Bxp B    104 ? 51.67  14.703  6.883   1    50.536  ? 2185 B 1 c
ATOM 6333 N N    . VAL Bxp B    105 ? 49.097 10.367  1.813   1    35.325  ? 2186 B 1 .
ATOM 6334 C CA   . VAL Bxp B    105 ? 49.703 10.256  0.506   1    34.56   ? 2186 B 1 .
ATOM 6335 C C    . VAL Bxp B    105 ? 50.464 11.54   0.218   1    35.21   ? 2186 B 1 .
ATOM 6336 O O    . VAL Bxp B    105 ? 50.073 12.618  0.649   1    35.213  ? 2186 B 1 .
ATOM 6337 C CB   . VAL Bxp B    105 ? 48.656 9.944   -0.569  1    34.616  ? 2186 B 1 .
ATOM 6338 C CG1  . VAL Bxp B    105 ? 49.224 10.076  -1.968  1    34      ? 2186 B 1 .
ATOM 6339 C CG2  . VAL Bxp B    105 ? 48.076 8.554   -0.365  1    37.015  ? 2186 B 1 .
ATOM 6340 H H    . VAL Bxp B    105 ? 48.401 10.945  1.944   1    35.546  ? 2186 B 1 c
ATOM 6341 H HA   . VAL Bxp B    105 ? 50.344 9.52    0.525   1    34.863  ? 2186 B 1 c
ATOM 6342 H HB   . VAL Bxp B    105 ? 47.927 10.601  -0.469  1    34.922  ? 2186 B 1 c
ATOM 6343 H HG11 . VAL Bxp B    105 ? 50.097 9.65    -2.005  1    34.302  ? 2186 B 1 c
ATOM 6344 H HG12 . VAL Bxp B    105 ? 49.313 11.016  -2.195  1    34.474  ? 2186 B 1 c
ATOM 6345 H HG13 . VAL Bxp B    105 ? 48.628 9.645   -2.604  1    34.406  ? 2186 B 1 c
ATOM 6346 H HG21 . VAL Bxp B    105 ? 47.412 8.375   -1.051  1    36.274  ? 2186 B 1 c
ATOM 6347 H HG22 . VAL Bxp B    105 ? 47.658 8.502   0.511   1    36.281  ? 2186 B 1 c
ATOM 6348 H HG23 . VAL Bxp B    105 ? 48.787 7.894   -0.423  1    36.285  ? 2186 B 1 c
ATOM 6349 N N    . PHE Bxp B    106 ? 51.582 11.381  -0.488  1    36.313  ? 2187 B 1 .
ATOM 6350 C CA   . PHE Bxp B    106 ? 52.415 12.494  -0.885  1    34.922  ? 2187 B 1 .
ATOM 6351 C C    . PHE Bxp B    106 ? 52.858 12.331  -2.329  1    34.627  ? 2187 B 1 .
ATOM 6352 O O    . PHE Bxp B    106 ? 53.268 11.252  -2.758  1    30.569  ? 2187 B 1 .
ATOM 6353 C CB   . PHE Bxp B    106 ? 53.632 12.543  0.025   1    34.984  ? 2187 B 1 .
ATOM 6354 C CG   . PHE Bxp B    106 ? 53.272 12.96   1.433   1    33.796  ? 2187 B 1 .
ATOM 6355 C CD1  . PHE Bxp B    106 ? 52.879 14.259  1.697   1    33.882  ? 2187 B 1 .
ATOM 6356 C CD2  . PHE Bxp B    106 ? 53.364 12.063  2.483   1    36.587  ? 2187 B 1 .
ATOM 6357 C CE1  . PHE Bxp B    106 ? 52.56  14.647  2.979   1    35.736  ? 2187 B 1 .
ATOM 6358 C CE2  . PHE Bxp B    106 ? 53.065 12.463  3.769   1    37.692  ? 2187 B 1 .
ATOM 6359 C CZ   . PHE Bxp B    106 ? 52.666 13.754  4.013   1    37.386  ? 2187 B 1 .
ATOM 6360 H H    . PHE Bxp B    106 ? 51.838 10.538  -0.731  1    35.695  ? 2187 B 1 c
ATOM 6361 H HA   . PHE Bxp B    106 ? 51.903 13.338  -0.79   1    35.292  ? 2187 B 1 c
ATOM 6362 H HB3  . PHE Bxp B    106 ? 54.282 13.181  -0.345  1    34.705  ? 2187 B 1 c
ATOM 6363 H HB2  . PHE Bxp B    106 ? 54.047 11.652  0.047   1    34.747  ? 2187 B 1 c
ATOM 6364 H HD1  . PHE Bxp B    106 ? 52.815 14.878  0.988   1    34.734  ? 2187 B 1 c
ATOM 6365 H HD2  . PHE Bxp B    106 ? 53.649 11.178  2.319   1    36.152  ? 2187 B 1 c
ATOM 6366 H HE1  . PHE Bxp B    106 ? 52.292 15.536  3.149   1    35.682  ? 2187 B 1 c
ATOM 6367 H HE2  . PHE Bxp B    106 ? 53.126 11.845  4.479   1    37.358  ? 2187 B 1 c
ATOM 6368 H HZ   . PHE Bxp B    106 ? 52.452 14.021  4.889   1    37.294  ? 2187 B 1 c
ATOM 6369 N N    . LYS Bxp B    107 ? 52.768 13.439  -3.06   1    38.047  ? 2188 B 1 .
ATOM 6370 C CA   . LYS Bxp B    107 ? 53.402 13.538  -4.355  1    40.932  ? 2188 B 1 .
ATOM 6371 C C    . LYS Bxp B    107 ? 54.858 13.86   -4.068  1    38.761  ? 2188 B 1 .
ATOM 6372 O O    . LYS Bxp B    107 ? 55.176 14.944  -3.61   1    39.339  ? 2188 B 1 .
ATOM 6373 C CB   . LYS Bxp B    107 ? 52.785 14.605  -5.267  1    43.835  ? 2188 B 1 .
ATOM 6374 C CG   . LYS Bxp B    107 ? 53.166 14.449  -6.726  1    46.517  ? 2188 B 1 .
ATOM 6375 C CD   . LYS Bxp B    107 ? 53.114 15.727  -7.555  1    49.52   ? 2188 B 1 .
ATOM 6376 C CE   . LYS Bxp B    107 ? 53.568 15.472  -8.966  1    53.748  ? 2188 B 1 .
ATOM 6377 N NZ   . LYS Bxp B    107 ? 54.385 16.551  -9.533  1    55.643  ? 2188 B 1 .
ATOM 6378 H H    . LYS Bxp B    107 ? 52.294 14.154  -2.745  1    37.92   ? 2188 B 1 c
ATOM 6379 H HA   . LYS Bxp B    107 ? 53.344 12.658  -4.806  1    40.324  ? 2188 B 1 c
ATOM 6380 H HB3  . LYS Bxp B    107 ? 53.067 15.493  -4.962  1    43.702  ? 2188 B 1 c
ATOM 6381 H HB2  . LYS Bxp B    107 ? 51.808 14.559  -5.193  1    43.745  ? 2188 B 1 c
ATOM 6382 H HG3  . LYS Bxp B    107 ? 52.564 13.787  -7.131  1    46.537  ? 2188 B 1 c
ATOM 6383 H HG2  . LYS Bxp B    107 ? 54.076 14.083  -6.769  1    46.513  ? 2188 B 1 c
ATOM 6384 H HD3  . LYS Bxp B    107 ? 53.695 16.404  -7.145  1    49.821  ? 2188 B 1 c
ATOM 6385 H HD2  . LYS Bxp B    107 ? 52.195 16.071  -7.568  1    49.768  ? 2188 B 1 c
ATOM 6386 H HE3  . LYS Bxp B    107 ? 52.784 15.348  -9.531  1    53.162  ? 2188 B 1 c
ATOM 6387 H HE2  . LYS Bxp B    107 ? 54.085 14.647  -8.996  1    53.065  ? 2188 B 1 c
ATOM 6388 H HZ1  . LYS Bxp B    107 ? 55.256 16.393  -9.347  1    54.869  ? 2188 B 1 c
ATOM 6389 H HZ2  . LYS Bxp B    107 ? 54.141 17.349  -9.181  1    54.939  ? 2188 B 1 c
ATOM 6390 H HZ3  . LYS Bxp B    107 ? 54.274 16.577  -10.431 1    54.996  ? 2188 B 1 c
ATOM 6391 N N    . ILE Bxp B    108 ? 55.719 12.875  -4.261  1    38.105  ? 2189 B 1 .
ATOM 6392 C CA   . ILE Bxp B    108 ? 57.138 13.136  -4.32   1    38.17   ? 2189 B 1 .
ATOM 6393 C C    . ILE Bxp B    108 ? 57.34  14.412  -5.13   1    38.118  ? 2189 B 1 .
ATOM 6394 O O    . ILE Bxp B    108 ? 56.832 14.534  -6.247  1    37.303  ? 2189 B 1 .
ATOM 6395 C CB   . ILE Bxp B    108 ? 57.874 11.946  -4.96   1    39.102  ? 2189 B 1 .
ATOM 6396 C CG1  . ILE Bxp B    108 ? 57.731 10.67   -4.132  1    37.229  ? 2189 B 1 .
ATOM 6397 C CG2  . ILE Bxp B    108 ? 59.341 12.299  -5.222  1    40.608  ? 2189 B 1 .
ATOM 6398 C CD1  . ILE Bxp B    108 ? 58.306 9.44    -4.805  1    37.205  ? 2189 B 1 .
ATOM 6399 H H    . ILE Bxp B    108 ? 55.415 12.019  -4.365  1    38.302  ? 2189 B 1 c
ATOM 6400 H HA   . ILE Bxp B    108 ? 57.474 13.269  -3.412  1    38.483  ? 2189 B 1 c
ATOM 6401 H HB   . ILE Bxp B    108 ? 57.454 11.778  -5.827  1    38.865  ? 2189 B 1 c
ATOM 6402 H HG12 . ILE Bxp B    108 ? 56.784 10.513  -3.946  1    37.677  ? 2189 B 1 c
ATOM 6403 H HG13 . ILE Bxp B    108 ? 58.186 10.8    -3.275  1    37.648  ? 2189 B 1 c
ATOM 6404 H HG21 . ILE Bxp B    108 ? 59.889 11.5    -5.15   1    40.09   ? 2189 B 1 c
ATOM 6405 H HG22 . ILE Bxp B    108 ? 59.643 12.953  -4.569  1    40.115  ? 2189 B 1 c
ATOM 6406 H HG23 . ILE Bxp B    108 ? 59.432 12.67   -6.115  1    40.101  ? 2189 B 1 c
ATOM 6407 H HD11 . ILE Bxp B    108 ? 58.299 9.56    -5.774  1    37.239  ? 2189 B 1 c
ATOM 6408 H HD12 . ILE Bxp B    108 ? 57.767 8.66    -4.573  1    37.222  ? 2189 B 1 c
ATOM 6409 H HD13 . ILE Bxp B    108 ? 59.223 9.301   -4.503  1    37.237  ? 2189 B 1 c
ATOM 6410 N N    . LYS Bxp B    109 ? 58.105 15.349  -4.568  1    38.714  ? 2190 B 1 .
ATOM 6411 C CA   . LYS Bxp B    109 ? 58.393 16.589  -5.262  1    38.732  ? 2190 B 1 .
ATOM 6412 C C    . LYS Bxp B    109 ? 58.939 16.194  -6.623  1    37.72   ? 2190 B 1 .
ATOM 6413 O O    . LYS Bxp B    109 ? 59.625 15.185  -6.75   1    35.087  ? 2190 B 1 .
ATOM 6414 C CB   . LYS Bxp B    109 ? 59.369 17.456  -4.466  1    41.94   ? 2190 B 1 .
ATOM 6415 C CG   . LYS Bxp B    109 ? 59.051 17.537  -2.961  1    46.97   ? 2190 B 1 .
ATOM 6416 C CD   . LYS Bxp B    109 ? 58.57  18.877  -2.395  1    51.616  ? 2190 B 1 .
ATOM 6417 C CE   . LYS Bxp B    109 ? 59.662 19.896  -2.076  1    53.936  ? 2190 B 1 .
ATOM 6418 N NZ   . LYS Bxp B    109 ? 60.688 19.445  -1.118  1    55.18   ? 2190 B 1 .
ATOM 6419 H H    . LYS Bxp B    109 ? 58.479 15.195  -3.749  1    38.723  ? 2190 B 1 c
ATOM 6420 H HA   . LYS Bxp B    109 ? 57.542 17.079  -5.381  1    39.152  ? 2190 B 1 c
ATOM 6421 H HB3  . LYS Bxp B    109 ? 59.36  18.365  -4.836  1    42.261  ? 2190 B 1 c
ATOM 6422 H HB2  . LYS Bxp B    109 ? 60.275 17.098  -4.574  1    42.278  ? 2190 B 1 c
ATOM 6423 H HG3  . LYS Bxp B    109 ? 59.858 17.271  -2.472  1    46.916  ? 2190 B 1 c
ATOM 6424 H HG2  . LYS Bxp B    109 ? 58.367 16.867  -2.76   1    46.859  ? 2190 B 1 c
ATOM 6425 H HD3  . LYS Bxp B    109 ? 58.06  18.699  -1.576  1    51.026  ? 2190 B 1 c
ATOM 6426 H HD2  . LYS Bxp B    109 ? 57.948 19.278  -3.041  1    51.026  ? 2190 B 1 c
ATOM 6427 H HE3  . LYS Bxp B    109 ? 59.242 20.699  -1.72   1    53.709  ? 2190 B 1 c
ATOM 6428 H HE2  . LYS Bxp B    109 ? 60.107 20.144  -2.906  1    53.778  ? 2190 B 1 c
ATOM 6429 H HZ1  . LYS Bxp B    109 ? 61.306 18.939  -1.545  1    54.733  ? 2190 B 1 c
ATOM 6430 H HZ2  . LYS Bxp B    109 ? 60.3   18.952  -0.464  1    54.762  ? 2190 B 1 c
ATOM 6431 H HZ3  . LYS Bxp B    109 ? 61.096 20.163  -0.746  1    54.776  ? 2190 B 1 c
ATOM 6432 N N    . PRO Bxp B    110 ? 58.616 16.938  -7.693  1    40.949  ? 2191 B 1 .
ATOM 6433 C CA   . PRO Bxp B    110 ? 58.884 16.454  -9.04   1    44.84   ? 2191 B 1 .
ATOM 6434 C C    . PRO Bxp B    110 ? 60.37  16.505  -9.382  1    46.274  ? 2191 B 1 .
ATOM 6435 O O    . PRO Bxp B    110 ? 60.873 15.678  -10.13  1    42.069  ? 2191 B 1 .
ATOM 6436 C CB   . PRO Bxp B    110 ? 58.011 17.348  -9.918  1    45.119  ? 2191 B 1 .
ATOM 6437 C CG   . PRO Bxp B    110 ? 57.384 18.384  -8.991  1    44.915  ? 2191 B 1 .
ATOM 6438 C CD   . PRO Bxp B    110 ? 58.062 18.295  -7.661  1    43.1    ? 2191 B 1 .
ATOM 6439 H HA   . PRO Bxp B    110 ? 58.569 15.529  -9.117  1    44.267  ? 2191 B 1 c
ATOM 6440 H HB3  . PRO Bxp B    110 ? 57.319 16.821  -10.363 1    45.072  ? 2191 B 1 c
ATOM 6441 H HB2  . PRO Bxp B    110 ? 58.549 17.785  -10.606 1    45.029  ? 2191 B 1 c
ATOM 6442 H HG3  . PRO Bxp B    110 ? 56.427 18.213  -8.889  1    44.654  ? 2191 B 1 c
ATOM 6443 H HG2  . PRO Bxp B    110 ? 57.496 19.281  -9.363  1    44.557  ? 2191 B 1 c
ATOM 6444 H HD3  . PRO Bxp B    110 ? 58.769 18.962  -7.573  1    43.11   ? 2191 B 1 c
ATOM 6445 H HD2  . PRO Bxp B    110 ? 57.424 18.4    -6.932  1    42.957  ? 2191 B 1 c
ATOM 6446 N N    . GLU Bxp B    111 ? 61.034 17.527  -8.834  1    53.515  ? 2192 B 1 .
ATOM 6447 C CA   . GLU Bxp B    111 ? 62.481 17.715  -8.82   1    55.838  ? 2192 B 1 .
ATOM 6448 C C    . GLU Bxp B    111 ? 63.232 16.478  -8.332  1    56.867  ? 2192 B 1 .
ATOM 6449 O O    . GLU Bxp B    111 ? 64.366 16.247  -8.752  1    59.107  ? 2192 B 1 .
ATOM 6450 C CB   . GLU Bxp B    111 ? 62.805 18.896  -7.905  1    56.031  ? 2192 B 1 .
ATOM 6451 C CG   . GLU Bxp B    111 ? 61.596 19.312  -7.07   1    60.381  ? 2192 B 1 .
ATOM 6452 C CD   . GLU Bxp B    111 ? 61.894 20      -5.775  1    65.766  ? 2192 B 1 .
ATOM 6453 O OE1  . GLU Bxp B    111 ? 63.016 19.762  -5.308  1    70.046  ? 2192 B 1 .
ATOM 6454 O OE2  . GLU Bxp B    111 ? 61.019 20.732  -5.254  1    71.536  ? 2192 B 1 .
ATOM 6455 H H    . GLU Bxp B    111 ? 60.522 18.204  -8.502  1    52.153  ? 2192 B 1 c
ATOM 6456 H HA   . GLU Bxp B    111 ? 62.778 17.926  -9.742  1    55.598  ? 2192 B 1 c
ATOM 6457 H HB3  . GLU Bxp B    111 ? 63.092 19.654  -8.456  1    56.967  ? 2192 B 1 c
ATOM 6458 H HB2  . GLU Bxp B    111 ? 63.552 18.651  -7.32   1    57.06   ? 2192 B 1 c
ATOM 6459 H HG3  . GLU Bxp B    111 ? 61.069 18.513  -6.859  1    60.391  ? 2192 B 1 c
ATOM 6460 H HG2  . GLU Bxp B    111 ? 61.029 19.904  -7.604  1    60.42   ? 2192 B 1 c
ATOM 6461 N N    . LYS Bxp B    112 ? 62.6   15.71   -7.433  1    55.475  ? 2193 B 1 .
ATOM 6462 C CA   . LYS Bxp B    112 ? 63.215 14.537  -6.837  1    50.003  ? 2193 B 1 .
ATOM 6463 C C    . LYS Bxp B    112 ? 63.264 13.396  -7.844  1    45.877  ? 2193 B 1 .
ATOM 6464 O O    . LYS Bxp B    112 ? 63.985 12.421  -7.633  1    43.331  ? 2193 B 1 .
ATOM 6465 C CB   . LYS Bxp B    112 ? 62.452 14.105  -5.581  1    48.592  ? 2193 B 1 .
ATOM 6466 C CG   . LYS Bxp B    112 ? 62.608 15.051  -4.412  1    48.716  ? 2193 B 1 .
ATOM 6467 C CD   . LYS Bxp B    112 ? 62.075 14.498  -3.1    1    50.637  ? 2193 B 1 .
ATOM 6468 C CE   . LYS Bxp B    112 ? 62.527 15.331  -1.941  1    54.399  ? 2193 B 1 .
ATOM 6469 N NZ   . LYS Bxp B    112 ? 61.551 15.355  -0.852  1    54.743  ? 2193 B 1 .
ATOM 6470 H H    . LYS Bxp B    112 ? 61.757 15.94   -7.167  1    54.264  ? 2193 B 1 c
ATOM 6471 H HA   . LYS Bxp B    112 ? 64.143 14.77   -6.578  1    50.039  ? 2193 B 1 c
ATOM 6472 H HB3  . LYS Bxp B    112 ? 62.766 13.219  -5.308  1    48.82   ? 2193 B 1 c
ATOM 6473 H HB2  . LYS Bxp B    112 ? 61.5   14.03   -5.797  1    48.804  ? 2193 B 1 c
ATOM 6474 H HG3  . LYS Bxp B    112 ? 62.139 15.887  -4.622  1    49.068  ? 2193 B 1 c
ATOM 6475 H HG2  . LYS Bxp B    112 ? 63.561 15.261  -4.306  1    49.14   ? 2193 B 1 c
ATOM 6476 H HD3  . LYS Bxp B    112 ? 62.391 13.577  -2.98   1    50.944  ? 2193 B 1 c
ATOM 6477 H HD2  . LYS Bxp B    112 ? 61.094 14.487  -3.131  1    51.207  ? 2193 B 1 c
ATOM 6478 H HE3  . LYS Bxp B    112 ? 62.684 16.245  -2.24   1    53.566  ? 2193 B 1 c
ATOM 6479 H HE2  . LYS Bxp B    112 ? 63.368 14.978  -1.601  1    53.589  ? 2193 B 1 c
ATOM 6480 H HZ1  . LYS Bxp B    112 ? 61.506 14.538  -0.464  1    54.597  ? 2193 B 1 c
ATOM 6481 H HZ2  . LYS Bxp B    112 ? 60.733 15.578  -1.17   1    54.515  ? 2193 B 1 c
ATOM 6482 H HZ3  . LYS Bxp B    112 ? 61.802 15.965  -0.232  1    54.551  ? 2193 B 1 c
ATOM 6483 N N    . ARG Bxp B    113 ? 62.469 13.523  -8.912  1    43.839  ? 2194 B 1 .
ATOM 6484 C CA   . ARG Bxp B    113 ? 62.435 12.537  -9.972  1    45.298  ? 2194 B 1 .
ATOM 6485 C C    . ARG Bxp B    113 ? 63.846 12.165  -10.401 1    42.478  ? 2194 B 1 .
ATOM 6486 O O    . ARG Bxp B    113 ? 64.04  11.015  -10.764 1    44.88   ? 2194 B 1 .
ATOM 6487 C CB   . ARG Bxp B    113 ? 61.686 13.087  -11.185 1    52.814  ? 2194 B 1 .
ATOM 6488 C CG   . ARG Bxp B    113 ? 61.638 12.24   -12.45  1    59.375  ? 2194 B 1 .
ATOM 6489 C CD   . ARG Bxp B    113 ? 60.384 11.37   -12.596 1    65.91   ? 2194 B 1 .
ATOM 6490 N NE   . ARG Bxp B    113 ? 60.049 11.28   -14.023 1    70.704  ? 2194 B 1 .
ATOM 6491 C CZ   . ARG Bxp B    113 ? 60.716 10.587  -14.945 1    71.69   ? 2194 B 1 .
ATOM 6492 N NH1  . ARG Bxp B    113 ? 61.648 9.706   -14.605 1    72.022  ? 2194 B 1 .
ATOM 6493 N NH2  . ARG Bxp B    113 ? 60.401 10.744  -16.218 1    69.791  ? 2194 B 1 .
ATOM 6494 H H    . ARG Bxp B    113 ? 61.908 14.241  -8.971  1    44.887  ? 2194 B 1 c
ATOM 6495 H HA   . ARG Bxp B    113 ? 61.974 11.726  -9.636  1    45.732  ? 2194 B 1 c
ATOM 6496 H HB3  . ARG Bxp B    113 ? 62.092 13.949  -11.417 1    52.282  ? 2194 B 1 c
ATOM 6497 H HB2  . ARG Bxp B    113 ? 60.763 13.269  -10.907 1    52.439  ? 2194 B 1 c
ATOM 6498 H HG3  . ARG Bxp B    113 ? 62.426 11.659  -12.48  1    59.047  ? 2194 B 1 c
ATOM 6499 H HG2  . ARG Bxp B    113 ? 61.694 12.837  -13.226 1    59.094  ? 2194 B 1 c
ATOM 6500 H HD3  . ARG Bxp B    113 ? 59.634 11.766  -12.108 1    65.38   ? 2194 B 1 c
ATOM 6501 H HD2  . ARG Bxp B    113 ? 60.551 10.474  -12.24  1    65.489  ? 2194 B 1 c
ATOM 6502 H HE   . ARG Bxp B    113 ? 59.348 11.719  -14.295 1    69.791  ? 2194 B 1 c
ATOM 6503 H HH11 . ARG Bxp B    113 ? 62.379 9.979   -14.19  1    71.807  ? 2194 B 1 c
ATOM 6504 H HH12 . ARG Bxp B    113 ? 61.533 8.85    -14.794 1    71.893  ? 2194 B 1 c
ATOM 6505 H HH21 . ARG Bxp B    113 ? 60.263 11.557  -16.539 1    70.37   ? 2194 B 1 c
ATOM 6506 H HH22 . ARG Bxp B    113 ? 60.329 10.037  -16.743 1    70.37   ? 2194 B 1 c
ATOM 6507 N N    . TRP Bxp B    114 ? 64.795 13.122  -10.387 1    41.004  ? 2195 B 1 .
ATOM 6508 C CA   . TRP Bxp B    114 ? 66.154 12.884  -10.878 1    39.336  ? 2195 B 1 .
ATOM 6509 C C    . TRP Bxp B    114 ? 67.182 12.955  -9.757  1    38.325  ? 2195 B 1 .
ATOM 6510 O O    . TRP Bxp B    114 ? 68.297 13.398  -9.987  1    41.449  ? 2195 B 1 .
ATOM 6511 C CB   . TRP Bxp B    114 ? 66.542 13.878  -11.984 1    39.959  ? 2195 B 1 .
ATOM 6512 C CG   . TRP Bxp B    114 ? 65.569 13.86   -13.124 1    41.349  ? 2195 B 1 .
ATOM 6513 C CD1  . TRP Bxp B    114 ? 65.522 12.99   -14.173 1    41.688  ? 2195 B 1 .
ATOM 6514 C CD2  . TRP Bxp B    114 ? 64.422 14.716  -13.252 1    43.111  ? 2195 B 1 .
ATOM 6515 N NE1  . TRP Bxp B    114 ? 64.44  13.26   -14.964 1    42.226  ? 2195 B 1 .
ATOM 6516 C CE2  . TRP Bxp B    114 ? 63.741 14.306  -14.417 1    44.505  ? 2195 B 1 .
ATOM 6517 C CE3  . TRP Bxp B    114 ? 63.919 15.775  -12.493 1    44.538  ? 2195 B 1 .
ATOM 6518 C CZ2  . TRP Bxp B    114 ? 62.572 14.93   -14.841 1    48.041  ? 2195 B 1 .
ATOM 6519 C CZ3  . TRP Bxp B    114 ? 62.761 16.386  -12.912 1    47.877  ? 2195 B 1 .
ATOM 6520 C CH2  . TRP Bxp B    114 ? 62.097 15.964  -14.067 1    49.731  ? 2195 B 1 .
ATOM 6521 H H    . TRP Bxp B    114 ? 64.585 13.956  -10.079 1    41.042  ? 2195 B 1 c
ATOM 6522 H HA   . TRP Bxp B    114 ? 66.186 11.97   -11.268 1    39.624  ? 2195 B 1 c
ATOM 6523 H HB3  . TRP Bxp B    114 ? 67.433 13.644  -12.321 1    40.143  ? 2195 B 1 c
ATOM 6524 H HB2  . TRP Bxp B    114 ? 66.573 14.781  -11.601 1    40.136  ? 2195 B 1 c
ATOM 6525 H HD1  . TRP Bxp B    114 ? 66.149 12.305  -14.343 1    41.766  ? 2195 B 1 c
ATOM 6526 H HE1  . TRP Bxp B    114 ? 64.227 12.832  -15.694 1    42.636  ? 2195 B 1 c
ATOM 6527 H HE3  . TRP Bxp B    114 ? 64.361 16.059  -11.711 1    44.991  ? 2195 B 1 c
ATOM 6528 H HZ2  . TRP Bxp B    114 ? 62.121 14.648  -15.618 1    47.516  ? 2195 B 1 c
ATOM 6529 H HZ3  . TRP Bxp B    114 ? 62.407 17.102  -12.41  1    47.426  ? 2195 B 1 c
ATOM 6530 H HH2  . TRP Bxp B    114 ? 61.309 16.406  -14.33  1    48.78   ? 2195 B 1 c
ATOM 6531 N N    . GLN Bxp B    115 ? 66.805 12.53   -8.551  1    38.414  ? 2196 B 1 .
ATOM 6532 C CA   . GLN Bxp B    115 ? 67.729 12.45   -7.428  1    37.423  ? 2196 B 1 .
ATOM 6533 C C    . GLN Bxp B    115 ? 68.006 10.967  -7.197  1    38.21   ? 2196 B 1 .
ATOM 6534 O O    . GLN Bxp B    115 ? 67.339 10.116  -7.76   1    40.741  ? 2196 B 1 .
ATOM 6535 C CB   . GLN Bxp B    115 ? 67.158 13.234  -6.238  1    35.125  ? 2196 B 1 .
ATOM 6536 C CG   . GLN Bxp B    115 ? 67.743 12.884  -4.876  1    32.82   ? 2196 B 1 .
ATOM 6537 C CD   . GLN Bxp B    115 ? 67.256 13.784  -3.764  1    32.602  ? 2196 B 1 .
ATOM 6538 O OE1  . GLN Bxp B    115 ? 66.084 13.786  -3.35   1    30.296  ? 2196 B 1 .
ATOM 6539 N NE2  . GLN Bxp B    115 ? 68.202 14.544  -3.236  1    33.574  ? 2196 B 1 .
ATOM 6540 H H    . GLN Bxp B    115 ? 65.938 12.272  -8.42   1    38.192  ? 2196 B 1 c
ATOM 6541 H HA   . GLN Bxp B    115 ? 68.576 12.883  -7.694  1    37.353  ? 2196 B 1 c
ATOM 6542 H HB3  . GLN Bxp B    115 ? 66.19  13.085  -6.208  1    35.16   ? 2196 B 1 c
ATOM 6543 H HB2  . GLN Bxp B    115 ? 67.302 14.189  -6.403  1    35.099  ? 2196 B 1 c
ATOM 6544 H HG3  . GLN Bxp B    115 ? 68.721 12.949  -4.921  1    33.405  ? 2196 B 1 c
ATOM 6545 H HG2  . GLN Bxp B    115 ? 67.517 11.96   -4.651  1    33.506  ? 2196 B 1 c
ATOM 6546 H HE21 . GLN Bxp B    115 ? 68.193 14.72   -2.367  1    33.271  ? 2196 B 1 c
ATOM 6547 H HE22 . GLN Bxp B    115 ? 68.844 14.877  -3.75   1    33.27   ? 2196 B 1 c
ATOM 6548 N N    . ASP Bxp B    116 ? 68.965 10.646  -6.343  1    39.76   ? 2197 B 1 .
ATOM 6549 C CA   . ASP Bxp B    116 ? 69.612 9.354   -6.402  1    43.779  ? 2197 B 1 .
ATOM 6550 C C    . ASP Bxp B    116 ? 68.708 8.219   -5.943  1    46.693  ? 2197 B 1 .
ATOM 6551 O O    . ASP Bxp B    116 ? 69.242 7.213   -5.517  1    57.215  ? 2197 B 1 .
ATOM 6552 C CB   . ASP Bxp B    116 ? 70.846 9.363   -5.517  1    47.517  ? 2197 B 1 .
ATOM 6553 C CG   . ASP Bxp B    116 ? 71.877 8.282   -5.8    1    50.158  ? 2197 B 1 .
ATOM 6554 O OD1  . ASP Bxp B    116 ? 71.825 7.259   -5.079  1    45.482  ? 2197 B 1 .
ATOM 6555 O OD2  . ASP Bxp B    116 ? 72.686 8.456   -6.766  1    58.909  ? 2197 B 1 .
ATOM 6556 H H    . ASP Bxp B    116 ? 69.25  11.253  -5.724  1    40.128  ? 2197 B 1 c
ATOM 6557 H HA   . ASP Bxp B    116 ? 69.89  9.185   -7.331  1    44.1    ? 2197 B 1 c
ATOM 6558 H HB3  . ASP Bxp B    116 ? 70.539 9.257   -4.6    1    46.903  ? 2197 B 1 c
ATOM 6559 H HB2  . ASP Bxp B    116 ? 71.287 10.234  -5.597  1    47.026  ? 2197 B 1 c
ATOM 6560 N N    . ILE Bxp B    117 ? 67.388 8.288   -6.146  1    50.741  ? 2198 B 1 .
ATOM 6561 C CA   . ILE Bxp B    117 ? 66.421 7.59    -5.299  1    55.118  ? 2198 B 1 .
ATOM 6562 C C    . ILE Bxp B    117 ? 67.051 7.343   -3.925  1    51.977  ? 2198 B 1 .
ATOM 6563 O O    . ILE Bxp B    117 ? 66.779 8.117   -3.033  1    60.029  ? 2198 B 1 .
ATOM 6564 C CB   . ILE Bxp B    117 ? 65.733 6.341   -5.915  1    57.938  ? 2198 B 1 .
ATOM 6565 C CG1  . ILE Bxp B    117 ? 66.711 5.297   -6.445  1    59.593  ? 2198 B 1 .
ATOM 6566 C CG2  . ILE Bxp B    117 ? 64.708 6.757   -6.979  1    63.014  ? 2198 B 1 .
ATOM 6567 C CD1  . ILE Bxp B    117 ? 66.23  4.553   -7.678  1    64.116  ? 2198 B 1 .
ATOM 6568 H H    . ILE Bxp B    117 ? 67.073 8.769   -6.857  1    50.498  ? 2198 B 1 c
ATOM 6569 H HA   . ILE Bxp B    117 ? 65.701 8.228   -5.149  1    54.106  ? 2198 B 1 c
ATOM 6570 H HB   . ILE Bxp B    117 ? 65.233 5.913   -5.193  1    58.591  ? 2198 B 1 c
ATOM 6571 H HG12 . ILE Bxp B    117 ? 66.885 4.644   -5.737  1    60.035  ? 2198 B 1 c
ATOM 6572 H HG13 . ILE Bxp B    117 ? 67.558 5.737   -6.661  1    59.909  ? 2198 B 1 c
ATOM 6573 H HG21 . ILE Bxp B    117 ? 64.119 6.011   -7.178  1    61.502  ? 2198 B 1 c
ATOM 6574 H HG22 . ILE Bxp B    117 ? 65.169 7.032   -7.789  1    61.5    ? 2198 B 1 c
ATOM 6575 H HG23 . ILE Bxp B    117 ? 64.178 7.501   -6.646  1    61.436  ? 2198 B 1 c
ATOM 6576 H HD11 . ILE Bxp B    117 ? 65.338 4.19    -7.523  1    62.739  ? 2198 B 1 c
ATOM 6577 H HD12 . ILE Bxp B    117 ? 66.847 3.819   -7.862  1    62.738  ? 2198 B 1 c
ATOM 6578 H HD13 . ILE Bxp B    117 ? 66.208 5.153   -8.447  1    62.74   ? 2198 B 1 c
ATOM 6579 N N    . SER Bxp B    118 ? 67.957 6.365   -3.774  1    45.878  ? 2199 B 1 .
ATOM 6580 C CA   . SER Bxp B    118 ? 68.684 6.047   -2.542  1    41.699  ? 2199 B 1 .
ATOM 6581 C C    . SER Bxp B    118 ? 68.943 7.248   -1.619  1    38.707  ? 2199 B 1 .
ATOM 6582 O O    . SER Bxp B    118 ? 68.828 7.138   -0.393  1    35.521  ? 2199 B 1 .
ATOM 6583 C CB   . SER Bxp B    118 ? 69.986 5.396   -2.921  1    41.726  ? 2199 B 1 .
ATOM 6584 O OG   . SER Bxp B    118 ? 70.253 4.287   -2.085  1    45.049  ? 2199 B 1 .
ATOM 6585 H H    . SER Bxp B    118 ? 68.141 5.855   -4.507  1    46.575  ? 2199 B 1 c
ATOM 6586 H HA   . SER Bxp B    118 ? 68.145 5.387   -2.037  1    41.931  ? 2199 B 1 c
ATOM 6587 H HB3  . SER Bxp B    118 ? 70.71  6.045   -2.841  1    42.456  ? 2199 B 1 c
ATOM 6588 H HB2  . SER Bxp B    118 ? 69.946 5.098   -3.849  1    42.534  ? 2199 B 1 c
ATOM 6589 H HG   . SER Bxp B    118 ? 70.965 3.933   -2.482  0    33.8    ? 2199 B 1 c
ATOM 6590 N N    . MET Bxp B    119 ? 69.42  8.354   -2.203  1    39.051  ? 2200 B 1 .
ATOM 6591 C CA   . MET Bxp B    119 ? 69.55  9.625   -1.507  1    38.738  ? 2200 B 1 .
ATOM 6592 C C    . MET Bxp B    119 ? 68.166 10.235  -1.303  1    39.086  ? 2200 B 1 .
ATOM 6593 O O    . MET Bxp B    119 ? 67.893 10.843  -0.277  1    39.281  ? 2200 B 1 .
ATOM 6594 C CB   . MET Bxp B    119 ? 70.395 10.614  -2.318  1    38.973  ? 2200 B 1 .
ATOM 6595 C CG   . MET Bxp B    119 ? 71.806 10.153  -2.613  1    39.308  ? 2200 B 1 .
ATOM 6596 S SD   . MET Bxp B    119 ? 72.742 11.475  -3.406  1    39.571  ? 2200 B 1 .
ATOM 6597 C CE   . MET Bxp B    119 ? 73.042 12.484  -1.951  1    39.448  ? 2200 B 1 .
ATOM 6598 H H    . MET Bxp B    119 ? 69.675 8.309   -3.079  1    39.092  ? 2200 B 1 c
ATOM 6599 H HA   . MET Bxp B    119 ? 69.972 9.466   -0.625  1    38.885  ? 2200 B 1 c
ATOM 6600 H HB3  . MET Bxp B    119 ? 70.438 11.459  -1.825  1    38.987  ? 2200 B 1 c
ATOM 6601 H HB2  . MET Bxp B    119 ? 69.936 10.792  -3.166  1    39.081  ? 2200 B 1 c
ATOM 6602 H HG3  . MET Bxp B    119 ? 71.791 9.372   -3.192  1    39.436  ? 2200 B 1 c
ATOM 6603 H HG2  . MET Bxp B    119 ? 72.25  9.903   -1.779  1    39.325  ? 2200 B 1 c
ATOM 6604 H HE3  . MET Bxp B    119 ? 72.998 11.926  -1.152  1    39.473  ? 2200 B 1 c
ATOM 6605 H HE2  . MET Bxp B    119 ? 72.367 13.185  -1.895  1    39.463  ? 2200 B 1 c
ATOM 6606 H HE1  . MET Bxp B    119 ? 73.927 12.887  -2.016  1    39.475  ? 2200 B 1 c
ATOM 6607 N N    . MET Bxp B    120 ? 67.296 10.085  -2.304  1    41.412  ? 2201 B 1 .
ATOM 6608 C CA   . MET Bxp B    120 ? 66.008 10.76   -2.317  1    42.161  ? 2201 B 1 .
ATOM 6609 C C    . MET Bxp B    120 ? 65.075 10.218  -1.24   1    42.124  ? 2201 B 1 .
ATOM 6610 O O    . MET Bxp B    120 ? 64.381 11.007  -0.61   1    42.672  ? 2201 B 1 .
ATOM 6611 C CB   . MET Bxp B    120 ? 65.314 10.603  -3.671  1    42.522  ? 2201 B 1 .
ATOM 6612 C CG   . MET Bxp B    120 ? 63.964 11.27   -3.732  1    42.524  ? 2201 B 1 .
ATOM 6613 S SD   . MET Bxp B    120 ? 62.686 10.208  -3.037  1    41.336  ? 2201 B 1 .
ATOM 6614 C CE   . MET Bxp B    120 ? 62.426 9.127   -4.453  1    41.764  ? 2201 B 1 .
ATOM 6615 H H    . MET Bxp B    120 ? 67.523 9.564   -3.018  1    41.061  ? 2201 B 1 c
ATOM 6616 H HA   . MET Bxp B    120 ? 66.163 11.719  -2.137  1    41.913  ? 2201 B 1 c
ATOM 6617 H HB3  . MET Bxp B    120 ? 65.199 9.649   -3.853  1    42.642  ? 2201 B 1 c
ATOM 6618 H HB2  . MET Bxp B    120 ? 65.888 10.974  -4.371  1    42.337  ? 2201 B 1 c
ATOM 6619 H HG3  . MET Bxp B    120 ? 63.742 11.471  -4.661  1    42.341  ? 2201 B 1 c
ATOM 6620 H HG2  . MET Bxp B    120 ? 63.991 12.109  -3.234  1    42.292  ? 2201 B 1 c
ATOM 6621 H HE3  . MET Bxp B    120 ? 63.204 8.552   -4.57   1    41.665  ? 2201 B 1 c
ATOM 6622 H HE2  . MET Bxp B    120 ? 62.297 9.667   -5.254  1    41.664  ? 2201 B 1 c
ATOM 6623 H HE1  . MET Bxp B    120 ? 61.635 8.578   -4.3    1    41.66   ? 2201 B 1 c
ATOM 6624 N N    . ARG Bxp B    121 ? 65.027 8.886   -1.089  1    44.691  ? 2202 B 1 .
ATOM 6625 C CA   . ARG Bxp B    121 ? 64.186 8.235   -0.096  1    47.512  ? 2202 B 1 .
ATOM 6626 C C    . ARG Bxp B    121 ? 64.668 8.656   1.284   1    44.364  ? 2202 B 1 .
ATOM 6627 O O    . ARG Bxp B    121 ? 63.897 9.196   2.073   1    44.014  ? 2202 B 1 .
ATOM 6628 C CB   . ARG Bxp B    121 ? 64.238 6.706   -0.191  1    54.478  ? 2202 B 1 .
ATOM 6629 C CG   . ARG Bxp B    121 ? 63.576 6.109   -1.425  1    60.964  ? 2202 B 1 .
ATOM 6630 C CD   . ARG Bxp B    121 ? 63.729 4.587   -1.503  1    69.044  ? 2202 B 1 .
ATOM 6631 N NE   . ARG Bxp B    121 ? 62.65  4.037   -2.337  1    80.363  ? 2202 B 1 .
ATOM 6632 C CZ   . ARG Bxp B    121 ? 62.787 3.319   -3.45   1    87.594  ? 2202 B 1 .
ATOM 6633 N NH1  . ARG Bxp B    121 ? 63.984 2.889   -3.802  1    104.252 ? 2202 B 1 .
ATOM 6634 N NH2  . ARG Bxp B    121 ? 61.729 3.011   -4.189  1    76.295  ? 2202 B 1 .
ATOM 6635 H H    . ARG Bxp B    121 ? 65.538 8.361   -1.635  1    44.733  ? 2202 B 1 c
ATOM 6636 H HA   . ARG Bxp B    121 ? 63.254 8.545   -0.221  1    47.427  ? 2202 B 1 c
ATOM 6637 H HB3  . ARG Bxp B    121 ? 63.806 6.33    0.605   1    54.111  ? 2202 B 1 c
ATOM 6638 H HB2  . ARG Bxp B    121 ? 65.178 6.426   -0.176  1    54.08   ? 2202 B 1 c
ATOM 6639 H HG3  . ARG Bxp B    121 ? 63.973 6.511   -2.228  1    61.157  ? 2202 B 1 c
ATOM 6640 H HG2  . ARG Bxp B    121 ? 62.62  6.334   -1.417  1    61.316  ? 2202 B 1 c
ATOM 6641 H HD3  . ARG Bxp B    121 ? 63.679 4.199   -0.606  1    69.658  ? 2202 B 1 c
ATOM 6642 H HD2  . ARG Bxp B    121 ? 64.598 4.358   -1.892  1    69.86   ? 2202 B 1 c
ATOM 6643 H HE   . ARG Bxp B    121 ? 61.838 4.193   -2.078  1    77.806  ? 2202 B 1 c
ATOM 6644 H HH11 . ARG Bxp B    121 ? 64.443 2.369   -3.255  1    98.807  ? 2202 B 1 c
ATOM 6645 H HH12 . ARG Bxp B    121 ? 64.322 3.124   -4.585  1    98.807  ? 2202 B 1 c
ATOM 6646 H HH21 . ARG Bxp B    121 ? 61.064 3.589   -4.266  1    79.595  ? 2202 B 1 c
ATOM 6647 H HH22 . ARG Bxp B    121 ? 61.694 2.23    -4.601  1    79.606  ? 2202 B 1 c
ATOM 6648 N N    . MET Bxp B    122 ? 65.966 8.445   1.526   1    40.59   ? 2203 B 1 .
ATOM 6649 C CA   . MET Bxp B    122 ? 66.565 8.719   2.818   1    38.727  ? 2203 B 1 .
ATOM 6650 C C    . MET Bxp B    122 ? 66.264 10.154  3.247   1    38.218  ? 2203 B 1 .
ATOM 6651 O O    . MET Bxp B    122 ? 65.997 10.422  4.422   1    41.46   ? 2203 B 1 .
ATOM 6652 C CB   . MET Bxp B    122 ? 68.076 8.478   2.771   1    38.159  ? 2203 B 1 .
ATOM 6653 C CG   . MET Bxp B    122 ? 68.432 7.025   2.645   1    39.05   ? 2203 B 1 .
ATOM 6654 S SD   . MET Bxp B    122 ? 67.941 6.106   4.113   1    40.855  ? 2203 B 1 .
ATOM 6655 C CE   . MET Bxp B    122 ? 67.973 4.473   3.367   1    40.118  ? 2203 B 1 .
ATOM 6656 H H    . MET Bxp B    122 ? 66.497 8.118   0.858   1    41.183  ? 2203 B 1 c
ATOM 6657 H HA   . MET Bxp B    122 ? 66.155 8.108   3.48    1    38.895  ? 2203 B 1 c
ATOM 6658 H HB3  . MET Bxp B    122 ? 68.48  8.838   3.589   1    38.49   ? 2203 B 1 c
ATOM 6659 H HB2  . MET Bxp B    122 ? 68.451 8.968   2.008   1    38.491  ? 2203 B 1 c
ATOM 6660 H HG3  . MET Bxp B    122 ? 69.397 6.932   2.517   1    39.168  ? 2203 B 1 c
ATOM 6661 H HG2  . MET Bxp B    122 ? 67.982 6.643   1.867   1    39.173  ? 2203 B 1 c
ATOM 6662 H HE3  . MET Bxp B    122 ? 68.897 4.171   3.289   1    40.385  ? 2203 B 1 c
ATOM 6663 H HE2  . MET Bxp B    122 ? 67.566 4.51    2.482   1    40.313  ? 2203 B 1 c
ATOM 6664 H HE1  . MET Bxp B    122 ? 67.475 3.85    3.927   1    40.32   ? 2203 B 1 c
ATOM 6665 N N    . LYS Bxp B    123 ? 66.302 11.092  2.302   1    33.375  ? 2204 B 1 .
ATOM 6666 C CA   . LYS Bxp B    123 ? 66.111 12.473  2.689   1    31.942  ? 2204 B 1 .
ATOM 6667 C C    . LYS Bxp B    123 ? 64.632 12.707  2.978   1    31.18   ? 2204 B 1 .
ATOM 6668 O O    . LYS Bxp B    123 ? 64.255 13.179  4.048   1    30.112  ? 2204 B 1 .
ATOM 6669 C CB   . LYS Bxp B    123 ? 66.669 13.387  1.602   1    32.896  ? 2204 B 1 .
ATOM 6670 C CG   . LYS Bxp B    123 ? 66.635 14.843  1.98    1    34.46   ? 2204 B 1 .
ATOM 6671 C CD   . LYS Bxp B    123 ? 67.18  15.105  3.372   1    37.226  ? 2204 B 1 .
ATOM 6672 C CE   . LYS Bxp B    123 ? 67.491 16.536  3.575   1    41.47   ? 2204 B 1 .
ATOM 6673 N NZ   . LYS Bxp B    123 ? 68.84  16.816  3.072   1    45.006  ? 2204 B 1 .
ATOM 6674 H H    . LYS Bxp B    123 ? 66.455 10.88   1.426   1    34.243  ? 2204 B 1 c
ATOM 6675 H HA   . LYS Bxp B    123 ? 66.621 12.63   3.522   1    32.413  ? 2204 B 1 c
ATOM 6676 H HB3  . LYS Bxp B    123 ? 66.149 13.263  0.779   1    33.019  ? 2204 B 1 c
ATOM 6677 H HB2  . LYS Bxp B    123 ? 67.597 13.132  1.414   1    33.028  ? 2204 B 1 c
ATOM 6678 H HG3  . LYS Bxp B    123 ? 65.707 15.16   1.931   1    34.696  ? 2204 B 1 c
ATOM 6679 H HG2  . LYS Bxp B    123 ? 67.163 15.35   1.325   1    34.782  ? 2204 B 1 c
ATOM 6680 H HD3  . LYS Bxp B    123 ? 67.994 14.573  3.508   1    37.552  ? 2204 B 1 c
ATOM 6681 H HD2  . LYS Bxp B    123 ? 66.514 14.826  4.039   1    37.462  ? 2204 B 1 c
ATOM 6682 H HE3  . LYS Bxp B    123 ? 67.449 16.754  4.524   1    41.226  ? 2204 B 1 c
ATOM 6683 H HE2  . LYS Bxp B    123 ? 66.846 17.091  3.1     1    41.193  ? 2204 B 1 c
ATOM 6684 H HZ1  . LYS Bxp B    123 ? 68.916 16.544  2.211   1    43.71   ? 2204 B 1 c
ATOM 6685 H HZ2  . LYS Bxp B    123 ? 69.453 16.381  3.577   1    43.799  ? 2204 B 1 c
ATOM 6686 H HZ3  . LYS Bxp B    123 ? 69     17.706  3.115   1    43.836  ? 2204 B 1 c
ATOM 6687 N N    . THR Bxp B    124 ? 63.801 12.359  1.996   1    31.159  ? 2205 B 1 .
ATOM 6688 C CA   . THR Bxp B    124 ? 62.362 12.384  2.162   1    31.504  ? 2205 B 1 .
ATOM 6689 C C    . THR Bxp B    124 ? 61.973 11.786  3.515   1    32.706  ? 2205 B 1 .
ATOM 6690 O O    . THR Bxp B    124 ? 61.322 12.443  4.318   1    37.544  ? 2205 B 1 .
ATOM 6691 C CB   . THR Bxp B    124 ? 61.716 11.602  1.028   1    32.948  ? 2205 B 1 .
ATOM 6692 O OG1  . THR Bxp B    124 ? 62.179 12.175  -0.194  1    31.661  ? 2205 B 1 .
ATOM 6693 C CG2  . THR Bxp B    124 ? 60.205 11.582  1.178   1    34.695  ? 2205 B 1 .
ATOM 6694 H H    . THR Bxp B    124 ? 64.145 12.1    1.19    1    31.292  ? 2205 B 1 c
ATOM 6695 H HA   . THR Bxp B    124 ? 62.056 13.316  2.12    1    31.931  ? 2205 B 1 c
ATOM 6696 H HB   . THR Bxp B    124 ? 62.04  10.671  1.077   1    32.779  ? 2205 B 1 c
ATOM 6697 H HG1  . THR Bxp B    124 ? 61.853 12.719  -0.39   0    20.92   ? 2205 B 1 c
ATOM 6698 H HG21 . THR Bxp B    124 ? 59.798 11.343  0.329   1    34.211  ? 2205 B 1 c
ATOM 6699 H HG22 . THR Bxp B    124 ? 59.894 12.463  1.448   1    34.172  ? 2205 B 1 c
ATOM 6700 H HG23 . THR Bxp B    124 ? 59.952 10.93   1.852   1    34.219  ? 2205 B 1 c
ATOM 6701 N N    . ILE Bxp B    125 ? 62.374 10.541  3.783   1    30.436  ? 2206 B 1 .
ATOM 6702 C CA   . ILE Bxp B    125 ? 61.938 9.877   4.999   1    28.686  ? 2206 B 1 .
ATOM 6703 C C    . ILE Bxp B    125 ? 62.238 10.765  6.202   1    26.912  ? 2206 B 1 .
ATOM 6704 O O    . ILE Bxp B    125 ? 61.395 10.942  7.069   1    25.147  ? 2206 B 1 .
ATOM 6705 C CB   . ILE Bxp B    125 ? 62.573 8.487   5.129   1    29.266  ? 2206 B 1 .
ATOM 6706 C CG1  . ILE Bxp B    125 ? 62.141 7.602   3.968   1    31.781  ? 2206 B 1 .
ATOM 6707 C CG2  . ILE Bxp B    125 ? 62.226 7.867   6.479   1    28.698  ? 2206 B 1 .
ATOM 6708 C CD1  . ILE Bxp B    125 ? 62.615 6.165   4.056   1    33.497  ? 2206 B 1 .
ATOM 6709 H H    . ILE Bxp B    125 ? 62.937 10.107  3.208   1    30.589  ? 2206 B 1 c
ATOM 6710 H HA   . ILE Bxp B    125 ? 60.97  9.759   4.945   1    28.777  ? 2206 B 1 c
ATOM 6711 H HB   . ILE Bxp B    125 ? 63.545 8.593   5.083   1    29.503  ? 2206 B 1 c
ATOM 6712 H HG12 . ILE Bxp B    125 ? 62.472 7.988   3.134   1    31.694  ? 2206 B 1 c
ATOM 6713 H HG13 . ILE Bxp B    125 ? 61.163 7.604   3.928   1    31.585  ? 2206 B 1 c
ATOM 6714 H HG21 . ILE Bxp B    125 ? 62.807 7.107   6.646   1    28.968  ? 2206 B 1 c
ATOM 6715 H HG22 . ILE Bxp B    125 ? 61.3   7.569   6.473   1    28.881  ? 2206 B 1 c
ATOM 6716 H HG23 . ILE Bxp B    125 ? 62.349 8.521   7.183   1    28.851  ? 2206 B 1 c
ATOM 6717 H HD11 . ILE Bxp B    125 ? 63.389 6.101   4.647   1    32.96   ? 2206 B 1 c
ATOM 6718 H HD12 . ILE Bxp B    125 ? 62.864 5.855   3.165   1    33.196  ? 2206 B 1 c
ATOM 6719 H HD13 . ILE Bxp B    125 ? 61.895 5.605   4.403   1    33.015  ? 2206 B 1 c
ATOM 6720 N N    . GLY Bxp B    126 ? 63.441 11.334  6.232   1    27.684  ? 2207 B 1 .
ATOM 6721 C CA   . GLY Bxp B    126 ? 63.826 12.249  7.288   1    27.832  ? 2207 B 1 .
ATOM 6722 C C    . GLY Bxp B    126 ? 63.046 13.555  7.191   1    28.032  ? 2207 B 1 .
ATOM 6723 O O    . GLY Bxp B    126 ? 62.54  14.055  8.186   1    27.84   ? 2207 B 1 .
ATOM 6724 H H    . GLY Bxp B    126 ? 64.047 11.141  5.576   1    27.558  ? 2207 B 1 c
ATOM 6725 H HA3  . GLY Bxp B    126 ? 64.792 12.435  7.22    1    27.838  ? 2207 B 1 c
ATOM 6726 H HA2  . GLY Bxp B    126 ? 63.657 11.827  8.163   1    27.825  ? 2207 B 1 c
ATOM 6727 N N    . GLU Bxp B    127 ? 62.947 14.1    5.979   1    29.173  ? 2208 B 1 .
ATOM 6728 C CA   . GLU Bxp B    127 ? 62.241 15.354  5.771   1    31.667  ? 2208 B 1 .
ATOM 6729 C C    . GLU Bxp B    127 ? 60.878 15.273  6.455   1    30.118  ? 2208 B 1 .
ATOM 6730 O O    . GLU Bxp B    127 ? 60.474 16.201  7.149   1    29.774  ? 2208 B 1 .
ATOM 6731 C CB   . GLU Bxp B    127 ? 62.082 15.686  4.283   1    34.863  ? 2208 B 1 .
ATOM 6732 C CG   . GLU Bxp B    127 ? 63.288 16.36   3.628   1    37.389  ? 2208 B 1 .
ATOM 6733 C CD   . GLU Bxp B    127 ? 63.039 16.876  2.212   1    42.984  ? 2208 B 1 .
ATOM 6734 O OE1  . GLU Bxp B    127 ? 61.954 16.618  1.625   1    44.099  ? 2208 B 1 .
ATOM 6735 O OE2  . GLU Bxp B    127 ? 63.941 17.57   1.68    1    49.039  ? 2208 B 1 .
ATOM 6736 H H    . GLU Bxp B    127 ? 63.335 13.686  5.262   1    29.512  ? 2208 B 1 c
ATOM 6737 H HA   . GLU Bxp B    127 ? 62.765 16.077  6.2     1    31.424  ? 2208 B 1 c
ATOM 6738 H HB3  . GLU Bxp B    127 ? 61.308 16.277  4.177   1    34.668  ? 2208 B 1 c
ATOM 6739 H HB2  . GLU Bxp B    127 ? 61.89  14.859  3.797   1    34.622  ? 2208 B 1 c
ATOM 6740 H HG3  . GLU Bxp B    127 ? 64.032 15.722  3.599   1    37.943  ? 2208 B 1 c
ATOM 6741 H HG2  . GLU Bxp B    127 ? 63.571 17.115  4.187   1    37.982  ? 2208 B 1 c
ATOM 6742 N N    . HIS Bxp B    128 ? 60.2   14.14   6.256   1    29.694  ? 2209 B 1 .
ATOM 6743 C CA   . HIS Bxp B    128 ? 58.842 13.938  6.716   1    30.485  ? 2209 B 1 .
ATOM 6744 C C    . HIS Bxp B    128 ? 58.836 13.577  8.185   1    27.599  ? 2209 B 1 .
ATOM 6745 O O    . HIS Bxp B    128 ? 57.927 13.962  8.903   1    28.326  ? 2209 B 1 .
ATOM 6746 C CB   . HIS Bxp B    128 ? 58.159 12.803  5.955   1    33.264  ? 2209 B 1 .
ATOM 6747 C CG   . HIS Bxp B    128 ? 57.626 13.261  4.655   1    37.71   ? 2209 B 1 .
ATOM 6748 N ND1  . HIS Bxp B    128 ? 56.274 13.36   4.416   1    38.914  ? 2209 B 1 .
ATOM 6749 C CD2  . HIS Bxp B    128 ? 58.248 13.656  3.536   1    40.774  ? 2209 B 1 .
ATOM 6750 C CE1  . HIS Bxp B    128 ? 56.098 13.798  3.177   1    42.809  ? 2209 B 1 .
ATOM 6751 N NE2  . HIS Bxp B    128 ? 57.285 13.987  2.623   1    42.913  ? 2209 B 1 .
ATOM 6752 H H    . HIS Bxp B    128 ? 60.605 13.461  5.797   1    30.016  ? 2209 B 1 c
ATOM 6753 H HA   . HIS Bxp B    128 ? 58.333 14.773  6.592   1    30.322  ? 2209 B 1 c
ATOM 6754 H HB3  . HIS Bxp B    128 ? 57.421 12.452  6.499   1    33.574  ? 2209 B 1 c
ATOM 6755 H HB2  . HIS Bxp B    128 ? 58.808 12.082  5.803   1    33.562  ? 2209 B 1 c
ATOM 6756 H HD1  . HIS Bxp B    128 ? 55.624 13.188  4.971   0    30.32   ? 2209 B 1 c
ATOM 6757 H HD2  . HIS Bxp B    128 ? 59.173 13.698  3.393   1    40.459  ? 2209 B 1 c
ATOM 6758 H HE1  . HIS Bxp B    128 ? 55.273 13.956  2.767   1    41.621  ? 2209 B 1 c
ATOM 6759 H HE2  . HIS Bxp B    128 ? 57.41  14.337  1.803   0    32.65   ? 2209 B 1 c
ATOM 6760 N N    . ILE Bxp B    129 ? 59.816 12.791  8.614   1    25.879  ? 2210 B 1 .
ATOM 6761 C CA   . ILE Bxp B    129 ? 59.879 12.502  10.027  1    26.416  ? 2210 B 1 .
ATOM 6762 C C    . ILE Bxp B    129 ? 59.836 13.834  10.742  1    27.846  ? 2210 B 1 .
ATOM 6763 O O    . ILE Bxp B    129 ? 58.948 14.042  11.551  1    29.7    ? 2210 B 1 .
ATOM 6764 C CB   . ILE Bxp B    129 ? 61.097 11.669  10.438  1    26.527  ? 2210 B 1 .
ATOM 6765 C CG1  . ILE Bxp B    129 ? 60.907 10.212  10.065  1    27.744  ? 2210 B 1 .
ATOM 6766 C CG2  . ILE Bxp B    129 ? 61.362 11.821  11.933  1    25.832  ? 2210 B 1 .
ATOM 6767 C CD1  . ILE Bxp B    129 ? 62.2   9.48    9.772   1    28.653  ? 2210 B 1 .
ATOM 6768 H H    . ILE Bxp B    129 ? 60.432 12.432  8.043   1    26.448  ? 2210 B 1 c
ATOM 6769 H HA   . ILE Bxp B    129 ? 59.085 12.005  10.267  1    26.7    ? 2210 B 1 c
ATOM 6770 H HB   . ILE Bxp B    129 ? 61.875 12.009  9.952   1    26.62   ? 2210 B 1 c
ATOM 6771 H HG12 . ILE Bxp B    129 ? 60.331 10.161  9.275   1    27.676  ? 2210 B 1 c
ATOM 6772 H HG13 . ILE Bxp B    129 ? 60.447 9.757   10.8    1    27.656  ? 2210 B 1 c
ATOM 6773 H HG21 . ILE Bxp B    129 ? 61.875 11.06   12.251  1    26.088  ? 2210 B 1 c
ATOM 6774 H HG22 . ILE Bxp B    129 ? 60.518 11.861  12.414  1    26.06   ? 2210 B 1 c
ATOM 6775 H HG23 . ILE Bxp B    129 ? 61.866 12.637  12.095  1    26.058  ? 2210 B 1 c
ATOM 6776 H HD11 . ILE Bxp B    129 ? 62.703 9.953   9.084   1    28.346  ? 2210 B 1 c
ATOM 6777 H HD12 . ILE Bxp B    129 ? 61.995 8.579   9.46    1    28.374  ? 2210 B 1 c
ATOM 6778 H HD13 . ILE Bxp B    129 ? 62.736 9.426   10.586  1    28.373  ? 2210 B 1 c
ATOM 6779 N N    . VAL Bxp B    130 ? 60.751 14.737  10.385  1    29.744  ? 2211 B 1 .
ATOM 6780 C CA   . VAL Bxp B    130 ? 60.816 16.04   11.025  1    30.521  ? 2211 B 1 .
ATOM 6781 C C    . VAL Bxp B    130 ? 59.506 16.777  10.782  1    29.317  ? 2211 B 1 .
ATOM 6782 O O    . VAL Bxp B    130 ? 58.905 17.287  11.711  1    29.469  ? 2211 B 1 .
ATOM 6783 C CB   . VAL Bxp B    130 ? 62     16.904  10.558  1    31.762  ? 2211 B 1 .
ATOM 6784 C CG1  . VAL Bxp B    130 ? 61.897 18.324  11.097  1    31.666  ? 2211 B 1 .
ATOM 6785 C CG2  . VAL Bxp B    130 ? 63.341 16.285  10.932  1    32.688  ? 2211 B 1 .
ATOM 6786 H H    . VAL Bxp B    130 ? 61.354 14.536  9.729   1    29.44   ? 2211 B 1 c
ATOM 6787 H HA   . VAL Bxp B    130 ? 60.91  15.895  11.982  1    30.455  ? 2211 B 1 c
ATOM 6788 H HB   . VAL Bxp B    130 ? 61.954 16.951  9.574   1    31.679  ? 2211 B 1 c
ATOM 6789 H HG11 . VAL Bxp B    130 ? 61.534 18.305  11.998  1    31.674  ? 2211 B 1 c
ATOM 6790 H HG12 . VAL Bxp B    130 ? 61.313 18.849  10.523  1    31.679  ? 2211 B 1 c
ATOM 6791 H HG13 . VAL Bxp B    130 ? 62.78  18.73   11.114  1    31.697  ? 2211 B 1 c
ATOM 6792 H HG21 . VAL Bxp B    130 ? 64.061 16.813  10.547  1    32.399  ? 2211 B 1 c
ATOM 6793 H HG22 . VAL Bxp B    130 ? 63.389 15.377  10.589  1    32.375  ? 2211 B 1 c
ATOM 6794 H HG23 . VAL Bxp B    130 ? 63.434 16.27   11.899  1    32.403  ? 2211 B 1 c
ATOM 6795 N N    . ALA Bxp B    131 ? 59.072 16.819  9.527   1    29.156  ? 2212 B 1 .
ATOM 6796 C CA   . ALA Bxp B    131 ? 57.872 17.551  9.156   1    30.801  ? 2212 B 1 .
ATOM 6797 C C    . ALA Bxp B    131 ? 56.679 17.197  10.041  1    28.595  ? 2212 B 1 .
ATOM 6798 O O    . ALA Bxp B    131 ? 56.085 18.06   10.686  1    25.87   ? 2212 B 1 .
ATOM 6799 C CB   . ALA Bxp B    131 ? 57.551 17.25   7.707   1    34.291  ? 2212 B 1 .
ATOM 6800 H H    . ALA Bxp B    131 ? 59.54  16.383  8.875   1    29.596  ? 2212 B 1 c
ATOM 6801 H HA   . ALA Bxp B    131 ? 58.057 18.526  9.255   1    30.659  ? 2212 B 1 c
ATOM 6802 H HB3  . ALA Bxp B    131 ? 56.757 17.742  7.439   1    33.194  ? 2212 B 1 c
ATOM 6803 H HB2  . ALA Bxp B    131 ? 57.39  16.299  7.598   1    33.136  ? 2212 B 1 c
ATOM 6804 H HB1  . ALA Bxp B    131 ? 58.297 17.517  7.144   1    33.178  ? 2212 B 1 c
ATOM 6805 N N    . HIS Bxp B    132 ? 56.317 15.911  10.014  1    29.484  ? 2213 B 1 .
ATOM 6806 C CA   . HIS Bxp B    132 ? 55.092 15.442  10.629  1    30.856  ? 2213 B 1 .
ATOM 6807 C C    . HIS Bxp B    132 ? 55.269 14.101  11.335  1    28.936  ? 2213 B 1 .
ATOM 6808 O O    . HIS Bxp B    132 ? 54.706 13.918  12.397  1    29.069  ? 2213 B 1 .
ATOM 6809 C CB   . HIS Bxp B    132 ? 53.963 15.342  9.598   1    33.961  ? 2213 B 1 .
ATOM 6810 C CG   . HIS Bxp B    132 ? 54.286 14.519  8.401   1    36.374  ? 2213 B 1 .
ATOM 6811 N ND1  . HIS Bxp B    132 ? 54.146 13.15   8.389   1    36.248  ? 2213 B 1 .
ATOM 6812 C CD2  . HIS Bxp B    132 ? 54.726 14.86   7.177   1    39.524  ? 2213 B 1 .
ATOM 6813 C CE1  . HIS Bxp B    132 ? 54.496 12.69   7.193   1    37.132  ? 2213 B 1 .
ATOM 6814 N NE2  . HIS Bxp B    132 ? 54.861 13.707  6.443   1    37.806  ? 2213 B 1 .
ATOM 6815 H H    . HIS Bxp B    132 ? 56.857 15.307  9.592   1    29.617  ? 2213 B 1 c
ATOM 6816 H HA   . HIS Bxp B    132 ? 54.822 16.107  11.309  1    30.704  ? 2213 B 1 c
ATOM 6817 H HB3  . HIS Bxp B    132 ? 53.727 16.248  9.304   1    33.772  ? 2213 B 1 c
ATOM 6818 H HB2  . HIS Bxp B    132 ? 53.172 14.962  10.037  1    33.776  ? 2213 B 1 c
ATOM 6819 H HD1  . HIS Bxp B    132 ? 53.868 12.662  9.075   0    28.45   ? 2213 B 1 c
ATOM 6820 H HD2  . HIS Bxp B    132 ? 54.92  15.725  6.875   1    38.342  ? 2213 B 1 c
ATOM 6821 H HE1  . HIS Bxp B    132 ? 54.494 11.785  6.934   1    37.033  ? 2213 B 1 c
ATOM 6822 H HE2  . HIS Bxp B    132 ? 55.07  13.666  5.602   0    29.63   ? 2213 B 1 c
ATOM 6823 N N    . ILE Bxp B    133 ? 56.01  13.151  10.767  1    28.916  ? 2214 B 1 .
ATOM 6824 C CA   . ILE Bxp B    133 ? 55.902 11.771  11.223  1    30.216  ? 2214 B 1 .
ATOM 6825 C C    . ILE Bxp B    133 ? 56.221 11.648  12.706  1    30.049  ? 2214 B 1 .
ATOM 6826 O O    . ILE Bxp B    133 ? 55.551 10.89   13.396  1    28.471  ? 2214 B 1 .
ATOM 6827 C CB   . ILE Bxp B    133 ? 56.791 10.801  10.43   1    32.397  ? 2214 B 1 .
ATOM 6828 C CG1  . ILE Bxp B    133 ? 56.443 10.778  8.935   1    33.91   ? 2214 B 1 .
ATOM 6829 C CG2  . ILE Bxp B    133 ? 56.723 9.406   11.048  1    32.635  ? 2214 B 1 .
ATOM 6830 C CD1  . ILE Bxp B    133 ? 57.318 9.866   8.09    1    33.3    ? 2214 B 1 .
ATOM 6831 H H    . ILE Bxp B    133 ? 56.593 13.357  10.094  1    29.288  ? 2214 B 1 c
ATOM 6832 H HA   . ILE Bxp B    133 ? 54.976 11.491  11.095  1    30.332  ? 2214 B 1 c
ATOM 6833 H HB   . ILE Bxp B    133 ? 57.706 11.111  10.512  1    32.208  ? 2214 B 1 c
ATOM 6834 H HG12 . ILE Bxp B    133 ? 56.518 11.688  8.584   1    33.366  ? 2214 B 1 c
ATOM 6835 H HG13 . ILE Bxp B    133 ? 55.51  10.497  8.835   1    33.391  ? 2214 B 1 c
ATOM 6836 H HG21 . ILE Bxp B    133 ? 57.01  8.747   10.397  1    32.524  ? 2214 B 1 c
ATOM 6837 H HG22 . ILE Bxp B    133 ? 55.81  9.212   11.32   1    32.505  ? 2214 B 1 c
ATOM 6838 H HG23 . ILE Bxp B    133 ? 57.307 9.363   11.825  1    32.533  ? 2214 B 1 c
ATOM 6839 H HD11 . ILE Bxp B    133 ? 58.196 9.777   8.507   1    33.424  ? 2214 B 1 c
ATOM 6840 H HD12 . ILE Bxp B    133 ? 57.422 10.244  7.196   1    33.465  ? 2214 B 1 c
ATOM 6841 H HD13 . ILE Bxp B    133 ? 56.902 8.986   8.022   1    33.46   ? 2214 B 1 c
ATOM 6842 N N    . GLN Bxp B    134 ? 57.265 12.348  13.163  1    33.543  ? 2215 B 1 .
ATOM 6843 C CA   . GLN Bxp B    134 ? 57.736 12.274  14.543  1    36.568  ? 2215 B 1 .
ATOM 6844 C C    . GLN Bxp B    134 ? 56.603 12.517  15.534  1    35.694  ? 2215 B 1 .
ATOM 6845 O O    . GLN Bxp B    134 ? 56.695 12.022  16.655  1    39.241  ? 2215 B 1 .
ATOM 6846 C CB   . GLN Bxp B    134 ? 58.823 13.294  14.893  1    39.082  ? 2215 B 1 .
ATOM 6847 C CG   . GLN Bxp B    134 ? 58.408 14.739  14.635  1    42.829  ? 2215 B 1 .
ATOM 6848 C CD   . GLN Bxp B    134 ? 59.491 15.748  14.933  1    46.821  ? 2215 B 1 .
ATOM 6849 O OE1  . GLN Bxp B    134 ? 60.226 16.21   14.05   1    49.137  ? 2215 B 1 .
ATOM 6850 N NE2  . GLN Bxp B    134 ? 59.591 16.1    16.202  1    49.842  ? 2215 B 1 .
ATOM 6851 H H    . GLN Bxp B    134 ? 57.716 12.892  12.583  1    33.408  ? 2215 B 1 c
ATOM 6852 H HA   . GLN Bxp B    134 ? 58.094 11.365  14.697  1    36.159  ? 2215 B 1 c
ATOM 6853 H HB3  . GLN Bxp B    134 ? 59.623 13.094  14.364  1    39.303  ? 2215 B 1 c
ATOM 6854 H HB2  . GLN Bxp B    134 ? 59.058 13.194  15.839  1    39.286  ? 2215 B 1 c
ATOM 6855 H HG3  . GLN Bxp B    134 ? 57.63  14.955  15.19   1    42.717  ? 2215 B 1 c
ATOM 6856 H HG2  . GLN Bxp B    134 ? 58.138 14.838  13.699  1    42.586  ? 2215 B 1 c
ATOM 6857 H HE21 . GLN Bxp B    134 ? 59.667 16.957  16.419  1    48.892  ? 2215 B 1 c
ATOM 6858 H HE22 . GLN Bxp B    134 ? 59.581 15.479  16.835  1    48.892  ? 2215 B 1 c
ATOM 6859 N N    . HIS Bxp B    135 ? 55.581 13.282  15.11   1    32.909  ? 2216 B 1 .
ATOM 6860 C CA   . HIS Bxp B    135 ? 54.494 13.733  15.962  1    32.784  ? 2216 B 1 .
ATOM 6861 C C    . HIS Bxp B    135 ? 53.281 12.83   15.845  1    31.795  ? 2216 B 1 .
ATOM 6862 O O    . HIS Bxp B    135 ? 52.282 13.058  16.513  1    30.971  ? 2216 B 1 .
ATOM 6863 C CB   . HIS Bxp B    135 ? 54.02  15.121  15.531  1    36.129  ? 2216 B 1 .
ATOM 6864 C CG   . HIS Bxp B    135 ? 55.074 16.155  15.718  1    41.299  ? 2216 B 1 .
ATOM 6865 N ND1  . HIS Bxp B    135 ? 55.801 16.25   16.892  1    41.418  ? 2216 B 1 .
ATOM 6866 C CD2  . HIS Bxp B    135 ? 55.522 17.117  14.904  1    41.982  ? 2216 B 1 .
ATOM 6867 C CE1  . HIS Bxp B    135 ? 56.659 17.243  16.788  1    41.383  ? 2216 B 1 .
ATOM 6868 N NE2  . HIS Bxp B    135 ? 56.515 17.774  15.585  1    44.671  ? 2216 B 1 .
ATOM 6869 H H    . HIS Bxp B    135 ? 55.575 13.556  14.239  1    33.533  ? 2216 B 1 c
ATOM 6870 H HA   . HIS Bxp B    135 ? 54.791 13.749  16.905  1    33.277  ? 2216 B 1 c
ATOM 6871 H HB3  . HIS Bxp B    135 ? 53.231 15.37   16.061  1    36.392  ? 2216 B 1 c
ATOM 6872 H HB2  . HIS Bxp B    135 ? 53.762 15.091  14.585  1    36.384  ? 2216 B 1 c
ATOM 6873 H HD1  . HIS Bxp B    135 ? 55.744 15.752  17.625  0    30.54   ? 2216 B 1 c
ATOM 6874 H HD2  . HIS Bxp B    135 ? 55.231 17.304  14.033  1    42.369  ? 2216 B 1 c
ATOM 6875 H HE1  . HIS Bxp B    135 ? 57.275 17.518  17.446  1    42.113  ? 2216 B 1 c
ATOM 6876 H HE2  . HIS Bxp B    135 ? 57.02  18.453  15.268  0    32.37   ? 2216 B 1 c
ATOM 6877 N N    . GLU Bxp B    136 ? 53.367 11.828  14.972  1    33.687  ? 2217 B 1 .
ATOM 6878 C CA   . GLU Bxp B    136 ? 52.19  11.096  14.537  1    32.335  ? 2217 B 1 .
ATOM 6879 C C    . GLU Bxp B    136 ? 52.255 9.623   14.923  1    28.57   ? 2217 B 1 .
ATOM 6880 O O    . GLU Bxp B    136 ? 51.203 8.981   14.915  1    26.629  ? 2217 B 1 .
ATOM 6881 C CB   . GLU Bxp B    136 ? 52.074 11.198  13.018  1    33.787  ? 2217 B 1 .
ATOM 6882 C CG   . GLU Bxp B    136 ? 52.043 12.632  12.505  1    33.931  ? 2217 B 1 .
ATOM 6883 C CD   . GLU Bxp B    136 ? 51.844 12.664  11.01   1    35.746  ? 2217 B 1 .
ATOM 6884 O OE1  . GLU Bxp B    136 ? 52.676 12.128  10.265  1    37.229  ? 2217 B 1 .
ATOM 6885 O OE2  . GLU Bxp B    136 ? 50.801 13.181  10.599  1    40.233  ? 2217 B 1 .
ATOM 6886 H H    . GLU Bxp B    136 ? 54.179 11.602  14.621  1    32.804  ? 2217 B 1 c
ATOM 6887 H HA   . GLU Bxp B    136 ? 51.387 11.501  14.952  1    32.109  ? 2217 B 1 c
ATOM 6888 H HB3  . GLU Bxp B    136 ? 51.26  10.735  12.73   1    33.484  ? 2217 B 1 c
ATOM 6889 H HB2  . GLU Bxp B    136 ? 52.838 10.737  12.615  1    33.43   ? 2217 B 1 c
ATOM 6890 H HG3  . GLU Bxp B    136 ? 52.882 13.079  12.727  1    34.242  ? 2217 B 1 c
ATOM 6891 H HG2  . GLU Bxp B    136 ? 51.309 13.119  12.937  1    34.36   ? 2217 B 1 c
ATOM 6892 N N    . VAL Bxp B    137 ? 53.47  9.11    15.207  1    26.159  ? 2218 B 1 .
ATOM 6893 C CA   . VAL Bxp B    137 ? 53.695 7.695   15.454  1    26.032  ? 2218 B 1 .
ATOM 6894 C C    . VAL Bxp B    137 ? 54.873 7.503   16.403  1    24.208  ? 2218 B 1 .
ATOM 6895 O O    . VAL Bxp B    137 ? 55.808 8.278   16.427  1    22.206  ? 2218 B 1 .
ATOM 6896 C CB   . VAL Bxp B    137 ? 53.969 6.893   14.168  1    29.578  ? 2218 B 1 .
ATOM 6897 C CG1  . VAL Bxp B    137 ? 52.966 7.19    13.059  1    30.605  ? 2218 B 1 .
ATOM 6898 C CG2  . VAL Bxp B    137 ? 55.398 7.083   13.67   1    30.754  ? 2218 B 1 .
ATOM 6899 H H    . VAL Bxp B    137 ? 54.189 9.672   15.248  1    26.807  ? 2218 B 1 c
ATOM 6900 H HA   . VAL Bxp B    137 ? 52.897 7.331   15.879  1    26.331  ? 2218 B 1 c
ATOM 6901 H HB   . VAL Bxp B    137 ? 53.871 5.942   14.398  1    29.26   ? 2218 B 1 c
ATOM 6902 H HG11 . VAL Bxp B    137 ? 53.114 8.089   12.721  1    30.237  ? 2218 B 1 c
ATOM 6903 H HG12 . VAL Bxp B    137 ? 52.063 7.121   13.409  1    30.234  ? 2218 B 1 c
ATOM 6904 H HG13 . VAL Bxp B    137 ? 53.081 6.552   12.337  1    30.222  ? 2218 B 1 c
ATOM 6905 H HG21 . VAL Bxp B    137 ? 55.448 6.845   12.729  1    30.375  ? 2218 B 1 c
ATOM 6906 H HG22 . VAL Bxp B    137 ? 56     6.512   14.177  1    30.345  ? 2218 B 1 c
ATOM 6907 H HG23 . VAL Bxp B    137 ? 55.662 8.012   13.78   1    30.307  ? 2218 B 1 c
ATOM 6908 N N    . ASP Bxp B    138 ? 54.852 6.382   17.113  1    25.488  ? 2219 B 1 .
ATOM 6909 C CA   . ASP Bxp B    138 ? 55.81  6.077   18.155  1    25.85   ? 2219 B 1 .
ATOM 6910 C C    . ASP Bxp B    138 ? 56.914 5.221   17.558  1    26.465  ? 2219 B 1 .
ATOM 6911 O O    . ASP Bxp B    138 ? 57.993 5.098   18.123  1    28.131  ? 2219 B 1 .
ATOM 6912 C CB   . ASP Bxp B    138 ? 55.083 5.381   19.289  1    26.9    ? 2219 B 1 .
ATOM 6913 C CG   . ASP Bxp B    138 ? 53.851 6.134   19.766  1    30.883  ? 2219 B 1 .
ATOM 6914 O OD1  . ASP Bxp B    138 ? 52.828 6.163   19.027  1    35.03   ? 2219 B 1 .
ATOM 6915 O OD2  . ASP Bxp B    138 ? 53.946 6.76    20.843  1    34.722  ? 2219 B 1 .
ATOM 6916 H H    . ASP Bxp B    138 ? 54.192 5.772   16.943  1    25.333  ? 2219 B 1 c
ATOM 6917 H HA   . ASP Bxp B    138 ? 56.197 6.918   18.49   1    26.046  ? 2219 B 1 c
ATOM 6918 H HB3  . ASP Bxp B    138 ? 55.697 5.274   20.045  1    27.552  ? 2219 B 1 c
ATOM 6919 H HB2  . ASP Bxp B    138 ? 54.806 4.489   18.991  1    27.52   ? 2219 B 1 c
ATOM 6920 N N    . PHE Bxp B    139 ? 56.609 4.597   16.422  1    27.07   ? 2220 B 1 .
ATOM 6921 C CA   . PHE Bxp B    139 ? 57.549 3.732   15.739  1    26.854  ? 2220 B 1 .
ATOM 6922 C C    . PHE Bxp B    139 ? 57.284 3.827   14.248  1    27.009  ? 2220 B 1 .
ATOM 6923 O O    . PHE Bxp B    139 ? 56.146 3.746   13.796  1    27.362  ? 2220 B 1 .
ATOM 6924 C CB   . PHE Bxp B    139 ? 57.41  2.273   16.167  1    27.203  ? 2220 B 1 .
ATOM 6925 C CG   . PHE Bxp B    139 ? 57.707 2.09    17.64   1    26.244  ? 2220 B 1 .
ATOM 6926 C CD1  . PHE Bxp B    139 ? 59.015 2.004   18.083  1    26.654  ? 2220 B 1 .
ATOM 6927 C CD2  . PHE Bxp B    139 ? 56.682 2.055   18.568  1    25.279  ? 2220 B 1 .
ATOM 6928 C CE1  . PHE Bxp B    139 ? 59.289 1.873   19.428  1    26.976  ? 2220 B 1 .
ATOM 6929 C CE2  . PHE Bxp B    139 ? 56.964 1.919   19.909  1    25.581  ? 2220 B 1 .
ATOM 6930 C CZ   . PHE Bxp B    139 ? 58.263 1.844   20.337  1    26.318  ? 2220 B 1 .
ATOM 6931 H H    . PHE Bxp B    139 ? 55.778 4.705   16.06   1    26.842  ? 2220 B 1 c
ATOM 6932 H HA   . PHE Bxp B    139 ? 58.474 4.041   15.929  1    26.988  ? 2220 B 1 c
ATOM 6933 H HB3  . PHE Bxp B    139 ? 58.033 1.725   15.64   1    26.903  ? 2220 B 1 c
ATOM 6934 H HB2  . PHE Bxp B    139 ? 56.493 1.974   15.983  1    26.902  ? 2220 B 1 c
ATOM 6935 H HD1  . PHE Bxp B    139 ? 59.722 2.043   17.459  1    26.639  ? 2220 B 1 c
ATOM 6936 H HD2  . PHE Bxp B    139 ? 55.786 2.122   18.279  1    25.599  ? 2220 B 1 c
ATOM 6937 H HE1  . PHE Bxp B    139 ? 60.183 1.81    19.723  1    26.726  ? 2220 B 1 c
ATOM 6938 H HE2  . PHE Bxp B    139 ? 56.259 1.891   20.536  1    25.703  ? 2220 B 1 c
ATOM 6939 H HZ   . PHE Bxp B    139 ? 58.451 1.735   21.256  1    26.292  ? 2220 B 1 c
ATOM 6940 N N    . LEU Bxp B    140 ? 58.362 3.993   13.5    1    26.399  ? 2221 B 1 .
ATOM 6941 C CA   . LEU Bxp B    140 ? 58.256 4.113   12.072  1    26.798  ? 2221 B 1 .
ATOM 6942 C C    . LEU Bxp B    140 ? 58.97  2.935   11.445  1    27.92   ? 2221 B 1 .
ATOM 6943 O O    . LEU Bxp B    140 ? 60.115 2.666   11.764  1    28.569  ? 2221 B 1 .
ATOM 6944 C CB   . LEU Bxp B    140 ? 58.919 5.412   11.664  1    27.547  ? 2221 B 1 .
ATOM 6945 C CG   . LEU Bxp B    140 ? 58.903 5.652   10.16   1    28.466  ? 2221 B 1 .
ATOM 6946 C CD1  . LEU Bxp B    140 ? 57.506 6.125   9.802   1    30.91   ? 2221 B 1 .
ATOM 6947 C CD2  . LEU Bxp B    140 ? 59.96  6.631   9.742   1    27.962  ? 2221 B 1 .
ATOM 6948 H H    . LEU Bxp B    140 ? 59.188 4.032   13.889  1    26.638  ? 2221 B 1 c
ATOM 6949 H HA   . LEU Bxp B    140 ? 57.304 4.12    11.807  1    27.108  ? 2221 B 1 c
ATOM 6950 H HB3  . LEU Bxp B    140 ? 59.855 5.392   11.972  1    27.591  ? 2221 B 1 c
ATOM 6951 H HB2  . LEU Bxp B    140 ? 58.457 6.156   12.114  1    27.618  ? 2221 B 1 c
ATOM 6952 H HG   . LEU Bxp B    140 ? 59.073 4.791   9.698   1    28.63   ? 2221 B 1 c
ATOM 6953 H HD11 . LEU Bxp B    140 ? 57.002 5.386   9.421   1    30.156  ? 2221 B 1 c
ATOM 6954 H HD12 . LEU Bxp B    140 ? 57.562 6.844   9.151   1    30.142  ? 2221 B 1 c
ATOM 6955 H HD13 . LEU Bxp B    140 ? 57.051 6.446   10.598  1    30.138  ? 2221 B 1 c
ATOM 6956 H HD21 . LEU Bxp B    140 ? 60.774 6.466   10.245  1    28.12   ? 2221 B 1 c
ATOM 6957 H HD22 . LEU Bxp B    140 ? 59.652 7.536   9.918   1    28.144  ? 2221 B 1 c
ATOM 6958 H HD23 . LEU Bxp B    140 ? 60.14  6.53    8.793   1    28.134  ? 2221 B 1 c
ATOM 6959 N N    . PHE Bxp B    141 ? 58.285 2.244   10.548  1    30.256  ? 2222 B 1 .
ATOM 6960 C CA   . PHE Bxp B    141 ? 58.96  1.319   9.666   1    31.781  ? 2222 B 1 .
ATOM 6961 C C    . PHE Bxp B    141 ? 59.06  1.949   8.282   1    34.005  ? 2222 B 1 .
ATOM 6962 O O    . PHE Bxp B    141 ? 58.103 2.518   7.769   1    36.446  ? 2222 B 1 .
ATOM 6963 C CB   . PHE Bxp B    141 ? 58.212 -0.01   9.643   1    31.234  ? 2222 B 1 .
ATOM 6964 C CG   . PHE Bxp B    141 ? 58.671 -0.987  10.709  1    31.542  ? 2222 B 1 .
ATOM 6965 C CD1  . PHE Bxp B    141 ? 59.852 -1.695  10.544  1    31.83   ? 2222 B 1 .
ATOM 6966 C CD2  . PHE Bxp B    141 ? 57.902 -1.229  11.843  1    33.232  ? 2222 B 1 .
ATOM 6967 C CE1  . PHE Bxp B    141 ? 60.253 -2.619  11.495  1    33.537  ? 2222 B 1 .
ATOM 6968 C CE2  . PHE Bxp B    141 ? 58.301 -2.159  12.789  1    33.679  ? 2222 B 1 .
ATOM 6969 C CZ   . PHE Bxp B    141 ? 59.479 -2.849  12.615  1    34.664  ? 2222 B 1 .
ATOM 6970 H H    . PHE Bxp B    141 ? 57.379 2.348   10.48   1    29.975  ? 2222 B 1 c
ATOM 6971 H HA   . PHE Bxp B    141 ? 59.877 1.158   10.011  1    31.749  ? 2222 B 1 c
ATOM 6972 H HB3  . PHE Bxp B    141 ? 58.333 -0.423  8.76    1    31.443  ? 2222 B 1 c
ATOM 6973 H HB2  . PHE Bxp B    141 ? 57.253 0.167   9.765   1    31.432  ? 2222 B 1 c
ATOM 6974 H HD1  . PHE Bxp B    141 ? 60.38  -1.551  9.776   1    32.197  ? 2222 B 1 c
ATOM 6975 H HD2  . PHE Bxp B    141 ? 57.087 -0.766  11.959  1    32.915  ? 2222 B 1 c
ATOM 6976 H HE1  . PHE Bxp B    141 ? 61.063 -3.09   11.379  1    33.373  ? 2222 B 1 c
ATOM 6977 H HE2  . PHE Bxp B    141 ? 57.776 -2.306  13.558  1    33.722  ? 2222 B 1 c
ATOM 6978 H HZ   . PHE Bxp B    141 ? 59.764 -3.468  13.266  1    34.043  ? 2222 B 1 c
ATOM 6979 N N    . CYS Bxp B    142 ? 60.245 1.846   7.687   1    33.939  ? 2223 B 1 .
ATOM 6980 C CA   . CYS Bxp B    142 ? 60.425 2.164   6.286   1    34.168  ? 2223 B 1 .
ATOM 6981 C C    . CYS Bxp B    142 ? 60.537 0.859   5.513   1    33.421  ? 2223 B 1 .
ATOM 6982 O O    . CYS Bxp B    142 ? 61.332 -0.007  5.869   1    35.32   ? 2223 B 1 .
ATOM 6983 C CB   . CYS Bxp B    142 ? 61.676 3.007   6.082   1    35.027  ? 2223 B 1 .
ATOM 6984 S SG   . CYS Bxp B    142 ? 61.733 4.486   7.124   1    32.214  ? 2223 B 1 .
ATOM 6985 H H    . CYS Bxp B    142 ? 60.969 1.568   8.17    1    33.97   ? 2223 B 1 c
ATOM 6986 H HA   . CYS Bxp B    142 ? 59.631 2.658   5.969   1    34.078  ? 2223 B 1 c
ATOM 6987 H HB3  . CYS Bxp B    142 ? 61.725 3.287   5.141   1    34.271  ? 2223 B 1 c
ATOM 6988 H HB2  . CYS Bxp B    142 ? 62.469 2.459   6.276   1    34.267  ? 2223 B 1 c
ATOM 6989 H HG   . CYS Bxp B    142 ? 62.788 4.854   6.705   0    28.07   ? 2223 B 1 c
ATOM 6990 N N    . MET Bxp B    143 ? 59.758 0.729   4.443   1    33.444  ? 2224 B 1 .
ATOM 6991 C CA   . MET Bxp B    143 ? 59.786 -0.51   3.696   1    36.527  ? 2224 B 1 .
ATOM 6992 C C    . MET Bxp B    143 ? 59.721 -0.31   2.186   1    40.185  ? 2224 B 1 .
ATOM 6993 O O    . MET Bxp B    143 ? 58.899 0.454   1.677   1    41.258  ? 2224 B 1 .
ATOM 6994 C CB   . MET Bxp B    143 ? 58.598 -1.389  4.065   1    36.4    ? 2224 B 1 .
ATOM 6995 C CG   . MET Bxp B    143 ? 58.693 -1.991  5.426   1    35.986  ? 2224 B 1 .
ATOM 6996 S SD   . MET Bxp B    143 ? 57.369 -3.205  5.509   1    37.543  ? 2224 B 1 .
ATOM 6997 C CE   . MET Bxp B    143 ? 57.534 -3.568  7.262   1    39.963  ? 2224 B 1 .
ATOM 6998 H H    . MET Bxp B    143 ? 59.21  1.41    4.174   1    34.108  ? 2224 B 1 c
ATOM 6999 H HA   . MET Bxp B    143 ? 60.621 -0.983  3.915   1    36.489  ? 2224 B 1 c
ATOM 7000 H HB3  . MET Bxp B    143 ? 58.521 -2.108  3.403   1    36.431  ? 2224 B 1 c
ATOM 7001 H HB2  . MET Bxp B    143 ? 57.781 -0.848  4.013   1    36.284  ? 2224 B 1 c
ATOM 7002 H HG3  . MET Bxp B    143 ? 58.566 -1.308  6.115   1    36.379  ? 2224 B 1 c
ATOM 7003 H HG2  . MET Bxp B    143 ? 59.556 -2.42   5.553   1    36.398  ? 2224 B 1 c
ATOM 7004 H HE3  . MET Bxp B    143 ? 57.421 -2.747  7.775   1    39.345  ? 2224 B 1 c
ATOM 7005 H HE2  . MET Bxp B    143 ? 58.418 -3.941  7.434   1    39.345  ? 2224 B 1 c
ATOM 7006 H HE1  . MET Bxp B    143 ? 56.852 -4.213  7.525   1    39.345  ? 2224 B 1 c
ATOM 7007 N N    . ASP Bxp B    144 ? 60.569 -1.089  1.495   1    40.521  ? 2225 B 1 .
ATOM 7008 C CA   . ASP Bxp B    144 ? 60.517 -1.258  0.056   1    37.984  ? 2225 B 1 .
ATOM 7009 C C    . ASP Bxp B    144 ? 59.121 -1.716  -0.333  1    37.059  ? 2225 B 1 .
ATOM 7010 O O    . ASP Bxp B    144 ? 58.564 -2.619  0.277   1    35.749  ? 2225 B 1 .
ATOM 7011 C CB   . ASP Bxp B    144 ? 61.562 -2.258  -0.404  1    38.969  ? 2225 B 1 .
ATOM 7012 C CG   . ASP Bxp B    144 ? 62.98  -1.716  -0.463  1    42.494  ? 2225 B 1 .
ATOM 7013 O OD1  . ASP Bxp B    144 ? 63.167 -0.518  -0.174  1    44.747  ? 2225 B 1 .
ATOM 7014 O OD2  . ASP Bxp B    144 ? 63.895 -2.498  -0.774  1    49.448  ? 2225 B 1 .
ATOM 7015 H H    . ASP Bxp B    144 ? 61.225 -1.529  1.955   1    39.772  ? 2225 B 1 c
ATOM 7016 H HA   . ASP Bxp B    144 ? 60.698 -0.388  -0.366  1    38.511  ? 2225 B 1 c
ATOM 7017 H HB3  . ASP Bxp B    144 ? 61.323 -2.568  -1.3    1    39.491  ? 2225 B 1 c
ATOM 7018 H HB2  . ASP Bxp B    144 ? 61.552 -3.033  0.197   1    39.541  ? 2225 B 1 c
ATOM 7019 N N    . VAL Bxp B    145 ? 58.565 -1.076  -1.357  1    37.569  ? 2226 B 1 .
ATOM 7020 C CA   . VAL Bxp B    145 ? 57.226 -1.408  -1.81   1    37.342  ? 2226 B 1 .
ATOM 7021 C C    . VAL Bxp B    145 ? 57.168 -2.804  -2.435  1    38.427  ? 2226 B 1 .
ATOM 7022 O O    . VAL Bxp B    145 ? 56.148 -3.48   -2.327  1    46.235  ? 2226 B 1 .
ATOM 7023 C CB   . VAL Bxp B    145 ? 56.764 -0.347  -2.812  1    36.115  ? 2226 B 1 .
ATOM 7024 C CG1  . VAL Bxp B    145 ? 57.742 -0.194  -3.964  1    36.671  ? 2226 B 1 .
ATOM 7025 C CG2  . VAL Bxp B    145 ? 55.378 -0.666  -3.322  1    35.562  ? 2226 B 1 .
ATOM 7026 H H    . VAL Bxp B    145 ? 59.026 -0.407  -1.774  1    37.386  ? 2226 B 1 c
ATOM 7027 H HA   . VAL Bxp B    145 ? 56.626 -1.388  -1.039  1    37.335  ? 2226 B 1 c
ATOM 7028 H HB   . VAL Bxp B    145 ? 56.723 0.51    -2.332  1    36.283  ? 2226 B 1 c
ATOM 7029 H HG11 . VAL Bxp B    145 ? 57.923 -1.061  -4.36   1    36.534  ? 2226 B 1 c
ATOM 7030 H HG12 . VAL Bxp B    145 ? 58.572 0.194   -3.642  1    36.517  ? 2226 B 1 c
ATOM 7031 H HG13 . VAL Bxp B    145 ? 57.357 0.391   -4.638  1    36.513  ? 2226 B 1 c
ATOM 7032 H HG21 . VAL Bxp B    145 ? 54.949 0.152   -3.626  1    35.846  ? 2226 B 1 c
ATOM 7033 H HG22 . VAL Bxp B    145 ? 54.851 -1.06   -2.607  1    35.935  ? 2226 B 1 c
ATOM 7034 H HG23 . VAL Bxp B    145 ? 55.44  -1.292  -4.061  1    36.147  ? 2226 B 1 c
ATOM 7035 N N    . ASP Bxp B    146 ? 58.247 -3.231  -3.1    1    37.763  ? 2227 B 1 .
ATOM 7036 C CA   . ASP Bxp B    146 ? 58.276 -4.492  -3.831  1    37.616  ? 2227 B 1 .
ATOM 7037 C C    . ASP Bxp B    146 ? 58.392 -5.685  -2.87   1    37.369  ? 2227 B 1 .
ATOM 7038 O O    . ASP Bxp B    146 ? 59.298 -6.515  -2.976  1    37.48   ? 2227 B 1 .
ATOM 7039 C CB   . ASP Bxp B    146 ? 59.381 -4.478  -4.88   1    38.112  ? 2227 B 1 .
ATOM 7040 C CG   . ASP Bxp B    146 ? 60.803 -4.302  -4.345  1    38.806  ? 2227 B 1 .
ATOM 7041 O OD1  . ASP Bxp B    146 ? 60.977 -3.926  -3.164  1    36.303  ? 2227 B 1 .
ATOM 7042 O OD2  . ASP Bxp B    146 ? 61.744 -4.572  -5.104  1    42.961  ? 2227 B 1 .
ATOM 7043 H H    . ASP Bxp B    146 ? 58.998 -2.711  -3.1    1    37.873  ? 2227 B 1 c
ATOM 7044 H HA   . ASP Bxp B    146 ? 57.427 -4.577  -4.321  1    37.736  ? 2227 B 1 c
ATOM 7045 H HB3  . ASP Bxp B    146 ? 59.202 -3.748  -5.509  1    38.155  ? 2227 B 1 c
ATOM 7046 H HB2  . ASP Bxp B    146 ? 59.347 -5.319  -5.381  1    38.152  ? 2227 B 1 c
ATOM 7047 N N    . GLN Bxp B    147 ? 57.434 -5.794  -1.952  1    36.701  ? 2228 B 1 .
ATOM 7048 C CA   . GLN Bxp B    147 ? 57.322 -6.948  -1.079  1    38.895  ? 2228 B 1 .
ATOM 7049 C C    . GLN Bxp B    147 ? 55.9   -6.986  -0.561  1    39.313  ? 2228 B 1 .
ATOM 7050 O O    . GLN Bxp B    147 ? 55.254 -5.952  -0.612  1    43.855  ? 2228 B 1 .
ATOM 7051 C CB   . GLN Bxp B    147 ? 58.286 -6.845  0.094   1    40.862  ? 2228 B 1 .
ATOM 7052 C CG   . GLN Bxp B    147 ? 58.397 -5.452  0.695   1    42.2    ? 2228 B 1 .
ATOM 7053 C CD   . GLN Bxp B    147 ? 59.705 -5.257  1.438   1    44.177  ? 2228 B 1 .
ATOM 7054 O OE1  . GLN Bxp B    147 ? 60.652 -6.03   1.257   1    43.274  ? 2228 B 1 .
ATOM 7055 N NE2  . GLN Bxp B    147 ? 59.775 -4.243  2.295   1    43.824  ? 2228 B 1 .
ATOM 7056 H H    . GLN Bxp B    147 ? 56.815 -5.127  -1.872  1    37.373  ? 2228 B 1 c
ATOM 7057 H HA   . GLN Bxp B    147 ? 57.503 -7.769  -1.603  1    39.012  ? 2228 B 1 c
ATOM 7058 H HB3  . GLN Bxp B    147 ? 59.171 -7.134  -0.211  1    40.741  ? 2228 B 1 c
ATOM 7059 H HB2  . GLN Bxp B    147 ? 57.997 -7.468  0.793   1    40.741  ? 2228 B 1 c
ATOM 7060 H HG3  . GLN Bxp B    147 ? 57.65  -5.302  1.314   1    42.316  ? 2228 B 1 c
ATOM 7061 H HG2  . GLN Bxp B    147 ? 58.335 -4.786  -0.018  1    42.24   ? 2228 B 1 c
ATOM 7062 H HE21 . GLN Bxp B    147 ? 60.426 -3.648  2.222   1    43.819  ? 2228 B 1 c
ATOM 7063 H HE22 . GLN Bxp B    147 ? 59.174 -4.173  2.942   1    43.834  ? 2228 B 1 c
ATOM 7064 N N    . VAL Bxp B    148 ? 55.427 -8.152  -0.099  1    39.108  ? 2229 B 1 .
ATOM 7065 C CA   . VAL Bxp B    148 ? 54.084 -8.258  0.46    1    40.813  ? 2229 B 1 .
ATOM 7066 C C    . VAL Bxp B    148 ? 54.156 -8.934  1.81    1    41.146  ? 2229 B 1 .
ATOM 7067 O O    . VAL Bxp B    148 ? 54.948 -9.852  1.993   1    44.677  ? 2229 B 1 .
ATOM 7068 C CB   . VAL Bxp B    148 ? 53.06  -9.051  -0.358  1    40.644  ? 2229 B 1 .
ATOM 7069 C CG1  . VAL Bxp B    148 ? 52.895 -8.45   -1.736  1    45.556  ? 2229 B 1 .
ATOM 7070 C CG2  . VAL Bxp B    148 ? 53.437 -10.522 -0.433  1    40.64   ? 2229 B 1 .
ATOM 7071 H H    . VAL Bxp B    148 ? 55.955 -8.898  -0.131  1    39.548  ? 2229 B 1 c
ATOM 7072 H HA   . VAL Bxp B    148 ? 53.736 -7.355  0.59    1    40.528  ? 2229 B 1 c
ATOM 7073 H HB   . VAL Bxp B    148 ? 52.195 -8.981  0.11    1    41.552  ? 2229 B 1 c
ATOM 7074 H HG11 . VAL Bxp B    148 ? 53.437 -8.943  -2.374  1    44.137  ? 2229 B 1 c
ATOM 7075 H HG12 . VAL Bxp B    148 ? 53.177 -7.52   -1.723  1    44.047  ? 2229 B 1 c
ATOM 7076 H HG13 . VAL Bxp B    148 ? 51.961 -8.499  -2      1    44.197  ? 2229 B 1 c
ATOM 7077 H HG21 . VAL Bxp B    148 ? 53.019 -10.924 -1.213  1    40.705  ? 2229 B 1 c
ATOM 7078 H HG22 . VAL Bxp B    148 ? 53.128 -10.979 0.368   1    40.701  ? 2229 B 1 c
ATOM 7079 H HG23 . VAL Bxp B    148 ? 54.402 -10.61  -0.504  1    40.672  ? 2229 B 1 c
ATOM 7080 N N    . PHE Bxp B    149 ? 53.238 -8.538  2.691   1    39.352  ? 2230 B 1 .
ATOM 7081 C CA   . PHE Bxp B    149 ? 53.07  -9.229  3.952   1    38.995  ? 2230 B 1 .
ATOM 7082 C C    . PHE Bxp B    149 ? 52.31  -10.528 3.7     1    40.065  ? 2230 B 1 .
ATOM 7083 O O    . PHE Bxp B    149 ? 51.292 -10.549 2.997   1    35.456  ? 2230 B 1 .
ATOM 7084 C CB   . PHE Bxp B    149 ? 52.313 -8.336  4.929   1    39.4    ? 2230 B 1 .
ATOM 7085 C CG   . PHE Bxp B    149 ? 52.997 -7.027  5.283   1    37.354  ? 2230 B 1 .
ATOM 7086 C CD1  . PHE Bxp B    149 ? 52.822 -5.897  4.502   1    35.919  ? 2230 B 1 .
ATOM 7087 C CD2  . PHE Bxp B    149 ? 53.777 -6.93   6.429   1    37.018  ? 2230 B 1 .
ATOM 7088 C CE1  . PHE Bxp B    149 ? 53.43  -4.711  4.858   1    36.862  ? 2230 B 1 .
ATOM 7089 C CE2  . PHE Bxp B    149 ? 54.379 -5.739  6.78    1    35.849  ? 2230 B 1 .
ATOM 7090 C CZ   . PHE Bxp B    149 ? 54.205 -4.633  5.99    1    36.735  ? 2230 B 1 .
ATOM 7091 H H    . PHE Bxp B    149 ? 52.694 -7.83   2.496   1    39.642  ? 2230 B 1 c
ATOM 7092 H HA   . PHE Bxp B    149 ? 53.961 -9.435  4.329   1    39.516  ? 2230 B 1 c
ATOM 7093 H HB3  . PHE Bxp B    149 ? 52.163 -8.845  5.756   1    38.891  ? 2230 B 1 c
ATOM 7094 H HB2  . PHE Bxp B    149 ? 51.432 -8.137  4.544   1    38.716  ? 2230 B 1 c
ATOM 7095 H HD1  . PHE Bxp B    149 ? 52.289 -5.939  3.727   1    36.43   ? 2230 B 1 c
ATOM 7096 H HD2  . PHE Bxp B    149 ? 53.894 -7.69   6.975   1    36.792  ? 2230 B 1 c
ATOM 7097 H HE1  . PHE Bxp B    149 ? 53.316 -3.947  4.316   1    36.549  ? 2230 B 1 c
ATOM 7098 H HE2  . PHE Bxp B    149 ? 54.914 -5.689  7.555   1    36.319  ? 2230 B 1 c
ATOM 7099 H HZ   . PHE Bxp B    149 ? 54.621 -3.819  6.222   1    36.564  ? 2230 B 1 c
ATOM 7100 N N    . GLN Bxp B    150 ? 52.834 -11.616 4.271   1    41.474  ? 2231 B 1 .
ATOM 7101 C CA   . GLN Bxp B    150 ? 52.223 -12.924 4.111   1    41.946  ? 2231 B 1 .
ATOM 7102 C C    . GLN Bxp B    150 ? 51.49  -13.288 5.396   1    41.393  ? 2231 B 1 .
ATOM 7103 O O    . GLN Bxp B    150 ? 50.592 -14.13  5.382   1    47.39   ? 2231 B 1 .
ATOM 7104 C CB   . GLN Bxp B    150 ? 53.243 -14.005 3.743   1    42.873  ? 2231 B 1 .
ATOM 7105 C CG   . GLN Bxp B    150 ? 54.072 -13.718 2.494   1    44.592  ? 2231 B 1 .
ATOM 7106 C CD   . GLN Bxp B    150 ? 53.29  -13.755 1.196   1    46.099  ? 2231 B 1 .
ATOM 7107 O OE1  . GLN Bxp B    150 ? 52.061 -13.636 1.159   1    45.145  ? 2231 B 1 .
ATOM 7108 N NE2  . GLN Bxp B    150 ? 54.011 -13.892 0.095   1    49.376  ? 2231 B 1 .
ATOM 7109 H H    . GLN Bxp B    150 ? 53.607 -11.546 4.751   1    41.164  ? 2231 B 1 c
ATOM 7110 H HA   . GLN Bxp B    150 ? 51.556 -12.87  3.384   1    41.899  ? 2231 B 1 c
ATOM 7111 H HB3  . GLN Bxp B    150 ? 52.764 -14.85  3.614   1    43.047  ? 2231 B 1 c
ATOM 7112 H HB2  . GLN Bxp B    150 ? 53.851 -14.125 4.5     1    43.057  ? 2231 B 1 c
ATOM 7113 H HG3  . GLN Bxp B    150 ? 54.797 -14.375 2.435   1    44.533  ? 2231 B 1 c
ATOM 7114 H HG2  . GLN Bxp B    150 ? 54.484 -12.832 2.58    1    44.52   ? 2231 B 1 c
ATOM 7115 H HE21 . GLN Bxp B    150 ? 53.767 -14.479 -0.524  1    48.344  ? 2231 B 1 c
ATOM 7116 H HE22 . GLN Bxp B    150 ? 54.738 -13.398 -0.023  1    48.344  ? 2231 B 1 c
ATOM 7117 N N    . ASP Bxp B    151 ? 51.879 -12.656 6.505   1    38.65   ? 2232 B 1 .
ATOM 7118 C CA   . ASP Bxp B    151 ? 51.236 -12.939 7.77    1    37.966  ? 2232 B 1 .
ATOM 7119 C C    . ASP Bxp B    151 ? 51.53  -11.814 8.75    1    37      ? 2232 B 1 .
ATOM 7120 O O    . ASP Bxp B    151 ? 52.27  -10.895 8.44    1    36.169  ? 2232 B 1 .
ATOM 7121 C CB   . ASP Bxp B    151 ? 51.695 -14.269 8.337   1    37.83   ? 2232 B 1 .
ATOM 7122 C CG   . ASP Bxp B    151 ? 50.604 -15.125 8.966   1    38.29   ? 2232 B 1 .
ATOM 7123 O OD1  . ASP Bxp B    151 ? 49.722 -14.555 9.663   1    39.037  ? 2232 B 1 .
ATOM 7124 O OD2  . ASP Bxp B    151 ? 50.668 -16.361 8.767   1    36.57   ? 2232 B 1 .
ATOM 7125 H H    . ASP Bxp B    151 ? 52.56  -12.048 6.479   1    39.17   ? 2232 B 1 c
ATOM 7126 H HA   . ASP Bxp B    151 ? 50.263 -12.977 7.623   1    37.965  ? 2232 B 1 c
ATOM 7127 H HB3  . ASP Bxp B    151 ? 52.378 -14.104 9.02    1    37.962  ? 2232 B 1 c
ATOM 7128 H HB2  . ASP Bxp B    151 ? 52.114 -14.794 7.623   1    37.976  ? 2232 B 1 c
ATOM 7129 N N    . LYS Bxp B    152 ? 50.938 -11.925 9.935   1    39.792  ? 2233 B 1 .
ATOM 7130 C CA   . LYS Bxp B    152 ? 51.128 -10.978 11.02   1    41.526  ? 2233 B 1 .
ATOM 7131 C C    . LYS Bxp B    152 ? 52.588 -10.533 11.125  1    39.512  ? 2233 B 1 .
ATOM 7132 O O    . LYS Bxp B    152 ? 53.485 -11.324 11.422  1    36.403  ? 2233 B 1 .
ATOM 7133 C CB   . LYS Bxp B    152 ? 50.608 -11.592 12.327  1    44.353  ? 2233 B 1 .
ATOM 7134 C CG   . LYS Bxp B    152 ? 49.095 -11.866 12.4    1    46.167  ? 2233 B 1 .
ATOM 7135 C CD   . LYS Bxp B    152 ? 48.201 -10.624 12.408  1    46.463  ? 2233 B 1 .
ATOM 7136 C CE   . LYS Bxp B    152 ? 46.887 -10.854 11.723  1    44.494  ? 2233 B 1 .
ATOM 7137 N NZ   . LYS Bxp B    152 ? 47.106 -11.169 10.307  1    42.569  ? 2233 B 1 .
ATOM 7138 H H    . LYS Bxp B    152 ? 50.376 -12.632 10.074  1    39.578  ? 2233 B 1 c
ATOM 7139 H HA   . LYS Bxp B    152 ? 50.575 -10.181 10.822  1    41.323  ? 2233 B 1 c
ATOM 7140 H HB3  . LYS Bxp B    152 ? 50.844 -10.985 13.06   1    44.007  ? 2233 B 1 c
ATOM 7141 H HB2  . LYS Bxp B    152 ? 51.081 -12.438 12.482  1    44.077  ? 2233 B 1 c
ATOM 7142 H HG3  . LYS Bxp B    152 ? 48.918 -12.384 13.216  1    45.788  ? 2233 B 1 c
ATOM 7143 H HG2  . LYS Bxp B    152 ? 48.847 -12.432 11.638  1    45.674  ? 2233 B 1 c
ATOM 7144 H HD3  . LYS Bxp B    152 ? 48.671 -9.887  11.963  1    45.836  ? 2233 B 1 c
ATOM 7145 H HD2  . LYS Bxp B    152 ? 48.034 -10.358 13.338  1    45.914  ? 2233 B 1 c
ATOM 7146 H HE3  . LYS Bxp B    152 ? 46.327 -10.061 11.794  1    44.447  ? 2233 B 1 c
ATOM 7147 H HE2  . LYS Bxp B    152 ? 46.421 -11.596 12.147  1    44.464  ? 2233 B 1 c
ATOM 7148 H HZ1  . LYS Bxp B    152 ? 47.02  -12.062 10.177  1    43.195  ? 2233 B 1 c
ATOM 7149 H HZ2  . LYS Bxp B    152 ? 47.935 -10.911 10.053  1    43.267  ? 2233 B 1 c
ATOM 7150 H HZ3  . LYS Bxp B    152 ? 46.493 -10.736 9.801   1    43.182  ? 2233 B 1 c
ATOM 7151 N N    . PHE Bxp B    153 ? 52.779 -9.242  10.834  1    39.501  ? 2234 B 1 .
ATOM 7152 C CA   . PHE Bxp B    153 ? 53.992 -8.494  11.103  1    36.27   ? 2234 B 1 .
ATOM 7153 C C    . PHE Bxp B    153 ? 53.612 -7.415  12.101  1    35.492  ? 2234 B 1 .
ATOM 7154 O O    . PHE Bxp B    153 ? 52.961 -6.46   11.708  1    35.138  ? 2234 B 1 .
ATOM 7155 C CB   . PHE Bxp B    153 ? 54.432 -7.854  9.785   1    34.487  ? 2234 B 1 .
ATOM 7156 C CG   . PHE Bxp B    153 ? 55.814 -7.234  9.808   1    32.349  ? 2234 B 1 .
ATOM 7157 C CD1  . PHE Bxp B    153 ? 56.113 -6.2    10.681  1    31.613  ? 2234 B 1 .
ATOM 7158 C CD2  . PHE Bxp B    153 ? 56.788 -7.668  8.917   1    31.605  ? 2234 B 1 .
ATOM 7159 C CE1  . PHE Bxp B    153 ? 57.374 -5.649  10.69   1    31.735  ? 2234 B 1 .
ATOM 7160 C CE2  . PHE Bxp B    153 ? 58.048 -7.113  8.924   1    30.572  ? 2234 B 1 .
ATOM 7161 C CZ   . PHE Bxp B    153 ? 58.335 -6.106  9.812   1    31.835  ? 2234 B 1 .
ATOM 7162 H H    . PHE Bxp B    153 ? 52.094 -8.795  10.426  1    38.734  ? 2234 B 1 c
ATOM 7163 H HA   . PHE Bxp B    153 ? 54.702 -9.086  11.468  1    36.406  ? 2234 B 1 c
ATOM 7164 H HB3  . PHE Bxp B    153 ? 53.779 -7.164  9.538   1    34.388  ? 2234 B 1 c
ATOM 7165 H HB2  . PHE Bxp B    153 ? 54.408 -8.545  9.086   1    34.386  ? 2234 B 1 c
ATOM 7166 H HD1  . PHE Bxp B    153 ? 55.462 -5.891  11.288  1    31.86   ? 2234 B 1 c
ATOM 7167 H HD2  . PHE Bxp B    153 ? 56.59  -8.368  8.315   1    31.569  ? 2234 B 1 c
ATOM 7168 H HE1  . PHE Bxp B    153 ? 57.579 -4.952  11.293  1    31.73   ? 2234 B 1 c
ATOM 7169 H HE2  . PHE Bxp B    153 ? 58.708 -7.422  8.324   1    31.163  ? 2234 B 1 c
ATOM 7170 H HZ   . PHE Bxp B    153 ? 59.195 -5.716  9.815   1    31.52   ? 2234 B 1 c
ATOM 7171 N N    . GLY Bxp B    154 ? 53.986 -7.565  13.374  1    35.574  ? 2235 B 1 .
ATOM 7172 C CA   . GLY Bxp B    154 ? 53.314 -6.821  14.432  1    35.702  ? 2235 B 1 .
ATOM 7173 C C    . GLY Bxp B    154 ? 54.253 -6.238  15.487  1    35.898  ? 2235 B 1 .
ATOM 7174 O O    . GLY Bxp B    154 ? 55.471 -6.142  15.307  1    35.196  ? 2235 B 1 .
ATOM 7175 H H    . GLY Bxp B    154 ? 54.673 -8.128  13.586  1    35.575  ? 2235 B 1 c
ATOM 7176 H HA3  . GLY Bxp B    154 ? 52.671 -7.423  14.875  1    35.704  ? 2235 B 1 c
ATOM 7177 H HA2  . GLY Bxp B    154 ? 52.798 -6.087  14.027  1    35.688  ? 2235 B 1 c
ATOM 7178 N N    . VAL Bxp B    155 ? 53.659 -5.877  16.625  1    34.638  ? 2236 B 1 .
ATOM 7179 C CA   . VAL Bxp B    155 ? 54.367 -5.094  17.618  1    33.958  ? 2236 B 1 .
ATOM 7180 C C    . VAL Bxp B    155 ? 55.594 -5.853  18.107  1    31.946  ? 2236 B 1 .
ATOM 7181 O O    . VAL Bxp B    155 ? 56.486 -5.272  18.707  1    33.702  ? 2236 B 1 .
ATOM 7182 C CB   . VAL Bxp B    155 ? 53.444 -4.76   18.798  1    35.561  ? 2236 B 1 .
ATOM 7183 C CG1  . VAL Bxp B    155 ? 52.129 -4.145  18.336  1    35.213  ? 2236 B 1 .
ATOM 7184 C CG2  . VAL Bxp B    155 ? 53.198 -5.993  19.646  1    35.936  ? 2236 B 1 .
ATOM 7185 H H    . VAL Bxp B    155 ? 52.797 -6.134  16.788  1    34.817  ? 2236 B 1 c
ATOM 7186 H HA   . VAL Bxp B    155 ? 54.656 -4.262  17.204  1    33.994  ? 2236 B 1 c
ATOM 7187 H HB   . VAL Bxp B    155 ? 53.913 -4.095  19.35   1    35.249  ? 2236 B 1 c
ATOM 7188 H HG11 . VAL Bxp B    155 ? 51.456 -4.84   18.249  1    35.321  ? 2236 B 1 c
ATOM 7189 H HG12 . VAL Bxp B    155 ? 52.257 -3.71   17.476  1    35.309  ? 2236 B 1 c
ATOM 7190 H HG13 . VAL Bxp B    155 ? 51.833 -3.488  18.988  1    35.334  ? 2236 B 1 c
ATOM 7191 H HG21 . VAL Bxp B    155 ? 52.68  -5.748  20.43   1    35.859  ? 2236 B 1 c
ATOM 7192 H HG22 . VAL Bxp B    155 ? 54.046 -6.372  19.924  1    35.828  ? 2236 B 1 c
ATOM 7193 H HG23 . VAL Bxp B    155 ? 52.706 -6.651  19.126  1    35.823  ? 2236 B 1 c
ATOM 7194 N N    . GLU Bxp B    156 ? 55.631 -7.164  17.88   1    30.983  ? 2237 B 1 .
ATOM 7195 C CA   . GLU Bxp B    156 ? 56.792 -7.944  18.261  1    31.457  ? 2237 B 1 .
ATOM 7196 C C    . GLU Bxp B    156 ? 58.063 -7.382  17.639  1    30.667  ? 2237 B 1 .
ATOM 7197 O O    . GLU Bxp B    156 ? 59.144 -7.695  18.118  1    28.324  ? 2237 B 1 .
ATOM 7198 C CB   . GLU Bxp B    156 ? 56.742 -9.404  17.823  1    32.309  ? 2237 B 1 .
ATOM 7199 C CG   . GLU Bxp B    156 ? 56.778 -9.605  16.311  1    32.659  ? 2237 B 1 .
ATOM 7200 C CD   . GLU Bxp B    156 ? 55.446 -9.335  15.653  1    33.48   ? 2237 B 1 .
ATOM 7201 O OE1  . GLU Bxp B    156 ? 54.52  -8.928  16.381  1    34.154  ? 2237 B 1 .
ATOM 7202 O OE2  . GLU Bxp B    156 ? 55.315 -9.551  14.434  1    35.542  ? 2237 B 1 .
ATOM 7203 H H    . GLU Bxp B    156 ? 54.905 -7.591  17.527  1    31.406  ? 2237 B 1 c
ATOM 7204 H HA   . GLU Bxp B    156 ? 56.883 -7.909  19.238  1    31.57   ? 2237 B 1 c
ATOM 7205 H HB3  . GLU Bxp B    156 ? 55.93  -9.815  18.188  1    32.263  ? 2237 B 1 c
ATOM 7206 H HB2  . GLU Bxp B    156 ? 57.51  -9.872  18.212  1    32.275  ? 2237 B 1 c
ATOM 7207 H HG3  . GLU Bxp B    156 ? 57.035 -10.53  16.125  1    32.751  ? 2237 B 1 c
ATOM 7208 H HG2  . GLU Bxp B    156 ? 57.454 -9.02   15.914  1    32.733  ? 2237 B 1 c
ATOM 7209 N N    . THR Bxp B    157 ? 57.909 -6.626  16.543  1    31.163  ? 2238 B 1 .
ATOM 7210 C CA   . THR Bxp B    157 ? 59.029 -6.11   15.778  1    29.658  ? 2238 B 1 .
ATOM 7211 C C    . THR Bxp B    157 ? 59.362 -4.691  16.198  1    27.011  ? 2238 B 1 .
ATOM 7212 O O    . THR Bxp B    157 ? 60.287 -4.137  15.636  1    26.492  ? 2238 B 1 .
ATOM 7213 C CB   . THR Bxp B    157 ? 58.726 -6.094  14.28   1    31.35   ? 2238 B 1 .
ATOM 7214 O OG1  . THR Bxp B    157 ? 57.551 -5.31   14.071  1    32.279  ? 2238 B 1 .
ATOM 7215 C CG2  . THR Bxp B    157 ? 58.548 -7.484  13.71   1    31.463  ? 2238 B 1 .
ATOM 7216 H H    . THR Bxp B    157 ? 57.066 -6.446  16.242  1    30.741  ? 2238 B 1 c
ATOM 7217 H HA   . THR Bxp B    157 ? 59.809 -6.682  15.934  1    29.751  ? 2238 B 1 c
ATOM 7218 H HB   . THR Bxp B    157 ? 59.48  -5.67   13.805  1    31.278  ? 2238 B 1 c
ATOM 7219 H HG1  . THR Bxp B    157 ? 56.944 -5.697  14.469  0    20.61   ? 2238 B 1 c
ATOM 7220 H HG21 . THR Bxp B    157 ? 58.526 -7.435  12.74   1    31.522  ? 2238 B 1 c
ATOM 7221 H HG22 . THR Bxp B    157 ? 57.713 -7.86   14.032  1    31.499  ? 2238 B 1 c
ATOM 7222 H HG23 . THR Bxp B    157 ? 59.288 -8.049  13.99   1    31.486  ? 2238 B 1 c
ATOM 7223 N N    . LEU Bxp B    158 ? 58.584 -4.074  17.087  1    26.098  ? 2239 B 1 .
ATOM 7224 C CA   . LEU Bxp B    158 ? 58.822 -2.674  17.401  1    27.182  ? 2239 B 1 .
ATOM 7225 C C    . LEU Bxp B    158 ? 60.089 -2.542  18.227  1    26.698  ? 2239 B 1 .
ATOM 7226 O O    . LEU Bxp B    158 ? 60.426 -3.456  18.966  1    27.338  ? 2239 B 1 .
ATOM 7227 C CB   . LEU Bxp B    158 ? 57.648 -2.07   18.148  1    29.345  ? 2239 B 1 .
ATOM 7228 C CG   . LEU Bxp B    158 ? 56.366 -1.976  17.324  1    33.53   ? 2239 B 1 .
ATOM 7229 C CD1  . LEU Bxp B    158 ? 55.249 -1.498  18.242  1    35.675  ? 2239 B 1 .
ATOM 7230 C CD2  . LEU Bxp B    158 ? 56.55  -1.065  16.109  1    34.038  ? 2239 B 1 .
ATOM 7231 H H    . LEU Bxp B    158 ? 57.906 -4.519  17.506  1    26.654  ? 2239 B 1 c
ATOM 7232 H HA   . LEU Bxp B    158 ? 58.951 -2.184  16.55   1    27.315  ? 2239 B 1 c
ATOM 7233 H HB3  . LEU Bxp B    158 ? 57.899 -1.165  18.444  1    29.74   ? 2239 B 1 c
ATOM 7234 H HB2  . LEU Bxp B    158 ? 57.47  -2.621  18.944  1    29.784  ? 2239 B 1 c
ATOM 7235 H HG   . LEU Bxp B    158 ? 56.139 -2.883  16.998  1    33.148  ? 2239 B 1 c
ATOM 7236 H HD11 . LEU Bxp B    158 ? 55.16  -2.109  18.992  1    34.991  ? 2239 B 1 c
ATOM 7237 H HD12 . LEU Bxp B    158 ? 54.412 -1.469  17.748  1    35.02   ? 2239 B 1 c
ATOM 7238 H HD13 . LEU Bxp B    158 ? 55.458 -0.608  18.573  1    35.02   ? 2239 B 1 c
ATOM 7239 H HD21 . LEU Bxp B    158 ? 56.63  -1.607  15.308  1    33.803  ? 2239 B 1 c
ATOM 7240 H HD22 . LEU Bxp B    158 ? 57.354 -0.531  16.219  1    33.698  ? 2239 B 1 c
ATOM 7241 H HD23 . LEU Bxp B    158 ? 55.781 -0.477  16.024  1    33.845  ? 2239 B 1 c
ATOM 7242 N N    . GLY Bxp B    159 ? 60.754 -1.39   18.11   1    26.437  ? 2240 B 1 .
ATOM 7243 C CA   . GLY Bxp B    159 ? 62.003 -1.144  18.811  1    27.623  ? 2240 B 1 .
ATOM 7244 C C    . GLY Bxp B    159 ? 62.51  0.278   18.569  1    29.879  ? 2240 B 1 .
ATOM 7245 O O    . GLY Bxp B    159 ? 62.046 0.927   17.632  1    29.596  ? 2240 B 1 .
ATOM 7246 H H    . GLY Bxp B    159 ? 60.415 -0.731  17.574  1    26.79   ? 2240 B 1 c
ATOM 7247 H HA3  . GLY Bxp B    159 ? 62.68  -1.792  18.503  1    27.82   ? 2240 B 1 c
ATOM 7248 H HA2  . GLY Bxp B    159 ? 61.865 -1.285  19.777  1    27.836  ? 2240 B 1 c
ATOM 7249 N N    . GLU Bxp B    160 ? 63.454 0.742   19.419  1    31.601  ? 2241 B 1 .
ATOM 7250 C CA   . GLU Bxp B    160 ? 64.152 2.002   19.2    0.68 30.772  ? 2241 B 1 .
ATOM 7251 C C    . GLU Bxp B    160 ? 64.766 1.971   17.802  1    30.759  ? 2241 B 1 .
ATOM 7252 O O    . GLU Bxp B    160 ? 64.631 2.921   17.039  1    32.318  ? 2241 B 1 .
ATOM 7253 C CB   . GLU Bxp B    160 ? 65.255 2.377   20.202  0.68 30.54   ? 2241 B 1 .
ATOM 7254 C CG   . GLU Bxp B    160 ? 64.812 2.452   21.662  0.68 31.796  ? 2241 B 1 .
ATOM 7255 C CD   . GLU Bxp B    160 ? 63.729 3.468   22.027  0.68 32.106  ? 2241 B 1 .
ATOM 7256 O OE1  . GLU Bxp B    160 ? 64.067 4.683   22.032  0.68 29.521  ? 2241 B 1 .
ATOM 7257 O OE2  . GLU Bxp B    160 ? 62.564 3.049   22.329  0.68 30.887  ? 2241 B 1 .
ATOM 7258 H H    . GLU Bxp B    160 ? 63.665 0.248   20.158  1    30.951  ? 2241 B 1 c
ATOM 7259 H HA   . GLU Bxp B    160 ? 63.477 2.721   19.219  0.68 30.836  ? 2241 B 1 c
ATOM 7260 H HB3  . GLU Bxp B    160 ? 65.625 3.248   19.948  0.68 30.884  ? 2241 B 1 c
ATOM 7261 H HB2  . GLU Bxp B    160 ? 65.976 1.718   20.132  0.68 30.923  ? 2241 B 1 c
ATOM 7262 H HG3  . GLU Bxp B    160 ? 65.601 2.645   22.212  0.68 31.573  ? 2241 B 1 c
ATOM 7263 H HG2  . GLU Bxp B    160 ? 64.494 1.565   21.933  0.68 31.567  ? 2241 B 1 c
ATOM 7264 N N    . SER Bxp B    161 ? 65.443 0.878   17.45   1    30.932  ? 2242 B 1 .
ATOM 7265 C CA   . SER Bxp B    161 ? 66.082 0.8     16.148  1    31.901  ? 2242 B 1 .
ATOM 7266 C C    . SER Bxp B    161 ? 66.005 -0.629  15.647  1    30.921  ? 2242 B 1 .
ATOM 7267 O O    . SER Bxp B    161 ? 66.613 -1.521  16.212  1    33.629  ? 2242 B 1 .
ATOM 7268 C CB   . SER Bxp B    161 ? 67.507 1.301   16.179  1    33.202  ? 2242 B 1 .
ATOM 7269 O OG   . SER Bxp B    161 ? 68.204 0.799   17.311  1    35.704  ? 2242 B 1 .
ATOM 7270 H H    . SER Bxp B    161 ? 65.516 0.174   18.028  1    31.105  ? 2242 B 1 c
ATOM 7271 H HA   . SER Bxp B    161 ? 65.57  1.371   15.52   1    31.691  ? 2242 B 1 c
ATOM 7272 H HB3  . SER Bxp B    161 ? 67.505 2.276   16.205  1    33.474  ? 2242 B 1 c
ATOM 7273 H HB2  . SER Bxp B    161 ? 67.966 1.02    15.364  1    33.463  ? 2242 B 1 c
ATOM 7274 H HG   . SER Bxp B    161 ? 68.992 1.1     17.296  0    21.51   ? 2242 B 1 c
ATOM 7275 N N    . VAL Bxp B    162 ? 65.251 -0.832  14.579  1    30.432  ? 2243 B 1 .
ATOM 7276 C CA   . VAL Bxp B    162 ? 65.033 -2.174  14.1    1    31.189  ? 2243 B 1 .
ATOM 7277 C C    . VAL Bxp B    162 ? 65.783 -2.386  12.798  1    30.691  ? 2243 B 1 .
ATOM 7278 O O    . VAL Bxp B    162 ? 65.589 -1.65   11.832  1    30.862  ? 2243 B 1 .
ATOM 7279 C CB   . VAL Bxp B    162 ? 63.533 -2.4    13.912  1    33.337  ? 2243 B 1 .
ATOM 7280 C CG1  . VAL Bxp B    162 ? 63.268 -3.805  13.394  1    34.366  ? 2243 B 1 .
ATOM 7281 C CG2  . VAL Bxp B    162 ? 62.788 -2.136  15.209  1    35.399  ? 2243 B 1 .
ATOM 7282 H H    . VAL Bxp B    162 ? 64.871 -0.129  14.137  1    30.678  ? 2243 B 1 c
ATOM 7283 H HA   . VAL Bxp B    162 ? 65.364 -2.807  14.765  1    31.363  ? 2243 B 1 c
ATOM 7284 H HB   . VAL Bxp B    162 ? 63.219 -1.755  13.236  1    33.483  ? 2243 B 1 c
ATOM 7285 H HG11 . VAL Bxp B    162 ? 63.922 -4.419  13.768  1    34.004  ? 2243 B 1 c
ATOM 7286 H HG12 . VAL Bxp B    162 ? 63.335 -3.812  12.424  1    34.031  ? 2243 B 1 c
ATOM 7287 H HG13 . VAL Bxp B    162 ? 62.375 -4.085  13.657  1    34.05   ? 2243 B 1 c
ATOM 7288 H HG21 . VAL Bxp B    162 ? 61.831 -2.162  15.042  1    34.709  ? 2243 B 1 c
ATOM 7289 H HG22 . VAL Bxp B    162 ? 63.031 -1.261  15.554  1    34.729  ? 2243 B 1 c
ATOM 7290 H HG23 . VAL Bxp B    162 ? 63.02  -2.817  15.862  1    34.738  ? 2243 B 1 c
ATOM 7291 N N    . ALA Bxp B    163 ? 66.58  -3.451  12.769  1    30.41   ? 2244 B 1 .
ATOM 7292 C CA   . ALA Bxp B    163 ? 67.216 -3.868  11.536  1    32.573  ? 2244 B 1 .
ATOM 7293 C C    . ALA Bxp B    163 ? 66.603 -5.17   11.032  1    31.56   ? 2244 B 1 .
ATOM 7294 O O    . ALA Bxp B    163 ? 65.872 -5.859  11.742  1    28.669  ? 2244 B 1 .
ATOM 7295 C CB   . ALA Bxp B    163 ? 68.697 -3.999  11.756  1    35.088  ? 2244 B 1 .
ATOM 7296 H H    . ALA Bxp B    163 ? 66.735 -3.929  13.533  1    30.959  ? 2244 B 1 c
ATOM 7297 H HA   . ALA Bxp B    163 ? 67.056 -3.167  10.847  1    32.377  ? 2244 B 1 c
ATOM 7298 H HB3  . ALA Bxp B    163 ? 69.154 -3.997  10.899  1    34.336  ? 2244 B 1 c
ATOM 7299 H HB2  . ALA Bxp B    163 ? 68.888 -4.831  12.22   1    34.281  ? 2244 B 1 c
ATOM 7300 H HB1  . ALA Bxp B    163 ? 69.015 -3.253  12.289  1    34.283  ? 2244 B 1 c
ATOM 7301 N N    . GLN Bxp B    164 ? 66.921 -5.494  9.779   1    32.167  ? 2245 B 1 .
ATOM 7302 C CA   . GLN Bxp B    164 ? 66.343 -6.658  9.145   1    32.986  ? 2245 B 1 .
ATOM 7303 C C    . GLN Bxp B    164 ? 67.423 -7.524  8.511   1    34.997  ? 2245 B 1 .
ATOM 7304 O O    . GLN Bxp B    164 ? 67.994 -7.14   7.499   1    36.005  ? 2245 B 1 .
ATOM 7305 C CB   . GLN Bxp B    164 ? 65.418 -6.146  8.056   1    33.09   ? 2245 B 1 .
ATOM 7306 C CG   . GLN Bxp B    164 ? 64.931 -7.259  7.147   1    34.052  ? 2245 B 1 .
ATOM 7307 C CD   . GLN Bxp B    164 ? 64.066 -8.248  7.886   1    34.964  ? 2245 B 1 .
ATOM 7308 O OE1  . GLN Bxp B    164 ? 62.893 -7.984  8.144   1    36.254  ? 2245 B 1 .
ATOM 7309 N NE2  . GLN Bxp B    164 ? 64.619 -9.402  8.217   1    36.704  ? 2245 B 1 .
ATOM 7310 H H    . GLN Bxp B    164 ? 67.511 -4.977  9.309   1    32.22   ? 2245 B 1 c
ATOM 7311 H HA   . GLN Bxp B    164 ? 65.839 -7.185  9.815   1    33.217  ? 2245 B 1 c
ATOM 7312 H HB3  . GLN Bxp B    164 ? 65.893 -5.477  7.521   1    33.281  ? 2245 B 1 c
ATOM 7313 H HB2  . GLN Bxp B    164 ? 64.648 -5.708  8.473   1    33.287  ? 2245 B 1 c
ATOM 7314 H HG3  . GLN Bxp B    164 ? 65.695 -7.727  6.752   1    34.084  ? 2245 B 1 c
ATOM 7315 H HG2  . GLN Bxp B    164 ? 64.408 -6.871  6.414   1    34.047  ? 2245 B 1 c
ATOM 7316 H HE21 . GLN Bxp B    164 ? 64.314 -9.851  8.918   1    36.151  ? 2245 B 1 c
ATOM 7317 H HE22 . GLN Bxp B    164 ? 65.29  -9.73   7.738   1    36.126  ? 2245 B 1 c
ATOM 7318 N N    . LEU Bxp B    165 ? 67.672 -8.707  9.084   1    37.795  ? 2246 B 1 .
ATOM 7319 C CA   . LEU Bxp B    165 ? 68.619 -9.645  8.503   1    38.867  ? 2246 B 1 .
ATOM 7320 C C    . LEU Bxp B    165 ? 68.184 -9.905  7.07    1    40.286  ? 2246 B 1 .
ATOM 7321 O O    . LEU Bxp B    165 ? 67.064 -10.349 6.82    1    38.602  ? 2246 B 1 .
ATOM 7322 C CB   . LEU Bxp B    165 ? 68.74  -11.014 9.17    1    40.418  ? 2246 B 1 .
ATOM 7323 C CG   . LEU Bxp B    165 ? 68.802 -11.096 10.696  1    41.099  ? 2246 B 1 .
ATOM 7324 C CD1  . LEU Bxp B    165 ? 68.541 -12.555 11.039  1    40.733  ? 2246 B 1 .
ATOM 7325 C CD2  . LEU Bxp B    165 ? 70.104 -10.627 11.305  1    39.208  ? 2246 B 1 .
ATOM 7326 H H    . LEU Bxp B    165 ? 67.236 -8.936  9.854   1    37.32   ? 2246 B 1 c
ATOM 7327 H HA   . LEU Bxp B    165 ? 69.511 -9.212  8.492   1    39.241  ? 2246 B 1 c
ATOM 7328 H HB3  . LEU Bxp B    165 ? 69.546 -11.451 8.811   1    40.21   ? 2246 B 1 c
ATOM 7329 H HB2  . LEU Bxp B    165 ? 67.978 -11.56  8.867   1    40.209  ? 2246 B 1 c
ATOM 7330 H HG   . LEU Bxp B    165 ? 68.067 -10.55  11.072  1    40.423  ? 2246 B 1 c
ATOM 7331 H HD11 . LEU Bxp B    165 ? 67.979 -12.953 10.36   1    40.719  ? 2246 B 1 c
ATOM 7332 H HD12 . LEU Bxp B    165 ? 68.096 -12.611 11.901  1    40.759  ? 2246 B 1 c
ATOM 7333 H HD13 . LEU Bxp B    165 ? 69.385 -13.035 11.08   1    40.792  ? 2246 B 1 c
ATOM 7334 H HD21 . LEU Bxp B    165 ? 70.176 -9.661  11.218  1    39.688  ? 2246 B 1 c
ATOM 7335 H HD22 . LEU Bxp B    165 ? 70.849 -11.048 10.844  1    39.732  ? 2246 B 1 c
ATOM 7336 H HD23 . LEU Bxp B    165 ? 70.13  -10.869 12.246  1    39.688  ? 2246 B 1 c
ATOM 7337 N N    . GLN Bxp B    166 ? 69.114 -9.686  6.146   1    43.665  ? 2247 B 1 .
ATOM 7338 C CA   . GLN Bxp B    166 ? 68.869 -9.959  4.743   1    44.292  ? 2247 B 1 .
ATOM 7339 C C    . GLN Bxp B    166 ? 68.725 -11.461 4.586   1    44.231  ? 2247 B 1 .
ATOM 7340 O O    . GLN Bxp B    166 ? 69.559 -12.205 5.099   1    40.574  ? 2247 B 1 .
ATOM 7341 C CB   . GLN Bxp B    166 ? 70.05  -9.379  3.973   1    43.144  ? 2247 B 1 .
ATOM 7342 C CG   . GLN Bxp B    166 ? 69.741 -9.098  2.516   1    40.668  ? 2247 B 1 .
ATOM 7343 C CD   . GLN Bxp B    166 ? 69.766 -10.362 1.712   1    41.329  ? 2247 B 1 .
ATOM 7344 O OE1  . GLN Bxp B    166 ? 70.129 -11.43  2.206   1    43.838  ? 2247 B 1 .
ATOM 7345 N NE2  . GLN Bxp B    166 ? 69.396 -10.23  0.454   1    45.966  ? 2247 B 1 .
ATOM 7346 H H    . GLN Bxp B    166 ? 69.931 -9.364  6.397   1    42.907  ? 2247 B 1 c
ATOM 7347 H HA   . GLN Bxp B    166 ? 68.026 -9.516  4.472   1    43.855  ? 2247 B 1 c
ATOM 7348 H HB3  . GLN Bxp B    166 ? 70.805 -10.001 4.031   1    42.792  ? 2247 B 1 c
ATOM 7349 H HB2  . GLN Bxp B    166 ? 70.323 -8.541  4.399   1    42.791  ? 2247 B 1 c
ATOM 7350 H HG3  . GLN Bxp B    166 ? 70.404 -8.471  2.154   1    41.37   ? 2247 B 1 c
ATOM 7351 H HG2  . GLN Bxp B    166 ? 68.857 -8.683  2.44    1    41.37   ? 2247 B 1 c
ATOM 7352 H HE21 . GLN Bxp B    166 ? 69.704 -10.795 -0.157  1    44.468  ? 2247 B 1 c
ATOM 7353 H HE22 . GLN Bxp B    166 ? 68.842 -9.579  0.22    1    44.412  ? 2247 B 1 c
ATOM 7354 N N    . ALA Bxp B    167 ? 67.666 -11.881 3.89    1    47.064  ? 2248 B 1 .
ATOM 7355 C CA   . ALA Bxp B    167 ? 67.3   -13.29  3.852   1    52.048  ? 2248 B 1 .
ATOM 7356 C C    . ALA Bxp B    167 ? 68.481 -14.169 3.436   1    52.125  ? 2248 B 1 .
ATOM 7357 O O    . ALA Bxp B    167 ? 68.91  -15.042 4.186   1    58.081  ? 2248 B 1 .
ATOM 7358 C CB   . ALA Bxp B    167 ? 66.115 -13.49  2.937   1    53.96   ? 2248 B 1 .
ATOM 7359 H H    . ALA Bxp B    167 ? 67.16  -11.278 3.426   1    47.463  ? 2248 B 1 c
ATOM 7360 H HA   . ALA Bxp B    167 ? 67.039 -13.556 4.771   1    51.17   ? 2248 B 1 c
ATOM 7361 H HB3  . ALA Bxp B    167 ? 65.988 -14.439 2.768   1    53.349  ? 2248 B 1 c
ATOM 7362 H HB2  . ALA Bxp B    167 ? 66.27  -13.031 2.094   1    53.321  ? 2248 B 1 c
ATOM 7363 H HB1  . ALA Bxp B    167 ? 65.315 -13.13  3.355   1    53.292  ? 2248 B 1 c
ATOM 7364 N N    . TRP Bxp B    168 ? 69.037 -13.9   2.254   1    50.405  ? 2249 B 1 .
ATOM 7365 C CA   . TRP Bxp B    168 ? 70.111 -14.696 1.678   1    48.509  ? 2249 B 1 .
ATOM 7366 C C    . TRP Bxp B    168 ? 71.368 -14.768 2.561   1    47.848  ? 2249 B 1 .
ATOM 7367 O O    . TRP Bxp B    168 ? 72.263 -15.542 2.272   1    47.761  ? 2249 B 1 .
ATOM 7368 C CB   . TRP Bxp B    168 ? 70.461 -14.139 0.288   1    47.96   ? 2249 B 1 .
ATOM 7369 C CG   . TRP Bxp B    168 ? 69.367 -14.283 -0.739  1    48.746  ? 2249 B 1 .
ATOM 7370 C CD1  . TRP Bxp B    168 ? 68.247 -13.515 -0.867  1    52.911  ? 2249 B 1 .
ATOM 7371 C CD2  . TRP Bxp B    168 ? 69.298 -15.256 -1.8    1    49.221  ? 2249 B 1 .
ATOM 7372 N NE1  . TRP Bxp B    168 ? 67.475 -13.949 -1.912  1    54.382  ? 2249 B 1 .
ATOM 7373 C CE2  . TRP Bxp B    168 ? 68.098 -15.012 -2.507  1    54.839  ? 2249 B 1 .
ATOM 7374 C CE3  . TRP Bxp B    168 ? 70.122 -16.303 -2.213  1    50.096  ? 2249 B 1 .
ATOM 7375 C CZ2  . TRP Bxp B    168 ? 67.714 -15.777 -3.606  1    58.32   ? 2249 B 1 .
ATOM 7376 C CZ3  . TRP Bxp B    168 ? 69.745 -17.053 -3.304  1    55.543  ? 2249 B 1 .
ATOM 7377 C CH2  . TRP Bxp B    168 ? 68.561 -16.79  -3.993  1    58.619  ? 2249 B 1 .
ATOM 7378 H H    . TRP Bxp B    168 ? 68.74  -13.171 1.79    1    50.383  ? 2249 B 1 c
ATOM 7379 H HA   . TRP Bxp B    168 ? 69.769 -15.623 1.556   1    48.651  ? 2249 B 1 c
ATOM 7380 H HB3  . TRP Bxp B    168 ? 71.262 -14.601 -0.039  1    48.254  ? 2249 B 1 c
ATOM 7381 H HB2  . TRP Bxp B    168 ? 70.684 -13.189 0.38    1    48.238  ? 2249 B 1 c
ATOM 7382 H HD1  . TRP Bxp B    168 ? 68.017 -12.795 -0.303  1    52.17   ? 2249 B 1 c
ATOM 7383 H HE1  . TRP Bxp B    168 ? 66.721 -13.593 -2.164  1    54.06   ? 2249 B 1 c
ATOM 7384 H HE3  . TRP Bxp B    168 ? 70.928 -16.484 -1.76   1    51.222  ? 2249 B 1 c
ATOM 7385 H HZ2  . TRP Bxp B    168 ? 66.917 -15.599 -4.073  1    57.426  ? 2249 B 1 c
ATOM 7386 H HZ3  . TRP Bxp B    168 ? 70.298 -17.761 -3.592  1    54.866  ? 2249 B 1 c
ATOM 7387 H HH2  . TRP Bxp B    168 ? 68.327 -17.328 -4.729  1    57.682  ? 2249 B 1 c
ATOM 7388 N N    . TRP Bxp B    169 ? 71.49  -13.994 3.64    1    50.946  ? 2250 B 1 .
ATOM 7389 C CA   . TRP Bxp B    169 ? 72.784 -13.914 4.299   1    52.112  ? 2250 B 1 .
ATOM 7390 C C    . TRP Bxp B    169 ? 72.742 -14.206 5.796   1    57.176  ? 2250 B 1 .
ATOM 7391 O O    . TRP Bxp B    169 ? 73.799 -14.306 6.415   1    63.133  ? 2250 B 1 .
ATOM 7392 C CB   . TRP Bxp B    169 ? 73.393 -12.531 4.056   1    55.443  ? 2250 B 1 .
ATOM 7393 C CG   . TRP Bxp B    169 ? 73.711 -12.278 2.611   1    56.293  ? 2250 B 1 .
ATOM 7394 C CD1  . TRP Bxp B    169 ? 72.918 -11.665 1.69    1    54.02   ? 2250 B 1 .
ATOM 7395 C CD2  . TRP Bxp B    169 ? 74.906 -12.679 1.913   1    57.766  ? 2250 B 1 .
ATOM 7396 N NE1  . TRP Bxp B    169 ? 73.543 -11.638 0.475   1    57.07   ? 2250 B 1 .
ATOM 7397 C CE2  . TRP Bxp B    169 ? 74.759 -12.261 0.577   1    58.701  ? 2250 B 1 .
ATOM 7398 C CE3  . TRP Bxp B    169 ? 76.075 -13.347 2.28    1    59.281  ? 2250 B 1 .
ATOM 7399 C CZ2  . TRP Bxp B    169 ? 75.738 -12.497 -0.386  1    59.954  ? 2250 B 1 .
ATOM 7400 C CZ3  . TRP Bxp B    169 ? 77.041 -13.578 1.327   1    57.82   ? 2250 B 1 .
ATOM 7401 C CH2  . TRP Bxp B    169 ? 76.871 -13.164 0.012   1    57.876  ? 2250 B 1 .
ATOM 7402 H H    . TRP Bxp B    169 ? 70.791 -13.497 3.952   1    50.543  ? 2250 B 1 c
ATOM 7403 H HA   . TRP Bxp B    169 ? 73.386 -14.584 3.878   1    53.299  ? 2250 B 1 c
ATOM 7404 H HB3  . TRP Bxp B    169 ? 74.217 -12.452 4.583   1    54.917  ? 2250 B 1 c
ATOM 7405 H HB2  . TRP Bxp B    169 ? 72.759 -11.85  4.368   1    54.874  ? 2250 B 1 c
ATOM 7406 H HD1  . TRP Bxp B    169 ? 72.08  -11.291 1.86    1    55.035  ? 2250 B 1 c
ATOM 7407 H HE1  . TRP Bxp B    169 ? 73.213 -11.289 -0.254  1    56.72   ? 2250 B 1 c
ATOM 7408 H HE3  . TRP Bxp B    169 ? 76.197 -13.638 3.167   1    58.657  ? 2250 B 1 c
ATOM 7409 H HZ2  . TRP Bxp B    169 ? 75.624 -12.213 -1.277  1    59.138  ? 2250 B 1 c
ATOM 7410 H HZ3  . TRP Bxp B    169 ? 77.831 -14.031 1.57    1    58.181  ? 2250 B 1 c
ATOM 7411 H HH2  . TRP Bxp B    169 ? 77.552 -13.331 -0.616  1    58.347  ? 2250 B 1 c
ATOM 7412 N N    . TYR Bxp B    170 ? 71.566 -14.351 6.413   1    57.311  ? 2251 B 1 .
ATOM 7413 C CA   . TYR Bxp B    170 ? 71.562 -14.474 7.863   1    54.483  ? 2251 B 1 .
ATOM 7414 C C    . TYR Bxp B    170 ? 72.588 -15.528 8.257   1    53.205  ? 2251 B 1 .
ATOM 7415 O O    . TYR Bxp B    170 ? 73.29  -15.376 9.246   1    45.103  ? 2251 B 1 .
ATOM 7416 C CB   . TYR Bxp B    170 ? 70.19  -14.8   8.454   1    54.022  ? 2251 B 1 .
ATOM 7417 C CG   . TYR Bxp B    170 ? 69.637 -16.202 8.239   1    51.546  ? 2251 B 1 .
ATOM 7418 C CD1  . TYR Bxp B    170 ? 69.015 -16.564 7.049   1    51.494  ? 2251 B 1 .
ATOM 7419 C CD2  . TYR Bxp B    170 ? 69.664 -17.14  9.261   1    53.314  ? 2251 B 1 .
ATOM 7420 C CE1  . TYR Bxp B    170 ? 68.451 -17.82  6.872   1    53.567  ? 2251 B 1 .
ATOM 7421 C CE2  . TYR Bxp B    170 ? 69.111 -18.404 9.095   1    56.435  ? 2251 B 1 .
ATOM 7422 C CZ   . TYR Bxp B    170 ? 68.501 -18.749 7.898   1    55.385  ? 2251 B 1 .
ATOM 7423 O OH   . TYR Bxp B    170 ? 67.966 -19.998 7.726   1    51.79   ? 2251 B 1 .
ATOM 7424 H H    . TYR Bxp B    170 ? 70.78  -14.381 5.949   1    56.534  ? 2251 B 1 c
ATOM 7425 H HA   . TYR Bxp B    170 ? 71.857 -13.603 8.241   1    54.698  ? 2251 B 1 c
ATOM 7426 H HB3  . TYR Bxp B    170 ? 69.545 -14.156 8.086   1    53.446  ? 2251 B 1 c
ATOM 7427 H HB2  . TYR Bxp B    170 ? 70.233 -14.632 9.421   1    53.528  ? 2251 B 1 c
ATOM 7428 H HD1  . TYR Bxp B    170 ? 68.962 -15.935 6.349   1    51.934  ? 2251 B 1 c
ATOM 7429 H HD2  . TYR Bxp B    170 ? 70.065 -16.916 10.085  1    53.607  ? 2251 B 1 c
ATOM 7430 H HE1  . TYR Bxp B    170 ? 68.048 -18.046 6.051   1    53.479  ? 2251 B 1 c
ATOM 7431 H HE2  . TYR Bxp B    170 ? 69.153 -19.031 9.797   1    55.363  ? 2251 B 1 c
ATOM 7432 H HH   . TYR Bxp B    170 ? 67.774 -20.16  6.995   0    50.02   ? 2251 B 1 c
ATOM 7433 N N    . LYS Bxp B    171 ? 72.703 -16.556 7.413   1    60.559  ? 2252 B 1 .
ATOM 7434 C CA   . LYS Bxp B    171 ? 73.531 -17.718 7.673   1    59.708  ? 2252 B 1 .
ATOM 7435 C C    . LYS Bxp B    171 ? 75.028 -17.445 7.56    1    53.887  ? 2252 B 1 .
ATOM 7436 O O    . LYS Bxp B    171 ? 75.775 -18.058 8.298   1    49.659  ? 2252 B 1 .
ATOM 7437 C CB   . LYS Bxp B    171 ? 73.162 -18.814 6.67    1    66.432  ? 2252 B 1 .
ATOM 7438 C CG   . LYS Bxp B    171 ? 71.892 -19.585 7.002   1    71.817  ? 2252 B 1 .
ATOM 7439 C CD   . LYS Bxp B    171 ? 72.024 -20.432 8.262   1    73.49   ? 2252 B 1 .
ATOM 7440 C CE   . LYS Bxp B    171 ? 71.035 -21.554 8.273   1    79.22   ? 2252 B 1 .
ATOM 7441 N NZ   . LYS Bxp B    171 ? 71.382 -22.523 9.314   1    83.168  ? 2252 B 1 .
ATOM 7442 H H    . LYS Bxp B    171 ? 72.214 -16.544 6.641   1    58.597  ? 2252 B 1 c
ATOM 7443 H HA   . LYS Bxp B    171 ? 73.337 -18.038 8.59    1    59.942  ? 2252 B 1 c
ATOM 7444 H HB3  . LYS Bxp B    171 ? 73.904 -19.454 6.616   1    65.967  ? 2252 B 1 c
ATOM 7445 H HB2  . LYS Bxp B    171 ? 73.055 -18.409 5.783   1    65.916  ? 2252 B 1 c
ATOM 7446 H HG3  . LYS Bxp B    171 ? 71.669 -20.166 6.242   1    70.984  ? 2252 B 1 c
ATOM 7447 H HG2  . LYS Bxp B    171 ? 71.158 -18.944 7.12    1    70.779  ? 2252 B 1 c
ATOM 7448 H HD3  . LYS Bxp B    171 ? 71.878 -19.865 9.051   1    74.276  ? 2252 B 1 c
ATOM 7449 H HD2  . LYS Bxp B    171 ? 72.932 -20.802 8.311   1    74.315  ? 2252 B 1 c
ATOM 7450 H HE3  . LYS Bxp B    171 ? 71.028 -22.003 7.409   1    78.647  ? 2252 B 1 c
ATOM 7451 H HE2  . LYS Bxp B    171 ? 70.143 -21.205 8.448   1    78.573  ? 2252 B 1 c
ATOM 7452 H HZ1  . LYS Bxp B    171 ? 71.435 -22.107 10.117  1    81.868  ? 2252 B 1 c
ATOM 7453 H HZ2  . LYS Bxp B    171 ? 72.182 -22.904 9.123   1    81.866  ? 2252 B 1 c
ATOM 7454 H HZ3  . LYS Bxp B    171 ? 70.748 -23.168 9.354   1    81.908  ? 2252 B 1 c
ATOM 7455 N N    . ALA Bxp B    172 ? 75.473 -16.573 6.644   1    57.839  ? 2253 B 1 .
ATOM 7456 C CA   . ALA Bxp B    172 ? 76.867 -16.55  6.192   1    64.288  ? 2253 B 1 .
ATOM 7457 C C    . ALA Bxp B    172 ? 77.824 -15.911 7.206   1    63.707  ? 2253 B 1 .
ATOM 7458 O O    . ALA Bxp B    172 ? 77.402 -15.493 8.278   1    65.169  ? 2253 B 1 .
ATOM 7459 C CB   . ALA Bxp B    172 ? 76.96  -15.852 4.85    1    66.161  ? 2253 B 1 .
ATOM 7460 H H    . ALA Bxp B    172 ? 74.889 -15.967 6.288   1    58.347  ? 2253 B 1 c
ATOM 7461 H HA   . ALA Bxp B    172 ? 77.155 -17.497 6.069   1    63.08   ? 2253 B 1 c
ATOM 7462 H HB3  . ALA Bxp B    172 ? 77.753 -16.155 4.378   1    65.558  ? 2253 B 1 c
ATOM 7463 H HB2  . ALA Bxp B    172 ? 77.013 -14.89  4.984   1    65.514  ? 2253 B 1 c
ATOM 7464 H HB1  . ALA Bxp B    172 ? 76.173 -16.058 4.319   1    65.481  ? 2253 B 1 c
ATOM 7465 N N    . ASP Bxp B    173 ? 79.125 -15.863 6.861   1    65.301  ? 2254 B 1 .
ATOM 7466 C CA   . ASP Bxp B    173 ? 80.146 -15.309 7.738   1    65.893  ? 2254 B 1 .
ATOM 7467 C C    . ASP Bxp B    173 ? 80.407 -13.874 7.319   1    65.628  ? 2254 B 1 .
ATOM 7468 O O    . ASP Bxp B    173 ? 80.494 -13.59  6.124   1    66.522  ? 2254 B 1 .
ATOM 7469 C CB   . ASP Bxp B    173 ? 81.467 -16.06  7.687   1    69.429  ? 2254 B 1 .
ATOM 7470 C CG   . ASP Bxp B    173 ? 81.37  -17.574 7.805   1    80.658  ? 2254 B 1 .
ATOM 7471 O OD1  . ASP Bxp B    173 ? 80.946 -18.073 8.88    1    82.439  ? 2254 B 1 .
ATOM 7472 O OD2  . ASP Bxp B    173 ? 81.713 -18.244 6.809   1    86.108  ? 2254 B 1 .
ATOM 7473 H H    . ASP Bxp B    173 ? 79.382 -16.196 6.05    1    65.055  ? 2254 B 1 c
ATOM 7474 H HA   . ASP Bxp B    173 ? 79.812 -15.33  8.66    1    66.165  ? 2254 B 1 c
ATOM 7475 H HB3  . ASP Bxp B    173 ? 82.037 -15.736 8.415   1    71.023  ? 2254 B 1 c
ATOM 7476 H HB2  . ASP Bxp B    173 ? 81.916 -15.85  6.841   1    71.069  ? 2254 B 1 c
ATOM 7477 N N    . PRO Bxp B    174 ? 80.507 -12.947 8.298   1    61.613  ? 2255 B 1 .
ATOM 7478 C CA   . PRO Bxp B    174 ? 80.786 -11.539 8.05    1    60.338  ? 2255 B 1 .
ATOM 7479 C C    . PRO Bxp B    174 ? 81.717 -11.245 6.881   1    64.13   ? 2255 B 1 .
ATOM 7480 O O    . PRO Bxp B    174 ? 81.451 -10.331 6.107   1    72.15   ? 2255 B 1 .
ATOM 7481 C CB   . PRO Bxp B    174 ? 81.412 -11.099 9.361   1    58.813  ? 2255 B 1 .
ATOM 7482 C CG   . PRO Bxp B    174 ? 80.529 -11.857 10.335  1    58.567  ? 2255 B 1 .
ATOM 7483 C CD   . PRO Bxp B    174 ? 80.287 -13.207 9.726   1    58.26   ? 2255 B 1 .
ATOM 7484 H HA   . PRO Bxp B    174 ? 79.945 -11.065 7.918   1    60.963  ? 2255 B 1 c
ATOM 7485 H HB3  . PRO Bxp B    174 ? 81.338 -10.132 9.486   1    59.102  ? 2255 B 1 c
ATOM 7486 H HB2  . PRO Bxp B    174 ? 82.345 -11.382 9.425   1    59.123  ? 2255 B 1 c
ATOM 7487 H HG3  . PRO Bxp B    174 ? 79.682 -11.387 10.468  1    58.552  ? 2255 B 1 c
ATOM 7488 H HG2  . PRO Bxp B    174 ? 80.974 -11.95  11.201  1    58.552  ? 2255 B 1 c
ATOM 7489 H HD3  . PRO Bxp B    174 ? 80.921 -13.87  10.063  1    59.179  ? 2255 B 1 c
ATOM 7490 H HD2  . PRO Bxp B    174 ? 79.374 -13.514 9.89    1    59.158  ? 2255 B 1 c
ATOM 7491 N N    . ASN Bxp B    175 ? 82.815 -12     6.761   1    65.449  ? 2256 B 1 .
ATOM 7492 C CA   . ASN Bxp B    175 ? 83.795 -11.711 5.726   1    61.431  ? 2256 B 1 .
ATOM 7493 C C    . ASN Bxp B    175 ? 83.286 -12.1   4.346   1    57.261  ? 2256 B 1 .
ATOM 7494 O O    . ASN Bxp B    175 ? 83.927 -11.764 3.364   1    59.315  ? 2256 B 1 .
ATOM 7495 C CB   . ASN Bxp B    175 ? 85.136 -12.384 5.962   1    62.073  ? 2256 B 1 .
ATOM 7496 C CG   . ASN Bxp B    175 ? 85.849 -11.798 7.153   1    67.293  ? 2256 B 1 .
ATOM 7497 O OD1  . ASN Bxp B    175 ? 85.698 -10.605 7.454   1    66.513  ? 2256 B 1 .
ATOM 7498 N ND2  . ASN Bxp B    175 ? 86.604 -12.635 7.849   1    71.578  ? 2256 B 1 .
ATOM 7499 H H    . ASN Bxp B    175 ? 82.962 -12.696 7.334   1    64.163  ? 2256 B 1 c
ATOM 7500 H HA   . ASN Bxp B    175 ? 83.953 -10.74  5.724   1    61.628  ? 2256 B 1 c
ATOM 7501 H HB3  . ASN Bxp B    175 ? 85.697 -12.277 5.168   1    63.042  ? 2256 B 1 c
ATOM 7502 H HB2  . ASN Bxp B    175 ? 84.995 -13.34  6.109   1    63.125  ? 2256 B 1 c
ATOM 7503 H HD21 . ASN Bxp B    175 ? 86.61  -12.593 8.735   1    70.217  ? 2256 B 1 c
ATOM 7504 H HD22 . ASN Bxp B    175 ? 87.101 -13.237 7.428   1    70.172  ? 2256 B 1 c
ATOM 7505 N N    . ASP Bxp B    176 ? 82.135 -12.765 4.263   1    58.941  ? 2257 B 1 .
ATOM 7506 C CA   . ASP Bxp B    176 ? 81.54  -13.049 2.967   1    67.736  ? 2257 B 1 .
ATOM 7507 C C    . ASP Bxp B    176 ? 80.442 -12.032 2.631   1    66.561  ? 2257 B 1 .
ATOM 7508 O O    . ASP Bxp B    176 ? 79.874 -12.095 1.541   1    66.233  ? 2257 B 1 .
ATOM 7509 C CB   . ASP Bxp B    176 ? 81.046 -14.489 2.884   1    75.263  ? 2257 B 1 .
ATOM 7510 C CG   . ASP Bxp B    176 ? 82.101 -15.583 3.015   1    70.762  ? 2257 B 1 .
ATOM 7511 O OD1  . ASP Bxp B    176 ? 83.199 -15.408 2.447   1    65.44   ? 2257 B 1 .
ATOM 7512 O OD2  . ASP Bxp B    176 ? 81.802 -16.619 3.653   1    64.589  ? 2257 B 1 .
ATOM 7513 H H    . ASP Bxp B    176 ? 81.72  -13.071 5.017   1    60.531  ? 2257 B 1 c
ATOM 7514 H HA   . ASP Bxp B    176 ? 82.242 -12.966 2.284   1    66.919  ? 2257 B 1 c
ATOM 7515 H HB3  . ASP Bxp B    176 ? 80.594 -14.613 2.023   1    72.399  ? 2257 B 1 c
ATOM 7516 H HB2  . ASP Bxp B    176 ? 80.381 -14.627 3.59    1    72.384  ? 2257 B 1 c
ATOM 7517 N N    . PHE Bxp B    177 ? 80.15  -11.097 3.552   1    65.504  ? 2258 B 1 .
ATOM 7518 C CA   . PHE Bxp B    177 ? 79.044 -10.155 3.406   1    64.825  ? 2258 B 1 .
ATOM 7519 C C    . PHE Bxp B    177 ? 79.342 -9.129  2.32    1    62.345  ? 2258 B 1 .
ATOM 7520 O O    . PHE Bxp B    177 ? 80.417 -8.526  2.331   1    58.392  ? 2258 B 1 .
ATOM 7521 C CB   . PHE Bxp B    177 ? 78.784 -9.31   4.66    1    64.759  ? 2258 B 1 .
ATOM 7522 C CG   . PHE Bxp B    177 ? 78.123 -10.012 5.841   1    60.489  ? 2258 B 1 .
ATOM 7523 C CD1  . PHE Bxp B    177 ? 77.477 -11.236 5.692   1    57.683  ? 2258 B 1 .
ATOM 7524 C CD2  . PHE Bxp B    177 ? 78.106 -9.416  7.098   1    55.585  ? 2258 B 1 .
ATOM 7525 C CE1  . PHE Bxp B    177 ? 76.861 -11.845 6.773   1    54.405  ? 2258 B 1 .
ATOM 7526 C CE2  . PHE Bxp B    177 ? 77.49  -10.036 8.173   1    52.743  ? 2258 B 1 .
ATOM 7527 C CZ   . PHE Bxp B    177 ? 76.873 -11.252 8.009   1    52.136  ? 2258 B 1 .
ATOM 7528 H H    . PHE Bxp B    177 ? 80.666 -11.041 4.303   1    65.456  ? 2258 B 1 c
ATOM 7529 H HA   . PHE Bxp B    177 ? 78.221 -10.654 3.165   1    64.347  ? 2258 B 1 c
ATOM 7530 H HB3  . PHE Bxp B    177 ? 78.219 -8.548  4.402   1    63.77   ? 2258 B 1 c
ATOM 7531 H HB2  . PHE Bxp B    177 ? 79.642 -8.939  4.961   1    63.815  ? 2258 B 1 c
ATOM 7532 H HD1  . PHE Bxp B    177 ? 77.46  -11.657 4.849   1    57.578  ? 2258 B 1 c
ATOM 7533 H HD2  . PHE Bxp B    177 ? 78.537 -8.59   7.221   1    55.996  ? 2258 B 1 c
ATOM 7534 H HE1  . PHE Bxp B    177 ? 76.436 -12.681 6.658   1    54.645  ? 2258 B 1 c
ATOM 7535 H HE2  . PHE Bxp B    177 ? 77.507 -9.626  9.023   1    53.232  ? 2258 B 1 c
ATOM 7536 H HZ   . PHE Bxp B    177 ? 76.454 -11.674 8.742   1    52.904  ? 2258 B 1 c
ATOM 7537 N N    . THR Bxp B    178 ? 78.341 -8.871  1.457   1    61.17   ? 2259 B 1 .
ATOM 7538 C CA   . THR Bxp B    178 ? 78.482 -7.92   0.355   1    60.989  ? 2259 B 1 .
ATOM 7539 C C    . THR Bxp B    178 ? 78.45  -6.481  0.874   1    53.779  ? 2259 B 1 .
ATOM 7540 O O    . THR Bxp B    178 ? 77.777 -5.625  0.296   1    50.061  ? 2259 B 1 .
ATOM 7541 C CB   . THR Bxp B    178 ? 77.418 -8.113  -0.732  1    66.743  ? 2259 B 1 .
ATOM 7542 O OG1  . THR Bxp B    178 ? 76.189 -8.553  -0.159  1    73.577  ? 2259 B 1 .
ATOM 7543 C CG2  . THR Bxp B    178 ? 77.843 -9.095  -1.81   1    70.528  ? 2259 B 1 .
ATOM 7544 H H    . THR Bxp B    178 ? 77.542 -9.303  1.56    1    61.488  ? 2259 B 1 c
ATOM 7545 H HA   . THR Bxp B    178 ? 79.36  -8.073  -0.057  1    60.671  ? 2259 B 1 c
ATOM 7546 H HB   . THR Bxp B    178 ? 77.267 -7.244  -1.17   1    67.29   ? 2259 B 1 c
ATOM 7547 H HG1  . THR Bxp B    178 ? 76.244 -9.353  0.158   0    50.75   ? 2259 B 1 c
ATOM 7548 H HG21 . THR Bxp B    178 ? 77.134 -9.181  -2.469  1    69.387  ? 2259 B 1 c
ATOM 7549 H HG22 . THR Bxp B    178 ? 78.018 -9.962  -1.409  1    69.387  ? 2259 B 1 c
ATOM 7550 H HG23 . THR Bxp B    178 ? 78.65  -8.771  -2.245  1    69.387  ? 2259 B 1 c
ATOM 7551 N N    . TYR Bxp B    179 ? 79.199 -6.223  1.952   1    49.505  ? 2260 B 1 .
ATOM 7552 C CA   . TYR Bxp B    179 ? 79.431 -4.871  2.416   1    51.363  ? 2260 B 1 .
ATOM 7553 C C    . TYR Bxp B    179 ? 80.234 -4.096  1.37    1    52.55   ? 2260 B 1 .
ATOM 7554 O O    . TYR Bxp B    179 ? 80.737 -4.659  0.4     1    51.393  ? 2260 B 1 .
ATOM 7555 C CB   . TYR Bxp B    179 ? 80.246 -4.887  3.71    1    53.221  ? 2260 B 1 .
ATOM 7556 C CG   . TYR Bxp B    179 ? 79.616 -5.392  5.002   1    52.685  ? 2260 B 1 .
ATOM 7557 C CD1  . TYR Bxp B    179 ? 78.245 -5.451  5.197   1    52.613  ? 2260 B 1 .
ATOM 7558 C CD2  . TYR Bxp B    179 ? 80.426 -5.752  6.072   1    54.886  ? 2260 B 1 .
ATOM 7559 C CE1  . TYR Bxp B    179 ? 77.704 -5.883  6.4     1    55.19   ? 2260 B 1 .
ATOM 7560 C CE2  . TYR Bxp B    179 ? 79.897 -6.188  7.276   1    54.516  ? 2260 B 1 .
ATOM 7561 C CZ   . TYR Bxp B    179 ? 78.528 -6.249  7.448   1    55.296  ? 2260 B 1 .
ATOM 7562 O OH   . TYR Bxp B    179 ? 78.002 -6.666  8.643   1    56.739  ? 2260 B 1 .
ATOM 7563 H H    . TYR Bxp B    179 ? 79.587 -6.912  2.408   1    51.153  ? 2260 B 1 c
ATOM 7564 H HA   . TYR Bxp B    179 ? 78.561 -4.417  2.573   1    51.546  ? 2260 B 1 c
ATOM 7565 H HB3  . TYR Bxp B    179 ? 80.562 -3.97   3.873   1    52.668  ? 2260 B 1 c
ATOM 7566 H HB2  . TYR Bxp B    179 ? 81.053 -5.423  3.542   1    52.658  ? 2260 B 1 c
ATOM 7567 H HD1  . TYR Bxp B    179 ? 77.666 -5.197  4.497   1    53.114  ? 2260 B 1 c
ATOM 7568 H HD2  . TYR Bxp B    179 ? 81.363 -5.712  5.972   1    54.304  ? 2260 B 1 c
ATOM 7569 H HE1  . TYR Bxp B    179 ? 76.77  -5.917  6.509   1    54.431  ? 2260 B 1 c
ATOM 7570 H HE2  . TYR Bxp B    179 ? 80.47  -6.433  7.98    1    54.708  ? 2260 B 1 c
ATOM 7571 H HH   . TYR Bxp B    179 ? 77.224 -6.707  8.617   0    49.16   ? 2260 B 1 c
ATOM 7572 N N    . GLU Bxp B    180 ? 80.375 -2.786  1.578   1    52.964  ? 2261 B 1 .
ATOM 7573 C CA   . GLU Bxp B    180 ? 81.302 -2.019  0.771   1    52.875  ? 2261 B 1 .
ATOM 7574 C C    . GLU Bxp B    180 ? 82.685 -2.165  1.396   1    57.12   ? 2261 B 1 .
ATOM 7575 O O    . GLU Bxp B    180 ? 82.886 -1.826  2.562   1    55.441  ? 2261 B 1 .
ATOM 7576 C CB   . GLU Bxp B    180 ? 80.843 -0.567  0.654   1    54.616  ? 2261 B 1 .
ATOM 7577 C CG   . GLU Bxp B    180 ? 81.732 0.296   -0.236  1    52.843  ? 2261 B 1 .
ATOM 7578 C CD   . GLU Bxp B    180 ? 82.167 -0.42   -1.496  1    54.352  ? 2261 B 1 .
ATOM 7579 O OE1  . GLU Bxp B    180 ? 81.306 -0.851  -2.286  1    58.437  ? 2261 B 1 .
ATOM 7580 O OE2  . GLU Bxp B    180 ? 83.387 -0.576  -1.664  1    57.327  ? 2261 B 1 .
ATOM 7581 H H    . GLU Bxp B    180 ? 79.889 -2.366  2.229   1    52.845  ? 2261 B 1 c
ATOM 7582 H HA   . GLU Bxp B    180 ? 81.319 -2.415  -0.136  1    54.033  ? 2261 B 1 c
ATOM 7583 H HB3  . GLU Bxp B    180 ? 80.816 -0.173  1.551   1    53.809  ? 2261 B 1 c
ATOM 7584 H HB2  . GLU Bxp B    180 ? 79.93  -0.554  0.296   1    53.809  ? 2261 B 1 c
ATOM 7585 H HG3  . GLU Bxp B    180 ? 82.53  0.565   0.268   1    53.604  ? 2261 B 1 c
ATOM 7586 H HG2  . GLU Bxp B    180 ? 81.245 1.109   -0.488  1    53.571  ? 2261 B 1 c
ATOM 7587 N N    . ARG Bxp B    181 ? 83.632 -2.68   0.602   1    60.611  ? 2262 B 1 .
ATOM 7588 C CA   . ARG Bxp B    181 ? 84.948 -3.043  1.104   1    57.545  ? 2262 B 1 .
ATOM 7589 C C    . ARG Bxp B    181 ? 86.003 -1.979  0.779   1    55.889  ? 2262 B 1 .
ATOM 7590 O O    . ARG Bxp B    181 ? 87.121 -2.073  1.272   1    57.294  ? 2262 B 1 .
ATOM 7591 C CB   . ARG Bxp B    181 ? 85.269 -4.441  0.558   1    56.397  ? 2262 B 1 .
ATOM 7592 C CG   . ARG Bxp B    181 ? 84.354 -5.561  1.048   1    56.266  ? 2262 B 1 .
ATOM 7593 C CD   . ARG Bxp B    181 ? 84.192 -5.634  2.576   1    56.688  ? 2262 B 1 .
ATOM 7594 N NE   . ARG Bxp B    181 ? 83.546 -6.872  3.037   1    58.175  ? 2262 B 1 .
ATOM 7595 C CZ   . ARG Bxp B    181 ? 83.403 -7.263  4.31    1    60.096  ? 2262 B 1 .
ATOM 7596 N NH1  . ARG Bxp B    181 ? 83.887 -6.547  5.313   1    58.58   ? 2262 B 1 .
ATOM 7597 N NH2  . ARG Bxp B    181 ? 82.761 -8.385  4.583   1    60.691  ? 2262 B 1 .
ATOM 7598 H H    . ARG Bxp B    181 ? 83.452 -2.809  -0.284  1    58.914  ? 2262 B 1 c
ATOM 7599 H HA   . ARG Bxp B    181 ? 84.892 -3.113  2.09    1    57.581  ? 2262 B 1 c
ATOM 7600 H HB3  . ARG Bxp B    181 ? 86.193 -4.663  0.804   1    56.628  ? 2262 B 1 c
ATOM 7601 H HB2  . ARG Bxp B    181 ? 85.225 -4.408  -0.421  1    56.64   ? 2262 B 1 c
ATOM 7602 H HG3  . ARG Bxp B    181 ? 84.707 -6.42   0.729   1    56.391  ? 2262 B 1 c
ATOM 7603 H HG2  . ARG Bxp B    181 ? 83.467 -5.444  0.644   1    56.391  ? 2262 B 1 c
ATOM 7604 H HD3  . ARG Bxp B    181 ? 83.66  -4.869  2.874   1    56.949  ? 2262 B 1 c
ATOM 7605 H HD2  . ARG Bxp B    181 ? 85.076 -5.562  2.991   1    56.943  ? 2262 B 1 c
ATOM 7606 H HE   . ARG Bxp B    181 ? 83.224 -7.404  2.427   1    58.294  ? 2262 B 1 c
ATOM 7607 H HH11 . ARG Bxp B    181 ? 83.932 -5.667  5.249   1    59.035  ? 2262 B 1 c
ATOM 7608 H HH12 . ARG Bxp B    181 ? 84.154 -6.953  6.05    1    59.073  ? 2262 B 1 c
ATOM 7609 H HH21 . ARG Bxp B    181 ? 82.905 -9.104  4.09    1    60.49   ? 2262 B 1 c
ATOM 7610 H HH22 . ARG Bxp B    181 ? 82.19  -8.411  5.257   1    60.503  ? 2262 B 1 c
ATOM 7611 N N    . ARG Bxp B    182 ? 85.65  -0.939  0.008   1    55.561  ? 2263 B 1 .
ATOM 7612 C CA   . ARG Bxp B    182 ? 86.616 0.064   -0.428  1    56.588  ? 2263 B 1 .
ATOM 7613 C C    . ARG Bxp B    182 ? 86.711 1.199   0.588   1    53.946  ? 2263 B 1 .
ATOM 7614 O O    . ARG Bxp B    182 ? 85.755 1.941   0.761   1    54.913  ? 2263 B 1 .
ATOM 7615 C CB   . ARG Bxp B    182 ? 86.185 0.654   -1.776  1    59.82   ? 2263 B 1 .
ATOM 7616 C CG   . ARG Bxp B    182 ? 86.028 -0.363  -2.9    1    61.702  ? 2263 B 1 .
ATOM 7617 C CD   . ARG Bxp B    182 ? 85.496 0.245   -4.199  1    59.487  ? 2263 B 1 .
ATOM 7618 N NE   . ARG Bxp B    182 ? 84.228 0.977   -4.067  1    56.114  ? 2263 B 1 .
ATOM 7619 C CZ   . ARG Bxp B    182 ? 83.249 0.985   -4.966  1    56.807  ? 2263 B 1 .
ATOM 7620 N NH1  . ARG Bxp B    182 ? 83.339 0.243   -6.055  1    60.994  ? 2263 B 1 .
ATOM 7621 N NH2  . ARG Bxp B    182 ? 82.175 1.727   -4.768  1    56.064  ? 2263 B 1 .
ATOM 7622 H H    . ARG Bxp B    182 ? 84.779 -0.849  -0.253  1    55.955  ? 2263 B 1 c
ATOM 7623 H HA   . ARG Bxp B    182 ? 87.504 -0.365  -0.526  1    56.462  ? 2263 B 1 c
ATOM 7624 H HB3  . ARG Bxp B    182 ? 86.847 1.321   -2.05   1    59.536  ? 2263 B 1 c
ATOM 7625 H HB2  . ARG Bxp B    182 ? 85.332 1.12    -1.651  1    59.395  ? 2263 B 1 c
ATOM 7626 H HG3  . ARG Bxp B    182 ? 85.422 -1.077  -2.612  1    60.709  ? 2263 B 1 c
ATOM 7627 H HG2  . ARG Bxp B    182 ? 86.901 -0.774  -3.08   1    60.751  ? 2263 B 1 c
ATOM 7628 H HD3  . ARG Bxp B    182 ? 85.381 -0.479  -4.848  1    59.159  ? 2263 B 1 c
ATOM 7629 H HD2  . ARG Bxp B    182 ? 86.176 0.853   -4.556  1    59.158  ? 2263 B 1 c
ATOM 7630 H HE   . ARG Bxp B    182 ? 84.103 1.451   -3.349  1    57.069  ? 2263 B 1 c
ATOM 7631 H HH11 . ARG Bxp B    182 ? 83.964 0.417   -6.655  1    59.673  ? 2263 B 1 c
ATOM 7632 H HH12 . ARG Bxp B    182 ? 82.773 -0.425  -6.178  1    59.673  ? 2263 B 1 c
ATOM 7633 H HH21 . ARG Bxp B    182 ? 81.782 1.727   -3.977  1    56.291  ? 2263 B 1 c
ATOM 7634 H HH22 . ARG Bxp B    182 ? 81.855 2.22    -5.428  1    56.291  ? 2263 B 1 c
ATOM 7635 N N    . LYS Bxp B    183 ? 87.88  1.378   1.213   1    56.05   ? 2264 B 1 .
ATOM 7636 C CA   . LYS Bxp B    183 ? 88.021 2.335   2.308   1    58.126  ? 2264 B 1 .
ATOM 7637 C C    . LYS Bxp B    183 ? 87.503 3.729   1.924   1    52.633  ? 2264 B 1 .
ATOM 7638 O O    . LYS Bxp B    183 ? 87.093 4.484   2.801   1    45.124  ? 2264 B 1 .
ATOM 7639 C CB   . LYS Bxp B    183 ? 89.431 2.334   2.93    1    62.808  ? 2264 B 1 .
ATOM 7640 C CG   . LYS Bxp B    183 ? 90.667 2.535   2.048   1    68.582  ? 2264 B 1 .
ATOM 7641 C CD   . LYS Bxp B    183 ? 91.237 1.266   1.424   1    75.31   ? 2264 B 1 .
ATOM 7642 C CE   . LYS Bxp B    183 ? 92.487 1.546   0.645   1    78.838  ? 2264 B 1 .
ATOM 7643 N NZ   . LYS Bxp B    183 ? 92.768 0.488   -0.33   1    80.171  ? 2264 B 1 .
ATOM 7644 H H    . LYS Bxp B    183 ? 88.604 0.883   0.961   1    56.368  ? 2264 B 1 c
ATOM 7645 H HA   . LYS Bxp B    183 ? 87.435 2.019   3.033   1    57.548  ? 2264 B 1 c
ATOM 7646 H HB3  . LYS Bxp B    183 ? 89.542 1.479   3.397   1    62.966  ? 2264 B 1 c
ATOM 7647 H HB2  . LYS Bxp B    183 ? 89.446 3.035   3.616   1    62.966  ? 2264 B 1 c
ATOM 7648 H HG3  . LYS Bxp B    183 ? 91.366 2.959   2.591   1    68.683  ? 2264 B 1 c
ATOM 7649 H HG2  . LYS Bxp B    183 ? 90.434 3.162   1.33    1    68.731  ? 2264 B 1 c
ATOM 7650 H HD3  . LYS Bxp B    183 ? 90.571 0.868   0.825   1    74.363  ? 2264 B 1 c
ATOM 7651 H HD2  . LYS Bxp B    183 ? 91.438 0.618   2.134   1    74.488  ? 2264 B 1 c
ATOM 7652 H HE3  . LYS Bxp B    183 ? 93.24  1.616   1.259   1    78.319  ? 2264 B 1 c
ATOM 7653 H HE2  . LYS Bxp B    183 ? 92.402 2.396   0.177   1    78.282  ? 2264 B 1 c
ATOM 7654 H HZ1  . LYS Bxp B    183 ? 92.115 0.467   -0.957  1    79.715  ? 2264 B 1 c
ATOM 7655 H HZ2  . LYS Bxp B    183 ? 92.804 -0.314  0.09    1    79.724  ? 2264 B 1 c
ATOM 7656 H HZ3  . LYS Bxp B    183 ? 93.563 0.648   -0.735  1    79.743  ? 2264 B 1 c
ATOM 7657 N N    . GLU Bxp B    184 ? 87.462 4.049   0.623   1    57.141  ? 2265 B 1 .
ATOM 7658 C CA   . GLU Bxp B    184 ? 87.221 5.408   0.148   1    61.744  ? 2265 B 1 .
ATOM 7659 C C    . GLU Bxp B    184 ? 85.733 5.755   0.221   1    58.301  ? 2265 B 1 .
ATOM 7660 O O    . GLU Bxp B    184 ? 85.371 6.927   0.185   1    57.329  ? 2265 B 1 .
ATOM 7661 C CB   . GLU Bxp B    184 ? 87.673 5.636   -1.3    1    66.056  ? 2265 B 1 .
ATOM 7662 C CG   . GLU Bxp B    184 ? 89.095 5.178   -1.625  1    68.334  ? 2265 B 1 .
ATOM 7663 C CD   . GLU Bxp B    184 ? 89.33  3.672   -1.582  1    74.806  ? 2265 B 1 .
ATOM 7664 O OE1  . GLU Bxp B    184 ? 88.415 2.889   -1.943  1    73.955  ? 2265 B 1 .
ATOM 7665 O OE2  . GLU Bxp B    184 ? 90.45  3.272   -1.191  1    80.042  ? 2265 B 1 .
ATOM 7666 H H    . GLU Bxp B    184 ? 87.577 3.39    0.003   1    57.22   ? 2265 B 1 c
ATOM 7667 H HA   . GLU Bxp B    184 ? 87.718 6.034   0.733   1    60.79   ? 2265 B 1 c
ATOM 7668 H HB3  . GLU Bxp B    184 ? 87.607 6.594   -1.498  1    65.557  ? 2265 B 1 c
ATOM 7669 H HB2  . GLU Bxp B    184 ? 87.054 5.168   -1.898  1    65.556  ? 2265 B 1 c
ATOM 7670 H HG3  . GLU Bxp B    184 ? 89.713 5.603   -0.993  1    69.293  ? 2265 B 1 c
ATOM 7671 H HG2  . GLU Bxp B    184 ? 89.332 5.5     -2.52   1    69.243  ? 2265 B 1 c
ATOM 7672 N N    . SER Bxp B    185 ? 84.876 4.731   0.277   1    58.943  ? 2266 B 1 .
ATOM 7673 C CA   . SER Bxp B    185 ? 83.446 4.901   0.506   1    56.575  ? 2266 B 1 .
ATOM 7674 C C    . SER Bxp B    185 ? 83.175 5.108   1.999   1    53.132  ? 2266 B 1 .
ATOM 7675 O O    . SER Bxp B    185 ? 83.767 4.429   2.831   1    55.528  ? 2266 B 1 .
ATOM 7676 C CB   . SER Bxp B    185 ? 82.682 3.709   -0.055  1    54.09   ? 2266 B 1 .
ATOM 7677 O OG   . SER Bxp B    185 ? 81.464 3.469   0.633   1    50.362  ? 2266 B 1 .
ATOM 7678 H H    . SER Bxp B    185 ? 85.196 3.883   0.157   1    58.163  ? 2266 B 1 c
ATOM 7679 H HA   . SER Bxp B    185 ? 83.152 5.713   0.022   1    55.854  ? 2266 B 1 c
ATOM 7680 H HB3  . SER Bxp B    185 ? 83.243 2.913   0.003   1    53.786  ? 2266 B 1 c
ATOM 7681 H HB2  . SER Bxp B    185 ? 82.49  3.87    -0.998  1    53.772  ? 2266 B 1 c
ATOM 7682 H HG   . SER Bxp B    185 ? 81.146 2.816   0.268   0    50.87   ? 2266 B 1 c
ATOM 7683 N N    . ALA Bxp B    186 ? 82.279 6.044   2.341   1    49.788  ? 2267 B 1 .
ATOM 7684 C CA   . ALA Bxp B    186 ? 81.92  6.292   3.731   1    49.57   ? 2267 B 1 .
ATOM 7685 C C    . ALA Bxp B    186 ? 81.286 5.04    4.33    1    52.524  ? 2267 B 1 .
ATOM 7686 O O    . ALA Bxp B    186 ? 81.379 4.777   5.527   1    56.544  ? 2267 B 1 .
ATOM 7687 C CB   . ALA Bxp B    186 ? 80.977 7.461   3.805   1    49.85   ? 2267 B 1 .
ATOM 7688 H H    . ALA Bxp B    186 ? 81.878 6.542   1.688   1    50.592  ? 2267 B 1 c
ATOM 7689 H HA   . ALA Bxp B    186 ? 82.751 6.501   4.24    1    50.216  ? 2267 B 1 c
ATOM 7690 H HB3  . ALA Bxp B    186 ? 80.737 7.629   4.732   1    49.766  ? 2267 B 1 c
ATOM 7691 H HB2  . ALA Bxp B    186 ? 80.173 7.266   3.296   1    49.766  ? 2267 B 1 c
ATOM 7692 H HB1  . ALA Bxp B    186 ? 81.407 8.251   3.436   1    49.766  ? 2267 B 1 c
ATOM 7693 N N    . ALA Bxp B    187 ? 80.678 4.259   3.437   1    52.762  ? 2268 B 1 .
ATOM 7694 C CA   . ALA Bxp B    187 ? 80.003 3.014   3.745   1    50.738  ? 2268 B 1 .
ATOM 7695 C C    . ALA Bxp B    187 ? 80.966 1.871   4.045   1    49.678  ? 2268 B 1 .
ATOM 7696 O O    . ALA Bxp B    187 ? 80.524 0.729   4.17    1    49.898  ? 2268 B 1 .
ATOM 7697 C CB   . ALA Bxp B    187 ? 79.152 2.654   2.553   1    52.33   ? 2268 B 1 .
ATOM 7698 H H    . ALA Bxp B    187 ? 80.67  4.537   2.567   1    52.197  ? 2268 B 1 c
ATOM 7699 H HA   . ALA Bxp B    187 ? 79.419 3.156   4.541   1    51.237  ? 2268 B 1 c
ATOM 7700 H HB3  . ALA Bxp B    187 ? 78.334 2.229   2.854   1    51.81   ? 2268 B 1 c
ATOM 7701 H HB2  . ALA Bxp B    187 ? 79.638 2.042   1.975   1    51.803  ? 2268 B 1 c
ATOM 7702 H HB1  . ALA Bxp B    187 ? 78.928 3.456   2.053   1    51.791  ? 2268 B 1 c
ATOM 7703 N N    . TYR Bxp B    188 ? 82.264 2.17    4.148   1    52.6    ? 2269 B 1 .
ATOM 7704 C CA   . TYR Bxp B    188 ? 83.28  1.133   4.208   1    55.817  ? 2269 B 1 .
ATOM 7705 C C    . TYR Bxp B    188 ? 83.189 0.382   5.532   1    55.806  ? 2269 B 1 .
ATOM 7706 O O    . TYR Bxp B    188 ? 83.193 0.983   6.608   1    51.755  ? 2269 B 1 .
ATOM 7707 C CB   . TYR Bxp B    188 ? 84.678 1.727   4.019   1    60.167  ? 2269 B 1 .
ATOM 7708 C CG   . TYR Bxp B    188 ? 85.822 0.791   4.387   1    61.49   ? 2269 B 1 .
ATOM 7709 C CD1  . TYR Bxp B    188 ? 86.166 -0.28   3.567   1    61.669  ? 2269 B 1 .
ATOM 7710 C CD2  . TYR Bxp B    188 ? 86.568 0.988   5.549   1    58.955  ? 2269 B 1 .
ATOM 7711 C CE1  . TYR Bxp B    188 ? 87.22  -1.123  3.891   1    61.331  ? 2269 B 1 .
ATOM 7712 C CE2  . TYR Bxp B    188 ? 87.621 0.149   5.885   1    58.137  ? 2269 B 1 .
ATOM 7713 C CZ   . TYR Bxp B    188 ? 87.945 -0.913  5.053   1    60.049  ? 2269 B 1 .
ATOM 7714 O OH   . TYR Bxp B    188 ? 88.964 -1.776  5.351   1    52.722  ? 2269 B 1 .
ATOM 7715 H H    . TYR Bxp B    188 ? 82.528 3.043   4.188   1    52.676  ? 2269 B 1 c
ATOM 7716 H HA   . TYR Bxp B    188 ? 83.112 0.495   3.467   1    55.873  ? 2269 B 1 c
ATOM 7717 H HB3  . TYR Bxp B    188 ? 84.747 2.54    4.566   1    59.381  ? 2269 B 1 c
ATOM 7718 H HB2  . TYR Bxp B    188 ? 84.777 1.992   3.079   1    59.383  ? 2269 B 1 c
ATOM 7719 H HD1  . TYR Bxp B    188 ? 85.678 -0.43   2.775   1    61.373  ? 2269 B 1 c
ATOM 7720 H HD2  . TYR Bxp B    188 ? 86.355 1.711   6.117   1    59.35   ? 2269 B 1 c
ATOM 7721 H HE1  . TYR Bxp B    188 ? 87.433 -1.849  3.334   1    60.958  ? 2269 B 1 c
ATOM 7722 H HE2  . TYR Bxp B    188 ? 88.11  0.296   6.677   1    58.771  ? 2269 B 1 c
ATOM 7723 H HH   . TYR Bxp B    188 ? 89.043 -2.343  4.782   0    51.98   ? 2269 B 1 c
ATOM 7724 N N    . ILE Bxp B    189 ? 83.09  -0.946  5.417   1    56.303  ? 2270 B 1 .
ATOM 7725 C CA   . ILE Bxp B    189 ? 83.298 -1.843  6.534   1    58.177  ? 2270 B 1 .
ATOM 7726 C C    . ILE Bxp B    189 ? 84.484 -2.73   6.189   1    62.709  ? 2270 B 1 .
ATOM 7727 O O    . ILE Bxp B    189 ? 84.488 -3.373  5.133   1    61.262  ? 2270 B 1 .
ATOM 7728 C CB   . ILE Bxp B    189 ? 82.066 -2.706  6.848   1    59.514  ? 2270 B 1 .
ATOM 7729 C CG1  . ILE Bxp B    189 ? 80.902 -1.871  7.329   1    64.395  ? 2270 B 1 .
ATOM 7730 C CG2  . ILE Bxp B    189 ? 82.43  -3.785  7.865   1    60.956  ? 2270 B 1 .
ATOM 7731 C CD1  . ILE Bxp B    189 ? 79.745 -2.69   7.873   1    66.709  ? 2270 B 1 .
ATOM 7732 H H    . ILE Bxp B    189 ? 82.878 -1.307  4.604   1    56.592  ? 2270 B 1 c
ATOM 7733 H HA   . ILE Bxp B    189 ? 83.512 -1.313  7.322   1    58.858  ? 2270 B 1 c
ATOM 7734 H HB   . ILE Bxp B    189 ? 81.794 -3.15   6.02    1    60.422  ? 2270 B 1 c
ATOM 7735 H HG12 . ILE Bxp B    189 ? 80.578 -1.324  6.585   1    63.722  ? 2270 B 1 c
ATOM 7736 H HG13 . ILE Bxp B    189 ? 81.217 -1.265  8.031   1    63.602  ? 2270 B 1 c
ATOM 7737 H HG21 . ILE Bxp B    189 ? 81.628 -4.234  8.173   1    60.593  ? 2270 B 1 c
ATOM 7738 H HG22 . ILE Bxp B    189 ? 82.881 -3.379  8.623   1    60.558  ? 2270 B 1 c
ATOM 7739 H HG23 . ILE Bxp B    189 ? 83.02  -4.437  7.452   1    60.591  ? 2270 B 1 c
ATOM 7740 H HD11 . ILE Bxp B    189 ? 79.61  -3.475  7.312   1    65.721  ? 2270 B 1 c
ATOM 7741 H HD12 . ILE Bxp B    189 ? 78.935 -2.146  7.864   1    65.729  ? 2270 B 1 c
ATOM 7742 H HD13 . ILE Bxp B    189 ? 79.93  -2.974  8.788   1    65.663  ? 2270 B 1 c
ATOM 7743 N N    . PRO Bxp B    190 ? 85.494 -2.799  7.09    1    62.781  ? 2271 B 1 .
ATOM 7744 C CA   . PRO Bxp B    190 ? 86.665 -3.638  6.874   1    62.78   ? 2271 B 1 .
ATOM 7745 C C    . PRO Bxp B    190 ? 86.374 -5.131  6.97    1    63.309  ? 2271 B 1 .
ATOM 7746 O O    . PRO Bxp B    190 ? 85.395 -5.541  7.59    1    67.376  ? 2271 B 1 .
ATOM 7747 C CB   . PRO Bxp B    190 ? 87.619 -3.193  7.977   1    62.971  ? 2271 B 1 .
ATOM 7748 C CG   . PRO Bxp B    190 ? 86.693 -2.692  9.064   1    60.736  ? 2271 B 1 .
ATOM 7749 C CD   . PRO Bxp B    190 ? 85.553 -2.048  8.356   1    60.876  ? 2271 B 1 .
ATOM 7750 H HA   . PRO Bxp B    190 ? 87.053 -3.437  5.999   1    62.833  ? 2271 B 1 c
ATOM 7751 H HB3  . PRO Bxp B    190 ? 88.209 -2.48   7.665   1    62.354  ? 2271 B 1 c
ATOM 7752 H HB2  . PRO Bxp B    190 ? 88.162 -3.941  8.296   1    62.408  ? 2271 B 1 c
ATOM 7753 H HG3  . PRO Bxp B    190 ? 87.15  -2.045  9.638   1    61.27   ? 2271 B 1 c
ATOM 7754 H HG2  . PRO Bxp B    190 ? 86.378 -3.432  9.616   1    61.294  ? 2271 B 1 c
ATOM 7755 H HD3  . PRO Bxp B    190 ? 84.724 -2.147  8.861   1    61.236  ? 2271 B 1 c
ATOM 7756 H HD2  . PRO Bxp B    190 ? 85.723 -1.1    8.191   1    61.257  ? 2271 B 1 c
ATOM 7757 N N    . PHE Bxp B    191 ? 87.243 -5.943  6.361   1    63.277  ? 2272 B 1 .
ATOM 7758 C CA   . PHE Bxp B    191 ? 87.198 -7.375  6.596   1    61.87   ? 2272 B 1 .
ATOM 7759 C C    . PHE Bxp B    191 ? 87.496 -7.63   8.075   1    61.872  ? 2272 B 1 .
ATOM 7760 O O    . PHE Bxp B    191 ? 88.331 -6.959  8.68    1    55.291  ? 2272 B 1 .
ATOM 7761 C CB   . PHE Bxp B    191 ? 88.14  -8.091  5.629   1    59.067  ? 2272 B 1 .
ATOM 7762 C CG   . PHE Bxp B    191 ? 87.61  -8.177  4.204   1    59.808  ? 2272 B 1 .
ATOM 7763 C CD1  . PHE Bxp B    191 ? 86.566 -9.045  3.885   1    59.26   ? 2272 B 1 .
ATOM 7764 C CD2  . PHE Bxp B    191 ? 88.177 -7.426  3.175   1    60.467  ? 2272 B 1 .
ATOM 7765 C CE1  . PHE Bxp B    191 ? 86.092 -9.141  2.58    1    58.341  ? 2272 B 1 .
ATOM 7766 C CE2  . PHE Bxp B    191 ? 87.713 -7.541  1.865   1    59.381  ? 2272 B 1 .
ATOM 7767 C CZ   . PHE Bxp B    191 ? 86.665 -8.39   1.572   1    57.145  ? 2272 B 1 .
ATOM 7768 H H    . PHE Bxp B    191 ? 87.871 -5.601  5.793   1    62.911  ? 2272 B 1 c
ATOM 7769 H HA   . PHE Bxp B    191 ? 86.274 -7.686  6.408   1    61.655  ? 2272 B 1 c
ATOM 7770 H HB3  . PHE Bxp B    191 ? 88.299 -9.002  5.965   1    59.878  ? 2272 B 1 c
ATOM 7771 H HB2  . PHE Bxp B    191 ? 89.001 -7.618  5.622   1    59.889  ? 2272 B 1 c
ATOM 7772 H HD1  . PHE Bxp B    191 ? 86.169 -9.564  4.566   1    59.161  ? 2272 B 1 c
ATOM 7773 H HD2  . PHE Bxp B    191 ? 88.897 -6.847  3.366   1    60.015  ? 2272 B 1 c
ATOM 7774 H HE1  . PHE Bxp B    191 ? 85.379 -9.727  2.382   1    58.305  ? 2272 B 1 c
ATOM 7775 H HE2  . PHE Bxp B    191 ? 88.1   -7.017  1.182   1    59.095  ? 2272 B 1 c
ATOM 7776 H HZ   . PHE Bxp B    191 ? 86.342 -8.456  0.688   1    57.977  ? 2272 B 1 c
ATOM 7777 N N    . GLY Bxp B    192 ? 86.763 -8.583  8.662   1    65.13   ? 2273 B 1 .
ATOM 7778 C CA   . GLY Bxp B    192 ? 86.95  -8.953  10.058  1    66.293  ? 2273 B 1 .
ATOM 7779 C C    . GLY Bxp B    192 ? 86.314 -7.927  10.99   1    64.188  ? 2273 B 1 .
ATOM 7780 O O    . GLY Bxp B    192 ? 86.774 -7.707  12.112  1    57.961  ? 2273 B 1 .
ATOM 7781 H H    . GLY Bxp B    192 ? 86.124 -9.02   8.176   1    64.55   ? 2273 B 1 c
ATOM 7782 H HA3  . GLY Bxp B    192 ? 87.915 -9.021  10.25   1    65.462  ? 2273 B 1 c
ATOM 7783 H HA2  . GLY Bxp B    192 ? 86.545 -9.838  10.215  1    65.526  ? 2273 B 1 c
ATOM 7784 N N    . GLU Bxp B    193 ? 85.266 -7.28   10.474  1    64.414  ? 2274 B 1 .
ATOM 7785 C CA   . GLU Bxp B    193 ? 84.35  -6.5    11.282  1    58.27   ? 2274 B 1 .
ATOM 7786 C C    . GLU Bxp B    193 ? 82.962 -6.735  10.706  1    51.982  ? 2274 B 1 .
ATOM 7787 O O    . GLU Bxp B    193 ? 82.849 -7.195  9.569   1    51.265  ? 2274 B 1 .
ATOM 7788 C CB   . GLU Bxp B    193 ? 84.758 -5.031  11.275  1    58.334  ? 2274 B 1 .
ATOM 7789 C CG   . GLU Bxp B    193 ? 84.534 -4.35   12.621  1    64.271  ? 2274 B 1 .
ATOM 7790 C CD   . GLU Bxp B    193 ? 84.923 -2.881  12.62   1    73.008  ? 2274 B 1 .
ATOM 7791 O OE1  . GLU Bxp B    193 ? 85.999 -2.569  12.059  1    72.318  ? 2274 B 1 .
ATOM 7792 O OE2  . GLU Bxp B    193 ? 84.172 -2.048  13.184  1    80.012  ? 2274 B 1 .
ATOM 7793 H H    . GLU Bxp B    193 ? 85.114 -7.328  9.574   1    62.863  ? 2274 B 1 c
ATOM 7794 H HA   . GLU Bxp B    193 ? 84.373 -6.846  12.211  1    58.202  ? 2274 B 1 c
ATOM 7795 H HB3  . GLU Bxp B    193 ? 84.249 -4.56   10.582  1    59.589  ? 2274 B 1 c
ATOM 7796 H HB2  . GLU Bxp B    193 ? 85.707 -4.97   11.043  1    59.713  ? 2274 B 1 c
ATOM 7797 H HG3  . GLU Bxp B    193 ? 85.059 -4.814  13.307  1    64.729  ? 2274 B 1 c
ATOM 7798 H HG2  . GLU Bxp B    193 ? 83.587 -4.424  12.865  1    64.701  ? 2274 B 1 c
ATOM 7799 N N    . GLY Bxp B    194 ? 81.934 -6.464  11.517  1    47.957  ? 2275 B 1 .
ATOM 7800 C CA   . GLY Bxp B    194 ? 80.552 -6.595  11.087  1    48.066  ? 2275 B 1 .
ATOM 7801 C C    . GLY Bxp B    194 ? 79.798 -7.673  11.859  1    48.596  ? 2275 B 1 .
ATOM 7802 O O    . GLY Bxp B    194 ? 80.35  -8.727  12.164  1    49.129  ? 2275 B 1 .
ATOM 7803 H H    . GLY Bxp B    194 ? 82.102 -6.189  12.373  1    49.142  ? 2275 B 1 c
ATOM 7804 H HA3  . GLY Bxp B    194 ? 80.533 -6.813  10.128  1    48.223  ? 2275 B 1 c
ATOM 7805 H HA2  . GLY Bxp B    194 ? 80.1   -5.737  11.204  1    48.059  ? 2275 B 1 c
ATOM 7806 N N    . ASP Bxp B    195 ? 78.515 -7.414  12.124  1    46.714  ? 2276 B 1 .
ATOM 7807 C CA   . ASP Bxp B    195 ? 77.719 -8.298  12.952  1    44.016  ? 2276 B 1 .
ATOM 7808 C C    . ASP Bxp B    195 ? 76.808 -9.152  12.084  1    43.358  ? 2276 B 1 .
ATOM 7809 O O    . ASP Bxp B    195 ? 76.792 -10.37  12.217  1    44.7    ? 2276 B 1 .
ATOM 7810 C CB   . ASP Bxp B    195 ? 76.887 -7.501  13.933  1    47.456  ? 2276 B 1 .
ATOM 7811 C CG   . ASP Bxp B    195 ? 77.688 -6.562  14.816  1    48.892  ? 2276 B 1 .
ATOM 7812 O OD1  . ASP Bxp B    195 ? 78.695 -7.049  15.386  1    42.025  ? 2276 B 1 .
ATOM 7813 O OD2  . ASP Bxp B    195 ? 77.276 -5.369  14.926  1    51.422  ? 2276 B 1 .
ATOM 7814 H H    . ASP Bxp B    195 ? 78.126 -6.663  11.779  1    46.53   ? 2276 B 1 c
ATOM 7815 H HA   . ASP Bxp B    195 ? 78.321 -8.887  13.46   1    45.054  ? 2276 B 1 c
ATOM 7816 H HB3  . ASP Bxp B    195 ? 76.401 -8.13   14.505  1    46.931  ? 2276 B 1 c
ATOM 7817 H HB2  . ASP Bxp B    195 ? 76.228 -6.969  13.439  1    46.94   ? 2276 B 1 c
ATOM 7818 N N    . PHE Bxp B    196 ? 76.016 -8.491  11.237  1    44.784  ? 2277 B 1 .
ATOM 7819 C CA   . PHE Bxp B    196 ? 75.039 -9.151  10.385  1    43.925  ? 2277 B 1 .
ATOM 7820 C C    . PHE Bxp B    196 ? 75.023 -8.442  9.042   1    44.205  ? 2277 B 1 .
ATOM 7821 O O    . PHE Bxp B    196 ? 75.709 -7.436  8.878   1    53.235  ? 2277 B 1 .
ATOM 7822 C CB   . PHE Bxp B    196 ? 73.633 -9.084  10.978  1    43.107  ? 2277 B 1 .
ATOM 7823 C CG   . PHE Bxp B    196 ? 73.556 -9.73   12.347  1    44.92   ? 2277 B 1 .
ATOM 7824 C CD1  . PHE Bxp B    196 ? 73.503 -11.113 12.471  1    45.436  ? 2277 B 1 .
ATOM 7825 C CD2  . PHE Bxp B    196 ? 73.573 -8.957  13.5    1    46.677  ? 2277 B 1 .
ATOM 7826 C CE1  . PHE Bxp B    196 ? 73.45  -11.707 13.719  1    47.656  ? 2277 B 1 .
ATOM 7827 C CE2  . PHE Bxp B    196 ? 73.528 -9.555  14.748  1    48.537  ? 2277 B 1 .
ATOM 7828 C CZ   . PHE Bxp B    196 ? 73.467 -10.929 14.854  1    50.185  ? 2277 B 1 .
ATOM 7829 H H    . PHE Bxp B    196 ? 76.085 -7.581  11.19   1    44.312  ? 2277 B 1 c
ATOM 7830 H HA   . PHE Bxp B    196 ? 75.298 -10.102 10.254  1    43.991  ? 2277 B 1 c
ATOM 7831 H HB3  . PHE Bxp B    196 ? 73.009 -9.54   10.371  1    43.663  ? 2277 B 1 c
ATOM 7832 H HB2  . PHE Bxp B    196 ? 73.366 -8.142  11.05   1    43.709  ? 2277 B 1 c
ATOM 7833 H HD1  . PHE Bxp B    196 ? 73.495 -11.65  11.695  1    45.863  ? 2277 B 1 c
ATOM 7834 H HD2  . PHE Bxp B    196 ? 73.621 -8.018  13.431  1    46.65   ? 2277 B 1 c
ATOM 7835 H HE1  . PHE Bxp B    196 ? 73.408 -12.647 13.792  1    47.678  ? 2277 B 1 c
ATOM 7836 H HE2  . PHE Bxp B    196 ? 73.533 -9.023  15.525  1    48.39   ? 2277 B 1 c
ATOM 7837 H HZ   . PHE Bxp B    196 ? 73.427 -11.335 15.705  1    49.117  ? 2277 B 1 c
ATOM 7838 N N    . TYR Bxp B    197 ? 74.254 -8.969  8.088   1    40.168  ? 2278 B 1 .
ATOM 7839 C CA   . TYR Bxp B    197 ? 74.043 -8.246  6.85    1    37.825  ? 2278 B 1 .
ATOM 7840 C C    . TYR Bxp B    197 ? 72.59  -7.81   6.807   1    36.716  ? 2278 B 1 .
ATOM 7841 O O    . TYR Bxp B    197 ? 71.709 -8.595  6.475   1    38.438  ? 2278 B 1 .
ATOM 7842 C CB   . TYR Bxp B    197 ? 74.382 -9.007  5.569   1    38.389  ? 2278 B 1 .
ATOM 7843 C CG   . TYR Bxp B    197 ? 74.355 -8.072  4.37    1    38.148  ? 2278 B 1 .
ATOM 7844 C CD1  . TYR Bxp B    197 ? 75.27  -7.042  4.265   1    40.113  ? 2278 B 1 .
ATOM 7845 C CD2  . TYR Bxp B    197 ? 73.403 -8.179  3.371   1    38.822  ? 2278 B 1 .
ATOM 7846 C CE1  . TYR Bxp B    197 ? 75.253 -6.154  3.202   1    41.61   ? 2278 B 1 .
ATOM 7847 C CE2  . TYR Bxp B    197 ? 73.374 -7.298  2.3     1    38.299  ? 2278 B 1 .
ATOM 7848 C CZ   . TYR Bxp B    197 ? 74.301 -6.278  2.214   1    38.551  ? 2278 B 1 .
ATOM 7849 O OH   . TYR Bxp B    197 ? 74.336 -5.384  1.185   1    38.429  ? 2278 B 1 .
ATOM 7850 H H    . TYR Bxp B    197 ? 73.861 -9.786  8.206   1    40.603  ? 2278 B 1 c
ATOM 7851 H HA   . TYR Bxp B    197 ? 74.607 -7.429  6.873   1    38.265  ? 2278 B 1 c
ATOM 7852 H HB3  . TYR Bxp B    197 ? 73.729 -9.729  5.438   1    38.228  ? 2278 B 1 c
ATOM 7853 H HB2  . TYR Bxp B    197 ? 75.279 -9.399  5.657   1    38.356  ? 2278 B 1 c
ATOM 7854 H HD1  . TYR Bxp B    197 ? 75.922 -6.942  4.935   1    40.204  ? 2278 B 1 c
ATOM 7855 H HD2  . TYR Bxp B    197 ? 72.758 -8.866  3.419   1    38.618  ? 2278 B 1 c
ATOM 7856 H HE1  . TYR Bxp B    197 ? 75.893 -5.466  3.152   1    40.567  ? 2278 B 1 c
ATOM 7857 H HE2  . TYR Bxp B    197 ? 72.72  -7.396  1.628   1    38.499  ? 2278 B 1 c
ATOM 7858 H HH   . TYR Bxp B    197 ? 74.936 -4.893  1.256   0    34.48   ? 2278 B 1 c
ATOM 7859 N N    . TYR Bxp B    198 ? 72.349 -6.548  7.143   1    35.131  ? 2279 B 1 .
ATOM 7860 C CA   . TYR Bxp B    198 ? 70.988 -6.063  7.19    1    35.015  ? 2279 B 1 .
ATOM 7861 C C    . TYR Bxp B    198 ? 70.522 -5.642  5.797   1    32.618  ? 2279 B 1 .
ATOM 7862 O O    . TYR Bxp B    198 ? 71.289 -5.247  4.93    1    30.546  ? 2279 B 1 .
ATOM 7863 C CB   . TYR Bxp B    198 ? 70.855 -4.92   8.192   1    37.786  ? 2279 B 1 .
ATOM 7864 C CG   . TYR Bxp B    198 ? 71.54  -5.159  9.528   1    39.785  ? 2279 B 1 .
ATOM 7865 C CD1  . TYR Bxp B    198 ? 70.972 -5.961  10.506  1    39.526  ? 2279 B 1 .
ATOM 7866 C CD2  . TYR Bxp B    198 ? 72.748 -4.543  9.818   1    44.585  ? 2279 B 1 .
ATOM 7867 C CE1  . TYR Bxp B    198 ? 71.587 -6.142  11.733  1    40.099  ? 2279 B 1 .
ATOM 7868 C CE2  . TYR Bxp B    198 ? 73.38  -4.726  11.036  1    46.645  ? 2279 B 1 .
ATOM 7869 C CZ   . TYR Bxp B    198 ? 72.792 -5.518  11.999  1    43.303  ? 2279 B 1 .
ATOM 7870 O OH   . TYR Bxp B    198 ? 73.478 -5.643  13.165  1    48.617  ? 2279 B 1 .
ATOM 7871 H H    . TYR Bxp B    198 ? 73.037 -5.981  7.342   1    35.638  ? 2279 B 1 c
ATOM 7872 H HA   . TYR Bxp B    198 ? 70.409 -6.807  7.499   1    35.087  ? 2279 B 1 c
ATOM 7873 H HB3  . TYR Bxp B    198 ? 69.899 -4.759  8.353   1    37.583  ? 2279 B 1 c
ATOM 7874 H HB2  . TYR Bxp B    198 ? 71.229 -4.106  7.786   1    37.619  ? 2279 B 1 c
ATOM 7875 H HD1  . TYR Bxp B    198 ? 70.143 -6.38   10.338  1    39.804  ? 2279 B 1 c
ATOM 7876 H HD2  . TYR Bxp B    198 ? 73.15  -3.986  9.171   1    43.792  ? 2279 B 1 c
ATOM 7877 H HE1  . TYR Bxp B    198 ? 71.19  -6.691  12.382  1    40.611  ? 2279 B 1 c
ATOM 7878 H HE2  . TYR Bxp B    198 ? 74.2   -4.298  11.213  1    45.224  ? 2279 B 1 c
ATOM 7879 H HH   . TYR Bxp B    198 ? 72.96  -6.155  13.653  0    33.03   ? 2279 B 1 c
ATOM 7880 N N    . HIS Bxp B    199 ? 69.207 -5.69   5.644   1    33.592  ? 2280 B 1 .
ATOM 7881 C CA   . HIS Bxp B    199 ? 68.505 -5.529  4.39    1    33.62   ? 2280 B 1 .
ATOM 7882 C C    . HIS Bxp B    199 ? 67.836 -4.169  4.434   1    34.339  ? 2280 B 1 .
ATOM 7883 O O    . HIS Bxp B    199 ? 67.232 -3.838  5.453   1    36.78   ? 2280 B 1 .
ATOM 7884 C CB   . HIS Bxp B    199 ? 67.433 -6.618  4.358   1    36.347  ? 2280 B 1 .
ATOM 7885 C CG   . HIS Bxp B    199 ? 66.754 -6.852  3.066   1    37.255  ? 2280 B 1 .
ATOM 7886 N ND1  . HIS Bxp B    199 ? 66.654 -5.897  2.085   1    37.892  ? 2280 B 1 .
ATOM 7887 C CD2  . HIS Bxp B    199 ? 66.13  -7.949  2.606   1    38.233  ? 2280 B 1 .
ATOM 7888 C CE1  . HIS Bxp B    199 ? 65.997 -6.413  1.051   1    39.522  ? 2280 B 1 .
ATOM 7889 N NE2  . HIS Bxp B    199 ? 65.665 -7.651  1.35    1    40.013  ? 2280 B 1 .
ATOM 7890 H H    . HIS Bxp B    199 ? 68.701 -5.829  6.392   1    33.41   ? 2280 B 1 c
ATOM 7891 H HA   . HIS Bxp B    199 ? 69.119 -5.579  3.617   1    34.222  ? 2280 B 1 c
ATOM 7892 H HB3  . HIS Bxp B    199 ? 66.752 -6.4    5.032   1    35.931  ? 2280 B 1 c
ATOM 7893 H HB2  . HIS Bxp B    199 ? 67.844 -7.457  4.65    1    36.001  ? 2280 B 1 c
ATOM 7894 H HD1  . HIS Bxp B    199 ? 67.087 -5.131  2.147   0    28.75   ? 2280 B 1 c
ATOM 7895 H HD2  . HIS Bxp B    199 ? 66.028 -8.767  3.051   1    38.393  ? 2280 B 1 c
ATOM 7896 H HE1  . HIS Bxp B    199 ? 65.794 -5.964  0.249   1    39.182  ? 2280 B 1 c
ATOM 7897 H HE2  . HIS Bxp B    199 ? 65.227 -8.217  0.915   0    30.68   ? 2280 B 1 c
ATOM 7898 N N    . ALA Bxp B    200 ? 67.929 -3.392  3.352   1    32.846  ? 2281 B 1 .
ATOM 7899 C CA   . ALA Bxp B    200 ? 67.385 -2.041  3.368   1    32.417  ? 2281 B 1 .
ATOM 7900 C C    . ALA Bxp B    200 ? 65.871 -2.059  3.177   1    29.531  ? 2281 B 1 .
ATOM 7901 O O    . ALA Bxp B    200 ? 65.199 -1.061  3.41    1    27.565  ? 2281 B 1 .
ATOM 7902 C CB   . ALA Bxp B    200 ? 68.069 -1.175  2.331   1    33.876  ? 2281 B 1 .
ATOM 7903 H H    . ALA Bxp B    200 ? 68.332 -3.704  2.594   1    33.119  ? 2281 B 1 c
ATOM 7904 H HA   . ALA Bxp B    200 ? 67.565 -1.654  4.265   1    32.298  ? 2281 B 1 c
ATOM 7905 H HB3  . ALA Bxp B    200 ? 67.61  -0.321  2.261   1    33.431  ? 2281 B 1 c
ATOM 7906 H HB2  . ALA Bxp B    200 ? 68.049 -1.621  1.467   1    33.447  ? 2281 B 1 c
ATOM 7907 H HB1  . ALA Bxp B    200 ? 68.992 -1.022  2.591   1    33.505  ? 2281 B 1 c
ATOM 7908 N N    . ALA Bxp B    201 ? 65.326 -3.198  2.762   1    29.112  ? 2282 B 1 .
ATOM 7909 C CA   . ALA Bxp B    201 ? 63.906 -3.269  2.469   1    32.217  ? 2282 B 1 .
ATOM 7910 C C    . ALA Bxp B    201 ? 63.055 -3.022  3.718   1    31.703  ? 2282 B 1 .
ATOM 7911 O O    . ALA Bxp B    201 ? 61.917 -2.567  3.599   1    31.275  ? 2282 B 1 .
ATOM 7912 C CB   . ALA Bxp B    201 ? 63.589 -4.602  1.832   1    34.16   ? 2282 B 1 .
ATOM 7913 H H    . ALA Bxp B    201 ? 65.841 -3.943  2.65    1    30.065  ? 2282 B 1 c
ATOM 7914 H HA   . ALA Bxp B    201 ? 63.697 -2.549  1.818   1    31.926  ? 2282 B 1 c
ATOM 7915 H HB3  . ALA Bxp B    201 ? 62.627 -4.699  1.747   1    33.637  ? 2282 B 1 c
ATOM 7916 H HB2  . ALA Bxp B    201 ? 63.936 -5.321  2.386   1    33.621  ? 2282 B 1 c
ATOM 7917 H HB1  . ALA Bxp B    201 ? 63.993 -4.647  0.95    1    33.653  ? 2282 B 1 c
ATOM 7918 N N    . ILE Bxp B    202 ? 63.574 -3.395  4.896   1    30.617  ? 2283 B 1 .
ATOM 7919 C CA   . ILE Bxp B    202 ? 62.958 -3.022  6.157   1    30.57   ? 2283 B 1 .
ATOM 7920 C C    . ILE Bxp B    202 ? 64.038 -2.415  7.018   1    29.797  ? 2283 B 1 .
ATOM 7921 O O    . ILE Bxp B    202 ? 65.077 -3.029  7.282   1    31.53   ? 2283 B 1 .
ATOM 7922 C CB   . ILE Bxp B    202 ? 62.349 -4.171  6.983   1    33.995  ? 2283 B 1 .
ATOM 7923 C CG1  . ILE Bxp B    202 ? 61.844 -5.337  6.162   1    36.98   ? 2283 B 1 .
ATOM 7924 C CG2  . ILE Bxp B    202 ? 61.265 -3.618  7.913   1    34.404  ? 2283 B 1 .
ATOM 7925 C CD1  . ILE Bxp B    202 ? 60.525 -5.053  5.48    1    39.909  ? 2283 B 1 .
ATOM 7926 H H    . ILE Bxp B    202 ? 64.331 -3.906  4.912   1    30.851  ? 2283 B 1 c
ATOM 7927 H HA   . ILE Bxp B    202 ? 62.269 -2.353  5.988   1    31.047  ? 2283 B 1 c
ATOM 7928 H HB   . ILE Bxp B    202 ? 63.06  -4.52   7.554   1    33.902  ? 2283 B 1 c
ATOM 7929 H HG12 . ILE Bxp B    202 ? 61.735 -6.112  6.75    1    36.902  ? 2283 B 1 c
ATOM 7930 H HG13 . ILE Bxp B    202 ? 62.512 -5.564  5.484   1    36.872  ? 2283 B 1 c
ATOM 7931 H HG21 . ILE Bxp B    202 ? 60.727 -4.35   8.257   1    34.325  ? 2283 B 1 c
ATOM 7932 H HG22 . ILE Bxp B    202 ? 60.695 -3.002  7.425   1    34.31   ? 2283 B 1 c
ATOM 7933 H HG23 . ILE Bxp B    202 ? 61.682 -3.15   8.656   1    34.283  ? 2283 B 1 c
ATOM 7934 H HD11 . ILE Bxp B    202 ? 59.783 -5.352  6.038   1    39.288  ? 2283 B 1 c
ATOM 7935 H HD12 . ILE Bxp B    202 ? 60.515 -5.525  4.63    1    39.239  ? 2283 B 1 c
ATOM 7936 H HD13 . ILE Bxp B    202 ? 60.444 -4.098  5.315   1    38.95   ? 2283 B 1 c
ATOM 7937 N N    . PHE Bxp B    203 ? 63.735 -1.232  7.51    1    27.655  ? 2284 B 1 .
ATOM 7938 C CA   . PHE Bxp B    203 ? 64.385 -0.801  8.719   1    26.821  ? 2284 B 1 .
ATOM 7939 C C    . PHE Bxp B    203 ? 63.369 0.066   9.405   1    25.138  ? 2284 B 1 .
ATOM 7940 O O    . PHE Bxp B    203 ? 62.532 0.653   8.743   1    25.607  ? 2284 B 1 .
ATOM 7941 C CB   . PHE Bxp B    203 ? 65.692 -0.067  8.453   1    27.546  ? 2284 B 1 .
ATOM 7942 C CG   . PHE Bxp B    203 ? 65.531 1.201   7.635   1    26.623  ? 2284 B 1 .
ATOM 7943 C CD1  . PHE Bxp B    203 ? 65.251 2.41    8.25    1    27.181  ? 2284 B 1 .
ATOM 7944 C CD2  . PHE Bxp B    203 ? 65.686 1.18    6.265   1    26.553  ? 2284 B 1 .
ATOM 7945 C CE1  . PHE Bxp B    203 ? 65.143 3.573   7.509   1    27.192  ? 2284 B 1 .
ATOM 7946 C CE2  . PHE Bxp B    203 ? 65.57  2.347   5.535   1    28.273  ? 2284 B 1 .
ATOM 7947 C CZ   . PHE Bxp B    203 ? 65.307 3.54    6.157   1    27.553  ? 2284 B 1 .
ATOM 7948 H H    . PHE Bxp B    203 ? 63.135 -0.684  7.092   1    27.979  ? 2284 B 1 c
ATOM 7949 H HA   . PHE Bxp B    203 ? 64.569 -1.595  9.289   1    26.798  ? 2284 B 1 c
ATOM 7950 H HB3  . PHE Bxp B    203 ? 66.302 -0.676  7.979   1    27.167  ? 2284 B 1 c
ATOM 7951 H HB2  . PHE Bxp B    203 ? 66.104 0.161   9.316   1    27.167  ? 2284 B 1 c
ATOM 7952 H HD1  . PHE Bxp B    203 ? 65.155 2.443   9.188   1    27.089  ? 2284 B 1 c
ATOM 7953 H HD2  . PHE Bxp B    203 ? 65.885 0.368   5.827   1    26.976  ? 2284 B 1 c
ATOM 7954 H HE1  . PHE Bxp B    203 ? 64.952 4.388   7.94    1    27.293  ? 2284 B 1 c
ATOM 7955 H HE2  . PHE Bxp B    203 ? 65.678 2.323   4.598   1    27.922  ? 2284 B 1 c
ATOM 7956 H HZ   . PHE Bxp B    203 ? 65.211 4.33    5.648   1    27.62   ? 2284 B 1 c
ATOM 7957 N N    . GLY Bxp B    204 ? 63.451 0.092   10.72   1    24.31   ? 2285 B 1 .
ATOM 7958 C CA   . GLY Bxp B    204 ? 62.456 0.775   11.505  1    23.926  ? 2285 B 1 .
ATOM 7959 C C    . GLY Bxp B    204 ? 63.118 1.229   12.785  1    23.062  ? 2285 B 1 .
ATOM 7960 O O    . GLY Bxp B    204 ? 64.323 1.091   12.918  1    22.666  ? 2285 B 1 .
ATOM 7961 H H    . GLY Bxp B    204 ? 64.144 -0.327  11.143  1    24.441  ? 2285 B 1 c
ATOM 7962 H HA3  . GLY Bxp B    204 ? 61.707 0.166   11.703  1    23.857  ? 2285 B 1 c
ATOM 7963 H HA2  . GLY Bxp B    204 ? 62.111 1.551   11.007  1    23.87   ? 2285 B 1 c
ATOM 7964 N N    . GLY Bxp B    205 ? 62.294 1.695   13.713  1    23.349  ? 2286 B 1 .
ATOM 7965 C CA   . GLY Bxp B    205 ? 62.757 2.323   14.927  1    24.001  ? 2286 B 1 .
ATOM 7966 C C    . GLY Bxp B    205 ? 61.834 3.486   15.252  1    24.705  ? 2286 B 1 .
ATOM 7967 O O    . GLY Bxp B    205 ? 60.928 3.78    14.486  1    23.908  ? 2286 B 1 .
ATOM 7968 H H    . GLY Bxp B    205 ? 61.393 1.613   13.581  1    23.442  ? 2286 B 1 c
ATOM 7969 H HA3  . GLY Bxp B    205 ? 63.678 2.65    14.801  1    24.084  ? 2286 B 1 c
ATOM 7970 H HA2  . GLY Bxp B    205 ? 62.753 1.67    15.659  1    24.086  ? 2286 B 1 c
ATOM 7971 N N    . THR Bxp B    206 ? 62.067 4.143   16.387  1    27.024  ? 2287 B 1 .
ATOM 7972 C CA   . THR Bxp B    206 ? 61.339 5.361   16.68   1    27.435  ? 2287 B 1 .
ATOM 7973 C C    . THR Bxp B    206 ? 61.731 6.337   15.587  1    28.289  ? 2287 B 1 .
ATOM 7974 O O    . THR Bxp B    206 ? 62.744 6.151   14.917  1    30.601  ? 2287 B 1 .
ATOM 7975 C CB   . THR Bxp B    206 ? 61.636 5.982   18.044  1    27.587  ? 2287 B 1 .
ATOM 7976 O OG1  . THR Bxp B    206 ? 62.614 6.986   17.808  1    29.419  ? 2287 B 1 .
ATOM 7977 C CG2  . THR Bxp B    206 ? 62.15  4.998   19.075  1    28.266  ? 2287 B 1 .
ATOM 7978 H H    . THR Bxp B    206 ? 62.697 3.837   16.974  1    26.579  ? 2287 B 1 c
ATOM 7979 H HA   . THR Bxp B    206 ? 60.379 5.171   16.62   1    27.513  ? 2287 B 1 c
ATOM 7980 H HB   . THR Bxp B    206 ? 60.816 6.406   18.395  1    28.038  ? 2287 B 1 c
ATOM 7981 H HG1  . THR Bxp B    206 ? 63.34  6.598   17.555  0    18.97   ? 2287 B 1 c
ATOM 7982 H HG21 . THR Bxp B    206 ? 62     5.356   19.967  1    28.068  ? 2287 B 1 c
ATOM 7983 H HG22 . THR Bxp B    206 ? 63.102 4.857   18.942  1    28.082  ? 2287 B 1 c
ATOM 7984 H HG23 . THR Bxp B    206 ? 61.678 4.154   18.984  1    28.069  ? 2287 B 1 c
ATOM 7985 N N    . PRO Bxp B    207 ? 60.913 7.382   15.39   1    27.879  ? 2288 B 1 .
ATOM 7986 C CA   . PRO Bxp B    207 ? 61.246 8.52    14.553  1    28.885  ? 2288 B 1 .
ATOM 7987 C C    . PRO Bxp B    207 ? 62.659 9.056   14.738  1    27.647  ? 2288 B 1 .
ATOM 7988 O O    . PRO Bxp B    207 ? 63.412 9.118   13.766  1    27.961  ? 2288 B 1 .
ATOM 7989 C CB   . PRO Bxp B    207 ? 60.204 9.529   14.987  1    30.392  ? 2288 B 1 .
ATOM 7990 C CG   . PRO Bxp B    207 ? 59.017 8.603   15.153  1    29.919  ? 2288 B 1 .
ATOM 7991 C CD   . PRO Bxp B    207 ? 59.566 7.488   15.947  1    28.701  ? 2288 B 1 .
ATOM 7992 H HA   . PRO Bxp B    207 ? 61.105 8.285   13.612  1    28.72   ? 2288 B 1 c
ATOM 7993 H HB3  . PRO Bxp B    207 ? 60.045 10.199  14.295  1    29.967  ? 2288 B 1 c
ATOM 7994 H HB2  . PRO Bxp B    207 ? 60.445 9.958   15.831  1    29.887  ? 2288 B 1 c
ATOM 7995 H HG3  . PRO Bxp B    207 ? 58.691 8.288   14.286  1    29.722  ? 2288 B 1 c
ATOM 7996 H HG2  . PRO Bxp B    207 ? 58.287 9.045   15.63   1    29.69   ? 2288 B 1 c
ATOM 7997 H HD3  . PRO Bxp B    207 ? 59.593 7.7     16.899  1    28.771  ? 2288 B 1 c
ATOM 7998 H HD2  . PRO Bxp B    207 ? 59.059 6.665   15.806  1    28.763  ? 2288 B 1 c
ATOM 7999 N N    . THR Bxp B    208 ? 63.016 9.437   15.972  1    25.792  ? 2289 B 1 .
ATOM 8000 C CA   . THR Bxp B    208 ? 64.355 9.964   16.202  1    27.956  ? 2289 B 1 .
ATOM 8001 C C    . THR Bxp B    208 ? 65.381 9.004   15.605  1    27.568  ? 2289 B 1 .
ATOM 8002 O O    . THR Bxp B    208 ? 66.331 9.41    14.926  1    27.281  ? 2289 B 1 .
ATOM 8003 C CB   . THR Bxp B    208 ? 64.659 10.178  17.683  1    30.159  ? 2289 B 1 .
ATOM 8004 O OG1  . THR Bxp B    208 ? 63.436 10.597  18.277  1    33.613  ? 2289 B 1 .
ATOM 8005 C CG2  . THR Bxp B    208 ? 65.771 11.198  17.887  1    30.388  ? 2289 B 1 .
ATOM 8006 H H    . THR Bxp B    208 ? 62.434 9.359   16.673  1    26.779  ? 2289 B 1 c
ATOM 8007 H HA   . THR Bxp B    208 ? 64.427 10.827  15.741  1    27.863  ? 2289 B 1 c
ATOM 8008 H HB   . THR Bxp B    208 ? 64.937 9.322   18.088  1    30.393  ? 2289 B 1 c
ATOM 8009 H HG1  . THR Bxp B    208 ? 63.135 11.378  17.949  0    21.38   ? 2289 B 1 c
ATOM 8010 H HG21 . THR Bxp B    208 ? 65.905 11.346  18.838  1    30.313  ? 2289 B 1 c
ATOM 8011 H HG22 . THR Bxp B    208 ? 65.526 12.036  17.461  1    30.3    ? 2289 B 1 c
ATOM 8012 H HG23 . THR Bxp B    208 ? 66.595 10.864  17.493  1    30.303  ? 2289 B 1 c
ATOM 8013 N N    . GLN Bxp B    209 ? 65.186 7.718   15.887  1    27.134  ? 2290 B 1 .
ATOM 8014 C CA   . GLN Bxp B    209 ? 66.104 6.719   15.393  1    27.979  ? 2290 B 1 .
ATOM 8015 C C    . GLN Bxp B    209 ? 66.118 6.745   13.878  1    27.755  ? 2290 B 1 .
ATOM 8016 O O    . GLN Bxp B    209 ? 67.146 7.028   13.287  1    29.143  ? 2290 B 1 .
ATOM 8017 C CB   . GLN Bxp B    209 ? 65.783 5.34    15.958  1    28.843  ? 2290 B 1 .
ATOM 8018 C CG   . GLN Bxp B    209 ? 66.418 5.141   17.329  1    30.258  ? 2290 B 1 .
ATOM 8019 C CD   . GLN Bxp B    209 ? 67.787 5.776   17.419  1    29.791  ? 2290 B 1 .
ATOM 8020 O OE1  . GLN Bxp B    209 ? 68.668 5.521   16.584  1    30.806  ? 2290 B 1 .
ATOM 8021 N NE2  . GLN Bxp B    209 ? 67.951 6.653   18.398  1    28.467  ? 2290 B 1 .
ATOM 8022 H H    . GLN Bxp B    209 ? 64.476 7.461   16.403  1    27.441  ? 2290 B 1 c
ATOM 8023 H HA   . GLN Bxp B    209 ? 67.007 6.975   15.696  1    27.97   ? 2290 B 1 c
ATOM 8024 H HB3  . GLN Bxp B    209 ? 66.116 4.652   15.344  1    28.954  ? 2290 B 1 c
ATOM 8025 H HB2  . GLN Bxp B    209 ? 64.813 5.238   16.032  1    28.973  ? 2290 B 1 c
ATOM 8026 H HG3  . GLN Bxp B    209 ? 66.506 4.184   17.513  1    29.844  ? 2290 B 1 c
ATOM 8027 H HG2  . GLN Bxp B    209 ? 65.836 5.529   18.017  1    29.821  ? 2290 B 1 c
ATOM 8028 H HE21 . GLN Bxp B    209 ? 68.304 7.448   18.226  1    28.868  ? 2290 B 1 c
ATOM 8029 H HE22 . GLN Bxp B    209 ? 67.707 6.443   19.225  1    28.868  ? 2290 B 1 c
ATOM 8030 N N    . VAL Bxp B    210 ? 64.969 6.461   13.275  1    28.071  ? 2291 B 1 .
ATOM 8031 C CA   . VAL Bxp B    210 ? 64.897 6.348   11.835  1    28.324  ? 2291 B 1 .
ATOM 8032 C C    . VAL Bxp B    210 ? 65.374 7.661   11.238  1    29.884  ? 2291 B 1 .
ATOM 8033 O O    . VAL Bxp B    210 ? 66.03  7.673   10.196  1    29.886  ? 2291 B 1 .
ATOM 8034 C CB   . VAL Bxp B    210 ? 63.472 6.015   11.379  1    28.458  ? 2291 B 1 .
ATOM 8035 C CG1  . VAL Bxp B    210 ? 63.404 5.873   9.868   1    28.486  ? 2291 B 1 .
ATOM 8036 C CG2  . VAL Bxp B    210 ? 62.946 4.766   12.078  1    29.186  ? 2291 B 1 .
ATOM 8037 H H    . VAL Bxp B    210 ? 64.211 6.347   13.772  1    28.066  ? 2291 B 1 c
ATOM 8038 H HA   . VAL Bxp B    210 ? 65.497 5.633   11.547  1    28.589  ? 2291 B 1 c
ATOM 8039 H HB   . VAL Bxp B    210 ? 62.898 6.773   11.638  1    28.572  ? 2291 B 1 c
ATOM 8040 H HG11 . VAL Bxp B    210 ? 64.223 5.465   9.545   1    28.473  ? 2291 B 1 c
ATOM 8041 H HG12 . VAL Bxp B    210 ? 63.299 6.75    9.463   1    28.486  ? 2291 B 1 c
ATOM 8042 H HG13 . VAL Bxp B    210 ? 62.648 5.314   9.628   1    28.499  ? 2291 B 1 c
ATOM 8043 H HG21 . VAL Bxp B    210 ? 62.679 4.107   11.416  1    28.954  ? 2291 B 1 c
ATOM 8044 H HG22 . VAL Bxp B    210 ? 62.177 5.002   12.623  1    28.94   ? 2291 B 1 c
ATOM 8045 H HG23 . VAL Bxp B    210 ? 63.64  4.389   12.644  1    28.947  ? 2291 B 1 c
ATOM 8046 N N    . LEU Bxp B    211 ? 65.073 8.753   11.949  1    30.954  ? 2292 B 1 .
ATOM 8047 C CA   . LEU Bxp B    211 ? 65.561 10.051  11.538  1    32.193  ? 2292 B 1 .
ATOM 8048 C C    . LEU Bxp B    211 ? 67.073 9.973   11.412  1    34.202  ? 2292 B 1 .
ATOM 8049 O O    . LEU Bxp B    211 ? 67.608 10.417  10.41   1    35.62   ? 2292 B 1 .
ATOM 8050 C CB   . LEU Bxp B    211 ? 65.162 11.21   12.441  1    32.185  ? 2292 B 1 .
ATOM 8051 C CG   . LEU Bxp B    211 ? 65.775 12.558  12.053  1    31.979  ? 2292 B 1 .
ATOM 8052 C CD1  . LEU Bxp B    211 ? 65.465 12.892  10.611  1    31.525  ? 2292 B 1 .
ATOM 8053 C CD2  . LEU Bxp B    211 ? 65.278 13.664  12.963  1    32.584  ? 2292 B 1 .
ATOM 8054 H H    . LEU Bxp B    211 ? 64.538 8.692   12.687  1    30.857  ? 2292 B 1 c
ATOM 8055 H HA   . LEU Bxp B    211 ? 65.198 10.224  10.632  1    32.298  ? 2292 B 1 c
ATOM 8056 H HB3  . LEU Bxp B    211 ? 65.434 10.996  13.362  1    32.093  ? 2292 B 1 c
ATOM 8057 H HB2  . LEU Bxp B    211 ? 64.182 11.296  12.42   1    32.065  ? 2292 B 1 c
ATOM 8058 H HG   . LEU Bxp B    211 ? 66.759 12.496  12.155  1    32.144  ? 2292 B 1 c
ATOM 8059 H HD11 . LEU Bxp B    211 ? 66.103 12.447  10.029  1    31.685  ? 2292 B 1 c
ATOM 8060 H HD12 . LEU Bxp B    211 ? 65.527 13.854  10.479  1    31.671  ? 2292 B 1 c
ATOM 8061 H HD13 . LEU Bxp B    211 ? 64.566 12.594  10.394  1    31.669  ? 2292 B 1 c
ATOM 8062 H HD21 . LEU Bxp B    211 ? 65.393 13.399  13.89   1    32.404  ? 2292 B 1 c
ATOM 8063 H HD22 . LEU Bxp B    211 ? 64.336 13.83   12.788  1    32.404  ? 2292 B 1 c
ATOM 8064 H HD23 . LEU Bxp B    211 ? 65.785 14.477  12.794  1    32.404  ? 2292 B 1 c
ATOM 8065 N N    . ASN Bxp B    212 ? 67.76  9.384   12.393  1    36.687  ? 2293 B 1 .
ATOM 8066 C CA   . ASN Bxp B    212 ? 69.194 9.195   12.229  1    38.91   ? 2293 B 1 .
ATOM 8067 C C    . ASN Bxp B    212 ? 69.54  8.229   11.099  1    37.664  ? 2293 B 1 .
ATOM 8068 O O    . ASN Bxp B    212 ? 70.319 8.579   10.22   1    36.183  ? 2293 B 1 .
ATOM 8069 C CB   . ASN Bxp B    212 ? 69.902 8.807   13.515  1    39.605  ? 2293 B 1 .
ATOM 8070 C CG   . ASN Bxp B    212 ? 70.561 10.042  14.052  1    44.081  ? 2293 B 1 .
ATOM 8071 O OD1  . ASN Bxp B    212 ? 69.859 11.032  14.294  1    49.534  ? 2293 B 1 .
ATOM 8072 N ND2  . ASN Bxp B    212 ? 71.886 10.043  14.105  1    46.078  ? 2293 B 1 .
ATOM 8073 H H    . ASN Bxp B    212 ? 67.348 9.116   13.163  1    36.477  ? 2293 B 1 c
ATOM 8074 H HA   . ASN Bxp B    212 ? 69.564 10.068  11.964  1    38.401  ? 2293 B 1 c
ATOM 8075 H HB3  . ASN Bxp B    212 ? 70.573 8.119   13.337  1    40.453  ? 2293 B 1 c
ATOM 8076 H HB2  . ASN Bxp B    212 ? 69.257 8.462   14.164  1    40.319  ? 2293 B 1 c
ATOM 8077 H HD21 . ASN Bxp B    212 ? 72.3   10.363  14.821  1    45.444  ? 2293 B 1 c
ATOM 8078 H HD22 . ASN Bxp B    212 ? 72.356 9.723   13.424  1    45.412  ? 2293 B 1 c
ATOM 8079 N N    . ILE Bxp B    213 ? 68.998 7.011   11.142  1    37.792  ? 2294 B 1 .
ATOM 8080 C CA   . ILE Bxp B    213 ? 69.325 6.011   10.144  1    35.482  ? 2294 B 1 .
ATOM 8081 C C    . ILE Bxp B    213 ? 69.378 6.684   8.778   1    35.971  ? 2294 B 1 .
ATOM 8082 O O    . ILE Bxp B    213 ? 70.368 6.551   8.06    1    34.246  ? 2294 B 1 .
ATOM 8083 C CB   . ILE Bxp B    213 ? 68.317 4.858   10.147  1    31.82   ? 2294 B 1 .
ATOM 8084 C CG1  . ILE Bxp B    213 ? 68.2   4.233   11.505  1    30.079  ? 2294 B 1 .
ATOM 8085 C CG2  . ILE Bxp B    213 ? 68.713 3.833   9.094   1    32.731  ? 2294 B 1 .
ATOM 8086 C CD1  . ILE Bxp B    213 ? 67.079 3.228   11.596  1    30.914  ? 2294 B 1 .
ATOM 8087 H H    . ILE Bxp B    213 ? 68.401 6.807   11.803  1    37.073  ? 2294 B 1 c
ATOM 8088 H HA   . ILE Bxp B    213 ? 70.209 5.65    10.348  1    35.26   ? 2294 B 1 c
ATOM 8089 H HB   . ILE Bxp B    213 ? 67.442 5.222   9.905   1    32.28   ? 2294 B 1 c
ATOM 8090 H HG12 . ILE Bxp B    213 ? 68.05  4.932   12.171  1    30.748  ? 2294 B 1 c
ATOM 8091 H HG13 . ILE Bxp B    213 ? 69.044 3.787   11.721  1    30.697  ? 2294 B 1 c
ATOM 8092 H HG21 . ILE Bxp B    213 ? 68.353 2.962   9.331   1    32.451  ? 2294 B 1 c
ATOM 8093 H HG22 . ILE Bxp B    213 ? 69.682 3.776   9.042   1    32.523  ? 2294 B 1 c
ATOM 8094 H HG23 . ILE Bxp B    213 ? 68.36  4.101   8.229   1    32.485  ? 2294 B 1 c
ATOM 8095 H HD11 . ILE Bxp B    213 ? 66.377 3.453   10.956  1    30.659  ? 2294 B 1 c
ATOM 8096 H HD12 . ILE Bxp B    213 ? 66.708 3.237   12.498  1    30.664  ? 2294 B 1 c
ATOM 8097 H HD13 . ILE Bxp B    213 ? 67.423 2.336   11.397  1    30.674  ? 2294 B 1 c
ATOM 8098 N N    . THR Bxp B    214 ? 68.3   7.397   8.44    1    35.916  ? 2295 B 1 .
ATOM 8099 C CA   . THR Bxp B    214 ? 68.183 8.018   7.133   1    36.686  ? 2295 B 1 .
ATOM 8100 C C    . THR Bxp B    214 ? 69.188 9.154   6.996   1    38.378  ? 2295 B 1 .
ATOM 8101 O O    . THR Bxp B    214 ? 69.981 9.132   6.061   1    37.927  ? 2295 B 1 .
ATOM 8102 C CB   . THR Bxp B    214 ? 66.759 8.504   6.915   1    36.16   ? 2295 B 1 .
ATOM 8103 O OG1  . THR Bxp B    214 ? 66.45  9.381   7.994   1    36.114  ? 2295 B 1 .
ATOM 8104 C CG2  . THR Bxp B    214 ? 65.79  7.34    6.838   1    37.094  ? 2295 B 1 .
ATOM 8105 H H    . THR Bxp B    214 ? 67.616 7.495   9.038   1    36.121  ? 2295 B 1 c
ATOM 8106 H HA   . THR Bxp B    214 ? 68.385 7.34    6.456   1    36.751  ? 2295 B 1 c
ATOM 8107 H HB   . THR Bxp B    214 ? 66.718 9.006   6.067   1    36.459  ? 2295 B 1 c
ATOM 8108 H HG1  . THR Bxp B    214 ? 66.361 8.82    8.766   0    26.8    ? 2295 B 1 c
ATOM 8109 H HG21 . THR Bxp B    214 ? 64.994 7.546   7.357   1    36.747  ? 2295 B 1 c
ATOM 8110 H HG22 . THR Bxp B    214 ? 66.209 6.54    7.197   1    36.793  ? 2295 B 1 c
ATOM 8111 H HG23 . THR Bxp B    214 ? 65.541 7.186   5.911   1    36.798  ? 2295 B 1 c
ATOM 8112 N N    . GLN Bxp B    215 ? 69.149 10.112  7.935   1    40.231  ? 2296 B 1 .
ATOM 8113 C CA   . GLN Bxp B    215 ? 69.97  11.316  7.9     1    38.671  ? 2296 B 1 .
ATOM 8114 C C    . GLN Bxp B    215 ? 71.428 10.948  7.696   1    36.194  ? 2296 B 1 .
ATOM 8115 O O    . GLN Bxp B    215 ? 72.11  11.598  6.925   1    37.629  ? 2296 B 1 .
ATOM 8116 C CB   . GLN Bxp B    215 ? 69.901 12.105  9.203   1    41.407  ? 2296 B 1 .
ATOM 8117 C CG   . GLN Bxp B    215 ? 69.679 13.6    9.004   1    47.849  ? 2296 B 1 .
ATOM 8118 C CD   . GLN Bxp B    215 ? 69.001 14.251  10.199  1    54.638  ? 2296 B 1 .
ATOM 8119 O OE1  . GLN Bxp B    215 ? 68.944 13.675  11.296  1    53.751  ? 2296 B 1 .
ATOM 8120 N NE2  . GLN Bxp B    215 ? 68.458 15.448  9.996   1    56.622  ? 2296 B 1 .
ATOM 8121 H H    . GLN Bxp B    215 ? 68.571 10.005  8.635   1    39.423  ? 2296 B 1 c
ATOM 8122 H HA   . GLN Bxp B    215 ? 69.67  11.881  7.144   1    39.07   ? 2296 B 1 c
ATOM 8123 H HB3  . GLN Bxp B    215 ? 70.736 11.972  9.7     1    42.071  ? 2296 B 1 c
ATOM 8124 H HB2  . GLN Bxp B    215 ? 69.175 11.748  9.748   1    42.155  ? 2296 B 1 c
ATOM 8125 H HG3  . GLN Bxp B    215 ? 69.124 13.746  8.209   1    47.61   ? 2296 B 1 c
ATOM 8126 H HG2  . GLN Bxp B    215 ? 70.543 14.039  8.851   1    47.709  ? 2296 B 1 c
ATOM 8127 H HE21 . GLN Bxp B    215 ? 67.804 15.731  10.524  1    55.99   ? 2296 B 1 c
ATOM 8128 H HE22 . GLN Bxp B    215 ? 68.75  15.961  9.334   1    55.943  ? 2296 B 1 c
ATOM 8129 N N    . GLU Bxp B    216 ? 71.886 9.901   8.384   1    36.811  ? 2297 B 1 .
ATOM 8130 C CA   . GLU Bxp B    216 ? 73.25  9.412   8.238   1    37.946  ? 2297 B 1 .
ATOM 8131 C C    . GLU Bxp B    216 ? 73.442 8.767   6.871   1    34.932  ? 2297 B 1 .
ATOM 8132 O O    . GLU Bxp B    216 ? 74.298 9.192   6.114   1    35.253  ? 2297 B 1 .
ATOM 8133 C CB   . GLU Bxp B    216 ? 73.641 8.424   9.338   1    42.036  ? 2297 B 1 .
ATOM 8134 C CG   . GLU Bxp B    216 ? 73.792 9.088   10.706  1    45.009  ? 2297 B 1 .
ATOM 8135 C CD   . GLU Bxp B    216 ? 74.82  10.206  10.785  1    44.39   ? 2297 B 1 .
ATOM 8136 O OE1  . GLU Bxp B    216 ? 75.767 10.192  9.987   1    43.991  ? 2297 B 1 .
ATOM 8137 O OE2  . GLU Bxp B    216 ? 74.647 11.119  11.616  1    47.353  ? 2297 B 1 .
ATOM 8138 H H    . GLU Bxp B    216 ? 71.331 9.477   8.973   1    36.987  ? 2297 B 1 c
ATOM 8139 H HA   . GLU Bxp B    216 ? 73.857 10.191  8.293   1    37.887  ? 2297 B 1 c
ATOM 8140 H HB3  . GLU Bxp B    216 ? 74.487 7.994   9.094   1    41.667  ? 2297 B 1 c
ATOM 8141 H HB2  . GLU Bxp B    216 ? 72.955 7.726   9.394   1    41.636  ? 2297 B 1 c
ATOM 8142 H HG3  . GLU Bxp B    216 ? 74.035 8.401   11.363  1    44.175  ? 2297 B 1 c
ATOM 8143 H HG2  . GLU Bxp B    216 ? 72.922 9.452   10.976  1    44.175  ? 2297 B 1 c
ATOM 8144 N N    . CYS Bxp B    217 ? 72.656 7.743   6.544   1    34.096  ? 2298 B 1 .
ATOM 8145 C CA   . CYS Bxp B    217 ? 72.806 7.09    5.253   1    34.386  ? 2298 B 1 .
ATOM 8146 C C    . CYS Bxp B    217 ? 72.938 8.133   4.147   1    32.652  ? 2298 B 1 .
ATOM 8147 O O    . CYS Bxp B    217 ? 73.794 8.021   3.281   1    30.047  ? 2298 B 1 .
ATOM 8148 C CB   . CYS Bxp B    217 ? 71.648 6.144   4.969   1    36.712  ? 2298 B 1 .
ATOM 8149 S SG   . CYS Bxp B    217 ? 71.576 4.771   6.144   1    40.9    ? 2298 B 1 .
ATOM 8150 H H    . CYS Bxp B    217 ? 72.019 7.446   7.128   1    34.396  ? 2298 B 1 c
ATOM 8151 H HA   . CYS Bxp B    217 ? 73.642 6.557   5.278   1    34.417  ? 2298 B 1 c
ATOM 8152 H HB3  . CYS Bxp B    217 ? 71.742 5.778   4.061   1    36.869  ? 2298 B 1 c
ATOM 8153 H HB2  . CYS Bxp B    217 ? 70.803 6.643   5.013   1    36.901  ? 2298 B 1 c
ATOM 8154 H HG   . CYS Bxp B    217 ? 70.587 4.235   5.626   0    29.56   ? 2298 B 1 c
ATOM 8155 N N    . PHE Bxp B    218 ? 72.098 9.167   4.197   1    32.802  ? 2299 B 1 .
ATOM 8156 C CA   . PHE Bxp B    218 ? 72.196 10.241  3.232   1    33.147  ? 2299 B 1 .
ATOM 8157 C C    . PHE Bxp B    218 ? 73.584 10.887  3.314   1    35.679  ? 2299 B 1 .
ATOM 8158 O O    . PHE Bxp B    218 ? 74.342 10.807  2.352   1    36.158  ? 2299 B 1 .
ATOM 8159 C CB   . PHE Bxp B    218 ? 71.033 11.201  3.463   1    32.056  ? 2299 B 1 .
ATOM 8160 C CG   . PHE Bxp B    218 ? 71.051 12.336  2.453   1    34.254  ? 2299 B 1 .
ATOM 8161 C CD1  . PHE Bxp B    218 ? 70.436 12.183  1.22    1    36.077  ? 2299 B 1 .
ATOM 8162 C CD2  . PHE Bxp B    218 ? 71.721 13.526  2.715   1    35.115  ? 2299 B 1 .
ATOM 8163 C CE1  . PHE Bxp B    218 ? 70.464 13.197  0.281   1    36.613  ? 2299 B 1 .
ATOM 8164 C CE2  . PHE Bxp B    218 ? 71.752 14.542  1.776   1    36.988  ? 2299 B 1 .
ATOM 8165 C CZ   . PHE Bxp B    218 ? 71.123 14.376  0.562   1    38.862  ? 2299 B 1 .
ATOM 8166 H H    . PHE Bxp B    218 ? 71.447 9.2     4.837   1    32.866  ? 2299 B 1 c
ATOM 8167 H HA   . PHE Bxp B    218 ? 72.093 9.848   2.326   1    33.372  ? 2299 B 1 c
ATOM 8168 H HB3  . PHE Bxp B    218 ? 71.097 11.571  4.371   1    32.814  ? 2299 B 1 c
ATOM 8169 H HB2  . PHE Bxp B    218 ? 70.188 10.705  3.381   1    32.796  ? 2299 B 1 c
ATOM 8170 H HD1  . PHE Bxp B    218 ? 69.986 11.378  1.024   1    35.795  ? 2299 B 1 c
ATOM 8171 H HD2  . PHE Bxp B    218 ? 72.155 13.643  3.545   1    35.361  ? 2299 B 1 c
ATOM 8172 H HE1  . PHE Bxp B    218 ? 70.029 13.086  -0.548  1    36.981  ? 2299 B 1 c
ATOM 8173 H HE2  . PHE Bxp B    218 ? 72.2   15.35   1.97    1    36.933  ? 2299 B 1 c
ATOM 8174 H HZ   . PHE Bxp B    218 ? 71.139 15.072  -0.076  1    37.821  ? 2299 B 1 c
ATOM 8175 N N    . LYS Bxp B    219 ? 73.919 11.514  4.454   1    36.527  ? 2300 B 1 .
ATOM 8176 C CA   . LYS Bxp B    219 ? 75.246 12.079  4.681   1    36.983  ? 2300 B 1 .
ATOM 8177 C C    . LYS Bxp B    219 ? 76.325 11.168  4.085   1    36.938  ? 2300 B 1 .
ATOM 8178 O O    . LYS Bxp B    219 ? 77.323 11.649  3.55    1    41.007  ? 2300 B 1 .
ATOM 8179 C CB   . LYS Bxp B    219 ? 75.551 12.298  6.167   1    38.439  ? 2300 B 1 .
ATOM 8180 C CG   . LYS Bxp B    219 ? 75.232 13.639  6.829   1    41.916  ? 2300 B 1 .
ATOM 8181 C CD   . LYS Bxp B    219 ? 75.725 13.681  8.279   1    49.587  ? 2300 B 1 .
ATOM 8182 C CE   . LYS Bxp B    219 ? 77.223 13.37   8.461   1    56.101  ? 2300 B 1 .
ATOM 8183 N NZ   . LYS Bxp B    219 ? 77.624 12.783  9.753   1    54.581  ? 2300 B 1 .
ATOM 8184 H H    . LYS Bxp B    219 ? 73.295 11.59   5.117   1    36.378  ? 2300 B 1 c
ATOM 8185 H HA   . LYS Bxp B    219 ? 75.289 12.956  4.221   1    37.146  ? 2300 B 1 c
ATOM 8186 H HB3  . LYS Bxp B    219 ? 76.508 12.128  6.289   1    39.037  ? 2300 B 1 c
ATOM 8187 H HB2  . LYS Bxp B    219 ? 75.074 11.604  6.669   1    38.85   ? 2300 B 1 c
ATOM 8188 H HG3  . LYS Bxp B    219 ? 74.261 13.781  6.81    1    42.689  ? 2300 B 1 c
ATOM 8189 H HG2  . LYS Bxp B    219 ? 75.661 14.358  6.316   1    42.689  ? 2300 B 1 c
ATOM 8190 H HD3  . LYS Bxp B    219 ? 75.203 13.036  8.804   1    49.068  ? 2300 B 1 c
ATOM 8191 H HD2  . LYS Bxp B    219 ? 75.542 14.574  8.644   1    49.068  ? 2300 B 1 c
ATOM 8192 H HE3  . LYS Bxp B    219 ? 77.715 14.202  8.346   1    54.159  ? 2300 B 1 c
ATOM 8193 H HE2  . LYS Bxp B    219 ? 77.521 12.768  7.759   1    53.958  ? 2300 B 1 c
ATOM 8194 H HZ1  . LYS Bxp B    219 ? 77.26  11.959  9.842   1    55.044  ? 2300 B 1 c
ATOM 8195 H HZ2  . LYS Bxp B    219 ? 77.337 13.311  10.432  1    55.044  ? 2300 B 1 c
ATOM 8196 H HZ3  . LYS Bxp B    219 ? 78.527 12.716  9.791   1    55.044  ? 2300 B 1 c
ATOM 8197 N N    . GLY Bxp B    220 ? 76.125 9.851   4.171   1    33.636  ? 2301 B 1 .
ATOM 8198 C CA   . GLY Bxp B    220 ? 77.078 8.907   3.621   1    35.156  ? 2301 B 1 .
ATOM 8199 C C    . GLY Bxp B    220 ? 77.075 8.931   2.095   1    37.652  ? 2301 B 1 .
ATOM 8200 O O    . GLY Bxp B    220 ? 78.052 9.318   1.466   1    41.031  ? 2301 B 1 .
ATOM 8201 H H    . GLY Bxp B    220 ? 75.392 9.53    4.61    1    34.761  ? 2301 B 1 c
ATOM 8202 H HA3  . GLY Bxp B    220 ? 76.852 8       3.936   1    35.328  ? 2301 B 1 c
ATOM 8203 H HA2  . GLY Bxp B    220 ? 77.98  9.127   3.953   1    35.357  ? 2301 B 1 c
ATOM 8204 N N    . ILE Bxp B    221 ? 75.945 8.552   1.503   1    39.53   ? 2302 B 1 .
ATOM 8205 C CA   . ILE Bxp B    221 ? 75.812 8.472   0.057   1    40.108  ? 2302 B 1 .
ATOM 8206 C C    . ILE Bxp B    221 ? 76.2   9.829   -0.533  1    39.171  ? 2302 B 1 .
ATOM 8207 O O    . ILE Bxp B    221 ? 76.577 9.923   -1.695  1    38.995  ? 2302 B 1 .
ATOM 8208 C CB   . ILE Bxp B    221 ? 74.376 8.052   -0.334  1    41.803  ? 2302 B 1 .
ATOM 8209 C CG1  . ILE Bxp B    221 ? 73.772 7.037   0.621   1    41.905  ? 2302 B 1 .
ATOM 8210 C CG2  . ILE Bxp B    221 ? 74.307 7.495   -1.751  1    42.924  ? 2302 B 1 .
ATOM 8211 C CD1  . ILE Bxp B    221 ? 72.27  7.146   0.747   1    43.251  ? 2302 B 1 .
ATOM 8212 H H    . ILE Bxp B    221 ? 75.219 8.372   2.027   1    39.237  ? 2302 B 1 c
ATOM 8213 H HA   . ILE Bxp B    221 ? 76.432 7.796   -0.274  1    40.215  ? 2302 B 1 c
ATOM 8214 H HB   . ILE Bxp B    221 ? 73.817 8.854   -0.303  1    41.698  ? 2302 B 1 c
ATOM 8215 H HG12 . ILE Bxp B    221 ? 74.172 7.139   1.504   1    42.002  ? 2302 B 1 c
ATOM 8216 H HG13 . ILE Bxp B    221 ? 73.991 6.139   0.3     1    42.153  ? 2302 B 1 c
ATOM 8217 H HG21 . ILE Bxp B    221 ? 73.398 7.207   -1.944  1    42.586  ? 2302 B 1 c
ATOM 8218 H HG22 . ILE Bxp B    221 ? 74.909 6.736   -1.833  1    42.587  ? 2302 B 1 c
ATOM 8219 H HG23 . ILE Bxp B    221 ? 74.568 8.184   -2.385  1    42.589  ? 2302 B 1 c
ATOM 8220 H HD11 . ILE Bxp B    221 ? 72.012 8.081   0.849   1    42.762  ? 2302 B 1 c
ATOM 8221 H HD12 . ILE Bxp B    221 ? 71.971 6.642   1.527   1    42.827  ? 2302 B 1 c
ATOM 8222 H HD13 . ILE Bxp B    221 ? 71.849 6.781   -0.054  1    42.827  ? 2302 B 1 c
ATOM 8223 N N    . LEU Bxp B    222 ? 76.084 10.881  0.288   1    40.197  ? 2303 B 1 .
ATOM 8224 C CA   . LEU Bxp B    222 ? 76.393 12.245  -0.111  1    39.511  ? 2303 B 1 .
ATOM 8225 C C    . LEU Bxp B    222 ? 77.901 12.417  -0.223  1    38.381  ? 2303 B 1 .
ATOM 8226 O O    . LEU Bxp B    222 ? 78.373 12.98   -1.2    1    36.293  ? 2303 B 1 .
ATOM 8227 C CB   . LEU Bxp B    222 ? 75.771 13.212  0.901   1    38.985  ? 2303 B 1 .
ATOM 8228 C CG   . LEU Bxp B    222 ? 75.827 14.715  0.6     1    39.762  ? 2303 B 1 .
ATOM 8229 C CD1  . LEU Bxp B    222 ? 77.112 15.373  1.119   1    41.155  ? 2303 B 1 .
ATOM 8230 C CD2  . LEU Bxp B    222 ? 75.626 15.011  -0.883  1    39.663  ? 2303 B 1 .
ATOM 8231 H H    . LEU Bxp B    222 ? 75.764 10.746  1.133   1    39.773  ? 2303 B 1 c
ATOM 8232 H HA   . LEU Bxp B    222 ? 75.99  12.402  -1.002  1    39.322  ? 2303 B 1 c
ATOM 8233 H HB3  . LEU Bxp B    222 ? 76.206 13.059  1.77    1    39.297  ? 2303 B 1 c
ATOM 8234 H HB2  . LEU Bxp B    222 ? 74.826 12.961  1.014   1    39.266  ? 2303 B 1 c
ATOM 8235 H HG   . LEU Bxp B    222 ? 75.072 15.141  1.083   1    39.853  ? 2303 B 1 c
ATOM 8236 H HD11 . LEU Bxp B    222 ? 77.092 15.403  2.09    1    40.789  ? 2303 B 1 c
ATOM 8237 H HD12 . LEU Bxp B    222 ? 77.178 16.278  0.769   1    40.863  ? 2303 B 1 c
ATOM 8238 H HD13 . LEU Bxp B    222 ? 77.883 14.859  0.829   1    40.863  ? 2303 B 1 c
ATOM 8239 H HD21 . LEU Bxp B    222 ? 74.813 14.58   -1.192  1    39.683  ? 2303 B 1 c
ATOM 8240 H HD22 . LEU Bxp B    222 ? 76.383 14.676  -1.39   1    39.668  ? 2303 B 1 c
ATOM 8241 H HD23 . LEU Bxp B    222 ? 75.55  15.971  -1.014  1    39.686  ? 2303 B 1 c
ATOM 8242 N N    . LYS Bxp B    223 ? 78.643 11.964  0.791   1    41.582  ? 2304 B 1 .
ATOM 8243 C CA   . LYS Bxp B    223 ? 80.093 11.976  0.72    1    44.68   ? 2304 B 1 .
ATOM 8244 C C    . LYS Bxp B    223 ? 80.49  11.137  -0.481  1    41.635  ? 2304 B 1 .
ATOM 8245 O O    . LYS Bxp B    223 ? 80.968 11.656  -1.471  1    41.324  ? 2304 B 1 .
ATOM 8246 C CB   . LYS Bxp B    223 ? 80.772 11.394  1.96    1    49.435  ? 2304 B 1 .
ATOM 8247 C CG   . LYS Bxp B    223 ? 80.363 11.998  3.282   1    56.612  ? 2304 B 1 .
ATOM 8248 C CD   . LYS Bxp B    223 ? 81.285 11.524  4.394   1    65.15   ? 2304 B 1 .
ATOM 8249 C CE   . LYS Bxp B    223 ? 82.69  12.041  4.235   1    68.138  ? 2304 B 1 .
ATOM 8250 N NZ   . LYS Bxp B    223 ? 83.613 11.231  5.032   1    73.132  ? 2304 B 1 .
ATOM 8251 H H    . LYS Bxp B    223 ? 78.236 11.64   1.543   1    41.663  ? 2304 B 1 c
ATOM 8252 H HA   . LYS Bxp B    223 ? 80.396 12.908  0.579   1    44.231  ? 2304 B 1 c
ATOM 8253 H HB3  . LYS Bxp B    223 ? 81.74  11.502  1.853   1    50.119  ? 2304 B 1 c
ATOM 8254 H HB2  . LYS Bxp B    223 ? 80.588 10.433  2       1    49.781  ? 2304 B 1 c
ATOM 8255 H HG3  . LYS Bxp B    223 ? 79.445 11.732  3.487   1    56.381  ? 2304 B 1 c
ATOM 8256 H HG2  . LYS Bxp B    223 ? 80.401 12.977  3.216   1    56.598  ? 2304 B 1 c
ATOM 8257 H HD3  . LYS Bxp B    223 ? 81.303 10.542  4.4     1    63.855  ? 2304 B 1 c
ATOM 8258 H HD2  . LYS Bxp B    223 ? 80.929 11.826  5.258   1    63.775  ? 2304 B 1 c
ATOM 8259 H HE3  . LYS Bxp B    223 ? 82.734 12.965  4.539   1    68.53   ? 2304 B 1 c
ATOM 8260 H HE2  . LYS Bxp B    223 ? 82.972 12.013  3.304   1    68.287  ? 2304 B 1 c
ATOM 8261 H HZ1  . LYS Bxp B    223 ? 83.646 10.388  4.702   1    71.493  ? 2304 B 1 c
ATOM 8262 H HZ2  . LYS Bxp B    223 ? 83.333 11.204  5.893   1    71.505  ? 2304 B 1 c
ATOM 8263 H HZ3  . LYS Bxp B    223 ? 84.443 11.594  5.001   1    71.535  ? 2304 B 1 c
ATOM 8264 N N    . ASP Bxp B    224 ? 80.235 9.841   -0.379  1    43.6    ? 2305 B 1 .
ATOM 8265 C CA   . ASP Bxp B    224 ? 80.29  8.936   -1.503  1    49.704  ? 2305 B 1 .
ATOM 8266 C C    . ASP Bxp B    224 ? 80.23  9.644   -2.859  1    48.203  ? 2305 B 1 .
ATOM 8267 O O    . ASP Bxp B    224 ? 81.149 9.511   -3.66   1    49.789  ? 2305 B 1 .
ATOM 8268 C CB   . ASP Bxp B    224 ? 79.195 7.891   -1.371  1    56.32   ? 2305 B 1 .
ATOM 8269 C CG   . ASP Bxp B    224 ? 79.697 6.541   -0.883  1    57.447  ? 2305 B 1 .
ATOM 8270 O OD1  . ASP Bxp B    224 ? 80.753 6.539   -0.194  1    48.38   ? 2305 B 1 .
ATOM 8271 O OD2  . ASP Bxp B    224 ? 79.064 5.513   -1.263  1    59.26   ? 2305 B 1 .
ATOM 8272 H H    . ASP Bxp B    224 ? 80.001 9.499   0.436   1    44.664  ? 2305 B 1 c
ATOM 8273 H HA   . ASP Bxp B    224 ? 81.148 8.465   -1.453  1    49.502  ? 2305 B 1 c
ATOM 8274 H HB3  . ASP Bxp B    224 ? 78.759 7.762   -2.24   1    54.836  ? 2305 B 1 c
ATOM 8275 H HB2  . ASP Bxp B    224 ? 78.52  8.211   -0.742  1    54.437  ? 2305 B 1 c
ATOM 8276 N N    . LYS Bxp B    225 ? 79.126 10.327  -3.164  1    47.727  ? 2306 B 1 .
ATOM 8277 C CA   . LYS Bxp B    225 ? 78.968 10.97   -4.464  1    47.517  ? 2306 B 1 .
ATOM 8278 C C    . LYS Bxp B    225 ? 80.009 12.074  -4.675  1    44.36   ? 2306 B 1 .
ATOM 8279 O O    . LYS Bxp B    225 ? 80.627 12.15   -5.731  1    41.25   ? 2306 B 1 .
ATOM 8280 C CB   . LYS Bxp B    225 ? 77.548 11.524  -4.626  1    50.867  ? 2306 B 1 .
ATOM 8281 C CG   . LYS Bxp B    225 ? 76.56  10.637  -5.367  1    52.035  ? 2306 B 1 .
ATOM 8282 C CD   . LYS Bxp B    225 ? 76.485 9.183   -4.923  1    53.245  ? 2306 B 1 .
ATOM 8283 C CE   . LYS Bxp B    225 ? 75.239 8.582   -5.485  1    57.571  ? 2306 B 1 .
ATOM 8284 N NZ   . LYS Bxp B    225 ? 75.272 8.371   -6.936  1    59.805  ? 2306 B 1 .
ATOM 8285 H H    . LYS Bxp B    225 ? 78.454 10.395  -2.549  1    47.888  ? 2306 B 1 c
ATOM 8286 H HA   . LYS Bxp B    225 ? 79.107 10.281  -5.163  1    47.613  ? 2306 B 1 c
ATOM 8287 H HB3  . LYS Bxp B    225 ? 77.603 12.38   -5.102  1    50.304  ? 2306 B 1 c
ATOM 8288 H HB2  . LYS Bxp B    225 ? 77.182 11.71   -3.735  1    50.307  ? 2306 B 1 c
ATOM 8289 H HG3  . LYS Bxp B    225 ? 76.79  10.658  -6.322  1    52.049  ? 2306 B 1 c
ATOM 8290 H HG2  . LYS Bxp B    225 ? 75.669 11.037  -5.277  1    52.102  ? 2306 B 1 c
ATOM 8291 H HD3  . LYS Bxp B    225 ? 76.462 9.131   -3.945  1    53.83   ? 2306 B 1 c
ATOM 8292 H HD2  . LYS Bxp B    225 ? 77.267 8.691   -5.254  1    53.948  ? 2306 B 1 c
ATOM 8293 H HE3  . LYS Bxp B    225 ? 74.493 9.171   -5.273  1    56.967  ? 2306 B 1 c
ATOM 8294 H HE2  . LYS Bxp B    225 ? 75.067 7.731   -5.047  1    57.075  ? 2306 B 1 c
ATOM 8295 H HZ1  . LYS Bxp B    225 ? 76.072 8.021   -7.178  1    59.028  ? 2306 B 1 c
ATOM 8296 H HZ2  . LYS Bxp B    225 ? 75.15  9.16    -7.364  1    59.056  ? 2306 B 1 c
ATOM 8297 H HZ3  . LYS Bxp B    225 ? 74.613 7.798   -7.175  1    59.083  ? 2306 B 1 c
ATOM 8298 N N    . LYS Bxp B    226 ? 80.207 12.933  -3.671  1    43.983  ? 2307 B 1 .
ATOM 8299 C CA   . LYS Bxp B    226 ? 81.214 13.976  -3.746  1    44.474  ? 2307 B 1 .
ATOM 8300 C C    . LYS Bxp B    226 ? 82.6   13.397  -4.013  1    45.708  ? 2307 B 1 .
ATOM 8301 O O    . LYS Bxp B    226 ? 83.466 14.127  -4.465  1    53.407  ? 2307 B 1 .
ATOM 8302 C CB   . LYS Bxp B    226 ? 81.243 14.806  -2.464  1    48.326  ? 2307 B 1 .
ATOM 8303 C CG   . LYS Bxp B    226 ? 80.048 15.716  -2.316  1    52.384  ? 2307 B 1 .
ATOM 8304 C CD   . LYS Bxp B    226 ? 79.806 16.204  -0.895  1    59.157  ? 2307 B 1 .
ATOM 8305 C CE   . LYS Bxp B    226 ? 80.824 17.191  -0.442  1    66.463  ? 2307 B 1 .
ATOM 8306 N NZ   . LYS Bxp B    226 ? 80.244 18.04   0.601   1    73.41   ? 2307 B 1 .
ATOM 8307 H H    . LYS Bxp B    226 ? 79.695 12.869  -2.917  1    44.252  ? 2307 B 1 c
ATOM 8308 H HA   . LYS Bxp B    226 ? 80.978 14.576  -4.498  1    45.284  ? 2307 B 1 c
ATOM 8309 H HB3  . LYS Bxp B    226 ? 82.057 15.354  -2.454  1    48.307  ? 2307 B 1 c
ATOM 8310 H HB2  . LYS Bxp B    226 ? 81.277 14.203  -1.691  1    48.336  ? 2307 B 1 c
ATOM 8311 H HG3  . LYS Bxp B    226 ? 79.25  15.237  -2.629  1    52.775  ? 2307 B 1 c
ATOM 8312 H HG2  . LYS Bxp B    226 ? 80.178 16.493  -2.899  1    52.92   ? 2307 B 1 c
ATOM 8313 H HD3  . LYS Bxp B    226 ? 79.818 15.433  -0.287  1    58.905  ? 2307 B 1 c
ATOM 8314 H HD2  . LYS Bxp B    226 ? 78.916 16.615  -0.846  1    59.098  ? 2307 B 1 c
ATOM 8315 H HE3  . LYS Bxp B    226 ? 81.109 17.749  -1.188  1    66.066  ? 2307 B 1 c
ATOM 8316 H HE2  . LYS Bxp B    226 ? 81.602 16.728  -0.085  1    66.212  ? 2307 B 1 c
ATOM 8317 H HZ1  . LYS Bxp B    226 ? 79.87  17.525  1.246   1    71.096  ? 2307 B 1 c
ATOM 8318 H HZ2  . LYS Bxp B    226 ? 79.609 18.578  0.242   1    71.087  ? 2307 B 1 c
ATOM 8319 H HZ3  . LYS Bxp B    226 ? 80.893 18.553  0.97    1    71.157  ? 2307 B 1 c
ATOM 8320 N N    . ASN Bxp B    227 ? 82.81  12.099  -3.758  1    47.318  ? 2308 B 1 .
ATOM 8321 C CA   . ASN Bxp B    227 ? 84.039 11.415  -4.144  1    46.541  ? 2308 B 1 .
ATOM 8322 C C    . ASN Bxp B    227 ? 83.794 10.433  -5.29   1    44.735  ? 2308 B 1 .
ATOM 8323 O O    . ASN Bxp B    227 ? 84.598 9.54    -5.525  1    41.113  ? 2308 B 1 .
ATOM 8324 C CB   . ASN Bxp B    227 ? 84.659 10.703  -2.953  1    47.756  ? 2308 B 1 .
ATOM 8325 C CG   . ASN Bxp B    227 ? 85.088 11.7    -1.911  1    53.138  ? 2308 B 1 .
ATOM 8326 O OD1  . ASN Bxp B    227 ? 86.112 12.366  -2.068  1    58.282  ? 2308 B 1 .
ATOM 8327 N ND2  . ASN Bxp B    227 ? 84.31  11.837  -0.852  1    60      ? 2308 B 1 .
ATOM 8328 H H    . ASN Bxp B    227 ? 82.177 11.627  -3.298  1    46.71   ? 2308 B 1 c
ATOM 8329 H HA   . ASN Bxp B    227 ? 84.686 12.089  -4.452  1    46.643  ? 2308 B 1 c
ATOM 8330 H HB3  . ASN Bxp B    227 ? 85.436 10.187  -3.247  1    48.602  ? 2308 B 1 c
ATOM 8331 H HB2  . ASN Bxp B    227 ? 84.007 10.085  -2.566  1    48.707  ? 2308 B 1 c
ATOM 8332 H HD21 . ASN Bxp B    227 ? 84.671 11.967  -0.052  1    57.78   ? 2308 B 1 c
ATOM 8333 H HD22 . ASN Bxp B    227 ? 83.428 11.799  -0.943  1    57.723  ? 2308 B 1 c
ATOM 8334 N N    . ASP Bxp B    228 ? 82.695 10.636  -6.019  1    47.146  ? 2309 B 1 .
ATOM 8335 C CA   . ASP Bxp B    228 ? 82.327 9.814   -7.157  1    49.149  ? 2309 B 1 .
ATOM 8336 C C    . ASP Bxp B    228 ? 82.525 8.334   -6.842  1    52.298  ? 2309 B 1 .
ATOM 8337 O O    . ASP Bxp B    228 ? 83.418 7.698   -7.39   1    50.33   ? 2309 B 1 .
ATOM 8338 C CB   . ASP Bxp B    228 ? 83.096 10.227  -8.395  1    46.472  ? 2309 B 1 .
ATOM 8339 C CG   . ASP Bxp B    228 ? 82.739 9.445   -9.646  1    46.723  ? 2309 B 1 .
ATOM 8340 O OD1  . ASP Bxp B    228 ? 81.761 8.655   -9.603  1    44.243  ? 2309 B 1 .
ATOM 8341 O OD2  . ASP Bxp B    228 ? 83.474 9.609   -10.63  1    49.171  ? 2309 B 1 .
ATOM 8342 H H    . ASP Bxp B    228 ? 82.154 11.339  -5.808  1    46.979  ? 2309 B 1 c
ATOM 8343 H HA   . ASP Bxp B    228 ? 81.372 9.963   -7.342  1    48.774  ? 2309 B 1 c
ATOM 8344 H HB3  . ASP Bxp B    228 ? 84.055 10.12   -8.227  1    47.145  ? 2309 B 1 c
ATOM 8345 H HB2  . ASP Bxp B    228 ? 82.924 11.176  -8.569  1    47.133  ? 2309 B 1 c
ATOM 8346 N N    . ILE Bxp B    229 ? 81.656 7.789   -5.981  1    57.494  ? 2310 B 1 .
ATOM 8347 C CA   . ILE Bxp B    229 ? 81.773 6.405   -5.552  1    58.151  ? 2310 B 1 .
ATOM 8348 C C    . ILE Bxp B    229 ? 80.397 5.847   -5.142  1    56.908  ? 2310 B 1 .
ATOM 8349 O O    . ILE Bxp B    229 ? 79.771 6.263   -4.167  1    53.406  ? 2310 B 1 .
ATOM 8350 C CB   . ILE Bxp B    229 ? 82.883 6.307   -4.483  1    59.199  ? 2310 B 1 .
ATOM 8351 C CG1  . ILE Bxp B    229 ? 83.414 4.889   -4.328  1    60.97   ? 2310 B 1 .
ATOM 8352 C CG2  . ILE Bxp B    229 ? 82.465 6.893   -3.138  1    62.86   ? 2310 B 1 .
ATOM 8353 C CD1  . ILE Bxp B    229 ? 84.522 4.764   -3.295  1    60.286  ? 2310 B 1 .
ATOM 8354 H H    . ILE Bxp B    229 ? 80.971 8.298   -5.652  1    56.305  ? 2310 B 1 c
ATOM 8355 H HA   . ILE Bxp B    229 ? 82.075 5.888   -6.324  1    57.92   ? 2310 B 1 c
ATOM 8356 H HB   . ILE Bxp B    229 ? 83.631 6.848   -4.805  1    59.954  ? 2310 B 1 c
ATOM 8357 H HG12 . ILE Bxp B    229 ? 83.754 4.583   -5.194  1    60.401  ? 2310 B 1 c
ATOM 8358 H HG13 . ILE Bxp B    229 ? 82.675 4.302   -4.071  1    60.383  ? 2310 B 1 c
ATOM 8359 H HG21 . ILE Bxp B    229 ? 83.181 7.451   -2.788  1    61.643  ? 2310 B 1 c
ATOM 8360 H HG22 . ILE Bxp B    229 ? 82.279 6.175   -2.51   1    61.629  ? 2310 B 1 c
ATOM 8361 H HG23 . ILE Bxp B    229 ? 81.67  7.429   -3.254  1    61.284  ? 2310 B 1 c
ATOM 8362 H HD11 . ILE Bxp B    229 ? 85.084 5.561   -3.321  1    60.471  ? 2310 B 1 c
ATOM 8363 H HD12 . ILE Bxp B    229 ? 85.066 3.978   -3.494  1    60.477  ? 2310 B 1 c
ATOM 8364 H HD13 . ILE Bxp B    229 ? 84.133 4.672   -2.405  1    60.452  ? 2310 B 1 c
ATOM 8365 N N    . GLU Bxp B    230 ? 79.886 4.901   -5.94   1    59.203  ? 2311 B 1 .
ATOM 8366 C CA   . GLU Bxp B    230 ? 78.613 4.276   -5.628  1    61.893  ? 2311 B 1 .
ATOM 8367 C C    . GLU Bxp B    230 ? 78.861 2.982   -4.854  1    63.202  ? 2311 B 1 .
ATOM 8368 O O    . GLU Bxp B    230 ? 79.419 2.016   -5.37   1    61.762  ? 2311 B 1 .
ATOM 8369 C CB   . GLU Bxp B    230 ? 77.715 4.08    -6.851  1    61.136  ? 2311 B 1 .
ATOM 8370 C CG   . GLU Bxp B    230 ? 76.258 3.831   -6.467  1    64.085  ? 2311 B 1 .
ATOM 8371 C CD   . GLU Bxp B    230 ? 75.614 4.821   -5.493  1    67.981  ? 2311 B 1 .
ATOM 8372 O OE1  . GLU Bxp B    230 ? 76.307 5.758   -4.992  1    62.807  ? 2311 B 1 .
ATOM 8373 O OE2  . GLU Bxp B    230 ? 74.393 4.634   -5.224  1    64.571  ? 2311 B 1 .
ATOM 8374 H H    . GLU Bxp B    230 ? 80.338 4.642   -6.691  1    59.217  ? 2311 B 1 c
ATOM 8375 H HA   . GLU Bxp B    230 ? 78.133 4.888   -5.026  1    61.465  ? 2311 B 1 c
ATOM 8376 H HB3  . GLU Bxp B    230 ? 78.049 3.32    -7.372  1    61.965  ? 2311 B 1 c
ATOM 8377 H HB2  . GLU Bxp B    230 ? 77.77  4.879   -7.417  1    61.965  ? 2311 B 1 c
ATOM 8378 H HG3  . GLU Bxp B    230 ? 76.194 2.936   -6.072  1    64.237  ? 2311 B 1 c
ATOM 8379 H HG2  . GLU Bxp B    230 ? 75.719 3.818   -7.286  1    64.257  ? 2311 B 1 c
ATOM 8380 N N    . ALA Bxp B    231 ? 78.407 2.994   -3.599  1    63.881  ? 2312 B 1 .
ATOM 8381 C CA   . ALA Bxp B    231 ? 78.593 1.902   -2.659  1    63.442  ? 2312 B 1 .
ATOM 8382 C C    . ALA Bxp B    231 ? 77.917 0.611   -3.134  1    59.392  ? 2312 B 1 .
ATOM 8383 O O    . ALA Bxp B    231 ? 76.734 0.608   -3.46   1    62.932  ? 2312 B 1 .
ATOM 8384 C CB   . ALA Bxp B    231 ? 78.05  2.359   -1.321  1    68.434  ? 2312 B 1 .
ATOM 8385 H H    . ALA Bxp B    231 ? 77.952 3.732   -3.312  1    63.645  ? 2312 B 1 c
ATOM 8386 H HA   . ALA Bxp B    231 ? 79.571 1.731   -2.573  1    63.542  ? 2312 B 1 c
ATOM 8387 H HB3  . ALA Bxp B    231 ? 77.973 1.597   -0.722  1    66.849  ? 2312 B 1 c
ATOM 8388 H HB2  . ALA Bxp B    231 ? 77.173 2.761   -1.442  1    66.851  ? 2312 B 1 c
ATOM 8389 H HB1  . ALA Bxp B    231 ? 78.653 3.013   -0.93   1    66.847  ? 2312 B 1 c
ATOM 8390 N N    . GLN Bxp B    232 ? 78.676 -0.494  -3.104  1    56.55   ? 2313 B 1 .
ATOM 8391 C CA   . GLN Bxp B    232 ? 78.264 -1.82   -3.555  1    51.96   ? 2313 B 1 .
ATOM 8392 C C    . GLN Bxp B    232 ? 76.762 -1.935  -3.798  1    51.178  ? 2313 B 1 .
ATOM 8393 O O    . GLN Bxp B    232 ? 76.358 -2.224  -4.921  1    50.092  ? 2313 B 1 .
ATOM 8394 C CB   . GLN Bxp B    232 ? 78.775 -2.877  -2.577  1    54.543  ? 2313 B 1 .
ATOM 8395 C CG   . GLN Bxp B    232 ? 79.851 -3.783  -3.164  1    57.044  ? 2313 B 1 .
ATOM 8396 C CD   . GLN Bxp B    232 ? 79.243 -4.777  -4.129  1    64.003  ? 2313 B 1 .
ATOM 8397 O OE1  . GLN Bxp B    232 ? 78.675 -5.804  -3.736  1    70.743  ? 2313 B 1 .
ATOM 8398 N NE2  . GLN Bxp B    232 ? 79.319 -4.463  -5.413  1    65.644  ? 2313 B 1 .
ATOM 8399 H H    . GLN Bxp B    232 ? 79.525 -0.41   -2.775  1    56.201  ? 2313 B 1 c
ATOM 8400 H HA   . GLN Bxp B    232 ? 78.714 -1.986  -4.422  1    53.338  ? 2313 B 1 c
ATOM 8401 H HB3  . GLN Bxp B    232 ? 78.021 -3.43   -2.284  1    54.546  ? 2313 B 1 c
ATOM 8402 H HB2  . GLN Bxp B    232 ? 79.137 -2.428  -1.785  1    54.532  ? 2313 B 1 c
ATOM 8403 H HG3  . GLN Bxp B    232 ? 80.302 -4.269  -2.441  1    57.989  ? 2313 B 1 c
ATOM 8404 H HG2  . GLN Bxp B    232 ? 80.522 -3.24   -3.629  1    58.033  ? 2313 B 1 c
ATOM 8405 H HE21 . GLN Bxp B    232 ? 78.938 -4.988  -6.017  1    65.121  ? 2313 B 1 c
ATOM 8406 H HE22 . GLN Bxp B    232 ? 79.75  -3.732  -5.672  1    64.913  ? 2313 B 1 c
ATOM 8407 N N    . TRP Bxp B    233 ? 75.944 -1.763  -2.75   1    53.754  ? 2314 B 1 .
ATOM 8408 C CA   . TRP Bxp B    233 ? 74.495 -1.794  -2.908  1    54.18   ? 2314 B 1 .
ATOM 8409 C C    . TRP Bxp B    233 ? 73.876 -0.53   -2.331  1    53.265  ? 2314 B 1 .
ATOM 8410 O O    . TRP Bxp B    233 ? 72.947 -0.6    -1.544  1    54.327  ? 2314 B 1 .
ATOM 8411 C CB   . TRP Bxp B    233 ? 73.874 -3.042  -2.267  1    54.272  ? 2314 B 1 .
ATOM 8412 C CG   . TRP Bxp B    233 ? 74.565 -4.298  -2.698  1    55.659  ? 2314 B 1 .
ATOM 8413 C CD1  . TRP Bxp B    233 ? 75.631 -4.881  -2.087  1    58.5    ? 2314 B 1 .
ATOM 8414 C CD2  . TRP Bxp B    233 ? 74.305 -5.059  -3.889  1    59.967  ? 2314 B 1 .
ATOM 8415 N NE1  . TRP Bxp B    233 ? 76.028 -5.986  -2.79   1    62.478  ? 2314 B 1 .
ATOM 8416 C CE2  . TRP Bxp B    233 ? 75.244 -6.113  -3.906  1    65.393  ? 2314 B 1 .
ATOM 8417 C CE3  . TRP Bxp B    233 ? 73.382 -4.952  -4.933  1    65.345  ? 2314 B 1 .
ATOM 8418 C CZ2  . TRP Bxp B    233 ? 75.281 -7.059  -4.928  1    72.084  ? 2314 B 1 .
ATOM 8419 C CZ3  . TRP Bxp B    233 ? 73.432 -5.877  -5.953  1    72.704  ? 2314 B 1 .
ATOM 8420 C CH2  . TRP Bxp B    233 ? 74.367 -6.917  -5.949  1    74.08   ? 2314 B 1 .
ATOM 8421 H H    . TRP Bxp B    233 ? 76.296 -1.624  -1.918  1    53.155  ? 2314 B 1 c
ATOM 8422 H HA   . TRP Bxp B    233 ? 74.291 -1.82   -3.88   1    53.971  ? 2314 B 1 c
ATOM 8423 H HB3  . TRP Bxp B    233 ? 72.928 -3.092  -2.523  1    54.567  ? 2314 B 1 c
ATOM 8424 H HB2  . TRP Bxp B    233 ? 73.937 -2.961  -1.291  1    54.561  ? 2314 B 1 c
ATOM 8425 H HD1  . TRP Bxp B    233 ? 76.022 -4.593  -1.279  1    58.727  ? 2314 B 1 c
ATOM 8426 H HE1  . TRP Bxp B    233 ? 76.682 -6.513  -2.584  1    62.237  ? 2314 B 1 c
ATOM 8427 H HE3  . TRP Bxp B    233 ? 72.75  -4.254  -4.944  1    65.735  ? 2314 B 1 c
ATOM 8428 H HZ2  . TRP Bxp B    233 ? 75.919 -7.752  -4.931  1    70.801  ? 2314 B 1 c
ATOM 8429 H HZ3  . TRP Bxp B    233 ? 72.809 -5.82   -6.659  1    71.066  ? 2314 B 1 c
ATOM 8430 H HH2  . TRP Bxp B    233 ? 74.366 -7.54   -6.654  1    73.061  ? 2314 B 1 c
ATOM 8431 N N    . HIS Bxp B    234 ? 74.388 0.626   -2.742  1    55.232  ? 2315 B 1 .
ATOM 8432 C CA   . HIS Bxp B    234 ? 73.67  1.88    -2.582  1    55.097  ? 2315 B 1 .
ATOM 8433 C C    . HIS Bxp B    234 ? 73.211 2.03    -1.127  1    49.559  ? 2315 B 1 .
ATOM 8434 O O    . HIS Bxp B    234 ? 73.913 1.631   -0.199  1    48.403  ? 2315 B 1 .
ATOM 8435 C CB   . HIS Bxp B    234 ? 72.585 1.937   -3.667  1    57.487  ? 2315 B 1 .
ATOM 8436 C CG   . HIS Bxp B    234 ? 73.01  1.283   -4.942  1    61.219  ? 2315 B 1 .
ATOM 8437 N ND1  . HIS Bxp B    234 ? 72.784 -0.056  -5.185  1    69.565  ? 2315 B 1 .
ATOM 8438 C CD2  . HIS Bxp B    234 ? 73.65  1.741   -6.018  1    62.175  ? 2315 B 1 .
ATOM 8439 C CE1  . HIS Bxp B    234 ? 73.273 -0.389  -6.373  1    65.687  ? 2315 B 1 .
ATOM 8440 N NE2  . HIS Bxp B    234 ? 73.802 0.692   -6.894  1    66.559  ? 2315 B 1 .
ATOM 8441 H H    . HIS Bxp B    234 ? 75.208 0.639   -3.144  1    54.854  ? 2315 B 1 c
ATOM 8442 H HA   . HIS Bxp B    234 ? 74.315 2.605   -2.77   1    54.484  ? 2315 B 1 c
ATOM 8443 H HB3  . HIS Bxp B    234 ? 72.365 2.877   -3.846  1    57.705  ? 2315 B 1 c
ATOM 8444 H HB2  . HIS Bxp B    234 ? 71.779 1.487   -3.333  1    57.661  ? 2315 B 1 c
ATOM 8445 H HD1  . HIS Bxp B    234 ? 72.255 -0.598  -4.633  0    49.39   ? 2315 B 1 c
ATOM 8446 H HD2  . HIS Bxp B    234 ? 73.94  2.618   -6.167  1    62.993  ? 2315 B 1 c
ATOM 8447 H HE1  . HIS Bxp B    234 ? 73.242 -1.241  -6.772  1    66.688  ? 2315 B 1 c
ATOM 8448 H HE2  . HIS Bxp B    234 ? 74.185 0.586   -7.691  0    49.43   ? 2315 B 1 c
ATOM 8449 N N    . ASP Bxp B    235 ? 72.021 2.604   -0.926  1    49.32   ? 2316 B 1 .
ATOM 8450 C CA   . ASP Bxp B    235 ? 71.531 2.9     0.412   1    52.527  ? 2316 B 1 .
ATOM 8451 C C    . ASP Bxp B    235 ? 71.924 1.782   1.371   1    49.576  ? 2316 B 1 .
ATOM 8452 O O    . ASP Bxp B    235 ? 72.436 2.055   2.455   1    46.916  ? 2316 B 1 .
ATOM 8453 C CB   . ASP Bxp B    235 ? 70.028 3.176   0.462   1    53.595  ? 2316 B 1 .
ATOM 8454 C CG   . ASP Bxp B    235 ? 69.113 2.149   -0.19   1    51.803  ? 2316 B 1 .
ATOM 8455 O OD1  . ASP Bxp B    235 ? 69.646 1.174   -0.747  1    51.809  ? 2316 B 1 .
ATOM 8456 O OD2  . ASP Bxp B    235 ? 67.876 2.341   -0.142  1    53.639  ? 2316 B 1 .
ATOM 8457 H H    . ASP Bxp B    235 ? 71.502 2.832   -1.642  1    50.309  ? 2316 B 1 c
ATOM 8458 H HA   . ASP Bxp B    235 ? 71.972 3.725   0.715   1    51.506  ? 2316 B 1 c
ATOM 8459 H HB3  . ASP Bxp B    235 ? 69.847 4.053   0.068   1    52.848  ? 2316 B 1 c
ATOM 8460 H HB2  . ASP Bxp B    235 ? 69.772 3.228   1.406   1    52.799  ? 2316 B 1 c
ATOM 8461 N N    . GLU Bxp B    236 ? 71.683 0.535   0.946   1    46.915  ? 2317 B 1 .
ATOM 8462 C CA   . GLU Bxp B    236 ? 71.811 -0.641  1.795   1    44.501  ? 2317 B 1 .
ATOM 8463 C C    . GLU Bxp B    236 ? 73.222 -0.764  2.358   1    43.452  ? 2317 B 1 .
ATOM 8464 O O    . GLU Bxp B    236 ? 73.407 -1.068  3.535   1    40.984  ? 2317 B 1 .
ATOM 8465 C CB   . GLU Bxp B    236 ? 71.436 -1.881  0.985   1    42.131  ? 2317 B 1 .
ATOM 8466 C CG   . GLU Bxp B    236 ? 71.89  -3.192  1.614   1    40.873  ? 2317 B 1 .
ATOM 8467 C CD   . GLU Bxp B    236 ? 71.031 -4.337  1.136   1    39.979  ? 2317 B 1 .
ATOM 8468 O OE1  . GLU Bxp B    236 ? 69.831 -4.256  1.45    1    43.654  ? 2317 B 1 .
ATOM 8469 O OE2  . GLU Bxp B    236 ? 71.515 -5.271  0.467   1    37.661  ? 2317 B 1 .
ATOM 8470 H H    . GLU Bxp B    236 ? 71.409 0.414   0.083   1    46.984  ? 2317 B 1 c
ATOM 8471 H HA   . GLU Bxp B    236 ? 71.179 -0.548  2.55    1    44.233  ? 2317 B 1 c
ATOM 8472 H HB3  . GLU Bxp B    236 ? 71.839 -1.814  0.098   1    42.457  ? 2317 B 1 c
ATOM 8473 H HB2  . GLU Bxp B    236 ? 70.463 -1.894  0.869   1    42.339  ? 2317 B 1 c
ATOM 8474 H HG3  . GLU Bxp B    236 ? 71.825 -3.13   2.591   1    40.956  ? 2317 B 1 c
ATOM 8475 H HG2  . GLU Bxp B    236 ? 72.823 -3.367  1.372   1    40.944  ? 2317 B 1 c
ATOM 8476 N N    . SER Bxp B    237 ? 74.217 -0.527  1.509   1    45.82   ? 2318 B 1 .
ATOM 8477 C CA   . SER Bxp B    237 ? 75.588 -0.718  1.939   1    47.507  ? 2318 B 1 .
ATOM 8478 C C    . SER Bxp B    237 ? 76.017 0.375   2.916   1    44.465  ? 2318 B 1 .
ATOM 8479 O O    . SER Bxp B    237 ? 77.074 0.246   3.53    1    48.492  ? 2318 B 1 .
ATOM 8480 C CB   . SER Bxp B    237 ? 76.518 -0.858  0.768   1    48.294  ? 2318 B 1 .
ATOM 8481 O OG   . SER Bxp B    237 ? 76.534 -2.218  0.352   1    50.335  ? 2318 B 1 .
ATOM 8482 H H    . SER Bxp B    237 ? 74.046 -0.248  0.655   1    45.655  ? 2318 B 1 c
ATOM 8483 H HA   . SER Bxp B    237 ? 75.618 -1.575  2.436   1    46.718  ? 2318 B 1 c
ATOM 8484 H HB3  . SER Bxp B    237 ? 77.418 -0.583  1.026   1    48.564  ? 2318 B 1 c
ATOM 8485 H HB2  . SER Bxp B    237 ? 76.215 -0.291  0.034   1    48.576  ? 2318 B 1 c
ATOM 8486 H HG   . SER Bxp B    237 ? 77.018 -2.295  -0.282  0    35.81   ? 2318 B 1 c
ATOM 8487 N N    . HIS Bxp B    238 ? 75.181 1.404   3.098   1    41.082  ? 2319 B 1 .
ATOM 8488 C CA   . HIS Bxp B    238 ? 75.438 2.431   4.094   1    42.478  ? 2319 B 1 .
ATOM 8489 C C    . HIS Bxp B    238 ? 74.681 2.116   5.379   1    42.755  ? 2319 B 1 .
ATOM 8490 O O    . HIS Bxp B    238 ? 75.259 2.126   6.457   1    46.357  ? 2319 B 1 .
ATOM 8491 C CB   . HIS Bxp B    238 ? 75.01  3.811   3.593   1    43.366  ? 2319 B 1 .
ATOM 8492 C CG   . HIS Bxp B    238 ? 75.812 4.359   2.468   1    41.05   ? 2319 B 1 .
ATOM 8493 N ND1  . HIS Bxp B    238 ? 76.781 5.313   2.687   1    37.633  ? 2319 B 1 .
ATOM 8494 C CD2  . HIS Bxp B    238 ? 75.761 4.145   1.139   1    40.918  ? 2319 B 1 .
ATOM 8495 C CE1  . HIS Bxp B    238 ? 77.31  5.641   1.516   1    41.575  ? 2319 B 1 .
ATOM 8496 N NE2  . HIS Bxp B    238 ? 76.708 4.943   0.56    1    41.915  ? 2319 B 1 .
ATOM 8497 H H    . HIS Bxp B    238 ? 74.442 1.486   2.569   1    42.287  ? 2319 B 1 c
ATOM 8498 H HA   . HIS Bxp B    238 ? 76.406 2.449   4.297   1    42.481  ? 2319 B 1 c
ATOM 8499 H HB3  . HIS Bxp B    238 ? 75.052 4.441   4.344   1    42.797  ? 2319 B 1 c
ATOM 8500 H HB2  . HIS Bxp B    238 ? 74.071 3.764   3.314   1    42.666  ? 2319 B 1 c
ATOM 8501 H HD1  . HIS Bxp B    238 ? 76.974 5.593   3.438   0    31.27   ? 2319 B 1 c
ATOM 8502 H HD2  . HIS Bxp B    238 ? 75.194 3.552   0.687   1    41.215  ? 2319 B 1 c
ATOM 8503 H HE1  . HIS Bxp B    238 ? 78.005 6.263   1.39    1    40.765  ? 2319 B 1 c
ATOM 8504 H HE2  . HIS Bxp B    238 ? 76.881 4.985   -0.324  0    32.36   ? 2319 B 1 c
ATOM 8505 N N    . LEU Bxp B    239 ? 73.378 1.863   5.247   1    41.915  ? 2320 B 1 .
ATOM 8506 C CA   . LEU Bxp B    239 ? 72.55  1.36    6.33    1    40.846  ? 2320 B 1 .
ATOM 8507 C C    . LEU Bxp B    239 ? 73.267 0.274   7.129   1    44.347  ? 2320 B 1 .
ATOM 8508 O O    . LEU Bxp B    239 ? 73.103 0.196   8.347   1    46.25   ? 2320 B 1 .
ATOM 8509 C CB   . LEU Bxp B    239 ? 71.278 0.803   5.702   1    37.907  ? 2320 B 1 .
ATOM 8510 C CG   . LEU Bxp B    239 ? 70.291 0.162   6.671   1    35.67   ? 2320 B 1 .
ATOM 8511 C CD1  . LEU Bxp B    239 ? 69.572 1.215   7.46    1    34.248  ? 2320 B 1 .
ATOM 8512 C CD2  . LEU Bxp B    239 ? 69.343 -0.676  5.875   1    37.694  ? 2320 B 1 .
ATOM 8513 H H    . LEU Bxp B    239 ? 72.984 2.015   4.436   1    41.821  ? 2320 B 1 c
ATOM 8514 H HA   . LEU Bxp B    239 ? 72.322 2.11    6.934   1    41.066  ? 2320 B 1 c
ATOM 8515 H HB3  . LEU Bxp B    239 ? 71.537 0.132   5.029   1    38.032  ? 2320 B 1 c
ATOM 8516 H HB2  . LEU Bxp B    239 ? 70.82  1.538   5.231   1    38.01   ? 2320 B 1 c
ATOM 8517 H HG   . LEU Bxp B    239 ? 70.787 -0.426  7.296   1    36.256  ? 2320 B 1 c
ATOM 8518 H HD11 . LEU Bxp B    239 ? 70.211 1.707   8.002   1    34.713  ? 2320 B 1 c
ATOM 8519 H HD12 . LEU Bxp B    239 ? 68.914 0.794   8.04    1    34.682  ? 2320 B 1 c
ATOM 8520 H HD13 . LEU Bxp B    239 ? 69.123 1.827   6.853   1    34.698  ? 2320 B 1 c
ATOM 8521 H HD21 . LEU Bxp B    239 ? 69.816 -1.44   5.503   1    37.074  ? 2320 B 1 c
ATOM 8522 H HD22 . LEU Bxp B    239 ? 68.97  -0.145  5.152   1    37.042  ? 2320 B 1 c
ATOM 8523 H HD23 . LEU Bxp B    239 ? 68.624 -0.99   6.449   1    37.069  ? 2320 B 1 c
ATOM 8524 N N    . ASN Bxp B    240 ? 74.037 -0.58   6.438   1    44.349  ? 2321 B 1 .
ATOM 8525 C CA   . ASN Bxp B    240 ? 74.784 -1.634  7.106   1    42.974  ? 2321 B 1 .
ATOM 8526 C C    . ASN Bxp B    240 ? 75.951 -1.059  7.89    1    42.371  ? 2321 B 1 .
ATOM 8527 O O    . ASN Bxp B    240 ? 76.196 -1.488  9.015   1    39.912  ? 2321 B 1 .
ATOM 8528 C CB   . ASN Bxp B    240 ? 75.304 -2.673  6.13    1    43.784  ? 2321 B 1 .
ATOM 8529 C CG   . ASN Bxp B    240 ? 74.373 -3.85   6.064   1    45.013  ? 2321 B 1 .
ATOM 8530 O OD1  . ASN Bxp B    240 ? 74.261 -4.589  7.051   1    48.553  ? 2321 B 1 .
ATOM 8531 N ND2  . ASN Bxp B    240 ? 73.709 -4.026  4.929   1    44.213  ? 2321 B 1 .
ATOM 8532 H H    . ASN Bxp B    240 ? 74.081 -0.516  5.528   1    43.988  ? 2321 B 1 c
ATOM 8533 H HA   . ASN Bxp B    240 ? 74.179 -2.089  7.735   1    43.311  ? 2321 B 1 c
ATOM 8534 H HB3  . ASN Bxp B    240 ? 76.188 -2.977  6.418   1    43.87   ? 2321 B 1 c
ATOM 8535 H HB2  . ASN Bxp B    240 ? 75.392 -2.274  5.242   1    43.885  ? 2321 B 1 c
ATOM 8536 H HD21 . ASN Bxp B    240 ? 73.308 -4.801  4.771   1    44.439  ? 2321 B 1 c
ATOM 8537 H HD22 . ASN Bxp B    240 ? 73.661 -3.372  4.332   1    44.444  ? 2321 B 1 c
ATOM 8538 N N    . LYS Bxp B    241 ? 76.673 -0.123  7.258   1    43.706  ? 2322 B 1 .
ATOM 8539 C CA   . LYS Bxp B    241 ? 77.696 0.651   7.94    1    46.121  ? 2322 B 1 .
ATOM 8540 C C    . LYS Bxp B    241 ? 77.046 1.38    9.108   1    44.045  ? 2322 B 1 .
ATOM 8541 O O    . LYS Bxp B    241 ? 77.599 1.403   10.199  1    47.873  ? 2322 B 1 .
ATOM 8542 C CB   . LYS Bxp B    241 ? 78.435 1.646   7.034   1    49.803  ? 2322 B 1 .
ATOM 8543 C CG   . LYS Bxp B    241 ? 79.932 1.842   7.33    1    55.302  ? 2322 B 1 .
ATOM 8544 C CD   . LYS Bxp B    241 ? 80.339 2.678   8.539   1    56.766  ? 2322 B 1 .
ATOM 8545 C CE   . LYS Bxp B    241 ? 81.829 2.723   8.733   1    61.249  ? 2322 B 1 .
ATOM 8546 N NZ   . LYS Bxp B    241 ? 82.545 3.323   7.599   1    64.424  ? 2322 B 1 .
ATOM 8547 H H    . LYS Bxp B    241 ? 76.523 0.033   6.37    1    43.994  ? 2322 B 1 c
ATOM 8548 H HA   . LYS Bxp B    241 ? 78.363 0.017   8.306   1    46.111  ? 2322 B 1 c
ATOM 8549 H HB3  . LYS Bxp B    241 ? 77.993 2.518   7.103   1    50.074  ? 2322 B 1 c
ATOM 8550 H HB2  . LYS Bxp B    241 ? 78.346 1.344   6.105   1    50.067  ? 2322 B 1 c
ATOM 8551 H HG3  . LYS Bxp B    241 ? 80.337 2.247   6.535   1    54.371  ? 2322 B 1 c
ATOM 8552 H HG2  . LYS Bxp B    241 ? 80.335 0.952   7.426   1    54.314  ? 2322 B 1 c
ATOM 8553 H HD3  . LYS Bxp B    241 ? 79.923 2.3     9.344   1    57.375  ? 2322 B 1 c
ATOM 8554 H HD2  . LYS Bxp B    241 ? 80.003 3.593   8.424   1    57.419  ? 2322 B 1 c
ATOM 8555 H HE3  . LYS Bxp B    241 ? 82.16  1.818   8.871   1    60.846  ? 2322 B 1 c
ATOM 8556 H HE2  . LYS Bxp B    241 ? 82.029 3.237   9.535   1    60.814  ? 2322 B 1 c
ATOM 8557 H HZ1  . LYS Bxp B    241 ? 82.094 4.051   7.302   1    63.355  ? 2322 B 1 c
ATOM 8558 H HZ2  . LYS Bxp B    241 ? 82.617 2.723   6.927   1    63.274  ? 2322 B 1 c
ATOM 8559 H HZ3  . LYS Bxp B    241 ? 83.374 3.575   7.862   1    63.386  ? 2322 B 1 c
ATOM 8560 N N    . TYR Bxp B    242 ? 75.864 1.957   8.885   1    42.049  ? 2323 B 1 .
ATOM 8561 C CA   . TYR Bxp B    242 ? 75.184 2.663   9.954   1    39.563  ? 2323 B 1 .
ATOM 8562 C C    . TYR Bxp B    242 ? 74.921 1.675   11.086  1    41.231  ? 2323 B 1 .
ATOM 8563 O O    . TYR Bxp B    242 ? 75.239 1.96    12.238  1    45.885  ? 2323 B 1 .
ATOM 8564 C CB   . TYR Bxp B    242 ? 73.88  3.339   9.528   1    36.868  ? 2323 B 1 .
ATOM 8565 C CG   . TYR Bxp B    242 ? 73.094 3.876   10.718  1    34.144  ? 2323 B 1 .
ATOM 8566 C CD1  . TYR Bxp B    242 ? 72.306 3.028   11.489  1    33.69   ? 2323 B 1 .
ATOM 8567 C CD2  . TYR Bxp B    242 ? 73.144 5.221   11.073  1    32.192  ? 2323 B 1 .
ATOM 8568 C CE1  . TYR Bxp B    242 ? 71.608 3.501   12.587  1    34.324  ? 2323 B 1 .
ATOM 8569 C CE2  . TYR Bxp B    242 ? 72.443 5.708   12.165  1    32.141  ? 2323 B 1 .
ATOM 8570 C CZ   . TYR Bxp B    242 ? 71.673 4.843   12.927  1    32.955  ? 2323 B 1 .
ATOM 8571 O OH   . TYR Bxp B    242 ? 70.953 5.281   14.004  1    30.378  ? 2323 B 1 .
ATOM 8572 H H    . TYR Bxp B    242 ? 75.479 1.919   8.057   1    41.957  ? 2323 B 1 c
ATOM 8573 H HA   . TYR Bxp B    242 ? 75.798 3.367   10.294  1    39.913  ? 2323 B 1 c
ATOM 8574 H HB3  . TYR Bxp B    242 ? 73.327 2.687   9.044   1    36.861  ? 2323 B 1 c
ATOM 8575 H HB2  . TYR Bxp B    242 ? 74.091 4.081   8.92    1    36.824  ? 2323 B 1 c
ATOM 8576 H HD1  . TYR Bxp B    242 ? 72.259 2.111   11.272  1    33.995  ? 2323 B 1 c
ATOM 8577 H HD2  . TYR Bxp B    242 ? 73.676 5.814   10.565  1    32.757  ? 2323 B 1 c
ATOM 8578 H HE1  . TYR Bxp B    242 ? 71.077 2.913   13.096  1    33.82   ? 2323 B 1 c
ATOM 8579 H HE2  . TYR Bxp B    242 ? 72.491 6.621   12.391  1    32.365  ? 2323 B 1 c
ATOM 8580 H HH   . TYR Bxp B    242 ? 70.538 4.579   14.402  0    29.32   ? 2323 B 1 c
ATOM 8581 N N    . PHE Bxp B    243 ? 74.357 0.511   10.754  1    39.816  ? 2324 B 1 .
ATOM 8582 C CA   . PHE Bxp B    243 ? 73.922 -0.427  11.778  1    40.643  ? 2324 B 1 .
ATOM 8583 C C    . PHE Bxp B    243 ? 75.109 -1.074  12.486  1    42.232  ? 2324 B 1 .
ATOM 8584 O O    . PHE Bxp B    243 ? 74.944 -1.645  13.57   1    39.624  ? 2324 B 1 .
ATOM 8585 C CB   . PHE Bxp B    243 ? 73.012 -1.52   11.212  1    40.883  ? 2324 B 1 .
ATOM 8586 C CG   . PHE Bxp B    243 ? 71.543 -1.142  11.193  1    36.479  ? 2324 B 1 .
ATOM 8587 C CD1  . PHE Bxp B    243 ? 71.01  -0.347  12.198  1    36.634  ? 2324 B 1 .
ATOM 8588 C CD2  . PHE Bxp B    243 ? 70.724 -1.562  10.164  1    34.753  ? 2324 B 1 .
ATOM 8589 C CE1  . PHE Bxp B    243 ? 69.684 0.009   12.18   1    36.336  ? 2324 B 1 .
ATOM 8590 C CE2  . PHE Bxp B    243 ? 69.397 -1.207  10.153  1    36.563  ? 2324 B 1 .
ATOM 8591 C CZ   . PHE Bxp B    243 ? 68.882 -0.425  11.161  1    37.195  ? 2324 B 1 .
ATOM 8592 H H    . PHE Bxp B    243 ? 74.236 0.297   9.874   1    40.359  ? 2324 B 1 c
ATOM 8593 H HA   . PHE Bxp B    243 ? 73.412 0.083   12.451  1    40.724  ? 2324 B 1 c
ATOM 8594 H HB3  . PHE Bxp B    243 ? 73.12  -2.328  11.759  1    39.854  ? 2324 B 1 c
ATOM 8595 H HB2  . PHE Bxp B    243 ? 73.301 -1.731  10.297  1    39.768  ? 2324 B 1 c
ATOM 8596 H HD1  . PHE Bxp B    243 ? 71.558 -0.053  12.905  1    36.612  ? 2324 B 1 c
ATOM 8597 H HD2  . PHE Bxp B    243 ? 71.076 -2.1    9.472   1    35.621  ? 2324 B 1 c
ATOM 8598 H HE1  . PHE Bxp B    243 ? 69.327 0.542   12.872  1    36.605  ? 2324 B 1 c
ATOM 8599 H HE2  . PHE Bxp B    243 ? 68.838 -1.499  9.451   1    36.289  ? 2324 B 1 c
ATOM 8600 H HZ   . PHE Bxp B    243 ? 67.97  -0.183  11.146  1    36.83   ? 2324 B 1 c
ATOM 8601 N N    . LEU Bxp B    244 ? 76.284 -1.02   11.837  1    43.527  ? 2325 B 1 .
ATOM 8602 C CA   . LEU Bxp B    244 ? 77.517 -1.492  12.442  1    42.437  ? 2325 B 1 .
ATOM 8603 C C    . LEU Bxp B    244 ? 77.876 -0.545  13.573  1    42.304  ? 2325 B 1 .
ATOM 8604 O O    . LEU Bxp B    244 ? 77.936 -0.96   14.728  1    44.733  ? 2325 B 1 .
ATOM 8605 C CB   . LEU Bxp B    244 ? 78.655 -1.558  11.431  1    42.202  ? 2325 B 1 .
ATOM 8606 C CG   . LEU Bxp B    244 ? 80.005 -1.984  12.009  1    43.621  ? 2325 B 1 .
ATOM 8607 C CD1  . LEU Bxp B    244 ? 80.029 -3.5    12.162  1    44.032  ? 2325 B 1 .
ATOM 8608 C CD2  . LEU Bxp B    244 ? 81.159 -1.468  11.168  1    45.047  ? 2325 B 1 .
ATOM 8609 H H    . LEU Bxp B    244 ? 76.312 -0.698  10.983  1    42.916  ? 2325 B 1 c
ATOM 8610 H HA   . LEU Bxp B    244 ? 77.359 -2.396  12.817  1    42.575  ? 2325 B 1 c
ATOM 8611 H HB3  . LEU Bxp B    244 ? 78.757 -0.67   11.018  1    42.633  ? 2325 B 1 c
ATOM 8612 H HB2  . LEU Bxp B    244 ? 78.401 -2.191  10.72   1    42.603  ? 2325 B 1 c
ATOM 8613 H HG   . LEU Bxp B    244 ? 80.094 -1.589  12.914  1    43.687  ? 2325 B 1 c
ATOM 8614 H HD11 . LEU Bxp B    244 ? 79.628 -3.747  13.013  1    43.927  ? 2325 B 1 c
ATOM 8615 H HD12 . LEU Bxp B    244 ? 80.948 -3.815  12.134  1    43.954  ? 2325 B 1 c
ATOM 8616 H HD13 . LEU Bxp B    244 ? 79.525 -3.906  11.438  1    43.953  ? 2325 B 1 c
ATOM 8617 H HD21 . LEU Bxp B    244 ? 81.055 -0.513  11.023  1    44.699  ? 2325 B 1 c
ATOM 8618 H HD22 . LEU Bxp B    244 ? 81.169 -1.926  10.312  1    44.899  ? 2325 B 1 c
ATOM 8619 H HD23 . LEU Bxp B    244 ? 81.998 -1.634  11.631  1    44.821  ? 2325 B 1 c
ATOM 8620 N N    . LEU Bxp B    245 ? 78.064 0.726   13.194  1    42.417  ? 2326 B 1 .
ATOM 8621 C CA   . LEU Bxp B    245 ? 78.463 1.804   14.086  1    43.201  ? 2326 B 1 .
ATOM 8622 C C    . LEU Bxp B    245 ? 77.372 2.098   15.109  1    41.619  ? 2326 B 1 .
ATOM 8623 O O    . LEU Bxp B    245 ? 77.672 2.597   16.19   1    45.105  ? 2326 B 1 .
ATOM 8624 C CB   . LEU Bxp B    245 ? 78.735 3.05    13.249  1    44.84   ? 2326 B 1 .
ATOM 8625 C CG   . LEU Bxp B    245 ? 80.097 3.124   12.556  1    47.653  ? 2326 B 1 .
ATOM 8626 C CD1  . LEU Bxp B    245 ? 80.044 4.303   11.602  1    48.261  ? 2326 B 1 .
ATOM 8627 C CD2  . LEU Bxp B    245 ? 81.268 3.26    13.535  1    49.491  ? 2326 B 1 .
ATOM 8628 H H    . LEU Bxp B    245 ? 77.925 0.934   12.315  1    42.607  ? 2326 B 1 c
ATOM 8629 H HA   . LEU Bxp B    245 ? 79.29  1.534   14.561  1    43.106  ? 2326 B 1 c
ATOM 8630 H HB3  . LEU Bxp B    245 ? 78.645 3.838   13.834  1    45.059  ? 2326 B 1 c
ATOM 8631 H HB2  . LEU Bxp B    245 ? 78.033 3.119   12.562  1    45.076  ? 2326 B 1 c
ATOM 8632 H HG   . LEU Bxp B    245 ? 80.225 2.296   12.026  1    47.562  ? 2326 B 1 c
ATOM 8633 H HD11 . LEU Bxp B    245 ? 79.417 4.112   10.884  1    48.112  ? 2326 B 1 c
ATOM 8634 H HD12 . LEU Bxp B    245 ? 80.927 4.458   11.227  1    48.164  ? 2326 B 1 c
ATOM 8635 H HD13 . LEU Bxp B    245 ? 79.753 5.097   12.082  1    48.085  ? 2326 B 1 c
ATOM 8636 H HD21 . LEU Bxp B    245 ? 81.415 2.412   13.986  1    48.901  ? 2326 B 1 c
ATOM 8637 H HD22 . LEU Bxp B    245 ? 81.063 3.945   14.194  1    48.934  ? 2326 B 1 c
ATOM 8638 H HD23 . LEU Bxp B    245 ? 82.071 3.51    13.048  1    48.93   ? 2326 B 1 c
ATOM 8639 N N    . ASN Bxp B    246 ? 76.118 1.846   14.719  1    38.261  ? 2327 B 1 .
ATOM 8640 C CA   . ASN Bxp B    246 ? 74.957 2.05    15.565  1    37.957  ? 2327 B 1 .
ATOM 8641 C C    . ASN Bxp B    246 ? 74.069 0.815   15.562  1    39.121  ? 2327 B 1 .
ATOM 8642 O O    . ASN Bxp B    246 ? 73.195 0.647   14.704  1    36.822  ? 2327 B 1 .
ATOM 8643 C CB   . ASN Bxp B    246 ? 74.135 3.22    15.068  1    39.186  ? 2327 B 1 .
ATOM 8644 C CG   . ASN Bxp B    246 ? 74.842 4.501   15.373  1    38.128  ? 2327 B 1 .
ATOM 8645 O OD1  . ASN Bxp B    246 ? 74.73  5.012   16.494  1    41.537  ? 2327 B 1 .
ATOM 8646 N ND2  . ASN Bxp B    246 ? 75.58  4.994   14.396  1    38.095  ? 2327 B 1 .
ATOM 8647 H H    . ASN Bxp B    246 ? 75.978 1.542   13.869  1    39.033  ? 2327 B 1 c
ATOM 8648 H HA   . ASN Bxp B    246 ? 75.252 2.246   16.483  1    38.52   ? 2327 B 1 c
ATOM 8649 H HB3  . ASN Bxp B    246 ? 73.26  3.218   15.506  1    38.653  ? 2327 B 1 c
ATOM 8650 H HB2  . ASN Bxp B    246 ? 73.999 3.142   14.103  1    38.662  ? 2327 B 1 c
ATOM 8651 H HD21 . ASN Bxp B    246 ? 75.569 5.866   14.23   1    38.111  ? 2327 B 1 c
ATOM 8652 H HD22 . ASN Bxp B    246 ? 76.085 4.454   13.906  1    38.131  ? 2327 B 1 c
ATOM 8653 N N    . LYS Bxp B    247 ? 74.287 -0.025  16.57   1    39.993  ? 2328 B 1 .
ATOM 8654 C CA   . LYS Bxp B    247 ? 73.749 -1.365  16.548  1    40.065  ? 2328 B 1 .
ATOM 8655 C C    . LYS Bxp B    247 ? 72.259 -1.273  16.83   1    34.635  ? 2328 B 1 .
ATOM 8656 O O    . LYS Bxp B    247 ? 71.835 -0.537  17.704  1    33.454  ? 2328 B 1 .
ATOM 8657 C CB   . LYS Bxp B    247 ? 74.531 -2.277  17.499  1    44.972  ? 2328 B 1 .
ATOM 8658 C CG   . LYS Bxp B    247 ? 76.027 -2.304  17.202  1    49.041  ? 2328 B 1 .
ATOM 8659 C CD   . LYS Bxp B    247 ? 76.788 -3.498  17.764  1    52.3    ? 2328 B 1 .
ATOM 8660 C CE   . LYS Bxp B    247 ? 78.266 -3.384  17.571  1    52.939  ? 2328 B 1 .
ATOM 8661 N NZ   . LYS Bxp B    247 ? 78.587 -3.213  16.153  1    52.094  ? 2328 B 1 .
ATOM 8662 H H    . LYS Bxp B    247 ? 74.778 0.246   17.291  1    39.852  ? 2328 B 1 c
ATOM 8663 H HA   . LYS Bxp B    247 ? 73.872 -1.72   15.638  1    39.645  ? 2328 B 1 c
ATOM 8664 H HB3  . LYS Bxp B    247 ? 74.181 -3.188  17.427  1    44.634  ? 2328 B 1 c
ATOM 8665 H HB2  . LYS Bxp B    247 ? 74.397 -1.972  18.422  1    44.677  ? 2328 B 1 c
ATOM 8666 H HG3  . LYS Bxp B    247 ? 76.425 -1.481  17.56   1    48.777  ? 2328 B 1 c
ATOM 8667 H HG2  . LYS Bxp B    247 ? 76.144 -2.286  16.227  1    48.73   ? 2328 B 1 c
ATOM 8668 H HD3  . LYS Bxp B    247 ? 76.471 -4.313  17.32   1    51.659  ? 2328 B 1 c
ATOM 8669 H HD2  . LYS Bxp B    247 ? 76.595 -3.579  18.723  1    51.683  ? 2328 B 1 c
ATOM 8670 H HE3  . LYS Bxp B    247 ? 78.704 -4.188  17.904  1    52.592  ? 2328 B 1 c
ATOM 8671 H HE2  . LYS Bxp B    247 ? 78.605 -2.62   18.07   1    52.592  ? 2328 B 1 c
ATOM 8672 H HZ1  . LYS Bxp B    247 ? 78.531 -2.338  15.927  1    52.331  ? 2328 B 1 c
ATOM 8673 H HZ2  . LYS Bxp B    247 ? 78.011 -3.691  15.641  1    52.328  ? 2328 B 1 c
ATOM 8674 H HZ3  . LYS Bxp B    247 ? 79.43  -3.504  15.996  1    52.344  ? 2328 B 1 c
ATOM 8675 N N    . PRO Bxp B    248 ? 71.444 -2.011  16.06   1    33.366  ? 2329 B 1 .
ATOM 8676 C CA   . PRO Bxp B    248 ? 69.997 -2.016  16.226  1    33.403  ? 2329 B 1 .
ATOM 8677 C C    . PRO Bxp B    248 ? 69.537 -2.618  17.548  1    32.592  ? 2329 B 1 .
ATOM 8678 O O    . PRO Bxp B    248 ? 70.066 -3.642  17.947  1    33.524  ? 2329 B 1 .
ATOM 8679 C CB   . PRO Bxp B    248 ? 69.53  -2.882  15.059  1    33.683  ? 2329 B 1 .
ATOM 8680 C CG   . PRO Bxp B    248 ? 70.735 -3.762  14.749  1    33.604  ? 2329 B 1 .
ATOM 8681 C CD   . PRO Bxp B    248 ? 71.911 -2.894  14.981  1    34.081  ? 2329 B 1 .
ATOM 8682 H HA   . PRO Bxp B    248 ? 69.65  -1.105  16.133  1    33.307  ? 2329 B 1 c
ATOM 8683 H HB3  . PRO Bxp B    248 ? 69.293 -2.329  14.29   1    33.607  ? 2329 B 1 c
ATOM 8684 H HB2  . PRO Bxp B    248 ? 68.758 -3.423  15.312  1    33.604  ? 2329 B 1 c
ATOM 8685 H HG3  . PRO Bxp B    248 ? 70.712 -4.07   13.821  1    33.745  ? 2329 B 1 c
ATOM 8686 H HG2  . PRO Bxp B    248 ? 70.757 -4.539  15.339  1    33.769  ? 2329 B 1 c
ATOM 8687 H HD3  . PRO Bxp B    248 ? 72.684 -3.419  15.264  1    33.886  ? 2329 B 1 c
ATOM 8688 H HD2  . PRO Bxp B    248 ? 72.14  -2.38   14.182  1    33.855  ? 2329 B 1 c
ATOM 8689 N N    . THR Bxp B    249 ? 68.526 -2.019  18.188  1    32.539  ? 2330 B 1 .
ATOM 8690 C CA   . THR Bxp B    249 ? 67.982 -2.552  19.426  1    34.724  ? 2330 B 1 .
ATOM 8691 C C    . THR Bxp B    249 ? 67.221 -3.862  19.201  1    35.428  ? 2330 B 1 .
ATOM 8692 O O    . THR Bxp B    249 ? 67.208 -4.708  20.089  1    40.597  ? 2330 B 1 .
ATOM 8693 C CB   . THR Bxp B    249 ? 67.088 -1.524  20.113  1    37.27   ? 2330 B 1 .
ATOM 8694 O OG1  . THR Bxp B    249 ? 66.243 -0.934  19.133  1    37.392  ? 2330 B 1 .
ATOM 8695 C CG2  . THR Bxp B    249 ? 67.917 -0.468  20.815  1    39.847  ? 2330 B 1 .
ATOM 8696 H H    . THR Bxp B    249 ? 68.164 -1.254  17.841  1    33.064  ? 2330 B 1 c
ATOM 8697 H HA   . THR Bxp B    249 ? 68.737 -2.741  20.026  1    34.898  ? 2330 B 1 c
ATOM 8698 H HB   . THR Bxp B    249 ? 66.528 -1.979  20.787  1    37.265  ? 2330 B 1 c
ATOM 8699 H HG1  . THR Bxp B    249 ? 66.751 -0.507  18.54   0    22.14   ? 2330 B 1 c
ATOM 8700 H HG21 . THR Bxp B    249 ? 67.329 0.155   21.274  1    38.994  ? 2330 B 1 c
ATOM 8701 H HG22 . THR Bxp B    249 ? 68.451 0.014   20.162  1    39.043  ? 2330 B 1 c
ATOM 8702 H HG23 . THR Bxp B    249 ? 68.504 -0.893  21.463  1    39.019  ? 2330 B 1 c
ATOM 8703 N N    . LYS Bxp B    250 ? 66.535 -4.013  18.064  1    33.066  ? 2331 B 1 .
ATOM 8704 C CA   . LYS Bxp B    250 ? 65.865 -5.26   17.728  1    32.216  ? 2331 B 1 .
ATOM 8705 C C    . LYS Bxp B    250 ? 66.369 -5.686  16.364  1    31.927  ? 2331 B 1 .
ATOM 8706 O O    . LYS Bxp B    250 ? 66.856 -4.856  15.614  1    34.632  ? 2331 B 1 .
ATOM 8707 C CB   . LYS Bxp B    250 ? 64.342 -5.102  17.641  1    32.712  ? 2331 B 1 .
ATOM 8708 C CG   . LYS Bxp B    250 ? 63.523 -6.386  17.703  1    31.401  ? 2331 B 1 .
ATOM 8709 C CD   . LYS Bxp B    250 ? 62.023 -6.114  17.71   1    31.355  ? 2331 B 1 .
ATOM 8710 C CE   . LYS Bxp B    250 ? 61.301 -6.32   19.009  1    31.604  ? 2331 B 1 .
ATOM 8711 N NZ   . LYS Bxp B    250 ? 61.666 -5.505  20.164  1    32.13   ? 2331 B 1 .
ATOM 8712 H H    . LYS Bxp B    250 ? 66.477 -3.312  17.48   1    33.411  ? 2331 B 1 c
ATOM 8713 H HA   . LYS Bxp B    250 ? 66.102 -5.952  18.396  1    32.484  ? 2331 B 1 c
ATOM 8714 H HB3  . LYS Bxp B    250 ? 64.126 -4.643  16.802  1    32.302  ? 2331 B 1 c
ATOM 8715 H HB2  . LYS Bxp B    250 ? 64.052 -4.52   18.376  1    32.296  ? 2331 B 1 c
ATOM 8716 H HG3  . LYS Bxp B    250 ? 63.766 -6.879  18.515  1    31.704  ? 2331 B 1 c
ATOM 8717 H HG2  . LYS Bxp B    250 ? 63.747 -6.943  16.927  1    31.688  ? 2331 B 1 c
ATOM 8718 H HD3  . LYS Bxp B    250 ? 61.612 -6.691  17.032  1    31.402  ? 2331 B 1 c
ATOM 8719 H HD2  . LYS Bxp B    250 ? 61.881 -5.187  17.42   1    31.383  ? 2331 B 1 c
ATOM 8720 H HE3  . LYS Bxp B    250 ? 61.398 -7.254  19.255  1    31.718  ? 2331 B 1 c
ATOM 8721 H HE2  . LYS Bxp B    250 ? 60.357 -6.16   18.842  1    31.624  ? 2331 B 1 c
ATOM 8722 H HZ1  . LYS Bxp B    250 ? 61.653 -4.628  19.937  1    31.974  ? 2331 B 1 c
ATOM 8723 H HZ2  . LYS Bxp B    250 ? 62.498 -5.727  20.445  1    31.974  ? 2331 B 1 c
ATOM 8724 H HZ3  . LYS Bxp B    250 ? 61.076 -5.646  20.837  1    31.996  ? 2331 B 1 c
ATOM 8725 N N    . ILE Bxp B    251 ? 66.271 -6.97   16.044  1    31.431  ? 2332 B 1 .
ATOM 8726 C CA   . ILE Bxp B    251 ? 66.594 -7.396  14.699  1    32.711  ? 2332 B 1 .
ATOM 8727 C C    . ILE Bxp B    251 ? 65.529 -8.377  14.248  1    34.904  ? 2332 B 1 .
ATOM 8728 O O    . ILE Bxp B    251 ? 65.101 -9.234  15.016  1    37.215  ? 2332 B 1 .
ATOM 8729 C CB   . ILE Bxp B    251 ? 67.993 -8.019  14.6    1    31.553  ? 2332 B 1 .
ATOM 8730 C CG1  . ILE Bxp B    251 ? 69.076 -6.972  14.696  1    31.098  ? 2332 B 1 .
ATOM 8731 C CG2  . ILE Bxp B    251 ? 68.119 -8.819  13.303  1    32.7    ? 2332 B 1 .
ATOM 8732 C CD1  . ILE Bxp B    251 ? 70.474 -7.549  14.827  1    32.228  ? 2332 B 1 .
ATOM 8733 H H    . ILE Bxp B    251 ? 66.007 -7.586  16.665  1    31.858  ? 2332 B 1 c
ATOM 8734 H HA   . ILE Bxp B    251 ? 66.565 -6.618  14.112  1    32.647  ? 2332 B 1 c
ATOM 8735 H HB   . ILE Bxp B    251 ? 68.102 -8.636  15.351  1    31.886  ? 2332 B 1 c
ATOM 8736 H HG12 . ILE Bxp B    251 ? 68.899 -6.404  15.473  1    31.48   ? 2332 B 1 c
ATOM 8737 H HG13 . ILE Bxp B    251 ? 69.041 -6.408  13.897  1    31.48   ? 2332 B 1 c
ATOM 8738 H HG21 . ILE Bxp B    251 ? 69.052 -9.025  13.139  1    32.487  ? 2332 B 1 c
ATOM 8739 H HG22 . ILE Bxp B    251 ? 67.771 -8.297  12.561  1    32.428  ? 2332 B 1 c
ATOM 8740 H HG23 . ILE Bxp B    251 ? 67.618 -9.649  13.379  1    32.41   ? 2332 B 1 c
ATOM 8741 H HD11 . ILE Bxp B    251 ? 70.457 -8.27   15.483  1    32.182  ? 2332 B 1 c
ATOM 8742 H HD12 . ILE Bxp B    251 ? 71.091 -6.855  15.125  1    32.035  ? 2332 B 1 c
ATOM 8743 H HD13 . ILE Bxp B    251 ? 70.773 -7.902  13.969  1    32.046  ? 2332 B 1 c
ATOM 8744 N N    . LEU Bxp B    252 ? 65.131 -8.272  12.983  1    34.569  ? 2333 B 1 .
ATOM 8745 C CA   . LEU Bxp B    252 ? 64.127 -9.192  12.5    1    35.148  ? 2333 B 1 .
ATOM 8746 C C    . LEU Bxp B    252 ? 64.817 -10.3   11.713  1    35.967  ? 2333 B 1 .
ATOM 8747 O O    . LEU Bxp B    252 ? 65.71  -10.046 10.904  1    33.727  ? 2333 B 1 .
ATOM 8748 C CB   . LEU Bxp B    252 ? 63.063 -8.433  11.717  1    36.302  ? 2333 B 1 .
ATOM 8749 C CG   . LEU Bxp B    252 ? 62.468 -7.219  12.443  1    37.872  ? 2333 B 1 .
ATOM 8750 C CD1  . LEU Bxp B    252 ? 61.249 -6.685  11.707  1    37.511  ? 2333 B 1 .
ATOM 8751 C CD2  . LEU Bxp B    252 ? 62.111 -7.482  13.904  1    37.984  ? 2333 B 1 .
ATOM 8752 H H    . LEU Bxp B    252 ? 65.478 -7.638  12.424  1    34.727  ? 2333 B 1 c
ATOM 8753 H HA   . LEU Bxp B    252 ? 63.693 -9.607  13.287  1    35.427  ? 2333 B 1 c
ATOM 8754 H HB3  . LEU Bxp B    252 ? 62.333 -9.058  11.503  1    36.381  ? 2333 B 1 c
ATOM 8755 H HB2  . LEU Bxp B    252 ? 63.462 -8.127  10.871  1    36.381  ? 2333 B 1 c
ATOM 8756 H HG   . LEU Bxp B    252 ? 63.152 -6.501  12.434  1    37.501  ? 2333 B 1 c
ATOM 8757 H HD11 . LEU Bxp B    252 ? 61.486 -6.495  10.784  1    37.585  ? 2333 B 1 c
ATOM 8758 H HD12 . LEU Bxp B    252 ? 60.941 -5.869  12.135  1    37.545  ? 2333 B 1 c
ATOM 8759 H HD13 . LEU Bxp B    252 ? 60.541 -7.35   11.727  1    37.522  ? 2333 B 1 c
ATOM 8760 H HD21 . LEU Bxp B    252 ? 62.915 -7.449  14.447  1    37.9    ? 2333 B 1 c
ATOM 8761 H HD22 . LEU Bxp B    252 ? 61.702 -8.36   13.985  1    37.922  ? 2333 B 1 c
ATOM 8762 H HD23 . LEU Bxp B    252 ? 61.486 -6.806  14.214  1    37.853  ? 2333 B 1 c
ATOM 8763 N N    . SER Bxp B    253 ? 64.409 -11.535 12.042  1    37.003  ? 2334 B 1 .
ATOM 8764 C CA   . SER Bxp B    253 ? 64.838 -12.75  11.372  1    33.467  ? 2334 B 1 .
ATOM 8765 C C    . SER Bxp B    253 ? 64.408 -12.681 9.926   1    31.962  ? 2334 B 1 .
ATOM 8766 O O    . SER Bxp B    253 ? 63.475 -11.974 9.596   1    33.119  ? 2334 B 1 .
ATOM 8767 C CB   . SER Bxp B    253 ? 64.205 -13.965 11.984  1    33.292  ? 2334 B 1 .
ATOM 8768 O OG   . SER Bxp B    253 ? 62.859 -14.113 11.548  1    30.561  ? 2334 B 1 .
ATOM 8769 H H    . SER Bxp B    253 ? 63.819 -11.62  12.735  1    35.867  ? 2334 B 1 c
ATOM 8770 H HA   . SER Bxp B    253 ? 65.822 -12.822 11.426  1    33.887  ? 2334 B 1 c
ATOM 8771 H HB3  . SER Bxp B    253 ? 64.229 -13.891 12.957  1    32.729  ? 2334 B 1 c
ATOM 8772 H HB2  . SER Bxp B    253 ? 64.715 -14.75  11.723  1    32.76   ? 2334 B 1 c
ATOM 8773 H HG   . SER Bxp B    253 ? 62.58  -14.745 11.947  0    23.53   ? 2334 B 1 c
ATOM 8774 N N    . PRO Bxp B    254 ? 64.972 -13.496 9.032   1    33.04   ? 2335 B 1 .
ATOM 8775 C CA   . PRO Bxp B    254 ? 64.496 -13.511 7.661   1    35      ? 2335 B 1 .
ATOM 8776 C C    . PRO Bxp B    254 ? 63.033 -13.929 7.508   1    34.381  ? 2335 B 1 .
ATOM 8777 O O    . PRO Bxp B    254 ? 62.436 -13.725 6.459   1    34.334  ? 2335 B 1 .
ATOM 8778 C CB   . PRO Bxp B    254 ? 65.487 -14.433 6.968   1    35.234  ? 2335 B 1 .
ATOM 8779 C CG   . PRO Bxp B    254 ? 66.69  -14.41  7.89    1    35.285  ? 2335 B 1 .
ATOM 8780 C CD   . PRO Bxp B    254 ? 66.091 -14.413 9.249   1    34.899  ? 2335 B 1 .
ATOM 8781 H HA   . PRO Bxp B    254 ? 64.603 -12.613 7.284   1    34.519  ? 2335 B 1 c
ATOM 8782 H HB3  . PRO Bxp B    254 ? 65.713 -14.099 6.081   1    35.398  ? 2335 B 1 c
ATOM 8783 H HB2  . PRO Bxp B    254 ? 65.126 -15.338 6.889   1    35.315  ? 2335 B 1 c
ATOM 8784 H HG3  . PRO Bxp B    254 ? 67.23  -13.607 7.747   1    35.234  ? 2335 B 1 c
ATOM 8785 H HG2  . PRO Bxp B    254 ? 67.245 -15.196 7.757   1    35.441  ? 2335 B 1 c
ATOM 8786 H HD3  . PRO Bxp B    254 ? 65.774 -15.299 9.502   1    34.58   ? 2335 B 1 c
ATOM 8787 H HD2  . PRO Bxp B    254 ? 66.704 -14.078 9.919   1    34.618  ? 2335 B 1 c
ATOM 8788 N N    . GLU Bxp B    255 ? 62.407 -14.455 8.552   1    35.032  ? 2336 B 1 .
ATOM 8789 C CA   . GLU Bxp B    255 ? 60.987 -14.742 8.428   1    39.596  ? 2336 B 1 .
ATOM 8790 C C    . GLU Bxp B    255 ? 60.195 -13.478 8.089   1    39.149  ? 2336 B 1 .
ATOM 8791 O O    . GLU Bxp B    255 ? 59.118 -13.567 7.516   1    42.433  ? 2336 B 1 .
ATOM 8792 C CB   . GLU Bxp B    255 ? 60.396 -15.346 9.7     1    43.044  ? 2336 B 1 .
ATOM 8793 C CG   . GLU Bxp B    255 ? 60.833 -16.785 9.948   1    42.216  ? 2336 B 1 .
ATOM 8794 C CD   . GLU Bxp B    255 ? 60.968 -17.046 11.427  1    42.243  ? 2336 B 1 .
ATOM 8795 O OE1  . GLU Bxp B    255 ? 61.508 -16.164 12.133  1    41.276  ? 2336 B 1 .
ATOM 8796 O OE2  . GLU Bxp B    255 ? 60.555 -18.131 11.856  1    45.656  ? 2336 B 1 .
ATOM 8797 H H    . GLU Bxp B    255 ? 62.848 -14.662 9.325   1    35.84   ? 2336 B 1 c
ATOM 8798 H HA   . GLU Bxp B    255 ? 60.867 -15.393 7.691   1    39.121  ? 2336 B 1 c
ATOM 8799 H HB3  . GLU Bxp B    255 ? 59.42  -15.327 9.63    1    42.082  ? 2336 B 1 c
ATOM 8800 H HB2  . GLU Bxp B    255 ? 60.647 -14.782 10.458  1    41.974  ? 2336 B 1 c
ATOM 8801 H HG3  . GLU Bxp B    255 ? 61.697 -16.949 9.513   1    42.395  ? 2336 B 1 c
ATOM 8802 H HG2  . GLU Bxp B    255 ? 60.17  -17.402 9.571   1    42.424  ? 2336 B 1 c
ATOM 8803 N N    . TYR Bxp B    256 ? 60.696 -12.304 8.473   1    37.986  ? 2337 B 1 .
ATOM 8804 C CA   . TYR Bxp B    256 ? 59.944 -11.082 8.272   1    37.4    ? 2337 B 1 .
ATOM 8805 C C    . TYR Bxp B    256 ? 60.267 -10.448 6.923   1    39.935  ? 2337 B 1 .
ATOM 8806 O O    . TYR Bxp B    256 ? 59.548 -9.539  6.496   1    41.06   ? 2337 B 1 .
ATOM 8807 C CB   . TYR Bxp B    256 ? 60.244 -10.107 9.403   1    36.253  ? 2337 B 1 .
ATOM 8808 C CG   . TYR Bxp B    256 ? 59.563 -10.459 10.711  1    35.114  ? 2337 B 1 .
ATOM 8809 C CD1  . TYR Bxp B    256 ? 60.066 -11.453 11.529  1    34.236  ? 2337 B 1 .
ATOM 8810 C CD2  . TYR Bxp B    256 ? 58.437 -9.768  11.138  1    35.438  ? 2337 B 1 .
ATOM 8811 C CE1  . TYR Bxp B    256 ? 59.462 -11.756 12.735  1    34.905  ? 2337 B 1 .
ATOM 8812 C CE2  . TYR Bxp B    256 ? 57.819 -10.065 12.34   1    34.506  ? 2337 B 1 .
ATOM 8813 C CZ   . TYR Bxp B    256 ? 58.337 -11.057 13.149  1    34.123  ? 2337 B 1 .
ATOM 8814 O OH   . TYR Bxp B    256 ? 57.724 -11.339 14.341  1    31.73   ? 2337 B 1 .
ATOM 8815 H H    . TYR Bxp B    256 ? 61.511 -12.262 8.884   1    38.075  ? 2337 B 1 c
ATOM 8816 H HA   . TYR Bxp B    256 ? 58.979 -11.298 8.294   1    37.782  ? 2337 B 1 c
ATOM 8817 H HB3  . TYR Bxp B    256 ? 59.959 -9.208  9.128   1    36.214  ? 2337 B 1 c
ATOM 8818 H HB2  . TYR Bxp B    256 ? 61.216 -10.083 9.547   1    36.252  ? 2337 B 1 c
ATOM 8819 H HD1  . TYR Bxp B    256 ? 60.838 -11.928 11.264  1    34.599  ? 2337 B 1 c
ATOM 8820 H HD2  . TYR Bxp B    256 ? 58.083 -9.084  10.597  1    35.08   ? 2337 B 1 c
ATOM 8821 H HE1  . TYR Bxp B    256 ? 59.817 -12.435 13.282  1    34.557  ? 2337 B 1 c
ATOM 8822 H HE2  . TYR Bxp B    256 ? 57.056 -9.585  12.61   1    34.582  ? 2337 B 1 c
ATOM 8823 H HH   . TYR Bxp B    256 ? 58.19  -11.991 14.741  0    29.67   ? 2337 B 1 c
ATOM 8824 N N    . CYS Bxp B    257 ? 61.348 -10.897 6.27    1    39.752  ? 2338 B 1 .
ATOM 8825 C CA   . CYS Bxp B    257 ? 61.668 -10.385 4.945   1    42.335  ? 2338 B 1 .
ATOM 8826 C C    . CYS Bxp B    257 ? 62.276 -11.476 4.075   1    41.366  ? 2338 B 1 .
ATOM 8827 O O    . CYS Bxp B    257 ? 63.397 -11.338 3.573   1    40.706  ? 2338 B 1 .
ATOM 8828 C CB   . CYS Bxp B    257 ? 62.598 -9.179  4.995   1    45.16   ? 2338 B 1 .
ATOM 8829 S SG   . CYS Bxp B    257 ? 62.6   -8.24   3.442   1    45.28   ? 2338 B 1 .
ATOM 8830 H H    . CYS Bxp B    257 ? 61.897 -11.518 6.653   1    40.276  ? 2338 B 1 c
ATOM 8831 H HA   . CYS Bxp B    257 ? 60.822 -10.094 4.52    1    42.18   ? 2338 B 1 c
ATOM 8832 H HB3  . CYS Bxp B    257 ? 63.515 -9.476  5.189   1    44.429  ? 2338 B 1 c
ATOM 8833 H HB2  . CYS Bxp B    257 ? 62.311 -8.581  5.719   1    44.377  ? 2338 B 1 c
ATOM 8834 H HG   . CYS Bxp B    257 ? 63.396 -7.44   3.857   0    34.73   ? 2338 B 1 c
ATOM 8835 N N    . TRP Bxp B    258 ? 61.474 -12.517 3.848   1    40.367  ? 2339 B 1 .
ATOM 8836 C CA   . TRP Bxp B    258 ? 61.965 -13.736 3.24    1    41.76   ? 2339 B 1 .
ATOM 8837 C C    . TRP Bxp B    258 ? 61.728 -13.701 1.741   1    42.312  ? 2339 B 1 .
ATOM 8838 O O    . TRP Bxp B    258 ? 60.658 -13.289 1.296   1    36.911  ? 2339 B 1 .
ATOM 8839 C CB   . TRP Bxp B    258 ? 61.286 -14.969 3.844   1    44.408  ? 2339 B 1 .
ATOM 8840 C CG   . TRP Bxp B    258 ? 61.832 -16.25  3.29    1    43.326  ? 2339 B 1 .
ATOM 8841 C CD1  . TRP Bxp B    258 ? 61.25  -17.094 2.392   1    44.92   ? 2339 B 1 .
ATOM 8842 C CD2  . TRP Bxp B    258 ? 63.136 -16.785 3.562   1    42.808  ? 2339 B 1 .
ATOM 8843 N NE1  . TRP Bxp B    258 ? 62.091 -18.139 2.112   1    45.232  ? 2339 B 1 .
ATOM 8844 C CE2  . TRP Bxp B    258 ? 63.258 -17.971 2.809   1    44.216  ? 2339 B 1 .
ATOM 8845 C CE3  . TRP Bxp B    258 ? 64.201 -16.378 4.365   1    43.604  ? 2339 B 1 .
ATOM 8846 C CZ2  . TRP Bxp B    258 ? 64.411 -18.749 2.84    1    44.767  ? 2339 B 1 .
ATOM 8847 C CZ3  . TRP Bxp B    258 ? 65.341 -17.15  4.393   1    46.189  ? 2339 B 1 .
ATOM 8848 C CH2  . TRP Bxp B    258 ? 65.445 -18.317 3.638   1    46.093  ? 2339 B 1 .
ATOM 8849 H H    . TRP Bxp B    258 ? 60.592 -12.463 4.079   1    40.925  ? 2339 B 1 c
ATOM 8850 H HA   . TRP Bxp B    258 ? 62.942 -13.803 3.411   1    42.104  ? 2339 B 1 c
ATOM 8851 H HB3  . TRP Bxp B    258 ? 60.326 -14.922 3.65    1    43.605  ? 2339 B 1 c
ATOM 8852 H HB2  . TRP Bxp B    258 ? 61.413 -14.96  4.816   1    43.489  ? 2339 B 1 c
ATOM 8853 H HD1  . TRP Bxp B    258 ? 60.383 -16.995 2.033   1    44.611  ? 2339 B 1 c
ATOM 8854 H HE1  . TRP Bxp B    258 ? 61.913 -18.8   1.569   1    44.895  ? 2339 B 1 c
ATOM 8855 H HE3  . TRP Bxp B    258 ? 64.138 -15.592 4.877   1    43.898  ? 2339 B 1 c
ATOM 8856 H HZ2  . TRP Bxp B    258 ? 64.485 -19.529 2.323   1    45.072  ? 2339 B 1 c
ATOM 8857 H HZ3  . TRP Bxp B    258 ? 66.067 -16.884 4.933   1    45.511  ? 2339 B 1 c
ATOM 8858 H HH2  . TRP Bxp B    258 ? 66.237 -18.824 3.677   1    45.757  ? 2339 B 1 c
ATOM 8859 N N    . ASP Bxp B    259 ? 62.753 -14.178 1.016   1    47.749  ? 2340 B 1 .
ATOM 8860 C CA   . ASP Bxp B    259 ? 62.74  -14.373 -0.425  1    47.497  ? 2340 B 1 .
ATOM 8861 C C    . ASP Bxp B    259 ? 62.471 -15.842 -0.706  1    45.873  ? 2340 B 1 .
ATOM 8862 O O    . ASP Bxp B    259 ? 63.353 -16.673 -0.527  1    42.667  ? 2340 B 1 .
ATOM 8863 C CB   . ASP Bxp B    259 ? 64.078 -14.039 -1.072  1    50.016  ? 2340 B 1 .
ATOM 8864 C CG   . ASP Bxp B    259 ? 64.079 -14.142 -2.591  1    55.312  ? 2340 B 1 .
ATOM 8865 O OD1  . ASP Bxp B    259 ? 62.97  -14.314 -3.145  1    59.315  ? 2340 B 1 .
ATOM 8866 O OD2  . ASP Bxp B    259 ? 65.172 -14.041 -3.208  1    54.948  ? 2340 B 1 .
ATOM 8867 H H    . ASP Bxp B    259 ? 63.52  -14.399 1.462   1    46.263  ? 2340 B 1 c
ATOM 8868 H HA   . ASP Bxp B    259 ? 62.026 -13.821 -0.818  1    47.675  ? 2340 B 1 c
ATOM 8869 H HB3  . ASP Bxp B    259 ? 64.768 -14.641 -0.722  1    50.492  ? 2340 B 1 c
ATOM 8870 H HB2  . ASP Bxp B    259 ? 64.33  -13.129 -0.824  1    50.475  ? 2340 B 1 c
ATOM 8871 N N    . TYR Bxp B    260 ? 61.254 -16.14  -1.168  1    50.093  ? 2341 B 1 .
ATOM 8872 C CA   . TYR Bxp B    260 ? 60.839 -17.501 -1.456  1    50.902  ? 2341 B 1 .
ATOM 8873 C C    . TYR Bxp B    260 ? 61.692 -18.117 -2.56   1    52.2    ? 2341 B 1 .
ATOM 8874 O O    . TYR Bxp B    260 ? 61.571 -19.31  -2.796  1    59.136  ? 2341 B 1 .
ATOM 8875 C CB   . TYR Bxp B    260 ? 59.366 -17.528 -1.867  1    52.373  ? 2341 B 1 .
ATOM 8876 C CG   . TYR Bxp B    260 ? 58.385 -17.545 -0.707  1    57.446  ? 2341 B 1 .
ATOM 8877 C CD1  . TYR Bxp B    260 ? 58.469 -18.512 0.289   1    60.013  ? 2341 B 1 .
ATOM 8878 C CD2  . TYR Bxp B    260 ? 57.373 -16.596 -0.606  1    60.585  ? 2341 B 1 .
ATOM 8879 C CE1  . TYR Bxp B    260 ? 57.568 -18.544 1.343   1    62.33   ? 2341 B 1 .
ATOM 8880 C CE2  . TYR Bxp B    260 ? 56.471 -16.614 0.449   1    60.608  ? 2341 B 1 .
ATOM 8881 C CZ   . TYR Bxp B    260 ? 56.572 -17.587 1.43    1    60.405  ? 2341 B 1 .
ATOM 8882 O OH   . TYR Bxp B    260 ? 55.689 -17.618 2.469   1    57.703  ? 2341 B 1 .
ATOM 8883 H H    . TYR Bxp B    260 ? 60.657 -15.463 -1.306  1    49.259  ? 2341 B 1 c
ATOM 8884 H HA   . TYR Bxp B    260 ? 60.95  -18.044 -0.632  1    51.366  ? 2341 B 1 c
ATOM 8885 H HB3  . TYR Bxp B    260 ? 59.211 -18.324 -2.421  1    53.18   ? 2341 B 1 c
ATOM 8886 H HB2  . TYR Bxp B    260 ? 59.184 -16.739 -2.425  1    53.182  ? 2341 B 1 c
ATOM 8887 H HD1  . TYR Bxp B    260 ? 59.143 -19.171 0.239   1    59.826  ? 2341 B 1 c
ATOM 8888 H HD2  . TYR Bxp B    260 ? 57.296 -15.928 -1.268  1    59.762  ? 2341 B 1 c
ATOM 8889 H HE1  . TYR Bxp B    260 ? 57.642 -19.207 2.007   1    61.329  ? 2341 B 1 c
ATOM 8890 H HE2  . TYR Bxp B    260 ? 55.793 -15.963 0.5     1    60.506  ? 2341 B 1 c
ATOM 8891 H HH   . TYR Bxp B    260 ? 55.938 -18.292 3.029   0    47.77   ? 2341 B 1 c
ATOM 8892 N N    . HIS Bxp B    261 ? 62.527 -17.319 -3.241  1    53.434  ? 2342 B 1 .
ATOM 8893 C CA   . HIS Bxp B    261 ? 63.476 -17.85  -4.21   1    54.069  ? 2342 B 1 .
ATOM 8894 C C    . HIS Bxp B    261 ? 64.391 -18.851 -3.511  1    54.409  ? 2342 B 1 .
ATOM 8895 O O    . HIS Bxp B    261 ? 64.603 -19.952 -4.001  1    56.882  ? 2342 B 1 .
ATOM 8896 C CB   . HIS Bxp B    261 ? 64.249 -16.732 -4.918  1    56.438  ? 2342 B 1 .
ATOM 8897 C CG   . HIS Bxp B    261 ? 63.424 -15.99  -5.916  1    61.268  ? 2342 B 1 .
ATOM 8898 N ND1  . HIS Bxp B    261 ? 63.963 -15.404 -7.041  1    65.725  ? 2342 B 1 .
ATOM 8899 C CD2  . HIS Bxp B    261 ? 62.104 -15.757 -5.975  1    65.136  ? 2342 B 1 .
ATOM 8900 C CE1  . HIS Bxp B    261 ? 62.995 -14.829 -7.743  1    69.084  ? 2342 B 1 .
ATOM 8901 N NE2  . HIS Bxp B    261 ? 61.855 -15.023 -7.109  1    70.497  ? 2342 B 1 .
ATOM 8902 H H    . HIS Bxp B    261 ? 62.483 -16.414 -3.125  1    53.214  ? 2342 B 1 c
ATOM 8903 H HA   . HIS Bxp B    261 ? 62.954 -18.34  -4.893  1    54.488  ? 2342 B 1 c
ATOM 8904 H HB3  . HIS Bxp B    261 ? 65.024 -17.126 -5.375  1    56.958  ? 2342 B 1 c
ATOM 8905 H HB2  . HIS Bxp B    261 ? 64.584 -16.106 -4.247  1    56.963  ? 2342 B 1 c
ATOM 8906 H HD1  . HIS Bxp B    261 ? 64.979 -15.792 -7.31   0    52.93   ? 2342 B 1 c
ATOM 8907 H HD2  . HIS Bxp B    261 ? 61.46  -16.027 -5.349  1    65.282  ? 2342 B 1 c
ATOM 8908 H HE1  . HIS Bxp B    261 ? 63.107 -14.356 -8.55   1    68.524  ? 2342 B 1 c
ATOM 8909 H HE2  . HIS Bxp B    261 ? 61.377 -14.572 -7.465  0    54.79   ? 2342 B 1 c
ATOM 8910 N N    . ILE Bxp B    262 ? 64.867 -18.495 -2.32   1    56.464  ? 2343 B 1 .
ATOM 8911 C CA   . ILE Bxp B    262 ? 65.653 -19.416 -1.515  1    55.425  ? 2343 B 1 .
ATOM 8912 C C    . ILE Bxp B    262 ? 64.813 -20.657 -1.225  1    49.933  ? 2343 B 1 .
ATOM 8913 O O    . ILE Bxp B    262 ? 65.378 -21.73  -1.081  1    46.876  ? 2343 B 1 .
ATOM 8914 C CB   . ILE Bxp B    262 ? 66.135 -18.755 -0.211  1    59.041  ? 2343 B 1 .
ATOM 8915 C CG1  . ILE Bxp B    262 ? 66.672 -17.356 -0.458  1    59.148  ? 2343 B 1 .
ATOM 8916 C CG2  . ILE Bxp B    262 ? 67.164 -19.63  0.512   1    61.279  ? 2343 B 1 .
ATOM 8917 C CD1  . ILE Bxp B    262 ? 66.535 -16.432 0.733   1    60.62   ? 2343 B 1 .
ATOM 8918 H H    . ILE Bxp B    262 ? 64.672 -17.667 -1.988  1    55.787  ? 2343 B 1 c
ATOM 8919 H HA   . ILE Bxp B    262 ? 66.437 -19.685 -2.033  1    55.239  ? 2343 B 1 c
ATOM 8920 H HB   . ILE Bxp B    262 ? 65.358 -18.668 0.373   1    58.562  ? 2343 B 1 c
ATOM 8921 H HG12 . ILE Bxp B    262 ? 66.203 -16.958 -1.217  1    59.382  ? 2343 B 1 c
ATOM 8922 H HG13 . ILE Bxp B    262 ? 67.619 -17.423 -0.695  1    59.453  ? 2343 B 1 c
ATOM 8923 H HG21 . ILE Bxp B    262 ? 67.64  -19.097 1.171   1    60.584  ? 2343 B 1 c
ATOM 8924 H HG22 . ILE Bxp B    262 ? 67.799 -19.986 -0.132  1    60.561  ? 2343 B 1 c
ATOM 8925 H HG23 . ILE Bxp B    262 ? 66.711 -20.365 0.958   1    60.549  ? 2343 B 1 c
ATOM 8926 H HD11 . ILE Bxp B    262 ? 65.604 -16.407 1.024   1    60.161  ? 2343 B 1 c
ATOM 8927 H HD12 . ILE Bxp B    262 ? 66.819 -15.532 0.483   1    60.14   ? 2343 B 1 c
ATOM 8928 H HD13 . ILE Bxp B    262 ? 67.094 -16.756 1.465   1    60.169  ? 2343 B 1 c
ATOM 8929 N N    . GLY Bxp B    263 ? 63.485 -20.484 -1.104  1    50.374  ? 2344 B 1 .
ATOM 8930 C CA   . GLY Bxp B    263 ? 62.541 -21.579 -0.917  1    50.634  ? 2344 B 1 .
ATOM 8931 C C    . GLY Bxp B    263 ? 62.496 -22.025 0.543   1    53.555  ? 2344 B 1 .
ATOM 8932 O O    . GLY Bxp B    263 ? 63.513 -22.438 1.087   1    61.626  ? 2344 B 1 .
ATOM 8933 H H    . GLY Bxp B    263 ? 63.156 -19.632 -1.106  1    50.436  ? 2344 B 1 c
ATOM 8934 H HA3  . GLY Bxp B    263 ? 62.808 -22.338 -1.486  1    51.189  ? 2344 B 1 c
ATOM 8935 H HA2  . GLY Bxp B    263 ? 61.645 -21.286 -1.202  1    51.264  ? 2344 B 1 c
ATOM 8936 N N    . LEU Bxp B    264 ? 61.303 -21.984 1.146   1    52.543  ? 2345 B 1 .
ATOM 8937 C CA   . LEU Bxp B    264 ? 61.081 -22.156 2.58    1    53.033  ? 2345 B 1 .
ATOM 8938 C C    . LEU Bxp B    264 ? 61.966 -23.233 3.226   1    47.236  ? 2345 B 1 .
ATOM 8939 O O    . LEU Bxp B    264 ? 61.508 -24.355 3.391   1    45.833  ? 2345 B 1 .
ATOM 8940 C CB   . LEU Bxp B    264 ? 59.585 -22.48  2.703   1    58.197  ? 2345 B 1 .
ATOM 8941 C CG   . LEU Bxp B    264 ? 58.938 -22.347 4.092   1    69.42   ? 2345 B 1 .
ATOM 8942 C CD1  . LEU Bxp B    264 ? 57.699 -21.439 4.016   1    72.085  ? 2345 B 1 .
ATOM 8943 C CD2  . LEU Bxp B    264 ? 58.555 -23.697 4.728   1    70.559  ? 2345 B 1 .
ATOM 8944 H H    . LEU Bxp B    264 ? 60.571 -21.837 0.618   1    52.96   ? 2345 B 1 c
ATOM 8945 H HA   . LEU Bxp B    264 ? 61.261 -21.29  3.026   1    52.689  ? 2345 B 1 c
ATOM 8946 H HB3  . LEU Bxp B    264 ? 59.444 -23.401 2.384   1    59.349  ? 2345 B 1 c
ATOM 8947 H HB2  . LEU Bxp B    264 ? 59.095 -21.892 2.083   1    59.361  ? 2345 B 1 c
ATOM 8948 H HG   . LEU Bxp B    264 ? 59.595 -21.908 4.692   1    67.77   ? 2345 B 1 c
ATOM 8949 H HD11 . LEU Bxp B    264 ? 57.977 -20.523 3.85    1    71.192  ? 2345 B 1 c
ATOM 8950 H HD12 . LEU Bxp B    264 ? 57.213 -21.481 4.857   1    71.244  ? 2345 B 1 c
ATOM 8951 H HD13 . LEU Bxp B    264 ? 57.12  -21.737 3.294   1    71.181  ? 2345 B 1 c
ATOM 8952 H HD21 . LEU Bxp B    264 ? 59.36  -24.206 4.92    1    70.036  ? 2345 B 1 c
ATOM 8953 H HD22 . LEU Bxp B    264 ? 57.995 -24.199 4.113   1    70.106  ? 2345 B 1 c
ATOM 8954 H HD23 . LEU Bxp B    264 ? 58.067 -23.54  5.554   1    70.173  ? 2345 B 1 c
ATOM 8955 N N    . PRO Bxp B    265 ? 63.201 -22.937 3.722   1    45.809  ? 2346 B 1 .
ATOM 8956 C CA   . PRO Bxp B    265 ? 64.003 -23.914 4.444   1    45.928  ? 2346 B 1 .
ATOM 8957 C C    . PRO Bxp B    265 ? 63.594 -24.021 5.906   1    47.583  ? 2346 B 1 .
ATOM 8958 O O    . PRO Bxp B    265 ? 62.51  -23.582 6.289   1    45.538  ? 2346 B 1 .
ATOM 8959 C CB   . PRO Bxp B    265 ? 65.431 -23.406 4.276   1    44.948  ? 2346 B 1 .
ATOM 8960 C CG   . PRO Bxp B    265 ? 65.241 -21.915 4.32    1    45.25   ? 2346 B 1 .
ATOM 8961 C CD   . PRO Bxp B    265 ? 63.891 -21.64  3.673   1    47.894  ? 2346 B 1 .
ATOM 8962 H HA   . PRO Bxp B    265 ? 63.916 -24.791 4.015   1    46.027  ? 2346 B 1 c
ATOM 8963 H HB3  . PRO Bxp B    265 ? 65.806 -23.687 3.419   1    45.258  ? 2346 B 1 c
ATOM 8964 H HB2  . PRO Bxp B    265 ? 66.012 -23.709 4.998   1    45.353  ? 2346 B 1 c
ATOM 8965 H HG3  . PRO Bxp B    265 ? 65.953 -21.461 3.827   1    45.77   ? 2346 B 1 c
ATOM 8966 H HG2  . PRO Bxp B    265 ? 65.248 -21.594 5.244   1    45.798  ? 2346 B 1 c
ATOM 8967 H HD3  . PRO Bxp B    265 ? 63.39  -20.967 4.169   1    46.862  ? 2346 B 1 c
ATOM 8968 H HD2  . PRO Bxp B    265 ? 64     -21.345 2.757   1    46.921  ? 2346 B 1 c
ATOM 8969 N N    . ALA Bxp B    266 ? 64.498 -24.588 6.709   1    53.033  ? 2347 B 1 .
ATOM 8970 C CA   . ALA Bxp B    266 ? 64.144 -25.17  7.991   1    57.823  ? 2347 B 1 .
ATOM 8971 C C    . ALA Bxp B    266 ? 63.729 -24.087 8.985   1    57.164  ? 2347 B 1 .
ATOM 8972 O O    . ALA Bxp B    266 ? 62.729 -24.259 9.681   1    49.509  ? 2347 B 1 .
ATOM 8973 C CB   . ALA Bxp B    266 ? 65.31  -26.002 8.504   1    60.344  ? 2347 B 1 .
ATOM 8974 H H    . ALA Bxp B    266 ? 65.372 -24.62  6.447   1    52.614  ? 2347 B 1 c
ATOM 8975 H HA   . ALA Bxp B    266 ? 63.361 -25.77  7.849   1    57.075  ? 2347 B 1 c
ATOM 8976 H HB3  . ALA Bxp B    266 ? 65.103 -26.346 9.389   1    59.578  ? 2347 B 1 c
ATOM 8977 H HB2  . ALA Bxp B    266 ? 66.109 -25.45  8.554   1    59.54   ? 2347 B 1 c
ATOM 8978 H HB1  . ALA Bxp B    266 ? 65.472 -26.746 7.901   1    59.578  ? 2347 B 1 c
ATOM 8979 N N    . ASP Bxp B    267 ? 64.493 -22.978 9.003   1    60.294  ? 2348 B 1 .
ATOM 8980 C CA   . ASP Bxp B    267 ? 64.414 -21.951 10.036  1    56.842  ? 2348 B 1 .
ATOM 8981 C C    . ASP Bxp B    267 ? 63.226 -21.018 9.77    1    55.948  ? 2348 B 1 .
ATOM 8982 O O    . ASP Bxp B    267 ? 62.809 -20.252 10.637  1    54.141  ? 2348 B 1 .
ATOM 8983 C CB   . ASP Bxp B    267 ? 65.729 -21.185 10.153  1    52.934  ? 2348 B 1 .
ATOM 8984 C CG   . ASP Bxp B    267 ? 67.011 -22.014 10.152  1    54.929  ? 2348 B 1 .
ATOM 8985 O OD1  . ASP Bxp B    267 ? 66.995 -23.148 9.632   1    59.737  ? 2348 B 1 .
ATOM 8986 O OD2  . ASP Bxp B    267 ? 68.027 -21.533 10.69   1    52.173  ? 2348 B 1 .
ATOM 8987 H H    . ASP Bxp B    267 ? 65.094 -22.857 8.326   1    58.634  ? 2348 B 1 c
ATOM 8988 H HA   . ASP Bxp B    267 ? 64.264 -22.399 10.899  1    56.542  ? 2348 B 1 c
ATOM 8989 H HB3  . ASP Bxp B    267 ? 65.709 -20.666 10.984  1    54.329  ? 2348 B 1 c
ATOM 8990 H HB2  . ASP Bxp B    267 ? 65.784 -20.55  9.409   1    54.281  ? 2348 B 1 c
ATOM 8991 N N    . ILE Bxp B    268 ? 62.673 -21.067 8.558   1    53.391  ? 2349 B 1 .
ATOM 8992 C CA   . ILE Bxp B    268 ? 61.663 -20.104 8.179   1    52.259  ? 2349 B 1 .
ATOM 8993 C C    . ILE Bxp B    268 ? 60.305 -20.681 8.55    1    54.206  ? 2349 B 1 .
ATOM 8994 O O    . ILE Bxp B    268 ? 59.671 -21.331 7.724   1    60.882  ? 2349 B 1 .
ATOM 8995 C CB   . ILE Bxp B    268 ? 61.793 -19.759 6.686   1    52.711  ? 2349 B 1 .
ATOM 8996 C CG1  . ILE Bxp B    268 ? 63.202 -19.278 6.342   1    50.74   ? 2349 B 1 .
ATOM 8997 C CG2  . ILE Bxp B    268 ? 60.739 -18.74  6.268   1    58.317  ? 2349 B 1 .
ATOM 8998 C CD1  . ILE Bxp B    268 ? 63.852 -18.425 7.413   1    50.581  ? 2349 B 1 .
ATOM 8999 H H    . ILE Bxp B    268 ? 62.931 -21.701 7.954   1    53.811  ? 2349 B 1 c
ATOM 9000 H HA   . ILE Bxp B    268 ? 61.8   -19.287 8.695   1    52.9    ? 2349 B 1 c
ATOM 9001 H HB   . ILE Bxp B    268 ? 61.632 -20.58  6.179   1    53.289  ? 2349 B 1 c
ATOM 9002 H HG12 . ILE Bxp B    268 ? 63.166 -18.765 5.51    1    51.093  ? 2349 B 1 c
ATOM 9003 H HG13 . ILE Bxp B    268 ? 63.768 -20.061 6.184   1    51.067  ? 2349 B 1 c
ATOM 9004 H HG21 . ILE Bxp B    268 ? 61.012 -18.305 5.443   1    56.52   ? 2349 B 1 c
ATOM 9005 H HG22 . ILE Bxp B    268 ? 60.636 -18.071 6.966   1    56.561  ? 2349 B 1 c
ATOM 9006 H HG23 . ILE Bxp B    268 ? 59.89  -19.191 6.127   1    56.579  ? 2349 B 1 c
ATOM 9007 H HD11 . ILE Bxp B    268 ? 63.196 -17.807 7.788   1    50.659  ? 2349 B 1 c
ATOM 9008 H HD12 . ILE Bxp B    268 ? 64.582 -17.914 7.014   1    50.623  ? 2349 B 1 c
ATOM 9009 H HD13 . ILE Bxp B    268 ? 64.208 -18.99  8.123   1    50.676  ? 2349 B 1 c
ATOM 9010 N N    . LYS Bxp B    269 ? 59.889 -20.436 9.801   1    52.286  ? 2350 B 1 .
ATOM 9011 C CA   . LYS Bxp B    269 ? 58.697 -21.052 10.368  1    47.849  ? 2350 B 1 .
ATOM 9012 C C    . LYS Bxp B    269 ? 57.448 -20.349 9.849   1    45.354  ? 2350 B 1 .
ATOM 9013 O O    . LYS Bxp B    269 ? 56.717 -20.93  9.07    1    46.875  ? 2350 B 1 .
ATOM 9014 C CB   . LYS Bxp B    269 ? 58.805 -21.116 11.892  1    47.052  ? 2350 B 1 .
ATOM 9015 C CG   . LYS Bxp B    269 ? 60.003 -21.925 12.354  1    51.676  ? 2350 B 1 .
ATOM 9016 C CD   . LYS Bxp B    269 ? 59.825 -23.428 12.123  1    61.646  ? 2350 B 1 .
ATOM 9017 C CE   . LYS Bxp B    269 ? 61.093 -24.245 12.211  1    65.423  ? 2350 B 1 .
ATOM 9018 N NZ   . LYS Bxp B    269 ? 61.741 -24.179 13.525  1    69.485  ? 2350 B 1 .
ATOM 9019 H H    . LYS Bxp B    269 ? 60.37  -19.859 10.322  1    51.68   ? 2350 B 1 c
ATOM 9020 H HA   . LYS Bxp B    269 ? 58.663 -21.986 10.042  1    48.267  ? 2350 B 1 c
ATOM 9021 H HB3  . LYS Bxp B    269 ? 57.989 -21.519 12.258  1    48.203  ? 2350 B 1 c
ATOM 9022 H HB2  . LYS Bxp B    269 ? 58.882 -20.207 12.248  1    47.982  ? 2350 B 1 c
ATOM 9023 H HG3  . LYS Bxp B    269 ? 60.142 -21.762 13.312  1    52.633  ? 2350 B 1 c
ATOM 9024 H HG2  . LYS Bxp B    269 ? 60.801 -21.617 11.873  1    52.628  ? 2350 B 1 c
ATOM 9025 H HD3  . LYS Bxp B    269 ? 59.425 -23.567 11.238  1    59.873  ? 2350 B 1 c
ATOM 9026 H HD2  . LYS Bxp B    269 ? 59.186 -23.769 12.786  1    60.004  ? 2350 B 1 c
ATOM 9027 H HE3  . LYS Bxp B    269 ? 61.72  -23.914 11.547  1    65.326  ? 2350 B 1 c
ATOM 9028 H HE2  . LYS Bxp B    269 ? 60.894 -25.175 12.002  1    65.446  ? 2350 B 1 c
ATOM 9029 H HZ1  . LYS Bxp B    269 ? 61.119 -24.265 14.178  1    68.188  ? 2350 B 1 c
ATOM 9030 H HZ2  . LYS Bxp B    269 ? 62.164 -23.384 13.618  1    68.219  ? 2350 B 1 c
ATOM 9031 H HZ3  . LYS Bxp B    269 ? 62.346 -24.85  13.601  1    68.283  ? 2350 B 1 c
ATOM 9032 N N    . LEU Bxp B    270 ? 57.202 -19.099 10.243  1    48.833  ? 2351 B 1 .
ATOM 9033 C CA   . LEU Bxp B    270 ? 56.093 -18.349 9.666   1    49.143  ? 2351 B 1 .
ATOM 9034 C C    . LEU Bxp B    270 ? 56.619 -17.126 8.897   1    53.371  ? 2351 B 1 .
ATOM 9035 O O    . LEU Bxp B    270 ? 57.211 -16.215 9.478   1    54.283  ? 2351 B 1 .
ATOM 9036 C CB   . LEU Bxp B    270 ? 55.1   -17.959 10.762  1    42.662  ? 2351 B 1 .
ATOM 9037 C CG   . LEU Bxp B    270 ? 53.632 -17.83  10.345  1    43.527  ? 2351 B 1 .
ATOM 9038 C CD1  . LEU Bxp B    270 ? 53.423 -17.899 8.828   1    45.266  ? 2351 B 1 .
ATOM 9039 C CD2  . LEU Bxp B    270 ? 52.74  -18.855 11.042  1    45.624  ? 2351 B 1 .
ATOM 9040 H H    . LEU Bxp B    270 ? 57.729 -18.704 10.876  1    48.039  ? 2351 B 1 c
ATOM 9041 H HA   . LEU Bxp B    270 ? 55.638 -18.94  9.022   1    48.501  ? 2351 B 1 c
ATOM 9042 H HB3  . LEU Bxp B    270 ? 55.389 -17.099 11.147  1    44.261  ? 2351 B 1 c
ATOM 9043 H HB2  . LEU Bxp B    270 ? 55.16  -18.63  11.481  1    44.198  ? 2351 B 1 c
ATOM 9044 H HG   . LEU Bxp B    270 ? 53.321 -16.934 10.636  1    44.069  ? 2351 B 1 c
ATOM 9045 H HD11 . LEU Bxp B    270 ? 53.891 -17.165 8.399   1    44.84   ? 2351 B 1 c
ATOM 9046 H HD12 . LEU Bxp B    270 ? 52.475 -17.833 8.631   1    44.719  ? 2351 B 1 c
ATOM 9047 H HD13 . LEU Bxp B    270 ? 53.759 -18.744 8.488   1    44.814  ? 2351 B 1 c
ATOM 9048 H HD21 . LEU Bxp B    270 ? 52.807 -18.743 12.005  1    44.997  ? 2351 B 1 c
ATOM 9049 H HD22 . LEU Bxp B    270 ? 53.025 -19.752 10.801  1    44.997  ? 2351 B 1 c
ATOM 9050 H HD23 . LEU Bxp B    270 ? 51.817 -18.724 10.766  1    44.997  ? 2351 B 1 c
ATOM 9051 N N    . VAL Bxp B    271 ? 56.373 -17.094 7.579   1    50.764  ? 2352 B 1 .
ATOM 9052 C CA   . VAL Bxp B    271 ? 56.842 -16.001 6.742   1    47.287  ? 2352 B 1 .
ATOM 9053 C C    . VAL Bxp B    271 ? 55.887 -14.837 6.953   1    44.348  ? 2352 B 1 .
ATOM 9054 O O    . VAL Bxp B    271 ? 54.693 -15.012 6.749   1    45.352  ? 2352 B 1 .
ATOM 9055 C CB   . VAL Bxp B    271 ? 56.893 -16.37  5.247   1    51.697  ? 2352 B 1 .
ATOM 9056 C CG1  . VAL Bxp B    271 ? 57.737 -15.378 4.456   1    49.481  ? 2352 B 1 .
ATOM 9057 C CG2  . VAL Bxp B    271 ? 57.365 -17.803 5.013   1    56.419  ? 2352 B 1 .
ATOM 9058 H H    . VAL Bxp B    271 ? 55.886 -17.766 7.196   1    50.597  ? 2352 B 1 c
ATOM 9059 H HA   . VAL Bxp B    271 ? 57.736 -15.741 7.035   1    48.117  ? 2352 B 1 c
ATOM 9060 H HB   . VAL Bxp B    271 ? 55.971 -16.309 4.903   1    51.193  ? 2352 B 1 c
ATOM 9061 H HG11 . VAL Bxp B    271 ? 58.577 -15.226 4.919   1    50.064  ? 2352 B 1 c
ATOM 9062 H HG12 . VAL Bxp B    271 ? 57.257 -14.537 4.374   1    50.096  ? 2352 B 1 c
ATOM 9063 H HG13 . VAL Bxp B    271 ? 57.916 -15.734 3.569   1    50.171  ? 2352 B 1 c
ATOM 9064 H HG21 . VAL Bxp B    271 ? 57.794 -17.869 4.144   1    54.941  ? 2352 B 1 c
ATOM 9065 H HG22 . VAL Bxp B    271 ? 56.603 -18.404 5.043   1    54.937  ? 2352 B 1 c
ATOM 9066 H HG23 . VAL Bxp B    271 ? 58     -18.052 5.705   1    54.927  ? 2352 B 1 c
ATOM 9067 N N    . LYS Bxp B    272 ? 56.414 -13.668 7.343   1    42.496  ? 2353 B 1 .
ATOM 9068 C CA   . LYS Bxp B    272 ? 55.599 -12.485 7.596   1    40.369  ? 2353 B 1 .
ATOM 9069 C C    . LYS Bxp B    272 ? 55.527 -11.608 6.35    1    40.07   ? 2353 B 1 .
ATOM 9070 O O    . LYS Bxp B    272 ? 54.514 -10.963 6.071   1    39.032  ? 2353 B 1 .
ATOM 9071 C CB   . LYS Bxp B    272 ? 56.158 -11.617 8.726   1    38.489  ? 2353 B 1 .
ATOM 9072 C CG   . LYS Bxp B    272 ? 56.096 -12.265 10.084  1    37.868  ? 2353 B 1 .
ATOM 9073 C CD   . LYS Bxp B    272 ? 57.274 -13.18  10.407  1    36.645  ? 2353 B 1 .
ATOM 9074 C CE   . LYS Bxp B    272 ? 57.079 -13.915 11.699  1    34.491  ? 2353 B 1 .
ATOM 9075 N NZ   . LYS Bxp B    272 ? 55.71  -14.404 11.869  1    32.655  ? 2353 B 1 .
ATOM 9076 H H    . LYS Bxp B    272 ? 57.318 -13.607 7.456   1    42.434  ? 2353 B 1 c
ATOM 9077 H HA   . LYS Bxp B    272 ? 54.683 -12.775 7.836   1    40.396  ? 2353 B 1 c
ATOM 9078 H HB3  . LYS Bxp B    272 ? 55.653 -10.776 8.759   1    38.762  ? 2353 B 1 c
ATOM 9079 H HB2  . LYS Bxp B    272 ? 57.09  -11.397 8.526   1    38.735  ? 2353 B 1 c
ATOM 9080 H HG3  . LYS Bxp B    272 ? 55.265 -12.783 10.135  1    37.648  ? 2353 B 1 c
ATOM 9081 H HG2  . LYS Bxp B    272 ? 56.048 -11.558 10.763  1    37.692  ? 2353 B 1 c
ATOM 9082 H HD3  . LYS Bxp B    272 ? 58.091 -12.646 10.46   1    36.409  ? 2353 B 1 c
ATOM 9083 H HD2  . LYS Bxp B    272 ? 57.386 -13.829 9.683   1    36.565  ? 2353 B 1 c
ATOM 9084 H HE3  . LYS Bxp B    272 ? 57.29  -13.33  12.445  1    34.518  ? 2353 B 1 c
ATOM 9085 H HE2  . LYS Bxp B    272 ? 57.689 -14.673 11.731  1    34.521  ? 2353 B 1 c
ATOM 9086 H HZ1  . LYS Bxp B    272 ? 55.394 -14.739 11.089  1    33.36   ? 2353 B 1 c
ATOM 9087 H HZ2  . LYS Bxp B    272 ? 55.17  -13.736 12.158  1    33.295  ? 2353 B 1 c
ATOM 9088 H HZ3  . LYS Bxp B    272 ? 55.706 -15.065 12.488  1    33.254  ? 2353 B 1 c
ATOM 9089 N N    . MET Bxp B    273 ? 56.624 -11.577 5.61    1    40.064  ? 2354 B 1 .
ATOM 9090 C CA   . MET Bxp B    273 ? 56.677 -10.746 4.437   1    46.136  ? 2354 B 1 .
ATOM 9091 C C    . MET Bxp B    273 ? 57.732 -11.332 3.513   1    50.621  ? 2354 B 1 .
ATOM 9092 O O    . MET Bxp B    273 ? 58.778 -11.781 3.969   1    52.608  ? 2354 B 1 .
ATOM 9093 C CB   . MET Bxp B    273 ? 57.014 -9.303  4.824   1    50.58   ? 2354 B 1 .
ATOM 9094 C CG   . MET Bxp B    273 ? 56.585 -8.262  3.786   1    53.242  ? 2354 B 1 .
ATOM 9095 S SD   . MET Bxp B    273 ? 57.082 -6.563  4.121   1    50.906  ? 2354 B 1 .
ATOM 9096 C CE   . MET Bxp B    273 ? 58.767 -7.118  4.405   1    54.67   ? 2354 B 1 .
ATOM 9097 H H    . MET Bxp B    273 ? 57.358 -12.069 5.844   1    41.439  ? 2354 B 1 c
ATOM 9098 H HA   . MET Bxp B    273 ? 55.798 -10.778 3.986   1    46.33   ? 2354 B 1 c
ATOM 9099 H HB3  . MET Bxp B    273 ? 57.98  -9.243  4.961   1    50.09   ? 2354 B 1 c
ATOM 9100 H HB2  . MET Bxp B    273 ? 56.579 -9.096  5.678   1    49.993  ? 2354 B 1 c
ATOM 9101 H HG3  . MET Bxp B    273 ? 55.619 -8.276  3.719   1    51.728  ? 2354 B 1 c
ATOM 9102 H HG2  . MET Bxp B    273 ? 56.944 -8.52   2.913   1    52.027  ? 2354 B 1 c
ATOM 9103 H HE3  . MET Bxp B    273 ? 58.922 -7.959  3.939   1    53.436  ? 2354 B 1 c
ATOM 9104 H HE2  . MET Bxp B    273 ? 58.919 -7.231  5.361   1    53.224  ? 2354 B 1 c
ATOM 9105 H HE1  . MET Bxp B    273 ? 59.382 -6.461  4.037   1    53.14   ? 2354 B 1 c
ATOM 9106 N N    . SER Bxp B    274 ? 57.424 -11.324 2.217   1    52.602  ? 2355 B 1 .
ATOM 9107 C CA   . SER Bxp B    274 ? 58.252 -11.948 1.207   1    50.408  ? 2355 B 1 .
ATOM 9108 C C    . SER Bxp B    274 ? 58.5   -10.934 0.106   1    48.272  ? 2355 B 1 .
ATOM 9109 O O    . SER Bxp B    274 ? 57.741 -9.979  0.006   1    48.966  ? 2355 B 1 .
ATOM 9110 C CB   . SER Bxp B    274 ? 57.548 -13.134 0.665   1    54.286  ? 2355 B 1 .
ATOM 9111 O OG   . SER Bxp B    274 ? 56.278 -12.714 0.18    1    55.104  ? 2355 B 1 .
ATOM 9112 H H    . SER Bxp B    274 ? 56.657 -10.905 1.949   1    51.512  ? 2355 B 1 c
ATOM 9113 H HA   . SER Bxp B    274 ? 59.11  -12.218 1.606   1    50.987  ? 2355 B 1 c
ATOM 9114 H HB3  . SER Bxp B    274 ? 57.432 -13.801 1.369   1    53.554  ? 2355 B 1 c
ATOM 9115 H HB2  . SER Bxp B    274 ? 58.069 -13.526 -0.062  1    53.531  ? 2355 B 1 c
ATOM 9116 H HG   . SER Bxp B    274 ? 55.92  -13.396 -0.134  0    41.9    ? 2355 B 1 c
ATOM 9117 N N    . TRP Bxp B    275 ? 59.505 -11.185 -0.742  1    48.5    ? 2356 B 1 .
ATOM 9118 C CA   . TRP Bxp B    275 ? 59.88  -10.257 -1.799  1    48.378  ? 2356 B 1 .
ATOM 9119 C C    . TRP Bxp B    275 ? 58.867 -10.331 -2.947  1    51.143  ? 2356 B 1 .
ATOM 9120 O O    . TRP Bxp B    275 ? 57.666 -10.371 -2.71   1    53.871  ? 2356 B 1 .
ATOM 9121 C CB   . TRP Bxp B    275 ? 61.3   -10.564 -2.285  1    47.487  ? 2356 B 1 .
ATOM 9122 C CG   . TRP Bxp B    275 ? 62.392 -10.56  -1.246  1    45.563  ? 2356 B 1 .
ATOM 9123 C CD1  . TRP Bxp B    275 ? 62.311 -10.602 0.117   1    45.22   ? 2356 B 1 .
ATOM 9124 C CD2  . TRP Bxp B    275 ? 63.8   -10.562 -1.554  1    43.015  ? 2356 B 1 .
ATOM 9125 N NE1  . TRP Bxp B    275 ? 63.564 -10.606 0.671   1    42.533  ? 2356 B 1 .
ATOM 9126 C CE2  . TRP Bxp B    275 ? 64.495 -10.587 -0.33   1    41.653  ? 2356 B 1 .
ATOM 9127 C CE3  . TRP Bxp B    275 ? 64.53  -10.54  -2.743  1    43.902  ? 2356 B 1 .
ATOM 9128 C CZ2  . TRP Bxp B    275 ? 65.882 -10.595 -0.27   1    41.716  ? 2356 B 1 .
ATOM 9129 C CZ3  . TRP Bxp B    275 ? 65.902 -10.555 -2.677  1    44.52   ? 2356 B 1 .
ATOM 9130 C CH2  . TRP Bxp B    275 ? 66.567 -10.586 -1.459  1    41.115  ? 2356 B 1 .
ATOM 9131 H H    . TRP Bxp B    275 ? 59.968 -11.97  -0.662  1    48.391  ? 2356 B 1 c
ATOM 9132 H HA   . TRP Bxp B    275 ? 59.87  -9.334  -1.426  1    48.726  ? 2356 B 1 c
ATOM 9133 H HB3  . TRP Bxp B    275 ? 61.536 -9.908  -2.974  1    47.386  ? 2356 B 1 c
ATOM 9134 H HB2  . TRP Bxp B    275 ? 61.291 -11.445 -2.718  1    47.372  ? 2356 B 1 c
ATOM 9135 H HD1  . TRP Bxp B    275 ? 61.511 -10.608 0.617   1    44.663  ? 2356 B 1 c
ATOM 9136 H HE1  . TRP Bxp B    275 ? 63.738 -10.624 1.526   1    42.966  ? 2356 B 1 c
ATOM 9137 H HE3  . TRP Bxp B    275 ? 64.088 -10.525 -3.575  1    43.807  ? 2356 B 1 c
ATOM 9138 H HZ2  . TRP Bxp B    275 ? 66.334 -10.619 0.556   1    41.612  ? 2356 B 1 c
ATOM 9139 H HZ3  . TRP Bxp B    275 ? 66.404 -10.541 -3.476  1    43.535  ? 2356 B 1 c
ATOM 9140 H HH2  . TRP Bxp B    275 ? 67.508 -10.588 -1.447  1    42.09   ? 2356 B 1 c
ATOM 9141 N N    . GLN Bxp B    276 ? 59.332 -10.379 -4.201  1    57.206  ? 2357 B 1 .
ATOM 9142 C CA   . GLN Bxp B    276 ? 58.418 -10.343 -5.327  1    65.194  ? 2357 B 1 .
ATOM 9143 C C    . GLN Bxp B    276 ? 58.858 -11.167 -6.543  1    80.896  ? 2357 B 1 .
ATOM 9144 O O    . GLN Bxp B    276 ? 59.901 -11.835 -6.564  1    73.705  ? 2357 B 1 .
ATOM 9145 C CB   . GLN Bxp B    276 ? 58.177 -8.881  -5.69   1    66.778  ? 2357 B 1 .
ATOM 9146 C CG   . GLN Bxp B    276 ? 57.096 -8.228  -4.842  1    70.316  ? 2357 B 1 .
ATOM 9147 C CD   . GLN Bxp B    276 ? 55.768 -8.95   -4.866  1    71.57   ? 2357 B 1 .
ATOM 9148 O OE1  . GLN Bxp B    276 ? 55.697 -10.159 -5.1    1    71.938  ? 2357 B 1 .
ATOM 9149 N NE2  . GLN Bxp B    276 ? 54.701 -8.205  -4.602  1    71.216  ? 2357 B 1 .
ATOM 9150 H H    . GLN Bxp B    276 ? 60.229 -10.435 -4.364  1    57.014  ? 2357 B 1 c
ATOM 9151 H HA   . GLN Bxp B    276 ? 57.565 -10.728 -5.023  1    66.368  ? 2357 B 1 c
ATOM 9152 H HB3  . GLN Bxp B    276 ? 57.926 -8.814  -6.633  1    67.57   ? 2357 B 1 c
ATOM 9153 H HB2  . GLN Bxp B    276 ? 59.015 -8.386  -5.571  1    67.207  ? 2357 B 1 c
ATOM 9154 H HG3  . GLN Bxp B    276 ? 56.956 -7.311  -5.153  1    69.551  ? 2357 B 1 c
ATOM 9155 H HG2  . GLN Bxp B    276 ? 57.404 -8.177  -3.914  1    68.859  ? 2357 B 1 c
ATOM 9156 H HE21 . GLN Bxp B    276 ? 53.956 -8.317  -5.071  1    71.323  ? 2357 B 1 c
ATOM 9157 H HE22 . GLN Bxp B    276 ? 54.734 -7.596  -3.958  1    71.318  ? 2357 B 1 c
ATOM 9158 N N    . THR Bxp B    277 ? 57.972 -11.09  -7.552  1    97.334  ? 2358 B 1 .
ATOM 9159 C CA   . THR Bxp B    277 ? 57.95  -11.913 -8.756  1    91.457  ? 2358 B 1 .
ATOM 9160 C C    . THR Bxp B    277 ? 59.357 -12.083 -9.306  1    85.306  ? 2358 B 1 .
ATOM 9161 O O    . THR Bxp B    277 ? 59.715 -11.27  -10.182 1    84.055  ? 2358 B 1 .
ATOM 9162 C CB   . THR Bxp B    277 ? 57.004 -11.276 -9.787  1    84.319  ? 2358 B 1 .
ATOM 9163 O OG1  . THR Bxp B    277 ? 57.654 -10.174 -10.417 1    79.181  ? 2358 B 1 .
ATOM 9164 C CG2  . THR Bxp B    277 ? 55.697 -10.774 -9.19   1    76.387  ? 2358 B 1 .
ATOM 9165 O OXT  . THR Bxp B    277 ? 60.051 -13.031 -8.854  1    73.612  ? 2358 B 1 .
ATOM 9166 H H    . THR Bxp B    277 ? 57.311 -10.467 -7.466  1    90.715  ? 2358 B 1 c
ATOM 9167 H HA   . THR Bxp B    277 ? 57.598 -12.798 -8.516  1    90.051  ? 2358 B 1 c
ATOM 9168 H HB   . THR Bxp B    277 ? 56.786 -11.951 -10.474 1    82.996  ? 2358 B 1 c
ATOM 9169 H HG1  . THR Bxp B    277 ? 58.145 -9.653  -9.997  0    54.19   ? 2358 B 1 c
ATOM 9170 H HG21 . THR Bxp B    277 ? 54.995 -10.823 -9.861  1    78.728  ? 2358 B 1 c
ATOM 9171 H HG22 . THR Bxp B    277 ? 55.802 -9.851  -8.903  1    78.797  ? 2358 B 1 c
ATOM 9172 H HG23 . THR Bxp B    277 ? 55.453 -11.325 -8.428  1    78.91   ? 2358 B 1 c
ATOM 9173 O O1   . SO4 Bx1 SO4! .   ? 66.906 22.052  -3.437  1    114.062 ? 3360 B 1 .
ATOM 9174 O O2   . SO4 Bx1 SO4! .   ? 66.118 23.018  -5.457  1    87.751  ? 3360 B 1 .
ATOM 9175 O O3   . SO4 Bx1 SO4! .   ? 65.787 20.738  -5.027  1    121.2   ? 3360 B 1 .
ATOM 9176 O O4   . SO4 Bx1 SO4! .   ? 64.593 22.316  -3.793  1    113.437 ? 3360 B 1 .
ATOM 9177 S S    . SO4 Bx1 SO4! .   ? 65.855 22.038  -4.428  1    109.197 ? 3360 B 1 .
ATOM 9178 O O1   . SO4 Bx2 SO4! .   ? 63.916 1.876   0.808   1    104.492 ? 3361 B 1 .
ATOM 9179 O O2   . SO4 Bx2 SO4! .   ? 64.121 3.763   2.181   1    95.654  ? 3361 B 1 .
ATOM 9180 O O3   . SO4 Bx2 SO4! .   ? 61.995 2.821   1.792   1    92.488  ? 3361 B 1 .
ATOM 9181 O O4   . SO4 Bx2 SO4! .   ? 63.552 1.677   3.129   1    91.176  ? 3361 B 1 .
ATOM 9182 S S    . SO4 Bx2 SO4! .   ? 63.392 2.532   1.98    1    104.374 ? 3361 B 1 .
ATOM 9183 O O1   . SO4 Bx3 SO4! .   ? 78.208 6.427   7.366   1    119.792 ? 3362 B 1 .
ATOM 9184 O O2   . SO4 Bx3 SO4! .   ? 77.196 5.251   5.614   1    97.875  ? 3362 B 1 .
ATOM 9185 O O3   . SO4 Bx3 SO4! .   ? 76.414 4.992   7.829   1    113.499 ? 3362 B 1 .
ATOM 9186 O O4   . SO4 Bx3 SO4! .   ? 76.025 6.991   6.685   1    124.311 ? 3362 B 1 .
ATOM 9187 S S    . SO4 Bx3 SO4! .   ? 76.963 5.912   6.87    1    117.558 ? 3362 B 1 .
ATOM 9188 O O1   . SO4 Bx4 SO4! .   ? 59.136 20.932  12.952  1    101.3   ? 3363 B 1 .
ATOM 9189 O O2   . SO4 Bx4 SO4! .   ? 57.787 19.245  13.879  1    107.285 ? 3363 B 1 .
ATOM 9190 O O3   . SO4 Bx4 SO4! .   ? 59.834 19.831  14.911  1    108.752 ? 3363 B 1 .
ATOM 9191 O O4   . SO4 Bx4 SO4! .   ? 58.018 21.298  14.992  1    114.024 ? 3363 B 1 .
ATOM 9192 S S    . SO4 Bx4 SO4! .   ? 58.694 20.322  14.182  1    106.718 ? 3363 B 1 .
ATOM 9193 O O1   . SO4 Bx5 SO4! .   ? 59.137 14.302  -1.569  1    84.342  ? 3364 B 1 .
ATOM 9194 O O2   . SO4 Bx5 SO4! .   ? 57.176 15.475  -1.137  1    102.615 ? 3364 B 1 .
ATOM 9195 O O3   . SO4 Bx5 SO4! .   ? 57.469 13.331  -0.212  1    79.627  ? 3364 B 1 .
ATOM 9196 O O4   . SO4 Bx5 SO4! .   ? 58.724 15.136  0.61    1    83.961  ? 3364 B 1 .
ATOM 9197 S S    . SO4 Bx5 SO4! .   ? 58.13  14.558  -0.575  1    84.818  ? 3364 B 1 .



loop_
_struct_mon_prot_cis.pdbx_id
_struct_mon_prot_cis.pdbx_PDB_model_num
_struct_mon_prot_cis.label_asym_id
_struct_mon_prot_cis.label_seq_id
_struct_mon_prot_cis.label_comp_id
_struct_mon_prot_cis.auth_asym_id
_struct_mon_prot_cis.auth_seq_id
_struct_mon_prot_cis.pdbx_PDB_ins_code
_struct_mon_prot_cis.pdbx_label_asym_id_2
_struct_mon_prot_cis.pdbx_label_seq_id_2
_struct_mon_prot_cis.pdbx_label_comp_id_2
_struct_mon_prot_cis.pdbx_auth_asym_id_2
_struct_mon_prot_cis.pdbx_auth_seq_id_2
_struct_mon_prot_cis.pdbx_PDB_ins_code_2
_struct_mon_prot_cis.label_alt_id
_struct_mon_prot_cis.pdbx_omega_angle
1 1 Axp 111 GLU A 1192 ? Axp 112 LYS A 1193 ? . -0.397897676

data_LYS
_chem_comp.id                     LYS
_chem_comp.group                  peptide

loop_
_chem_comp_atom.comp_id
_chem_comp_atom.atom_id
_chem_comp_atom.type_symbol
_chem_comp_atom.type_energy
_chem_comp_atom.charge
LYS N   N NT3 1
LYS CA  C CH1 0
LYS C   C C   0
LYS O   O O   0
LYS CB  C CH2 0
LYS CG  C CH2 0
LYS CD  C CH2 0
LYS CE  C CH2 0
LYS NZ  N NT3 1
LYS OXT O OC  -1
LYS H   H H   0
LYS H2  H H   0
LYS H3  H H   0
LYS HA  H H   0
LYS HB3 H H   0
LYS HB2 H H   0
LYS HG3 H H   0
LYS HG2 H H   0
LYS HD3 H H   0
LYS HD2 H H   0
LYS HE3 H H   0
LYS HE2 H H   0
LYS HZ1 H H   0
LYS HZ2 H H   0
LYS HZ3 H H   0

loop_
_chem_comp_bond.comp_id
_chem_comp_bond.atom_id_1
_chem_comp_bond.atom_id_2
_chem_comp_bond.type
_chem_comp_bond.aromatic
_chem_comp_bond.value_dist
_chem_comp_bond.value_dist_esd
_chem_comp_bond.value_dist_nucleus
_chem_comp_bond.value_dist_nucleus_esd
LYS N  CA  single n 1.487 0.01   1.487 0.01
LYS CA C   single n 1.538 0.0113 1.538 0.0113
LYS CA CB  single n 1.533 0.01   1.533 0.01
LYS C  O   double n 1.251 0.0183 1.251 0.0183
LYS C  OXT single n 1.251 0.0183 1.251 0.0183
LYS CB CG  single n 1.523 0.0189 1.523 0.0189
LYS CG CD  single n 1.524 0.0122 1.524 0.0122
LYS CD CE  single n 1.496 0.02   1.496 0.02
LYS CE NZ  single n 1.465 0.013  1.465 0.013
LYS N  H   single n 0.902 0.0102 1.018 0.052
LYS N  H2  single n 0.902 0.0102 1.018 0.052
LYS N  H3  single n 0.902 0.0102 1.018 0.052
LYS CA HA  single n 0.991 0.02   1.092 0.01
LYS CB HB3 single n 0.981 0.0141 1.092 0.01
LYS CB HB2 single n 0.981 0.0141 1.092 0.01
LYS CG HG3 single n 0.982 0.0163 1.092 0.01
LYS CG HG2 single n 0.982 0.0163 1.092 0.01
LYS CD HD3 single n 0.982 0.0163 1.092 0.01
LYS CD HD2 single n 0.982 0.0163 1.092 0.01
LYS CE HE3 single n 0.974 0.0147 1.092 0.01
LYS CE HE2 single n 0.974 0.0147 1.092 0.01
LYS NZ HZ1 single n 0.906 0.02   1.018 0.052
LYS NZ HZ2 single n 0.906 0.02   1.018 0.052
LYS NZ HZ3 single n 0.906 0.02   1.018 0.052

loop_
_chem_comp_angle.comp_id
_chem_comp_angle.atom_id_1
_chem_comp_angle.atom_id_2
_chem_comp_angle.atom_id_3
_chem_comp_angle.value_angle
_chem_comp_angle.value_angle_esd
LYS CA  N  H   109.99  3
LYS CA  N  H2  109.99  3
LYS CA  N  H3  109.99  3
LYS H   N  H2  109.032 3
LYS H   N  H3  109.032 3
LYS H2  N  H3  109.032 3
LYS N   CA C   109.258 1.5
LYS N   CA CB  110.44  2.46
LYS N   CA HA  108.387 1.58
LYS C   CA CB  111.059 3
LYS C   CA HA  108.774 1.79
LYS CB  CA HA  109.08  2.33
LYS CA  C  O   117.148 1.6
LYS CA  C  OXT 117.148 1.6
LYS O   C  OXT 125.704 1.5
LYS CA  CB CG  115.148 2.35
LYS CA  CB HB3 108.677 1.74
LYS CA  CB HB2 108.677 1.74
LYS CG  CB HB3 108.413 1.5
LYS CG  CB HB2 108.413 1.5
LYS HB3 CB HB2 107.655 1.5
LYS CB  CG CD  113.403 3
LYS CB  CG HG3 108.381 1.5
LYS CB  CG HG2 108.381 1.5
LYS CD  CG HG3 108.819 1.5
LYS CD  CG HG2 108.819 1.5
LYS HG3 CG HG2 107.566 1.82
LYS CG  CD CE  112.541 3
LYS CG  CD HD3 108.993 1.92
LYS CG  CD HD2 108.993 1.92
LYS CE  CD HD3 109.016 1.5
LYS CE  CD HD2 109.016 1.5
LYS HD3 CD HD2 107.958 2.23
LYS CD  CE NZ  111.716 3
LYS CD  CE HE3 109.468 2.65
LYS CD  CE HE2 109.468 2.65
LYS NZ  CE HE3 108.972 2.23
LYS NZ  CE HE2 108.972 2.23
LYS HE3 CE HE2 108.144 2.57
LYS CE  NZ HZ1 109.659 3
LYS CE  NZ HZ2 109.659 3
LYS CE  NZ HZ3 109.659 3
LYS HZ1 NZ HZ2 109.089 3
LYS HZ1 NZ HZ3 109.089 3
LYS HZ2 NZ HZ3 109.089 3

loop_
_chem_comp_tor.comp_id
_chem_comp_tor.id
_chem_comp_tor.atom_id_1
_chem_comp_tor.atom_id_2
_chem_comp_tor.atom_id_3
_chem_comp_tor.atom_id_4
_chem_comp_tor.value_angle
_chem_comp_tor.value_angle_esd
_chem_comp_tor.period
LYS chi1      N  CA CB CG  -60 10 3
LYS chi2      CA CB CG CD  180 10 3
LYS chi3      CB CG CD CE  180 10 3
LYS chi4      CG CD CE NZ  180 10 3
LYS hh1       CD CE NZ HZ3 180 10 3
LYS sp3_sp3_1 C  CA N  H   180 10 3
LYS sp2_sp3_1 O  C  CA N   0   10 6

loop_
_chem_comp_chir.comp_id
_chem_comp_chir.id
_chem_comp_chir.atom_id_centre
_chem_comp_chir.atom_id_1
_chem_comp_chir.atom_id_2
_chem_comp_chir.atom_id_3
_chem_comp_chir.volume_sign
LYS chir_1 CA N C CB positive

loop_
_chem_comp_plane_atom.comp_id
_chem_comp_plane_atom.plane_id
_chem_comp_plane_atom.atom_id
_chem_comp_plane_atom.dist_esd
LYS plan-1 C   0.02
LYS plan-1 CA  0.02
LYS plan-1 O   0.02
LYS plan-1 OXT 0.02

data_LEU
_chem_comp.id                     LEU
_chem_comp.group                  peptide

loop_
_chem_comp_atom.comp_id
_chem_comp_atom.atom_id
_chem_comp_atom.type_symbol
_chem_comp_atom.type_energy
_chem_comp_atom.charge
LEU N    N NT3 1
LEU CA   C CH1 0
LEU C    C C   0
LEU O    O O   0
LEU CB   C CH2 0
LEU CG   C CH1 0
LEU CD1  C CH3 0
LEU CD2  C CH3 0
LEU OXT  O OC  -1
LEU H    H H   0
LEU H2   H H   0
LEU H3   H H   0
LEU HA   H H   0
LEU HB3  H H   0
LEU HB2  H H   0
LEU HG   H H   0
LEU HD11 H H   0
LEU HD12 H H   0
LEU HD13 H H   0
LEU HD21 H H   0
LEU HD22 H H   0
LEU HD23 H H   0

loop_
_chem_comp_bond.comp_id
_chem_comp_bond.atom_id_1
_chem_comp_bond.atom_id_2
_chem_comp_bond.type
_chem_comp_bond.aromatic
_chem_comp_bond.value_dist
_chem_comp_bond.value_dist_esd
_chem_comp_bond.value_dist_nucleus
_chem_comp_bond.value_dist_nucleus_esd
LEU N   CA   single n 1.487 0.01   1.487 0.01
LEU CA  C    single n 1.538 0.0113 1.538 0.0113
LEU CA  CB   single n 1.528 0.01   1.528 0.01
LEU C   O    double n 1.251 0.0183 1.251 0.0183
LEU C   OXT  single n 1.251 0.0183 1.251 0.0183
LEU CB  CG   single n 1.532 0.01   1.532 0.01
LEU CG  CD1  single n 1.519 0.02   1.519 0.02
LEU CG  CD2  single n 1.519 0.02   1.519 0.02
LEU N   H    single n 0.902 0.0102 1.018 0.052
LEU N   H2   single n 0.902 0.0102 1.018 0.052
LEU N   H3   single n 0.902 0.0102 1.018 0.052
LEU CA  HA   single n 0.991 0.02   1.092 0.01
LEU CB  HB3  single n 0.985 0.0129 1.092 0.01
LEU CB  HB2  single n 0.985 0.0129 1.092 0.01
LEU CG  HG   single n 0.992 0.0164 1.092 0.01
LEU CD1 HD11 single n 0.972 0.0156 1.092 0.01
LEU CD1 HD12 single n 0.972 0.0156 1.092 0.01
LEU CD1 HD13 single n 0.972 0.0156 1.092 0.01
LEU CD2 HD21 single n 0.972 0.0156 1.092 0.01
LEU CD2 HD22 single n 0.972 0.0156 1.092 0.01
LEU CD2 HD23 single n 0.972 0.0156 1.092 0.01

loop_
_chem_comp_angle.comp_id
_chem_comp_angle.atom_id_1
_chem_comp_angle.atom_id_2
_chem_comp_angle.atom_id_3
_chem_comp_angle.value_angle
_chem_comp_angle.value_angle_esd
LEU CA   N   H    109.99  3
LEU CA   N   H2   109.99  3
LEU CA   N   H3   109.99  3
LEU H    N   H2   109.032 3
LEU H    N   H3   109.032 3
LEU H2   N   H3   109.032 3
LEU N    CA  C    109.258 1.5
LEU N    CA  CB   109.859 2.63
LEU N    CA  HA   108.387 1.58
LEU C    CA  CB   111.627 1.5
LEU C    CA  HA   108.774 1.79
LEU CB   CA  HA   109.261 1.5
LEU CA   C   O    117.148 1.6
LEU CA   C   OXT  117.148 1.6
LEU O    C   OXT  125.704 1.5
LEU CA   CB  CG   115.973 1.5
LEU CA   CB  HB3  108.172 1.5
LEU CA   CB  HB2  108.172 1.5
LEU CG   CB  HB3  108.39  1.5
LEU CG   CB  HB2  108.39  1.5
LEU HB3  CB  HB2  107.673 3
LEU CB   CG  CD1  110.898 3
LEU CB   CG  CD2  110.898 3
LEU CB   CG  HG   108.09  1.5
LEU CD1  CG  CD2  110.647 1.82
LEU CD1  CG  HG   107.962 1.81
LEU CD2  CG  HG   107.962 1.81
LEU CG   CD1 HD11 109.527 1.5
LEU CG   CD1 HD12 109.527 1.5
LEU CG   CD1 HD13 109.527 1.5
LEU HD11 CD1 HD12 109.39  1.5
LEU HD11 CD1 HD13 109.39  1.5
LEU HD12 CD1 HD13 109.39  1.5
LEU CG   CD2 HD21 109.527 1.5
LEU CG   CD2 HD22 109.527 1.5
LEU CG   CD2 HD23 109.527 1.5
LEU HD21 CD2 HD22 109.39  1.5
LEU HD21 CD2 HD23 109.39  1.5
LEU HD22 CD2 HD23 109.39  1.5

loop_
_chem_comp_tor.comp_id
_chem_comp_tor.id
_chem_comp_tor.atom_id_1
_chem_comp_tor.atom_id_2
_chem_comp_tor.atom_id_3
_chem_comp_tor.atom_id_4
_chem_comp_tor.value_angle
_chem_comp_tor.value_angle_esd
_chem_comp_tor.period
LEU chi1      N  CA CB  CG   -60 10 3
LEU chi2      CA CB CG  CD1  180 10 3
LEU hh1       CB CG CD1 HD13 60  10 3
LEU hh2       CB CG CD2 HD23 180 10 3
LEU sp3_sp3_1 C  CA N   H    180 10 3
LEU sp2_sp3_1 O  C  CA  N    0   10 6

loop_
_chem_comp_chir.comp_id
_chem_comp_chir.id
_chem_comp_chir.atom_id_centre
_chem_comp_chir.atom_id_1
_chem_comp_chir.atom_id_2
_chem_comp_chir.atom_id_3
_chem_comp_chir.volume_sign
LEU chir_1 CA N  C   CB  positive
LEU chir_2 CG CB CD1 CD2 both

loop_
_chem_comp_plane_atom.comp_id
_chem_comp_plane_atom.plane_id
_chem_comp_plane_atom.atom_id
_chem_comp_plane_atom.dist_esd
LEU plan-1 C   0.02
LEU plan-1 CA  0.02
LEU plan-1 O   0.02
LEU plan-1 OXT 0.02

data_SER
_chem_comp.id                     SER
_chem_comp.group                  peptide

loop_
_chem_comp_atom.comp_id
_chem_comp_atom.atom_id
_chem_comp_atom.type_symbol
_chem_comp_atom.type_energy
_chem_comp_atom.charge
SER N   N NT3 1
SER CA  C CH1 0
SER C   C C   0
SER O   O O   0
SER CB  C CH2 0
SER OG  O OH1 0
SER OXT O OC  -1
SER H   H H   0
SER H2  H H   0
SER H3  H H   0
SER HA  H H   0
SER HB3 H H   0
SER HB2 H H   0
SER HG  H H   0

loop_
_chem_comp_bond.comp_id
_chem_comp_bond.atom_id_1
_chem_comp_bond.atom_id_2
_chem_comp_bond.type
_chem_comp_bond.aromatic
_chem_comp_bond.value_dist
_chem_comp_bond.value_dist_esd
_chem_comp_bond.value_dist_nucleus
_chem_comp_bond.value_dist_nucleus_esd
SER N  CA  single n 1.487 0.01   1.487 0.01
SER CA C   single n 1.536 0.01   1.536 0.01
SER CA CB  single n 1.508 0.019  1.508 0.019
SER C  O   double n 1.251 0.0183 1.251 0.0183
SER C  OXT single n 1.251 0.0183 1.251 0.0183
SER CB OG  single n 1.421 0.0108 1.421 0.0108
SER N  H   single n 0.902 0.0102 1.018 0.052
SER N  H2  single n 0.902 0.0102 1.018 0.052
SER N  H3  single n 0.902 0.0102 1.018 0.052
SER CA HA  single n 0.991 0.02   1.092 0.01
SER CB HB3 single n 0.976 0.018  1.092 0.01
SER CB HB2 single n 0.976 0.018  1.092 0.01
SER OG HG  single n 0.846 0.02   0.972 0.018

loop_
_chem_comp_angle.comp_id
_chem_comp_angle.atom_id_1
_chem_comp_angle.atom_id_2
_chem_comp_angle.atom_id_3
_chem_comp_angle.value_angle
_chem_comp_angle.value_angle_esd
SER CA  N  H   109.696 3
SER CA  N  H2  109.696 3
SER CA  N  H3  109.696 3
SER H   N  H2  109.032 3
SER H   N  H3  109.032 3
SER H2  N  H3  109.032 3
SER N   CA C   109.839 1.5
SER N   CA CB  111.152 1.5
SER N   CA HA  108.129 1.5
SER C   CA CB  111.3   1.5
SER C   CA HA  108.235 1.5
SER CB  CA HA  108.445 1.5
SER CA  C  O   117.199 1.5
SER CA  C  OXT 117.189 1.5
SER O   C  OXT 125.593 1.5
SER CA  CB OG  110.934 1.86
SER CA  CB HB3 109.238 1.5
SER CA  CB HB2 109.238 1.5
SER OG  CB HB3 109.353 1.5
SER OG  CB HB2 109.353 1.5
SER HB3 CB HB2 108.095 1.88
SER CB  OG HG  108.539 3

loop_
_chem_comp_tor.comp_id
_chem_comp_tor.id
_chem_comp_tor.atom_id_1
_chem_comp_tor.atom_id_2
_chem_comp_tor.atom_id_3
_chem_comp_tor.atom_id_4
_chem_comp_tor.value_angle
_chem_comp_tor.value_angle_esd
_chem_comp_tor.period
SER chi1      N  CA CB OG -60 10 3
SER hh1       CA CB OG HG 180 10 3
SER sp3_sp3_1 C  CA N  H  180 10 3
SER sp2_sp3_1 O  C  CA N  0   10 6

loop_
_chem_comp_chir.comp_id
_chem_comp_chir.id
_chem_comp_chir.atom_id_centre
_chem_comp_chir.atom_id_1
_chem_comp_chir.atom_id_2
_chem_comp_chir.atom_id_3
_chem_comp_chir.volume_sign
SER chir_1 CA N C CB positive

loop_
_chem_comp_plane_atom.comp_id
_chem_comp_plane_atom.plane_id
_chem_comp_plane_atom.atom_id
_chem_comp_plane_atom.dist_esd
SER plan-1 C   0.02
SER plan-1 CA  0.02
SER plan-1 O   0.02
SER plan-1 OXT 0.02

data_ASP
_chem_comp.id                     ASP
_chem_comp.group                  peptide

loop_
_chem_comp_atom.comp_id
_chem_comp_atom.atom_id
_chem_comp_atom.type_symbol
_chem_comp_atom.type_energy
_chem_comp_atom.charge
ASP N   N NT3 1
ASP CA  C CH1 0
ASP C   C C   0
ASP O   O O   0
ASP CB  C CH2 0
ASP CG  C C   0
ASP OD1 O O   0
ASP OD2 O OC  -1
ASP OXT O OC  -1
ASP H   H H   0
ASP H2  H H   0
ASP H3  H H   0
ASP HA  H H   0
ASP HB3 H H   0
ASP HB2 H H   0

loop_
_chem_comp_bond.comp_id
_chem_comp_bond.atom_id_1
_chem_comp_bond.atom_id_2
_chem_comp_bond.type
_chem_comp_bond.aromatic
_chem_comp_bond.value_dist
_chem_comp_bond.value_dist_esd
_chem_comp_bond.value_dist_nucleus
_chem_comp_bond.value_dist_nucleus_esd
ASP N  CA  single n 1.49  0.01   1.49  0.01
ASP CA C   single n 1.533 0.01   1.533 0.01
ASP CA CB  single n 1.521 0.01   1.521 0.01
ASP C  O   double n 1.251 0.0183 1.251 0.0183
ASP C  OXT single n 1.251 0.0183 1.251 0.0183
ASP CB CG  single n 1.522 0.01   1.522 0.01
ASP CG OD1 double n 1.249 0.0161 1.249 0.0161
ASP CG OD2 single n 1.249 0.0161 1.249 0.0161
ASP N  H   single n 0.902 0.0102 1.018 0.052
ASP N  H2  single n 0.902 0.0102 1.018 0.052
ASP N  H3  single n 0.902 0.0102 1.018 0.052
ASP CA HA  single n 0.984 0.02   1.092 0.01
ASP CB HB3 single n 0.98  0.0165 1.092 0.01
ASP CB HB2 single n 0.98  0.0165 1.092 0.01

loop_
_chem_comp_angle.comp_id
_chem_comp_angle.atom_id_1
_chem_comp_angle.atom_id_2
_chem_comp_angle.atom_id_3
_chem_comp_angle.value_angle
_chem_comp_angle.value_angle_esd
ASP CA  N  H   109.99  3
ASP CA  N  H2  109.99  3
ASP CA  N  H3  109.99  3
ASP H   N  H2  109.032 3
ASP H   N  H3  109.032 3
ASP H2  N  H3  109.032 3
ASP N   CA C   109.258 1.5
ASP N   CA CB  111.4   1.5
ASP N   CA HA  108.387 1.58
ASP C   CA CB  112.421 3
ASP C   CA HA  108.774 1.79
ASP CB  CA HA  108.472 2.65
ASP CA  C  O   117.148 1.6
ASP CA  C  OXT 117.148 1.6
ASP O   C  OXT 125.704 1.5
ASP CA  CB CG  115.436 1.5
ASP CA  CB HB3 108.799 3
ASP CA  CB HB2 108.799 3
ASP CG  CB HB3 108.242 2.79
ASP CG  CB HB2 108.242 2.79
ASP HB3 CB HB2 107.976 2.66
ASP CB  CG OD1 117.985 1.5
ASP CB  CG OD2 117.985 1.5
ASP OD1 CG OD2 124.031 1.82

loop_
_chem_comp_tor.comp_id
_chem_comp_tor.id
_chem_comp_tor.atom_id_1
_chem_comp_tor.atom_id_2
_chem_comp_tor.atom_id_3
_chem_comp_tor.atom_id_4
_chem_comp_tor.value_angle
_chem_comp_tor.value_angle_esd
_chem_comp_tor.period
ASP chi1      N  CA CB CG  -60 10 3
ASP chi2      CA CB CG OD1 180 10 6
ASP sp3_sp3_1 C  CA N  H   180 10 3
ASP sp2_sp3_1 O  C  CA N   0   10 6

loop_
_chem_comp_chir.comp_id
_chem_comp_chir.id
_chem_comp_chir.atom_id_centre
_chem_comp_chir.atom_id_1
_chem_comp_chir.atom_id_2
_chem_comp_chir.atom_id_3
_chem_comp_chir.volume_sign
ASP chir_1 CA N C CB positive

loop_
_chem_comp_plane_atom.comp_id
_chem_comp_plane_atom.plane_id
_chem_comp_plane_atom.atom_id
_chem_comp_plane_atom.dist_esd
ASP plan-1 C   0.02
ASP plan-1 CA  0.02
ASP plan-1 O   0.02
ASP plan-1 OXT 0.02
ASP plan-2 CB  0.02
ASP plan-2 CG  0.02
ASP plan-2 OD1 0.02
ASP plan-2 OD2 0.02

data_TRP
_chem_comp.id                     TRP
_chem_comp.group                  peptide

loop_
_chem_comp_atom.comp_id
_chem_comp_atom.atom_id
_chem_comp_atom.type_symbol
_chem_comp_atom.type_energy
_chem_comp_atom.charge
TRP N   N NT3  1
TRP CA  C CH1  0
TRP C   C C    0
TRP O   O O    0
TRP CB  C CH2  0
TRP CG  C CR5  0
TRP CD1 C CR15 0
TRP CD2 C CR56 0
TRP NE1 N NR15 0
TRP CE2 C CR56 0
TRP CE3 C CR16 0
TRP CZ2 C CR16 0
TRP CZ3 C CR16 0
TRP CH2 C CR16 0
TRP OXT O OC   -1
TRP H   H H    0
TRP H2  H H    0
TRP H3  H H    0
TRP HA  H H    0
TRP HB3 H H    0
TRP HB2 H H    0
TRP HD1 H H    0
TRP HE1 H H    0
TRP HE3 H H    0
TRP HZ2 H H    0
TRP HZ3 H H    0
TRP HH2 H H    0

loop_
_chem_comp_bond.comp_id
_chem_comp_bond.atom_id_1
_chem_comp_bond.atom_id_2
_chem_comp_bond.type
_chem_comp_bond.aromatic
_chem_comp_bond.value_dist
_chem_comp_bond.value_dist_esd
_chem_comp_bond.value_dist_nucleus
_chem_comp_bond.value_dist_nucleus_esd
TRP N   CA  single n 1.486 0.01   1.486 0.01
TRP CA  C   single n 1.532 0.0129 1.532 0.0129
TRP CA  CB  single n 1.535 0.01   1.535 0.01
TRP C   O   double n 1.251 0.0183 1.251 0.0183
TRP C   OXT single n 1.251 0.0183 1.251 0.0183
TRP CB  CG  single n 1.506 0.01   1.506 0.01
TRP CG  CD1 double y 1.364 0.01   1.364 0.01
TRP CG  CD2 single y 1.445 0.01   1.445 0.01
TRP CD1 NE1 single y 1.369 0.01   1.369 0.01
TRP CD2 CE2 double y 1.412 0.01   1.412 0.01
TRP CD2 CE3 single y 1.399 0.01   1.399 0.01
TRP NE1 CE2 single y 1.37  0.01   1.37  0.01
TRP CE2 CZ2 single y 1.393 0.01   1.393 0.01
TRP CE3 CZ3 double y 1.377 0.01   1.377 0.01
TRP CZ2 CH2 double y 1.376 0.0101 1.376 0.0101
TRP CZ3 CH2 single y 1.394 0.012  1.394 0.012
TRP N   H   single n 0.902 0.0102 1.018 0.052
TRP N   H2  single n 0.902 0.0102 1.018 0.052
TRP N   H3  single n 0.902 0.0102 1.018 0.052
TRP CA  HA  single n 0.995 0.02   1.092 0.01
TRP CB  HB3 single n 0.981 0.01   1.092 0.01
TRP CB  HB2 single n 0.981 0.01   1.092 0.01
TRP CD1 HD1 single n 0.944 0.0195 1.085 0.015
TRP NE1 HE1 single n 0.873 0.02   1.013 0.012
TRP CE3 HE3 single n 0.942 0.0199 1.085 0.015
TRP CZ2 HZ2 single n 0.942 0.0181 1.085 0.015
TRP CZ3 HZ3 single n 0.943 0.0167 1.085 0.015
TRP CH2 HH2 single n 0.941 0.0176 1.085 0.015

loop_
_chem_comp_angle.comp_id
_chem_comp_angle.atom_id_1
_chem_comp_angle.atom_id_2
_chem_comp_angle.atom_id_3
_chem_comp_angle.value_angle
_chem_comp_angle.value_angle_esd
TRP CA  N   H   109.786 3
TRP CA  N   H2  109.786 3
TRP CA  N   H3  109.786 3
TRP H   N   H2  109.032 3
TRP H   N   H3  109.032 3
TRP H2  N   H3  109.032 3
TRP N   CA  C   109.79  1.5
TRP N   CA  CB  110.346 1.5
TRP N   CA  HA  108.404 1.5
TRP C   CA  CB  111.156 1.5
TRP C   CA  HA  108.682 1.5
TRP CB  CA  HA  108.429 1.5
TRP CA  C   O   117.155 2.01
TRP CA  C   OXT 117.155 2.01
TRP O   C   OXT 125.691 1.5
TRP CA  CB  CG  113.87  1.5
TRP CA  CB  HB3 108.522 1.5
TRP CA  CB  HB2 108.522 1.5
TRP CG  CB  HB3 108.877 1.5
TRP CG  CB  HB2 108.877 1.5
TRP HB3 CB  HB2 107.959 3
TRP CB  CG  CD1 126.94  2.13
TRP CB  CG  CD2 126.837 1.66
TRP CD1 CG  CD2 106.223 1.5
TRP CG  CD1 NE1 110.303 1.5
TRP CG  CD1 HD1 125.325 2.99
TRP NE1 CD1 HD1 124.372 1.81
TRP CG  CD2 CE2 106.978 1.5
TRP CG  CD2 CE3 134.327 1.5
TRP CE2 CD2 CE3 118.695 1.5
TRP CD1 NE1 CE2 109.057 1.5
TRP CD1 NE1 HE1 125.366 3
TRP CE2 NE1 HE1 125.577 3
TRP CD2 CE2 NE1 107.438 1.5
TRP CD2 CE2 CZ2 122.273 1.5
TRP NE1 CE2 CZ2 130.289 1.5
TRP CD2 CE3 CZ3 118.811 1.5
TRP CD2 CE3 HE3 120.479 1.5
TRP CZ3 CE3 HE3 120.709 1.5
TRP CE2 CZ2 CH2 117.418 1.5
TRP CE2 CZ2 HZ2 121.196 1.5
TRP CH2 CZ2 HZ2 121.386 1.5
TRP CE3 CZ3 CH2 121.228 1.5
TRP CE3 CZ3 HZ3 119.424 1.5
TRP CH2 CZ3 HZ3 119.348 1.5
TRP CZ2 CH2 CZ3 121.574 1.5
TRP CZ2 CH2 HH2 119.154 1.5
TRP CZ3 CH2 HH2 119.272 1.5

loop_
_chem_comp_tor.comp_id
_chem_comp_tor.id
_chem_comp_tor.atom_id_1
_chem_comp_tor.atom_id_2
_chem_comp_tor.atom_id_3
_chem_comp_tor.atom_id_4
_chem_comp_tor.value_angle
_chem_comp_tor.value_angle_esd
_chem_comp_tor.period
TRP chi1      N   CA  CB  CG  -60 10 3
TRP chi2      CA  CB  CG  CD1 90  10 6
TRP CONST_1   CB  CG  CD1 NE1 0   0  1
TRP CONST_2   CG  CD1 NE1 CE2 0   0  1
TRP CONST_3   NE1 CE2 CD2 CE3 0   0  1
TRP CONST_4   CE2 CD2 CE3 CZ3 0   0  1
TRP CONST_5   CD1 NE1 CE2 CD2 0   0  1
TRP CONST_6   CD2 CE3 CZ3 CH2 0   0  1
TRP CONST_7   CZ3 CH2 CZ2 CE2 0   0  1
TRP CONST_8   CE3 CZ3 CH2 CZ2 0   0  1
TRP sp3_sp3_1 C   CA  N   H   180 10 3
TRP const_33  CE2 CD2 CG  CD1 0   0  1
TRP const_17  CD2 CE2 CZ2 CH2 0   0  1
TRP sp2_sp3_1 O   C   CA  N   0   10 6

loop_
_chem_comp_chir.comp_id
_chem_comp_chir.id
_chem_comp_chir.atom_id_centre
_chem_comp_chir.atom_id_1
_chem_comp_chir.atom_id_2
_chem_comp_chir.atom_id_3
_chem_comp_chir.volume_sign
TRP chir_1 CA N C CB positive

loop_
_chem_comp_plane_atom.comp_id
_chem_comp_plane_atom.plane_id
_chem_comp_plane_atom.atom_id
_chem_comp_plane_atom.dist_esd
TRP plan-1 CD2 0.02
TRP plan-1 CE2 0.02
TRP plan-1 CE3 0.02
TRP plan-1 CG  0.02
TRP plan-1 CH2 0.02
TRP plan-1 CZ2 0.02
TRP plan-1 CZ3 0.02
TRP plan-1 HE3 0.02
TRP plan-1 HH2 0.02
TRP plan-1 HZ2 0.02
TRP plan-1 HZ3 0.02
TRP plan-1 NE1 0.02
TRP plan-2 CB  0.02
TRP plan-2 CD1 0.02
TRP plan-2 CD2 0.02
TRP plan-2 CE2 0.02
TRP plan-2 CE3 0.02
TRP plan-2 CG  0.02
TRP plan-2 CZ2 0.02
TRP plan-2 HD1 0.02
TRP plan-2 HE1 0.02
TRP plan-2 NE1 0.02
TRP plan-3 C   0.02
TRP plan-3 CA  0.02
TRP plan-3 O   0.02
TRP plan-3 OXT 0.02

data_PHE
_chem_comp.id                     PHE
_chem_comp.group                  peptide

loop_
_chem_comp_atom.comp_id
_chem_comp_atom.atom_id
_chem_comp_atom.type_symbol
_chem_comp_atom.type_energy
_chem_comp_atom.charge
PHE N   N NT3  1
PHE CA  C CH1  0
PHE C   C C    0
PHE O   O O    0
PHE CB  C CH2  0
PHE CG  C CR6  0
PHE CD1 C CR16 0
PHE CD2 C CR16 0
PHE CE1 C CR16 0
PHE CE2 C CR16 0
PHE CZ  C CR16 0
PHE OXT O OC   -1
PHE H   H H    0
PHE H2  H H    0
PHE H3  H H    0
PHE HA  H H    0
PHE HB3 H H    0
PHE HB2 H H    0
PHE HD1 H H    0
PHE HD2 H H    0
PHE HE1 H H    0
PHE HE2 H H    0
PHE HZ  H H    0

loop_
_chem_comp_bond.comp_id
_chem_comp_bond.atom_id_1
_chem_comp_bond.atom_id_2
_chem_comp_bond.type
_chem_comp_bond.aromatic
_chem_comp_bond.value_dist
_chem_comp_bond.value_dist_esd
_chem_comp_bond.value_dist_nucleus
_chem_comp_bond.value_dist_nucleus_esd
PHE N   CA  single n 1.489 0.01   1.489 0.01
PHE CA  C   single n 1.531 0.0171 1.531 0.0171
PHE CA  CB  single n 1.532 0.01   1.532 0.01
PHE C   O   double n 1.251 0.0183 1.251 0.0183
PHE C   OXT single n 1.251 0.0183 1.251 0.0183
PHE CB  CG  single n 1.523 0.01   1.523 0.01
PHE CG  CD1 double y 1.39  0.0116 1.39  0.0116
PHE CG  CD2 single y 1.39  0.0116 1.39  0.0116
PHE CD1 CE1 single y 1.386 0.0131 1.386 0.0131
PHE CD2 CE2 double y 1.386 0.0131 1.386 0.0131
PHE CE1 CZ  double y 1.376 0.0151 1.376 0.0151
PHE CE2 CZ  single y 1.376 0.0151 1.376 0.0151
PHE N   H   single n 0.902 0.0102 1.018 0.052
PHE N   H2  single n 0.902 0.0102 1.018 0.052
PHE N   H3  single n 0.902 0.0102 1.018 0.052
PHE CA  HA  single n 0.994 0.02   1.092 0.01
PHE CB  HB3 single n 0.983 0.0163 1.092 0.01
PHE CB  HB2 single n 0.983 0.0163 1.092 0.01
PHE CD1 HD1 single n 0.944 0.0143 1.085 0.015
PHE CD2 HD2 single n 0.944 0.0143 1.085 0.015
PHE CE1 HE1 single n 0.944 0.018  1.085 0.015
PHE CE2 HE2 single n 0.944 0.018  1.085 0.015
PHE CZ  HZ  single n 0.944 0.017  1.085 0.015

loop_
_chem_comp_angle.comp_id
_chem_comp_angle.atom_id_1
_chem_comp_angle.atom_id_2
_chem_comp_angle.atom_id_3
_chem_comp_angle.value_angle
_chem_comp_angle.value_angle_esd
PHE CA  N   H   109.791 3
PHE CA  N   H2  109.791 3
PHE CA  N   H3  109.791 3
PHE H   N   H2  109.032 3
PHE H   N   H3  109.032 3
PHE H2  N   H3  109.032 3
PHE N   CA  C   109.085 1.5
PHE N   CA  CB  109.965 3
PHE N   CA  HA  108.547 1.5
PHE C   CA  CB  111.98  3
PHE C   CA  HA  108.746 1.5
PHE CB  CA  HA  108.686 1.5
PHE CA  C   O   117.219 3
PHE CA  C   OXT 117.219 3
PHE O   C   OXT 125.562 1.5
PHE CA  CB  CG  114.693 2.05
PHE CA  CB  HB3 108.494 1.5
PHE CA  CB  HB2 108.494 1.5
PHE CG  CB  HB3 108.859 1.5
PHE CG  CB  HB2 108.859 1.5
PHE HB3 CB  HB2 107.843 2.16
PHE CB  CG  CD1 120.965 1.5
PHE CB  CG  CD2 120.965 1.5
PHE CD1 CG  CD2 118.071 1.5
PHE CG  CD1 CE1 120.673 1.5
PHE CG  CD1 HD1 119.564 1.5
PHE CE1 CD1 HD1 119.763 1.5
PHE CG  CD2 CE2 120.673 1.5
PHE CG  CD2 HD2 119.564 1.5
PHE CE2 CD2 HD2 119.763 1.5
PHE CD1 CE1 CZ  120.297 1.5
PHE CD1 CE1 HE1 119.796 1.5
PHE CZ  CE1 HE1 119.907 1.5
PHE CD2 CE2 CZ  120.297 1.5
PHE CD2 CE2 HE2 119.796 1.5
PHE CZ  CE2 HE2 119.907 1.5
PHE CE1 CZ  CE2 119.995 1.5
PHE CE1 CZ  HZ  120     1.5
PHE CE2 CZ  HZ  120     1.5

loop_
_chem_comp_tor.comp_id
_chem_comp_tor.id
_chem_comp_tor.atom_id_1
_chem_comp_tor.atom_id_2
_chem_comp_tor.atom_id_3
_chem_comp_tor.atom_id_4
_chem_comp_tor.value_angle
_chem_comp_tor.value_angle_esd
_chem_comp_tor.period
PHE chi1      N   CA  CB  CG  -60 10 3
PHE chi2      CA  CB  CG  CD1 90  10 6
PHE CONST_1   CB  CG  CD1 CE1 0   0  1
PHE CONST_2   CG  CD1 CE1 CZ  0   0  1
PHE CONST_3   CZ  CE2 CD2 CG  0   0  1
PHE CONST_4   CD1 CE1 CZ  CE2 0   0  1
PHE CONST_5   CE1 CZ  CE2 CD2 0   0  1
PHE sp3_sp3_1 C   CA  N   H   180 10 3
PHE const_21  CE2 CD2 CG  CD1 0   0  1
PHE sp2_sp3_1 O   C   CA  N   0   10 6

loop_
_chem_comp_chir.comp_id
_chem_comp_chir.id
_chem_comp_chir.atom_id_centre
_chem_comp_chir.atom_id_1
_chem_comp_chir.atom_id_2
_chem_comp_chir.atom_id_3
_chem_comp_chir.volume_sign
PHE chir_1 CA N C CB positive

loop_
_chem_comp_plane_atom.comp_id
_chem_comp_plane_atom.plane_id
_chem_comp_plane_atom.atom_id
_chem_comp_plane_atom.dist_esd
PHE plan-1 CB  0.02
PHE plan-1 CD1 0.02
PHE plan-1 CD2 0.02
PHE plan-1 CE1 0.02
PHE plan-1 CE2 0.02
PHE plan-1 CG  0.02
PHE plan-1 CZ  0.02
PHE plan-1 HD1 0.02
PHE plan-1 HD2 0.02
PHE plan-1 HE1 0.02
PHE plan-1 HE2 0.02
PHE plan-1 HZ  0.02
PHE plan-2 C   0.02
PHE plan-2 CA  0.02
PHE plan-2 O   0.02
PHE plan-2 OXT 0.02

data_ASN
_chem_comp.id                     ASN
_chem_comp.group                  peptide

loop_
_chem_comp_atom.comp_id
_chem_comp_atom.atom_id
_chem_comp_atom.type_symbol
_chem_comp_atom.type_energy
_chem_comp_atom.charge
ASN N    N NT3 1
ASN CA   C CH1 0
ASN C    C C   0
ASN O    O O   0
ASN CB   C CH2 0
ASN CG   C C   0
ASN OD1  O O   0
ASN ND2  N NH2 0
ASN OXT  O OC  -1
ASN H    H H   0
ASN H2   H H   0
ASN H3   H H   0
ASN HA   H H   0
ASN HB3  H H   0
ASN HB2  H H   0
ASN HD21 H H   0
ASN HD22 H H   0

loop_
_chem_comp_bond.comp_id
_chem_comp_bond.atom_id_1
_chem_comp_bond.atom_id_2
_chem_comp_bond.type
_chem_comp_bond.aromatic
_chem_comp_bond.value_dist
_chem_comp_bond.value_dist_esd
_chem_comp_bond.value_dist_nucleus
_chem_comp_bond.value_dist_nucleus_esd
ASN N   CA   single n 1.49  0.01   1.49  0.01
ASN CA  C    single n 1.533 0.01   1.533 0.01
ASN CA  CB   single n 1.525 0.01   1.525 0.01
ASN C   O    double n 1.251 0.0183 1.251 0.0183
ASN C   OXT  single n 1.251 0.0183 1.251 0.0183
ASN CB  CG   single n 1.51  0.01   1.51  0.01
ASN CG  OD1  double n 1.236 0.01   1.236 0.01
ASN CG  ND2  single n 1.325 0.01   1.325 0.01
ASN N   H    single n 0.902 0.0102 1.018 0.052
ASN N   H2   single n 0.902 0.0102 1.018 0.052
ASN N   H3   single n 0.902 0.0102 1.018 0.052
ASN CA  HA   single n 0.984 0.02   1.092 0.01
ASN CB  HB3  single n 0.978 0.0143 1.092 0.01
ASN CB  HB2  single n 0.978 0.0143 1.092 0.01
ASN ND2 HD21 single n 0.887 0.02   1.013 0.012
ASN ND2 HD22 single n 0.887 0.02   1.013 0.012

loop_
_chem_comp_angle.comp_id
_chem_comp_angle.atom_id_1
_chem_comp_angle.atom_id_2
_chem_comp_angle.atom_id_3
_chem_comp_angle.value_angle
_chem_comp_angle.value_angle_esd
ASN CA   N   H    109.99  3
ASN CA   N   H2   109.99  3
ASN CA   N   H3   109.99  3
ASN H    N   H2   109.032 3
ASN H    N   H3   109.032 3
ASN H2   N   H3   109.032 3
ASN N    CA  C    109.258 1.5
ASN N    CA  CB   111.558 1.5
ASN N    CA  HA   108.387 1.58
ASN C    CA  CB   111.904 3
ASN C    CA  HA   108.774 1.79
ASN CB   CA  HA   107.748 1.5
ASN CA   C   O    117.148 1.6
ASN CA   C   OXT  117.148 1.6
ASN O    C   OXT  125.704 1.5
ASN CA   CB  CG   112.193 1.5
ASN CA   CB  HB3  109.177 1.5
ASN CA   CB  HB2  109.177 1.5
ASN CG   CB  HB3  109.132 1.5
ASN CG   CB  HB2  109.132 1.5
ASN HB3  CB  HB2  108.039 1.5
ASN CB   CG  OD1  120.239 1.5
ASN CB   CG  ND2  117.18  1.62
ASN OD1  CG  ND2  122.581 1.5
ASN CG   ND2 HD21 119.917 2.87
ASN CG   ND2 HD22 119.917 2.87
ASN HD21 ND2 HD22 120.165 3

loop_
_chem_comp_tor.comp_id
_chem_comp_tor.id
_chem_comp_tor.atom_id_1
_chem_comp_tor.atom_id_2
_chem_comp_tor.atom_id_3
_chem_comp_tor.atom_id_4
_chem_comp_tor.value_angle
_chem_comp_tor.value_angle_esd
_chem_comp_tor.period
ASN chi1      N  CA CB  CG   -60 10 3
ASN chi2      CA CB CG  ND2  180 10 6
ASN hh1       CB CG ND2 HD22 180 5  2
ASN sp3_sp3_1 C  CA N   H    180 10 3
ASN sp2_sp3_1 O  C  CA  N    0   10 6

loop_
_chem_comp_chir.comp_id
_chem_comp_chir.id
_chem_comp_chir.atom_id_centre
_chem_comp_chir.atom_id_1
_chem_comp_chir.atom_id_2
_chem_comp_chir.atom_id_3
_chem_comp_chir.volume_sign
ASN chir_1 CA N C CB positive

loop_
_chem_comp_plane_atom.comp_id
_chem_comp_plane_atom.plane_id
_chem_comp_plane_atom.atom_id
_chem_comp_plane_atom.dist_esd
ASN plan-1 C    0.02
ASN plan-1 CA   0.02
ASN plan-1 O    0.02
ASN plan-1 OXT  0.02
ASN plan-2 CB   0.02
ASN plan-2 CG   0.02
ASN plan-2 ND2  0.02
ASN plan-2 OD1  0.02
ASN plan-3 CG   0.02
ASN plan-3 HD21 0.02
ASN plan-3 HD22 0.02
ASN plan-3 ND2  0.02

data_PRO
_chem_comp.id                     PRO
_chem_comp.group                  P-peptide

loop_
_chem_comp_atom.comp_id
_chem_comp_atom.atom_id
_chem_comp_atom.type_symbol
_chem_comp_atom.type_energy
_chem_comp_atom.charge
PRO N   N NT2 1
PRO CA  C CH1 0
PRO C   C C   0
PRO O   O O   0
PRO CB  C CH2 0
PRO CG  C CH2 0
PRO CD  C CH2 0
PRO OXT O OC  -1
PRO H   H H   0
PRO H2  H H   0
PRO HA  H H   0
PRO HB3 H H   0
PRO HB2 H H   0
PRO HG3 H H   0
PRO HG2 H H   0
PRO HD3 H H   0
PRO HD2 H H   0

loop_
_chem_comp_bond.comp_id
_chem_comp_bond.atom_id_1
_chem_comp_bond.atom_id_2
_chem_comp_bond.type
_chem_comp_bond.aromatic
_chem_comp_bond.value_dist
_chem_comp_bond.value_dist_esd
_chem_comp_bond.value_dist_nucleus
_chem_comp_bond.value_dist_nucleus_esd
PRO N  CA  single n 1.496 0.0142 1.496 0.0142
PRO N  CD  single n 1.499 0.0135 1.499 0.0135
PRO CA C   single n 1.525 0.0103 1.525 0.0103
PRO CA CB  single n 1.526 0.0157 1.526 0.0157
PRO C  O   double n 1.252 0.0117 1.252 0.0117
PRO C  OXT single n 1.252 0.0117 1.252 0.0117
PRO CB CG  single n 1.516 0.0179 1.516 0.0179
PRO CG CD  single n 1.497 0.02   1.497 0.02
PRO N  H   single n 0.91  0.02   1.018 0.052
PRO N  H2  single n 0.91  0.02   1.018 0.052
PRO CA HA  single n 0.98  0.02   1.092 0.01
PRO CB HB3 single n 0.977 0.0145 1.092 0.01
PRO CB HB2 single n 0.977 0.0145 1.092 0.01
PRO CG HG3 single n 0.978 0.0181 1.092 0.01
PRO CG HG2 single n 0.978 0.0181 1.092 0.01
PRO CD HD3 single n 0.977 0.0199 1.092 0.01
PRO CD HD2 single n 0.977 0.0199 1.092 0.01

loop_
_chem_comp_angle.comp_id
_chem_comp_angle.atom_id_1
_chem_comp_angle.atom_id_2
_chem_comp_angle.atom_id_3
_chem_comp_angle.value_angle
_chem_comp_angle.value_angle_esd
PRO CA  N  CD  107.978 1.5
PRO CA  N  H   109.889 3
PRO CA  N  H2  109.889 3
PRO CD  N  H   110.257 3
PRO CD  N  H2  110.257 3
PRO H   N  H2  108.772 3
PRO N   CA C   110.397 1.5
PRO N   CA CB  103.994 1.5
PRO N   CA HA  109.579 1.5
PRO C   CA CB  113.159 3
PRO C   CA HA  109.687 1.5
PRO CB  CA HA  109.91  1.89
PRO CA  C  O   116.979 3
PRO CA  C  OXT 116.979 3
PRO O   C  OXT 126.043 1.52
PRO CA  CB CG  101.701 3
PRO CA  CB HB3 110.865 1.5
PRO CA  CB HB2 110.865 1.5
PRO CG  CB HB3 110.891 1.59
PRO CG  CB HB2 110.891 1.59
PRO HB3 CB HB2 108.88  2.25
PRO CB  CG CD  105.541 3
PRO CB  CG HG3 110.897 1.5
PRO CB  CG HG2 110.897 1.5
PRO CD  CG HG3 110.621 1.5
PRO CD  CG HG2 110.621 1.5
PRO HG3 CG HG2 108.871 1.5
PRO N   CD CG  104.386 2.3
PRO N   CD HD3 110.569 1.5
PRO N   CD HD2 110.569 1.5
PRO CG  CD HD3 111.131 1.62
PRO CG  CD HD2 111.131 1.62
PRO HD3 CD HD2 109.116 1.5

loop_
_chem_comp_tor.comp_id
_chem_comp_tor.id
_chem_comp_tor.atom_id_1
_chem_comp_tor.atom_id_2
_chem_comp_tor.atom_id_3
_chem_comp_tor.atom_id_4
_chem_comp_tor.value_angle
_chem_comp_tor.value_angle_esd
_chem_comp_tor.period
PRO chi1       N  CA CB CG -60 10 3
PRO chi2       CA CB CG CD 180 10 3
PRO sp3_sp3_1  CB CA N  CD 60  10 3
PRO sp3_sp3_28 N  CD CG CB -60 10 3
PRO sp3_sp3_37 CG CD N  CA 180 10 3
PRO sp2_sp3_1  O  C  CA N  0   10 6

loop_
_chem_comp_chir.comp_id
_chem_comp_chir.id
_chem_comp_chir.atom_id_centre
_chem_comp_chir.atom_id_1
_chem_comp_chir.atom_id_2
_chem_comp_chir.atom_id_3
_chem_comp_chir.volume_sign
PRO chir_1 CA N C CB positive

loop_
_chem_comp_plane_atom.comp_id
_chem_comp_plane_atom.plane_id
_chem_comp_plane_atom.atom_id
_chem_comp_plane_atom.dist_esd
PRO plan-1 C   0.02
PRO plan-1 CA  0.02
PRO plan-1 O   0.02
PRO plan-1 OXT 0.02

data_ARG
_chem_comp.id                     ARG
_chem_comp.group                  peptide

loop_
_chem_comp_atom.comp_id
_chem_comp_atom.atom_id
_chem_comp_atom.type_symbol
_chem_comp_atom.type_energy
_chem_comp_atom.charge
ARG N    N NT3 1
ARG CA   C CH1 0
ARG C    C C   0
ARG O    O O   0
ARG CB   C CH2 0
ARG CG   C CH2 0
ARG CD   C CH2 0
ARG NE   N NC1 0
ARG CZ   C C   0
ARG NH1  N NC2 0
ARG NH2  N NC2 1
ARG OXT  O OC  -1
ARG H    H H   0
ARG H2   H H   0
ARG H3   H H   0
ARG HA   H H   0
ARG HB3  H H   0
ARG HB2  H H   0
ARG HG3  H H   0
ARG HG2  H H   0
ARG HD3  H H   0
ARG HD2  H H   0
ARG HE   H H   0
ARG HH11 H H   0
ARG HH12 H H   0
ARG HH21 H H   0
ARG HH22 H H   0

loop_
_chem_comp_bond.comp_id
_chem_comp_bond.atom_id_1
_chem_comp_bond.atom_id_2
_chem_comp_bond.type
_chem_comp_bond.aromatic
_chem_comp_bond.value_dist
_chem_comp_bond.value_dist_esd
_chem_comp_bond.value_dist_nucleus
_chem_comp_bond.value_dist_nucleus_esd
ARG N   CA   single n 1.487 0.01   1.487 0.01
ARG CA  C    single n 1.538 0.0113 1.538 0.0113
ARG CA  CB   single n 1.533 0.01   1.533 0.01
ARG C   O    double n 1.251 0.0183 1.251 0.0183
ARG C   OXT  single n 1.251 0.0183 1.251 0.0183
ARG CB  CG   single n 1.522 0.01   1.522 0.01
ARG CG  CD   single n 1.521 0.02   1.521 0.02
ARG CD  NE   single n 1.467 0.01   1.467 0.01
ARG NE  CZ   single n 1.327 0.0153 1.327 0.0153
ARG CZ  NH1  single n 1.321 0.0134 1.321 0.0134
ARG CZ  NH2  double n 1.321 0.0134 1.321 0.0134
ARG N   H    single n 0.902 0.0102 1.018 0.052
ARG N   H2   single n 0.902 0.0102 1.018 0.052
ARG N   H3   single n 0.902 0.0102 1.018 0.052
ARG CA  HA   single n 0.991 0.02   1.092 0.01
ARG CB  HB3  single n 0.981 0.0141 1.092 0.01
ARG CB  HB2  single n 0.981 0.0141 1.092 0.01
ARG CG  HG3  single n 0.982 0.0161 1.092 0.01
ARG CG  HG2  single n 0.982 0.0161 1.092 0.01
ARG CD  HD3  single n 0.979 0.0175 1.092 0.01
ARG CD  HD2  single n 0.979 0.0175 1.092 0.01
ARG NE  HE   single n 0.871 0.02   1.013 0.012
ARG NH1 HH11 single n 0.884 0.02   1.013 0.012
ARG NH1 HH12 single n 0.884 0.02   1.013 0.012
ARG NH2 HH21 single n 0.884 0.02   1.013 0.012
ARG NH2 HH22 single n 0.884 0.02   1.013 0.012

loop_
_chem_comp_angle.comp_id
_chem_comp_angle.atom_id_1
_chem_comp_angle.atom_id_2
_chem_comp_angle.atom_id_3
_chem_comp_angle.value_angle
_chem_comp_angle.value_angle_esd
ARG CA   N   H    109.99  3
ARG CA   N   H2   109.99  3
ARG CA   N   H3   109.99  3
ARG H    N   H2   109.032 3
ARG H    N   H3   109.032 3
ARG H2   N   H3   109.032 3
ARG N    CA  C    109.258 1.5
ARG N    CA  CB   110.44  2.46
ARG N    CA  HA   108.387 1.58
ARG C    CA  CB   111.059 3
ARG C    CA  HA   108.774 1.79
ARG CB   CA  HA   109.08  2.33
ARG CA   C   O    117.148 1.6
ARG CA   C   OXT  117.148 1.6
ARG O    C   OXT  125.704 1.5
ARG CA   CB  CG   114.16  3
ARG CA   CB  HB3  108.677 1.74
ARG CA   CB  HB2  108.677 1.74
ARG CG   CB  HB3  108.721 1.5
ARG CG   CB  HB2  108.721 1.5
ARG HB3  CB  HB2  107.655 1.5
ARG CB   CG  CD   112.025 3
ARG CB   CG  HG3  109.216 1.64
ARG CB   CG  HG2  109.216 1.64
ARG CD   CG  HG3  108.991 1.5
ARG CD   CG  HG2  108.991 1.5
ARG HG3  CG  HG2  107.958 2.23
ARG CG   CD  NE   112.275 3
ARG CG   CD  HD3  109.172 2.35
ARG CG   CD  HD2  109.172 2.35
ARG NE   CD  HD3  109.193 1.5
ARG NE   CD  HD2  109.193 1.5
ARG HD3  CD  HD2  107.932 1.94
ARG CD   NE  CZ   124.614 2.32
ARG CD   NE  HE   117.935 2.37
ARG CZ   NE  HE   117.451 2.77
ARG NE   CZ  NH1  120.032 1.9
ARG NE   CZ  NH2  120.032 1.9
ARG NH1  CZ  NH2  119.937 1.95
ARG CZ   NH1 HH11 119.775 3
ARG CZ   NH1 HH12 119.775 3
ARG HH11 NH1 HH12 120.45  3
ARG CZ   NH2 HH21 119.775 3
ARG CZ   NH2 HH22 119.775 3
ARG HH21 NH2 HH22 120.45  3

loop_
_chem_comp_tor.comp_id
_chem_comp_tor.id
_chem_comp_tor.atom_id_1
_chem_comp_tor.atom_id_2
_chem_comp_tor.atom_id_3
_chem_comp_tor.atom_id_4
_chem_comp_tor.value_angle
_chem_comp_tor.value_angle_esd
_chem_comp_tor.period
ARG chi1      N  CA CB  CG   -60 10 3
ARG chi2      CA CB CG  CD   180 10 3
ARG chi3      CB CG CD  NE   60  10 3
ARG chi4      CG CD NE  CZ   180 10 6
ARG chi5      CD NE CZ  NH2  0   5  2
ARG hh1       NE CZ NH1 HH12 0   5  2
ARG hh2       NE CZ NH2 HH22 0   5  2
ARG sp3_sp3_1 C  CA N   H    180 10 3
ARG sp2_sp3_1 O  C  CA  N    0   10 6

loop_
_chem_comp_chir.comp_id
_chem_comp_chir.id
_chem_comp_chir.atom_id_centre
_chem_comp_chir.atom_id_1
_chem_comp_chir.atom_id_2
_chem_comp_chir.atom_id_3
_chem_comp_chir.volume_sign
ARG chir_1 CA N C CB positive

loop_
_chem_comp_plane_atom.comp_id
_chem_comp_plane_atom.plane_id
_chem_comp_plane_atom.atom_id
_chem_comp_plane_atom.dist_esd
ARG plan-1 C    0.02
ARG plan-1 CA   0.02
ARG plan-1 O    0.02
ARG plan-1 OXT  0.02
ARG plan-2 CD   0.02
ARG plan-2 CZ   0.02
ARG plan-2 HE   0.02
ARG plan-2 NE   0.02
ARG plan-3 CZ   0.02
ARG plan-3 NE   0.02
ARG plan-3 NH1  0.02
ARG plan-3 NH2  0.02
ARG plan-4 CZ   0.02
ARG plan-4 HH11 0.02
ARG plan-4 HH12 0.02
ARG plan-4 NH1  0.02
ARG plan-5 CZ   0.02
ARG plan-5 HH21 0.02
ARG plan-5 HH22 0.02
ARG plan-5 NH2  0.02

data_GLU
_chem_comp.id                     GLU
_chem_comp.group                  peptide

loop_
_chem_comp_atom.comp_id
_chem_comp_atom.atom_id
_chem_comp_atom.type_symbol
_chem_comp_atom.type_energy
_chem_comp_atom.charge
GLU N   N NT3 1
GLU CA  C CH1 0
GLU C   C C   0
GLU O   O O   0
GLU CB  C CH2 0
GLU CG  C CH2 0
GLU CD  C C   0
GLU OE1 O O   0
GLU OE2 O OC  -1
GLU OXT O OC  -1
GLU H   H H   0
GLU H2  H H   0
GLU H3  H H   0
GLU HA  H H   0
GLU HB3 H H   0
GLU HB2 H H   0
GLU HG3 H H   0
GLU HG2 H H   0

loop_
_chem_comp_bond.comp_id
_chem_comp_bond.atom_id_1
_chem_comp_bond.atom_id_2
_chem_comp_bond.type
_chem_comp_bond.aromatic
_chem_comp_bond.value_dist
_chem_comp_bond.value_dist_esd
_chem_comp_bond.value_dist_nucleus
_chem_comp_bond.value_dist_nucleus_esd
GLU N  CA  single n 1.487 0.01   1.487 0.01
GLU CA C   single n 1.538 0.0113 1.538 0.0113
GLU CA CB  single n 1.529 0.01   1.529 0.01
GLU C  O   double n 1.251 0.0183 1.251 0.0183
GLU C  OXT single n 1.251 0.0183 1.251 0.0183
GLU CB CG  single n 1.526 0.01   1.526 0.01
GLU CG CD  single n 1.518 0.0135 1.518 0.0135
GLU CD OE1 double n 1.249 0.0161 1.249 0.0161
GLU CD OE2 single n 1.249 0.0161 1.249 0.0161
GLU N  H   single n 0.902 0.0102 1.018 0.052
GLU N  H2  single n 0.902 0.0102 1.018 0.052
GLU N  H3  single n 0.902 0.0102 1.018 0.052
GLU CA HA  single n 0.991 0.02   1.092 0.01
GLU CB HB3 single n 0.98  0.0168 1.092 0.01
GLU CB HB2 single n 0.98  0.0168 1.092 0.01
GLU CG HG3 single n 0.981 0.0172 1.092 0.01
GLU CG HG2 single n 0.981 0.0172 1.092 0.01

loop_
_chem_comp_angle.comp_id
_chem_comp_angle.atom_id_1
_chem_comp_angle.atom_id_2
_chem_comp_angle.atom_id_3
_chem_comp_angle.value_angle
_chem_comp_angle.value_angle_esd
GLU CA  N  H   109.99  3
GLU CA  N  H2  109.99  3
GLU CA  N  H3  109.99  3
GLU H   N  H2  109.032 3
GLU H   N  H3  109.032 3
GLU H2  N  H3  109.032 3
GLU N   CA C   109.258 1.5
GLU N   CA CB  110.44  2.46
GLU N   CA HA  108.387 1.58
GLU C   CA CB  111.059 3
GLU C   CA HA  108.774 1.79
GLU CB  CA HA  109.08  2.33
GLU CA  C  O   117.148 1.6
GLU CA  C  OXT 117.148 1.6
GLU O   C  OXT 125.704 1.5
GLU CA  CB CG  113.294 1.61
GLU CA  CB HB3 108.677 1.74
GLU CA  CB HB2 108.677 1.74
GLU CG  CB HB3 108.696 2.8
GLU CG  CB HB2 108.696 2.8
GLU HB3 CB HB2 107.655 1.5
GLU CB  CG CD  114.14  3
GLU CB  CG HG3 108.968 1.5
GLU CB  CG HG2 108.968 1.5
GLU CD  CG HG3 108.472 1.5
GLU CD  CG HG2 108.472 1.5
GLU HG3 CG HG2 107.541 1.92
GLU CG  CD OE1 118.251 3
GLU CG  CD OE2 118.251 3
GLU OE1 CD OE2 123.498 1.82

loop_
_chem_comp_tor.comp_id
_chem_comp_tor.id
_chem_comp_tor.atom_id_1
_chem_comp_tor.atom_id_2
_chem_comp_tor.atom_id_3
_chem_comp_tor.atom_id_4
_chem_comp_tor.value_angle
_chem_comp_tor.value_angle_esd
_chem_comp_tor.period
GLU chi1      N  CA CB CG  -60 10 3
GLU chi2      CA CB CG CD  180 10 3
GLU chi3      CB CG CD OE1 180 10 6
GLU sp3_sp3_1 C  CA N  H   180 10 3
GLU sp2_sp3_1 O  C  CA N   0   10 6

loop_
_chem_comp_chir.comp_id
_chem_comp_chir.id
_chem_comp_chir.atom_id_centre
_chem_comp_chir.atom_id_1
_chem_comp_chir.atom_id_2
_chem_comp_chir.atom_id_3
_chem_comp_chir.volume_sign
GLU chir_1 CA N C CB positive

loop_
_chem_comp_plane_atom.comp_id
_chem_comp_plane_atom.plane_id
_chem_comp_plane_atom.atom_id
_chem_comp_plane_atom.dist_esd
GLU plan-1 C   0.02
GLU plan-1 CA  0.02
GLU plan-1 O   0.02
GLU plan-1 OXT 0.02
GLU plan-2 CD  0.02
GLU plan-2 CG  0.02
GLU plan-2 OE1 0.02
GLU plan-2 OE2 0.02

data_VAL
_chem_comp.id                     VAL
_chem_comp.group                  peptide

loop_
_chem_comp_atom.comp_id
_chem_comp_atom.atom_id
_chem_comp_atom.type_symbol
_chem_comp_atom.type_energy
_chem_comp_atom.charge
VAL N    N NT3 1
VAL CA   C CH1 0
VAL C    C C   0
VAL O    O O   0
VAL CB   C CH1 0
VAL CG1  C CH3 0
VAL CG2  C CH3 0
VAL OXT  O OC  -1
VAL H    H H   0
VAL H2   H H   0
VAL H3   H H   0
VAL HA   H H   0
VAL HB   H H   0
VAL HG11 H H   0
VAL HG12 H H   0
VAL HG13 H H   0
VAL HG21 H H   0
VAL HG22 H H   0
VAL HG23 H H   0

loop_
_chem_comp_bond.comp_id
_chem_comp_bond.atom_id_1
_chem_comp_bond.atom_id_2
_chem_comp_bond.type
_chem_comp_bond.aromatic
_chem_comp_bond.value_dist
_chem_comp_bond.value_dist_esd
_chem_comp_bond.value_dist_nucleus
_chem_comp_bond.value_dist_nucleus_esd
VAL N   CA   single n 1.495 0.01   1.495 0.01
VAL CA  C    single n 1.538 0.01   1.538 0.01
VAL CA  CB   single n 1.541 0.0101 1.541 0.0101
VAL C   O    double n 1.251 0.0183 1.251 0.0183
VAL C   OXT  single n 1.251 0.0183 1.251 0.0183
VAL CB  CG1  single n 1.524 0.0131 1.524 0.0131
VAL CB  CG2  single n 1.524 0.0131 1.524 0.0131
VAL N   H    single n 0.902 0.0102 1.018 0.052
VAL N   H2   single n 0.902 0.0102 1.018 0.052
VAL N   H3   single n 0.902 0.0102 1.018 0.052
VAL CA  HA   single n 0.977 0.02   1.092 0.01
VAL CB  HB   single n 0.986 0.0184 1.092 0.01
VAL CG1 HG11 single n 0.972 0.0156 1.092 0.01
VAL CG1 HG12 single n 0.972 0.0156 1.092 0.01
VAL CG1 HG13 single n 0.972 0.0156 1.092 0.01
VAL CG2 HG21 single n 0.972 0.0156 1.092 0.01
VAL CG2 HG22 single n 0.972 0.0156 1.092 0.01
VAL CG2 HG23 single n 0.972 0.0156 1.092 0.01

loop_
_chem_comp_angle.comp_id
_chem_comp_angle.atom_id_1
_chem_comp_angle.atom_id_2
_chem_comp_angle.atom_id_3
_chem_comp_angle.value_angle
_chem_comp_angle.value_angle_esd
VAL CA   N   H    109.99  2.8
VAL CA   N   H2   109.99  2.8
VAL CA   N   H3   109.99  2.8
VAL H    N   H2   109.032 3
VAL H    N   H3   109.032 3
VAL H2   N   H3   109.032 3
VAL N    CA  C    108.738 1.5
VAL N    CA  CB   111.627 2.88
VAL N    CA  HA   108.328 1.5
VAL C    CA  CB   111.231 1.5
VAL C    CA  HA   108.55  1.5
VAL CB   CA  HA   108.536 1.5
VAL CA   C   O    117.155 1.5
VAL CA   C   OXT  117.155 1.5
VAL O    C   OXT  125.69  1.5
VAL CA   CB  CG1  111.834 1.5
VAL CA   CB  CG2  111.834 1.5
VAL CA   CB  HB   107.069 1.5
VAL CG1  CB  CG2  110.7   1.76
VAL CG1  CB  HB   107.681 2.06
VAL CG2  CB  HB   107.681 2.06
VAL CB   CG1 HG11 109.51  1.5
VAL CB   CG1 HG12 109.51  1.5
VAL CB   CG1 HG13 109.51  1.5
VAL HG11 CG1 HG12 109.39  1.5
VAL HG11 CG1 HG13 109.39  1.5
VAL HG12 CG1 HG13 109.39  1.5
VAL CB   CG2 HG21 109.51  1.5
VAL CB   CG2 HG22 109.51  1.5
VAL CB   CG2 HG23 109.51  1.5
VAL HG21 CG2 HG22 109.39  1.5
VAL HG21 CG2 HG23 109.39  1.5
VAL HG22 CG2 HG23 109.39  1.5

loop_
_chem_comp_tor.comp_id
_chem_comp_tor.id
_chem_comp_tor.atom_id_1
_chem_comp_tor.atom_id_2
_chem_comp_tor.atom_id_3
_chem_comp_tor.atom_id_4
_chem_comp_tor.value_angle
_chem_comp_tor.value_angle_esd
_chem_comp_tor.period
VAL chi1      N  CA CB  CG2  -60 10 3
VAL hh1       CA CB CG1 HG13 180 10 3
VAL hh2       CA CB CG2 HG23 -60 10 3
VAL sp3_sp3_1 C  CA N   H    180 10 3
VAL sp2_sp3_1 O  C  CA  N    0   10 6

loop_
_chem_comp_chir.comp_id
_chem_comp_chir.id
_chem_comp_chir.atom_id_centre
_chem_comp_chir.atom_id_1
_chem_comp_chir.atom_id_2
_chem_comp_chir.atom_id_3
_chem_comp_chir.volume_sign
VAL chir_1 CA N  C   CB  positive
VAL chir_2 CB CA CG1 CG2 both

loop_
_chem_comp_plane_atom.comp_id
_chem_comp_plane_atom.plane_id
_chem_comp_plane_atom.atom_id
_chem_comp_plane_atom.dist_esd
VAL plan-1 C   0.02
VAL plan-1 CA  0.02
VAL plan-1 O   0.02
VAL plan-1 OXT 0.02

data_THR
_chem_comp.id                     THR
_chem_comp.group                  peptide

loop_
_chem_comp_atom.comp_id
_chem_comp_atom.atom_id
_chem_comp_atom.type_symbol
_chem_comp_atom.type_energy
_chem_comp_atom.charge
THR N    N NT3 1
THR CA   C CH1 0
THR C    C C   0
THR O    O O   0
THR CB   C CH1 0
THR OG1  O OH1 0
THR CG2  C CH3 0
THR OXT  O OC  -1
THR H    H H   0
THR H2   H H   0
THR H3   H H   0
THR HA   H H   0
THR HB   H H   0
THR HG1  H H   0
THR HG21 H H   0
THR HG22 H H   0
THR HG23 H H   0

loop_
_chem_comp_bond.comp_id
_chem_comp_bond.atom_id_1
_chem_comp_bond.atom_id_2
_chem_comp_bond.type
_chem_comp_bond.aromatic
_chem_comp_bond.value_dist
_chem_comp_bond.value_dist_esd
_chem_comp_bond.value_dist_nucleus
_chem_comp_bond.value_dist_nucleus_esd
THR N   CA   single n 1.48  0.0122 1.48  0.0122
THR CA  C    single n 1.515 0.0129 1.515 0.0129
THR CA  CB   single n 1.528 0.01   1.528 0.01
THR C   O    double n 1.251 0.0183 1.251 0.0183
THR C   OXT  single n 1.251 0.0183 1.251 0.0183
THR CB  OG1  single n 1.424 0.01   1.424 0.01
THR CB  CG2  single n 1.518 0.01   1.518 0.01
THR N   H    single n 0.902 0.0102 1.018 0.052
THR N   H2   single n 0.902 0.0102 1.018 0.052
THR N   H3   single n 0.902 0.0102 1.018 0.052
THR CA  HA   single n 0.982 0.02   1.092 0.01
THR CB  HB   single n 0.987 0.01   1.092 0.01
THR OG1 HG1  single n 0.864 0.02   0.972 0.018
THR CG2 HG21 single n 0.972 0.0156 1.092 0.01
THR CG2 HG22 single n 0.972 0.0156 1.092 0.01
THR CG2 HG23 single n 0.972 0.0156 1.092 0.01

loop_
_chem_comp_angle.comp_id
_chem_comp_angle.atom_id_1
_chem_comp_angle.atom_id_2
_chem_comp_angle.atom_id_3
_chem_comp_angle.value_angle
_chem_comp_angle.value_angle_esd
THR CA   N   H    109.577 1.5
THR CA   N   H2   109.577 1.5
THR CA   N   H3   109.577 1.5
THR H    N   H2   109.032 3
THR H    N   H3   109.032 3
THR H2   N   H3   109.032 3
THR N    CA  C    109.121 1.5
THR N    CA  CB   109.645 1.84
THR N    CA  HA   108.639 1.5
THR C    CA  CB   111.778 1.58
THR C    CA  HA   109.055 1.5
THR CB   CA  HA   108.87  1.5
THR CA   C   O    117.098 1.5
THR CA   C   OXT  117.098 1.5
THR O    C   OXT  125.804 1.5
THR CA   CB  OG1  105.245 3
THR CA   CB  CG2  112.544 1.5
THR CA   CB  HB   109.595 2.39
THR OG1  CB  CG2  109.974 3
THR OG1  CB  HB   109.323 1.86
THR CG2  CB  HB   109.17  2.61
THR CB   OG1 HG1  109.544 3
THR CB   CG2 HG21 109.532 1.5
THR CB   CG2 HG22 109.532 1.5
THR CB   CG2 HG23 109.532 1.5
THR HG21 CG2 HG22 109.425 1.5
THR HG21 CG2 HG23 109.425 1.5
THR HG22 CG2 HG23 109.425 1.5

loop_
_chem_comp_tor.comp_id
_chem_comp_tor.id
_chem_comp_tor.atom_id_1
_chem_comp_tor.atom_id_2
_chem_comp_tor.atom_id_3
_chem_comp_tor.atom_id_4
_chem_comp_tor.value_angle
_chem_comp_tor.value_angle_esd
_chem_comp_tor.period
THR chi1      N  CA CB  CG2  -60 10 3
THR hh1       CA CB OG1 HG1  -60 10 3
THR hh2       CA CB CG2 HG23 -60 10 3
THR sp3_sp3_1 C  CA N   H    180 10 3
THR sp2_sp3_1 O  C  CA  N    0   10 6

loop_
_chem_comp_chir.comp_id
_chem_comp_chir.id
_chem_comp_chir.atom_id_centre
_chem_comp_chir.atom_id_1
_chem_comp_chir.atom_id_2
_chem_comp_chir.atom_id_3
_chem_comp_chir.volume_sign
THR chir_1 CA N   C  CB  positive
THR chir_2 CB OG1 CA CG2 negative

loop_
_chem_comp_plane_atom.comp_id
_chem_comp_plane_atom.plane_id
_chem_comp_plane_atom.atom_id
_chem_comp_plane_atom.dist_esd
THR plan-1 C   0.02
THR plan-1 CA  0.02
THR plan-1 O   0.02
THR plan-1 OXT 0.02

data_MET
_chem_comp.id                     MET
_chem_comp.group                  peptide

loop_
_chem_comp_atom.comp_id
_chem_comp_atom.atom_id
_chem_comp_atom.type_symbol
_chem_comp_atom.type_energy
_chem_comp_atom.charge
MET N   N NT3 1
MET CA  C CH1 0
MET C   C C   0
MET O   O O   0
MET CB  C CH2 0
MET CG  C CH2 0
MET SD  S S2  0
MET CE  C CH3 0
MET OXT O OC  -1
MET H   H H   0
MET H2  H H   0
MET H3  H H   0
MET HA  H H   0
MET HB3 H H   0
MET HB2 H H   0
MET HG3 H H   0
MET HG2 H H   0
MET HE3 H H   0
MET HE2 H H   0
MET HE1 H H   0

loop_
_chem_comp_bond.comp_id
_chem_comp_bond.atom_id_1
_chem_comp_bond.atom_id_2
_chem_comp_bond.type
_chem_comp_bond.aromatic
_chem_comp_bond.value_dist
_chem_comp_bond.value_dist_esd
_chem_comp_bond.value_dist_nucleus
_chem_comp_bond.value_dist_nucleus_esd
MET N  CA  single n 1.487 0.01   1.487 0.01
MET CA C   single n 1.538 0.0113 1.538 0.0113
MET CA CB  single n 1.533 0.01   1.533 0.01
MET C  O   double n 1.251 0.0183 1.251 0.0183
MET C  OXT single n 1.251 0.0183 1.251 0.0183
MET CB CG  single n 1.517 0.0186 1.517 0.0186
MET CG SD  single n 1.804 0.01   1.804 0.01
MET SD CE  single n 1.798 0.01   1.798 0.01
MET N  H   single n 0.902 0.0102 1.018 0.052
MET N  H2  single n 0.902 0.0102 1.018 0.052
MET N  H3  single n 0.902 0.0102 1.018 0.052
MET CA HA  single n 0.991 0.02   1.092 0.01
MET CB HB3 single n 0.981 0.0141 1.092 0.01
MET CB HB2 single n 0.981 0.0141 1.092 0.01
MET CG HG3 single n 0.978 0.02   1.092 0.01
MET CG HG2 single n 0.978 0.02   1.092 0.01
MET CE HE3 single n 0.975 0.011  1.092 0.01
MET CE HE2 single n 0.975 0.011  1.092 0.01
MET CE HE1 single n 0.975 0.011  1.092 0.01

loop_
_chem_comp_angle.comp_id
_chem_comp_angle.atom_id_1
_chem_comp_angle.atom_id_2
_chem_comp_angle.atom_id_3
_chem_comp_angle.value_angle
_chem_comp_angle.value_angle_esd
MET CA  N  H   109.99  3
MET CA  N  H2  109.99  3
MET CA  N  H3  109.99  3
MET H   N  H2  109.032 3
MET H   N  H3  109.032 3
MET H2  N  H3  109.032 3
MET N   CA C   109.258 1.5
MET N   CA CB  110.97  1.5
MET N   CA HA  108.387 1.58
MET C   CA CB  109.608 2.17
MET C   CA HA  108.774 1.79
MET CB  CA HA  109.55  1.56
MET CA  C  O   117.148 1.6
MET CA  C  OXT 117.148 1.6
MET O   C  OXT 125.704 1.5
MET CA  CB CG  113.978 1.6
MET CA  CB HB3 108.606 1.5
MET CA  CB HB2 108.606 1.5
MET CG  CB HB3 108.93  1.5
MET CG  CB HB2 108.93  1.5
MET HB3 CB HB2 107.726 1.5
MET CB  CG SD  112.846 3
MET CB  CG HG3 109.287 1.5
MET CB  CG HG2 109.287 1.5
MET SD  CG HG3 108.733 1.5
MET SD  CG HG2 108.733 1.5
MET HG3 CG HG2 107.881 1.5
MET CG  SD CE  100.693 3
MET SD  CE HE3 109.472 1.5
MET SD  CE HE2 109.472 1.5
MET SD  CE HE1 109.472 1.5
MET HE3 CE HE2 109.569 2.44
MET HE3 CE HE1 109.569 2.44
MET HE2 CE HE1 109.569 2.44

loop_
_chem_comp_tor.comp_id
_chem_comp_tor.id
_chem_comp_tor.atom_id_1
_chem_comp_tor.atom_id_2
_chem_comp_tor.atom_id_3
_chem_comp_tor.atom_id_4
_chem_comp_tor.value_angle
_chem_comp_tor.value_angle_esd
_chem_comp_tor.period
MET chi1      N  CA CB CG  -60 10 3
MET chi2      CA CB CG SD  180 10 3
MET chi3      CB CG SD CE  180 10 3
MET hh1       CG SD CE HE3 60  10 3
MET sp3_sp3_1 C  CA N  H   180 10 3
MET sp2_sp3_1 O  C  CA N   0   10 6

loop_
_chem_comp_chir.comp_id
_chem_comp_chir.id
_chem_comp_chir.atom_id_centre
_chem_comp_chir.atom_id_1
_chem_comp_chir.atom_id_2
_chem_comp_chir.atom_id_3
_chem_comp_chir.volume_sign
MET chir_1 CA N C CB positive

loop_
_chem_comp_plane_atom.comp_id
_chem_comp_plane_atom.plane_id
_chem_comp_plane_atom.atom_id
_chem_comp_plane_atom.dist_esd
MET plan-1 C   0.02
MET plan-1 CA  0.02
MET plan-1 O   0.02
MET plan-1 OXT 0.02

data_ALA
_chem_comp.id                     ALA
_chem_comp.group                  peptide

loop_
_chem_comp_atom.comp_id
_chem_comp_atom.atom_id
_chem_comp_atom.type_symbol
_chem_comp_atom.type_energy
_chem_comp_atom.charge
ALA N   N NT3 1
ALA CA  C CH1 0
ALA C   C C   0
ALA O   O O   0
ALA CB  C CH3 0
ALA OXT O OC  -1
ALA H   H H   0
ALA H2  H H   0
ALA H3  H H   0
ALA HA  H H   0
ALA HB3 H H   0
ALA HB2 H H   0
ALA HB1 H H   0

loop_
_chem_comp_bond.comp_id
_chem_comp_bond.atom_id_1
_chem_comp_bond.atom_id_2
_chem_comp_bond.type
_chem_comp_bond.aromatic
_chem_comp_bond.value_dist
_chem_comp_bond.value_dist_esd
_chem_comp_bond.value_dist_nucleus
_chem_comp_bond.value_dist_nucleus_esd
ALA N  CA  single n 1.483 0.01   1.483 0.01
ALA CA C   single n 1.531 0.01   1.531 0.01
ALA CA CB  single n 1.513 0.0158 1.513 0.0158
ALA C  O   double n 1.251 0.0183 1.251 0.0183
ALA C  OXT single n 1.251 0.0183 1.251 0.0183
ALA N  H   single n 0.902 0.0102 1.018 0.052
ALA N  H2  single n 0.902 0.0102 1.018 0.052
ALA N  H3  single n 0.902 0.0102 1.018 0.052
ALA CA HA  single n 0.997 0.02   1.092 0.01
ALA CB HB3 single n 0.972 0.0148 1.092 0.01
ALA CB HB2 single n 0.972 0.0148 1.092 0.01
ALA CB HB1 single n 0.972 0.0148 1.092 0.01

loop_
_chem_comp_angle.comp_id
_chem_comp_angle.atom_id_1
_chem_comp_angle.atom_id_2
_chem_comp_angle.atom_id_3
_chem_comp_angle.value_angle
_chem_comp_angle.value_angle_esd
ALA CA  N  H   109.611 2.03
ALA CA  N  H2  109.611 2.03
ALA CA  N  H3  109.611 2.03
ALA H   N  H2  109.032 3
ALA H   N  H3  109.032 3
ALA H2  N  H3  109.032 3
ALA N   CA C   109.72  1.5
ALA N   CA CB  109.927 1.5
ALA N   CA HA  108.247 1.5
ALA C   CA CB  111.515 1.5
ALA C   CA HA  108.267 1.5
ALA CB  CA HA  109.172 1.57
ALA CA  C  O   117.191 2.33
ALA CA  C  OXT 117.191 2.33
ALA O   C  OXT 125.618 1.5
ALA CA  CB HB3 109.742 1.5
ALA CA  CB HB2 109.742 1.5
ALA CA  CB HB1 109.742 1.5
ALA HB3 CB HB2 109.365 1.6
ALA HB3 CB HB1 109.365 1.6
ALA HB2 CB HB1 109.365 1.6

loop_
_chem_comp_tor.comp_id
_chem_comp_tor.id
_chem_comp_tor.atom_id_1
_chem_comp_tor.atom_id_2
_chem_comp_tor.atom_id_3
_chem_comp_tor.atom_id_4
_chem_comp_tor.value_angle
_chem_comp_tor.value_angle_esd
_chem_comp_tor.period
ALA hh1       N CA CB HB3 180 10 3
ALA sp3_sp3_1 C CA N  H   180 10 3
ALA sp2_sp3_1 O C  CA N   0   10 6

loop_
_chem_comp_chir.comp_id
_chem_comp_chir.id
_chem_comp_chir.atom_id_centre
_chem_comp_chir.atom_id_1
_chem_comp_chir.atom_id_2
_chem_comp_chir.atom_id_3
_chem_comp_chir.volume_sign
ALA chir_1 CA N C CB positive

loop_
_chem_comp_plane_atom.comp_id
_chem_comp_plane_atom.plane_id
_chem_comp_plane_atom.atom_id
_chem_comp_plane_atom.dist_esd
ALA plan-1 C   0.02
ALA plan-1 CA  0.02
ALA plan-1 O   0.02
ALA plan-1 OXT 0.02

data_GLY
_chem_comp.id                     GLY
_chem_comp.group                  peptide

loop_
_chem_comp_atom.comp_id
_chem_comp_atom.atom_id
_chem_comp_atom.type_symbol
_chem_comp_atom.type_energy
_chem_comp_atom.charge
GLY N   N NT3 1
GLY CA  C CH2 0
GLY C   C C   0
GLY O   O O   0
GLY OXT O OC  -1
GLY H   H H   0
GLY H2  H H   0
GLY H3  H H   0
GLY HA3 H H   0
GLY HA2 H H   0

loop_
_chem_comp_bond.comp_id
_chem_comp_bond.atom_id_1
_chem_comp_bond.atom_id_2
_chem_comp_bond.type
_chem_comp_bond.aromatic
_chem_comp_bond.value_dist
_chem_comp_bond.value_dist_esd
_chem_comp_bond.value_dist_nucleus
_chem_comp_bond.value_dist_nucleus_esd
GLY N  CA  single n 1.476 0.0106 1.476 0.0106
GLY CA C   single n 1.517 0.0121 1.517 0.0121
GLY C  O   double n 1.249 0.0161 1.249 0.0161
GLY C  OXT single n 1.249 0.0161 1.249 0.0161
GLY N  H   single n 0.905 0.02   1.018 0.052
GLY N  H2  single n 0.905 0.02   1.018 0.052
GLY N  H3  single n 0.905 0.02   1.018 0.052
GLY CA HA3 single n 0.986 0.02   1.092 0.01
GLY CA HA2 single n 0.986 0.02   1.092 0.01

loop_
_chem_comp_angle.comp_id
_chem_comp_angle.atom_id_1
_chem_comp_angle.atom_id_2
_chem_comp_angle.atom_id_3
_chem_comp_angle.value_angle
_chem_comp_angle.value_angle_esd
GLY CA  N  H   110.151 2.94
GLY CA  N  H2  110.151 2.94
GLY CA  N  H3  110.151 2.94
GLY H   N  H2  109.089 3
GLY H   N  H3  109.089 3
GLY H2  N  H3  109.089 3
GLY N   CA C   111.292 1.5
GLY N   CA HA3 109.172 1.5
GLY N   CA HA2 109.172 1.5
GLY C   CA HA3 109.62  1.5
GLY C   CA HA2 109.62  1.5
GLY HA3 CA HA2 108.054 1.5
GLY CA  C  O   117.08  1.5
GLY CA  C  OXT 117.08  1.5
GLY O   C  OXT 125.839 1.5

loop_
_chem_comp_tor.comp_id
_chem_comp_tor.id
_chem_comp_tor.atom_id_1
_chem_comp_tor.atom_id_2
_chem_comp_tor.atom_id_3
_chem_comp_tor.atom_id_4
_chem_comp_tor.value_angle
_chem_comp_tor.value_angle_esd
_chem_comp_tor.period
GLY sp3_sp3_1 C CA N  H   180 10 3
GLY sp2_sp3_1 O C  CA HA3 0   10 6

loop_
_chem_comp_plane_atom.comp_id
_chem_comp_plane_atom.plane_id
_chem_comp_plane_atom.atom_id
_chem_comp_plane_atom.dist_esd
GLY plan-1 C   0.02
GLY plan-1 CA  0.02
GLY plan-1 O   0.02
GLY plan-1 OXT 0.02

data_TYR
_chem_comp.id                     TYR
_chem_comp.group                  peptide

loop_
_chem_comp_atom.comp_id
_chem_comp_atom.atom_id
_chem_comp_atom.type_symbol
_chem_comp_atom.type_energy
_chem_comp_atom.charge
TYR N   N NT3  1
TYR CA  C CH1  0
TYR C   C C    0
TYR O   O O    0
TYR CB  C CH2  0
TYR CG  C CR6  0
TYR CD1 C CR16 0
TYR CD2 C CR16 0
TYR CE1 C CR16 0
TYR CE2 C CR16 0
TYR CZ  C CR6  0
TYR OH  O OH1  0
TYR OXT O OC   -1
TYR H   H H    0
TYR H2  H H    0
TYR H3  H H    0
TYR HA  H H    0
TYR HB3 H H    0
TYR HB2 H H    0
TYR HD1 H H    0
TYR HD2 H H    0
TYR HE1 H H    0
TYR HE2 H H    0
TYR HH  H H    0

loop_
_chem_comp_bond.comp_id
_chem_comp_bond.atom_id_1
_chem_comp_bond.atom_id_2
_chem_comp_bond.type
_chem_comp_bond.aromatic
_chem_comp_bond.value_dist
_chem_comp_bond.value_dist_esd
_chem_comp_bond.value_dist_nucleus
_chem_comp_bond.value_dist_nucleus_esd
TYR N   CA  single n 1.489 0.01   1.489 0.01
TYR CA  C   single n 1.531 0.0171 1.531 0.0171
TYR CA  CB  single n 1.532 0.01   1.532 0.01
TYR C   O   double n 1.251 0.0183 1.251 0.0183
TYR C   OXT single n 1.251 0.0183 1.251 0.0183
TYR CB  CG  single n 1.523 0.01   1.523 0.01
TYR CG  CD1 double y 1.39  0.0116 1.39  0.0116
TYR CG  CD2 single y 1.39  0.0116 1.39  0.0116
TYR CD1 CE1 single y 1.385 0.01   1.385 0.01
TYR CD2 CE2 double y 1.385 0.01   1.385 0.01
TYR CE1 CZ  double y 1.383 0.01   1.383 0.01
TYR CE2 CZ  single y 1.383 0.01   1.383 0.01
TYR CZ  OH  single n 1.365 0.0137 1.365 0.0137
TYR N   H   single n 0.902 0.0102 1.018 0.052
TYR N   H2  single n 0.902 0.0102 1.018 0.052
TYR N   H3  single n 0.902 0.0102 1.018 0.052
TYR CA  HA  single n 0.994 0.02   1.092 0.01
TYR CB  HB3 single n 0.983 0.0163 1.092 0.01
TYR CB  HB2 single n 0.983 0.0163 1.092 0.01
TYR CD1 HD1 single n 0.944 0.0143 1.085 0.015
TYR CD2 HD2 single n 0.944 0.0143 1.085 0.015
TYR CE1 HE1 single n 0.942 0.0174 1.085 0.015
TYR CE2 HE2 single n 0.942 0.0174 1.085 0.015
TYR OH  HH  single n 0.858 0.02   0.966 0.0059

loop_
_chem_comp_angle.comp_id
_chem_comp_angle.atom_id_1
_chem_comp_angle.atom_id_2
_chem_comp_angle.atom_id_3
_chem_comp_angle.value_angle
_chem_comp_angle.value_angle_esd
TYR CA  N   H   109.791 3
TYR CA  N   H2  109.791 3
TYR CA  N   H3  109.791 3
TYR H   N   H2  109.032 3
TYR H   N   H3  109.032 3
TYR H2  N   H3  109.032 3
TYR N   CA  C   109.085 1.5
TYR N   CA  CB  109.965 3
TYR N   CA  HA  108.547 1.5
TYR C   CA  CB  111.98  3
TYR C   CA  HA  108.746 1.5
TYR CB  CA  HA  108.686 1.5
TYR CA  C   O   117.219 3
TYR CA  C   OXT 117.219 3
TYR O   C   OXT 125.562 1.5
TYR CA  CB  CG  114.693 2.05
TYR CA  CB  HB3 108.494 1.5
TYR CA  CB  HB2 108.494 1.5
TYR CG  CB  HB3 108.859 1.5
TYR CG  CB  HB2 108.859 1.5
TYR HB3 CB  HB2 107.843 2.16
TYR CB  CG  CD1 121.06  1.5
TYR CB  CG  CD2 121.06  1.5
TYR CD1 CG  CD2 117.879 1.5
TYR CG  CD1 CE1 121.468 1.5
TYR CG  CD1 HD1 119.327 1.5
TYR CE1 CD1 HD1 119.205 1.5
TYR CG  CD2 CE2 121.468 1.5
TYR CG  CD2 HD2 119.327 1.5
TYR CE2 CD2 HD2 119.205 1.5
TYR CD1 CE1 CZ  119.794 1.5
TYR CD1 CE1 HE1 120.177 1.5
TYR CZ  CE1 HE1 120.029 1.5
TYR CD2 CE2 CZ  119.794 1.5
TYR CD2 CE2 HE2 120.177 1.5
TYR CZ  CE2 HE2 120.029 1.5
TYR CE1 CZ  CE2 119.597 1.5
TYR CE1 CZ  OH  120.202 3
TYR CE2 CZ  OH  120.202 3
TYR CZ  OH  HH  109.97  3

loop_
_chem_comp_tor.comp_id
_chem_comp_tor.id
_chem_comp_tor.atom_id_1
_chem_comp_tor.atom_id_2
_chem_comp_tor.atom_id_3
_chem_comp_tor.atom_id_4
_chem_comp_tor.value_angle
_chem_comp_tor.value_angle_esd
_chem_comp_tor.period
TYR chi1      N   CA  CB  CG  -60 10 3
TYR chi2      CA  CB  CG  CD1 90  10 6
TYR CONST_1   CB  CG  CD1 CE1 0   0  1
TYR CONST_2   CG  CD1 CE1 CZ  0   0  1
TYR CONST_3   CZ  CE2 CD2 CG  0   0  1
TYR CONST_4   CD1 CE1 CZ  CE2 0   0  1
TYR CONST_5   CE1 CZ  CE2 CD2 0   0  1
TYR hh1       CE1 CZ  OH  HH  0   5  2
TYR sp3_sp3_1 C   CA  N   H   180 10 3
TYR const_21  CE2 CD2 CG  CD1 0   0  1
TYR sp2_sp3_1 O   C   CA  N   0   10 6

loop_
_chem_comp_chir.comp_id
_chem_comp_chir.id
_chem_comp_chir.atom_id_centre
_chem_comp_chir.atom_id_1
_chem_comp_chir.atom_id_2
_chem_comp_chir.atom_id_3
_chem_comp_chir.volume_sign
TYR chir_1 CA N C CB positive

loop_
_chem_comp_plane_atom.comp_id
_chem_comp_plane_atom.plane_id
_chem_comp_plane_atom.atom_id
_chem_comp_plane_atom.dist_esd
TYR plan-1 CB  0.02
TYR plan-1 CD1 0.02
TYR plan-1 CD2 0.02
TYR plan-1 CE1 0.02
TYR plan-1 CE2 0.02
TYR plan-1 CG  0.02
TYR plan-1 CZ  0.02
TYR plan-1 HD1 0.02
TYR plan-1 HD2 0.02
TYR plan-1 HE1 0.02
TYR plan-1 HE2 0.02
TYR plan-1 OH  0.02
TYR plan-2 C   0.02
TYR plan-2 CA  0.02
TYR plan-2 O   0.02
TYR plan-2 OXT 0.02

data_GLN
_chem_comp.id                     GLN
_chem_comp.group                  peptide

loop_
_chem_comp_atom.comp_id
_chem_comp_atom.atom_id
_chem_comp_atom.type_symbol
_chem_comp_atom.type_energy
_chem_comp_atom.charge
GLN N    N NT3 1
GLN CA   C CH1 0
GLN C    C C   0
GLN O    O O   0
GLN CB   C CH2 0
GLN CG   C CH2 0
GLN CD   C C   0
GLN OE1  O O   0
GLN NE2  N NH2 0
GLN OXT  O OC  -1
GLN H    H H   0
GLN H2   H H   0
GLN H3   H H   0
GLN HA   H H   0
GLN HB3  H H   0
GLN HB2  H H   0
GLN HG3  H H   0
GLN HG2  H H   0
GLN HE21 H H   0
GLN HE22 H H   0

loop_
_chem_comp_bond.comp_id
_chem_comp_bond.atom_id_1
_chem_comp_bond.atom_id_2
_chem_comp_bond.type
_chem_comp_bond.aromatic
_chem_comp_bond.value_dist
_chem_comp_bond.value_dist_esd
_chem_comp_bond.value_dist_nucleus
_chem_comp_bond.value_dist_nucleus_esd
GLN N   CA   single n 1.487 0.01   1.487 0.01
GLN CA  C    single n 1.538 0.0113 1.538 0.0113
GLN CA  CB   single n 1.529 0.01   1.529 0.01
GLN C   O    double n 1.251 0.0183 1.251 0.0183
GLN C   OXT  single n 1.251 0.0183 1.251 0.0183
GLN CB  CG   single n 1.525 0.01   1.525 0.01
GLN CG  CD   single n 1.513 0.01   1.513 0.01
GLN CD  OE1  double n 1.236 0.01   1.236 0.01
GLN CD  NE2  single n 1.325 0.01   1.325 0.01
GLN N   H    single n 0.902 0.0102 1.018 0.052
GLN N   H2   single n 0.902 0.0102 1.018 0.052
GLN N   H3   single n 0.902 0.0102 1.018 0.052
GLN CA  HA   single n 0.991 0.02   1.092 0.01
GLN CB  HB3  single n 0.98  0.0168 1.092 0.01
GLN CB  HB2  single n 0.98  0.0168 1.092 0.01
GLN CG  HG3  single n 0.981 0.0172 1.092 0.01
GLN CG  HG2  single n 0.981 0.0172 1.092 0.01
GLN NE2 HE21 single n 0.887 0.02   1.013 0.012
GLN NE2 HE22 single n 0.887 0.02   1.013 0.012

loop_
_chem_comp_angle.comp_id
_chem_comp_angle.atom_id_1
_chem_comp_angle.atom_id_2
_chem_comp_angle.atom_id_3
_chem_comp_angle.value_angle
_chem_comp_angle.value_angle_esd
GLN CA   N   H    109.99  3
GLN CA   N   H2   109.99  3
GLN CA   N   H3   109.99  3
GLN H    N   H2   109.032 3
GLN H    N   H3   109.032 3
GLN H2   N   H3   109.032 3
GLN N    CA  C    109.258 1.5
GLN N    CA  CB   110.44  2.46
GLN N    CA  HA   108.387 1.58
GLN C    CA  CB   111.059 3
GLN C    CA  HA   108.774 1.79
GLN CB   CA  HA   109.08  2.33
GLN CA   C   O    117.148 1.6
GLN CA   C   OXT  117.148 1.6
GLN O    C   OXT  125.704 1.5
GLN CA   CB  CG   113.998 1.5
GLN CA   CB  HB3  108.677 1.74
GLN CA   CB  HB2  108.677 1.74
GLN CG   CB  HB3  108.907 1.5
GLN CG   CB  HB2  108.907 1.5
GLN HB3  CB  HB2  107.655 1.5
GLN CB   CG  CD   113.265 1.5
GLN CB   CG  HG3  109.355 1.5
GLN CB   CG  HG2  109.355 1.5
GLN CD   CG  HG3  108.958 1.89
GLN CD   CG  HG2  108.958 1.89
GLN HG3  CG  HG2  107.827 1.56
GLN CG   CD  OE1  121.487 1.5
GLN CG   CD  NE2  116.074 1.76
GLN OE1  CD  NE2  122.439 1.5
GLN CD   NE2 HE21 119.917 2.87
GLN CD   NE2 HE22 119.917 2.87
GLN HE21 NE2 HE22 120.165 3

loop_
_chem_comp_tor.comp_id
_chem_comp_tor.id
_chem_comp_tor.atom_id_1
_chem_comp_tor.atom_id_2
_chem_comp_tor.atom_id_3
_chem_comp_tor.atom_id_4
_chem_comp_tor.value_angle
_chem_comp_tor.value_angle_esd
_chem_comp_tor.period
GLN chi1      N  CA CB  CG   -60 10 3
GLN chi2      CA CB CG  CD   180 10 3
GLN chi3      CB CG CD  NE2  180 10 6
GLN hh1       CG CD NE2 HE22 180 5  2
GLN sp3_sp3_1 C  CA N   H    180 10 3
GLN sp2_sp3_1 O  C  CA  N    0   10 6

loop_
_chem_comp_chir.comp_id
_chem_comp_chir.id
_chem_comp_chir.atom_id_centre
_chem_comp_chir.atom_id_1
_chem_comp_chir.atom_id_2
_chem_comp_chir.atom_id_3
_chem_comp_chir.volume_sign
GLN chir_1 CA N C CB positive

loop_
_chem_comp_plane_atom.comp_id
_chem_comp_plane_atom.plane_id
_chem_comp_plane_atom.atom_id
_chem_comp_plane_atom.dist_esd
GLN plan-1 C    0.02
GLN plan-1 CA   0.02
GLN plan-1 O    0.02
GLN plan-1 OXT  0.02
GLN plan-2 CD   0.02
GLN plan-2 CG   0.02
GLN plan-2 NE2  0.02
GLN plan-2 OE1  0.02
GLN plan-3 CD   0.02
GLN plan-3 HE21 0.02
GLN plan-3 HE22 0.02
GLN plan-3 NE2  0.02

data_ILE
_chem_comp.id                     ILE
_chem_comp.group                  peptide

loop_
_chem_comp_atom.comp_id
_chem_comp_atom.atom_id
_chem_comp_atom.type_symbol
_chem_comp_atom.type_energy
_chem_comp_atom.charge
ILE N    N NT3 1
ILE CA   C CH1 0
ILE C    C C   0
ILE O    O O   0
ILE CB   C CH1 0
ILE CG1  C CH2 0
ILE CG2  C CH3 0
ILE CD1  C CH3 0
ILE OXT  O OC  -1
ILE H    H H   0
ILE H2   H H   0
ILE H3   H H   0
ILE HA   H H   0
ILE HB   H H   0
ILE HG12 H H   0
ILE HG13 H H   0
ILE HG21 H H   0
ILE HG22 H H   0
ILE HG23 H H   0
ILE HD11 H H   0
ILE HD12 H H   0
ILE HD13 H H   0

loop_
_chem_comp_bond.comp_id
_chem_comp_bond.atom_id_1
_chem_comp_bond.atom_id_2
_chem_comp_bond.type
_chem_comp_bond.aromatic
_chem_comp_bond.value_dist
_chem_comp_bond.value_dist_esd
_chem_comp_bond.value_dist_nucleus
_chem_comp_bond.value_dist_nucleus_esd
ILE N   CA   single n 1.495 0.01   1.495 0.01
ILE CA  C    single n 1.538 0.01   1.538 0.01
ILE CA  CB   single n 1.54  0.0102 1.54  0.0102
ILE C   O    double n 1.251 0.0183 1.251 0.0183
ILE C   OXT  single n 1.251 0.0183 1.251 0.0183
ILE CB  CG1  single n 1.529 0.02   1.529 0.02
ILE CB  CG2  single n 1.529 0.0119 1.529 0.0119
ILE CG1 CD1  single n 1.518 0.0129 1.518 0.0129
ILE N   H    single n 0.902 0.0102 1.018 0.052
ILE N   H2   single n 0.902 0.0102 1.018 0.052
ILE N   H3   single n 0.902 0.0102 1.018 0.052
ILE CA  HA   single n 0.977 0.02   1.092 0.01
ILE CB  HB   single n 0.978 0.0189 1.092 0.01
ILE CG1 HG12 single n 0.979 0.0127 1.092 0.01
ILE CG1 HG13 single n 0.979 0.0127 1.092 0.01
ILE CG2 HG21 single n 0.972 0.0156 1.092 0.01
ILE CG2 HG22 single n 0.972 0.0156 1.092 0.01
ILE CG2 HG23 single n 0.972 0.0156 1.092 0.01
ILE CD1 HD11 single n 0.976 0.014  1.092 0.01
ILE CD1 HD12 single n 0.976 0.014  1.092 0.01
ILE CD1 HD13 single n 0.976 0.014  1.092 0.01

loop_
_chem_comp_angle.comp_id
_chem_comp_angle.atom_id_1
_chem_comp_angle.atom_id_2
_chem_comp_angle.atom_id_3
_chem_comp_angle.value_angle
_chem_comp_angle.value_angle_esd
ILE CA   N   H    109.99  2.8
ILE CA   N   H2   109.99  2.8
ILE CA   N   H3   109.99  2.8
ILE H    N   H2   109.032 3
ILE H    N   H3   109.032 3
ILE H2   N   H3   109.032 3
ILE N    CA  C    108.738 1.5
ILE N    CA  CB   110.837 1.5
ILE N    CA  HA   108.328 1.5
ILE C    CA  CB   111.703 1.5
ILE C    CA  HA   108.55  1.5
ILE CB   CA  HA   108.373 1.5
ILE CA   C   O    117.155 1.5
ILE CA   C   OXT  117.155 1.5
ILE O    C   OXT  125.69  1.5
ILE CA   CB  CG1  111.638 1.5
ILE CA   CB  CG2  110.951 1.5
ILE CA   CB  HB   107.422 1.5
ILE CG1  CB  CG2  111.728 1.5
ILE CG1  CB  HB   107.389 1.5
ILE CG2  CB  HB   107.597 1.5
ILE CB   CG1 CD1  114.066 1.5
ILE CB   CG1 HG12 108.686 1.5
ILE CB   CG1 HG13 108.686 1.5
ILE CD1  CG1 HG12 108.722 1.5
ILE CD1  CG1 HG13 108.722 1.5
ILE HG12 CG1 HG13 107.774 1.5
ILE CB   CG2 HG21 109.633 1.5
ILE CB   CG2 HG22 109.633 1.5
ILE CB   CG2 HG23 109.633 1.5
ILE HG21 CG2 HG22 109.39  1.5
ILE HG21 CG2 HG23 109.39  1.5
ILE HG22 CG2 HG23 109.39  1.5
ILE CG1  CD1 HD11 109.644 2.81
ILE CG1  CD1 HD12 109.644 2.81
ILE CG1  CD1 HD13 109.644 2.81
ILE HD11 CD1 HD12 109.381 1.5
ILE HD11 CD1 HD13 109.381 1.5
ILE HD12 CD1 HD13 109.381 1.5

loop_
_chem_comp_tor.comp_id
_chem_comp_tor.id
_chem_comp_tor.atom_id_1
_chem_comp_tor.atom_id_2
_chem_comp_tor.atom_id_3
_chem_comp_tor.atom_id_4
_chem_comp_tor.value_angle
_chem_comp_tor.value_angle_esd
_chem_comp_tor.period
ILE chi1      N  CA  CB  CG2  -60 10 3
ILE chi2      CA CB  CG1 CD1  180 10 3
ILE hh1       CA CB  CG2 HG23 -60 10 3
ILE hh2       CB CG1 CD1 HD13 60  10 3
ILE sp3_sp3_1 C  CA  N   H    180 10 3
ILE sp2_sp3_1 O  C   CA  N    0   10 6

loop_
_chem_comp_chir.comp_id
_chem_comp_chir.id
_chem_comp_chir.atom_id_centre
_chem_comp_chir.atom_id_1
_chem_comp_chir.atom_id_2
_chem_comp_chir.atom_id_3
_chem_comp_chir.volume_sign
ILE chir_1 CA N  C   CB  positive
ILE chir_2 CB CA CG1 CG2 positive

loop_
_chem_comp_plane_atom.comp_id
_chem_comp_plane_atom.plane_id
_chem_comp_plane_atom.atom_id
_chem_comp_plane_atom.dist_esd
ILE plan-1 C   0.02
ILE plan-1 CA  0.02
ILE plan-1 O   0.02
ILE plan-1 OXT 0.02

data_HIS
_chem_comp.id                     HIS
_chem_comp.group                  peptide

loop_
_chem_comp_atom.comp_id
_chem_comp_atom.atom_id
_chem_comp_atom.type_symbol
_chem_comp_atom.type_energy
_chem_comp_atom.charge
HIS N   N NT3  1
HIS CA  C CH1  0
HIS C   C C    0
HIS O   O O    0
HIS CB  C CH2  0
HIS CG  C CR5  0
HIS ND1 N NR15 1
HIS CD2 C CR15 0
HIS CE1 C CR15 0
HIS NE2 N NR15 0
HIS OXT O OC   -1
HIS H   H H    0
HIS H2  H H    0
HIS H3  H H    0
HIS HA  H H    0
HIS HB3 H H    0
HIS HB2 H H    0
HIS HD1 H H    0
HIS HD2 H H    0
HIS HE1 H H    0
HIS HE2 H H    0

loop_
_chem_comp_bond.comp_id
_chem_comp_bond.atom_id_1
_chem_comp_bond.atom_id_2
_chem_comp_bond.type
_chem_comp_bond.aromatic
_chem_comp_bond.value_dist
_chem_comp_bond.value_dist_esd
_chem_comp_bond.value_dist_nucleus
_chem_comp_bond.value_dist_nucleus_esd
HIS N   CA  single n 1.489 0.01   1.489 0.01
HIS CA  C   single n 1.533 0.01   1.533 0.01
HIS CA  CB  single n 1.533 0.0104 1.533 0.0104
HIS C   O   double n 1.251 0.0183 1.251 0.0183
HIS C   OXT single n 1.251 0.0183 1.251 0.0183
HIS CB  CG  single n 1.493 0.0146 1.493 0.0146
HIS CG  ND1 single y 1.378 0.01   1.378 0.01
HIS CG  CD2 double y 1.338 0.0174 1.338 0.0174
HIS ND1 CE1 double y 1.326 0.0133 1.326 0.0133
HIS CD2 NE2 single y 1.371 0.0154 1.371 0.0154
HIS CE1 NE2 single y 1.316 0.0157 1.316 0.0157
HIS N   H   single n 0.902 0.0102 1.018 0.052
HIS N   H2  single n 0.902 0.0102 1.018 0.052
HIS N   H3  single n 0.902 0.0102 1.018 0.052
HIS CA  HA  single n 0.989 0.02   1.092 0.01
HIS CB  HB3 single n 0.982 0.0176 1.092 0.01
HIS CB  HB2 single n 0.982 0.0176 1.092 0.01
HIS ND1 HD1 single n 0.881 0.02   1.013 0.012
HIS CD2 HD2 single n 0.937 0.0104 1.085 0.015
HIS CE1 HE1 single n 0.942 0.02   1.085 0.015
HIS NE2 HE2 single n 0.877 0.02   1.013 0.012

loop_
_chem_comp_angle.comp_id
_chem_comp_angle.atom_id_1
_chem_comp_angle.atom_id_2
_chem_comp_angle.atom_id_3
_chem_comp_angle.value_angle
_chem_comp_angle.value_angle_esd
HIS CA  N   H   109.992 2.14
HIS CA  N   H2  109.992 2.14
HIS CA  N   H3  109.992 2.14
HIS H   N   H2  109.032 3
HIS H   N   H3  109.032 3
HIS H2  N   H3  109.032 3
HIS N   CA  C   109.292 1.55
HIS N   CA  CB  110.573 1.5
HIS N   CA  HA  108.019 2.27
HIS C   CA  CB  111.874 3
HIS C   CA  HA  108.29  1.5
HIS CB  CA  HA  108.89  2.34
HIS CA  C   O   117.058 3
HIS CA  C   OXT 117.058 3
HIS O   C   OXT 125.883 1.5
HIS CA  CB  CG  113.931 1.83
HIS CA  CB  HB3 108.697 1.5
HIS CA  CB  HB2 108.697 1.5
HIS CG  CB  HB3 108.948 1.5
HIS CG  CB  HB2 108.948 1.5
HIS HB3 CB  HB2 107.846 2.68
HIS CB  CG  ND1 122.94  3
HIS CB  CG  CD2 131.173 3
HIS ND1 CG  CD2 105.887 1.5
HIS CG  ND1 CE1 109.313 1.5
HIS CG  ND1 HD1 125.337 2.6
HIS CE1 ND1 HD1 125.35  3
HIS CG  CD2 NE2 107.589 1.5
HIS CG  CD2 HD2 126.688 3
HIS NE2 CD2 HD2 125.723 3
HIS ND1 CE1 NE2 108.287 1.5
HIS ND1 CE1 HE1 125.729 2.42
HIS NE2 CE1 HE1 125.984 1.51
HIS CD2 NE2 CE1 108.93  1.5
HIS CD2 NE2 HE2 125.575 3
HIS CE1 NE2 HE2 125.489 3

loop_
_chem_comp_tor.comp_id
_chem_comp_tor.id
_chem_comp_tor.atom_id_1
_chem_comp_tor.atom_id_2
_chem_comp_tor.atom_id_3
_chem_comp_tor.atom_id_4
_chem_comp_tor.value_angle
_chem_comp_tor.value_angle_esd
_chem_comp_tor.period
HIS chi1            N   CA  CB  CG  -60 10 3
HIS chi2            CA  CB  CG  CD2 90  10 6
HIS sp3_sp3_1       C   CA  N   H   180 10 3
HIS const_17        NE2 CD2 CG  ND1 0   0  1
HIS const_13        CG  CD2 NE2 CE1 0   0  1
HIS const_sp2_sp2_5 NE2 CE1 ND1 CG  0   0  1
HIS const_sp2_sp2_9 ND1 CE1 NE2 CD2 0   0  1
HIS const_sp2_sp2_1 CD2 CG  ND1 CE1 0   0  1
HIS sp2_sp3_1       O   C   CA  N   0   10 6

loop_
_chem_comp_chir.comp_id
_chem_comp_chir.id
_chem_comp_chir.atom_id_centre
_chem_comp_chir.atom_id_1
_chem_comp_chir.atom_id_2
_chem_comp_chir.atom_id_3
_chem_comp_chir.volume_sign
HIS chir_1 CA N C CB positive

loop_
_chem_comp_plane_atom.comp_id
_chem_comp_plane_atom.plane_id
_chem_comp_plane_atom.atom_id
_chem_comp_plane_atom.dist_esd
HIS plan-1 CB  0.02
HIS plan-1 CD2 0.02
HIS plan-1 CE1 0.02
HIS plan-1 CG  0.02
HIS plan-1 HD1 0.02
HIS plan-1 HD2 0.02
HIS plan-1 HE1 0.02
HIS plan-1 HE2 0.02
HIS plan-1 ND1 0.02
HIS plan-1 NE2 0.02
HIS plan-2 C   0.02
HIS plan-2 CA  0.02
HIS plan-2 O   0.02
HIS plan-2 OXT 0.02

data_CYS
_chem_comp.id                     CYS
_chem_comp.group                  peptide

loop_
_chem_comp_atom.comp_id
_chem_comp_atom.atom_id
_chem_comp_atom.type_symbol
_chem_comp_atom.type_energy
_chem_comp_atom.charge
CYS N   N NT3  1
CYS CA  C CH1  0
CYS C   C C    0
CYS O   O O    0
CYS CB  C CH2  0
CYS SG  S SH1  0
CYS OXT O OC   -1
CYS H   H H    0
CYS H2  H H    0
CYS H3  H H    0
CYS HA  H H    0
CYS HB3 H H    0
CYS HB2 H H    0
CYS HG  H HSH1 0

loop_
_chem_comp_bond.comp_id
_chem_comp_bond.atom_id_1
_chem_comp_bond.atom_id_2
_chem_comp_bond.type
_chem_comp_bond.aromatic
_chem_comp_bond.value_dist
_chem_comp_bond.value_dist_esd
_chem_comp_bond.value_dist_nucleus
_chem_comp_bond.value_dist_nucleus_esd
CYS N  CA  single n 1.487 0.01   1.487 0.01
CYS CA C   single n 1.538 0.0113 1.538 0.0113
CYS CA CB  single n 1.524 0.01   1.524 0.01
CYS C  O   double n 1.251 0.0183 1.251 0.0183
CYS C  OXT single n 1.251 0.0183 1.251 0.0183
CYS CB SG  single n 1.812 0.0101 1.812 0.0101
CYS N  H   single n 0.902 0.0102 1.018 0.052
CYS N  H2  single n 0.902 0.0102 1.018 0.052
CYS N  H3  single n 0.902 0.0102 1.018 0.052
CYS CA HA  single n 0.991 0.02   1.092 0.01
CYS CB HB3 single n 0.983 0.0131 1.092 0.01
CYS CB HB2 single n 0.983 0.0131 1.092 0.01
CYS SG HG  single n 1.212 0.02   1.338 0.01

loop_
_chem_comp_angle.comp_id
_chem_comp_angle.atom_id_1
_chem_comp_angle.atom_id_2
_chem_comp_angle.atom_id_3
_chem_comp_angle.value_angle
_chem_comp_angle.value_angle_esd
CYS CA  N  H   109.684 2.12
CYS CA  N  H2  109.684 2.12
CYS CA  N  H3  109.684 2.12
CYS H   N  H2  109.032 3
CYS H   N  H3  109.032 3
CYS H2  N  H3  109.032 3
CYS N   CA C   109.504 1.5
CYS N   CA CB  110.927 1.5
CYS N   CA HA  107.886 1.5
CYS C   CA CB  110.126 3
CYS C   CA HA  108.362 1.5
CYS CB  CA HA  108.525 2.42
CYS CA  C  O   117.126 1.5
CYS CA  C  OXT 117.126 1.5
CYS O   C  OXT 125.747 1.5
CYS CA  CB SG  113.492 1.5
CYS CA  CB HB3 109.109 1.5
CYS CA  CB HB2 109.109 1.5
CYS SG  CB HB3 108.513 1.5
CYS SG  CB HB2 108.513 1.5
CYS HB3 CB HB2 107.963 1.5
CYS CB  SG HG  97.543  3

loop_
_chem_comp_tor.comp_id
_chem_comp_tor.id
_chem_comp_tor.atom_id_1
_chem_comp_tor.atom_id_2
_chem_comp_tor.atom_id_3
_chem_comp_tor.atom_id_4
_chem_comp_tor.value_angle
_chem_comp_tor.value_angle_esd
_chem_comp_tor.period
CYS chi1      N  CA CB SG -60 10 3
CYS chi2      CA CB SG HG 180 10 3
CYS sp3_sp3_1 C  CA N  H  180 10 3
CYS sp2_sp3_1 O  C  CA N  0   10 6

loop_
_chem_comp_chir.comp_id
_chem_comp_chir.id
_chem_comp_chir.atom_id_centre
_chem_comp_chir.atom_id_1
_chem_comp_chir.atom_id_2
_chem_comp_chir.atom_id_3
_chem_comp_chir.volume_sign
CYS chir_1 CA N CB C negative

loop_
_chem_comp_plane_atom.comp_id
_chem_comp_plane_atom.plane_id
_chem_comp_plane_atom.atom_id
_chem_comp_plane_atom.dist_esd
CYS plan-1 C   0.02
CYS plan-1 CA  0.02
CYS plan-1 O   0.02
CYS plan-1 OXT 0.02

data_SO4
_chem_comp.id                     SO4
_chem_comp.group                  non-polymer

loop_
_chem_comp_atom.comp_id
_chem_comp_atom.atom_id
_chem_comp_atom.type_symbol
_chem_comp_atom.type_energy
_chem_comp_atom.charge
SO4 S  S S3 0
SO4 O1 O O  0
SO4 O2 O O  0
SO4 O3 O OS -1
SO4 O4 O OS -1

loop_
_chem_comp_bond.comp_id
_chem_comp_bond.atom_id_1
_chem_comp_bond.atom_id_2
_chem_comp_bond.type
_chem_comp_bond.aromatic
_chem_comp_bond.value_dist
_chem_comp_bond.value_dist_esd
_chem_comp_bond.value_dist_nucleus
_chem_comp_bond.value_dist_nucleus_esd
SO4 S O1 double n 1.438 0.0156 1.438 0.0156
SO4 S O2 double n 1.438 0.0156 1.438 0.0156
SO4 S O3 single n 1.438 0.0156 1.438 0.0156
SO4 S O4 single n 1.438 0.0156 1.438 0.0156

loop_
_chem_comp_angle.comp_id
_chem_comp_angle.atom_id_1
_chem_comp_angle.atom_id_2
_chem_comp_angle.atom_id_3
_chem_comp_angle.value_angle
_chem_comp_angle.value_angle_esd
SO4 O1 S O2 109.467 1.5
SO4 O1 S O3 109.467 1.5
SO4 O1 S O4 109.467 1.5
SO4 O2 S O3 109.467 1.5
SO4 O2 S O4 109.467 1.5
SO4 O3 S O4 109.467 1.5

loop_
_chem_comp_chir.comp_id
_chem_comp_chir.id
_chem_comp_chir.atom_id_centre
_chem_comp_chir.atom_id_1
_chem_comp_chir.atom_id_2
_chem_comp_chir.atom_id_3
_chem_comp_chir.volume_sign
SO4 chir_1 S O1 O2 O3 both

data_link_TRANS
loop_
_chem_link_bond.link_id
_chem_link_bond.atom_1_comp_id
_chem_link_bond.atom_id_1
_chem_link_bond.atom_2_comp_id
_chem_link_bond.atom_id_2
_chem_link_bond.type
_chem_link_bond.value_dist
_chem_link_bond.value_dist_esd
TRANS 1 C 2 N SINGLE 1.337 0.011

loop_
_chem_link_angle.link_id
_chem_link_angle.atom_1_comp_id
_chem_link_angle.atom_id_1
_chem_link_angle.atom_2_comp_id
_chem_link_angle.atom_id_2
_chem_link_angle.atom_3_comp_id
_chem_link_angle.atom_id_3
_chem_link_angle.value_angle
_chem_link_angle.value_angle_esd
TRANS 1 CA 1 C 2 N  115.917 1.50
TRANS 1 O  1 C 2 N  123.469 1.50
TRANS 1 C  2 N 2 CA 122.095 1.76
TRANS 1 C  2 N 2 H  119.176 1.83

loop_
_chem_link_tor.link_id
_chem_link_tor.id
_chem_link_tor.atom_1_comp_id
_chem_link_tor.atom_id_1
_chem_link_tor.atom_2_comp_id
_chem_link_tor.atom_id_2
_chem_link_tor.atom_3_comp_id
_chem_link_tor.atom_id_3
_chem_link_tor.atom_4_comp_id
_chem_link_tor.atom_id_4
_chem_link_tor.value_angle
_chem_link_tor.value_angle_esd
_chem_link_tor.period
TRANS psi   1 N  1 CA 1 C  2 N  160.00 30.0 2
TRANS omega 1 CA 1 C  2 N  2 CA 180.00 5.0  0
TRANS phi   1 C  2 N  2 CA 2 C  60.00  20.0 3

loop_
_chem_link_plane.link_id
_chem_link_plane.plane_id
_chem_link_plane.atom_comp_id
_chem_link_plane.atom_id
_chem_link_plane.dist_esd
TRANS plan-1 1 CA 0.020
TRANS plan-1 1 C  0.020
TRANS plan-1 2 N  0.020
TRANS plan-1 1 O  0.020
TRANS plan-2 2 CA 0.020
TRANS plan-2 1 C  0.020
TRANS plan-2 2 H  0.020
TRANS plan-2 2 N  0.020

loop_
_chem_link.id
_chem_link.name
_chem_link.comp_id_1
_chem_link.mod_id_1
_chem_link.group_comp_1
_chem_link.comp_id_2
_chem_link.mod_id_2
_chem_link.group_comp_2
TRANS TRANS ? DEL-OXT peptide ? DEL-HN1 peptide

data_link_PTRANS
loop_
_chem_link_bond.link_id
_chem_link_bond.atom_1_comp_id
_chem_link_bond.atom_id_1
_chem_link_bond.atom_2_comp_id
_chem_link_bond.atom_id_2
_chem_link_bond.type
_chem_link_bond.value_dist
_chem_link_bond.value_dist_esd
PTRANS 1 C 2 N SINGLE 1.352 0.010

loop_
_chem_link_angle.link_id
_chem_link_angle.atom_1_comp_id
_chem_link_angle.atom_id_1
_chem_link_angle.atom_2_comp_id
_chem_link_angle.atom_id_2
_chem_link_angle.atom_3_comp_id
_chem_link_angle.atom_id_3
_chem_link_angle.value_angle
_chem_link_angle.value_angle_esd
PTRANS 1 CA 1 C 2 N 118.415 1.50
PTRANS 1 O  1 C 2 N 121.016 1.53
PTRANS 2 CA 2 N 1 C 120.469 1.50
PTRANS 2 CD 2 N 1 C 124.005 1.50

loop_
_chem_link_tor.link_id
_chem_link_tor.id
_chem_link_tor.atom_1_comp_id
_chem_link_tor.atom_id_1
_chem_link_tor.atom_2_comp_id
_chem_link_tor.atom_id_2
_chem_link_tor.atom_3_comp_id
_chem_link_tor.atom_id_3
_chem_link_tor.atom_4_comp_id
_chem_link_tor.atom_id_4
_chem_link_tor.value_angle
_chem_link_tor.value_angle_esd
_chem_link_tor.period
PTRANS psi   1 N  1 CA 1 C  2 N  160.00 30.0 2
PTRANS omega 1 CA 1 C  2 N  2 CA 180.00 5.0  0
PTRANS phi   1 C  2 N  2 CA 2 C  60.00  20.0 3

loop_
_chem_link_plane.link_id
_chem_link_plane.plane_id
_chem_link_plane.atom_comp_id
_chem_link_plane.atom_id
_chem_link_plane.dist_esd
PTRANS plan-1 1 CA 0.020
PTRANS plan-1 1 C  0.020
PTRANS plan-1 2 N  0.020
PTRANS plan-1 1 O  0.020
PTRANS plan-2 1 C  .020
PTRANS plan-2 2 N  .020
PTRANS plan-2 2 CA .020
PTRANS plan-2 2 CD .020

loop_
_chem_link.id
_chem_link.name
_chem_link.comp_id_1
_chem_link.mod_id_1
_chem_link.group_comp_1
_chem_link.comp_id_2
_chem_link.mod_id_2
_chem_link.group_comp_2
PTRANS PTRANS ? DEL-OXT peptide ? DEL-HNP P-peptide

data_link_CIS
loop_
_chem_link_bond.link_id
_chem_link_bond.atom_1_comp_id
_chem_link_bond.atom_id_1
_chem_link_bond.atom_2_comp_id
_chem_link_bond.atom_id_2
_chem_link_bond.type
_chem_link_bond.value_dist
_chem_link_bond.value_dist_esd
CIS 1 C 2 N SINGLE 1.337 0.011

loop_
_chem_link_angle.link_id
_chem_link_angle.atom_1_comp_id
_chem_link_angle.atom_id_1
_chem_link_angle.atom_2_comp_id
_chem_link_angle.atom_id_2
_chem_link_angle.atom_3_comp_id
_chem_link_angle.atom_id_3
_chem_link_angle.value_angle
_chem_link_angle.value_angle_esd
CIS 1 CA 1 C 2 N  115.917 1.50
CIS 1 O  1 C 2 N  123.469 1.50
CIS 1 C  2 N 2 CA 122.095 1.76
CIS 1 C  2 N 2 H  119.176 1.83

loop_
_chem_link_tor.link_id
_chem_link_tor.id
_chem_link_tor.atom_1_comp_id
_chem_link_tor.atom_id_1
_chem_link_tor.atom_2_comp_id
_chem_link_tor.atom_id_2
_chem_link_tor.atom_3_comp_id
_chem_link_tor.atom_id_3
_chem_link_tor.atom_4_comp_id
_chem_link_tor.atom_id_4
_chem_link_tor.value_angle
_chem_link_tor.value_angle_esd
_chem_link_tor.period
CIS psi   1 N  1 CA 1 C  2 N  160.00 30.0 2
CIS omega 1 CA 1 C  2 N  2 CA 0.00   5.0  0
CIS phi   1 C  2 N  2 CA 2 C  60.00  20.0 3

loop_
_chem_link_plane.link_id
_chem_link_plane.plane_id
_chem_link_plane.atom_comp_id
_chem_link_plane.atom_id
_chem_link_plane.dist_esd
CIS plan-1 1 CA 0.020
CIS plan-1 1 C  0.020
CIS plan-1 2 N  0.020
CIS plan-1 1 O  0.020
CIS plan-2 2 CA 0.020
CIS plan-2 1 C  0.020
CIS plan-2 2 H  0.020
CIS plan-2 2 N  0.020

loop_
_chem_link.id
_chem_link.name
_chem_link.comp_id_1
_chem_link.mod_id_1
_chem_link.group_comp_1
_chem_link.comp_id_2
_chem_link.mod_id_2
_chem_link.group_comp_2
CIS CIS ? DEL-OXT peptide ? DEL-HN1 peptide

data_mod_DEL-OXT
loop_
_chem_mod_atom.mod_id
_chem_mod_atom.function
_chem_mod_atom.atom_id
_chem_mod_atom.new_atom_id
_chem_mod_atom.new_type_symbol
_chem_mod_atom.new_type_energy
_chem_mod_atom.new_charge
DEL-OXT delete OXT . O OC -1

loop_
_chem_mod_bond.mod_id
_chem_mod_bond.function
_chem_mod_bond.atom_id_1
_chem_mod_bond.atom_id_2
_chem_mod_bond.new_type
_chem_mod_bond.new_value_dist
_chem_mod_bond.new_value_dist_esd
_chem_mod_bond.new_value_dist_nucleus
_chem_mod_bond.new_value_dist_nucleus_esd
DEL-OXT delete C  OXT single .     .     .     .
DEL-OXT change CA C   single 1.526 0.010 1.526 0.010
DEL-OXT change C  O   double 1.229 0.012 1.229 0.012

loop_
_chem_mod_angle.mod_id
_chem_mod_angle.function
_chem_mod_angle.atom_id_1
_chem_mod_angle.atom_id_2
_chem_mod_angle.atom_id_3
_chem_mod_angle.new_value_angle
_chem_mod_angle.new_value_angle_esd
DEL-OXT delete CA C OXT .       .
DEL-OXT delete O  C OXT .       .
DEL-OXT change CA C O   120.614 1.50

loop_
_chem_mod_plane_atom.mod_id
_chem_mod_plane_atom.function
_chem_mod_plane_atom.plane_id
_chem_mod_plane_atom.atom_id
_chem_mod_plane_atom.new_dist_esd
DEL-OXT delete plan-1 C   0.020
DEL-OXT delete plan-1 CA  0.020
DEL-OXT delete plan-1 O   0.020
DEL-OXT delete plan-1 OXT 0.020

loop_
_chem_mod_tor.mod_id
_chem_mod_tor.function
_chem_mod_tor.atom_id_1
_chem_mod_tor.atom_id_2
_chem_mod_tor.atom_id_3
_chem_mod_tor.atom_id_4
_chem_mod_tor.new_value_angle
_chem_mod_tor.new_value_angle_esd
DEL-OXT delete O C CA N 0.000 10.0

loop_
_chem_mod.id
_chem_mod.name
_chem_mod.comp_id
_chem_mod.group_id
DEL-OXT 'delete_OXT_from_peptide' ? peptide

data_mod_DEL-HN1
loop_
_chem_mod_atom.mod_id
_chem_mod_atom.function
_chem_mod_atom.atom_id
_chem_mod_atom.new_atom_id
_chem_mod_atom.new_type_symbol
_chem_mod_atom.new_type_energy
_chem_mod_atom.new_charge
DEL-HN1 delete H2 . H H   0
DEL-HN1 delete H3 . H H   0
DEL-HN1 change N  . N NH1 0

loop_
_chem_mod_bond.mod_id
_chem_mod_bond.function
_chem_mod_bond.atom_id_1
_chem_mod_bond.atom_id_2
_chem_mod_bond.new_type
_chem_mod_bond.new_value_dist
_chem_mod_bond.new_value_dist_esd
_chem_mod_bond.new_value_dist_nucleus
_chem_mod_bond.new_value_dist_nucleus_esd
DEL-HN1 delete N  H2 single .     .     .     .
DEL-HN1 delete N  H3 single .     .     .     .
DEL-HN1 change CA N  single 1.453 0.010 1.453 0.010
DEL-HN1 change N  H  single 0.914 0.010 1.036 0.016

loop_
_chem_mod_angle.mod_id
_chem_mod_angle.function
_chem_mod_angle.atom_id_1
_chem_mod_angle.atom_id_2
_chem_mod_angle.atom_id_3
_chem_mod_angle.new_value_angle
_chem_mod_angle.new_value_angle_esd
DEL-HN1 delete CA N H2 .       .
DEL-HN1 delete CA N H3 .       .
DEL-HN1 delete H  N H2 .       .
DEL-HN1 delete H  N H3 .       .
DEL-HN1 delete H2 N H3 .       .
DEL-HN1 change CA N H  118.729 1.50

loop_
_chem_mod_tor.mod_id
_chem_mod_tor.function
_chem_mod_tor.atom_id_1
_chem_mod_tor.atom_id_2
_chem_mod_tor.atom_id_3
_chem_mod_tor.atom_id_4
_chem_mod_tor.new_value_angle
_chem_mod_tor.new_value_angle_esd
DEL-HN1 delete C CA N H 180 10

loop_
_chem_mod.id
_chem_mod.name
_chem_mod.comp_id
_chem_mod.group_id
DEL-HN1 'delete_Hs_from_peptide' ? peptide

data_mod_DEL-HNP
loop_
_chem_mod_atom.mod_id
_chem_mod_atom.function
_chem_mod_atom.atom_id
_chem_mod_atom.new_atom_id
_chem_mod_atom.new_type_symbol
_chem_mod_atom.new_type_energy
_chem_mod_atom.new_charge
DEL-HNP delete H  . H H   0
DEL-HNP delete H2 . H H   0
DEL-HNP change N  . N NH0 0

loop_
_chem_mod_bond.mod_id
_chem_mod_bond.function
_chem_mod_bond.atom_id_1
_chem_mod_bond.atom_id_2
_chem_mod_bond.new_type
_chem_mod_bond.new_value_dist
_chem_mod_bond.new_value_dist_esd
_chem_mod_bond.new_value_dist_nucleus
_chem_mod_bond.new_value_dist_nucleus_esd
DEL-HNP delete N H  single .     .      .     .
DEL-HNP delete N H2 single .     .      .     .
DEL-HNP change N CA single 1.459 0.0100 1.459 0.0100
DEL-HNP change N CD single 1.472 0.0100 1.472 0.0100

loop_
_chem_mod_angle.mod_id
_chem_mod_angle.function
_chem_mod_angle.atom_id_1
_chem_mod_angle.atom_id_2
_chem_mod_angle.atom_id_3
_chem_mod_angle.new_value_angle
_chem_mod_angle.new_value_angle_esd
DEL-HNP delete CA N  H  .       .
DEL-HNP delete CA N  H2 .       .
DEL-HNP delete CD N  H  .       .
DEL-HNP delete CD N  H2 .       .
DEL-HNP delete H  N  H2 .       .
DEL-HNP change CA N  CD 112.597 1.50
DEL-HNP change N  CA C  113.251 1.50
DEL-HNP change N  CD CG 102.887 1.50

loop_
_chem_mod.id
_chem_mod.name
_chem_mod.comp_id
_chem_mod.group_id
DEL-HNP 'delete_Hs_from_peptide' ? peptide
