NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | cing | stage | program | type | subtype | subsubtype |
455134 | 5gcn | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_5gcn save_distance_constraint_statistics_1 _Distance_constraint_stats_list.Sf_category distance_constraint_statistics _Distance_constraint_stats_list.Constraint_list_ID 1 _Distance_constraint_stats_list.Constraint_count 1226 _Distance_constraint_stats_list.Viol_count 4677 _Distance_constraint_stats_list.Viol_total 7156.791 _Distance_constraint_stats_list.Viol_max 0.478 _Distance_constraint_stats_list.Viol_rms 0.0343 _Distance_constraint_stats_list.Viol_average_all_restraints 0.0101 _Distance_constraint_stats_list.Viol_average_violations_only 0.0638 _Distance_constraint_stats_list.Cutoff_violation_report 0.500 _Distance_constraint_stats_list.Details ; Description of the tags in this list: * 1 * Administrative tag * 2 * Administrative tag * 3 * Administrative tag * 4 * ID of the restraint list. * 5 * Number of restraints in list. * 6 * Number of violated restraints (each model violation is used). * 7 * Sum of violations in Angstrom. * 8 * Maximum violation of a restraint without averaging in any way. * 9 * Rms of violations over all restraints. * 10 * Average violation over all restraints. * 11 * Average violation over violated restraints. This violation is averaged over only those models in which the restraint is violated. These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998). * 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table. * 13 * This tag Description of the tags in the per residue table below: * 1 * Chain identifier (can be absent if none defined) * 2 * Residue number * 3 * Residue name * 4 * Maximum violation in ensemble of models (without any averaging) * 5 * Model number with the maximum violation * 6 * Number of models with a violation above cutoff * 7 * List of models (1 character per model) with a violation above cutoff. An '*' marks a violation above the cutoff. A '+' indicates the largest violation above the cutoff and a '-' marks the smallest violation over cutoff. For models 5, 15, 25,... a ' ' is replaced by a '.'. For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1. * 8 * Administrative tag * 9 * Administrative tag Description of the tags in the per restraint table below: * 1 * Restraint ID within restraint list. First node, FIRST member, first atom's: * 2 * Chain identifier (can be absent if none defined) * 3 * Residue number * 4 * Residue name * 5 * Name of (pseudo-)atom First node, SECOND member, first atom's: * 6 * Chain identifier (can be absent if none defined) * 7 * Residue number * 8 * Residue name * 9 * Name of (pseudo-)atom FIRST node's: * 10 * Target distance value (Angstrom) * 11 * Lower bound distance (Angstrom) * 12 * Upper bound distance (Angstrom) * 13 * Average distance in ensemble of models * 14 * Minimum distance in ensemble of models * 15 * Maximum distance in ensemble of models * 16 * Maximum violation (without any averaging) * 17 * Model number with the maximum violation * 18 * Number of models with a violation above cutoff * 19 * List of models with a violation above cutoff. See description above. * 20 * Administrative tag * 21 * Administrative tag ; loop_ _Distance_constraint_stats_per_res.Atom_entity_assembly_ID _Distance_constraint_stats_per_res.Atom_comp_index_ID _Distance_constraint_stats_per_res.Atom_comp_ID _Distance_constraint_stats_per_res.Total_violation _Distance_constraint_stats_per_res.Max_violation _Distance_constraint_stats_per_res.Max_violation_model_number _Distance_constraint_stats_per_res.Over_cutoff_viol_count _Distance_constraint_stats_per_res.Over_cutoff_viol_per_model 1 2 LYS 0.000 0.000 . 0 "[ . 1 . 2 ]" 1 3 GLY 0.000 0.000 . 0 "[ . 1 . 2 ]" 1 4 LEU 0.069 0.016 21 0 "[ . 1 . 2 ]" 1 5 LEU 4.480 0.153 12 0 "[ . 1 . 2 ]" 1 6 ASP 5.180 0.172 22 0 "[ . 1 . 2 ]" 1 7 PHE 3.430 0.190 6 0 "[ . 1 . 2 ]" 1 8 ASP 7.261 0.190 6 0 "[ . 1 . 2 ]" 1 9 ILE 3.858 0.141 4 0 "[ . 1 . 2 ]" 1 10 LEU 9.932 0.148 13 0 "[ . 1 . 2 ]" 1 11 THR 8.010 0.355 21 0 "[ . 1 . 2 ]" 1 12 ASN 5.906 0.355 21 0 "[ . 1 . 2 ]" 1 13 ASP 9.539 0.221 20 0 "[ . 1 . 2 ]" 1 14 GLY 2.437 0.113 6 0 "[ . 1 . 2 ]" 1 15 THR 0.533 0.053 22 0 "[ . 1 . 2 ]" 1 16 HIS 0.000 0.000 . 0 "[ . 1 . 2 ]" 1 17 ARG 0.468 0.048 13 0 "[ . 1 . 2 ]" 1 18 ASN 0.367 0.058 13 0 "[ . 1 . 2 ]" 1 19 MET 2.217 0.439 24 0 "[ . 1 . 2 ]" 1 20 LYS 0.981 0.147 24 0 "[ . 1 . 2 ]" 1 21 LEU 0.877 0.058 13 0 "[ . 1 . 2 ]" 1 22 LEU 0.933 0.081 8 0 "[ . 1 . 2 ]" 1 23 ILE 4.256 0.092 1 0 "[ . 1 . 2 ]" 1 24 ASP 7.936 0.149 1 0 "[ . 1 . 2 ]" 1 25 LEU 4.578 0.145 12 0 "[ . 1 . 2 ]" 1 26 LYS 3.227 0.126 23 0 "[ . 1 . 2 ]" 1 27 ASN 2.014 0.102 19 0 "[ . 1 . 2 ]" 1 28 ILE 5.703 0.198 19 0 "[ . 1 . 2 ]" 1 29 PHE 12.454 0.198 19 0 "[ . 1 . 2 ]" 1 30 SER 8.441 0.245 19 0 "[ . 1 . 2 ]" 1 31 ARG 0.233 0.033 11 0 "[ . 1 . 2 ]" 1 32 GLN 11.570 0.298 2 0 "[ . 1 . 2 ]" 1 33 LEU 2.896 0.127 1 0 "[ . 1 . 2 ]" 1 34 PRO 0.538 0.196 1 0 "[ . 1 . 2 ]" 1 35 LYS 0.583 0.219 1 0 "[ . 1 . 2 ]" 1 36 MET 0.542 0.155 1 0 "[ . 1 . 2 ]" 1 37 PRO 0.783 0.070 8 0 "[ . 1 . 2 ]" 1 38 LYS 0.601 0.041 15 0 "[ . 1 . 2 ]" 1 39 GLU 1.040 0.070 8 0 "[ . 1 . 2 ]" 1 40 TYR 2.470 0.153 7 0 "[ . 1 . 2 ]" 1 41 ILE 0.139 0.024 1 0 "[ . 1 . 2 ]" 1 42 VAL 3.128 0.140 12 0 "[ . 1 . 2 ]" 1 43 LYS 0.992 0.064 4 0 "[ . 1 . 2 ]" 1 44 LEU 1.424 0.066 15 0 "[ . 1 . 2 ]" 1 45 VAL 2.374 0.140 12 0 "[ . 1 . 2 ]" 1 46 PHE 0.433 0.075 8 0 "[ . 1 . 2 ]" 1 47 ASP 0.834 0.087 17 0 "[ . 1 . 2 ]" 1 48 ARG 1.300 0.087 17 0 "[ . 1 . 2 ]" 1 49 HIS 0.375 0.062 19 0 "[ . 1 . 2 ]" 1 50 HIS 0.656 0.085 24 0 "[ . 1 . 2 ]" 1 51 GLU 1.424 0.085 24 0 "[ . 1 . 2 ]" 1 52 SER 0.446 0.070 5 0 "[ . 1 . 2 ]" 1 53 MET 0.793 0.038 11 0 "[ . 1 . 2 ]" 1 54 VAL 5.023 0.209 20 0 "[ . 1 . 2 ]" 1 55 ILE 6.005 0.176 10 0 "[ . 1 . 2 ]" 1 56 LEU 9.990 0.209 20 0 "[ . 1 . 2 ]" 1 57 LYS 7.646 0.145 3 0 "[ . 1 . 2 ]" 1 58 ASN 5.196 0.171 3 0 "[ . 1 . 2 ]" 1 59 LYS 2.575 0.100 24 0 "[ . 1 . 2 ]" 1 60 GLN 14.421 0.275 4 0 "[ . 1 . 2 ]" 1 61 LYS 7.767 0.275 4 0 "[ . 1 . 2 ]" 1 62 VAL 5.289 0.149 1 0 "[ . 1 . 2 ]" 1 63 ILE 6.175 0.176 10 0 "[ . 1 . 2 ]" 1 64 GLY 2.922 0.164 10 0 "[ . 1 . 2 ]" 1 65 GLY 6.294 0.175 19 0 "[ . 1 . 2 ]" 1 66 ILE 6.937 0.175 19 0 "[ . 1 . 2 ]" 1 67 CYS 1.348 0.127 22 0 "[ . 1 . 2 ]" 1 68 PHE 1.264 0.140 15 0 "[ . 1 . 2 ]" 1 69 ARG 0.643 0.107 15 0 "[ . 1 . 2 ]" 1 70 GLN 8.454 0.302 6 0 "[ . 1 . 2 ]" 1 71 TYR 0.188 0.032 15 0 "[ . 1 . 2 ]" 1 72 LYS 9.654 0.272 18 0 "[ . 1 . 2 ]" 1 73 PRO 0.000 0.000 . 0 "[ . 1 . 2 ]" 1 74 GLN 9.382 0.272 18 0 "[ . 1 . 2 ]" 1 75 ARG 5.096 0.200 6 0 "[ . 1 . 2 ]" 1 76 PHE 5.119 0.200 6 0 "[ . 1 . 2 ]" 1 77 ALA 4.020 0.143 8 0 "[ . 1 . 2 ]" 1 78 GLU 1.547 0.107 15 0 "[ . 1 . 2 ]" 1 79 VAL 3.421 0.191 10 0 "[ . 1 . 2 ]" 1 80 ALA 0.872 0.140 15 0 "[ . 1 . 2 ]" 1 81 PHE 5.150 0.245 19 0 "[ . 1 . 2 ]" 1 82 LEU 3.390 0.237 22 0 "[ . 1 . 2 ]" 1 83 ALA 5.541 0.237 22 0 "[ . 1 . 2 ]" 1 84 VAL 6.805 0.222 10 0 "[ . 1 . 2 ]" 1 85 THR 3.729 0.300 8 0 "[ . 1 . 2 ]" 1 86 ALA 14.516 0.478 22 0 "[ . 1 . 2 ]" 1 87 ASN 4.570 0.189 10 0 "[ . 1 . 2 ]" 1 88 GLU 12.305 0.298 2 0 "[ . 1 . 2 ]" 1 89 GLN 17.133 0.478 22 0 "[ . 1 . 2 ]" 1 90 VAL 0.388 0.039 2 0 "[ . 1 . 2 ]" 1 91 ARG 0.000 0.000 . 0 "[ . 1 . 2 ]" 1 92 GLY 0.469 0.081 3 0 "[ . 1 . 2 ]" 1 93 TYR 0.512 0.105 3 0 "[ . 1 . 2 ]" 1 94 GLY 1.631 0.102 17 0 "[ . 1 . 2 ]" 1 95 THR 2.183 0.135 17 0 "[ . 1 . 2 ]" 1 96 ARG 0.534 0.105 3 0 "[ . 1 . 2 ]" 1 97 LEU 1.804 0.077 18 0 "[ . 1 . 2 ]" 1 98 MET 3.361 0.155 11 0 "[ . 1 . 2 ]" 1 99 ASN 6.631 0.167 22 0 "[ . 1 . 2 ]" 1 100 LYS 0.025 0.025 9 0 "[ . 1 . 2 ]" 1 101 PHE 1.628 0.160 14 0 "[ . 1 . 2 ]" 1 102 LYS 5.480 0.167 22 0 "[ . 1 . 2 ]" 1 103 ASP 0.080 0.024 13 0 "[ . 1 . 2 ]" 1 104 HIS 0.122 0.026 24 0 "[ . 1 . 2 ]" 1 105 MET 2.523 0.157 9 0 "[ . 1 . 2 ]" 1 106 GLN 0.754 0.066 20 0 "[ . 1 . 2 ]" 1 107 LYS 4.789 0.129 22 0 "[ . 1 . 2 ]" 1 108 GLN 14.286 0.378 12 0 "[ . 1 . 2 ]" 1 109 ASN 9.161 0.378 12 0 "[ . 1 . 2 ]" 1 110 ILE 15.152 0.302 6 0 "[ . 1 . 2 ]" 1 111 GLU 0.196 0.027 16 0 "[ . 1 . 2 ]" 1 112 TYR 1.974 0.130 17 0 "[ . 1 . 2 ]" 1 113 LEU 1.564 0.170 12 0 "[ . 1 . 2 ]" 1 114 LEU 4.441 0.142 23 0 "[ . 1 . 2 ]" 1 115 THR 6.820 0.191 10 0 "[ . 1 . 2 ]" 1 116 TYR 2.828 0.238 9 0 "[ . 1 . 2 ]" 1 117 ALA 4.513 0.134 15 0 "[ . 1 . 2 ]" 1 118 ASP 0.074 0.026 11 0 "[ . 1 . 2 ]" 1 119 ASN 0.000 0.000 . 0 "[ . 1 . 2 ]" 1 120 PHE 0.003 0.003 6 0 "[ . 1 . 2 ]" 1 121 ALA 4.587 0.238 2 0 "[ . 1 . 2 ]" 1 122 ILE 4.648 0.238 2 0 "[ . 1 . 2 ]" 1 123 GLY 2.390 0.154 22 0 "[ . 1 . 2 ]" 1 124 TYR 0.065 0.020 11 0 "[ . 1 . 2 ]" 1 125 PHE 3.269 0.211 24 0 "[ . 1 . 2 ]" 1 126 LYS 0.490 0.037 10 0 "[ . 1 . 2 ]" 1 127 LYS 0.316 0.059 20 0 "[ . 1 . 2 ]" 1 128 GLN 4.891 0.155 11 0 "[ . 1 . 2 ]" 1 129 GLY 0.795 0.087 20 0 "[ . 1 . 2 ]" 1 130 PHE 3.829 0.133 4 0 "[ . 1 . 2 ]" 1 131 THR 2.718 0.187 19 0 "[ . 1 . 2 ]" 1 132 LYS 8.285 0.211 24 0 "[ . 1 . 2 ]" 1 133 GLU 1.085 0.108 19 0 "[ . 1 . 2 ]" 1 134 HIS 0.114 0.024 6 0 "[ . 1 . 2 ]" 1 135 ARG 0.000 0.000 . 0 "[ . 1 . 2 ]" 1 136 MET 0.099 0.034 16 0 "[ . 1 . 2 ]" 1 137 PRO 0.250 0.065 9 0 "[ . 1 . 2 ]" 1 138 GLN 2.574 0.189 15 0 "[ . 1 . 2 ]" 1 139 GLU 0.712 0.055 22 0 "[ . 1 . 2 ]" 1 140 LYS 0.312 0.042 21 0 "[ . 1 . 2 ]" 1 141 TRP 5.532 0.194 12 0 "[ . 1 . 2 ]" 1 142 LYS 0.492 0.061 15 0 "[ . 1 . 2 ]" 1 143 GLY 0.000 0.000 . 0 "[ . 1 . 2 ]" 1 144 TYR 1.324 0.119 5 0 "[ . 1 . 2 ]" 1 145 ILE 0.566 0.114 1 0 "[ . 1 . 2 ]" 1 146 LYS 4.338 0.275 10 0 "[ . 1 . 2 ]" 1 147 ASP 4.857 0.275 10 0 "[ . 1 . 2 ]" 1 148 TYR 1.268 0.092 12 0 "[ . 1 . 2 ]" 1 149 ASP 0.481 0.072 9 0 "[ . 1 . 2 ]" 1 150 GLY 0.153 0.072 9 0 "[ . 1 . 2 ]" 1 151 GLY 0.131 0.028 15 0 "[ . 1 . 2 ]" 1 152 THR 4.324 0.134 15 0 "[ . 1 . 2 ]" 1 153 LEU 2.452 0.121 13 0 "[ . 1 . 2 ]" 1 154 MET 3.916 0.194 12 0 "[ . 1 . 2 ]" 1 155 GLU 1.670 0.187 19 0 "[ . 1 . 2 ]" 1 156 CYS 1.536 0.140 14 0 "[ . 1 . 2 ]" 1 157 TYR 1.355 0.116 10 0 "[ . 1 . 2 ]" 1 158 ILE 1.921 0.130 17 0 "[ . 1 . 2 ]" 1 160 PRO 0.041 0.022 7 0 "[ . 1 . 2 ]" 1 161 TYR 0.354 0.075 9 0 "[ . 1 . 2 ]" 1 162 VAL 1.001 0.061 16 0 "[ . 1 . 2 ]" 1 163 ASP 0.107 0.044 23 0 "[ . 1 . 2 ]" 1 164 TYR 0.017 0.011 22 0 "[ . 1 . 2 ]" 1 165 GLY 0.036 0.013 23 0 "[ . 1 . 2 ]" 1 166 ASN 0.031 0.013 23 0 "[ . 1 . 2 ]" stop_ loop_ _Distance_constraint_stats.Restraint_ID _Distance_constraint_stats.Atom_1_entity_assembly_ID _Distance_constraint_stats.Atom_1_comp_index_ID _Distance_constraint_stats.Atom_1_comp_ID _Distance_constraint_stats.Atom_1_ID _Distance_constraint_stats.Atom_2_entity_assembly_ID _Distance_constraint_stats.Atom_2_comp_index_ID _Distance_constraint_stats.Atom_2_comp_ID _Distance_constraint_stats.Atom_2_ID _Distance_constraint_stats.Node_1_distance_val _Distance_constraint_stats.Node_1_distance_lower_bound_val _Distance_constraint_stats.Node_1_distance_upper_bound_val _Distance_constraint_stats.Distance_average _Distance_constraint_stats.Distance_minimum _Distance_constraint_stats.Distance_maximum _Distance_constraint_stats.Max_violation _Distance_constraint_stats.Max_violation_model_number _Distance_constraint_stats.Over_cutoff_violation_count _Distance_constraint_stats.Over_cutoff_viol_per_model _Distance_constraint_stats.Distance_constraint_stats_ID 1 1 2 LYS HA 1 3 GLY H 0.000 . 4.000 2.683 2.144 3.570 . 0 0 "[ . 1 . 2 ]" 1 2 1 3 GLY QA 1 4 LEU H 0.000 . 2.500 2.181 2.108 2.320 . 0 0 "[ . 1 . 2 ]" 1 3 1 4 LEU H 1 4 LEU HA 0.000 . 3.000 2.897 2.853 2.936 . 0 0 "[ . 1 . 2 ]" 1 4 1 4 LEU H 1 4 LEU QB 0.000 . 2.500 2.283 2.243 2.349 . 0 0 "[ . 1 . 2 ]" 1 5 1 4 LEU H 1 4 LEU MD1 0.000 . 4.000 3.913 3.812 4.005 0.005 21 0 "[ . 1 . 2 ]" 1 6 1 4 LEU H 1 4 LEU MD2 0.000 . 4.000 2.167 1.949 2.435 . 0 0 "[ . 1 . 2 ]" 1 7 1 4 LEU HA 1 5 LEU H 0.000 . 4.000 3.476 3.324 3.572 . 0 0 "[ . 1 . 2 ]" 1 8 1 4 LEU MD2 1 5 LEU H 0.000 . 4.000 3.964 3.862 4.012 0.012 9 0 "[ . 1 . 2 ]" 1 9 1 4 LEU H 1 5 LEU H 0.000 . 2.500 2.365 2.175 2.516 0.016 21 0 "[ . 1 . 2 ]" 1 10 1 5 LEU H 1 5 LEU HA 0.000 . 3.000 2.866 2.728 2.937 . 0 0 "[ . 1 . 2 ]" 1 11 1 5 LEU H 1 5 LEU QB 0.000 . 3.000 2.488 2.008 3.061 0.061 8 0 "[ . 1 . 2 ]" 1 12 1 5 LEU H 1 5 LEU MD1 0.000 . 4.000 3.329 2.007 4.068 0.068 20 0 "[ . 1 . 2 ]" 1 13 1 5 LEU H 1 5 LEU MD2 0.000 . 4.000 3.299 2.055 4.147 0.147 22 0 "[ . 1 . 2 ]" 1 14 1 5 LEU H 1 5 LEU HG 0.000 . 4.000 3.087 1.929 4.042 0.042 21 0 "[ . 1 . 2 ]" 1 15 1 5 LEU HA 1 6 ASP H 0.000 . 2.500 2.461 2.300 2.591 0.091 16 0 "[ . 1 . 2 ]" 1 16 1 5 LEU QB 1 6 ASP H 0.000 . 3.000 2.510 1.904 3.012 0.012 15 0 "[ . 1 . 2 ]" 1 17 1 5 LEU MD1 1 6 ASP H 0.000 . 4.000 3.764 3.148 4.010 0.010 15 0 "[ . 1 . 2 ]" 1 18 1 5 LEU HG 1 6 ASP H 0.000 . 4.000 4.083 4.029 4.153 0.153 12 0 "[ . 1 . 2 ]" 1 19 1 5 LEU H 1 6 ASP H 0.000 . 5.000 4.530 4.393 4.651 . 0 0 "[ . 1 . 2 ]" 1 20 1 5 LEU MD2 1 58 ASN H 0.000 . 5.000 4.406 3.704 5.048 0.048 6 0 "[ . 1 . 2 ]" 1 21 1 6 ASP H 1 6 ASP HA 0.000 . 3.000 2.929 2.896 2.951 . 0 0 "[ . 1 . 2 ]" 1 22 1 6 ASP H 1 6 ASP QB 0.000 . 3.000 2.683 2.457 3.106 0.106 6 0 "[ . 1 . 2 ]" 1 23 1 6 ASP HA 1 7 PHE H 0.000 . 2.500 2.183 2.145 2.220 . 0 0 "[ . 1 . 2 ]" 1 24 1 6 ASP QB 1 7 PHE H 0.000 . 3.000 3.020 2.927 3.076 0.076 1 0 "[ . 1 . 2 ]" 1 25 1 6 ASP H 1 55 ILE MG 0.000 . 4.000 3.423 2.584 4.172 0.172 22 0 "[ . 1 . 2 ]" 1 26 1 6 ASP H 1 56 LEU QB 0.000 . 3.000 2.994 2.663 3.125 0.125 22 0 "[ . 1 . 2 ]" 1 27 1 6 ASP H 1 56 LEU H 0.000 . 4.000 2.763 1.955 3.532 . 0 0 "[ . 1 . 2 ]" 1 28 1 7 PHE H 1 7 PHE HA 0.000 . 3.000 2.931 2.907 2.952 . 0 0 "[ . 1 . 2 ]" 1 29 1 7 PHE H 1 7 PHE QB 0.000 . 3.000 2.400 2.343 2.463 . 0 0 "[ . 1 . 2 ]" 1 30 1 7 PHE H 1 7 PHE QD 0.000 . 3.000 2.301 1.968 2.790 . 0 0 "[ . 1 . 2 ]" 1 31 1 7 PHE HA 1 8 ASP H 0.000 . 2.500 2.298 2.196 2.378 . 0 0 "[ . 1 . 2 ]" 1 32 1 7 PHE QB 1 8 ASP H 0.000 . 3.000 2.676 2.416 2.999 . 0 0 "[ . 1 . 2 ]" 1 33 1 7 PHE QD 1 8 ASP H 0.000 . 4.000 4.113 4.030 4.190 0.190 6 0 "[ . 1 . 2 ]" 1 34 1 7 PHE H 1 8 ASP H 0.000 . 5.000 4.545 4.493 4.592 . 0 0 "[ . 1 . 2 ]" 1 35 1 7 PHE HA 1 56 LEU H 0.000 . 4.000 3.537 2.623 4.014 0.014 24 0 "[ . 1 . 2 ]" 1 36 1 7 PHE H 1 56 LEU MD1 0.000 . 5.000 4.534 3.926 5.016 0.016 24 0 "[ . 1 . 2 ]" 1 37 1 7 PHE QE 1 97 LEU H 0.000 . 5.000 3.862 3.440 4.718 . 0 0 "[ . 1 . 2 ]" 1 38 1 7 PHE HZ 1 97 LEU H 0.000 . 5.000 4.172 3.821 4.915 . 0 0 "[ . 1 . 2 ]" 1 39 1 8 ASP H 1 8 ASP HA 0.000 . 3.000 2.931 2.916 2.942 . 0 0 "[ . 1 . 2 ]" 1 40 1 8 ASP H 1 8 ASP QB 0.000 . 2.500 2.571 2.532 2.623 0.123 1 0 "[ . 1 . 2 ]" 1 41 1 8 ASP HA 1 9 ILE H 0.000 . 2.500 2.211 2.190 2.256 . 0 0 "[ . 1 . 2 ]" 1 42 1 8 ASP QB 1 9 ILE H 0.000 . 3.000 3.033 3.008 3.061 0.061 10 0 "[ . 1 . 2 ]" 1 43 1 8 ASP QB 1 54 VAL H 0.000 . 5.000 3.465 3.341 3.606 . 0 0 "[ . 1 . 2 ]" 1 44 1 8 ASP H 1 54 VAL MG1 0.000 . 4.000 4.051 3.807 4.167 0.167 12 0 "[ . 1 . 2 ]" 1 45 1 8 ASP H 1 54 VAL MG2 0.000 . 3.000 2.536 2.243 2.791 . 0 0 "[ . 1 . 2 ]" 1 46 1 8 ASP H 1 54 VAL H 0.000 . 4.000 2.636 2.350 2.982 . 0 0 "[ . 1 . 2 ]" 1 47 1 8 ASP H 1 55 ILE HA 0.000 . 5.000 3.932 3.482 4.184 . 0 0 "[ . 1 . 2 ]" 1 48 1 8 ASP H 1 56 LEU MD1 0.000 . 4.000 3.984 3.528 4.068 0.068 6 0 "[ . 1 . 2 ]" 1 49 1 9 ILE H 1 9 ILE HA 0.000 . 3.000 2.938 2.920 2.946 . 0 0 "[ . 1 . 2 ]" 1 50 1 9 ILE H 1 9 ILE HB 0.000 . 3.000 2.514 2.390 2.647 . 0 0 "[ . 1 . 2 ]" 1 51 1 9 ILE H 1 9 ILE MD 0.000 . 4.000 3.976 3.621 4.024 0.024 12 0 "[ . 1 . 2 ]" 1 52 1 9 ILE H 1 9 ILE QG 0.000 . 3.000 2.907 2.632 3.020 0.020 3 0 "[ . 1 . 2 ]" 1 53 1 9 ILE H 1 9 ILE MG 0.000 . 4.000 3.776 3.726 3.832 . 0 0 "[ . 1 . 2 ]" 1 54 1 9 ILE HA 1 10 LEU H 0.000 . 2.500 2.131 2.116 2.141 . 0 0 "[ . 1 . 2 ]" 1 55 1 9 ILE QG 1 10 LEU H 0.000 . 4.000 4.101 4.065 4.141 0.141 4 0 "[ . 1 . 2 ]" 1 56 1 9 ILE MG 1 10 LEU H 0.000 . 3.000 2.974 2.754 3.024 0.024 4 0 "[ . 1 . 2 ]" 1 57 1 9 ILE H 1 10 LEU QD 0.000 . 4.000 3.823 3.406 4.029 0.029 15 0 "[ . 1 . 2 ]" 1 58 1 9 ILE MG 1 52 SER H 0.000 . 4.000 2.872 2.598 3.135 . 0 0 "[ . 1 . 2 ]" 1 59 1 9 ILE HA 1 54 VAL H 0.000 . 4.000 3.650 3.213 3.895 . 0 0 "[ . 1 . 2 ]" 1 60 1 10 LEU H 1 10 LEU QB 0.000 . 3.000 2.540 2.450 2.596 . 0 0 "[ . 1 . 2 ]" 1 61 1 10 LEU H 1 10 LEU HG 0.000 . 3.000 2.964 2.629 3.083 0.083 2 0 "[ . 1 . 2 ]" 1 62 1 10 LEU H 1 10 LEU QD 0.000 . 3.000 3.085 3.032 3.141 0.141 14 0 "[ . 1 . 2 ]" 1 63 1 10 LEU HA 1 11 THR H 0.000 . 2.500 2.515 2.329 2.563 0.063 12 0 "[ . 1 . 2 ]" 1 64 1 10 LEU QB 1 11 THR H 0.000 . 3.000 2.021 1.955 2.408 . 0 0 "[ . 1 . 2 ]" 1 65 1 10 LEU QD 1 11 THR H 0.000 . 3.000 3.115 3.086 3.148 0.148 13 0 "[ . 1 . 2 ]" 1 66 1 10 LEU HA 1 18 ASN HD22 0.000 . 4.000 3.853 2.917 4.029 0.029 22 0 "[ . 1 . 2 ]" 1 67 1 10 LEU QD 1 18 ASN HD21 0.000 . 5.000 3.001 2.380 3.657 . 0 0 "[ . 1 . 2 ]" 1 68 1 10 LEU QD 1 18 ASN HD22 0.000 . 5.000 2.717 2.191 3.377 . 0 0 "[ . 1 . 2 ]" 1 69 1 10 LEU H 1 22 LEU MD1 0.000 . 5.000 5.024 4.979 5.081 0.081 8 0 "[ . 1 . 2 ]" 1 70 1 10 LEU H 1 52 SER H 0.000 . 4.000 3.465 3.119 3.719 . 0 0 "[ . 1 . 2 ]" 1 71 1 10 LEU H 1 53 MET HA 0.000 . 4.000 3.489 2.849 3.833 . 0 0 "[ . 1 . 2 ]" 1 72 1 11 THR H 1 11 THR HA 0.000 . 3.000 2.930 2.896 2.948 . 0 0 "[ . 1 . 2 ]" 1 73 1 11 THR H 1 11 THR HB 0.000 . 4.000 3.910 3.852 3.993 . 0 0 "[ . 1 . 2 ]" 1 74 1 11 THR H 1 11 THR MG 0.000 . 3.000 2.654 2.495 2.838 . 0 0 "[ . 1 . 2 ]" 1 75 1 11 THR HA 1 12 ASN H 0.000 . 3.000 2.649 2.379 3.355 0.355 21 0 "[ . 1 . 2 ]" 1 76 1 11 THR HB 1 12 ASN H 0.000 . 4.000 2.417 2.095 4.115 0.115 21 0 "[ . 1 . 2 ]" 1 77 1 11 THR MG 1 12 ASN H 0.000 . 5.000 3.812 3.515 4.067 . 0 0 "[ . 1 . 2 ]" 1 78 1 11 THR MG 1 13 ASP H 0.000 . 4.000 4.163 4.136 4.210 0.210 14 0 "[ . 1 . 2 ]" 1 79 1 11 THR MG 1 18 ASN HD22 0.000 . 5.000 3.962 2.715 4.436 . 0 0 "[ . 1 . 2 ]" 1 80 1 11 THR H 1 22 LEU MD1 0.000 . 5.000 3.126 2.202 3.752 . 0 0 "[ . 1 . 2 ]" 1 81 1 12 ASN QB 1 12 ASN HD21 0.000 . 3.000 2.180 2.111 2.238 . 0 0 "[ . 1 . 2 ]" 1 82 1 12 ASN H 1 12 ASN QB 0.000 . 3.000 2.599 2.291 3.028 0.028 21 0 "[ . 1 . 2 ]" 1 83 1 12 ASN HA 1 13 ASP H 0.000 . 2.500 2.680 2.644 2.721 0.221 20 0 "[ . 1 . 2 ]" 1 84 1 12 ASN QB 1 13 ASP H 0.000 . 4.000 3.919 3.857 4.026 0.026 1 0 "[ . 1 . 2 ]" 1 85 1 12 ASN HA 1 14 GLY H 0.000 . 3.000 3.037 3.022 3.067 0.067 8 0 "[ . 1 . 2 ]" 1 86 1 12 ASN HD21 1 46 PHE HA 0.000 . 4.000 2.580 2.000 3.333 . 0 0 "[ . 1 . 2 ]" 1 87 1 12 ASN HD21 1 46 PHE QB 0.000 . 4.000 3.656 2.033 4.016 0.016 16 0 "[ . 1 . 2 ]" 1 88 1 12 ASN HD22 1 46 PHE HA 0.000 . 4.000 2.821 2.145 4.019 0.019 19 0 "[ . 1 . 2 ]" 1 89 1 12 ASN HD22 1 46 PHE QB 0.000 . 5.000 3.509 2.525 5.002 0.002 17 0 "[ . 1 . 2 ]" 1 90 1 13 ASP H 1 13 ASP HA 0.000 . 3.000 2.838 2.802 2.890 . 0 0 "[ . 1 . 2 ]" 1 91 1 13 ASP H 1 13 ASP QB 0.000 . 3.000 2.247 2.113 2.656 . 0 0 "[ . 1 . 2 ]" 1 92 1 13 ASP HA 1 14 GLY H 0.000 . 4.000 3.428 3.401 3.456 . 0 0 "[ . 1 . 2 ]" 1 93 1 13 ASP QB 1 14 GLY H 0.000 . 5.000 3.088 2.896 3.705 . 0 0 "[ . 1 . 2 ]" 1 94 1 13 ASP H 1 14 GLY H 0.000 . 2.500 2.546 2.408 2.613 0.113 6 0 "[ . 1 . 2 ]" 1 95 1 13 ASP QB 1 15 THR H 0.000 . 5.000 3.411 2.647 4.160 . 0 0 "[ . 1 . 2 ]" 1 96 1 13 ASP H 1 18 ASN HD21 0.000 . 5.000 3.838 3.058 5.014 0.014 24 0 "[ . 1 . 2 ]" 1 97 1 13 ASP H 1 22 LEU MD1 0.000 . 5.000 4.021 3.856 4.250 . 0 0 "[ . 1 . 2 ]" 1 98 1 14 GLY H 1 14 GLY QA 0.000 . 2.500 2.278 2.210 2.381 . 0 0 "[ . 1 . 2 ]" 1 99 1 14 GLY QA 1 15 THR H 0.000 . 3.000 2.741 2.494 2.930 . 0 0 "[ . 1 . 2 ]" 1 100 1 14 GLY H 1 15 THR HA 0.000 . 5.000 4.942 4.652 5.053 0.053 22 0 "[ . 1 . 2 ]" 1 101 1 14 GLY H 1 15 THR MG 0.000 . 5.000 3.683 3.122 4.387 . 0 0 "[ . 1 . 2 ]" 1 102 1 14 GLY H 1 15 THR H 0.000 . 3.000 2.394 2.048 2.698 . 0 0 "[ . 1 . 2 ]" 1 103 1 15 THR H 1 15 THR HA 0.000 . 3.000 2.871 2.743 2.947 . 0 0 "[ . 1 . 2 ]" 1 104 1 15 THR H 1 15 THR MG 0.000 . 2.500 2.401 2.135 2.516 0.016 22 0 "[ . 1 . 2 ]" 1 105 1 15 THR HB 1 17 ARG H 0.000 . 4.000 3.813 3.219 4.034 0.034 3 0 "[ . 1 . 2 ]" 1 106 1 15 THR MG 1 18 ASN H 0.000 . 5.000 4.299 4.025 4.718 . 0 0 "[ . 1 . 2 ]" 1 107 1 16 HIS HA 1 17 ARG H 0.000 . 5.000 3.566 3.553 3.573 . 0 0 "[ . 1 . 2 ]" 1 108 1 16 HIS QB 1 17 ARG H 0.000 . 4.000 2.126 1.933 2.482 . 0 0 "[ . 1 . 2 ]" 1 109 1 16 HIS H 1 17 ARG H 0.000 . 5.000 2.684 2.411 3.769 . 0 0 "[ . 1 . 2 ]" 1 110 1 17 ARG H 1 17 ARG QB 0.000 . 3.000 2.686 2.498 2.787 . 0 0 "[ . 1 . 2 ]" 1 111 1 17 ARG H 1 17 ARG QD 0.000 . 3.000 2.629 2.064 3.032 0.032 14 0 "[ . 1 . 2 ]" 1 112 1 17 ARG H 1 17 ARG QG 0.000 . 3.000 1.951 1.753 2.272 . 0 0 "[ . 1 . 2 ]" 1 113 1 17 ARG HA 1 18 ASN H 0.000 . 4.000 3.547 3.472 3.576 . 0 0 "[ . 1 . 2 ]" 1 114 1 17 ARG QB 1 18 ASN H 0.000 . 4.000 3.170 2.881 3.519 . 0 0 "[ . 1 . 2 ]" 1 115 1 17 ARG QD 1 18 ASN H 0.000 . 4.000 3.587 1.907 4.016 0.016 9 0 "[ . 1 . 2 ]" 1 116 1 17 ARG QG 1 18 ASN H 0.000 . 3.000 2.051 1.851 2.852 . 0 0 "[ . 1 . 2 ]" 1 117 1 17 ARG H 1 18 ASN H 0.000 . 4.000 2.827 2.362 3.038 . 0 0 "[ . 1 . 2 ]" 1 118 1 17 ARG QG 1 19 MET H 0.000 . 5.000 4.418 3.905 5.048 0.048 13 0 "[ . 1 . 2 ]" 1 119 1 17 ARG HA 1 20 LYS H 0.000 . 4.000 3.732 3.202 3.998 . 0 0 "[ . 1 . 2 ]" 1 120 1 18 ASN HA 1 18 ASN HD22 0.000 . 5.000 4.532 3.742 4.768 . 0 0 "[ . 1 . 2 ]" 1 121 1 18 ASN H 1 18 ASN HA 0.000 . 3.000 2.786 2.740 2.837 . 0 0 "[ . 1 . 2 ]" 1 122 1 18 ASN QB 1 18 ASN HD21 0.000 . 3.000 2.220 2.119 2.557 . 0 0 "[ . 1 . 2 ]" 1 123 1 18 ASN H 1 18 ASN QB 0.000 . 3.000 2.472 2.147 2.649 . 0 0 "[ . 1 . 2 ]" 1 124 1 18 ASN HA 1 19 MET H 0.000 . 4.000 3.538 3.433 3.566 . 0 0 "[ . 1 . 2 ]" 1 125 1 18 ASN QB 1 19 MET H 0.000 . 3.000 2.466 2.015 3.046 0.046 24 0 "[ . 1 . 2 ]" 1 126 1 18 ASN H 1 19 MET H 0.000 . 3.000 2.783 2.555 3.010 0.010 6 0 "[ . 1 . 2 ]" 1 127 1 18 ASN HA 1 21 LEU H 0.000 . 4.000 3.843 3.646 4.058 0.058 13 0 "[ . 1 . 2 ]" 1 128 1 19 MET H 1 19 MET HA 0.000 . 3.000 2.779 2.710 2.852 . 0 0 "[ . 1 . 2 ]" 1 129 1 19 MET H 1 19 MET QB 0.000 . 2.500 2.182 1.958 2.298 . 0 0 "[ . 1 . 2 ]" 1 130 1 19 MET H 1 19 MET ME 0.000 . 4.000 4.044 4.005 4.128 0.128 13 0 "[ . 1 . 2 ]" 1 131 1 19 MET H 1 19 MET QG 0.000 . 3.000 2.801 2.444 3.439 0.439 24 0 "[ . 1 . 2 ]" 1 132 1 19 MET HA 1 20 LYS H 0.000 . 5.000 3.564 3.542 3.574 . 0 0 "[ . 1 . 2 ]" 1 133 1 19 MET QB 1 20 LYS H 0.000 . 2.500 2.410 2.173 2.647 0.147 24 0 "[ . 1 . 2 ]" 1 134 1 19 MET ME 1 20 LYS H 0.000 . 4.000 3.982 3.781 4.059 0.059 13 0 "[ . 1 . 2 ]" 1 135 1 19 MET HA 1 22 LEU H 0.000 . 4.000 3.641 3.348 3.916 . 0 0 "[ . 1 . 2 ]" 1 136 1 20 LYS H 1 20 LYS HA 0.000 . 3.000 2.723 2.702 2.756 . 0 0 "[ . 1 . 2 ]" 1 137 1 20 LYS H 1 20 LYS QB 0.000 . 2.500 2.205 2.052 2.499 . 0 0 "[ . 1 . 2 ]" 1 138 1 20 LYS H 1 20 LYS QG 0.000 . 4.000 3.581 2.349 4.056 0.056 16 0 "[ . 1 . 2 ]" 1 139 1 20 LYS HA 1 21 LEU H 0.000 . 4.000 3.560 3.541 3.567 . 0 0 "[ . 1 . 2 ]" 1 140 1 20 LYS H 1 21 LEU H 0.000 . 3.000 2.997 2.910 3.045 0.045 3 0 "[ . 1 . 2 ]" 1 141 1 20 LYS HA 1 23 ILE H 0.000 . 4.000 3.817 3.683 3.986 . 0 0 "[ . 1 . 2 ]" 1 142 1 20 LYS H 1 23 ILE MD 0.000 . 5.000 3.139 3.012 3.347 . 0 0 "[ . 1 . 2 ]" 1 143 1 20 LYS HA 1 24 ASP H 0.000 . 5.000 4.523 4.397 4.606 . 0 0 "[ . 1 . 2 ]" 1 144 1 21 LEU H 1 21 LEU HA 0.000 . 3.000 2.825 2.806 2.842 . 0 0 "[ . 1 . 2 ]" 1 145 1 21 LEU H 1 21 LEU QB 0.000 . 2.500 2.518 2.479 2.557 0.057 14 0 "[ . 1 . 2 ]" 1 146 1 21 LEU H 1 21 LEU HG 0.000 . 2.500 2.182 2.091 2.453 . 0 0 "[ . 1 . 2 ]" 1 147 1 21 LEU H 1 21 LEU QD 0.000 . 3.000 2.809 2.383 3.030 0.030 24 0 "[ . 1 . 2 ]" 1 148 1 21 LEU HA 1 22 LEU H 0.000 . 5.000 3.567 3.555 3.579 . 0 0 "[ . 1 . 2 ]" 1 149 1 21 LEU QB 1 22 LEU H 0.000 . 3.000 2.254 2.110 2.410 . 0 0 "[ . 1 . 2 ]" 1 150 1 21 LEU H 1 22 LEU H 0.000 . 4.000 2.756 2.629 2.852 . 0 0 "[ . 1 . 2 ]" 1 151 1 21 LEU HA 1 24 ASP H 0.000 . 4.000 3.512 3.311 3.691 . 0 0 "[ . 1 . 2 ]" 1 152 1 21 LEU HA 1 25 LEU H 0.000 . 5.000 4.627 4.544 4.697 . 0 0 "[ . 1 . 2 ]" 1 153 1 22 LEU H 1 22 LEU HA 0.000 . 3.000 2.756 2.736 2.783 . 0 0 "[ . 1 . 2 ]" 1 154 1 22 LEU H 1 22 LEU QB 0.000 . 2.500 2.364 2.151 2.539 0.039 2 0 "[ . 1 . 2 ]" 1 155 1 22 LEU H 1 22 LEU MD1 0.000 . 4.000 3.513 2.989 3.870 . 0 0 "[ . 1 . 2 ]" 1 156 1 22 LEU H 1 22 LEU MD2 0.000 . 4.000 3.516 2.698 4.053 0.053 20 0 "[ . 1 . 2 ]" 1 157 1 22 LEU H 1 22 LEU HG 0.000 . 3.000 2.498 2.132 3.013 0.013 20 0 "[ . 1 . 2 ]" 1 158 1 22 LEU HA 1 23 ILE H 0.000 . 4.000 3.519 3.499 3.544 . 0 0 "[ . 1 . 2 ]" 1 159 1 22 LEU QB 1 23 ILE H 0.000 . 3.000 2.660 2.512 2.787 . 0 0 "[ . 1 . 2 ]" 1 160 1 22 LEU HA 1 25 LEU H 0.000 . 4.000 3.709 3.525 3.826 . 0 0 "[ . 1 . 2 ]" 1 161 1 23 ILE H 1 23 ILE HA 0.000 . 3.000 2.794 2.758 2.823 . 0 0 "[ . 1 . 2 ]" 1 162 1 23 ILE H 1 23 ILE HB 0.000 . 2.500 2.478 2.447 2.515 0.015 8 0 "[ . 1 . 2 ]" 1 163 1 23 ILE H 1 23 ILE MD 0.000 . 4.000 3.169 3.117 3.226 . 0 0 "[ . 1 . 2 ]" 1 164 1 23 ILE H 1 23 ILE QG 0.000 . 2.500 2.228 2.129 2.304 . 0 0 "[ . 1 . 2 ]" 1 165 1 23 ILE H 1 23 ILE MG 0.000 . 4.000 3.756 3.745 3.763 . 0 0 "[ . 1 . 2 ]" 1 166 1 23 ILE HA 1 24 ASP H 0.000 . 4.000 3.559 3.547 3.568 . 0 0 "[ . 1 . 2 ]" 1 167 1 23 ILE HB 1 24 ASP H 0.000 . 3.000 2.336 2.281 2.376 . 0 0 "[ . 1 . 2 ]" 1 168 1 23 ILE MD 1 24 ASP H 0.000 . 4.000 4.072 4.051 4.092 0.092 1 0 "[ . 1 . 2 ]" 1 169 1 23 ILE QG 1 24 ASP H 0.000 . 4.000 4.059 4.023 4.079 0.079 16 0 "[ . 1 . 2 ]" 1 170 1 23 ILE MG 1 24 ASP H 0.000 . 3.000 3.045 3.016 3.071 0.071 1 0 "[ . 1 . 2 ]" 1 171 1 23 ILE H 1 24 ASP H 0.000 . 3.000 2.808 2.744 2.916 . 0 0 "[ . 1 . 2 ]" 1 172 1 23 ILE MG 1 27 ASN HD21 0.000 . 4.000 2.412 1.854 2.841 . 0 0 "[ . 1 . 2 ]" 1 173 1 23 ILE MG 1 27 ASN HD22 0.000 . 4.000 2.879 1.948 3.891 . 0 0 "[ . 1 . 2 ]" 1 174 1 23 ILE MG 1 27 ASN H 0.000 . 5.000 3.795 3.581 4.001 . 0 0 "[ . 1 . 2 ]" 1 175 1 24 ASP H 1 24 ASP HA 0.000 . 3.000 2.731 2.721 2.758 . 0 0 "[ . 1 . 2 ]" 1 176 1 24 ASP H 1 24 ASP QB 0.000 . 2.500 2.328 2.185 2.433 . 0 0 "[ . 1 . 2 ]" 1 177 1 24 ASP HA 1 25 LEU H 0.000 . 4.000 3.568 3.562 3.575 . 0 0 "[ . 1 . 2 ]" 1 178 1 24 ASP QB 1 25 LEU H 0.000 . 3.000 2.396 2.299 2.557 . 0 0 "[ . 1 . 2 ]" 1 179 1 24 ASP H 1 25 LEU H 0.000 . 3.000 3.018 2.923 3.058 0.058 3 0 "[ . 1 . 2 ]" 1 180 1 24 ASP HA 1 27 ASN HD21 0.000 . 4.000 2.909 2.333 3.409 . 0 0 "[ . 1 . 2 ]" 1 181 1 24 ASP HA 1 27 ASN HD22 0.000 . 5.000 2.814 1.898 5.005 0.005 10 0 "[ . 1 . 2 ]" 1 182 1 24 ASP HA 1 27 ASN H 0.000 . 4.000 3.789 3.534 4.006 0.006 23 0 "[ . 1 . 2 ]" 1 183 1 24 ASP QB 1 62 VAL H 0.000 . 5.000 4.788 4.468 4.997 . 0 0 "[ . 1 . 2 ]" 1 184 1 24 ASP H 1 62 VAL MG1 0.000 . 4.000 4.027 3.981 4.064 0.064 10 0 "[ . 1 . 2 ]" 1 185 1 24 ASP H 1 62 VAL MG2 0.000 . 4.000 4.105 4.063 4.149 0.149 1 0 "[ . 1 . 2 ]" 1 186 1 25 LEU H 1 25 LEU QB 0.000 . 2.500 2.452 2.336 2.515 0.015 6 0 "[ . 1 . 2 ]" 1 187 1 25 LEU H 1 25 LEU MD1 0.000 . 4.000 2.464 2.119 2.692 . 0 0 "[ . 1 . 2 ]" 1 188 1 25 LEU H 1 25 LEU MD2 0.000 . 4.000 2.025 1.922 2.750 . 0 0 "[ . 1 . 2 ]" 1 189 1 25 LEU H 1 25 LEU HG 0.000 . 4.000 3.934 3.871 4.045 0.045 1 0 "[ . 1 . 2 ]" 1 190 1 25 LEU HA 1 26 LYS H 0.000 . 4.000 3.548 3.535 3.564 . 0 0 "[ . 1 . 2 ]" 1 191 1 25 LEU QB 1 26 LYS H 0.000 . 3.000 2.388 2.100 2.450 . 0 0 "[ . 1 . 2 ]" 1 192 1 25 LEU MD1 1 26 LYS H 0.000 . 5.000 4.340 4.199 4.411 . 0 0 "[ . 1 . 2 ]" 1 193 1 25 LEU MD2 1 26 LYS H 0.000 . 4.000 3.657 3.562 3.962 . 0 0 "[ . 1 . 2 ]" 1 194 1 25 LEU HG 1 26 LYS H 0.000 . 5.000 5.007 4.698 5.052 0.052 8 0 "[ . 1 . 2 ]" 1 195 1 25 LEU H 1 26 LYS H 0.000 . 3.000 2.928 2.814 3.062 0.062 23 0 "[ . 1 . 2 ]" 1 196 1 25 LEU HA 1 28 ILE H 0.000 . 4.000 3.669 3.423 3.805 . 0 0 "[ . 1 . 2 ]" 1 197 1 25 LEU MD1 1 28 ILE H 0.000 . 5.000 4.830 4.580 5.000 . 0 0 "[ . 1 . 2 ]" 1 198 1 25 LEU HA 1 29 PHE H 0.000 . 4.000 4.032 3.977 4.071 0.071 2 0 "[ . 1 . 2 ]" 1 199 1 25 LEU MD1 1 29 PHE H 0.000 . 5.000 5.084 5.026 5.145 0.145 12 0 "[ . 1 . 2 ]" 1 200 1 25 LEU MD2 1 53 MET H 0.000 . 5.000 5.017 4.958 5.027 0.027 9 0 "[ . 1 . 2 ]" 1 201 1 25 LEU H 1 62 VAL MG1 0.000 . 4.000 3.014 2.811 3.309 . 0 0 "[ . 1 . 2 ]" 1 202 1 25 LEU MD1 1 64 GLY H 0.000 . 5.000 3.856 3.537 4.120 . 0 0 "[ . 1 . 2 ]" 1 203 1 25 LEU MD1 1 65 GLY H 0.000 . 4.000 3.515 3.103 4.013 0.013 8 0 "[ . 1 . 2 ]" 1 204 1 25 LEU MD1 1 66 ILE H 0.000 . 5.000 4.521 4.081 5.029 0.029 12 0 "[ . 1 . 2 ]" 1 205 1 26 LYS H 1 26 LYS HA 0.000 . 3.000 2.768 2.709 2.791 . 0 0 "[ . 1 . 2 ]" 1 206 1 26 LYS H 1 26 LYS QB 0.000 . 2.500 2.237 2.190 2.626 0.126 23 0 "[ . 1 . 2 ]" 1 207 1 26 LYS H 1 26 LYS QD 0.000 . 4.000 4.008 3.706 4.052 0.052 9 0 "[ . 1 . 2 ]" 1 208 1 26 LYS HA 1 27 ASN H 0.000 . 4.000 3.570 3.527 3.587 . 0 0 "[ . 1 . 2 ]" 1 209 1 26 LYS QB 1 27 ASN H 0.000 . 3.000 2.410 2.167 3.099 0.099 23 0 "[ . 1 . 2 ]" 1 210 1 26 LYS QD 1 27 ASN H 0.000 . 4.000 2.283 1.962 2.865 . 0 0 "[ . 1 . 2 ]" 1 211 1 26 LYS H 1 27 ASN H 0.000 . 3.000 2.958 2.756 3.034 0.034 8 0 "[ . 1 . 2 ]" 1 212 1 26 LYS HA 1 29 PHE H 0.000 . 4.000 4.063 4.038 4.096 0.096 12 0 "[ . 1 . 2 ]" 1 213 1 26 LYS HA 1 30 SER H 0.000 . 5.000 4.222 3.991 4.380 . 0 0 "[ . 1 . 2 ]" 1 214 1 26 LYS H 1 45 VAL MG1 0.000 . 4.000 3.269 2.692 3.721 . 0 0 "[ . 1 . 2 ]" 1 215 1 27 ASN H 1 27 ASN HA 0.000 . 3.000 2.812 2.776 2.860 . 0 0 "[ . 1 . 2 ]" 1 216 1 27 ASN H 1 27 ASN QB 0.000 . 2.500 2.392 2.287 2.521 0.021 5 0 "[ . 1 . 2 ]" 1 217 1 27 ASN H 1 27 ASN HD21 0.000 . 5.000 3.169 2.040 3.643 . 0 0 "[ . 1 . 2 ]" 1 218 1 27 ASN H 1 27 ASN HD22 0.000 . 5.000 3.944 3.570 4.245 . 0 0 "[ . 1 . 2 ]" 1 219 1 27 ASN HA 1 28 ILE H 0.000 . 4.000 3.527 3.483 3.569 . 0 0 "[ . 1 . 2 ]" 1 220 1 27 ASN QB 1 28 ILE H 0.000 . 4.000 3.215 2.545 3.593 . 0 0 "[ . 1 . 2 ]" 1 221 1 27 ASN H 1 28 ILE HB 0.000 . 5.000 4.825 4.630 5.002 0.002 6 0 "[ . 1 . 2 ]" 1 222 1 27 ASN H 1 28 ILE QG 0.000 . 5.000 4.381 4.187 4.676 . 0 0 "[ . 1 . 2 ]" 1 223 1 27 ASN H 1 28 ILE H 0.000 . 3.000 2.688 2.533 2.790 . 0 0 "[ . 1 . 2 ]" 1 224 1 27 ASN HA 1 30 SER H 0.000 . 4.000 4.069 4.040 4.102 0.102 19 0 "[ . 1 . 2 ]" 1 225 1 27 ASN HA 1 31 ARG H 0.000 . 5.000 3.713 3.531 3.851 . 0 0 "[ . 1 . 2 ]" 1 226 1 28 ILE H 1 28 ILE HA 0.000 . 3.000 2.769 2.745 2.798 . 0 0 "[ . 1 . 2 ]" 1 227 1 28 ILE H 1 28 ILE HB 0.000 . 2.500 2.476 2.310 2.541 0.041 19 0 "[ . 1 . 2 ]" 1 228 1 28 ILE H 1 28 ILE MD 0.000 . 4.000 3.412 3.275 3.726 . 0 0 "[ . 1 . 2 ]" 1 229 1 28 ILE H 1 28 ILE QG 0.000 . 2.500 2.234 2.062 2.509 0.009 10 0 "[ . 1 . 2 ]" 1 230 1 28 ILE H 1 28 ILE MG 0.000 . 4.000 3.761 3.691 3.778 . 0 0 "[ . 1 . 2 ]" 1 231 1 28 ILE HA 1 29 PHE H 0.000 . 5.000 3.579 3.557 3.592 . 0 0 "[ . 1 . 2 ]" 1 232 1 28 ILE HB 1 29 PHE H 0.000 . 3.000 2.277 2.220 2.322 . 0 0 "[ . 1 . 2 ]" 1 233 1 28 ILE MD 1 29 PHE H 0.000 . 4.000 4.151 4.124 4.198 0.198 19 0 "[ . 1 . 2 ]" 1 234 1 28 ILE QG 1 29 PHE H 0.000 . 4.000 4.057 4.025 4.095 0.095 23 0 "[ . 1 . 2 ]" 1 235 1 28 ILE MG 1 29 PHE H 0.000 . 3.000 2.888 2.297 3.054 0.054 19 0 "[ . 1 . 2 ]" 1 236 1 28 ILE H 1 29 PHE H 0.000 . 3.000 2.989 2.937 3.038 0.038 10 0 "[ . 1 . 2 ]" 1 237 1 28 ILE HA 1 31 ARG H 0.000 . 4.000 3.868 3.713 3.969 . 0 0 "[ . 1 . 2 ]" 1 238 1 28 ILE HA 1 32 GLN HE21 0.000 . 5.000 3.015 2.829 3.233 . 0 0 "[ . 1 . 2 ]" 1 239 1 28 ILE HA 1 32 GLN H 0.000 . 5.000 4.085 3.928 4.287 . 0 0 "[ . 1 . 2 ]" 1 240 1 28 ILE MD 1 64 GLY H 0.000 . 4.000 3.793 3.503 4.011 0.011 1 0 "[ . 1 . 2 ]" 1 241 1 28 ILE MG 1 84 VAL H 0.000 . 5.000 3.380 2.623 3.830 . 0 0 "[ . 1 . 2 ]" 1 242 1 28 ILE MD 1 85 THR H 0.000 . 4.000 3.191 2.682 3.641 . 0 0 "[ . 1 . 2 ]" 1 243 1 28 ILE MG 1 85 THR H 0.000 . 4.000 2.585 1.685 2.994 . 0 0 "[ . 1 . 2 ]" 1 244 1 28 ILE MG 1 86 ALA H 0.000 . 5.000 3.779 3.475 4.363 . 0 0 "[ . 1 . 2 ]" 1 245 1 29 PHE H 1 29 PHE HA 0.000 . 3.000 2.799 2.777 2.822 . 0 0 "[ . 1 . 2 ]" 1 246 1 29 PHE H 1 29 PHE QB 0.000 . 3.000 2.798 2.687 2.850 . 0 0 "[ . 1 . 2 ]" 1 247 1 29 PHE H 1 29 PHE QD 0.000 . 4.000 2.573 2.375 2.726 . 0 0 "[ . 1 . 2 ]" 1 248 1 29 PHE HA 1 30 SER H 0.000 . 5.000 3.540 3.528 3.558 . 0 0 "[ . 1 . 2 ]" 1 249 1 29 PHE QB 1 30 SER H 0.000 . 3.000 1.820 1.756 1.929 . 0 0 "[ . 1 . 2 ]" 1 250 1 29 PHE QD 1 30 SER H 0.000 . 5.000 3.604 3.453 3.736 . 0 0 "[ . 1 . 2 ]" 1 251 1 29 PHE H 1 30 SER H 0.000 . 3.000 3.091 3.042 3.134 0.134 21 0 "[ . 1 . 2 ]" 1 252 1 29 PHE HA 1 31 ARG H 0.000 . 5.000 4.099 4.021 4.253 . 0 0 "[ . 1 . 2 ]" 1 253 1 29 PHE H 1 31 ARG H 0.000 . 5.000 3.984 3.906 4.131 . 0 0 "[ . 1 . 2 ]" 1 254 1 29 PHE HA 1 32 GLN H 0.000 . 5.000 3.950 3.617 4.274 . 0 0 "[ . 1 . 2 ]" 1 255 1 29 PHE H 1 41 ILE MG 0.000 . 4.000 3.917 3.679 4.024 0.024 1 0 "[ . 1 . 2 ]" 1 256 1 29 PHE QE 1 65 GLY H 0.000 . 5.000 3.783 3.397 4.214 . 0 0 "[ . 1 . 2 ]" 1 257 1 29 PHE QE 1 67 CYS H 0.000 . 5.000 4.286 3.903 4.791 . 0 0 "[ . 1 . 2 ]" 1 258 1 29 PHE QD 1 83 ALA H 0.000 . 4.000 3.977 3.821 4.069 0.069 22 0 "[ . 1 . 2 ]" 1 259 1 29 PHE QE 1 83 ALA H 0.000 . 3.000 2.368 2.041 2.866 . 0 0 "[ . 1 . 2 ]" 1 260 1 29 PHE H 1 83 ALA MB 0.000 . 4.000 3.794 3.406 4.002 0.002 9 0 "[ . 1 . 2 ]" 1 261 1 29 PHE HZ 1 83 ALA H 0.000 . 5.000 3.943 3.554 4.506 . 0 0 "[ . 1 . 2 ]" 1 262 1 30 SER H 1 30 SER HA 0.000 . 3.000 2.699 2.673 2.723 . 0 0 "[ . 1 . 2 ]" 1 263 1 30 SER H 1 30 SER QB 0.000 . 2.500 2.214 2.092 2.291 . 0 0 "[ . 1 . 2 ]" 1 264 1 30 SER HA 1 31 ARG H 0.000 . 4.000 3.515 3.492 3.537 . 0 0 "[ . 1 . 2 ]" 1 265 1 30 SER QB 1 31 ARG H 0.000 . 3.000 2.808 2.680 2.945 . 0 0 "[ . 1 . 2 ]" 1 266 1 30 SER H 1 31 ARG H 0.000 . 3.000 2.955 2.895 3.011 0.011 6 0 "[ . 1 . 2 ]" 1 267 1 30 SER HA 1 33 LEU H 0.000 . 5.000 3.673 3.508 3.909 . 0 0 "[ . 1 . 2 ]" 1 268 1 30 SER H 1 41 ILE MD 0.000 . 4.000 2.441 1.902 3.002 . 0 0 "[ . 1 . 2 ]" 1 269 1 30 SER H 1 41 ILE MG 0.000 . 4.000 3.129 2.690 3.415 . 0 0 "[ . 1 . 2 ]" 1 270 1 30 SER H 1 81 PHE QD 0.000 . 5.000 5.190 5.158 5.245 0.245 19 0 "[ . 1 . 2 ]" 1 271 1 31 ARG H 1 31 ARG HA 0.000 . 3.000 2.831 2.808 2.847 . 0 0 "[ . 1 . 2 ]" 1 272 1 31 ARG H 1 31 ARG QB 0.000 . 2.500 2.202 2.146 2.261 . 0 0 "[ . 1 . 2 ]" 1 273 1 31 ARG H 1 31 ARG QG 0.000 . 3.000 2.874 2.756 2.980 . 0 0 "[ . 1 . 2 ]" 1 274 1 31 ARG HA 1 32 GLN H 0.000 . 4.000 3.581 3.567 3.592 . 0 0 "[ . 1 . 2 ]" 1 275 1 31 ARG QB 1 32 GLN HE21 0.000 . 5.000 2.523 2.424 2.613 . 0 0 "[ . 1 . 2 ]" 1 276 1 31 ARG QB 1 32 GLN H 0.000 . 4.000 2.196 2.109 2.283 . 0 0 "[ . 1 . 2 ]" 1 277 1 31 ARG H 1 32 GLN H 0.000 . 3.000 2.980 2.848 3.033 0.033 11 0 "[ . 1 . 2 ]" 1 278 1 32 GLN HA 1 32 GLN HE21 0.000 . 4.000 4.028 4.013 4.043 0.043 17 0 "[ . 1 . 2 ]" 1 279 1 32 GLN HA 1 32 GLN HE22 0.000 . 4.000 4.024 3.986 4.071 0.071 6 0 "[ . 1 . 2 ]" 1 280 1 32 GLN H 1 32 GLN HA 0.000 . 3.000 2.807 2.793 2.821 . 0 0 "[ . 1 . 2 ]" 1 281 1 32 GLN H 1 32 GLN QB 0.000 . 2.500 2.351 2.293 2.379 . 0 0 "[ . 1 . 2 ]" 1 282 1 32 GLN HE21 1 32 GLN QG 0.000 . 3.000 2.191 2.156 2.252 . 0 0 "[ . 1 . 2 ]" 1 283 1 32 GLN H 1 32 GLN QG 0.000 . 3.000 3.103 3.059 3.180 0.180 22 0 "[ . 1 . 2 ]" 1 284 1 32 GLN HA 1 33 LEU H 0.000 . 4.000 3.424 3.406 3.465 . 0 0 "[ . 1 . 2 ]" 1 285 1 32 GLN QB 1 33 LEU H 0.000 . 3.000 3.018 2.836 3.077 0.077 19 0 "[ . 1 . 2 ]" 1 286 1 32 GLN H 1 33 LEU HG 0.000 . 4.000 4.038 4.019 4.063 0.063 2 0 "[ . 1 . 2 ]" 1 287 1 32 GLN H 1 33 LEU H 0.000 . 3.000 2.611 2.555 2.671 . 0 0 "[ . 1 . 2 ]" 1 288 1 32 GLN HE21 1 85 THR HA 0.000 . 5.000 2.823 2.323 3.201 . 0 0 "[ . 1 . 2 ]" 1 289 1 32 GLN HE22 1 85 THR HA 0.000 . 5.000 3.784 3.287 4.222 . 0 0 "[ . 1 . 2 ]" 1 290 1 32 GLN HE21 1 86 ALA HA 0.000 . 5.000 3.747 3.536 4.014 . 0 0 "[ . 1 . 2 ]" 1 291 1 32 GLN HE21 1 86 ALA MB 0.000 . 4.000 3.496 3.139 4.007 0.007 20 0 "[ . 1 . 2 ]" 1 292 1 32 GLN HE21 1 86 ALA H 0.000 . 4.000 2.739 2.335 3.619 . 0 0 "[ . 1 . 2 ]" 1 293 1 32 GLN HE22 1 86 ALA HA 0.000 . 4.000 3.868 3.559 4.021 0.021 21 0 "[ . 1 . 2 ]" 1 294 1 32 GLN HE22 1 86 ALA MB 0.000 . 3.000 2.619 2.147 3.046 0.046 20 0 "[ . 1 . 2 ]" 1 295 1 32 GLN HE22 1 86 ALA H 0.000 . 4.000 2.718 2.468 3.443 . 0 0 "[ . 1 . 2 ]" 1 296 1 32 GLN QG 1 86 ALA H 0.000 . 5.000 3.208 2.925 3.824 . 0 0 "[ . 1 . 2 ]" 1 297 1 32 GLN QG 1 88 GLU H 0.000 . 5.000 5.245 5.149 5.298 0.298 2 0 "[ . 1 . 2 ]" 1 298 1 33 LEU H 1 33 LEU HA 0.000 . 3.000 2.931 2.866 2.940 . 0 0 "[ . 1 . 2 ]" 1 299 1 33 LEU H 1 33 LEU QB 0.000 . 2.500 2.546 2.492 2.581 0.081 24 0 "[ . 1 . 2 ]" 1 300 1 33 LEU H 1 33 LEU MD1 0.000 . 4.000 3.764 3.436 3.909 . 0 0 "[ . 1 . 2 ]" 1 301 1 33 LEU H 1 33 LEU MD2 0.000 . 4.000 3.456 3.301 3.707 . 0 0 "[ . 1 . 2 ]" 1 302 1 33 LEU H 1 33 LEU HG 0.000 . 3.000 2.464 2.181 2.536 . 0 0 "[ . 1 . 2 ]" 1 303 1 33 LEU H 1 34 PRO QD 0.000 . 4.000 3.533 3.249 4.127 0.127 1 0 "[ . 1 . 2 ]" 1 304 1 33 LEU HA 1 35 LYS H 0.000 . 5.000 3.675 3.180 5.026 0.026 1 0 "[ . 1 . 2 ]" 1 305 1 33 LEU QB 1 36 MET H 0.000 . 5.000 3.101 2.775 3.413 . 0 0 "[ . 1 . 2 ]" 1 306 1 33 LEU MD1 1 36 MET H 0.000 . 5.000 4.855 4.501 5.027 0.027 2 0 "[ . 1 . 2 ]" 1 307 1 34 PRO HA 1 35 LYS H 0.000 . 4.000 3.469 2.307 3.573 . 0 0 "[ . 1 . 2 ]" 1 308 1 34 PRO QD 1 35 LYS H 0.000 . 4.000 2.839 2.143 4.196 0.196 1 0 "[ . 1 . 2 ]" 1 309 1 34 PRO HA 1 36 MET H 0.000 . 4.000 3.890 3.587 4.155 0.155 1 0 "[ . 1 . 2 ]" 1 310 1 35 LYS H 1 35 LYS HA 0.000 . 3.000 2.818 2.299 2.938 . 0 0 "[ . 1 . 2 ]" 1 311 1 35 LYS H 1 35 LYS QB 0.000 . 2.500 2.376 2.134 2.719 0.219 1 0 "[ . 1 . 2 ]" 1 312 1 35 LYS H 1 35 LYS QG 0.000 . 3.000 2.610 2.177 3.094 0.094 1 0 "[ . 1 . 2 ]" 1 313 1 35 LYS HA 1 36 MET H 0.000 . 4.000 3.324 2.875 3.475 . 0 0 "[ . 1 . 2 ]" 1 314 1 35 LYS QB 1 36 MET H 0.000 . 4.000 3.199 2.895 3.828 . 0 0 "[ . 1 . 2 ]" 1 315 1 35 LYS H 1 36 MET H 0.000 . 3.000 2.662 2.385 3.014 0.014 1 0 "[ . 1 . 2 ]" 1 316 1 36 MET H 1 36 MET HA 0.000 . 3.000 2.912 2.748 2.944 . 0 0 "[ . 1 . 2 ]" 1 317 1 36 MET H 1 36 MET QB 0.000 . 2.500 2.312 2.082 2.517 0.017 11 0 "[ . 1 . 2 ]" 1 318 1 36 MET H 1 36 MET QG 0.000 . 4.000 3.531 2.472 4.054 0.054 21 0 "[ . 1 . 2 ]" 1 319 1 36 MET H 1 37 PRO QD 0.000 . 5.000 4.087 3.546 4.399 . 0 0 "[ . 1 . 2 ]" 1 320 1 36 MET H 1 41 ILE MD 0.000 . 5.000 4.802 4.398 5.016 0.016 4 0 "[ . 1 . 2 ]" 1 321 1 37 PRO HA 1 38 LYS H 0.000 . 2.500 2.182 2.151 2.237 . 0 0 "[ . 1 . 2 ]" 1 322 1 37 PRO QB 1 38 LYS H 0.000 . 4.000 3.165 2.964 3.596 . 0 0 "[ . 1 . 2 ]" 1 323 1 37 PRO HA 1 39 GLU H 0.000 . 4.000 4.027 3.862 4.070 0.070 8 0 "[ . 1 . 2 ]" 1 324 1 37 PRO QB 1 40 TYR H 0.000 . 3.000 2.506 2.262 2.970 . 0 0 "[ . 1 . 2 ]" 1 325 1 38 LYS H 1 38 LYS HA 0.000 . 3.000 2.789 2.732 2.859 . 0 0 "[ . 1 . 2 ]" 1 326 1 38 LYS H 1 38 LYS QB 0.000 . 2.500 2.516 2.492 2.541 0.041 15 0 "[ . 1 . 2 ]" 1 327 1 38 LYS H 1 38 LYS QG 0.000 . 3.000 2.126 1.980 2.327 . 0 0 "[ . 1 . 2 ]" 1 328 1 38 LYS HA 1 39 GLU H 0.000 . 4.000 3.528 3.499 3.551 . 0 0 "[ . 1 . 2 ]" 1 329 1 38 LYS QB 1 39 GLU H 0.000 . 3.000 2.560 2.461 2.735 . 0 0 "[ . 1 . 2 ]" 1 330 1 38 LYS QG 1 39 GLU H 0.000 . 4.000 3.982 3.845 4.039 0.039 10 0 "[ . 1 . 2 ]" 1 331 1 38 LYS H 1 39 GLU QB 0.000 . 5.000 4.514 4.335 4.792 . 0 0 "[ . 1 . 2 ]" 1 332 1 38 LYS H 1 39 GLU H 0.000 . 4.000 2.718 2.477 2.879 . 0 0 "[ . 1 . 2 ]" 1 333 1 38 LYS HA 1 41 ILE H 0.000 . 4.000 3.890 3.664 4.006 0.006 9 0 "[ . 1 . 2 ]" 1 334 1 38 LYS HA 1 42 VAL H 0.000 . 5.000 4.158 3.936 4.396 . 0 0 "[ . 1 . 2 ]" 1 335 1 39 GLU H 1 39 GLU HA 0.000 . 3.000 2.789 2.754 2.822 . 0 0 "[ . 1 . 2 ]" 1 336 1 39 GLU H 1 39 GLU QB 0.000 . 2.500 2.253 2.051 2.476 . 0 0 "[ . 1 . 2 ]" 1 337 1 39 GLU H 1 39 GLU QG 0.000 . 4.000 3.235 2.171 4.024 0.024 1 0 "[ . 1 . 2 ]" 1 338 1 39 GLU HA 1 40 TYR H 0.000 . 4.000 3.518 3.495 3.552 . 0 0 "[ . 1 . 2 ]" 1 339 1 39 GLU QB 1 40 TYR H 0.000 . 4.000 2.775 2.593 2.904 . 0 0 "[ . 1 . 2 ]" 1 340 1 39 GLU QG 1 40 TYR H 0.000 . 5.000 4.279 3.797 4.629 . 0 0 "[ . 1 . 2 ]" 1 341 1 39 GLU H 1 40 TYR H 0.000 . 3.000 2.739 2.630 2.854 . 0 0 "[ . 1 . 2 ]" 1 342 1 39 GLU HA 1 42 VAL H 0.000 . 4.000 3.586 3.480 3.689 . 0 0 "[ . 1 . 2 ]" 1 343 1 39 GLU HA 1 43 LYS H 0.000 . 5.000 3.764 3.679 3.916 . 0 0 "[ . 1 . 2 ]" 1 344 1 40 TYR H 1 40 TYR HA 0.000 . 3.000 2.797 2.787 2.810 . 0 0 "[ . 1 . 2 ]" 1 345 1 40 TYR H 1 40 TYR QB 0.000 . 2.500 2.153 2.103 2.245 . 0 0 "[ . 1 . 2 ]" 1 346 1 40 TYR H 1 40 TYR QD 0.000 . 4.000 4.084 4.020 4.153 0.153 7 0 "[ . 1 . 2 ]" 1 347 1 40 TYR HA 1 41 ILE H 0.000 . 4.000 3.579 3.576 3.586 . 0 0 "[ . 1 . 2 ]" 1 348 1 40 TYR QB 1 41 ILE H 0.000 . 3.000 1.963 1.910 2.083 . 0 0 "[ . 1 . 2 ]" 1 349 1 40 TYR H 1 41 ILE HB 0.000 . 5.000 4.981 4.918 5.022 0.022 7 0 "[ . 1 . 2 ]" 1 350 1 40 TYR HA 1 43 LYS H 0.000 . 4.000 3.357 3.250 3.427 . 0 0 "[ . 1 . 2 ]" 1 351 1 40 TYR QE 1 44 LEU H 0.000 . 5.000 5.009 4.868 5.034 0.034 18 0 "[ . 1 . 2 ]" 1 352 1 41 ILE H 1 41 ILE HB 0.000 . 3.000 2.503 2.465 2.539 . 0 0 "[ . 1 . 2 ]" 1 353 1 41 ILE H 1 41 ILE MD 0.000 . 4.000 2.204 1.958 2.923 . 0 0 "[ . 1 . 2 ]" 1 354 1 41 ILE H 1 41 ILE QG 0.000 . 3.000 2.672 2.350 2.847 . 0 0 "[ . 1 . 2 ]" 1 355 1 41 ILE H 1 41 ILE MG 0.000 . 4.000 3.775 3.763 3.782 . 0 0 "[ . 1 . 2 ]" 1 356 1 41 ILE HA 1 42 VAL H 0.000 . 5.000 3.494 3.467 3.512 . 0 0 "[ . 1 . 2 ]" 1 357 1 41 ILE HB 1 42 VAL H 0.000 . 3.000 2.764 2.639 2.916 . 0 0 "[ . 1 . 2 ]" 1 358 1 41 ILE MD 1 42 VAL H 0.000 . 5.000 3.957 3.812 4.314 . 0 0 "[ . 1 . 2 ]" 1 359 1 41 ILE QG 1 42 VAL H 0.000 . 5.000 4.363 4.199 4.436 . 0 0 "[ . 1 . 2 ]" 1 360 1 41 ILE MG 1 42 VAL H 0.000 . 4.000 3.419 3.300 3.565 . 0 0 "[ . 1 . 2 ]" 1 361 1 41 ILE H 1 42 VAL H 0.000 . 4.000 2.717 2.661 2.751 . 0 0 "[ . 1 . 2 ]" 1 362 1 42 VAL H 1 42 VAL HA 0.000 . 3.000 2.821 2.799 2.839 . 0 0 "[ . 1 . 2 ]" 1 363 1 42 VAL H 1 42 VAL HB 0.000 . 2.500 2.364 2.312 2.417 . 0 0 "[ . 1 . 2 ]" 1 364 1 42 VAL H 1 42 VAL MG1 0.000 . 4.000 3.722 3.706 3.735 . 0 0 "[ . 1 . 2 ]" 1 365 1 42 VAL H 1 42 VAL MG2 0.000 . 2.500 2.379 2.265 2.503 0.003 4 0 "[ . 1 . 2 ]" 1 366 1 42 VAL HA 1 43 LYS H 0.000 . 4.000 3.536 3.520 3.545 . 0 0 "[ . 1 . 2 ]" 1 367 1 42 VAL HB 1 43 LYS H 0.000 . 2.500 2.532 2.500 2.564 0.064 4 0 "[ . 1 . 2 ]" 1 368 1 42 VAL MG1 1 43 LYS H 0.000 . 4.000 3.196 3.059 3.368 . 0 0 "[ . 1 . 2 ]" 1 369 1 42 VAL MG2 1 43 LYS H 0.000 . 4.000 3.883 3.840 3.930 . 0 0 "[ . 1 . 2 ]" 1 370 1 42 VAL H 1 43 LYS H 0.000 . 3.000 2.624 2.537 2.686 . 0 0 "[ . 1 . 2 ]" 1 371 1 42 VAL HA 1 45 VAL H 0.000 . 4.000 3.562 3.444 3.702 . 0 0 "[ . 1 . 2 ]" 1 372 1 42 VAL MG2 1 45 VAL H 0.000 . 5.000 5.099 5.042 5.140 0.140 12 0 "[ . 1 . 2 ]" 1 373 1 42 VAL MG1 1 46 PHE H 0.000 . 5.000 3.840 3.428 4.106 . 0 0 "[ . 1 . 2 ]" 1 374 1 43 LYS H 1 43 LYS HA 0.000 . 3.000 2.814 2.775 2.845 . 0 0 "[ . 1 . 2 ]" 1 375 1 43 LYS H 1 43 LYS QB 0.000 . 2.500 2.104 2.035 2.211 . 0 0 "[ . 1 . 2 ]" 1 376 1 43 LYS H 1 43 LYS QD 0.000 . 4.000 3.397 2.299 4.057 0.057 3 0 "[ . 1 . 2 ]" 1 377 1 43 LYS H 1 43 LYS QG 0.000 . 4.000 3.285 2.707 4.015 0.015 16 0 "[ . 1 . 2 ]" 1 378 1 43 LYS HA 1 44 LEU H 0.000 . 4.000 3.553 3.518 3.567 . 0 0 "[ . 1 . 2 ]" 1 379 1 43 LYS QB 1 44 LEU H 0.000 . 3.000 2.529 2.429 2.633 . 0 0 "[ . 1 . 2 ]" 1 380 1 43 LYS QD 1 44 LEU H 0.000 . 5.000 4.526 2.767 4.902 . 0 0 "[ . 1 . 2 ]" 1 381 1 43 LYS H 1 44 LEU H 0.000 . 3.000 2.704 2.539 2.823 . 0 0 "[ . 1 . 2 ]" 1 382 1 44 LEU H 1 44 LEU HA 0.000 . 3.000 2.838 2.809 2.871 . 0 0 "[ . 1 . 2 ]" 1 383 1 44 LEU H 1 44 LEU QB 0.000 . 2.500 2.504 2.287 2.566 0.066 15 0 "[ . 1 . 2 ]" 1 384 1 44 LEU H 1 44 LEU HG 0.000 . 3.000 2.176 1.993 2.682 . 0 0 "[ . 1 . 2 ]" 1 385 1 44 LEU H 1 44 LEU QD 0.000 . 3.000 2.941 2.446 3.044 0.044 1 0 "[ . 1 . 2 ]" 1 386 1 44 LEU HA 1 45 VAL H 0.000 . 4.000 3.542 3.469 3.578 . 0 0 "[ . 1 . 2 ]" 1 387 1 44 LEU QB 1 45 VAL H 0.000 . 4.000 2.653 2.361 2.998 . 0 0 "[ . 1 . 2 ]" 1 388 1 44 LEU H 1 45 VAL H 0.000 . 3.000 2.613 2.477 2.782 . 0 0 "[ . 1 . 2 ]" 1 389 1 44 LEU HA 1 47 ASP H 0.000 . 4.000 3.764 3.364 4.027 0.027 3 0 "[ . 1 . 2 ]" 1 390 1 45 VAL H 1 45 VAL HA 0.000 . 3.000 2.879 2.835 2.923 . 0 0 "[ . 1 . 2 ]" 1 391 1 45 VAL H 1 45 VAL HB 0.000 . 3.000 2.448 2.394 2.552 . 0 0 "[ . 1 . 2 ]" 1 392 1 45 VAL H 1 45 VAL MG1 0.000 . 4.000 3.767 3.746 3.789 . 0 0 "[ . 1 . 2 ]" 1 393 1 45 VAL H 1 45 VAL MG2 0.000 . 3.000 2.389 2.059 2.606 . 0 0 "[ . 1 . 2 ]" 1 394 1 45 VAL HA 1 46 PHE H 0.000 . 4.000 3.517 3.406 3.577 . 0 0 "[ . 1 . 2 ]" 1 395 1 45 VAL HB 1 46 PHE H 0.000 . 4.000 2.836 2.432 3.311 . 0 0 "[ . 1 . 2 ]" 1 396 1 45 VAL MG1 1 46 PHE H 0.000 . 4.000 3.478 3.219 3.759 . 0 0 "[ . 1 . 2 ]" 1 397 1 45 VAL MG2 1 46 PHE H 0.000 . 5.000 3.997 3.821 4.188 . 0 0 "[ . 1 . 2 ]" 1 398 1 45 VAL H 1 46 PHE H 0.000 . 3.000 2.481 2.228 2.671 . 0 0 "[ . 1 . 2 ]" 1 399 1 45 VAL MG1 1 47 ASP H 0.000 . 5.000 4.699 4.497 5.007 0.007 8 0 "[ . 1 . 2 ]" 1 400 1 46 PHE H 1 46 PHE QB 0.000 . 3.000 2.536 2.429 2.715 . 0 0 "[ . 1 . 2 ]" 1 401 1 46 PHE H 1 46 PHE QD 0.000 . 3.000 3.009 2.942 3.075 0.075 8 0 "[ . 1 . 2 ]" 1 402 1 46 PHE HA 1 47 ASP H 0.000 . 4.000 3.046 2.923 3.129 . 0 0 "[ . 1 . 2 ]" 1 403 1 47 ASP H 1 47 ASP HA 0.000 . 3.000 2.779 2.741 2.864 . 0 0 "[ . 1 . 2 ]" 1 404 1 47 ASP H 1 47 ASP QB 0.000 . 2.500 2.105 2.046 2.386 . 0 0 "[ . 1 . 2 ]" 1 405 1 47 ASP HA 1 48 ARG H 0.000 . 2.500 2.499 2.272 2.587 0.087 17 0 "[ . 1 . 2 ]" 1 406 1 47 ASP H 1 48 ARG H 0.000 . 5.000 4.394 3.655 4.626 . 0 0 "[ . 1 . 2 ]" 1 407 1 48 ARG H 1 48 ARG QB 0.000 . 3.000 2.466 2.038 3.049 0.049 23 0 "[ . 1 . 2 ]" 1 408 1 48 ARG H 1 48 ARG QG 0.000 . 4.000 3.206 1.962 4.009 0.009 16 0 "[ . 1 . 2 ]" 1 409 1 48 ARG HA 1 49 HIS H 0.000 . 4.000 2.927 2.131 3.577 . 0 0 "[ . 1 . 2 ]" 1 410 1 48 ARG H 1 49 HIS H 0.000 . 4.000 3.795 3.166 4.062 0.062 19 0 "[ . 1 . 2 ]" 1 411 1 49 HIS H 1 49 HIS HA 0.000 . 3.000 2.598 2.272 2.947 . 0 0 "[ . 1 . 2 ]" 1 412 1 49 HIS H 1 49 HIS QB 0.000 . 3.000 2.827 2.414 3.025 0.025 19 0 "[ . 1 . 2 ]" 1 413 1 50 HIS HA 1 51 GLU H 0.000 . 2.500 2.494 2.208 2.585 0.085 24 0 "[ . 1 . 2 ]" 1 414 1 50 HIS QB 1 51 GLU H 0.000 . 3.000 2.281 2.012 2.921 . 0 0 "[ . 1 . 2 ]" 1 415 1 51 GLU H 1 51 GLU QB 0.000 . 3.000 2.313 2.076 2.551 . 0 0 "[ . 1 . 2 ]" 1 416 1 51 GLU H 1 51 GLU QG 0.000 . 4.000 3.553 2.906 3.995 . 0 0 "[ . 1 . 2 ]" 1 417 1 51 GLU HA 1 52 SER H 0.000 . 2.500 2.438 2.234 2.540 0.040 24 0 "[ . 1 . 2 ]" 1 418 1 51 GLU QB 1 52 SER H 0.000 . 3.000 2.539 2.184 3.001 0.001 4 0 "[ . 1 . 2 ]" 1 419 1 51 GLU QG 1 52 SER H 0.000 . 4.000 3.269 2.131 3.868 . 0 0 "[ . 1 . 2 ]" 1 420 1 51 GLU H 1 68 PHE H 0.000 . 4.000 4.025 4.000 4.067 0.067 4 0 "[ . 1 . 2 ]" 1 421 1 52 SER H 1 52 SER QB 0.000 . 3.000 2.899 2.713 3.070 0.070 5 0 "[ . 1 . 2 ]" 1 422 1 52 SER HA 1 53 MET H 0.000 . 2.500 2.287 2.129 2.518 0.018 21 0 "[ . 1 . 2 ]" 1 423 1 52 SER QB 1 53 MET H 0.000 . 4.000 3.086 2.132 3.779 . 0 0 "[ . 1 . 2 ]" 1 424 1 52 SER HA 1 68 PHE H 0.000 . 4.000 3.006 2.444 3.420 . 0 0 "[ . 1 . 2 ]" 1 425 1 53 MET H 1 53 MET QB 0.000 . 3.000 2.538 2.339 2.768 . 0 0 "[ . 1 . 2 ]" 1 426 1 53 MET HA 1 54 VAL H 0.000 . 2.500 2.181 2.156 2.264 . 0 0 "[ . 1 . 2 ]" 1 427 1 53 MET QG 1 54 VAL H 0.000 . 3.000 2.801 2.388 3.022 0.022 18 0 "[ . 1 . 2 ]" 1 428 1 53 MET QB 1 66 ILE H 0.000 . 5.000 3.073 2.341 3.758 . 0 0 "[ . 1 . 2 ]" 1 429 1 53 MET H 1 66 ILE MG 0.000 . 3.000 2.880 2.507 3.038 0.038 11 0 "[ . 1 . 2 ]" 1 430 1 53 MET H 1 67 CYS HA 0.000 . 4.000 2.937 2.500 3.466 . 0 0 "[ . 1 . 2 ]" 1 431 1 54 VAL H 1 54 VAL HB 0.000 . 4.000 3.777 3.691 3.915 . 0 0 "[ . 1 . 2 ]" 1 432 1 54 VAL H 1 54 VAL MG1 0.000 . 3.000 2.280 2.048 2.657 . 0 0 "[ . 1 . 2 ]" 1 433 1 54 VAL H 1 54 VAL MG2 0.000 . 2.500 2.523 2.452 2.585 0.085 19 0 "[ . 1 . 2 ]" 1 434 1 54 VAL HA 1 55 ILE H 0.000 . 2.500 2.477 2.315 2.530 0.030 18 0 "[ . 1 . 2 ]" 1 435 1 54 VAL HB 1 55 ILE H 0.000 . 3.000 2.303 2.135 2.666 . 0 0 "[ . 1 . 2 ]" 1 436 1 54 VAL MG1 1 55 ILE H 0.000 . 4.000 3.813 3.715 4.001 0.001 3 0 "[ . 1 . 2 ]" 1 437 1 54 VAL MG2 1 55 ILE H 0.000 . 4.000 2.446 2.224 3.131 . 0 0 "[ . 1 . 2 ]" 1 438 1 54 VAL MG2 1 56 LEU H 0.000 . 4.000 4.024 3.513 4.209 0.209 20 0 "[ . 1 . 2 ]" 1 439 1 54 VAL HA 1 66 ILE H 0.000 . 4.000 3.534 3.196 4.008 0.008 12 0 "[ . 1 . 2 ]" 1 440 1 55 ILE H 1 55 ILE HA 0.000 . 3.000 2.948 2.941 2.953 . 0 0 "[ . 1 . 2 ]" 1 441 1 55 ILE H 1 55 ILE HB 0.000 . 3.000 2.801 2.660 2.915 . 0 0 "[ . 1 . 2 ]" 1 442 1 55 ILE H 1 55 ILE MD 0.000 . 4.000 3.707 3.267 4.036 0.036 7 0 "[ . 1 . 2 ]" 1 443 1 55 ILE H 1 55 ILE QG 0.000 . 5.000 2.420 2.277 2.561 . 0 0 "[ . 1 . 2 ]" 1 444 1 55 ILE H 1 55 ILE MG 0.000 . 4.000 3.901 3.845 3.942 . 0 0 "[ . 1 . 2 ]" 1 445 1 55 ILE HA 1 56 LEU H 0.000 . 2.500 2.262 2.103 2.373 . 0 0 "[ . 1 . 2 ]" 1 446 1 55 ILE HB 1 56 LEU H 0.000 . 4.000 3.658 3.324 4.165 0.165 3 0 "[ . 1 . 2 ]" 1 447 1 55 ILE MD 1 56 LEU H 0.000 . 4.000 3.971 3.721 4.102 0.102 11 0 "[ . 1 . 2 ]" 1 448 1 55 ILE MG 1 56 LEU H 0.000 . 3.000 2.201 1.879 2.937 . 0 0 "[ . 1 . 2 ]" 1 449 1 55 ILE H 1 56 LEU MD2 0.000 . 4.000 3.976 3.793 4.039 0.039 7 0 "[ . 1 . 2 ]" 1 450 1 55 ILE QG 1 63 ILE H 0.000 . 4.000 4.123 4.045 4.176 0.176 10 0 "[ . 1 . 2 ]" 1 451 1 55 ILE MG 1 63 ILE H 0.000 . 4.000 3.812 3.550 4.021 0.021 22 0 "[ . 1 . 2 ]" 1 452 1 55 ILE HB 1 64 GLY H 0.000 . 4.000 1.772 1.521 1.926 . 0 0 "[ . 1 . 2 ]" 1 453 1 55 ILE MG 1 64 GLY H 0.000 . 4.000 3.349 3.039 3.601 . 0 0 "[ . 1 . 2 ]" 1 454 1 55 ILE H 1 64 GLY H 0.000 . 4.000 3.263 2.637 3.611 . 0 0 "[ . 1 . 2 ]" 1 455 1 55 ILE H 1 65 GLY QA 0.000 . 3.000 3.007 2.700 3.091 0.091 12 0 "[ . 1 . 2 ]" 1 456 1 56 LEU H 1 56 LEU QB 0.000 . 3.000 2.744 2.576 2.857 . 0 0 "[ . 1 . 2 ]" 1 457 1 56 LEU H 1 56 LEU HG 0.000 . 4.000 2.736 2.199 3.150 . 0 0 "[ . 1 . 2 ]" 1 458 1 56 LEU H 1 56 LEU QD 0.000 . 4.000 3.391 3.079 3.620 . 0 0 "[ . 1 . 2 ]" 1 459 1 56 LEU HA 1 57 LYS H 0.000 . 2.500 2.144 2.108 2.198 . 0 0 "[ . 1 . 2 ]" 1 460 1 56 LEU QB 1 57 LYS H 0.000 . 4.000 3.540 3.403 3.686 . 0 0 "[ . 1 . 2 ]" 1 461 1 56 LEU HG 1 57 LYS H 0.000 . 5.000 5.100 5.055 5.145 0.145 3 0 "[ . 1 . 2 ]" 1 462 1 56 LEU QD 1 57 LYS H 0.000 . 4.000 3.874 3.639 4.029 0.029 18 0 "[ . 1 . 2 ]" 1 463 1 56 LEU QB 1 59 LYS H 0.000 . 5.000 2.717 2.635 2.759 . 0 0 "[ . 1 . 2 ]" 1 464 1 56 LEU MD1 1 59 LYS H 0.000 . 5.000 4.101 4.029 4.175 . 0 0 "[ . 1 . 2 ]" 1 465 1 56 LEU QB 1 60 GLN H 0.000 . 5.000 2.980 2.669 3.357 . 0 0 "[ . 1 . 2 ]" 1 466 1 56 LEU QD 1 60 GLN H 0.000 . 4.000 3.617 3.363 3.730 . 0 0 "[ . 1 . 2 ]" 1 467 1 56 LEU HA 1 61 LYS H 0.000 . 4.000 3.552 3.245 3.842 . 0 0 "[ . 1 . 2 ]" 1 468 1 56 LEU QB 1 61 LYS H 0.000 . 4.000 2.755 2.193 3.152 . 0 0 "[ . 1 . 2 ]" 1 469 1 56 LEU QD 1 61 LYS H 0.000 . 4.000 3.389 2.859 3.713 . 0 0 "[ . 1 . 2 ]" 1 470 1 56 LEU QB 1 62 VAL H 0.000 . 5.000 4.731 4.330 5.022 0.022 4 0 "[ . 1 . 2 ]" 1 471 1 56 LEU QD 1 62 VAL H 0.000 . 4.000 3.159 2.912 3.358 . 0 0 "[ . 1 . 2 ]" 1 472 1 56 LEU HA 1 63 ILE H 0.000 . 4.000 3.694 3.506 3.933 . 0 0 "[ . 1 . 2 ]" 1 473 1 56 LEU MD2 1 63 ILE H 0.000 . 4.000 4.066 4.029 4.110 0.110 2 0 "[ . 1 . 2 ]" 1 474 1 57 LYS H 1 57 LYS QB 0.000 . 2.500 2.386 2.255 2.613 0.113 9 0 "[ . 1 . 2 ]" 1 475 1 57 LYS H 1 57 LYS QG 0.000 . 4.000 3.602 2.263 4.048 0.048 7 0 "[ . 1 . 2 ]" 1 476 1 57 LYS HA 1 58 ASN H 0.000 . 2.500 2.554 2.509 2.622 0.122 3 0 "[ . 1 . 2 ]" 1 477 1 57 LYS QB 1 58 ASN H 0.000 . 4.000 3.979 3.949 4.013 0.013 3 0 "[ . 1 . 2 ]" 1 478 1 57 LYS QE 1 58 ASN HD22 0.000 . 4.000 3.530 2.893 4.022 0.022 19 0 "[ . 1 . 2 ]" 1 479 1 57 LYS QG 1 58 ASN HD21 0.000 . 5.000 3.530 2.799 5.009 0.009 24 0 "[ . 1 . 2 ]" 1 480 1 57 LYS QG 1 58 ASN HD22 0.000 . 5.000 4.326 3.519 5.007 0.007 16 0 "[ . 1 . 2 ]" 1 481 1 57 LYS QG 1 58 ASN H 0.000 . 4.000 4.015 3.894 4.082 0.082 23 0 "[ . 1 . 2 ]" 1 482 1 57 LYS HA 1 59 LYS H 0.000 . 4.000 4.024 4.001 4.056 0.056 9 0 "[ . 1 . 2 ]" 1 483 1 57 LYS H 1 60 GLN H 0.000 . 5.000 5.064 5.000 5.095 0.095 2 0 "[ . 1 . 2 ]" 1 484 1 57 LYS H 1 61 LYS QB 0.000 . 4.000 2.727 2.468 2.897 . 0 0 "[ . 1 . 2 ]" 1 485 1 57 LYS H 1 61 LYS H 0.000 . 4.000 3.680 3.489 4.007 0.007 19 0 "[ . 1 . 2 ]" 1 486 1 57 LYS H 1 62 VAL HA 0.000 . 5.000 3.654 3.492 3.829 . 0 0 "[ . 1 . 2 ]" 1 487 1 57 LYS QB 1 63 ILE H 0.000 . 5.000 4.550 4.126 5.007 0.007 16 0 "[ . 1 . 2 ]" 1 488 1 57 LYS H 1 63 ILE MD 0.000 . 5.000 4.468 4.325 4.696 . 0 0 "[ . 1 . 2 ]" 1 489 1 57 LYS H 1 63 ILE MG 0.000 . 4.000 3.488 3.170 3.864 . 0 0 "[ . 1 . 2 ]" 1 490 1 58 ASN HA 1 58 ASN HD22 0.000 . 5.000 3.695 3.263 4.463 . 0 0 "[ . 1 . 2 ]" 1 491 1 58 ASN H 1 58 ASN HA 0.000 . 2.500 2.610 2.551 2.671 0.171 3 0 "[ . 1 . 2 ]" 1 492 1 58 ASN QB 1 58 ASN HD21 0.000 . 3.000 2.523 2.093 2.801 . 0 0 "[ . 1 . 2 ]" 1 493 1 58 ASN HA 1 59 LYS H 0.000 . 3.000 2.986 2.956 3.012 0.012 13 0 "[ . 1 . 2 ]" 1 494 1 58 ASN QB 1 59 LYS H 0.000 . 4.000 3.742 3.717 3.763 . 0 0 "[ . 1 . 2 ]" 1 495 1 58 ASN H 1 59 LYS H 0.000 . 3.000 1.625 1.610 1.652 . 0 0 "[ . 1 . 2 ]" 1 496 1 58 ASN HA 1 60 GLN H 0.000 . 5.000 4.326 4.296 4.355 . 0 0 "[ . 1 . 2 ]" 1 497 1 58 ASN QB 1 60 GLN H 0.000 . 5.000 3.108 3.062 3.192 . 0 0 "[ . 1 . 2 ]" 1 498 1 58 ASN QB 1 61 LYS H 0.000 . 5.000 2.922 2.750 3.098 . 0 0 "[ . 1 . 2 ]" 1 499 1 58 ASN H 1 61 LYS QD 0.000 . 5.000 4.922 4.692 5.026 0.026 5 0 "[ . 1 . 2 ]" 1 500 1 59 LYS H 1 59 LYS HA 0.000 . 2.500 2.288 2.282 2.292 . 0 0 "[ . 1 . 2 ]" 1 501 1 59 LYS H 1 59 LYS QD 0.000 . 5.000 4.773 4.612 4.933 . 0 0 "[ . 1 . 2 ]" 1 502 1 59 LYS H 1 59 LYS QG 0.000 . 3.000 2.881 2.767 2.939 . 0 0 "[ . 1 . 2 ]" 1 503 1 59 LYS HA 1 60 GLN H 0.000 . 4.000 3.509 3.479 3.522 . 0 0 "[ . 1 . 2 ]" 1 504 1 59 LYS QG 1 60 GLN H 0.000 . 5.000 3.894 3.856 3.941 . 0 0 "[ . 1 . 2 ]" 1 505 1 59 LYS H 1 60 GLN H 0.000 . 3.000 3.036 2.951 3.075 0.075 9 0 "[ . 1 . 2 ]" 1 506 1 59 LYS QG 1 61 LYS H 0.000 . 5.000 5.043 5.021 5.100 0.100 24 0 "[ . 1 . 2 ]" 1 507 1 59 LYS H 1 61 LYS H 0.000 . 5.000 3.480 3.392 3.658 . 0 0 "[ . 1 . 2 ]" 1 508 1 60 GLN H 1 60 GLN HA 0.000 . 3.000 2.906 2.896 2.916 . 0 0 "[ . 1 . 2 ]" 1 509 1 60 GLN H 1 60 GLN QB 0.000 . 2.500 2.681 2.653 2.702 0.202 12 0 "[ . 1 . 2 ]" 1 510 1 60 GLN H 1 60 GLN QG 0.000 . 3.000 3.074 3.058 3.091 0.091 14 0 "[ . 1 . 2 ]" 1 511 1 60 GLN HA 1 61 LYS H 0.000 . 4.000 3.255 3.154 3.380 . 0 0 "[ . 1 . 2 ]" 1 512 1 60 GLN QB 1 61 LYS H 0.000 . 4.000 3.518 3.128 3.756 . 0 0 "[ . 1 . 2 ]" 1 513 1 60 GLN H 1 61 LYS HA 0.000 . 4.000 4.245 4.209 4.275 0.275 4 0 "[ . 1 . 2 ]" 1 514 1 60 GLN H 1 61 LYS QB 0.000 . 4.000 3.405 3.293 3.451 . 0 0 "[ . 1 . 2 ]" 1 515 1 60 GLN H 1 61 LYS H 0.000 . 2.500 1.699 1.597 1.780 . 0 0 "[ . 1 . 2 ]" 1 516 1 61 LYS H 1 61 LYS HA 0.000 . 3.000 2.875 2.826 2.900 . 0 0 "[ . 1 . 2 ]" 1 517 1 61 LYS H 1 61 LYS QB 0.000 . 2.500 2.303 2.153 2.357 . 0 0 "[ . 1 . 2 ]" 1 518 1 61 LYS H 1 61 LYS QG 0.000 . 5.000 3.990 3.701 4.058 . 0 0 "[ . 1 . 2 ]" 1 519 1 61 LYS HA 1 62 VAL H 0.000 . 2.500 2.291 2.262 2.329 . 0 0 "[ . 1 . 2 ]" 1 520 1 61 LYS QB 1 62 VAL H 0.000 . 4.000 4.017 3.898 4.035 0.035 6 0 "[ . 1 . 2 ]" 1 521 1 61 LYS QG 1 62 VAL H 0.000 . 4.000 3.703 3.604 4.007 0.007 24 0 "[ . 1 . 2 ]" 1 522 1 61 LYS H 1 62 VAL H 0.000 . 4.000 4.005 3.960 4.024 0.024 18 0 "[ . 1 . 2 ]" 1 523 1 62 VAL H 1 62 VAL HB 0.000 . 2.500 2.501 2.435 2.544 0.044 3 0 "[ . 1 . 2 ]" 1 524 1 62 VAL H 1 62 VAL MG1 0.000 . 4.000 3.771 3.757 3.777 . 0 0 "[ . 1 . 2 ]" 1 525 1 62 VAL H 1 62 VAL MG2 0.000 . 3.000 2.167 2.045 2.320 . 0 0 "[ . 1 . 2 ]" 1 526 1 62 VAL HA 1 63 ILE H 0.000 . 2.500 2.187 2.137 2.241 . 0 0 "[ . 1 . 2 ]" 1 527 1 62 VAL HB 1 63 ILE H 0.000 . 5.000 4.162 4.002 4.309 . 0 0 "[ . 1 . 2 ]" 1 528 1 62 VAL MG2 1 63 ILE H 0.000 . 4.000 3.853 3.732 4.011 0.011 24 0 "[ . 1 . 2 ]" 1 529 1 62 VAL HA 1 64 GLY H 0.000 . 4.000 3.932 3.756 4.017 0.017 15 0 "[ . 1 . 2 ]" 1 530 1 62 VAL MG2 1 64 GLY H 0.000 . 5.000 5.042 5.008 5.071 0.071 20 0 "[ . 1 . 2 ]" 1 531 1 63 ILE H 1 63 ILE HB 0.000 . 4.000 3.035 2.794 3.213 . 0 0 "[ . 1 . 2 ]" 1 532 1 63 ILE H 1 63 ILE MG 0.000 . 2.500 2.382 2.139 2.527 0.027 12 0 "[ . 1 . 2 ]" 1 533 1 63 ILE HA 1 64 GLY H 0.000 . 4.000 3.506 3.466 3.524 . 0 0 "[ . 1 . 2 ]" 1 534 1 63 ILE HB 1 64 GLY H 0.000 . 5.000 3.705 3.585 3.874 . 0 0 "[ . 1 . 2 ]" 1 535 1 63 ILE MG 1 64 GLY H 0.000 . 2.500 1.918 1.853 2.248 . 0 0 "[ . 1 . 2 ]" 1 536 1 63 ILE H 1 64 GLY H 0.000 . 2.500 1.911 1.770 1.983 . 0 0 "[ . 1 . 2 ]" 1 537 1 63 ILE HA 1 85 THR H 0.000 . 5.000 3.408 3.154 4.969 . 0 0 "[ . 1 . 2 ]" 1 538 1 63 ILE MG 1 85 THR H 0.000 . 5.000 4.043 3.498 5.018 0.018 10 0 "[ . 1 . 2 ]" 1 539 1 63 ILE MG 1 94 GLY H 0.000 . 5.000 5.063 5.037 5.102 0.102 17 0 "[ . 1 . 2 ]" 1 540 1 64 GLY QA 1 65 GLY H 0.000 . 2.500 2.283 2.211 2.324 . 0 0 "[ . 1 . 2 ]" 1 541 1 64 GLY H 1 65 GLY H 0.000 . 5.000 4.293 4.116 4.398 . 0 0 "[ . 1 . 2 ]" 1 542 1 64 GLY H 1 84 VAL HA 0.000 . 5.000 3.979 3.757 4.149 . 0 0 "[ . 1 . 2 ]" 1 543 1 64 GLY H 1 84 VAL MG2 0.000 . 4.000 4.079 4.042 4.164 0.164 10 0 "[ . 1 . 2 ]" 1 544 1 64 GLY QA 1 85 THR H 0.000 . 4.000 3.426 2.909 3.634 . 0 0 "[ . 1 . 2 ]" 1 545 1 65 GLY QA 1 66 ILE H 0.000 . 2.500 2.144 2.125 2.169 . 0 0 "[ . 1 . 2 ]" 1 546 1 65 GLY H 1 66 ILE H 0.000 . 4.000 4.127 4.087 4.175 0.175 19 0 "[ . 1 . 2 ]" 1 547 1 65 GLY H 1 83 ALA MB 0.000 . 5.000 4.690 4.258 5.023 0.023 1 0 "[ . 1 . 2 ]" 1 548 1 65 GLY H 1 83 ALA H 0.000 . 3.000 2.585 2.328 2.811 . 0 0 "[ . 1 . 2 ]" 1 549 1 65 GLY H 1 84 VAL HA 0.000 . 4.000 4.076 3.961 4.129 0.129 10 0 "[ . 1 . 2 ]" 1 550 1 65 GLY H 1 84 VAL MG2 0.000 . 5.000 3.544 3.260 3.776 . 0 0 "[ . 1 . 2 ]" 1 551 1 65 GLY H 1 97 LEU MD2 0.000 . 3.000 2.848 1.953 3.070 0.070 5 0 "[ . 1 . 2 ]" 1 552 1 66 ILE H 1 66 ILE HB 0.000 . 4.000 2.865 2.678 3.083 . 0 0 "[ . 1 . 2 ]" 1 553 1 66 ILE H 1 66 ILE QG 0.000 . 4.000 4.085 4.027 4.165 0.165 22 0 "[ . 1 . 2 ]" 1 554 1 66 ILE H 1 66 ILE MG 0.000 . 2.500 2.273 2.079 2.499 . 0 0 "[ . 1 . 2 ]" 1 555 1 66 ILE HA 1 67 CYS H 0.000 . 2.500 2.281 2.169 2.433 . 0 0 "[ . 1 . 2 ]" 1 556 1 66 ILE HB 1 67 CYS H 0.000 . 4.000 4.016 3.893 4.127 0.127 22 0 "[ . 1 . 2 ]" 1 557 1 66 ILE QG 1 67 CYS H 0.000 . 4.000 2.166 1.888 2.757 . 0 0 "[ . 1 . 2 ]" 1 558 1 66 ILE MG 1 67 CYS H 0.000 . 4.000 3.429 3.067 3.719 . 0 0 "[ . 1 . 2 ]" 1 559 1 66 ILE QG 1 81 PHE H 0.000 . 5.000 3.153 2.743 3.739 . 0 0 "[ . 1 . 2 ]" 1 560 1 66 ILE HA 1 83 ALA H 0.000 . 4.000 4.000 3.796 4.096 0.096 18 0 "[ . 1 . 2 ]" 1 561 1 66 ILE H 1 97 LEU MD1 0.000 . 4.000 2.527 1.868 3.041 . 0 0 "[ . 1 . 2 ]" 1 562 1 67 CYS HA 1 68 PHE H 0.000 . 2.500 2.282 2.164 2.369 . 0 0 "[ . 1 . 2 ]" 1 563 1 67 CYS QB 1 68 PHE H 0.000 . 5.000 2.996 2.584 3.587 . 0 0 "[ . 1 . 2 ]" 1 564 1 67 CYS H 1 80 ALA MB 0.000 . 5.000 3.163 2.482 3.507 . 0 0 "[ . 1 . 2 ]" 1 565 1 67 CYS QB 1 81 PHE H 0.000 . 4.000 3.784 3.020 4.086 0.086 13 0 "[ . 1 . 2 ]" 1 566 1 67 CYS H 1 81 PHE H 0.000 . 4.000 2.891 2.641 3.175 . 0 0 "[ . 1 . 2 ]" 1 567 1 67 CYS H 1 82 LEU HA 0.000 . 4.000 3.898 3.659 4.036 0.036 15 0 "[ . 1 . 2 ]" 1 568 1 68 PHE HA 1 69 ARG H 0.000 . 3.000 2.654 2.536 2.952 . 0 0 "[ . 1 . 2 ]" 1 569 1 68 PHE QB 1 69 ARG H 0.000 . 3.000 1.975 1.829 2.225 . 0 0 "[ . 1 . 2 ]" 1 570 1 68 PHE HA 1 80 ALA H 0.000 . 4.000 2.665 1.955 4.140 0.140 15 0 "[ . 1 . 2 ]" 1 571 1 69 ARG HA 1 70 GLN H 0.000 . 3.000 2.373 2.148 2.943 . 0 0 "[ . 1 . 2 ]" 1 572 1 69 ARG H 1 70 GLN H 0.000 . 5.000 3.934 3.492 4.328 . 0 0 "[ . 1 . 2 ]" 1 573 1 69 ARG H 1 77 ALA MB 0.000 . 5.000 4.119 3.310 5.038 0.038 15 0 "[ . 1 . 2 ]" 1 574 1 69 ARG H 1 78 GLU QG 0.000 . 5.000 3.453 2.771 5.016 0.016 1 0 "[ . 1 . 2 ]" 1 575 1 69 ARG H 1 78 GLU H 0.000 . 4.000 3.592 2.822 4.107 0.107 15 0 "[ . 1 . 2 ]" 1 576 1 69 ARG H 1 79 VAL HA 0.000 . 5.000 3.543 3.193 4.411 . 0 0 "[ . 1 . 2 ]" 1 577 1 69 ARG H 1 80 ALA H 0.000 . 5.000 4.399 4.073 4.857 . 0 0 "[ . 1 . 2 ]" 1 578 1 70 GLN QB 1 70 GLN HE21 0.000 . 4.000 2.596 1.704 3.631 . 0 0 "[ . 1 . 2 ]" 1 579 1 70 GLN QB 1 70 GLN HE22 0.000 . 4.000 3.677 3.225 4.205 0.205 1 0 "[ . 1 . 2 ]" 1 580 1 70 GLN H 1 70 GLN QB 0.000 . 3.000 2.718 2.288 2.968 . 0 0 "[ . 1 . 2 ]" 1 581 1 70 GLN H 1 70 GLN QG 0.000 . 4.000 2.400 1.821 3.207 . 0 0 "[ . 1 . 2 ]" 1 582 1 70 GLN HA 1 71 TYR H 0.000 . 2.500 2.243 2.125 2.390 . 0 0 "[ . 1 . 2 ]" 1 583 1 70 GLN HA 1 78 GLU H 0.000 . 4.000 2.942 2.497 3.951 . 0 0 "[ . 1 . 2 ]" 1 584 1 70 GLN H 1 110 ILE HB 0.000 . 5.000 5.128 5.046 5.253 0.253 10 0 "[ . 1 . 2 ]" 1 585 1 70 GLN H 1 110 ILE QG 0.000 . 4.000 4.199 4.024 4.302 0.302 6 0 "[ . 1 . 2 ]" 1 586 1 71 TYR H 1 71 TYR QD 0.000 . 3.000 2.480 1.981 3.019 0.019 11 0 "[ . 1 . 2 ]" 1 587 1 71 TYR H 1 71 TYR QE 0.000 . 5.000 4.650 4.230 4.928 . 0 0 "[ . 1 . 2 ]" 1 588 1 71 TYR HA 1 72 LYS H 0.000 . 2.500 2.168 2.128 2.195 . 0 0 "[ . 1 . 2 ]" 1 589 1 71 TYR QB 1 72 LYS H 0.000 . 5.000 3.108 2.967 3.610 . 0 0 "[ . 1 . 2 ]" 1 590 1 71 TYR QB 1 74 GLN H 0.000 . 5.000 2.797 2.561 4.053 . 0 0 "[ . 1 . 2 ]" 1 591 1 71 TYR QB 1 76 PHE H 0.000 . 5.000 2.643 2.373 3.067 . 0 0 "[ . 1 . 2 ]" 1 592 1 71 TYR H 1 76 PHE H 0.000 . 4.000 3.660 3.368 3.968 . 0 0 "[ . 1 . 2 ]" 1 593 1 71 TYR H 1 77 ALA HA 0.000 . 4.000 2.258 1.918 2.819 . 0 0 "[ . 1 . 2 ]" 1 594 1 71 TYR H 1 77 ALA MB 0.000 . 4.000 3.023 2.858 3.260 . 0 0 "[ . 1 . 2 ]" 1 595 1 71 TYR QD 1 78 GLU H 0.000 . 4.000 3.714 3.244 4.020 0.020 1 0 "[ . 1 . 2 ]" 1 596 1 71 TYR QE 1 78 GLU H 0.000 . 4.000 3.852 3.135 4.032 0.032 15 0 "[ . 1 . 2 ]" 1 597 1 71 TYR H 1 78 GLU H 0.000 . 5.000 4.137 3.583 4.648 . 0 0 "[ . 1 . 2 ]" 1 598 1 71 TYR H 1 110 ILE MD 0.000 . 5.000 3.977 3.513 4.405 . 0 0 "[ . 1 . 2 ]" 1 599 1 71 TYR H 1 110 ILE MG 0.000 . 5.000 2.618 2.264 3.180 . 0 0 "[ . 1 . 2 ]" 1 600 1 72 LYS H 1 72 LYS HA 0.000 . 3.000 2.875 2.783 2.912 . 0 0 "[ . 1 . 2 ]" 1 601 1 72 LYS H 1 72 LYS QB 0.000 . 3.000 2.713 2.037 2.856 . 0 0 "[ . 1 . 2 ]" 1 602 1 72 LYS H 1 72 LYS QD 0.000 . 4.000 2.031 1.630 4.061 0.061 6 0 "[ . 1 . 2 ]" 1 603 1 72 LYS H 1 72 LYS QG 0.000 . 3.000 2.492 2.220 3.212 0.212 6 0 "[ . 1 . 2 ]" 1 604 1 72 LYS H 1 73 PRO QD 0.000 . 3.000 1.995 1.827 2.494 . 0 0 "[ . 1 . 2 ]" 1 605 1 72 LYS QB 1 74 GLN H 0.000 . 5.000 4.152 4.116 4.240 . 0 0 "[ . 1 . 2 ]" 1 606 1 72 LYS QD 1 74 GLN H 0.000 . 4.000 4.232 4.191 4.272 0.272 18 0 "[ . 1 . 2 ]" 1 607 1 72 LYS H 1 74 GLN QB 0.000 . 4.000 4.140 4.094 4.243 0.243 17 0 "[ . 1 . 2 ]" 1 608 1 72 LYS H 1 74 GLN H 0.000 . 5.000 3.524 3.230 4.645 . 0 0 "[ . 1 . 2 ]" 1 609 1 72 LYS HA 1 75 ARG H 0.000 . 4.000 3.165 2.857 3.421 . 0 0 "[ . 1 . 2 ]" 1 610 1 73 PRO HA 1 74 GLN H 0.000 . 4.000 3.343 2.718 3.453 . 0 0 "[ . 1 . 2 ]" 1 611 1 73 PRO QB 1 74 GLN H 0.000 . 4.000 3.380 2.916 3.989 . 0 0 "[ . 1 . 2 ]" 1 612 1 73 PRO QD 1 74 GLN H 0.000 . 4.000 2.796 2.556 3.847 . 0 0 "[ . 1 . 2 ]" 1 613 1 73 PRO QG 1 74 GLN H 0.000 . 5.000 3.190 2.683 4.705 . 0 0 "[ . 1 . 2 ]" 1 614 1 74 GLN H 1 74 GLN QB 0.000 . 3.000 2.246 2.119 2.713 . 0 0 "[ . 1 . 2 ]" 1 615 1 74 GLN H 1 74 GLN QG 0.000 . 4.000 3.965 3.696 4.073 0.073 8 0 "[ . 1 . 2 ]" 1 616 1 74 GLN HA 1 75 ARG H 0.000 . 5.000 3.489 3.454 3.540 . 0 0 "[ . 1 . 2 ]" 1 617 1 74 GLN QB 1 75 ARG H 0.000 . 5.000 2.878 2.573 3.037 . 0 0 "[ . 1 . 2 ]" 1 618 1 74 GLN H 1 75 ARG H 0.000 . 3.000 2.213 1.868 2.314 . 0 0 "[ . 1 . 2 ]" 1 619 1 74 GLN QB 1 76 PHE H 0.000 . 5.000 2.282 2.137 2.557 . 0 0 "[ . 1 . 2 ]" 1 620 1 75 ARG H 1 75 ARG HA 0.000 . 2.500 2.278 2.270 2.297 . 0 0 "[ . 1 . 2 ]" 1 621 1 75 ARG H 1 75 ARG QG 0.000 . 3.000 2.645 2.464 2.813 . 0 0 "[ . 1 . 2 ]" 1 622 1 75 ARG HA 1 76 PHE H 0.000 . 3.000 3.038 2.999 3.099 0.099 2 0 "[ . 1 . 2 ]" 1 623 1 75 ARG QB 1 76 PHE H 0.000 . 5.000 3.663 3.586 3.699 . 0 0 "[ . 1 . 2 ]" 1 624 1 75 ARG QG 1 76 PHE H 0.000 . 4.000 4.153 4.125 4.200 0.200 6 0 "[ . 1 . 2 ]" 1 625 1 75 ARG H 1 76 PHE H 0.000 . 3.000 2.509 2.314 2.593 . 0 0 "[ . 1 . 2 ]" 1 626 1 75 ARG H 1 110 ILE MD 0.000 . 4.000 3.222 2.924 3.381 . 0 0 "[ . 1 . 2 ]" 1 627 1 75 ARG H 1 110 ILE MG 0.000 . 4.000 3.973 3.648 4.053 0.053 11 0 "[ . 1 . 2 ]" 1 628 1 75 ARG HA 1 111 GLU H 0.000 . 5.000 4.345 4.066 4.705 . 0 0 "[ . 1 . 2 ]" 1 629 1 75 ARG QB 1 111 GLU H 0.000 . 5.000 4.323 3.983 4.692 . 0 0 "[ . 1 . 2 ]" 1 630 1 76 PHE H 1 76 PHE QD 0.000 . 4.000 3.062 1.936 3.677 . 0 0 "[ . 1 . 2 ]" 1 631 1 76 PHE HA 1 77 ALA H 0.000 . 2.500 2.481 2.365 2.567 0.067 7 0 "[ . 1 . 2 ]" 1 632 1 76 PHE QB 1 77 ALA H 0.000 . 3.000 2.463 2.154 2.902 . 0 0 "[ . 1 . 2 ]" 1 633 1 76 PHE QD 1 77 ALA H 0.000 . 4.000 3.188 2.044 4.021 0.021 16 0 "[ . 1 . 2 ]" 1 634 1 76 PHE H 1 110 ILE MD 0.000 . 4.000 3.667 3.384 3.920 . 0 0 "[ . 1 . 2 ]" 1 635 1 76 PHE H 1 110 ILE MG 0.000 . 4.000 2.886 2.550 3.126 . 0 0 "[ . 1 . 2 ]" 1 636 1 76 PHE HA 1 112 TYR H 0.000 . 3.000 2.886 2.397 3.028 0.028 6 0 "[ . 1 . 2 ]" 1 637 1 76 PHE QB 1 112 TYR H 0.000 . 5.000 4.662 3.945 5.059 0.059 8 0 "[ . 1 . 2 ]" 1 638 1 77 ALA H 1 77 ALA MB 0.000 . 3.000 2.616 2.553 2.663 . 0 0 "[ . 1 . 2 ]" 1 639 1 77 ALA HA 1 78 GLU H 0.000 . 2.500 2.249 2.138 2.372 . 0 0 "[ . 1 . 2 ]" 1 640 1 77 ALA MB 1 78 GLU H 0.000 . 3.000 2.651 2.354 3.051 0.051 11 0 "[ . 1 . 2 ]" 1 641 1 77 ALA H 1 110 ILE MG 0.000 . 3.000 3.084 3.019 3.143 0.143 8 0 "[ . 1 . 2 ]" 1 642 1 77 ALA H 1 112 TYR QB 0.000 . 5.000 3.328 2.765 3.632 . 0 0 "[ . 1 . 2 ]" 1 643 1 77 ALA H 1 112 TYR H 0.000 . 5.000 4.585 4.015 4.920 . 0 0 "[ . 1 . 2 ]" 1 644 1 77 ALA H 1 113 LEU HA 0.000 . 4.000 2.360 2.114 2.826 . 0 0 "[ . 1 . 2 ]" 1 645 1 77 ALA H 1 113 LEU MD2 0.000 . 4.000 3.544 2.964 3.981 . 0 0 "[ . 1 . 2 ]" 1 646 1 77 ALA H 1 114 LEU QB 0.000 . 4.000 4.066 3.971 4.129 0.129 3 0 "[ . 1 . 2 ]" 1 647 1 78 GLU H 1 78 GLU QG 0.000 . 4.000 2.103 1.944 2.579 . 0 0 "[ . 1 . 2 ]" 1 648 1 78 GLU HA 1 79 VAL H 0.000 . 2.500 2.231 2.193 2.267 . 0 0 "[ . 1 . 2 ]" 1 649 1 78 GLU QB 1 79 VAL H 0.000 . 3.000 3.027 2.951 3.075 0.075 4 0 "[ . 1 . 2 ]" 1 650 1 78 GLU HA 1 114 LEU H 0.000 . 4.000 2.877 2.678 3.199 . 0 0 "[ . 1 . 2 ]" 1 651 1 79 VAL H 1 79 VAL HB 0.000 . 3.000 2.761 2.599 2.874 . 0 0 "[ . 1 . 2 ]" 1 652 1 79 VAL H 1 79 VAL MG1 0.000 . 4.000 3.891 3.853 3.928 . 0 0 "[ . 1 . 2 ]" 1 653 1 79 VAL H 1 79 VAL MG2 0.000 . 3.000 2.483 2.318 2.713 . 0 0 "[ . 1 . 2 ]" 1 654 1 79 VAL HA 1 80 ALA H 0.000 . 2.500 2.148 2.108 2.179 . 0 0 "[ . 1 . 2 ]" 1 655 1 79 VAL MG1 1 80 ALA H 0.000 . 4.000 2.374 2.074 2.752 . 0 0 "[ . 1 . 2 ]" 1 656 1 79 VAL MG2 1 80 ALA H 0.000 . 5.000 4.145 3.944 4.258 . 0 0 "[ . 1 . 2 ]" 1 657 1 79 VAL HA 1 81 PHE H 0.000 . 5.000 3.629 3.421 3.858 . 0 0 "[ . 1 . 2 ]" 1 658 1 79 VAL MG1 1 81 PHE H 0.000 . 4.000 1.871 1.746 2.071 . 0 0 "[ . 1 . 2 ]" 1 659 1 79 VAL H 1 114 LEU H 0.000 . 5.000 3.760 3.547 4.006 . 0 0 "[ . 1 . 2 ]" 1 660 1 79 VAL H 1 115 THR HA 0.000 . 4.000 4.108 4.010 4.191 0.191 10 0 "[ . 1 . 2 ]" 1 661 1 79 VAL H 1 115 THR HB 0.000 . 4.000 3.503 2.948 4.050 0.050 7 0 "[ . 1 . 2 ]" 1 662 1 80 ALA H 1 80 ALA MB 0.000 . 3.000 2.098 2.018 2.271 . 0 0 "[ . 1 . 2 ]" 1 663 1 80 ALA HA 1 81 PHE H 0.000 . 4.000 3.439 3.370 3.501 . 0 0 "[ . 1 . 2 ]" 1 664 1 80 ALA MB 1 81 PHE H 0.000 . 3.000 2.834 2.474 3.082 0.082 10 0 "[ . 1 . 2 ]" 1 665 1 80 ALA H 1 81 PHE H 0.000 . 3.000 2.517 2.327 2.731 . 0 0 "[ . 1 . 2 ]" 1 666 1 81 PHE H 1 81 PHE QD 0.000 . 4.000 2.653 2.433 2.968 . 0 0 "[ . 1 . 2 ]" 1 667 1 81 PHE HA 1 82 LEU H 0.000 . 2.500 2.193 2.121 2.249 . 0 0 "[ . 1 . 2 ]" 1 668 1 81 PHE QB 1 82 LEU H 0.000 . 4.000 2.642 2.475 2.839 . 0 0 "[ . 1 . 2 ]" 1 669 1 81 PHE QD 1 82 LEU H 0.000 . 5.000 4.053 3.958 4.157 . 0 0 "[ . 1 . 2 ]" 1 670 1 81 PHE H 1 82 LEU H 0.000 . 5.000 4.091 3.973 4.185 . 0 0 "[ . 1 . 2 ]" 1 671 1 82 LEU H 1 82 LEU QB 0.000 . 3.000 2.453 2.287 2.666 . 0 0 "[ . 1 . 2 ]" 1 672 1 82 LEU H 1 82 LEU MD1 0.000 . 5.000 4.510 4.133 4.691 . 0 0 "[ . 1 . 2 ]" 1 673 1 82 LEU H 1 82 LEU MD2 0.000 . 4.000 3.604 3.089 4.005 0.005 20 0 "[ . 1 . 2 ]" 1 674 1 82 LEU H 1 82 LEU HG 0.000 . 5.000 3.767 2.923 4.238 . 0 0 "[ . 1 . 2 ]" 1 675 1 82 LEU HA 1 83 ALA H 0.000 . 2.500 2.342 2.264 2.499 . 0 0 "[ . 1 . 2 ]" 1 676 1 82 LEU MD1 1 83 ALA H 0.000 . 3.000 2.673 1.876 3.110 0.110 5 0 "[ . 1 . 2 ]" 1 677 1 82 LEU MD2 1 83 ALA H 0.000 . 4.000 4.061 3.824 4.237 0.237 22 0 "[ . 1 . 2 ]" 1 678 1 82 LEU HG 1 83 ALA H 0.000 . 4.000 2.685 2.221 3.555 . 0 0 "[ . 1 . 2 ]" 1 679 1 82 LEU MD2 1 97 LEU H 0.000 . 5.000 4.804 3.911 5.077 0.077 18 0 "[ . 1 . 2 ]" 1 680 1 83 ALA H 1 83 ALA HA 0.000 . 3.000 2.739 2.702 2.799 . 0 0 "[ . 1 . 2 ]" 1 681 1 83 ALA H 1 83 ALA MB 0.000 . 3.000 2.978 2.937 3.016 0.016 2 0 "[ . 1 . 2 ]" 1 682 1 83 ALA HA 1 84 VAL H 0.000 . 2.500 2.336 2.058 2.709 0.209 6 0 "[ . 1 . 2 ]" 1 683 1 83 ALA MB 1 84 VAL H 0.000 . 3.000 2.443 1.831 2.954 . 0 0 "[ . 1 . 2 ]" 1 684 1 84 VAL H 1 84 VAL HB 0.000 . 3.000 2.527 2.326 2.855 . 0 0 "[ . 1 . 2 ]" 1 685 1 84 VAL H 1 84 VAL MG1 0.000 . 4.000 3.765 3.683 3.894 . 0 0 "[ . 1 . 2 ]" 1 686 1 84 VAL H 1 84 VAL MG2 0.000 . 4.000 2.715 2.328 3.268 . 0 0 "[ . 1 . 2 ]" 1 687 1 84 VAL HA 1 85 THR H 0.000 . 2.500 2.407 2.324 2.609 0.109 10 0 "[ . 1 . 2 ]" 1 688 1 84 VAL HB 1 85 THR H 0.000 . 5.000 3.955 3.659 4.350 . 0 0 "[ . 1 . 2 ]" 1 689 1 84 VAL MG1 1 85 THR H 0.000 . 4.000 2.107 1.815 3.915 . 0 0 "[ . 1 . 2 ]" 1 690 1 84 VAL MG2 1 85 THR H 0.000 . 4.000 3.934 3.770 4.222 0.222 10 0 "[ . 1 . 2 ]" 1 691 1 84 VAL MG1 1 88 GLU H 0.000 . 4.000 3.804 3.679 4.079 0.079 10 0 "[ . 1 . 2 ]" 1 692 1 84 VAL HB 1 89 GLN HE21 0.000 . 5.000 3.435 2.785 3.593 . 0 0 "[ . 1 . 2 ]" 1 693 1 84 VAL HB 1 89 GLN HE22 0.000 . 5.000 4.894 3.989 5.055 0.055 14 0 "[ . 1 . 2 ]" 1 694 1 84 VAL MG1 1 89 GLN H 0.000 . 4.000 2.784 2.445 3.125 . 0 0 "[ . 1 . 2 ]" 1 695 1 84 VAL H 1 89 GLN HE21 0.000 . 5.000 4.002 3.504 4.359 . 0 0 "[ . 1 . 2 ]" 1 696 1 84 VAL MG1 1 93 TYR H 0.000 . 5.000 4.953 4.471 5.050 0.050 5 0 "[ . 1 . 2 ]" 1 697 1 84 VAL MG2 1 93 TYR H 0.000 . 5.000 3.823 3.496 4.545 . 0 0 "[ . 1 . 2 ]" 1 698 1 84 VAL MG2 1 94 GLY H 0.000 . 4.000 2.470 2.096 3.498 . 0 0 "[ . 1 . 2 ]" 1 699 1 85 THR H 1 85 THR HA 0.000 . 3.000 2.774 2.305 2.884 . 0 0 "[ . 1 . 2 ]" 1 700 1 85 THR H 1 85 THR HB 0.000 . 3.000 2.355 2.222 2.850 . 0 0 "[ . 1 . 2 ]" 1 701 1 85 THR HA 1 86 ALA H 0.000 . 2.500 2.362 2.230 2.800 0.300 8 0 "[ . 1 . 2 ]" 1 702 1 85 THR HB 1 86 ALA H 0.000 . 4.000 3.918 3.520 4.036 0.036 24 0 "[ . 1 . 2 ]" 1 703 1 85 THR MG 1 86 ALA H 0.000 . 4.000 2.908 2.051 3.117 . 0 0 "[ . 1 . 2 ]" 1 704 1 85 THR MG 1 87 ASN H 0.000 . 4.000 4.064 4.031 4.189 0.189 10 0 "[ . 1 . 2 ]" 1 705 1 85 THR MG 1 88 GLU H 0.000 . 3.000 2.926 2.446 3.049 0.049 22 0 "[ . 1 . 2 ]" 1 706 1 85 THR MG 1 89 GLN H 0.000 . 5.000 3.990 3.592 4.087 . 0 0 "[ . 1 . 2 ]" 1 707 1 86 ALA H 1 86 ALA HA 0.000 . 3.000 2.608 2.557 2.804 . 0 0 "[ . 1 . 2 ]" 1 708 1 86 ALA H 1 86 ALA MB 0.000 . 2.500 2.217 2.185 2.249 . 0 0 "[ . 1 . 2 ]" 1 709 1 86 ALA HA 1 87 ASN H 0.000 . 5.000 3.305 3.066 3.357 . 0 0 "[ . 1 . 2 ]" 1 710 1 86 ALA MB 1 87 ASN H 0.000 . 3.000 1.798 1.767 1.826 . 0 0 "[ . 1 . 2 ]" 1 711 1 86 ALA H 1 87 ASN H 0.000 . 4.000 4.127 4.085 4.170 0.170 20 0 "[ . 1 . 2 ]" 1 712 1 86 ALA HA 1 88 GLU H 0.000 . 5.000 3.830 3.788 4.035 . 0 0 "[ . 1 . 2 ]" 1 713 1 86 ALA HA 1 89 GLN HE21 0.000 . 4.000 3.138 2.792 3.756 . 0 0 "[ . 1 . 2 ]" 1 714 1 86 ALA HA 1 89 GLN HE22 0.000 . 4.000 1.918 1.607 2.894 . 0 0 "[ . 1 . 2 ]" 1 715 1 86 ALA HA 1 89 GLN H 0.000 . 4.000 4.423 4.390 4.478 0.478 22 0 "[ . 1 . 2 ]" 1 716 1 86 ALA MB 1 89 GLN H 0.000 . 5.000 4.920 4.706 5.007 0.007 6 0 "[ . 1 . 2 ]" 1 717 1 87 ASN H 1 87 ASN HA 0.000 . 3.000 2.789 2.692 2.819 . 0 0 "[ . 1 . 2 ]" 1 718 1 87 ASN QB 1 87 ASN HD21 0.000 . 3.000 2.703 2.668 2.772 . 0 0 "[ . 1 . 2 ]" 1 719 1 87 ASN H 1 87 ASN QB 0.000 . 3.000 2.112 2.067 2.178 . 0 0 "[ . 1 . 2 ]" 1 720 1 87 ASN HA 1 88 GLU H 0.000 . 4.000 2.926 2.796 3.357 . 0 0 "[ . 1 . 2 ]" 1 721 1 87 ASN QB 1 88 GLU H 0.000 . 5.000 3.756 3.354 3.859 . 0 0 "[ . 1 . 2 ]" 1 722 1 87 ASN H 1 88 GLU H 0.000 . 4.000 3.165 2.978 3.259 . 0 0 "[ . 1 . 2 ]" 1 723 1 87 ASN HA 1 89 GLN H 0.000 . 4.000 3.601 3.292 3.732 . 0 0 "[ . 1 . 2 ]" 1 724 1 87 ASN H 1 89 GLN H 0.000 . 5.000 4.772 4.432 4.888 . 0 0 "[ . 1 . 2 ]" 1 725 1 88 GLU H 1 88 GLU HA 0.000 . 3.000 2.918 2.795 2.943 . 0 0 "[ . 1 . 2 ]" 1 726 1 88 GLU H 1 88 GLU QB 0.000 . 3.000 2.315 2.156 2.366 . 0 0 "[ . 1 . 2 ]" 1 727 1 88 GLU H 1 88 GLU QG 0.000 . 3.000 3.023 2.493 3.116 0.116 19 0 "[ . 1 . 2 ]" 1 728 1 88 GLU HA 1 89 GLN H 0.000 . 4.000 3.471 3.457 3.489 . 0 0 "[ . 1 . 2 ]" 1 729 1 88 GLU QB 1 89 GLN HE21 0.000 . 5.000 4.392 4.031 4.491 . 0 0 "[ . 1 . 2 ]" 1 730 1 88 GLU QB 1 89 GLN HE22 0.000 . 5.000 5.164 5.096 5.193 0.193 22 0 "[ . 1 . 2 ]" 1 731 1 88 GLU H 1 89 GLN QG 0.000 . 5.000 3.310 3.256 3.422 . 0 0 "[ . 1 . 2 ]" 1 732 1 88 GLU H 1 89 GLN H 0.000 . 2.500 1.988 1.854 2.530 0.030 8 0 "[ . 1 . 2 ]" 1 733 1 89 GLN H 1 89 GLN QB 0.000 . 2.500 2.606 2.569 2.739 0.239 20 0 "[ . 1 . 2 ]" 1 734 1 89 GLN H 1 89 GLN QG 0.000 . 3.000 1.986 1.699 2.064 . 0 0 "[ . 1 . 2 ]" 1 735 1 89 GLN HA 1 90 VAL H 0.000 . 4.000 2.885 2.572 2.978 . 0 0 "[ . 1 . 2 ]" 1 736 1 89 GLN QB 1 90 VAL H 0.000 . 4.000 1.877 1.837 2.023 . 0 0 "[ . 1 . 2 ]" 1 737 1 89 GLN H 1 90 VAL MG2 0.000 . 5.000 3.648 3.495 4.131 . 0 0 "[ . 1 . 2 ]" 1 738 1 89 GLN H 1 90 VAL H 0.000 . 5.000 4.354 4.257 4.597 . 0 0 "[ . 1 . 2 ]" 1 739 1 90 VAL H 1 90 VAL HA 0.000 . 2.500 2.278 2.264 2.289 . 0 0 "[ . 1 . 2 ]" 1 740 1 90 VAL H 1 90 VAL MG2 0.000 . 4.000 2.793 2.752 2.865 . 0 0 "[ . 1 . 2 ]" 1 741 1 90 VAL HA 1 91 ARG H 0.000 . 4.000 2.764 2.243 2.892 . 0 0 "[ . 1 . 2 ]" 1 742 1 90 VAL MG2 1 91 ARG H 0.000 . 5.000 3.896 3.741 4.337 . 0 0 "[ . 1 . 2 ]" 1 743 1 90 VAL H 1 91 ARG H 0.000 . 4.000 2.925 2.814 3.500 . 0 0 "[ . 1 . 2 ]" 1 744 1 90 VAL HA 1 92 GLY H 0.000 . 4.000 3.960 3.445 4.039 0.039 2 0 "[ . 1 . 2 ]" 1 745 1 91 ARG HA 1 92 GLY H 0.000 . 4.000 3.447 2.923 3.538 . 0 0 "[ . 1 . 2 ]" 1 746 1 91 ARG H 1 92 GLY H 0.000 . 3.000 1.901 1.825 2.037 . 0 0 "[ . 1 . 2 ]" 1 747 1 91 ARG QB 1 93 TYR H 0.000 . 5.000 4.238 3.408 4.712 . 0 0 "[ . 1 . 2 ]" 1 748 1 91 ARG H 1 93 TYR H 0.000 . 5.000 3.928 2.901 4.482 . 0 0 "[ . 1 . 2 ]" 1 749 1 92 GLY H 1 92 GLY QA 0.000 . 2.500 2.309 2.194 2.405 . 0 0 "[ . 1 . 2 ]" 1 750 1 92 GLY QA 1 93 TYR H 0.000 . 4.000 2.532 2.335 2.802 . 0 0 "[ . 1 . 2 ]" 1 751 1 92 GLY H 1 93 TYR H 0.000 . 4.000 2.488 1.949 3.127 . 0 0 "[ . 1 . 2 ]" 1 752 1 92 GLY QA 1 94 GLY H 0.000 . 5.000 4.498 4.278 5.081 0.081 3 0 "[ . 1 . 2 ]" 1 753 1 93 TYR H 1 93 TYR QB 0.000 . 3.000 2.704 2.576 2.850 . 0 0 "[ . 1 . 2 ]" 1 754 1 93 TYR H 1 93 TYR QD 0.000 . 4.000 3.629 3.276 3.857 . 0 0 "[ . 1 . 2 ]" 1 755 1 93 TYR HA 1 94 GLY H 0.000 . 5.000 3.504 2.098 3.570 . 0 0 "[ . 1 . 2 ]" 1 756 1 93 TYR QB 1 94 GLY H 0.000 . 4.000 2.228 1.960 3.375 . 0 0 "[ . 1 . 2 ]" 1 757 1 93 TYR H 1 94 GLY H 0.000 . 4.000 2.330 2.076 4.043 0.043 3 0 "[ . 1 . 2 ]" 1 758 1 93 TYR HA 1 96 ARG H 0.000 . 4.000 3.766 3.554 4.105 0.105 3 0 "[ . 1 . 2 ]" 1 759 1 94 GLY H 1 94 GLY QA 0.000 . 2.500 2.197 2.185 2.416 . 0 0 "[ . 1 . 2 ]" 1 760 1 94 GLY QA 1 95 THR H 0.000 . 5.000 2.690 2.556 2.828 . 0 0 "[ . 1 . 2 ]" 1 761 1 94 GLY H 1 95 THR H 0.000 . 4.000 3.078 2.936 3.278 . 0 0 "[ . 1 . 2 ]" 1 762 1 95 THR H 1 95 THR HA 0.000 . 3.000 2.764 2.727 2.810 . 0 0 "[ . 1 . 2 ]" 1 763 1 95 THR H 1 95 THR HB 0.000 . 3.000 2.715 2.534 3.009 0.009 20 0 "[ . 1 . 2 ]" 1 764 1 95 THR H 1 95 THR MG 0.000 . 4.000 3.721 3.595 3.759 . 0 0 "[ . 1 . 2 ]" 1 765 1 95 THR HA 1 96 ARG H 0.000 . 4.000 3.555 3.497 3.576 . 0 0 "[ . 1 . 2 ]" 1 766 1 95 THR HB 1 96 ARG H 0.000 . 3.000 2.404 2.157 2.840 . 0 0 "[ . 1 . 2 ]" 1 767 1 95 THR MG 1 96 ARG H 0.000 . 4.000 3.515 3.138 3.922 . 0 0 "[ . 1 . 2 ]" 1 768 1 95 THR H 1 96 ARG H 0.000 . 3.000 2.922 2.635 3.015 0.015 13 0 "[ . 1 . 2 ]" 1 769 1 95 THR HA 1 98 MET H 0.000 . 4.000 3.401 3.165 3.777 . 0 0 "[ . 1 . 2 ]" 1 770 1 95 THR HA 1 99 ASN H 0.000 . 4.000 4.085 4.039 4.135 0.135 17 0 "[ . 1 . 2 ]" 1 771 1 95 THR MG 1 99 ASN HD21 0.000 . 4.000 3.092 2.513 3.866 . 0 0 "[ . 1 . 2 ]" 1 772 1 95 THR MG 1 99 ASN HD22 0.000 . 3.000 2.643 2.070 3.031 0.031 10 0 "[ . 1 . 2 ]" 1 773 1 95 THR MG 1 99 ASN H 0.000 . 5.000 4.125 3.885 4.444 . 0 0 "[ . 1 . 2 ]" 1 774 1 95 THR MG 1 128 GLN QE 0.000 . 4.000 2.821 1.799 3.754 . 0 0 "[ . 1 . 2 ]" 1 775 1 96 ARG H 1 96 ARG HA 0.000 . 3.000 2.786 2.752 2.837 . 0 0 "[ . 1 . 2 ]" 1 776 1 96 ARG H 1 96 ARG QB 0.000 . 2.500 2.317 2.171 2.524 0.024 11 0 "[ . 1 . 2 ]" 1 777 1 96 ARG H 1 96 ARG QG 0.000 . 3.000 2.554 1.988 2.911 . 0 0 "[ . 1 . 2 ]" 1 778 1 96 ARG QB 1 97 LEU H 0.000 . 3.000 2.934 2.753 3.016 0.016 19 0 "[ . 1 . 2 ]" 1 779 1 96 ARG H 1 97 LEU H 0.000 . 3.000 2.677 2.537 2.753 . 0 0 "[ . 1 . 2 ]" 1 780 1 96 ARG HA 1 99 ASN HD21 0.000 . 4.000 3.156 2.272 3.841 . 0 0 "[ . 1 . 2 ]" 1 781 1 96 ARG HA 1 99 ASN HD22 0.000 . 5.000 3.990 1.826 4.993 . 0 0 "[ . 1 . 2 ]" 1 782 1 96 ARG HA 1 99 ASN H 0.000 . 4.000 3.980 3.807 4.050 0.050 19 0 "[ . 1 . 2 ]" 1 783 1 97 LEU H 1 97 LEU HA 0.000 . 3.000 2.877 2.850 2.891 . 0 0 "[ . 1 . 2 ]" 1 784 1 97 LEU H 1 97 LEU QB 0.000 . 2.500 2.177 2.038 2.240 . 0 0 "[ . 1 . 2 ]" 1 785 1 97 LEU H 1 97 LEU MD1 0.000 . 5.000 3.992 3.700 4.066 . 0 0 "[ . 1 . 2 ]" 1 786 1 97 LEU H 1 97 LEU MD2 0.000 . 4.000 3.539 2.208 4.026 0.026 16 0 "[ . 1 . 2 ]" 1 787 1 97 LEU H 1 97 LEU HG 0.000 . 5.000 4.596 4.161 4.720 . 0 0 "[ . 1 . 2 ]" 1 788 1 97 LEU HA 1 98 MET H 0.000 . 4.000 3.576 3.564 3.589 . 0 0 "[ . 1 . 2 ]" 1 789 1 97 LEU QB 1 98 MET H 0.000 . 4.000 2.278 1.939 2.517 . 0 0 "[ . 1 . 2 ]" 1 790 1 97 LEU MD1 1 98 MET H 0.000 . 5.000 4.019 3.830 4.442 . 0 0 "[ . 1 . 2 ]" 1 791 1 97 LEU HG 1 98 MET H 0.000 . 5.000 4.442 4.044 4.873 . 0 0 "[ . 1 . 2 ]" 1 792 1 97 LEU H 1 98 MET H 0.000 . 4.000 2.581 2.425 2.806 . 0 0 "[ . 1 . 2 ]" 1 793 1 97 LEU H 1 99 ASN H 0.000 . 4.000 3.994 3.814 4.072 0.072 4 0 "[ . 1 . 2 ]" 1 794 1 97 LEU HA 1 100 LYS H 0.000 . 4.000 3.211 2.977 3.532 . 0 0 "[ . 1 . 2 ]" 1 795 1 98 MET H 1 98 MET HA 0.000 . 3.000 2.731 2.712 2.748 . 0 0 "[ . 1 . 2 ]" 1 796 1 98 MET H 1 98 MET QB 0.000 . 2.500 2.248 2.153 2.279 . 0 0 "[ . 1 . 2 ]" 1 797 1 98 MET H 1 98 MET ME 0.000 . 4.000 3.808 3.393 4.043 0.043 18 0 "[ . 1 . 2 ]" 1 798 1 98 MET H 1 98 MET QG 0.000 . 5.000 4.068 4.029 4.095 . 0 0 "[ . 1 . 2 ]" 1 799 1 98 MET QB 1 99 ASN H 0.000 . 3.000 2.507 2.335 2.675 . 0 0 "[ . 1 . 2 ]" 1 800 1 98 MET ME 1 99 ASN H 0.000 . 5.000 4.962 4.761 5.040 0.040 7 0 "[ . 1 . 2 ]" 1 801 1 98 MET QG 1 99 ASN H 0.000 . 4.000 3.582 3.231 4.022 0.022 20 0 "[ . 1 . 2 ]" 1 802 1 98 MET H 1 99 ASN H 0.000 . 3.000 2.920 2.842 3.004 0.004 22 0 "[ . 1 . 2 ]" 1 803 1 98 MET HA 1 101 PHE H 0.000 . 4.000 3.499 3.366 3.624 . 0 0 "[ . 1 . 2 ]" 1 804 1 98 MET QG 1 128 GLN H 0.000 . 4.000 4.101 4.030 4.155 0.155 11 0 "[ . 1 . 2 ]" 1 805 1 98 MET QG 1 129 GLY H 0.000 . 5.000 5.012 4.820 5.087 0.087 20 0 "[ . 1 . 2 ]" 1 806 1 99 ASN H 1 99 ASN HA 0.000 . 3.000 2.849 2.819 2.875 . 0 0 "[ . 1 . 2 ]" 1 807 1 99 ASN QB 1 99 ASN HD21 0.000 . 3.000 2.155 2.088 2.263 . 0 0 "[ . 1 . 2 ]" 1 808 1 99 ASN H 1 99 ASN QB 0.000 . 2.500 2.448 2.249 2.630 0.130 19 0 "[ . 1 . 2 ]" 1 809 1 99 ASN H 1 99 ASN HD21 0.000 . 5.000 3.383 2.121 4.275 . 0 0 "[ . 1 . 2 ]" 1 810 1 99 ASN H 1 99 ASN HD22 0.000 . 5.000 3.984 3.476 4.542 . 0 0 "[ . 1 . 2 ]" 1 811 1 99 ASN HA 1 100 LYS H 0.000 . 4.000 3.522 3.469 3.569 . 0 0 "[ . 1 . 2 ]" 1 812 1 99 ASN QB 1 100 LYS H 0.000 . 4.000 2.786 2.452 3.611 . 0 0 "[ . 1 . 2 ]" 1 813 1 99 ASN H 1 100 LYS H 0.000 . 3.000 2.557 2.487 2.687 . 0 0 "[ . 1 . 2 ]" 1 814 1 99 ASN HA 1 102 LYS H 0.000 . 3.000 3.128 3.069 3.167 0.167 22 0 "[ . 1 . 2 ]" 1 815 1 100 LYS H 1 100 LYS HA 0.000 . 3.000 2.809 2.790 2.862 . 0 0 "[ . 1 . 2 ]" 1 816 1 100 LYS H 1 100 LYS QB 0.000 . 2.500 2.136 2.046 2.375 . 0 0 "[ . 1 . 2 ]" 1 817 1 100 LYS H 1 100 LYS QG 0.000 . 4.000 3.411 2.386 4.025 0.025 9 0 "[ . 1 . 2 ]" 1 818 1 100 LYS HA 1 101 PHE H 0.000 . 5.000 3.478 3.452 3.500 . 0 0 "[ . 1 . 2 ]" 1 819 1 100 LYS QB 1 101 PHE H 0.000 . 3.000 2.864 2.770 2.944 . 0 0 "[ . 1 . 2 ]" 1 820 1 100 LYS H 1 101 PHE H 0.000 . 3.000 2.586 2.382 2.655 . 0 0 "[ . 1 . 2 ]" 1 821 1 100 LYS HA 1 103 ASP H 0.000 . 4.000 3.597 3.314 3.885 . 0 0 "[ . 1 . 2 ]" 1 822 1 101 PHE H 1 101 PHE QB 0.000 . 2.500 2.200 2.155 2.238 . 0 0 "[ . 1 . 2 ]" 1 823 1 101 PHE H 1 101 PHE QD 0.000 . 4.000 4.064 3.964 4.160 0.160 14 0 "[ . 1 . 2 ]" 1 824 1 101 PHE QB 1 102 LYS H 0.000 . 3.000 2.617 2.470 2.791 . 0 0 "[ . 1 . 2 ]" 1 825 1 101 PHE QD 1 102 LYS H 0.000 . 4.000 2.863 2.527 3.329 . 0 0 "[ . 1 . 2 ]" 1 826 1 101 PHE H 1 102 LYS H 0.000 . 4.000 2.600 2.529 2.686 . 0 0 "[ . 1 . 2 ]" 1 827 1 101 PHE HA 1 104 HIS H 0.000 . 4.000 3.757 3.548 4.022 0.022 20 0 "[ . 1 . 2 ]" 1 828 1 102 LYS H 1 102 LYS QB 0.000 . 3.000 2.513 2.404 2.674 . 0 0 "[ . 1 . 2 ]" 1 829 1 102 LYS H 1 102 LYS QG 0.000 . 3.000 2.222 1.979 2.511 . 0 0 "[ . 1 . 2 ]" 1 830 1 102 LYS HA 1 103 ASP H 0.000 . 5.000 3.562 3.503 3.583 . 0 0 "[ . 1 . 2 ]" 1 831 1 102 LYS QB 1 103 ASP H 0.000 . 4.000 2.400 2.150 3.414 . 0 0 "[ . 1 . 2 ]" 1 832 1 102 LYS QG 1 103 ASP H 0.000 . 4.000 3.801 2.042 4.018 0.018 5 0 "[ . 1 . 2 ]" 1 833 1 102 LYS H 1 103 ASP H 0.000 . 4.000 2.749 2.413 2.955 . 0 0 "[ . 1 . 2 ]" 1 834 1 102 LYS H 1 104 HIS H 0.000 . 5.000 4.060 3.833 4.237 . 0 0 "[ . 1 . 2 ]" 1 835 1 102 LYS HA 1 105 MET H 0.000 . 3.000 3.099 3.060 3.157 0.157 9 0 "[ . 1 . 2 ]" 1 836 1 103 ASP H 1 103 ASP HA 0.000 . 3.000 2.752 2.719 2.792 . 0 0 "[ . 1 . 2 ]" 1 837 1 103 ASP H 1 103 ASP QB 0.000 . 2.500 2.213 2.062 2.524 0.024 13 0 "[ . 1 . 2 ]" 1 838 1 103 ASP HA 1 104 HIS H 0.000 . 5.000 3.514 3.479 3.550 . 0 0 "[ . 1 . 2 ]" 1 839 1 103 ASP QB 1 104 HIS H 0.000 . 4.000 2.640 2.420 2.869 . 0 0 "[ . 1 . 2 ]" 1 840 1 103 ASP H 1 104 HIS H 0.000 . 3.000 2.796 2.674 2.930 . 0 0 "[ . 1 . 2 ]" 1 841 1 103 ASP HA 1 106 GLN H 0.000 . 4.000 3.805 3.690 4.005 0.005 24 0 "[ . 1 . 2 ]" 1 842 1 103 ASP H 1 164 TYR QB 0.000 . 4.000 3.750 3.067 4.011 0.011 22 0 "[ . 1 . 2 ]" 1 843 1 104 HIS H 1 104 HIS HA 0.000 . 3.000 2.861 2.827 2.881 . 0 0 "[ . 1 . 2 ]" 1 844 1 104 HIS H 1 104 HIS QB 0.000 . 2.500 2.250 2.161 2.276 . 0 0 "[ . 1 . 2 ]" 1 845 1 104 HIS HA 1 105 MET H 0.000 . 4.000 3.545 3.499 3.575 . 0 0 "[ . 1 . 2 ]" 1 846 1 104 HIS H 1 105 MET H 0.000 . 4.000 2.514 2.463 2.614 . 0 0 "[ . 1 . 2 ]" 1 847 1 104 HIS HA 1 107 LYS H 0.000 . 4.000 3.009 2.886 3.131 . 0 0 "[ . 1 . 2 ]" 1 848 1 104 HIS HE1 1 108 GLN HE21 0.000 . 4.000 3.713 2.668 4.022 0.022 9 0 "[ . 1 . 2 ]" 1 849 1 104 HIS HE1 1 108 GLN HE22 0.000 . 4.000 3.515 2.469 4.026 0.026 24 0 "[ . 1 . 2 ]" 1 850 1 105 MET H 1 105 MET QB 0.000 . 2.500 2.251 2.040 2.513 0.013 7 0 "[ . 1 . 2 ]" 1 851 1 105 MET H 1 105 MET ME 0.000 . 4.000 3.162 2.149 4.018 0.018 4 0 "[ . 1 . 2 ]" 1 852 1 105 MET HA 1 106 GLN H 0.000 . 5.000 3.461 3.419 3.527 . 0 0 "[ . 1 . 2 ]" 1 853 1 105 MET QB 1 106 GLN H 0.000 . 4.000 2.937 2.695 3.061 . 0 0 "[ . 1 . 2 ]" 1 854 1 105 MET H 1 106 GLN H 0.000 . 4.000 2.710 2.661 2.802 . 0 0 "[ . 1 . 2 ]" 1 855 1 105 MET HA 1 108 GLN H 0.000 . 4.000 3.877 3.640 4.061 0.061 24 0 "[ . 1 . 2 ]" 1 856 1 105 MET HA 1 110 ILE H 0.000 . 5.000 4.144 3.435 4.615 . 0 0 "[ . 1 . 2 ]" 1 857 1 105 MET H 1 158 ILE MD 0.000 . 5.000 4.296 3.950 4.732 . 0 0 "[ . 1 . 2 ]" 1 858 1 106 GLN H 1 106 GLN HA 0.000 . 3.000 2.897 2.865 2.928 . 0 0 "[ . 1 . 2 ]" 1 859 1 106 GLN H 1 106 GLN QB 0.000 . 2.500 2.239 2.117 2.319 . 0 0 "[ . 1 . 2 ]" 1 860 1 106 GLN H 1 106 GLN QG 0.000 . 5.000 3.759 3.044 4.063 . 0 0 "[ . 1 . 2 ]" 1 861 1 106 GLN HA 1 107 LYS H 0.000 . 4.000 3.493 3.455 3.527 . 0 0 "[ . 1 . 2 ]" 1 862 1 106 GLN QB 1 107 LYS H 0.000 . 3.000 2.836 2.662 3.001 0.001 5 0 "[ . 1 . 2 ]" 1 863 1 106 GLN H 1 107 LYS H 0.000 . 4.000 2.294 2.128 2.438 . 0 0 "[ . 1 . 2 ]" 1 864 1 106 GLN HA 1 108 GLN H 0.000 . 5.000 3.878 3.537 4.413 . 0 0 "[ . 1 . 2 ]" 1 865 1 106 GLN HA 1 109 ASN H 0.000 . 5.000 3.165 3.007 3.410 . 0 0 "[ . 1 . 2 ]" 1 866 1 106 GLN HA 1 110 ILE H 0.000 . 4.000 4.024 3.902 4.066 0.066 20 0 "[ . 1 . 2 ]" 1 867 1 106 GLN H 1 158 ILE MD 0.000 . 5.000 4.419 3.734 4.930 . 0 0 "[ . 1 . 2 ]" 1 868 1 106 GLN H 1 158 ILE MG 0.000 . 4.000 3.470 3.225 3.887 . 0 0 "[ . 1 . 2 ]" 1 869 1 106 GLN HE21 1 160 PRO HA 0.000 . 5.000 2.996 1.995 5.022 0.022 7 0 "[ . 1 . 2 ]" 1 870 1 106 GLN HE21 1 162 VAL H 0.000 . 4.000 3.639 2.004 4.011 0.011 14 0 "[ . 1 . 2 ]" 1 871 1 106 GLN HE22 1 162 VAL H 0.000 . 4.000 3.304 2.204 4.009 0.009 5 0 "[ . 1 . 2 ]" 1 872 1 106 GLN HE21 1 164 TYR QE 0.000 . 4.000 3.065 2.049 3.889 . 0 0 "[ . 1 . 2 ]" 1 873 1 106 GLN HE22 1 164 TYR QE 0.000 . 5.000 3.779 2.882 4.893 . 0 0 "[ . 1 . 2 ]" 1 874 1 107 LYS H 1 107 LYS HA 0.000 . 3.000 2.828 2.765 2.873 . 0 0 "[ . 1 . 2 ]" 1 875 1 107 LYS H 1 107 LYS QB 0.000 . 2.500 2.509 2.370 2.571 0.071 4 0 "[ . 1 . 2 ]" 1 876 1 107 LYS H 1 107 LYS QG 0.000 . 2.500 2.232 2.021 2.401 . 0 0 "[ . 1 . 2 ]" 1 877 1 107 LYS HA 1 108 GLN H 0.000 . 4.000 3.416 3.301 3.562 . 0 0 "[ . 1 . 2 ]" 1 878 1 107 LYS QB 1 108 GLN HE21 0.000 . 4.000 2.399 1.788 2.876 . 0 0 "[ . 1 . 2 ]" 1 879 1 107 LYS QB 1 108 GLN HE22 0.000 . 4.000 3.442 2.171 4.077 0.077 23 0 "[ . 1 . 2 ]" 1 880 1 107 LYS QB 1 108 GLN H 0.000 . 4.000 2.970 2.427 3.341 . 0 0 "[ . 1 . 2 ]" 1 881 1 107 LYS QG 1 108 GLN H 0.000 . 4.000 4.085 4.014 4.129 0.129 22 0 "[ . 1 . 2 ]" 1 882 1 107 LYS H 1 108 GLN H 0.000 . 3.000 2.661 2.540 2.875 . 0 0 "[ . 1 . 2 ]" 1 883 1 107 LYS HA 1 109 ASN H 0.000 . 4.000 4.036 3.950 4.120 0.120 5 0 "[ . 1 . 2 ]" 1 884 1 108 GLN HA 1 108 GLN HE21 0.000 . 5.000 3.450 2.949 4.082 . 0 0 "[ . 1 . 2 ]" 1 885 1 108 GLN HA 1 108 GLN HE22 0.000 . 5.000 4.323 3.576 5.338 0.338 9 0 "[ . 1 . 2 ]" 1 886 1 108 GLN H 1 108 GLN HA 0.000 . 3.000 2.910 2.875 2.934 . 0 0 "[ . 1 . 2 ]" 1 887 1 108 GLN H 1 108 GLN QB 0.000 . 2.500 2.517 2.439 2.555 0.055 20 0 "[ . 1 . 2 ]" 1 888 1 108 GLN HE21 1 108 GLN QG 0.000 . 3.000 2.088 2.045 2.385 . 0 0 "[ . 1 . 2 ]" 1 889 1 108 GLN H 1 108 GLN QG 0.000 . 2.500 2.608 2.404 2.815 0.315 6 0 "[ . 1 . 2 ]" 1 890 1 108 GLN HA 1 109 ASN H 0.000 . 4.000 3.359 3.315 3.381 . 0 0 "[ . 1 . 2 ]" 1 891 1 108 GLN QB 1 109 ASN H 0.000 . 4.000 3.049 2.891 3.223 . 0 0 "[ . 1 . 2 ]" 1 892 1 108 GLN H 1 109 ASN HA 0.000 . 4.000 4.242 4.159 4.378 0.378 12 0 "[ . 1 . 2 ]" 1 893 1 108 GLN H 1 109 ASN H 0.000 . 3.000 2.039 1.941 2.197 . 0 0 "[ . 1 . 2 ]" 1 894 1 108 GLN H 1 110 ILE H 0.000 . 4.000 3.644 3.352 3.988 . 0 0 "[ . 1 . 2 ]" 1 895 1 109 ASN HA 1 109 ASN HD22 0.000 . 5.000 4.198 3.372 5.029 0.029 6 0 "[ . 1 . 2 ]" 1 896 1 109 ASN H 1 109 ASN HA 0.000 . 2.500 2.230 2.211 2.244 . 0 0 "[ . 1 . 2 ]" 1 897 1 109 ASN H 1 109 ASN QB 0.000 . 3.000 3.036 2.989 3.054 0.054 6 0 "[ . 1 . 2 ]" 1 898 1 109 ASN HA 1 110 ILE H 0.000 . 3.000 2.998 2.794 3.092 0.092 23 0 "[ . 1 . 2 ]" 1 899 1 109 ASN H 1 110 ILE H 0.000 . 2.500 2.527 2.462 2.615 0.115 5 0 "[ . 1 . 2 ]" 1 900 1 110 ILE H 1 110 ILE HB 0.000 . 2.500 2.598 2.524 2.657 0.157 22 0 "[ . 1 . 2 ]" 1 901 1 110 ILE H 1 110 ILE MD 0.000 . 4.000 3.105 2.850 3.364 . 0 0 "[ . 1 . 2 ]" 1 902 1 110 ILE H 1 110 ILE QG 0.000 . 3.000 2.563 2.346 2.837 . 0 0 "[ . 1 . 2 ]" 1 903 1 110 ILE H 1 110 ILE MG 0.000 . 4.000 3.833 3.805 3.865 . 0 0 "[ . 1 . 2 ]" 1 904 1 110 ILE HA 1 111 GLU H 0.000 . 3.000 2.148 2.106 2.220 . 0 0 "[ . 1 . 2 ]" 1 905 1 110 ILE HB 1 111 GLU H 0.000 . 5.000 4.285 4.060 4.426 . 0 0 "[ . 1 . 2 ]" 1 906 1 110 ILE MG 1 111 GLU H 0.000 . 3.000 2.832 2.201 3.027 0.027 16 0 "[ . 1 . 2 ]" 1 907 1 110 ILE HA 1 112 TYR H 0.000 . 4.000 3.868 3.617 4.042 0.042 22 0 "[ . 1 . 2 ]" 1 908 1 110 ILE MG 1 112 TYR H 0.000 . 3.000 2.585 1.949 3.012 0.012 13 0 "[ . 1 . 2 ]" 1 909 1 111 GLU H 1 111 GLU QB 0.000 . 3.000 2.643 2.324 3.014 0.014 23 0 "[ . 1 . 2 ]" 1 910 1 111 GLU H 1 111 GLU QG 0.000 . 3.000 2.295 1.958 3.003 0.003 22 0 "[ . 1 . 2 ]" 1 911 1 111 GLU HA 1 112 TYR H 0.000 . 4.000 3.510 3.278 3.581 . 0 0 "[ . 1 . 2 ]" 1 912 1 111 GLU QB 1 112 TYR H 0.000 . 4.000 3.097 2.466 3.964 . 0 0 "[ . 1 . 2 ]" 1 913 1 111 GLU QG 1 112 TYR H 0.000 . 5.000 3.418 1.918 4.389 . 0 0 "[ . 1 . 2 ]" 1 914 1 111 GLU H 1 112 TYR H 0.000 . 3.000 2.498 2.087 2.935 . 0 0 "[ . 1 . 2 ]" 1 915 1 111 GLU HA 1 158 ILE H 0.000 . 4.000 2.503 2.172 3.051 . 0 0 "[ . 1 . 2 ]" 1 916 1 112 TYR H 1 112 TYR QB 0.000 . 3.000 2.280 2.074 2.524 . 0 0 "[ . 1 . 2 ]" 1 917 1 112 TYR H 1 112 TYR QD 0.000 . 4.000 3.028 1.979 3.790 . 0 0 "[ . 1 . 2 ]" 1 918 1 112 TYR HA 1 113 LEU H 0.000 . 2.500 2.222 2.151 2.399 . 0 0 "[ . 1 . 2 ]" 1 919 1 112 TYR QB 1 113 LEU H 0.000 . 4.000 3.285 2.638 3.880 . 0 0 "[ . 1 . 2 ]" 1 920 1 112 TYR QD 1 113 LEU H 0.000 . 5.000 3.696 2.245 4.937 . 0 0 "[ . 1 . 2 ]" 1 921 1 112 TYR HA 1 158 ILE H 0.000 . 4.000 4.065 4.020 4.130 0.130 17 0 "[ . 1 . 2 ]" 1 922 1 113 LEU H 1 113 LEU MD1 0.000 . 5.000 3.926 3.491 4.168 . 0 0 "[ . 1 . 2 ]" 1 923 1 113 LEU H 1 113 LEU MD2 0.000 . 4.000 3.268 2.269 4.014 0.014 5 0 "[ . 1 . 2 ]" 1 924 1 113 LEU H 1 113 LEU HG 0.000 . 4.000 3.070 2.006 4.170 0.170 12 0 "[ . 1 . 2 ]" 1 925 1 113 LEU HA 1 114 LEU H 0.000 . 2.500 2.463 2.387 2.530 0.030 24 0 "[ . 1 . 2 ]" 1 926 1 113 LEU MD2 1 114 LEU H 0.000 . 4.000 3.987 3.548 4.142 0.142 23 0 "[ . 1 . 2 ]" 1 927 1 113 LEU QB 1 156 CYS H 0.000 . 4.000 2.497 1.892 3.173 . 0 0 "[ . 1 . 2 ]" 1 928 1 113 LEU H 1 156 CYS QB 0.000 . 5.000 3.937 3.185 4.533 . 0 0 "[ . 1 . 2 ]" 1 929 1 113 LEU H 1 156 CYS H 0.000 . 4.000 2.834 2.282 3.234 . 0 0 "[ . 1 . 2 ]" 1 930 1 113 LEU H 1 157 TYR HA 0.000 . 5.000 3.809 3.295 4.243 . 0 0 "[ . 1 . 2 ]" 1 931 1 114 LEU H 1 114 LEU QB 0.000 . 3.000 2.799 2.728 2.874 . 0 0 "[ . 1 . 2 ]" 1 932 1 114 LEU H 1 114 LEU MD1 0.000 . 5.000 4.740 4.624 4.833 . 0 0 "[ . 1 . 2 ]" 1 933 1 114 LEU H 1 114 LEU MD2 0.000 . 5.000 4.076 3.908 4.353 . 0 0 "[ . 1 . 2 ]" 1 934 1 114 LEU H 1 114 LEU HG 0.000 . 4.000 3.983 3.784 4.074 0.074 3 0 "[ . 1 . 2 ]" 1 935 1 114 LEU HA 1 115 THR H 0.000 . 2.500 2.271 2.205 2.348 . 0 0 "[ . 1 . 2 ]" 1 936 1 114 LEU QB 1 115 THR H 0.000 . 4.000 2.725 2.579 2.951 . 0 0 "[ . 1 . 2 ]" 1 937 1 114 LEU MD1 1 115 THR H 0.000 . 5.000 4.198 4.049 4.360 . 0 0 "[ . 1 . 2 ]" 1 938 1 114 LEU MD2 1 115 THR H 0.000 . 4.000 2.587 2.142 2.996 . 0 0 "[ . 1 . 2 ]" 1 939 1 114 LEU HA 1 156 CYS H 0.000 . 4.000 4.063 3.986 4.140 0.140 14 0 "[ . 1 . 2 ]" 1 940 1 115 THR H 1 115 THR HB 0.000 . 4.000 4.021 3.910 4.074 0.074 7 0 "[ . 1 . 2 ]" 1 941 1 115 THR H 1 115 THR MG 0.000 . 3.000 2.596 2.526 2.702 . 0 0 "[ . 1 . 2 ]" 1 942 1 115 THR HA 1 116 TYR H 0.000 . 2.500 2.490 2.372 2.565 0.065 23 0 "[ . 1 . 2 ]" 1 943 1 115 THR HB 1 116 TYR H 0.000 . 5.000 2.802 2.416 3.332 . 0 0 "[ . 1 . 2 ]" 1 944 1 115 THR MG 1 116 TYR H 0.000 . 4.000 3.854 3.700 4.023 0.023 14 0 "[ . 1 . 2 ]" 1 945 1 115 THR MG 1 117 ALA H 0.000 . 4.000 3.997 3.894 4.087 0.087 16 0 "[ . 1 . 2 ]" 1 946 1 115 THR H 1 153 LEU MD1 0.000 . 4.000 3.551 2.771 4.121 0.121 13 0 "[ . 1 . 2 ]" 1 947 1 115 THR MG 1 154 MET H 0.000 . 4.000 3.989 3.643 4.067 0.067 3 0 "[ . 1 . 2 ]" 1 948 1 115 THR H 1 154 MET QB 0.000 . 5.000 3.214 2.515 4.424 . 0 0 "[ . 1 . 2 ]" 1 949 1 115 THR H 1 154 MET H 0.000 . 4.000 3.081 2.501 3.868 . 0 0 "[ . 1 . 2 ]" 1 950 1 115 THR H 1 155 GLU HA 0.000 . 4.000 4.041 3.866 4.133 0.133 22 0 "[ . 1 . 2 ]" 1 951 1 116 TYR H 1 116 TYR QB 0.000 . 3.000 2.417 2.271 2.540 . 0 0 "[ . 1 . 2 ]" 1 952 1 116 TYR H 1 116 TYR QD 0.000 . 4.000 4.071 3.883 4.238 0.238 9 0 "[ . 1 . 2 ]" 1 953 1 116 TYR HA 1 117 ALA H 0.000 . 2.500 2.438 2.249 2.537 0.037 14 0 "[ . 1 . 2 ]" 1 954 1 116 TYR QB 1 117 ALA H 0.000 . 5.000 3.941 3.832 4.001 . 0 0 "[ . 1 . 2 ]" 1 955 1 116 TYR QD 1 117 ALA H 0.000 . 5.000 4.232 3.326 4.618 . 0 0 "[ . 1 . 2 ]" 1 956 1 116 TYR QE 1 148 TYR H 0.000 . 5.000 4.301 1.969 5.040 0.040 11 0 "[ . 1 . 2 ]" 1 957 1 116 TYR QD 1 151 GLY H 0.000 . 4.000 2.660 2.041 3.724 . 0 0 "[ . 1 . 2 ]" 1 958 1 116 TYR QE 1 151 GLY H 0.000 . 5.000 3.524 2.414 5.003 0.003 19 0 "[ . 1 . 2 ]" 1 959 1 116 TYR HA 1 152 THR H 0.000 . 5.000 3.198 2.978 3.730 . 0 0 "[ . 1 . 2 ]" 1 960 1 116 TYR QD 1 152 THR H 0.000 . 5.000 3.377 2.190 4.367 . 0 0 "[ . 1 . 2 ]" 1 961 1 116 TYR QD 1 153 LEU H 0.000 . 4.000 3.755 3.137 4.032 0.032 4 0 "[ . 1 . 2 ]" 1 962 1 116 TYR QE 1 153 LEU H 0.000 . 5.000 3.307 2.265 3.950 . 0 0 "[ . 1 . 2 ]" 1 963 1 116 TYR HA 1 154 MET H 0.000 . 4.000 2.974 2.526 3.599 . 0 0 "[ . 1 . 2 ]" 1 964 1 117 ALA H 1 117 ALA MB 0.000 . 3.000 2.166 2.047 2.271 . 0 0 "[ . 1 . 2 ]" 1 965 1 117 ALA HA 1 118 ASP H 0.000 . 2.500 2.217 2.139 2.515 0.015 19 0 "[ . 1 . 2 ]" 1 966 1 117 ALA MB 1 118 ASP H 0.000 . 3.000 2.873 2.351 3.026 0.026 11 0 "[ . 1 . 2 ]" 1 967 1 117 ALA H 1 152 THR HB 0.000 . 5.000 5.037 4.927 5.078 0.078 12 0 "[ . 1 . 2 ]" 1 968 1 117 ALA H 1 152 THR H 0.000 . 3.000 3.078 3.027 3.134 0.134 15 0 "[ . 1 . 2 ]" 1 969 1 117 ALA H 1 153 LEU HA 0.000 . 4.000 4.029 3.897 4.096 0.096 2 0 "[ . 1 . 2 ]" 1 970 1 118 ASP H 1 118 ASP HA 0.000 . 3.000 2.912 2.879 2.935 . 0 0 "[ . 1 . 2 ]" 1 971 1 118 ASP H 1 118 ASP QB 0.000 . 3.000 2.385 2.151 2.902 . 0 0 "[ . 1 . 2 ]" 1 972 1 118 ASP HA 1 119 ASN H 0.000 . 3.000 2.580 2.486 2.687 . 0 0 "[ . 1 . 2 ]" 1 973 1 118 ASP QB 1 119 ASN H 0.000 . 4.000 2.498 1.948 2.970 . 0 0 "[ . 1 . 2 ]" 1 974 1 118 ASP QB 1 120 PHE H 0.000 . 5.000 2.891 2.360 3.728 . 0 0 "[ . 1 . 2 ]" 1 975 1 118 ASP H 1 121 ALA MB 0.000 . 4.000 2.764 2.401 3.191 . 0 0 "[ . 1 . 2 ]" 1 976 1 119 ASN QB 1 119 ASN HD21 0.000 . 3.000 2.189 2.088 2.583 . 0 0 "[ . 1 . 2 ]" 1 977 1 119 ASN H 1 119 ASN QB 0.000 . 3.000 2.326 2.061 2.660 . 0 0 "[ . 1 . 2 ]" 1 978 1 119 ASN HA 1 120 PHE H 0.000 . 5.000 3.544 3.489 3.582 . 0 0 "[ . 1 . 2 ]" 1 979 1 119 ASN QB 1 120 PHE H 0.000 . 4.000 2.650 2.092 3.532 . 0 0 "[ . 1 . 2 ]" 1 980 1 119 ASN H 1 120 PHE H 0.000 . 5.000 3.019 2.781 3.294 . 0 0 "[ . 1 . 2 ]" 1 981 1 120 PHE H 1 120 PHE HA 0.000 . 3.000 2.782 2.706 2.851 . 0 0 "[ . 1 . 2 ]" 1 982 1 120 PHE H 1 120 PHE QB 0.000 . 3.000 2.559 2.037 2.830 . 0 0 "[ . 1 . 2 ]" 1 983 1 120 PHE H 1 120 PHE QD 0.000 . 4.000 2.984 2.440 3.842 . 0 0 "[ . 1 . 2 ]" 1 984 1 120 PHE HA 1 121 ALA H 0.000 . 4.000 3.537 3.489 3.571 . 0 0 "[ . 1 . 2 ]" 1 985 1 120 PHE QB 1 121 ALA H 0.000 . 4.000 2.439 2.077 2.776 . 0 0 "[ . 1 . 2 ]" 1 986 1 120 PHE H 1 121 ALA MB 0.000 . 5.000 4.519 4.197 4.626 . 0 0 "[ . 1 . 2 ]" 1 987 1 120 PHE H 1 121 ALA H 0.000 . 3.000 2.843 2.529 3.003 0.003 6 0 "[ . 1 . 2 ]" 1 988 1 121 ALA H 1 121 ALA HA 0.000 . 3.000 2.877 2.842 2.901 . 0 0 "[ . 1 . 2 ]" 1 989 1 121 ALA H 1 121 ALA MB 0.000 . 2.500 2.173 2.064 2.271 . 0 0 "[ . 1 . 2 ]" 1 990 1 121 ALA HA 1 122 ILE H 0.000 . 4.000 3.459 3.409 3.492 . 0 0 "[ . 1 . 2 ]" 1 991 1 121 ALA MB 1 122 ILE H 0.000 . 4.000 2.769 2.597 2.920 . 0 0 "[ . 1 . 2 ]" 1 992 1 121 ALA H 1 122 ILE HB 0.000 . 4.000 4.191 4.159 4.238 0.238 2 0 "[ . 1 . 2 ]" 1 993 1 121 ALA H 1 122 ILE H 0.000 . 3.000 2.328 2.226 2.446 . 0 0 "[ . 1 . 2 ]" 1 994 1 121 ALA HA 1 124 TYR H 0.000 . 4.000 3.539 3.275 3.698 . 0 0 "[ . 1 . 2 ]" 1 995 1 122 ILE H 1 122 ILE HB 0.000 . 2.500 2.243 2.127 2.378 . 0 0 "[ . 1 . 2 ]" 1 996 1 122 ILE H 1 122 ILE QG 0.000 . 3.000 2.523 2.330 2.714 . 0 0 "[ . 1 . 2 ]" 1 997 1 122 ILE H 1 122 ILE MG 0.000 . 4.000 3.657 3.577 3.726 . 0 0 "[ . 1 . 2 ]" 1 998 1 122 ILE HA 1 123 GLY H 0.000 . 5.000 3.545 3.532 3.554 . 0 0 "[ . 1 . 2 ]" 1 999 1 122 ILE HB 1 123 GLY H 0.000 . 3.000 2.216 2.023 2.436 . 0 0 "[ . 1 . 2 ]" 1 1000 1 122 ILE MG 1 123 GLY H 0.000 . 3.000 2.073 1.881 2.346 . 0 0 "[ . 1 . 2 ]" 1 1001 1 122 ILE H 1 123 GLY H 0.000 . 4.000 3.171 3.089 3.246 . 0 0 "[ . 1 . 2 ]" 1 1002 1 122 ILE HA 1 125 PHE H 0.000 . 4.000 3.671 3.397 3.901 . 0 0 "[ . 1 . 2 ]" 1 1003 1 122 ILE HA 1 126 LYS H 0.000 . 5.000 4.097 3.893 4.245 . 0 0 "[ . 1 . 2 ]" 1 1004 1 122 ILE MG 1 126 LYS H 0.000 . 5.000 4.076 3.929 4.253 . 0 0 "[ . 1 . 2 ]" 1 1005 1 122 ILE MD 1 152 THR H 0.000 . 5.000 4.692 4.315 5.024 0.024 7 0 "[ . 1 . 2 ]" 1 1006 1 123 GLY H 1 123 GLY QA 0.000 . 2.500 2.191 2.188 2.195 . 0 0 "[ . 1 . 2 ]" 1 1007 1 123 GLY QA 1 124 TYR H 0.000 . 4.000 2.712 2.626 2.769 . 0 0 "[ . 1 . 2 ]" 1 1008 1 123 GLY H 1 124 TYR H 0.000 . 4.000 2.818 2.703 2.961 . 0 0 "[ . 1 . 2 ]" 1 1009 1 123 GLY QA 1 126 LYS H 0.000 . 5.000 3.363 3.166 3.573 . 0 0 "[ . 1 . 2 ]" 1 1010 1 123 GLY H 1 132 LYS QB 0.000 . 5.000 5.100 5.065 5.154 0.154 22 0 "[ . 1 . 2 ]" 1 1011 1 124 TYR H 1 124 TYR HA 0.000 . 3.000 2.820 2.794 2.853 . 0 0 "[ . 1 . 2 ]" 1 1012 1 124 TYR H 1 124 TYR QB 0.000 . 2.500 2.271 2.111 2.520 0.020 11 0 "[ . 1 . 2 ]" 1 1013 1 124 TYR QB 1 125 PHE H 0.000 . 3.000 2.825 2.580 2.959 . 0 0 "[ . 1 . 2 ]" 1 1014 1 124 TYR H 1 125 PHE H 0.000 . 3.000 2.608 2.488 2.721 . 0 0 "[ . 1 . 2 ]" 1 1015 1 124 TYR H 1 126 LYS H 0.000 . 5.000 4.307 4.130 4.458 . 0 0 "[ . 1 . 2 ]" 1 1016 1 124 TYR HA 1 127 LYS H 0.000 . 4.000 3.692 3.563 3.806 . 0 0 "[ . 1 . 2 ]" 1 1017 1 124 TYR H 1 127 LYS QG 0.000 . 5.000 4.689 4.280 5.015 0.015 1 0 "[ . 1 . 2 ]" 1 1018 1 125 PHE H 1 125 PHE HA 0.000 . 3.000 2.873 2.824 2.893 . 0 0 "[ . 1 . 2 ]" 1 1019 1 125 PHE H 1 125 PHE QB 0.000 . 3.000 2.165 2.112 2.246 . 0 0 "[ . 1 . 2 ]" 1 1020 1 125 PHE H 1 125 PHE QD 0.000 . 4.000 3.419 3.295 3.553 . 0 0 "[ . 1 . 2 ]" 1 1021 1 125 PHE HA 1 126 LYS H 0.000 . 5.000 3.550 3.526 3.566 . 0 0 "[ . 1 . 2 ]" 1 1022 1 125 PHE QB 1 126 LYS H 0.000 . 4.000 2.546 2.367 2.655 . 0 0 "[ . 1 . 2 ]" 1 1023 1 125 PHE H 1 126 LYS H 0.000 . 3.000 2.501 2.422 2.761 . 0 0 "[ . 1 . 2 ]" 1 1024 1 125 PHE HA 1 128 GLN H 0.000 . 4.000 3.350 3.146 3.459 . 0 0 "[ . 1 . 2 ]" 1 1025 1 125 PHE H 1 132 LYS QB 0.000 . 5.000 5.136 5.037 5.211 0.211 24 0 "[ . 1 . 2 ]" 1 1026 1 126 LYS H 1 126 LYS HA 0.000 . 3.000 2.826 2.781 2.856 . 0 0 "[ . 1 . 2 ]" 1 1027 1 126 LYS H 1 126 LYS QB 0.000 . 2.500 2.430 2.319 2.507 0.007 19 0 "[ . 1 . 2 ]" 1 1028 1 126 LYS H 1 126 LYS QD 0.000 . 3.000 2.605 2.394 3.009 0.009 16 0 "[ . 1 . 2 ]" 1 1029 1 126 LYS H 1 126 LYS QG 0.000 . 3.000 2.601 2.154 2.928 . 0 0 "[ . 1 . 2 ]" 1 1030 1 126 LYS HA 1 127 LYS H 0.000 . 4.000 3.359 3.250 3.441 . 0 0 "[ . 1 . 2 ]" 1 1031 1 126 LYS QB 1 127 LYS H 0.000 . 4.000 3.230 2.963 3.473 . 0 0 "[ . 1 . 2 ]" 1 1032 1 126 LYS H 1 127 LYS H 0.000 . 3.000 2.656 2.610 2.733 . 0 0 "[ . 1 . 2 ]" 1 1033 1 126 LYS HA 1 128 GLN H 0.000 . 5.000 4.438 4.192 4.621 . 0 0 "[ . 1 . 2 ]" 1 1034 1 126 LYS H 1 128 GLN H 0.000 . 5.000 4.415 4.336 4.563 . 0 0 "[ . 1 . 2 ]" 1 1035 1 126 LYS HA 1 129 GLY H 0.000 . 4.000 3.738 3.534 3.967 . 0 0 "[ . 1 . 2 ]" 1 1036 1 126 LYS HA 1 130 PHE H 0.000 . 4.000 3.854 2.374 4.037 0.037 10 0 "[ . 1 . 2 ]" 1 1037 1 127 LYS H 1 127 LYS HA 0.000 . 3.000 2.909 2.873 2.936 . 0 0 "[ . 1 . 2 ]" 1 1038 1 127 LYS H 1 127 LYS QB 0.000 . 2.500 2.292 2.168 2.446 . 0 0 "[ . 1 . 2 ]" 1 1039 1 127 LYS H 1 127 LYS QG 0.000 . 3.000 2.937 2.707 3.023 0.023 16 0 "[ . 1 . 2 ]" 1 1040 1 127 LYS HA 1 128 GLN H 0.000 . 4.000 3.545 3.504 3.577 . 0 0 "[ . 1 . 2 ]" 1 1041 1 127 LYS H 1 128 GLN H 0.000 . 3.000 2.302 2.070 2.515 . 0 0 "[ . 1 . 2 ]" 1 1042 1 127 LYS HA 1 129 GLY H 0.000 . 4.000 3.969 3.803 4.059 0.059 20 0 "[ . 1 . 2 ]" 1 1043 1 128 GLN H 1 128 GLN HA 0.000 . 3.000 2.908 2.873 2.932 . 0 0 "[ . 1 . 2 ]" 1 1044 1 128 GLN H 1 128 GLN QB 0.000 . 2.500 2.268 2.133 2.515 0.015 12 0 "[ . 1 . 2 ]" 1 1045 1 128 GLN QE 1 128 GLN QG 0.000 . 3.000 2.226 2.066 2.532 . 0 0 "[ . 1 . 2 ]" 1 1046 1 128 GLN H 1 128 GLN QE 0.000 . 5.000 4.088 2.390 4.945 . 0 0 "[ . 1 . 2 ]" 1 1047 1 128 GLN H 1 128 GLN QG 0.000 . 4.000 3.277 2.294 4.030 0.030 20 0 "[ . 1 . 2 ]" 1 1048 1 128 GLN HA 1 129 GLY H 0.000 . 4.000 3.339 3.301 3.414 . 0 0 "[ . 1 . 2 ]" 1 1049 1 128 GLN QB 1 129 GLY H 0.000 . 4.000 3.310 3.040 3.390 . 0 0 "[ . 1 . 2 ]" 1 1050 1 128 GLN H 1 129 GLY H 0.000 . 3.000 2.405 2.287 2.523 . 0 0 "[ . 1 . 2 ]" 1 1051 1 128 GLN H 1 130 PHE QB 0.000 . 4.000 4.101 4.059 4.133 0.133 4 0 "[ . 1 . 2 ]" 1 1052 1 128 GLN H 1 130 PHE H 0.000 . 4.000 3.578 3.335 4.008 0.008 6 0 "[ . 1 . 2 ]" 1 1053 1 129 GLY H 1 129 GLY QA 0.000 . 2.500 2.398 2.326 2.442 . 0 0 "[ . 1 . 2 ]" 1 1054 1 129 GLY QA 1 130 PHE H 0.000 . 4.000 2.803 2.551 2.881 . 0 0 "[ . 1 . 2 ]" 1 1055 1 129 GLY H 1 130 PHE H 0.000 . 3.000 2.298 1.965 2.547 . 0 0 "[ . 1 . 2 ]" 1 1056 1 130 PHE H 1 130 PHE QB 0.000 . 3.000 2.164 2.001 2.558 . 0 0 "[ . 1 . 2 ]" 1 1057 1 130 PHE HA 1 131 THR H 0.000 . 2.500 2.528 2.343 2.600 0.100 18 0 "[ . 1 . 2 ]" 1 1058 1 130 PHE QB 1 131 THR H 0.000 . 4.000 2.299 2.075 2.749 . 0 0 "[ . 1 . 2 ]" 1 1059 1 130 PHE HA 1 157 TYR H 0.000 . 5.000 4.647 3.803 5.031 0.031 11 0 "[ . 1 . 2 ]" 1 1060 1 131 THR H 1 131 THR MG 0.000 . 3.000 2.451 2.240 3.046 0.046 19 0 "[ . 1 . 2 ]" 1 1061 1 131 THR HA 1 132 LYS H 0.000 . 2.500 2.107 2.089 2.132 . 0 0 "[ . 1 . 2 ]" 1 1062 1 131 THR MG 1 132 LYS H 0.000 . 4.000 4.012 3.690 4.113 0.113 1 0 "[ . 1 . 2 ]" 1 1063 1 131 THR HA 1 133 GLU H 0.000 . 4.000 3.473 3.345 3.603 . 0 0 "[ . 1 . 2 ]" 1 1064 1 131 THR HB 1 133 GLU H 0.000 . 5.000 4.671 3.387 5.004 0.004 22 0 "[ . 1 . 2 ]" 1 1065 1 131 THR MG 1 133 GLU H 0.000 . 4.000 3.869 3.509 4.108 0.108 19 0 "[ . 1 . 2 ]" 1 1066 1 131 THR MG 1 155 GLU H 0.000 . 4.000 3.623 3.194 4.187 0.187 19 0 "[ . 1 . 2 ]" 1 1067 1 131 THR H 1 155 GLU H 0.000 . 4.000 3.803 2.631 4.053 0.053 18 0 "[ . 1 . 2 ]" 1 1068 1 131 THR H 1 156 CYS HA 0.000 . 5.000 3.313 2.671 3.631 . 0 0 "[ . 1 . 2 ]" 1 1069 1 132 LYS H 1 132 LYS HA 0.000 . 3.000 2.884 2.801 2.942 . 0 0 "[ . 1 . 2 ]" 1 1070 1 132 LYS H 1 132 LYS QB 0.000 . 2.500 2.238 2.180 2.485 . 0 0 "[ . 1 . 2 ]" 1 1071 1 132 LYS H 1 132 LYS QD 0.000 . 5.000 3.930 3.495 4.483 . 0 0 "[ . 1 . 2 ]" 1 1072 1 132 LYS H 1 132 LYS QG 0.000 . 4.000 4.052 3.998 4.158 0.158 19 0 "[ . 1 . 2 ]" 1 1073 1 132 LYS HA 1 133 GLU H 0.000 . 5.000 3.452 3.399 3.494 . 0 0 "[ . 1 . 2 ]" 1 1074 1 132 LYS QB 1 133 GLU H 0.000 . 3.000 2.997 2.802 3.088 0.088 19 0 "[ . 1 . 2 ]" 1 1075 1 132 LYS QD 1 133 GLU H 0.000 . 5.000 3.499 2.840 5.090 0.090 22 0 "[ . 1 . 2 ]" 1 1076 1 132 LYS QG 1 133 GLU H 0.000 . 5.000 4.219 4.033 4.350 . 0 0 "[ . 1 . 2 ]" 1 1077 1 132 LYS H 1 133 GLU H 0.000 . 3.000 2.334 1.889 2.633 . 0 0 "[ . 1 . 2 ]" 1 1078 1 133 GLU H 1 133 GLU HA 0.000 . 3.000 2.718 2.639 2.918 . 0 0 "[ . 1 . 2 ]" 1 1079 1 133 GLU H 1 133 GLU QB 0.000 . 2.500 2.399 2.229 2.511 0.011 9 0 "[ . 1 . 2 ]" 1 1080 1 133 GLU H 1 133 GLU QG 0.000 . 3.000 2.457 2.093 2.991 . 0 0 "[ . 1 . 2 ]" 1 1081 1 133 GLU HA 1 134 HIS H 0.000 . 2.500 2.247 2.171 2.524 0.024 6 0 "[ . 1 . 2 ]" 1 1082 1 133 GLU QB 1 134 HIS H 0.000 . 3.000 2.817 2.080 3.016 0.016 19 0 "[ . 1 . 2 ]" 1 1083 1 133 GLU QG 1 134 HIS H 0.000 . 5.000 3.820 3.367 4.201 . 0 0 "[ . 1 . 2 ]" 1 1084 1 134 HIS H 1 134 HIS HA 0.000 . 3.000 2.884 2.754 2.943 . 0 0 "[ . 1 . 2 ]" 1 1085 1 134 HIS H 1 134 HIS QB 0.000 . 3.000 2.434 2.057 3.004 0.004 1 0 "[ . 1 . 2 ]" 1 1086 1 134 HIS H 1 134 HIS HD1 0.000 . 4.000 2.980 1.952 4.005 0.005 19 0 "[ . 1 . 2 ]" 1 1087 1 134 HIS HA 1 136 MET H 0.000 . 5.000 3.831 3.231 4.540 . 0 0 "[ . 1 . 2 ]" 1 1088 1 135 ARG HA 1 136 MET H 0.000 . 4.000 3.376 2.582 3.571 . 0 0 "[ . 1 . 2 ]" 1 1089 1 135 ARG QB 1 136 MET H 0.000 . 4.000 2.786 1.957 3.976 . 0 0 "[ . 1 . 2 ]" 1 1090 1 136 MET H 1 136 MET ME 0.000 . 4.000 3.826 2.627 4.034 0.034 16 0 "[ . 1 . 2 ]" 1 1091 1 137 PRO HA 1 138 GLN H 0.000 . 2.500 2.346 2.143 2.565 0.065 9 0 "[ . 1 . 2 ]" 1 1092 1 137 PRO QB 1 138 GLN H 0.000 . 4.000 3.224 2.317 3.933 . 0 0 "[ . 1 . 2 ]" 1 1093 1 137 PRO HA 1 139 GLU H 0.000 . 5.000 3.757 3.047 4.477 . 0 0 "[ . 1 . 2 ]" 1 1094 1 137 PRO QB 1 139 GLU H 0.000 . 5.000 3.094 2.187 4.704 . 0 0 "[ . 1 . 2 ]" 1 1095 1 137 PRO QB 1 140 LYS H 0.000 . 5.000 4.071 2.943 5.026 0.026 2 0 "[ . 1 . 2 ]" 1 1096 1 138 GLN H 1 138 GLN QB 0.000 . 3.000 2.616 2.324 2.829 . 0 0 "[ . 1 . 2 ]" 1 1097 1 138 GLN HE21 1 138 GLN QG 0.000 . 3.000 2.198 2.095 2.643 . 0 0 "[ . 1 . 2 ]" 1 1098 1 138 GLN H 1 138 GLN QG 0.000 . 4.000 2.235 1.893 3.990 . 0 0 "[ . 1 . 2 ]" 1 1099 1 138 GLN HA 1 139 GLU H 0.000 . 5.000 3.198 2.623 3.568 . 0 0 "[ . 1 . 2 ]" 1 1100 1 138 GLN QB 1 139 GLU H 0.000 . 4.000 3.679 2.880 4.045 0.045 9 0 "[ . 1 . 2 ]" 1 1101 1 138 GLN H 1 139 GLU H 0.000 . 4.000 2.798 2.167 3.513 . 0 0 "[ . 1 . 2 ]" 1 1102 1 138 GLN HA 1 141 TRP HE1 0.000 . 4.000 4.089 3.975 4.189 0.189 15 0 "[ . 1 . 2 ]" 1 1103 1 138 GLN QB 1 141 TRP HE1 0.000 . 5.000 4.181 3.586 5.004 0.004 20 0 "[ . 1 . 2 ]" 1 1104 1 139 GLU H 1 139 GLU QB 0.000 . 3.000 2.356 2.082 2.964 . 0 0 "[ . 1 . 2 ]" 1 1105 1 139 GLU H 1 139 GLU QG 0.000 . 4.000 3.216 1.956 4.007 0.007 13 0 "[ . 1 . 2 ]" 1 1106 1 139 GLU HA 1 140 LYS H 0.000 . 4.000 3.517 3.442 3.575 . 0 0 "[ . 1 . 2 ]" 1 1107 1 139 GLU QB 1 140 LYS H 0.000 . 4.000 2.543 1.970 3.012 . 0 0 "[ . 1 . 2 ]" 1 1108 1 139 GLU QG 1 140 LYS H 0.000 . 4.000 3.920 3.291 4.018 0.018 23 0 "[ . 1 . 2 ]" 1 1109 1 139 GLU H 1 140 LYS H 0.000 . 4.000 2.795 2.414 4.042 0.042 21 0 "[ . 1 . 2 ]" 1 1110 1 139 GLU HA 1 142 LYS H 0.000 . 5.000 4.730 3.913 5.055 0.055 22 0 "[ . 1 . 2 ]" 1 1111 1 140 LYS H 1 140 LYS HA 0.000 . 3.000 2.861 2.793 2.916 . 0 0 "[ . 1 . 2 ]" 1 1112 1 140 LYS H 1 140 LYS QB 0.000 . 2.500 2.323 2.106 2.472 . 0 0 "[ . 1 . 2 ]" 1 1113 1 140 LYS H 1 140 LYS QG 0.000 . 3.000 2.724 2.376 3.007 0.007 7 0 "[ . 1 . 2 ]" 1 1114 1 140 LYS HA 1 141 TRP H 0.000 . 5.000 3.201 2.854 3.448 . 0 0 "[ . 1 . 2 ]" 1 1115 1 140 LYS H 1 141 TRP H 0.000 . 3.000 2.724 2.572 3.018 0.018 18 0 "[ . 1 . 2 ]" 1 1116 1 141 TRP HA 1 142 LYS H 0.000 . 4.000 3.469 3.415 3.546 . 0 0 "[ . 1 . 2 ]" 1 1117 1 141 TRP H 1 142 LYS H 0.000 . 3.000 2.662 2.177 3.019 0.019 15 0 "[ . 1 . 2 ]" 1 1118 1 141 TRP HA 1 144 TYR H 0.000 . 5.000 4.793 4.014 5.105 0.105 13 0 "[ . 1 . 2 ]" 1 1119 1 141 TRP HE1 1 153 LEU MD2 0.000 . 5.000 4.225 3.562 5.058 0.058 14 0 "[ . 1 . 2 ]" 1 1120 1 141 TRP HE1 1 154 MET QB 0.000 . 5.000 5.115 5.017 5.194 0.194 12 0 "[ . 1 . 2 ]" 1 1121 1 142 LYS H 1 142 LYS HA 0.000 . 3.000 2.705 2.345 2.883 . 0 0 "[ . 1 . 2 ]" 1 1122 1 142 LYS H 1 142 LYS QB 0.000 . 2.500 2.251 2.061 2.561 0.061 15 0 "[ . 1 . 2 ]" 1 1123 1 142 LYS H 1 142 LYS QG 0.000 . 4.000 3.588 2.119 4.057 0.057 17 0 "[ . 1 . 2 ]" 1 1124 1 142 LYS H 1 143 GLY H 0.000 . 5.000 4.186 2.817 4.637 . 0 0 "[ . 1 . 2 ]" 1 1125 1 143 GLY QA 1 144 TYR H 0.000 . 3.000 2.535 2.147 2.937 . 0 0 "[ . 1 . 2 ]" 1 1126 1 143 GLY H 1 144 TYR H 0.000 . 4.000 2.902 1.950 3.610 . 0 0 "[ . 1 . 2 ]" 1 1127 1 144 TYR H 1 144 TYR QB 0.000 . 3.000 2.854 2.245 3.119 0.119 5 0 "[ . 1 . 2 ]" 1 1128 1 144 TYR H 1 144 TYR QD 0.000 . 4.000 2.627 1.978 3.550 . 0 0 "[ . 1 . 2 ]" 1 1129 1 144 TYR H 1 144 TYR QE 0.000 . 5.000 4.170 3.681 5.009 0.009 12 0 "[ . 1 . 2 ]" 1 1130 1 144 TYR HA 1 145 ILE H 0.000 . 4.000 3.180 2.488 3.565 . 0 0 "[ . 1 . 2 ]" 1 1131 1 144 TYR QB 1 145 ILE H 0.000 . 4.000 3.626 3.007 3.916 . 0 0 "[ . 1 . 2 ]" 1 1132 1 144 TYR H 1 145 ILE H 0.000 . 3.000 2.417 1.912 3.050 0.050 13 0 "[ . 1 . 2 ]" 1 1133 1 145 ILE H 1 145 ILE HB 0.000 . 4.000 2.879 2.502 3.776 . 0 0 "[ . 1 . 2 ]" 1 1134 1 145 ILE H 1 145 ILE MD 0.000 . 5.000 3.091 2.095 4.500 . 0 0 "[ . 1 . 2 ]" 1 1135 1 145 ILE H 1 145 ILE QG 0.000 . 4.000 2.419 1.880 3.904 . 0 0 "[ . 1 . 2 ]" 1 1136 1 145 ILE H 1 145 ILE MG 0.000 . 4.000 3.824 3.709 4.033 0.033 1 0 "[ . 1 . 2 ]" 1 1137 1 145 ILE HA 1 146 LYS H 0.000 . 2.500 2.301 2.135 2.470 . 0 0 "[ . 1 . 2 ]" 1 1138 1 145 ILE HB 1 146 LYS H 0.000 . 4.000 3.590 3.016 4.060 0.060 24 0 "[ . 1 . 2 ]" 1 1139 1 145 ILE MG 1 146 LYS H 0.000 . 4.000 2.084 1.878 2.935 . 0 0 "[ . 1 . 2 ]" 1 1140 1 145 ILE MG 1 147 ASP H 0.000 . 5.000 4.735 4.162 5.114 0.114 1 0 "[ . 1 . 2 ]" 1 1141 1 146 LYS H 1 146 LYS QB 0.000 . 3.000 2.959 2.683 3.093 0.093 1 0 "[ . 1 . 2 ]" 1 1142 1 146 LYS H 1 146 LYS QG 0.000 . 4.000 3.827 2.985 4.015 0.015 13 0 "[ . 1 . 2 ]" 1 1143 1 146 LYS HA 1 147 ASP H 0.000 . 2.500 2.213 2.113 2.602 0.102 5 0 "[ . 1 . 2 ]" 1 1144 1 146 LYS QB 1 147 ASP H 0.000 . 3.000 2.952 1.913 3.115 0.115 11 0 "[ . 1 . 2 ]" 1 1145 1 146 LYS QD 1 147 ASP H 0.000 . 5.000 3.892 2.443 5.041 0.041 13 0 "[ . 1 . 2 ]" 1 1146 1 146 LYS QG 1 147 ASP H 0.000 . 4.000 3.535 3.110 3.778 . 0 0 "[ . 1 . 2 ]" 1 1147 1 146 LYS H 1 147 ASP H 0.000 . 4.000 4.108 4.041 4.275 0.275 10 0 "[ . 1 . 2 ]" 1 1148 1 147 ASP H 1 147 ASP HA 0.000 . 3.000 2.574 2.270 2.876 . 0 0 "[ . 1 . 2 ]" 1 1149 1 147 ASP H 1 147 ASP QB 0.000 . 3.000 2.664 2.149 3.042 0.042 2 0 "[ . 1 . 2 ]" 1 1150 1 147 ASP HA 1 148 TYR H 0.000 . 2.500 2.280 2.147 2.465 . 0 0 "[ . 1 . 2 ]" 1 1151 1 147 ASP QB 1 148 TYR H 0.000 . 4.000 3.820 3.521 4.030 0.030 10 0 "[ . 1 . 2 ]" 1 1152 1 147 ASP H 1 148 TYR H 0.000 . 4.000 3.879 3.257 4.092 0.092 12 0 "[ . 1 . 2 ]" 1 1153 1 148 TYR H 1 148 TYR HA 0.000 . 3.000 2.812 2.266 2.947 . 0 0 "[ . 1 . 2 ]" 1 1154 1 148 TYR H 1 148 TYR QB 0.000 . 3.000 2.627 2.061 3.060 0.060 13 0 "[ . 1 . 2 ]" 1 1155 1 148 TYR H 1 148 TYR QD 0.000 . 4.000 3.850 3.183 4.066 0.066 11 0 "[ . 1 . 2 ]" 1 1156 1 148 TYR HA 1 149 ASP H 0.000 . 2.500 2.353 2.142 2.549 0.049 2 0 "[ . 1 . 2 ]" 1 1157 1 148 TYR QB 1 149 ASP H 0.000 . 4.000 2.994 2.105 4.005 0.005 11 0 "[ . 1 . 2 ]" 1 1158 1 148 TYR QD 1 149 ASP H 0.000 . 4.000 3.296 2.529 4.019 0.019 19 0 "[ . 1 . 2 ]" 1 1159 1 148 TYR H 1 149 ASP H 0.000 . 5.000 4.161 3.206 4.552 . 0 0 "[ . 1 . 2 ]" 1 1160 1 149 ASP H 1 149 ASP QB 0.000 . 3.000 2.747 2.136 3.020 0.020 2 0 "[ . 1 . 2 ]" 1 1161 1 149 ASP HA 1 150 GLY H 0.000 . 3.000 2.364 2.138 3.034 0.034 9 0 "[ . 1 . 2 ]" 1 1162 1 149 ASP QB 1 150 GLY H 0.000 . 5.000 3.728 1.907 4.028 . 0 0 "[ . 1 . 2 ]" 1 1163 1 149 ASP H 1 150 GLY H 0.000 . 4.000 3.571 1.982 4.072 0.072 9 0 "[ . 1 . 2 ]" 1 1164 1 149 ASP HA 1 151 GLY H 0.000 . 4.000 3.929 3.570 4.028 0.028 15 0 "[ . 1 . 2 ]" 1 1165 1 150 GLY H 1 150 GLY QA 0.000 . 2.500 2.381 2.207 2.501 0.001 18 0 "[ . 1 . 2 ]" 1 1166 1 150 GLY QA 1 151 GLY H 0.000 . 3.000 2.714 2.640 2.823 . 0 0 "[ . 1 . 2 ]" 1 1167 1 150 GLY H 1 151 GLY H 0.000 . 4.000 2.297 1.976 3.288 . 0 0 "[ . 1 . 2 ]" 1 1168 1 151 GLY H 1 151 GLY QA 0.000 . 2.500 2.415 2.300 2.502 0.002 8 0 "[ . 1 . 2 ]" 1 1169 1 151 GLY QA 1 152 THR H 0.000 . 2.500 2.134 2.113 2.184 . 0 0 "[ . 1 . 2 ]" 1 1170 1 151 GLY H 1 152 THR H 0.000 . 4.000 3.740 3.270 4.012 0.012 23 0 "[ . 1 . 2 ]" 1 1171 1 152 THR H 1 152 THR HB 0.000 . 3.000 2.892 2.704 2.974 . 0 0 "[ . 1 . 2 ]" 1 1172 1 152 THR H 1 152 THR MG 0.000 . 3.000 3.037 2.860 3.121 0.121 16 0 "[ . 1 . 2 ]" 1 1173 1 152 THR HA 1 153 LEU H 0.000 . 2.500 2.257 2.207 2.393 . 0 0 "[ . 1 . 2 ]" 1 1174 1 152 THR MG 1 153 LEU H 0.000 . 3.000 2.939 2.405 3.058 0.058 15 0 "[ . 1 . 2 ]" 1 1175 1 153 LEU H 1 153 LEU QB 0.000 . 3.000 2.197 2.030 2.398 . 0 0 "[ . 1 . 2 ]" 1 1176 1 153 LEU H 1 153 LEU MD1 0.000 . 5.000 3.826 3.131 4.275 . 0 0 "[ . 1 . 2 ]" 1 1177 1 153 LEU H 1 153 LEU MD2 0.000 . 5.000 3.347 1.890 4.277 . 0 0 "[ . 1 . 2 ]" 1 1178 1 153 LEU H 1 153 LEU HG 0.000 . 5.000 4.101 3.778 4.538 . 0 0 "[ . 1 . 2 ]" 1 1179 1 153 LEU HA 1 154 MET H 0.000 . 2.500 2.182 2.078 2.343 . 0 0 "[ . 1 . 2 ]" 1 1180 1 153 LEU MD1 1 154 MET H 0.000 . 4.000 2.995 2.042 3.903 . 0 0 "[ . 1 . 2 ]" 1 1181 1 153 LEU MD2 1 154 MET H 0.000 . 5.000 4.837 4.484 5.059 0.059 1 0 "[ . 1 . 2 ]" 1 1182 1 154 MET H 1 154 MET QG 0.000 . 4.000 3.696 2.695 4.087 0.087 8 0 "[ . 1 . 2 ]" 1 1183 1 154 MET HA 1 155 GLU H 0.000 . 2.500 2.318 2.175 2.508 0.008 12 0 "[ . 1 . 2 ]" 1 1184 1 155 GLU HA 1 156 CYS H 0.000 . 3.000 2.297 2.173 2.483 . 0 0 "[ . 1 . 2 ]" 1 1185 1 156 CYS HA 1 157 TYR H 0.000 . 2.500 2.200 2.130 2.333 . 0 0 "[ . 1 . 2 ]" 1 1186 1 156 CYS QB 1 157 TYR H 0.000 . 5.000 3.665 3.389 3.964 . 0 0 "[ . 1 . 2 ]" 1 1187 1 157 TYR H 1 157 TYR QB 0.000 . 2.500 2.309 2.065 2.553 0.053 9 0 "[ . 1 . 2 ]" 1 1188 1 157 TYR H 1 157 TYR QD 0.000 . 4.000 3.735 2.232 4.116 0.116 10 0 "[ . 1 . 2 ]" 1 1189 1 157 TYR HA 1 158 ILE H 0.000 . 3.000 2.202 2.136 2.376 . 0 0 "[ . 1 . 2 ]" 1 1190 1 157 TYR QB 1 158 ILE H 0.000 . 4.000 3.481 2.591 3.936 . 0 0 "[ . 1 . 2 ]" 1 1191 1 157 TYR QD 1 158 ILE H 0.000 . 3.000 2.988 2.465 3.051 0.051 4 0 "[ . 1 . 2 ]" 1 1192 1 158 ILE H 1 158 ILE HB 0.000 . 3.000 2.677 2.514 2.875 . 0 0 "[ . 1 . 2 ]" 1 1193 1 158 ILE H 1 158 ILE MD 0.000 . 5.000 3.369 2.911 3.863 . 0 0 "[ . 1 . 2 ]" 1 1194 1 160 PRO HA 1 161 TYR H 0.000 . 4.000 3.083 2.201 3.576 . 0 0 "[ . 1 . 2 ]" 1 1195 1 160 PRO QB 1 161 TYR H 0.000 . 5.000 3.209 1.828 4.010 . 0 0 "[ . 1 . 2 ]" 1 1196 1 160 PRO QG 1 161 TYR H 0.000 . 5.000 3.452 2.344 4.870 . 0 0 "[ . 1 . 2 ]" 1 1197 1 161 TYR H 1 161 TYR QB 0.000 . 3.000 2.661 2.154 3.075 0.075 9 0 "[ . 1 . 2 ]" 1 1198 1 161 TYR H 1 161 TYR QD 0.000 . 5.000 2.711 2.075 3.612 . 0 0 "[ . 1 . 2 ]" 1 1199 1 161 TYR H 1 161 TYR QE 0.000 . 5.000 4.548 3.934 5.030 0.030 3 0 "[ . 1 . 2 ]" 1 1200 1 161 TYR HA 1 162 VAL H 0.000 . 4.000 3.270 2.454 3.569 . 0 0 "[ . 1 . 2 ]" 1 1201 1 161 TYR QB 1 162 VAL H 0.000 . 4.000 3.199 2.240 4.010 0.010 7 0 "[ . 1 . 2 ]" 1 1202 1 161 TYR H 1 162 VAL MG2 0.000 . 5.000 3.800 2.943 4.357 . 0 0 "[ . 1 . 2 ]" 1 1203 1 161 TYR H 1 162 VAL H 0.000 . 3.000 2.583 1.920 3.017 0.017 7 0 "[ . 1 . 2 ]" 1 1204 1 162 VAL H 1 162 VAL HA 0.000 . 3.000 2.891 2.818 2.942 . 0 0 "[ . 1 . 2 ]" 1 1205 1 162 VAL H 1 162 VAL HB 0.000 . 2.500 2.537 2.522 2.561 0.061 16 0 "[ . 1 . 2 ]" 1 1206 1 162 VAL H 1 162 VAL MG1 0.000 . 4.000 3.788 3.762 3.823 . 0 0 "[ . 1 . 2 ]" 1 1207 1 162 VAL H 1 162 VAL MG2 0.000 . 3.000 2.257 2.006 2.711 . 0 0 "[ . 1 . 2 ]" 1 1208 1 162 VAL HA 1 163 ASP H 0.000 . 2.500 2.298 2.189 2.361 . 0 0 "[ . 1 . 2 ]" 1 1209 1 162 VAL HB 1 163 ASP H 0.000 . 4.000 3.772 3.596 4.007 0.007 8 0 "[ . 1 . 2 ]" 1 1210 1 162 VAL MG1 1 163 ASP H 0.000 . 3.000 2.030 1.870 2.374 . 0 0 "[ . 1 . 2 ]" 1 1211 1 162 VAL MG2 1 163 ASP H 0.000 . 4.000 3.865 3.766 4.009 0.009 8 0 "[ . 1 . 2 ]" 1 1212 1 162 VAL H 1 163 ASP H 0.000 . 5.000 4.582 4.515 4.633 . 0 0 "[ . 1 . 2 ]" 1 1213 1 163 ASP H 1 163 ASP QB 0.000 . 2.500 2.370 2.180 2.544 0.044 23 0 "[ . 1 . 2 ]" 1 1214 1 163 ASP HA 1 164 TYR H 0.000 . 3.000 2.307 2.148 2.496 . 0 0 "[ . 1 . 2 ]" 1 1215 1 163 ASP H 1 164 TYR H 0.000 . 5.000 3.923 3.551 4.275 . 0 0 "[ . 1 . 2 ]" 1 1216 1 163 ASP HA 1 165 GLY H 0.000 . 4.000 3.545 3.182 3.992 . 0 0 "[ . 1 . 2 ]" 1 1217 1 164 TYR H 1 164 TYR QB 0.000 . 3.000 2.462 2.211 2.695 . 0 0 "[ . 1 . 2 ]" 1 1218 1 164 TYR H 1 164 TYR QD 0.000 . 4.000 3.027 2.585 3.606 . 0 0 "[ . 1 . 2 ]" 1 1219 1 164 TYR HA 1 165 GLY H 0.000 . 4.000 3.426 2.865 3.570 . 0 0 "[ . 1 . 2 ]" 1 1220 1 164 TYR QB 1 165 GLY H 0.000 . 4.000 2.838 2.215 3.854 . 0 0 "[ . 1 . 2 ]" 1 1221 1 164 TYR QD 1 165 GLY H 0.000 . 5.000 4.373 3.836 4.754 . 0 0 "[ . 1 . 2 ]" 1 1222 1 164 TYR H 1 165 GLY H 0.000 . 3.000 2.610 2.050 2.916 . 0 0 "[ . 1 . 2 ]" 1 1223 1 165 GLY H 1 165 GLY QA 0.000 . 2.500 2.376 2.193 2.503 0.003 1 0 "[ . 1 . 2 ]" 1 1224 1 165 GLY QA 1 166 ASN H 0.000 . 3.000 2.578 2.249 2.875 . 0 0 "[ . 1 . 2 ]" 1 1225 1 165 GLY H 1 166 ASN H 0.000 . 3.000 2.542 2.021 3.013 0.013 23 0 "[ . 1 . 2 ]" 1 1226 1 166 ASN H 1 166 ASN QB 0.000 . 3.000 2.639 2.130 2.996 . 0 0 "[ . 1 . 2 ]" 1 stop_ save_ save_distance_constraint_statistics_2 _Distance_constraint_stats_list.Sf_category distance_constraint_statistics _Distance_constraint_stats_list.Constraint_list_ID 2 _Distance_constraint_stats_list.Constraint_count 574 _Distance_constraint_stats_list.Viol_count 2251 _Distance_constraint_stats_list.Viol_total 3500.358 _Distance_constraint_stats_list.Viol_max 0.392 _Distance_constraint_stats_list.Viol_rms 0.0350 _Distance_constraint_stats_list.Viol_average_all_restraints 0.0106 _Distance_constraint_stats_list.Viol_average_violations_only 0.0648 _Distance_constraint_stats_list.Cutoff_violation_report 0.500 _Distance_constraint_stats_list.Details . loop_ _Distance_constraint_stats_per_res.Atom_entity_assembly_ID _Distance_constraint_stats_per_res.Atom_comp_index_ID _Distance_constraint_stats_per_res.Atom_comp_ID _Distance_constraint_stats_per_res.Total_violation _Distance_constraint_stats_per_res.Max_violation _Distance_constraint_stats_per_res.Max_violation_model_number _Distance_constraint_stats_per_res.Over_cutoff_viol_count _Distance_constraint_stats_per_res.Over_cutoff_viol_per_model 1 2 LYS 0.098 0.035 4 0 "[ . 1 . 2 ]" 1 4 LEU 0.057 0.011 21 0 "[ . 1 . 2 ]" 1 5 LEU 5.063 0.170 10 0 "[ . 1 . 2 ]" 1 6 ASP 0.000 0.000 . 0 "[ . 1 . 2 ]" 1 7 PHE 6.204 0.163 8 0 "[ . 1 . 2 ]" 1 8 ASP 0.211 0.032 3 0 "[ . 1 . 2 ]" 1 9 ILE 0.104 0.038 14 0 "[ . 1 . 2 ]" 1 10 LEU 0.301 0.040 18 0 "[ . 1 . 2 ]" 1 11 THR 2.847 0.143 6 0 "[ . 1 . 2 ]" 1 12 ASN 0.839 0.103 20 0 "[ . 1 . 2 ]" 1 13 ASP 0.039 0.019 19 0 "[ . 1 . 2 ]" 1 15 THR 0.141 0.036 10 0 "[ . 1 . 2 ]" 1 16 HIS 0.134 0.036 8 0 "[ . 1 . 2 ]" 1 17 ARG 0.000 0.000 . 0 "[ . 1 . 2 ]" 1 18 ASN 0.209 0.040 18 0 "[ . 1 . 2 ]" 1 19 MET 0.317 0.172 24 0 "[ . 1 . 2 ]" 1 20 LYS 0.474 0.040 24 0 "[ . 1 . 2 ]" 1 21 LEU 0.000 0.000 . 0 "[ . 1 . 2 ]" 1 22 LEU 1.001 0.103 20 0 "[ . 1 . 2 ]" 1 23 ILE 0.660 0.040 24 0 "[ . 1 . 2 ]" 1 24 ASP 0.012 0.012 1 0 "[ . 1 . 2 ]" 1 25 LEU 0.700 0.065 12 0 "[ . 1 . 2 ]" 1 26 LYS 0.638 0.072 21 0 "[ . 1 . 2 ]" 1 27 ASN 0.000 0.000 . 0 "[ . 1 . 2 ]" 1 28 ILE 3.975 0.128 3 0 "[ . 1 . 2 ]" 1 29 PHE 12.673 0.248 23 0 "[ . 1 . 2 ]" 1 30 SER 0.029 0.021 1 0 "[ . 1 . 2 ]" 1 31 ARG 0.004 0.004 12 0 "[ . 1 . 2 ]" 1 32 GLN 0.000 0.000 . 0 "[ . 1 . 2 ]" 1 33 LEU 3.334 0.168 8 0 "[ . 1 . 2 ]" 1 34 PRO 0.000 0.000 . 0 "[ . 1 . 2 ]" 1 35 LYS 0.089 0.021 1 0 "[ . 1 . 2 ]" 1 36 MET 0.334 0.042 4 0 "[ . 1 . 2 ]" 1 37 PRO 0.000 0.000 . 0 "[ . 1 . 2 ]" 1 38 LYS 0.257 0.050 4 0 "[ . 1 . 2 ]" 1 39 GLU 2.046 0.108 8 0 "[ . 1 . 2 ]" 1 40 TYR 1.392 0.079 7 0 "[ . 1 . 2 ]" 1 41 ILE 5.280 0.248 23 0 "[ . 1 . 2 ]" 1 42 VAL 3.176 0.108 8 0 "[ . 1 . 2 ]" 1 43 LYS 1.978 0.081 3 0 "[ . 1 . 2 ]" 1 44 LEU 2.557 0.149 4 0 "[ . 1 . 2 ]" 1 45 VAL 2.108 0.129 4 0 "[ . 1 . 2 ]" 1 46 PHE 0.398 0.040 8 0 "[ . 1 . 2 ]" 1 47 ASP 0.249 0.038 15 0 "[ . 1 . 2 ]" 1 48 ARG 0.000 0.000 . 0 "[ . 1 . 2 ]" 1 50 HIS 0.114 0.039 12 0 "[ . 1 . 2 ]" 1 51 GLU 0.393 0.036 14 0 "[ . 1 . 2 ]" 1 52 SER 0.092 0.047 10 0 "[ . 1 . 2 ]" 1 53 MET 0.112 0.038 14 0 "[ . 1 . 2 ]" 1 54 VAL 6.122 0.154 11 0 "[ . 1 . 2 ]" 1 55 ILE 1.585 0.110 1 0 "[ . 1 . 2 ]" 1 56 LEU 2.696 0.156 14 0 "[ . 1 . 2 ]" 1 57 LYS 2.226 0.170 10 0 "[ . 1 . 2 ]" 1 58 ASN 0.533 0.040 3 0 "[ . 1 . 2 ]" 1 59 LYS 1.347 0.061 24 0 "[ . 1 . 2 ]" 1 60 GLN 1.143 0.134 8 0 "[ . 1 . 2 ]" 1 61 LYS 0.028 0.028 24 0 "[ . 1 . 2 ]" 1 62 VAL 3.370 0.156 14 0 "[ . 1 . 2 ]" 1 63 ILE 7.870 0.190 4 0 "[ . 1 . 2 ]" 1 64 GLY 0.000 0.000 . 0 "[ . 1 . 2 ]" 1 65 GLY 0.000 0.000 . 0 "[ . 1 . 2 ]" 1 66 ILE 2.981 0.178 22 0 "[ . 1 . 2 ]" 1 67 CYS 0.092 0.047 10 0 "[ . 1 . 2 ]" 1 68 PHE 0.010 0.010 15 0 "[ . 1 . 2 ]" 1 70 GLN 0.093 0.052 11 0 "[ . 1 . 2 ]" 1 71 TYR 4.119 0.159 22 0 "[ . 1 . 2 ]" 1 72 LYS 3.853 0.218 9 0 "[ . 1 . 2 ]" 1 73 PRO 0.000 0.000 . 0 "[ . 1 . 2 ]" 1 74 GLN 0.265 0.037 20 0 "[ . 1 . 2 ]" 1 75 ARG 2.210 0.106 7 0 "[ . 1 . 2 ]" 1 76 PHE 0.799 0.097 24 0 "[ . 1 . 2 ]" 1 77 ALA 1.510 0.089 14 0 "[ . 1 . 2 ]" 1 79 VAL 6.591 0.256 23 0 "[ . 1 . 2 ]" 1 80 ALA 0.000 0.000 . 0 "[ . 1 . 2 ]" 1 81 PHE 12.550 0.331 19 0 "[ . 1 . 2 ]" 1 82 LEU 0.539 0.091 24 0 "[ . 1 . 2 ]" 1 83 ALA 4.477 0.244 18 0 "[ . 1 . 2 ]" 1 84 VAL 0.000 0.000 . 0 "[ . 1 . 2 ]" 1 85 THR 7.243 0.179 5 0 "[ . 1 . 2 ]" 1 86 ALA 0.000 0.000 . 0 "[ . 1 . 2 ]" 1 87 ASN 0.509 0.028 17 0 "[ . 1 . 2 ]" 1 88 GLU 0.002 0.002 5 0 "[ . 1 . 2 ]" 1 89 GLN 1.780 0.121 19 0 "[ . 1 . 2 ]" 1 90 VAL 1.780 0.121 19 0 "[ . 1 . 2 ]" 1 91 ARG 0.315 0.037 6 0 "[ . 1 . 2 ]" 1 93 TYR 0.185 0.022 3 0 "[ . 1 . 2 ]" 1 94 GLY 0.000 0.000 . 0 "[ . 1 . 2 ]" 1 95 THR 0.021 0.021 10 0 "[ . 1 . 2 ]" 1 96 ARG 0.001 0.001 10 0 "[ . 1 . 2 ]" 1 97 LEU 3.139 0.163 8 0 "[ . 1 . 2 ]" 1 98 MET 0.424 0.070 24 0 "[ . 1 . 2 ]" 1 100 LYS 0.016 0.013 14 0 "[ . 1 . 2 ]" 1 101 PHE 7.665 0.287 17 0 "[ . 1 . 2 ]" 1 102 LYS 0.137 0.046 5 0 "[ . 1 . 2 ]" 1 104 HIS 0.174 0.039 24 0 "[ . 1 . 2 ]" 1 105 MET 0.161 0.039 24 0 "[ . 1 . 2 ]" 1 106 GLN 0.977 0.064 22 0 "[ . 1 . 2 ]" 1 107 LYS 0.820 0.077 2 0 "[ . 1 . 2 ]" 1 108 GLN 3.839 0.290 3 0 "[ . 1 . 2 ]" 1 109 ASN 0.015 0.008 16 0 "[ . 1 . 2 ]" 1 110 ILE 1.021 0.097 24 0 "[ . 1 . 2 ]" 1 111 GLU 0.000 0.000 . 0 "[ . 1 . 2 ]" 1 112 TYR 0.000 0.000 . 0 "[ . 1 . 2 ]" 1 113 LEU 0.954 0.096 24 0 "[ . 1 . 2 ]" 1 114 LEU 2.067 0.392 15 0 "[ . 1 . 2 ]" 1 115 THR 11.601 0.331 19 0 "[ . 1 . 2 ]" 1 116 TYR 2.550 0.163 18 0 "[ . 1 . 2 ]" 1 117 ALA 4.666 0.186 16 0 "[ . 1 . 2 ]" 1 118 ASP 0.072 0.037 16 0 "[ . 1 . 2 ]" 1 119 ASN 0.135 0.055 19 0 "[ . 1 . 2 ]" 1 120 PHE 0.541 0.037 15 0 "[ . 1 . 2 ]" 1 121 ALA 0.755 0.091 24 0 "[ . 1 . 2 ]" 1 122 ILE 7.552 0.204 4 0 "[ . 1 . 2 ]" 1 124 TYR 0.004 0.004 19 0 "[ . 1 . 2 ]" 1 125 PHE 1.559 0.186 16 0 "[ . 1 . 2 ]" 1 126 LYS 3.270 0.204 4 0 "[ . 1 . 2 ]" 1 127 LYS 0.013 0.008 8 0 "[ . 1 . 2 ]" 1 128 GLN 0.175 0.031 4 0 "[ . 1 . 2 ]" 1 130 PHE 0.000 0.000 . 0 "[ . 1 . 2 ]" 1 131 THR 6.309 0.203 11 0 "[ . 1 . 2 ]" 1 132 LYS 3.451 0.149 19 0 "[ . 1 . 2 ]" 1 133 GLU 0.000 0.000 . 0 "[ . 1 . 2 ]" 1 134 HIS 0.152 0.034 19 0 "[ . 1 . 2 ]" 1 135 ARG 0.228 0.036 7 0 "[ . 1 . 2 ]" 1 136 MET 0.108 0.048 19 0 "[ . 1 . 2 ]" 1 137 PRO 0.000 0.000 . 0 "[ . 1 . 2 ]" 1 138 GLN 0.000 0.000 . 0 "[ . 1 . 2 ]" 1 139 GLU 0.036 0.029 12 0 "[ . 1 . 2 ]" 1 140 LYS 0.035 0.017 24 0 "[ . 1 . 2 ]" 1 141 TRP 1.385 0.214 22 0 "[ . 1 . 2 ]" 1 142 LYS 0.119 0.036 8 0 "[ . 1 . 2 ]" 1 144 TYR 1.228 0.108 22 0 "[ . 1 . 2 ]" 1 145 ILE 1.812 0.392 15 0 "[ . 1 . 2 ]" 1 146 LYS 0.311 0.030 5 0 "[ . 1 . 2 ]" 1 147 ASP 0.046 0.034 21 0 "[ . 1 . 2 ]" 1 148 TYR 0.014 0.009 24 0 "[ . 1 . 2 ]" 1 149 ASP 0.049 0.026 24 0 "[ . 1 . 2 ]" 1 152 THR 7.676 0.285 16 0 "[ . 1 . 2 ]" 1 153 LEU 2.764 0.163 18 0 "[ . 1 . 2 ]" 1 154 MET 4.402 0.149 19 0 "[ . 1 . 2 ]" 1 155 GLU 0.260 0.057 1 0 "[ . 1 . 2 ]" 1 156 CYS 0.014 0.014 20 0 "[ . 1 . 2 ]" 1 158 ILE 1.394 0.064 22 0 "[ . 1 . 2 ]" 1 160 PRO 0.000 0.000 . 0 "[ . 1 . 2 ]" 1 161 TYR 0.099 0.031 4 0 "[ . 1 . 2 ]" 1 162 VAL 0.592 0.023 23 0 "[ . 1 . 2 ]" 1 164 TYR 0.180 0.023 23 0 "[ . 1 . 2 ]" 1 166 ASN 0.012 0.006 20 0 "[ . 1 . 2 ]" stop_ loop_ _Distance_constraint_stats.Restraint_ID _Distance_constraint_stats.Atom_1_entity_assembly_ID _Distance_constraint_stats.Atom_1_comp_index_ID _Distance_constraint_stats.Atom_1_comp_ID _Distance_constraint_stats.Atom_1_ID _Distance_constraint_stats.Atom_2_entity_assembly_ID _Distance_constraint_stats.Atom_2_comp_index_ID _Distance_constraint_stats.Atom_2_comp_ID _Distance_constraint_stats.Atom_2_ID _Distance_constraint_stats.Node_1_distance_val _Distance_constraint_stats.Node_1_distance_lower_bound_val _Distance_constraint_stats.Node_1_distance_upper_bound_val _Distance_constraint_stats.Distance_average _Distance_constraint_stats.Distance_minimum _Distance_constraint_stats.Distance_maximum _Distance_constraint_stats.Max_violation _Distance_constraint_stats.Max_violation_model_number _Distance_constraint_stats.Over_cutoff_violation_count _Distance_constraint_stats.Over_cutoff_viol_per_model _Distance_constraint_stats.Distance_constraint_stats_ID 1 1 2 LYS HA 1 2 LYS QB 0.000 . 2.500 2.400 2.177 2.535 0.035 4 0 "[ . 1 . 2 ]" 2 2 1 4 LEU HA 1 4 LEU MD1 0.000 . 3.000 2.108 1.957 2.274 . 0 0 "[ . 1 . 2 ]" 2 3 1 4 LEU HA 1 4 LEU MD2 0.000 . 2.500 2.486 2.426 2.511 0.011 21 0 "[ . 1 . 2 ]" 2 4 1 4 LEU QB 1 4 LEU MD1 0.000 . 2.500 2.218 2.138 2.305 . 0 0 "[ . 1 . 2 ]" 2 5 1 4 LEU MD2 1 4 LEU HG 0.000 . 2.500 2.124 2.110 2.128 . 0 0 "[ . 1 . 2 ]" 2 6 1 5 LEU HA 1 5 LEU QB 0.000 . 2.500 2.270 2.131 2.535 0.035 1 0 "[ . 1 . 2 ]" 2 7 1 5 LEU HA 1 5 LEU MD2 0.000 . 3.000 2.676 1.856 3.142 0.142 10 0 "[ . 1 . 2 ]" 2 8 1 5 LEU QB 1 5 LEU MD1 0.000 . 2.500 2.168 2.053 2.420 . 0 0 "[ . 1 . 2 ]" 2 9 1 5 LEU QB 1 5 LEU MD2 0.000 . 2.500 2.203 2.038 2.394 . 0 0 "[ . 1 . 2 ]" 2 10 1 5 LEU MD1 1 5 LEU HG 0.000 . 2.500 2.114 2.088 2.128 . 0 0 "[ . 1 . 2 ]" 2 11 1 5 LEU MD2 1 5 LEU HG 0.000 . 2.500 2.098 2.069 2.126 . 0 0 "[ . 1 . 2 ]" 2 12 1 5 LEU MD1 1 7 PHE QE 0.000 . 5.000 2.111 1.766 3.176 . 0 0 "[ . 1 . 2 ]" 2 13 1 5 LEU MD1 1 7 PHE HZ 0.000 . 3.000 3.073 3.019 3.138 0.138 6 0 "[ . 1 . 2 ]" 2 14 1 5 LEU MD1 1 55 ILE MD 0.000 . 5.000 3.019 2.448 4.796 . 0 0 "[ . 1 . 2 ]" 2 15 1 5 LEU HG 1 55 ILE MD 0.000 . 5.000 4.746 3.451 5.050 0.050 23 0 "[ . 1 . 2 ]" 2 16 1 5 LEU MD2 1 57 LYS HA 0.000 . 3.000 2.984 2.471 3.170 0.170 10 0 "[ . 1 . 2 ]" 2 17 1 6 ASP HA 1 6 ASP QB 0.000 . 2.500 2.394 2.184 2.495 . 0 0 "[ . 1 . 2 ]" 2 18 1 7 PHE HA 1 7 PHE QD 0.000 . 3.000 2.948 2.119 3.160 0.160 12 0 "[ . 1 . 2 ]" 2 19 1 7 PHE QB 1 7 PHE QD 0.000 . 2.500 2.158 2.118 2.321 . 0 0 "[ . 1 . 2 ]" 2 20 1 7 PHE HA 1 55 ILE HA 0.000 . 2.500 2.540 2.335 2.610 0.110 1 0 "[ . 1 . 2 ]" 2 21 1 7 PHE QD 1 55 ILE MG 0.000 . 5.000 3.635 2.974 4.183 . 0 0 "[ . 1 . 2 ]" 2 22 1 7 PHE QE 1 55 ILE MD 0.000 . 3.000 2.360 2.035 2.656 . 0 0 "[ . 1 . 2 ]" 2 23 1 7 PHE QE 1 55 ILE MG 0.000 . 5.000 3.173 2.000 3.803 . 0 0 "[ . 1 . 2 ]" 2 24 1 7 PHE HZ 1 55 ILE MG 0.000 . 5.000 3.732 3.496 4.124 . 0 0 "[ . 1 . 2 ]" 2 25 1 7 PHE QD 1 97 LEU HA 0.000 . 5.000 4.211 3.885 4.643 . 0 0 "[ . 1 . 2 ]" 2 26 1 7 PHE QD 1 97 LEU MD1 0.000 . 3.000 2.974 2.552 3.053 0.053 21 0 "[ . 1 . 2 ]" 2 27 1 7 PHE QE 1 97 LEU HA 0.000 . 2.500 2.580 2.525 2.663 0.163 8 0 "[ . 1 . 2 ]" 2 28 1 7 PHE QE 1 97 LEU MD1 0.000 . 3.000 2.516 1.837 3.020 0.020 10 0 "[ . 1 . 2 ]" 2 29 1 7 PHE HZ 1 97 LEU HA 0.000 . 5.000 4.429 4.017 4.700 . 0 0 "[ . 1 . 2 ]" 2 30 1 7 PHE QD 1 100 LYS QE 0.000 . 5.000 3.928 2.200 4.997 . 0 0 "[ . 1 . 2 ]" 2 31 1 8 ASP HA 1 8 ASP QB 0.000 . 2.500 2.498 2.458 2.532 0.032 3 0 "[ . 1 . 2 ]" 2 32 1 8 ASP QB 1 54 VAL MG2 0.000 . 5.000 1.929 1.779 2.235 . 0 0 "[ . 1 . 2 ]" 2 33 1 8 ASP QB 1 56 LEU MD1 0.000 . 5.000 2.592 2.126 2.898 . 0 0 "[ . 1 . 2 ]" 2 34 1 9 ILE HA 1 9 ILE QG 0.000 . 3.000 2.313 2.273 2.344 . 0 0 "[ . 1 . 2 ]" 2 35 1 9 ILE HA 1 9 ILE MG 0.000 . 2.500 2.446 2.403 2.483 . 0 0 "[ . 1 . 2 ]" 2 36 1 9 ILE HB 1 9 ILE MD 0.000 . 3.000 2.336 2.179 2.496 . 0 0 "[ . 1 . 2 ]" 2 37 1 9 ILE HB 1 9 ILE MG 0.000 . 2.500 2.101 2.095 2.114 . 0 0 "[ . 1 . 2 ]" 2 38 1 9 ILE MD 1 9 ILE MG 0.000 . 2.500 2.024 1.679 2.363 . 0 0 "[ . 1 . 2 ]" 2 39 1 9 ILE HA 1 53 MET HA 0.000 . 2.500 2.383 2.164 2.538 0.038 14 0 "[ . 1 . 2 ]" 2 40 1 9 ILE MD 1 53 MET ME 0.000 . 5.000 2.622 1.763 3.262 . 0 0 "[ . 1 . 2 ]" 2 41 1 9 ILE QG 1 53 MET ME 0.000 . 5.000 2.827 2.009 3.702 . 0 0 "[ . 1 . 2 ]" 2 42 1 9 ILE MG 1 53 MET ME 0.000 . 5.000 4.184 3.326 4.990 . 0 0 "[ . 1 . 2 ]" 2 43 1 9 ILE MD 1 104 HIS HD1 0.000 . 5.000 4.123 2.674 5.013 0.013 7 0 "[ . 1 . 2 ]" 2 44 1 10 LEU HA 1 10 LEU QB 0.000 . 2.500 2.348 2.334 2.368 . 0 0 "[ . 1 . 2 ]" 2 45 1 10 LEU HA 1 10 LEU MD2 0.000 . 3.000 2.435 1.877 2.827 . 0 0 "[ . 1 . 2 ]" 2 46 1 10 LEU MD2 1 18 ASN HA 0.000 . 2.500 2.340 1.896 2.540 0.040 18 0 "[ . 1 . 2 ]" 2 47 1 10 LEU MD1 1 21 LEU QB 0.000 . 5.000 2.134 1.657 2.638 . 0 0 "[ . 1 . 2 ]" 2 48 1 10 LEU QB 1 22 LEU MD2 0.000 . 5.000 2.749 2.358 3.089 . 0 0 "[ . 1 . 2 ]" 2 49 1 10 LEU MD1 1 22 LEU MD1 0.000 . 5.000 3.641 2.260 4.607 . 0 0 "[ . 1 . 2 ]" 2 50 1 10 LEU MD1 1 22 LEU MD2 0.000 . 5.000 3.400 2.493 4.104 . 0 0 "[ . 1 . 2 ]" 2 51 1 10 LEU MD2 1 22 LEU MD2 0.000 . 5.000 4.812 4.327 5.021 0.021 15 0 "[ . 1 . 2 ]" 2 52 1 11 THR HA 1 11 THR HB 0.000 . 2.500 2.311 2.285 2.345 . 0 0 "[ . 1 . 2 ]" 2 53 1 11 THR HA 1 11 THR MG 0.000 . 2.500 2.602 2.551 2.643 0.143 6 0 "[ . 1 . 2 ]" 2 54 1 11 THR HB 1 11 THR MG 0.000 . 2.500 2.094 2.085 2.106 . 0 0 "[ . 1 . 2 ]" 2 55 1 11 THR MG 1 51 GLU HA 0.000 . 3.000 3.014 2.954 3.036 0.036 14 0 "[ . 1 . 2 ]" 2 56 1 11 THR MG 1 51 GLU QG 0.000 . 5.000 2.898 2.238 3.454 . 0 0 "[ . 1 . 2 ]" 2 57 1 12 ASN HA 1 12 ASN QB 0.000 . 2.500 2.357 2.189 2.516 0.016 22 0 "[ . 1 . 2 ]" 2 58 1 12 ASN HA 1 22 LEU MD1 0.000 . 2.500 2.510 2.284 2.603 0.103 20 0 "[ . 1 . 2 ]" 2 59 1 13 ASP HA 1 13 ASP QB 0.000 . 2.500 2.431 2.183 2.519 0.019 19 0 "[ . 1 . 2 ]" 2 60 1 15 THR HA 1 15 THR MG 0.000 . 2.500 2.425 2.269 2.536 0.036 10 0 "[ . 1 . 2 ]" 2 61 1 15 THR HB 1 15 THR MG 0.000 . 2.500 2.100 2.073 2.119 . 0 0 "[ . 1 . 2 ]" 2 62 1 16 HIS HA 1 16 HIS QB 0.000 . 2.500 2.405 2.153 2.536 0.036 8 0 "[ . 1 . 2 ]" 2 63 1 17 ARG HA 1 17 ARG QB 0.000 . 2.500 2.168 2.158 2.182 . 0 0 "[ . 1 . 2 ]" 2 64 1 17 ARG QB 1 17 ARG QG 0.000 . 2.500 2.027 2.009 2.053 . 0 0 "[ . 1 . 2 ]" 2 65 1 18 ASN HA 1 18 ASN QB 0.000 . 2.500 2.362 2.301 2.497 . 0 0 "[ . 1 . 2 ]" 2 66 1 19 MET HA 1 19 MET QB 0.000 . 2.500 2.474 2.179 2.513 0.013 5 0 "[ . 1 . 2 ]" 2 67 1 19 MET HA 1 19 MET ME 0.000 . 3.000 1.888 1.852 1.957 . 0 0 "[ . 1 . 2 ]" 2 68 1 19 MET HA 1 19 MET QG 0.000 . 3.000 2.416 2.229 3.172 0.172 24 0 "[ . 1 . 2 ]" 2 69 1 19 MET HA 1 22 LEU MD1 0.000 . 3.000 2.783 2.240 3.027 0.027 2 0 "[ . 1 . 2 ]" 2 70 1 19 MET ME 1 22 LEU MD1 0.000 . 5.000 3.144 2.485 3.725 . 0 0 "[ . 1 . 2 ]" 2 71 1 19 MET ME 1 23 ILE MD 0.000 . 5.000 2.251 1.922 2.634 . 0 0 "[ . 1 . 2 ]" 2 72 1 19 MET QG 1 23 ILE MD 0.000 . 5.000 4.005 1.944 4.337 . 0 0 "[ . 1 . 2 ]" 2 73 1 19 MET ME 1 46 PHE QE 0.000 . 3.000 2.267 1.824 3.012 0.012 6 0 "[ . 1 . 2 ]" 2 74 1 20 LYS HA 1 20 LYS QB 0.000 . 2.500 2.437 2.343 2.532 0.032 1 0 "[ . 1 . 2 ]" 2 75 1 20 LYS HA 1 23 ILE HB 0.000 . 3.000 3.008 2.890 3.040 0.040 24 0 "[ . 1 . 2 ]" 2 76 1 20 LYS HA 1 23 ILE MD 0.000 . 2.500 1.845 1.802 1.931 . 0 0 "[ . 1 . 2 ]" 2 77 1 21 LEU HA 1 21 LEU QB 0.000 . 2.500 2.333 2.309 2.353 . 0 0 "[ . 1 . 2 ]" 2 78 1 21 LEU HA 1 21 LEU MD2 0.000 . 2.500 1.990 1.888 2.421 . 0 0 "[ . 1 . 2 ]" 2 79 1 21 LEU HA 1 21 LEU QD 0.000 . 2.500 1.983 1.884 2.400 . 0 0 "[ . 1 . 2 ]" 2 80 1 21 LEU QB 1 21 LEU QD 0.000 . 2.500 1.939 1.859 1.965 . 0 0 "[ . 1 . 2 ]" 2 81 1 21 LEU MD1 1 56 LEU QD 0.000 . 5.000 2.346 2.006 3.222 . 0 0 "[ . 1 . 2 ]" 2 82 1 21 LEU MD2 1 56 LEU MD2 0.000 . 5.000 2.385 1.826 3.144 . 0 0 "[ . 1 . 2 ]" 2 83 1 21 LEU MD2 1 62 VAL MG1 0.000 . 5.000 3.839 3.642 3.956 . 0 0 "[ . 1 . 2 ]" 2 84 1 22 LEU HA 1 22 LEU MD2 0.000 . 2.500 2.193 1.940 2.510 0.010 19 0 "[ . 1 . 2 ]" 2 85 1 22 LEU QB 1 22 LEU MD1 0.000 . 2.500 2.034 1.948 2.107 . 0 0 "[ . 1 . 2 ]" 2 86 1 22 LEU MD1 1 22 LEU HG 0.000 . 2.500 2.106 2.089 2.127 . 0 0 "[ . 1 . 2 ]" 2 87 1 22 LEU MD2 1 22 LEU HG 0.000 . 2.500 2.113 2.083 2.128 . 0 0 "[ . 1 . 2 ]" 2 88 1 22 LEU HA 1 25 LEU QB 0.000 . 5.000 3.126 2.984 3.215 . 0 0 "[ . 1 . 2 ]" 2 89 1 23 ILE HB 1 23 ILE MD 0.000 . 2.500 2.092 2.074 2.129 . 0 0 "[ . 1 . 2 ]" 2 90 1 23 ILE HB 1 23 ILE MG 0.000 . 2.500 2.124 2.121 2.127 . 0 0 "[ . 1 . 2 ]" 2 91 1 23 ILE QG 1 23 ILE MG 0.000 . 3.000 2.190 2.178 2.208 . 0 0 "[ . 1 . 2 ]" 2 92 1 23 ILE MG 1 26 LYS QE 0.000 . 5.000 4.264 2.846 5.029 0.029 20 0 "[ . 1 . 2 ]" 2 93 1 23 ILE HA 1 46 PHE HZ 0.000 . 2.500 2.447 2.226 2.530 0.030 19 0 "[ . 1 . 2 ]" 2 94 1 24 ASP HA 1 24 ASP QB 0.000 . 2.500 2.454 2.413 2.512 0.012 1 0 "[ . 1 . 2 ]" 2 95 1 24 ASP QB 1 62 VAL MG2 0.000 . 5.000 2.500 2.426 2.580 . 0 0 "[ . 1 . 2 ]" 2 96 1 25 LEU HA 1 25 LEU MD1 0.000 . 2.500 1.906 1.876 1.951 . 0 0 "[ . 1 . 2 ]" 2 97 1 25 LEU MD1 1 25 LEU MD2 0.000 . 2.500 2.047 2.024 2.064 . 0 0 "[ . 1 . 2 ]" 2 98 1 25 LEU MD1 1 25 LEU HG 0.000 . 2.500 2.121 2.113 2.124 . 0 0 "[ . 1 . 2 ]" 2 99 1 25 LEU HA 1 28 ILE MD 0.000 . 2.500 2.141 1.961 2.377 . 0 0 "[ . 1 . 2 ]" 2 100 1 25 LEU MD1 1 28 ILE MD 0.000 . 2.500 2.174 1.961 2.399 . 0 0 "[ . 1 . 2 ]" 2 101 1 25 LEU MD1 1 28 ILE MG 0.000 . 5.000 3.867 3.585 4.107 . 0 0 "[ . 1 . 2 ]" 2 102 1 25 LEU MD1 1 29 PHE QE 0.000 . 5.000 3.226 2.970 3.707 . 0 0 "[ . 1 . 2 ]" 2 103 1 25 LEU MD1 1 29 PHE HZ 0.000 . 5.000 3.238 2.807 3.719 . 0 0 "[ . 1 . 2 ]" 2 104 1 25 LEU MD1 1 54 VAL MG1 0.000 . 3.000 3.021 2.865 3.065 0.065 12 0 "[ . 1 . 2 ]" 2 105 1 25 LEU HA 1 62 VAL MG1 0.000 . 5.000 3.702 3.493 3.868 . 0 0 "[ . 1 . 2 ]" 2 106 1 25 LEU MD1 1 62 VAL MG1 0.000 . 2.500 2.142 1.806 2.470 . 0 0 "[ . 1 . 2 ]" 2 107 1 25 LEU MD1 1 65 GLY QA 0.000 . 3.000 2.229 1.885 2.756 . 0 0 "[ . 1 . 2 ]" 2 108 1 26 LYS HA 1 29 PHE QD 0.000 . 3.000 3.017 2.892 3.072 0.072 21 0 "[ . 1 . 2 ]" 2 109 1 26 LYS HA 1 41 ILE MG 0.000 . 5.000 1.776 1.729 1.813 . 0 0 "[ . 1 . 2 ]" 2 110 1 27 ASN HA 1 27 ASN QB 0.000 . 2.500 2.256 2.172 2.450 . 0 0 "[ . 1 . 2 ]" 2 111 1 28 ILE HA 1 28 ILE QG 0.000 . 2.500 2.365 2.252 2.403 . 0 0 "[ . 1 . 2 ]" 2 112 1 28 ILE HA 1 28 ILE MG 0.000 . 2.500 2.444 2.379 2.568 0.068 10 0 "[ . 1 . 2 ]" 2 113 1 28 ILE HB 1 28 ILE MD 0.000 . 2.500 2.201 2.141 2.370 . 0 0 "[ . 1 . 2 ]" 2 114 1 28 ILE HB 1 28 ILE MG 0.000 . 2.500 2.096 2.084 2.125 . 0 0 "[ . 1 . 2 ]" 2 115 1 28 ILE MG 1 29 PHE QD 0.000 . 5.000 2.425 1.921 2.708 . 0 0 "[ . 1 . 2 ]" 2 116 1 28 ILE MG 1 32 GLN QG 0.000 . 5.000 3.359 3.112 3.564 . 0 0 "[ . 1 . 2 ]" 2 117 1 28 ILE MD 1 62 VAL MG1 0.000 . 2.500 2.061 1.826 2.269 . 0 0 "[ . 1 . 2 ]" 2 118 1 28 ILE MD 1 63 ILE HA 0.000 . 3.000 3.104 3.084 3.128 0.128 3 0 "[ . 1 . 2 ]" 2 119 1 28 ILE MG 1 83 ALA MB 0.000 . 2.500 2.199 1.833 2.516 0.016 5 0 "[ . 1 . 2 ]" 2 120 1 28 ILE MD 1 85 THR HB 0.000 . 3.000 2.772 2.273 3.028 0.028 19 0 "[ . 1 . 2 ]" 2 121 1 28 ILE MD 1 85 THR MG 0.000 . 5.000 4.021 3.617 4.283 . 0 0 "[ . 1 . 2 ]" 2 122 1 28 ILE MG 1 85 THR HA 0.000 . 2.500 1.961 1.799 2.229 . 0 0 "[ . 1 . 2 ]" 2 123 1 28 ILE MG 1 85 THR HB 0.000 . 3.000 3.052 3.028 3.117 0.117 10 0 "[ . 1 . 2 ]" 2 124 1 28 ILE MG 1 85 THR MG 0.000 . 5.000 4.002 3.949 4.094 . 0 0 "[ . 1 . 2 ]" 2 125 1 29 PHE HA 1 29 PHE QD 0.000 . 2.500 2.327 2.180 2.435 . 0 0 "[ . 1 . 2 ]" 2 126 1 29 PHE HA 1 29 PHE QE 0.000 . 5.000 4.638 4.514 4.727 . 0 0 "[ . 1 . 2 ]" 2 127 1 29 PHE QB 1 29 PHE QD 0.000 . 2.500 2.191 2.153 2.227 . 0 0 "[ . 1 . 2 ]" 2 128 1 29 PHE HA 1 33 LEU MD1 0.000 . 5.000 2.733 2.237 3.129 . 0 0 "[ . 1 . 2 ]" 2 129 1 29 PHE QB 1 41 ILE MD 0.000 . 5.000 2.471 1.865 2.850 . 0 0 "[ . 1 . 2 ]" 2 130 1 29 PHE QB 1 41 ILE MG 0.000 . 5.000 2.647 2.520 2.782 . 0 0 "[ . 1 . 2 ]" 2 131 1 29 PHE QD 1 41 ILE MG 0.000 . 2.500 1.684 1.657 1.716 . 0 0 "[ . 1 . 2 ]" 2 132 1 29 PHE QE 1 41 ILE MG 0.000 . 2.500 2.709 2.687 2.748 0.248 23 0 "[ . 1 . 2 ]" 2 133 1 29 PHE QD 1 45 VAL MG2 0.000 . 3.000 3.087 3.037 3.129 0.129 4 0 "[ . 1 . 2 ]" 2 134 1 29 PHE QE 1 45 VAL MG2 0.000 . 3.000 2.377 2.242 2.496 . 0 0 "[ . 1 . 2 ]" 2 135 1 29 PHE QE 1 81 PHE QD 0.000 . 5.000 4.954 4.665 5.115 0.115 8 0 "[ . 1 . 2 ]" 2 136 1 29 PHE HA 1 83 ALA MB 0.000 . 3.000 2.767 2.524 2.929 . 0 0 "[ . 1 . 2 ]" 2 137 1 29 PHE QD 1 83 ALA MB 0.000 . 2.500 1.731 1.623 1.783 . 0 0 "[ . 1 . 2 ]" 2 138 1 29 PHE QE 1 83 ALA MB 0.000 . 2.500 2.686 2.652 2.744 0.244 18 0 "[ . 1 . 2 ]" 2 139 1 30 SER HA 1 30 SER QB 0.000 . 2.500 2.374 2.241 2.505 0.005 11 0 "[ . 1 . 2 ]" 2 140 1 30 SER HA 1 41 ILE MD 0.000 . 2.500 2.303 1.952 2.521 0.021 1 0 "[ . 1 . 2 ]" 2 141 1 30 SER QB 1 41 ILE MD 0.000 . 2.500 2.076 1.867 2.502 0.002 23 0 "[ . 1 . 2 ]" 2 142 1 31 ARG HA 1 31 ARG QD 0.000 . 5.000 3.099 2.184 4.001 . 0 0 "[ . 1 . 2 ]" 2 143 1 31 ARG HA 1 31 ARG QG 0.000 . 2.500 2.270 2.089 2.504 0.004 12 0 "[ . 1 . 2 ]" 2 144 1 31 ARG QB 1 31 ARG QD 0.000 . 3.000 2.116 1.948 2.530 . 0 0 "[ . 1 . 2 ]" 2 145 1 31 ARG QD 1 31 ARG QG 0.000 . 2.500 2.041 2.002 2.085 . 0 0 "[ . 1 . 2 ]" 2 146 1 32 GLN QB 1 83 ALA MB 0.000 . 5.000 3.839 3.535 4.060 . 0 0 "[ . 1 . 2 ]" 2 147 1 33 LEU HA 1 33 LEU MD2 0.000 . 2.500 2.190 1.975 2.458 . 0 0 "[ . 1 . 2 ]" 2 148 1 33 LEU MD1 1 33 LEU MD2 0.000 . 2.500 2.021 1.944 2.093 . 0 0 "[ . 1 . 2 ]" 2 149 1 33 LEU MD1 1 33 LEU HG 0.000 . 2.500 2.114 2.091 2.131 . 0 0 "[ . 1 . 2 ]" 2 150 1 33 LEU MD2 1 33 LEU HG 0.000 . 2.500 2.095 2.081 2.117 . 0 0 "[ . 1 . 2 ]" 2 151 1 33 LEU HA 1 34 PRO QD 0.000 . 2.500 2.008 1.728 2.207 . 0 0 "[ . 1 . 2 ]" 2 152 1 33 LEU MD1 1 36 MET ME 0.000 . 5.000 2.525 1.733 4.587 . 0 0 "[ . 1 . 2 ]" 2 153 1 33 LEU MD2 1 36 MET ME 0.000 . 5.000 3.218 1.918 5.042 0.042 4 0 "[ . 1 . 2 ]" 2 154 1 33 LEU MD1 1 81 PHE QD 0.000 . 2.500 2.620 2.585 2.668 0.168 8 0 "[ . 1 . 2 ]" 2 155 1 33 LEU MD2 1 120 PHE QE 0.000 . 5.000 3.221 2.969 3.797 . 0 0 "[ . 1 . 2 ]" 2 156 1 33 LEU MD2 1 120 PHE HZ 0.000 . 5.000 4.993 4.714 5.037 0.037 15 0 "[ . 1 . 2 ]" 2 157 1 34 PRO HA 1 34 PRO QB 0.000 . 2.500 2.184 2.173 2.244 . 0 0 "[ . 1 . 2 ]" 2 158 1 35 LYS HA 1 35 LYS QB 0.000 . 2.500 2.414 2.333 2.521 0.021 1 0 "[ . 1 . 2 ]" 2 159 1 35 LYS HA 1 35 LYS QD 0.000 . 5.000 3.344 2.119 4.071 . 0 0 "[ . 1 . 2 ]" 2 160 1 35 LYS HA 1 35 LYS QG 0.000 . 2.500 2.393 2.119 2.515 0.015 17 0 "[ . 1 . 2 ]" 2 161 1 36 MET HA 1 36 MET QB 0.000 . 2.500 2.472 2.332 2.536 0.036 7 0 "[ . 1 . 2 ]" 2 162 1 36 MET HA 1 36 MET ME 0.000 . 5.000 3.849 2.178 4.851 . 0 0 "[ . 1 . 2 ]" 2 163 1 36 MET HA 1 37 PRO QD 0.000 . 2.500 1.964 1.893 2.054 . 0 0 "[ . 1 . 2 ]" 2 164 1 36 MET QB 1 41 ILE MD 0.000 . 5.000 2.287 1.968 2.765 . 0 0 "[ . 1 . 2 ]" 2 165 1 36 MET ME 1 41 ILE MD 0.000 . 5.000 3.642 1.765 4.964 . 0 0 "[ . 1 . 2 ]" 2 166 1 37 PRO HA 1 37 PRO QB 0.000 . 2.500 2.220 2.180 2.243 . 0 0 "[ . 1 . 2 ]" 2 167 1 38 LYS HA 1 38 LYS QB 0.000 . 2.500 2.351 2.319 2.373 . 0 0 "[ . 1 . 2 ]" 2 168 1 38 LYS HA 1 38 LYS QG 0.000 . 2.500 2.460 2.342 2.550 0.050 4 0 "[ . 1 . 2 ]" 2 169 1 38 LYS QD 1 38 LYS QE 0.000 . 2.500 2.045 1.990 2.091 . 0 0 "[ . 1 . 2 ]" 2 170 1 38 LYS QE 1 38 LYS QG 0.000 . 2.500 2.148 1.942 2.454 . 0 0 "[ . 1 . 2 ]" 2 171 1 38 LYS HA 1 41 ILE MD 0.000 . 5.000 2.987 2.600 3.372 . 0 0 "[ . 1 . 2 ]" 2 172 1 38 LYS HA 1 41 ILE MG 0.000 . 5.000 4.867 4.476 5.026 0.026 6 0 "[ . 1 . 2 ]" 2 173 1 39 GLU HA 1 39 GLU QB 0.000 . 2.500 2.436 2.348 2.538 0.038 10 0 "[ . 1 . 2 ]" 2 174 1 39 GLU HA 1 39 GLU QG 0.000 . 3.000 2.370 2.020 2.940 . 0 0 "[ . 1 . 2 ]" 2 175 1 39 GLU HA 1 42 VAL MG1 0.000 . 3.000 3.081 3.058 3.108 0.108 8 0 "[ . 1 . 2 ]" 2 176 1 39 GLU HA 1 42 VAL MG2 0.000 . 3.000 2.648 2.412 2.926 . 0 0 "[ . 1 . 2 ]" 2 177 1 40 TYR HA 1 40 TYR QB 0.000 . 2.500 2.465 2.364 2.513 0.013 12 0 "[ . 1 . 2 ]" 2 178 1 40 TYR HA 1 40 TYR QD 0.000 . 2.500 2.246 1.857 2.523 0.023 18 0 "[ . 1 . 2 ]" 2 179 1 40 TYR QB 1 40 TYR QD 0.000 . 2.500 2.225 2.187 2.286 . 0 0 "[ . 1 . 2 ]" 2 180 1 40 TYR HA 1 43 LYS QB 0.000 . 2.500 2.553 2.511 2.579 0.079 7 0 "[ . 1 . 2 ]" 2 181 1 40 TYR QD 1 44 LEU QD 0.000 . 5.000 2.476 1.915 3.194 . 0 0 "[ . 1 . 2 ]" 2 182 1 40 TYR QE 1 44 LEU QD 0.000 . 2.500 1.988 1.746 2.476 . 0 0 "[ . 1 . 2 ]" 2 183 1 41 ILE HA 1 41 ILE MG 0.000 . 2.500 2.501 2.463 2.529 0.029 23 0 "[ . 1 . 2 ]" 2 184 1 41 ILE HB 1 41 ILE MD 0.000 . 3.000 2.120 1.996 2.220 . 0 0 "[ . 1 . 2 ]" 2 185 1 41 ILE HB 1 41 ILE MG 0.000 . 2.500 2.128 2.127 2.130 . 0 0 "[ . 1 . 2 ]" 2 186 1 41 ILE MG 1 45 VAL MG2 0.000 . 5.000 1.715 1.688 1.737 . 0 0 "[ . 1 . 2 ]" 2 187 1 42 VAL HA 1 42 VAL HB 0.000 . 3.000 3.014 3.009 3.020 0.020 3 0 "[ . 1 . 2 ]" 2 188 1 42 VAL HA 1 42 VAL MG1 0.000 . 2.500 2.530 2.488 2.562 0.062 24 0 "[ . 1 . 2 ]" 2 189 1 42 VAL HA 1 42 VAL MG2 0.000 . 2.500 2.285 2.232 2.331 . 0 0 "[ . 1 . 2 ]" 2 190 1 42 VAL HB 1 42 VAL MG1 0.000 . 2.500 2.111 2.082 2.128 . 0 0 "[ . 1 . 2 ]" 2 191 1 42 VAL HB 1 42 VAL MG2 0.000 . 2.500 2.091 2.085 2.105 . 0 0 "[ . 1 . 2 ]" 2 192 1 42 VAL MG1 1 43 LYS HA 0.000 . 5.000 3.289 3.161 3.513 . 0 0 "[ . 1 . 2 ]" 2 193 1 42 VAL MG1 1 46 PHE QD 0.000 . 2.500 1.937 1.832 2.143 . 0 0 "[ . 1 . 2 ]" 2 194 1 42 VAL MG1 1 46 PHE QE 0.000 . 3.000 2.936 2.635 3.040 0.040 8 0 "[ . 1 . 2 ]" 2 195 1 42 VAL MG2 1 46 PHE QD 0.000 . 5.000 3.279 3.048 3.729 . 0 0 "[ . 1 . 2 ]" 2 196 1 42 VAL MG2 1 46 PHE QE 0.000 . 5.000 2.775 2.494 3.163 . 0 0 "[ . 1 . 2 ]" 2 197 1 43 LYS HA 1 43 LYS QB 0.000 . 2.500 2.508 2.310 2.541 0.041 6 0 "[ . 1 . 2 ]" 2 198 1 43 LYS HA 1 43 LYS QG 0.000 . 2.500 2.321 2.027 2.581 0.081 3 0 "[ . 1 . 2 ]" 2 199 1 43 LYS QB 1 43 LYS QG 0.000 . 2.500 2.034 1.987 2.087 . 0 0 "[ . 1 . 2 ]" 2 200 1 44 LEU HA 1 44 LEU QB 0.000 . 2.500 2.329 2.297 2.438 . 0 0 "[ . 1 . 2 ]" 2 201 1 44 LEU HA 1 44 LEU QD 0.000 . 2.500 2.121 1.905 2.341 . 0 0 "[ . 1 . 2 ]" 2 202 1 44 LEU QB 1 44 LEU QD 0.000 . 2.500 1.927 1.871 1.970 . 0 0 "[ . 1 . 2 ]" 2 203 1 44 LEU QD 1 80 ALA MB 0.000 . 5.000 3.605 3.081 3.977 . 0 0 "[ . 1 . 2 ]" 2 204 1 44 LEU QD 1 81 PHE QE 0.000 . 2.500 2.607 2.553 2.649 0.149 4 0 "[ . 1 . 2 ]" 2 205 1 45 VAL HA 1 45 VAL MG1 0.000 . 2.500 2.413 2.350 2.473 . 0 0 "[ . 1 . 2 ]" 2 206 1 45 VAL HA 1 45 VAL MG2 0.000 . 2.500 2.368 2.309 2.462 . 0 0 "[ . 1 . 2 ]" 2 207 1 45 VAL HB 1 45 VAL MG1 0.000 . 2.500 2.115 2.101 2.130 . 0 0 "[ . 1 . 2 ]" 2 208 1 45 VAL HB 1 45 VAL MG2 0.000 . 2.500 2.129 2.117 2.134 . 0 0 "[ . 1 . 2 ]" 2 209 1 45 VAL MG1 1 45 VAL MG2 0.000 . 2.500 2.081 2.063 2.092 . 0 0 "[ . 1 . 2 ]" 2 210 1 45 VAL MG2 1 81 PHE QD 0.000 . 5.000 4.794 4.574 5.027 0.027 20 0 "[ . 1 . 2 ]" 2 211 1 46 PHE HA 1 46 PHE QB 0.000 . 2.500 2.356 2.323 2.392 . 0 0 "[ . 1 . 2 ]" 2 212 1 46 PHE HA 1 46 PHE QD 0.000 . 3.000 2.470 2.003 2.843 . 0 0 "[ . 1 . 2 ]" 2 213 1 46 PHE QB 1 46 PHE QD 0.000 . 2.500 2.175 2.119 2.314 . 0 0 "[ . 1 . 2 ]" 2 214 1 47 ASP HA 1 47 ASP QB 0.000 . 2.500 2.494 2.183 2.538 0.038 15 0 "[ . 1 . 2 ]" 2 215 1 48 ARG HA 1 48 ARG QD 0.000 . 5.000 3.595 2.512 4.522 . 0 0 "[ . 1 . 2 ]" 2 216 1 48 ARG QD 1 48 ARG QG 0.000 . 2.500 2.037 2.004 2.086 . 0 0 "[ . 1 . 2 ]" 2 217 1 50 HIS HA 1 50 HIS QB 0.000 . 2.500 2.296 2.171 2.539 0.039 12 0 "[ . 1 . 2 ]" 2 218 1 51 GLU HA 1 51 GLU QG 0.000 . 2.500 2.232 2.006 2.456 . 0 0 "[ . 1 . 2 ]" 2 219 1 52 SER HA 1 67 CYS HA 0.000 . 2.500 2.152 1.888 2.547 0.047 10 0 "[ . 1 . 2 ]" 2 220 1 53 MET HA 1 53 MET ME 0.000 . 5.000 4.068 3.597 4.690 . 0 0 "[ . 1 . 2 ]" 2 221 1 53 MET ME 1 101 PHE HA 0.000 . 5.000 4.287 3.074 5.012 0.012 24 0 "[ . 1 . 2 ]" 2 222 1 54 VAL HA 1 54 VAL HB 0.000 . 2.500 2.283 2.266 2.310 . 0 0 "[ . 1 . 2 ]" 2 223 1 54 VAL HA 1 54 VAL MG1 0.000 . 2.500 2.556 2.506 2.597 0.097 19 0 "[ . 1 . 2 ]" 2 224 1 54 VAL HA 1 54 VAL MG2 0.000 . 3.000 3.140 3.123 3.154 0.154 11 0 "[ . 1 . 2 ]" 2 225 1 54 VAL HB 1 54 VAL MG1 0.000 . 2.500 2.117 2.103 2.123 . 0 0 "[ . 1 . 2 ]" 2 226 1 54 VAL HB 1 54 VAL MG2 0.000 . 2.500 2.120 2.092 2.129 . 0 0 "[ . 1 . 2 ]" 2 227 1 54 VAL MG2 1 56 LEU MD1 0.000 . 5.000 3.153 2.994 3.405 . 0 0 "[ . 1 . 2 ]" 2 228 1 54 VAL MG2 1 56 LEU MD2 0.000 . 5.000 2.128 1.799 2.370 . 0 0 "[ . 1 . 2 ]" 2 229 1 54 VAL MG2 1 56 LEU HG 0.000 . 3.000 2.561 2.409 2.758 . 0 0 "[ . 1 . 2 ]" 2 230 1 54 VAL MG2 1 56 LEU QD 0.000 . 5.000 2.094 1.787 2.311 . 0 0 "[ . 1 . 2 ]" 2 231 1 54 VAL HB 1 62 VAL MG1 0.000 . 5.000 3.047 2.692 3.462 . 0 0 "[ . 1 . 2 ]" 2 232 1 54 VAL HB 1 62 VAL MG2 0.000 . 5.000 3.186 2.853 3.395 . 0 0 "[ . 1 . 2 ]" 2 233 1 54 VAL MG2 1 62 VAL MG2 0.000 . 2.500 2.508 2.332 2.581 0.081 8 0 "[ . 1 . 2 ]" 2 234 1 54 VAL HA 1 65 GLY QA 0.000 . 5.000 1.826 1.715 1.944 . 0 0 "[ . 1 . 2 ]" 2 235 1 55 ILE HA 1 55 ILE MD 0.000 . 3.000 2.458 2.089 2.861 . 0 0 "[ . 1 . 2 ]" 2 236 1 55 ILE HA 1 55 ILE MG 0.000 . 2.500 2.215 2.096 2.390 . 0 0 "[ . 1 . 2 ]" 2 237 1 56 LEU HA 1 56 LEU QB 0.000 . 2.500 2.305 2.274 2.363 . 0 0 "[ . 1 . 2 ]" 2 238 1 56 LEU HA 1 56 LEU MD2 0.000 . 2.500 2.172 1.944 2.356 . 0 0 "[ . 1 . 2 ]" 2 239 1 56 LEU QB 1 56 LEU MD1 0.000 . 2.500 2.040 2.004 2.078 . 0 0 "[ . 1 . 2 ]" 2 240 1 56 LEU QB 1 56 LEU MD2 0.000 . 2.500 2.243 2.154 2.331 . 0 0 "[ . 1 . 2 ]" 2 241 1 56 LEU QB 1 56 LEU HG 0.000 . 2.500 2.401 2.372 2.432 . 0 0 "[ . 1 . 2 ]" 2 242 1 56 LEU QB 1 56 LEU QD 0.000 . 2.500 1.892 1.855 1.942 . 0 0 "[ . 1 . 2 ]" 2 243 1 56 LEU MD1 1 56 LEU HG 0.000 . 2.500 2.084 2.080 2.092 . 0 0 "[ . 1 . 2 ]" 2 244 1 56 LEU MD2 1 56 LEU HG 0.000 . 2.500 2.120 2.090 2.126 . 0 0 "[ . 1 . 2 ]" 2 245 1 56 LEU MD1 1 59 LYS HA 0.000 . 3.000 3.016 2.876 3.046 0.046 21 0 "[ . 1 . 2 ]" 2 246 1 56 LEU MD2 1 60 GLN HA 0.000 . 3.000 2.086 1.951 2.404 . 0 0 "[ . 1 . 2 ]" 2 247 1 56 LEU HA 1 62 VAL HA 0.000 . 2.500 2.591 2.520 2.656 0.156 14 0 "[ . 1 . 2 ]" 2 248 1 56 LEU MD1 1 62 VAL MG2 0.000 . 5.000 4.215 4.017 4.389 . 0 0 "[ . 1 . 2 ]" 2 249 1 56 LEU MD2 1 62 VAL HA 0.000 . 2.500 2.364 2.286 2.440 . 0 0 "[ . 1 . 2 ]" 2 250 1 56 LEU MD2 1 62 VAL HB 0.000 . 5.000 4.179 3.971 4.346 . 0 0 "[ . 1 . 2 ]" 2 251 1 56 LEU MD2 1 62 VAL MG2 0.000 . 2.500 2.161 1.999 2.329 . 0 0 "[ . 1 . 2 ]" 2 252 1 57 LYS HA 1 57 LYS QB 0.000 . 2.500 2.330 2.175 2.424 . 0 0 "[ . 1 . 2 ]" 2 253 1 57 LYS HA 1 57 LYS QD 0.000 . 5.000 3.974 2.686 4.494 . 0 0 "[ . 1 . 2 ]" 2 254 1 57 LYS QB 1 57 LYS QD 0.000 . 2.500 2.058 1.909 2.324 . 0 0 "[ . 1 . 2 ]" 2 255 1 57 LYS QB 1 57 LYS QG 0.000 . 2.500 2.046 2.022 2.071 . 0 0 "[ . 1 . 2 ]" 2 256 1 57 LYS QD 1 57 LYS QE 0.000 . 2.500 2.044 1.980 2.089 . 0 0 "[ . 1 . 2 ]" 2 257 1 57 LYS QD 1 57 LYS QG 0.000 . 2.500 2.052 2.014 2.082 . 0 0 "[ . 1 . 2 ]" 2 258 1 57 LYS QE 1 57 LYS QG 0.000 . 2.500 2.123 1.947 2.404 . 0 0 "[ . 1 . 2 ]" 2 259 1 57 LYS QB 1 63 ILE MD 0.000 . 2.500 2.411 2.150 2.546 0.046 5 0 "[ . 1 . 2 ]" 2 260 1 57 LYS QB 1 63 ILE MG 0.000 . 2.500 2.517 2.466 2.558 0.058 24 0 "[ . 1 . 2 ]" 2 261 1 57 LYS QD 1 63 ILE MD 0.000 . 2.500 2.297 1.885 2.518 0.018 11 0 "[ . 1 . 2 ]" 2 262 1 57 LYS QD 1 63 ILE MG 0.000 . 5.000 3.899 3.311 4.184 . 0 0 "[ . 1 . 2 ]" 2 263 1 57 LYS QG 1 63 ILE MD 0.000 . 3.000 2.950 2.358 3.022 0.022 11 0 "[ . 1 . 2 ]" 2 264 1 57 LYS QG 1 63 ILE MG 0.000 . 5.000 3.715 3.206 4.277 . 0 0 "[ . 1 . 2 ]" 2 265 1 58 ASN HA 1 58 ASN QB 0.000 . 2.500 2.522 2.499 2.540 0.040 3 0 "[ . 1 . 2 ]" 2 266 1 59 LYS HA 1 59 LYS QB 0.000 . 2.500 2.277 2.264 2.284 . 0 0 "[ . 1 . 2 ]" 2 267 1 59 LYS HA 1 59 LYS QD 0.000 . 5.000 3.644 3.474 4.071 . 0 0 "[ . 1 . 2 ]" 2 268 1 59 LYS HA 1 59 LYS QG 0.000 . 2.500 2.535 2.523 2.561 0.061 24 0 "[ . 1 . 2 ]" 2 269 1 59 LYS QB 1 59 LYS QG 0.000 . 2.500 2.056 2.043 2.065 . 0 0 "[ . 1 . 2 ]" 2 270 1 60 GLN HA 1 60 GLN QB 0.000 . 2.500 2.287 2.145 2.379 . 0 0 "[ . 1 . 2 ]" 2 271 1 60 GLN HA 1 60 GLN QG 0.000 . 3.000 2.830 2.388 3.134 0.134 8 0 "[ . 1 . 2 ]" 2 272 1 61 LYS HA 1 61 LYS QB 0.000 . 2.500 2.392 2.365 2.528 0.028 24 0 "[ . 1 . 2 ]" 2 273 1 61 LYS HA 1 61 LYS QD 0.000 . 5.000 3.998 3.553 4.184 . 0 0 "[ . 1 . 2 ]" 2 274 1 61 LYS HA 1 61 LYS QG 0.000 . 2.500 2.358 2.057 2.461 . 0 0 "[ . 1 . 2 ]" 2 275 1 61 LYS QD 1 61 LYS QG 0.000 . 2.500 2.054 2.021 2.090 . 0 0 "[ . 1 . 2 ]" 2 276 1 62 VAL HA 1 62 VAL HB 0.000 . 3.000 3.020 3.013 3.024 0.024 11 0 "[ . 1 . 2 ]" 2 277 1 62 VAL HA 1 62 VAL MG1 0.000 . 2.500 2.427 2.367 2.481 . 0 0 "[ . 1 . 2 ]" 2 278 1 62 VAL HA 1 62 VAL MG2 0.000 . 2.500 2.351 2.282 2.398 . 0 0 "[ . 1 . 2 ]" 2 279 1 62 VAL HB 1 62 VAL MG1 0.000 . 2.500 2.116 2.107 2.128 . 0 0 "[ . 1 . 2 ]" 2 280 1 62 VAL HB 1 62 VAL MG2 0.000 . 2.500 2.125 2.122 2.128 . 0 0 "[ . 1 . 2 ]" 2 281 1 62 VAL MG1 1 62 VAL MG2 0.000 . 2.500 2.067 2.041 2.084 . 0 0 "[ . 1 . 2 ]" 2 282 1 63 ILE HA 1 63 ILE HB 0.000 . 3.000 2.558 2.469 2.640 . 0 0 "[ . 1 . 2 ]" 2 283 1 63 ILE HA 1 63 ILE QG 0.000 . 3.000 2.257 2.173 2.323 . 0 0 "[ . 1 . 2 ]" 2 284 1 63 ILE HA 1 63 ILE MG 0.000 . 3.000 3.181 3.153 3.190 0.190 4 0 "[ . 1 . 2 ]" 2 285 1 63 ILE HB 1 63 ILE MD 0.000 . 2.500 2.354 2.241 2.494 . 0 0 "[ . 1 . 2 ]" 2 286 1 63 ILE HB 1 63 ILE QG 0.000 . 2.500 2.366 2.326 2.427 . 0 0 "[ . 1 . 2 ]" 2 287 1 63 ILE HB 1 63 ILE MG 0.000 . 2.500 2.117 2.100 2.121 . 0 0 "[ . 1 . 2 ]" 2 288 1 63 ILE QG 1 63 ILE MG 0.000 . 2.500 2.295 2.177 2.375 . 0 0 "[ . 1 . 2 ]" 2 289 1 63 ILE MD 1 84 VAL MG1 0.000 . 5.000 2.472 2.161 2.843 . 0 0 "[ . 1 . 2 ]" 2 290 1 63 ILE MG 1 84 VAL MG1 0.000 . 5.000 2.623 1.941 3.326 . 0 0 "[ . 1 . 2 ]" 2 291 1 63 ILE HA 1 85 THR MG 0.000 . 5.000 3.072 2.907 3.304 . 0 0 "[ . 1 . 2 ]" 2 292 1 63 ILE MD 1 85 THR MG 0.000 . 5.000 3.396 3.140 3.654 . 0 0 "[ . 1 . 2 ]" 2 293 1 63 ILE MG 1 85 THR MG 0.000 . 5.000 4.428 4.138 4.681 . 0 0 "[ . 1 . 2 ]" 2 294 1 63 ILE MD 1 93 TYR QD 0.000 . 2.500 2.365 1.949 2.513 0.013 10 0 "[ . 1 . 2 ]" 2 295 1 63 ILE MD 1 93 TYR QE 0.000 . 2.500 2.407 2.024 2.522 0.022 3 0 "[ . 1 . 2 ]" 2 296 1 64 GLY QA 1 84 VAL HA 0.000 . 2.500 1.912 1.843 2.036 . 0 0 "[ . 1 . 2 ]" 2 297 1 64 GLY QA 1 84 VAL MG2 0.000 . 5.000 2.108 1.917 2.417 . 0 0 "[ . 1 . 2 ]" 2 298 1 66 ILE MD 1 79 VAL MG1 0.000 . 2.500 1.784 1.556 2.016 . 0 0 "[ . 1 . 2 ]" 2 299 1 66 ILE MD 1 79 VAL MG2 0.000 . 3.000 3.017 2.498 3.178 0.178 22 0 "[ . 1 . 2 ]" 2 300 1 66 ILE MG 1 79 VAL MG2 0.000 . 5.000 5.074 5.023 5.131 0.131 12 0 "[ . 1 . 2 ]" 2 301 1 66 ILE MD 1 82 LEU MD1 0.000 . 5.000 3.496 2.671 4.972 . 0 0 "[ . 1 . 2 ]" 2 302 1 66 ILE MD 1 98 MET ME 0.000 . 5.000 2.953 1.965 5.053 0.053 12 0 "[ . 1 . 2 ]" 2 303 1 66 ILE MD 1 101 PHE QD 0.000 . 5.000 2.034 1.759 2.319 . 0 0 "[ . 1 . 2 ]" 2 304 1 68 PHE HA 1 68 PHE QB 0.000 . 2.500 2.268 2.168 2.510 0.010 15 0 "[ . 1 . 2 ]" 2 305 1 68 PHE HA 1 79 VAL HA 0.000 . 5.000 3.155 2.069 4.899 . 0 0 "[ . 1 . 2 ]" 2 306 1 70 GLN HA 1 70 GLN QB 0.000 . 2.500 2.184 2.147 2.274 . 0 0 "[ . 1 . 2 ]" 2 307 1 70 GLN HA 1 77 ALA HA 0.000 . 2.500 1.989 1.804 2.529 0.029 2 0 "[ . 1 . 2 ]" 2 308 1 70 GLN HA 1 77 ALA MB 0.000 . 2.500 1.854 1.776 2.017 . 0 0 "[ . 1 . 2 ]" 2 309 1 70 GLN QB 1 77 ALA MB 0.000 . 2.500 1.838 1.650 2.552 0.052 11 0 "[ . 1 . 2 ]" 2 310 1 70 GLN QB 1 110 ILE MD 0.000 . 5.000 3.267 3.076 3.502 . 0 0 "[ . 1 . 2 ]" 2 311 1 71 TYR HA 1 71 TYR QD 0.000 . 2.500 2.613 2.550 2.659 0.159 22 0 "[ . 1 . 2 ]" 2 312 1 71 TYR HA 1 71 TYR QE 0.000 . 5.000 4.485 4.429 4.581 . 0 0 "[ . 1 . 2 ]" 2 313 1 71 TYR QB 1 71 TYR QD 0.000 . 2.500 2.215 2.134 2.249 . 0 0 "[ . 1 . 2 ]" 2 314 1 71 TYR QD 1 77 ALA HA 0.000 . 3.000 3.059 3.021 3.089 0.089 14 0 "[ . 1 . 2 ]" 2 315 1 72 LYS HA 1 72 LYS QB 0.000 . 2.500 2.246 2.189 2.524 0.024 6 0 "[ . 1 . 2 ]" 2 316 1 72 LYS HA 1 72 LYS QD 0.000 . 5.000 3.452 1.889 3.765 . 0 0 "[ . 1 . 2 ]" 2 317 1 72 LYS HA 1 72 LYS QG 0.000 . 2.500 2.658 2.513 2.718 0.218 9 0 "[ . 1 . 2 ]" 2 318 1 72 LYS QB 1 73 PRO QD 0.000 . 5.000 1.748 1.598 1.837 . 0 0 "[ . 1 . 2 ]" 2 319 1 72 LYS HA 1 110 ILE MD 0.000 . 2.500 1.822 1.699 1.923 . 0 0 "[ . 1 . 2 ]" 2 320 1 72 LYS QB 1 110 ILE MD 0.000 . 5.000 3.111 2.735 3.849 . 0 0 "[ . 1 . 2 ]" 2 321 1 72 LYS QG 1 110 ILE MD 0.000 . 5.000 2.738 2.184 3.287 . 0 0 "[ . 1 . 2 ]" 2 322 1 73 PRO HA 1 73 PRO QB 0.000 . 2.500 2.196 2.184 2.227 . 0 0 "[ . 1 . 2 ]" 2 323 1 74 GLN HA 1 74 GLN QB 0.000 . 2.500 2.508 2.484 2.537 0.037 20 0 "[ . 1 . 2 ]" 2 324 1 74 GLN HA 1 74 GLN QG 0.000 . 3.000 2.298 2.066 2.675 . 0 0 "[ . 1 . 2 ]" 2 325 1 75 ARG HA 1 75 ARG QD 0.000 . 5.000 3.770 3.452 4.118 . 0 0 "[ . 1 . 2 ]" 2 326 1 75 ARG HA 1 75 ARG QG 0.000 . 2.500 2.583 2.554 2.606 0.106 7 0 "[ . 1 . 2 ]" 2 327 1 75 ARG HA 1 110 ILE MD 0.000 . 2.500 2.392 1.957 2.545 0.045 7 0 "[ . 1 . 2 ]" 2 328 1 76 PHE QB 1 76 PHE QD 0.000 . 2.500 2.136 2.121 2.225 . 0 0 "[ . 1 . 2 ]" 2 329 1 76 PHE HA 1 110 ILE MG 0.000 . 2.500 2.486 2.217 2.597 0.097 24 0 "[ . 1 . 2 ]" 2 330 1 76 PHE QD 1 114 LEU MD1 0.000 . 5.000 2.825 1.972 4.094 . 0 0 "[ . 1 . 2 ]" 2 331 1 76 PHE QE 1 114 LEU MD1 0.000 . 5.000 3.221 2.000 4.682 . 0 0 "[ . 1 . 2 ]" 2 332 1 77 ALA HA 1 77 ALA MB 0.000 . 2.500 2.118 2.086 2.128 . 0 0 "[ . 1 . 2 ]" 2 333 1 77 ALA MB 1 110 ILE MD 0.000 . 5.000 4.386 4.165 4.715 . 0 0 "[ . 1 . 2 ]" 2 334 1 77 ALA MB 1 110 ILE MG 0.000 . 2.500 1.863 1.756 2.183 . 0 0 "[ . 1 . 2 ]" 2 335 1 77 ALA MB 1 113 LEU MD2 0.000 . 2.500 1.858 1.675 2.443 . 0 0 "[ . 1 . 2 ]" 2 336 1 79 VAL HA 1 79 VAL MG1 0.000 . 2.500 2.269 2.177 2.358 . 0 0 "[ . 1 . 2 ]" 2 337 1 79 VAL HA 1 79 VAL MG2 0.000 . 2.500 2.456 2.385 2.527 0.027 4 0 "[ . 1 . 2 ]" 2 338 1 79 VAL HB 1 79 VAL MG1 0.000 . 2.500 2.095 2.084 2.112 . 0 0 "[ . 1 . 2 ]" 2 339 1 79 VAL HB 1 79 VAL MG2 0.000 . 2.500 2.110 2.086 2.121 . 0 0 "[ . 1 . 2 ]" 2 340 1 79 VAL MG1 1 79 VAL MG2 0.000 . 2.500 2.014 1.949 2.076 . 0 0 "[ . 1 . 2 ]" 2 341 1 79 VAL MG1 1 98 MET ME 0.000 . 5.000 4.074 3.330 4.748 . 0 0 "[ . 1 . 2 ]" 2 342 1 79 VAL MG2 1 98 MET ME 0.000 . 5.000 4.592 3.821 5.070 0.070 24 0 "[ . 1 . 2 ]" 2 343 1 79 VAL MG1 1 101 PHE QD 0.000 . 2.500 2.637 2.565 2.756 0.256 23 0 "[ . 1 . 2 ]" 2 344 1 79 VAL MG1 1 101 PHE QE 0.000 . 2.500 1.981 1.737 2.359 . 0 0 "[ . 1 . 2 ]" 2 345 1 79 VAL MG1 1 101 PHE HZ 0.000 . 5.000 3.763 3.603 4.077 . 0 0 "[ . 1 . 2 ]" 2 346 1 79 VAL MG2 1 101 PHE QD 0.000 . 5.000 3.500 3.319 3.583 . 0 0 "[ . 1 . 2 ]" 2 347 1 79 VAL MG2 1 101 PHE QE 0.000 . 3.000 1.896 1.771 2.023 . 0 0 "[ . 1 . 2 ]" 2 348 1 79 VAL MG2 1 101 PHE HZ 0.000 . 3.000 2.103 1.920 2.426 . 0 0 "[ . 1 . 2 ]" 2 349 1 79 VAL MG2 1 113 LEU MD1 0.000 . 5.000 3.163 1.676 4.406 . 0 0 "[ . 1 . 2 ]" 2 350 1 79 VAL MG2 1 113 LEU MD2 0.000 . 5.000 3.576 2.976 3.929 . 0 0 "[ . 1 . 2 ]" 2 351 1 79 VAL HB 1 115 THR HB 0.000 . 5.000 3.532 3.212 3.798 . 0 0 "[ . 1 . 2 ]" 2 352 1 79 VAL MG1 1 115 THR HB 0.000 . 5.000 4.861 4.446 5.039 0.039 18 0 "[ . 1 . 2 ]" 2 353 1 79 VAL MG2 1 115 THR HB 0.000 . 5.000 4.194 3.501 4.617 . 0 0 "[ . 1 . 2 ]" 2 354 1 80 ALA HA 1 80 ALA MB 0.000 . 2.500 2.096 2.079 2.132 . 0 0 "[ . 1 . 2 ]" 2 355 1 81 PHE HA 1 81 PHE QB 0.000 . 2.500 2.402 2.305 2.472 . 0 0 "[ . 1 . 2 ]" 2 356 1 81 PHE HA 1 81 PHE QD 0.000 . 2.500 2.130 1.994 2.269 . 0 0 "[ . 1 . 2 ]" 2 357 1 81 PHE QB 1 81 PHE QD 0.000 . 2.500 2.322 2.263 2.347 . 0 0 "[ . 1 . 2 ]" 2 358 1 81 PHE QE 1 115 THR HB 0.000 . 2.500 1.759 1.586 1.886 . 0 0 "[ . 1 . 2 ]" 2 359 1 81 PHE HZ 1 115 THR HB 0.000 . 3.000 3.273 3.215 3.331 0.331 19 0 "[ . 1 . 2 ]" 2 360 1 82 LEU HA 1 82 LEU QB 0.000 . 2.500 2.186 2.135 2.268 . 0 0 "[ . 1 . 2 ]" 2 361 1 82 LEU MD1 1 98 MET ME 0.000 . 5.000 3.363 2.592 3.992 . 0 0 "[ . 1 . 2 ]" 2 362 1 82 LEU MD2 1 98 MET ME 0.000 . 5.000 1.746 1.658 1.978 . 0 0 "[ . 1 . 2 ]" 2 363 1 82 LEU MD2 1 121 ALA MB 0.000 . 5.000 4.967 4.742 5.091 0.091 24 0 "[ . 1 . 2 ]" 2 364 1 83 ALA HA 1 83 ALA MB 0.000 . 2.500 2.044 2.030 2.080 . 0 0 "[ . 1 . 2 ]" 2 365 1 84 VAL HA 1 84 VAL MG1 0.000 . 3.000 2.478 2.424 2.541 . 0 0 "[ . 1 . 2 ]" 2 366 1 84 VAL HA 1 84 VAL MG2 0.000 . 2.500 2.266 2.112 2.385 . 0 0 "[ . 1 . 2 ]" 2 367 1 84 VAL HB 1 84 VAL MG1 0.000 . 2.500 2.067 2.047 2.109 . 0 0 "[ . 1 . 2 ]" 2 368 1 84 VAL HB 1 84 VAL MG2 0.000 . 2.500 2.078 2.053 2.095 . 0 0 "[ . 1 . 2 ]" 2 369 1 84 VAL MG1 1 84 VAL MG2 0.000 . 2.500 1.964 1.884 2.054 . 0 0 "[ . 1 . 2 ]" 2 370 1 84 VAL MG1 1 85 THR MG 0.000 . 5.000 3.008 2.801 3.130 . 0 0 "[ . 1 . 2 ]" 2 371 1 84 VAL MG1 1 89 GLN HA 0.000 . 5.000 1.908 1.802 2.347 . 0 0 "[ . 1 . 2 ]" 2 372 1 84 VAL MG2 1 94 GLY QA 0.000 . 5.000 2.540 2.184 2.857 . 0 0 "[ . 1 . 2 ]" 2 373 1 85 THR HA 1 85 THR HB 0.000 . 2.500 2.582 2.557 2.610 0.110 21 0 "[ . 1 . 2 ]" 2 374 1 85 THR HA 1 85 THR MG 0.000 . 3.000 3.164 3.147 3.179 0.179 5 0 "[ . 1 . 2 ]" 2 375 1 85 THR HB 1 85 THR MG 0.000 . 2.500 2.103 2.087 2.108 . 0 0 "[ . 1 . 2 ]" 2 376 1 85 THR MG 1 87 ASN QB 0.000 . 5.000 4.831 4.757 4.928 . 0 0 "[ . 1 . 2 ]" 2 377 1 86 ALA HA 1 86 ALA MB 0.000 . 2.500 2.115 2.111 2.120 . 0 0 "[ . 1 . 2 ]" 2 378 1 86 ALA MB 1 87 ASN HA 0.000 . 5.000 3.841 3.810 3.928 . 0 0 "[ . 1 . 2 ]" 2 379 1 87 ASN HA 1 87 ASN QB 0.000 . 2.500 2.519 2.459 2.528 0.028 17 0 "[ . 1 . 2 ]" 2 380 1 88 GLU HA 1 88 GLU QB 0.000 . 2.500 2.445 2.433 2.488 . 0 0 "[ . 1 . 2 ]" 2 381 1 88 GLU HA 1 88 GLU QG 0.000 . 3.000 2.784 2.152 2.910 . 0 0 "[ . 1 . 2 ]" 2 382 1 88 GLU HA 1 91 ARG QD 0.000 . 5.000 4.183 3.132 5.002 0.002 5 0 "[ . 1 . 2 ]" 2 383 1 89 GLN HA 1 90 VAL MG2 0.000 . 5.000 3.928 3.864 3.973 . 0 0 "[ . 1 . 2 ]" 2 384 1 89 GLN QB 1 90 VAL MG2 0.000 . 2.500 2.574 2.549 2.621 0.121 19 0 "[ . 1 . 2 ]" 2 385 1 89 GLN QG 1 90 VAL MG2 0.000 . 5.000 4.056 2.493 4.392 . 0 0 "[ . 1 . 2 ]" 2 386 1 90 VAL HA 1 90 VAL HB 0.000 . 3.000 2.638 2.596 2.673 . 0 0 "[ . 1 . 2 ]" 2 387 1 90 VAL HA 1 90 VAL MG1 0.000 . 2.500 2.026 1.980 2.142 . 0 0 "[ . 1 . 2 ]" 2 388 1 90 VAL HB 1 90 VAL MG1 0.000 . 2.500 2.092 2.085 2.096 . 0 0 "[ . 1 . 2 ]" 2 389 1 90 VAL HB 1 90 VAL MG2 0.000 . 2.500 2.127 2.119 2.129 . 0 0 "[ . 1 . 2 ]" 2 390 1 90 VAL MG1 1 90 VAL MG2 0.000 . 2.500 2.059 2.041 2.068 . 0 0 "[ . 1 . 2 ]" 2 391 1 91 ARG HA 1 91 ARG QB 0.000 . 2.500 2.500 2.428 2.537 0.037 6 0 "[ . 1 . 2 ]" 2 392 1 91 ARG HA 1 91 ARG QD 0.000 . 5.000 3.668 2.419 4.027 . 0 0 "[ . 1 . 2 ]" 2 393 1 91 ARG HA 1 91 ARG QG 0.000 . 2.500 2.164 2.009 2.478 . 0 0 "[ . 1 . 2 ]" 2 394 1 91 ARG QD 1 93 TYR QD 0.000 . 5.000 4.424 3.689 5.003 0.003 12 0 "[ . 1 . 2 ]" 2 395 1 93 TYR QB 1 93 TYR QD 0.000 . 2.500 2.207 2.161 2.272 . 0 0 "[ . 1 . 2 ]" 2 396 1 95 THR HA 1 95 THR MG 0.000 . 2.500 2.326 2.105 2.521 0.021 10 0 "[ . 1 . 2 ]" 2 397 1 95 THR HB 1 95 THR MG 0.000 . 2.500 2.093 2.073 2.119 . 0 0 "[ . 1 . 2 ]" 2 398 1 96 ARG HA 1 96 ARG QB 0.000 . 2.500 2.440 2.351 2.501 0.001 10 0 "[ . 1 . 2 ]" 2 399 1 97 LEU HA 1 97 LEU MD1 0.000 . 2.500 1.872 1.799 1.967 . 0 0 "[ . 1 . 2 ]" 2 400 1 97 LEU HA 1 97 LEU MD2 0.000 . 3.000 2.948 2.633 3.099 0.099 21 0 "[ . 1 . 2 ]" 2 401 1 97 LEU MD1 1 97 LEU MD2 0.000 . 2.500 2.056 1.928 2.085 . 0 0 "[ . 1 . 2 ]" 2 402 1 97 LEU MD1 1 97 LEU HG 0.000 . 2.500 2.116 2.082 2.127 . 0 0 "[ . 1 . 2 ]" 2 403 1 97 LEU MD2 1 97 LEU HG 0.000 . 2.500 2.108 2.074 2.121 . 0 0 "[ . 1 . 2 ]" 2 404 1 98 MET HA 1 98 MET ME 0.000 . 5.000 2.266 1.851 2.641 . 0 0 "[ . 1 . 2 ]" 2 405 1 98 MET ME 1 121 ALA MB 0.000 . 5.000 4.822 4.187 5.058 0.058 18 0 "[ . 1 . 2 ]" 2 406 1 98 MET QG 1 128 GLN HA 0.000 . 5.000 4.033 3.886 4.265 . 0 0 "[ . 1 . 2 ]" 2 407 1 100 LYS HA 1 100 LYS QD 0.000 . 2.500 2.258 1.977 2.513 0.013 14 0 "[ . 1 . 2 ]" 2 408 1 100 LYS QD 1 100 LYS QG 0.000 . 2.500 2.058 2.016 2.091 . 0 0 "[ . 1 . 2 ]" 2 409 1 101 PHE HA 1 101 PHE QD 0.000 . 3.000 3.156 3.053 3.287 0.287 17 0 "[ . 1 . 2 ]" 2 410 1 101 PHE QB 1 101 PHE QD 0.000 . 2.500 2.121 2.116 2.135 . 0 0 "[ . 1 . 2 ]" 2 411 1 101 PHE QE 1 105 MET ME 0.000 . 5.000 3.237 2.215 4.298 . 0 0 "[ . 1 . 2 ]" 2 412 1 101 PHE QE 1 113 LEU MD2 0.000 . 3.000 2.808 1.930 3.096 0.096 24 0 "[ . 1 . 2 ]" 2 413 1 101 PHE HZ 1 113 LEU MD2 0.000 . 5.000 2.683 2.066 3.794 . 0 0 "[ . 1 . 2 ]" 2 414 1 102 LYS HA 1 158 ILE MD 0.000 . 3.000 2.868 2.521 3.046 0.046 5 0 "[ . 1 . 2 ]" 2 415 1 104 HIS HA 1 104 HIS QB 0.000 . 2.500 2.419 2.343 2.497 . 0 0 "[ . 1 . 2 ]" 2 416 1 104 HIS HD1 1 105 MET ME 0.000 . 2.500 2.433 2.159 2.539 0.039 24 0 "[ . 1 . 2 ]" 2 417 1 104 HIS HA 1 107 LYS QB 0.000 . 5.000 2.635 2.401 2.888 . 0 0 "[ . 1 . 2 ]" 2 418 1 105 MET HA 1 105 MET ME 0.000 . 5.000 2.168 1.870 3.118 . 0 0 "[ . 1 . 2 ]" 2 419 1 106 GLN HA 1 106 GLN QB 0.000 . 2.500 2.471 2.367 2.533 0.033 15 0 "[ . 1 . 2 ]" 2 420 1 106 GLN HA 1 158 ILE MG 0.000 . 2.500 2.535 2.465 2.564 0.064 22 0 "[ . 1 . 2 ]" 2 421 1 107 LYS HA 1 107 LYS QB 0.000 . 2.500 2.338 2.296 2.413 . 0 0 "[ . 1 . 2 ]" 2 422 1 107 LYS HA 1 107 LYS QG 0.000 . 2.500 2.507 2.336 2.577 0.077 2 0 "[ . 1 . 2 ]" 2 423 1 108 GLN HA 1 108 GLN QG 0.000 . 2.500 2.610 2.321 2.790 0.290 3 0 "[ . 1 . 2 ]" 2 424 1 109 ASN HA 1 109 ASN QB 0.000 . 2.500 2.447 2.147 2.508 0.008 16 0 "[ . 1 . 2 ]" 2 425 1 110 ILE HA 1 110 ILE MD 0.000 . 2.500 2.002 1.866 2.097 . 0 0 "[ . 1 . 2 ]" 2 426 1 110 ILE HA 1 110 ILE MG 0.000 . 2.500 2.315 2.215 2.423 . 0 0 "[ . 1 . 2 ]" 2 427 1 110 ILE HB 1 110 ILE MG 0.000 . 2.500 2.111 2.084 2.137 . 0 0 "[ . 1 . 2 ]" 2 428 1 110 ILE MG 1 113 LEU MD2 0.000 . 5.000 2.892 2.432 3.252 . 0 0 "[ . 1 . 2 ]" 2 429 1 111 GLU HA 1 111 GLU QB 0.000 . 2.500 2.251 2.162 2.405 . 0 0 "[ . 1 . 2 ]" 2 430 1 111 GLU HA 1 158 ILE HB 0.000 . 2.500 1.870 1.771 2.022 . 0 0 "[ . 1 . 2 ]" 2 431 1 111 GLU HA 1 158 ILE MG 0.000 . 5.000 3.471 3.233 3.605 . 0 0 "[ . 1 . 2 ]" 2 432 1 112 TYR QB 1 112 TYR QD 0.000 . 2.500 2.150 2.135 2.263 . 0 0 "[ . 1 . 2 ]" 2 433 1 113 LEU HA 1 113 LEU MD2 0.000 . 3.000 2.408 1.966 2.816 . 0 0 "[ . 1 . 2 ]" 2 434 1 113 LEU MD1 1 113 LEU HG 0.000 . 2.500 2.098 2.081 2.129 . 0 0 "[ . 1 . 2 ]" 2 435 1 113 LEU MD2 1 113 LEU HG 0.000 . 2.500 2.100 2.079 2.125 . 0 0 "[ . 1 . 2 ]" 2 436 1 113 LEU MD1 1 158 ILE MD 0.000 . 5.000 2.575 1.673 4.583 . 0 0 "[ . 1 . 2 ]" 2 437 1 113 LEU MD2 1 158 ILE MD 0.000 . 2.500 2.474 1.946 2.562 0.062 8 0 "[ . 1 . 2 ]" 2 438 1 114 LEU HA 1 114 LEU MD2 0.000 . 3.000 1.902 1.780 2.164 . 0 0 "[ . 1 . 2 ]" 2 439 1 114 LEU QB 1 114 LEU MD1 0.000 . 3.000 2.046 1.989 2.095 . 0 0 "[ . 1 . 2 ]" 2 440 1 114 LEU MD1 1 114 LEU MD2 0.000 . 2.500 1.997 1.881 2.089 . 0 0 "[ . 1 . 2 ]" 2 441 1 114 LEU MD1 1 136 MET ME 0.000 . 5.000 4.311 2.182 5.048 0.048 19 0 "[ . 1 . 2 ]" 2 442 1 114 LEU MD2 1 136 MET ME 0.000 . 5.000 3.382 1.809 4.428 . 0 0 "[ . 1 . 2 ]" 2 443 1 114 LEU MD1 1 145 ILE MD 0.000 . 3.000 2.906 2.404 3.392 0.392 15 0 "[ . 1 . 2 ]" 2 444 1 114 LEU MD1 1 145 ILE MG 0.000 . 5.000 4.998 4.709 5.077 0.077 22 0 "[ . 1 . 2 ]" 2 445 1 114 LEU MD2 1 153 LEU MD1 0.000 . 5.000 2.849 1.668 4.213 . 0 0 "[ . 1 . 2 ]" 2 446 1 114 LEU HA 1 155 GLU HA 0.000 . 2.500 2.463 2.312 2.528 0.028 5 0 "[ . 1 . 2 ]" 2 447 1 114 LEU MD2 1 155 GLU HA 0.000 . 2.500 2.180 1.846 2.557 0.057 1 0 "[ . 1 . 2 ]" 2 448 1 115 THR HA 1 115 THR HB 0.000 . 2.500 2.242 2.228 2.274 . 0 0 "[ . 1 . 2 ]" 2 449 1 115 THR HB 1 115 THR MG 0.000 . 2.500 2.098 2.077 2.109 . 0 0 "[ . 1 . 2 ]" 2 450 1 115 THR MG 1 117 ALA HA 0.000 . 5.000 5.017 4.674 5.082 0.082 21 0 "[ . 1 . 2 ]" 2 451 1 115 THR MG 1 117 ALA MB 0.000 . 3.000 3.121 3.033 3.171 0.171 24 0 "[ . 1 . 2 ]" 2 452 1 115 THR MG 1 125 PHE QD 0.000 . 5.000 4.551 4.226 4.900 . 0 0 "[ . 1 . 2 ]" 2 453 1 115 THR MG 1 125 PHE QE 0.000 . 5.000 3.518 3.150 3.900 . 0 0 "[ . 1 . 2 ]" 2 454 1 115 THR MG 1 125 PHE HZ 0.000 . 5.000 3.456 3.018 4.211 . 0 0 "[ . 1 . 2 ]" 2 455 1 115 THR MG 1 144 TYR QD 0.000 . 5.000 5.048 4.915 5.108 0.108 22 0 "[ . 1 . 2 ]" 2 456 1 115 THR MG 1 154 MET QB 0.000 . 5.000 2.409 1.805 3.625 . 0 0 "[ . 1 . 2 ]" 2 457 1 115 THR MG 1 154 MET ME 0.000 . 5.000 4.485 4.003 4.995 . 0 0 "[ . 1 . 2 ]" 2 458 1 116 TYR HA 1 116 TYR QD 0.000 . 3.000 2.294 1.846 2.847 . 0 0 "[ . 1 . 2 ]" 2 459 1 116 TYR QB 1 116 TYR QD 0.000 . 2.500 2.176 2.124 2.258 . 0 0 "[ . 1 . 2 ]" 2 460 1 116 TYR HA 1 153 LEU HA 0.000 . 2.500 2.606 2.510 2.663 0.163 18 0 "[ . 1 . 2 ]" 2 461 1 116 TYR QD 1 153 LEU HA 0.000 . 5.000 2.911 1.949 4.125 . 0 0 "[ . 1 . 2 ]" 2 462 1 116 TYR QD 1 153 LEU MD1 0.000 . 5.000 3.266 1.900 4.630 . 0 0 "[ . 1 . 2 ]" 2 463 1 116 TYR QE 1 153 LEU HA 0.000 . 5.000 3.789 2.714 4.841 . 0 0 "[ . 1 . 2 ]" 2 464 1 116 TYR QE 1 153 LEU MD1 0.000 . 5.000 3.503 1.891 4.947 . 0 0 "[ . 1 . 2 ]" 2 465 1 116 TYR QE 1 153 LEU MD2 0.000 . 5.000 3.451 2.063 5.005 0.005 3 0 "[ . 1 . 2 ]" 2 466 1 117 ALA HA 1 117 ALA MB 0.000 . 2.500 2.092 2.073 2.121 . 0 0 "[ . 1 . 2 ]" 2 467 1 117 ALA MB 1 121 ALA MB 0.000 . 2.500 1.750 1.688 1.899 . 0 0 "[ . 1 . 2 ]" 2 468 1 117 ALA MB 1 125 PHE QD 0.000 . 2.500 2.477 2.229 2.686 0.186 16 0 "[ . 1 . 2 ]" 2 469 1 117 ALA MB 1 154 MET ME 0.000 . 5.000 3.865 3.384 4.385 . 0 0 "[ . 1 . 2 ]" 2 470 1 117 ALA MB 1 154 MET QG 0.000 . 5.000 2.626 1.790 4.088 . 0 0 "[ . 1 . 2 ]" 2 471 1 118 ASP HA 1 118 ASP QB 0.000 . 2.500 2.423 2.179 2.537 0.037 16 0 "[ . 1 . 2 ]" 2 472 1 119 ASN HA 1 119 ASN QB 0.000 . 2.500 2.384 2.173 2.528 0.028 12 0 "[ . 1 . 2 ]" 2 473 1 119 ASN HA 1 122 ILE MD 0.000 . 2.500 2.318 1.974 2.555 0.055 19 0 "[ . 1 . 2 ]" 2 474 1 119 ASN HA 1 122 ILE MG 0.000 . 5.000 3.009 2.612 3.338 . 0 0 "[ . 1 . 2 ]" 2 475 1 119 ASN QB 1 122 ILE MD 0.000 . 5.000 3.708 3.162 4.079 . 0 0 "[ . 1 . 2 ]" 2 476 1 120 PHE HA 1 120 PHE QB 0.000 . 2.500 2.341 2.233 2.537 0.037 2 0 "[ . 1 . 2 ]" 2 477 1 120 PHE QB 1 120 PHE QD 0.000 . 2.500 2.135 2.121 2.175 . 0 0 "[ . 1 . 2 ]" 2 478 1 121 ALA HA 1 121 ALA MB 0.000 . 2.500 2.105 2.085 2.130 . 0 0 "[ . 1 . 2 ]" 2 479 1 121 ALA MB 1 125 PHE QD 0.000 . 3.000 2.303 1.948 2.629 . 0 0 "[ . 1 . 2 ]" 2 480 1 122 ILE HA 1 122 ILE MG 0.000 . 2.500 2.608 2.545 2.703 0.203 6 0 "[ . 1 . 2 ]" 2 481 1 122 ILE HA 1 125 PHE QD 0.000 . 3.000 2.976 2.609 3.117 0.117 19 0 "[ . 1 . 2 ]" 2 482 1 122 ILE MD 1 126 LYS QE 0.000 . 3.000 3.136 3.059 3.204 0.204 4 0 "[ . 1 . 2 ]" 2 483 1 122 ILE MG 1 126 LYS QE 0.000 . 3.000 1.774 1.700 1.870 . 0 0 "[ . 1 . 2 ]" 2 484 1 122 ILE MD 1 152 THR HB 0.000 . 2.500 2.436 2.107 2.582 0.082 16 0 "[ . 1 . 2 ]" 2 485 1 122 ILE MD 1 154 MET ME 0.000 . 5.000 4.921 4.479 5.074 0.074 23 0 "[ . 1 . 2 ]" 2 486 1 122 ILE MG 1 154 MET ME 0.000 . 5.000 4.130 3.431 4.450 . 0 0 "[ . 1 . 2 ]" 2 487 1 124 TYR HA 1 124 TYR QB 0.000 . 2.500 2.413 2.333 2.504 0.004 19 0 "[ . 1 . 2 ]" 2 488 1 125 PHE HA 1 125 PHE QD 0.000 . 2.500 2.123 1.946 2.283 . 0 0 "[ . 1 . 2 ]" 2 489 1 125 PHE QB 1 125 PHE QD 0.000 . 2.500 2.162 2.139 2.199 . 0 0 "[ . 1 . 2 ]" 2 490 1 126 LYS HA 1 126 LYS QB 0.000 . 2.500 2.379 2.352 2.419 . 0 0 "[ . 1 . 2 ]" 2 491 1 126 LYS HA 1 126 LYS QD 0.000 . 5.000 3.858 3.691 4.065 . 0 0 "[ . 1 . 2 ]" 2 492 1 126 LYS HA 1 126 LYS QG 0.000 . 2.500 2.380 2.248 2.496 . 0 0 "[ . 1 . 2 ]" 2 493 1 126 LYS HA 1 154 MET ME 0.000 . 5.000 3.978 3.102 4.473 . 0 0 "[ . 1 . 2 ]" 2 494 1 127 LYS HA 1 127 LYS QB 0.000 . 2.500 2.441 2.391 2.482 . 0 0 "[ . 1 . 2 ]" 2 495 1 127 LYS HA 1 127 LYS QG 0.000 . 2.500 2.358 2.148 2.508 0.008 8 0 "[ . 1 . 2 ]" 2 496 1 128 GLN HA 1 128 GLN QB 0.000 . 2.500 2.450 2.317 2.531 0.031 4 0 "[ . 1 . 2 ]" 2 497 1 130 PHE HA 1 156 CYS HA 0.000 . 5.000 3.568 3.030 4.138 . 0 0 "[ . 1 . 2 ]" 2 498 1 131 THR HA 1 131 THR HB 0.000 . 2.500 2.485 2.435 2.605 0.105 19 0 "[ . 1 . 2 ]" 2 499 1 131 THR HA 1 131 THR MG 0.000 . 3.000 3.123 2.241 3.203 0.203 11 0 "[ . 1 . 2 ]" 2 500 1 131 THR HB 1 131 THR MG 0.000 . 2.500 2.106 2.073 2.111 . 0 0 "[ . 1 . 2 ]" 2 501 1 131 THR HA 1 154 MET ME 0.000 . 3.000 3.070 2.937 3.132 0.132 6 0 "[ . 1 . 2 ]" 2 502 1 131 THR MG 1 154 MET ME 0.000 . 5.000 3.602 3.357 4.281 . 0 0 "[ . 1 . 2 ]" 2 503 1 132 LYS HA 1 132 LYS QB 0.000 . 2.500 2.323 2.284 2.473 . 0 0 "[ . 1 . 2 ]" 2 504 1 132 LYS HA 1 132 LYS QG 0.000 . 2.500 2.545 2.446 2.618 0.118 6 0 "[ . 1 . 2 ]" 2 505 1 132 LYS QB 1 132 LYS QE 0.000 . 3.000 2.802 1.896 3.141 0.141 22 0 "[ . 1 . 2 ]" 2 506 1 132 LYS HA 1 154 MET HA 0.000 . 2.500 2.578 2.383 2.649 0.149 19 0 "[ . 1 . 2 ]" 2 507 1 132 LYS HA 1 154 MET ME 0.000 . 5.000 1.974 1.736 2.380 . 0 0 "[ . 1 . 2 ]" 2 508 1 132 LYS QB 1 154 MET HA 0.000 . 5.000 4.188 3.775 4.666 . 0 0 "[ . 1 . 2 ]" 2 509 1 133 GLU HA 1 133 GLU QB 0.000 . 2.500 2.435 2.355 2.499 . 0 0 "[ . 1 . 2 ]" 2 510 1 133 GLU HA 1 133 GLU QG 0.000 . 2.500 2.315 2.118 2.443 . 0 0 "[ . 1 . 2 ]" 2 511 1 134 HIS HA 1 134 HIS QB 0.000 . 2.500 2.374 2.180 2.534 0.034 19 0 "[ . 1 . 2 ]" 2 512 1 134 HIS HD1 1 153 LEU MD2 0.000 . 5.000 4.081 2.019 5.014 0.014 13 0 "[ . 1 . 2 ]" 2 513 1 135 ARG HA 1 135 ARG QB 0.000 . 2.500 2.476 2.306 2.536 0.036 7 0 "[ . 1 . 2 ]" 2 514 1 135 ARG HA 1 135 ARG QD 0.000 . 5.000 3.523 2.474 4.031 . 0 0 "[ . 1 . 2 ]" 2 515 1 135 ARG HA 1 135 ARG QG 0.000 . 2.500 2.250 2.023 2.500 . 0 0 "[ . 1 . 2 ]" 2 516 1 135 ARG QD 1 135 ARG QG 0.000 . 2.500 2.051 1.976 2.090 . 0 0 "[ . 1 . 2 ]" 2 517 1 137 PRO HA 1 137 PRO QB 0.000 . 2.500 2.213 2.178 2.248 . 0 0 "[ . 1 . 2 ]" 2 518 1 138 GLN HA 1 138 GLN QB 0.000 . 2.500 2.205 2.168 2.380 . 0 0 "[ . 1 . 2 ]" 2 519 1 139 GLU HA 1 139 GLU QB 0.000 . 2.500 2.394 2.306 2.529 0.029 12 0 "[ . 1 . 2 ]" 2 520 1 139 GLU HA 1 139 GLU QG 0.000 . 2.500 2.398 2.154 2.507 0.007 1 0 "[ . 1 . 2 ]" 2 521 1 139 GLU QB 1 139 GLU QG 0.000 . 2.500 2.054 1.995 2.086 . 0 0 "[ . 1 . 2 ]" 2 522 1 140 LYS HA 1 140 LYS QB 0.000 . 2.500 2.421 2.350 2.517 0.017 24 0 "[ . 1 . 2 ]" 2 523 1 140 LYS HA 1 140 LYS QG 0.000 . 2.500 2.349 2.116 2.510 0.010 1 0 "[ . 1 . 2 ]" 2 524 1 141 TRP HA 1 141 TRP HD1 0.000 . 5.000 3.018 1.898 4.223 . 0 0 "[ . 1 . 2 ]" 2 525 1 141 TRP HA 1 141 TRP HE1 0.000 . 5.000 4.809 4.385 5.214 0.214 22 0 "[ . 1 . 2 ]" 2 526 1 142 LYS HA 1 142 LYS QB 0.000 . 2.500 2.421 2.332 2.536 0.036 8 0 "[ . 1 . 2 ]" 2 527 1 142 LYS HA 1 142 LYS QD 0.000 . 5.000 3.555 1.977 4.122 . 0 0 "[ . 1 . 2 ]" 2 528 1 142 LYS HA 1 142 LYS QG 0.000 . 3.000 2.360 2.018 2.985 . 0 0 "[ . 1 . 2 ]" 2 529 1 144 TYR HA 1 144 TYR QB 0.000 . 2.500 2.195 2.153 2.305 . 0 0 "[ . 1 . 2 ]" 2 530 1 144 TYR QB 1 144 TYR QD 0.000 . 2.500 2.164 2.138 2.258 . 0 0 "[ . 1 . 2 ]" 2 531 1 145 ILE HB 1 145 ILE MG 0.000 . 2.500 2.114 2.081 2.126 . 0 0 "[ . 1 . 2 ]" 2 532 1 145 ILE MD 1 145 ILE MG 0.000 . 2.500 2.237 1.876 2.530 0.030 1 0 "[ . 1 . 2 ]" 2 533 1 145 ILE QG 1 145 ILE MG 0.000 . 2.500 2.202 2.015 2.325 . 0 0 "[ . 1 . 2 ]" 2 534 1 145 ILE MD 1 153 LEU MD1 0.000 . 5.000 3.256 1.656 5.036 0.036 1 0 "[ . 1 . 2 ]" 2 535 1 146 LYS HA 1 146 LYS QB 0.000 . 2.500 2.499 2.341 2.528 0.028 13 0 "[ . 1 . 2 ]" 2 536 1 146 LYS HA 1 146 LYS QD 0.000 . 5.000 3.417 2.599 4.195 . 0 0 "[ . 1 . 2 ]" 2 537 1 146 LYS HA 1 146 LYS QG 0.000 . 2.500 2.124 2.017 2.530 0.030 5 0 "[ . 1 . 2 ]" 2 538 1 146 LYS QB 1 146 LYS QG 0.000 . 2.500 2.038 2.019 2.080 . 0 0 "[ . 1 . 2 ]" 2 539 1 146 LYS QD 1 146 LYS QG 0.000 . 2.500 2.048 2.020 2.088 . 0 0 "[ . 1 . 2 ]" 2 540 1 147 ASP HA 1 147 ASP QB 0.000 . 2.500 2.363 2.172 2.534 0.034 21 0 "[ . 1 . 2 ]" 2 541 1 148 TYR HA 1 148 TYR QD 0.000 . 3.000 2.502 1.949 3.009 0.009 24 0 "[ . 1 . 2 ]" 2 542 1 148 TYR QB 1 148 TYR QD 0.000 . 2.500 2.160 2.135 2.273 . 0 0 "[ . 1 . 2 ]" 2 543 1 149 ASP HA 1 149 ASP QB 0.000 . 2.500 2.439 2.185 2.526 0.026 24 0 "[ . 1 . 2 ]" 2 544 1 152 THR HA 1 152 THR HB 0.000 . 2.500 2.726 2.676 2.785 0.285 16 0 "[ . 1 . 2 ]" 2 545 1 152 THR HA 1 152 THR MG 0.000 . 3.000 3.076 3.018 3.119 0.119 15 0 "[ . 1 . 2 ]" 2 546 1 152 THR HB 1 152 THR MG 0.000 . 2.500 2.113 2.102 2.121 . 0 0 "[ . 1 . 2 ]" 2 547 1 153 LEU HA 1 153 LEU QB 0.000 . 2.500 2.316 2.163 2.483 . 0 0 "[ . 1 . 2 ]" 2 548 1 153 LEU HA 1 153 LEU MD1 0.000 . 2.500 2.122 1.863 2.537 0.037 16 0 "[ . 1 . 2 ]" 2 549 1 154 MET HA 1 154 MET ME 0.000 . 5.000 3.036 2.384 4.117 . 0 0 "[ . 1 . 2 ]" 2 550 1 154 MET HA 1 154 MET QG 0.000 . 3.000 2.518 2.081 3.058 0.058 19 0 "[ . 1 . 2 ]" 2 551 1 155 GLU HA 1 155 GLU QB 0.000 . 2.500 2.282 2.174 2.513 0.013 19 0 "[ . 1 . 2 ]" 2 552 1 156 CYS HA 1 156 CYS QB 0.000 . 2.500 2.375 2.315 2.514 0.014 20 0 "[ . 1 . 2 ]" 2 553 1 158 ILE HA 1 158 ILE MD 0.000 . 3.000 2.178 1.951 2.450 . 0 0 "[ . 1 . 2 ]" 2 554 1 158 ILE HA 1 158 ILE MG 0.000 . 2.500 2.351 2.148 2.476 . 0 0 "[ . 1 . 2 ]" 2 555 1 158 ILE HB 1 158 ILE MG 0.000 . 2.500 2.112 2.085 2.130 . 0 0 "[ . 1 . 2 ]" 2 556 1 158 ILE MD 1 158 ILE MG 0.000 . 2.500 1.836 1.678 2.113 . 0 0 "[ . 1 . 2 ]" 2 557 1 158 ILE MG 1 164 TYR QD 0.000 . 5.000 3.623 2.825 4.257 . 0 0 "[ . 1 . 2 ]" 2 558 1 158 ILE MG 1 164 TYR QE 0.000 . 2.500 2.237 1.906 2.520 0.020 8 0 "[ . 1 . 2 ]" 2 559 1 160 PRO HA 1 160 PRO QB 0.000 . 2.500 2.191 2.178 2.236 . 0 0 "[ . 1 . 2 ]" 2 560 1 160 PRO QD 1 160 PRO QG 0.000 . 2.500 1.965 1.957 1.972 . 0 0 "[ . 1 . 2 ]" 2 561 1 161 TYR HA 1 161 TYR QB 0.000 . 2.500 2.360 2.167 2.531 0.031 4 0 "[ . 1 . 2 ]" 2 562 1 161 TYR QB 1 161 TYR QD 0.000 . 2.500 2.172 2.135 2.325 . 0 0 "[ . 1 . 2 ]" 2 563 1 162 VAL HA 1 162 VAL HB 0.000 . 3.000 3.018 3.016 3.020 0.020 4 0 "[ . 1 . 2 ]" 2 564 1 162 VAL HA 1 162 VAL MG1 0.000 . 2.500 2.327 2.266 2.428 . 0 0 "[ . 1 . 2 ]" 2 565 1 162 VAL HA 1 162 VAL MG2 0.000 . 2.500 2.419 2.291 2.473 . 0 0 "[ . 1 . 2 ]" 2 566 1 162 VAL HB 1 162 VAL MG1 0.000 . 2.500 2.120 2.102 2.130 . 0 0 "[ . 1 . 2 ]" 2 567 1 162 VAL HB 1 162 VAL MG2 0.000 . 2.500 2.120 2.098 2.128 . 0 0 "[ . 1 . 2 ]" 2 568 1 162 VAL MG1 1 162 VAL MG2 0.000 . 2.500 2.068 1.958 2.096 . 0 0 "[ . 1 . 2 ]" 2 569 1 162 VAL MG1 1 164 TYR QD 0.000 . 5.000 2.417 2.021 2.991 . 0 0 "[ . 1 . 2 ]" 2 570 1 162 VAL MG1 1 164 TYR QE 0.000 . 2.500 2.218 1.861 2.511 0.011 8 0 "[ . 1 . 2 ]" 2 571 1 162 VAL MG2 1 164 TYR QE 0.000 . 3.000 2.971 2.738 3.023 0.023 23 0 "[ . 1 . 2 ]" 2 572 1 164 TYR HA 1 164 TYR QD 0.000 . 2.500 2.169 1.957 2.501 0.001 12 0 "[ . 1 . 2 ]" 2 573 1 164 TYR QB 1 164 TYR QD 0.000 . 2.500 2.226 2.148 2.333 . 0 0 "[ . 1 . 2 ]" 2 574 1 166 ASN HA 1 166 ASN QB 0.000 . 2.500 2.409 2.184 2.506 0.006 20 0 "[ . 1 . 2 ]" 2 stop_ save_ save_distance_constraint_statistics_3 _Distance_constraint_stats_list.Sf_category distance_constraint_statistics _Distance_constraint_stats_list.Constraint_list_ID 3 _Distance_constraint_stats_list.Constraint_count 116 _Distance_constraint_stats_list.Viol_count 740 _Distance_constraint_stats_list.Viol_total 681.160 _Distance_constraint_stats_list.Viol_max 0.185 _Distance_constraint_stats_list.Viol_rms 0.0246 _Distance_constraint_stats_list.Viol_average_all_restraints 0.0102 _Distance_constraint_stats_list.Viol_average_violations_only 0.0384 _Distance_constraint_stats_list.Cutoff_violation_report 0.500 _Distance_constraint_stats_list.Details . loop_ _Distance_constraint_stats_per_res.Atom_entity_assembly_ID _Distance_constraint_stats_per_res.Atom_comp_index_ID _Distance_constraint_stats_per_res.Atom_comp_ID _Distance_constraint_stats_per_res.Total_violation _Distance_constraint_stats_per_res.Max_violation _Distance_constraint_stats_per_res.Max_violation_model_number _Distance_constraint_stats_per_res.Over_cutoff_viol_count _Distance_constraint_stats_per_res.Over_cutoff_viol_per_model 1 6 ASP 0.000 0.000 . 0 "[ . 1 . 2 ]" 1 8 ASP 0.000 0.000 . 0 "[ . 1 . 2 ]" 1 10 LEU 0.122 0.025 10 0 "[ . 1 . 2 ]" 1 16 HIS 0.099 0.030 22 0 "[ . 1 . 2 ]" 1 17 ARG 0.330 0.029 23 0 "[ . 1 . 2 ]" 1 18 ASN 0.017 0.017 22 0 "[ . 1 . 2 ]" 1 19 MET 0.000 0.000 . 0 "[ . 1 . 2 ]" 1 20 LYS 0.624 0.039 7 0 "[ . 1 . 2 ]" 1 21 LEU 1.620 0.090 13 0 "[ . 1 . 2 ]" 1 22 LEU 0.405 0.046 8 0 "[ . 1 . 2 ]" 1 23 ILE 0.000 0.000 . 0 "[ . 1 . 2 ]" 1 24 ASP 0.524 0.039 7 0 "[ . 1 . 2 ]" 1 25 LEU 1.290 0.090 13 0 "[ . 1 . 2 ]" 1 26 LYS 0.460 0.046 8 0 "[ . 1 . 2 ]" 1 27 ASN 0.000 0.000 . 0 "[ . 1 . 2 ]" 1 28 ILE 0.000 0.000 . 0 "[ . 1 . 2 ]" 1 29 PHE 0.000 0.000 . 0 "[ . 1 . 2 ]" 1 30 SER 0.071 0.018 20 0 "[ . 1 . 2 ]" 1 38 LYS 0.000 0.000 . 0 "[ . 1 . 2 ]" 1 39 GLU 0.000 0.000 . 0 "[ . 1 . 2 ]" 1 40 TYR 0.000 0.000 . 0 "[ . 1 . 2 ]" 1 41 ILE 0.174 0.027 5 0 "[ . 1 . 2 ]" 1 42 VAL 0.009 0.007 18 0 "[ . 1 . 2 ]" 1 43 LYS 0.962 0.058 10 0 "[ . 1 . 2 ]" 1 44 LEU 0.000 0.000 . 0 "[ . 1 . 2 ]" 1 45 VAL 0.174 0.027 5 0 "[ . 1 . 2 ]" 1 46 PHE 0.009 0.007 18 0 "[ . 1 . 2 ]" 1 47 ASP 0.962 0.058 10 0 "[ . 1 . 2 ]" 1 51 GLU 0.029 0.017 22 0 "[ . 1 . 2 ]" 1 52 SER 0.122 0.025 10 0 "[ . 1 . 2 ]" 1 53 MET 0.000 0.000 . 0 "[ . 1 . 2 ]" 1 54 VAL 0.000 0.000 . 0 "[ . 1 . 2 ]" 1 55 ILE 0.000 0.000 . 0 "[ . 1 . 2 ]" 1 56 LEU 0.000 0.000 . 0 "[ . 1 . 2 ]" 1 64 GLY 0.000 0.000 . 0 "[ . 1 . 2 ]" 1 65 GLY 1.810 0.095 22 0 "[ . 1 . 2 ]" 1 66 ILE 0.000 0.000 . 0 "[ . 1 . 2 ]" 1 67 CYS 3.725 0.183 7 0 "[ . 1 . 2 ]" 1 68 PHE 0.029 0.017 22 0 "[ . 1 . 2 ]" 1 69 ARG 0.583 0.067 8 0 "[ . 1 . 2 ]" 1 71 TYR 4.723 0.185 1 0 "[ . 1 . 2 ]" 1 75 ARG 2.080 0.123 24 0 "[ . 1 . 2 ]" 1 76 PHE 4.723 0.185 1 0 "[ . 1 . 2 ]" 1 77 ALA 0.051 0.017 17 0 "[ . 1 . 2 ]" 1 78 GLU 0.583 0.067 8 0 "[ . 1 . 2 ]" 1 79 VAL 1.501 0.128 4 0 "[ . 1 . 2 ]" 1 81 PHE 3.725 0.183 7 0 "[ . 1 . 2 ]" 1 83 ALA 1.810 0.095 22 0 "[ . 1 . 2 ]" 1 94 GLY 0.000 0.000 . 0 "[ . 1 . 2 ]" 1 95 THR 0.011 0.009 3 0 "[ . 1 . 2 ]" 1 96 ARG 0.576 0.071 4 0 "[ . 1 . 2 ]" 1 97 LEU 0.000 0.000 . 0 "[ . 1 . 2 ]" 1 98 MET 0.753 0.074 4 0 "[ . 1 . 2 ]" 1 99 ASN 0.011 0.009 3 0 "[ . 1 . 2 ]" 1 100 LYS 0.825 0.071 4 0 "[ . 1 . 2 ]" 1 101 PHE 0.000 0.000 . 0 "[ . 1 . 2 ]" 1 102 LYS 0.759 0.074 4 0 "[ . 1 . 2 ]" 1 103 ASP 1.047 0.072 9 0 "[ . 1 . 2 ]" 1 104 HIS 1.485 0.114 12 0 "[ . 1 . 2 ]" 1 105 MET 0.000 0.000 . 0 "[ . 1 . 2 ]" 1 106 GLN 0.006 0.006 24 0 "[ . 1 . 2 ]" 1 107 LYS 1.047 0.072 9 0 "[ . 1 . 2 ]" 1 108 GLN 1.236 0.114 12 0 "[ . 1 . 2 ]" 1 111 GLU 0.000 0.000 . 0 "[ . 1 . 2 ]" 1 112 TYR 2.107 0.123 24 0 "[ . 1 . 2 ]" 1 113 LEU 0.076 0.017 4 0 "[ . 1 . 2 ]" 1 114 LEU 1.525 0.128 4 0 "[ . 1 . 2 ]" 1 115 THR 0.301 0.062 12 0 "[ . 1 . 2 ]" 1 120 PHE 2.825 0.143 6 0 "[ . 1 . 2 ]" 1 121 ALA 0.231 0.055 22 0 "[ . 1 . 2 ]" 1 122 ILE 0.000 0.000 . 0 "[ . 1 . 2 ]" 1 123 GLY 0.116 0.025 18 0 "[ . 1 . 2 ]" 1 124 TYR 4.046 0.143 6 0 "[ . 1 . 2 ]" 1 125 PHE 0.644 0.055 22 0 "[ . 1 . 2 ]" 1 126 LYS 0.000 0.000 . 0 "[ . 1 . 2 ]" 1 127 LYS 0.116 0.025 18 0 "[ . 1 . 2 ]" 1 128 GLN 1.221 0.077 24 0 "[ . 1 . 2 ]" 1 129 GLY 0.414 0.044 16 0 "[ . 1 . 2 ]" 1 131 THR 0.832 0.054 18 0 "[ . 1 . 2 ]" 1 154 MET 0.301 0.062 12 0 "[ . 1 . 2 ]" 1 155 GLU 0.832 0.054 18 0 "[ . 1 . 2 ]" 1 156 CYS 0.076 0.017 4 0 "[ . 1 . 2 ]" 1 158 ILE 0.000 0.000 . 0 "[ . 1 . 2 ]" stop_ loop_ _Distance_constraint_stats.Restraint_ID _Distance_constraint_stats.Atom_1_entity_assembly_ID _Distance_constraint_stats.Atom_1_comp_index_ID _Distance_constraint_stats.Atom_1_comp_ID _Distance_constraint_stats.Atom_1_ID _Distance_constraint_stats.Atom_2_entity_assembly_ID _Distance_constraint_stats.Atom_2_comp_index_ID _Distance_constraint_stats.Atom_2_comp_ID _Distance_constraint_stats.Atom_2_ID _Distance_constraint_stats.Node_1_distance_val _Distance_constraint_stats.Node_1_distance_lower_bound_val _Distance_constraint_stats.Node_1_distance_upper_bound_val _Distance_constraint_stats.Distance_average _Distance_constraint_stats.Distance_minimum _Distance_constraint_stats.Distance_maximum _Distance_constraint_stats.Max_violation _Distance_constraint_stats.Max_violation_model_number _Distance_constraint_stats.Over_cutoff_violation_count _Distance_constraint_stats.Over_cutoff_viol_per_model _Distance_constraint_stats.Distance_constraint_stats_ID 1 1 6 ASP O 1 56 LEU H 0.000 . 2.500 2.025 1.681 2.430 . 0 0 "[ . 1 . 2 ]" 3 2 1 6 ASP O 1 56 LEU N 2.500 2.500 3.300 2.671 2.578 2.987 . 0 0 "[ . 1 . 2 ]" 3 3 1 8 ASP O 1 54 VAL H 0.000 . 2.500 1.783 1.604 1.948 . 0 0 "[ . 1 . 2 ]" 3 4 1 8 ASP O 1 54 VAL N 2.500 2.500 3.300 2.715 2.507 2.854 . 0 0 "[ . 1 . 2 ]" 3 5 1 10 LEU O 1 52 SER H 0.000 . 2.500 2.356 1.854 2.519 0.019 19 0 "[ . 1 . 2 ]" 3 6 1 10 LEU O 1 52 SER N 2.500 2.500 3.300 2.956 2.583 3.294 . 0 0 "[ . 1 . 2 ]" 3 7 1 10 LEU H 1 52 SER O 0.000 . 2.500 2.174 1.681 2.525 0.025 10 0 "[ . 1 . 2 ]" 3 8 1 10 LEU N 1 52 SER O 2.500 2.500 3.300 2.970 2.553 3.283 . 0 0 "[ . 1 . 2 ]" 3 9 1 55 ILE H 1 64 GLY O 0.000 . 2.500 2.085 1.693 2.439 . 0 0 "[ . 1 . 2 ]" 3 10 1 55 ILE N 1 64 GLY O 2.500 2.500 3.300 2.866 2.598 3.136 . 0 0 "[ . 1 . 2 ]" 3 11 1 53 MET H 1 66 ILE O 0.000 . 2.500 1.774 1.584 2.209 . 0 0 "[ . 1 . 2 ]" 3 12 1 53 MET N 1 66 ILE O 2.500 2.500 3.300 2.677 2.516 2.943 . 0 0 "[ . 1 . 2 ]" 3 13 1 53 MET O 1 66 ILE H 0.000 . 2.500 2.005 1.756 2.420 . 0 0 "[ . 1 . 2 ]" 3 14 1 53 MET O 1 66 ILE N 2.500 2.500 3.300 2.662 2.551 2.923 . 0 0 "[ . 1 . 2 ]" 3 15 1 51 GLU O 1 68 PHE H 0.000 . 2.500 2.146 1.711 2.456 . 0 0 "[ . 1 . 2 ]" 3 16 1 51 GLU O 1 68 PHE N 2.500 2.500 3.300 3.049 2.552 3.317 0.017 22 0 "[ . 1 . 2 ]" 3 17 1 65 GLY O 1 83 ALA H 0.000 . 2.500 2.542 2.503 2.595 0.095 22 0 "[ . 1 . 2 ]" 3 18 1 65 GLY O 1 83 ALA N 2.500 2.500 3.300 3.330 3.260 3.369 0.069 3 0 "[ . 1 . 2 ]" 3 19 1 67 CYS H 1 81 PHE O 0.000 . 2.500 2.520 2.437 2.555 0.055 19 0 "[ . 1 . 2 ]" 3 20 1 67 CYS N 1 81 PHE O 2.500 2.500 3.300 3.279 3.015 3.386 0.086 16 0 "[ . 1 . 2 ]" 3 21 1 67 CYS O 1 81 PHE H 0.000 . 2.500 2.525 2.284 2.635 0.135 19 0 "[ . 1 . 2 ]" 3 22 1 67 CYS O 1 81 PHE N 2.500 2.500 3.300 3.346 3.164 3.483 0.183 7 0 "[ . 1 . 2 ]" 3 23 1 69 ARG O 1 78 GLU H 0.000 . 2.500 2.315 2.101 2.447 . 0 0 "[ . 1 . 2 ]" 3 24 1 69 ARG O 1 78 GLU N 2.500 2.500 3.300 3.251 3.069 3.367 0.067 8 0 "[ . 1 . 2 ]" 3 25 1 71 TYR H 1 76 PHE O 0.000 . 2.500 1.597 1.494 1.889 . 0 0 "[ . 1 . 2 ]" 3 26 1 71 TYR N 1 76 PHE O 2.500 2.500 3.300 2.454 2.407 2.571 0.093 1 0 "[ . 1 . 2 ]" 3 27 1 71 TYR O 1 76 PHE H 0.000 . 2.500 2.637 2.555 2.685 0.185 1 0 "[ . 1 . 2 ]" 3 28 1 71 TYR O 1 76 PHE N 2.500 2.500 3.300 3.243 3.101 3.373 0.073 6 0 "[ . 1 . 2 ]" 3 29 1 79 VAL H 1 114 LEU O 0.000 . 2.500 2.444 2.396 2.507 0.007 4 0 "[ . 1 . 2 ]" 3 30 1 79 VAL N 1 114 LEU O 2.500 2.500 3.300 3.362 3.318 3.428 0.128 4 0 "[ . 1 . 2 ]" 3 31 1 77 ALA O 1 114 LEU H 0.000 . 2.500 2.198 1.868 2.517 0.017 17 0 "[ . 1 . 2 ]" 3 32 1 77 ALA O 1 114 LEU N 2.500 2.500 3.300 2.698 2.544 3.008 . 0 0 "[ . 1 . 2 ]" 3 33 1 77 ALA H 1 112 TYR O 0.000 . 2.500 1.952 1.620 2.295 . 0 0 "[ . 1 . 2 ]" 3 34 1 77 ALA N 1 112 TYR O 2.500 2.500 3.300 2.556 2.487 2.759 0.013 14 0 "[ . 1 . 2 ]" 3 35 1 75 ARG O 1 112 TYR H 0.000 . 2.500 2.522 2.469 2.600 0.100 12 0 "[ . 1 . 2 ]" 3 36 1 75 ARG O 1 112 TYR N 2.500 2.500 3.300 3.359 3.235 3.423 0.123 24 0 "[ . 1 . 2 ]" 3 37 1 111 GLU O 1 158 ILE H 0.000 . 2.500 1.946 1.779 2.251 . 0 0 "[ . 1 . 2 ]" 3 38 1 111 GLU O 1 158 ILE N 2.500 2.500 3.300 2.791 2.562 3.108 . 0 0 "[ . 1 . 2 ]" 3 39 1 113 LEU H 1 156 CYS O 0.000 . 2.500 2.269 1.583 2.517 0.017 4 0 "[ . 1 . 2 ]" 3 40 1 113 LEU N 1 156 CYS O 2.500 2.500 3.300 2.982 2.557 3.312 0.012 23 0 "[ . 1 . 2 ]" 3 41 1 115 THR H 1 154 MET O 0.000 . 2.500 2.303 2.110 2.484 . 0 0 "[ . 1 . 2 ]" 3 42 1 115 THR N 1 154 MET O 2.500 2.500 3.300 3.144 2.864 3.362 0.062 12 0 "[ . 1 . 2 ]" 3 43 1 115 THR O 1 154 MET H 0.000 . 2.500 1.729 1.515 2.040 . 0 0 "[ . 1 . 2 ]" 3 44 1 115 THR O 1 154 MET N 2.500 2.500 3.300 2.596 2.452 2.903 0.048 22 0 "[ . 1 . 2 ]" 3 45 1 131 THR O 1 155 GLU H 0.000 . 2.500 2.389 1.851 2.554 0.054 18 0 "[ . 1 . 2 ]" 3 46 1 131 THR O 1 155 GLU N 2.500 2.500 3.300 3.238 2.693 3.350 0.050 22 0 "[ . 1 . 2 ]" 3 47 1 131 THR H 1 155 GLU O 0.000 . 2.500 2.383 1.642 2.542 0.042 4 0 "[ . 1 . 2 ]" 3 48 1 131 THR N 1 155 GLU O 2.500 2.500 3.300 3.187 2.548 3.339 0.039 20 0 "[ . 1 . 2 ]" 3 49 1 16 HIS O 1 20 LYS H 0.000 . 2.500 2.117 1.618 2.384 . 0 0 "[ . 1 . 2 ]" 3 50 1 16 HIS O 1 20 LYS N 2.500 2.500 3.300 3.084 2.585 3.330 0.030 22 0 "[ . 1 . 2 ]" 3 51 1 17 ARG O 1 21 LEU H 0.000 . 2.500 2.320 2.040 2.397 . 0 0 "[ . 1 . 2 ]" 3 52 1 17 ARG O 1 21 LEU N 2.500 2.500 3.300 3.282 3.019 3.329 0.029 23 0 "[ . 1 . 2 ]" 3 53 1 18 ASN O 1 22 LEU H 0.000 . 2.500 1.922 1.660 2.344 . 0 0 "[ . 1 . 2 ]" 3 54 1 18 ASN O 1 22 LEU N 2.500 2.500 3.300 2.873 2.634 3.317 0.017 22 0 "[ . 1 . 2 ]" 3 55 1 19 MET O 1 23 ILE H 0.000 . 2.500 1.749 1.661 1.909 . 0 0 "[ . 1 . 2 ]" 3 56 1 19 MET O 1 23 ILE N 2.500 2.500 3.300 2.670 2.575 2.809 . 0 0 "[ . 1 . 2 ]" 3 57 1 20 LYS O 1 24 ASP H 0.000 . 2.500 2.367 2.328 2.388 . 0 0 "[ . 1 . 2 ]" 3 58 1 20 LYS O 1 24 ASP N 2.500 2.500 3.300 3.321 3.285 3.339 0.039 7 0 "[ . 1 . 2 ]" 3 59 1 21 LEU O 1 25 LEU H 0.000 . 2.500 2.406 2.372 2.440 . 0 0 "[ . 1 . 2 ]" 3 60 1 21 LEU O 1 25 LEU N 2.500 2.500 3.300 3.354 3.323 3.390 0.090 13 0 "[ . 1 . 2 ]" 3 61 1 22 LEU O 1 26 LYS H 0.000 . 2.500 2.360 2.287 2.408 . 0 0 "[ . 1 . 2 ]" 3 62 1 22 LEU O 1 26 LYS N 2.500 2.500 3.300 3.308 3.229 3.346 0.046 8 0 "[ . 1 . 2 ]" 3 63 1 23 ILE O 1 27 ASN H 0.000 . 2.500 2.176 1.894 2.325 . 0 0 "[ . 1 . 2 ]" 3 64 1 23 ILE O 1 27 ASN N 2.500 2.500 3.300 3.121 2.860 3.259 . 0 0 "[ . 1 . 2 ]" 3 65 1 24 ASP O 1 28 ILE H 0.000 . 2.500 1.799 1.641 1.945 . 0 0 "[ . 1 . 2 ]" 3 66 1 24 ASP O 1 28 ILE N 2.500 2.500 3.300 2.736 2.561 2.891 . 0 0 "[ . 1 . 2 ]" 3 67 1 25 LEU O 1 29 PHE H 0.000 . 2.500 2.157 2.078 2.216 . 0 0 "[ . 1 . 2 ]" 3 68 1 25 LEU O 1 29 PHE N 2.500 2.500 3.300 3.140 3.061 3.205 . 0 0 "[ . 1 . 2 ]" 3 69 1 26 LYS O 1 30 SER H 0.000 . 2.500 2.394 2.195 2.487 . 0 0 "[ . 1 . 2 ]" 3 70 1 26 LYS O 1 30 SER N 2.500 2.500 3.300 3.227 3.032 3.318 0.018 20 0 "[ . 1 . 2 ]" 3 71 1 38 LYS O 1 42 VAL H 0.000 . 2.500 2.018 1.752 2.227 . 0 0 "[ . 1 . 2 ]" 3 72 1 38 LYS O 1 42 VAL N 2.500 2.500 3.300 2.908 2.641 3.106 . 0 0 "[ . 1 . 2 ]" 3 73 1 39 GLU O 1 43 LYS H 0.000 . 2.500 1.685 1.640 1.780 . 0 0 "[ . 1 . 2 ]" 3 74 1 39 GLU O 1 43 LYS N 2.500 2.500 3.300 2.556 2.520 2.640 . 0 0 "[ . 1 . 2 ]" 3 75 1 40 TYR O 1 44 LEU H 0.000 . 2.500 1.822 1.580 2.120 . 0 0 "[ . 1 . 2 ]" 3 76 1 40 TYR O 1 44 LEU N 2.500 2.500 3.300 2.786 2.558 3.073 . 0 0 "[ . 1 . 2 ]" 3 77 1 41 ILE O 1 45 VAL H 0.000 . 2.500 1.631 1.530 1.755 . 0 0 "[ . 1 . 2 ]" 3 78 1 41 ILE O 1 45 VAL N 2.500 2.500 3.300 2.497 2.473 2.530 0.027 5 0 "[ . 1 . 2 ]" 3 79 1 42 VAL O 1 46 PHE H 0.000 . 2.500 1.730 1.590 1.923 . 0 0 "[ . 1 . 2 ]" 3 80 1 42 VAL O 1 46 PHE N 2.500 2.500 3.300 2.565 2.493 2.653 0.007 18 0 "[ . 1 . 2 ]" 3 81 1 43 LYS O 1 47 ASP H 0.000 . 2.500 2.540 2.528 2.558 0.058 10 0 "[ . 1 . 2 ]" 3 82 1 43 LYS O 1 47 ASP N 2.500 2.500 3.300 2.700 2.572 2.905 . 0 0 "[ . 1 . 2 ]" 3 83 1 94 GLY O 1 98 MET H 0.000 . 2.500 1.920 1.625 2.396 . 0 0 "[ . 1 . 2 ]" 3 84 1 94 GLY O 1 98 MET N 2.500 2.500 3.300 2.859 2.597 3.279 . 0 0 "[ . 1 . 2 ]" 3 85 1 95 THR O 1 99 ASN H 0.000 . 2.500 2.170 2.053 2.358 . 0 0 "[ . 1 . 2 ]" 3 86 1 95 THR O 1 99 ASN N 2.500 2.500 3.300 3.142 3.024 3.309 0.009 3 0 "[ . 1 . 2 ]" 3 87 1 96 ARG O 1 100 LYS H 0.000 . 2.500 2.475 2.282 2.571 0.071 4 0 "[ . 1 . 2 ]" 3 88 1 96 ARG O 1 100 LYS N 2.500 2.500 3.300 3.269 3.069 3.337 0.037 3 0 "[ . 1 . 2 ]" 3 89 1 97 LEU O 1 101 PHE H 0.000 . 2.500 1.963 1.716 2.376 . 0 0 "[ . 1 . 2 ]" 3 90 1 97 LEU O 1 101 PHE N 2.500 2.500 3.300 2.779 2.570 3.165 . 0 0 "[ . 1 . 2 ]" 3 91 1 98 MET O 1 102 LYS H 0.000 . 2.500 2.443 2.266 2.507 0.007 3 0 "[ . 1 . 2 ]" 3 92 1 98 MET O 1 102 LYS N 2.500 2.500 3.300 3.319 3.189 3.374 0.074 4 0 "[ . 1 . 2 ]" 3 93 1 99 ASN O 1 103 ASP H 0.000 . 2.500 2.053 1.720 2.299 . 0 0 "[ . 1 . 2 ]" 3 94 1 99 ASN O 1 103 ASP N 2.500 2.500 3.300 3.011 2.666 3.212 . 0 0 "[ . 1 . 2 ]" 3 95 1 100 LYS O 1 104 HIS H 0.000 . 2.500 2.404 2.227 2.516 0.016 15 0 "[ . 1 . 2 ]" 3 96 1 100 LYS O 1 104 HIS N 2.500 2.500 3.300 3.268 3.059 3.348 0.048 22 0 "[ . 1 . 2 ]" 3 97 1 101 PHE O 1 105 MET H 0.000 . 2.500 2.004 1.812 2.321 . 0 0 "[ . 1 . 2 ]" 3 98 1 101 PHE O 1 105 MET N 2.500 2.500 3.300 2.884 2.701 3.107 . 0 0 "[ . 1 . 2 ]" 3 99 1 102 LYS O 1 106 GLN H 0.000 . 2.500 2.257 2.047 2.506 0.006 24 0 "[ . 1 . 2 ]" 3 100 1 102 LYS O 1 106 GLN N 2.500 2.500 3.300 3.058 2.928 3.218 . 0 0 "[ . 1 . 2 ]" 3 101 1 103 ASP O 1 107 LYS H 0.000 . 2.500 2.525 2.482 2.572 0.072 9 0 "[ . 1 . 2 ]" 3 102 1 103 ASP O 1 107 LYS N 2.500 2.500 3.300 3.316 3.259 3.351 0.051 9 0 "[ . 1 . 2 ]" 3 103 1 104 HIS O 1 108 GLN H 0.000 . 2.500 2.505 2.381 2.564 0.064 22 0 "[ . 1 . 2 ]" 3 104 1 104 HIS O 1 108 GLN N 2.500 2.500 3.300 3.203 3.045 3.414 0.114 12 0 "[ . 1 . 2 ]" 3 105 1 120 PHE O 1 124 TYR H 0.000 . 2.500 2.516 2.462 2.546 0.046 10 0 "[ . 1 . 2 ]" 3 106 1 120 PHE O 1 124 TYR N 2.500 2.500 3.300 3.398 3.367 3.443 0.143 6 0 "[ . 1 . 2 ]" 3 107 1 121 ALA O 1 125 PHE H 0.000 . 2.500 1.754 1.570 1.843 . 0 0 "[ . 1 . 2 ]" 3 108 1 121 ALA O 1 125 PHE N 2.500 2.500 3.300 2.509 2.445 2.568 0.055 22 0 "[ . 1 . 2 ]" 3 109 1 122 ILE O 1 126 LYS H 0.000 . 2.500 1.866 1.771 1.959 . 0 0 "[ . 1 . 2 ]" 3 110 1 122 ILE O 1 126 LYS N 2.500 2.500 3.300 2.826 2.733 2.926 . 0 0 "[ . 1 . 2 ]" 3 111 1 123 GLY O 1 127 LYS H 0.000 . 2.500 2.465 2.274 2.525 0.025 18 0 "[ . 1 . 2 ]" 3 112 1 123 GLY O 1 127 LYS N 2.500 2.500 3.300 3.014 2.866 3.243 . 0 0 "[ . 1 . 2 ]" 3 113 1 124 TYR O 1 128 GLN H 0.000 . 2.500 2.519 2.478 2.549 0.049 19 0 "[ . 1 . 2 ]" 3 114 1 124 TYR O 1 128 GLN N 2.500 2.500 3.300 3.329 3.264 3.377 0.077 24 0 "[ . 1 . 2 ]" 3 115 1 125 PHE O 1 129 GLY H 0.000 . 2.500 2.489 2.250 2.544 0.044 16 0 "[ . 1 . 2 ]" 3 116 1 125 PHE O 1 129 GLY N 2.500 2.500 3.300 3.203 2.954 3.291 . 0 0 "[ . 1 . 2 ]" 3 stop_ save_
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