NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
480761 | 2kyh | 16957 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2kyh 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 1115 _Distance_constraint_stats_list.Viol_count 2194 _Distance_constraint_stats_list.Viol_total 4283.848 _Distance_constraint_stats_list.Viol_max 0.495 _Distance_constraint_stats_list.Viol_rms 0.0401 _Distance_constraint_stats_list.Viol_average_all_restraints 0.0096 _Distance_constraint_stats_list.Viol_average_violations_only 0.0976 _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 6 ASP 0.111 0.072 19 0 "[ . 1 . 2]" 1 7 LEU 1.731 0.375 17 0 "[ . 1 . 2]" 1 8 GLY 1.468 0.375 17 0 "[ . 1 . 2]" 1 9 GLY 0.850 0.258 20 0 "[ . 1 . 2]" 1 10 ARG 5.476 0.397 16 0 "[ . 1 . 2]" 1 11 VAL 7.832 0.397 16 0 "[ . 1 . 2]" 1 12 ARG 1.547 0.258 20 0 "[ . 1 . 2]" 1 13 ASN 4.904 0.443 9 0 "[ . 1 . 2]" 1 14 ILE 4.241 0.270 15 0 "[ . 1 . 2]" 1 15 GLY 0.000 0.000 . 0 "[ . 1 . 2]" 1 16 ASP 3.338 0.177 6 0 "[ . 1 . 2]" 1 17 VAL 7.455 0.443 9 0 "[ . 1 . 2]" 1 18 MET 1.107 0.155 12 0 "[ . 1 . 2]" 1 19 GLU 6.245 0.489 9 0 "[ . 1 . 2]" 1 20 HIS 3.729 0.418 18 0 "[ . 1 . 2]" 1 21 PRO 1.251 0.225 7 0 "[ . 1 . 2]" 1 22 LEU 4.891 0.382 15 0 "[ . 1 . 2]" 1 23 VAL 11.586 0.489 9 0 "[ . 1 . 2]" 1 24 GLU 0.653 0.225 7 0 "[ . 1 . 2]" 1 25 LEU 0.320 0.141 17 0 "[ . 1 . 2]" 1 26 GLY 0.713 0.156 8 0 "[ . 1 . 2]" 1 27 VAL 3.367 0.286 13 0 "[ . 1 . 2]" 1 28 SER 0.661 0.200 3 0 "[ . 1 . 2]" 1 29 TYR 1.226 0.209 9 0 "[ . 1 . 2]" 1 30 ALA 0.106 0.089 8 0 "[ . 1 . 2]" 1 31 ALA 0.681 0.207 4 0 "[ . 1 . 2]" 1 32 LEU 0.000 0.000 . 0 "[ . 1 . 2]" 1 33 LEU 0.833 0.209 9 0 "[ . 1 . 2]" 1 34 SER 0.000 0.000 . 0 "[ . 1 . 2]" 1 35 VAL 1.584 0.277 11 0 "[ . 1 . 2]" 1 36 ILE 1.366 0.411 9 0 "[ . 1 . 2]" 1 37 VAL 0.576 0.294 7 0 "[ . 1 . 2]" 1 38 VAL 4.177 0.403 15 0 "[ . 1 . 2]" 1 39 VAL 5.086 0.411 9 0 "[ . 1 . 2]" 1 40 VAL 1.701 0.282 20 0 "[ . 1 . 2]" 1 41 GLU 0.694 0.172 4 0 "[ . 1 . 2]" 1 42 TYR 8.354 0.364 4 0 "[ . 1 . 2]" 1 43 THR 8.418 0.364 4 0 "[ . 1 . 2]" 1 44 MET 9.550 0.282 20 0 "[ . 1 . 2]" 1 45 GLN 3.457 0.447 11 0 "[ . 1 . 2]" 1 46 LEU 4.904 0.447 11 0 "[ . 1 . 2]" 1 47 SER 5.064 0.294 16 0 "[ . 1 . 2]" 1 48 GLY 0.509 0.123 14 0 "[ . 1 . 2]" 1 49 GLU 1.414 0.291 2 0 "[ . 1 . 2]" 1 50 TYR 1.661 0.291 2 0 "[ . 1 . 2]" 1 51 LEU 6.233 0.459 15 0 "[ . 1 . 2]" 1 52 VAL 5.073 0.375 17 0 "[ . 1 . 2]" 1 53 ARG 3.118 0.375 17 0 "[ . 1 . 2]" 1 54 LEU 2.626 0.160 11 0 "[ . 1 . 2]" 1 55 TYR 3.458 0.459 15 0 "[ . 1 . 2]" 1 56 LEU 6.974 0.472 13 0 "[ . 1 . 2]" 1 57 VAL 8.784 0.495 12 0 "[ . 1 . 2]" 1 58 ASP 1.222 0.294 7 0 "[ . 1 . 2]" 1 59 LEU 1.450 0.214 17 0 "[ . 1 . 2]" 1 60 ILE 1.034 0.182 11 0 "[ . 1 . 2]" 1 61 LEU 3.357 0.495 12 0 "[ . 1 . 2]" 1 62 VAL 5.392 0.419 6 0 "[ . 1 . 2]" 1 63 ILE 1.174 0.235 8 0 "[ . 1 . 2]" 1 64 ILE 0.755 0.403 13 0 "[ . 1 . 2]" 1 65 LEU 1.971 0.207 4 0 "[ . 1 . 2]" 1 66 TRP 4.517 0.338 10 0 "[ . 1 . 2]" 1 67 ALA 4.247 0.286 13 0 "[ . 1 . 2]" 1 68 ASP 1.708 0.181 14 0 "[ . 1 . 2]" 1 69 TYR 2.825 0.314 5 0 "[ . 1 . 2]" 1 70 ALA 2.071 0.160 17 0 "[ . 1 . 2]" 1 71 TYR 0.901 0.213 12 0 "[ . 1 . 2]" 1 72 ARG 1.745 0.230 7 0 "[ . 1 . 2]" 1 73 ALA 1.060 0.175 14 0 "[ . 1 . 2]" 1 74 TYR 1.059 0.169 9 0 "[ . 1 . 2]" 1 75 LYS 1.456 0.151 9 0 "[ . 1 . 2]" 1 76 SER 4.679 0.299 14 0 "[ . 1 . 2]" 1 77 GLY 2.509 0.116 14 0 "[ . 1 . 2]" 1 78 ASP 4.325 0.141 10 0 "[ . 1 . 2]" 1 79 PRO 1.346 0.394 14 0 "[ . 1 . 2]" 1 80 ALA 6.245 0.252 4 0 "[ . 1 . 2]" 1 81 GLY 3.422 0.161 15 0 "[ . 1 . 2]" 1 82 TYR 5.688 0.394 14 0 "[ . 1 . 2]" 1 83 VAL 16.805 0.405 11 0 "[ . 1 . 2]" 1 84 LYS 2.612 0.236 6 0 "[ . 1 . 2]" 1 85 LYS 14.415 0.381 17 0 "[ . 1 . 2]" 1 86 THR 8.224 0.405 11 0 "[ . 1 . 2]" 1 87 LEU 7.741 0.344 15 0 "[ . 1 . 2]" 1 88 TYR 0.199 0.090 19 0 "[ . 1 . 2]" 1 89 GLU 0.185 0.101 16 0 "[ . 1 . 2]" 1 90 ILE 5.001 0.344 15 0 "[ . 1 . 2]" 1 91 PRO 0.844 0.119 10 0 "[ . 1 . 2]" 1 92 ALA 1.966 0.216 12 0 "[ . 1 . 2]" 1 93 LEU 4.374 0.419 6 0 "[ . 1 . 2]" 1 94 VAL 0.531 0.124 12 0 "[ . 1 . 2]" 1 95 PRO 0.139 0.084 19 0 "[ . 1 . 2]" 1 96 ALA 1.067 0.169 19 0 "[ . 1 . 2]" 1 97 GLY 0.000 0.000 . 0 "[ . 1 . 2]" 1 98 LEU 0.781 0.167 2 0 "[ . 1 . 2]" 1 99 LEU 0.684 0.169 19 0 "[ . 1 . 2]" 1 100 ALA 1.669 0.494 13 0 "[ . 1 . 2]" 1 101 LEU 1.594 0.494 13 0 "[ . 1 . 2]" 1 102 ILE 2.905 0.169 19 0 "[ . 1 . 2]" 1 103 GLU 1.427 0.337 18 0 "[ . 1 . 2]" 1 104 GLY 1.138 0.162 9 0 "[ . 1 . 2]" 1 105 HIS 0.351 0.107 16 0 "[ . 1 . 2]" 1 106 LEU 1.946 0.230 16 0 "[ . 1 . 2]" 1 107 ALA 0.430 0.086 13 0 "[ . 1 . 2]" 1 108 GLY 0.000 0.000 . 0 "[ . 1 . 2]" 1 109 LEU 0.346 0.145 3 0 "[ . 1 . 2]" 1 110 GLY 0.000 0.000 . 0 "[ . 1 . 2]" 1 111 LEU 0.477 0.145 3 0 "[ . 1 . 2]" 1 112 PHE 0.271 0.086 13 0 "[ . 1 . 2]" 1 113 ARG 1.913 0.257 18 0 "[ . 1 . 2]" 1 114 LEU 0.550 0.108 6 0 "[ . 1 . 2]" 1 115 VAL 0.966 0.186 16 0 "[ . 1 . 2]" 1 116 ARG 6.523 0.327 10 0 "[ . 1 . 2]" 1 117 LEU 1.267 0.345 13 0 "[ . 1 . 2]" 1 118 LEU 3.296 0.348 11 0 "[ . 1 . 2]" 1 119 ARG 6.573 0.348 11 0 "[ . 1 . 2]" 1 120 PHE 2.406 0.345 13 0 "[ . 1 . 2]" 1 121 LEU 0.763 0.283 4 0 "[ . 1 . 2]" 1 122 ARG 0.741 0.275 19 0 "[ . 1 . 2]" 1 123 ILE 1.137 0.336 2 0 "[ . 1 . 2]" 1 124 LEU 0.289 0.097 19 0 "[ . 1 . 2]" 1 125 LEU 1.065 0.263 16 0 "[ . 1 . 2]" 1 126 ILE 2.951 0.403 15 0 "[ . 1 . 2]" 1 127 ILE 1.243 0.331 4 0 "[ . 1 . 2]" 1 128 SER 1.002 0.216 12 0 "[ . 1 . 2]" 1 129 ARG 2.835 0.310 6 0 "[ . 1 . 2]" 1 130 GLY 0.347 0.197 15 0 "[ . 1 . 2]" 1 131 SER 0.555 0.247 12 0 "[ . 1 . 2]" 1 132 LYS 4.986 0.335 12 0 "[ . 1 . 2]" 1 133 PHE 2.202 0.232 19 0 "[ . 1 . 2]" 1 134 LEU 1.629 0.247 12 0 "[ . 1 . 2]" 1 135 SER 3.651 0.335 12 0 "[ . 1 . 2]" 1 136 ALA 0.223 0.158 13 0 "[ . 1 . 2]" 1 137 ILE 2.845 0.232 19 0 "[ . 1 . 2]" 1 138 ALA 1.084 0.072 17 0 "[ . 1 . 2]" 1 139 ASP 4.047 0.268 10 0 "[ . 1 . 2]" 1 140 ALA 1.552 0.164 10 0 "[ . 1 . 2]" 1 141 ALA 5.155 0.382 10 0 "[ . 1 . 2]" 1 142 ASP 2.485 0.214 11 0 "[ . 1 . 2]" 1 143 LYS 3.727 0.268 10 0 "[ . 1 . 2]" 1 144 LEU 10.144 0.470 17 0 "[ . 1 . 2]" 1 145 VAL 9.274 0.470 17 0 "[ . 1 . 2]" 1 146 PRO 0.400 0.083 15 0 "[ . 1 . 2]" 1 147 ARG 1.561 0.177 9 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 HA 1 7 LEU H 2.650 . 3.500 2.439 2.132 3.572 0.072 19 0 "[ . 1 . 2]" 1 2 1 6 ASP QB 1 7 LEU H 3.150 . 4.500 3.300 1.960 4.003 . 0 0 "[ . 1 . 2]" 1 3 1 7 LEU H 1 7 LEU QB 3.150 . 4.500 2.823 2.172 3.364 . 0 0 "[ . 1 . 2]" 1 4 1 7 LEU H 1 8 GLY H 2.650 . 3.500 3.028 2.071 3.648 0.148 1 0 "[ . 1 . 2]" 1 5 1 7 LEU HA 1 8 GLY H 3.150 . 4.500 3.140 2.211 3.569 . 0 0 "[ . 1 . 2]" 1 6 1 7 LEU QB 1 8 GLY QA 3.150 . 4.500 3.965 3.420 4.504 0.004 15 0 "[ . 1 . 2]" 1 7 1 7 LEU QB 1 11 VAL H 3.650 . 5.500 5.184 3.681 5.673 0.173 2 0 "[ . 1 . 2]" 1 8 1 7 LEU QD 1 8 GLY QA 3.150 . 4.500 3.910 2.704 4.497 . 0 0 "[ . 1 . 2]" 1 9 1 7 LEU HG 1 8 GLY QA 3.150 . 4.500 4.002 3.318 4.875 0.375 17 0 "[ . 1 . 2]" 1 10 1 8 GLY H 1 8 GLY QA 2.650 . 3.500 2.271 2.193 2.503 . 0 0 "[ . 1 . 2]" 1 11 1 8 GLY QA 1 11 VAL HB 3.150 . 4.500 3.555 2.491 4.869 0.369 8 0 "[ . 1 . 2]" 1 12 1 8 GLY QA 1 11 VAL QG 3.150 . 4.500 3.148 2.313 4.790 0.290 8 0 "[ . 1 . 2]" 1 13 1 9 GLY QA 1 10 ARG H 3.650 . 5.500 2.690 2.403 2.843 . 0 0 "[ . 1 . 2]" 1 14 1 9 GLY QA 1 10 ARG HA 3.150 . 4.500 4.060 3.986 4.552 0.052 8 0 "[ . 1 . 2]" 1 15 1 9 GLY QA 1 12 ARG QB 3.150 . 4.500 3.295 2.301 4.628 0.128 15 0 "[ . 1 . 2]" 1 16 1 9 GLY QA 1 12 ARG QG 3.150 . 4.500 4.066 2.348 4.758 0.258 20 0 "[ . 1 . 2]" 1 17 1 10 ARG H 1 10 ARG HA 2.650 . 3.500 2.808 2.294 2.921 . 0 0 "[ . 1 . 2]" 1 18 1 10 ARG H 1 11 VAL MG2 3.150 . 4.500 3.958 3.456 4.897 0.397 16 0 "[ . 1 . 2]" 1 19 1 10 ARG HA 1 11 VAL H 2.650 . 3.500 3.475 2.947 3.567 0.067 5 0 "[ . 1 . 2]" 1 20 1 10 ARG HA 1 11 VAL QG 3.150 . 4.500 4.584 4.110 4.723 0.223 11 0 "[ . 1 . 2]" 1 21 1 10 ARG HA 1 11 VAL MG1 3.150 . 4.500 3.616 3.044 4.062 . 0 0 "[ . 1 . 2]" 1 22 1 10 ARG QB 1 11 VAL H 2.650 . 3.500 2.728 1.979 3.749 0.249 8 0 "[ . 1 . 2]" 1 23 1 10 ARG QB 1 11 VAL QG 3.150 . 4.500 3.073 2.426 3.939 . 0 0 "[ . 1 . 2]" 1 24 1 10 ARG QD 1 11 VAL QG 3.650 . 5.500 4.130 2.956 4.911 . 0 0 "[ . 1 . 2]" 1 25 1 10 ARG QG 1 11 VAL HA 3.650 . 5.500 4.884 2.958 5.785 0.285 7 0 "[ . 1 . 2]" 1 26 1 11 VAL H 1 11 VAL HA 2.650 . 3.500 2.839 2.748 2.961 . 0 0 "[ . 1 . 2]" 1 27 1 11 VAL H 1 11 VAL HB 2.300 . 2.800 2.583 2.454 2.778 . 0 0 "[ . 1 . 2]" 1 28 1 11 VAL H 1 12 ARG H 3.150 . 4.500 2.824 1.756 4.277 0.044 18 0 "[ . 1 . 2]" 1 29 1 11 VAL HA 1 12 ARG H 2.650 . 3.500 3.323 2.166 3.564 0.064 8 0 "[ . 1 . 2]" 1 30 1 11 VAL HA 1 14 ILE HB 2.650 . 3.500 2.805 2.243 3.603 0.103 15 0 "[ . 1 . 2]" 1 31 1 11 VAL HA 1 14 ILE QG 3.150 . 4.500 3.890 2.704 4.592 0.092 18 0 "[ . 1 . 2]" 1 32 1 11 VAL HA 1 75 LYS QE 3.650 . 5.500 4.760 3.293 5.590 0.090 10 0 "[ . 1 . 2]" 1 33 1 11 VAL MG2 1 75 LYS QE 3.650 . 5.500 4.321 2.369 5.454 . 0 0 "[ . 1 . 2]" 1 34 1 12 ARG H 1 12 ARG QB 3.650 . 5.500 2.442 2.176 3.349 . 0 0 "[ . 1 . 2]" 1 35 1 12 ARG HA 1 13 ASN H 3.150 . 4.500 3.408 2.151 3.585 . 0 0 "[ . 1 . 2]" 1 36 1 12 ARG QB 1 13 ASN HA 3.150 . 4.500 4.057 3.768 4.731 0.231 15 0 "[ . 1 . 2]" 1 37 1 13 ASN H 1 13 ASN QB 3.650 . 5.500 2.508 2.039 3.486 . 0 0 "[ . 1 . 2]" 1 38 1 13 ASN HA 1 14 ILE H 2.650 . 3.500 3.461 2.908 3.573 0.073 5 0 "[ . 1 . 2]" 1 39 1 13 ASN HA 1 17 VAL HB 3.150 . 4.500 4.703 4.585 4.943 0.443 9 0 "[ . 1 . 2]" 1 40 1 13 ASN QB 1 14 ILE H 3.150 . 4.500 2.846 2.273 3.795 . 0 0 "[ . 1 . 2]" 1 41 1 14 ILE H 1 14 ILE HB 2.650 . 3.500 2.353 2.120 2.552 . 0 0 "[ . 1 . 2]" 1 42 1 14 ILE H 1 15 GLY H 2.650 . 3.500 2.688 2.545 2.834 . 0 0 "[ . 1 . 2]" 1 43 1 14 ILE HA 1 17 VAL HB 2.650 . 3.500 2.469 2.238 3.247 . 0 0 "[ . 1 . 2]" 1 44 1 14 ILE HB 1 15 GLY H 3.150 . 4.500 2.934 2.402 3.835 . 0 0 "[ . 1 . 2]" 1 45 1 14 ILE MD 1 18 MET QB 3.650 . 5.500 4.637 2.313 5.630 0.130 8 0 "[ . 1 . 2]" 1 46 1 14 ILE QG 1 17 VAL HB 3.150 . 4.500 4.455 3.888 4.770 0.270 15 0 "[ . 1 . 2]" 1 47 1 14 ILE MG 1 15 GLY H 3.650 . 5.500 2.950 1.900 3.722 . 0 0 "[ . 1 . 2]" 1 48 1 14 ILE MG 1 18 MET QB 3.150 . 4.500 2.767 2.044 3.820 . 0 0 "[ . 1 . 2]" 1 49 1 14 ILE MG 1 71 TYR QD 3.150 . 4.500 3.817 2.410 4.713 0.213 12 0 "[ . 1 . 2]" 1 50 1 14 ILE MG 1 71 TYR QE 3.150 . 4.500 2.786 2.115 3.798 . 0 0 "[ . 1 . 2]" 1 51 1 14 ILE MG 1 72 ARG QD 3.650 . 5.500 5.415 4.139 5.730 0.230 7 0 "[ . 1 . 2]" 1 52 1 14 ILE MG 1 75 LYS QE 3.650 . 5.500 3.230 2.092 4.812 . 0 0 "[ . 1 . 2]" 1 53 1 15 GLY H 1 15 GLY QA 2.300 . 2.800 2.202 2.193 2.215 . 0 0 "[ . 1 . 2]" 1 54 1 15 GLY H 1 16 ASP H 2.650 . 3.500 2.856 2.624 3.188 . 0 0 "[ . 1 . 2]" 1 55 1 15 GLY QA 1 16 ASP H 2.650 . 3.500 2.631 2.521 2.766 . 0 0 "[ . 1 . 2]" 1 56 1 15 GLY QA 1 16 ASP HA 3.650 . 5.500 4.007 3.985 4.022 . 0 0 "[ . 1 . 2]" 1 57 1 16 ASP H 1 16 ASP HA 2.300 . 2.800 2.862 2.818 2.912 0.112 17 0 "[ . 1 . 2]" 1 58 1 16 ASP H 1 16 ASP QB 2.300 . 2.800 2.354 2.247 2.706 . 0 0 "[ . 1 . 2]" 1 59 1 16 ASP H 1 17 VAL H 2.300 . 2.800 2.528 2.321 2.684 . 0 0 "[ . 1 . 2]" 1 60 1 16 ASP H 1 17 VAL HB 3.150 . 4.500 4.566 4.420 4.677 0.177 6 0 "[ . 1 . 2]" 1 61 1 16 ASP HA 1 17 VAL H 2.650 . 3.500 3.503 3.326 3.556 0.056 18 0 "[ . 1 . 2]" 1 62 1 16 ASP HA 1 19 GLU QB 3.650 . 5.500 3.554 2.769 5.553 0.053 2 0 "[ . 1 . 2]" 1 63 1 16 ASP QB 1 17 VAL H 3.150 . 4.500 2.768 2.368 3.827 . 0 0 "[ . 1 . 2]" 1 64 1 16 ASP QB 1 17 VAL QG 3.150 . 4.500 3.294 2.868 4.260 . 0 0 "[ . 1 . 2]" 1 65 1 17 VAL H 1 17 VAL HA 2.650 . 3.500 2.864 2.811 2.948 . 0 0 "[ . 1 . 2]" 1 66 1 17 VAL H 1 17 VAL HB 2.650 . 3.500 2.337 2.129 2.476 . 0 0 "[ . 1 . 2]" 1 67 1 17 VAL H 1 18 MET H 2.650 . 3.500 2.553 2.190 2.770 . 0 0 "[ . 1 . 2]" 1 68 1 17 VAL HA 1 18 MET H 3.150 . 4.500 3.474 3.290 3.579 . 0 0 "[ . 1 . 2]" 1 69 1 17 VAL QG 1 18 MET H 3.650 . 5.500 3.141 1.901 3.641 . 0 0 "[ . 1 . 2]" 1 70 1 17 VAL QG 1 18 MET HA 3.150 . 4.500 3.360 2.955 3.840 . 0 0 "[ . 1 . 2]" 1 71 1 17 VAL QG 1 19 GLU H 3.650 . 5.500 4.307 3.602 4.899 . 0 0 "[ . 1 . 2]" 1 72 1 17 VAL MG1 1 18 MET H 3.150 . 4.500 3.319 1.905 4.001 . 0 0 "[ . 1 . 2]" 1 73 1 18 MET H 1 18 MET HA 2.650 . 3.500 2.858 2.784 2.952 . 0 0 "[ . 1 . 2]" 1 74 1 18 MET H 1 18 MET QB 3.150 . 4.500 2.266 2.104 2.370 . 0 0 "[ . 1 . 2]" 1 75 1 18 MET H 1 19 GLU H 2.650 . 3.500 2.561 2.270 2.804 . 0 0 "[ . 1 . 2]" 1 76 1 18 MET ME 1 23 VAL HB 3.650 . 5.500 5.296 4.096 5.655 0.155 12 0 "[ . 1 . 2]" 1 77 1 18 MET ME 1 23 VAL MG1 3.650 . 5.500 4.044 2.493 5.077 . 0 0 "[ . 1 . 2]" 1 78 1 18 MET ME 1 67 ALA MB 3.650 . 5.500 4.480 3.012 5.536 0.036 6 0 "[ . 1 . 2]" 1 79 1 18 MET ME 1 68 ASP QB 3.650 . 5.500 3.615 2.347 5.010 . 0 0 "[ . 1 . 2]" 1 80 1 18 MET ME 1 71 TYR QB 3.650 . 5.500 3.065 2.141 4.432 . 0 0 "[ . 1 . 2]" 1 81 1 18 MET ME 1 71 TYR QD 3.150 . 4.500 3.326 2.231 4.637 0.137 7 0 "[ . 1 . 2]" 1 82 1 19 GLU H 1 19 GLU QB 2.650 . 3.500 2.485 2.219 2.867 . 0 0 "[ . 1 . 2]" 1 83 1 19 GLU H 1 20 HIS H 3.150 . 4.500 2.501 1.883 3.021 . 0 0 "[ . 1 . 2]" 1 84 1 19 GLU H 1 20 HIS HA 3.150 . 4.500 4.454 4.245 4.806 0.306 9 0 "[ . 1 . 2]" 1 85 1 19 GLU HA 1 20 HIS H 2.650 . 3.500 3.098 2.955 3.461 . 0 0 "[ . 1 . 2]" 1 86 1 19 GLU HA 1 23 VAL MG1 3.150 . 4.500 2.318 2.094 2.787 . 0 0 "[ . 1 . 2]" 1 87 1 19 GLU HA 1 23 VAL MG2 3.150 . 4.500 3.906 2.713 4.475 . 0 0 "[ . 1 . 2]" 1 88 1 19 GLU QB 1 20 HIS H 3.150 . 4.500 3.695 2.913 4.034 . 0 0 "[ . 1 . 2]" 1 89 1 19 GLU QB 1 23 VAL MG1 2.650 . 3.500 3.745 3.364 3.989 0.489 9 0 "[ . 1 . 2]" 1 90 1 20 HIS H 1 20 HIS QB 2.650 . 3.500 2.273 2.085 2.601 . 0 0 "[ . 1 . 2]" 1 91 1 20 HIS H 1 23 VAL HB 3.650 . 5.500 3.526 2.799 3.976 . 0 0 "[ . 1 . 2]" 1 92 1 20 HIS H 1 23 VAL MG2 3.650 . 5.500 4.167 3.162 4.860 . 0 0 "[ . 1 . 2]" 1 93 1 20 HIS QB 1 22 LEU QD 3.650 . 5.500 3.659 2.676 4.687 . 0 0 "[ . 1 . 2]" 1 94 1 20 HIS QB 1 23 VAL H 3.150 . 4.500 2.995 2.470 4.094 . 0 0 "[ . 1 . 2]" 1 95 1 20 HIS QB 1 23 VAL MG2 3.150 . 4.500 4.257 2.297 4.918 0.418 18 0 "[ . 1 . 2]" 1 96 1 20 HIS HE1 1 22 LEU QD 3.150 . 4.500 3.093 2.009 4.366 . 0 0 "[ . 1 . 2]" 1 97 1 20 HIS HE1 1 22 LEU HG 3.150 . 4.500 4.039 2.811 4.882 0.382 15 0 "[ . 1 . 2]" 1 98 1 21 PRO HA 1 23 VAL H 3.150 . 4.500 4.384 3.937 4.581 0.081 12 0 "[ . 1 . 2]" 1 99 1 21 PRO HA 1 24 GLU QB 3.150 . 4.500 2.805 2.222 3.474 . 0 0 "[ . 1 . 2]" 1 100 1 21 PRO HA 1 24 GLU QG 3.150 . 4.500 4.046 2.915 4.725 0.225 7 0 "[ . 1 . 2]" 1 101 1 21 PRO HA 1 25 LEU H 3.150 . 4.500 4.288 3.769 4.641 0.141 17 0 "[ . 1 . 2]" 1 102 1 21 PRO QB 1 22 LEU QD 3.150 . 4.500 3.189 2.174 4.466 . 0 0 "[ . 1 . 2]" 1 103 1 22 LEU H 1 23 VAL H 3.150 . 4.500 2.642 2.547 2.788 . 0 0 "[ . 1 . 2]" 1 104 1 22 LEU H 1 23 VAL MG2 3.650 . 5.500 5.465 4.342 5.840 0.340 4 0 "[ . 1 . 2]" 1 105 1 22 LEU HA 1 23 VAL H 3.150 . 4.500 3.529 3.457 3.567 . 0 0 "[ . 1 . 2]" 1 106 1 22 LEU HA 1 25 LEU QD 3.650 . 5.500 3.547 2.356 4.781 . 0 0 "[ . 1 . 2]" 1 107 1 22 LEU QB 1 23 VAL H 2.650 . 3.500 2.662 2.380 3.439 . 0 0 "[ . 1 . 2]" 1 108 1 23 VAL H 1 23 VAL HB 2.650 . 3.500 2.242 2.084 2.373 . 0 0 "[ . 1 . 2]" 1 109 1 23 VAL H 1 24 GLU H 2.650 . 3.500 2.606 2.467 2.723 . 0 0 "[ . 1 . 2]" 1 110 1 23 VAL H 1 24 GLU QB 3.650 . 5.500 4.428 4.177 4.738 . 0 0 "[ . 1 . 2]" 1 111 1 23 VAL QG 1 24 GLU H 3.650 . 5.500 2.230 1.849 3.095 . 0 0 "[ . 1 . 2]" 1 112 1 23 VAL MG1 1 24 GLU HA 3.150 . 4.500 3.017 2.793 3.274 . 0 0 "[ . 1 . 2]" 1 113 1 23 VAL MG1 1 26 GLY H 3.650 . 5.500 4.857 4.128 5.246 . 0 0 "[ . 1 . 2]" 1 114 1 24 GLU H 1 24 GLU HA 2.650 . 3.500 2.810 2.736 2.861 . 0 0 "[ . 1 . 2]" 1 115 1 24 GLU H 1 24 GLU QB 3.150 . 4.500 2.288 2.201 2.488 . 0 0 "[ . 1 . 2]" 1 116 1 24 GLU HA 1 27 VAL HB 3.150 . 4.500 3.155 2.594 3.595 . 0 0 "[ . 1 . 2]" 1 117 1 24 GLU HA 1 27 VAL QG 3.150 . 4.500 3.603 3.322 3.947 . 0 0 "[ . 1 . 2]" 1 118 1 24 GLU QB 1 25 LEU H 3.150 . 4.500 2.374 2.096 2.621 . 0 0 "[ . 1 . 2]" 1 119 1 25 LEU H 1 25 LEU QB 2.650 . 3.500 2.259 2.072 2.543 . 0 0 "[ . 1 . 2]" 1 120 1 25 LEU H 1 26 GLY H 2.650 . 3.500 2.670 2.600 2.742 . 0 0 "[ . 1 . 2]" 1 121 1 25 LEU HA 1 26 GLY H 3.150 . 4.500 3.548 3.531 3.566 . 0 0 "[ . 1 . 2]" 1 122 1 25 LEU QB 1 26 GLY H 3.650 . 5.500 2.599 2.436 2.757 . 0 0 "[ . 1 . 2]" 1 123 1 25 LEU QD 1 29 TYR H 3.650 . 5.500 4.423 3.142 5.435 . 0 0 "[ . 1 . 2]" 1 124 1 26 GLY H 1 26 GLY QA 2.650 . 3.500 2.203 2.195 2.217 . 0 0 "[ . 1 . 2]" 1 125 1 26 GLY H 1 27 VAL H 3.150 . 4.500 2.799 2.654 2.912 . 0 0 "[ . 1 . 2]" 1 126 1 26 GLY QA 1 27 VAL H 3.650 . 5.500 2.646 2.566 2.700 . 0 0 "[ . 1 . 2]" 1 127 1 26 GLY QA 1 29 TYR QD 3.150 . 4.500 4.369 3.552 4.656 0.156 8 0 "[ . 1 . 2]" 1 128 1 27 VAL H 1 27 VAL HB 3.150 . 4.500 2.408 2.334 2.468 . 0 0 "[ . 1 . 2]" 1 129 1 27 VAL H 1 28 SER H 2.650 . 3.500 2.678 2.628 2.731 . 0 0 "[ . 1 . 2]" 1 130 1 27 VAL HA 1 29 TYR H 3.650 . 5.500 4.471 4.313 4.686 . 0 0 "[ . 1 . 2]" 1 131 1 27 VAL HA 1 30 ALA H 3.150 . 4.500 3.573 3.426 3.786 . 0 0 "[ . 1 . 2]" 1 132 1 27 VAL QG 1 28 SER H 3.150 . 4.500 3.094 2.960 3.171 . 0 0 "[ . 1 . 2]" 1 133 1 27 VAL QG 1 30 ALA H 3.650 . 5.500 4.399 4.253 4.574 . 0 0 "[ . 1 . 2]" 1 134 1 27 VAL MG1 1 28 SER HA 3.150 . 4.500 3.307 3.166 3.397 . 0 0 "[ . 1 . 2]" 1 135 1 27 VAL MG1 1 68 ASP QB 3.150 . 4.500 3.986 3.386 4.398 . 0 0 "[ . 1 . 2]" 1 136 1 27 VAL MG2 1 64 ILE MG 3.150 . 4.500 3.179 2.360 4.053 . 0 0 "[ . 1 . 2]" 1 137 1 27 VAL MG2 1 67 ALA MB 3.150 . 4.500 4.634 4.004 4.786 0.286 13 0 "[ . 1 . 2]" 1 138 1 27 VAL MG2 1 68 ASP HA 3.650 . 5.500 5.287 4.895 5.681 0.181 14 0 "[ . 1 . 2]" 1 139 1 27 VAL MG2 1 68 ASP QB 3.650 . 5.500 3.346 2.772 3.765 . 0 0 "[ . 1 . 2]" 1 140 1 28 SER H 1 28 SER HA 2.650 . 3.500 2.811 2.798 2.826 . 0 0 "[ . 1 . 2]" 1 141 1 28 SER H 1 28 SER QB 2.650 . 3.500 2.431 2.215 2.541 . 0 0 "[ . 1 . 2]" 1 142 1 28 SER H 1 29 TYR H 3.150 . 4.500 2.722 2.668 2.796 . 0 0 "[ . 1 . 2]" 1 143 1 28 SER HA 1 29 TYR H 3.150 . 4.500 3.551 3.534 3.568 . 0 0 "[ . 1 . 2]" 1 144 1 28 SER HA 1 31 ALA MB 3.150 . 4.500 2.655 2.369 3.022 . 0 0 "[ . 1 . 2]" 1 145 1 28 SER HA 1 136 ALA MB 3.650 . 5.500 4.010 3.114 5.565 0.065 10 0 "[ . 1 . 2]" 1 146 1 28 SER QB 1 29 TYR H 3.650 . 5.500 2.885 2.395 3.405 . 0 0 "[ . 1 . 2]" 1 147 1 28 SER QB 1 136 ALA MB 3.650 . 5.500 3.345 2.177 5.211 . 0 0 "[ . 1 . 2]" 1 148 1 28 SER QB 1 137 ILE MD 3.650 . 5.500 5.158 4.276 5.700 0.200 3 0 "[ . 1 . 2]" 1 149 1 29 TYR H 1 29 TYR QB 2.650 . 3.500 2.194 2.055 2.263 . 0 0 "[ . 1 . 2]" 1 150 1 29 TYR H 1 30 ALA H 2.650 . 3.500 2.734 2.632 2.822 . 0 0 "[ . 1 . 2]" 1 151 1 29 TYR H 1 30 ALA MB 3.650 . 5.500 4.361 4.279 4.462 . 0 0 "[ . 1 . 2]" 1 152 1 29 TYR QB 1 30 ALA H 3.150 . 4.500 2.474 2.314 2.720 . 0 0 "[ . 1 . 2]" 1 153 1 29 TYR QD 1 30 ALA HA 3.650 . 5.500 3.571 2.698 5.433 . 0 0 "[ . 1 . 2]" 1 154 1 29 TYR QD 1 33 LEU QD 3.150 . 4.500 3.052 2.046 3.809 . 0 0 "[ . 1 . 2]" 1 155 1 29 TYR QD 1 33 LEU HG 3.150 . 4.500 4.148 3.170 4.709 0.209 9 0 "[ . 1 . 2]" 1 156 1 29 TYR QE 1 33 LEU QD 2.650 . 3.500 2.749 2.254 3.677 0.177 17 0 "[ . 1 . 2]" 1 157 1 30 ALA H 1 30 ALA MB 3.150 . 4.500 2.200 2.081 2.241 . 0 0 "[ . 1 . 2]" 1 158 1 30 ALA H 1 31 ALA H 3.150 . 4.500 2.678 2.589 2.795 . 0 0 "[ . 1 . 2]" 1 159 1 30 ALA HA 1 33 LEU QD 3.150 . 4.500 3.273 2.407 4.413 . 0 0 "[ . 1 . 2]" 1 160 1 30 ALA MB 1 64 ILE MD 3.150 . 4.500 3.249 2.072 4.589 0.089 8 0 "[ . 1 . 2]" 1 161 1 30 ALA MB 1 65 LEU QD 3.650 . 5.500 2.893 1.880 3.722 . 0 0 "[ . 1 . 2]" 1 162 1 31 ALA HA 1 65 LEU MD1 2.650 . 3.500 3.375 2.874 3.707 0.207 4 0 "[ . 1 . 2]" 1 163 1 31 ALA HA 1 65 LEU MD2 3.150 . 4.500 3.745 2.409 4.359 . 0 0 "[ . 1 . 2]" 1 164 1 31 ALA MB 1 65 LEU QD 3.150 . 4.500 3.040 2.632 3.397 . 0 0 "[ . 1 . 2]" 1 165 1 31 ALA MB 1 132 LYS QB 3.150 . 4.500 3.515 2.257 4.503 0.003 10 0 "[ . 1 . 2]" 1 166 1 31 ALA MB 1 133 PHE HA 3.150 . 4.500 4.152 3.471 4.638 0.138 14 0 "[ . 1 . 2]" 1 167 1 31 ALA MB 1 133 PHE QB 3.650 . 5.500 4.294 2.758 5.308 . 0 0 "[ . 1 . 2]" 1 168 1 31 ALA MB 1 133 PHE QD 3.650 . 5.500 4.543 3.523 5.534 0.034 13 0 "[ . 1 . 2]" 1 169 1 32 LEU H 1 32 LEU QB 3.150 . 4.500 2.217 2.046 2.564 . 0 0 "[ . 1 . 2]" 1 170 1 32 LEU QD 1 133 PHE QE 2.650 . 3.500 2.437 2.001 3.222 . 0 0 "[ . 1 . 2]" 1 171 1 32 LEU QD 1 136 ALA MB 3.650 . 5.500 4.145 2.306 5.249 . 0 0 "[ . 1 . 2]" 1 172 1 33 LEU H 1 33 LEU QB 3.150 . 4.500 2.266 2.120 2.556 . 0 0 "[ . 1 . 2]" 1 173 1 33 LEU HA 1 36 ILE MG 3.150 . 4.500 3.750 2.048 4.571 0.071 18 0 "[ . 1 . 2]" 1 174 1 33 LEU QB 1 37 VAL MG2 3.150 . 4.500 3.123 2.535 3.965 . 0 0 "[ . 1 . 2]" 1 175 1 33 LEU MD1 1 61 LEU MD1 3.150 . 4.500 3.593 2.083 4.698 0.198 12 0 "[ . 1 . 2]" 1 176 1 34 SER HA 1 37 VAL H 3.150 . 4.500 3.579 3.251 3.801 . 0 0 "[ . 1 . 2]" 1 177 1 34 SER HA 1 37 VAL HB 2.650 . 3.500 2.647 2.408 2.957 . 0 0 "[ . 1 . 2]" 1 178 1 34 SER HA 1 37 VAL QG 2.650 . 3.500 2.952 2.271 3.333 . 0 0 "[ . 1 . 2]" 1 179 1 35 VAL H 1 35 VAL HB 3.150 . 4.500 2.441 2.311 2.570 . 0 0 "[ . 1 . 2]" 1 180 1 35 VAL H 1 36 ILE H 3.150 . 4.500 2.724 2.633 2.855 . 0 0 "[ . 1 . 2]" 1 181 1 35 VAL HA 1 38 VAL MG2 3.150 . 4.500 3.115 2.183 4.753 0.253 9 0 "[ . 1 . 2]" 1 182 1 35 VAL HB 1 36 ILE H 3.650 . 5.500 2.855 2.410 3.969 . 0 0 "[ . 1 . 2]" 1 183 1 35 VAL QG 1 36 ILE H 3.150 . 4.500 2.772 1.711 3.168 0.089 19 0 "[ . 1 . 2]" 1 184 1 35 VAL QG 1 129 ARG QB 2.650 . 3.500 2.852 2.026 3.574 0.074 16 0 "[ . 1 . 2]" 1 185 1 35 VAL MG1 1 36 ILE HA 3.150 . 4.500 3.256 2.970 3.437 . 0 0 "[ . 1 . 2]" 1 186 1 35 VAL MG1 1 36 ILE QG 3.150 . 4.500 3.741 2.172 4.777 0.277 11 0 "[ . 1 . 2]" 1 187 1 35 VAL MG1 1 129 ARG QB 3.650 . 5.500 4.293 3.240 5.492 . 0 0 "[ . 1 . 2]" 1 188 1 35 VAL MG2 1 130 GLY H 3.150 . 4.500 4.312 3.709 4.697 0.197 15 0 "[ . 1 . 2]" 1 189 1 35 VAL MG2 1 130 GLY QA 3.150 . 4.500 3.222 2.273 3.827 . 0 0 "[ . 1 . 2]" 1 190 1 35 VAL MG2 1 133 PHE QB 3.150 . 4.500 2.783 2.130 4.335 . 0 0 "[ . 1 . 2]" 1 191 1 36 ILE H 1 36 ILE HB 3.150 . 4.500 2.558 2.220 3.633 . 0 0 "[ . 1 . 2]" 1 192 1 36 ILE H 1 37 VAL H 3.650 . 5.500 2.634 2.485 2.734 . 0 0 "[ . 1 . 2]" 1 193 1 36 ILE HA 1 39 VAL H 3.150 . 4.500 3.474 3.273 3.718 . 0 0 "[ . 1 . 2]" 1 194 1 36 ILE HA 1 39 VAL HB 2.650 . 3.500 2.760 2.319 3.225 . 0 0 "[ . 1 . 2]" 1 195 1 36 ILE HA 1 39 VAL QG 3.150 . 4.500 3.001 2.431 3.458 . 0 0 "[ . 1 . 2]" 1 196 1 36 ILE HA 1 40 VAL QG 3.650 . 5.500 3.824 3.397 4.317 . 0 0 "[ . 1 . 2]" 1 197 1 36 ILE MD 1 39 VAL HB 3.150 . 4.500 3.899 2.961 4.911 0.411 9 0 "[ . 1 . 2]" 1 198 1 36 ILE MG 1 37 VAL H 3.650 . 5.500 3.140 1.891 3.866 . 0 0 "[ . 1 . 2]" 1 199 1 37 VAL H 1 37 VAL HA 2.650 . 3.500 2.806 2.778 2.822 . 0 0 "[ . 1 . 2]" 1 200 1 37 VAL H 1 37 VAL HB 2.650 . 3.500 2.370 2.188 2.517 . 0 0 "[ . 1 . 2]" 1 201 1 37 VAL H 1 38 VAL H 3.650 . 5.500 2.774 2.687 2.868 . 0 0 "[ . 1 . 2]" 1 202 1 37 VAL HA 1 54 LEU MD1 2.650 . 3.500 3.248 2.877 3.476 . 0 0 "[ . 1 . 2]" 1 203 1 37 VAL HA 1 54 LEU MD2 3.150 . 4.500 4.008 3.434 4.529 0.029 3 0 "[ . 1 . 2]" 1 204 1 37 VAL QG 1 40 VAL HB 3.150 . 4.500 3.634 3.301 3.929 . 0 0 "[ . 1 . 2]" 1 205 1 37 VAL QG 1 54 LEU HG 3.150 . 4.500 2.468 2.191 3.023 . 0 0 "[ . 1 . 2]" 1 206 1 37 VAL MG1 1 54 LEU MD2 3.650 . 5.500 2.365 1.961 3.115 . 0 0 "[ . 1 . 2]" 1 207 1 37 VAL MG1 1 58 ASP HA 3.150 . 4.500 3.464 2.816 3.847 . 0 0 "[ . 1 . 2]" 1 208 1 37 VAL MG1 1 58 ASP QB 3.150 . 4.500 2.639 2.244 3.410 . 0 0 "[ . 1 . 2]" 1 209 1 37 VAL MG2 1 54 LEU MD1 3.150 . 4.500 3.036 2.404 3.793 . 0 0 "[ . 1 . 2]" 1 210 1 37 VAL MG2 1 58 ASP HA 3.150 . 4.500 4.008 3.430 4.390 . 0 0 "[ . 1 . 2]" 1 211 1 37 VAL MG2 1 58 ASP QB 3.150 . 4.500 4.230 3.798 4.794 0.294 7 0 "[ . 1 . 2]" 1 212 1 38 VAL H 1 39 VAL MG2 3.150 . 4.500 4.221 4.057 4.362 . 0 0 "[ . 1 . 2]" 1 213 1 38 VAL HB 1 126 ILE MD 3.150 . 4.500 3.418 2.048 4.595 0.095 9 0 "[ . 1 . 2]" 1 214 1 38 VAL QG 1 39 VAL H 3.650 . 5.500 2.780 1.937 3.228 . 0 0 "[ . 1 . 2]" 1 215 1 38 VAL QG 1 39 VAL HA 3.150 . 4.500 3.302 3.045 3.672 . 0 0 "[ . 1 . 2]" 1 216 1 38 VAL QG 1 96 ALA MB 3.650 . 5.500 4.447 3.397 5.542 0.042 4 0 "[ . 1 . 2]" 1 217 1 38 VAL QG 1 126 ILE HB 3.150 . 4.500 4.331 2.645 4.903 0.403 15 0 "[ . 1 . 2]" 1 218 1 38 VAL QG 1 126 ILE MD 3.150 . 4.500 2.415 1.780 3.292 0.020 15 0 "[ . 1 . 2]" 1 219 1 38 VAL QG 1 126 ILE MG 3.150 . 4.500 3.447 1.870 4.566 0.066 11 0 "[ . 1 . 2]" 1 220 1 38 VAL MG1 1 42 TYR QB 3.650 . 5.500 4.308 2.909 5.837 0.337 4 0 "[ . 1 . 2]" 1 221 1 38 VAL MG2 1 129 ARG QB 3.150 . 4.500 4.327 3.420 4.731 0.231 9 0 "[ . 1 . 2]" 1 222 1 38 VAL MG2 1 129 ARG QD 3.150 . 4.500 3.547 2.542 4.601 0.101 7 0 "[ . 1 . 2]" 1 223 1 39 VAL H 1 39 VAL HA 2.650 . 3.500 2.828 2.809 2.852 . 0 0 "[ . 1 . 2]" 1 224 1 39 VAL H 1 39 VAL HB 2.650 . 3.500 2.459 2.358 2.609 . 0 0 "[ . 1 . 2]" 1 225 1 39 VAL H 1 40 VAL H 2.650 . 3.500 2.706 2.556 2.894 . 0 0 "[ . 1 . 2]" 1 226 1 39 VAL HA 1 40 VAL H 3.150 . 4.500 3.558 3.512 3.573 . 0 0 "[ . 1 . 2]" 1 227 1 39 VAL HA 1 42 TYR QD 3.150 . 4.500 3.441 2.392 4.132 . 0 0 "[ . 1 . 2]" 1 228 1 39 VAL HA 1 43 THR H 3.150 . 4.500 3.916 3.525 4.278 . 0 0 "[ . 1 . 2]" 1 229 1 39 VAL HA 1 43 THR MG 3.150 . 4.500 3.985 3.233 4.746 0.246 4 0 "[ . 1 . 2]" 1 230 1 39 VAL HB 1 43 THR MG 3.150 . 4.500 4.479 3.990 4.721 0.221 18 0 "[ . 1 . 2]" 1 231 1 39 VAL QG 1 40 VAL HA 3.150 . 4.500 3.320 3.104 3.539 . 0 0 "[ . 1 . 2]" 1 232 1 39 VAL QG 1 42 TYR QE 3.150 . 4.500 4.397 2.672 4.822 0.322 3 0 "[ . 1 . 2]" 1 233 1 39 VAL MG1 1 40 VAL H 3.150 . 4.500 3.311 2.889 3.517 . 0 0 "[ . 1 . 2]" 1 234 1 39 VAL MG1 1 42 TYR H 3.650 . 5.500 4.612 4.394 4.897 . 0 0 "[ . 1 . 2]" 1 235 1 39 VAL MG1 1 43 THR HB 3.150 . 4.500 3.543 2.263 4.494 . 0 0 "[ . 1 . 2]" 1 236 1 39 VAL MG1 1 43 THR MG 3.150 . 4.500 2.413 1.994 2.837 . 0 0 "[ . 1 . 2]" 1 237 1 39 VAL MG2 1 126 ILE MG 3.150 . 4.500 3.226 2.243 4.508 0.008 11 0 "[ . 1 . 2]" 1 238 1 40 VAL H 1 40 VAL HA 2.650 . 3.500 2.797 2.743 2.820 . 0 0 "[ . 1 . 2]" 1 239 1 40 VAL H 1 40 VAL HB 2.300 . 2.800 2.424 2.278 2.648 . 0 0 "[ . 1 . 2]" 1 240 1 40 VAL H 1 41 GLU H 3.150 . 4.500 2.779 2.675 2.887 . 0 0 "[ . 1 . 2]" 1 241 1 40 VAL H 1 41 GLU QB 3.650 . 5.500 4.576 4.409 5.076 . 0 0 "[ . 1 . 2]" 1 242 1 40 VAL H 1 42 TYR H 3.650 . 5.500 4.306 3.889 4.965 . 0 0 "[ . 1 . 2]" 1 243 1 40 VAL HA 1 43 THR MG 3.150 . 4.500 2.985 1.974 4.380 . 0 0 "[ . 1 . 2]" 1 244 1 40 VAL HA 1 44 MET H 2.650 . 3.500 3.263 2.901 3.473 . 0 0 "[ . 1 . 2]" 1 245 1 40 VAL HA 1 44 MET QB 2.650 . 3.500 3.413 2.456 3.782 0.282 20 0 "[ . 1 . 2]" 1 246 1 40 VAL HB 1 41 GLU H 2.650 . 3.500 2.631 2.459 2.977 . 0 0 "[ . 1 . 2]" 1 247 1 40 VAL HB 1 46 LEU QD 3.650 . 5.500 4.308 3.903 5.186 . 0 0 "[ . 1 . 2]" 1 248 1 40 VAL HB 1 54 LEU MD1 2.650 . 3.500 3.319 2.796 3.660 0.160 11 0 "[ . 1 . 2]" 1 249 1 40 VAL QG 1 41 GLU H 3.150 . 4.500 3.106 2.991 3.402 . 0 0 "[ . 1 . 2]" 1 250 1 40 VAL QG 1 44 MET ME 3.150 . 4.500 3.637 1.917 4.624 0.124 8 0 "[ . 1 . 2]" 1 251 1 40 VAL MG1 1 41 GLU HA 3.150 . 4.500 3.291 3.184 3.774 . 0 0 "[ . 1 . 2]" 1 252 1 40 VAL MG1 1 44 MET H 3.650 . 5.500 3.674 3.443 3.911 . 0 0 "[ . 1 . 2]" 1 253 1 40 VAL MG1 1 44 MET QB 3.150 . 4.500 2.411 2.016 2.711 . 0 0 "[ . 1 . 2]" 1 254 1 40 VAL MG1 1 46 LEU MD1 2.650 . 3.500 2.398 1.989 3.008 . 0 0 "[ . 1 . 2]" 1 255 1 41 GLU H 1 41 GLU QB 3.650 . 5.500 2.263 2.144 2.551 . 0 0 "[ . 1 . 2]" 1 256 1 41 GLU H 1 42 TYR H 3.150 . 4.500 2.717 2.473 3.061 . 0 0 "[ . 1 . 2]" 1 257 1 41 GLU HA 1 42 TYR H 3.650 . 5.500 3.545 3.463 3.598 . 0 0 "[ . 1 . 2]" 1 258 1 41 GLU HA 1 44 MET H 3.150 . 4.500 4.192 3.541 4.672 0.172 4 0 "[ . 1 . 2]" 1 259 1 41 GLU HA 1 46 LEU QD 3.650 . 5.500 4.090 3.307 4.885 . 0 0 "[ . 1 . 2]" 1 260 1 41 GLU HA 1 51 LEU QD 3.650 . 5.500 4.005 3.436 4.959 . 0 0 "[ . 1 . 2]" 1 261 1 41 GLU HA 1 54 LEU QD 2.650 . 3.500 3.266 2.477 3.629 0.129 3 0 "[ . 1 . 2]" 1 262 1 41 GLU QB 1 42 TYR HA 3.150 . 4.500 4.147 3.886 4.519 0.019 13 0 "[ . 1 . 2]" 1 263 1 41 GLU QB 1 54 LEU MD2 3.150 . 4.500 2.586 1.979 3.506 . 0 0 "[ . 1 . 2]" 1 264 1 41 GLU QG 1 51 LEU MD2 3.650 . 5.500 4.465 2.359 5.558 0.058 4 0 "[ . 1 . 2]" 1 265 1 42 TYR H 1 42 TYR QB 3.150 . 4.500 2.367 2.192 2.976 . 0 0 "[ . 1 . 2]" 1 266 1 42 TYR QB 1 43 THR H 3.650 . 5.500 2.573 2.123 3.448 . 0 0 "[ . 1 . 2]" 1 267 1 42 TYR QB 1 43 THR MG 3.150 . 4.500 3.716 2.889 4.864 0.364 4 0 "[ . 1 . 2]" 1 268 1 42 TYR QB 1 123 ILE MD 3.650 . 5.500 4.729 3.140 5.676 0.176 10 0 "[ . 1 . 2]" 1 269 1 42 TYR QD 1 43 THR HB 3.150 . 4.500 4.035 2.726 4.784 0.284 11 0 "[ . 1 . 2]" 1 270 1 42 TYR QD 1 43 THR MG 3.150 . 4.500 3.362 2.059 4.719 0.219 19 0 "[ . 1 . 2]" 1 271 1 42 TYR QD 1 119 ARG QG 3.150 . 4.500 4.239 3.160 4.820 0.320 12 0 "[ . 1 . 2]" 1 272 1 42 TYR QD 1 122 ARG QB 3.650 . 5.500 4.088 3.278 5.537 0.037 12 0 "[ . 1 . 2]" 1 273 1 42 TYR QD 1 122 ARG QD 3.150 . 4.500 3.773 2.135 4.775 0.275 19 0 "[ . 1 . 2]" 1 274 1 42 TYR QD 1 123 ILE MD 3.150 . 4.500 3.845 2.866 4.507 0.007 10 0 "[ . 1 . 2]" 1 275 1 42 TYR QE 1 122 ARG QB 3.150 . 4.500 4.075 2.367 4.518 0.018 5 0 "[ . 1 . 2]" 1 276 1 42 TYR QE 1 123 ILE MD 3.150 . 4.500 2.915 2.225 4.305 . 0 0 "[ . 1 . 2]" 1 277 1 42 TYR QE 1 123 ILE QG 3.650 . 5.500 3.658 2.252 4.899 . 0 0 "[ . 1 . 2]" 1 278 1 43 THR H 1 43 THR HA 2.650 . 3.500 2.864 2.724 2.969 . 0 0 "[ . 1 . 2]" 1 279 1 43 THR H 1 43 THR HB 3.150 . 4.500 2.985 2.182 3.646 . 0 0 "[ . 1 . 2]" 1 280 1 43 THR H 1 44 MET H 2.300 . 2.800 2.650 2.078 2.852 0.052 12 0 "[ . 1 . 2]" 1 281 1 43 THR HB 1 44 MET H 2.650 . 3.500 3.483 2.772 3.774 0.274 12 0 "[ . 1 . 2]" 1 282 1 43 THR MG 1 44 MET H 3.650 . 5.500 2.696 1.653 4.379 0.147 9 0 "[ . 1 . 2]" 1 283 1 43 THR MG 1 44 MET ME 3.650 . 5.500 4.457 2.240 5.683 0.183 10 0 "[ . 1 . 2]" 1 284 1 43 THR MG 1 44 MET QG 3.150 . 4.500 3.625 2.250 4.547 0.047 1 0 "[ . 1 . 2]" 1 285 1 44 MET H 1 44 MET HA 2.300 . 2.800 2.929 2.855 2.957 0.157 20 0 "[ . 1 . 2]" 1 286 1 44 MET H 1 44 MET QB 2.650 . 3.500 2.427 2.223 2.679 . 0 0 "[ . 1 . 2]" 1 287 1 44 MET H 1 45 GLN H 3.150 . 4.500 4.354 2.350 4.579 0.079 9 0 "[ . 1 . 2]" 1 288 1 44 MET H 1 46 LEU HG 3.650 . 5.500 5.350 4.805 5.599 0.099 13 0 "[ . 1 . 2]" 1 289 1 44 MET HA 1 45 GLN H 2.650 . 3.500 2.260 2.122 3.492 . 0 0 "[ . 1 . 2]" 1 290 1 44 MET HA 1 45 GLN QG 3.150 . 4.500 3.569 3.236 4.274 . 0 0 "[ . 1 . 2]" 1 291 1 44 MET HA 1 46 LEU H 3.150 . 4.500 4.218 3.424 4.688 0.188 3 0 "[ . 1 . 2]" 1 292 1 44 MET QB 1 46 LEU QD 3.150 . 4.500 2.803 2.418 3.502 . 0 0 "[ . 1 . 2]" 1 293 1 44 MET ME 1 46 LEU QD 3.150 . 4.500 3.428 2.146 4.501 0.001 11 0 "[ . 1 . 2]" 1 294 1 45 GLN H 1 45 GLN QB 2.650 . 3.500 2.698 2.326 2.996 . 0 0 "[ . 1 . 2]" 1 295 1 45 GLN H 1 46 LEU H 3.150 . 4.500 2.938 1.953 3.682 . 0 0 "[ . 1 . 2]" 1 296 1 45 GLN HA 1 46 LEU H 2.300 . 2.800 2.790 2.459 3.247 0.447 11 0 "[ . 1 . 2]" 1 297 1 46 LEU H 1 46 LEU QB 2.650 . 3.500 2.828 2.475 3.280 . 0 0 "[ . 1 . 2]" 1 298 1 46 LEU H 1 51 LEU QD 3.150 . 4.500 3.950 2.983 4.623 0.123 3 0 "[ . 1 . 2]" 1 299 1 46 LEU QB 1 47 SER H 2.650 . 3.500 2.168 1.757 2.628 0.043 9 0 "[ . 1 . 2]" 1 300 1 46 LEU QB 1 50 TYR QB 2.650 . 3.500 2.161 2.044 2.239 . 0 0 "[ . 1 . 2]" 1 301 1 46 LEU QB 1 50 TYR QD 3.150 . 4.500 3.717 2.906 4.154 . 0 0 "[ . 1 . 2]" 1 302 1 46 LEU MD1 1 50 TYR QB 3.150 . 4.500 2.474 2.260 2.809 . 0 0 "[ . 1 . 2]" 1 303 1 46 LEU MD1 1 50 TYR QD 3.150 . 4.500 3.518 2.318 4.268 . 0 0 "[ . 1 . 2]" 1 304 1 46 LEU MD1 1 51 LEU HA 3.150 . 4.500 3.721 3.078 4.517 0.017 1 0 "[ . 1 . 2]" 1 305 1 46 LEU MD1 1 54 LEU QB 3.650 . 5.500 3.085 2.524 3.922 . 0 0 "[ . 1 . 2]" 1 306 1 46 LEU MD2 1 50 TYR QB 2.650 . 3.500 3.204 2.636 3.610 0.110 9 0 "[ . 1 . 2]" 1 307 1 46 LEU MD2 1 50 TYR QD 3.150 . 4.500 3.804 3.009 4.339 . 0 0 "[ . 1 . 2]" 1 308 1 47 SER H 1 47 SER HA 2.300 . 2.800 2.885 2.804 2.961 0.161 14 0 "[ . 1 . 2]" 1 309 1 47 SER H 1 47 SER QB 2.650 . 3.500 2.459 2.180 2.793 . 0 0 "[ . 1 . 2]" 1 310 1 47 SER H 1 50 TYR QB 3.150 . 4.500 2.657 1.919 3.558 . 0 0 "[ . 1 . 2]" 1 311 1 47 SER HA 1 51 LEU QB 3.150 . 4.500 4.398 4.158 4.704 0.204 1 0 "[ . 1 . 2]" 1 312 1 47 SER HA 1 51 LEU QD 3.150 . 4.500 4.599 4.216 4.794 0.294 16 0 "[ . 1 . 2]" 1 313 1 47 SER QB 1 48 GLY H 3.650 . 5.500 2.580 2.087 3.451 . 0 0 "[ . 1 . 2]" 1 314 1 48 GLY QA 1 51 LEU H 3.650 . 5.500 3.386 3.230 3.559 . 0 0 "[ . 1 . 2]" 1 315 1 48 GLY QA 1 51 LEU QB 3.150 . 4.500 2.285 2.074 2.778 . 0 0 "[ . 1 . 2]" 1 316 1 48 GLY QA 1 51 LEU MD1 3.150 . 4.500 4.214 2.659 4.623 0.123 14 0 "[ . 1 . 2]" 1 317 1 48 GLY QA 1 52 VAL MG2 3.150 . 4.500 3.622 3.309 4.125 . 0 0 "[ . 1 . 2]" 1 318 1 49 GLU H 1 49 GLU QB 3.150 . 4.500 2.406 2.219 2.848 . 0 0 "[ . 1 . 2]" 1 319 1 49 GLU H 1 50 TYR H 3.150 . 4.500 2.888 2.634 3.134 . 0 0 "[ . 1 . 2]" 1 320 1 49 GLU HA 1 52 VAL HB 2.650 . 3.500 3.410 2.909 3.693 0.193 12 0 "[ . 1 . 2]" 1 321 1 49 GLU HA 1 52 VAL QG 3.150 . 4.500 3.411 2.947 3.856 . 0 0 "[ . 1 . 2]" 1 322 1 49 GLU QG 1 50 TYR HA 3.150 . 4.500 3.615 3.209 4.354 . 0 0 "[ . 1 . 2]" 1 323 1 49 GLU QG 1 50 TYR QD 2.650 . 3.500 3.163 2.192 3.791 0.291 2 0 "[ . 1 . 2]" 1 324 1 50 TYR H 1 50 TYR QB 2.300 . 2.800 2.256 2.074 2.509 . 0 0 "[ . 1 . 2]" 1 325 1 50 TYR H 1 51 LEU HA 3.650 . 5.500 5.189 5.103 5.272 . 0 0 "[ . 1 . 2]" 1 326 1 50 TYR HA 1 51 LEU H 3.150 . 4.500 3.500 3.472 3.538 . 0 0 "[ . 1 . 2]" 1 327 1 50 TYR HA 1 52 VAL H 3.150 . 4.500 4.352 4.081 4.517 0.017 9 0 "[ . 1 . 2]" 1 328 1 50 TYR HA 1 53 ARG H 2.650 . 3.500 3.364 3.257 3.509 0.009 15 0 "[ . 1 . 2]" 1 329 1 50 TYR HA 1 53 ARG QB 2.650 . 3.500 2.604 2.209 3.018 . 0 0 "[ . 1 . 2]" 1 330 1 50 TYR HA 1 53 ARG QD 3.150 . 4.500 3.703 2.536 4.777 0.277 5 0 "[ . 1 . 2]" 1 331 1 50 TYR QB 1 51 LEU H 3.150 . 4.500 2.808 2.671 2.955 . 0 0 "[ . 1 . 2]" 1 332 1 50 TYR QD 1 53 ARG QB 3.650 . 5.500 4.020 3.183 4.850 . 0 0 "[ . 1 . 2]" 1 333 1 51 LEU H 1 51 LEU HA 2.650 . 3.500 2.806 2.789 2.815 . 0 0 "[ . 1 . 2]" 1 334 1 51 LEU H 1 51 LEU QB 2.650 . 3.500 2.183 2.036 2.275 . 0 0 "[ . 1 . 2]" 1 335 1 51 LEU H 1 52 VAL HA 3.650 . 5.500 5.321 5.265 5.398 . 0 0 "[ . 1 . 2]" 1 336 1 51 LEU H 1 52 VAL HB 3.650 . 5.500 4.796 4.707 4.893 . 0 0 "[ . 1 . 2]" 1 337 1 51 LEU H 1 53 ARG H 3.650 . 5.500 4.186 3.998 4.426 . 0 0 "[ . 1 . 2]" 1 338 1 51 LEU HA 1 52 VAL H 2.650 . 3.500 3.546 3.519 3.565 0.065 6 0 "[ . 1 . 2]" 1 339 1 51 LEU QB 1 52 VAL H 2.650 . 3.500 2.505 2.322 2.742 . 0 0 "[ . 1 . 2]" 1 340 1 51 LEU QD 1 52 VAL H 3.650 . 5.500 3.788 3.395 4.148 . 0 0 "[ . 1 . 2]" 1 341 1 51 LEU QD 1 55 TYR QB 3.150 . 4.500 4.164 3.384 4.599 0.099 2 0 "[ . 1 . 2]" 1 342 1 51 LEU MD1 1 55 TYR H 3.650 . 5.500 4.507 3.418 5.959 0.459 15 0 "[ . 1 . 2]" 1 343 1 51 LEU MD1 1 55 TYR QD 3.150 . 4.500 3.148 2.148 4.199 . 0 0 "[ . 1 . 2]" 1 344 1 51 LEU MD1 1 55 TYR QE 3.150 . 4.500 2.599 2.063 4.040 . 0 0 "[ . 1 . 2]" 1 345 1 51 LEU MD2 1 55 TYR QD 3.150 . 4.500 4.078 3.105 4.675 0.175 1 0 "[ . 1 . 2]" 1 346 1 51 LEU MD2 1 55 TYR QE 3.150 . 4.500 3.539 2.680 4.635 0.135 1 0 "[ . 1 . 2]" 1 347 1 52 VAL H 1 52 VAL HA 2.300 . 2.800 2.823 2.809 2.839 0.039 12 0 "[ . 1 . 2]" 1 348 1 52 VAL H 1 52 VAL HB 2.300 . 2.800 2.401 2.344 2.481 . 0 0 "[ . 1 . 2]" 1 349 1 52 VAL H 1 53 ARG H 2.650 . 3.500 2.676 2.579 2.759 . 0 0 "[ . 1 . 2]" 1 350 1 52 VAL H 1 53 ARG QB 3.150 . 4.500 4.453 4.315 4.637 0.137 3 0 "[ . 1 . 2]" 1 351 1 52 VAL H 1 54 LEU H 3.150 . 4.500 4.080 3.962 4.153 . 0 0 "[ . 1 . 2]" 1 352 1 52 VAL HA 1 53 ARG H 3.150 . 4.500 3.548 3.527 3.567 . 0 0 "[ . 1 . 2]" 1 353 1 52 VAL HA 1 55 TYR H 2.650 . 3.500 3.543 3.450 3.664 0.164 3 0 "[ . 1 . 2]" 1 354 1 52 VAL HA 1 55 TYR QD 3.150 . 4.500 3.966 2.845 4.582 0.082 7 0 "[ . 1 . 2]" 1 355 1 52 VAL HA 1 56 LEU H 3.150 . 4.500 4.328 4.041 4.499 . 0 0 "[ . 1 . 2]" 1 356 1 52 VAL HB 1 53 ARG H 2.650 . 3.500 2.543 2.462 2.631 . 0 0 "[ . 1 . 2]" 1 357 1 52 VAL QG 1 53 ARG H 3.650 . 5.500 3.068 2.968 3.153 . 0 0 "[ . 1 . 2]" 1 358 1 52 VAL QG 1 53 ARG QB 3.150 . 4.500 4.007 3.773 4.339 . 0 0 "[ . 1 . 2]" 1 359 1 52 VAL QG 1 53 ARG QD 3.650 . 5.500 5.279 4.602 5.875 0.375 17 0 "[ . 1 . 2]" 1 360 1 52 VAL QG 1 55 TYR QB 3.150 . 4.500 3.536 3.350 3.798 . 0 0 "[ . 1 . 2]" 1 361 1 52 VAL QG 1 56 LEU H 3.650 . 5.500 4.048 3.849 4.256 . 0 0 "[ . 1 . 2]" 1 362 1 52 VAL MG1 1 55 TYR QD 3.650 . 5.500 5.221 4.624 5.547 0.047 3 0 "[ . 1 . 2]" 1 363 1 52 VAL MG2 1 55 TYR QD 3.650 . 5.500 5.026 4.091 5.510 0.010 7 0 "[ . 1 . 2]" 1 364 1 53 ARG H 1 53 ARG HA 2.650 . 3.500 2.822 2.804 2.850 . 0 0 "[ . 1 . 2]" 1 365 1 53 ARG H 1 53 ARG QB 2.300 . 2.800 2.255 2.188 2.326 . 0 0 "[ . 1 . 2]" 1 366 1 53 ARG H 1 54 LEU H 2.650 . 3.500 2.679 2.582 2.752 . 0 0 "[ . 1 . 2]" 1 367 1 53 ARG HA 1 56 LEU H 3.150 . 4.500 3.438 3.302 3.542 . 0 0 "[ . 1 . 2]" 1 368 1 53 ARG HA 1 56 LEU QB 3.150 . 4.500 2.699 2.286 2.926 . 0 0 "[ . 1 . 2]" 1 369 1 53 ARG HA 1 57 VAL H 3.150 . 4.500 4.221 3.929 4.537 0.037 8 0 "[ . 1 . 2]" 1 370 1 53 ARG QB 1 54 LEU H 2.650 . 3.500 2.574 2.464 2.677 . 0 0 "[ . 1 . 2]" 1 371 1 53 ARG QG 1 54 LEU H 3.150 . 4.500 3.872 3.294 4.313 . 0 0 "[ . 1 . 2]" 1 372 1 53 ARG QG 1 57 VAL H 3.650 . 5.500 4.550 3.684 5.782 0.282 4 0 "[ . 1 . 2]" 1 373 1 54 LEU H 1 54 LEU HA 2.300 . 2.800 2.811 2.797 2.819 0.019 18 0 "[ . 1 . 2]" 1 374 1 54 LEU H 1 54 LEU QB 2.650 . 3.500 2.227 2.184 2.253 . 0 0 "[ . 1 . 2]" 1 375 1 54 LEU H 1 55 TYR H 2.650 . 3.500 2.701 2.621 2.780 . 0 0 "[ . 1 . 2]" 1 376 1 54 LEU H 1 55 TYR QB 3.650 . 5.500 4.442 4.343 4.593 . 0 0 "[ . 1 . 2]" 1 377 1 54 LEU HA 1 55 TYR H 2.650 . 3.500 3.544 3.524 3.568 0.068 9 0 "[ . 1 . 2]" 1 378 1 54 LEU HA 1 57 VAL H 2.650 . 3.500 3.520 3.400 3.646 0.146 9 0 "[ . 1 . 2]" 1 379 1 54 LEU HA 1 57 VAL HB 2.650 . 3.500 2.852 2.589 3.162 . 0 0 "[ . 1 . 2]" 1 380 1 54 LEU HA 1 57 VAL MG2 3.150 . 4.500 3.239 2.870 3.519 . 0 0 "[ . 1 . 2]" 1 381 1 54 LEU QB 1 55 TYR H 3.150 . 4.500 2.487 2.368 2.590 . 0 0 "[ . 1 . 2]" 1 382 1 54 LEU QD 1 55 TYR H 3.650 . 5.500 3.589 2.773 3.934 . 0 0 "[ . 1 . 2]" 1 383 1 54 LEU MD2 1 55 TYR QD 3.150 . 4.500 3.276 2.285 4.517 0.017 15 0 "[ . 1 . 2]" 1 384 1 54 LEU MD2 1 55 TYR QE 3.150 . 4.500 3.679 2.758 4.599 0.099 15 0 "[ . 1 . 2]" 1 385 1 55 TYR H 1 55 TYR QB 2.650 . 3.500 2.147 2.053 2.226 . 0 0 "[ . 1 . 2]" 1 386 1 55 TYR H 1 56 LEU H 2.300 . 2.800 2.658 2.530 2.734 . 0 0 "[ . 1 . 2]" 1 387 1 55 TYR H 1 56 LEU HA 3.650 . 5.500 5.264 5.138 5.334 . 0 0 "[ . 1 . 2]" 1 388 1 55 TYR H 1 56 LEU QB 3.650 . 5.500 4.402 4.266 4.534 . 0 0 "[ . 1 . 2]" 1 389 1 55 TYR HA 1 56 LEU H 3.650 . 5.500 3.531 3.495 3.555 . 0 0 "[ . 1 . 2]" 1 390 1 55 TYR HA 1 57 VAL H 3.650 . 5.500 4.466 4.246 4.608 . 0 0 "[ . 1 . 2]" 1 391 1 55 TYR HA 1 58 ASP H 3.150 . 4.500 3.473 3.278 3.671 . 0 0 "[ . 1 . 2]" 1 392 1 55 TYR HA 1 58 ASP QB 2.650 . 3.500 2.755 2.489 3.157 . 0 0 "[ . 1 . 2]" 1 393 1 55 TYR QB 1 56 LEU H 3.150 . 4.500 2.725 2.633 2.840 . 0 0 "[ . 1 . 2]" 1 394 1 55 TYR QD 1 96 ALA MB 2.650 . 3.500 3.259 2.875 3.585 0.085 20 0 "[ . 1 . 2]" 1 395 1 55 TYR QE 1 96 ALA MB 2.650 . 3.500 2.513 2.084 2.983 . 0 0 "[ . 1 . 2]" 1 396 1 55 TYR QE 1 100 ALA MB 2.650 . 3.500 2.671 2.208 3.340 . 0 0 "[ . 1 . 2]" 1 397 1 56 LEU H 1 56 LEU HA 2.650 . 3.500 2.819 2.802 2.835 . 0 0 "[ . 1 . 2]" 1 398 1 56 LEU H 1 56 LEU QB 2.300 . 2.800 2.203 2.074 2.262 . 0 0 "[ . 1 . 2]" 1 399 1 56 LEU H 1 57 VAL H 2.650 . 3.500 2.666 2.619 2.710 . 0 0 "[ . 1 . 2]" 1 400 1 56 LEU H 1 57 VAL HB 3.150 . 4.500 4.700 4.661 4.740 0.240 10 0 "[ . 1 . 2]" 1 401 1 56 LEU H 1 57 VAL MG2 3.650 . 5.500 4.283 4.154 4.406 . 0 0 "[ . 1 . 2]" 1 402 1 56 LEU HA 1 57 VAL H 2.650 . 3.500 3.533 3.504 3.556 0.056 12 0 "[ . 1 . 2]" 1 403 1 56 LEU HA 1 59 LEU MD2 3.150 . 4.500 3.854 3.238 4.714 0.214 17 0 "[ . 1 . 2]" 1 404 1 56 LEU QB 1 57 VAL H 2.650 . 3.500 2.496 2.366 2.607 . 0 0 "[ . 1 . 2]" 1 405 1 56 LEU QB 1 57 VAL MG2 3.150 . 4.500 3.137 3.023 3.284 . 0 0 "[ . 1 . 2]" 1 406 1 56 LEU HG 1 57 VAL H 3.150 . 4.500 4.244 3.676 4.972 0.472 13 0 "[ . 1 . 2]" 1 407 1 57 VAL H 1 57 VAL HA 2.650 . 3.500 2.818 2.798 2.842 . 0 0 "[ . 1 . 2]" 1 408 1 57 VAL H 1 57 VAL HB 2.300 . 2.800 2.380 2.335 2.451 . 0 0 "[ . 1 . 2]" 1 409 1 57 VAL H 1 58 ASP H 2.650 . 3.500 2.701 2.612 2.774 . 0 0 "[ . 1 . 2]" 1 410 1 57 VAL H 1 59 LEU H 3.650 . 5.500 4.146 4.015 4.268 . 0 0 "[ . 1 . 2]" 1 411 1 57 VAL HA 1 60 ILE HB 2.650 . 3.500 3.011 2.652 3.682 0.182 11 0 "[ . 1 . 2]" 1 412 1 57 VAL HB 1 58 ASP H 3.150 . 4.500 2.580 2.497 2.894 . 0 0 "[ . 1 . 2]" 1 413 1 57 VAL QG 1 58 ASP H 3.650 . 5.500 3.082 3.013 3.319 . 0 0 "[ . 1 . 2]" 1 414 1 57 VAL QG 1 60 ILE HB 3.150 . 4.500 3.490 3.035 4.525 0.025 11 0 "[ . 1 . 2]" 1 415 1 57 VAL QG 1 61 LEU HG 2.650 . 3.500 3.196 2.884 3.995 0.495 12 0 "[ . 1 . 2]" 1 416 1 57 VAL MG1 1 58 ASP HA 3.150 . 4.500 3.278 3.182 3.440 . 0 0 "[ . 1 . 2]" 1 417 1 58 ASP H 1 58 ASP QB 2.650 . 3.500 2.303 2.208 2.685 . 0 0 "[ . 1 . 2]" 1 418 1 58 ASP H 1 59 LEU H 2.650 . 3.500 2.720 2.560 2.918 . 0 0 "[ . 1 . 2]" 1 419 1 58 ASP HA 1 59 LEU H 2.650 . 3.500 3.534 3.511 3.560 0.060 16 0 "[ . 1 . 2]" 1 420 1 58 ASP HA 1 61 LEU H 3.150 . 4.500 3.488 3.349 3.703 . 0 0 "[ . 1 . 2]" 1 421 1 58 ASP HA 1 61 LEU QB 2.650 . 3.500 2.823 2.490 3.228 . 0 0 "[ . 1 . 2]" 1 422 1 58 ASP QB 1 59 LEU H 2.650 . 3.500 2.581 2.451 2.721 . 0 0 "[ . 1 . 2]" 1 423 1 58 ASP QB 1 61 LEU QD 3.650 . 5.500 4.154 3.773 5.102 . 0 0 "[ . 1 . 2]" 1 424 1 58 ASP QB 1 96 ALA MB 3.150 . 4.500 3.842 3.018 4.404 . 0 0 "[ . 1 . 2]" 1 425 1 59 LEU H 1 59 LEU HA 2.650 . 3.500 2.814 2.795 2.831 . 0 0 "[ . 1 . 2]" 1 426 1 59 LEU H 1 59 LEU QB 2.300 . 2.800 2.251 2.079 2.439 . 0 0 "[ . 1 . 2]" 1 427 1 59 LEU H 1 62 VAL H 3.650 . 5.500 4.826 4.616 5.147 . 0 0 "[ . 1 . 2]" 1 428 1 59 LEU HA 1 62 VAL H 3.150 . 4.500 3.450 3.172 3.696 . 0 0 "[ . 1 . 2]" 1 429 1 59 LEU HA 1 62 VAL HB 2.650 . 3.500 2.839 2.342 3.347 . 0 0 "[ . 1 . 2]" 1 430 1 59 LEU HA 1 62 VAL MG2 3.150 . 4.500 2.925 2.583 3.237 . 0 0 "[ . 1 . 2]" 1 431 1 59 LEU QD 1 60 ILE HA 3.650 . 5.500 4.489 3.936 5.153 . 0 0 "[ . 1 . 2]" 1 432 1 59 LEU QD 1 62 VAL HB 3.150 . 4.500 3.506 2.440 4.377 . 0 0 "[ . 1 . 2]" 1 433 1 59 LEU QD 1 95 PRO HA 3.150 . 4.500 4.133 3.514 4.584 0.084 19 0 "[ . 1 . 2]" 1 434 1 59 LEU QD 1 95 PRO QG 3.650 . 5.500 3.844 2.851 5.060 . 0 0 "[ . 1 . 2]" 1 435 1 60 ILE H 1 60 ILE HA 2.650 . 3.500 2.814 2.784 2.830 . 0 0 "[ . 1 . 2]" 1 436 1 60 ILE H 1 60 ILE HB 2.300 . 2.800 2.393 2.222 2.575 . 0 0 "[ . 1 . 2]" 1 437 1 60 ILE H 1 62 VAL MG2 3.650 . 5.500 5.059 4.875 5.257 . 0 0 "[ . 1 . 2]" 1 438 1 60 ILE H 1 63 ILE H 3.650 . 5.500 4.873 4.668 5.018 . 0 0 "[ . 1 . 2]" 1 439 1 60 ILE H 1 63 ILE MD 3.650 . 5.500 4.531 3.800 5.597 0.097 10 0 "[ . 1 . 2]" 1 440 1 60 ILE HA 1 61 LEU H 2.650 . 3.500 3.537 3.503 3.554 0.054 16 0 "[ . 1 . 2]" 1 441 1 60 ILE MG 1 61 LEU H 3.150 . 4.500 3.176 1.980 3.528 . 0 0 "[ . 1 . 2]" 1 442 1 61 LEU H 1 61 LEU HA 2.650 . 3.500 2.824 2.784 2.879 . 0 0 "[ . 1 . 2]" 1 443 1 61 LEU H 1 62 VAL H 2.650 . 3.500 2.666 2.445 2.759 . 0 0 "[ . 1 . 2]" 1 444 1 61 LEU HA 1 62 VAL H 3.150 . 4.500 3.532 3.495 3.558 . 0 0 "[ . 1 . 2]" 1 445 1 61 LEU HA 1 63 ILE H 3.150 . 4.500 4.429 4.287 4.650 0.150 8 0 "[ . 1 . 2]" 1 446 1 61 LEU HA 1 64 ILE H 3.150 . 4.500 3.527 3.260 3.791 . 0 0 "[ . 1 . 2]" 1 447 1 61 LEU HA 1 64 ILE MD 2.650 . 3.500 2.664 2.223 3.903 0.403 13 0 "[ . 1 . 2]" 1 448 1 61 LEU HA 1 64 ILE MG 3.650 . 5.500 4.271 3.359 4.899 . 0 0 "[ . 1 . 2]" 1 449 1 61 LEU HA 1 65 LEU H 3.150 . 4.500 4.424 3.804 4.612 0.112 16 0 "[ . 1 . 2]" 1 450 1 61 LEU HA 1 65 LEU MD1 3.150 . 4.500 4.369 3.809 4.615 0.115 18 0 "[ . 1 . 2]" 1 451 1 61 LEU QB 1 62 VAL H 3.150 . 4.500 2.630 2.461 2.722 . 0 0 "[ . 1 . 2]" 1 452 1 61 LEU QB 1 65 LEU MD1 3.150 . 4.500 3.284 2.582 3.473 . 0 0 "[ . 1 . 2]" 1 453 1 62 VAL H 1 62 VAL HB 2.650 . 3.500 2.451 2.186 2.523 . 0 0 "[ . 1 . 2]" 1 454 1 62 VAL H 1 63 ILE H 2.650 . 3.500 2.692 2.592 2.838 . 0 0 "[ . 1 . 2]" 1 455 1 62 VAL H 1 64 ILE H 3.150 . 4.500 4.231 4.020 4.468 . 0 0 "[ . 1 . 2]" 1 456 1 62 VAL HA 1 63 ILE H 3.150 . 4.500 3.553 3.530 3.583 . 0 0 "[ . 1 . 2]" 1 457 1 62 VAL HA 1 64 ILE H 3.150 . 4.500 4.396 4.192 4.629 0.129 6 0 "[ . 1 . 2]" 1 458 1 62 VAL HA 1 65 LEU H 3.150 . 4.500 3.462 3.274 3.830 . 0 0 "[ . 1 . 2]" 1 459 1 62 VAL HA 1 65 LEU MD1 3.150 . 4.500 2.648 2.264 3.358 . 0 0 "[ . 1 . 2]" 1 460 1 62 VAL HB 1 63 ILE H 3.150 . 4.500 2.618 2.420 2.705 . 0 0 "[ . 1 . 2]" 1 461 1 62 VAL HB 1 66 TRP HE1 3.150 . 4.500 4.674 4.550 4.743 0.243 4 0 "[ . 1 . 2]" 1 462 1 62 VAL QG 1 63 ILE H 3.150 . 4.500 3.147 2.699 3.235 . 0 0 "[ . 1 . 2]" 1 463 1 62 VAL QG 1 66 TRP HD1 3.150 . 4.500 2.583 2.114 3.214 . 0 0 "[ . 1 . 2]" 1 464 1 62 VAL QG 1 95 PRO QG 3.150 . 4.500 3.094 2.238 4.395 . 0 0 "[ . 1 . 2]" 1 465 1 62 VAL MG1 1 64 ILE H 3.650 . 5.500 4.947 4.713 5.087 . 0 0 "[ . 1 . 2]" 1 466 1 62 VAL MG1 1 66 TRP HE1 3.650 . 5.500 1.992 1.792 3.081 0.008 12 0 "[ . 1 . 2]" 1 467 1 62 VAL MG1 1 93 LEU HA 2.650 . 3.500 3.132 2.591 3.613 0.113 6 0 "[ . 1 . 2]" 1 468 1 62 VAL MG1 1 93 LEU MD1 3.150 . 4.500 4.251 3.818 4.919 0.419 6 0 "[ . 1 . 2]" 1 469 1 62 VAL MG1 1 93 LEU MD2 3.150 . 4.500 3.066 2.613 4.368 . 0 0 "[ . 1 . 2]" 1 470 1 62 VAL MG1 1 95 PRO HA 3.150 . 4.500 3.730 3.101 4.467 . 0 0 "[ . 1 . 2]" 1 471 1 62 VAL MG1 1 95 PRO QD 3.150 . 4.500 3.601 2.659 4.347 . 0 0 "[ . 1 . 2]" 1 472 1 62 VAL MG2 1 93 LEU HA 2.650 . 3.500 3.501 3.100 3.646 0.146 10 0 "[ . 1 . 2]" 1 473 1 62 VAL MG2 1 93 LEU MD2 3.150 . 4.500 4.029 3.829 4.548 0.048 6 0 "[ . 1 . 2]" 1 474 1 62 VAL MG2 1 95 PRO HA 2.650 . 3.500 3.053 2.360 3.453 . 0 0 "[ . 1 . 2]" 1 475 1 63 ILE H 1 63 ILE HB 3.150 . 4.500 2.685 2.172 3.609 . 0 0 "[ . 1 . 2]" 1 476 1 63 ILE H 1 64 ILE H 2.650 . 3.500 2.760 2.687 2.891 . 0 0 "[ . 1 . 2]" 1 477 1 63 ILE MG 1 67 ALA H 3.650 . 5.500 4.549 3.996 5.735 0.235 8 0 "[ . 1 . 2]" 1 478 1 64 ILE H 1 64 ILE HB 2.650 . 3.500 2.393 2.049 2.600 . 0 0 "[ . 1 . 2]" 1 479 1 64 ILE H 1 65 LEU H 3.150 . 4.500 2.710 2.587 2.808 . 0 0 "[ . 1 . 2]" 1 480 1 64 ILE H 1 66 TRP H 3.650 . 5.500 4.170 3.961 5.049 . 0 0 "[ . 1 . 2]" 1 481 1 64 ILE H 1 67 ALA H 3.650 . 5.500 4.855 4.728 4.961 . 0 0 "[ . 1 . 2]" 1 482 1 64 ILE HA 1 65 LEU H 3.150 . 4.500 3.549 3.494 3.577 . 0 0 "[ . 1 . 2]" 1 483 1 64 ILE HA 1 67 ALA H 3.150 . 4.500 3.562 3.441 3.689 . 0 0 "[ . 1 . 2]" 1 484 1 64 ILE HA 1 67 ALA MB 2.650 . 3.500 2.858 2.226 3.130 . 0 0 "[ . 1 . 2]" 1 485 1 64 ILE HB 1 65 LEU H 2.650 . 3.500 2.622 2.405 3.029 . 0 0 "[ . 1 . 2]" 1 486 1 64 ILE MG 1 67 ALA MB 3.650 . 5.500 3.513 3.047 3.908 . 0 0 "[ . 1 . 2]" 1 487 1 65 LEU H 1 65 LEU QB 2.650 . 3.500 2.283 2.042 2.387 . 0 0 "[ . 1 . 2]" 1 488 1 65 LEU H 1 66 TRP H 3.150 . 4.500 2.671 2.538 3.063 . 0 0 "[ . 1 . 2]" 1 489 1 65 LEU H 1 67 ALA H 3.150 . 4.500 4.038 3.699 4.256 . 0 0 "[ . 1 . 2]" 1 490 1 65 LEU HA 1 66 TRP H 3.150 . 4.500 3.531 3.500 3.594 . 0 0 "[ . 1 . 2]" 1 491 1 65 LEU HA 1 69 TYR H 3.650 . 5.500 4.519 3.936 5.463 . 0 0 "[ . 1 . 2]" 1 492 1 65 LEU QB 1 66 TRP H 3.650 . 5.500 2.583 2.186 2.758 . 0 0 "[ . 1 . 2]" 1 493 1 65 LEU QB 1 93 LEU MD2 3.650 . 5.500 2.494 1.965 4.358 . 0 0 "[ . 1 . 2]" 1 494 1 65 LEU QD 1 93 LEU MD2 3.150 . 4.500 2.684 2.130 4.577 0.077 6 0 "[ . 1 . 2]" 1 495 1 65 LEU QD 1 132 LYS QD 3.150 . 4.500 3.703 2.756 4.563 0.063 17 0 "[ . 1 . 2]" 1 496 1 65 LEU MD1 1 132 LYS QE 3.150 . 4.500 4.350 3.492 4.628 0.128 16 0 "[ . 1 . 2]" 1 497 1 65 LEU MD2 1 132 LYS QE 3.150 . 4.500 3.670 2.614 4.542 0.042 6 0 "[ . 1 . 2]" 1 498 1 66 TRP H 1 66 TRP HA 2.650 . 3.500 2.805 2.781 2.827 . 0 0 "[ . 1 . 2]" 1 499 1 66 TRP H 1 66 TRP QB 3.650 . 5.500 2.337 2.241 2.644 . 0 0 "[ . 1 . 2]" 1 500 1 66 TRP H 1 66 TRP HD1 3.150 . 4.500 2.369 2.062 3.907 . 0 0 "[ . 1 . 2]" 1 501 1 66 TRP H 1 67 ALA H 2.650 . 3.500 2.673 2.607 2.756 . 0 0 "[ . 1 . 2]" 1 502 1 66 TRP H 1 67 ALA MB 3.650 . 5.500 4.330 4.272 4.401 . 0 0 "[ . 1 . 2]" 1 503 1 66 TRP H 1 93 LEU MD2 3.150 . 4.500 4.084 2.727 4.672 0.172 6 0 "[ . 1 . 2]" 1 504 1 66 TRP HA 1 67 ALA H 2.650 . 3.500 3.501 3.409 3.545 0.045 12 0 "[ . 1 . 2]" 1 505 1 66 TRP QB 1 67 ALA H 3.650 . 5.500 2.874 2.607 3.662 . 0 0 "[ . 1 . 2]" 1 506 1 66 TRP QB 1 67 ALA HA 3.150 . 4.500 3.972 3.867 4.556 0.056 10 0 "[ . 1 . 2]" 1 507 1 66 TRP QB 1 67 ALA MB 3.650 . 5.500 4.159 3.892 4.903 . 0 0 "[ . 1 . 2]" 1 508 1 66 TRP HD1 1 93 LEU QB 3.150 . 4.500 3.589 2.923 4.219 . 0 0 "[ . 1 . 2]" 1 509 1 66 TRP HD1 1 93 LEU MD1 3.150 . 4.500 3.495 2.547 4.583 0.083 8 0 "[ . 1 . 2]" 1 510 1 66 TRP HD1 1 93 LEU MD2 3.150 . 4.500 2.840 2.457 3.979 . 0 0 "[ . 1 . 2]" 1 511 1 66 TRP HE1 1 93 LEU MD1 3.650 . 5.500 3.581 2.660 5.838 0.338 10 0 "[ . 1 . 2]" 1 512 1 66 TRP HE1 1 93 LEU MD2 3.650 . 5.500 3.047 2.346 5.446 . 0 0 "[ . 1 . 2]" 1 513 1 67 ALA H 1 67 ALA HA 2.650 . 3.500 2.771 2.740 2.815 . 0 0 "[ . 1 . 2]" 1 514 1 67 ALA H 1 67 ALA MB 2.650 . 3.500 2.211 2.146 2.245 . 0 0 "[ . 1 . 2]" 1 515 1 67 ALA H 1 68 ASP H 2.650 . 3.500 2.928 2.804 3.019 . 0 0 "[ . 1 . 2]" 1 516 1 67 ALA H 1 69 TYR QB 3.650 . 5.500 4.806 4.639 5.009 . 0 0 "[ . 1 . 2]" 1 517 1 67 ALA HA 1 70 ALA MB 2.650 . 3.500 2.989 2.598 3.379 . 0 0 "[ . 1 . 2]" 1 518 1 67 ALA HA 1 71 TYR H 3.150 . 4.500 4.061 3.685 4.442 . 0 0 "[ . 1 . 2]" 1 519 1 68 ASP H 1 69 TYR H 3.150 . 4.500 2.637 2.464 2.731 . 0 0 "[ . 1 . 2]" 1 520 1 68 ASP H 1 70 ALA H 3.650 . 5.500 4.191 4.072 4.403 . 0 0 "[ . 1 . 2]" 1 521 1 68 ASP HA 1 69 TYR H 3.150 . 4.500 3.546 3.519 3.564 . 0 0 "[ . 1 . 2]" 1 522 1 68 ASP HA 1 70 ALA H 3.150 . 4.500 4.574 4.475 4.660 0.160 17 0 "[ . 1 . 2]" 1 523 1 68 ASP HA 1 71 TYR H 3.150 . 4.500 3.604 3.401 3.866 . 0 0 "[ . 1 . 2]" 1 524 1 68 ASP HA 1 71 TYR QB 2.650 . 3.500 2.773 2.422 3.218 . 0 0 "[ . 1 . 2]" 1 525 1 68 ASP QB 1 69 TYR H 3.650 . 5.500 2.601 2.374 3.266 . 0 0 "[ . 1 . 2]" 1 526 1 68 ASP QB 1 69 TYR HA 3.150 . 4.500 3.984 3.824 4.164 . 0 0 "[ . 1 . 2]" 1 527 1 68 ASP QB 1 71 TYR H 3.650 . 5.500 5.024 4.807 5.293 . 0 0 "[ . 1 . 2]" 1 528 1 69 TYR H 1 69 TYR HA 2.650 . 3.500 2.819 2.794 2.855 . 0 0 "[ . 1 . 2]" 1 529 1 69 TYR H 1 69 TYR QB 2.650 . 3.500 2.216 2.098 2.262 . 0 0 "[ . 1 . 2]" 1 530 1 69 TYR H 1 70 ALA H 3.150 . 4.500 2.730 2.612 2.821 . 0 0 "[ . 1 . 2]" 1 531 1 69 TYR HA 1 73 ALA H 3.150 . 4.500 4.103 3.845 4.372 . 0 0 "[ . 1 . 2]" 1 532 1 69 TYR QB 1 70 ALA H 2.650 . 3.500 2.524 2.330 2.791 . 0 0 "[ . 1 . 2]" 1 533 1 69 TYR QB 1 70 ALA MB 3.150 . 4.500 3.878 3.626 4.125 . 0 0 "[ . 1 . 2]" 1 534 1 69 TYR QB 1 93 LEU MD1 3.150 . 4.500 3.045 2.549 4.401 . 0 0 "[ . 1 . 2]" 1 535 1 69 TYR QD 1 70 ALA H 3.150 . 4.500 2.985 2.338 3.412 . 0 0 "[ . 1 . 2]" 1 536 1 69 TYR QD 1 86 THR HB 3.150 . 4.500 4.342 3.245 4.814 0.314 5 0 "[ . 1 . 2]" 1 537 1 69 TYR QD 1 86 THR MG 3.650 . 5.500 3.574 2.362 4.186 . 0 0 "[ . 1 . 2]" 1 538 1 69 TYR QD 1 90 ILE MD 3.150 . 4.500 4.505 4.055 4.786 0.286 1 0 "[ . 1 . 2]" 1 539 1 69 TYR QD 1 93 LEU MD1 3.150 . 4.500 3.270 2.472 4.127 . 0 0 "[ . 1 . 2]" 1 540 1 69 TYR QE 1 70 ALA HA 3.150 . 4.500 4.010 3.208 4.650 0.150 14 0 "[ . 1 . 2]" 1 541 1 69 TYR QE 1 83 VAL HA 3.650 . 5.500 3.667 2.787 4.386 . 0 0 "[ . 1 . 2]" 1 542 1 69 TYR QE 1 83 VAL MG1 3.150 . 4.500 4.171 3.636 4.586 0.086 14 0 "[ . 1 . 2]" 1 543 1 69 TYR QE 1 83 VAL MG2 2.650 . 3.500 3.033 2.563 3.605 0.105 14 0 "[ . 1 . 2]" 1 544 1 69 TYR QE 1 86 THR H 3.650 . 5.500 5.014 4.643 5.346 . 0 0 "[ . 1 . 2]" 1 545 1 69 TYR QE 1 86 THR HB 3.150 . 4.500 3.167 2.328 4.617 0.117 12 0 "[ . 1 . 2]" 1 546 1 69 TYR QE 1 86 THR MG 2.650 . 3.500 2.511 2.074 3.360 . 0 0 "[ . 1 . 2]" 1 547 1 69 TYR QE 1 90 ILE MD 3.150 . 4.500 3.256 2.839 3.718 . 0 0 "[ . 1 . 2]" 1 548 1 70 ALA H 1 70 ALA HA 2.650 . 3.500 2.822 2.797 2.851 . 0 0 "[ . 1 . 2]" 1 549 1 70 ALA H 1 70 ALA MB 2.650 . 3.500 2.226 2.174 2.253 . 0 0 "[ . 1 . 2]" 1 550 1 70 ALA H 1 71 TYR H 2.650 . 3.500 2.696 2.566 2.815 . 0 0 "[ . 1 . 2]" 1 551 1 70 ALA HA 1 71 TYR H 3.150 . 4.500 3.551 3.523 3.571 . 0 0 "[ . 1 . 2]" 1 552 1 70 ALA HA 1 73 ALA H 2.650 . 3.500 3.464 3.308 3.629 0.129 7 0 "[ . 1 . 2]" 1 553 1 70 ALA HA 1 73 ALA MB 2.650 . 3.500 2.474 2.236 2.769 . 0 0 "[ . 1 . 2]" 1 554 1 70 ALA MB 1 71 TYR H 3.150 . 4.500 2.490 2.245 2.657 . 0 0 "[ . 1 . 2]" 1 555 1 70 ALA MB 1 73 ALA MB 3.150 . 4.500 3.704 3.453 3.973 . 0 0 "[ . 1 . 2]" 1 556 1 70 ALA MB 1 74 TYR QD 3.150 . 4.500 3.618 2.978 4.486 . 0 0 "[ . 1 . 2]" 1 557 1 71 TYR H 1 71 TYR HA 2.650 . 3.500 2.804 2.784 2.822 . 0 0 "[ . 1 . 2]" 1 558 1 71 TYR H 1 71 TYR QB 2.650 . 3.500 2.200 2.040 2.344 . 0 0 "[ . 1 . 2]" 1 559 1 71 TYR H 1 72 ARG H 2.650 . 3.500 2.776 2.710 2.876 . 0 0 "[ . 1 . 2]" 1 560 1 71 TYR HA 1 72 ARG H 3.150 . 4.500 3.560 3.547 3.582 . 0 0 "[ . 1 . 2]" 1 561 1 71 TYR HA 1 74 TYR H 3.150 . 4.500 3.816 3.522 4.075 . 0 0 "[ . 1 . 2]" 1 562 1 71 TYR QB 1 72 ARG H 3.150 . 4.500 2.435 2.239 2.564 . 0 0 "[ . 1 . 2]" 1 563 1 71 TYR QB 1 73 ALA H 3.650 . 5.500 4.601 4.423 4.713 . 0 0 "[ . 1 . 2]" 1 564 1 71 TYR QE 1 75 LYS QD 3.650 . 5.500 3.923 2.513 5.651 0.151 9 0 "[ . 1 . 2]" 1 565 1 72 ARG H 1 72 ARG QB 3.150 . 4.500 2.238 2.074 2.497 . 0 0 "[ . 1 . 2]" 1 566 1 72 ARG HA 1 73 ALA H 3.150 . 4.500 3.533 3.508 3.564 . 0 0 "[ . 1 . 2]" 1 567 1 72 ARG HA 1 75 LYS H 3.150 . 4.500 3.338 3.171 3.507 . 0 0 "[ . 1 . 2]" 1 568 1 72 ARG HA 1 75 LYS QB 2.650 . 3.500 2.356 2.121 2.639 . 0 0 "[ . 1 . 2]" 1 569 1 72 ARG HA 1 76 SER H 3.650 . 5.500 4.234 3.611 5.027 . 0 0 "[ . 1 . 2]" 1 570 1 72 ARG QB 1 73 ALA H 3.150 . 4.500 2.649 2.432 2.816 . 0 0 "[ . 1 . 2]" 1 571 1 72 ARG QB 1 73 ALA MB 3.150 . 4.500 3.940 3.755 4.111 . 0 0 "[ . 1 . 2]" 1 572 1 72 ARG QG 1 73 ALA H 3.150 . 4.500 4.144 3.696 4.587 0.087 10 0 "[ . 1 . 2]" 1 573 1 73 ALA H 1 73 ALA HA 2.650 . 3.500 2.786 2.754 2.818 . 0 0 "[ . 1 . 2]" 1 574 1 73 ALA H 1 73 ALA MB 2.650 . 3.500 2.214 2.182 2.239 . 0 0 "[ . 1 . 2]" 1 575 1 73 ALA H 1 74 TYR H 2.650 . 3.500 2.854 2.732 2.972 . 0 0 "[ . 1 . 2]" 1 576 1 73 ALA H 1 75 LYS H 3.150 . 4.500 4.045 3.813 4.219 . 0 0 "[ . 1 . 2]" 1 577 1 73 ALA HA 1 82 TYR QD 2.650 . 3.500 3.043 2.525 3.437 . 0 0 "[ . 1 . 2]" 1 578 1 73 ALA MB 1 74 TYR H 3.650 . 5.500 2.325 2.167 2.508 . 0 0 "[ . 1 . 2]" 1 579 1 73 ALA MB 1 74 TYR QD 3.150 . 4.500 3.454 2.282 4.669 0.169 9 0 "[ . 1 . 2]" 1 580 1 73 ALA MB 1 79 PRO HA 2.650 . 3.500 2.659 2.344 3.000 . 0 0 "[ . 1 . 2]" 1 581 1 73 ALA MB 1 79 PRO QB 3.150 . 4.500 2.890 2.387 3.530 . 0 0 "[ . 1 . 2]" 1 582 1 73 ALA MB 1 82 TYR QB 3.150 . 4.500 3.184 2.613 4.675 0.175 14 0 "[ . 1 . 2]" 1 583 1 73 ALA MB 1 82 TYR QD 2.650 . 3.500 3.016 2.259 3.507 0.007 10 0 "[ . 1 . 2]" 1 584 1 73 ALA MB 1 82 TYR QE 3.150 . 4.500 3.625 2.091 4.464 . 0 0 "[ . 1 . 2]" 1 585 1 74 TYR H 1 74 TYR HA 2.650 . 3.500 2.839 2.810 2.881 . 0 0 "[ . 1 . 2]" 1 586 1 74 TYR H 1 75 LYS H 2.650 . 3.500 2.608 2.424 2.692 . 0 0 "[ . 1 . 2]" 1 587 1 74 TYR HA 1 75 LYS H 3.150 . 4.500 3.519 3.440 3.557 . 0 0 "[ . 1 . 2]" 1 588 1 74 TYR HA 1 77 GLY H 2.650 . 3.500 3.404 3.165 3.616 0.116 14 0 "[ . 1 . 2]" 1 589 1 74 TYR HA 1 79 PRO QB 2.650 . 3.500 3.235 2.314 3.582 0.082 10 0 "[ . 1 . 2]" 1 590 1 74 TYR QB 1 75 LYS H 3.150 . 4.500 2.739 2.614 2.997 . 0 0 "[ . 1 . 2]" 1 591 1 74 TYR QD 1 75 LYS H 3.150 . 4.500 4.440 4.273 4.609 0.109 7 0 "[ . 1 . 2]" 1 592 1 74 TYR QD 1 79 PRO QB 3.150 . 4.500 3.543 2.430 4.162 . 0 0 "[ . 1 . 2]" 1 593 1 74 TYR QE 1 79 PRO QB 3.150 . 4.500 3.559 2.543 4.388 . 0 0 "[ . 1 . 2]" 1 594 1 75 LYS H 1 75 LYS HA 2.650 . 3.500 2.799 2.777 2.814 . 0 0 "[ . 1 . 2]" 1 595 1 75 LYS H 1 75 LYS QB 2.650 . 3.500 2.217 2.045 2.343 . 0 0 "[ . 1 . 2]" 1 596 1 75 LYS H 1 76 SER H 2.650 . 3.500 2.718 2.655 2.793 . 0 0 "[ . 1 . 2]" 1 597 1 75 LYS HA 1 76 SER H 2.650 . 3.500 3.534 3.503 3.559 0.059 8 0 "[ . 1 . 2]" 1 598 1 75 LYS QB 1 76 SER H 2.650 . 3.500 2.676 2.462 2.876 . 0 0 "[ . 1 . 2]" 1 599 1 75 LYS QB 1 77 GLY H 3.650 . 5.500 4.493 4.406 4.733 . 0 0 "[ . 1 . 2]" 1 600 1 75 LYS QG 1 76 SER H 3.650 . 5.500 4.056 3.706 4.585 . 0 0 "[ . 1 . 2]" 1 601 1 76 SER H 1 76 SER HA 2.300 . 2.800 2.825 2.806 2.857 0.057 6 0 "[ . 1 . 2]" 1 602 1 76 SER H 1 76 SER QB 2.650 . 3.500 2.332 2.180 2.528 . 0 0 "[ . 1 . 2]" 1 603 1 76 SER H 1 77 GLY H 2.300 . 2.800 2.612 2.548 2.663 . 0 0 "[ . 1 . 2]" 1 604 1 76 SER H 1 77 GLY QA 3.150 . 4.500 4.502 4.436 4.553 0.053 17 0 "[ . 1 . 2]" 1 605 1 76 SER H 1 78 ASP H 3.150 . 4.500 4.028 3.800 4.280 . 0 0 "[ . 1 . 2]" 1 606 1 76 SER H 1 82 TYR QB 3.150 . 4.500 4.582 4.381 4.787 0.287 10 0 "[ . 1 . 2]" 1 607 1 76 SER H 1 82 TYR QD 3.150 . 4.500 4.558 4.435 4.799 0.299 14 0 "[ . 1 . 2]" 1 608 1 76 SER HA 1 77 GLY H 2.650 . 3.500 3.449 3.367 3.534 0.034 10 0 "[ . 1 . 2]" 1 609 1 77 GLY H 1 77 GLY QA 2.300 . 2.800 2.229 2.214 2.298 . 0 0 "[ . 1 . 2]" 1 610 1 77 GLY H 1 78 ASP H 2.300 . 2.800 2.500 2.118 2.629 . 0 0 "[ . 1 . 2]" 1 611 1 77 GLY H 1 78 ASP HA 3.650 . 5.500 5.041 4.758 5.148 . 0 0 "[ . 1 . 2]" 1 612 1 77 GLY H 1 79 PRO QD 3.150 . 4.500 3.975 3.730 4.365 . 0 0 "[ . 1 . 2]" 1 613 1 77 GLY QA 1 78 ASP H 2.300 . 2.800 2.899 2.852 2.912 0.112 14 0 "[ . 1 . 2]" 1 614 1 78 ASP H 1 78 ASP HA 2.300 . 2.800 2.917 2.900 2.941 0.141 10 0 "[ . 1 . 2]" 1 615 1 78 ASP H 1 78 ASP QB 2.650 . 3.500 2.893 2.632 3.298 . 0 0 "[ . 1 . 2]" 1 616 1 78 ASP H 1 79 PRO QD 2.650 . 3.500 2.950 2.754 3.192 . 0 0 "[ . 1 . 2]" 1 617 1 78 ASP H 1 82 TYR H 3.650 . 5.500 4.746 4.579 4.860 . 0 0 "[ . 1 . 2]" 1 618 1 78 ASP H 1 82 TYR QB 3.150 . 4.500 3.884 3.561 4.336 . 0 0 "[ . 1 . 2]" 1 619 1 78 ASP HA 1 79 PRO QD 2.650 . 3.500 2.136 2.037 2.197 . 0 0 "[ . 1 . 2]" 1 620 1 78 ASP HA 1 80 ALA H 3.150 . 4.500 3.744 3.503 4.051 . 0 0 "[ . 1 . 2]" 1 621 1 78 ASP QB 1 79 PRO QD 3.650 . 5.500 3.759 3.565 3.869 . 0 0 "[ . 1 . 2]" 1 622 1 78 ASP QB 1 81 GLY H 3.650 . 5.500 2.812 2.489 3.561 . 0 0 "[ . 1 . 2]" 1 623 1 79 PRO HA 1 82 TYR H 2.650 . 3.500 3.540 3.424 3.894 0.394 14 0 "[ . 1 . 2]" 1 624 1 79 PRO HA 1 82 TYR QB 3.150 . 4.500 2.565 2.270 4.321 . 0 0 "[ . 1 . 2]" 1 625 1 79 PRO HA 1 82 TYR QD 3.650 . 5.500 4.131 2.198 4.663 . 0 0 "[ . 1 . 2]" 1 626 1 79 PRO QB 1 81 GLY H 3.650 . 5.500 4.489 4.076 4.652 . 0 0 "[ . 1 . 2]" 1 627 1 79 PRO QB 1 80 ALA H 2.650 . 3.500 2.659 2.261 3.201 . 0 0 "[ . 1 . 2]" 1 628 1 79 PRO QD 1 80 ALA H 3.150 . 4.500 2.940 2.771 3.264 . 0 0 "[ . 1 . 2]" 1 629 1 79 PRO QG 1 80 ALA H 3.150 . 4.500 3.206 2.295 3.883 . 0 0 "[ . 1 . 2]" 1 630 1 80 ALA H 1 80 ALA HA 2.300 . 2.800 2.814 2.785 2.854 0.054 14 0 "[ . 1 . 2]" 1 631 1 80 ALA H 1 80 ALA MB 2.300 . 2.800 2.214 2.175 2.245 . 0 0 "[ . 1 . 2]" 1 632 1 80 ALA H 1 81 GLY H 2.300 . 2.800 2.722 2.495 2.826 0.026 15 0 "[ . 1 . 2]" 1 633 1 80 ALA H 1 81 GLY QA 3.150 . 4.500 4.580 4.354 4.661 0.161 15 0 "[ . 1 . 2]" 1 634 1 80 ALA H 1 82 TYR H 3.150 . 4.500 4.028 3.878 4.529 0.029 14 0 "[ . 1 . 2]" 1 635 1 80 ALA H 1 83 VAL QG 3.650 . 5.500 4.388 4.126 4.706 . 0 0 "[ . 1 . 2]" 1 636 1 80 ALA HA 1 81 GLY H 2.650 . 3.500 3.539 3.401 3.552 0.052 19 0 "[ . 1 . 2]" 1 637 1 80 ALA HA 1 83 VAL H 2.650 . 3.500 3.619 3.496 3.752 0.252 4 0 "[ . 1 . 2]" 1 638 1 80 ALA HA 1 83 VAL HB 2.650 . 3.500 2.968 2.604 3.302 . 0 0 "[ . 1 . 2]" 1 639 1 80 ALA HA 1 83 VAL MG2 2.650 . 3.500 3.143 2.531 3.603 0.103 19 0 "[ . 1 . 2]" 1 640 1 80 ALA HA 1 84 LYS H 3.150 . 4.500 4.319 3.990 4.611 0.111 15 0 "[ . 1 . 2]" 1 641 1 80 ALA HA 1 84 LYS QE 3.150 . 4.500 4.260 3.463 4.736 0.236 6 0 "[ . 1 . 2]" 1 642 1 80 ALA MB 1 81 GLY H 2.650 . 3.500 2.398 2.264 3.017 . 0 0 "[ . 1 . 2]" 1 643 1 80 ALA MB 1 82 TYR H 3.650 . 5.500 4.415 4.248 4.922 . 0 0 "[ . 1 . 2]" 1 644 1 80 ALA MB 1 84 LYS QE 3.150 . 4.500 3.054 2.221 3.772 . 0 0 "[ . 1 . 2]" 1 645 1 81 GLY H 1 81 GLY QA 2.300 . 2.800 2.208 2.197 2.216 . 0 0 "[ . 1 . 2]" 1 646 1 81 GLY H 1 82 TYR H 2.300 . 2.800 2.582 2.520 2.655 . 0 0 "[ . 1 . 2]" 1 647 1 81 GLY H 1 82 TYR QB 3.150 . 4.500 4.364 4.305 4.587 0.087 14 0 "[ . 1 . 2]" 1 648 1 81 GLY H 1 83 VAL H 3.650 . 5.500 4.068 3.759 4.247 . 0 0 "[ . 1 . 2]" 1 649 1 81 GLY QA 1 82 TYR H 2.650 . 3.500 2.718 2.660 2.785 . 0 0 "[ . 1 . 2]" 1 650 1 81 GLY QA 1 84 LYS QB 3.150 . 4.500 2.945 2.390 4.221 . 0 0 "[ . 1 . 2]" 1 651 1 81 GLY QA 1 84 LYS QE 2.650 . 3.500 2.997 2.270 3.635 0.135 18 0 "[ . 1 . 2]" 1 652 1 82 TYR H 1 82 TYR QB 2.300 . 2.800 2.256 2.197 2.293 . 0 0 "[ . 1 . 2]" 1 653 1 82 TYR H 1 83 VAL H 2.650 . 3.500 2.639 2.441 2.748 . 0 0 "[ . 1 . 2]" 1 654 1 82 TYR H 1 83 VAL HB 3.650 . 5.500 4.737 4.471 4.921 . 0 0 "[ . 1 . 2]" 1 655 1 82 TYR H 1 83 VAL MG2 3.650 . 5.500 4.251 3.974 4.460 . 0 0 "[ . 1 . 2]" 1 656 1 82 TYR H 1 84 LYS H 3.650 . 5.500 4.311 4.203 4.455 . 0 0 "[ . 1 . 2]" 1 657 1 82 TYR HA 1 83 VAL H 2.650 . 3.500 3.527 3.462 3.561 0.061 19 0 "[ . 1 . 2]" 1 658 1 82 TYR HA 1 85 LYS QB 3.150 . 4.500 3.186 2.672 4.699 0.199 6 0 "[ . 1 . 2]" 1 659 1 82 TYR HA 1 85 LYS QD 3.150 . 4.500 4.120 2.297 4.623 0.123 11 0 "[ . 1 . 2]" 1 660 1 82 TYR HA 1 85 LYS QE 3.150 . 4.500 3.413 2.441 4.354 . 0 0 "[ . 1 . 2]" 1 661 1 82 TYR HA 1 85 LYS QG 3.650 . 5.500 4.450 2.182 5.428 . 0 0 "[ . 1 . 2]" 1 662 1 82 TYR HA 1 86 THR MG 3.650 . 5.500 4.245 3.622 4.789 . 0 0 "[ . 1 . 2]" 1 663 1 82 TYR QB 1 83 VAL H 2.650 . 3.500 2.707 2.479 3.551 0.051 14 0 "[ . 1 . 2]" 1 664 1 82 TYR QB 1 83 VAL MG2 3.150 . 4.500 3.199 2.971 4.349 . 0 0 "[ . 1 . 2]" 1 665 1 82 TYR QB 1 84 LYS H 3.650 . 5.500 4.923 4.766 5.286 . 0 0 "[ . 1 . 2]" 1 666 1 82 TYR QD 1 83 VAL H 3.150 . 4.500 3.694 3.090 4.191 . 0 0 "[ . 1 . 2]" 1 667 1 82 TYR QD 1 83 VAL HA 3.150 . 4.500 3.316 2.872 3.996 . 0 0 "[ . 1 . 2]" 1 668 1 82 TYR QD 1 83 VAL MG2 3.150 . 4.500 3.204 2.494 3.932 . 0 0 "[ . 1 . 2]" 1 669 1 82 TYR QD 1 85 LYS H 3.650 . 5.500 5.077 4.529 5.321 . 0 0 "[ . 1 . 2]" 1 670 1 82 TYR QD 1 85 LYS QE 3.650 . 5.500 3.426 2.824 4.116 . 0 0 "[ . 1 . 2]" 1 671 1 82 TYR QE 1 86 THR HB 3.650 . 5.500 4.483 3.569 4.904 . 0 0 "[ . 1 . 2]" 1 672 1 82 TYR QE 1 86 THR MG 3.150 . 4.500 2.620 2.250 4.013 . 0 0 "[ . 1 . 2]" 1 673 1 83 VAL H 1 83 VAL HA 2.650 . 3.500 2.833 2.798 2.890 . 0 0 "[ . 1 . 2]" 1 674 1 83 VAL H 1 83 VAL HB 2.300 . 2.800 2.378 2.273 2.465 . 0 0 "[ . 1 . 2]" 1 675 1 83 VAL H 1 84 LYS H 2.650 . 3.500 2.673 2.457 2.763 . 0 0 "[ . 1 . 2]" 1 676 1 83 VAL H 1 85 LYS H 3.150 . 4.500 3.917 3.719 4.073 . 0 0 "[ . 1 . 2]" 1 677 1 83 VAL HA 1 84 LYS H 2.650 . 3.500 3.545 3.530 3.561 0.061 3 0 "[ . 1 . 2]" 1 678 1 83 VAL HA 1 85 LYS H 2.650 . 3.500 3.651 3.545 3.881 0.381 17 0 "[ . 1 . 2]" 1 679 1 83 VAL HA 1 85 LYS QE 3.650 . 5.500 5.653 5.388 5.862 0.362 15 0 "[ . 1 . 2]" 1 680 1 83 VAL HA 1 86 THR H 2.650 . 3.500 3.095 2.796 3.473 . 0 0 "[ . 1 . 2]" 1 681 1 83 VAL HA 1 90 ILE MD 3.150 . 4.500 3.607 2.622 4.433 . 0 0 "[ . 1 . 2]" 1 682 1 83 VAL HB 1 84 LYS H 2.650 . 3.500 2.522 2.384 2.700 . 0 0 "[ . 1 . 2]" 1 683 1 83 VAL HB 1 84 LYS QG 3.150 . 4.500 3.759 3.236 4.703 0.203 13 0 "[ . 1 . 2]" 1 684 1 83 VAL HB 1 85 LYS H 3.150 . 4.500 4.670 4.522 4.844 0.344 9 0 "[ . 1 . 2]" 1 685 1 83 VAL QG 1 84 LYS H 3.150 . 4.500 3.044 2.825 3.142 . 0 0 "[ . 1 . 2]" 1 686 1 83 VAL QG 1 84 LYS QG 3.150 . 4.500 3.589 3.227 4.132 . 0 0 "[ . 1 . 2]" 1 687 1 83 VAL QG 1 86 THR H 3.650 . 5.500 3.800 3.436 4.211 . 0 0 "[ . 1 . 2]" 1 688 1 83 VAL QG 1 87 LEU H 3.650 . 5.500 4.582 3.853 5.133 . 0 0 "[ . 1 . 2]" 1 689 1 83 VAL MG1 1 84 LYS HA 3.150 . 4.500 3.243 3.034 3.372 . 0 0 "[ . 1 . 2]" 1 690 1 83 VAL MG1 1 86 THR MG 3.150 . 4.500 4.385 2.788 4.905 0.405 11 0 "[ . 1 . 2]" 1 691 1 83 VAL MG1 1 90 ILE MD 2.650 . 3.500 2.300 2.010 2.845 . 0 0 "[ . 1 . 2]" 1 692 1 84 LYS H 1 84 LYS HA 2.300 . 2.800 2.778 2.726 2.821 0.021 17 0 "[ . 1 . 2]" 1 693 1 84 LYS H 1 84 LYS QB 2.300 . 2.800 2.356 2.110 2.723 . 0 0 "[ . 1 . 2]" 1 694 1 84 LYS H 1 85 LYS H 2.300 . 2.800 2.710 2.623 2.835 0.035 6 0 "[ . 1 . 2]" 1 695 1 84 LYS H 1 85 LYS HA 3.650 . 5.500 5.319 5.234 5.448 . 0 0 "[ . 1 . 2]" 1 696 1 84 LYS H 1 86 THR H 3.150 . 4.500 4.155 4.064 4.300 . 0 0 "[ . 1 . 2]" 1 697 1 84 LYS HA 1 87 LEU H 3.150 . 4.500 4.270 3.994 4.474 . 0 0 "[ . 1 . 2]" 1 698 1 84 LYS HA 1 87 LEU MD1 3.150 . 4.500 2.689 2.197 4.534 0.034 8 0 "[ . 1 . 2]" 1 699 1 84 LYS HA 1 87 LEU MD2 2.650 . 3.500 2.544 2.193 2.926 . 0 0 "[ . 1 . 2]" 1 700 1 84 LYS HA 1 87 LEU HG 2.650 . 3.500 2.453 2.258 2.944 . 0 0 "[ . 1 . 2]" 1 701 1 85 LYS H 1 85 LYS HA 2.300 . 2.800 2.926 2.904 2.948 0.148 17 0 "[ . 1 . 2]" 1 702 1 85 LYS H 1 85 LYS QB 2.300 . 2.800 2.375 2.223 2.896 0.096 6 0 "[ . 1 . 2]" 1 703 1 85 LYS H 1 86 THR H 2.300 . 2.800 2.285 2.187 2.417 . 0 0 "[ . 1 . 2]" 1 704 1 85 LYS H 1 86 THR MG 3.650 . 5.500 3.646 3.187 3.960 . 0 0 "[ . 1 . 2]" 1 705 1 85 LYS H 1 87 LEU H 3.150 . 4.500 4.308 4.022 4.613 0.113 20 0 "[ . 1 . 2]" 1 706 1 85 LYS H 1 87 LEU MD2 3.650 . 5.500 4.903 4.387 5.253 . 0 0 "[ . 1 . 2]" 1 707 1 85 LYS QB 1 86 THR H 2.650 . 3.500 3.088 2.777 3.705 0.205 9 0 "[ . 1 . 2]" 1 708 1 85 LYS QB 1 86 THR HB 3.650 . 5.500 5.253 4.087 5.730 0.230 9 0 "[ . 1 . 2]" 1 709 1 85 LYS QB 1 86 THR MG 3.150 . 4.500 2.959 2.421 4.721 0.221 5 0 "[ . 1 . 2]" 1 710 1 85 LYS QD 1 86 THR MG 3.650 . 5.500 4.034 2.029 4.929 . 0 0 "[ . 1 . 2]" 1 711 1 85 LYS QE 1 86 THR MG 3.650 . 5.500 2.853 2.308 3.530 . 0 0 "[ . 1 . 2]" 1 712 1 85 LYS QG 1 86 THR H 3.650 . 5.500 3.684 2.286 4.441 . 0 0 "[ . 1 . 2]" 1 713 1 85 LYS QG 1 86 THR HA 3.150 . 4.500 3.961 3.606 4.515 0.015 20 0 "[ . 1 . 2]" 1 714 1 85 LYS QG 1 86 THR MG 3.150 . 4.500 3.136 2.016 4.525 0.025 12 0 "[ . 1 . 2]" 1 715 1 86 THR H 1 86 THR HB 3.150 . 4.500 3.624 2.865 3.830 . 0 0 "[ . 1 . 2]" 1 716 1 86 THR H 1 87 LEU H 2.300 . 2.800 2.767 2.643 2.924 0.124 4 0 "[ . 1 . 2]" 1 717 1 86 THR H 1 87 LEU HA 3.150 . 4.500 4.467 4.296 4.653 0.153 2 0 "[ . 1 . 2]" 1 718 1 86 THR H 1 87 LEU MD1 3.650 . 5.500 4.584 3.407 4.968 . 0 0 "[ . 1 . 2]" 1 719 1 86 THR H 1 87 LEU MD2 3.650 . 5.500 4.490 3.543 4.923 . 0 0 "[ . 1 . 2]" 1 720 1 86 THR H 1 87 LEU HG 2.650 . 3.500 3.497 3.091 3.735 0.235 1 0 "[ . 1 . 2]" 1 721 1 86 THR H 1 89 GLU H 3.650 . 5.500 5.385 5.186 5.560 0.060 17 0 "[ . 1 . 2]" 1 722 1 86 THR HA 1 87 LEU H 2.300 . 2.800 2.868 2.808 2.979 0.179 1 0 "[ . 1 . 2]" 1 723 1 86 THR HA 1 88 TYR H 3.150 . 4.500 3.246 3.026 3.713 . 0 0 "[ . 1 . 2]" 1 724 1 86 THR HA 1 88 TYR QD 3.150 . 4.500 3.428 2.569 4.140 . 0 0 "[ . 1 . 2]" 1 725 1 86 THR HA 1 88 TYR QE 3.150 . 4.500 2.984 2.341 3.580 . 0 0 "[ . 1 . 2]" 1 726 1 86 THR HA 1 89 GLU H 3.650 . 5.500 3.412 2.924 3.798 . 0 0 "[ . 1 . 2]" 1 727 1 86 THR HA 1 89 GLU QB 3.150 . 4.500 3.339 2.640 3.917 . 0 0 "[ . 1 . 2]" 1 728 1 86 THR MG 1 87 LEU H 3.650 . 5.500 4.161 3.511 4.347 . 0 0 "[ . 1 . 2]" 1 729 1 87 LEU H 1 87 LEU HA 2.300 . 2.800 2.825 2.754 2.868 0.068 17 0 "[ . 1 . 2]" 1 730 1 87 LEU H 1 87 LEU QB 2.300 . 2.800 2.460 2.281 2.902 0.102 20 0 "[ . 1 . 2]" 1 731 1 87 LEU H 1 88 TYR QD 3.150 . 4.500 3.575 3.205 4.007 . 0 0 "[ . 1 . 2]" 1 732 1 87 LEU HA 1 88 TYR H 3.150 . 4.500 3.469 3.413 3.559 . 0 0 "[ . 1 . 2]" 1 733 1 87 LEU HA 1 90 ILE H 3.150 . 4.500 3.441 3.056 3.724 . 0 0 "[ . 1 . 2]" 1 734 1 87 LEU HA 1 90 ILE MD 3.150 . 4.500 3.461 2.300 4.795 0.295 13 0 "[ . 1 . 2]" 1 735 1 87 LEU HA 1 90 ILE QG 2.650 . 3.500 3.166 2.388 3.844 0.344 15 0 "[ . 1 . 2]" 1 736 1 87 LEU HA 1 90 ILE MG 3.150 . 5.000 4.256 3.574 4.974 . 0 0 "[ . 1 . 2]" 1 737 1 87 LEU QB 1 88 TYR H 2.650 . 3.500 2.905 2.489 3.491 . 0 0 "[ . 1 . 2]" 1 738 1 87 LEU QB 1 88 TYR HA 3.150 . 4.500 3.994 3.876 4.076 . 0 0 "[ . 1 . 2]" 1 739 1 87 LEU MD1 1 88 TYR H 3.650 . 5.500 4.306 1.816 4.938 . 0 0 "[ . 1 . 2]" 1 740 1 87 LEU MD2 1 90 ILE HB 3.650 . 5.500 4.289 3.492 5.740 0.240 8 0 "[ . 1 . 2]" 1 741 1 87 LEU HG 1 88 TYR H 3.150 . 4.500 4.364 3.660 4.526 0.026 9 0 "[ . 1 . 2]" 1 742 1 88 TYR H 1 88 TYR HA 2.650 . 3.500 2.904 2.852 2.942 . 0 0 "[ . 1 . 2]" 1 743 1 88 TYR H 1 88 TYR QB 2.650 . 3.500 2.597 2.393 2.856 . 0 0 "[ . 1 . 2]" 1 744 1 88 TYR H 1 89 GLU H 2.650 . 3.500 2.430 2.239 2.726 . 0 0 "[ . 1 . 2]" 1 745 1 88 TYR HA 1 89 GLU H 3.650 . 5.500 3.365 3.169 3.479 . 0 0 "[ . 1 . 2]" 1 746 1 88 TYR HA 1 90 ILE H 3.150 . 4.500 4.266 3.837 4.590 0.090 19 0 "[ . 1 . 2]" 1 747 1 88 TYR QB 1 89 GLU H 3.650 . 5.500 3.768 3.589 3.953 . 0 0 "[ . 1 . 2]" 1 748 1 88 TYR QD 1 89 GLU HA 3.150 . 4.500 3.558 3.217 4.212 . 0 0 "[ . 1 . 2]" 1 749 1 88 TYR QE 1 89 GLU HA 3.650 . 5.500 4.476 3.990 5.274 . 0 0 "[ . 1 . 2]" 1 750 1 89 GLU H 1 89 GLU HA 2.650 . 3.500 2.955 2.924 2.966 . 0 0 "[ . 1 . 2]" 1 751 1 89 GLU H 1 89 GLU QB 2.650 . 3.500 2.383 2.278 2.485 . 0 0 "[ . 1 . 2]" 1 752 1 89 GLU H 1 90 ILE H 2.650 . 3.500 2.125 2.027 2.298 . 0 0 "[ . 1 . 2]" 1 753 1 89 GLU H 1 90 ILE QG 3.650 . 5.500 4.296 2.999 5.350 . 0 0 "[ . 1 . 2]" 1 754 1 89 GLU HA 1 90 ILE H 3.150 . 4.500 3.469 3.261 3.547 . 0 0 "[ . 1 . 2]" 1 755 1 89 GLU HA 1 92 ALA MB 3.150 . 4.500 3.217 2.707 3.545 . 0 0 "[ . 1 . 2]" 1 756 1 89 GLU HA 1 132 LYS QE 3.650 . 5.500 4.967 3.846 5.601 0.101 16 0 "[ . 1 . 2]" 1 757 1 89 GLU QB 1 90 ILE H 3.150 . 4.500 2.913 2.617 3.431 . 0 0 "[ . 1 . 2]" 1 758 1 89 GLU QB 1 93 LEU MD1 3.650 . 5.500 3.917 3.307 5.112 . 0 0 "[ . 1 . 2]" 1 759 1 90 ILE H 1 90 ILE HA 2.650 . 3.500 2.809 2.743 2.870 . 0 0 "[ . 1 . 2]" 1 760 1 90 ILE H 1 90 ILE HB 2.300 . 2.800 2.343 2.113 2.777 . 0 0 "[ . 1 . 2]" 1 761 1 90 ILE H 1 91 PRO QD 2.650 . 3.500 2.108 1.934 2.295 . 0 0 "[ . 1 . 2]" 1 762 1 90 ILE H 1 92 ALA H 3.650 . 5.500 4.277 4.068 4.413 . 0 0 "[ . 1 . 2]" 1 763 1 90 ILE HA 1 93 LEU MD1 3.150 . 4.500 2.608 2.228 3.138 . 0 0 "[ . 1 . 2]" 1 764 1 90 ILE HB 1 91 PRO QD 2.650 . 3.500 2.150 2.039 2.255 . 0 0 "[ . 1 . 2]" 1 765 1 90 ILE MD 1 93 LEU QD 3.650 . 5.500 3.007 2.126 4.751 . 0 0 "[ . 1 . 2]" 1 766 1 90 ILE QG 1 93 LEU QD 3.150 . 4.500 3.642 2.728 4.270 . 0 0 "[ . 1 . 2]" 1 767 1 90 ILE MG 1 91 PRO QD 3.150 . 4.500 2.730 2.271 3.695 . 0 0 "[ . 1 . 2]" 1 768 1 90 ILE MG 1 91 PRO QG 3.650 . 5.500 3.846 2.951 4.650 . 0 0 "[ . 1 . 2]" 1 769 1 90 ILE MG 1 93 LEU MD1 3.150 . 4.500 3.870 2.612 4.660 0.160 1 0 "[ . 1 . 2]" 1 770 1 91 PRO HA 1 92 ALA H 2.650 . 3.500 3.520 3.423 3.550 0.050 8 0 "[ . 1 . 2]" 1 771 1 91 PRO HA 1 94 VAL MG2 2.650 . 3.500 2.097 2.001 2.305 . 0 0 "[ . 1 . 2]" 1 772 1 91 PRO QB 1 92 ALA H 2.650 . 3.500 2.865 2.514 3.421 . 0 0 "[ . 1 . 2]" 1 773 1 91 PRO QB 1 94 VAL MG2 3.150 . 4.500 3.540 3.310 3.851 . 0 0 "[ . 1 . 2]" 1 774 1 91 PRO QB 1 128 SER QB 3.150 . 4.500 3.626 3.000 4.540 0.040 14 0 "[ . 1 . 2]" 1 775 1 91 PRO QD 1 92 ALA H 2.650 . 3.500 2.913 2.523 3.293 . 0 0 "[ . 1 . 2]" 1 776 1 91 PRO QG 1 92 ALA H 3.150 . 4.500 3.531 2.628 3.997 . 0 0 "[ . 1 . 2]" 1 777 1 91 PRO QG 1 94 VAL MG2 3.650 . 5.500 4.326 4.070 4.701 . 0 0 "[ . 1 . 2]" 1 778 1 91 PRO QG 1 128 SER QB 3.150 . 4.500 4.211 3.468 4.619 0.119 10 0 "[ . 1 . 2]" 1 779 1 92 ALA H 1 92 ALA HA 2.300 . 2.800 2.853 2.769 2.909 0.109 15 0 "[ . 1 . 2]" 1 780 1 92 ALA H 1 92 ALA MB 2.650 . 3.500 2.222 2.164 2.282 . 0 0 "[ . 1 . 2]" 1 781 1 92 ALA H 1 93 LEU H 2.650 . 3.500 2.529 2.282 2.747 . 0 0 "[ . 1 . 2]" 1 782 1 92 ALA H 1 94 VAL HB 3.650 . 5.500 5.243 4.950 5.535 0.035 13 0 "[ . 1 . 2]" 1 783 1 92 ALA H 1 94 VAL QG 3.650 . 5.500 4.224 3.828 4.469 . 0 0 "[ . 1 . 2]" 1 784 1 92 ALA HA 1 125 LEU MD1 3.150 . 4.500 3.177 2.061 4.554 0.054 9 0 "[ . 1 . 2]" 1 785 1 92 ALA MB 1 93 LEU H 3.650 . 5.500 2.750 2.409 3.085 . 0 0 "[ . 1 . 2]" 1 786 1 92 ALA MB 1 93 LEU MD2 3.650 . 5.500 2.909 2.522 3.284 . 0 0 "[ . 1 . 2]" 1 787 1 92 ALA MB 1 125 LEU HA 3.650 . 5.500 4.907 3.984 5.496 . 0 0 "[ . 1 . 2]" 1 788 1 92 ALA MB 1 128 SER QB 3.150 . 4.500 3.759 2.548 4.716 0.216 12 0 "[ . 1 . 2]" 1 789 1 92 ALA MB 1 129 ARG QB 3.650 . 5.500 3.749 2.373 5.041 . 0 0 "[ . 1 . 2]" 1 790 1 92 ALA MB 1 129 ARG QG 3.150 . 4.500 2.692 2.022 4.104 . 0 0 "[ . 1 . 2]" 1 791 1 92 ALA MB 1 132 LYS QE 3.150 . 4.500 3.256 2.191 4.468 . 0 0 "[ . 1 . 2]" 1 792 1 93 LEU H 1 93 LEU QB 3.650 . 5.500 2.570 2.457 2.791 . 0 0 "[ . 1 . 2]" 1 793 1 93 LEU H 1 94 VAL H 2.650 . 3.500 2.489 1.931 3.024 . 0 0 "[ . 1 . 2]" 1 794 1 93 LEU HA 1 95 PRO QG 3.650 . 5.500 4.767 4.241 5.166 . 0 0 "[ . 1 . 2]" 1 795 1 93 LEU QB 1 94 VAL H 3.650 . 5.500 3.049 2.577 3.869 . 0 0 "[ . 1 . 2]" 1 796 1 93 LEU QB 1 94 VAL MG2 3.150 . 4.500 3.879 3.507 4.285 . 0 0 "[ . 1 . 2]" 1 797 1 93 LEU MD2 1 129 ARG QD 3.650 . 5.500 5.351 4.482 5.810 0.310 6 0 "[ . 1 . 2]" 1 798 1 93 LEU MD2 1 132 LYS QE 3.150 . 4.500 4.325 3.089 4.660 0.160 6 0 "[ . 1 . 2]" 1 799 1 94 VAL H 1 94 VAL HB 2.300 . 2.800 2.527 2.388 2.768 . 0 0 "[ . 1 . 2]" 1 800 1 94 VAL HA 1 95 PRO QD 3.150 . 4.500 2.062 2.024 2.109 . 0 0 "[ . 1 . 2]" 1 801 1 94 VAL HB 1 125 LEU MD1 2.650 . 3.500 3.204 2.367 3.624 0.124 12 0 "[ . 1 . 2]" 1 802 1 94 VAL QG 1 95 PRO QD 3.150 . 4.500 2.728 2.275 2.991 . 0 0 "[ . 1 . 2]" 1 803 1 94 VAL MG1 1 95 PRO QG 3.650 . 5.500 4.326 3.663 4.730 . 0 0 "[ . 1 . 2]" 1 804 1 94 VAL MG1 1 99 LEU HG 3.150 . 4.500 3.177 2.097 4.384 . 0 0 "[ . 1 . 2]" 1 805 1 96 ALA HA 1 100 ALA MB 3.150 . 4.500 4.490 4.082 4.669 0.169 19 0 "[ . 1 . 2]" 1 806 1 96 ALA MB 1 97 GLY H 3.650 . 5.500 2.794 2.539 2.995 . 0 0 "[ . 1 . 2]" 1 807 1 96 ALA MB 1 97 GLY QA 3.150 . 4.500 3.615 3.526 3.717 . 0 0 "[ . 1 . 2]" 1 808 1 96 ALA MB 1 99 LEU QD 3.650 . 5.500 3.937 2.639 4.963 . 0 0 "[ . 1 . 2]" 1 809 1 97 GLY H 1 98 LEU H 3.150 . 4.500 2.777 2.619 2.963 . 0 0 "[ . 1 . 2]" 1 810 1 97 GLY QA 1 98 LEU H 3.150 . 4.500 2.710 2.575 2.802 . 0 0 "[ . 1 . 2]" 1 811 1 97 GLY QA 1 100 ALA H 3.150 . 4.500 3.434 3.269 3.673 . 0 0 "[ . 1 . 2]" 1 812 1 97 GLY QA 1 100 ALA MB 3.150 . 4.500 2.454 2.090 2.715 . 0 0 "[ . 1 . 2]" 1 813 1 98 LEU H 1 98 LEU QB 2.650 . 3.500 2.181 2.044 2.266 . 0 0 "[ . 1 . 2]" 1 814 1 98 LEU H 1 99 LEU H 2.650 . 3.500 2.747 2.597 3.145 . 0 0 "[ . 1 . 2]" 1 815 1 98 LEU H 1 100 ALA H 3.150 . 4.500 3.987 3.733 4.117 . 0 0 "[ . 1 . 2]" 1 816 1 98 LEU HA 1 101 LEU QB 3.150 . 4.500 3.269 2.867 3.625 . 0 0 "[ . 1 . 2]" 1 817 1 98 LEU QB 1 99 LEU H 3.150 . 4.500 2.428 1.973 2.688 . 0 0 "[ . 1 . 2]" 1 818 1 98 LEU QB 1 99 LEU MD2 3.150 . 4.500 3.404 2.229 4.618 0.118 18 0 "[ . 1 . 2]" 1 819 1 98 LEU MD1 1 102 ILE QG 2.650 . 3.500 3.132 2.381 3.667 0.167 2 0 "[ . 1 . 2]" 1 820 1 99 LEU H 1 99 LEU QB 3.150 . 4.500 2.322 2.136 2.819 . 0 0 "[ . 1 . 2]" 1 821 1 99 LEU H 1 100 ALA H 2.650 . 3.500 2.621 2.565 2.680 . 0 0 "[ . 1 . 2]" 1 822 1 99 LEU HA 1 100 ALA H 3.150 . 4.500 3.520 3.491 3.537 . 0 0 "[ . 1 . 2]" 1 823 1 99 LEU HA 1 102 ILE H 3.150 . 4.500 3.367 3.230 3.533 . 0 0 "[ . 1 . 2]" 1 824 1 99 LEU HA 1 102 ILE MD 2.650 . 3.500 2.556 2.289 3.669 0.169 19 0 "[ . 1 . 2]" 1 825 1 99 LEU HA 1 102 ILE MG 3.150 . 4.500 3.921 3.673 4.348 . 0 0 "[ . 1 . 2]" 1 826 1 99 LEU QB 1 100 ALA H 2.650 . 3.500 2.797 2.576 3.523 0.023 6 0 "[ . 1 . 2]" 1 827 1 99 LEU QB 1 118 LEU MD1 2.650 . 3.500 3.191 2.314 3.637 0.137 14 0 "[ . 1 . 2]" 1 828 1 99 LEU QD 1 118 LEU MD1 3.150 . 4.500 2.666 1.899 4.502 0.002 11 0 "[ . 1 . 2]" 1 829 1 99 LEU MD2 1 100 ALA H 3.650 . 5.500 4.348 3.614 4.817 . 0 0 "[ . 1 . 2]" 1 830 1 99 LEU HG 1 100 ALA H 3.150 . 4.500 3.893 2.067 4.449 . 0 0 "[ . 1 . 2]" 1 831 1 100 ALA H 1 100 ALA HA 2.650 . 3.500 2.786 2.767 2.818 . 0 0 "[ . 1 . 2]" 1 832 1 100 ALA H 1 100 ALA MB 2.650 . 3.500 2.196 2.145 2.228 . 0 0 "[ . 1 . 2]" 1 833 1 100 ALA HA 1 103 GLU H 3.150 . 4.500 3.642 3.498 3.780 . 0 0 "[ . 1 . 2]" 1 834 1 100 ALA HA 1 103 GLU QB 2.650 . 3.500 2.784 2.491 3.553 0.053 13 0 "[ . 1 . 2]" 1 835 1 100 ALA MB 1 101 LEU H 3.650 . 5.500 2.374 2.255 2.546 . 0 0 "[ . 1 . 2]" 1 836 1 100 ALA MB 1 101 LEU QB 3.150 . 4.500 4.036 3.610 4.258 . 0 0 "[ . 1 . 2]" 1 837 1 100 ALA MB 1 101 LEU MD2 3.150 . 4.500 3.991 2.295 4.994 0.494 13 0 "[ . 1 . 2]" 1 838 1 100 ALA MB 1 103 GLU QB 3.650 . 5.500 4.140 3.829 4.863 . 0 0 "[ . 1 . 2]" 1 839 1 101 LEU H 1 101 LEU QB 2.650 . 3.500 2.258 2.086 2.485 . 0 0 "[ . 1 . 2]" 1 840 1 101 LEU H 1 103 GLU H 3.650 . 5.500 4.176 4.100 4.284 . 0 0 "[ . 1 . 2]" 1 841 1 101 LEU H 1 104 GLY H 3.650 . 5.500 4.728 4.567 4.922 . 0 0 "[ . 1 . 2]" 1 842 1 101 LEU HA 1 102 ILE H 2.650 . 3.500 3.542 3.528 3.564 0.064 20 0 "[ . 1 . 2]" 1 843 1 101 LEU HA 1 104 GLY H 3.150 . 4.500 3.559 3.423 3.879 . 0 0 "[ . 1 . 2]" 1 844 1 101 LEU QB 1 102 ILE H 2.650 . 3.500 2.566 2.439 2.669 . 0 0 "[ . 1 . 2]" 1 845 1 102 ILE H 1 102 ILE HA 2.650 . 3.500 2.834 2.814 2.861 . 0 0 "[ . 1 . 2]" 1 846 1 102 ILE H 1 102 ILE HB 2.300 . 2.800 2.429 2.267 2.566 . 0 0 "[ . 1 . 2]" 1 847 1 102 ILE H 1 103 GLU H 2.650 . 3.500 2.663 2.618 2.735 . 0 0 "[ . 1 . 2]" 1 848 1 102 ILE H 1 103 GLU QB 3.650 . 5.500 4.426 4.354 4.597 . 0 0 "[ . 1 . 2]" 1 849 1 102 ILE H 1 104 GLY H 3.650 . 5.500 4.079 3.974 4.202 . 0 0 "[ . 1 . 2]" 1 850 1 102 ILE H 1 104 GLY QA 3.650 . 5.500 5.545 5.409 5.662 0.162 9 0 "[ . 1 . 2]" 1 851 1 102 ILE HA 1 118 LEU MD1 3.150 . 4.500 3.696 2.301 4.623 0.123 12 0 "[ . 1 . 2]" 1 852 1 102 ILE HA 1 105 HIS H 3.150 . 4.500 3.497 3.290 3.776 . 0 0 "[ . 1 . 2]" 1 853 1 102 ILE HA 1 105 HIS QB 2.650 . 3.500 2.886 2.467 3.424 . 0 0 "[ . 1 . 2]" 1 854 1 102 ILE HB 1 103 GLU H 2.650 . 3.500 2.564 2.369 2.726 . 0 0 "[ . 1 . 2]" 1 855 1 102 ILE MG 1 103 GLU H 3.650 . 5.500 3.282 3.037 3.513 . 0 0 "[ . 1 . 2]" 1 856 1 102 ILE MG 1 103 GLU QB 3.150 . 4.500 4.152 3.799 4.538 0.038 12 0 "[ . 1 . 2]" 1 857 1 102 ILE MG 1 105 HIS QB 3.150 . 4.500 3.645 3.200 4.189 . 0 0 "[ . 1 . 2]" 1 858 1 103 GLU H 1 103 GLU QB 2.650 . 3.500 2.247 2.142 2.351 . 0 0 "[ . 1 . 2]" 1 859 1 103 GLU H 1 104 GLY H 3.650 . 5.500 2.674 2.537 2.759 . 0 0 "[ . 1 . 2]" 1 860 1 103 GLU H 1 104 GLY QA 3.650 . 5.500 4.543 4.423 4.610 . 0 0 "[ . 1 . 2]" 1 861 1 103 GLU HA 1 104 GLY H 3.650 . 5.500 3.537 3.500 3.562 . 0 0 "[ . 1 . 2]" 1 862 1 103 GLU HA 1 106 LEU H 3.150 . 4.500 3.539 3.307 3.731 . 0 0 "[ . 1 . 2]" 1 863 1 103 GLU HA 1 106 LEU QB 2.650 . 3.500 2.843 2.226 3.457 . 0 0 "[ . 1 . 2]" 1 864 1 103 GLU HA 1 106 LEU MD1 3.150 . 4.500 2.925 2.296 4.730 0.230 16 0 "[ . 1 . 2]" 1 865 1 103 GLU QB 1 104 GLY H 2.650 . 3.500 2.652 2.416 3.401 . 0 0 "[ . 1 . 2]" 1 866 1 103 GLU QB 1 115 VAL QG 3.150 . 4.500 3.060 2.079 3.685 . 0 0 "[ . 1 . 2]" 1 867 1 103 GLU QB 1 118 LEU QB 3.150 . 4.500 3.973 2.914 4.618 0.118 12 0 "[ . 1 . 2]" 1 868 1 103 GLU QB 1 118 LEU QD 2.650 . 3.500 2.775 1.891 3.837 0.337 18 0 "[ . 1 . 2]" 1 869 1 103 GLU QG 1 106 LEU MD1 3.650 . 5.500 4.275 3.519 5.542 0.042 16 0 "[ . 1 . 2]" 1 870 1 103 GLU QG 1 115 VAL QG 3.150 . 4.500 2.862 2.030 4.205 . 0 0 "[ . 1 . 2]" 1 871 1 103 GLU QG 1 118 LEU MD1 3.150 . 4.500 3.732 2.118 4.652 0.152 10 0 "[ . 1 . 2]" 1 872 1 104 GLY H 1 104 GLY QA 2.650 . 3.500 2.201 2.198 2.206 . 0 0 "[ . 1 . 2]" 1 873 1 104 GLY H 1 105 HIS H 2.650 . 3.500 2.699 2.627 2.846 . 0 0 "[ . 1 . 2]" 1 874 1 104 GLY QA 1 105 HIS H 3.150 . 4.500 2.698 2.593 2.739 . 0 0 "[ . 1 . 2]" 1 875 1 104 GLY QA 1 107 ALA H 3.650 . 5.500 3.466 3.266 3.756 . 0 0 "[ . 1 . 2]" 1 876 1 105 HIS H 1 105 HIS HA 2.650 . 3.500 2.821 2.797 2.861 . 0 0 "[ . 1 . 2]" 1 877 1 105 HIS H 1 105 HIS QB 2.300 . 2.800 2.230 2.075 2.260 . 0 0 "[ . 1 . 2]" 1 878 1 105 HIS H 1 106 LEU H 2.650 . 3.500 2.708 2.482 2.840 . 0 0 "[ . 1 . 2]" 1 879 1 105 HIS H 1 106 LEU QB 3.650 . 5.500 4.646 4.243 4.928 . 0 0 "[ . 1 . 2]" 1 880 1 105 HIS H 1 106 LEU QD 3.650 . 5.500 4.805 4.611 5.495 . 0 0 "[ . 1 . 2]" 1 881 1 105 HIS HA 1 106 LEU H 3.150 . 4.500 3.552 3.502 3.577 . 0 0 "[ . 1 . 2]" 1 882 1 105 HIS HE1 1 106 LEU QD 3.150 . 4.500 4.229 3.420 4.607 0.107 16 0 "[ . 1 . 2]" 1 883 1 105 HIS HE1 1 109 LEU QD 3.150 . 4.500 2.654 2.095 3.414 . 0 0 "[ . 1 . 2]" 1 884 1 106 LEU H 1 106 LEU HA 2.650 . 3.500 2.820 2.773 2.845 . 0 0 "[ . 1 . 2]" 1 885 1 106 LEU H 1 106 LEU QB 2.650 . 3.500 2.398 2.205 2.543 . 0 0 "[ . 1 . 2]" 1 886 1 106 LEU H 1 107 ALA H 3.150 . 4.500 2.689 2.621 2.893 . 0 0 "[ . 1 . 2]" 1 887 1 106 LEU HA 1 111 LEU MD1 3.150 . 4.500 3.206 2.343 4.196 . 0 0 "[ . 1 . 2]" 1 888 1 106 LEU QB 1 107 ALA H 3.150 . 4.500 2.501 2.232 2.578 . 0 0 "[ . 1 . 2]" 1 889 1 106 LEU QB 1 111 LEU MD1 3.150 . 4.500 3.755 2.960 4.569 0.069 14 0 "[ . 1 . 2]" 1 890 1 106 LEU QB 1 115 VAL MG1 3.150 . 4.500 3.196 2.845 3.568 . 0 0 "[ . 1 . 2]" 1 891 1 106 LEU QB 1 115 VAL MG2 2.650 . 3.500 2.871 2.121 3.543 0.043 3 0 "[ . 1 . 2]" 1 892 1 106 LEU QD 1 114 LEU QD 3.150 . 4.500 2.204 1.837 3.017 . 0 0 "[ . 1 . 2]" 1 893 1 106 LEU MD1 1 114 LEU HA 3.150 . 4.500 4.435 4.105 4.608 0.108 6 0 "[ . 1 . 2]" 1 894 1 106 LEU MD1 1 114 LEU QB 3.150 . 4.500 2.161 2.033 2.510 . 0 0 "[ . 1 . 2]" 1 895 1 106 LEU MD1 1 115 VAL HA 3.150 . 4.500 4.034 2.956 4.686 0.186 16 0 "[ . 1 . 2]" 1 896 1 107 ALA H 1 107 ALA HA 2.650 . 3.500 2.829 2.799 2.891 . 0 0 "[ . 1 . 2]" 1 897 1 107 ALA H 1 107 ALA MB 3.150 . 4.500 2.221 2.189 2.261 . 0 0 "[ . 1 . 2]" 1 898 1 107 ALA H 1 108 GLY H 3.150 . 4.500 2.625 2.381 2.769 . 0 0 "[ . 1 . 2]" 1 899 1 107 ALA H 1 115 VAL QG 3.650 . 5.500 3.733 3.259 4.079 . 0 0 "[ . 1 . 2]" 1 900 1 107 ALA HA 1 115 VAL QG 2.650 . 3.500 3.207 2.751 3.574 0.074 16 0 "[ . 1 . 2]" 1 901 1 107 ALA MB 1 108 GLY H 3.650 . 5.500 2.619 2.427 2.834 . 0 0 "[ . 1 . 2]" 1 902 1 107 ALA MB 1 112 PHE QE 3.150 . 4.500 4.191 3.120 4.586 0.086 13 0 "[ . 1 . 2]" 1 903 1 107 ALA MB 1 115 VAL MG1 3.150 . 4.500 4.125 3.704 4.464 . 0 0 "[ . 1 . 2]" 1 904 1 107 ALA MB 1 115 VAL QG 2.650 . 3.500 2.950 2.625 3.351 . 0 0 "[ . 1 . 2]" 1 905 1 107 ALA MB 1 115 VAL MG2 2.650 . 3.500 3.027 2.672 3.463 . 0 0 "[ . 1 . 2]" 1 906 1 108 GLY H 1 108 GLY QA 2.650 . 3.500 2.201 2.194 2.206 . 0 0 "[ . 1 . 2]" 1 907 1 108 GLY H 1 109 LEU H 3.150 . 4.500 2.700 2.591 2.811 . 0 0 "[ . 1 . 2]" 1 908 1 108 GLY H 1 109 LEU QB 3.650 . 5.500 4.605 4.284 4.828 . 0 0 "[ . 1 . 2]" 1 909 1 108 GLY QA 1 109 LEU QD 3.650 . 5.500 4.006 2.953 5.091 . 0 0 "[ . 1 . 2]" 1 910 1 109 LEU H 1 109 LEU QB 3.150 . 4.500 2.271 2.064 2.391 . 0 0 "[ . 1 . 2]" 1 911 1 109 LEU H 1 110 GLY H 3.150 . 4.500 2.511 2.353 2.797 . 0 0 "[ . 1 . 2]" 1 912 1 109 LEU MD1 1 111 LEU MD1 2.650 . 3.500 2.790 2.133 3.645 0.145 3 0 "[ . 1 . 2]" 1 913 1 111 LEU H 1 111 LEU QB 3.150 . 4.500 2.457 2.214 3.147 . 0 0 "[ . 1 . 2]" 1 914 1 111 LEU HA 1 112 PHE H 2.650 . 3.500 2.326 2.146 2.610 . 0 0 "[ . 1 . 2]" 1 915 1 112 PHE H 1 112 PHE QB 3.150 . 4.500 2.468 2.107 2.691 . 0 0 "[ . 1 . 2]" 1 916 1 112 PHE HA 1 114 LEU H 3.650 . 5.500 4.340 4.023 4.486 . 0 0 "[ . 1 . 2]" 1 917 1 112 PHE HA 1 115 VAL HB 2.650 . 3.500 2.530 2.302 3.292 . 0 0 "[ . 1 . 2]" 1 918 1 112 PHE HA 1 115 VAL MG1 3.150 . 4.500 3.824 3.624 4.251 . 0 0 "[ . 1 . 2]" 1 919 1 112 PHE HA 1 115 VAL MG2 2.650 . 3.500 2.412 2.169 2.814 . 0 0 "[ . 1 . 2]" 1 920 1 112 PHE QB 1 115 VAL H 3.650 . 5.500 4.640 4.450 4.800 . 0 0 "[ . 1 . 2]" 1 921 1 112 PHE QB 1 115 VAL HB 3.150 . 4.500 3.697 3.162 4.576 0.076 16 0 "[ . 1 . 2]" 1 922 1 112 PHE QB 1 115 VAL QG 3.150 . 4.500 3.777 3.336 4.078 . 0 0 "[ . 1 . 2]" 1 923 1 112 PHE QD 1 115 VAL MG1 3.150 . 4.500 3.772 3.170 4.407 . 0 0 "[ . 1 . 2]" 1 924 1 112 PHE QD 1 115 VAL MG2 3.150 . 4.500 3.390 3.011 3.997 . 0 0 "[ . 1 . 2]" 1 925 1 113 ARG HA 1 116 ARG H 2.650 . 3.500 3.596 3.507 3.757 0.257 18 0 "[ . 1 . 2]" 1 926 1 114 LEU H 1 114 LEU QB 2.650 . 3.500 2.339 2.096 2.557 . 0 0 "[ . 1 . 2]" 1 927 1 114 LEU H 1 115 VAL H 2.650 . 3.500 2.580 2.310 2.637 . 0 0 "[ . 1 . 2]" 1 928 1 114 LEU QB 1 115 VAL H 3.150 . 4.500 2.704 2.602 2.971 . 0 0 "[ . 1 . 2]" 1 929 1 114 LEU QB 1 115 VAL MG2 3.150 . 4.500 3.270 3.060 3.601 . 0 0 "[ . 1 . 2]" 1 930 1 114 LEU HG 1 115 VAL H 3.650 . 5.500 4.663 4.025 5.192 . 0 0 "[ . 1 . 2]" 1 931 1 115 VAL H 1 115 VAL HA 2.650 . 3.500 2.811 2.786 2.829 . 0 0 "[ . 1 . 2]" 1 932 1 115 VAL H 1 115 VAL HB 2.650 . 3.500 2.497 2.383 2.591 . 0 0 "[ . 1 . 2]" 1 933 1 115 VAL HA 1 116 ARG H 3.150 . 4.500 3.543 3.504 3.566 . 0 0 "[ . 1 . 2]" 1 934 1 115 VAL HB 1 116 ARG H 2.650 . 3.500 2.644 2.499 2.842 . 0 0 "[ . 1 . 2]" 1 935 1 115 VAL MG1 1 116 ARG H 3.150 . 4.500 3.437 3.258 3.685 . 0 0 "[ . 1 . 2]" 1 936 1 115 VAL MG1 1 116 ARG HA 3.150 . 4.500 3.463 3.267 3.683 . 0 0 "[ . 1 . 2]" 1 937 1 115 VAL MG1 1 116 ARG QB 3.650 . 5.500 4.520 4.081 4.970 . 0 0 "[ . 1 . 2]" 1 938 1 115 VAL MG1 1 116 ARG QD 3.150 . 4.500 3.948 2.580 4.577 0.077 5 0 "[ . 1 . 2]" 1 939 1 115 VAL MG1 1 119 ARG H 3.150 . 4.500 3.832 3.525 4.105 . 0 0 "[ . 1 . 2]" 1 940 1 115 VAL MG2 1 116 ARG H 3.650 . 5.500 3.867 3.750 4.015 . 0 0 "[ . 1 . 2]" 1 941 1 116 ARG H 1 116 ARG HA 2.300 . 2.800 2.802 2.780 2.825 0.025 7 0 "[ . 1 . 2]" 1 942 1 116 ARG H 1 116 ARG QB 2.300 . 2.800 2.280 2.086 2.503 . 0 0 "[ . 1 . 2]" 1 943 1 116 ARG H 1 117 LEU H 2.300 . 2.800 2.758 2.687 2.825 0.025 9 0 "[ . 1 . 2]" 1 944 1 116 ARG H 1 119 ARG H 3.150 . 4.500 4.718 4.611 4.827 0.327 10 0 "[ . 1 . 2]" 1 945 1 116 ARG HA 1 117 LEU H 3.150 . 4.500 3.560 3.537 3.581 . 0 0 "[ . 1 . 2]" 1 946 1 116 ARG HA 1 117 LEU MD1 3.150 . 4.500 4.369 4.205 4.523 0.023 17 0 "[ . 1 . 2]" 1 947 1 116 ARG QB 1 117 LEU MD1 3.650 . 5.500 2.440 2.241 2.621 . 0 0 "[ . 1 . 2]" 1 948 1 117 LEU H 1 117 LEU HA 2.650 . 3.500 2.839 2.823 2.850 . 0 0 "[ . 1 . 2]" 1 949 1 117 LEU H 1 117 LEU QB 2.300 . 2.800 2.215 2.165 2.256 . 0 0 "[ . 1 . 2]" 1 950 1 117 LEU H 1 118 LEU H 2.650 . 3.500 2.616 2.543 2.670 . 0 0 "[ . 1 . 2]" 1 951 1 117 LEU H 1 119 ARG H 3.650 . 5.500 4.159 4.084 4.296 . 0 0 "[ . 1 . 2]" 1 952 1 117 LEU HA 1 118 LEU H 3.150 . 4.500 3.529 3.509 3.547 . 0 0 "[ . 1 . 2]" 1 953 1 117 LEU HA 1 120 PHE H 2.650 . 3.500 3.395 3.291 3.561 0.061 11 0 "[ . 1 . 2]" 1 954 1 117 LEU HA 1 120 PHE QB 2.650 . 3.500 2.596 2.359 2.967 . 0 0 "[ . 1 . 2]" 1 955 1 117 LEU QD 1 118 LEU H 3.150 . 4.500 3.660 3.573 3.748 . 0 0 "[ . 1 . 2]" 1 956 1 117 LEU QD 1 120 PHE QB 3.150 . 4.500 3.960 3.675 4.411 . 0 0 "[ . 1 . 2]" 1 957 1 117 LEU MD1 1 119 ARG H 3.650 . 5.500 4.953 4.775 5.119 . 0 0 "[ . 1 . 2]" 1 958 1 117 LEU MD1 1 120 PHE QD 3.150 . 4.500 4.350 3.859 4.845 0.345 13 0 "[ . 1 . 2]" 1 959 1 118 LEU H 1 118 LEU HA 2.650 . 3.500 2.817 2.802 2.834 . 0 0 "[ . 1 . 2]" 1 960 1 118 LEU H 1 118 LEU QB 2.650 . 3.500 2.192 2.062 2.255 . 0 0 "[ . 1 . 2]" 1 961 1 118 LEU H 1 119 ARG H 3.150 . 4.500 2.685 2.622 2.734 . 0 0 "[ . 1 . 2]" 1 962 1 118 LEU HA 1 121 LEU H 2.650 . 3.500 3.436 3.277 3.717 0.217 18 0 "[ . 1 . 2]" 1 963 1 118 LEU HA 1 121 LEU MD2 3.150 . 4.500 3.719 2.562 4.783 0.283 4 0 "[ . 1 . 2]" 1 964 1 118 LEU QD 1 119 ARG HA 3.150 . 4.500 3.643 2.646 4.848 0.348 11 0 "[ . 1 . 2]" 1 965 1 119 ARG H 1 119 ARG QB 2.650 . 3.500 2.254 2.144 2.405 . 0 0 "[ . 1 . 2]" 1 966 1 119 ARG HA 1 120 PHE H 3.150 . 4.500 3.539 3.463 3.565 . 0 0 "[ . 1 . 2]" 1 967 1 119 ARG QB 1 120 PHE QD 3.650 . 5.500 4.788 3.909 5.604 0.104 16 0 "[ . 1 . 2]" 1 968 1 120 PHE H 1 120 PHE HA 2.650 . 3.500 2.813 2.776 2.861 . 0 0 "[ . 1 . 2]" 1 969 1 120 PHE H 1 120 PHE QB 2.650 . 3.500 2.104 2.049 2.250 . 0 0 "[ . 1 . 2]" 1 970 1 120 PHE HA 1 123 ILE H 3.650 . 5.500 3.492 3.316 3.618 . 0 0 "[ . 1 . 2]" 1 971 1 120 PHE HA 1 123 ILE HB 2.650 . 3.500 3.255 2.749 3.836 0.336 2 0 "[ . 1 . 2]" 1 972 1 120 PHE HA 1 123 ILE MD 3.650 . 5.500 3.278 2.268 4.909 . 0 0 "[ . 1 . 2]" 1 973 1 120 PHE QB 1 121 LEU H 3.650 . 5.500 2.701 2.440 2.993 . 0 0 "[ . 1 . 2]" 1 974 1 120 PHE QD 1 123 ILE MG 3.150 . 4.500 4.137 2.608 4.582 0.082 11 0 "[ . 1 . 2]" 1 975 1 120 PHE QD 1 124 LEU QD 3.150 . 4.500 3.217 2.128 4.321 . 0 0 "[ . 1 . 2]" 1 976 1 120 PHE QE 1 124 LEU QD 3.150 . 4.500 3.589 2.218 4.597 0.097 19 0 "[ . 1 . 2]" 1 977 1 121 LEU H 1 121 LEU HA 2.650 . 3.500 2.810 2.790 2.861 . 0 0 "[ . 1 . 2]" 1 978 1 121 LEU H 1 121 LEU QB 2.300 . 2.800 2.222 2.052 2.357 . 0 0 "[ . 1 . 2]" 1 979 1 121 LEU H 1 122 ARG H 3.150 . 4.500 2.680 2.489 2.813 . 0 0 "[ . 1 . 2]" 1 980 1 121 LEU H 1 122 ARG QB 3.650 . 5.500 4.476 4.206 4.984 . 0 0 "[ . 1 . 2]" 1 981 1 121 LEU QB 1 122 ARG H 2.300 . 2.800 2.640 2.410 2.746 . 0 0 "[ . 1 . 2]" 1 982 1 122 ARG H 1 122 ARG QB 3.650 . 5.500 2.257 2.083 2.464 . 0 0 "[ . 1 . 2]" 1 983 1 122 ARG H 1 123 ILE H 2.650 . 3.500 2.754 2.657 2.859 . 0 0 "[ . 1 . 2]" 1 984 1 122 ARG HA 1 123 ILE H 3.150 . 4.500 3.552 3.503 3.575 . 0 0 "[ . 1 . 2]" 1 985 1 123 ILE H 1 123 ILE HA 2.650 . 3.500 2.831 2.805 2.856 . 0 0 "[ . 1 . 2]" 1 986 1 124 LEU H 1 124 LEU HA 2.650 . 3.500 2.827 2.788 2.862 . 0 0 "[ . 1 . 2]" 1 987 1 124 LEU H 1 125 LEU H 2.650 . 3.500 2.612 2.491 2.689 . 0 0 "[ . 1 . 2]" 1 988 1 124 LEU H 1 126 ILE H 3.150 . 4.500 4.259 4.110 4.474 . 0 0 "[ . 1 . 2]" 1 989 1 124 LEU HA 1 127 ILE H 3.150 . 4.500 3.425 3.264 3.715 . 0 0 "[ . 1 . 2]" 1 990 1 125 LEU HA 1 126 ILE H 3.150 . 4.500 3.530 3.435 3.580 . 0 0 "[ . 1 . 2]" 1 991 1 125 LEU QB 1 126 ILE H 2.650 . 3.500 2.642 2.409 3.118 . 0 0 "[ . 1 . 2]" 1 992 1 125 LEU QD 1 129 ARG QD 3.150 . 4.500 3.608 2.355 4.763 0.263 16 0 "[ . 1 . 2]" 1 993 1 126 ILE H 1 126 ILE HB 2.650 . 3.500 2.500 2.062 3.576 0.076 12 0 "[ . 1 . 2]" 1 994 1 126 ILE HB 1 127 ILE H 2.650 . 3.500 2.871 2.461 3.831 0.331 4 0 "[ . 1 . 2]" 1 995 1 127 ILE H 1 127 ILE HB 2.300 . 2.800 2.462 2.296 2.697 . 0 0 "[ . 1 . 2]" 1 996 1 127 ILE H 1 128 SER H 3.150 . 4.500 2.730 2.642 2.848 . 0 0 "[ . 1 . 2]" 1 997 1 127 ILE HA 1 128 SER H 3.150 . 4.500 3.557 3.488 3.583 . 0 0 "[ . 1 . 2]" 1 998 1 127 ILE HB 1 128 SER H 3.150 . 4.500 2.699 2.366 4.003 . 0 0 "[ . 1 . 2]" 1 999 1 127 ILE MG 1 128 SER H 3.650 . 5.500 3.158 1.749 3.554 0.051 11 0 "[ . 1 . 2]" 1 1000 1 127 ILE MG 1 128 SER HA 3.150 . 4.500 3.340 3.082 3.644 . 0 0 "[ . 1 . 2]" 1 1001 1 127 ILE MG 1 128 SER QB 3.150 . 4.500 4.172 2.665 4.600 0.100 20 0 "[ . 1 . 2]" 1 1002 1 128 SER H 1 128 SER QB 3.150 . 4.500 2.363 2.187 2.585 . 0 0 "[ . 1 . 2]" 1 1003 1 130 GLY H 1 131 SER H 3.150 . 4.500 2.701 2.619 2.768 . 0 0 "[ . 1 . 2]" 1 1004 1 130 GLY QA 1 131 SER H 3.650 . 5.500 2.793 2.727 2.848 . 0 0 "[ . 1 . 2]" 1 1005 1 130 GLY QA 1 133 PHE H 3.650 . 5.500 3.223 3.050 3.401 . 0 0 "[ . 1 . 2]" 1 1006 1 131 SER H 1 131 SER HA 2.650 . 3.500 2.802 2.754 2.835 . 0 0 "[ . 1 . 2]" 1 1007 1 131 SER H 1 131 SER QB 3.650 . 5.500 2.395 2.192 2.602 . 0 0 "[ . 1 . 2]" 1 1008 1 131 SER H 1 132 LYS H 3.650 . 5.500 2.740 2.645 2.971 . 0 0 "[ . 1 . 2]" 1 1009 1 131 SER HA 1 134 LEU H 3.150 . 4.500 3.693 3.409 4.296 . 0 0 "[ . 1 . 2]" 1 1010 1 131 SER HA 1 134 LEU QB 3.150 . 4.500 3.042 2.395 4.747 0.247 12 0 "[ . 1 . 2]" 1 1011 1 131 SER HA 1 134 LEU MD1 2.650 . 3.500 2.912 2.317 3.640 0.140 7 0 "[ . 1 . 2]" 1 1012 1 131 SER QB 1 132 LYS H 2.650 . 3.500 2.819 2.398 3.412 . 0 0 "[ . 1 . 2]" 1 1013 1 131 SER QB 1 133 PHE H 3.650 . 5.500 4.853 4.355 5.355 . 0 0 "[ . 1 . 2]" 1 1014 1 132 LYS H 1 132 LYS HA 2.650 . 3.500 2.831 2.808 2.882 . 0 0 "[ . 1 . 2]" 1 1015 1 132 LYS H 1 132 LYS QB 3.150 . 4.500 2.374 2.139 2.799 . 0 0 "[ . 1 . 2]" 1 1016 1 132 LYS H 1 133 PHE H 3.150 . 4.500 2.631 2.422 2.770 . 0 0 "[ . 1 . 2]" 1 1017 1 132 LYS H 1 135 SER H 3.150 . 4.500 4.683 4.534 4.835 0.335 12 0 "[ . 1 . 2]" 1 1018 1 132 LYS HA 1 133 PHE H 3.150 . 4.500 3.542 3.470 3.574 . 0 0 "[ . 1 . 2]" 1 1019 1 132 LYS QB 1 133 PHE H 3.650 . 5.500 2.596 2.238 3.539 . 0 0 "[ . 1 . 2]" 1 1020 1 133 PHE H 1 133 PHE HA 2.650 . 3.500 2.817 2.788 2.837 . 0 0 "[ . 1 . 2]" 1 1021 1 133 PHE H 1 133 PHE QB 2.650 . 3.500 2.224 2.147 2.267 . 0 0 "[ . 1 . 2]" 1 1022 1 133 PHE HA 1 136 ALA MB 3.150 . 4.500 2.837 2.532 3.206 . 0 0 "[ . 1 . 2]" 1 1023 1 133 PHE HA 1 137 ILE MD 3.150 . 4.500 4.102 3.351 4.732 0.232 19 0 "[ . 1 . 2]" 1 1024 1 133 PHE QD 1 134 LEU QD 2.650 . 3.500 2.878 2.239 3.663 0.163 13 0 "[ . 1 . 2]" 1 1025 1 133 PHE QE 1 134 LEU QD 3.150 . 4.500 3.505 2.605 4.721 0.221 12 0 "[ . 1 . 2]" 1 1026 1 133 PHE QE 1 137 ILE MD 2.650 . 3.500 2.621 2.218 3.384 . 0 0 "[ . 1 . 2]" 1 1027 1 134 LEU H 1 134 LEU QB 2.650 . 3.500 2.330 2.053 2.588 . 0 0 "[ . 1 . 2]" 1 1028 1 134 LEU H 1 135 SER H 3.150 . 4.500 2.699 2.644 2.805 . 0 0 "[ . 1 . 2]" 1 1029 1 134 LEU HA 1 137 ILE QG 3.150 . 4.500 4.121 3.298 4.675 0.175 11 0 "[ . 1 . 2]" 1 1030 1 134 LEU HA 1 137 ILE MG 3.650 . 5.500 4.039 2.145 4.862 . 0 0 "[ . 1 . 2]" 1 1031 1 134 LEU QB 1 135 SER H 3.150 . 4.500 2.656 2.446 3.477 . 0 0 "[ . 1 . 2]" 1 1032 1 134 LEU MD1 1 135 SER H 3.650 . 5.500 4.154 2.595 4.778 . 0 0 "[ . 1 . 2]" 1 1033 1 135 SER H 1 135 SER HA 2.650 . 3.500 2.820 2.793 2.843 . 0 0 "[ . 1 . 2]" 1 1034 1 135 SER H 1 135 SER QB 3.150 . 4.500 2.370 2.188 2.531 . 0 0 "[ . 1 . 2]" 1 1035 1 135 SER H 1 136 ALA H 3.150 . 4.500 2.708 2.627 2.772 . 0 0 "[ . 1 . 2]" 1 1036 1 135 SER HA 1 138 ALA MB 2.650 . 3.500 2.488 2.292 2.747 . 0 0 "[ . 1 . 2]" 1 1037 1 135 SER QB 1 136 ALA H 3.650 . 5.500 2.869 2.354 3.521 . 0 0 "[ . 1 . 2]" 1 1038 1 135 SER QB 1 136 ALA HA 3.150 . 4.500 4.161 3.831 4.491 . 0 0 "[ . 1 . 2]" 1 1039 1 135 SER QB 1 138 ALA MB 3.650 . 5.500 4.071 3.711 4.354 . 0 0 "[ . 1 . 2]" 1 1040 1 136 ALA H 1 137 ILE H 2.650 . 3.500 2.785 2.645 2.945 . 0 0 "[ . 1 . 2]" 1 1041 1 136 ALA HA 1 137 ILE H 3.150 . 4.500 3.569 3.555 3.587 . 0 0 "[ . 1 . 2]" 1 1042 1 136 ALA HA 1 139 ASP H 3.150 . 4.500 3.819 3.644 4.058 . 0 0 "[ . 1 . 2]" 1 1043 1 136 ALA HA 1 139 ASP QB 2.650 . 3.500 3.210 2.719 3.658 0.158 13 0 "[ . 1 . 2]" 1 1044 1 136 ALA MB 1 137 ILE H 3.150 . 4.500 2.321 2.112 2.468 . 0 0 "[ . 1 . 2]" 1 1045 1 136 ALA MB 1 137 ILE MD 3.150 . 4.500 2.867 2.141 4.024 . 0 0 "[ . 1 . 2]" 1 1046 1 137 ILE H 1 137 ILE HA 2.650 . 3.500 2.834 2.820 2.850 . 0 0 "[ . 1 . 2]" 1 1047 1 137 ILE H 1 137 ILE HB 2.650 . 3.500 2.360 2.202 2.601 . 0 0 "[ . 1 . 2]" 1 1048 1 137 ILE H 1 138 ALA H 2.650 . 3.500 2.649 2.548 2.693 . 0 0 "[ . 1 . 2]" 1 1049 1 137 ILE HA 1 140 ALA H 2.650 . 3.500 3.407 3.123 3.589 0.089 11 0 "[ . 1 . 2]" 1 1050 1 137 ILE HA 1 140 ALA MB 3.150 . 4.500 2.505 2.275 3.007 . 0 0 "[ . 1 . 2]" 1 1051 1 137 ILE HB 1 138 ALA H 3.650 . 5.500 2.769 2.517 3.742 . 0 0 "[ . 1 . 2]" 1 1052 1 137 ILE QG 1 141 ALA MB 3.650 . 5.500 4.845 2.933 5.582 0.082 20 0 "[ . 1 . 2]" 1 1053 1 137 ILE MG 1 138 ALA HA 3.150 . 4.500 3.254 2.923 3.807 . 0 0 "[ . 1 . 2]" 1 1054 1 137 ILE MG 1 140 ALA MB 3.650 . 5.500 3.641 3.236 4.549 . 0 0 "[ . 1 . 2]" 1 1055 1 137 ILE MG 1 141 ALA MB 3.150 . 4.500 2.726 2.290 3.405 . 0 0 "[ . 1 . 2]" 1 1056 1 138 ALA H 1 138 ALA HA 2.650 . 3.500 2.780 2.741 2.830 . 0 0 "[ . 1 . 2]" 1 1057 1 138 ALA H 1 138 ALA MB 2.650 . 3.500 2.219 2.133 2.236 . 0 0 "[ . 1 . 2]" 1 1058 1 138 ALA H 1 139 ASP H 2.650 . 3.500 2.829 2.657 2.934 . 0 0 "[ . 1 . 2]" 1 1059 1 138 ALA HA 1 139 ASP H 2.650 . 3.500 3.554 3.486 3.572 0.072 17 0 "[ . 1 . 2]" 1 1060 1 138 ALA MB 1 139 ASP H 2.650 . 3.500 2.415 2.226 2.793 . 0 0 "[ . 1 . 2]" 1 1061 1 138 ALA MB 1 139 ASP QB 3.650 . 5.500 3.923 3.609 4.224 . 0 0 "[ . 1 . 2]" 1 1062 1 139 ASP H 1 139 ASP HA 2.300 . 2.800 2.830 2.808 2.869 0.069 3 0 "[ . 1 . 2]" 1 1063 1 139 ASP H 1 139 ASP QB 2.650 . 3.500 2.280 2.226 2.355 . 0 0 "[ . 1 . 2]" 1 1064 1 139 ASP H 1 141 ALA H 3.650 . 5.500 4.060 3.605 4.245 . 0 0 "[ . 1 . 2]" 1 1065 1 139 ASP HA 1 140 ALA H 2.650 . 3.500 3.550 3.522 3.565 0.065 13 0 "[ . 1 . 2]" 1 1066 1 139 ASP HA 1 141 ALA H 3.150 . 4.500 4.447 4.114 4.607 0.107 11 0 "[ . 1 . 2]" 1 1067 1 139 ASP HA 1 143 LYS QG 3.650 . 5.500 4.908 3.882 5.768 0.268 10 0 "[ . 1 . 2]" 1 1068 1 139 ASP QB 1 140 ALA H 2.650 . 3.500 2.479 2.256 2.658 . 0 0 "[ . 1 . 2]" 1 1069 1 139 ASP QB 1 140 ALA MB 3.650 . 5.500 3.763 3.636 3.861 . 0 0 "[ . 1 . 2]" 1 1070 1 140 ALA H 1 140 ALA HA 2.650 . 3.500 2.835 2.807 2.907 . 0 0 "[ . 1 . 2]" 1 1071 1 140 ALA H 1 140 ALA MB 2.650 . 3.500 2.227 2.209 2.243 . 0 0 "[ . 1 . 2]" 1 1072 1 140 ALA H 1 141 ALA H 2.650 . 3.500 2.636 2.346 2.741 . 0 0 "[ . 1 . 2]" 1 1073 1 140 ALA HA 1 143 LYS H 2.650 . 3.500 3.431 3.073 3.664 0.164 10 0 "[ . 1 . 2]" 1 1074 1 140 ALA HA 1 143 LYS QB 3.150 . 4.500 3.012 2.483 4.492 . 0 0 "[ . 1 . 2]" 1 1075 1 140 ALA MB 1 144 LEU QD 3.150 . 4.500 2.645 2.197 3.617 . 0 0 "[ . 1 . 2]" 1 1076 1 141 ALA H 1 141 ALA HA 2.300 . 2.800 2.804 2.747 2.861 0.061 10 0 "[ . 1 . 2]" 1 1077 1 141 ALA H 1 141 ALA MB 2.650 . 3.500 2.218 2.184 2.234 . 0 0 "[ . 1 . 2]" 1 1078 1 141 ALA H 1 142 ASP H 2.650 . 3.500 2.696 2.577 2.853 . 0 0 "[ . 1 . 2]" 1 1079 1 141 ALA H 1 142 ASP QB 3.650 . 5.500 4.535 4.354 4.856 . 0 0 "[ . 1 . 2]" 1 1080 1 141 ALA H 1 144 LEU H 3.150 . 4.500 4.515 4.258 4.641 0.141 13 0 "[ . 1 . 2]" 1 1081 1 141 ALA H 1 144 LEU QD 3.150 . 4.500 4.354 3.611 4.768 0.268 4 0 "[ . 1 . 2]" 1 1082 1 141 ALA HA 1 143 LYS H 3.650 . 5.500 4.377 3.896 4.769 . 0 0 "[ . 1 . 2]" 1 1083 1 141 ALA HA 1 144 LEU QB 2.650 . 3.500 2.476 2.168 3.196 . 0 0 "[ . 1 . 2]" 1 1084 1 141 ALA HA 1 144 LEU QD 3.150 . 4.500 3.331 2.674 4.106 . 0 0 "[ . 1 . 2]" 1 1085 1 141 ALA HA 1 145 VAL H 2.650 . 3.500 3.186 2.451 3.789 0.289 12 0 "[ . 1 . 2]" 1 1086 1 141 ALA HA 1 145 VAL QG 3.150 . 4.500 4.111 2.878 4.882 0.382 10 0 "[ . 1 . 2]" 1 1087 1 141 ALA MB 1 142 ASP H 2.650 . 3.500 2.574 2.400 2.843 . 0 0 "[ . 1 . 2]" 1 1088 1 141 ALA MB 1 142 ASP HA 3.150 . 4.500 3.807 3.745 3.872 . 0 0 "[ . 1 . 2]" 1 1089 1 141 ALA MB 1 142 ASP QB 3.650 . 5.500 4.026 3.735 4.394 . 0 0 "[ . 1 . 2]" 1 1090 1 141 ALA MB 1 145 VAL H 3.650 . 5.500 4.068 3.602 4.480 . 0 0 "[ . 1 . 2]" 1 1091 1 141 ALA MB 1 145 VAL MG1 3.650 . 5.500 4.779 3.342 5.418 . 0 0 "[ . 1 . 2]" 1 1092 1 142 ASP H 1 143 LYS H 2.300 . 2.800 2.669 2.536 2.805 0.005 5 0 "[ . 1 . 2]" 1 1093 1 142 ASP H 1 145 VAL MG1 3.650 . 5.500 4.472 3.110 5.510 0.010 4 0 "[ . 1 . 2]" 1 1094 1 142 ASP HA 1 143 LYS H 2.650 . 3.500 3.530 3.493 3.559 0.059 5 0 "[ . 1 . 2]" 1 1095 1 142 ASP HA 1 144 LEU H 3.150 . 4.500 4.550 4.240 4.714 0.214 11 0 "[ . 1 . 2]" 1 1096 1 142 ASP HA 1 145 VAL QG 3.650 . 5.500 3.442 2.480 5.315 . 0 0 "[ . 1 . 2]" 1 1097 1 142 ASP QB 1 143 LYS H 2.650 . 3.500 2.599 2.318 3.527 0.027 15 0 "[ . 1 . 2]" 1 1098 1 143 LYS H 1 143 LYS HA 2.300 . 2.800 2.884 2.841 2.959 0.159 15 0 "[ . 1 . 2]" 1 1099 1 143 LYS H 1 143 LYS QB 2.650 . 3.500 2.382 2.117 2.892 . 0 0 "[ . 1 . 2]" 1 1100 1 143 LYS QB 1 144 LEU H 2.650 . 3.500 2.730 2.508 3.683 0.183 15 0 "[ . 1 . 2]" 1 1101 1 144 LEU H 1 144 LEU HA 2.300 . 2.800 2.866 2.793 2.940 0.140 15 0 "[ . 1 . 2]" 1 1102 1 144 LEU H 1 144 LEU QB 2.650 . 3.500 2.255 2.079 2.528 . 0 0 "[ . 1 . 2]" 1 1103 1 144 LEU H 1 145 VAL H 2.300 . 2.800 2.641 2.225 2.872 0.072 7 0 "[ . 1 . 2]" 1 1104 1 144 LEU QB 1 145 VAL H 2.650 . 3.500 2.485 2.098 3.534 0.034 15 0 "[ . 1 . 2]" 1 1105 1 144 LEU QB 1 145 VAL QG 2.650 . 3.500 3.460 2.368 3.970 0.470 17 0 "[ . 1 . 2]" 1 1106 1 144 LEU QD 1 145 VAL H 3.650 . 5.500 3.837 3.358 4.483 . 0 0 "[ . 1 . 2]" 1 1107 1 145 VAL H 1 145 VAL HA 2.300 . 2.800 2.479 2.248 2.965 0.165 12 0 "[ . 1 . 2]" 1 1108 1 145 VAL H 1 145 VAL HB 2.650 . 3.500 3.404 2.494 3.915 0.415 15 0 "[ . 1 . 2]" 1 1109 1 145 VAL H 1 146 PRO QD 3.150 . 4.500 3.217 2.211 4.272 . 0 0 "[ . 1 . 2]" 1 1110 1 145 VAL HA 1 146 PRO QD 2.300 . 2.800 2.150 2.034 2.271 . 0 0 "[ . 1 . 2]" 1 1111 1 145 VAL MG1 1 147 ARG H 3.650 . 5.500 4.786 3.266 5.677 0.177 9 0 "[ . 1 . 2]" 1 1112 1 146 PRO HA 1 147 ARG H 2.650 . 3.500 2.901 2.146 3.583 0.083 15 0 "[ . 1 . 2]" 1 1113 1 146 PRO QB 1 147 ARG H 3.150 . 4.500 3.015 1.741 3.943 0.059 18 0 "[ . 1 . 2]" 1 1114 1 147 ARG H 1 147 ARG HA 2.300 . 2.800 2.715 2.300 2.958 0.158 17 0 "[ . 1 . 2]" 1 1115 1 147 ARG H 1 147 ARG QB 2.650 . 3.500 2.830 2.268 3.333 . 0 0 "[ . 1 . 2]" 1 stop_ save_
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