NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
637932 | 6ivs | 36220 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_6ivs 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 1815 _Distance_constraint_stats_list.Viol_count 1285 _Distance_constraint_stats_list.Viol_total 628.156 _Distance_constraint_stats_list.Viol_max 0.140 _Distance_constraint_stats_list.Viol_rms 0.0062 _Distance_constraint_stats_list.Viol_average_all_restraints 0.0009 _Distance_constraint_stats_list.Viol_average_violations_only 0.0244 _Distance_constraint_stats_list.Cutoff_violation_report 0.500 _Distance_constraint_stats_list.Details ; Description of the tags in this list: * 1 * Administrative tag * 2 * Administrative tag * 3 * Administrative tag * 4 * ID of the restraint list. * 5 * Number of restraints in list. * 6 * Number of violated restraints (each model violation is used). * 7 * Sum of violations in Angstrom. * 8 * Maximum violation of a restraint without averaging in any way. * 9 * Rms of violations over all restraints. * 10 * Average violation over all restraints. * 11 * Average violation over violated restraints. This violation is averaged over only those models in which the restraint is violated. These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998). * 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table. * 13 * This tag Description of the tags in the per residue table below: * 1 * Chain identifier (can be absent if none defined) * 2 * Residue number * 3 * Residue name * 4 * Maximum violation in ensemble of models (without any averaging) * 5 * Model number with the maximum violation * 6 * Number of models with a violation above cutoff * 7 * List of models (1 character per model) with a violation above cutoff. An '*' marks a violation above the cutoff. A '+' indicates the largest violation above the cutoff and a '-' marks the smallest violation over cutoff. For models 5, 15, 25,... a ' ' is replaced by a '.'. For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1. * 8 * Administrative tag * 9 * Administrative tag Description of the tags in the per restraint table below: * 1 * Restraint ID within restraint list. First node, FIRST member, first atom's: * 2 * Chain identifier (can be absent if none defined) * 3 * Residue number * 4 * Residue name * 5 * Name of (pseudo-)atom First node, SECOND member, first atom's: * 6 * Chain identifier (can be absent if none defined) * 7 * Residue number * 8 * Residue name * 9 * Name of (pseudo-)atom FIRST node's: * 10 * Target distance value (Angstrom) * 11 * Lower bound distance (Angstrom) * 12 * Upper bound distance (Angstrom) * 13 * Average distance in ensemble of models * 14 * Minimum distance in ensemble of models * 15 * Maximum distance in ensemble of models * 16 * Maximum violation (without any averaging) * 17 * Model number with the maximum violation * 18 * Number of models with a violation above cutoff * 19 * List of models with a violation above cutoff. See description above. * 20 * Administrative tag * 21 * Administrative tag ; loop_ _Distance_constraint_stats_per_res.Atom_entity_assembly_ID _Distance_constraint_stats_per_res.Atom_comp_index_ID _Distance_constraint_stats_per_res.Atom_comp_ID _Distance_constraint_stats_per_res.Total_violation _Distance_constraint_stats_per_res.Max_violation _Distance_constraint_stats_per_res.Max_violation_model_number _Distance_constraint_stats_per_res.Over_cutoff_viol_count _Distance_constraint_stats_per_res.Over_cutoff_viol_per_model 1 2 MET 1.191 0.120 6 0 "[ . 1 . 2]" 1 3 ASN 1.453 0.117 20 0 "[ . 1 . 2]" 1 4 ARG 2.351 0.108 12 0 "[ . 1 . 2]" 1 5 LEU 2.102 0.064 18 0 "[ . 1 . 2]" 1 6 GLY 0.741 0.043 8 0 "[ . 1 . 2]" 1 7 ILE 2.151 0.099 11 0 "[ . 1 . 2]" 1 8 ILE 2.264 0.077 12 0 "[ . 1 . 2]" 1 9 TYR 1.216 0.051 17 0 "[ . 1 . 2]" 1 10 GLU 1.448 0.065 9 0 "[ . 1 . 2]" 1 11 ILE 1.397 0.103 8 0 "[ . 1 . 2]" 1 12 GLN 1.769 0.139 16 0 "[ . 1 . 2]" 1 13 GLY 0.008 0.008 10 0 "[ . 1 . 2]" 1 14 MET 0.043 0.027 17 0 "[ . 1 . 2]" 1 15 LYS 2.079 0.109 13 0 "[ . 1 . 2]" 1 16 ALA 0.819 0.053 9 0 "[ . 1 . 2]" 1 17 VAL 2.125 0.076 8 0 "[ . 1 . 2]" 1 18 VAL 0.743 0.069 10 0 "[ . 1 . 2]" 1 19 LEU 2.832 0.099 11 0 "[ . 1 . 2]" 1 20 THR 0.877 0.048 16 0 "[ . 1 . 2]" 1 21 SER 0.202 0.043 4 0 "[ . 1 . 2]" 1 22 GLU 0.776 0.066 15 0 "[ . 1 . 2]" 1 23 GLY 0.763 0.099 11 0 "[ . 1 . 2]" 1 24 GLU 0.298 0.048 16 0 "[ . 1 . 2]" 1 25 PHE 2.272 0.050 10 0 "[ . 1 . 2]" 1 26 LEU 1.271 0.120 5 0 "[ . 1 . 2]" 1 27 ILE 0.509 0.089 16 0 "[ . 1 . 2]" 1 28 ILE 0.989 0.045 10 0 "[ . 1 . 2]" 1 29 ARG 1.412 0.084 1 0 "[ . 1 . 2]" 1 30 ARG 2.496 0.109 3 0 "[ . 1 . 2]" 1 31 ARG 1.458 0.109 3 0 "[ . 1 . 2]" 1 32 LYS 0.140 0.064 4 0 "[ . 1 . 2]" 1 33 ASP 0.215 0.056 19 0 "[ . 1 . 2]" 1 34 MET 2.276 0.109 13 0 "[ . 1 . 2]" 1 35 LYS 2.682 0.125 19 0 "[ . 1 . 2]" 1 36 VAL 1.075 0.053 19 0 "[ . 1 . 2]" 1 37 GLY 0.234 0.023 14 0 "[ . 1 . 2]" 1 38 GLN 1.573 0.136 17 0 "[ . 1 . 2]" 1 39 GLN 0.333 0.077 12 0 "[ . 1 . 2]" 1 40 VAL 1.569 0.069 3 0 "[ . 1 . 2]" 1 41 SER 0.119 0.055 5 0 "[ . 1 . 2]" 1 42 PHE 1.898 0.110 4 0 "[ . 1 . 2]" 1 43 GLU 4.318 0.117 20 0 "[ . 1 . 2]" 1 44 ASN 1.759 0.120 6 0 "[ . 1 . 2]" 1 45 GLU 1.037 0.140 15 0 "[ . 1 . 2]" 1 46 ASP 2.213 0.108 12 0 "[ . 1 . 2]" 1 47 ILE 1.083 0.120 5 0 "[ . 1 . 2]" 1 48 TYR 1.792 0.084 1 0 "[ . 1 . 2]" 1 49 ASN 0.866 0.120 5 0 "[ . 1 . 2]" 1 50 VAL 0.386 0.082 15 0 "[ . 1 . 2]" 1 51 ARG 0.097 0.043 7 0 "[ . 1 . 2]" 1 52 GLY 0.000 0.000 . 0 "[ . 1 . 2]" 1 53 LYS 0.000 0.000 . 0 "[ . 1 . 2]" stop_ loop_ _Distance_constraint_stats.Restraint_ID _Distance_constraint_stats.Atom_1_entity_assembly_ID _Distance_constraint_stats.Atom_1_comp_index_ID _Distance_constraint_stats.Atom_1_comp_ID _Distance_constraint_stats.Atom_1_ID _Distance_constraint_stats.Atom_2_entity_assembly_ID _Distance_constraint_stats.Atom_2_comp_index_ID _Distance_constraint_stats.Atom_2_comp_ID _Distance_constraint_stats.Atom_2_ID _Distance_constraint_stats.Node_1_distance_val _Distance_constraint_stats.Node_1_distance_lower_bound_val _Distance_constraint_stats.Node_1_distance_upper_bound_val _Distance_constraint_stats.Distance_average _Distance_constraint_stats.Distance_minimum _Distance_constraint_stats.Distance_maximum _Distance_constraint_stats.Max_violation _Distance_constraint_stats.Max_violation_model_number _Distance_constraint_stats.Over_cutoff_violation_count _Distance_constraint_stats.Over_cutoff_viol_per_model _Distance_constraint_stats.Distance_constraint_stats_ID 1 1 9 TYR H 1 10 GLU H 2.650 . 2.800 2.259 2.204 2.354 . 0 0 "[ . 1 . 2]" 1 2 1 9 TYR H 1 18 VAL HA 3.150 . 4.500 2.703 2.577 2.802 . 0 0 "[ . 1 . 2]" 1 3 1 9 TYR H 1 9 TYR QB 2.300 . 2.800 2.222 2.187 2.249 . 0 0 "[ . 1 . 2]" 1 4 1 8 ILE MG 1 9 TYR H 2.650 . 3.500 3.046 2.918 3.130 . 0 0 "[ . 1 . 2]" 1 5 1 18 VAL H 1 26 LEU H 2.650 . 3.500 2.871 2.807 2.938 . 0 0 "[ . 1 . 2]" 1 6 1 12 GLN H 1 13 GLY H 3.150 . 4.500 3.230 3.165 3.375 . 0 0 "[ . 1 . 2]" 1 7 1 48 TYR H 1 49 ASN H 3.150 . 4.500 2.320 2.060 2.517 . 0 0 "[ . 1 . 2]" 1 8 1 12 GLN H 1 15 LYS H 3.150 . 4.500 3.313 3.110 3.459 . 0 0 "[ . 1 . 2]" 1 9 1 48 TYR H 1 48 TYR QD 3.650 . 5.500 3.447 3.123 3.663 . 0 0 "[ . 1 . 2]" 1 10 1 18 VAL H 1 18 VAL HA 2.650 . 3.500 2.797 2.755 2.828 . 0 0 "[ . 1 . 2]" 1 11 1 12 GLN H 1 16 ALA HA 2.650 . 3.500 2.851 2.602 3.116 . 0 0 "[ . 1 . 2]" 1 12 1 48 TYR H 1 48 TYR HA 2.650 . 3.500 2.876 2.844 2.923 . 0 0 "[ . 1 . 2]" 1 13 1 47 ILE HA 1 48 TYR H 2.300 . 2.800 2.071 2.024 2.138 . 0 0 "[ . 1 . 2]" 1 14 1 11 ILE HA 1 12 GLN H 2.300 . 2.800 2.207 2.164 2.254 . 0 0 "[ . 1 . 2]" 1 15 1 48 TYR H 1 48 TYR HB3 2.650 . 3.500 3.405 3.204 3.479 . 0 0 "[ . 1 . 2]" 1 16 1 48 TYR H 1 48 TYR HB2 2.650 . 3.500 2.110 1.997 2.158 . 0 0 "[ . 1 . 2]" 1 17 1 27 ILE HB 1 48 TYR H 3.150 . 4.500 3.427 3.343 3.520 . 0 0 "[ . 1 . 2]" 1 18 1 12 GLN H 1 12 GLN QG 3.150 . 4.500 3.879 3.082 4.239 . 0 0 "[ . 1 . 2]" 1 19 1 12 GLN H 1 12 GLN HB3 3.150 . 4.500 3.511 3.107 3.813 . 0 0 "[ . 1 . 2]" 1 20 1 12 GLN H 1 12 GLN HB2 2.300 . 2.800 2.577 2.436 2.705 . 0 0 "[ . 1 . 2]" 1 21 1 11 ILE HB 1 12 GLN H 3.150 . 4.500 4.114 4.000 4.263 . 0 0 "[ . 1 . 2]" 1 22 1 11 ILE HG12 1 12 GLN H 3.150 . 4.500 3.338 3.097 3.610 . 0 0 "[ . 1 . 2]" 1 23 1 12 GLN H 1 15 LYS HG2 3.150 . 4.500 4.049 3.899 4.234 . 0 0 "[ . 1 . 2]" 1 24 1 17 VAL MG2 1 18 VAL H 3.150 . 4.500 4.084 4.004 4.162 . 0 0 "[ . 1 . 2]" 1 25 1 18 VAL H 1 18 VAL QG 2.650 . 3.500 1.975 1.864 2.072 . 0 0 "[ . 1 . 2]" 1 26 1 47 ILE MG 1 48 TYR H 2.300 . 2.800 2.697 2.228 2.843 0.043 6 0 "[ . 1 . 2]" 1 27 1 26 LEU MD2 1 48 TYR H 3.150 . 4.500 3.795 3.693 3.930 . 0 0 "[ . 1 . 2]" 1 28 1 11 ILE MD 1 12 GLN H 3.150 . 4.500 3.577 3.390 3.714 . 0 0 "[ . 1 . 2]" 1 29 1 28 ILE MG 1 48 TYR H 3.150 . 4.500 3.303 3.129 3.463 . 0 0 "[ . 1 . 2]" 1 30 1 9 TYR H 1 19 LEU H 3.150 . 4.500 3.334 3.214 3.466 . 0 0 "[ . 1 . 2]" 1 31 1 8 ILE H 1 37 GLY H 3.650 . 5.500 3.345 3.262 3.417 . 0 0 "[ . 1 . 2]" 1 32 1 7 ILE H 1 19 LEU H 3.150 . 3.500 2.826 2.758 2.885 . 0 0 "[ . 1 . 2]" 1 33 1 8 ILE H 1 35 LYS H 3.150 . 4.500 3.667 3.477 3.793 . 0 0 "[ . 1 . 2]" 1 34 1 8 ILE HA 1 19 LEU H 3.150 . 4.500 3.869 3.756 4.009 . 0 0 "[ . 1 . 2]" 1 35 1 30 ARG HA 1 31 ARG H 2.300 . 2.800 2.084 2.002 2.146 . 0 0 "[ . 1 . 2]" 1 36 1 52 GLY QA 1 53 LYS H 3.150 . 4.500 2.463 2.113 2.878 . 0 0 "[ . 1 . 2]" 1 37 1 9 TYR QB 1 19 LEU H 3.650 . 5.500 2.897 2.759 3.028 . 0 0 "[ . 1 . 2]" 1 38 1 31 ARG H 1 33 ASP QB 3.150 . 4.500 3.902 3.698 4.034 . 0 0 "[ . 1 . 2]" 1 39 1 8 ILE H 1 8 ILE HB 2.300 . 2.800 2.594 2.549 2.630 . 0 0 "[ . 1 . 2]" 1 40 1 8 ILE H 1 34 MET ME 3.650 . 5.500 4.562 4.450 4.659 . 0 0 "[ . 1 . 2]" 1 41 1 31 ARG H 1 34 MET ME 2.300 . 2.800 2.692 2.301 2.823 0.023 15 0 "[ . 1 . 2]" 1 42 1 31 ARG H 1 34 MET HB3 3.150 . 4.500 4.032 2.252 4.512 0.012 7 0 "[ . 1 . 2]" 1 43 1 7 ILE HB 1 19 LEU H 2.300 . 2.800 2.281 2.231 2.305 . 0 0 "[ . 1 . 2]" 1 44 1 18 VAL HB 1 19 LEU H 3.150 . 4.500 3.182 3.050 3.309 . 0 0 "[ . 1 . 2]" 1 45 1 7 ILE HG13 1 19 LEU H 3.650 . 5.500 4.019 3.976 4.048 . 0 0 "[ . 1 . 2]" 1 46 1 7 ILE HG13 1 8 ILE H 2.650 . 3.500 3.512 3.483 3.531 0.031 3 0 "[ . 1 . 2]" 1 47 1 31 ARG H 1 31 ARG HB2 2.300 . 2.800 2.351 2.054 2.505 . 0 0 "[ . 1 . 2]" 1 48 1 30 ARG HG3 1 31 ARG H 3.150 . 4.500 3.646 3.024 3.942 . 0 0 "[ . 1 . 2]" 1 49 1 19 LEU H 1 19 LEU HB2 2.300 . 2.800 2.813 2.806 2.825 0.025 3 0 "[ . 1 . 2]" 1 50 1 18 VAL QG 1 19 LEU H 3.150 . 4.500 3.368 3.308 3.435 . 0 0 "[ . 1 . 2]" 1 51 1 7 ILE MG 1 8 ILE H 2.300 . 2.800 2.477 2.414 2.515 . 0 0 "[ . 1 . 2]" 1 52 1 18 VAL H 1 26 LEU H 3.150 . 4.500 2.937 2.867 3.016 . 0 0 "[ . 1 . 2]" 1 53 1 15 LYS H 1 30 ARG H 3.150 . 4.500 3.906 3.827 3.970 . 0 0 "[ . 1 . 2]" 1 54 1 25 PHE HA 1 26 LEU H 2.300 . 2.800 2.075 2.021 2.102 . 0 0 "[ . 1 . 2]" 1 55 1 7 ILE HA 1 39 GLN H 3.150 . 4.500 4.124 3.942 4.235 . 0 0 "[ . 1 . 2]" 1 56 1 15 LYS HA 1 30 ARG H 3.150 . 4.500 2.495 2.252 2.699 . 0 0 "[ . 1 . 2]" 1 57 1 16 ALA H 1 29 ARG HA 3.650 . 5.500 3.685 3.396 3.786 . 0 0 "[ . 1 . 2]" 1 58 1 50 VAL HA 1 51 ARG H 2.650 . 3.500 2.582 2.078 3.543 0.043 7 0 "[ . 1 . 2]" 1 59 1 29 ARG HA 1 30 ARG H 2.300 . 2.800 2.101 2.046 2.130 . 0 0 "[ . 1 . 2]" 1 60 1 25 PHE HB3 1 26 LEU H 3.150 . 4.500 3.457 3.319 3.505 . 0 0 "[ . 1 . 2]" 1 61 1 30 ARG H 1 30 ARG QD 3.650 . 4.500 4.361 4.169 4.515 0.015 5 0 "[ . 1 . 2]" 1 62 1 25 PHE HB2 1 26 LEU H 3.150 . 4.500 4.248 4.174 4.283 . 0 0 "[ . 1 . 2]" 1 63 1 10 GLU HG2 1 11 ILE H 2.650 . 3.500 2.318 1.827 3.565 0.065 9 0 "[ . 1 . 2]" 1 64 1 10 GLU HB2 1 11 ILE H 3.150 . 4.500 3.922 3.788 4.126 . 0 0 "[ . 1 . 2]" 1 65 1 38 GLN QG 1 39 GLN H 3.150 . 4.500 3.651 3.331 4.257 . 0 0 "[ . 1 . 2]" 1 66 1 38 GLN QB 1 39 GLN H 2.650 . 3.500 2.297 2.159 2.410 . 0 0 "[ . 1 . 2]" 1 67 1 39 GLN H 1 39 GLN HB2 2.300 . 2.800 2.625 2.489 2.754 . 0 0 "[ . 1 . 2]" 1 68 1 50 VAL HB 1 51 ARG H 3.650 . 5.500 3.681 1.916 4.478 . 0 0 "[ . 1 . 2]" 1 69 1 51 ARG H 1 51 ARG HB3 3.150 . 4.500 3.089 2.279 3.803 . 0 0 "[ . 1 . 2]" 1 70 1 29 ARG QB 1 30 ARG H 3.150 . 4.500 3.077 2.846 3.190 . 0 0 "[ . 1 . 2]" 1 71 1 18 VAL HB 1 26 LEU H 3.150 . 4.500 3.876 3.756 4.041 . 0 0 "[ . 1 . 2]" 1 72 1 26 LEU H 1 26 LEU QB 2.650 . 3.500 2.398 2.268 2.507 . 0 0 "[ . 1 . 2]" 1 73 1 15 LYS HB2 1 16 ALA H 2.650 . 3.500 3.508 3.445 3.553 0.053 9 0 "[ . 1 . 2]" 1 74 1 16 ALA H 1 30 ARG HB2 3.150 . 4.500 3.451 3.241 3.797 . 0 0 "[ . 1 . 2]" 1 75 1 16 ALA H 1 16 ALA MB 2.300 . 2.800 2.521 2.487 2.553 . 0 0 "[ . 1 . 2]" 1 76 1 11 ILE H 1 11 ILE HB 2.650 . 3.500 2.538 2.460 2.677 . 0 0 "[ . 1 . 2]" 1 77 1 11 ILE H 1 11 ILE HG12 2.650 . 3.500 2.956 2.713 3.098 . 0 0 "[ . 1 . 2]" 1 78 1 51 ARG H 1 51 ARG HB2 2.650 . 3.500 2.574 1.930 3.368 . 0 0 "[ . 1 . 2]" 1 79 1 30 ARG H 1 30 ARG HB3 2.650 . 3.500 2.504 2.295 2.636 . 0 0 "[ . 1 . 2]" 1 80 1 30 ARG H 1 30 ARG HB2 2.650 . 3.500 2.702 2.547 2.837 . 0 0 "[ . 1 . 2]" 1 81 1 15 LYS HG2 1 30 ARG H 3.650 . 5.500 3.732 3.507 3.858 . 0 0 "[ . 1 . 2]" 1 82 1 17 VAL MG1 1 26 LEU H 2.650 . 3.500 3.343 3.235 3.399 . 0 0 "[ . 1 . 2]" 1 83 1 18 VAL QG 1 26 LEU H 3.150 . 4.500 2.589 2.385 2.740 . 0 0 "[ . 1 . 2]" 1 84 1 11 ILE MG 1 16 ALA H 2.650 . 3.500 3.265 3.112 3.426 . 0 0 "[ . 1 . 2]" 1 85 1 11 ILE H 1 11 ILE HG13 2.650 . 3.500 3.227 2.679 3.511 0.011 9 0 "[ . 1 . 2]" 1 86 1 7 ILE MD 1 39 GLN H 3.150 . 4.500 3.490 3.344 3.602 . 0 0 "[ . 1 . 2]" 1 87 1 50 VAL MG1 1 51 ARG H 3.150 . 4.500 3.306 2.032 3.901 . 0 0 "[ . 1 . 2]" 1 88 1 6 GLY H 1 40 VAL H 2.650 . 3.500 2.836 2.758 2.916 . 0 0 "[ . 1 . 2]" 1 89 1 4 ARG H 1 42 PHE H 2.650 . 3.500 2.927 2.743 3.150 . 0 0 "[ . 1 . 2]" 1 90 1 15 LYS H 1 16 ALA H 3.650 . 5.500 4.417 4.333 4.466 . 0 0 "[ . 1 . 2]" 1 91 1 14 MET H 1 15 LYS H 3.150 . 4.500 2.353 2.218 2.647 . 0 0 "[ . 1 . 2]" 1 92 1 27 ILE H 1 49 ASN H 3.650 . 5.500 4.003 3.129 5.325 . 0 0 "[ . 1 . 2]" 1 93 1 3 ASN H 1 4 ARG H 3.150 . 4.500 4.476 4.387 4.533 0.033 13 0 "[ . 1 . 2]" 1 94 1 4 ARG H 1 5 LEU H 3.150 . 4.500 4.387 4.251 4.450 . 0 0 "[ . 1 . 2]" 1 95 1 10 GLU H 1 17 VAL H 2.650 . 3.500 3.011 2.870 3.158 . 0 0 "[ . 1 . 2]" 1 96 1 35 LYS H 1 36 VAL H 3.650 . 5.500 4.043 3.982 4.091 . 0 0 "[ . 1 . 2]" 1 97 1 25 PHE H 1 25 PHE QD 2.650 . 3.500 2.388 2.261 2.583 . 0 0 "[ . 1 . 2]" 1 98 1 25 PHE H 1 25 PHE HA 2.650 . 3.500 2.924 2.904 2.941 . 0 0 "[ . 1 . 2]" 1 99 1 16 ALA HA 1 17 VAL H 2.300 . 2.800 2.175 2.105 2.230 . 0 0 "[ . 1 . 2]" 1 100 1 39 GLN HA 1 40 VAL H 2.300 . 2.800 2.101 2.066 2.143 . 0 0 "[ . 1 . 2]" 1 101 1 40 VAL H 1 40 VAL HA 2.650 . 3.500 2.929 2.913 2.943 . 0 0 "[ . 1 . 2]" 1 102 1 26 LEU HA 1 27 ILE H 2.300 . 2.800 2.245 2.118 2.307 . 0 0 "[ . 1 . 2]" 1 103 1 11 ILE HA 1 17 VAL H 2.650 . 3.500 3.146 2.974 3.392 . 0 0 "[ . 1 . 2]" 1 104 1 35 LYS HA 1 36 VAL H 2.300 . 2.800 2.261 2.181 2.359 . 0 0 "[ . 1 . 2]" 1 105 1 14 MET HA 1 15 LYS H 3.150 . 4.500 3.111 2.941 3.234 . 0 0 "[ . 1 . 2]" 1 106 1 13 GLY HA3 1 15 LYS H 3.650 . 5.500 3.532 3.397 3.651 . 0 0 "[ . 1 . 2]" 1 107 1 25 PHE H 1 25 PHE HB3 3.150 . 4.500 3.695 3.659 3.726 . 0 0 "[ . 1 . 2]" 1 108 1 25 PHE H 1 25 PHE HB2 2.650 . 3.500 2.600 2.549 2.660 . 0 0 "[ . 1 . 2]" 1 109 1 17 VAL H 1 17 VAL HB 2.300 . 2.800 2.549 2.493 2.607 . 0 0 "[ . 1 . 2]" 1 110 1 39 GLN HB2 1 40 VAL H 3.150 . 4.500 4.284 4.160 4.406 . 0 0 "[ . 1 . 2]" 1 111 1 24 GLU QG 1 25 PHE H 3.650 . 5.500 4.410 3.951 4.625 . 0 0 "[ . 1 . 2]" 1 112 1 24 GLU HB3 1 25 PHE H 2.650 . 3.500 2.929 2.605 3.230 . 0 0 "[ . 1 . 2]" 1 113 1 27 ILE H 1 27 ILE HB 2.300 . 2.800 2.340 2.297 2.407 . 0 0 "[ . 1 . 2]" 1 114 1 12 GLN HB3 1 15 LYS H 3.150 . 4.500 3.420 3.155 3.793 . 0 0 "[ . 1 . 2]" 1 115 1 12 GLN HB2 1 15 LYS H 2.650 . 3.500 3.412 3.136 3.542 0.042 17 0 "[ . 1 . 2]" 1 116 1 16 ALA MB 1 17 VAL H 2.300 . 2.800 2.751 2.559 2.811 0.011 13 0 "[ . 1 . 2]" 1 117 1 27 ILE H 1 27 ILE HG12 2.650 . 3.500 2.429 2.280 2.567 . 0 0 "[ . 1 . 2]" 1 118 1 26 LEU QB 1 27 ILE H 2.300 . 2.800 2.751 2.581 2.829 0.029 16 0 "[ . 1 . 2]" 1 119 1 27 ILE H 1 27 ILE HG13 3.150 . 4.500 3.788 3.714 3.872 . 0 0 "[ . 1 . 2]" 1 120 1 4 ARG H 1 5 LEU HB3 3.650 . 5.500 4.970 4.536 5.254 . 0 0 "[ . 1 . 2]" 1 121 1 4 ARG H 1 4 ARG HB3 2.650 . 3.500 2.816 2.604 3.195 . 0 0 "[ . 1 . 2]" 1 122 1 15 LYS H 1 15 LYS HB2 2.650 . 3.500 2.585 2.488 2.677 . 0 0 "[ . 1 . 2]" 1 123 1 15 LYS H 1 15 LYS QD 3.150 . 4.500 3.545 3.403 3.763 . 0 0 "[ . 1 . 2]" 1 124 1 15 LYS H 1 15 LYS HG2 3.150 . 4.500 3.652 3.425 3.746 . 0 0 "[ . 1 . 2]" 1 125 1 8 ILE MD 1 17 VAL H 2.650 . 3.500 3.270 3.226 3.324 . 0 0 "[ . 1 . 2]" 1 126 1 40 VAL H 1 40 VAL QG 2.300 . 2.800 2.057 1.979 2.127 . 0 0 "[ . 1 . 2]" 1 127 1 36 VAL H 1 36 VAL MG2 2.300 . 2.800 1.956 1.856 2.043 . 0 0 "[ . 1 . 2]" 1 128 1 4 ARG H 1 4 ARG HB2 2.650 . 3.500 2.801 2.598 3.038 . 0 0 "[ . 1 . 2]" 1 129 1 15 LYS H 1 15 LYS HG3 3.150 . 4.500 2.724 2.535 2.972 . 0 0 "[ . 1 . 2]" 1 130 1 11 ILE MG 1 15 LYS H 3.150 . 4.500 3.847 3.565 4.185 . 0 0 "[ . 1 . 2]" 1 131 1 6 GLY H 1 42 PHE H 3.650 . 5.500 4.545 4.278 4.915 . 0 0 "[ . 1 . 2]" 1 132 1 37 GLY H 1 38 GLN H 2.300 . 2.800 2.651 2.520 2.810 0.010 10 0 "[ . 1 . 2]" 1 133 1 8 ILE H 1 38 GLN H 3.150 . 4.500 3.550 3.390 3.644 . 0 0 "[ . 1 . 2]" 1 134 1 50 VAL H 1 51 ARG H 3.150 . 4.500 3.519 2.254 4.399 . 0 0 "[ . 1 . 2]" 1 135 1 46 ASP H 1 47 ILE H 2.650 . 3.500 2.300 2.124 2.490 . 0 0 "[ . 1 . 2]" 1 136 1 20 THR H 1 24 GLU H 3.150 . 4.500 2.909 2.745 3.172 . 0 0 "[ . 1 . 2]" 1 137 1 34 MET H 1 35 LYS H 3.650 . 4.500 4.339 4.211 4.472 . 0 0 "[ . 1 . 2]" 1 138 1 42 PHE H 1 42 PHE QD 3.150 . 3.500 2.676 2.504 2.849 . 0 0 "[ . 1 . 2]" 1 139 1 20 THR H 1 25 PHE HA 3.150 . 3.500 3.481 3.339 3.535 0.035 8 0 "[ . 1 . 2]" 1 140 1 41 SER HA 1 42 PHE H 2.300 . 2.800 2.143 2.062 2.191 . 0 0 "[ . 1 . 2]" 1 141 1 19 LEU HA 1 20 THR H 2.650 . 3.500 2.133 2.084 2.172 . 0 0 "[ . 1 . 2]" 1 142 1 5 LEU HA 1 42 PHE H 3.150 . 4.500 3.564 3.326 3.789 . 0 0 "[ . 1 . 2]" 1 143 1 28 ILE HA 1 29 ARG H 2.300 . 2.800 2.338 2.282 2.414 . 0 0 "[ . 1 . 2]" 1 144 1 7 ILE H 1 7 ILE HA 2.650 . 3.500 2.859 2.841 2.871 . 0 0 "[ . 1 . 2]" 1 145 1 49 ASN HA 1 50 VAL H 2.650 . 3.500 2.683 1.979 3.532 0.032 15 0 "[ . 1 . 2]" 1 146 1 43 GLU HA 1 44 ASN H 2.300 . 2.800 2.376 2.260 2.516 . 0 0 "[ . 1 . 2]" 1 147 1 44 ASN H 1 44 ASN HA 2.650 . 3.500 2.864 2.802 2.904 . 0 0 "[ . 1 . 2]" 1 148 1 48 TYR HA 1 49 ASN H 2.650 . 3.500 3.370 3.231 3.449 . 0 0 "[ . 1 . 2]" 1 149 1 3 ASN H 1 3 ASN HA 2.650 . 3.500 2.861 2.774 2.916 . 0 0 "[ . 1 . 2]" 1 150 1 2 MET HA 1 3 ASN H 2.300 . 2.800 2.188 2.024 2.305 . 0 0 "[ . 1 . 2]" 1 151 1 29 ARG H 1 47 ILE HA 3.650 . 5.500 3.607 3.230 3.917 . 0 0 "[ . 1 . 2]" 1 152 1 4 ARG HA 1 5 LEU H 2.300 . 2.800 2.382 2.265 2.458 . 0 0 "[ . 1 . 2]" 1 153 1 34 MET HA 1 35 LYS H 2.300 . 2.800 2.089 2.049 2.145 . 0 0 "[ . 1 . 2]" 1 154 1 46 ASP HA 1 47 ILE H 3.150 . 4.500 3.358 3.285 3.440 . 0 0 "[ . 1 . 2]" 1 155 1 44 ASN HA 1 47 ILE H 3.150 . 4.500 3.291 2.977 3.512 . 0 0 "[ . 1 . 2]" 1 156 1 47 ILE H 1 47 ILE HA 2.650 . 3.500 2.846 2.812 2.885 . 0 0 "[ . 1 . 2]" 1 157 1 37 GLY HA3 1 38 GLN H 2.650 . 3.500 2.646 2.614 2.685 . 0 0 "[ . 1 . 2]" 1 158 1 41 SER QB 1 42 PHE H 3.150 . 4.500 3.425 3.220 3.810 . 0 0 "[ . 1 . 2]" 1 159 1 6 GLY HA2 1 7 ILE H 2.300 . 2.800 2.208 2.180 2.248 . 0 0 "[ . 1 . 2]" 1 160 1 37 GLY HA2 1 38 GLN H 2.650 . 3.500 3.460 3.411 3.515 0.015 17 0 "[ . 1 . 2]" 1 161 1 44 ASN H 1 44 ASN QB 2.650 . 3.500 2.284 2.176 2.452 . 0 0 "[ . 1 . 2]" 1 162 1 42 PHE H 1 42 PHE HB2 3.650 . 5.500 3.774 3.729 3.857 . 0 0 "[ . 1 . 2]" 1 163 1 3 ASN QB 1 42 PHE H 3.650 . 5.500 4.090 3.512 4.470 . 0 0 "[ . 1 . 2]" 1 164 1 3 ASN H 1 3 ASN QB 2.650 . 3.500 2.334 2.176 2.514 . 0 0 "[ . 1 . 2]" 1 165 1 29 ARG H 1 29 ARG QD 3.150 . 4.500 3.913 3.652 4.476 . 0 0 "[ . 1 . 2]" 1 166 1 29 ARG H 1 46 ASP HB2 3.150 . 4.500 4.157 3.915 4.316 . 0 0 "[ . 1 . 2]" 1 167 1 49 ASN HB3 1 50 VAL H 3.150 . 4.500 3.647 2.732 4.281 . 0 0 "[ . 1 . 2]" 1 168 1 49 ASN HB2 1 50 VAL H 3.150 . 4.500 3.747 2.198 4.500 . 0 0 "[ . 1 . 2]" 1 169 1 34 MET HG3 1 35 LYS H 3.650 . 5.500 3.983 3.398 4.264 . 0 0 "[ . 1 . 2]" 1 170 1 46 ASP HB3 1 47 ILE H 3.150 . 4.500 3.977 3.817 4.122 . 0 0 "[ . 1 . 2]" 1 171 1 36 VAL HA 1 38 GLN H 3.150 . 4.500 3.610 3.478 3.732 . 0 0 "[ . 1 . 2]" 1 172 1 43 GLU HB3 1 44 ASN H 2.300 . 2.800 2.212 1.990 2.394 . 0 0 "[ . 1 . 2]" 1 173 1 43 GLU HB2 1 44 ASN H 2.650 . 3.500 3.523 3.341 3.597 0.097 4 0 "[ . 1 . 2]" 1 174 1 50 VAL H 1 50 VAL HB 2.650 . 3.500 2.681 2.531 3.582 0.082 15 0 "[ . 1 . 2]" 1 175 1 34 MET HB3 1 35 LYS H 3.150 . 4.500 3.824 3.552 4.416 . 0 0 "[ . 1 . 2]" 1 176 1 47 ILE H 1 47 ILE HB 2.300 . 2.800 2.524 2.431 2.597 . 0 0 "[ . 1 . 2]" 1 177 1 38 GLN H 1 38 GLN QG 2.300 . 2.800 2.213 1.884 2.517 . 0 0 "[ . 1 . 2]" 1 178 1 38 GLN H 1 38 GLN QB 2.300 . 2.800 2.720 2.576 2.936 0.136 17 0 "[ . 1 . 2]" 1 179 1 20 THR H 1 20 THR MG 2.300 . 2.800 2.295 2.183 2.383 . 0 0 "[ . 1 . 2]" 1 180 1 19 LEU HG 1 20 THR H 3.150 . 4.500 3.805 3.736 3.875 . 0 0 "[ . 1 . 2]" 1 181 1 28 ILE H 1 28 ILE HG12 2.300 . 2.800 2.451 2.340 2.641 . 0 0 "[ . 1 . 2]" 1 182 1 28 ILE HB 1 29 ARG H 2.300 . 2.800 2.027 1.922 2.236 . 0 0 "[ . 1 . 2]" 1 183 1 27 ILE MG 1 29 ARG H 3.650 . 5.500 5.022 4.881 5.189 . 0 0 "[ . 1 . 2]" 1 184 1 7 ILE H 1 7 ILE HB 2.300 . 2.800 2.533 2.491 2.607 . 0 0 "[ . 1 . 2]" 1 185 1 5 LEU HB2 1 7 ILE H 3.150 . 4.500 4.483 4.367 4.540 0.040 10 0 "[ . 1 . 2]" 1 186 1 7 ILE H 1 7 ILE HG13 3.150 . 4.500 2.321 2.243 2.401 . 0 0 "[ . 1 . 2]" 1 187 1 5 LEU H 1 5 LEU HB3 2.650 . 3.500 2.810 2.594 3.010 . 0 0 "[ . 1 . 2]" 1 188 1 4 ARG HB3 1 5 LEU H 2.650 . 3.500 3.455 3.121 3.550 0.050 11 0 "[ . 1 . 2]" 1 189 1 8 ILE HG12 1 38 GLN H 3.150 . 4.500 3.857 3.580 3.994 . 0 0 "[ . 1 . 2]" 1 190 1 19 LEU HB2 1 20 THR H 3.150 . 4.500 4.177 4.085 4.263 . 0 0 "[ . 1 . 2]" 1 191 1 18 VAL QG 1 28 ILE H 3.650 . 5.500 3.414 3.265 3.537 . 0 0 "[ . 1 . 2]" 1 192 1 28 ILE H 1 28 ILE MD 3.150 . 4.500 3.984 3.925 4.061 . 0 0 "[ . 1 . 2]" 1 193 1 5 LEU MD2 1 42 PHE H 3.150 . 4.500 3.687 3.378 3.866 . 0 0 "[ . 1 . 2]" 1 194 1 47 ILE MG 1 49 ASN H 3.150 . 4.500 1.833 1.779 1.937 0.021 1 0 "[ . 1 . 2]" 1 195 1 28 ILE MD 1 29 ARG H 3.150 . 4.500 3.910 3.670 4.063 . 0 0 "[ . 1 . 2]" 1 196 1 7 ILE H 1 7 ILE MD 2.650 . 3.500 3.149 3.094 3.203 . 0 0 "[ . 1 . 2]" 1 197 1 7 ILE H 1 18 VAL QG 3.150 . 4.500 3.772 3.508 3.924 . 0 0 "[ . 1 . 2]" 1 198 1 50 VAL H 1 50 VAL MG2 2.650 . 3.500 2.268 1.949 2.674 . 0 0 "[ . 1 . 2]" 1 199 1 5 LEU H 1 5 LEU QD 3.150 . 4.500 3.419 3.271 3.560 . 0 0 "[ . 1 . 2]" 1 200 1 4 ARG HB2 1 5 LEU H 3.150 . 4.500 4.133 4.039 4.214 . 0 0 "[ . 1 . 2]" 1 201 1 8 ILE MD 1 35 LYS H 2.650 . 3.500 3.244 2.960 3.543 0.043 3 0 "[ . 1 . 2]" 1 202 1 8 ILE MG 1 35 LYS H 3.150 . 4.500 3.857 3.516 4.146 . 0 0 "[ . 1 . 2]" 1 203 1 47 ILE H 1 47 ILE HG13 2.300 . 2.800 2.096 1.853 2.296 . 0 0 "[ . 1 . 2]" 1 204 1 7 ILE MG 1 38 GLN H 2.650 . 3.500 3.478 3.343 3.549 0.049 17 0 "[ . 1 . 2]" 1 205 1 19 LEU MD1 1 20 THR H 2.650 . 3.500 2.989 2.849 3.198 . 0 0 "[ . 1 . 2]" 1 206 1 28 ILE H 1 28 ILE MG 3.150 . 4.500 2.854 2.742 2.971 . 0 0 "[ . 1 . 2]" 1 207 1 28 ILE MG 1 29 ARG H 3.150 . 4.500 3.624 3.544 3.728 . 0 0 "[ . 1 . 2]" 1 208 1 43 GLU H 1 46 ASP H 3.650 . 4.500 3.517 3.268 3.799 . 0 0 "[ . 1 . 2]" 1 209 1 21 SER H 1 22 GLU H 3.150 . 4.500 2.577 2.483 2.721 . 0 0 "[ . 1 . 2]" 1 210 1 45 GLU H 1 46 ASP H 3.150 . 4.500 2.535 2.436 2.720 . 0 0 "[ . 1 . 2]" 1 211 1 33 ASP H 1 34 MET H 2.650 . 3.500 2.490 2.233 2.904 . 0 0 "[ . 1 . 2]" 1 212 1 22 GLU H 1 23 GLY H 2.300 . 2.800 2.337 2.196 2.508 . 0 0 "[ . 1 . 2]" 1 213 1 23 GLY H 1 24 GLU H 2.650 . 3.500 2.407 2.213 2.574 . 0 0 "[ . 1 . 2]" 1 214 1 42 PHE QD 1 43 GLU H 3.150 . 4.500 3.263 2.884 3.451 . 0 0 "[ . 1 . 2]" 1 215 1 43 GLU H 1 43 GLU HA 2.650 . 3.500 2.923 2.897 2.941 . 0 0 "[ . 1 . 2]" 1 216 1 46 ASP H 1 46 ASP HA 2.650 . 3.500 2.906 2.862 2.939 . 0 0 "[ . 1 . 2]" 1 217 1 21 SER HA 1 22 GLU H 3.150 . 4.500 3.348 3.253 3.418 . 0 0 "[ . 1 . 2]" 1 218 1 45 GLU HA 1 46 ASP H 3.150 . 4.500 3.378 3.241 3.441 . 0 0 "[ . 1 . 2]" 1 219 1 24 GLU H 1 24 GLU HA 2.650 . 3.500 2.937 2.926 2.958 . 0 0 "[ . 1 . 2]" 1 220 1 23 GLY HA3 1 24 GLU H 3.150 . 4.500 3.473 3.344 3.555 . 0 0 "[ . 1 . 2]" 1 221 1 33 ASP HA 1 34 MET H 2.300 . 2.800 2.677 2.629 2.734 . 0 0 "[ . 1 . 2]" 1 222 1 21 SER HB3 1 22 GLU H 3.150 . 4.500 4.289 4.145 4.447 . 0 0 "[ . 1 . 2]" 1 223 1 23 GLY HA2 1 24 GLU H 3.150 . 4.500 3.006 2.921 3.094 . 0 0 "[ . 1 . 2]" 1 224 1 32 LYS HA 1 34 MET H 3.150 . 4.500 3.648 3.413 4.233 . 0 0 "[ . 1 . 2]" 1 225 1 42 PHE HB2 1 43 GLU H 2.300 . 2.800 2.201 2.053 2.360 . 0 0 "[ . 1 . 2]" 1 226 1 33 ASP QB 1 34 MET H 2.650 . 3.500 3.207 2.359 3.486 . 0 0 "[ . 1 . 2]" 1 227 1 43 GLU H 1 43 GLU HB3 2.650 . 3.500 3.006 2.485 3.237 . 0 0 "[ . 1 . 2]" 1 228 1 43 GLU H 1 43 GLU HB2 2.300 . 2.800 2.487 2.279 2.622 . 0 0 "[ . 1 . 2]" 1 229 1 43 GLU QG 1 46 ASP H 3.150 . 4.500 4.450 4.203 4.544 0.044 18 0 "[ . 1 . 2]" 1 230 1 22 GLU H 1 22 GLU HG3 2.650 . 3.500 2.826 1.942 3.537 0.037 9 0 "[ . 1 . 2]" 1 231 1 22 GLU H 1 22 GLU HB2 2.650 . 3.500 2.509 2.264 2.862 . 0 0 "[ . 1 . 2]" 1 232 1 24 GLU H 1 24 GLU QG 2.650 . 3.500 2.709 2.420 2.969 . 0 0 "[ . 1 . 2]" 1 233 1 22 GLU HB2 1 24 GLU H 2.650 . 3.500 2.414 2.213 2.629 . 0 0 "[ . 1 . 2]" 1 234 1 34 MET H 1 34 MET HG2 3.150 . 4.500 4.229 3.832 4.446 . 0 0 "[ . 1 . 2]" 1 235 1 31 ARG HB3 1 34 MET H 3.150 . 4.500 4.010 3.309 4.291 . 0 0 "[ . 1 . 2]" 1 236 1 34 MET H 1 34 MET HB3 2.650 . 3.500 3.318 2.312 3.557 0.057 15 0 "[ . 1 . 2]" 1 237 1 20 THR MG 1 24 GLU H 3.150 . 4.500 3.848 3.698 4.059 . 0 0 "[ . 1 . 2]" 1 238 1 31 ARG HB2 1 34 MET H 2.300 . 2.800 2.217 2.089 2.586 . 0 0 "[ . 1 . 2]" 1 239 1 30 ARG HG3 1 34 MET H 3.650 . 5.500 4.057 3.485 4.425 . 0 0 "[ . 1 . 2]" 1 240 1 8 ILE MD 1 34 MET H 3.650 . 5.500 4.352 3.598 4.871 . 0 0 "[ . 1 . 2]" 1 241 1 8 ILE MG 1 34 MET H 3.650 . 5.500 4.874 4.598 5.098 . 0 0 "[ . 1 . 2]" 1 242 1 19 LEU MD1 1 24 GLU H 3.150 . 4.500 3.164 2.964 3.475 . 0 0 "[ . 1 . 2]" 1 243 1 10 GLU H 1 11 ILE H 3.650 . 5.500 4.126 4.059 4.165 . 0 0 "[ . 1 . 2]" 1 244 1 20 THR HA 1 21 SER H 2.300 . 2.800 2.095 2.021 2.164 . 0 0 "[ . 1 . 2]" 1 245 1 40 VAL HA 1 41 SER H 2.300 . 2.800 2.274 2.177 2.367 . 0 0 "[ . 1 . 2]" 1 246 1 10 GLU H 1 16 ALA HA 3.150 . 4.500 4.133 4.050 4.200 . 0 0 "[ . 1 . 2]" 1 247 1 45 GLU H 1 45 GLU HA 2.650 . 3.500 2.821 2.736 2.868 . 0 0 "[ . 1 . 2]" 1 248 1 9 TYR HA 1 10 GLU H 3.150 . 4.500 3.515 3.497 3.545 . 0 0 "[ . 1 . 2]" 1 249 1 10 GLU H 1 10 GLU HA 2.650 . 3.500 2.853 2.836 2.866 . 0 0 "[ . 1 . 2]" 1 250 1 8 ILE HA 1 10 GLU H 2.650 . 3.500 3.490 3.441 3.531 0.031 15 0 "[ . 1 . 2]" 1 251 1 21 SER H 1 21 SER HB2 2.650 . 3.500 3.442 3.391 3.537 0.037 2 0 "[ . 1 . 2]" 1 252 1 32 LYS HA 1 33 ASP H 2.650 . 3.500 3.388 3.269 3.511 0.011 18 0 "[ . 1 . 2]" 1 253 1 41 SER H 1 41 SER QB 2.650 . 3.500 2.618 2.388 3.014 . 0 0 "[ . 1 . 2]" 1 254 1 44 ASN QB 1 45 GLU H 2.650 . 3.500 2.986 2.822 3.193 . 0 0 "[ . 1 . 2]" 1 255 1 33 ASP H 1 33 ASP QB 3.150 . 4.500 2.379 2.244 2.574 . 0 0 "[ . 1 . 2]" 1 256 1 9 TYR QB 1 10 GLU H 2.300 . 2.800 2.635 2.513 2.733 . 0 0 "[ . 1 . 2]" 1 257 1 45 GLU H 1 45 GLU HG3 2.650 . 3.500 2.336 1.890 3.453 . 0 0 "[ . 1 . 2]" 1 258 1 45 GLU H 1 45 GLU QB 2.300 . 2.800 2.405 2.157 2.568 . 0 0 "[ . 1 . 2]" 1 259 1 43 GLU HB2 1 45 GLU H 3.150 . 4.500 3.045 2.578 3.498 . 0 0 "[ . 1 . 2]" 1 260 1 31 ARG HB3 1 33 ASP H 3.650 . 5.500 3.012 2.713 3.384 . 0 0 "[ . 1 . 2]" 1 261 1 32 LYS HB2 1 33 ASP H 2.650 . 3.500 3.142 2.608 3.410 . 0 0 "[ . 1 . 2]" 1 262 1 40 VAL HB 1 41 SER H 3.150 . 3.500 2.631 2.382 2.867 . 0 0 "[ . 1 . 2]" 1 263 1 10 GLU H 1 17 VAL HB 2.300 . 2.800 2.411 2.271 2.598 . 0 0 "[ . 1 . 2]" 1 264 1 10 GLU H 1 10 GLU HB2 2.650 . 3.500 3.282 3.165 3.367 . 0 0 "[ . 1 . 2]" 1 265 1 4 ARG HG2 1 21 SER H 3.150 . 4.500 3.157 3.028 3.252 . 0 0 "[ . 1 . 2]" 1 266 1 32 LYS QG 1 33 ASP H 3.150 . 4.500 4.246 4.026 4.447 . 0 0 "[ . 1 . 2]" 1 267 1 5 LEU MD2 1 41 SER H 2.650 . 3.500 3.105 3.021 3.182 . 0 0 "[ . 1 . 2]" 1 268 1 8 ILE MG 1 10 GLU H 2.300 . 2.800 2.746 2.582 2.813 0.013 1 0 "[ . 1 . 2]" 1 269 1 10 GLU H 1 18 VAL QG 4.150 . 6.500 4.844 4.730 4.950 . 0 0 "[ . 1 . 2]" 1 270 1 9 TYR HA 1 37 GLY H 3.650 . 5.500 4.193 4.070 4.410 . 0 0 "[ . 1 . 2]" 1 271 1 37 GLY H 1 37 GLY HA2 2.300 . 2.800 2.391 2.336 2.429 . 0 0 "[ . 1 . 2]" 1 272 1 36 VAL HA 1 37 GLY H 2.300 . 2.800 2.156 2.109 2.236 . 0 0 "[ . 1 . 2]" 1 273 1 8 ILE HB 1 37 GLY H 2.650 . 3.500 2.255 2.082 2.350 . 0 0 "[ . 1 . 2]" 1 274 1 36 VAL HB 1 37 GLY H 3.650 . 4.500 4.062 3.868 4.194 . 0 0 "[ . 1 . 2]" 1 275 1 4 ARG HE 1 4 ARG QG 3.150 . 4.500 2.398 2.217 2.656 . 0 0 "[ . 1 . 2]" 1 276 1 4 ARG HB3 1 4 ARG HE 3.650 . 5.500 4.769 4.157 5.083 . 0 0 "[ . 1 . 2]" 1 277 1 36 VAL MG1 1 37 GLY H 2.300 . 2.800 2.615 2.345 2.764 . 0 0 "[ . 1 . 2]" 1 278 1 44 ASN QB 1 44 ASN HD22 3.150 . 4.500 3.390 3.260 3.470 . 0 0 "[ . 1 . 2]" 1 279 1 5 LEU QD 1 39 GLN HE21 3.650 . 5.500 3.193 2.696 3.494 . 0 0 "[ . 1 . 2]" 1 280 1 5 LEU MD1 1 39 GLN HE22 3.650 . 5.500 3.293 2.711 3.902 . 0 0 "[ . 1 . 2]" 1 281 1 51 ARG HA 1 52 GLY H 3.150 . 4.500 2.681 2.099 3.537 . 0 0 "[ . 1 . 2]" 1 282 1 10 GLU HG3 1 12 GLN HE21 3.150 . 4.500 2.375 2.017 3.490 . 0 0 "[ . 1 . 2]" 1 283 1 34 MET ME 1 38 GLN HE21 3.650 . 5.500 3.370 2.574 3.624 . 0 0 "[ . 1 . 2]" 1 284 1 38 GLN HE22 1 38 GLN QG 3.150 . 4.500 3.225 3.201 3.285 . 0 0 "[ . 1 . 2]" 1 285 1 6 GLY H 1 40 VAL H 2.650 . 3.500 2.903 2.813 2.999 . 0 0 "[ . 1 . 2]" 1 286 1 6 GLY H 1 7 ILE H 3.650 . 5.500 4.278 4.233 4.313 . 0 0 "[ . 1 . 2]" 1 287 1 6 GLY H 1 42 PHE QE 3.150 . 4.500 2.661 2.439 2.946 . 0 0 "[ . 1 . 2]" 1 288 1 6 GLY H 1 41 SER HA 3.150 . 4.500 3.899 3.629 4.096 . 0 0 "[ . 1 . 2]" 1 289 1 5 LEU HA 1 6 GLY H 2.300 . 2.800 2.163 2.120 2.229 . 0 0 "[ . 1 . 2]" 1 290 1 6 GLY H 1 7 ILE HA 3.650 . 5.500 3.830 3.726 3.927 . 0 0 "[ . 1 . 2]" 1 291 1 6 GLY H 1 6 GLY HA3 2.650 . 3.500 2.671 2.640 2.716 . 0 0 "[ . 1 . 2]" 1 292 1 22 GLU HA 1 23 GLY H 3.150 . 4.500 3.371 3.257 3.439 . 0 0 "[ . 1 . 2]" 1 293 1 23 GLY H 1 23 GLY HA3 2.650 . 3.500 2.881 2.850 2.939 . 0 0 "[ . 1 . 2]" 1 294 1 6 GLY H 1 6 GLY HA2 2.650 . 3.500 2.880 2.842 2.900 . 0 0 "[ . 1 . 2]" 1 295 1 23 GLY H 1 23 GLY HA2 2.300 . 2.800 2.303 2.274 2.386 . 0 0 "[ . 1 . 2]" 1 296 1 6 GLY H 1 39 GLN HG3 4.150 . 6.500 3.318 2.856 3.680 . 0 0 "[ . 1 . 2]" 1 297 1 23 GLY H 1 24 GLU QG 3.650 . 5.500 4.142 3.772 4.546 . 0 0 "[ . 1 . 2]" 1 298 1 22 GLU HB2 1 23 GLY H 3.150 . 4.500 3.354 3.121 3.616 . 0 0 "[ . 1 . 2]" 1 299 1 5 LEU HB2 1 6 GLY H 3.150 . 4.500 3.809 3.753 3.917 . 0 0 "[ . 1 . 2]" 1 300 1 5 LEU MD2 1 6 GLY H 2.650 . 3.500 3.022 2.928 3.102 . 0 0 "[ . 1 . 2]" 1 301 1 6 GLY H 1 18 VAL QG 3.650 . 5.500 3.830 3.681 3.967 . 0 0 "[ . 1 . 2]" 1 302 1 19 LEU MD1 1 23 GLY H 3.650 . 5.500 3.728 3.567 3.940 . 0 0 "[ . 1 . 2]" 1 303 1 5 LEU H 1 6 GLY H 3.650 . 5.500 4.362 4.263 4.421 . 0 0 "[ . 1 . 2]" 1 304 1 4 ARG HA 1 6 GLY H 4.150 . 6.500 5.510 5.430 5.585 . 0 0 "[ . 1 . 2]" 1 305 1 4 ARG HB3 1 6 GLY H 3.650 . 5.500 4.603 4.491 4.775 . 0 0 "[ . 1 . 2]" 1 306 1 6 GLY H 1 39 GLN HB2 3.650 . 5.500 5.447 5.168 5.533 0.033 8 0 "[ . 1 . 2]" 1 307 1 6 GLY H 1 21 SER H 3.650 . 5.500 5.119 4.908 5.281 . 0 0 "[ . 1 . 2]" 1 308 1 19 LEU MD2 1 23 GLY H 3.650 . 5.500 5.214 5.017 5.473 . 0 0 "[ . 1 . 2]" 1 309 1 7 ILE MD 1 23 GLY H 3.650 . 5.500 5.538 5.510 5.599 0.099 11 0 "[ . 1 . 2]" 1 310 1 19 LEU HG 1 23 GLY H 3.650 . 5.500 4.154 3.953 4.408 . 0 0 "[ . 1 . 2]" 1 311 1 5 LEU HB2 1 23 GLY H 3.650 . 5.500 4.671 4.491 4.849 . 0 0 "[ . 1 . 2]" 1 312 1 22 GLU HB3 1 23 GLY H 3.150 . 4.500 3.928 3.732 4.236 . 0 0 "[ . 1 . 2]" 1 313 1 19 LEU HA 1 23 GLY H 3.650 . 5.500 5.252 5.165 5.422 . 0 0 "[ . 1 . 2]" 1 314 1 21 SER H 1 23 GLY H 3.650 . 5.500 4.078 3.959 4.175 . 0 0 "[ . 1 . 2]" 1 315 1 20 THR H 1 23 GLY H 3.650 . 4.500 3.953 3.812 4.211 . 0 0 "[ . 1 . 2]" 1 316 1 51 ARG HB2 1 52 GLY H 3.650 . 5.500 3.316 1.852 4.136 . 0 0 "[ . 1 . 2]" 1 317 1 51 ARG HB3 1 52 GLY H 3.650 . 5.500 3.764 2.573 4.618 . 0 0 "[ . 1 . 2]" 1 318 1 52 GLY H 1 53 LYS H 3.650 . 4.500 3.121 1.839 4.427 . 0 0 "[ . 1 . 2]" 1 319 1 11 ILE MG 1 12 GLN HE21 3.650 . 5.500 4.314 3.693 4.539 . 0 0 "[ . 1 . 2]" 1 320 1 38 GLN HE21 1 40 VAL MG1 3.650 . 5.500 2.257 1.807 4.367 . 0 0 "[ . 1 . 2]" 1 321 1 11 ILE HG12 1 12 GLN HE21 4.150 . 6.500 6.316 5.616 6.603 0.103 8 0 "[ . 1 . 2]" 1 322 1 35 LYS QG 1 38 GLN HE21 4.150 . 6.500 4.418 3.522 6.199 . 0 0 "[ . 1 . 2]" 1 323 1 34 MET HA 1 38 GLN HE22 3.150 . 4.500 4.074 3.158 4.557 0.057 12 0 "[ . 1 . 2]" 1 324 1 34 MET HA 1 38 GLN HE21 3.650 . 5.500 3.420 2.725 5.295 . 0 0 "[ . 1 . 2]" 1 325 1 34 MET ME 1 38 GLN HE22 3.650 . 5.500 3.871 3.512 3.973 . 0 0 "[ . 1 . 2]" 1 326 1 38 GLN HE22 1 40 VAL MG1 3.650 . 4.500 3.397 2.349 4.194 . 0 0 "[ . 1 . 2]" 1 327 1 12 GLN HE22 1 27 ILE MD 3.650 . 5.500 4.539 2.956 5.589 0.089 16 0 "[ . 1 . 2]" 1 328 1 35 LYS QG 1 38 GLN HE22 3.650 . 5.500 3.820 3.153 5.406 . 0 0 "[ . 1 . 2]" 1 329 1 35 LYS QD 1 38 GLN HE22 3.150 . 4.500 3.205 2.132 4.532 0.032 16 0 "[ . 1 . 2]" 1 330 1 3 ASN HD21 1 41 SER QB 3.650 . 5.500 3.333 2.713 4.672 . 0 0 "[ . 1 . 2]" 1 331 1 3 ASN HD22 1 41 SER QB 3.650 . 5.500 3.873 3.392 5.057 . 0 0 "[ . 1 . 2]" 1 332 1 39 GLN HB2 1 39 GLN HE22 3.650 . 5.500 4.171 3.761 4.536 . 0 0 "[ . 1 . 2]" 1 333 1 26 LEU MD1 1 49 ASN HD21 3.650 . 5.500 4.246 2.719 5.620 0.120 5 0 "[ . 1 . 2]" 1 334 1 3 ASN HD21 1 5 LEU MD2 3.650 . 5.500 4.934 4.225 5.518 0.018 10 0 "[ . 1 . 2]" 1 335 1 3 ASN HA 1 3 ASN HD21 3.650 . 5.500 2.421 1.747 3.046 0.053 11 0 "[ . 1 . 2]" 1 336 1 39 GLN HB2 1 39 GLN HE21 3.650 . 5.500 3.443 2.720 4.077 . 0 0 "[ . 1 . 2]" 1 337 1 7 ILE HG12 1 39 GLN HE21 3.650 . 5.500 3.767 2.706 4.669 . 0 0 "[ . 1 . 2]" 1 338 1 3 ASN HD21 1 43 GLU QG 3.650 . 5.500 2.784 1.935 3.482 . 0 0 "[ . 1 . 2]" 1 339 1 44 ASN H 1 44 ASN HD21 3.650 . 5.500 2.766 2.124 4.805 . 0 0 "[ . 1 . 2]" 1 340 1 44 ASN H 1 44 ASN HD22 3.650 . 5.500 4.223 3.733 4.955 . 0 0 "[ . 1 . 2]" 1 341 1 3 ASN HD21 1 4 ARG H 3.650 . 5.500 3.263 2.751 3.877 . 0 0 "[ . 1 . 2]" 1 342 1 3 ASN H 1 3 ASN HD21 3.650 . 5.500 4.493 3.857 5.015 . 0 0 "[ . 1 . 2]" 1 343 1 4 ARG HA 1 44 ASN HD22 4.150 . 6.500 5.046 3.798 6.523 0.023 18 0 "[ . 1 . 2]" 1 344 1 43 GLU HA 1 44 ASN HD22 4.150 . 6.500 5.242 4.640 6.531 0.031 18 0 "[ . 1 . 2]" 1 345 1 3 ASN HA 1 3 ASN HD22 3.650 . 5.500 3.559 3.223 3.836 . 0 0 "[ . 1 . 2]" 1 346 1 26 LEU QD 1 49 ASN HD22 3.150 . 4.500 3.846 2.777 4.572 0.072 18 0 "[ . 1 . 2]" 1 347 1 5 LEU HB3 1 39 GLN HE22 3.650 . 5.500 3.655 2.978 4.464 . 0 0 "[ . 1 . 2]" 1 348 1 27 ILE HG12 1 49 ASN HD22 3.650 . 5.500 3.473 2.246 4.940 . 0 0 "[ . 1 . 2]" 1 349 1 4 ARG HB2 1 4 ARG HE 3.650 . 5.500 4.468 3.724 4.680 . 0 0 "[ . 1 . 2]" 1 350 1 4 ARG HE 1 42 PHE HZ 4.150 . 6.500 4.307 3.116 5.268 . 0 0 "[ . 1 . 2]" 1 351 1 4 ARG HA 1 4 ARG HE 3.650 . 5.500 4.060 2.281 4.705 . 0 0 "[ . 1 . 2]" 1 352 1 11 ILE HG13 1 30 ARG HE 3.650 . 5.500 3.510 3.052 3.822 . 0 0 "[ . 1 . 2]" 1 353 1 30 ARG HE 1 30 ARG HG2 3.650 . 5.500 2.459 2.329 2.605 . 0 0 "[ . 1 . 2]" 1 354 1 31 ARG HB2 1 31 ARG HE 3.650 . 5.500 2.364 2.117 2.829 . 0 0 "[ . 1 . 2]" 1 355 1 31 ARG HB3 1 31 ARG HE 3.650 . 5.500 3.416 2.989 3.979 . 0 0 "[ . 1 . 2]" 1 356 1 8 ILE HG13 1 37 GLY H 3.650 . 5.500 4.608 4.415 4.705 . 0 0 "[ . 1 . 2]" 1 357 1 11 ILE HG12 1 37 GLY H 3.650 . 5.500 5.313 5.086 5.515 0.015 3 0 "[ . 1 . 2]" 1 358 1 8 ILE HG12 1 37 GLY H 3.150 . 4.500 4.469 4.345 4.523 0.023 14 0 "[ . 1 . 2]" 1 359 1 8 ILE HA 1 37 GLY H 3.150 . 4.500 4.418 4.328 4.481 . 0 0 "[ . 1 . 2]" 1 360 1 37 GLY H 1 37 GLY HA3 2.650 . 3.500 2.930 2.912 2.940 . 0 0 "[ . 1 . 2]" 1 361 1 7 ILE HA 1 37 GLY H 3.650 . 5.500 4.866 4.774 4.967 . 0 0 "[ . 1 . 2]" 1 362 1 36 VAL H 1 37 GLY H 3.650 . 5.500 4.544 4.482 4.615 . 0 0 "[ . 1 . 2]" 1 363 1 8 ILE H 1 37 GLY H 3.150 . 4.500 3.594 3.470 3.694 . 0 0 "[ . 1 . 2]" 1 364 1 9 TYR H 1 37 GLY H 3.650 . 5.500 4.840 4.779 4.902 . 0 0 "[ . 1 . 2]" 1 365 1 11 ILE MG 1 13 GLY H 3.650 . 5.500 2.356 2.157 2.864 . 0 0 "[ . 1 . 2]" 1 366 1 12 GLN HB3 1 13 GLY H 3.650 . 5.500 4.185 3.993 4.278 . 0 0 "[ . 1 . 2]" 1 367 1 12 GLN QG 1 13 GLY H 3.650 . 5.500 4.315 4.018 4.825 . 0 0 "[ . 1 . 2]" 1 368 1 12 GLN HB2 1 13 GLY H 3.650 . 5.500 4.568 4.430 4.639 . 0 0 "[ . 1 . 2]" 1 369 1 12 GLN HA 1 13 GLY H 2.650 . 3.500 2.339 2.178 2.429 . 0 0 "[ . 1 . 2]" 1 370 1 12 GLN H 1 13 GLY H 3.650 . 5.500 3.437 3.361 3.601 . 0 0 "[ . 1 . 2]" 1 371 1 10 GLU H 1 36 VAL HA 3.650 . 5.500 4.967 4.636 5.224 . 0 0 "[ . 1 . 2]" 1 372 1 9 TYR QE 1 10 GLU H 4.150 . 6.500 5.267 5.124 5.358 . 0 0 "[ . 1 . 2]" 1 373 1 45 GLU H 1 46 ASP HB3 4.150 . 6.500 6.110 5.921 6.346 . 0 0 "[ . 1 . 2]" 1 374 1 45 GLU H 1 47 ILE H 3.650 . 5.500 3.995 3.831 4.157 . 0 0 "[ . 1 . 2]" 1 375 1 41 SER H 1 42 PHE QD 3.650 . 5.500 4.642 4.206 4.988 . 0 0 "[ . 1 . 2]" 1 376 1 40 VAL H 1 41 SER H 3.650 . 4.500 4.429 4.353 4.476 . 0 0 "[ . 1 . 2]" 1 377 1 46 ASP H 1 47 ILE HG13 3.150 . 4.500 3.341 3.036 3.683 . 0 0 "[ . 1 . 2]" 1 378 1 28 ILE MG 1 46 ASP H 3.650 . 5.500 4.918 4.636 5.170 . 0 0 "[ . 1 . 2]" 1 379 1 22 GLU H 1 23 GLY HA2 3.650 . 5.500 4.629 4.456 4.824 . 0 0 "[ . 1 . 2]" 1 380 1 30 ARG QD 1 34 MET H 3.650 . 5.500 5.029 4.547 5.362 . 0 0 "[ . 1 . 2]" 1 381 1 20 THR HA 1 24 GLU H 3.650 . 5.500 3.819 3.640 4.018 . 0 0 "[ . 1 . 2]" 1 382 1 24 GLU H 1 26 LEU MD1 3.650 . 5.500 4.049 3.882 4.260 . 0 0 "[ . 1 . 2]" 1 383 1 24 GLU H 1 25 PHE H 3.650 . 5.500 4.463 4.437 4.502 . 0 0 "[ . 1 . 2]" 1 384 1 42 PHE H 1 43 GLU H 3.650 . 5.500 4.342 4.254 4.395 . 0 0 "[ . 1 . 2]" 1 385 1 41 SER HA 1 43 GLU H 4.150 . 6.500 6.267 6.157 6.369 . 0 0 "[ . 1 . 2]" 1 386 1 3 ASN HD21 1 43 GLU H 3.650 . 5.500 4.015 3.608 4.579 . 0 0 "[ . 1 . 2]" 1 387 1 19 LEU H 1 20 THR H 3.650 . 4.500 4.127 4.087 4.186 . 0 0 "[ . 1 . 2]" 1 388 1 7 ILE HA 1 38 GLN H 3.650 . 5.500 4.581 4.463 4.635 . 0 0 "[ . 1 . 2]" 1 389 1 18 VAL MG2 1 20 THR H 3.150 . 4.500 3.927 3.740 4.092 . 0 0 "[ . 1 . 2]" 1 390 1 20 THR H 1 23 GLY HA2 3.650 . 5.500 4.493 4.262 4.747 . 0 0 "[ . 1 . 2]" 1 391 1 6 GLY HA2 1 20 THR H 3.650 . 5.500 4.329 4.250 4.389 . 0 0 "[ . 1 . 2]" 1 392 1 20 THR H 1 21 SER HB3 4.150 . 6.500 5.511 5.367 5.648 . 0 0 "[ . 1 . 2]" 1 393 1 6 GLY HA3 1 20 THR H 3.150 . 4.500 4.286 4.140 4.472 . 0 0 "[ . 1 . 2]" 1 394 1 7 ILE H 1 42 PHE QE 3.650 . 5.500 4.728 4.580 4.881 . 0 0 "[ . 1 . 2]" 1 395 1 5 LEU H 1 42 PHE QE 3.150 . 4.500 4.024 3.778 4.218 . 0 0 "[ . 1 . 2]" 1 396 1 35 LYS H 1 38 GLN HE22 3.650 . 5.500 3.440 2.786 3.923 . 0 0 "[ . 1 . 2]" 1 397 1 42 PHE QD 1 47 ILE H 3.650 . 5.500 4.115 3.849 4.395 . 0 0 "[ . 1 . 2]" 1 398 1 42 PHE QE 1 47 ILE H 3.650 . 5.500 5.162 4.833 5.508 0.008 16 0 "[ . 1 . 2]" 1 399 1 28 ILE HA 1 47 ILE H 3.650 . 5.500 4.667 4.519 4.757 . 0 0 "[ . 1 . 2]" 1 400 1 7 ILE H 1 20 THR H 3.150 . 4.500 4.081 4.036 4.139 . 0 0 "[ . 1 . 2]" 1 401 1 29 ARG H 1 48 TYR QE 3.150 . 4.500 4.179 3.844 4.510 0.010 13 0 "[ . 1 . 2]" 1 402 1 29 ARG H 1 48 TYR QD 3.150 . 4.500 3.535 3.040 3.933 . 0 0 "[ . 1 . 2]" 1 403 1 29 ARG H 1 47 ILE H 3.650 . 5.500 4.753 4.605 4.883 . 0 0 "[ . 1 . 2]" 1 404 1 4 ARG HA 1 42 PHE H 3.650 . 5.500 4.939 4.834 5.063 . 0 0 "[ . 1 . 2]" 1 405 1 44 ASN H 1 47 ILE MD 3.650 . 5.500 4.270 4.119 4.410 . 0 0 "[ . 1 . 2]" 1 406 1 42 PHE QD 1 44 ASN H 3.650 . 5.500 3.958 3.602 4.287 . 0 0 "[ . 1 . 2]" 1 407 1 44 ASN H 1 46 ASP H 3.650 . 5.500 3.910 3.698 4.164 . 0 0 "[ . 1 . 2]" 1 408 1 5 LEU H 1 42 PHE H 3.650 . 5.500 4.979 4.829 5.085 . 0 0 "[ . 1 . 2]" 1 409 1 4 ARG H 1 41 SER HA 3.650 . 5.500 4.280 3.867 4.508 . 0 0 "[ . 1 . 2]" 1 410 1 3 ASN HD22 1 4 ARG H 3.650 . 5.500 4.058 3.924 4.149 . 0 0 "[ . 1 . 2]" 1 411 1 4 ARG H 1 43 GLU QG 3.650 . 5.500 4.573 4.106 4.951 . 0 0 "[ . 1 . 2]" 1 412 1 4 ARG H 1 41 SER QB 3.650 . 5.500 4.683 4.153 5.498 . 0 0 "[ . 1 . 2]" 1 413 1 27 ILE H 1 47 ILE HA 3.650 . 5.500 5.221 4.755 5.521 0.021 9 0 "[ . 1 . 2]" 1 414 1 8 ILE HB 1 36 VAL H 3.150 . 4.500 4.445 4.309 4.529 0.029 7 0 "[ . 1 . 2]" 1 415 1 25 PHE HB3 1 27 ILE H 3.650 . 5.500 5.071 4.759 5.296 . 0 0 "[ . 1 . 2]" 1 416 1 19 LEU HA 1 25 PHE H 3.150 . 4.500 4.219 4.148 4.285 . 0 0 "[ . 1 . 2]" 1 417 1 25 PHE H 1 25 PHE QE 3.650 . 5.500 4.502 4.385 4.661 . 0 0 "[ . 1 . 2]" 1 418 1 6 GLY HA2 1 40 VAL H 3.650 . 5.500 4.653 4.581 4.810 . 0 0 "[ . 1 . 2]" 1 419 1 33 ASP QB 1 38 GLN HE22 3.650 . 5.500 4.055 3.447 4.979 . 0 0 "[ . 1 . 2]" 1 420 1 35 LYS QE 1 38 GLN HE21 3.650 . 5.500 4.850 2.276 5.574 0.074 2 0 "[ . 1 . 2]" 1 421 1 10 GLU HA 1 12 GLN HE22 4.150 . 6.500 4.582 3.237 5.669 . 0 0 "[ . 1 . 2]" 1 422 1 2 MET QB 1 44 ASN HD21 3.650 . 5.500 2.905 1.982 4.956 . 0 0 "[ . 1 . 2]" 1 423 1 44 ASN HD21 1 47 ILE MD 3.650 . 5.500 3.139 1.777 4.158 0.023 6 0 "[ . 1 . 2]" 1 424 1 44 ASN HA 1 44 ASN HD21 3.650 . 5.500 2.764 1.800 3.497 . 0 0 "[ . 1 . 2]" 1 425 1 4 ARG HA 1 44 ASN HD21 4.150 . 6.500 5.132 4.668 6.094 . 0 0 "[ . 1 . 2]" 1 426 1 44 ASN HD22 1 47 ILE MD 3.650 . 5.500 3.242 2.705 4.032 . 0 0 "[ . 1 . 2]" 1 427 1 3 ASN HD22 1 43 GLU QG 3.650 . 5.500 2.418 2.001 2.780 . 0 0 "[ . 1 . 2]" 1 428 1 44 ASN HA 1 44 ASN HD22 3.650 . 5.500 3.688 3.307 4.155 . 0 0 "[ . 1 . 2]" 1 429 1 3 ASN HD22 1 42 PHE H 3.650 . 5.500 4.946 4.280 5.517 0.017 15 0 "[ . 1 . 2]" 1 430 1 3 ASN HD21 1 4 ARG HB2 4.150 . 6.500 5.697 5.115 6.287 . 0 0 "[ . 1 . 2]" 1 431 1 9 TYR QB 1 37 GLY H 4.150 . 6.500 5.649 5.578 5.787 . 0 0 "[ . 1 . 2]" 1 432 1 10 GLU H 1 11 ILE HG12 3.150 . 4.500 4.442 4.254 4.523 0.023 14 0 "[ . 1 . 2]" 1 433 1 45 GLU H 1 47 ILE MD 3.650 . 5.500 4.817 4.631 4.938 . 0 0 "[ . 1 . 2]" 1 434 1 44 ASN HA 1 45 GLU H 3.150 . 4.500 3.366 3.277 3.492 . 0 0 "[ . 1 . 2]" 1 435 1 42 PHE QD 1 45 GLU H 4.150 . 6.500 5.082 4.863 5.280 . 0 0 "[ . 1 . 2]" 1 436 1 6 GLY HA2 1 21 SER H 3.150 . 4.500 3.296 3.096 3.463 . 0 0 "[ . 1 . 2]" 1 437 1 21 SER H 1 42 PHE QE 3.650 . 5.500 4.951 4.481 5.265 . 0 0 "[ . 1 . 2]" 1 438 1 18 VAL MG2 1 21 SER H 4.150 . 6.500 6.260 5.976 6.519 0.019 10 0 "[ . 1 . 2]" 1 439 1 5 LEU QD 1 21 SER H 3.650 . 5.500 4.442 4.299 4.579 . 0 0 "[ . 1 . 2]" 1 440 1 21 SER H 1 22 GLU HB2 3.650 . 5.500 4.838 4.510 5.199 . 0 0 "[ . 1 . 2]" 1 441 1 21 SER H 1 22 GLU HG3 3.650 . 5.500 4.497 3.468 5.495 . 0 0 "[ . 1 . 2]" 1 442 1 5 LEU HA 1 21 SER H 3.650 . 5.500 5.312 5.115 5.484 . 0 0 "[ . 1 . 2]" 1 443 1 7 ILE H 1 21 SER H 3.650 . 5.500 5.077 4.799 5.298 . 0 0 "[ . 1 . 2]" 1 444 1 19 LEU MD1 1 22 GLU H 3.650 . 5.500 5.393 5.207 5.527 0.027 5 0 "[ . 1 . 2]" 1 445 1 30 ARG HA 1 34 MET H 3.650 . 5.500 5.386 5.029 5.598 0.098 19 0 "[ . 1 . 2]" 1 446 1 31 ARG HD2 1 34 MET H 4.150 . 6.500 5.779 5.099 6.507 0.007 12 0 "[ . 1 . 2]" 1 447 1 24 GLU H 1 25 PHE HA 3.650 . 5.500 4.897 4.811 5.023 . 0 0 "[ . 1 . 2]" 1 448 1 7 ILE H 1 19 LEU MD1 3.650 . 5.500 5.121 5.056 5.193 . 0 0 "[ . 1 . 2]" 1 449 1 7 ILE H 1 39 GLN HG2 3.650 . 5.500 5.272 4.740 5.511 0.011 5 0 "[ . 1 . 2]" 1 450 1 7 ILE H 1 9 TYR QB 3.650 . 5.500 5.174 5.015 5.383 . 0 0 "[ . 1 . 2]" 1 451 1 5 LEU H 1 20 THR HA 3.650 . 5.500 4.111 3.864 4.336 . 0 0 "[ . 1 . 2]" 1 452 1 5 LEU H 1 6 GLY HA2 3.650 . 5.500 5.048 4.869 5.204 . 0 0 "[ . 1 . 2]" 1 453 1 5 LEU HA 1 7 ILE H 4.150 . 6.500 6.208 6.112 6.264 . 0 0 "[ . 1 . 2]" 1 454 1 28 ILE H 1 47 ILE HA 4.150 . 6.500 4.790 4.632 4.942 . 0 0 "[ . 1 . 2]" 1 455 1 28 ILE H 1 29 ARG HA 3.650 . 5.500 4.878 4.731 4.928 . 0 0 "[ . 1 . 2]" 1 456 1 5 LEU H 1 21 SER H 3.650 . 5.500 4.119 3.796 4.372 . 0 0 "[ . 1 . 2]" 1 457 1 49 ASN HD21 1 50 VAL H 3.650 . 5.500 5.060 4.109 5.551 0.051 3 0 "[ . 1 . 2]" 1 458 1 4 ARG HA 1 44 ASN H 3.650 . 5.500 4.900 4.732 5.153 . 0 0 "[ . 1 . 2]" 1 459 1 25 PHE H 1 26 LEU MD1 3.150 . 4.500 3.464 3.266 3.674 . 0 0 "[ . 1 . 2]" 1 460 1 20 THR MG 1 25 PHE H 3.650 . 5.500 4.916 4.659 5.097 . 0 0 "[ . 1 . 2]" 1 461 1 19 LEU MD1 1 25 PHE H 3.650 . 5.500 3.953 3.765 4.077 . 0 0 "[ . 1 . 2]" 1 462 1 27 ILE H 1 28 ILE MG 3.650 . 5.500 3.934 3.704 4.083 . 0 0 "[ . 1 . 2]" 1 463 1 8 ILE HG12 1 40 VAL H 3.650 . 5.500 3.929 3.833 4.127 . 0 0 "[ . 1 . 2]" 1 464 1 18 VAL MG1 1 40 VAL H 3.650 . 5.500 3.935 3.692 4.188 . 0 0 "[ . 1 . 2]" 1 465 1 7 ILE HG13 1 40 VAL H 3.650 . 5.500 4.665 4.552 4.758 . 0 0 "[ . 1 . 2]" 1 466 1 40 VAL H 1 41 SER HA 3.650 . 5.500 4.908 4.692 5.010 . 0 0 "[ . 1 . 2]" 1 467 1 5 LEU HA 1 40 VAL H 3.150 . 4.500 4.524 4.481 4.547 0.047 14 0 "[ . 1 . 2]" 1 468 1 18 VAL H 1 27 ILE H 3.650 . 5.500 4.916 4.812 5.008 . 0 0 "[ . 1 . 2]" 1 469 1 40 VAL H 1 42 PHE QD 3.650 . 5.500 4.393 4.205 4.544 . 0 0 "[ . 1 . 2]" 1 470 1 9 TYR QB 1 17 VAL H 3.650 . 5.500 4.508 4.258 4.637 . 0 0 "[ . 1 . 2]" 1 471 1 17 VAL H 1 18 VAL H 3.650 . 5.500 4.268 4.214 4.341 . 0 0 "[ . 1 . 2]" 1 472 1 9 TYR H 1 17 VAL H 3.150 . 4.500 4.169 4.036 4.288 . 0 0 "[ . 1 . 2]" 1 473 1 16 ALA H 1 48 TYR QE 4.150 . 6.500 4.698 4.318 5.339 . 0 0 "[ . 1 . 2]" 1 474 1 16 ALA H 1 48 TYR QD 3.650 . 5.500 4.120 3.868 4.735 . 0 0 "[ . 1 . 2]" 1 475 1 16 ALA H 1 28 ILE MG 3.650 . 5.500 4.917 4.821 5.006 . 0 0 "[ . 1 . 2]" 1 476 1 16 ALA H 1 28 ILE MD 3.650 . 5.500 4.522 4.402 4.693 . 0 0 "[ . 1 . 2]" 1 477 1 16 ALA H 1 18 VAL QG 3.650 . 5.500 4.754 4.636 4.882 . 0 0 "[ . 1 . 2]" 1 478 1 16 ALA H 1 30 ARG QD 4.150 . 6.500 5.545 5.214 5.852 . 0 0 "[ . 1 . 2]" 1 479 1 15 LYS HE2 1 16 ALA H 3.650 . 5.500 5.294 5.087 5.507 0.007 14 0 "[ . 1 . 2]" 1 480 1 7 ILE HG13 1 39 GLN H 3.650 . 5.500 5.285 5.115 5.468 . 0 0 "[ . 1 . 2]" 1 481 1 7 ILE HG12 1 39 GLN H 3.650 . 5.500 4.078 3.881 4.396 . 0 0 "[ . 1 . 2]" 1 482 1 19 LEU MD1 1 26 LEU H 3.650 . 5.500 4.998 4.841 5.197 . 0 0 "[ . 1 . 2]" 1 483 1 26 LEU H 1 28 ILE MG 3.650 . 5.500 4.674 4.493 4.868 . 0 0 "[ . 1 . 2]" 1 484 1 24 GLU HB3 1 26 LEU H 3.650 . 5.500 4.872 4.724 5.155 . 0 0 "[ . 1 . 2]" 1 485 1 24 GLU HA 1 26 LEU H 4.150 . 6.500 5.716 5.631 5.834 . 0 0 "[ . 1 . 2]" 1 486 1 25 PHE QE 1 26 LEU H 4.150 . 6.500 6.414 6.321 6.463 . 0 0 "[ . 1 . 2]" 1 487 1 26 LEU H 1 27 ILE H 3.650 . 5.500 4.454 4.384 4.494 . 0 0 "[ . 1 . 2]" 1 488 1 25 PHE H 1 26 LEU H 3.150 . 4.500 4.253 4.174 4.362 . 0 0 "[ . 1 . 2]" 1 489 1 8 ILE MD 1 30 ARG H 3.650 . 5.500 4.931 4.724 5.049 . 0 0 "[ . 1 . 2]" 1 490 1 14 MET ME 1 30 ARG H 3.650 . 5.500 4.377 3.569 5.212 . 0 0 "[ . 1 . 2]" 1 491 1 14 MET HB3 1 30 ARG H 3.150 . 4.500 3.837 3.489 4.037 . 0 0 "[ . 1 . 2]" 1 492 1 29 ARG QD 1 30 ARG H 3.650 . 5.500 5.085 4.296 5.360 . 0 0 "[ . 1 . 2]" 1 493 1 14 MET HA 1 30 ARG H 3.150 . 4.500 3.996 3.739 4.221 . 0 0 "[ . 1 . 2]" 1 494 1 28 ILE HA 1 30 ARG H 4.150 . 6.500 5.966 5.804 6.080 . 0 0 "[ . 1 . 2]" 1 495 1 30 ARG H 1 48 TYR QE 3.650 . 5.500 3.650 3.136 4.261 . 0 0 "[ . 1 . 2]" 1 496 1 30 ARG H 1 48 TYR QD 3.650 . 5.500 4.903 4.423 5.258 . 0 0 "[ . 1 . 2]" 1 497 1 11 ILE H 1 16 ALA HA 3.650 . 5.500 4.919 4.807 5.012 . 0 0 "[ . 1 . 2]" 1 498 1 51 ARG H 1 51 ARG QD 3.650 . 5.500 4.363 2.595 5.353 . 0 0 "[ . 1 . 2]" 1 499 1 8 ILE H 1 36 VAL HA 3.650 . 5.500 4.575 4.459 4.719 . 0 0 "[ . 1 . 2]" 1 500 1 8 ILE H 1 9 TYR H 3.650 . 5.500 4.229 4.184 4.285 . 0 0 "[ . 1 . 2]" 1 501 1 8 ILE H 1 37 GLY HA2 3.650 . 5.500 4.866 4.634 5.086 . 0 0 "[ . 1 . 2]" 1 502 1 8 ILE H 1 9 TYR QB 3.650 . 5.500 5.390 5.303 5.500 0.000 8 0 "[ . 1 . 2]" 1 503 1 8 ILE H 1 37 GLY HA3 3.650 . 5.500 4.508 4.449 4.609 . 0 0 "[ . 1 . 2]" 1 504 1 6 GLY HA3 1 8 ILE H 4.150 . 6.500 5.683 5.590 5.814 . 0 0 "[ . 1 . 2]" 1 505 1 13 GLY HA3 1 14 MET H 3.150 . 4.500 2.144 2.088 2.181 . 0 0 "[ . 1 . 2]" 1 506 1 13 GLY HA2 1 14 MET H 3.650 . 5.500 3.362 3.230 3.412 . 0 0 "[ . 1 . 2]" 1 507 1 31 ARG H 1 34 MET H 3.150 . 4.500 3.893 3.590 4.158 . 0 0 "[ . 1 . 2]" 1 508 1 53 LYS H 1 53 LYS QG 3.650 . 5.500 3.533 1.967 4.546 . 0 0 "[ . 1 . 2]" 1 509 1 28 ILE MD 1 31 ARG H 3.650 . 5.500 4.398 4.140 4.739 . 0 0 "[ . 1 . 2]" 1 510 1 31 ARG H 1 32 LYS HA 3.650 . 5.500 5.248 5.098 5.375 . 0 0 "[ . 1 . 2]" 1 511 1 6 GLY HA2 1 19 LEU H 3.150 . 4.500 4.523 4.497 4.543 0.043 8 0 "[ . 1 . 2]" 1 512 1 19 LEU H 1 25 PHE QE 4.150 . 6.500 5.410 5.183 5.597 . 0 0 "[ . 1 . 2]" 1 513 1 19 LEU H 1 25 PHE HA 3.650 . 5.500 4.534 4.452 4.630 . 0 0 "[ . 1 . 2]" 1 514 1 10 GLU H 1 19 LEU H 3.650 . 5.500 5.436 5.307 5.524 0.024 5 0 "[ . 1 . 2]" 1 515 1 9 TYR QE 1 19 LEU H 3.650 . 5.500 5.089 5.008 5.188 . 0 0 "[ . 1 . 2]" 1 516 1 18 VAL H 1 19 LEU H 3.150 . 4.500 4.315 4.272 4.355 . 0 0 "[ . 1 . 2]" 1 517 1 18 VAL H 1 25 PHE HA 3.150 . 4.500 4.228 4.091 4.362 . 0 0 "[ . 1 . 2]" 1 518 1 18 VAL H 1 25 PHE QD 3.650 . 5.500 4.919 4.762 5.046 . 0 0 "[ . 1 . 2]" 1 519 1 18 VAL H 1 25 PHE HB2 4.150 . 6.500 6.118 5.936 6.227 . 0 0 "[ . 1 . 2]" 1 520 1 9 TYR HB2 1 18 VAL H 3.650 . 5.500 5.362 5.121 5.512 0.012 2 0 "[ . 1 . 2]" 1 521 1 8 ILE HA 1 18 VAL H 3.650 . 5.500 4.949 4.872 5.015 . 0 0 "[ . 1 . 2]" 1 522 1 16 ALA H 1 18 VAL H 3.650 . 5.500 4.165 4.116 4.237 . 0 0 "[ . 1 . 2]" 1 523 1 18 VAL H 1 28 ILE MG 3.650 . 4.500 3.847 3.660 4.023 . 0 0 "[ . 1 . 2]" 1 524 1 18 VAL H 1 28 ILE MD 3.650 . 5.500 4.600 4.435 4.806 . 0 0 "[ . 1 . 2]" 1 525 1 12 GLN H 1 30 ARG QD 3.150 . 4.500 4.392 4.127 4.534 0.034 9 0 "[ . 1 . 2]" 1 526 1 12 GLN H 1 13 GLY HA2 3.650 . 5.500 5.130 5.046 5.300 . 0 0 "[ . 1 . 2]" 1 527 1 12 GLN H 1 13 GLY HA3 3.650 . 5.500 5.033 4.896 5.100 . 0 0 "[ . 1 . 2]" 1 528 1 12 GLN H 1 15 LYS HE3 4.150 . 6.500 6.426 5.016 6.609 0.109 13 0 "[ . 1 . 2]" 1 529 1 15 LYS QD 1 48 TYR H 4.150 . 6.500 4.629 4.436 4.791 . 0 0 "[ . 1 . 2]" 1 530 1 28 ILE HB 1 48 TYR H 3.150 . 4.500 4.342 4.180 4.522 0.022 11 0 "[ . 1 . 2]" 1 531 1 48 TYR H 1 48 TYR QE 3.650 . 5.500 5.044 4.766 5.322 . 0 0 "[ . 1 . 2]" 1 532 1 47 ILE H 1 48 TYR H 3.650 . 5.500 4.323 3.820 4.477 . 0 0 "[ . 1 . 2]" 1 533 1 27 ILE H 1 48 TYR H 3.650 . 5.500 4.475 4.217 4.825 . 0 0 "[ . 1 . 2]" 1 534 1 9 TYR H 1 9 TYR QD 3.150 . 4.500 4.152 4.082 4.197 . 0 0 "[ . 1 . 2]" 1 535 1 9 TYR H 1 26 LEU H 3.650 . 5.500 4.676 4.625 4.727 . 0 0 "[ . 1 . 2]" 1 536 1 9 TYR H 1 18 VAL QG 3.150 . 4.500 3.758 3.592 3.901 . 0 0 "[ . 1 . 2]" 1 537 1 7 ILE HG13 1 9 TYR H 3.650 . 5.500 5.385 5.304 5.427 . 0 0 "[ . 1 . 2]" 1 538 1 7 ILE HG12 1 9 TYR H 4.150 . 6.500 5.104 4.951 5.246 . 0 0 "[ . 1 . 2]" 1 539 1 8 ILE HG12 1 9 TYR H 3.650 . 5.500 4.302 4.185 4.471 . 0 0 "[ . 1 . 2]" 1 540 1 8 ILE HB 1 9 TYR H 3.150 . 4.500 4.286 4.209 4.319 . 0 0 "[ . 1 . 2]" 1 541 1 9 TYR H 1 36 VAL HA 3.650 . 5.500 5.122 4.840 5.315 . 0 0 "[ . 1 . 2]" 1 542 1 9 TYR H 1 17 VAL HB 3.650 . 5.500 3.523 3.325 3.743 . 0 0 "[ . 1 . 2]" 1 543 1 9 TYR H 1 10 GLU HA 3.650 . 5.500 4.720 4.671 4.765 . 0 0 "[ . 1 . 2]" 1 544 1 8 ILE HA 1 9 TYR H 2.300 . 2.800 2.016 1.969 2.063 . 0 0 "[ . 1 . 2]" 1 545 1 9 TYR H 1 9 TYR QE 4.150 . 6.500 6.184 6.119 6.229 . 0 0 "[ . 1 . 2]" 1 546 1 15 LYS HA 1 48 TYR H 3.650 . 5.500 4.887 4.758 4.966 . 0 0 "[ . 1 . 2]" 1 547 1 19 LEU H 1 19 LEU MD1 3.650 . 5.500 4.260 4.235 4.287 . 0 0 "[ . 1 . 2]" 1 548 1 6 GLY HA3 1 19 LEU H 3.150 . 4.500 4.031 3.950 4.144 . 0 0 "[ . 1 . 2]" 1 549 1 18 VAL HA 1 19 LEU H 2.300 . 2.800 2.046 2.028 2.082 . 0 0 "[ . 1 . 2]" 1 550 1 9 TYR QD 1 19 LEU H 3.150 . 4.500 4.474 4.210 4.534 0.034 18 0 "[ . 1 . 2]" 1 551 1 8 ILE MD 1 31 ARG H 3.150 . 4.500 4.364 4.140 4.505 0.005 4 0 "[ . 1 . 2]" 1 552 1 8 ILE HG13 1 31 ARG H 3.150 . 4.500 4.134 3.980 4.295 . 0 0 "[ . 1 . 2]" 1 553 1 31 ARG H 1 34 MET HG2 3.150 . 4.500 2.997 2.505 4.081 . 0 0 "[ . 1 . 2]" 1 554 1 30 ARG QD 1 31 ARG H 3.150 . 4.500 4.540 4.499 4.609 0.109 3 0 "[ . 1 . 2]" 1 555 1 31 ARG H 1 31 ARG HD3 3.650 . 5.500 4.865 3.065 5.175 . 0 0 "[ . 1 . 2]" 1 556 1 31 ARG H 1 33 ASP HA 3.650 . 5.500 4.858 4.651 5.157 . 0 0 "[ . 1 . 2]" 1 557 1 30 ARG H 1 31 ARG H 3.150 . 4.500 4.405 4.317 4.501 0.001 18 0 "[ . 1 . 2]" 1 558 1 31 ARG H 1 33 ASP H 3.650 . 5.500 4.577 4.055 4.983 . 0 0 "[ . 1 . 2]" 1 559 1 16 ALA H 1 31 ARG H 4.150 . 6.500 6.427 6.243 6.512 0.012 6 0 "[ . 1 . 2]" 1 560 1 53 LYS H 1 53 LYS HB2 3.150 . 4.500 3.015 2.215 3.763 . 0 0 "[ . 1 . 2]" 1 561 1 8 ILE H 1 18 VAL MG1 3.650 . 5.500 3.628 3.413 3.822 . 0 0 "[ . 1 . 2]" 1 562 1 8 ILE H 1 34 MET HB3 4.150 . 6.500 5.172 5.069 5.349 . 0 0 "[ . 1 . 2]" 1 563 1 9 TYR HB3 1 11 ILE H 4.150 . 6.500 6.439 6.356 6.515 0.015 5 0 "[ . 1 . 2]" 1 564 1 11 ILE H 1 16 ALA MB 3.650 . 5.500 5.475 5.302 5.532 0.032 2 0 "[ . 1 . 2]" 1 565 1 10 GLU H 1 11 ILE H 3.150 . 4.500 4.276 4.180 4.310 . 0 0 "[ . 1 . 2]" 1 566 1 11 ILE H 1 12 GLN H 3.150 . 4.500 4.368 4.278 4.430 . 0 0 "[ . 1 . 2]" 1 567 1 14 MET HG3 1 30 ARG H 4.150 . 6.500 6.030 5.817 6.208 . 0 0 "[ . 1 . 2]" 1 568 1 16 ALA H 1 30 ARG H 3.150 . 4.500 3.841 3.690 3.991 . 0 0 "[ . 1 . 2]" 1 569 1 25 PHE QD 1 26 LEU H 3.150 . 4.500 4.498 4.340 4.541 0.041 12 0 "[ . 1 . 2]" 1 570 1 12 GLN HG3 1 16 ALA H 3.650 . 5.500 5.217 4.774 5.416 . 0 0 "[ . 1 . 2]" 1 571 1 11 ILE HA 1 16 ALA H 3.650 . 5.500 4.972 4.864 5.067 . 0 0 "[ . 1 . 2]" 1 572 1 16 ALA H 1 28 ILE HA 3.650 . 5.500 4.607 4.550 4.657 . 0 0 "[ . 1 . 2]" 1 573 1 15 LYS H 1 16 ALA H 3.150 . 4.500 4.343 4.267 4.393 . 0 0 "[ . 1 . 2]" 1 574 1 12 GLN H 1 17 VAL H 3.650 . 5.500 4.355 4.119 4.617 . 0 0 "[ . 1 . 2]" 1 575 1 38 GLN H 1 39 GLN H 3.150 . 4.500 4.261 4.086 4.347 . 0 0 "[ . 1 . 2]" 1 576 1 39 GLN H 1 40 VAL H 3.150 . 4.500 4.402 4.357 4.494 . 0 0 "[ . 1 . 2]" 1 577 1 38 GLN HA 1 40 VAL H 4.150 . 6.500 5.898 5.749 6.082 . 0 0 "[ . 1 . 2]" 1 578 1 6 GLY HA3 1 40 VAL H 3.650 . 5.500 4.444 4.372 4.541 . 0 0 "[ . 1 . 2]" 1 579 1 12 GLN QG 1 15 LYS H 3.650 . 5.500 5.304 4.955 5.553 0.053 9 0 "[ . 1 . 2]" 1 580 1 14 MET HB3 1 15 LYS H 3.150 . 4.500 4.056 3.659 4.200 . 0 0 "[ . 1 . 2]" 1 581 1 14 MET HG3 1 15 LYS H 4.150 . 6.500 5.430 4.981 5.756 . 0 0 "[ . 1 . 2]" 1 582 1 15 LYS H 1 30 ARG QD 3.150 . 4.500 4.165 3.854 4.508 0.008 20 0 "[ . 1 . 2]" 1 583 1 13 GLY HA2 1 15 LYS H 3.150 . 4.500 4.361 4.258 4.508 0.008 10 0 "[ . 1 . 2]" 1 584 1 15 LYS H 1 29 ARG HA 3.650 . 5.500 5.065 4.751 5.236 . 0 0 "[ . 1 . 2]" 1 585 1 11 ILE HA 1 15 LYS H 3.650 . 5.500 5.190 4.900 5.397 . 0 0 "[ . 1 . 2]" 1 586 1 15 LYS H 1 48 TYR QD 4.150 . 6.500 6.061 5.605 6.539 0.039 15 0 "[ . 1 . 2]" 1 587 1 15 LYS H 1 30 ARG H 3.150 . 4.500 4.370 4.155 4.501 0.001 11 0 "[ . 1 . 2]" 1 588 1 20 THR H 1 25 PHE H 3.650 . 5.500 4.891 4.821 4.953 . 0 0 "[ . 1 . 2]" 1 589 1 4 ARG H 1 5 LEU MD2 3.150 . 4.500 4.453 4.147 4.521 0.021 4 0 "[ . 1 . 2]" 1 590 1 2 MET QB 1 4 ARG H 3.650 . 5.500 5.359 4.987 5.548 0.048 4 0 "[ . 1 . 2]" 1 591 1 4 ARG H 1 44 ASN H 4.150 . 6.500 4.845 4.189 5.180 . 0 0 "[ . 1 . 2]" 1 592 1 4 ARG H 1 43 GLU H 3.650 . 5.500 4.736 4.595 4.923 . 0 0 "[ . 1 . 2]" 1 593 1 2 MET QB 1 44 ASN H 3.150 . 4.500 3.414 2.348 4.568 0.068 19 0 "[ . 1 . 2]" 1 594 1 43 GLU H 1 44 ASN H 3.150 . 4.500 4.419 4.345 4.501 0.001 11 0 "[ . 1 . 2]" 1 595 1 4 ARG HB2 1 42 PHE H 3.150 . 4.500 4.447 4.358 4.542 0.042 15 0 "[ . 1 . 2]" 1 596 1 4 ARG HB3 1 42 PHE H 3.650 . 5.500 3.942 3.657 4.188 . 0 0 "[ . 1 . 2]" 1 597 1 5 LEU HB3 1 42 PHE H 3.650 . 5.500 4.934 4.708 5.101 . 0 0 "[ . 1 . 2]" 1 598 1 42 PHE H 1 43 GLU QG 3.650 . 5.500 5.291 4.717 5.550 0.050 16 0 "[ . 1 . 2]" 1 599 1 4 ARG HD2 1 42 PHE H 4.150 . 6.500 5.589 5.386 5.969 . 0 0 "[ . 1 . 2]" 1 600 1 3 ASN HA 1 42 PHE H 3.150 . 4.500 4.253 3.945 4.519 0.019 5 0 "[ . 1 . 2]" 1 601 1 3 ASN HD22 1 42 PHE H 3.650 . 5.500 3.890 3.713 4.114 . 0 0 "[ . 1 . 2]" 1 602 1 3 ASN HD21 1 42 PHE H 3.650 . 5.500 3.536 3.001 4.113 . 0 0 "[ . 1 . 2]" 1 603 1 40 VAL H 1 42 PHE H 3.150 . 4.500 4.239 4.179 4.283 . 0 0 "[ . 1 . 2]" 1 604 1 18 VAL QG 1 29 ARG H 3.650 . 5.500 5.408 5.282 5.469 . 0 0 "[ . 1 . 2]" 1 605 1 15 LYS QD 1 29 ARG H 3.650 . 5.500 5.408 5.159 5.532 0.032 10 0 "[ . 1 . 2]" 1 606 1 29 ARG H 1 34 MET ME 3.650 . 5.500 5.147 4.714 5.505 0.005 16 0 "[ . 1 . 2]" 1 607 1 29 ARG H 1 30 ARG H 3.150 . 4.500 4.502 4.404 4.535 0.035 1 0 "[ . 1 . 2]" 1 608 1 16 ALA H 1 29 ARG H 3.150 . 4.500 3.724 3.582 3.870 . 0 0 "[ . 1 . 2]" 1 609 1 29 ARG H 1 48 TYR HB2 3.150 . 4.500 4.540 4.501 4.584 0.084 1 0 "[ . 1 . 2]" 1 610 1 35 LYS H 1 35 LYS QE 3.650 . 5.500 4.489 3.245 5.105 . 0 0 "[ . 1 . 2]" 1 611 1 35 LYS H 1 36 VAL H 3.150 . 4.500 4.351 4.253 4.446 . 0 0 "[ . 1 . 2]" 1 612 1 7 ILE H 1 9 TYR QD 4.150 . 6.500 5.700 5.509 5.896 . 0 0 "[ . 1 . 2]" 1 613 1 7 ILE H 1 9 TYR H 3.650 . 5.500 5.442 5.344 5.520 0.020 8 0 "[ . 1 . 2]" 1 614 1 15 LYS QD 1 28 ILE H 3.150 . 4.500 4.315 4.174 4.442 . 0 0 "[ . 1 . 2]" 1 615 1 27 ILE HB 1 28 ILE H 3.150 . 4.500 4.103 3.963 4.177 . 0 0 "[ . 1 . 2]" 1 616 1 20 THR H 1 24 GLU HA 3.650 . 5.500 4.684 4.554 4.773 . 0 0 "[ . 1 . 2]" 1 617 1 20 THR H 1 21 SER HA 4.150 . 6.500 5.735 5.623 5.804 . 0 0 "[ . 1 . 2]" 1 618 1 5 LEU H 1 22 GLU HG3 4.150 . 6.500 5.498 4.813 5.991 . 0 0 "[ . 1 . 2]" 1 619 1 3 ASN QB 1 5 LEU H 3.650 . 5.500 5.396 5.108 5.525 0.025 8 0 "[ . 1 . 2]" 1 620 1 5 LEU H 1 41 SER QB 4.150 . 6.500 6.104 5.768 6.499 . 0 0 "[ . 1 . 2]" 1 621 1 3 ASN HA 1 5 LEU H 3.650 . 5.500 4.940 4.816 5.081 . 0 0 "[ . 1 . 2]" 1 622 1 5 LEU H 1 41 SER HA 3.650 . 5.500 5.051 4.855 5.277 . 0 0 "[ . 1 . 2]" 1 623 1 4 ARG HE 1 5 LEU H 3.650 . 5.500 3.999 2.343 4.849 . 0 0 "[ . 1 . 2]" 1 624 1 5 LEU H 1 42 PHE H 3.650 . 5.500 5.065 4.902 5.194 . 0 0 "[ . 1 . 2]" 1 625 1 28 ILE MG 1 47 ILE H 3.650 . 5.500 3.794 3.633 4.008 . 0 0 "[ . 1 . 2]" 1 626 1 28 ILE MD 1 47 ILE H 4.150 . 6.500 5.773 5.547 6.086 . 0 0 "[ . 1 . 2]" 1 627 1 28 ILE HB 1 47 ILE H 3.650 . 5.500 4.232 4.101 4.553 . 0 0 "[ . 1 . 2]" 1 628 1 43 GLU QG 1 47 ILE H 4.150 . 6.500 5.813 5.565 6.034 . 0 0 "[ . 1 . 2]" 1 629 1 44 ASN QB 1 47 ILE H 3.650 . 5.500 4.618 4.329 4.845 . 0 0 "[ . 1 . 2]" 1 630 1 20 THR H 1 26 LEU MD1 3.650 . 5.500 3.574 3.367 3.939 . 0 0 "[ . 1 . 2]" 1 631 1 19 LEU HB3 1 20 THR H 3.650 . 5.500 4.406 4.370 4.435 . 0 0 "[ . 1 . 2]" 1 632 1 20 THR H 1 22 GLU HB2 3.150 . 4.500 3.714 3.515 3.995 . 0 0 "[ . 1 . 2]" 1 633 1 20 THR H 1 24 GLU QG 3.650 . 5.500 5.046 4.687 5.357 . 0 0 "[ . 1 . 2]" 1 634 1 20 THR H 1 22 GLU HB3 4.150 . 6.500 5.954 5.449 6.391 . 0 0 "[ . 1 . 2]" 1 635 1 20 THR H 1 22 GLU H 3.650 . 5.500 4.485 4.257 4.734 . 0 0 "[ . 1 . 2]" 1 636 1 7 ILE H 1 20 THR H 3.650 . 5.500 4.447 4.373 4.527 . 0 0 "[ . 1 . 2]" 1 637 1 28 ILE H 1 29 ARG H 3.650 . 5.500 4.391 4.315 4.422 . 0 0 "[ . 1 . 2]" 1 638 1 7 ILE H 1 7 ILE HG12 2.650 . 3.500 3.191 3.081 3.302 . 0 0 "[ . 1 . 2]" 1 639 1 7 ILE H 1 8 ILE HA 3.650 . 5.500 4.736 4.622 4.851 . 0 0 "[ . 1 . 2]" 1 640 1 6 GLY HA3 1 7 ILE H 2.300 . 2.800 2.759 2.726 2.785 . 0 0 "[ . 1 . 2]" 1 641 1 35 LYS H 1 35 LYS HB2 2.650 . 3.500 2.419 2.367 2.542 . 0 0 "[ . 1 . 2]" 1 642 1 8 ILE MG 1 38 GLN H 3.150 . 4.500 4.417 4.286 4.529 0.029 17 0 "[ . 1 . 2]" 1 643 1 22 GLU HB3 1 24 GLU H 3.650 . 5.500 4.213 3.837 4.618 . 0 0 "[ . 1 . 2]" 1 644 1 19 LEU HG 1 24 GLU H 3.650 . 5.500 4.635 4.304 5.097 . 0 0 "[ . 1 . 2]" 1 645 1 19 LEU MD2 1 24 GLU H 4.150 . 6.500 5.585 5.319 5.955 . 0 0 "[ . 1 . 2]" 1 646 1 22 GLU HG2 1 24 GLU H 4.150 . 6.500 5.681 4.193 6.498 . 0 0 "[ . 1 . 2]" 1 647 1 22 GLU H 1 24 GLU H 3.150 . 4.500 3.553 3.328 3.763 . 0 0 "[ . 1 . 2]" 1 648 1 21 SER H 1 24 GLU H 3.650 . 5.500 4.880 4.785 4.948 . 0 0 "[ . 1 . 2]" 1 649 1 41 SER QB 1 43 GLU H 4.150 . 6.500 6.018 5.646 6.478 . 0 0 "[ . 1 . 2]" 1 650 1 4 ARG HA 1 43 GLU H 4.150 . 6.500 6.279 6.052 6.503 0.003 16 0 "[ . 1 . 2]" 1 651 1 8 ILE HG13 1 34 MET H 4.150 . 6.500 5.145 4.825 5.698 . 0 0 "[ . 1 . 2]" 1 652 1 30 ARG HE 1 34 MET H 3.650 . 5.500 3.808 3.371 4.523 . 0 0 "[ . 1 . 2]" 1 653 1 28 ILE MD 1 46 ASP H 4.150 . 6.500 5.887 5.661 6.217 . 0 0 "[ . 1 . 2]" 1 654 1 4 ARG HG2 1 22 GLU H 3.150 . 4.500 3.874 3.714 4.109 . 0 0 "[ . 1 . 2]" 1 655 1 5 LEU HB3 1 22 GLU H 4.150 . 6.500 6.458 6.240 6.533 0.033 14 0 "[ . 1 . 2]" 1 656 1 28 ILE HB 1 46 ASP H 3.650 . 5.500 5.297 5.133 5.509 0.009 6 0 "[ . 1 . 2]" 1 657 1 22 GLU H 1 24 GLU QG 3.650 . 5.500 4.558 4.118 5.051 . 0 0 "[ . 1 . 2]" 1 658 1 44 ASN QB 1 46 ASP H 3.650 . 5.500 4.570 4.393 4.729 . 0 0 "[ . 1 . 2]" 1 659 1 42 PHE HA 1 46 ASP H 4.150 . 6.500 5.895 5.692 6.226 . 0 0 "[ . 1 . 2]" 1 660 1 42 PHE QD 1 46 ASP H 3.650 . 5.500 4.086 3.734 4.532 . 0 0 "[ . 1 . 2]" 1 661 1 5 LEU HB3 1 21 SER H 3.650 . 5.500 4.301 4.138 4.513 . 0 0 "[ . 1 . 2]" 1 662 1 6 GLY HA3 1 21 SER H 3.150 . 4.500 4.433 4.241 4.519 0.019 7 0 "[ . 1 . 2]" 1 663 1 5 LEU H 1 21 SER H 3.650 . 5.500 3.647 3.456 3.786 . 0 0 "[ . 1 . 2]" 1 664 1 41 SER H 1 42 PHE H 3.150 . 4.500 4.268 4.195 4.356 . 0 0 "[ . 1 . 2]" 1 665 1 5 LEU HA 1 41 SER H 3.650 . 5.500 5.002 4.849 5.180 . 0 0 "[ . 1 . 2]" 1 666 1 33 ASP H 1 34 MET HG2 4.150 . 6.500 6.045 5.698 6.556 0.056 19 0 "[ . 1 . 2]" 1 667 1 30 ARG QD 1 33 ASP H 4.150 . 6.500 5.188 4.019 5.897 . 0 0 "[ . 1 . 2]" 1 668 1 8 ILE MD 1 10 GLU H 2.650 . 3.500 3.128 3.030 3.217 . 0 0 "[ . 1 . 2]" 1 669 1 8 ILE HG13 1 10 GLU H 3.150 . 4.500 4.321 4.206 4.450 . 0 0 "[ . 1 . 2]" 1 670 1 9 TYR QD 1 10 GLU H 3.150 . 4.500 3.990 3.772 4.098 . 0 0 "[ . 1 . 2]" 1 671 1 8 ILE H 1 10 GLU H 3.650 . 5.500 5.464 5.409 5.525 0.025 9 0 "[ . 1 . 2]" 1 672 1 10 GLU H 1 28 ILE H 3.650 . 5.500 5.321 5.138 5.405 . 0 0 "[ . 1 . 2]" 1 673 1 10 GLU H 1 18 VAL H 3.650 . 5.500 5.433 5.340 5.503 0.003 19 0 "[ . 1 . 2]" 1 674 1 17 VAL HB 1 37 GLY H 3.650 . 5.500 5.043 4.920 5.192 . 0 0 "[ . 1 . 2]" 1 675 1 10 GLU H 1 37 GLY H 3.650 . 5.500 5.436 5.221 5.521 0.021 17 0 "[ . 1 . 2]" 1 676 1 49 ASN HB3 1 49 ASN HD22 3.650 . 5.500 3.570 3.418 4.044 . 0 0 "[ . 1 . 2]" 1 677 1 7 ILE HA 1 39 GLN HE21 3.650 . 5.500 4.304 3.775 4.602 . 0 0 "[ . 1 . 2]" 1 678 1 8 ILE HG12 1 38 GLN HE21 3.650 . 5.500 3.685 2.056 4.096 . 0 0 "[ . 1 . 2]" 1 679 1 12 GLN HB2 1 12 GLN HE21 3.650 . 5.500 3.309 1.917 4.449 . 0 0 "[ . 1 . 2]" 1 680 1 10 GLU HB3 1 12 GLN HE21 3.650 . 5.500 3.407 2.576 3.826 . 0 0 "[ . 1 . 2]" 1 681 1 35 LYS HB2 1 38 GLN HE21 3.650 . 5.500 3.669 1.887 4.592 . 0 0 "[ . 1 . 2]" 1 682 1 12 GLN HB3 1 12 GLN HE22 3.650 . 5.500 4.989 4.657 5.165 . 0 0 "[ . 1 . 2]" 1 683 1 10 GLU HG3 1 12 GLN HE22 3.150 . 4.500 4.137 3.688 4.558 0.058 19 0 "[ . 1 . 2]" 1 684 1 12 GLN HA 1 12 GLN HE21 3.650 . 5.500 3.066 2.116 4.875 . 0 0 "[ . 1 . 2]" 1 685 1 38 GLN HA 1 38 GLN HE21 4.150 . 6.500 5.772 5.001 5.972 . 0 0 "[ . 1 . 2]" 1 686 1 11 ILE HA 1 12 GLN HE21 3.650 . 5.500 4.347 3.565 5.056 . 0 0 "[ . 1 . 2]" 1 687 1 6 GLY H 1 28 ILE MD 3.650 . 5.500 5.428 5.217 5.522 0.022 8 0 "[ . 1 . 2]" 1 688 1 28 ILE MD 1 48 TYR H 4.150 . 6.500 5.810 5.700 5.941 . 0 0 "[ . 1 . 2]" 1 689 1 29 ARG HA 1 48 TYR H 4.150 . 6.500 5.702 5.470 5.912 . 0 0 "[ . 1 . 2]" 1 690 1 46 ASP H 1 48 TYR H 4.150 . 6.500 6.467 6.332 6.574 0.074 18 0 "[ . 1 . 2]" 1 691 1 8 ILE MG 1 18 VAL H 3.650 . 5.500 4.848 4.609 4.997 . 0 0 "[ . 1 . 2]" 1 692 1 18 VAL H 1 20 THR MG 3.150 . 4.500 3.566 3.449 3.700 . 0 0 "[ . 1 . 2]" 1 693 1 17 VAL HB 1 18 VAL H 3.150 . 4.500 4.248 4.188 4.328 . 0 0 "[ . 1 . 2]" 1 694 1 9 TYR H 1 18 VAL H 3.650 . 5.500 4.667 4.608 4.717 . 0 0 "[ . 1 . 2]" 1 695 1 19 LEU H 1 20 THR MG 3.650 . 5.500 4.759 4.621 4.899 . 0 0 "[ . 1 . 2]" 1 696 1 19 LEU H 1 21 SER H 4.150 . 6.500 6.188 6.078 6.265 . 0 0 "[ . 1 . 2]" 1 697 1 17 VAL HB 1 26 LEU H 4.150 . 6.500 5.654 5.544 5.751 . 0 0 "[ . 1 . 2]" 1 698 1 19 LEU H 1 26 LEU H 3.650 . 5.500 4.873 4.809 4.939 . 0 0 "[ . 1 . 2]" 1 699 1 7 ILE HB 1 39 GLN H 4.150 . 6.500 6.388 6.201 6.515 0.015 17 0 "[ . 1 . 2]" 1 700 1 17 VAL H 1 18 VAL QG 3.650 . 5.500 4.172 4.074 4.325 . 0 0 "[ . 1 . 2]" 1 701 1 15 LYS QD 1 17 VAL H 3.650 . 5.500 5.511 5.413 5.576 0.076 8 0 "[ . 1 . 2]" 1 702 1 11 ILE HG12 1 17 VAL H 3.150 . 4.500 4.432 4.262 4.526 0.026 17 0 "[ . 1 . 2]" 1 703 1 8 ILE HG12 1 17 VAL H 3.650 . 5.500 5.409 5.313 5.508 0.008 19 0 "[ . 1 . 2]" 1 704 1 32 LYS H 1 32 LYS QD 3.650 . 5.500 3.678 1.736 4.341 0.064 4 0 "[ . 1 . 2]" 1 705 1 18 VAL MG2 1 27 ILE H 3.650 . 5.500 4.426 4.299 4.572 . 0 0 "[ . 1 . 2]" 1 706 1 4 ARG H 1 4 ARG QG 3.150 . 4.500 4.181 4.058 4.333 . 0 0 "[ . 1 . 2]" 1 707 1 3 ASN QB 1 4 ARG H 3.150 . 4.500 2.901 2.420 3.160 . 0 0 "[ . 1 . 2]" 1 708 1 3 ASN HA 1 4 ARG H 2.300 . 2.800 2.102 1.954 2.287 . 0 0 "[ . 1 . 2]" 1 709 1 4 ARG H 1 5 LEU HA 3.650 . 5.500 4.708 4.458 4.823 . 0 0 "[ . 1 . 2]" 1 710 1 4 ARG QG 1 42 PHE H 3.650 . 5.500 4.990 4.768 5.208 . 0 0 "[ . 1 . 2]" 1 711 1 34 MET ME 1 42 PHE H 3.650 . 5.500 4.557 4.295 4.798 . 0 0 "[ . 1 . 2]" 1 712 1 2 MET QB 1 3 ASN H 3.150 . 4.500 3.448 2.583 4.005 . 0 0 "[ . 1 . 2]" 1 713 1 28 ILE HG13 1 29 ARG H 3.150 . 4.500 3.542 3.355 3.682 . 0 0 "[ . 1 . 2]" 1 714 1 29 ARG H 1 29 ARG QB 2.300 . 2.800 2.398 2.102 2.512 . 0 0 "[ . 1 . 2]" 1 715 1 17 VAL HB 1 28 ILE H 4.150 . 6.500 5.485 5.194 5.638 . 0 0 "[ . 1 . 2]" 1 716 1 28 ILE H 1 48 TYR HB2 3.650 . 5.500 4.315 4.116 4.519 . 0 0 "[ . 1 . 2]" 1 717 1 5 LEU H 1 22 GLU H 4.150 . 6.500 5.943 5.532 6.309 . 0 0 "[ . 1 . 2]" 1 718 1 5 LEU H 1 39 GLN HE21 4.150 . 6.500 5.862 5.042 6.526 0.026 11 0 "[ . 1 . 2]" 1 719 1 44 ASN HD21 1 47 ILE H 4.150 . 6.500 5.898 4.949 6.561 0.061 2 0 "[ . 1 . 2]" 1 720 1 47 ILE H 1 49 ASN H 3.650 . 5.500 5.436 4.848 5.601 0.101 5 0 "[ . 1 . 2]" 1 721 1 44 ASN H 1 47 ILE H 3.150 . 4.500 3.858 3.720 3.995 . 0 0 "[ . 1 . 2]" 1 722 1 43 GLU H 1 47 ILE H 3.650 . 5.500 5.183 4.913 5.499 . 0 0 "[ . 1 . 2]" 1 723 1 8 ILE HG13 1 38 GLN H 3.150 . 4.500 4.310 4.141 4.504 0.004 18 0 "[ . 1 . 2]" 1 724 1 8 ILE HA 1 38 GLN H 4.150 . 6.500 5.701 5.498 5.849 . 0 0 "[ . 1 . 2]" 1 725 1 34 MET ME 1 43 GLU H 3.650 . 5.500 4.495 4.154 4.763 . 0 0 "[ . 1 . 2]" 1 726 1 27 ILE HG12 1 28 ILE H 3.150 . 4.500 3.731 3.710 3.759 . 0 0 "[ . 1 . 2]" 1 727 1 3 ASN QB 1 43 GLU H 4.150 . 6.500 5.876 5.439 6.150 . 0 0 "[ . 1 . 2]" 1 728 1 42 PHE HB3 1 43 GLU H 2.650 . 3.500 3.562 3.525 3.610 0.110 4 0 "[ . 1 . 2]" 1 729 1 20 THR HA 1 22 GLU H 3.150 . 4.500 3.907 3.765 4.142 . 0 0 "[ . 1 . 2]" 1 730 1 18 VAL H 1 20 THR H 4.150 . 6.500 5.757 5.659 5.929 . 0 0 "[ . 1 . 2]" 1 731 1 18 VAL H 1 28 ILE H 3.150 . 4.500 4.046 3.891 4.150 . 0 0 "[ . 1 . 2]" 1 732 1 20 THR H 1 21 SER H 3.650 . 5.500 4.601 4.570 4.641 . 0 0 "[ . 1 . 2]" 1 733 1 26 LEU H 1 27 ILE H 3.150 . 4.500 3.683 3.647 3.716 . 0 0 "[ . 1 . 2]" 1 734 1 6 GLY H 1 39 GLN HE21 3.650 . 5.500 4.659 3.833 5.507 0.007 8 0 "[ . 1 . 2]" 1 735 1 8 ILE H 1 38 GLN HE21 3.650 . 5.500 5.259 4.732 5.577 0.077 12 0 "[ . 1 . 2]" 1 736 1 12 GLN H 1 16 ALA H 3.650 . 5.500 4.479 4.359 4.682 . 0 0 "[ . 1 . 2]" 1 737 1 27 ILE H 1 28 ILE H 3.650 . 5.500 4.299 4.210 4.359 . 0 0 "[ . 1 . 2]" 1 738 1 7 ILE H 1 8 ILE H 3.150 . 4.500 4.415 4.370 4.473 . 0 0 "[ . 1 . 2]" 1 739 1 3 ASN HD22 1 4 ARG H 3.650 . 5.500 4.239 3.865 4.613 . 0 0 "[ . 1 . 2]" 1 740 1 4 ARG HE 1 22 GLU H 3.650 . 5.500 4.921 3.984 5.527 0.027 4 0 "[ . 1 . 2]" 1 741 1 9 TYR QD 1 17 VAL H 4.150 . 6.500 5.881 5.545 6.121 . 0 0 "[ . 1 . 2]" 1 742 1 3 ASN HD21 1 42 PHE QD 4.150 . 6.500 5.218 4.828 5.770 . 0 0 "[ . 1 . 2]" 1 743 1 24 GLU H 1 25 PHE QD 4.150 . 6.500 5.574 5.392 5.717 . 0 0 "[ . 1 . 2]" 1 744 1 20 THR H 1 42 PHE HZ 3.650 . 5.500 5.291 5.097 5.484 . 0 0 "[ . 1 . 2]" 1 745 1 28 ILE HA 1 48 TYR H 2.300 . 2.800 2.131 2.010 2.262 . 0 0 "[ . 1 . 2]" 1 746 1 20 THR HB 1 22 GLU H 2.650 . 3.500 2.413 2.201 2.735 . 0 0 "[ . 1 . 2]" 1 747 1 7 ILE HA 1 8 ILE H 2.300 . 2.800 2.132 2.091 2.148 . 0 0 "[ . 1 . 2]" 1 748 1 17 VAL HA 1 18 VAL H 2.300 . 2.800 2.129 2.101 2.157 . 0 0 "[ . 1 . 2]" 1 749 1 15 LYS HA 1 16 ALA H 2.300 . 2.800 2.311 2.209 2.420 . 0 0 "[ . 1 . 2]" 1 750 1 10 GLU HA 1 11 ILE H 2.300 . 2.800 2.293 2.185 2.334 . 0 0 "[ . 1 . 2]" 1 751 1 24 GLU HA 1 25 PHE H 2.300 . 2.800 2.266 2.223 2.322 . 0 0 "[ . 1 . 2]" 1 752 1 19 LEU HA 1 26 LEU H 3.150 . 4.500 3.692 3.573 3.776 . 0 0 "[ . 1 . 2]" 1 753 1 8 ILE HA 1 17 VAL H 3.650 . 5.500 4.500 4.361 4.592 . 0 0 "[ . 1 . 2]" 1 754 1 5 LEU H 1 21 SER HB3 3.650 . 5.500 5.090 4.190 5.531 0.031 3 0 "[ . 1 . 2]" 1 755 1 46 ASP H 1 46 ASP HB2 2.650 . 3.500 2.423 2.350 2.509 . 0 0 "[ . 1 . 2]" 1 756 1 48 TYR HB3 1 49 ASN H 2.650 . 3.500 3.212 2.868 3.350 . 0 0 "[ . 1 . 2]" 1 757 1 4 ARG HD3 1 5 LEU H 3.650 . 5.500 4.644 4.078 5.003 . 0 0 "[ . 1 . 2]" 1 758 1 42 PHE H 1 42 PHE HB3 3.150 . 4.500 3.281 3.190 3.407 . 0 0 "[ . 1 . 2]" 1 759 1 27 ILE H 1 48 TYR HB2 3.650 . 5.500 4.639 4.344 4.935 . 0 0 "[ . 1 . 2]" 1 760 1 3 ASN QB 1 3 ASN HD22 3.150 . 4.500 3.149 2.941 3.282 . 0 0 "[ . 1 . 2]" 1 761 1 34 MET ME 1 40 VAL H 2.650 . 3.500 3.432 3.378 3.485 . 0 0 "[ . 1 . 2]" 1 762 1 35 LYS H 1 38 GLN QG 2.650 . 3.500 2.769 2.372 3.156 . 0 0 "[ . 1 . 2]" 1 763 1 3 ASN H 1 43 GLU QG 3.650 . 5.500 4.340 3.841 4.977 . 0 0 "[ . 1 . 2]" 1 764 1 8 ILE HB 1 17 VAL H 4.150 . 6.500 6.458 6.207 6.527 0.027 10 0 "[ . 1 . 2]" 1 765 1 45 GLU QB 1 46 ASP H 2.650 . 3.500 2.989 2.566 3.330 . 0 0 "[ . 1 . 2]" 1 766 1 10 GLU HB2 1 17 VAL H 3.150 . 4.500 4.343 4.075 4.532 0.032 10 0 "[ . 1 . 2]" 1 767 1 15 LYS HB3 1 16 ALA H 3.150 . 4.500 2.602 2.425 2.748 . 0 0 "[ . 1 . 2]" 1 768 1 18 VAL H 1 18 VAL HB 3.150 . 4.500 3.684 3.614 3.753 . 0 0 "[ . 1 . 2]" 1 769 1 5 LEU HB3 1 40 VAL H 3.150 . 4.500 4.266 4.174 4.405 . 0 0 "[ . 1 . 2]" 1 770 1 7 ILE HG12 1 8 ILE H 3.150 . 4.500 4.364 4.300 4.460 . 0 0 "[ . 1 . 2]" 1 771 1 30 ARG HE 1 30 ARG HG3 3.650 . 5.500 2.572 2.380 2.715 . 0 0 "[ . 1 . 2]" 1 772 1 35 LYS H 1 35 LYS QG 3.150 . 4.500 2.928 2.451 3.845 . 0 0 "[ . 1 . 2]" 1 773 1 28 ILE H 1 28 ILE HG13 2.650 . 3.500 2.862 2.692 3.001 . 0 0 "[ . 1 . 2]" 1 774 1 11 ILE H 1 12 GLN H 3.150 . 4.500 3.316 3.261 3.448 . 0 0 "[ . 1 . 2]" 1 775 1 27 ILE H 1 42 PHE QE 4.150 . 6.500 5.890 5.650 6.075 . 0 0 "[ . 1 . 2]" 1 776 1 29 ARG HE 1 47 ILE H 4.150 . 6.500 5.418 4.333 6.322 . 0 0 "[ . 1 . 2]" 1 777 1 16 ALA H 1 28 ILE H 2.300 . 2.800 2.757 2.706 2.842 0.042 8 0 "[ . 1 . 2]" 1 778 1 27 ILE HA 1 28 ILE H 2.300 . 2.800 2.130 2.101 2.164 . 0 0 "[ . 1 . 2]" 1 779 1 9 TYR H 1 17 VAL MG2 3.150 . 4.500 4.113 3.943 4.268 . 0 0 "[ . 1 . 2]" 1 780 1 11 ILE MG 1 12 GLN H 2.300 . 2.800 2.518 2.393 2.653 . 0 0 "[ . 1 . 2]" 1 781 1 7 ILE HB 1 18 VAL H 4.150 . 6.500 5.782 5.732 5.831 . 0 0 "[ . 1 . 2]" 1 782 1 8 ILE MD 1 18 VAL H 3.150 . 4.500 2.849 2.734 2.934 . 0 0 "[ . 1 . 2]" 1 783 1 16 ALA MB 1 18 VAL H 3.150 . 4.500 3.539 3.374 3.688 . 0 0 "[ . 1 . 2]" 1 784 1 8 ILE H 1 8 ILE HG12 2.300 . 2.800 2.120 2.043 2.173 . 0 0 "[ . 1 . 2]" 1 785 1 9 TYR HA 1 11 ILE H 3.650 . 5.500 4.768 4.657 4.872 . 0 0 "[ . 1 . 2]" 1 786 1 10 GLU HG3 1 11 ILE H 2.650 . 3.500 2.786 2.005 3.147 . 0 0 "[ . 1 . 2]" 1 787 1 38 GLN HA 1 39 GLN H 2.300 . 2.800 2.249 2.165 2.326 . 0 0 "[ . 1 . 2]" 1 788 1 4 ARG H 1 42 PHE QD 3.650 . 5.500 3.903 3.641 4.147 . 0 0 "[ . 1 . 2]" 1 789 1 8 ILE HB 1 10 GLU H 3.650 . 5.500 4.969 4.815 5.056 . 0 0 "[ . 1 . 2]" 1 790 1 21 SER HB2 1 23 GLY H 3.650 . 5.500 5.225 5.101 5.495 . 0 0 "[ . 1 . 2]" 1 791 1 20 THR HB 1 23 GLY H 3.650 . 5.500 3.982 3.746 4.281 . 0 0 "[ . 1 . 2]" 1 792 1 14 MET H 1 14 MET HB2 3.650 . 5.500 2.456 2.340 2.568 . 0 0 "[ . 1 . 2]" 1 793 1 35 LYS H 1 35 LYS HB3 2.650 . 3.500 3.588 3.549 3.625 0.125 19 0 "[ . 1 . 2]" 1 794 1 16 ALA MB 1 29 ARG H 3.150 . 4.500 4.304 4.195 4.386 . 0 0 "[ . 1 . 2]" 1 795 1 8 ILE H 1 8 ILE MG 3.150 . 4.500 3.796 3.771 3.807 . 0 0 "[ . 1 . 2]" 1 796 1 26 LEU H 1 26 LEU MD1 2.650 . 3.500 2.825 2.637 3.013 . 0 0 "[ . 1 . 2]" 1 797 1 7 ILE H 1 21 SER H 3.650 . 5.500 4.931 4.706 5.092 . 0 0 "[ . 1 . 2]" 1 798 1 6 GLY H 1 7 ILE H 3.150 . 4.500 3.869 3.831 3.890 . 0 0 "[ . 1 . 2]" 1 799 1 36 VAL H 1 37 GLY HA2 4.150 . 6.500 6.247 6.199 6.304 . 0 0 "[ . 1 . 2]" 1 800 1 5 LEU HB3 1 6 GLY H 2.650 . 3.500 3.130 2.919 3.297 . 0 0 "[ . 1 . 2]" 1 801 1 11 ILE MD 1 31 ARG H 4.150 . 6.500 4.593 4.265 4.772 . 0 0 "[ . 1 . 2]" 1 802 1 27 ILE MD 1 28 ILE H 2.650 . 3.500 2.816 2.686 2.914 . 0 0 "[ . 1 . 2]" 1 803 1 43 GLU HB2 1 46 ASP H 3.150 . 4.500 3.046 2.645 3.371 . 0 0 "[ . 1 . 2]" 1 804 1 39 GLN QG 1 40 VAL H 2.650 . 3.500 2.819 2.599 3.058 . 0 0 "[ . 1 . 2]" 1 805 1 14 MET HG2 1 15 LYS H 3.650 . 5.500 4.606 4.092 4.858 . 0 0 "[ . 1 . 2]" 1 806 1 8 ILE MG 1 11 ILE H 3.150 . 4.500 3.660 3.525 3.744 . 0 0 "[ . 1 . 2]" 1 807 1 4 ARG HG2 1 5 LEU H 3.150 . 4.500 3.443 2.688 3.651 . 0 0 "[ . 1 . 2]" 1 808 1 3 ASN H 1 3 ASN HD22 3.650 . 5.500 4.937 4.517 5.438 . 0 0 "[ . 1 . 2]" 1 809 1 12 GLN H 1 15 LYS QD 3.150 . 4.500 4.218 4.114 4.389 . 0 0 "[ . 1 . 2]" 1 810 1 31 ARG H 1 31 ARG HD2 3.650 . 5.500 4.060 2.605 4.439 . 0 0 "[ . 1 . 2]" 1 811 1 16 ALA H 1 28 ILE HG13 3.150 . 4.500 3.076 2.932 3.248 . 0 0 "[ . 1 . 2]" 1 812 1 8 ILE MG 1 36 VAL H 2.650 . 3.500 3.398 3.270 3.526 0.026 10 0 "[ . 1 . 2]" 1 813 1 4 ARG HD2 1 5 LEU H 3.650 . 5.500 3.714 3.132 5.072 . 0 0 "[ . 1 . 2]" 1 814 1 22 GLU H 1 22 GLU HG2 3.150 . 4.500 3.482 1.824 4.055 . 0 0 "[ . 1 . 2]" 1 815 1 45 GLU H 1 45 GLU HG2 2.650 . 3.500 3.460 3.206 3.640 0.140 15 0 "[ . 1 . 2]" 1 816 1 33 ASP H 1 33 ASP HA 2.650 . 3.500 2.904 2.861 2.954 . 0 0 "[ . 1 . 2]" 1 817 1 31 ARG HB2 1 33 ASP H 3.150 . 4.500 2.969 2.274 3.826 . 0 0 "[ . 1 . 2]" 1 818 1 8 ILE MG 1 37 GLY H 2.650 . 3.500 3.188 2.990 3.369 . 0 0 "[ . 1 . 2]" 1 819 1 6 GLY H 1 42 PHE QD 3.150 . 4.500 3.422 3.089 3.772 . 0 0 "[ . 1 . 2]" 1 820 1 6 GLY H 1 39 GLN HG2 3.150 . 4.500 3.181 2.787 3.576 . 0 0 "[ . 1 . 2]" 1 821 1 19 LEU H 1 25 PHE QD 3.650 . 5.500 4.659 4.449 4.850 . 0 0 "[ . 1 . 2]" 1 822 1 8 ILE MG 1 17 VAL H 2.650 . 3.500 3.075 2.954 3.186 . 0 0 "[ . 1 . 2]" 1 823 1 19 LEU HA 1 24 GLU H 3.150 . 4.500 3.931 3.780 4.182 . 0 0 "[ . 1 . 2]" 1 824 1 7 ILE H 1 20 THR HA 2.650 . 3.500 3.332 3.267 3.421 . 0 0 "[ . 1 . 2]" 1 825 1 43 GLU H 1 46 ASP HB3 3.150 . 4.500 3.970 3.615 4.504 0.004 16 0 "[ . 1 . 2]" 1 826 1 43 GLU HB3 1 46 ASP H 3.150 . 4.500 3.439 3.010 3.700 . 0 0 "[ . 1 . 2]" 1 827 1 43 GLU HA 1 45 GLU H 3.650 . 5.500 3.990 3.710 4.312 . 0 0 "[ . 1 . 2]" 1 828 1 2 MET HB3 1 44 ASN HD22 3.650 . 5.500 2.982 2.339 4.495 . 0 0 "[ . 1 . 2]" 1 829 1 3 ASN H 1 43 GLU HB3 3.650 . 5.500 5.546 5.335 5.617 0.117 20 0 "[ . 1 . 2]" 1 830 1 2 MET QG 1 3 ASN H 3.150 . 4.500 4.268 3.753 4.519 0.019 20 0 "[ . 1 . 2]" 1 831 1 4 ARG H 1 4 ARG HD2 3.150 . 4.500 4.476 4.041 4.608 0.108 12 0 "[ . 1 . 2]" 1 832 1 5 LEU H 1 5 LEU HB3 3.650 . 5.500 3.694 3.666 3.739 . 0 0 "[ . 1 . 2]" 1 833 1 5 LEU H 1 5 LEU HB2 3.650 . 5.500 2.539 2.475 2.599 . 0 0 "[ . 1 . 2]" 1 834 1 26 LEU QB 1 27 ILE H 3.150 . 4.500 2.805 2.608 2.893 . 0 0 "[ . 1 . 2]" 1 835 1 6 GLY HA2 1 20 THR HA 3.650 . 5.500 1.920 1.877 1.982 . 0 0 "[ . 1 . 2]" 1 836 1 14 MET HA 1 30 ARG QD 3.150 . 4.500 2.873 2.251 3.340 . 0 0 "[ . 1 . 2]" 1 837 1 30 ARG HB3 1 30 ARG QD 2.300 . 2.800 2.002 1.936 2.043 . 0 0 "[ . 1 . 2]" 1 838 1 30 ARG HB2 1 30 ARG QD 2.300 . 2.800 2.680 2.474 2.797 . 0 0 "[ . 1 . 2]" 1 839 1 4 ARG QG 1 5 LEU HB3 3.650 . 5.500 5.444 5.255 5.564 0.064 18 0 "[ . 1 . 2]" 1 840 1 6 GLY HA2 1 18 VAL QG 3.150 . 4.500 4.035 3.832 4.148 . 0 0 "[ . 1 . 2]" 1 841 1 7 ILE MG 1 37 GLY HA2 3.150 . 4.500 2.972 2.669 3.104 . 0 0 "[ . 1 . 2]" 1 842 1 11 ILE MG 1 30 ARG QD 2.650 . 3.500 2.146 2.020 2.309 . 0 0 "[ . 1 . 2]" 1 843 1 5 LEU HB3 1 5 LEU QD 2.650 . 3.500 2.112 2.093 2.123 . 0 0 "[ . 1 . 2]" 1 844 1 5 LEU HB2 1 5 LEU MD1 2.650 . 3.500 2.315 2.269 2.348 . 0 0 "[ . 1 . 2]" 1 845 1 26 LEU QB 1 26 LEU MD2 2.650 . 3.500 2.073 2.033 2.098 . 0 0 "[ . 1 . 2]" 1 846 1 18 VAL QG 1 26 LEU QB 3.150 . 4.500 1.993 1.863 2.144 . 0 0 "[ . 1 . 2]" 1 847 1 19 LEU MD1 1 23 GLY HA3 3.150 . 4.500 3.503 3.318 3.799 . 0 0 "[ . 1 . 2]" 1 848 1 19 LEU MD1 1 23 GLY HA2 3.150 . 4.500 2.307 2.135 2.582 . 0 0 "[ . 1 . 2]" 1 849 1 19 LEU H 1 19 LEU HB3 3.150 . 4.500 2.326 2.263 2.350 . 0 0 "[ . 1 . 2]" 1 850 1 28 ILE HB 1 29 ARG H 2.300 . 2.800 2.298 2.195 2.413 . 0 0 "[ . 1 . 2]" 1 851 1 28 ILE HA 1 28 ILE HB 2.650 . 3.500 2.447 2.425 2.469 . 0 0 "[ . 1 . 2]" 1 852 1 9 TYR HA 1 9 TYR HB3 2.650 . 3.500 3.009 2.992 3.018 . 0 0 "[ . 1 . 2]" 1 853 1 9 TYR HA 1 9 TYR HB2 2.650 . 3.500 2.541 2.502 2.571 . 0 0 "[ . 1 . 2]" 1 854 1 31 ARG HB3 1 31 ARG HD3 3.150 . 4.500 2.524 1.966 3.735 . 0 0 "[ . 1 . 2]" 1 855 1 31 ARG HB3 1 31 ARG HD2 3.150 . 4.500 2.431 2.118 2.861 . 0 0 "[ . 1 . 2]" 1 856 1 9 TYR HB3 1 17 VAL HB 3.650 . 4.500 2.601 2.401 2.818 . 0 0 "[ . 1 . 2]" 1 857 1 31 ARG HB2 1 31 ARG HD3 2.300 . 2.800 2.243 2.076 2.295 . 0 0 "[ . 1 . 2]" 1 858 1 29 ARG QD 1 29 ARG HG3 2.300 . 2.800 2.353 2.168 2.468 . 0 0 "[ . 1 . 2]" 1 859 1 4 ARG HD2 1 4 ARG QG 2.650 . 3.500 2.397 2.262 2.537 . 0 0 "[ . 1 . 2]" 1 860 1 4 ARG HD3 1 4 ARG QG 2.650 . 3.500 2.269 2.114 2.402 . 0 0 "[ . 1 . 2]" 1 861 1 28 ILE HB 1 46 ASP HB3 3.650 . 5.500 2.479 2.110 2.743 . 0 0 "[ . 1 . 2]" 1 862 1 32 LYS QE 1 32 LYS QG 2.650 . 3.500 2.268 2.105 2.706 . 0 0 "[ . 1 . 2]" 1 863 1 15 LYS HE2 1 15 LYS HG2 3.650 . 5.500 2.897 2.419 3.725 . 0 0 "[ . 1 . 2]" 1 864 1 19 LEU HB3 1 19 LEU HG 2.650 . 3.500 2.495 2.460 2.545 . 0 0 "[ . 1 . 2]" 1 865 1 28 ILE HB 1 28 ILE HG12 2.650 . 3.500 3.019 2.997 3.030 . 0 0 "[ . 1 . 2]" 1 866 1 4 ARG HB2 1 4 ARG HD2 3.150 . 4.500 2.609 2.116 3.035 . 0 0 "[ . 1 . 2]" 1 867 1 4 ARG HB2 1 4 ARG HD3 3.650 . 5.500 2.637 2.215 3.428 . 0 0 "[ . 1 . 2]" 1 868 1 9 TYR HB3 1 17 VAL MG2 3.150 . 4.500 3.871 3.727 4.044 . 0 0 "[ . 1 . 2]" 1 869 1 9 TYR HB2 1 17 VAL MG2 3.650 . 5.500 4.777 4.619 4.919 . 0 0 "[ . 1 . 2]" 1 870 1 8 ILE MG 1 9 TYR HB3 3.650 . 5.500 3.821 3.625 4.057 . 0 0 "[ . 1 . 2]" 1 871 1 9 TYR HB2 1 19 LEU HB2 3.650 . 5.500 2.686 2.486 2.981 . 0 0 "[ . 1 . 2]" 1 872 1 15 LYS HE2 1 15 LYS HG3 3.650 . 5.500 3.122 2.270 3.753 . 0 0 "[ . 1 . 2]" 1 873 1 15 LYS HE3 1 15 LYS HG3 3.650 . 5.500 2.617 2.359 3.566 . 0 0 "[ . 1 . 2]" 1 874 1 19 LEU HB3 1 19 LEU MD2 2.650 . 3.500 2.296 2.213 2.336 . 0 0 "[ . 1 . 2]" 1 875 1 28 ILE HB 1 28 ILE MD 2.300 . 2.800 2.344 2.279 2.381 . 0 0 "[ . 1 . 2]" 1 876 1 19 LEU HB2 1 19 LEU MD2 2.650 . 3.500 2.402 2.357 2.485 . 0 0 "[ . 1 . 2]" 1 877 1 19 LEU HB2 1 19 LEU MD1 3.150 . 3.500 2.343 2.280 2.398 . 0 0 "[ . 1 . 2]" 1 878 1 3 ASN QB 1 4 ARG H 2.650 . 3.500 2.297 2.122 2.400 . 0 0 "[ . 1 . 2]" 1 879 1 42 PHE HB2 1 42 PHE QD 2.650 . 2.800 2.341 2.321 2.375 . 0 0 "[ . 1 . 2]" 1 880 1 42 PHE HB3 1 42 PHE QD 2.650 . 2.800 2.472 2.419 2.506 . 0 0 "[ . 1 . 2]" 1 881 1 25 PHE HB3 1 25 PHE QD 3.150 . 4.500 2.304 2.266 2.342 . 0 0 "[ . 1 . 2]" 1 882 1 25 PHE HB2 1 25 PHE QD 3.150 . 4.500 2.475 2.411 2.524 . 0 0 "[ . 1 . 2]" 1 883 1 48 TYR HB3 1 48 TYR QD 2.650 . 3.500 2.646 2.317 2.768 . 0 0 "[ . 1 . 2]" 1 884 1 48 TYR HB2 1 48 TYR QD 2.650 . 3.500 2.268 2.202 2.471 . 0 0 "[ . 1 . 2]" 1 885 1 25 PHE HA 1 25 PHE HB2 2.650 . 3.500 3.046 3.033 3.063 . 0 0 "[ . 1 . 2]" 1 886 1 42 PHE HA 1 42 PHE HB2 . . 2.800 2.498 2.465 2.532 . 0 0 "[ . 1 . 2]" 1 887 1 42 PHE HA 1 42 PHE HB3 2.650 . 2.800 2.407 2.389 2.435 . 0 0 "[ . 1 . 2]" 1 888 1 7 ILE HA 1 7 ILE HB 2.650 . 3.500 3.031 3.022 3.042 . 0 0 "[ . 1 . 2]" 1 889 1 49 ASN HA 1 49 ASN HB3 2.650 . 3.500 2.519 2.435 2.599 . 0 0 "[ . 1 . 2]" 1 890 1 3 ASN HA 1 3 ASN QB 2.300 . 2.800 2.443 2.403 2.502 . 0 0 "[ . 1 . 2]" 1 891 1 48 TYR HA 1 48 TYR HB3 2.650 . 2.800 2.736 2.683 2.821 0.021 15 0 "[ . 1 . 2]" 1 892 1 48 TYR HA 1 48 TYR HB2 2.650 . 3.500 2.931 2.866 2.965 . 0 0 "[ . 1 . 2]" 1 893 1 10 GLU HA 1 11 ILE HB 2.650 . 3.500 2.987 2.976 2.992 . 0 0 "[ . 1 . 2]" 1 894 1 7 ILE HB 1 7 ILE HG13 2.650 . 3.500 2.548 2.518 2.595 . 0 0 "[ . 1 . 2]" 1 895 1 7 ILE HB 1 7 ILE HG12 2.650 . 3.500 3.018 3.009 3.026 . 0 0 "[ . 1 . 2]" 1 896 1 11 ILE HB 1 11 ILE HG12 2.300 . 2.800 2.475 2.439 2.510 . 0 0 "[ . 1 . 2]" 1 897 1 28 ILE MD 1 42 PHE HB3 3.650 . 5.500 2.579 2.375 2.962 . 0 0 "[ . 1 . 2]" 1 898 1 17 VAL MG2 1 25 PHE HB3 3.650 . 4.500 4.334 4.267 4.382 . 0 0 "[ . 1 . 2]" 1 899 1 17 VAL MG2 1 25 PHE HB2 3.650 . 5.500 5.510 5.448 5.531 0.031 1 0 "[ . 1 . 2]" 1 900 1 27 ILE MG 1 48 TYR HB3 2.650 . 3.500 3.199 2.930 3.438 . 0 0 "[ . 1 . 2]" 1 901 1 27 ILE MG 1 48 TYR HB2 2.650 . 3.500 2.456 2.286 2.689 . 0 0 "[ . 1 . 2]" 1 902 1 7 ILE HB 1 7 ILE MD 2.300 . 2.800 1.982 1.965 1.992 . 0 0 "[ . 1 . 2]" 1 903 1 44 ASN H 1 44 ASN QB 2.650 . 3.500 2.212 2.130 2.340 . 0 0 "[ . 1 . 2]" 1 904 1 27 ILE H 1 27 ILE HB 2.650 . 3.500 2.583 2.532 2.685 . 0 0 "[ . 1 . 2]" 1 905 1 47 ILE H 1 47 ILE HB 2.650 . 3.500 2.614 2.482 2.734 . 0 0 "[ . 1 . 2]" 1 906 1 44 ASN HA 1 44 ASN QB 2.300 . 2.800 2.489 2.422 2.538 . 0 0 "[ . 1 . 2]" 1 907 1 22 GLU HA 1 22 GLU HG2 2.650 . 3.500 3.141 2.562 3.566 0.066 15 0 "[ . 1 . 2]" 1 908 1 22 GLU HA 1 22 GLU HG3 3.150 . 4.500 2.900 2.288 4.013 . 0 0 "[ . 1 . 2]" 1 909 1 45 GLU HA 1 45 GLU HG3 3.150 . 3.500 2.885 2.387 3.284 . 0 0 "[ . 1 . 2]" 1 910 1 10 GLU HA 1 10 GLU HG3 3.650 . 5.500 2.585 2.408 3.189 . 0 0 "[ . 1 . 2]" 1 911 1 27 ILE HB 1 48 TYR HB3 3.150 . 4.500 3.393 3.035 3.696 . 0 0 "[ . 1 . 2]" 1 912 1 27 ILE HB 1 48 TYR HB2 3.150 . 4.500 2.878 2.603 3.038 . 0 0 "[ . 1 . 2]" 1 913 1 45 GLU QB 1 45 GLU HG3 2.300 . 2.800 2.385 2.312 2.492 . 0 0 "[ . 1 . 2]" 1 914 1 45 GLU QB 1 45 GLU HG2 2.300 . 2.800 2.259 2.076 2.358 . 0 0 "[ . 1 . 2]" 1 915 1 22 GLU HB2 1 22 GLU HG2 2.650 . 3.500 2.763 2.432 3.021 . 0 0 "[ . 1 . 2]" 1 916 1 22 GLU HB2 1 22 GLU HG3 2.650 . 3.500 2.674 2.374 2.988 . 0 0 "[ . 1 . 2]" 1 917 1 10 GLU HB2 1 10 GLU HG3 2.650 . 3.500 2.498 2.384 3.002 . 0 0 "[ . 1 . 2]" 1 918 1 44 ASN QB 1 47 ILE MD 3.650 . 5.500 3.117 2.586 3.536 . 0 0 "[ . 1 . 2]" 1 919 1 27 ILE HB 1 27 ILE HG12 2.650 . 3.500 2.464 2.443 2.498 . 0 0 "[ . 1 . 2]" 1 920 1 47 ILE HB 1 47 ILE MD 2.300 . 2.800 1.995 1.974 2.016 . 0 0 "[ . 1 . 2]" 1 921 1 27 ILE HB 1 27 ILE MG 2.300 . 2.800 2.128 2.122 2.139 . 0 0 "[ . 1 . 2]" 1 922 1 8 ILE HB 1 37 GLY H 2.300 . 2.800 2.235 2.070 2.341 . 0 0 "[ . 1 . 2]" 1 923 1 8 ILE H 1 38 GLN QG 3.650 . 5.500 3.353 3.178 4.001 . 0 0 "[ . 1 . 2]" 1 924 1 15 LYS H 1 15 LYS HB3 3.650 . 5.500 3.723 3.668 3.762 . 0 0 "[ . 1 . 2]" 1 925 1 8 ILE HB 1 35 LYS H 3.150 . 4.500 2.963 2.825 3.057 . 0 0 "[ . 1 . 2]" 1 926 1 38 GLN H 1 38 GLN QG 2.300 . 2.800 1.951 1.790 2.089 0.010 19 0 "[ . 1 . 2]" 1 927 1 7 ILE HA 1 39 GLN HG3 3.150 . 4.500 2.510 2.350 2.638 . 0 0 "[ . 1 . 2]" 1 928 1 39 GLN HA 1 39 GLN HG2 2.650 . 3.500 2.972 2.691 3.172 . 0 0 "[ . 1 . 2]" 1 929 1 40 VAL HA 1 40 VAL HB 2.300 . 2.800 2.470 2.427 2.527 . 0 0 "[ . 1 . 2]" 1 930 1 18 VAL HA 1 18 VAL HB 2.650 . 3.500 2.525 2.472 2.567 . 0 0 "[ . 1 . 2]" 1 931 1 34 MET HA 1 34 MET HG3 . . 3.500 2.384 2.312 2.473 . 0 0 "[ . 1 . 2]" 1 932 1 43 GLU HA 1 43 GLU QG 3.150 . 4.500 2.359 2.234 2.529 . 0 0 "[ . 1 . 2]" 1 933 1 34 MET HA 1 34 MET HG2 2.650 . 3.500 3.293 3.015 3.502 0.002 17 0 "[ . 1 . 2]" 1 934 1 37 GLY HA3 1 38 GLN QG 2.650 . 3.500 3.301 3.262 3.328 . 0 0 "[ . 1 . 2]" 1 935 1 24 GLU HA 1 24 GLU QG 2.650 . 3.500 2.782 2.389 3.040 . 0 0 "[ . 1 . 2]" 1 936 1 10 GLU HA 1 10 GLU HB2 . . 2.800 2.555 2.494 2.619 . 0 0 "[ . 1 . 2]" 1 937 1 35 LYS HA 1 35 LYS HB3 2.650 . 3.500 2.487 2.363 2.633 . 0 0 "[ . 1 . 2]" 1 938 1 8 ILE HB 1 36 VAL HA 2.650 . 3.500 2.104 2.011 2.200 . 0 0 "[ . 1 . 2]" 1 939 1 34 MET ME 1 34 MET HG3 3.150 . 4.500 2.488 2.356 2.559 . 0 0 "[ . 1 . 2]" 1 940 1 43 GLU HB2 1 43 GLU QG 2.300 . 2.800 2.320 2.151 2.471 . 0 0 "[ . 1 . 2]" 1 941 1 39 GLN HB2 1 39 GLN HG3 2.650 . 3.500 2.415 2.338 2.513 . 0 0 "[ . 1 . 2]" 1 942 1 39 GLN HB2 1 39 GLN HG2 2.650 . 3.500 3.003 2.990 3.015 . 0 0 "[ . 1 . 2]" 1 943 1 22 GLU HB2 1 24 GLU QG 2.300 . 2.800 1.950 1.792 2.043 0.008 6 0 "[ . 1 . 2]" 1 944 1 8 ILE HG12 1 34 MET HG3 2.650 . 3.500 2.816 2.459 2.898 . 0 0 "[ . 1 . 2]" 1 945 1 8 ILE HB 1 8 ILE HG13 2.650 . 3.500 2.425 2.403 2.480 . 0 0 "[ . 1 . 2]" 1 946 1 8 ILE HG12 1 38 GLN QG 2.650 . 3.500 2.424 2.280 2.733 . 0 0 "[ . 1 . 2]" 1 947 1 35 LYS HB3 1 35 LYS QG 2.650 . 2.800 2.277 2.149 2.367 . 0 0 "[ . 1 . 2]" 1 948 1 35 LYS HB2 1 35 LYS QG 2.300 . 2.800 2.401 2.322 2.502 . 0 0 "[ . 1 . 2]" 1 949 1 8 ILE MD 1 34 MET HG3 3.650 . 5.500 1.893 1.779 2.058 0.021 20 0 "[ . 1 . 2]" 1 950 1 7 ILE MG 1 8 ILE HB 2.650 . 3.500 2.940 2.915 2.961 . 0 0 "[ . 1 . 2]" 1 951 1 8 ILE HB 1 8 ILE MG 2.300 . 2.800 2.139 2.130 2.149 . 0 0 "[ . 1 . 2]" 1 952 1 5 LEU QD 1 39 GLN HG2 2.650 . 3.500 3.070 2.638 3.494 . 0 0 "[ . 1 . 2]" 1 953 1 8 ILE MD 1 34 MET HG2 3.150 . 4.500 2.042 1.910 2.920 . 0 0 "[ . 1 . 2]" 1 954 1 15 LYS HB3 1 27 ILE MG 3.650 . 4.500 2.288 2.108 2.471 . 0 0 "[ . 1 . 2]" 1 955 1 15 LYS HB2 1 27 ILE MD 2.650 . 3.500 3.263 3.035 3.438 . 0 0 "[ . 1 . 2]" 1 956 1 8 ILE MD 1 18 VAL HB 3.150 . 4.500 3.529 3.429 3.637 . 0 0 "[ . 1 . 2]" 1 957 1 43 GLU HB3 1 44 ASN H 3.150 . 4.500 2.002 1.737 2.198 0.063 4 0 "[ . 1 . 2]" 1 958 1 36 VAL H 1 36 VAL HB 2.300 . 2.800 2.677 2.615 2.801 0.001 9 0 "[ . 1 . 2]" 1 959 1 12 GLN HA 1 12 GLN HG2 3.650 . 5.500 3.370 2.678 3.754 . 0 0 "[ . 1 . 2]" 1 960 1 24 GLU HA 1 24 GLU HB3 . . 2.800 2.465 2.408 2.528 . 0 0 "[ . 1 . 2]" 1 961 1 32 LYS HA 1 32 LYS HB3 2.650 . 3.500 2.473 2.402 2.554 . 0 0 "[ . 1 . 2]" 1 962 1 30 ARG HB3 1 30 ARG QD 3.150 . 4.500 2.199 2.097 2.281 . 0 0 "[ . 1 . 2]" 1 963 1 14 MET HB2 1 14 MET HG2 2.300 . 2.800 2.233 2.153 2.326 . 0 0 "[ . 1 . 2]" 1 964 1 12 GLN HB2 1 12 GLN HG2 2.650 . 3.500 2.659 2.349 2.995 . 0 0 "[ . 1 . 2]" 1 965 1 12 GLN HB3 1 12 GLN HG2 2.300 . 2.800 2.302 2.220 2.939 0.139 16 0 "[ . 1 . 2]" 1 966 1 24 GLU HB2 1 24 GLU QG 2.300 . 2.800 2.198 2.140 2.355 . 0 0 "[ . 1 . 2]" 1 967 1 32 LYS HB3 1 32 LYS QG 2.650 . 3.500 2.311 2.147 2.395 . 0 0 "[ . 1 . 2]" 1 968 1 32 LYS HB2 1 32 LYS QG 2.650 . 3.500 2.339 2.163 2.472 . 0 0 "[ . 1 . 2]" 1 969 1 8 ILE MG 1 36 VAL HB 3.650 . 5.500 4.059 3.969 4.201 . 0 0 "[ . 1 . 2]" 1 970 1 38 GLN QB 1 39 GLN H 3.150 . 4.500 2.621 2.329 2.841 . 0 0 "[ . 1 . 2]" 1 971 1 39 GLN H 1 39 GLN HB3 3.150 . 4.500 2.552 2.450 2.670 . 0 0 "[ . 1 . 2]" 1 972 1 12 GLN H 1 12 GLN HB3 2.650 . 3.500 2.550 2.432 2.693 . 0 0 "[ . 1 . 2]" 1 973 1 29 ARG H 1 29 ARG QB 2.650 . 3.500 2.459 2.108 2.612 . 0 0 "[ . 1 . 2]" 1 974 1 38 GLN HA 1 38 GLN QB 2.650 . 2.800 2.171 2.120 2.185 . 0 0 "[ . 1 . 2]" 1 975 1 22 GLU HA 1 22 GLU HB3 2.650 . 3.500 2.417 2.291 2.510 . 0 0 "[ . 1 . 2]" 1 976 1 29 ARG HA 1 29 ARG QB . . 2.800 2.363 2.318 2.488 . 0 0 "[ . 1 . 2]" 1 977 1 45 GLU HA 1 45 GLU HB2 2.650 . 3.500 3.011 2.972 3.029 . 0 0 "[ . 1 . 2]" 1 978 1 29 ARG QB 1 29 ARG QD 2.650 . 3.500 2.201 2.031 2.429 . 0 0 "[ . 1 . 2]" 1 979 1 38 GLN QB 1 38 GLN QG 2.300 . 2.800 2.077 1.987 2.094 . 0 0 "[ . 1 . 2]" 1 980 1 12 GLN HB2 1 12 GLN QG 2.300 . 2.800 2.432 2.118 2.492 . 0 0 "[ . 1 . 2]" 1 981 1 45 GLU HB2 1 45 GLU HG3 2.650 . 3.500 2.608 2.403 3.017 . 0 0 "[ . 1 . 2]" 1 982 1 45 GLU HB2 1 45 GLU HG2 2.650 . 3.500 2.889 2.380 3.017 . 0 0 "[ . 1 . 2]" 1 983 1 12 GLN HB2 1 15 LYS QD 2.650 . 3.500 2.328 2.225 2.458 . 0 0 "[ . 1 . 2]" 1 984 1 15 LYS QD 1 15 LYS HG2 2.300 . 2.800 2.312 2.163 2.354 . 0 0 "[ . 1 . 2]" 1 985 1 7 ILE MD 1 39 GLN HB2 3.650 . 5.500 3.143 2.946 3.306 . 0 0 "[ . 1 . 2]" 1 986 1 15 LYS QD 1 15 LYS HG3 2.300 . 2.800 2.370 2.329 2.442 . 0 0 "[ . 1 . 2]" 1 987 1 15 LYS QD 1 27 ILE MG 2.300 . 2.800 2.226 1.947 2.560 . 0 0 "[ . 1 . 2]" 1 988 1 6 GLY H 1 7 ILE HG13 3.150 . 4.500 3.446 3.411 3.467 . 0 0 "[ . 1 . 2]" 1 989 1 29 ARG H 1 29 ARG HG3 3.650 . 5.500 2.363 2.083 4.445 . 0 0 "[ . 1 . 2]" 1 990 1 29 ARG H 1 29 ARG HG2 3.650 . 5.500 2.611 2.259 3.965 . 0 0 "[ . 1 . 2]" 1 991 1 47 ILE H 1 47 ILE HG12 3.150 . 4.500 3.372 3.081 3.546 . 0 0 "[ . 1 . 2]" 1 992 1 7 ILE HA 1 7 ILE HG13 3.150 . 4.500 2.869 2.789 2.974 . 0 0 "[ . 1 . 2]" 1 993 1 10 GLU HA 1 11 ILE HG12 3.650 . 5.500 2.788 2.599 2.853 . 0 0 "[ . 1 . 2]" 1 994 1 29 ARG HA 1 29 ARG HG2 3.650 . 5.500 2.677 2.424 3.064 . 0 0 "[ . 1 . 2]" 1 995 1 30 ARG HA 1 30 ARG HG2 3.650 . 5.500 2.717 2.528 3.084 . 0 0 "[ . 1 . 2]" 1 996 1 30 ARG HA 1 30 ARG HG3 3.650 . 5.500 2.859 2.742 3.045 . 0 0 "[ . 1 . 2]" 1 997 1 11 ILE HA 1 11 ILE HG13 3.650 . 5.500 3.576 3.142 3.685 . 0 0 "[ . 1 . 2]" 1 998 1 30 ARG QD 1 30 ARG HG3 2.650 . 2.800 2.351 2.310 2.392 . 0 0 "[ . 1 . 2]" 1 999 1 31 ARG HB3 1 31 ARG HG2 2.650 . 3.500 2.437 2.313 2.512 . 0 0 "[ . 1 . 2]" 1 1000 1 15 LYS HG2 1 29 ARG HG2 3.650 . 5.500 5.098 4.459 5.510 0.010 8 0 "[ . 1 . 2]" 1 1001 1 8 ILE MD 1 8 ILE HG12 2.300 . 2.800 1.929 1.885 1.960 . 0 0 "[ . 1 . 2]" 1 1002 1 4 ARG HB2 1 4 ARG QG 2.300 . 2.800 2.412 2.365 2.458 . 0 0 "[ . 1 . 2]" 1 1003 1 35 LYS H 1 36 VAL HA 3.150 . 4.500 3.518 3.411 3.594 . 0 0 "[ . 1 . 2]" 1 1004 1 26 LEU MD2 1 42 PHE QE 2.650 . 3.500 2.596 2.082 3.092 . 0 0 "[ . 1 . 2]" 1 1005 1 9 TYR QE 1 19 LEU MD2 3.650 . 5.500 2.790 2.443 2.972 . 0 0 "[ . 1 . 2]" 1 1006 1 41 SER HA 1 41 SER QB 2.650 . 2.800 2.287 2.173 2.462 . 0 0 "[ . 1 . 2]" 1 1007 1 5 LEU MD2 1 41 SER HA 2.650 . 2.800 2.202 2.039 2.449 . 0 0 "[ . 1 . 2]" 1 1008 1 5 LEU HA 1 5 LEU MD2 2.650 . 2.800 2.140 2.011 2.213 . 0 0 "[ . 1 . 2]" 1 1009 1 10 GLU HA 1 36 VAL HA 3.150 . 4.500 4.077 4.002 4.139 . 0 0 "[ . 1 . 2]" 1 1010 1 33 ASP HA 1 35 LYS QG 2.650 . 3.500 2.427 2.206 2.629 . 0 0 "[ . 1 . 2]" 1 1011 1 36 VAL HA 1 37 GLY HA2 3.150 . 4.500 4.382 4.334 4.461 . 0 0 "[ . 1 . 2]" 1 1012 1 5 LEU MD2 1 41 SER QB 2.650 . 3.500 2.568 2.137 2.975 . 0 0 "[ . 1 . 2]" 1 1013 1 26 LEU MD2 1 47 ILE HG12 3.650 . 5.500 2.892 2.388 3.362 . 0 0 "[ . 1 . 2]" 1 1014 1 5 LEU MD2 1 39 GLN HG2 3.650 . 5.500 3.196 2.683 3.612 . 0 0 "[ . 1 . 2]" 1 1015 1 35 LYS QD 1 35 LYS QG 2.300 . 2.800 2.051 2.002 2.097 . 0 0 "[ . 1 . 2]" 1 1016 1 4 ARG HG2 1 26 LEU MD2 2.300 . 2.800 1.964 1.807 2.050 . 0 0 "[ . 1 . 2]" 1 1017 1 26 LEU MD1 1 47 ILE MD 3.650 . 5.500 4.252 4.049 4.563 . 0 0 "[ . 1 . 2]" 1 1018 1 5 LEU HB3 1 5 LEU MD2 2.300 . 2.800 1.984 1.962 1.999 . 0 0 "[ . 1 . 2]" 1 1019 1 7 ILE HB 1 19 LEU MD2 2.650 . 3.500 2.253 2.150 2.303 . 0 0 "[ . 1 . 2]" 1 1020 1 36 VAL HA 1 36 VAL QG 2.300 . 2.800 2.150 2.118 2.169 . 0 0 "[ . 1 . 2]" 1 1021 1 8 ILE MG 1 36 VAL HA 2.300 . 2.800 2.032 1.948 2.152 . 0 0 "[ . 1 . 2]" 1 1022 1 26 LEU MD2 1 47 ILE MD 2.650 . 3.500 2.030 1.904 2.317 . 0 0 "[ . 1 . 2]" 1 1023 1 17 VAL MG2 1 18 VAL H 3.150 . 4.500 4.143 4.062 4.211 . 0 0 "[ . 1 . 2]" 1 1024 1 20 THR MG 1 21 SER H 3.650 . 5.500 3.130 2.959 3.232 . 0 0 "[ . 1 . 2]" 1 1025 1 16 ALA H 1 16 ALA MB 2.650 . 3.500 2.557 2.527 2.586 . 0 0 "[ . 1 . 2]" 1 1026 1 11 ILE H 1 36 VAL MG1 3.150 . 4.500 4.304 3.797 4.508 0.008 16 0 "[ . 1 . 2]" 1 1027 1 17 VAL H 1 17 VAL MG2 3.650 . 5.500 2.494 2.348 2.618 . 0 0 "[ . 1 . 2]" 1 1028 1 18 VAL QG 1 26 LEU H 3.150 . 4.500 2.481 2.320 2.579 . 0 0 "[ . 1 . 2]" 1 1029 1 6 GLY H 1 18 VAL MG1 3.150 . 4.500 3.199 3.131 3.275 . 0 0 "[ . 1 . 2]" 1 1030 1 36 VAL H 1 36 VAL MG1 3.150 . 4.500 3.786 3.756 3.802 . 0 0 "[ . 1 . 2]" 1 1031 1 9 TYR QD 1 19 LEU MD1 3.650 . 5.500 3.070 2.895 3.334 . 0 0 "[ . 1 . 2]" 1 1032 1 20 THR MG 1 42 PHE QE 2.650 . 3.500 2.056 1.847 2.315 . 0 0 "[ . 1 . 2]" 1 1033 1 17 VAL MG2 1 25 PHE QD 3.150 . 4.500 4.517 4.478 4.533 0.033 11 0 "[ . 1 . 2]" 1 1034 1 18 VAL QG 1 42 PHE QE 2.650 . 3.500 2.235 2.027 2.433 . 0 0 "[ . 1 . 2]" 1 1035 1 9 TYR QE 1 19 LEU MD1 3.150 . 4.500 4.470 4.238 4.551 0.051 17 0 "[ . 1 . 2]" 1 1036 1 19 LEU MD1 1 25 PHE QE 3.650 . 5.500 2.834 2.754 2.902 . 0 0 "[ . 1 . 2]" 1 1037 1 19 LEU MD1 1 25 PHE HA 3.650 . 5.500 3.448 3.308 3.585 . 0 0 "[ . 1 . 2]" 1 1038 1 16 ALA HA 1 16 ALA MB 2.300 . 2.800 2.128 2.118 2.138 . 0 0 "[ . 1 . 2]" 1 1039 1 7 ILE HA 1 40 VAL MG2 3.650 . 5.500 3.345 3.159 3.494 . 0 0 "[ . 1 . 2]" 1 1040 1 16 ALA HA 1 17 VAL MG2 3.650 . 5.500 3.185 3.048 3.244 . 0 0 "[ . 1 . 2]" 1 1041 1 40 VAL HA 1 40 VAL MG2 2.650 . 3.500 3.221 3.202 3.235 . 0 0 "[ . 1 . 2]" 1 1042 1 18 VAL HA 1 18 VAL QG 2.650 . 3.500 2.202 2.144 2.248 . 0 0 "[ . 1 . 2]" 1 1043 1 19 LEU HA 1 19 LEU MD1 3.150 . 4.500 2.217 2.168 2.314 . 0 0 "[ . 1 . 2]" 1 1044 1 11 ILE HA 1 16 ALA MB 3.150 . 3.500 3.351 3.207 3.455 . 0 0 "[ . 1 . 2]" 1 1045 1 16 ALA MB 1 30 ARG HA 3.150 . 3.500 2.745 2.584 2.859 . 0 0 "[ . 1 . 2]" 1 1046 1 10 GLU HA 1 36 VAL MG1 2.650 . 2.800 2.819 2.771 2.853 0.053 19 0 "[ . 1 . 2]" 1 1047 1 17 VAL HA 1 17 VAL MG2 3.150 . 4.500 2.448 2.413 2.495 . 0 0 "[ . 1 . 2]" 1 1048 1 10 GLU HA 1 36 VAL MG2 3.150 . 4.500 3.219 2.585 3.775 . 0 0 "[ . 1 . 2]" 1 1049 1 6 GLY HA3 1 18 VAL MG1 2.650 . 3.500 2.751 2.604 2.831 . 0 0 "[ . 1 . 2]" 1 1050 1 8 ILE HA 1 18 VAL QG 2.650 . 3.500 2.692 2.521 2.863 . 0 0 "[ . 1 . 2]" 1 1051 1 36 VAL HA 1 36 VAL MG1 2.650 . 3.500 2.354 2.296 2.405 . 0 0 "[ . 1 . 2]" 1 1052 1 36 VAL MG2 1 37 GLY HA2 4.150 . 6.500 5.658 5.539 5.725 . 0 0 "[ . 1 . 2]" 1 1053 1 36 VAL HA 1 36 VAL MG2 3.150 . 4.500 2.489 2.398 2.556 . 0 0 "[ . 1 . 2]" 1 1054 1 20 THR MG 1 22 GLU HB2 3.150 . 4.500 3.127 2.897 3.259 . 0 0 "[ . 1 . 2]" 1 1055 1 16 ALA MB 1 34 MET ME 3.150 . 4.500 3.499 2.957 3.735 . 0 0 "[ . 1 . 2]" 1 1056 1 36 VAL HB 1 36 VAL MG1 2.300 . 2.800 2.131 2.120 2.139 . 0 0 "[ . 1 . 2]" 1 1057 1 34 MET HG2 1 40 VAL MG2 3.650 . 5.500 3.538 3.164 4.159 . 0 0 "[ . 1 . 2]" 1 1058 1 34 MET ME 1 40 VAL MG2 2.300 . 2.800 1.864 1.773 1.958 0.027 8 0 "[ . 1 . 2]" 1 1059 1 10 GLU HB2 1 17 VAL MG2 3.650 . 5.500 3.193 2.723 3.576 . 0 0 "[ . 1 . 2]" 1 1060 1 17 VAL HB 1 18 VAL MG1 3.650 . 5.500 3.451 3.168 3.627 . 0 0 "[ . 1 . 2]" 1 1061 1 4 ARG HB3 1 20 THR MG 3.650 . 5.500 3.846 3.437 4.145 . 0 0 "[ . 1 . 2]" 1 1062 1 16 ALA MB 1 34 MET HB3 3.150 . 4.500 3.475 2.940 4.247 . 0 0 "[ . 1 . 2]" 1 1063 1 16 ALA MB 1 30 ARG HG3 3.150 . 4.500 2.440 2.096 3.177 . 0 0 "[ . 1 . 2]" 1 1064 1 16 ALA MB 1 30 ARG HB2 3.150 . 4.500 2.275 2.120 2.446 . 0 0 "[ . 1 . 2]" 1 1065 1 8 ILE HG12 1 36 VAL MG1 3.650 . 5.500 4.785 4.420 4.999 . 0 0 "[ . 1 . 2]" 1 1066 1 11 ILE HG12 1 36 VAL MG1 3.150 . 4.500 3.766 3.328 3.994 . 0 0 "[ . 1 . 2]" 1 1067 1 8 ILE HG12 1 40 VAL MG2 3.150 . 4.500 2.706 2.421 2.998 . 0 0 "[ . 1 . 2]" 1 1068 1 8 ILE HG13 1 40 VAL MG2 3.150 . 4.500 3.577 3.441 3.785 . 0 0 "[ . 1 . 2]" 1 1069 1 18 VAL QG 1 20 THR MG 2.300 . 2.800 1.934 1.810 2.071 . 0 0 "[ . 1 . 2]" 1 1070 1 18 VAL QG 1 28 ILE HG12 2.300 . 2.800 2.189 2.035 2.352 . 0 0 "[ . 1 . 2]" 1 1071 1 19 LEU MD1 1 20 THR MG 3.650 . 5.500 4.645 4.520 4.713 . 0 0 "[ . 1 . 2]" 1 1072 1 20 THR MG 1 26 LEU MD2 2.650 . 3.500 2.586 2.038 3.065 . 0 0 "[ . 1 . 2]" 1 1073 1 18 VAL MG2 1 20 THR MG 3.150 . 4.500 2.681 2.401 3.073 . 0 0 "[ . 1 . 2]" 1 1074 1 8 ILE MD 1 16 ALA MB 2.300 . 2.800 2.097 1.992 2.276 . 0 0 "[ . 1 . 2]" 1 1075 1 8 ILE MG 1 16 ALA MB 2.300 . 2.800 1.860 1.782 1.947 0.018 19 0 "[ . 1 . 2]" 1 1076 1 16 ALA MB 1 18 VAL QG 3.150 . 4.500 2.935 2.803 3.077 . 0 0 "[ . 1 . 2]" 1 1077 1 16 ALA MB 1 28 ILE MD 3.150 . 4.500 2.643 2.545 2.791 . 0 0 "[ . 1 . 2]" 1 1078 1 28 ILE MD 1 40 VAL MG2 3.650 . 5.500 2.707 2.383 2.861 . 0 0 "[ . 1 . 2]" 1 1079 1 17 VAL MG2 1 18 VAL MG2 3.650 . 5.500 5.126 5.016 5.266 . 0 0 "[ . 1 . 2]" 1 1080 1 18 VAL QG 1 40 VAL MG2 3.150 . 4.500 2.363 2.175 2.604 . 0 0 "[ . 1 . 2]" 1 1081 1 8 ILE MD 1 18 VAL QG 2.300 . 2.800 1.793 1.731 1.833 0.069 3 0 "[ . 1 . 2]" 1 1082 1 8 ILE MG 1 18 VAL QG 3.150 . 4.500 3.068 2.995 3.150 . 0 0 "[ . 1 . 2]" 1 1083 1 18 VAL QG 1 28 ILE MD 2.650 . 3.500 1.994 1.896 2.060 . 0 0 "[ . 1 . 2]" 1 1084 1 18 VAL QG 1 28 ILE MG 3.150 . 3.500 2.039 1.886 2.148 . 0 0 "[ . 1 . 2]" 1 1085 1 7 ILE MD 1 19 LEU MD1 3.150 . 4.500 3.937 3.857 4.020 . 0 0 "[ . 1 . 2]" 1 1086 1 17 VAL MG1 1 18 VAL H 3.150 . 4.500 2.949 2.792 3.061 . 0 0 "[ . 1 . 2]" 1 1087 1 8 ILE MG 1 9 TYR H 3.150 . 4.500 3.084 2.942 3.177 . 0 0 "[ . 1 . 2]" 1 1088 1 8 ILE H 1 40 VAL MG1 3.650 . 5.500 3.458 3.245 3.608 . 0 0 "[ . 1 . 2]" 1 1089 1 27 ILE MG 1 28 ILE H 2.650 . 3.500 2.884 2.726 3.002 . 0 0 "[ . 1 . 2]" 1 1090 1 16 ALA H 1 27 ILE MG 3.150 . 4.500 3.167 3.045 3.282 . 0 0 "[ . 1 . 2]" 1 1091 1 8 ILE H 1 8 ILE MG 3.150 . 4.500 3.738 3.707 3.757 . 0 0 "[ . 1 . 2]" 1 1092 1 40 VAL MG1 1 41 SER H 3.150 . 4.500 3.726 3.598 3.857 . 0 0 "[ . 1 . 2]" 1 1093 1 27 ILE H 1 27 ILE MG 3.650 . 5.500 3.816 3.794 3.857 . 0 0 "[ . 1 . 2]" 1 1094 1 10 GLU H 1 17 VAL MG1 3.650 . 5.500 3.718 3.575 3.959 . 0 0 "[ . 1 . 2]" 1 1095 1 8 ILE MG 1 35 LYS H 3.650 . 5.500 3.767 3.542 4.015 . 0 0 "[ . 1 . 2]" 1 1096 1 40 VAL MG1 1 42 PHE QD 3.650 . 5.500 4.805 4.444 5.088 . 0 0 "[ . 1 . 2]" 1 1097 1 27 ILE MG 1 48 TYR QD 3.150 . 3.500 2.543 2.063 3.201 . 0 0 "[ . 1 . 2]" 1 1098 1 17 VAL MG1 1 27 ILE HA 3.150 . 4.500 4.081 3.879 4.212 . 0 0 "[ . 1 . 2]" 1 1099 1 40 VAL HA 1 40 VAL MG1 2.650 . 3.500 2.370 2.280 2.472 . 0 0 "[ . 1 . 2]" 1 1100 1 27 ILE HA 1 27 ILE MG 2.650 . 3.500 2.383 2.322 2.417 . 0 0 "[ . 1 . 2]" 1 1101 1 8 ILE MG 1 16 ALA HA 3.650 . 5.500 3.669 3.481 3.784 . 0 0 "[ . 1 . 2]" 1 1102 1 17 VAL HA 1 17 VAL MG1 2.650 . 3.500 2.426 2.382 2.482 . 0 0 "[ . 1 . 2]" 1 1103 1 8 ILE MG 1 10 GLU HA 3.150 . 4.500 3.090 2.950 3.198 . 0 0 "[ . 1 . 2]" 1 1104 1 8 ILE HA 1 8 ILE MG 2.650 . 2.800 2.404 2.365 2.435 . 0 0 "[ . 1 . 2]" 1 1105 1 17 VAL HB 1 17 VAL MG1 2.300 . 2.800 2.131 2.124 2.141 . 0 0 "[ . 1 . 2]" 1 1106 1 10 GLU HB2 1 17 VAL MG1 3.150 . 4.500 3.988 3.705 4.267 . 0 0 "[ . 1 . 2]" 1 1107 1 34 MET ME 1 40 VAL MG1 2.300 . 2.800 2.067 2.017 2.102 . 0 0 "[ . 1 . 2]" 1 1108 1 38 GLN QG 1 40 VAL MG1 3.650 . 5.500 2.196 1.952 4.033 . 0 0 "[ . 1 . 2]" 1 1109 1 8 ILE MG 1 10 GLU HG2 3.650 . 5.500 4.087 3.960 4.219 . 0 0 "[ . 1 . 2]" 1 1110 1 8 ILE MG 1 34 MET HB3 3.650 . 5.500 3.284 2.954 3.983 . 0 0 "[ . 1 . 2]" 1 1111 1 17 VAL MG1 1 27 ILE HG12 3.650 . 5.500 4.547 4.201 4.753 . 0 0 "[ . 1 . 2]" 1 1112 1 15 LYS HB2 1 27 ILE MG 2.650 . 3.500 3.335 3.099 3.512 0.012 10 0 "[ . 1 . 2]" 1 1113 1 8 ILE MG 1 11 ILE HG12 2.650 . 3.500 2.671 2.355 3.061 . 0 0 "[ . 1 . 2]" 1 1114 1 18 VAL QG 1 40 VAL MG1 3.650 . 5.500 3.937 3.728 4.119 . 0 0 "[ . 1 . 2]" 1 1115 1 28 ILE MD 1 40 VAL MG1 3.150 . 4.500 4.355 4.007 4.530 0.030 1 0 "[ . 1 . 2]" 1 1116 1 8 ILE MD 1 8 ILE MG 2.300 . 2.800 1.826 1.788 1.878 0.012 9 0 "[ . 1 . 2]" 1 1117 1 8 ILE MG 1 18 VAL MG1 3.150 . 4.500 3.721 3.620 3.835 . 0 0 "[ . 1 . 2]" 1 1118 1 7 ILE MG 1 37 GLY H 3.650 . 5.500 3.300 3.088 3.458 . 0 0 "[ . 1 . 2]" 1 1119 1 7 ILE MG 1 19 LEU H 3.150 . 4.500 3.457 3.408 3.530 . 0 0 "[ . 1 . 2]" 1 1120 1 7 ILE MG 1 8 ILE H 2.650 . 3.500 2.310 2.231 2.399 . 0 0 "[ . 1 . 2]" 1 1121 1 28 ILE H 1 28 ILE MG 2.650 . 3.500 2.691 2.643 2.763 . 0 0 "[ . 1 . 2]" 1 1122 1 7 ILE H 1 7 ILE MG 3.650 . 5.500 3.789 3.765 3.815 . 0 0 "[ . 1 . 2]" 1 1123 1 47 ILE H 1 47 ILE MG 3.650 . 5.500 3.774 3.740 3.825 . 0 0 "[ . 1 . 2]" 1 1124 1 28 ILE MG 1 42 PHE QD 3.150 . 4.500 2.821 2.625 3.085 . 0 0 "[ . 1 . 2]" 1 1125 1 7 ILE HA 1 7 ILE MG 2.650 . 3.500 2.314 2.243 2.358 . 0 0 "[ . 1 . 2]" 1 1126 1 28 ILE HA 1 28 ILE MG 2.650 . 3.500 2.407 2.354 2.455 . 0 0 "[ . 1 . 2]" 1 1127 1 2 MET HA 1 2 MET ME 3.650 . 5.500 3.587 2.876 3.862 . 0 0 "[ . 1 . 2]" 1 1128 1 30 ARG HA 1 34 MET ME 3.150 . 3.500 3.035 2.349 3.356 . 0 0 "[ . 1 . 2]" 1 1129 1 7 ILE MG 1 38 GLN HA 2.650 . 3.500 2.457 2.387 2.546 . 0 0 "[ . 1 . 2]" 1 1130 1 28 ILE MG 1 47 ILE HA 2.650 . 3.500 1.966 1.903 2.085 . 0 0 "[ . 1 . 2]" 1 1131 1 31 ARG HD3 1 34 MET ME 3.650 . 5.500 3.871 1.976 4.226 . 0 0 "[ . 1 . 2]" 1 1132 1 7 ILE MG 1 37 GLY HA2 3.150 . 4.500 2.815 2.590 2.959 . 0 0 "[ . 1 . 2]" 1 1133 1 31 ARG HD2 1 34 MET ME 3.150 . 4.500 2.575 2.164 3.022 . 0 0 "[ . 1 . 2]" 1 1134 1 28 ILE MG 1 42 PHE HB2 3.650 . 5.500 3.648 3.206 4.102 . 0 0 "[ . 1 . 2]" 1 1135 1 28 ILE MG 1 46 ASP HB2 3.150 . 4.500 3.686 3.329 4.063 . 0 0 "[ . 1 . 2]" 1 1136 1 34 MET ME 1 34 MET HG2 2.650 . 3.500 2.620 2.411 3.426 . 0 0 "[ . 1 . 2]" 1 1137 1 7 ILE MG 1 8 ILE HB 3.650 . 5.500 3.709 3.618 3.813 . 0 0 "[ . 1 . 2]" 1 1138 1 7 ILE MG 1 38 GLN QB 3.650 . 5.500 3.730 3.601 3.932 . 0 0 "[ . 1 . 2]" 1 1139 1 7 ILE MG 1 39 GLN HB2 3.650 . 5.500 3.540 3.255 3.779 . 0 0 "[ . 1 . 2]" 1 1140 1 28 ILE MG 1 34 MET ME 3.650 . 5.500 4.517 4.318 4.774 . 0 0 "[ . 1 . 2]" 1 1141 1 28 ILE MG 1 47 ILE HG12 3.150 . 4.500 2.107 1.916 2.293 . 0 0 "[ . 1 . 2]" 1 1142 1 31 ARG HB2 1 34 MET ME 2.300 . 2.800 2.325 1.766 2.832 0.034 8 0 "[ . 1 . 2]" 1 1143 1 2 MET ME 1 4 ARG HG2 3.650 . 5.500 4.521 4.266 4.801 . 0 0 "[ . 1 . 2]" 1 1144 1 30 ARG HB2 1 34 MET ME 3.650 . 5.500 5.036 4.372 5.385 . 0 0 "[ . 1 . 2]" 1 1145 1 16 ALA MB 1 34 MET ME 2.650 . 3.500 3.356 2.882 3.545 0.045 10 0 "[ . 1 . 2]" 1 1146 1 26 LEU QB 1 47 ILE MG 3.150 . 4.500 2.607 2.304 2.880 . 0 0 "[ . 1 . 2]" 1 1147 1 7 ILE HB 1 7 ILE MG 2.300 . 2.800 2.133 2.125 2.139 . 0 0 "[ . 1 . 2]" 1 1148 1 26 LEU QB 1 28 ILE MG 2.650 . 3.500 2.584 2.326 2.744 . 0 0 "[ . 1 . 2]" 1 1149 1 8 ILE MD 1 34 MET ME 2.300 . 2.800 1.978 1.797 2.218 0.003 8 0 "[ . 1 . 2]" 1 1150 1 28 ILE HG13 1 34 MET ME 3.150 . 4.500 3.553 3.112 3.919 . 0 0 "[ . 1 . 2]" 1 1151 1 18 VAL MG1 1 34 MET ME 3.650 . 5.500 3.696 3.327 3.887 . 0 0 "[ . 1 . 2]" 1 1152 1 28 ILE MD 1 34 MET ME 2.650 . 3.500 2.070 1.976 2.205 . 0 0 "[ . 1 . 2]" 1 1153 1 7 ILE MG 1 18 VAL MG1 3.650 . 5.500 4.889 4.756 5.047 . 0 0 "[ . 1 . 2]" 1 1154 1 28 ILE MD 1 28 ILE MG 2.300 . 2.800 2.058 1.949 2.199 . 0 0 "[ . 1 . 2]" 1 1155 1 28 ILE MG 1 47 ILE MG 3.650 . 5.500 2.594 2.229 3.005 . 0 0 "[ . 1 . 2]" 1 1156 1 28 ILE H 1 28 ILE MD 3.650 . 5.500 3.731 3.620 3.802 . 0 0 "[ . 1 . 2]" 1 1157 1 47 ILE H 1 47 ILE MD 3.150 . 4.500 3.572 3.447 3.709 . 0 0 "[ . 1 . 2]" 1 1158 1 42 PHE QE 1 47 ILE MD 3.150 . 4.500 2.264 2.065 2.567 . 0 0 "[ . 1 . 2]" 1 1159 1 28 ILE MD 1 42 PHE QE 3.650 . 5.500 3.472 3.201 3.669 . 0 0 "[ . 1 . 2]" 1 1160 1 44 ASN HA 1 47 ILE MD 2.650 . 2.800 2.032 1.887 2.111 . 0 0 "[ . 1 . 2]" 1 1161 1 28 ILE MD 1 42 PHE HB2 3.650 . 5.500 3.006 2.670 3.408 . 0 0 "[ . 1 . 2]" 1 1162 1 47 ILE HB 1 47 ILE MD 2.300 . 2.800 1.983 1.973 1.996 . 0 0 "[ . 1 . 2]" 1 1163 1 4 ARG HG2 1 47 ILE MD 3.150 . 4.500 3.643 2.656 4.459 . 0 0 "[ . 1 . 2]" 1 1164 1 4 ARG HB3 1 47 ILE MD 3.150 . 4.500 3.717 3.138 4.313 . 0 0 "[ . 1 . 2]" 1 1165 1 8 ILE MD 1 28 ILE MD 2.650 . 3.500 2.400 2.239 2.542 . 0 0 "[ . 1 . 2]" 1 1166 1 28 ILE MG 1 47 ILE MD 3.650 . 5.500 3.485 3.230 3.638 . 0 0 "[ . 1 . 2]" 1 1167 1 11 ILE MD 1 36 VAL H 3.150 . 4.500 4.350 4.079 4.494 . 0 0 "[ . 1 . 2]" 1 1168 1 7 ILE MD 1 37 GLY H 3.650 . 5.500 3.906 3.662 4.034 . 0 0 "[ . 1 . 2]" 1 1169 1 7 ILE MD 1 39 GLN H 3.150 . 4.500 3.237 2.939 3.352 . 0 0 "[ . 1 . 2]" 1 1170 1 8 ILE MD 1 17 VAL H 3.150 . 4.500 4.092 3.825 4.309 . 0 0 "[ . 1 . 2]" 1 1171 1 27 ILE H 1 27 ILE MD 3.650 . 5.500 3.410 3.180 3.555 . 0 0 "[ . 1 . 2]" 1 1172 1 7 ILE H 1 7 ILE MD 3.150 . 4.500 3.525 3.419 3.630 . 0 0 "[ . 1 . 2]" 1 1173 1 27 ILE HA 1 27 ILE MD 3.150 . 4.500 2.219 2.165 2.289 . 0 0 "[ . 1 . 2]" 1 1174 1 7 ILE HA 1 7 ILE MD 2.650 . 3.500 3.474 3.367 3.511 0.011 15 0 "[ . 1 . 2]" 1 1175 1 17 VAL HA 1 27 ILE MD 3.650 . 5.500 2.639 2.462 3.037 . 0 0 "[ . 1 . 2]" 1 1176 1 11 ILE HA 1 11 ILE MD 2.650 . 3.500 2.138 2.086 2.235 . 0 0 "[ . 1 . 2]" 1 1177 1 8 ILE HA 1 8 ILE MD 3.150 . 4.500 2.060 1.969 2.225 . 0 0 "[ . 1 . 2]" 1 1178 1 12 GLN HB3 1 27 ILE MD 3.150 . 4.500 3.219 3.183 3.245 . 0 0 "[ . 1 . 2]" 1 1179 1 11 ILE MD 1 34 MET HB3 3.150 . 4.500 2.587 2.015 3.542 . 0 0 "[ . 1 . 2]" 1 1180 1 7 ILE MD 1 39 GLN HG3 2.650 . 3.500 3.099 2.995 3.165 . 0 0 "[ . 1 . 2]" 1 1181 1 8 ILE MD 1 34 MET ME 2.650 . 3.500 2.852 2.121 3.387 . 0 0 "[ . 1 . 2]" 1 1182 1 7 ILE MD 1 39 GLN HB2 3.150 . 4.500 2.905 2.348 3.567 . 0 0 "[ . 1 . 2]" 1 1183 1 11 ILE HB 1 11 ILE MD 2.650 . 3.500 3.016 2.897 3.183 . 0 0 "[ . 1 . 2]" 1 1184 1 15 LYS QD 1 27 ILE MD 3.650 . 5.500 3.898 3.557 4.131 . 0 0 "[ . 1 . 2]" 1 1185 1 27 ILE MD 1 27 ILE HG13 2.300 . 2.800 2.124 2.117 2.134 . 0 0 "[ . 1 . 2]" 1 1186 1 11 ILE MD 1 16 ALA MB 3.150 . 4.500 2.153 1.993 2.288 . 0 0 "[ . 1 . 2]" 1 1187 1 7 ILE HB 1 7 ILE MD 2.300 . 2.800 1.958 1.932 1.978 . 0 0 "[ . 1 . 2]" 1 1188 1 8 ILE MD 1 8 ILE MG 2.300 . 2.800 1.970 1.913 2.018 . 0 0 "[ . 1 . 2]" 1 1189 1 8 ILE MD 1 18 VAL QG 2.650 . 3.500 1.880 1.802 1.955 . 0 0 "[ . 1 . 2]" 1 1190 1 8 ILE MD 1 28 ILE MD 3.150 . 4.500 2.700 2.511 2.911 . 0 0 "[ . 1 . 2]" 1 1191 1 8 ILE HA 1 18 VAL HA 2.300 . 2.800 2.666 2.567 2.742 . 0 0 "[ . 1 . 2]" 1 1192 1 28 ILE HA 1 47 ILE HA 3.150 . 4.500 2.241 2.003 2.446 . 0 0 "[ . 1 . 2]" 1 1193 1 6 GLY HA3 1 8 ILE HA 3.650 . 5.500 4.232 4.172 4.277 . 0 0 "[ . 1 . 2]" 1 1194 1 8 ILE HA 1 9 TYR QB 3.650 . 5.500 3.901 3.833 3.952 . 0 0 "[ . 1 . 2]" 1 1195 1 8 ILE HA 1 8 ILE HG12 2.650 . 3.500 3.072 2.979 3.195 . 0 0 "[ . 1 . 2]" 1 1196 1 8 ILE HA 1 8 ILE HG13 3.150 . 4.500 3.779 3.742 3.810 . 0 0 "[ . 1 . 2]" 1 1197 1 21 SER HA 1 21 SER HB3 2.650 . 3.500 2.337 2.318 2.371 . 0 0 "[ . 1 . 2]" 1 1198 1 21 SER HA 1 21 SER HB2 2.650 . 2.800 2.595 2.551 2.612 . 0 0 "[ . 1 . 2]" 1 1199 1 11 ILE H 1 11 ILE HA 2.650 . 3.500 2.940 2.924 2.955 . 0 0 "[ . 1 . 2]" 1 1200 1 11 ILE HA 1 13 GLY H 3.150 . 4.500 3.108 2.950 3.334 . 0 0 "[ . 1 . 2]" 1 1201 1 11 ILE HA 1 16 ALA HA 2.300 . 2.800 2.226 2.116 2.384 . 0 0 "[ . 1 . 2]" 1 1202 1 10 GLU HB2 1 11 ILE HA 3.650 . 5.500 4.073 3.877 4.371 . 0 0 "[ . 1 . 2]" 1 1203 1 11 ILE HA 1 11 ILE HG12 2.650 . 3.500 2.904 2.663 2.999 . 0 0 "[ . 1 . 2]" 1 1204 1 11 ILE HA 1 11 ILE HG13 2.300 . 2.800 2.484 2.410 2.573 . 0 0 "[ . 1 . 2]" 1 1205 1 21 SER HA 1 23 GLY H 3.650 . 5.500 3.617 3.463 4.007 . 0 0 "[ . 1 . 2]" 1 1206 1 20 THR HA 1 21 SER HA 3.650 . 5.500 4.328 4.259 4.401 . 0 0 "[ . 1 . 2]" 1 1207 1 48 TYR HA 1 48 TYR QD 2.650 . 3.500 2.398 1.979 2.998 . 0 0 "[ . 1 . 2]" 1 1208 1 11 ILE HG12 1 34 MET HA 3.650 . 5.500 4.419 4.328 4.632 . 0 0 "[ . 1 . 2]" 1 1209 1 27 ILE MG 1 48 TYR HA 3.650 . 5.500 4.994 4.775 5.263 . 0 0 "[ . 1 . 2]" 1 1210 1 16 ALA H 1 29 ARG HA 3.650 . 5.500 3.986 3.520 4.146 . 0 0 "[ . 1 . 2]" 1 1211 1 45 GLU HA 1 46 ASP H 3.150 . 4.500 3.451 3.312 3.508 . 0 0 "[ . 1 . 2]" 1 1212 1 29 ARG HA 1 30 ARG H 2.300 . 2.800 2.159 2.097 2.192 . 0 0 "[ . 1 . 2]" 1 1213 1 29 ARG HA 1 48 TYR QD 3.150 . 4.500 3.209 2.725 3.640 . 0 0 "[ . 1 . 2]" 1 1214 1 29 ARG HA 1 48 TYR QE 2.650 . 3.500 2.210 1.973 2.615 . 0 0 "[ . 1 . 2]" 1 1215 1 15 LYS HA 1 29 ARG HA 2.650 . 3.500 2.811 2.260 3.012 . 0 0 "[ . 1 . 2]" 1 1216 1 29 ARG HA 1 29 ARG QD 3.650 . 4.500 4.038 3.937 4.142 . 0 0 "[ . 1 . 2]" 1 1217 1 45 GLU HA 1 45 GLU HG2 2.650 . 3.500 2.874 2.516 3.579 0.079 9 0 "[ . 1 . 2]" 1 1218 1 45 GLU HA 1 45 GLU QB 2.300 . 2.800 2.343 2.309 2.395 . 0 0 "[ . 1 . 2]" 1 1219 1 15 LYS QD 1 29 ARG HA 3.150 . 4.500 4.306 4.029 4.459 . 0 0 "[ . 1 . 2]" 1 1220 1 32 LYS HA 1 33 ASP HA 3.650 . 5.500 4.550 4.385 4.688 . 0 0 "[ . 1 . 2]" 1 1221 1 32 LYS HA 1 32 LYS QB 2.300 . 2.800 2.365 2.313 2.421 . 0 0 "[ . 1 . 2]" 1 1222 1 32 LYS HA 1 32 LYS QG 2.650 . 3.500 2.542 2.318 3.087 . 0 0 "[ . 1 . 2]" 1 1223 1 44 ASN H 1 44 ASN HA 2.650 . 3.500 2.714 2.671 2.743 . 0 0 "[ . 1 . 2]" 1 1224 1 10 GLU HA 1 11 ILE H 2.300 . 2.800 2.393 2.254 2.451 . 0 0 "[ . 1 . 2]" 1 1225 1 44 ASN HA 1 46 ASP H 3.650 . 5.500 3.586 3.385 3.928 . 0 0 "[ . 1 . 2]" 1 1226 1 33 ASP H 1 33 ASP HA 2.650 . 3.500 2.186 2.124 2.266 . 0 0 "[ . 1 . 2]" 1 1227 1 42 PHE QD 1 44 ASN HA 3.650 . 5.500 3.329 3.172 3.531 . 0 0 "[ . 1 . 2]" 1 1228 1 44 ASN HA 1 47 ILE HB 2.650 . 3.500 3.142 2.888 3.337 . 0 0 "[ . 1 . 2]" 1 1229 1 2 MET HA 1 2 MET QG 3.150 . 4.500 2.756 2.478 3.364 . 0 0 "[ . 1 . 2]" 1 1230 1 2 MET HA 1 2 MET QB 2.300 . 2.800 2.192 2.073 2.269 . 0 0 "[ . 1 . 2]" 1 1231 1 10 GLU HA 1 11 ILE HB 3.150 . 4.500 4.498 4.439 4.530 0.030 15 0 "[ . 1 . 2]" 1 1232 1 30 ARG H 1 30 ARG HA 2.650 . 3.500 2.884 2.851 2.904 . 0 0 "[ . 1 . 2]" 1 1233 1 38 GLN H 1 38 GLN HA 2.650 . 3.500 2.908 2.863 2.920 . 0 0 "[ . 1 . 2]" 1 1234 1 30 ARG HA 1 30 ARG QD 3.650 . 4.500 4.051 4.009 4.091 . 0 0 "[ . 1 . 2]" 1 1235 1 24 GLU HA 1 25 PHE HB3 4.150 . 6.500 5.740 5.690 5.799 . 0 0 "[ . 1 . 2]" 1 1236 1 4 ARG HA 1 4 ARG HD2 3.150 . 4.500 2.402 2.028 3.891 . 0 0 "[ . 1 . 2]" 1 1237 1 22 GLU HA 1 22 GLU HB3 2.300 . 2.800 2.248 2.118 2.350 . 0 0 "[ . 1 . 2]" 1 1238 1 38 GLN HA 1 38 GLN QG 2.650 . 3.500 3.358 3.339 3.383 . 0 0 "[ . 1 . 2]" 1 1239 1 30 ARG HA 1 30 ARG HB3 2.300 . 2.800 2.525 2.406 2.715 . 0 0 "[ . 1 . 2]" 1 1240 1 30 ARG HA 1 30 ARG HB2 2.300 . 2.800 2.465 2.382 2.521 . 0 0 "[ . 1 . 2]" 1 1241 1 4 ARG HA 1 5 LEU HG 3.150 . 4.500 3.677 3.452 3.968 . 0 0 "[ . 1 . 2]" 1 1242 1 4 ARG HA 1 4 ARG QG 2.650 . 3.500 2.607 2.208 2.918 . 0 0 "[ . 1 . 2]" 1 1243 1 7 ILE MG 1 38 GLN HA 3.150 . 4.500 3.351 3.137 3.439 . 0 0 "[ . 1 . 2]" 1 1244 1 4 ARG HA 1 4 ARG HB2 2.650 . 3.500 2.646 2.586 2.740 . 0 0 "[ . 1 . 2]" 1 1245 1 25 PHE HA 1 25 PHE QD 2.650 . 3.500 3.108 3.005 3.174 . 0 0 "[ . 1 . 2]" 1 1246 1 20 THR MG 1 25 PHE HA 3.150 . 4.500 4.169 3.926 4.344 . 0 0 "[ . 1 . 2]" 1 1247 1 27 ILE HB 1 28 ILE HA 3.650 . 5.500 3.872 3.760 3.975 . 0 0 "[ . 1 . 2]" 1 1248 1 28 ILE HA 1 28 ILE HG12 2.650 . 3.500 3.329 3.117 3.495 . 0 0 "[ . 1 . 2]" 1 1249 1 27 ILE MG 1 28 ILE HA 3.650 . 5.500 3.766 3.662 3.911 . 0 0 "[ . 1 . 2]" 1 1250 1 28 ILE HA 1 28 ILE MD 3.150 . 4.500 4.178 4.144 4.193 . 0 0 "[ . 1 . 2]" 1 1251 1 7 ILE HA 1 40 VAL H 2.650 . 3.500 3.216 3.136 3.295 . 0 0 "[ . 1 . 2]" 1 1252 1 7 ILE H 1 7 ILE HA 2.650 . 3.500 2.928 2.917 2.941 . 0 0 "[ . 1 . 2]" 1 1253 1 7 ILE HA 1 39 GLN HG3 3.150 . 4.500 3.471 3.152 3.850 . 0 0 "[ . 1 . 2]" 1 1254 1 7 ILE HA 1 7 ILE HG12 2.650 . 3.500 2.731 2.692 2.822 . 0 0 "[ . 1 . 2]" 1 1255 1 7 ILE HA 1 7 ILE HG13 2.650 . 3.500 2.998 2.930 3.088 . 0 0 "[ . 1 . 2]" 1 1256 1 7 ILE HA 1 7 ILE MG 2.300 . 2.800 2.341 2.279 2.379 . 0 0 "[ . 1 . 2]" 1 1257 1 41 SER HA 1 42 PHE QD 3.150 . 4.500 3.578 3.144 3.783 . 0 0 "[ . 1 . 2]" 1 1258 1 5 LEU HA 1 41 SER HA 2.300 . 2.800 2.698 2.411 2.855 0.055 5 0 "[ . 1 . 2]" 1 1259 1 5 LEU HB2 1 41 SER HA 3.650 . 5.500 4.261 4.067 4.430 . 0 0 "[ . 1 . 2]" 1 1260 1 42 PHE HA 1 43 GLU H 2.300 . 2.800 2.446 2.255 2.580 . 0 0 "[ . 1 . 2]" 1 1261 1 8 ILE H 1 39 GLN HA 2.650 . 3.500 2.726 2.692 2.758 . 0 0 "[ . 1 . 2]" 1 1262 1 42 PHE HA 1 42 PHE QD 3.150 . 4.500 3.742 3.720 3.761 . 0 0 "[ . 1 . 2]" 1 1263 1 42 PHE HA 1 46 ASP QB 3.150 . 4.500 4.148 3.877 4.468 . 0 0 "[ . 1 . 2]" 1 1264 1 42 PHE HA 1 43 GLU QG 3.150 . 4.500 4.090 3.238 4.522 0.022 7 0 "[ . 1 . 2]" 1 1265 1 39 GLN HA 1 39 GLN HG3 2.650 . 3.500 2.577 2.423 2.709 . 0 0 "[ . 1 . 2]" 1 1266 1 39 GLN HA 1 39 GLN HB2 2.650 . 3.500 2.528 2.483 2.597 . 0 0 "[ . 1 . 2]" 1 1267 1 7 ILE HG13 1 39 GLN HA 3.150 . 4.500 3.664 3.461 3.882 . 0 0 "[ . 1 . 2]" 1 1268 1 7 ILE MG 1 39 GLN HA 2.650 . 3.500 2.923 2.799 3.034 . 0 0 "[ . 1 . 2]" 1 1269 1 5 LEU HA 1 42 PHE QE 3.650 . 5.500 3.515 3.285 3.742 . 0 0 "[ . 1 . 2]" 1 1270 1 5 LEU HA 1 6 GLY HA2 3.650 . 5.500 3.869 3.649 3.996 . 0 0 "[ . 1 . 2]" 1 1271 1 5 LEU HA 1 5 LEU HB3 2.650 . 3.500 2.381 2.351 2.434 . 0 0 "[ . 1 . 2]" 1 1272 1 8 ILE MG 1 36 VAL MG1 2.300 . 2.800 2.522 2.167 2.743 . 0 0 "[ . 1 . 2]" 1 1273 1 19 LEU HG 1 20 THR MG 3.650 . 5.500 5.469 5.344 5.518 0.018 3 0 "[ . 1 . 2]" 1 1274 1 18 VAL HB 1 20 THR MG 3.150 . 4.500 3.242 2.919 3.542 . 0 0 "[ . 1 . 2]" 1 1275 1 16 ALA MB 1 30 ARG HB3 3.150 . 4.500 3.346 3.178 3.700 . 0 0 "[ . 1 . 2]" 1 1276 1 15 LYS HA 1 17 VAL MG2 4.150 . 6.500 6.164 5.956 6.374 . 0 0 "[ . 1 . 2]" 1 1277 1 12 GLN HE22 1 17 VAL MG2 3.650 . 5.500 2.695 1.781 4.341 0.019 5 0 "[ . 1 . 2]" 1 1278 1 15 LYS H 1 16 ALA MB 3.650 . 5.500 3.963 3.843 4.046 . 0 0 "[ . 1 . 2]" 1 1279 1 8 ILE MG 1 36 VAL H 3.650 . 5.500 3.549 3.397 3.686 . 0 0 "[ . 1 . 2]" 1 1280 1 8 ILE MG 1 17 VAL H 3.650 . 5.500 3.466 3.160 3.574 . 0 0 "[ . 1 . 2]" 1 1281 1 2 MET ME 1 4 ARG HD2 3.650 . 5.500 4.559 3.223 5.519 0.019 14 0 "[ . 1 . 2]" 1 1282 1 34 MET ME 1 42 PHE HA 3.650 . 5.500 4.006 3.429 4.619 . 0 0 "[ . 1 . 2]" 1 1283 1 44 ASN QB 1 45 GLU HA 3.650 . 5.500 4.068 3.966 4.232 . 0 0 "[ . 1 . 2]" 1 1284 1 28 ILE HA 1 48 TYR QD 3.150 . 4.500 3.204 2.714 3.643 . 0 0 "[ . 1 . 2]" 1 1285 1 28 ILE HA 1 42 PHE HB3 3.650 . 5.500 4.723 4.540 4.856 . 0 0 "[ . 1 . 2]" 1 1286 1 7 ILE MG 1 9 TYR HA 3.150 . 4.500 3.056 2.978 3.145 . 0 0 "[ . 1 . 2]" 1 1287 1 18 VAL HA 1 28 ILE MG 3.650 . 5.500 3.613 3.542 3.668 . 0 0 "[ . 1 . 2]" 1 1288 1 34 MET HA 1 34 MET HG2 2.650 . 3.500 3.308 3.067 3.515 0.015 17 0 "[ . 1 . 2]" 1 1289 1 34 MET HA 1 35 LYS H 2.300 . 2.800 2.140 2.093 2.208 . 0 0 "[ . 1 . 2]" 1 1290 1 34 MET H 1 34 MET HA 2.650 . 3.500 2.860 2.722 2.908 . 0 0 "[ . 1 . 2]" 1 1291 1 8 ILE MD 1 11 ILE MD 2.300 . 2.800 2.042 1.985 2.069 . 0 0 "[ . 1 . 2]" 1 1292 1 40 VAL MG2 1 42 PHE HA 3.650 . 5.500 4.576 4.187 5.055 . 0 0 "[ . 1 . 2]" 1 1293 1 8 ILE MD 1 30 ARG HA 3.150 . 4.500 4.071 3.956 4.203 . 0 0 "[ . 1 . 2]" 1 1294 1 42 PHE QD 1 47 ILE MD 3.650 . 5.500 2.907 2.559 3.311 . 0 0 "[ . 1 . 2]" 1 1295 1 33 ASP HA 1 33 ASP QB 2.300 . 2.800 2.397 2.257 2.477 . 0 0 "[ . 1 . 2]" 1 1296 1 4 ARG HD2 1 42 PHE QE 3.650 . 5.500 4.809 3.820 5.060 . 0 0 "[ . 1 . 2]" 1 1297 1 15 LYS HE3 1 15 LYS HG2 3.650 . 5.500 2.993 2.358 3.798 . 0 0 "[ . 1 . 2]" 1 1298 1 16 ALA HA 1 28 ILE MD 3.650 . 5.500 3.886 3.794 4.039 . 0 0 "[ . 1 . 2]" 1 1299 1 3 ASN QB 1 41 SER QB 3.650 . 4.500 3.295 2.310 4.186 . 0 0 "[ . 1 . 2]" 1 1300 1 34 MET ME 1 41 SER QB 3.650 . 5.500 4.549 4.301 4.850 . 0 0 "[ . 1 . 2]" 1 1301 1 5 LEU HA 1 41 SER QB 3.650 . 5.500 4.330 3.887 4.634 . 0 0 "[ . 1 . 2]" 1 1302 1 41 SER QB 1 42 PHE QD 3.650 . 5.500 5.057 4.854 5.223 . 0 0 "[ . 1 . 2]" 1 1303 1 3 ASN HA 1 5 LEU MD2 3.650 . 5.500 5.008 4.743 5.145 . 0 0 "[ . 1 . 2]" 1 1304 1 5 LEU HB3 1 41 SER QB 3.650 . 5.500 4.471 3.979 4.781 . 0 0 "[ . 1 . 2]" 1 1305 1 8 ILE HG13 1 36 VAL HA 3.650 . 5.500 3.815 3.539 3.973 . 0 0 "[ . 1 . 2]" 1 1306 1 3 ASN QB 1 5 LEU MD2 3.650 . 5.500 3.724 3.266 4.124 . 0 0 "[ . 1 . 2]" 1 1307 1 11 ILE HG12 1 36 VAL HA 3.150 . 4.500 3.980 3.700 4.295 . 0 0 "[ . 1 . 2]" 1 1308 1 8 ILE HG12 1 36 VAL HA 3.150 . 4.500 4.348 4.196 4.443 . 0 0 "[ . 1 . 2]" 1 1309 1 10 GLU HG3 1 36 VAL HA 4.150 . 6.500 5.598 5.370 5.852 . 0 0 "[ . 1 . 2]" 1 1310 1 8 ILE HA 1 36 VAL HA 3.650 . 5.500 4.502 4.372 4.611 . 0 0 "[ . 1 . 2]" 1 1311 1 24 GLU QG 1 26 LEU MD1 3.150 . 4.500 3.536 3.238 3.968 . 0 0 "[ . 1 . 2]" 1 1312 1 26 LEU MD1 1 28 ILE MG 3.650 . 5.500 4.634 4.450 4.837 . 0 0 "[ . 1 . 2]" 1 1313 1 18 VAL QG 1 26 LEU MD1 3.650 . 5.500 3.396 3.219 3.686 . 0 0 "[ . 1 . 2]" 1 1314 1 15 LYS HA 1 15 LYS HG2 3.150 . 4.500 2.650 2.493 2.738 . 0 0 "[ . 1 . 2]" 1 1315 1 26 LEU MD1 1 42 PHE QE 3.150 . 4.500 3.815 3.327 4.384 . 0 0 "[ . 1 . 2]" 1 1316 1 35 LYS QG 1 36 VAL H 3.150 . 4.500 4.018 3.571 4.268 . 0 0 "[ . 1 . 2]" 1 1317 1 15 LYS H 1 15 LYS HG2 3.650 . 5.500 3.765 3.494 3.887 . 0 0 "[ . 1 . 2]" 1 1318 1 28 ILE HG12 1 29 ARG H 3.650 . 5.500 4.632 4.501 4.720 . 0 0 "[ . 1 . 2]" 1 1319 1 5 LEU HA 1 5 LEU MD1 3.650 . 5.500 3.880 3.824 3.912 . 0 0 "[ . 1 . 2]" 1 1320 1 5 LEU MD1 1 41 SER HA 3.650 . 5.500 4.982 4.813 5.144 . 0 0 "[ . 1 . 2]" 1 1321 1 28 ILE HA 1 28 ILE HG12 3.650 . 5.500 3.845 3.807 3.902 . 0 0 "[ . 1 . 2]" 1 1322 1 16 ALA HA 1 28 ILE HG12 3.650 . 5.500 3.778 3.736 3.855 . 0 0 "[ . 1 . 2]" 1 1323 1 5 LEU MD1 1 41 SER QB 3.650 . 5.500 4.793 4.280 5.215 . 0 0 "[ . 1 . 2]" 1 1324 1 4 ARG HA 1 5 LEU MD1 3.650 . 5.500 4.692 4.543 4.828 . 0 0 "[ . 1 . 2]" 1 1325 1 16 ALA HA 1 28 ILE HG13 3.650 . 5.500 4.266 4.149 4.360 . 0 0 "[ . 1 . 2]" 1 1326 1 17 VAL HB 1 28 ILE HG12 3.650 . 5.500 4.282 3.960 4.468 . 0 0 "[ . 1 . 2]" 1 1327 1 5 LEU MD1 1 39 GLN QG 3.650 . 5.500 3.800 3.310 4.369 . 0 0 "[ . 1 . 2]" 1 1328 1 3 ASN QB 1 5 LEU MD1 3.650 . 5.500 5.209 4.872 5.500 . 0 0 "[ . 1 . 2]" 1 1329 1 19 LEU HA 1 19 LEU MD2 3.150 . 4.500 3.933 3.906 3.969 . 0 0 "[ . 1 . 2]" 1 1330 1 19 LEU MD2 1 25 PHE QE 3.650 . 5.500 3.208 2.944 3.471 . 0 0 "[ . 1 . 2]" 1 1331 1 9 TYR QD 1 19 LEU MD2 3.650 . 4.500 2.630 2.430 2.892 . 0 0 "[ . 1 . 2]" 1 1332 1 9 TYR HB2 1 19 LEU MD2 3.650 . 5.500 3.908 3.680 4.267 . 0 0 "[ . 1 . 2]" 1 1333 1 19 LEU MD2 1 23 GLY HA2 3.650 . 5.500 3.826 3.632 4.084 . 0 0 "[ . 1 . 2]" 1 1334 1 18 VAL QG 1 26 LEU MD2 3.150 . 4.500 3.312 2.788 3.643 . 0 0 "[ . 1 . 2]" 1 1335 1 26 LEU MD2 1 27 ILE H 3.650 . 5.500 4.354 4.100 4.600 . 0 0 "[ . 1 . 2]" 1 1336 1 19 LEU H 1 19 LEU MD2 3.150 . 4.500 4.232 4.134 4.258 . 0 0 "[ . 1 . 2]" 1 1337 1 5 LEU H 1 26 LEU MD2 4.150 . 6.500 6.289 5.823 6.520 0.020 18 0 "[ . 1 . 2]" 1 1338 1 7 ILE HG12 1 19 LEU MD2 3.650 . 5.500 5.261 4.915 5.515 0.015 3 0 "[ . 1 . 2]" 1 1339 1 26 LEU MD2 1 28 ILE MG 3.650 . 5.500 3.325 2.973 3.598 . 0 0 "[ . 1 . 2]" 1 1340 1 20 THR HA 1 26 LEU MD2 3.650 . 5.500 5.156 4.883 5.437 . 0 0 "[ . 1 . 2]" 1 1341 1 19 LEU MD2 1 25 PHE H 4.150 . 6.500 6.449 6.286 6.547 0.047 17 0 "[ . 1 . 2]" 1 1342 1 4 ARG HD3 1 26 LEU MD2 3.650 . 5.500 4.412 2.878 5.196 . 0 0 "[ . 1 . 2]" 1 1343 1 26 LEU H 1 26 LEU HG 3.150 . 4.500 4.299 4.072 4.483 . 0 0 "[ . 1 . 2]" 1 1344 1 4 ARG QG 1 5 LEU H 3.650 . 5.500 2.158 1.969 2.499 . 0 0 "[ . 1 . 2]" 1 1345 1 5 LEU HG 1 6 GLY H 3.650 . 5.500 5.154 5.070 5.208 . 0 0 "[ . 1 . 2]" 1 1346 1 4 ARG QG 1 26 LEU MD2 3.150 . 4.500 3.293 2.778 4.073 . 0 0 "[ . 1 . 2]" 1 1347 1 5 LEU HA 1 5 LEU HG 3.150 . 4.500 3.174 3.090 3.266 . 0 0 "[ . 1 . 2]" 1 1348 1 5 LEU HG 1 41 SER HA 3.650 . 5.500 4.460 4.224 4.682 . 0 0 "[ . 1 . 2]" 1 1349 1 30 ARG HG2 1 31 ARG H 3.150 . 4.500 2.665 2.547 2.811 . 0 0 "[ . 1 . 2]" 1 1350 1 5 LEU H 1 5 LEU HG 3.150 . 4.500 2.917 2.652 3.199 . 0 0 "[ . 1 . 2]" 1 1351 1 30 ARG H 1 30 ARG HG3 3.650 . 5.500 4.598 4.484 4.658 . 0 0 "[ . 1 . 2]" 1 1352 1 11 ILE HG13 1 12 GLN H 3.650 . 5.500 5.307 5.170 5.392 . 0 0 "[ . 1 . 2]" 1 1353 1 7 ILE HA 1 8 ILE HG12 3.150 . 4.500 3.471 3.401 3.541 . 0 0 "[ . 1 . 2]" 1 1354 1 7 ILE HA 1 7 ILE HG12 3.150 . 4.500 2.554 2.505 2.662 . 0 0 "[ . 1 . 2]" 1 1355 1 7 ILE HG13 1 39 GLN HB3 3.150 . 4.500 3.951 3.707 4.179 . 0 0 "[ . 1 . 2]" 1 1356 1 8 ILE HG12 1 18 VAL QG 3.650 . 5.500 3.356 3.185 3.628 . 0 0 "[ . 1 . 2]" 1 1357 1 7 ILE HG13 1 18 VAL MG1 3.150 . 4.500 4.153 4.061 4.235 . 0 0 "[ . 1 . 2]" 1 1358 1 27 ILE H 1 27 ILE HG13 3.650 . 5.500 3.840 3.754 3.929 . 0 0 "[ . 1 . 2]" 1 1359 1 8 ILE HG12 1 34 MET HA 3.150 . 4.500 3.987 3.341 4.528 0.028 8 0 "[ . 1 . 2]" 1 1360 1 27 ILE HA 1 27 ILE HG13 3.150 . 4.500 3.840 3.804 3.880 . 0 0 "[ . 1 . 2]" 1 1361 1 11 ILE HG13 1 16 ALA HA 3.650 . 5.500 5.351 5.202 5.490 . 0 0 "[ . 1 . 2]" 1 1362 1 7 ILE HG13 1 21 SER HA 3.150 . 4.500 3.660 3.576 3.737 . 0 0 "[ . 1 . 2]" 1 1363 1 44 ASN HA 1 47 ILE HG12 3.150 . 4.500 3.607 3.457 3.870 . 0 0 "[ . 1 . 2]" 1 1364 1 29 ARG HG2 1 30 ARG H 3.150 . 4.500 4.208 2.960 4.413 . 0 0 "[ . 1 . 2]" 1 1365 1 8 ILE HG12 1 35 LYS H 3.650 . 5.500 3.736 3.380 3.970 . 0 0 "[ . 1 . 2]" 1 1366 1 29 ARG HG3 1 30 ARG H 3.650 . 5.500 5.040 3.133 5.301 . 0 0 "[ . 1 . 2]" 1 1367 1 8 ILE HG12 1 34 MET HG3 3.150 . 4.500 3.671 3.309 3.851 . 0 0 "[ . 1 . 2]" 1 1368 1 8 ILE HB 1 11 ILE HG13 4.150 . 6.500 6.105 5.616 6.506 0.006 16 0 "[ . 1 . 2]" 1 1369 1 45 GLU HB3 1 45 GLU HG3 2.650 . 3.500 2.895 2.466 3.015 . 0 0 "[ . 1 . 2]" 1 1370 1 42 PHE QD 1 47 ILE HG12 3.650 . 4.500 3.012 2.635 3.399 . 0 0 "[ . 1 . 2]" 1 1371 1 42 PHE QE 1 47 ILE HG12 3.150 . 4.500 2.362 2.113 2.540 . 0 0 "[ . 1 . 2]" 1 1372 1 11 ILE H 1 11 ILE HG13 3.650 . 5.500 4.155 3.990 4.303 . 0 0 "[ . 1 . 2]" 1 1373 1 28 ILE HB 1 47 ILE HG12 3.150 . 4.500 4.227 3.754 4.503 0.003 11 0 "[ . 1 . 2]" 1 1374 1 28 ILE MG 1 47 ILE HG13 3.650 . 5.500 3.149 2.810 3.452 . 0 0 "[ . 1 . 2]" 1 1375 1 42 PHE QE 1 47 ILE HG13 3.650 . 5.500 3.249 2.917 3.474 . 0 0 "[ . 1 . 2]" 1 1376 1 46 ASP H 1 47 ILE HG12 3.650 . 5.500 4.853 4.468 5.220 . 0 0 "[ . 1 . 2]" 1 1377 1 47 ILE HA 1 47 ILE HG12 3.150 . 4.500 2.636 2.528 2.833 . 0 0 "[ . 1 . 2]" 1 1378 1 47 ILE HA 1 47 ILE HG13 3.150 . 4.500 3.073 2.935 3.192 . 0 0 "[ . 1 . 2]" 1 1379 1 44 ASN HA 1 47 ILE HG13 3.650 . 5.500 2.161 1.956 2.414 . 0 0 "[ . 1 . 2]" 1 1380 1 45 GLU H 1 45 GLU HB2 3.150 . 4.500 2.448 2.181 2.629 . 0 0 "[ . 1 . 2]" 1 1381 1 35 LYS H 1 35 LYS QD 3.150 . 4.500 3.787 2.845 4.449 . 0 0 "[ . 1 . 2]" 1 1382 1 22 GLU H 1 22 GLU HB3 3.650 . 5.500 3.587 3.512 3.628 . 0 0 "[ . 1 . 2]" 1 1383 1 45 GLU HA 1 45 GLU HB3 2.650 . 3.500 2.444 2.399 2.513 . 0 0 "[ . 1 . 2]" 1 1384 1 32 LYS HA 1 32 LYS QD 3.150 . 4.500 3.654 2.029 4.222 . 0 0 "[ . 1 . 2]" 1 1385 1 15 LYS HA 1 15 LYS QD 3.650 . 5.500 3.875 3.733 3.978 . 0 0 "[ . 1 . 2]" 1 1386 1 7 ILE MG 1 38 GLN QB 3.150 . 4.500 3.568 3.193 3.805 . 0 0 "[ . 1 . 2]" 1 1387 1 39 GLN HB3 1 40 VAL H 3.650 . 5.500 4.103 3.950 4.245 . 0 0 "[ . 1 . 2]" 1 1388 1 29 ARG QB 1 30 ARG H 3.150 . 4.500 3.177 3.023 3.682 . 0 0 "[ . 1 . 2]" 1 1389 1 24 GLU HA 1 24 GLU HB2 2.650 . 3.500 2.976 2.966 2.988 . 0 0 "[ . 1 . 2]" 1 1390 1 29 ARG QB 1 46 ASP HB2 3.150 . 4.500 4.350 3.844 4.551 0.051 18 0 "[ . 1 . 2]" 1 1391 1 35 LYS HB2 1 38 GLN QB 3.650 . 5.500 3.672 3.100 4.087 . 0 0 "[ . 1 . 2]" 1 1392 1 35 LYS QG 1 38 GLN QB 3.650 . 5.500 5.276 4.744 5.573 0.073 19 0 "[ . 1 . 2]" 1 1393 1 28 ILE HA 1 29 ARG QB 3.650 . 5.500 4.588 4.036 4.739 . 0 0 "[ . 1 . 2]" 1 1394 1 29 ARG QB 1 48 TYR QE 3.650 . 5.500 3.692 2.403 4.077 . 0 0 "[ . 1 . 2]" 1 1395 1 15 LYS H 1 30 ARG HB2 3.150 . 4.500 3.544 3.417 3.670 . 0 0 "[ . 1 . 2]" 1 1396 1 14 MET HA 1 30 ARG HB3 3.650 . 5.500 2.543 2.303 2.741 . 0 0 "[ . 1 . 2]" 1 1397 1 15 LYS H 1 30 ARG HB3 3.650 . 5.500 3.592 3.469 3.699 . 0 0 "[ . 1 . 2]" 1 1398 1 14 MET HA 1 30 ARG HB2 3.150 . 4.500 3.793 3.519 4.086 . 0 0 "[ . 1 . 2]" 1 1399 1 24 GLU H 1 24 GLU HB3 3.150 . 4.500 3.675 3.599 3.770 . 0 0 "[ . 1 . 2]" 1 1400 1 24 GLU HB2 1 25 PHE H 3.150 . 4.500 3.942 3.748 4.066 . 0 0 "[ . 1 . 2]" 1 1401 1 2 MET HA 1 2 MET HB3 2.650 . 3.500 2.574 2.324 3.022 . 0 0 "[ . 1 . 2]" 1 1402 1 2 MET HA 1 2 MET HG2 3.150 . 4.500 3.062 2.533 3.800 . 0 0 "[ . 1 . 2]" 1 1403 1 14 MET HA 1 14 MET HG2 3.150 . 4.500 2.553 2.267 2.989 . 0 0 "[ . 1 . 2]" 1 1404 1 14 MET HA 1 14 MET HG3 3.650 . 5.500 3.553 3.064 3.838 . 0 0 "[ . 1 . 2]" 1 1405 1 43 GLU H 1 43 GLU HB3 3.150 . 4.500 3.619 3.436 3.723 . 0 0 "[ . 1 . 2]" 1 1406 1 43 GLU HB2 1 44 ASN H 3.150 . 4.500 2.859 2.506 3.137 . 0 0 "[ . 1 . 2]" 1 1407 1 2 MET HB3 1 3 ASN H 3.150 . 4.500 3.752 2.662 4.411 . 0 0 "[ . 1 . 2]" 1 1408 1 9 TYR QD 1 17 VAL HB 3.650 . 5.500 3.605 3.312 3.870 . 0 0 "[ . 1 . 2]" 1 1409 1 16 ALA HA 1 17 VAL HB 3.150 . 4.500 4.030 3.990 4.063 . 0 0 "[ . 1 . 2]" 1 1410 1 12 GLN H 1 12 GLN HG3 3.650 . 5.500 4.196 3.152 4.666 . 0 0 "[ . 1 . 2]" 1 1411 1 12 GLN HE22 1 12 GLN HG2 3.650 . 5.500 3.974 3.464 4.087 . 0 0 "[ . 1 . 2]" 1 1412 1 12 GLN HE22 1 12 GLN HG3 3.650 . 5.500 3.544 3.417 4.098 . 0 0 "[ . 1 . 2]" 1 1413 1 34 MET H 1 34 MET HG3 3.150 . 4.500 4.111 3.547 4.423 . 0 0 "[ . 1 . 2]" 1 1414 1 31 ARG H 1 34 MET HG3 3.650 . 5.500 4.027 3.754 4.167 . 0 0 "[ . 1 . 2]" 1 1415 1 34 MET HB2 1 35 LYS H 3.650 . 5.500 4.514 4.435 4.577 . 0 0 "[ . 1 . 2]" 1 1416 1 10 GLU H 1 10 GLU HB3 3.650 . 5.500 3.065 2.965 3.173 . 0 0 "[ . 1 . 2]" 1 1417 1 9 TYR QD 1 10 GLU HB2 3.650 . 4.500 2.564 2.127 2.880 . 0 0 "[ . 1 . 2]" 1 1418 1 9 TYR QD 1 10 GLU HB3 3.650 . 5.500 3.439 3.158 3.677 . 0 0 "[ . 1 . 2]" 1 1419 1 34 MET H 1 34 MET HB2 3.150 . 4.500 2.242 2.100 2.648 . 0 0 "[ . 1 . 2]" 1 1420 1 10 GLU HB3 1 11 ILE H 3.650 . 5.500 3.535 3.291 4.010 . 0 0 "[ . 1 . 2]" 1 1421 1 10 GLU HB2 1 11 ILE H 3.650 . 5.500 4.000 3.849 4.244 . 0 0 "[ . 1 . 2]" 1 1422 1 8 ILE MG 1 34 MET HG3 3.650 . 5.500 3.546 2.972 4.051 . 0 0 "[ . 1 . 2]" 1 1423 1 8 ILE MG 1 34 MET HG2 3.650 . 5.500 3.246 2.141 3.775 . 0 0 "[ . 1 . 2]" 1 1424 1 30 ARG HB2 1 34 MET HG2 3.650 . 5.500 3.708 3.133 4.030 . 0 0 "[ . 1 . 2]" 1 1425 1 35 LYS HB2 1 38 GLN QG 3.150 . 4.500 2.699 2.028 3.377 . 0 0 "[ . 1 . 2]" 1 1426 1 8 ILE MG 1 34 MET HB2 3.650 . 5.500 3.568 3.213 4.395 . 0 0 "[ . 1 . 2]" 1 1427 1 8 ILE MD 1 34 MET HB2 3.150 . 4.500 3.694 3.206 4.154 . 0 0 "[ . 1 . 2]" 1 1428 1 10 GLU HB2 1 17 VAL MG1 3.150 . 4.500 3.654 3.487 3.778 . 0 0 "[ . 1 . 2]" 1 1429 1 8 ILE MD 1 34 MET HB3 3.150 . 4.500 2.994 2.338 3.956 . 0 0 "[ . 1 . 2]" 1 1430 1 10 GLU HB3 1 17 VAL MG1 2.650 . 3.500 3.404 3.189 3.536 0.036 10 0 "[ . 1 . 2]" 1 1431 1 7 ILE H 1 18 VAL HB 3.650 . 5.500 3.507 3.321 3.679 . 0 0 "[ . 1 . 2]" 1 1432 1 18 VAL HB 1 21 SER H 3.150 . 4.500 4.319 4.180 4.486 . 0 0 "[ . 1 . 2]" 1 1433 1 39 GLN HE21 1 39 GLN HG2 3.150 . 4.500 3.210 2.887 3.486 . 0 0 "[ . 1 . 2]" 1 1434 1 6 GLY HA2 1 18 VAL HB 3.150 . 4.500 3.647 3.505 3.773 . 0 0 "[ . 1 . 2]" 1 1435 1 18 VAL HB 1 28 ILE MG 3.650 . 5.500 4.385 4.181 4.565 . 0 0 "[ . 1 . 2]" 1 1436 1 18 VAL HB 1 28 ILE MD 3.150 . 4.500 4.136 4.009 4.254 . 0 0 "[ . 1 . 2]" 1 1437 1 39 GLN HG2 1 40 VAL H 3.150 . 4.500 3.044 2.696 3.459 . 0 0 "[ . 1 . 2]" 1 1438 1 39 GLN HG3 1 40 VAL H 3.650 . 5.500 3.406 3.055 3.713 . 0 0 "[ . 1 . 2]" 1 1439 1 18 VAL HB 1 42 PHE QD 3.150 . 4.500 3.614 3.334 3.908 . 0 0 "[ . 1 . 2]" 1 1440 1 39 GLN HE22 1 39 GLN HG3 3.650 . 5.500 3.478 3.450 3.505 . 0 0 "[ . 1 . 2]" 1 1441 1 6 GLY HA3 1 18 VAL HB 3.150 . 4.500 2.111 2.020 2.222 . 0 0 "[ . 1 . 2]" 1 1442 1 8 ILE HA 1 18 VAL HB 3.650 . 5.500 4.621 4.410 4.776 . 0 0 "[ . 1 . 2]" 1 1443 1 5 LEU HB3 1 39 GLN HG3 3.150 . 4.500 2.782 2.518 2.929 . 0 0 "[ . 1 . 2]" 1 1444 1 5 LEU HB3 1 39 GLN HG2 3.650 . 5.500 2.856 2.533 3.195 . 0 0 "[ . 1 . 2]" 1 1445 1 15 LYS H 1 15 LYS HB2 3.150 . 4.500 2.621 2.508 2.729 . 0 0 "[ . 1 . 2]" 1 1446 1 8 ILE HG12 1 40 VAL HB 3.150 . 4.500 4.448 4.160 4.552 0.052 3 0 "[ . 1 . 2]" 1 1447 1 15 LYS HB2 1 16 ALA H 3.150 . 4.500 3.600 3.524 3.667 . 0 0 "[ . 1 . 2]" 1 1448 1 40 VAL H 1 40 VAL HB 3.150 . 4.500 3.757 3.721 3.790 . 0 0 "[ . 1 . 2]" 1 1449 1 40 VAL HB 1 41 SER QB 3.650 . 5.500 4.779 4.564 5.089 . 0 0 "[ . 1 . 2]" 1 1450 1 8 ILE HG13 1 40 VAL HB 3.650 . 5.500 5.355 5.231 5.514 0.014 17 0 "[ . 1 . 2]" 1 1451 1 18 VAL MG1 1 40 VAL HB 3.650 . 5.500 4.805 4.581 5.157 . 0 0 "[ . 1 . 2]" 1 1452 1 8 ILE HB 1 37 GLY HA2 3.650 . 5.500 4.497 4.256 4.677 . 0 0 "[ . 1 . 2]" 1 1453 1 20 THR MG 1 24 GLU QG 3.150 . 4.500 4.397 3.921 4.548 0.048 16 0 "[ . 1 . 2]" 1 1454 1 35 LYS HB3 1 36 VAL H 3.150 . 4.500 2.938 2.697 3.214 . 0 0 "[ . 1 . 2]" 1 1455 1 35 LYS HB2 1 36 VAL H 3.650 . 5.500 3.969 3.592 4.210 . 0 0 "[ . 1 . 2]" 1 1456 1 7 ILE HA 1 8 ILE HB 3.150 . 4.500 4.227 3.589 4.509 0.009 7 0 "[ . 1 . 2]" 1 1457 1 5 LEU H 1 22 GLU HG3 3.650 . 5.500 4.264 3.857 4.581 . 0 0 "[ . 1 . 2]" 1 1458 1 2 MET QB 1 44 ASN QB 3.150 . 4.500 2.737 1.939 4.242 . 0 0 "[ . 1 . 2]" 1 1459 1 43 GLU HB3 1 44 ASN QB 3.650 . 5.500 3.989 3.811 4.301 . 0 0 "[ . 1 . 2]" 1 1460 1 43 GLU HA 1 44 ASN QB 3.650 . 5.500 4.439 4.288 4.752 . 0 0 "[ . 1 . 2]" 1 1461 1 27 ILE HB 1 48 TYR QD 3.150 . 4.500 4.304 3.969 4.517 0.017 8 0 "[ . 1 . 2]" 1 1462 1 44 ASN HA 1 47 ILE HB 3.150 . 4.500 3.480 3.069 3.917 . 0 0 "[ . 1 . 2]" 1 1463 1 46 ASP H 1 47 ILE HB 3.650 . 5.500 4.706 4.380 4.917 . 0 0 "[ . 1 . 2]" 1 1464 1 42 PHE QE 1 47 ILE HB 3.650 . 5.500 5.077 4.882 5.359 . 0 0 "[ . 1 . 2]" 1 1465 1 28 ILE MG 1 47 ILE HB 3.150 . 4.500 4.090 3.918 4.231 . 0 0 "[ . 1 . 2]" 1 1466 1 48 TYR HB3 1 49 ASN H 3.150 . 4.500 3.579 2.998 3.884 . 0 0 "[ . 1 . 2]" 1 1467 1 3 ASN QB 1 5 LEU H 3.650 . 5.500 5.232 5.026 5.357 . 0 0 "[ . 1 . 2]" 1 1468 1 11 ILE HB 1 11 ILE HG13 2.300 . 2.800 1.994 1.982 1.999 . 0 0 "[ . 1 . 2]" 1 1469 1 28 ILE HA 1 48 TYR HB3 3.650 . 5.500 4.812 4.601 4.941 . 0 0 "[ . 1 . 2]" 1 1470 1 3 ASN QB 1 43 GLU QG 3.650 . 4.500 4.092 3.785 4.517 0.017 1 0 "[ . 1 . 2]" 1 1471 1 47 ILE MG 1 49 ASN HB2 3.150 . 4.500 2.232 1.899 3.771 . 0 0 "[ . 1 . 2]" 1 1472 1 15 LYS QD 1 48 TYR HB2 3.150 . 4.500 4.165 3.402 4.520 0.020 18 0 "[ . 1 . 2]" 1 1473 1 19 LEU HB3 1 25 PHE HB3 4.150 . 6.500 6.523 6.510 6.544 0.044 5 0 "[ . 1 . 2]" 1 1474 1 28 ILE MG 1 42 PHE HB3 3.650 . 4.500 4.051 3.504 4.512 0.012 7 0 "[ . 1 . 2]" 1 1475 1 8 ILE MD 1 42 PHE HB2 3.650 . 5.500 4.460 4.108 4.733 . 0 0 "[ . 1 . 2]" 1 1476 1 24 GLU QB 1 25 PHE HB2 3.650 . 5.500 5.042 4.837 5.243 . 0 0 "[ . 1 . 2]" 1 1477 1 10 GLU HG3 1 11 ILE HB 3.650 . 5.500 4.895 4.161 5.169 . 0 0 "[ . 1 . 2]" 1 1478 1 10 GLU HG2 1 11 ILE HB 3.650 . 5.500 4.421 4.143 5.030 . 0 0 "[ . 1 . 2]" 1 1479 1 7 ILE HB 1 9 TYR QE 4.150 . 6.500 6.295 5.886 6.535 0.035 20 0 "[ . 1 . 2]" 1 1480 1 40 VAL MG2 1 42 PHE HB3 3.150 . 4.500 3.139 2.713 3.496 . 0 0 "[ . 1 . 2]" 1 1481 1 7 ILE HB 1 19 LEU MD2 3.150 . 4.500 3.279 2.918 3.492 . 0 0 "[ . 1 . 2]" 1 1482 1 7 ILE HB 1 9 TYR QD 3.650 . 5.500 4.344 3.989 4.622 . 0 0 "[ . 1 . 2]" 1 1483 1 7 ILE HB 1 8 ILE H 3.150 . 4.500 4.063 4.008 4.100 . 0 0 "[ . 1 . 2]" 1 1484 1 7 ILE HB 1 19 LEU H 3.150 . 4.500 3.297 3.152 3.469 . 0 0 "[ . 1 . 2]" 1 1485 1 8 ILE HA 1 9 TYR HB2 3.150 . 4.500 4.257 4.111 4.365 . 0 0 "[ . 1 . 2]" 1 1486 1 9 TYR HB2 1 17 VAL HB 3.150 . 4.500 4.154 3.938 4.455 . 0 0 "[ . 1 . 2]" 1 1487 1 15 LYS HE2 1 27 ILE MG 3.150 . 4.500 4.093 3.485 4.569 0.069 13 0 "[ . 1 . 2]" 1 1488 1 15 LYS HE3 1 27 ILE MG 3.650 . 5.500 4.525 3.715 5.082 . 0 0 "[ . 1 . 2]" 1 1489 1 9 TYR HB3 1 9 TYR QD 2.650 . 3.500 2.346 2.298 2.385 . 0 0 "[ . 1 . 2]" 1 1490 1 9 TYR HB3 1 18 VAL HA 3.150 . 4.500 4.191 3.919 4.380 . 0 0 "[ . 1 . 2]" 1 1491 1 9 TYR HB2 1 18 VAL HA 3.650 . 5.500 3.699 3.462 3.879 . 0 0 "[ . 1 . 2]" 1 1492 1 12 GLN HB2 1 15 LYS HE2 3.650 . 5.500 4.341 4.098 4.753 . 0 0 "[ . 1 . 2]" 1 1493 1 12 GLN HB2 1 15 LYS HE3 3.650 . 5.500 4.301 3.035 4.539 . 0 0 "[ . 1 . 2]" 1 1494 1 14 MET HG3 1 15 LYS HE3 4.150 . 6.500 5.891 4.570 6.506 0.006 15 0 "[ . 1 . 2]" 1 1495 1 15 LYS HE3 1 48 TYR QE 3.650 . 5.500 4.406 3.151 5.484 . 0 0 "[ . 1 . 2]" 1 1496 1 32 LYS HA 1 32 LYS QE 3.650 . 5.500 4.346 2.529 5.014 . 0 0 "[ . 1 . 2]" 1 1497 1 28 ILE H 1 28 ILE HB 3.150 . 4.500 3.587 3.545 3.629 . 0 0 "[ . 1 . 2]" 1 1498 1 42 PHE QD 1 46 ASP HB3 3.650 . 5.500 4.132 3.782 4.747 . 0 0 "[ . 1 . 2]" 1 1499 1 28 ILE MD 1 46 ASP HB2 3.650 . 5.500 3.890 3.561 4.198 . 0 0 "[ . 1 . 2]" 1 1500 1 28 ILE HB 1 47 ILE HA 3.150 . 4.500 3.239 2.931 3.634 . 0 0 "[ . 1 . 2]" 1 1501 1 18 VAL QG 1 28 ILE HB 3.650 . 5.500 3.881 3.809 3.949 . 0 0 "[ . 1 . 2]" 1 1502 1 28 ILE HB 1 42 PHE QD 3.650 . 5.500 3.853 3.626 4.071 . 0 0 "[ . 1 . 2]" 1 1503 1 28 ILE HB 1 29 ARG HA 3.650 . 5.500 4.407 4.328 4.472 . 0 0 "[ . 1 . 2]" 1 1504 1 28 ILE HB 1 34 MET ME 3.650 . 5.500 4.243 3.976 4.605 . 0 0 "[ . 1 . 2]" 1 1505 1 4 ARG HA 1 4 ARG HD3 3.650 . 4.500 3.624 3.091 4.524 0.024 12 0 "[ . 1 . 2]" 1 1506 1 4 ARG HD3 1 42 PHE QE 3.150 . 4.500 4.336 2.602 4.550 0.050 13 0 "[ . 1 . 2]" 1 1507 1 29 ARG QD 1 46 ASP HA 3.650 . 5.500 2.847 1.996 4.364 . 0 0 "[ . 1 . 2]" 1 1508 1 4 ARG HD2 1 5 LEU MD1 3.650 . 5.500 5.075 4.144 5.493 . 0 0 "[ . 1 . 2]" 1 1509 1 29 ARG H 1 29 ARG QD 3.650 . 5.500 4.015 3.703 4.762 . 0 0 "[ . 1 . 2]" 1 1510 1 29 ARG QD 1 30 ARG H 3.650 . 5.500 5.216 4.677 5.449 . 0 0 "[ . 1 . 2]" 1 1511 1 4 ARG H 1 4 ARG HD2 3.650 . 5.500 4.574 4.086 4.736 . 0 0 "[ . 1 . 2]" 1 1512 1 9 TYR QE 1 19 LEU HB2 3.150 . 4.500 3.991 3.828 4.087 . 0 0 "[ . 1 . 2]" 1 1513 1 9 TYR QD 1 19 LEU HB2 3.650 . 5.500 3.008 2.821 3.200 . 0 0 "[ . 1 . 2]" 1 1514 1 9 TYR QE 1 19 LEU HB3 3.650 . 5.500 4.838 4.562 4.951 . 0 0 "[ . 1 . 2]" 1 1515 1 9 TYR QD 1 19 LEU HB3 3.650 . 5.500 3.325 3.017 3.553 . 0 0 "[ . 1 . 2]" 1 1516 1 19 LEU HB2 1 25 PHE QE 3.650 . 4.500 3.095 2.864 3.291 . 0 0 "[ . 1 . 2]" 1 1517 1 7 ILE H 1 19 LEU HB3 3.650 . 5.500 3.232 3.118 3.312 . 0 0 "[ . 1 . 2]" 1 1518 1 9 TYR HB3 1 19 LEU HB2 3.150 . 4.500 4.043 3.759 4.381 . 0 0 "[ . 1 . 2]" 1 1519 1 9 TYR HB3 1 19 LEU HB3 3.650 . 5.500 4.863 4.536 5.144 . 0 0 "[ . 1 . 2]" 1 1520 1 19 LEU HB2 1 20 THR H 3.650 . 5.500 4.391 4.358 4.434 . 0 0 "[ . 1 . 2]" 1 1521 1 15 LYS H 1 30 ARG QD 3.150 . 4.500 3.844 3.666 4.034 . 0 0 "[ . 1 . 2]" 1 1522 1 11 ILE HA 1 30 ARG QD 3.150 . 4.500 4.416 4.172 4.555 0.055 17 0 "[ . 1 . 2]" 1 1523 1 16 ALA MB 1 30 ARG QD 3.150 . 4.500 3.724 3.358 4.018 . 0 0 "[ . 1 . 2]" 1 1524 1 30 ARG QD 1 32 LYS HB3 3.650 . 5.500 4.216 3.907 4.514 . 0 0 "[ . 1 . 2]" 1 1525 1 5 LEU HB3 1 6 GLY H 3.150 . 4.500 3.208 2.955 3.406 . 0 0 "[ . 1 . 2]" 1 1526 1 5 LEU HB2 1 6 GLY H 3.150 . 4.500 4.127 3.967 4.274 . 0 0 "[ . 1 . 2]" 1 1527 1 25 PHE HA 1 26 LEU QB 3.650 . 5.500 4.188 4.016 4.299 . 0 0 "[ . 1 . 2]" 1 1528 1 22 GLU HA 1 23 GLY HA3 3.150 . 4.500 4.003 3.963 4.039 . 0 0 "[ . 1 . 2]" 1 1529 1 5 LEU HB2 1 6 GLY HA2 3.650 . 5.500 3.366 3.282 3.444 . 0 0 "[ . 1 . 2]" 1 1530 1 5 LEU QD 1 6 GLY HA2 3.650 . 5.500 3.812 3.736 3.858 . 0 0 "[ . 1 . 2]" 1 1531 1 26 LEU QB 1 27 ILE HB 3.650 . 5.500 3.540 3.245 3.915 . 0 0 "[ . 1 . 2]" 1 1532 1 19 LEU HG 1 23 GLY HA3 3.650 . 5.500 4.987 4.679 5.444 . 0 0 "[ . 1 . 2]" 1 1533 1 6 GLY HA2 1 42 PHE QE 3.150 . 4.500 3.571 3.385 3.807 . 0 0 "[ . 1 . 2]" 1 1534 1 5 LEU HB3 1 6 GLY HA2 3.650 . 5.500 3.359 3.271 3.432 . 0 0 "[ . 1 . 2]" 1 1535 1 26 LEU QB 1 26 LEU MD1 2.650 . 3.500 2.136 2.037 2.227 . 0 0 "[ . 1 . 2]" 1 1536 1 5 LEU HB3 1 39 GLN QG 3.650 . 5.500 2.700 2.461 3.055 . 0 0 "[ . 1 . 2]" 1 1537 1 5 LEU HB2 1 22 GLU HG3 4.150 . 6.500 4.618 4.231 5.073 . 0 0 "[ . 1 . 2]" 1 1538 1 12 GLN HA 1 13 GLY HA3 3.150 . 4.500 4.311 4.257 4.354 . 0 0 "[ . 1 . 2]" 1 1539 1 12 GLN HA 1 13 GLY HA2 3.650 . 5.500 3.978 3.891 4.049 . 0 0 "[ . 1 . 2]" 1 1540 1 12 GLN HB3 1 13 GLY HA3 3.650 . 5.500 4.016 3.924 4.104 . 0 0 "[ . 1 . 2]" 1 1541 1 13 GLY HA2 1 14 MET HG2 3.650 . 5.500 4.635 3.985 5.221 . 0 0 "[ . 1 . 2]" 1 1542 1 16 ALA HA 1 28 ILE H 3.650 . 5.500 4.708 4.667 4.775 . 0 0 "[ . 1 . 2]" 1 1543 1 16 ALA H 1 16 ALA HA 2.300 . 2.800 2.118 2.059 2.165 . 0 0 "[ . 1 . 2]" 1 1544 1 8 ILE MD 1 34 MET HG3 3.150 . 4.500 2.053 1.886 2.456 . 0 0 "[ . 1 . 2]" 1 1545 1 8 ILE MD 1 38 GLN HE22 3.650 . 5.500 4.845 4.492 5.200 . 0 0 "[ . 1 . 2]" 1 1546 1 8 ILE MD 1 34 MET H 4.150 . 6.500 5.399 4.915 5.957 . 0 0 "[ . 1 . 2]" 1 1547 1 8 ILE MD 1 9 TYR H 3.650 . 5.500 3.724 3.580 3.901 . 0 0 "[ . 1 . 2]" 1 1548 1 4 ARG H 1 5 LEU HA 3.150 . 4.500 4.309 4.194 4.392 . 0 0 "[ . 1 . 2]" 1 1549 1 5 LEU HA 1 39 GLN HE22 3.150 . 4.500 3.837 3.557 4.104 . 0 0 "[ . 1 . 2]" 1 1550 1 4 ARG HA 1 5 LEU HA 3.650 . 5.500 4.435 4.357 4.489 . 0 0 "[ . 1 . 2]" 1 1551 1 5 LEU HA 1 39 GLN QG 3.650 . 5.500 3.641 3.478 3.874 . 0 0 "[ . 1 . 2]" 1 1552 1 4 ARG HD3 1 5 LEU HA 4.150 . 6.500 5.724 5.529 5.864 . 0 0 "[ . 1 . 2]" 1 1553 1 3 ASN QB 1 5 LEU HA 3.650 . 5.500 5.317 4.986 5.532 0.032 15 0 "[ . 1 . 2]" 1 1554 1 5 LEU HA 1 18 VAL QG 3.650 . 5.500 5.044 4.907 5.177 . 0 0 "[ . 1 . 2]" 1 1555 1 7 ILE MD 1 39 GLN HE21 3.150 . 4.500 3.677 2.711 4.504 0.004 2 0 "[ . 1 . 2]" 1 1556 1 8 ILE MD 1 36 VAL HA 3.150 . 4.500 4.356 4.154 4.513 0.013 17 0 "[ . 1 . 2]" 1 1557 1 11 ILE H 1 11 ILE MD 3.650 . 5.500 3.946 3.846 4.140 . 0 0 "[ . 1 . 2]" 1 1558 1 11 ILE MD 1 16 ALA H 3.650 . 5.500 4.630 4.410 4.875 . 0 0 "[ . 1 . 2]" 1 1559 1 11 ILE MD 1 35 LYS H 3.650 . 5.500 4.705 4.374 5.025 . 0 0 "[ . 1 . 2]" 1 1560 1 25 PHE QD 1 27 ILE MD 3.650 . 5.500 5.209 4.917 5.430 . 0 0 "[ . 1 . 2]" 1 1561 1 11 ILE MD 1 16 ALA HA 3.650 . 5.500 2.555 2.353 2.739 . 0 0 "[ . 1 . 2]" 1 1562 1 11 ILE MD 1 36 VAL HA 3.650 . 5.500 4.116 3.964 4.399 . 0 0 "[ . 1 . 2]" 1 1563 1 11 ILE MD 1 30 ARG QD 3.150 . 4.500 2.439 2.212 2.728 . 0 0 "[ . 1 . 2]" 1 1564 1 11 ILE MD 1 34 MET HG3 3.650 . 5.500 4.045 3.366 4.679 . 0 0 "[ . 1 . 2]" 1 1565 1 11 ILE MD 1 34 MET HG2 3.150 . 4.500 3.432 2.179 4.064 . 0 0 "[ . 1 . 2]" 1 1566 1 10 GLU HG2 1 11 ILE MD 3.150 . 4.500 4.350 4.172 4.547 0.047 9 0 "[ . 1 . 2]" 1 1567 1 18 VAL MG2 1 27 ILE MD 3.650 . 5.500 4.712 4.560 4.919 . 0 0 "[ . 1 . 2]" 1 1568 1 4 ARG HA 1 42 PHE QE 3.650 . 5.500 4.680 4.583 4.786 . 0 0 "[ . 1 . 2]" 1 1569 1 24 GLU HA 1 25 PHE QD 3.150 . 4.500 3.494 3.246 3.719 . 0 0 "[ . 1 . 2]" 1 1570 1 24 GLU HA 1 25 PHE HA 3.150 . 4.500 4.376 4.338 4.423 . 0 0 "[ . 1 . 2]" 1 1571 1 4 ARG HA 1 5 LEU QD 3.150 . 4.500 4.095 3.874 4.331 . 0 0 "[ . 1 . 2]" 1 1572 1 3 ASN QB 1 4 ARG HA 3.650 . 5.500 4.043 3.766 4.181 . 0 0 "[ . 1 . 2]" 1 1573 1 4 ARG H 1 47 ILE MD 3.650 . 5.500 4.450 4.234 4.742 . 0 0 "[ . 1 . 2]" 1 1574 1 17 VAL H 1 28 ILE MD 3.650 . 5.500 5.505 5.360 5.523 0.023 6 0 "[ . 1 . 2]" 1 1575 1 28 ILE MD 1 30 ARG HA 3.650 . 4.500 3.778 3.563 4.075 . 0 0 "[ . 1 . 2]" 1 1576 1 6 GLY HA3 1 28 ILE MD 3.650 . 5.500 4.692 4.462 4.844 . 0 0 "[ . 1 . 2]" 1 1577 1 28 ILE MD 1 34 MET HB3 3.650 . 5.500 4.362 4.058 4.635 . 0 0 "[ . 1 . 2]" 1 1578 1 28 ILE MD 1 29 ARG QB 3.650 . 5.500 4.401 4.156 4.642 . 0 0 "[ . 1 . 2]" 1 1579 1 28 ILE MD 1 42 PHE QD 3.150 . 4.500 2.897 2.689 3.058 . 0 0 "[ . 1 . 2]" 1 1580 1 8 ILE HA 1 28 ILE MD 3.650 . 5.500 4.378 4.270 4.503 . 0 0 "[ . 1 . 2]" 1 1581 1 28 ILE MD 1 46 ASP QB 3.650 . 5.500 3.177 2.916 3.498 . 0 0 "[ . 1 . 2]" 1 1582 1 42 PHE HB2 1 47 ILE MD 4.150 . 6.500 5.367 5.038 5.558 . 0 0 "[ . 1 . 2]" 1 1583 1 20 THR MG 1 28 ILE MD 3.650 . 5.500 4.165 3.923 4.261 . 0 0 "[ . 1 . 2]" 1 1584 1 7 ILE HG12 1 39 GLN HA 2.650 . 3.500 3.078 2.936 3.259 . 0 0 "[ . 1 . 2]" 1 1585 1 7 ILE HB 1 39 GLN HA 3.650 . 5.500 4.671 4.565 4.725 . 0 0 "[ . 1 . 2]" 1 1586 1 34 MET ME 1 41 SER HA 3.650 . 5.500 4.387 4.174 4.573 . 0 0 "[ . 1 . 2]" 1 1587 1 41 SER HA 1 42 PHE HB3 4.150 . 6.500 4.754 4.572 4.865 . 0 0 "[ . 1 . 2]" 1 1588 1 4 ARG HB3 1 41 SER HA 3.650 . 5.500 5.338 4.960 5.521 0.021 5 0 "[ . 1 . 2]" 1 1589 1 18 VAL MG1 1 41 SER HA 4.150 . 6.500 5.929 5.395 6.175 . 0 0 "[ . 1 . 2]" 1 1590 1 30 ARG HA 1 34 MET HG3 3.650 . 5.500 4.336 3.878 4.599 . 0 0 "[ . 1 . 2]" 1 1591 1 30 ARG HA 1 34 MET HG2 3.650 . 5.500 2.793 2.244 4.007 . 0 0 "[ . 1 . 2]" 1 1592 1 24 GLU QB 1 25 PHE HA 3.650 . 5.500 4.233 4.103 4.341 . 0 0 "[ . 1 . 2]" 1 1593 1 19 LEU HB3 1 25 PHE HA 3.650 . 5.500 5.237 5.169 5.288 . 0 0 "[ . 1 . 2]" 1 1594 1 25 PHE HA 1 25 PHE QE 3.650 . 5.500 4.776 4.712 4.827 . 0 0 "[ . 1 . 2]" 1 1595 1 28 ILE HA 1 29 ARG HA 3.650 . 5.500 4.366 4.302 4.402 . 0 0 "[ . 1 . 2]" 1 1596 1 15 LYS HG2 1 29 ARG HA 3.150 . 4.500 3.820 3.074 4.247 . 0 0 "[ . 1 . 2]" 1 1597 1 8 ILE HG12 1 34 MET HA 2.650 . 3.500 2.834 2.421 2.923 . 0 0 "[ . 1 . 2]" 1 1598 1 27 ILE H 1 28 ILE MG 3.650 . 5.500 3.860 3.655 3.983 . 0 0 "[ . 1 . 2]" 1 1599 1 30 ARG HG3 1 34 MET HA 3.150 . 4.500 3.906 3.578 4.540 0.040 6 0 "[ . 1 . 2]" 1 1600 1 7 ILE MG 1 38 GLN H 3.150 . 4.500 3.773 3.567 3.874 . 0 0 "[ . 1 . 2]" 1 1601 1 7 ILE MG 1 9 TYR QD 3.150 . 4.500 4.185 3.919 4.514 0.014 17 0 "[ . 1 . 2]" 1 1602 1 7 ILE MG 1 8 ILE HA 3.150 . 4.500 4.150 4.078 4.254 . 0 0 "[ . 1 . 2]" 1 1603 1 28 ILE MG 1 42 PHE QE 3.150 . 4.500 2.742 2.481 3.027 . 0 0 "[ . 1 . 2]" 1 1604 1 6 GLY HA3 1 28 ILE MG 3.650 . 5.500 4.670 4.513 4.854 . 0 0 "[ . 1 . 2]" 1 1605 1 28 ILE MG 1 44 ASN HA 3.650 . 5.500 4.932 4.527 5.256 . 0 0 "[ . 1 . 2]" 1 1606 1 18 VAL QG 1 25 PHE HA 3.650 . 5.500 4.033 3.821 4.222 . 0 0 "[ . 1 . 2]" 1 1607 1 14 MET HB3 1 14 MET ME 2.650 . 3.500 2.771 2.076 3.399 . 0 0 "[ . 1 . 2]" 1 1608 1 11 ILE MG 1 30 ARG H 4.150 . 6.500 5.704 5.345 5.971 . 0 0 "[ . 1 . 2]" 1 1609 1 7 ILE MG 1 36 VAL HA 3.650 . 5.500 4.805 4.654 4.909 . 0 0 "[ . 1 . 2]" 1 1610 1 28 ILE HA 1 48 TYR QE 3.650 . 5.500 4.962 4.634 5.261 . 0 0 "[ . 1 . 2]" 1 1611 1 28 ILE HA 1 46 ASP HB3 4.150 . 6.500 4.195 3.732 4.482 . 0 0 "[ . 1 . 2]" 1 1612 1 28 ILE HA 1 48 TYR HB2 3.150 . 4.500 3.097 2.904 3.220 . 0 0 "[ . 1 . 2]" 1 1613 1 28 ILE HA 1 28 ILE HG13 3.650 . 5.500 3.636 3.614 3.660 . 0 0 "[ . 1 . 2]" 1 1614 1 18 VAL QG 1 28 ILE HA 3.650 . 5.500 4.506 4.430 4.623 . 0 0 "[ . 1 . 2]" 1 1615 1 28 ILE HA 1 46 ASP HB2 3.650 . 5.500 5.037 4.698 5.237 . 0 0 "[ . 1 . 2]" 1 1616 1 45 GLU HA 1 47 ILE H 3.150 . 4.500 3.845 3.697 4.028 . 0 0 "[ . 1 . 2]" 1 1617 1 27 ILE H 1 47 ILE MG 3.650 . 5.500 3.547 3.051 3.962 . 0 0 "[ . 1 . 2]" 1 1618 1 28 ILE HA 1 47 ILE MG 3.650 . 5.500 3.661 3.296 3.991 . 0 0 "[ . 1 . 2]" 1 1619 1 44 ASN HA 1 47 ILE MG 3.150 . 4.500 3.782 3.642 3.923 . 0 0 "[ . 1 . 2]" 1 1620 1 47 ILE MG 1 48 TYR HB2 3.650 . 5.500 4.163 3.670 4.393 . 0 0 "[ . 1 . 2]" 1 1621 1 44 ASN QB 1 47 ILE MG 4.150 . 6.500 4.413 4.148 4.615 . 0 0 "[ . 1 . 2]" 1 1622 1 11 ILE MD 1 11 ILE MG 2.650 . 3.500 1.972 1.828 2.025 . 0 0 "[ . 1 . 2]" 1 1623 1 42 PHE QE 1 47 ILE MG 3.150 . 4.500 3.825 3.417 4.105 . 0 0 "[ . 1 . 2]" 1 1624 1 26 LEU HG 1 47 ILE MG 3.650 . 5.500 3.332 2.448 3.680 . 0 0 "[ . 1 . 2]" 1 1625 1 26 LEU MD2 1 47 ILE MG 3.150 . 4.500 2.140 1.879 2.586 . 0 0 "[ . 1 . 2]" 1 1626 1 32 LYS HA 1 33 ASP QB 3.650 . 5.500 5.210 4.943 5.517 0.017 19 0 "[ . 1 . 2]" 1 1627 1 45 GLU HA 1 46 ASP HA 3.650 . 5.500 4.706 4.596 4.843 . 0 0 "[ . 1 . 2]" 1 1628 1 14 MET ME 1 32 LYS HA 3.650 . 5.500 4.276 3.638 4.513 . 0 0 "[ . 1 . 2]" 1 1629 1 8 ILE MG 1 11 ILE H 3.650 . 5.500 4.198 3.946 4.377 . 0 0 "[ . 1 . 2]" 1 1630 1 8 ILE MG 1 9 TYR HB2 3.650 . 5.500 5.033 4.890 5.136 . 0 0 "[ . 1 . 2]" 1 1631 1 11 ILE HA 1 27 ILE MG 3.650 . 5.500 4.791 4.651 4.935 . 0 0 "[ . 1 . 2]" 1 1632 1 17 VAL HA 1 27 ILE MG 3.650 . 5.500 3.983 3.597 4.203 . 0 0 "[ . 1 . 2]" 1 1633 1 31 ARG HD2 1 40 VAL MG1 3.650 . 5.500 5.034 4.575 5.405 . 0 0 "[ . 1 . 2]" 1 1634 1 10 GLU HB3 1 11 ILE HA 3.150 . 4.500 4.266 4.064 4.455 . 0 0 "[ . 1 . 2]" 1 1635 1 7 ILE HG13 1 21 SER HA 3.650 . 5.500 4.462 4.085 4.849 . 0 0 "[ . 1 . 2]" 1 1636 1 4 ARG HG3 1 21 SER HA 3.650 . 5.500 5.370 5.206 5.454 . 0 0 "[ . 1 . 2]" 1 1637 1 17 VAL MG2 1 26 LEU H 3.150 . 4.500 4.460 4.250 4.521 0.021 12 0 "[ . 1 . 2]" 1 1638 1 9 TYR QD 1 17 VAL MG1 3.650 . 5.500 2.942 2.654 3.250 . 0 0 "[ . 1 . 2]" 1 1639 1 12 GLN HE22 1 17 VAL MG1 3.150 . 4.500 3.658 3.515 3.793 . 0 0 "[ . 1 . 2]" 1 1640 1 9 TYR HB2 1 17 VAL MG1 3.150 . 4.500 3.206 2.962 3.447 . 0 0 "[ . 1 . 2]" 1 1641 1 5 LEU H 1 18 VAL MG2 4.150 . 6.500 6.278 6.005 6.508 0.008 17 0 "[ . 1 . 2]" 1 1642 1 9 TYR QE 1 17 VAL MG1 3.650 . 5.500 4.447 4.173 4.735 . 0 0 "[ . 1 . 2]" 1 1643 1 16 ALA H 1 18 VAL QG 3.650 . 5.500 3.918 3.834 4.044 . 0 0 "[ . 1 . 2]" 1 1644 1 35 LYS H 1 36 VAL MG2 3.650 . 5.500 4.718 4.627 4.795 . 0 0 "[ . 1 . 2]" 1 1645 1 9 TYR HB2 1 18 VAL MG1 3.150 . 4.500 3.861 3.594 4.220 . 0 0 "[ . 1 . 2]" 1 1646 1 18 VAL QG 1 42 PHE HB2 3.650 . 5.500 4.560 4.242 4.904 . 0 0 "[ . 1 . 2]" 1 1647 1 18 VAL MG1 1 41 SER HA 3.650 . 5.500 4.034 3.831 4.232 . 0 0 "[ . 1 . 2]" 1 1648 1 6 GLY HA3 1 19 LEU MD1 4.150 . 6.500 6.175 6.031 6.320 . 0 0 "[ . 1 . 2]" 1 1649 1 19 LEU MD1 1 24 GLU HA 3.650 . 4.500 3.629 3.341 3.866 . 0 0 "[ . 1 . 2]" 1 1650 1 8 ILE HB 1 18 VAL MG1 3.650 . 5.500 4.494 4.392 4.611 . 0 0 "[ . 1 . 2]" 1 1651 1 19 LEU MD1 1 24 GLU QG 3.650 . 5.500 4.885 4.594 5.164 . 0 0 "[ . 1 . 2]" 1 1652 1 19 LEU MD1 1 22 GLU HB2 3.650 . 5.500 4.825 4.642 5.020 . 0 0 "[ . 1 . 2]" 1 1653 1 8 ILE HA 1 36 VAL MG2 3.650 . 5.500 5.347 5.081 5.549 0.049 10 0 "[ . 1 . 2]" 1 1654 1 8 ILE HA 1 9 TYR QD 4.150 . 6.500 5.722 5.564 5.805 . 0 0 "[ . 1 . 2]" 1 1655 1 28 ILE MD 1 47 ILE HA 3.650 . 5.500 4.817 4.649 5.070 . 0 0 "[ . 1 . 2]" 1 1656 1 9 TYR H 1 17 VAL MG2 3.650 . 5.500 4.956 4.793 5.136 . 0 0 "[ . 1 . 2]" 1 1657 1 8 ILE H 1 16 ALA MB 3.150 . 4.500 4.032 3.874 4.211 . 0 0 "[ . 1 . 2]" 1 1658 1 17 VAL MG2 1 25 PHE HA 4.150 . 6.500 5.762 5.696 5.844 . 0 0 "[ . 1 . 2]" 1 1659 1 17 VAL MG2 1 27 ILE HG12 3.150 . 4.500 4.324 4.156 4.476 . 0 0 "[ . 1 . 2]" 1 1660 1 11 ILE HG12 1 36 VAL MG2 3.150 . 4.500 2.036 1.946 2.188 . 0 0 "[ . 1 . 2]" 1 1661 1 16 ALA MB 1 28 ILE MG 3.650 . 5.500 4.305 4.163 4.430 . 0 0 "[ . 1 . 2]" 1 1662 1 16 ALA MB 1 34 MET H 4.150 . 6.500 5.823 5.504 6.314 . 0 0 "[ . 1 . 2]" 1 1663 1 10 GLU H 1 16 ALA MB 3.650 . 5.500 4.413 4.290 4.571 . 0 0 "[ . 1 . 2]" 1 1664 1 11 ILE H 1 17 VAL MG2 3.650 . 5.500 4.540 4.092 5.081 . 0 0 "[ . 1 . 2]" 1 1665 1 14 MET HA 1 16 ALA MB 3.650 . 5.500 4.063 3.986 4.106 . 0 0 "[ . 1 . 2]" 1 1666 1 34 MET HG3 1 40 VAL MG2 3.650 . 5.500 2.870 2.162 3.688 . 0 0 "[ . 1 . 2]" 1 1667 1 6 GLY HA2 1 20 THR MG 3.650 . 5.500 3.471 3.374 3.598 . 0 0 "[ . 1 . 2]" 1 1668 1 7 ILE H 1 20 THR MG 3.650 . 5.500 4.561 4.442 4.630 . 0 0 "[ . 1 . 2]" 1 1669 1 20 THR MG 1 22 GLU H 3.650 . 5.500 3.976 3.842 4.233 . 0 0 "[ . 1 . 2]" 1 1670 1 6 GLY HA3 1 20 THR MG 3.650 . 5.500 2.870 2.715 3.065 . 0 0 "[ . 1 . 2]" 1 1671 1 20 THR MG 1 24 GLU QG 3.650 . 5.500 4.532 4.011 4.733 . 0 0 "[ . 1 . 2]" 1 1672 1 20 THR MG 1 28 ILE HG12 3.650 . 5.500 4.299 3.929 4.743 . 0 0 "[ . 1 . 2]" 1 1673 1 4 ARG HD3 1 20 THR MG 3.650 . 5.500 4.376 3.246 5.154 . 0 0 "[ . 1 . 2]" 1 1674 1 4 ARG HA 1 20 THR MG 3.650 . 5.500 4.763 4.590 4.972 . 0 0 "[ . 1 . 2]" 1 1675 1 20 THR MG 1 22 GLU HA 3.650 . 5.500 5.001 4.876 5.132 . 0 0 "[ . 1 . 2]" 1 1676 1 10 GLU H 1 36 VAL MG1 3.650 . 5.500 3.697 3.473 3.919 . 0 0 "[ . 1 . 2]" 1 1677 1 36 VAL MG1 1 38 GLN H 3.650 . 5.500 4.604 4.452 4.737 . 0 0 "[ . 1 . 2]" 1 1678 1 9 TYR H 1 36 VAL MG1 4.150 . 6.500 4.397 4.145 4.616 . 0 0 "[ . 1 . 2]" 1 1679 1 36 VAL MG1 1 37 GLY HA2 3.650 . 5.500 3.397 3.186 3.508 . 0 0 "[ . 1 . 2]" 1 1680 1 10 GLU HG3 1 36 VAL MG1 3.650 . 5.500 4.399 4.167 4.921 . 0 0 "[ . 1 . 2]" 1 1681 1 8 ILE HB 1 36 VAL MG1 3.650 . 5.500 3.668 3.499 3.787 . 0 0 "[ . 1 . 2]" 1 1682 1 10 GLU HB3 1 36 VAL MG1 3.650 . 5.500 4.694 4.589 4.897 . 0 0 "[ . 1 . 2]" 1 1683 1 8 ILE HG13 1 36 VAL MG1 3.650 . 5.500 5.389 5.130 5.524 0.024 2 0 "[ . 1 . 2]" 1 1684 1 18 VAL MG1 1 34 MET HB3 3.150 . 4.500 4.015 3.807 4.285 . 0 0 "[ . 1 . 2]" 1 1685 1 31 ARG H 1 31 ARG HB3 3.150 . 4.500 3.639 3.463 3.694 . 0 0 "[ . 1 . 2]" 1 1686 1 31 ARG HB3 1 31 ARG HD2 3.150 . 4.500 3.091 2.790 3.858 . 0 0 "[ . 1 . 2]" 1 1687 1 31 ARG HB3 1 31 ARG HD3 3.150 . 4.500 2.653 2.409 4.260 . 0 0 "[ . 1 . 2]" 1 1688 1 31 ARG HB2 1 31 ARG HD2 3.150 . 4.500 2.467 2.244 2.942 . 0 0 "[ . 1 . 2]" 1 1689 1 31 ARG HB2 1 31 ARG HD3 3.150 . 4.500 3.029 2.277 3.688 . 0 0 "[ . 1 . 2]" 1 1690 1 31 ARG HB3 1 33 ASP QB 3.150 . 4.500 4.106 3.484 4.553 0.053 18 0 "[ . 1 . 2]" 1 1691 1 31 ARG H 1 31 ARG HB2 3.150 . 4.500 2.505 2.285 2.627 . 0 0 "[ . 1 . 2]" 1 1692 1 14 MET HB2 1 14 MET HG2 2.650 . 3.500 2.739 2.540 3.006 . 0 0 "[ . 1 . 2]" 1 1693 1 14 MET HB3 1 14 MET HG3 2.650 . 3.500 2.737 2.540 3.006 . 0 0 "[ . 1 . 2]" 1 1694 1 2 MET QG 1 44 ASN QB 2.650 . 3.500 3.338 1.929 3.620 0.120 6 0 "[ . 1 . 2]" 1 1695 1 19 LEU MD2 1 19 LEU HG 2.300 . 2.800 2.124 2.117 2.131 . 0 0 "[ . 1 . 2]" 1 1696 1 9 TYR H 1 17 VAL MG1 3.650 . 5.500 3.652 3.462 3.794 . 0 0 "[ . 1 . 2]" 1 1697 1 9 TYR H 1 11 ILE MD 3.650 . 5.500 5.308 5.143 5.503 0.003 19 0 "[ . 1 . 2]" 1 1698 1 19 LEU MD2 1 20 THR H 3.650 . 5.500 5.020 4.987 5.049 . 0 0 "[ . 1 . 2]" 1 1699 1 26 LEU H 1 27 ILE MD 3.650 . 5.500 3.739 3.685 3.803 . 0 0 "[ . 1 . 2]" 1 1700 1 16 ALA H 1 27 ILE MD 3.150 . 4.500 4.132 3.958 4.446 . 0 0 "[ . 1 . 2]" 1 1701 1 45 GLU HB2 1 46 ASP H 3.650 . 5.500 3.080 2.615 3.463 . 0 0 "[ . 1 . 2]" 1 1702 1 46 ASP H 1 47 ILE MD 3.650 . 5.500 4.584 4.330 4.894 . 0 0 "[ . 1 . 2]" 1 1703 1 20 THR MG 1 23 GLY H 3.650 . 5.500 4.714 4.519 4.900 . 0 0 "[ . 1 . 2]" 1 1704 1 10 GLU H 1 10 GLU HG2 3.650 . 5.500 4.733 4.593 5.194 . 0 0 "[ . 1 . 2]" 1 1705 1 35 LYS H 1 40 VAL MG1 3.650 . 5.500 3.355 3.031 3.739 . 0 0 "[ . 1 . 2]" 1 1706 1 11 ILE MD 1 34 MET H 3.650 . 5.500 5.122 4.775 5.406 . 0 0 "[ . 1 . 2]" 1 1707 1 5 LEU HB3 1 41 SER HA 3.650 . 5.500 4.626 4.303 4.856 . 0 0 "[ . 1 . 2]" 1 1708 1 7 ILE HA 1 38 GLN HA 3.150 . 4.500 4.016 3.937 4.066 . 0 0 "[ . 1 . 2]" 1 1709 1 7 ILE HA 1 40 VAL HB 3.650 . 5.500 5.319 5.249 5.374 . 0 0 "[ . 1 . 2]" 1 1710 1 7 ILE HA 1 19 LEU HB3 3.650 . 5.500 4.097 4.038 4.143 . 0 0 "[ . 1 . 2]" 1 1711 1 27 ILE HA 1 27 ILE HG12 3.150 . 4.500 3.206 3.137 3.337 . 0 0 "[ . 1 . 2]" 1 1712 1 19 LEU HA 1 25 PHE HA 2.300 . 2.800 2.473 2.403 2.535 . 0 0 "[ . 1 . 2]" 1 1713 1 17 VAL HA 1 27 ILE HG13 4.150 . 6.500 5.564 5.346 5.898 . 0 0 "[ . 1 . 2]" 1 1714 1 8 ILE MD 1 34 MET HA 3.150 . 4.500 3.655 3.196 4.383 . 0 0 "[ . 1 . 2]" 1 1715 1 6 GLY HA3 1 7 ILE HB 3.650 . 5.500 4.453 4.311 4.542 . 0 0 "[ . 1 . 2]" 1 1716 1 12 GLN HA 1 12 GLN HG3 3.150 . 4.500 2.371 2.123 3.708 . 0 0 "[ . 1 . 2]" 1 1717 1 32 LYS QG 1 33 ASP HA 4.150 . 6.500 5.828 5.751 5.932 . 0 0 "[ . 1 . 2]" 1 1718 1 18 VAL MG1 1 34 MET HA 4.150 . 6.500 6.028 5.457 6.569 0.069 10 0 "[ . 1 . 2]" 1 1719 1 22 GLU HA 1 23 GLY HA2 3.650 . 5.500 4.222 4.157 4.307 . 0 0 "[ . 1 . 2]" 1 1720 1 14 MET ME 1 32 LYS HA 3.650 . 5.500 4.907 3.750 5.527 0.027 17 0 "[ . 1 . 2]" 1 1721 1 7 ILE MD 1 21 SER QB 3.650 . 5.500 5.093 4.403 5.543 0.043 4 0 "[ . 1 . 2]" 1 1722 1 11 ILE MG 1 13 GLY HA3 3.650 . 5.500 4.317 4.091 4.819 . 0 0 "[ . 1 . 2]" 1 1723 1 40 VAL MG1 1 41 SER QB 4.150 . 6.500 5.504 5.182 5.700 . 0 0 "[ . 1 . 2]" 1 1724 1 8 ILE MG 1 37 GLY HA2 3.650 . 5.500 5.162 4.915 5.388 . 0 0 "[ . 1 . 2]" 1 1725 1 29 ARG QD 1 29 ARG HG2 2.300 . 2.800 2.088 2.014 2.231 . 0 0 "[ . 1 . 2]" 1 1726 1 28 ILE HB 1 46 ASP HB2 2.650 . 3.500 3.378 3.131 3.536 0.036 13 0 "[ . 1 . 2]" 1 1727 1 35 LYS QE 1 38 GLN QG 3.650 . 5.500 4.852 2.640 5.532 0.032 10 0 "[ . 1 . 2]" 1 1728 1 2 MET ME 1 44 ASN QB 2.300 . 2.800 2.441 2.245 2.562 . 0 0 "[ . 1 . 2]" 1 1729 1 8 ILE HB 1 34 MET HG3 3.650 . 5.500 5.149 4.618 5.524 0.024 15 0 "[ . 1 . 2]" 1 1730 1 14 MET ME 1 14 MET HG3 3.150 . 4.500 3.399 3.364 3.430 . 0 0 "[ . 1 . 2]" 1 1731 1 2 MET HB2 1 44 ASN QB 3.650 . 5.500 3.124 1.975 4.594 . 0 0 "[ . 1 . 2]" 1 1732 1 14 MET ME 1 30 ARG QD 3.650 . 5.500 3.006 2.046 4.350 . 0 0 "[ . 1 . 2]" 1 1733 1 32 LYS QD 1 32 LYS QG 2.300 . 2.800 2.050 2.003 2.100 . 0 0 "[ . 1 . 2]" 1 1734 1 20 THR MG 1 24 GLU HB3 3.150 . 4.500 4.445 4.266 4.519 0.019 17 0 "[ . 1 . 2]" 1 1735 1 7 ILE MD 1 38 GLN HA 3.650 . 5.500 5.509 5.251 5.569 0.069 8 0 "[ . 1 . 2]" 1 1736 1 8 ILE HG12 1 18 VAL MG1 2.650 . 3.500 3.174 3.056 3.333 . 0 0 "[ . 1 . 2]" 1 1737 1 9 TYR QB 1 17 VAL MG2 3.150 . 4.500 3.902 3.749 4.124 . 0 0 "[ . 1 . 2]" 1 1738 1 20 THR MG 1 26 LEU MD1 3.150 . 4.500 2.091 1.933 2.421 . 0 0 "[ . 1 . 2]" 1 1739 1 20 THR HA 1 20 THR MG 2.650 . 3.500 2.282 2.229 2.357 . 0 0 "[ . 1 . 2]" 1 1740 1 9 TYR QD 1 17 VAL MG2 3.150 . 4.500 4.006 3.694 4.283 . 0 0 "[ . 1 . 2]" 1 1741 1 10 GLU H 1 17 VAL MG2 3.650 . 5.500 3.812 3.624 4.012 . 0 0 "[ . 1 . 2]" 1 1742 1 8 ILE HG12 1 16 ALA MB 3.150 . 4.500 3.615 3.372 3.865 . 0 0 "[ . 1 . 2]" 1 1743 1 50 VAL HA 1 50 VAL QG 2.300 . 2.800 2.154 2.111 2.203 . 0 0 "[ . 1 . 2]" 1 1744 1 8 ILE MG 1 9 TYR HA 3.150 . 4.500 4.132 4.034 4.244 . 0 0 "[ . 1 . 2]" 1 1745 1 8 ILE MG 1 9 TYR HB3 3.650 . 5.500 4.724 4.572 4.868 . 0 0 "[ . 1 . 2]" 1 1746 1 34 MET HA 1 40 VAL MG1 3.150 . 4.500 2.639 2.027 3.193 . 0 0 "[ . 1 . 2]" 1 1747 1 8 ILE MG 1 34 MET HA 3.150 . 4.500 4.022 3.619 4.537 0.037 10 0 "[ . 1 . 2]" 1 1748 1 7 ILE HA 1 19 LEU HB2 3.650 . 5.500 4.466 4.411 4.518 . 0 0 "[ . 1 . 2]" 1 1749 1 19 LEU HB2 1 25 PHE HA 3.650 . 5.500 4.084 3.986 4.196 . 0 0 "[ . 1 . 2]" 1 1750 1 29 ARG QB 1 29 ARG QD 2.300 . 2.800 1.969 1.903 2.095 . 0 0 "[ . 1 . 2]" 1 1751 1 4 ARG HD2 1 47 ILE MD 3.650 . 5.500 4.930 3.064 5.528 0.028 17 0 "[ . 1 . 2]" 1 1752 1 4 ARG HD3 1 47 ILE MD 3.650 . 5.500 4.023 2.393 5.257 . 0 0 "[ . 1 . 2]" 1 1753 1 4 ARG HB3 1 4 ARG HD2 3.150 . 4.500 3.615 3.156 3.794 . 0 0 "[ . 1 . 2]" 1 1754 1 4 ARG HB3 1 4 ARG HD3 3.150 . 4.500 3.660 2.676 4.115 . 0 0 "[ . 1 . 2]" 1 1755 1 8 ILE MG 1 11 ILE HB 2.650 . 3.500 3.184 3.151 3.205 . 0 0 "[ . 1 . 2]" 1 1756 1 3 ASN QB 1 43 GLU HA 2.650 . 3.500 2.967 2.936 2.990 . 0 0 "[ . 1 . 2]" 1 1757 1 10 GLU HB3 1 17 VAL H 3.650 . 5.500 3.772 3.550 4.084 . 0 0 "[ . 1 . 2]" 1 1758 1 10 GLU HB2 1 17 VAL H 3.650 . 5.500 5.108 4.951 5.360 . 0 0 "[ . 1 . 2]" 1 1759 1 11 ILE HG13 1 30 ARG HB3 3.150 . 4.500 4.053 3.710 4.398 . 0 0 "[ . 1 . 2]" 1 1760 1 8 ILE MD 1 30 ARG HB2 3.650 . 5.500 3.486 3.153 3.663 . 0 0 "[ . 1 . 2]" 1 1761 1 15 LYS HG2 1 30 ARG HB3 3.650 . 5.500 3.757 3.651 3.914 . 0 0 "[ . 1 . 2]" 1 1762 1 45 GLU HB3 1 45 GLU HG2 2.650 . 3.500 2.365 2.236 2.466 . 0 0 "[ . 1 . 2]" 1 1763 1 7 ILE H 1 7 ILE HG12 3.150 . 4.500 3.675 3.584 3.755 . 0 0 "[ . 1 . 2]" 1 1764 1 8 ILE HG12 1 37 GLY H 3.650 . 5.500 4.419 4.291 4.503 . 0 0 "[ . 1 . 2]" 1 1765 1 7 ILE HG12 1 37 GLY H 3.650 . 5.500 4.645 4.582 4.742 . 0 0 "[ . 1 . 2]" 1 1766 1 7 ILE HG13 1 39 GLN HE21 3.650 . 5.500 2.724 2.154 3.035 . 0 0 "[ . 1 . 2]" 1 1767 1 29 ARG HG3 1 48 TYR QD 3.650 . 5.500 3.835 2.687 4.511 . 0 0 "[ . 1 . 2]" 1 1768 1 30 ARG H 1 30 ARG HG2 3.150 . 4.500 4.372 4.294 4.430 . 0 0 "[ . 1 . 2]" 1 1769 1 4 ARG HG2 1 42 PHE QE 3.150 . 4.500 2.720 2.400 3.062 . 0 0 "[ . 1 . 2]" 1 1770 1 34 MET HG2 1 35 LYS QG 3.650 . 5.500 4.301 3.811 5.114 . 0 0 "[ . 1 . 2]" 1 1771 1 2 MET ME 1 4 ARG HD3 3.650 . 5.500 4.525 3.507 5.531 0.031 12 0 "[ . 1 . 2]" 1 1772 1 9 TYR HB2 1 9 TYR QD 2.650 . 3.500 2.428 2.386 2.486 . 0 0 "[ . 1 . 2]" 1 1773 1 9 TYR HB3 1 10 GLU H 3.150 . 4.500 2.690 2.554 2.793 . 0 0 "[ . 1 . 2]" 1 1774 1 9 TYR HB2 1 10 GLU H 3.150 . 4.500 3.778 3.655 3.879 . 0 0 "[ . 1 . 2]" 1 1775 1 35 LYS QE 1 38 GLN HE22 3.150 . 4.500 3.761 2.504 4.510 0.010 14 0 "[ . 1 . 2]" 1 1776 1 43 GLU HG2 1 46 ASP H 3.650 . 5.500 5.510 5.138 5.598 0.098 9 0 "[ . 1 . 2]" 1 1777 1 29 ARG QD 1 48 TYR QD 3.650 . 5.500 5.001 4.494 5.528 0.028 6 0 "[ . 1 . 2]" 1 1778 1 29 ARG HG2 1 48 TYR QE 3.650 . 4.500 2.826 2.148 3.933 . 0 0 "[ . 1 . 2]" 1 1779 1 29 ARG HG2 1 48 TYR QD 3.650 . 5.500 3.848 2.766 5.553 0.053 8 0 "[ . 1 . 2]" 1 1780 1 14 MET HG2 1 30 ARG QD 3.650 . 5.500 4.501 3.287 5.276 . 0 0 "[ . 1 . 2]" 1 1781 1 2 MET HA 1 43 GLU QG 3.650 . 5.500 5.095 4.505 5.531 0.031 20 0 "[ . 1 . 2]" 1 1782 1 9 TYR QD 1 25 PHE QE 3.650 . 5.500 2.966 2.782 3.059 . 0 0 "[ . 1 . 2]" 1 1783 1 9 TYR QB 1 9 TYR QD 2.300 . 2.800 2.124 2.112 2.134 . 0 0 "[ . 1 . 2]" 1 1784 1 40 VAL MG2 1 42 PHE QD 2.650 . 3.500 2.042 1.927 2.336 . 0 0 "[ . 1 . 2]" 1 1785 1 9 TYR QE 1 25 PHE QD 3.150 . 4.500 4.511 4.338 4.550 0.050 10 0 "[ . 1 . 2]" 1 1786 1 9 TYR QE 1 17 VAL MG1 3.650 . 5.500 3.975 3.838 4.108 . 0 0 "[ . 1 . 2]" 1 1787 1 16 ALA H 1 48 TYR QD 3.150 . 4.500 3.270 3.032 3.417 . 0 0 "[ . 1 . 2]" 1 1788 1 20 THR HA 1 42 PHE QD 3.150 . 4.500 3.712 3.695 3.724 . 0 0 "[ . 1 . 2]" 1 1789 1 9 TYR HA 1 9 TYR QD 3.150 . 4.500 2.804 2.699 2.951 . 0 0 "[ . 1 . 2]" 1 1790 1 5 LEU HA 1 42 PHE QD 3.650 . 5.500 3.887 3.571 4.156 . 0 0 "[ . 1 . 2]" 1 1791 1 9 TYR QD 1 10 GLU HG2 3.150 . 4.500 3.543 3.275 3.799 . 0 0 "[ . 1 . 2]" 1 1792 1 9 TYR QD 1 17 VAL MG1 2.650 . 3.500 2.637 2.533 2.787 . 0 0 "[ . 1 . 2]" 1 1793 1 42 PHE QD 1 47 ILE MD 2.650 . 3.500 3.342 3.019 3.531 0.031 3 0 "[ . 1 . 2]" 1 1794 1 15 LYS HB3 1 48 TYR QD 3.150 . 4.500 3.075 2.734 3.525 . 0 0 "[ . 1 . 2]" 1 1795 1 4 ARG HG2 1 42 PHE QD 3.150 . 4.500 4.327 4.149 4.506 0.006 18 0 "[ . 1 . 2]" 1 1796 1 42 PHE QD 1 46 ASP HB2 3.150 . 4.500 2.882 2.454 3.561 . 0 0 "[ . 1 . 2]" 1 1797 1 18 VAL QG 1 42 PHE QD 3.150 . 4.500 2.889 2.665 3.195 . 0 0 "[ . 1 . 2]" 1 1798 1 9 TYR QB 1 25 PHE QE 3.650 . 5.500 3.303 3.105 3.541 . 0 0 "[ . 1 . 2]" 1 1799 1 17 VAL MG1 1 25 PHE QD 3.150 . 4.500 2.151 2.099 2.200 . 0 0 "[ . 1 . 2]" 1 1800 1 19 LEU MD1 1 25 PHE QD 3.650 . 5.500 3.236 3.132 3.339 . 0 0 "[ . 1 . 2]" 1 1801 1 28 ILE HG12 1 42 PHE HZ 3.150 . 4.500 4.034 3.785 4.329 . 0 0 "[ . 1 . 2]" 1 1802 1 4 ARG HG2 1 42 PHE QE 3.150 . 4.500 2.716 2.407 2.970 . 0 0 "[ . 1 . 2]" 1 1803 1 18 VAL MG2 1 42 PHE HZ 3.150 . 4.500 2.585 2.196 2.983 . 0 0 "[ . 1 . 2]" 1 1804 1 26 LEU MD2 1 42 PHE HZ 3.150 . 4.500 3.042 2.408 3.649 . 0 0 "[ . 1 . 2]" 1 1805 1 19 LEU MD1 1 25 PHE HZ 3.650 . 5.500 2.925 2.744 3.054 . 0 0 "[ . 1 . 2]" 1 1806 1 9 TYR QE 1 19 LEU MD2 3.150 . 4.500 2.961 2.502 3.322 . 0 0 "[ . 1 . 2]" 1 1807 1 9 TYR QE 1 10 GLU HB2 3.150 . 4.500 4.214 3.810 4.528 0.028 15 0 "[ . 1 . 2]" 1 1808 1 15 LYS HG3 1 48 TYR QE 3.150 . 4.500 3.719 3.529 3.951 . 0 0 "[ . 1 . 2]" 1 1809 1 9 TYR HB2 1 9 TYR QE 3.150 . 4.500 4.404 4.392 4.429 . 0 0 "[ . 1 . 2]" 1 1810 1 15 LYS HE2 1 48 TYR QE 3.150 . 4.500 3.934 3.198 4.529 0.029 2 0 "[ . 1 . 2]" 1 1811 1 9 TYR QE 1 10 GLU HB3 3.650 . 5.500 5.341 5.021 5.536 0.036 13 0 "[ . 1 . 2]" 1 1812 1 15 LYS QD 1 48 TYR QE 3.150 . 4.500 3.876 2.911 4.243 . 0 0 "[ . 1 . 2]" 1 1813 1 14 MET HB3 1 48 TYR QE 3.650 . 5.500 3.931 3.090 4.657 . 0 0 "[ . 1 . 2]" 1 1814 1 29 ARG HG3 1 48 TYR QE 4.150 . 6.500 3.667 2.449 4.133 . 0 0 "[ . 1 . 2]" 1 1815 1 27 ILE MG 1 48 TYR QE 3.150 . 4.500 4.227 3.791 4.553 0.053 8 0 "[ . 1 . 2]" 1 stop_ save_ save_distance_constraint_statistics_2 _Distance_constraint_stats_list.Sf_category distance_constraint_statistics _Distance_constraint_stats_list.Constraint_list_ID 2 _Distance_constraint_stats_list.Constraint_count 42 _Distance_constraint_stats_list.Viol_count 6 _Distance_constraint_stats_list.Viol_total 2.071 _Distance_constraint_stats_list.Viol_max 0.047 _Distance_constraint_stats_list.Viol_rms 0.0020 _Distance_constraint_stats_list.Viol_average_all_restraints 0.0001 _Distance_constraint_stats_list.Viol_average_violations_only 0.0173 _Distance_constraint_stats_list.Cutoff_violation_report 0.500 _Distance_constraint_stats_list.Details . loop_ _Distance_constraint_stats_per_res.Atom_entity_assembly_ID _Distance_constraint_stats_per_res.Atom_comp_index_ID _Distance_constraint_stats_per_res.Atom_comp_ID _Distance_constraint_stats_per_res.Total_violation _Distance_constraint_stats_per_res.Max_violation _Distance_constraint_stats_per_res.Max_violation_model_number _Distance_constraint_stats_per_res.Over_cutoff_viol_count _Distance_constraint_stats_per_res.Over_cutoff_viol_per_model 1 4 ARG 0.000 0.000 . 0 "[ . 1 . 2]" 1 5 LEU 0.000 0.000 . 0 "[ . 1 . 2]" 1 6 GLY 0.000 0.000 . 0 "[ . 1 . 2]" 1 7 ILE 0.000 0.000 . 0 "[ . 1 . 2]" 1 8 ILE 0.000 0.000 . 0 "[ . 1 . 2]" 1 9 TYR 0.000 0.000 . 0 "[ . 1 . 2]" 1 10 GLU 0.000 0.000 . 0 "[ . 1 . 2]" 1 12 GLN 0.000 0.000 . 0 "[ . 1 . 2]" 1 14 MET 0.000 0.000 . 0 "[ . 1 . 2]" 1 15 LYS 0.000 0.000 . 0 "[ . 1 . 2]" 1 16 ALA 0.000 0.000 . 0 "[ . 1 . 2]" 1 17 VAL 0.000 0.000 . 0 "[ . 1 . 2]" 1 18 VAL 0.000 0.000 . 0 "[ . 1 . 2]" 1 19 LEU 0.000 0.000 . 0 "[ . 1 . 2]" 1 20 THR 0.000 0.000 . 0 "[ . 1 . 2]" 1 21 SER 0.000 0.000 . 0 "[ . 1 . 2]" 1 24 GLU 0.000 0.000 . 0 "[ . 1 . 2]" 1 26 LEU 0.000 0.000 . 0 "[ . 1 . 2]" 1 28 ILE 0.000 0.000 . 0 "[ . 1 . 2]" 1 30 ARG 0.000 0.000 . 0 "[ . 1 . 2]" 1 37 GLY 0.000 0.000 . 0 "[ . 1 . 2]" 1 38 GLN 0.000 0.000 . 0 "[ . 1 . 2]" 1 40 VAL 0.000 0.000 . 0 "[ . 1 . 2]" 1 42 PHE 0.000 0.000 . 0 "[ . 1 . 2]" 1 43 GLU 0.000 0.000 . 0 "[ . 1 . 2]" 1 44 ASN 0.104 0.047 18 0 "[ . 1 . 2]" 1 46 ASP 0.000 0.000 . 0 "[ . 1 . 2]" 1 47 ILE 0.104 0.047 18 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 5 LEU O 1 21 SER H 2.000 . 2.500 2.264 2.064 2.446 . 0 0 "[ . 1 . 2]" 2 2 1 5 LEU O 1 21 SER N 3.000 2.500 3.500 3.118 2.935 3.281 . 0 0 "[ . 1 . 2]" 2 3 1 7 ILE H 1 19 LEU O 2.000 . 2.500 1.742 1.703 1.784 . 0 0 "[ . 1 . 2]" 2 4 1 7 ILE N 1 19 LEU O 3.000 2.500 3.500 2.722 2.688 2.762 . 0 0 "[ . 1 . 2]" 2 5 1 7 ILE O 1 19 LEU H 2.000 . 2.500 1.753 1.720 1.783 . 0 0 "[ . 1 . 2]" 2 6 1 7 ILE O 1 19 LEU N 3.000 2.500 3.500 2.720 2.682 2.754 . 0 0 "[ . 1 . 2]" 2 7 1 9 TYR H 1 17 VAL O 2.000 . 2.500 1.786 1.735 1.848 . 0 0 "[ . 1 . 2]" 2 8 1 9 TYR N 1 17 VAL O 3.000 2.500 3.500 2.725 2.687 2.762 . 0 0 "[ . 1 . 2]" 2 9 1 10 GLU O 1 17 VAL H 2.000 . 2.500 1.781 1.730 1.832 . 0 0 "[ . 1 . 2]" 2 10 1 10 GLU O 1 17 VAL N 3.000 2.500 3.500 2.758 2.708 2.812 . 0 0 "[ . 1 . 2]" 2 11 1 12 GLN H 1 15 LYS O 2.000 . 2.500 1.761 1.714 1.813 . 0 0 "[ . 1 . 2]" 2 12 1 12 GLN N 1 15 LYS O 3.000 2.500 3.500 2.731 2.691 2.790 . 0 0 "[ . 1 . 2]" 2 13 1 12 GLN O 1 15 LYS H 2.000 . 2.500 1.970 1.869 2.155 . 0 0 "[ . 1 . 2]" 2 14 1 12 GLN O 1 15 LYS N 3.000 2.500 3.500 2.885 2.818 3.008 . 0 0 "[ . 1 . 2]" 2 15 1 4 ARG H 1 42 PHE O 2.000 . 2.500 1.790 1.707 1.934 . 0 0 "[ . 1 . 2]" 2 16 1 4 ARG N 1 42 PHE O 3.000 2.500 3.500 2.735 2.652 2.821 . 0 0 "[ . 1 . 2]" 2 17 1 4 ARG O 1 42 PHE H 2.000 . 2.500 1.993 1.844 2.093 . 0 0 "[ . 1 . 2]" 2 18 1 4 ARG O 1 42 PHE N 3.000 2.500 3.500 2.957 2.807 3.065 . 0 0 "[ . 1 . 2]" 2 19 1 6 GLY H 1 40 VAL O 2.000 . 2.500 2.122 1.991 2.285 . 0 0 "[ . 1 . 2]" 2 20 1 6 GLY N 1 40 VAL O 3.000 2.500 3.500 3.081 2.947 3.231 . 0 0 "[ . 1 . 2]" 2 21 1 6 GLY O 1 40 VAL H 2.000 . 2.500 1.743 1.707 1.841 . 0 0 "[ . 1 . 2]" 2 22 1 6 GLY O 1 40 VAL N 3.000 2.500 3.500 2.708 2.677 2.778 . 0 0 "[ . 1 . 2]" 2 23 1 8 ILE O 1 37 GLY H 2.000 . 2.500 1.880 1.782 2.014 . 0 0 "[ . 1 . 2]" 2 24 1 8 ILE O 1 37 GLY N 3.000 2.500 3.500 2.795 2.727 2.871 . 0 0 "[ . 1 . 2]" 2 25 1 8 ILE H 1 38 GLN O 2.000 . 2.500 1.870 1.815 1.936 . 0 0 "[ . 1 . 2]" 2 26 1 8 ILE N 1 38 GLN O 3.000 2.500 3.500 2.842 2.793 2.909 . 0 0 "[ . 1 . 2]" 2 27 1 14 MET O 1 30 ARG H 2.000 . 2.500 1.830 1.768 1.924 . 0 0 "[ . 1 . 2]" 2 28 1 14 MET O 1 30 ARG N 3.000 2.500 3.500 2.787 2.735 2.860 . 0 0 "[ . 1 . 2]" 2 29 1 16 ALA H 1 28 ILE O 2.000 . 2.500 1.815 1.742 1.879 . 0 0 "[ . 1 . 2]" 2 30 1 16 ALA N 1 28 ILE O 3.000 2.500 3.500 2.760 2.691 2.821 . 0 0 "[ . 1 . 2]" 2 31 1 16 ALA O 1 28 ILE H 2.000 . 2.500 1.801 1.758 1.875 . 0 0 "[ . 1 . 2]" 2 32 1 16 ALA O 1 28 ILE N 3.000 2.500 3.500 2.782 2.735 2.855 . 0 0 "[ . 1 . 2]" 2 33 1 18 VAL H 1 26 LEU O 2.000 . 2.500 1.822 1.738 1.904 . 0 0 "[ . 1 . 2]" 2 34 1 18 VAL N 1 26 LEU O 3.000 2.500 3.500 2.796 2.719 2.874 . 0 0 "[ . 1 . 2]" 2 35 1 18 VAL O 1 26 LEU H 2.000 . 2.500 1.830 1.773 1.882 . 0 0 "[ . 1 . 2]" 2 36 1 18 VAL O 1 26 LEU N 3.000 2.500 3.500 2.797 2.739 2.845 . 0 0 "[ . 1 . 2]" 2 37 1 20 THR H 1 24 GLU O 2.000 . 2.500 1.817 1.744 1.882 . 0 0 "[ . 1 . 2]" 2 38 1 20 THR N 1 24 GLU O 3.000 2.500 3.500 2.781 2.707 2.864 . 0 0 "[ . 1 . 2]" 2 39 1 43 GLU O 1 46 ASP H 2.000 . 2.500 2.133 1.975 2.426 . 0 0 "[ . 1 . 2]" 2 40 1 43 GLU O 1 46 ASP N 3.000 2.500 3.500 3.002 2.893 3.233 . 0 0 "[ . 1 . 2]" 2 41 1 44 ASN O 1 47 ILE H 2.000 . 2.500 2.392 2.090 2.547 0.047 18 0 "[ . 1 . 2]" 2 42 1 44 ASN O 1 47 ILE N 3.000 2.500 3.500 3.266 2.997 3.436 . 0 0 "[ . 1 . 2]" 2 stop_ save_
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