NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
418002 | 2dt6 | 11364 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2dt6 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 1814 _Distance_constraint_stats_list.Viol_count 3865 _Distance_constraint_stats_list.Viol_total 4130.544 _Distance_constraint_stats_list.Viol_max 0.122 _Distance_constraint_stats_list.Viol_rms 0.0180 _Distance_constraint_stats_list.Viol_average_all_restraints 0.0057 _Distance_constraint_stats_list.Viol_average_violations_only 0.0534 _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 1 GLY 0.304 0.066 1 0 "[ . 1 . 2]" 1 2 GLU 9.680 0.103 13 0 "[ . 1 . 2]" 1 3 VAL 9.450 0.103 13 0 "[ . 1 . 2]" 1 4 ARG 4.350 0.091 5 0 "[ . 1 . 2]" 1 5 ASN 4.047 0.088 1 0 "[ . 1 . 2]" 1 6 ILE 16.477 0.105 16 0 "[ . 1 . 2]" 1 7 VAL 4.530 0.098 8 0 "[ . 1 . 2]" 1 8 ASP 3.684 0.079 13 0 "[ . 1 . 2]" 1 9 LYS 9.016 0.088 4 0 "[ . 1 . 2]" 1 10 THR 12.108 0.106 4 0 "[ . 1 . 2]" 1 11 ALA 5.992 0.093 16 0 "[ . 1 . 2]" 1 12 SER 3.202 0.080 13 0 "[ . 1 . 2]" 1 13 PHE 5.240 0.085 14 0 "[ . 1 . 2]" 1 14 VAL 9.011 0.122 4 0 "[ . 1 . 2]" 1 15 ALA 11.520 0.107 6 0 "[ . 1 . 2]" 1 16 ARG 8.001 0.091 14 0 "[ . 1 . 2]" 1 17 ASN 3.228 0.091 14 0 "[ . 1 . 2]" 1 18 GLY 3.574 0.078 12 0 "[ . 1 . 2]" 1 19 PRO 3.888 0.068 1 0 "[ . 1 . 2]" 1 20 GLU 2.519 0.086 3 0 "[ . 1 . 2]" 1 21 PHE 8.908 0.099 1 0 "[ . 1 . 2]" 1 22 GLU 6.882 0.086 19 0 "[ . 1 . 2]" 1 23 ALA 6.154 0.089 9 0 "[ . 1 . 2]" 1 24 ARG 6.165 0.079 4 0 "[ . 1 . 2]" 1 25 ILE 7.405 0.089 9 0 "[ . 1 . 2]" 1 26 ARG 3.218 0.075 20 0 "[ . 1 . 2]" 1 27 GLN 3.903 0.100 2 0 "[ . 1 . 2]" 1 28 ASN 5.583 0.084 11 0 "[ . 1 . 2]" 1 29 GLU 1.483 0.074 4 0 "[ . 1 . 2]" 1 30 ILE 3.559 0.100 2 0 "[ . 1 . 2]" 1 31 ASN 1.263 0.091 19 0 "[ . 1 . 2]" 1 32 ASN 5.198 0.087 2 0 "[ . 1 . 2]" 1 33 PRO 5.625 0.087 2 0 "[ . 1 . 2]" 1 34 LYS 4.964 0.090 15 0 "[ . 1 . 2]" 1 35 PHE 7.782 0.106 4 0 "[ . 1 . 2]" 1 36 ASN 2.562 0.087 6 0 "[ . 1 . 2]" 1 37 PHE 6.118 0.097 5 0 "[ . 1 . 2]" 1 38 LEU 7.615 0.089 3 0 "[ . 1 . 2]" 1 39 ASN 6.403 0.089 3 0 "[ . 1 . 2]" 1 40 PRO 6.337 0.073 20 0 "[ . 1 . 2]" 1 41 ASN 3.722 0.073 20 0 "[ . 1 . 2]" 1 42 ASP 2.573 0.080 17 0 "[ . 1 . 2]" 1 43 PRO 6.752 0.084 17 0 "[ . 1 . 2]" 1 44 TYR 7.797 0.091 5 0 "[ . 1 . 2]" 1 45 HIS 6.579 0.076 11 0 "[ . 1 . 2]" 1 46 ALA 3.560 0.081 20 0 "[ . 1 . 2]" 1 47 TYR 7.866 0.098 8 0 "[ . 1 . 2]" 1 48 TYR 3.524 0.076 1 0 "[ . 1 . 2]" 1 49 ARG 5.237 0.091 3 0 "[ . 1 . 2]" 1 50 HIS 4.918 0.091 2 0 "[ . 1 . 2]" 1 51 LYS 9.920 0.095 2 0 "[ . 1 . 2]" 1 52 VAL 18.697 0.122 4 0 "[ . 1 . 2]" 1 53 SER 5.567 0.115 17 0 "[ . 1 . 2]" 1 54 GLU 11.434 0.096 5 0 "[ . 1 . 2]" 1 55 PHE 15.379 0.099 13 0 "[ . 1 . 2]" 1 56 LYS 15.083 0.113 5 0 "[ . 1 . 2]" 1 57 GLU 4.497 0.072 5 0 "[ . 1 . 2]" 1 58 GLY 3.787 0.073 3 0 "[ . 1 . 2]" 1 59 LYS 3.520 0.078 6 0 "[ . 1 . 2]" 1 60 ALA 5.880 0.108 12 0 "[ . 1 . 2]" 1 61 GLN 2.133 0.108 12 0 "[ . 1 . 2]" 1 62 GLU 2.388 0.093 4 0 "[ . 1 . 2]" 1 63 PRO 4.146 0.074 6 0 "[ . 1 . 2]" 1 64 SER 1.803 0.095 6 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 1 GLY QA 1 2 GLU HA . . 4.740 4.072 3.992 4.202 . 0 0 "[ . 1 . 2]" 1 2 1 1 GLY QA 1 2 GLU HB2 . . 4.830 4.259 3.900 4.463 . 0 0 "[ . 1 . 2]" 1 3 1 1 GLY QA 1 2 GLU HB3 . . 4.900 4.165 3.885 4.595 . 0 0 "[ . 1 . 2]" 1 4 1 1 GLY QA 1 4 ARG H . . 5.340 4.100 3.297 4.531 . 0 0 "[ . 1 . 2]" 1 5 1 1 GLY HA2 1 2 GLU HA . . 5.500 4.543 4.341 4.901 . 0 0 "[ . 1 . 2]" 1 6 1 1 GLY HA2 1 2 GLU HB2 . . 5.500 4.597 4.095 5.179 . 0 0 "[ . 1 . 2]" 1 7 1 1 GLY HA2 1 3 VAL H . . 5.500 4.748 4.142 5.555 0.055 15 0 "[ . 1 . 2]" 1 8 1 1 GLY HA3 1 2 GLU HA . . 5.500 4.646 4.403 5.172 . 0 0 "[ . 1 . 2]" 1 9 1 1 GLY HA3 1 2 GLU HB2 . . 5.500 5.130 4.648 5.566 0.066 1 0 "[ . 1 . 2]" 1 10 1 1 GLY HA3 1 3 VAL H . . 5.500 4.474 3.860 5.558 0.058 10 0 "[ . 1 . 2]" 1 11 1 2 GLU HA 1 2 GLU HG3 . . 3.240 2.690 2.490 3.090 . 0 0 "[ . 1 . 2]" 1 12 1 2 GLU HA 1 3 VAL MG1 . . 4.850 4.900 4.811 4.938 0.088 8 0 "[ . 1 . 2]" 1 13 1 2 GLU HA 1 5 ASN H . . 4.580 3.359 3.260 3.440 . 0 0 "[ . 1 . 2]" 1 14 1 2 GLU HA 1 5 ASN HB2 . . 4.130 2.548 2.280 2.678 . 0 0 "[ . 1 . 2]" 1 15 1 2 GLU HA 1 5 ASN QB . . 3.480 2.518 2.253 2.649 . 0 0 "[ . 1 . 2]" 1 16 1 2 GLU HA 1 5 ASN HB3 . . 4.130 3.966 3.353 4.198 0.068 12 0 "[ . 1 . 2]" 1 17 1 2 GLU HA 1 5 ASN QD . . 3.920 3.755 2.509 4.007 0.087 17 0 "[ . 1 . 2]" 1 18 1 2 GLU HB2 1 2 GLU HG3 . . 3.000 2.745 2.578 3.051 0.051 3 0 "[ . 1 . 2]" 1 19 1 2 GLU HB2 1 3 VAL H . . 3.790 3.820 3.554 3.861 0.071 14 0 "[ . 1 . 2]" 1 20 1 2 GLU HB2 1 3 VAL MG1 . . 5.250 5.245 4.802 5.328 0.078 11 0 "[ . 1 . 2]" 1 21 1 2 GLU HB2 1 5 ASN H . . 5.500 5.558 5.529 5.571 0.071 13 0 "[ . 1 . 2]" 1 22 1 2 GLU HB3 1 2 GLU HG3 . . 2.960 2.938 2.605 3.013 0.053 15 0 "[ . 1 . 2]" 1 23 1 2 GLU HB3 1 3 VAL H . . 3.780 2.407 2.104 2.532 . 0 0 "[ . 1 . 2]" 1 24 1 2 GLU HB3 1 3 VAL HA . . 5.290 4.396 4.147 4.633 . 0 0 "[ . 1 . 2]" 1 25 1 2 GLU HB3 1 3 VAL MG1 . . 4.030 3.961 3.557 4.110 0.080 1 0 "[ . 1 . 2]" 1 26 1 2 GLU HB3 1 4 ARG H . . 5.160 5.127 4.849 5.223 0.063 11 0 "[ . 1 . 2]" 1 27 1 2 GLU HG2 1 3 VAL H . . 4.380 3.261 2.847 3.951 . 0 0 "[ . 1 . 2]" 1 28 1 2 GLU HG2 1 3 VAL HA . . 4.500 3.579 3.001 4.544 0.044 3 0 "[ . 1 . 2]" 1 29 1 2 GLU HG2 1 3 VAL MG1 . . 5.030 4.778 4.425 5.133 0.103 13 0 "[ . 1 . 2]" 1 30 1 2 GLU HG2 1 6 ILE MD . . 4.930 4.669 4.188 5.028 0.098 13 0 "[ . 1 . 2]" 1 31 1 2 GLU HG3 1 3 VAL H . . 4.610 3.885 3.286 4.038 . 0 0 "[ . 1 . 2]" 1 32 1 2 GLU HG3 1 3 VAL HA . . 4.840 4.039 3.276 4.240 . 0 0 "[ . 1 . 2]" 1 33 1 2 GLU HG3 1 3 VAL MG1 . . 5.410 5.386 4.694 5.500 0.090 1 0 "[ . 1 . 2]" 1 34 1 2 GLU HG3 1 6 ILE MD . . 4.370 4.341 4.131 4.458 0.088 16 0 "[ . 1 . 2]" 1 35 1 3 VAL H 1 3 VAL HB . . 2.910 2.506 2.330 2.612 . 0 0 "[ . 1 . 2]" 1 36 1 3 VAL H 1 3 VAL MG1 . . 2.980 1.999 1.809 2.078 . 0 0 "[ . 1 . 2]" 1 37 1 3 VAL H 1 3 VAL MG2 . . 3.850 3.770 3.695 3.828 . 0 0 "[ . 1 . 2]" 1 38 1 3 VAL HA 1 3 VAL MG1 . . 3.260 3.239 3.201 3.269 0.009 12 0 "[ . 1 . 2]" 1 39 1 3 VAL HA 1 3 VAL MG2 . . 2.900 2.389 2.319 2.477 . 0 0 "[ . 1 . 2]" 1 40 1 3 VAL HA 1 6 ILE H . . 4.320 3.692 3.554 3.799 . 0 0 "[ . 1 . 2]" 1 41 1 3 VAL HA 1 6 ILE HB . . 4.330 4.259 4.054 4.386 0.056 12 0 "[ . 1 . 2]" 1 42 1 3 VAL HA 1 6 ILE HG12 . . 5.410 5.450 5.342 5.478 0.068 1 0 "[ . 1 . 2]" 1 43 1 3 VAL HA 1 7 VAL QG . . 4.590 3.586 3.440 3.782 . 0 0 "[ . 1 . 2]" 1 44 1 3 VAL HB 1 4 ARG H . . 4.000 4.047 3.925 4.072 0.072 13 0 "[ . 1 . 2]" 1 45 1 3 VAL HB 1 7 VAL QG . . 4.900 4.624 4.454 4.869 . 0 0 "[ . 1 . 2]" 1 46 1 3 VAL HB 1 44 TYR QE . . 4.830 4.766 4.176 4.887 0.057 13 0 "[ . 1 . 2]" 1 47 1 3 VAL MG1 1 4 ARG H . . 3.220 2.137 2.029 2.252 . 0 0 "[ . 1 . 2]" 1 48 1 3 VAL MG1 1 7 VAL QG . . 4.010 3.972 3.886 4.020 0.010 13 0 "[ . 1 . 2]" 1 49 1 3 VAL MG1 1 44 TYR HB2 . . 5.020 4.729 4.371 4.957 . 0 0 "[ . 1 . 2]" 1 50 1 3 VAL MG1 1 44 TYR QD . . 4.240 3.480 3.266 3.752 . 0 0 "[ . 1 . 2]" 1 51 1 3 VAL MG1 1 44 TYR QE . . 3.900 2.661 2.335 2.890 . 0 0 "[ . 1 . 2]" 1 52 1 3 VAL MG2 1 4 ARG H . . 3.510 3.485 3.266 3.586 0.076 4 0 "[ . 1 . 2]" 1 53 1 3 VAL MG2 1 4 ARG HA . . 3.750 3.638 3.458 3.792 0.042 1 0 "[ . 1 . 2]" 1 54 1 3 VAL MG2 1 5 ASN H . . 5.050 5.110 5.004 5.138 0.088 1 0 "[ . 1 . 2]" 1 55 1 3 VAL MG2 1 7 VAL H . . 4.360 4.219 4.010 4.392 0.032 8 0 "[ . 1 . 2]" 1 56 1 3 VAL MG2 1 7 VAL QG . . 3.130 2.371 2.248 2.585 . 0 0 "[ . 1 . 2]" 1 57 1 3 VAL MG2 1 44 TYR QD . . 3.880 2.699 2.432 2.887 . 0 0 "[ . 1 . 2]" 1 58 1 3 VAL MG2 1 44 TYR QE . . 3.730 3.214 2.744 3.559 . 0 0 "[ . 1 . 2]" 1 59 1 4 ARG H 1 4 ARG QB . . 3.110 2.354 1.997 2.604 . 0 0 "[ . 1 . 2]" 1 60 1 4 ARG H 1 4 ARG HD2 . . 5.500 4.752 4.335 5.573 0.073 6 0 "[ . 1 . 2]" 1 61 1 4 ARG H 1 4 ARG HD3 . . 5.500 4.925 3.501 5.306 . 0 0 "[ . 1 . 2]" 1 62 1 4 ARG H 1 4 ARG HG2 . . 4.660 3.815 3.425 4.593 . 0 0 "[ . 1 . 2]" 1 63 1 4 ARG H 1 4 ARG QG . . 4.060 2.902 2.495 3.970 . 0 0 "[ . 1 . 2]" 1 64 1 4 ARG H 1 4 ARG HG3 . . 4.660 3.024 2.556 4.405 . 0 0 "[ . 1 . 2]" 1 65 1 4 ARG H 1 5 ASN H . . 3.860 2.733 2.603 2.840 . 0 0 "[ . 1 . 2]" 1 66 1 4 ARG H 1 7 VAL QG . . 5.030 4.346 4.235 4.445 . 0 0 "[ . 1 . 2]" 1 67 1 4 ARG HA 1 4 ARG QD . . 3.700 3.758 3.663 3.776 0.076 8 0 "[ . 1 . 2]" 1 68 1 4 ARG HA 1 4 ARG HG2 . . 3.690 2.516 2.270 3.156 . 0 0 "[ . 1 . 2]" 1 69 1 4 ARG HA 1 4 ARG QG . . 3.140 2.293 2.098 2.607 . 0 0 "[ . 1 . 2]" 1 70 1 4 ARG HA 1 4 ARG HG3 . . 3.690 3.006 2.133 3.481 . 0 0 "[ . 1 . 2]" 1 71 1 4 ARG HA 1 7 VAL H . . 4.210 3.460 3.321 3.605 . 0 0 "[ . 1 . 2]" 1 72 1 4 ARG HA 1 7 VAL HB . . 3.290 2.260 2.144 2.422 . 0 0 "[ . 1 . 2]" 1 73 1 4 ARG HA 1 7 VAL QG . . 3.600 2.846 2.751 2.941 . 0 0 "[ . 1 . 2]" 1 74 1 4 ARG HA 1 8 ASP H . . 4.730 3.695 3.507 3.963 . 0 0 "[ . 1 . 2]" 1 75 1 4 ARG HA 1 47 TYR QE . . 4.470 2.523 2.204 3.134 . 0 0 "[ . 1 . 2]" 1 76 1 4 ARG QB 1 4 ARG QD . . 3.290 2.095 1.942 2.431 . 0 0 "[ . 1 . 2]" 1 77 1 4 ARG QB 1 5 ASN H . . 3.810 2.798 2.587 2.954 . 0 0 "[ . 1 . 2]" 1 78 1 4 ARG QB 1 44 TYR QE . . 4.730 4.233 2.404 4.821 0.091 5 0 "[ . 1 . 2]" 1 79 1 4 ARG QB 1 47 TYR QE . . 4.820 3.136 2.508 4.205 . 0 0 "[ . 1 . 2]" 1 80 1 4 ARG HB2 1 5 ASN H . . 4.500 3.056 2.660 4.054 . 0 0 "[ . 1 . 2]" 1 81 1 4 ARG HB2 1 7 VAL QG . . 5.500 4.919 4.468 5.081 . 0 0 "[ . 1 . 2]" 1 82 1 4 ARG HB3 1 5 ASN H . . 4.500 3.520 2.864 3.878 . 0 0 "[ . 1 . 2]" 1 83 1 4 ARG HB3 1 7 VAL QG . . 5.500 4.458 4.061 5.043 . 0 0 "[ . 1 . 2]" 1 84 1 4 ARG QD 1 44 TYR QE . . 4.400 3.646 2.295 4.432 0.032 17 0 "[ . 1 . 2]" 1 85 1 4 ARG QD 1 47 TYR QE . . 3.920 3.326 2.833 3.871 . 0 0 "[ . 1 . 2]" 1 86 1 4 ARG HD2 1 44 TYR QE . . 5.130 4.305 2.898 5.201 0.071 5 0 "[ . 1 . 2]" 1 87 1 4 ARG HD3 1 44 TYR QE . . 5.130 4.117 2.322 5.182 0.052 17 0 "[ . 1 . 2]" 1 88 1 4 ARG QG 1 44 TYR QE . . 4.170 2.616 2.098 3.576 . 0 0 "[ . 1 . 2]" 1 89 1 4 ARG QG 1 47 TYR QD . . 4.740 3.382 2.990 3.710 . 0 0 "[ . 1 . 2]" 1 90 1 4 ARG QG 1 47 TYR QE . . 3.800 2.528 2.164 2.952 . 0 0 "[ . 1 . 2]" 1 91 1 4 ARG HG2 1 5 ASN H . . 5.500 5.049 4.231 5.344 . 0 0 "[ . 1 . 2]" 1 92 1 4 ARG HG2 1 7 VAL QG . . 5.500 3.919 3.582 4.530 . 0 0 "[ . 1 . 2]" 1 93 1 4 ARG HG2 1 44 TYR QE . . 4.810 3.309 2.466 4.885 0.075 6 0 "[ . 1 . 2]" 1 94 1 4 ARG HG2 1 47 TYR QD . . 5.500 3.691 3.024 5.362 . 0 0 "[ . 1 . 2]" 1 95 1 4 ARG HG2 1 47 TYR QE . . 4.490 2.692 2.298 3.440 . 0 0 "[ . 1 . 2]" 1 96 1 4 ARG HG3 1 5 ASN H . . 5.500 4.809 4.543 5.111 . 0 0 "[ . 1 . 2]" 1 97 1 4 ARG HG3 1 7 VAL QG . . 5.500 4.517 3.520 5.012 . 0 0 "[ . 1 . 2]" 1 98 1 4 ARG HG3 1 44 TYR QE . . 4.810 2.787 2.194 3.678 . 0 0 "[ . 1 . 2]" 1 99 1 4 ARG HG3 1 47 TYR QD . . 5.500 4.696 3.372 5.421 . 0 0 "[ . 1 . 2]" 1 100 1 4 ARG HG3 1 47 TYR QE . . 4.490 3.851 2.187 4.556 0.066 5 0 "[ . 1 . 2]" 1 101 1 5 ASN H 1 5 ASN HB2 . . 3.700 2.390 2.121 2.672 . 0 0 "[ . 1 . 2]" 1 102 1 5 ASN H 1 5 ASN HB3 . . 3.700 3.504 3.235 3.661 . 0 0 "[ . 1 . 2]" 1 103 1 5 ASN H 1 5 ASN QD . . 4.790 3.693 2.577 4.395 . 0 0 "[ . 1 . 2]" 1 104 1 5 ASN H 1 6 ILE H . . 3.960 2.789 2.702 2.891 . 0 0 "[ . 1 . 2]" 1 105 1 5 ASN HA 1 5 ASN QD . . 4.500 3.427 2.352 4.148 . 0 0 "[ . 1 . 2]" 1 106 1 5 ASN HA 1 6 ILE HA . . 4.920 4.720 4.630 4.783 . 0 0 "[ . 1 . 2]" 1 107 1 5 ASN HA 1 6 ILE MG . . 5.300 5.191 5.122 5.315 0.015 10 0 "[ . 1 . 2]" 1 108 1 5 ASN HA 1 7 VAL H . . 4.800 4.436 4.317 4.555 . 0 0 "[ . 1 . 2]" 1 109 1 5 ASN HA 1 8 ASP H . . 4.460 3.864 3.552 4.009 . 0 0 "[ . 1 . 2]" 1 110 1 5 ASN HA 1 8 ASP QB . . 4.180 3.024 2.461 4.216 0.036 13 0 "[ . 1 . 2]" 1 111 1 5 ASN HA 1 9 LYS H . . 4.760 3.997 3.701 4.393 . 0 0 "[ . 1 . 2]" 1 112 1 5 ASN HA 1 9 LYS HG3 . . 4.710 4.169 3.712 4.756 0.046 8 0 "[ . 1 . 2]" 1 113 1 5 ASN QB 1 5 ASN QD . . 3.050 2.262 2.090 2.789 . 0 0 "[ . 1 . 2]" 1 114 1 5 ASN QB 1 6 ILE H . . 3.210 2.391 2.254 2.806 . 0 0 "[ . 1 . 2]" 1 115 1 5 ASN QB 1 6 ILE HA . . 4.250 3.725 3.492 3.912 . 0 0 "[ . 1 . 2]" 1 116 1 5 ASN QB 1 6 ILE HB . . 4.460 3.888 3.633 4.298 . 0 0 "[ . 1 . 2]" 1 117 1 5 ASN QB 1 6 ILE MG . . 4.320 4.038 3.875 4.390 0.070 1 0 "[ . 1 . 2]" 1 118 1 5 ASN HB2 1 6 ILE H . . 3.930 2.605 2.299 3.061 . 0 0 "[ . 1 . 2]" 1 119 1 5 ASN HB2 1 6 ILE HA . . 4.910 4.568 4.185 4.989 0.079 16 0 "[ . 1 . 2]" 1 120 1 5 ASN HB3 1 6 ILE H . . 3.930 3.101 2.400 3.546 . 0 0 "[ . 1 . 2]" 1 121 1 5 ASN HB3 1 6 ILE HA . . 4.910 4.039 3.565 4.477 . 0 0 "[ . 1 . 2]" 1 122 1 6 ILE H 1 6 ILE HB . . 3.150 2.490 2.403 2.567 . 0 0 "[ . 1 . 2]" 1 123 1 6 ILE H 1 6 ILE MD . . 4.310 4.325 4.197 4.388 0.078 5 0 "[ . 1 . 2]" 1 124 1 6 ILE H 1 6 ILE HG12 . . 4.710 4.585 4.536 4.641 . 0 0 "[ . 1 . 2]" 1 125 1 6 ILE H 1 6 ILE HG13 . . 4.420 4.414 4.346 4.459 0.039 13 0 "[ . 1 . 2]" 1 126 1 6 ILE H 1 6 ILE MG . . 3.310 2.213 2.083 2.353 . 0 0 "[ . 1 . 2]" 1 127 1 6 ILE H 1 7 VAL QG . . 5.440 4.364 4.299 4.490 . 0 0 "[ . 1 . 2]" 1 128 1 6 ILE HA 1 6 ILE MD . . 3.640 3.548 3.395 3.688 0.048 19 0 "[ . 1 . 2]" 1 129 1 6 ILE HA 1 6 ILE HG12 . . 3.490 3.293 3.225 3.364 . 0 0 "[ . 1 . 2]" 1 130 1 6 ILE HA 1 6 ILE HG13 . . 3.530 2.317 2.252 2.391 . 0 0 "[ . 1 . 2]" 1 131 1 6 ILE HA 1 6 ILE MG . . 3.270 3.238 3.221 3.258 . 0 0 "[ . 1 . 2]" 1 132 1 6 ILE HA 1 7 VAL HA . . 4.960 4.850 4.800 4.908 . 0 0 "[ . 1 . 2]" 1 133 1 6 ILE HA 1 7 VAL QG . . 5.340 4.956 4.895 4.986 . 0 0 "[ . 1 . 2]" 1 134 1 6 ILE HA 1 9 LYS H . . 3.870 3.612 3.435 3.729 . 0 0 "[ . 1 . 2]" 1 135 1 6 ILE HA 1 9 LYS HB2 . . 3.300 2.641 2.440 2.843 . 0 0 "[ . 1 . 2]" 1 136 1 6 ILE HA 1 9 LYS QD . . 3.910 3.483 3.210 3.763 . 0 0 "[ . 1 . 2]" 1 137 1 6 ILE HA 1 9 LYS QE . . 5.300 4.717 3.966 5.380 0.080 19 0 "[ . 1 . 2]" 1 138 1 6 ILE HA 1 10 THR H . . 4.400 3.616 3.523 3.715 . 0 0 "[ . 1 . 2]" 1 139 1 6 ILE HA 1 10 THR HG1 . . 4.680 3.437 3.313 3.557 . 0 0 "[ . 1 . 2]" 1 140 1 6 ILE HA 1 37 PHE QE . . 5.500 5.124 5.016 5.212 . 0 0 "[ . 1 . 2]" 1 141 1 6 ILE HA 1 37 PHE HZ . . 5.500 5.244 4.874 5.549 0.049 6 0 "[ . 1 . 2]" 1 142 1 6 ILE HB 1 6 ILE MD . . 2.970 2.260 2.166 2.348 . 0 0 "[ . 1 . 2]" 1 143 1 6 ILE HB 1 7 VAL H . . 4.080 4.049 3.972 4.147 0.067 8 0 "[ . 1 . 2]" 1 144 1 6 ILE HB 1 7 VAL QG . . 5.100 4.969 4.874 5.036 . 0 0 "[ . 1 . 2]" 1 145 1 6 ILE HB 1 34 LYS QD . . 4.530 4.346 3.974 4.603 0.073 3 0 "[ . 1 . 2]" 1 146 1 6 ILE HB 1 37 PHE QD . . 5.500 5.531 5.422 5.580 0.080 20 0 "[ . 1 . 2]" 1 147 1 6 ILE HB 1 37 PHE QE . . 5.110 4.470 4.316 4.659 . 0 0 "[ . 1 . 2]" 1 148 1 6 ILE MD 1 7 VAL HA . . 5.500 5.481 5.328 5.574 0.074 4 0 "[ . 1 . 2]" 1 149 1 6 ILE MD 1 7 VAL QG . . 5.120 4.830 4.665 4.943 . 0 0 "[ . 1 . 2]" 1 150 1 6 ILE MD 1 9 LYS HB2 . . 5.500 5.330 5.204 5.570 0.070 11 0 "[ . 1 . 2]" 1 151 1 6 ILE MD 1 10 THR H . . 5.280 5.370 5.349 5.385 0.105 16 0 "[ . 1 . 2]" 1 152 1 6 ILE MD 1 10 THR HB . . 5.500 5.315 5.172 5.495 . 0 0 "[ . 1 . 2]" 1 153 1 6 ILE MD 1 10 THR HG1 . . 4.200 3.903 3.804 4.052 . 0 0 "[ . 1 . 2]" 1 154 1 6 ILE MD 1 34 LYS H . . 5.500 5.441 5.116 5.575 0.075 16 0 "[ . 1 . 2]" 1 155 1 6 ILE MD 1 34 LYS HA . . 4.420 3.584 2.833 4.082 . 0 0 "[ . 1 . 2]" 1 156 1 6 ILE MD 1 34 LYS HB2 . . 4.640 4.300 3.848 4.621 . 0 0 "[ . 1 . 2]" 1 157 1 6 ILE MD 1 34 LYS HB3 . . 3.900 2.880 2.404 3.333 . 0 0 "[ . 1 . 2]" 1 158 1 6 ILE MD 1 34 LYS QD . . 2.860 2.403 2.184 2.665 . 0 0 "[ . 1 . 2]" 1 159 1 6 ILE MD 1 34 LYS HE2 . . 4.960 4.257 3.332 5.031 0.071 7 0 "[ . 1 . 2]" 1 160 1 6 ILE MD 1 34 LYS QE . . 4.310 3.759 2.762 4.131 . 0 0 "[ . 1 . 2]" 1 161 1 6 ILE MD 1 34 LYS HE3 . . 4.960 4.390 2.813 5.043 0.083 9 0 "[ . 1 . 2]" 1 162 1 6 ILE MD 1 34 LYS HG2 . . 4.630 4.323 3.699 4.692 0.062 6 0 "[ . 1 . 2]" 1 163 1 6 ILE MD 1 34 LYS QG . . 3.970 3.888 3.563 4.060 0.090 15 0 "[ . 1 . 2]" 1 164 1 6 ILE MD 1 34 LYS HG3 . . 4.630 4.499 4.072 4.719 0.089 11 0 "[ . 1 . 2]" 1 165 1 6 ILE MD 1 35 PHE HA . . 4.680 4.087 3.659 4.576 . 0 0 "[ . 1 . 2]" 1 166 1 6 ILE MD 1 37 PHE QD . . 4.270 4.065 3.732 4.351 0.081 15 0 "[ . 1 . 2]" 1 167 1 6 ILE MD 1 37 PHE QE . . 3.410 2.665 2.334 3.019 . 0 0 "[ . 1 . 2]" 1 168 1 6 ILE HG12 1 6 ILE MG . . 3.160 2.197 2.153 2.278 . 0 0 "[ . 1 . 2]" 1 169 1 6 ILE HG12 1 10 THR H . . 4.540 4.406 4.217 4.574 0.034 20 0 "[ . 1 . 2]" 1 170 1 6 ILE HG12 1 10 THR HG1 . . 4.390 2.692 2.526 2.994 . 0 0 "[ . 1 . 2]" 1 171 1 6 ILE HG12 1 37 PHE QD . . 5.500 4.042 3.993 4.108 . 0 0 "[ . 1 . 2]" 1 172 1 6 ILE HG12 1 37 PHE QE . . 4.230 2.122 2.035 2.196 . 0 0 "[ . 1 . 2]" 1 173 1 6 ILE HG13 1 10 THR HG1 . . 4.680 2.594 2.466 2.787 . 0 0 "[ . 1 . 2]" 1 174 1 6 ILE HG13 1 37 PHE QD . . 5.500 5.591 5.577 5.597 0.097 5 0 "[ . 1 . 2]" 1 175 1 6 ILE HG13 1 37 PHE QE . . 4.500 3.731 3.658 3.820 . 0 0 "[ . 1 . 2]" 1 176 1 6 ILE HG13 1 37 PHE HZ . . 4.940 3.828 3.508 4.182 . 0 0 "[ . 1 . 2]" 1 177 1 6 ILE MG 1 7 VAL H . . 3.590 2.297 2.215 2.415 . 0 0 "[ . 1 . 2]" 1 178 1 6 ILE MG 1 7 VAL HA . . 3.720 3.221 3.159 3.289 . 0 0 "[ . 1 . 2]" 1 179 1 6 ILE MG 1 7 VAL HB . . 4.810 3.731 3.664 3.849 . 0 0 "[ . 1 . 2]" 1 180 1 6 ILE MG 1 7 VAL QG . . 3.060 2.417 2.306 2.528 . 0 0 "[ . 1 . 2]" 1 181 1 6 ILE MG 1 8 ASP H . . 4.570 4.631 4.579 4.649 0.079 9 0 "[ . 1 . 2]" 1 182 1 6 ILE MG 1 9 LYS HB2 . . 5.330 5.227 5.089 5.365 0.035 18 0 "[ . 1 . 2]" 1 183 1 6 ILE MG 1 10 THR H . . 4.710 4.797 4.779 4.811 0.101 18 0 "[ . 1 . 2]" 1 184 1 6 ILE MG 1 10 THR HB . . 4.530 4.619 4.607 4.626 0.096 5 0 "[ . 1 . 2]" 1 185 1 6 ILE MG 1 34 LYS HA . . 4.680 4.154 3.709 4.614 . 0 0 "[ . 1 . 2]" 1 186 1 6 ILE MG 1 34 LYS HB3 . . 5.300 4.730 3.885 5.383 0.083 18 0 "[ . 1 . 2]" 1 187 1 6 ILE MG 1 34 LYS QD . . 4.190 3.836 3.328 4.224 0.034 9 0 "[ . 1 . 2]" 1 188 1 6 ILE MG 1 35 PHE HA . . 5.010 4.540 4.299 4.748 . 0 0 "[ . 1 . 2]" 1 189 1 6 ILE MG 1 37 PHE QD . . 3.210 2.788 2.657 2.918 . 0 0 "[ . 1 . 2]" 1 190 1 6 ILE MG 1 37 PHE QE . . 3.100 2.462 2.297 2.729 . 0 0 "[ . 1 . 2]" 1 191 1 7 VAL H 1 7 VAL HB . . 3.380 2.123 2.037 2.212 . 0 0 "[ . 1 . 2]" 1 192 1 7 VAL H 1 7 VAL QG . . 2.820 2.470 2.416 2.545 . 0 0 "[ . 1 . 2]" 1 193 1 7 VAL H 1 8 ASP H . . 3.380 2.815 2.721 2.903 . 0 0 "[ . 1 . 2]" 1 194 1 7 VAL H 1 8 ASP HA . . 5.380 5.374 5.260 5.425 0.045 2 0 "[ . 1 . 2]" 1 195 1 7 VAL H 1 8 ASP QB . . 4.720 4.376 4.219 4.799 0.079 13 0 "[ . 1 . 2]" 1 196 1 7 VAL H 1 37 PHE QE . . 5.400 4.763 4.594 4.996 . 0 0 "[ . 1 . 2]" 1 197 1 7 VAL H 1 47 TYR QE . . 4.850 4.901 4.791 4.948 0.098 8 0 "[ . 1 . 2]" 1 198 1 7 VAL HA 1 7 VAL QG . . 2.900 2.195 2.164 2.213 . 0 0 "[ . 1 . 2]" 1 199 1 7 VAL HA 1 9 LYS H . . 4.750 4.799 4.719 4.817 0.067 8 0 "[ . 1 . 2]" 1 200 1 7 VAL HA 1 10 THR H . . 4.230 3.764 3.647 3.853 . 0 0 "[ . 1 . 2]" 1 201 1 7 VAL HA 1 10 THR HB . . 3.810 2.964 2.847 3.032 . 0 0 "[ . 1 . 2]" 1 202 1 7 VAL HA 1 10 THR HG1 . . 4.220 3.771 3.515 3.948 . 0 0 "[ . 1 . 2]" 1 203 1 7 VAL HA 1 10 THR MG . . 4.270 4.325 4.256 4.349 0.079 8 0 "[ . 1 . 2]" 1 204 1 7 VAL HA 1 11 ALA H . . 4.550 4.000 3.822 4.140 . 0 0 "[ . 1 . 2]" 1 205 1 7 VAL HA 1 37 PHE QD . . 4.120 3.605 3.438 3.847 . 0 0 "[ . 1 . 2]" 1 206 1 7 VAL HA 1 37 PHE QE . . 3.920 3.091 2.802 3.349 . 0 0 "[ . 1 . 2]" 1 207 1 7 VAL HA 1 37 PHE HZ . . 4.490 3.606 3.279 4.001 . 0 0 "[ . 1 . 2]" 1 208 1 7 VAL HB 1 8 ASP H . . 3.440 2.471 2.355 2.584 . 0 0 "[ . 1 . 2]" 1 209 1 7 VAL HB 1 47 TYR QD . . 4.430 3.809 3.377 4.032 . 0 0 "[ . 1 . 2]" 1 210 1 7 VAL HB 1 47 TYR QE . . 3.650 3.026 2.883 3.238 . 0 0 "[ . 1 . 2]" 1 211 1 7 VAL QG 1 8 ASP H . . 3.710 2.662 2.583 2.791 . 0 0 "[ . 1 . 2]" 1 212 1 7 VAL QG 1 8 ASP HA . . 4.070 3.257 3.173 3.386 . 0 0 "[ . 1 . 2]" 1 213 1 7 VAL QG 1 8 ASP QB . . 4.950 3.558 3.247 4.102 . 0 0 "[ . 1 . 2]" 1 214 1 7 VAL QG 1 10 THR HB . . 4.800 4.172 4.031 4.249 . 0 0 "[ . 1 . 2]" 1 215 1 7 VAL QG 1 10 THR MG . . 5.080 4.675 4.550 4.714 . 0 0 "[ . 1 . 2]" 1 216 1 7 VAL QG 1 11 ALA H . . 4.380 4.220 3.976 4.285 . 0 0 "[ . 1 . 2]" 1 217 1 7 VAL QG 1 11 ALA MB . . 3.630 3.513 3.050 3.638 0.008 9 0 "[ . 1 . 2]" 1 218 1 7 VAL QG 1 37 PHE H . . 5.090 4.520 4.344 5.051 . 0 0 "[ . 1 . 2]" 1 219 1 7 VAL QG 1 37 PHE HA . . 4.580 4.256 4.089 4.553 . 0 0 "[ . 1 . 2]" 1 220 1 7 VAL QG 1 37 PHE HB2 . . 3.530 2.337 2.189 2.707 . 0 0 "[ . 1 . 2]" 1 221 1 7 VAL QG 1 37 PHE QD . . 3.710 2.549 2.415 2.648 . 0 0 "[ . 1 . 2]" 1 222 1 7 VAL QG 1 37 PHE QE . . 4.010 3.337 3.198 3.467 . 0 0 "[ . 1 . 2]" 1 223 1 7 VAL QG 1 44 TYR HB2 . . 4.190 3.188 2.972 3.416 . 0 0 "[ . 1 . 2]" 1 224 1 7 VAL QG 1 44 TYR HB3 . . 4.210 2.491 2.247 2.740 . 0 0 "[ . 1 . 2]" 1 225 1 7 VAL QG 1 44 TYR QD . . 3.980 3.296 2.875 3.706 . 0 0 "[ . 1 . 2]" 1 226 1 7 VAL QG 1 44 TYR QE . . 5.070 4.620 4.364 4.865 . 0 0 "[ . 1 . 2]" 1 227 1 7 VAL QG 1 47 TYR HB2 . . 5.120 4.656 4.404 4.803 . 0 0 "[ . 1 . 2]" 1 228 1 7 VAL QG 1 47 TYR HB3 . . 3.910 3.495 3.211 3.685 . 0 0 "[ . 1 . 2]" 1 229 1 7 VAL QG 1 47 TYR QD . . 2.880 2.015 1.932 2.101 . 0 0 "[ . 1 . 2]" 1 230 1 7 VAL QG 1 47 TYR QE . . 3.100 2.343 2.171 2.542 . 0 0 "[ . 1 . 2]" 1 231 1 7 VAL QG 1 48 TYR H . . 3.350 3.071 2.923 3.182 . 0 0 "[ . 1 . 2]" 1 232 1 7 VAL QG 1 48 TYR HA . . 3.140 2.105 1.942 2.190 . 0 0 "[ . 1 . 2]" 1 233 1 7 VAL QG 1 48 TYR HB2 . . 3.740 2.021 1.974 2.065 . 0 0 "[ . 1 . 2]" 1 234 1 7 VAL QG 1 48 TYR QB . . 3.110 2.004 1.959 2.045 . 0 0 "[ . 1 . 2]" 1 235 1 7 VAL QG 1 48 TYR HB3 . . 3.740 3.305 3.262 3.366 . 0 0 "[ . 1 . 2]" 1 236 1 7 VAL QG 1 48 TYR QD . . 4.200 2.022 1.958 2.069 . 0 0 "[ . 1 . 2]" 1 237 1 7 VAL QG 1 49 ARG H . . 4.680 4.555 4.416 4.602 . 0 0 "[ . 1 . 2]" 1 238 1 8 ASP H 1 8 ASP HB2 . . 3.760 2.576 2.182 3.568 . 0 0 "[ . 1 . 2]" 1 239 1 8 ASP H 1 8 ASP QB . . 3.200 2.155 2.072 2.299 . 0 0 "[ . 1 . 2]" 1 240 1 8 ASP H 1 8 ASP HB3 . . 3.760 2.515 2.114 3.539 . 0 0 "[ . 1 . 2]" 1 241 1 8 ASP H 1 9 LYS HG3 . . 5.500 5.058 4.871 5.291 . 0 0 "[ . 1 . 2]" 1 242 1 8 ASP H 1 47 TYR QD . . 5.390 5.306 4.948 5.464 0.074 8 0 "[ . 1 . 2]" 1 243 1 8 ASP H 1 47 TYR QE . . 4.510 3.668 3.393 3.827 . 0 0 "[ . 1 . 2]" 1 244 1 8 ASP H 1 48 TYR HA . . 5.500 5.491 5.312 5.567 0.067 8 0 "[ . 1 . 2]" 1 245 1 8 ASP HA 1 10 THR H . . 5.370 4.782 4.550 4.923 . 0 0 "[ . 1 . 2]" 1 246 1 8 ASP HA 1 11 ALA H . . 4.100 3.676 3.297 3.891 . 0 0 "[ . 1 . 2]" 1 247 1 8 ASP HA 1 11 ALA MB . . 3.310 2.726 2.253 3.000 . 0 0 "[ . 1 . 2]" 1 248 1 8 ASP HA 1 12 SER H . . 4.930 4.266 3.922 4.628 . 0 0 "[ . 1 . 2]" 1 249 1 8 ASP HA 1 47 TYR QE . . 5.000 4.740 4.323 5.005 0.005 16 0 "[ . 1 . 2]" 1 250 1 8 ASP HA 1 51 LYS HB3 . . 5.130 2.963 2.586 3.227 . 0 0 "[ . 1 . 2]" 1 251 1 8 ASP HA 1 51 LYS HE2 . . 4.600 2.684 2.186 3.084 . 0 0 "[ . 1 . 2]" 1 252 1 8 ASP HA 1 51 LYS HE3 . . 4.920 3.892 3.000 4.489 . 0 0 "[ . 1 . 2]" 1 253 1 8 ASP HA 1 51 LYS HG2 . . 4.180 4.194 4.085 4.249 0.069 1 0 "[ . 1 . 2]" 1 254 1 8 ASP HA 1 51 LYS HG3 . . 4.270 2.510 2.374 2.650 . 0 0 "[ . 1 . 2]" 1 255 1 8 ASP HA 1 55 PHE QD . . 5.050 4.422 4.210 4.671 . 0 0 "[ . 1 . 2]" 1 256 1 8 ASP HA 1 55 PHE QE . . 3.720 2.776 2.492 3.269 . 0 0 "[ . 1 . 2]" 1 257 1 8 ASP HA 1 55 PHE HZ . . 5.160 4.395 4.082 4.729 . 0 0 "[ . 1 . 2]" 1 258 1 8 ASP QB 1 9 LYS H . . 3.480 2.574 2.102 3.548 0.068 13 0 "[ . 1 . 2]" 1 259 1 8 ASP QB 1 9 LYS HA . . 5.180 4.297 3.708 4.788 . 0 0 "[ . 1 . 2]" 1 260 1 8 ASP QB 1 11 ALA MB . . 5.030 4.405 3.691 4.723 . 0 0 "[ . 1 . 2]" 1 261 1 8 ASP QB 1 47 TYR QE . . 5.190 3.817 3.255 4.762 . 0 0 "[ . 1 . 2]" 1 262 1 8 ASP QB 1 51 LYS HE2 . . 4.150 2.809 1.805 3.588 . 0 0 "[ . 1 . 2]" 1 263 1 8 ASP QB 1 55 PHE QE . . 4.690 3.500 2.214 3.999 . 0 0 "[ . 1 . 2]" 1 264 1 8 ASP QB 1 55 PHE HZ . . 4.390 3.949 2.650 4.454 0.064 17 0 "[ . 1 . 2]" 1 265 1 8 ASP HB2 1 9 LYS H . . 4.150 3.692 2.578 4.186 0.036 18 0 "[ . 1 . 2]" 1 266 1 8 ASP HB2 1 55 PHE QE . . 5.500 3.896 2.229 4.570 . 0 0 "[ . 1 . 2]" 1 267 1 8 ASP HB3 1 9 LYS H . . 4.150 2.720 2.117 3.954 . 0 0 "[ . 1 . 2]" 1 268 1 8 ASP HB3 1 55 PHE QE . . 5.500 4.289 3.155 4.784 . 0 0 "[ . 1 . 2]" 1 269 1 9 LYS H 1 9 LYS HB2 . . 3.120 2.285 2.245 2.318 . 0 0 "[ . 1 . 2]" 1 270 1 9 LYS H 1 9 LYS HB3 . . 3.460 3.523 3.518 3.531 0.071 18 0 "[ . 1 . 2]" 1 271 1 9 LYS H 1 9 LYS QD . . 4.250 3.682 3.557 3.927 . 0 0 "[ . 1 . 2]" 1 272 1 9 LYS H 1 9 LYS HG2 . . 4.350 3.671 3.536 3.809 . 0 0 "[ . 1 . 2]" 1 273 1 9 LYS H 1 9 LYS HG3 . . 3.960 2.434 2.302 2.605 . 0 0 "[ . 1 . 2]" 1 274 1 9 LYS H 1 10 THR H . . 3.570 2.845 2.755 2.944 . 0 0 "[ . 1 . 2]" 1 275 1 9 LYS H 1 10 THR HG1 . . 4.640 4.564 4.384 4.690 0.050 17 0 "[ . 1 . 2]" 1 276 1 9 LYS H 1 11 ALA H . . 4.110 4.166 4.139 4.179 0.069 10 0 "[ . 1 . 2]" 1 277 1 9 LYS HA 1 9 LYS HD2 . . 5.370 4.608 4.546 4.656 . 0 0 "[ . 1 . 2]" 1 278 1 9 LYS HA 1 9 LYS QD . . 4.560 4.047 3.878 4.112 . 0 0 "[ . 1 . 2]" 1 279 1 9 LYS HA 1 9 LYS HD3 . . 5.370 4.486 4.198 4.587 . 0 0 "[ . 1 . 2]" 1 280 1 9 LYS HA 1 9 LYS HG2 . . 3.540 2.346 2.197 2.430 . 0 0 "[ . 1 . 2]" 1 281 1 9 LYS HA 1 9 LYS HG3 . . 3.550 2.717 2.613 2.829 . 0 0 "[ . 1 . 2]" 1 282 1 9 LYS HA 1 11 ALA H . . 5.190 4.375 4.262 4.538 . 0 0 "[ . 1 . 2]" 1 283 1 9 LYS HA 1 12 SER H . . 4.080 3.378 3.184 3.533 . 0 0 "[ . 1 . 2]" 1 284 1 9 LYS HA 1 12 SER HB2 . . 4.090 3.146 2.710 3.449 . 0 0 "[ . 1 . 2]" 1 285 1 9 LYS HA 1 12 SER HB3 . . 3.770 2.999 2.444 3.412 . 0 0 "[ . 1 . 2]" 1 286 1 9 LYS HA 1 13 PHE H . . 5.260 4.472 4.101 4.769 . 0 0 "[ . 1 . 2]" 1 287 1 9 LYS HA 1 55 PHE HZ . . 5.400 4.106 3.850 4.408 . 0 0 "[ . 1 . 2]" 1 288 1 9 LYS HB2 1 9 LYS QD . . 3.110 2.471 2.381 2.559 . 0 0 "[ . 1 . 2]" 1 289 1 9 LYS HB2 1 9 LYS HE2 . . 5.190 3.603 2.726 4.664 . 0 0 "[ . 1 . 2]" 1 290 1 9 LYS HB2 1 9 LYS QE . . 4.380 3.311 2.665 4.188 . 0 0 "[ . 1 . 2]" 1 291 1 9 LYS HB2 1 9 LYS HE3 . . 5.190 4.107 3.045 4.811 . 0 0 "[ . 1 . 2]" 1 292 1 9 LYS HB2 1 10 THR H . . 3.700 2.747 2.632 2.857 . 0 0 "[ . 1 . 2]" 1 293 1 9 LYS HB2 1 10 THR HG1 . . 4.970 3.806 3.680 3.982 . 0 0 "[ . 1 . 2]" 1 294 1 9 LYS HB2 1 11 ALA H . . 5.270 5.113 5.040 5.163 . 0 0 "[ . 1 . 2]" 1 295 1 9 LYS HB3 1 9 LYS QE . . 4.380 2.813 2.014 4.246 . 0 0 "[ . 1 . 2]" 1 296 1 9 LYS HB3 1 10 THR H . . 3.730 3.461 3.297 3.614 . 0 0 "[ . 1 . 2]" 1 297 1 9 LYS HB3 1 10 THR HG1 . . 4.820 4.532 4.247 4.848 0.028 7 0 "[ . 1 . 2]" 1 298 1 9 LYS HB3 1 11 ALA H . . 5.500 5.502 5.414 5.549 0.049 2 0 "[ . 1 . 2]" 1 299 1 9 LYS QD 1 10 THR H . . 4.970 4.959 4.658 5.041 0.071 18 0 "[ . 1 . 2]" 1 300 1 9 LYS QE 1 9 LYS HG2 . . 3.460 2.448 2.197 2.924 . 0 0 "[ . 1 . 2]" 1 301 1 9 LYS HE2 1 9 LYS HG2 . . 4.020 2.976 2.234 3.874 . 0 0 "[ . 1 . 2]" 1 302 1 9 LYS HE3 1 9 LYS HG2 . . 4.020 2.889 2.268 3.762 . 0 0 "[ . 1 . 2]" 1 303 1 9 LYS HG2 1 10 THR H . . 5.050 5.090 5.043 5.109 0.059 6 0 "[ . 1 . 2]" 1 304 1 9 LYS HG2 1 55 PHE QE . . 5.500 5.544 5.402 5.584 0.084 20 0 "[ . 1 . 2]" 1 305 1 9 LYS HG2 1 55 PHE HZ . . 5.500 5.131 4.815 5.545 0.045 4 0 "[ . 1 . 2]" 1 306 1 9 LYS HG3 1 10 THR H . . 4.980 4.642 4.580 4.723 . 0 0 "[ . 1 . 2]" 1 307 1 9 LYS HG3 1 55 PHE QE . . 5.500 5.573 5.544 5.588 0.088 4 0 "[ . 1 . 2]" 1 308 1 9 LYS HG3 1 55 PHE HZ . . 5.070 4.996 4.862 5.126 0.056 5 0 "[ . 1 . 2]" 1 309 1 10 THR H 1 10 THR HB . . 3.510 2.450 2.370 2.587 . 0 0 "[ . 1 . 2]" 1 310 1 10 THR H 1 10 THR HG1 . . 3.350 2.105 1.967 2.192 . 0 0 "[ . 1 . 2]" 1 311 1 10 THR H 1 10 THR MG . . 3.890 3.762 3.727 3.805 . 0 0 "[ . 1 . 2]" 1 312 1 10 THR H 1 11 ALA H . . 3.610 2.739 2.655 2.839 . 0 0 "[ . 1 . 2]" 1 313 1 10 THR H 1 11 ALA MB . . 4.490 4.468 4.301 4.566 0.076 14 0 "[ . 1 . 2]" 1 314 1 10 THR H 1 12 SER H . . 4.690 4.349 4.182 4.518 . 0 0 "[ . 1 . 2]" 1 315 1 10 THR H 1 37 PHE QE . . 5.180 4.715 4.548 4.859 . 0 0 "[ . 1 . 2]" 1 316 1 10 THR H 1 37 PHE HZ . . 4.660 4.331 4.000 4.655 . 0 0 "[ . 1 . 2]" 1 317 1 10 THR HA 1 10 THR MG . . 2.890 2.399 2.296 2.498 . 0 0 "[ . 1 . 2]" 1 318 1 10 THR HA 1 13 PHE H . . 4.010 3.674 3.552 3.814 . 0 0 "[ . 1 . 2]" 1 319 1 10 THR HA 1 13 PHE HB2 . . 4.370 3.961 3.674 4.190 . 0 0 "[ . 1 . 2]" 1 320 1 10 THR HA 1 13 PHE QB . . 3.620 3.317 3.061 3.590 . 0 0 "[ . 1 . 2]" 1 321 1 10 THR HA 1 13 PHE HB3 . . 4.370 3.570 3.258 3.904 . 0 0 "[ . 1 . 2]" 1 322 1 10 THR HA 1 14 VAL H . . 4.770 4.258 4.123 4.406 . 0 0 "[ . 1 . 2]" 1 323 1 10 THR HA 1 14 VAL MG2 . . 4.160 3.897 3.730 4.075 . 0 0 "[ . 1 . 2]" 1 324 1 10 THR HA 1 25 ILE MD . . 4.750 4.243 3.750 4.707 . 0 0 "[ . 1 . 2]" 1 325 1 10 THR HA 1 37 PHE HZ . . 4.810 4.782 4.688 4.864 0.054 17 0 "[ . 1 . 2]" 1 326 1 10 THR HB 1 11 ALA H . . 3.630 2.835 2.678 2.970 . 0 0 "[ . 1 . 2]" 1 327 1 10 THR HB 1 11 ALA HA . . 4.490 4.509 4.393 4.549 0.059 2 0 "[ . 1 . 2]" 1 328 1 10 THR HB 1 11 ALA MB . . 4.570 4.334 4.120 4.459 . 0 0 "[ . 1 . 2]" 1 329 1 10 THR HB 1 37 PHE QD . . 4.840 4.650 4.511 4.885 0.045 1 0 "[ . 1 . 2]" 1 330 1 10 THR HB 1 37 PHE QE . . 3.960 2.602 2.406 2.794 . 0 0 "[ . 1 . 2]" 1 331 1 10 THR HB 1 37 PHE HZ . . 4.280 2.580 2.350 2.856 . 0 0 "[ . 1 . 2]" 1 332 1 10 THR HB 1 38 LEU MD1 . . 5.500 4.903 4.678 5.265 . 0 0 "[ . 1 . 2]" 1 333 1 10 THR HB 1 38 LEU MD2 . . 4.720 3.963 3.770 4.207 . 0 0 "[ . 1 . 2]" 1 334 1 10 THR HG1 1 10 THR MG . . 3.440 3.001 2.938 3.050 . 0 0 "[ . 1 . 2]" 1 335 1 10 THR HG1 1 11 ALA H . . 4.370 4.202 4.024 4.309 . 0 0 "[ . 1 . 2]" 1 336 1 10 THR HG1 1 37 PHE QE . . 4.080 3.706 3.583 3.856 . 0 0 "[ . 1 . 2]" 1 337 1 10 THR MG 1 11 ALA H . . 3.880 3.614 3.500 3.727 . 0 0 "[ . 1 . 2]" 1 338 1 10 THR MG 1 11 ALA HA . . 3.710 3.658 3.567 3.739 0.029 5 0 "[ . 1 . 2]" 1 339 1 10 THR MG 1 13 PHE H . . 4.990 4.886 4.821 5.023 0.033 3 0 "[ . 1 . 2]" 1 340 1 10 THR MG 1 13 PHE HB2 . . 5.010 5.068 4.840 5.095 0.085 14 0 "[ . 1 . 2]" 1 341 1 10 THR MG 1 13 PHE QB . . 4.290 3.907 3.817 4.010 . 0 0 "[ . 1 . 2]" 1 342 1 10 THR MG 1 13 PHE HB3 . . 5.010 4.066 3.949 4.202 . 0 0 "[ . 1 . 2]" 1 343 1 10 THR MG 1 13 PHE QD . . 5.500 4.958 4.692 5.217 . 0 0 "[ . 1 . 2]" 1 344 1 10 THR MG 1 14 VAL H . . 4.280 4.051 3.983 4.145 . 0 0 "[ . 1 . 2]" 1 345 1 10 THR MG 1 14 VAL HB . . 4.160 3.888 3.762 4.133 . 0 0 "[ . 1 . 2]" 1 346 1 10 THR MG 1 14 VAL MG1 . . 4.640 4.225 4.080 4.477 . 0 0 "[ . 1 . 2]" 1 347 1 10 THR MG 1 14 VAL MG2 . . 2.990 2.494 2.340 2.645 . 0 0 "[ . 1 . 2]" 1 348 1 10 THR MG 1 25 ILE MD . . 3.050 2.504 2.133 2.837 . 0 0 "[ . 1 . 2]" 1 349 1 10 THR MG 1 25 ILE MG . . 3.090 2.793 2.319 3.123 0.033 14 0 "[ . 1 . 2]" 1 350 1 10 THR MG 1 35 PHE QE . . 4.110 3.947 3.019 4.216 0.106 4 0 "[ . 1 . 2]" 1 351 1 10 THR MG 1 37 PHE QD . . 4.950 4.402 4.288 4.555 . 0 0 "[ . 1 . 2]" 1 352 1 10 THR MG 1 37 PHE QE . . 3.340 2.491 2.351 2.669 . 0 0 "[ . 1 . 2]" 1 353 1 10 THR MG 1 37 PHE HZ . . 3.440 2.295 2.143 2.528 . 0 0 "[ . 1 . 2]" 1 354 1 10 THR MG 1 38 LEU MD1 . . 3.230 2.668 2.413 3.004 . 0 0 "[ . 1 . 2]" 1 355 1 10 THR MG 1 38 LEU MD2 . . 2.880 2.358 2.172 2.569 . 0 0 "[ . 1 . 2]" 1 356 1 10 THR MG 1 48 TYR QE . . 3.510 2.364 2.280 2.480 . 0 0 "[ . 1 . 2]" 1 357 1 10 THR MG 1 48 TYR HH . . 4.090 3.505 3.352 3.803 . 0 0 "[ . 1 . 2]" 1 358 1 11 ALA H 1 11 ALA MB . . 2.870 2.264 2.219 2.318 . 0 0 "[ . 1 . 2]" 1 359 1 11 ALA H 1 12 SER H . . 3.490 2.807 2.633 2.888 . 0 0 "[ . 1 . 2]" 1 360 1 11 ALA H 1 12 SER HB2 . . 5.100 5.005 4.699 5.172 0.072 6 0 "[ . 1 . 2]" 1 361 1 11 ALA H 1 12 SER HB3 . . 5.140 4.961 4.234 5.166 0.026 10 0 "[ . 1 . 2]" 1 362 1 11 ALA H 1 37 PHE QE . . 4.930 4.581 4.366 4.796 . 0 0 "[ . 1 . 2]" 1 363 1 11 ALA H 1 48 TYR QE . . 4.170 2.611 2.521 2.770 . 0 0 "[ . 1 . 2]" 1 364 1 11 ALA H 1 52 VAL MG2 . . 4.680 4.477 4.284 4.669 . 0 0 "[ . 1 . 2]" 1 365 1 11 ALA HA 1 14 VAL H . . 4.150 3.465 3.310 3.637 . 0 0 "[ . 1 . 2]" 1 366 1 11 ALA HA 1 14 VAL HB . . 3.580 2.539 2.403 2.679 . 0 0 "[ . 1 . 2]" 1 367 1 11 ALA HA 1 14 VAL MG1 . . 4.240 3.846 3.705 3.999 . 0 0 "[ . 1 . 2]" 1 368 1 11 ALA HA 1 14 VAL MG2 . . 3.870 3.556 3.431 3.690 . 0 0 "[ . 1 . 2]" 1 369 1 11 ALA HA 1 15 ALA H . . 4.530 3.887 3.771 4.014 . 0 0 "[ . 1 . 2]" 1 370 1 11 ALA HA 1 38 LEU MD2 . . 5.030 4.791 4.624 5.022 . 0 0 "[ . 1 . 2]" 1 371 1 11 ALA HA 1 48 TYR QD . . 5.140 4.518 4.290 4.656 . 0 0 "[ . 1 . 2]" 1 372 1 11 ALA HA 1 48 TYR QE . . 3.800 2.864 2.681 3.050 . 0 0 "[ . 1 . 2]" 1 373 1 11 ALA HA 1 52 VAL H . . 5.100 4.829 4.630 5.050 . 0 0 "[ . 1 . 2]" 1 374 1 11 ALA HA 1 52 VAL HA . . 4.270 3.788 3.601 3.942 . 0 0 "[ . 1 . 2]" 1 375 1 11 ALA HA 1 52 VAL MG1 . . 4.340 4.270 4.008 4.426 0.086 2 0 "[ . 1 . 2]" 1 376 1 11 ALA HA 1 52 VAL MG2 . . 2.870 2.454 2.161 2.801 . 0 0 "[ . 1 . 2]" 1 377 1 11 ALA MB 1 12 SER H . . 3.290 2.667 2.578 2.799 . 0 0 "[ . 1 . 2]" 1 378 1 11 ALA MB 1 12 SER HB2 . . 4.640 4.294 4.133 4.497 . 0 0 "[ . 1 . 2]" 1 379 1 11 ALA MB 1 12 SER HB3 . . 5.160 4.862 4.409 5.015 . 0 0 "[ . 1 . 2]" 1 380 1 11 ALA MB 1 14 VAL HB . . 4.550 4.061 3.930 4.189 . 0 0 "[ . 1 . 2]" 1 381 1 11 ALA MB 1 48 TYR HA . . 4.120 3.618 3.344 3.805 . 0 0 "[ . 1 . 2]" 1 382 1 11 ALA MB 1 48 TYR QD . . 4.670 3.267 2.871 3.557 . 0 0 "[ . 1 . 2]" 1 383 1 11 ALA MB 1 48 TYR QE . . 4.040 2.912 2.725 3.151 . 0 0 "[ . 1 . 2]" 1 384 1 11 ALA MB 1 49 ARG HA . . 5.090 5.026 4.844 5.171 0.081 1 0 "[ . 1 . 2]" 1 385 1 11 ALA MB 1 51 LYS H . . 4.140 4.210 4.105 4.233 0.093 16 0 "[ . 1 . 2]" 1 386 1 11 ALA MB 1 51 LYS HB3 . . 2.670 2.286 2.155 2.479 . 0 0 "[ . 1 . 2]" 1 387 1 11 ALA MB 1 51 LYS HG3 . . 3.860 3.486 3.334 3.613 . 0 0 "[ . 1 . 2]" 1 388 1 11 ALA MB 1 52 VAL H . . 3.420 2.817 2.679 2.974 . 0 0 "[ . 1 . 2]" 1 389 1 11 ALA MB 1 52 VAL HA . . 3.140 2.329 2.190 2.536 . 0 0 "[ . 1 . 2]" 1 390 1 11 ALA MB 1 52 VAL HB . . 4.170 4.089 3.962 4.237 0.067 11 0 "[ . 1 . 2]" 1 391 1 11 ALA MB 1 52 VAL MG1 . . 3.860 3.856 3.753 3.941 0.081 3 0 "[ . 1 . 2]" 1 392 1 11 ALA MB 1 52 VAL MG2 . . 2.880 2.131 2.049 2.237 . 0 0 "[ . 1 . 2]" 1 393 1 11 ALA MB 1 55 PHE HB2 . . 4.960 3.539 3.218 3.973 . 0 0 "[ . 1 . 2]" 1 394 1 11 ALA MB 1 55 PHE QD . . 3.370 2.750 2.458 3.439 0.069 13 0 "[ . 1 . 2]" 1 395 1 11 ALA MB 1 55 PHE QE . . 3.890 3.172 2.768 3.708 . 0 0 "[ . 1 . 2]" 1 396 1 11 ALA MB 1 55 PHE HZ . . 5.230 4.888 4.649 5.290 0.060 5 0 "[ . 1 . 2]" 1 397 1 12 SER H 1 12 SER HB2 . . 3.230 2.368 2.121 2.667 . 0 0 "[ . 1 . 2]" 1 398 1 12 SER H 1 12 SER HB3 . . 3.100 2.589 2.113 2.766 . 0 0 "[ . 1 . 2]" 1 399 1 12 SER H 1 13 PHE H . . 3.520 3.058 2.871 3.239 . 0 0 "[ . 1 . 2]" 1 400 1 12 SER H 1 15 ALA MB . . 4.300 4.358 4.283 4.380 0.080 13 0 "[ . 1 . 2]" 1 401 1 12 SER H 1 52 VAL MG2 . . 5.280 5.103 4.762 5.353 0.073 15 0 "[ . 1 . 2]" 1 402 1 12 SER H 1 55 PHE QD . . 4.350 3.914 3.688 4.341 . 0 0 "[ . 1 . 2]" 1 403 1 12 SER H 1 55 PHE QE . . 4.590 3.729 3.335 4.259 . 0 0 "[ . 1 . 2]" 1 404 1 12 SER HA 1 15 ALA H . . 3.900 3.686 3.488 3.873 . 0 0 "[ . 1 . 2]" 1 405 1 12 SER HA 1 15 ALA MB . . 3.190 2.555 2.416 2.729 . 0 0 "[ . 1 . 2]" 1 406 1 12 SER HA 1 55 PHE H . . 5.040 5.090 5.020 5.111 0.071 18 0 "[ . 1 . 2]" 1 407 1 12 SER HA 1 55 PHE HA . . 5.020 4.824 4.669 5.051 0.031 1 0 "[ . 1 . 2]" 1 408 1 12 SER HA 1 55 PHE HB2 . . 4.610 2.999 2.832 3.152 . 0 0 "[ . 1 . 2]" 1 409 1 12 SER HA 1 55 PHE QD . . 3.550 2.965 2.696 3.129 . 0 0 "[ . 1 . 2]" 1 410 1 12 SER HA 1 55 PHE QE . . 4.580 3.895 3.583 4.186 . 0 0 "[ . 1 . 2]" 1 411 1 12 SER HB2 1 13 PHE H . . 3.960 3.736 3.592 3.970 0.010 6 0 "[ . 1 . 2]" 1 412 1 12 SER HB2 1 55 PHE QE . . 4.170 2.790 2.509 2.948 . 0 0 "[ . 1 . 2]" 1 413 1 12 SER HB2 1 55 PHE HZ . . 4.230 3.117 2.834 3.484 . 0 0 "[ . 1 . 2]" 1 414 1 12 SER HB3 1 13 PHE H . . 3.220 2.333 2.125 2.687 . 0 0 "[ . 1 . 2]" 1 415 1 12 SER HB3 1 55 PHE QD . . 4.650 4.583 4.286 4.709 0.059 16 0 "[ . 1 . 2]" 1 416 1 12 SER HB3 1 55 PHE QE . . 4.180 4.118 3.920 4.227 0.047 18 0 "[ . 1 . 2]" 1 417 1 12 SER HB3 1 55 PHE HZ . . 5.430 4.681 4.399 5.066 . 0 0 "[ . 1 . 2]" 1 418 1 13 PHE H 1 13 PHE HB2 . . 3.460 2.234 1.989 2.315 . 0 0 "[ . 1 . 2]" 1 419 1 13 PHE H 1 13 PHE HB3 . . 3.460 2.717 2.557 2.883 . 0 0 "[ . 1 . 2]" 1 420 1 13 PHE H 1 13 PHE QD . . 4.290 4.057 3.778 4.159 . 0 0 "[ . 1 . 2]" 1 421 1 13 PHE H 1 14 VAL H . . 3.570 2.846 2.722 3.024 . 0 0 "[ . 1 . 2]" 1 422 1 13 PHE H 1 14 VAL HB . . 5.250 4.917 4.813 5.150 . 0 0 "[ . 1 . 2]" 1 423 1 13 PHE H 1 14 VAL MG2 . . 4.600 4.353 4.201 4.513 . 0 0 "[ . 1 . 2]" 1 424 1 13 PHE H 1 15 ALA H . . 4.600 4.116 3.978 4.277 . 0 0 "[ . 1 . 2]" 1 425 1 13 PHE H 1 15 ALA MB . . 5.050 4.630 4.542 4.746 . 0 0 "[ . 1 . 2]" 1 426 1 13 PHE H 1 16 ARG H . . 4.980 4.717 4.634 4.813 . 0 0 "[ . 1 . 2]" 1 427 1 13 PHE HA 1 13 PHE QD . . 3.490 2.742 2.295 3.042 . 0 0 "[ . 1 . 2]" 1 428 1 13 PHE HA 1 13 PHE QE . . 4.510 4.501 4.246 4.588 0.078 19 0 "[ . 1 . 2]" 1 429 1 13 PHE HA 1 15 ALA H . . 4.330 4.208 4.090 4.377 0.047 19 0 "[ . 1 . 2]" 1 430 1 13 PHE HA 1 16 ARG H . . 3.640 3.309 3.197 3.395 . 0 0 "[ . 1 . 2]" 1 431 1 13 PHE HA 1 16 ARG QB . . 3.570 2.805 2.394 3.636 0.066 15 0 "[ . 1 . 2]" 1 432 1 13 PHE HA 1 16 ARG QD . . 4.490 3.595 2.690 4.390 . 0 0 "[ . 1 . 2]" 1 433 1 13 PHE HA 1 16 ARG QG . . 3.380 3.269 2.168 3.463 0.083 10 0 "[ . 1 . 2]" 1 434 1 13 PHE HA 1 17 ASN HD21 . . 4.350 3.024 2.735 3.255 . 0 0 "[ . 1 . 2]" 1 435 1 13 PHE HA 1 17 ASN QD . . 3.780 2.907 2.618 3.126 . 0 0 "[ . 1 . 2]" 1 436 1 13 PHE HA 1 17 ASN HD22 . . 4.350 3.771 3.342 4.087 . 0 0 "[ . 1 . 2]" 1 437 1 13 PHE QB 1 14 VAL MG2 . . 3.950 2.987 2.865 3.176 . 0 0 "[ . 1 . 2]" 1 438 1 13 PHE QB 1 15 ALA H . . 5.270 4.590 4.490 4.740 . 0 0 "[ . 1 . 2]" 1 439 1 13 PHE HB2 1 14 VAL H . . 3.980 3.736 3.451 3.877 . 0 0 "[ . 1 . 2]" 1 440 1 13 PHE HB2 1 14 VAL MG2 . . 4.750 4.528 4.306 4.701 . 0 0 "[ . 1 . 2]" 1 441 1 13 PHE HB2 1 16 ARG H . . 5.500 5.573 5.554 5.579 0.079 1 0 "[ . 1 . 2]" 1 442 1 13 PHE HB2 1 25 ILE MD . . 5.500 5.008 4.589 5.404 . 0 0 "[ . 1 . 2]" 1 443 1 13 PHE HB3 1 14 VAL H . . 3.980 2.603 2.404 2.842 . 0 0 "[ . 1 . 2]" 1 444 1 13 PHE HB3 1 14 VAL MG2 . . 4.750 3.030 2.901 3.233 . 0 0 "[ . 1 . 2]" 1 445 1 13 PHE HB3 1 16 ARG H . . 5.500 5.422 5.285 5.492 . 0 0 "[ . 1 . 2]" 1 446 1 13 PHE HB3 1 25 ILE MD . . 5.500 3.740 3.291 4.105 . 0 0 "[ . 1 . 2]" 1 447 1 13 PHE QD 1 14 VAL H . . 4.410 3.927 3.479 4.426 0.016 9 0 "[ . 1 . 2]" 1 448 1 13 PHE QD 1 14 VAL HA . . 4.540 3.799 3.141 4.605 0.065 3 0 "[ . 1 . 2]" 1 449 1 13 PHE QD 1 14 VAL MG2 . . 3.920 3.361 2.961 3.987 0.067 9 0 "[ . 1 . 2]" 1 450 1 13 PHE QD 1 16 ARG QD . . 4.830 4.341 2.777 4.902 0.072 16 0 "[ . 1 . 2]" 1 451 1 13 PHE QD 1 17 ASN HD21 . . 4.990 3.306 3.163 3.728 . 0 0 "[ . 1 . 2]" 1 452 1 13 PHE QD 1 17 ASN QD . . 4.250 2.961 2.832 3.226 . 0 0 "[ . 1 . 2]" 1 453 1 13 PHE QD 1 17 ASN HD22 . . 4.990 3.365 3.038 3.699 . 0 0 "[ . 1 . 2]" 1 454 1 13 PHE QD 1 25 ILE MD . . 3.570 2.999 2.408 3.451 . 0 0 "[ . 1 . 2]" 1 455 1 13 PHE QD 1 25 ILE QG . . 5.340 4.687 4.080 5.125 . 0 0 "[ . 1 . 2]" 1 456 1 13 PHE QE 1 17 ASN HD21 . . 5.500 3.739 3.425 4.508 . 0 0 "[ . 1 . 2]" 1 457 1 13 PHE QE 1 17 ASN QD . . 4.640 2.851 2.686 3.464 . 0 0 "[ . 1 . 2]" 1 458 1 13 PHE QE 1 17 ASN HD22 . . 5.500 2.965 2.734 3.600 . 0 0 "[ . 1 . 2]" 1 459 1 14 VAL H 1 14 VAL HB . . 3.260 2.342 2.265 2.431 . 0 0 "[ . 1 . 2]" 1 460 1 14 VAL H 1 14 VAL MG1 . . 3.840 3.726 3.699 3.749 . 0 0 "[ . 1 . 2]" 1 461 1 14 VAL H 1 14 VAL MG2 . . 2.980 2.242 2.113 2.305 . 0 0 "[ . 1 . 2]" 1 462 1 14 VAL H 1 15 ALA H . . 3.350 2.620 2.523 2.740 . 0 0 "[ . 1 . 2]" 1 463 1 14 VAL H 1 15 ALA HA . . 5.330 5.272 5.153 5.369 0.039 3 0 "[ . 1 . 2]" 1 464 1 14 VAL H 1 15 ALA MB . . 4.510 4.182 4.112 4.327 . 0 0 "[ . 1 . 2]" 1 465 1 14 VAL H 1 16 ARG H . . 4.700 4.141 3.960 4.242 . 0 0 "[ . 1 . 2]" 1 466 1 14 VAL H 1 52 VAL MG2 . . 5.100 4.779 4.324 5.099 . 0 0 "[ . 1 . 2]" 1 467 1 14 VAL HA 1 14 VAL MG1 . . 3.070 2.478 2.352 2.570 . 0 0 "[ . 1 . 2]" 1 468 1 14 VAL HA 1 14 VAL MG2 . . 2.890 2.322 2.231 2.402 . 0 0 "[ . 1 . 2]" 1 469 1 14 VAL HA 1 16 ARG H . . 4.500 4.426 4.165 4.563 0.063 15 0 "[ . 1 . 2]" 1 470 1 14 VAL HA 1 17 ASN H . . 4.020 3.695 3.597 3.866 . 0 0 "[ . 1 . 2]" 1 471 1 14 VAL HA 1 17 ASN QB . . 3.890 3.208 3.072 3.314 . 0 0 "[ . 1 . 2]" 1 472 1 14 VAL HA 1 18 GLY H . . 3.790 3.173 3.001 3.525 . 0 0 "[ . 1 . 2]" 1 473 1 14 VAL HA 1 21 PHE H . . 4.990 4.284 4.079 4.449 . 0 0 "[ . 1 . 2]" 1 474 1 14 VAL HA 1 21 PHE HB2 . . 4.400 2.549 2.425 2.717 . 0 0 "[ . 1 . 2]" 1 475 1 14 VAL HA 1 21 PHE HB3 . . 4.280 3.282 3.042 3.524 . 0 0 "[ . 1 . 2]" 1 476 1 14 VAL HA 1 21 PHE QD . . 4.080 4.127 3.994 4.162 0.082 18 0 "[ . 1 . 2]" 1 477 1 14 VAL HA 1 22 GLU H . . 5.330 4.457 4.311 4.578 . 0 0 "[ . 1 . 2]" 1 478 1 14 VAL HA 1 25 ILE MD . . 4.630 4.201 3.965 4.429 . 0 0 "[ . 1 . 2]" 1 479 1 14 VAL HA 1 52 VAL MG2 . . 5.410 5.421 5.131 5.524 0.114 2 0 "[ . 1 . 2]" 1 480 1 14 VAL HB 1 15 ALA H . . 3.470 3.002 2.844 3.113 . 0 0 "[ . 1 . 2]" 1 481 1 14 VAL HB 1 15 ALA HA . . 4.770 4.693 4.576 4.811 0.041 6 0 "[ . 1 . 2]" 1 482 1 14 VAL HB 1 15 ALA MB . . 4.230 4.244 4.164 4.297 0.067 15 0 "[ . 1 . 2]" 1 483 1 14 VAL HB 1 25 ILE MD . . 4.930 4.605 4.406 4.816 . 0 0 "[ . 1 . 2]" 1 484 1 14 VAL HB 1 48 TYR HH . . 4.610 2.860 2.702 3.072 . 0 0 "[ . 1 . 2]" 1 485 1 14 VAL HB 1 52 VAL MG1 . . 3.950 3.877 3.396 4.049 0.099 17 0 "[ . 1 . 2]" 1 486 1 14 VAL HB 1 52 VAL MG2 . . 3.390 3.103 2.653 3.371 . 0 0 "[ . 1 . 2]" 1 487 1 14 VAL MG1 1 15 ALA H . . 3.850 3.653 3.445 3.760 . 0 0 "[ . 1 . 2]" 1 488 1 14 VAL MG1 1 15 ALA HA . . 3.710 3.736 3.537 3.801 0.091 17 0 "[ . 1 . 2]" 1 489 1 14 VAL MG1 1 17 ASN H . . 5.340 5.190 5.080 5.355 0.015 1 0 "[ . 1 . 2]" 1 490 1 14 VAL MG1 1 18 GLY H . . 4.270 3.874 3.733 4.204 . 0 0 "[ . 1 . 2]" 1 491 1 14 VAL MG1 1 18 GLY HA2 . . 5.290 4.429 4.263 4.648 . 0 0 "[ . 1 . 2]" 1 492 1 14 VAL MG1 1 19 PRO HA . . 3.380 2.427 2.082 2.732 . 0 0 "[ . 1 . 2]" 1 493 1 14 VAL MG1 1 19 PRO HB2 . . 5.060 4.629 4.217 5.003 . 0 0 "[ . 1 . 2]" 1 494 1 14 VAL MG1 1 19 PRO HB3 . . 4.700 3.935 3.465 4.378 . 0 0 "[ . 1 . 2]" 1 495 1 14 VAL MG1 1 19 PRO HD2 . . 5.430 5.198 4.972 5.422 . 0 0 "[ . 1 . 2]" 1 496 1 14 VAL MG1 1 19 PRO QD . . 4.700 4.186 3.971 4.413 . 0 0 "[ . 1 . 2]" 1 497 1 14 VAL MG1 1 19 PRO HD3 . . 5.430 4.414 4.175 4.681 . 0 0 "[ . 1 . 2]" 1 498 1 14 VAL MG1 1 21 PHE HA . . 4.690 4.756 4.628 4.782 0.092 10 0 "[ . 1 . 2]" 1 499 1 14 VAL MG1 1 21 PHE HB2 . . 5.280 2.960 2.680 3.128 . 0 0 "[ . 1 . 2]" 1 500 1 14 VAL MG1 1 21 PHE HB3 . . 5.320 3.554 3.233 3.775 . 0 0 "[ . 1 . 2]" 1 501 1 14 VAL MG1 1 21 PHE QD . . 4.710 4.624 4.441 4.763 0.053 19 0 "[ . 1 . 2]" 1 502 1 14 VAL MG1 1 22 GLU H . . 3.750 2.382 2.266 2.461 . 0 0 "[ . 1 . 2]" 1 503 1 14 VAL MG1 1 22 GLU HA . . 3.850 2.955 2.777 3.167 . 0 0 "[ . 1 . 2]" 1 504 1 14 VAL MG1 1 22 GLU HB2 . . 3.800 1.974 1.914 2.011 . 0 0 "[ . 1 . 2]" 1 505 1 14 VAL MG1 1 22 GLU HB3 . . 3.860 3.391 3.315 3.436 . 0 0 "[ . 1 . 2]" 1 506 1 14 VAL MG1 1 22 GLU HG2 . . 4.400 4.068 3.905 4.337 . 0 0 "[ . 1 . 2]" 1 507 1 14 VAL MG1 1 22 GLU HG3 . . 4.360 2.884 2.610 3.330 . 0 0 "[ . 1 . 2]" 1 508 1 14 VAL MG1 1 23 ALA H . . 4.630 4.505 4.390 4.624 . 0 0 "[ . 1 . 2]" 1 509 1 14 VAL MG1 1 48 TYR QE . . 4.910 3.482 3.302 3.790 . 0 0 "[ . 1 . 2]" 1 510 1 14 VAL MG1 1 48 TYR HH . . 3.380 2.073 1.922 2.252 . 0 0 "[ . 1 . 2]" 1 511 1 14 VAL MG1 1 52 VAL HA . . 5.050 4.772 4.509 5.119 0.069 4 0 "[ . 1 . 2]" 1 512 1 14 VAL MG1 1 52 VAL MG1 . . 3.020 2.807 2.423 3.142 0.122 4 0 "[ . 1 . 2]" 1 513 1 14 VAL MG1 1 52 VAL MG2 . . 3.170 2.859 2.633 3.160 . 0 0 "[ . 1 . 2]" 1 514 1 14 VAL MG2 1 15 ALA H . . 4.040 4.098 4.027 4.117 0.077 6 0 "[ . 1 . 2]" 1 515 1 14 VAL MG2 1 18 GLY H . . 5.180 4.922 4.778 5.250 0.070 1 0 "[ . 1 . 2]" 1 516 1 14 VAL MG2 1 19 PRO HA . . 4.840 4.564 4.127 4.856 0.016 19 0 "[ . 1 . 2]" 1 517 1 14 VAL MG2 1 21 PHE H . . 4.660 4.162 3.893 4.442 . 0 0 "[ . 1 . 2]" 1 518 1 14 VAL MG2 1 21 PHE HB2 . . 4.490 2.658 2.452 2.769 . 0 0 "[ . 1 . 2]" 1 519 1 14 VAL MG2 1 21 PHE HB3 . . 3.760 2.122 2.075 2.229 . 0 0 "[ . 1 . 2]" 1 520 1 14 VAL MG2 1 21 PHE QD . . 3.960 3.834 3.688 3.930 . 0 0 "[ . 1 . 2]" 1 521 1 14 VAL MG2 1 21 PHE QE . . 5.500 5.501 5.313 5.599 0.099 1 0 "[ . 1 . 2]" 1 522 1 14 VAL MG2 1 22 GLU H . . 3.720 3.259 3.106 3.501 . 0 0 "[ . 1 . 2]" 1 523 1 14 VAL MG2 1 22 GLU HA . . 3.210 2.597 2.414 2.778 . 0 0 "[ . 1 . 2]" 1 524 1 14 VAL MG2 1 22 GLU HB2 . . 4.060 3.399 3.130 3.621 . 0 0 "[ . 1 . 2]" 1 525 1 14 VAL MG2 1 22 GLU HB3 . . 4.820 4.553 4.355 4.772 . 0 0 "[ . 1 . 2]" 1 526 1 14 VAL MG2 1 22 GLU HG2 . . 5.010 4.723 4.549 4.942 . 0 0 "[ . 1 . 2]" 1 527 1 14 VAL MG2 1 22 GLU HG3 . . 4.170 3.456 3.273 3.708 . 0 0 "[ . 1 . 2]" 1 528 1 14 VAL MG2 1 25 ILE MD . . 2.750 2.174 2.027 2.334 . 0 0 "[ . 1 . 2]" 1 529 1 14 VAL MG2 1 25 ILE MG . . 4.300 4.077 3.814 4.283 . 0 0 "[ . 1 . 2]" 1 530 1 14 VAL MG2 1 38 LEU MD2 . . 3.780 3.238 3.149 3.489 . 0 0 "[ . 1 . 2]" 1 531 1 14 VAL MG2 1 48 TYR QE . . 4.480 3.746 3.658 3.795 . 0 0 "[ . 1 . 2]" 1 532 1 14 VAL MG2 1 48 TYR HH . . 3.530 2.480 2.074 2.764 . 0 0 "[ . 1 . 2]" 1 533 1 14 VAL MG2 1 52 VAL MG2 . . 4.580 4.030 3.704 4.211 . 0 0 "[ . 1 . 2]" 1 534 1 15 ALA H 1 15 ALA MB . . 2.690 2.110 2.068 2.223 . 0 0 "[ . 1 . 2]" 1 535 1 15 ALA H 1 16 ARG H . . 3.390 2.530 2.470 2.591 . 0 0 "[ . 1 . 2]" 1 536 1 15 ALA H 1 16 ARG HA . . 5.110 5.157 5.097 5.177 0.067 13 0 "[ . 1 . 2]" 1 537 1 15 ALA H 1 16 ARG QB . . 4.950 4.540 4.354 4.678 . 0 0 "[ . 1 . 2]" 1 538 1 15 ALA H 1 17 ASN H . . 4.770 4.244 4.004 4.382 . 0 0 "[ . 1 . 2]" 1 539 1 15 ALA H 1 18 GLY H . . 4.970 4.595 4.468 4.710 . 0 0 "[ . 1 . 2]" 1 540 1 15 ALA H 1 52 VAL HA . . 4.630 4.232 3.973 4.332 . 0 0 "[ . 1 . 2]" 1 541 1 15 ALA H 1 52 VAL MG1 . . 3.880 3.819 3.408 3.975 0.095 4 0 "[ . 1 . 2]" 1 542 1 15 ALA H 1 52 VAL MG2 . . 4.650 4.217 3.654 4.545 . 0 0 "[ . 1 . 2]" 1 543 1 15 ALA H 1 55 PHE HB2 . . 4.910 4.512 4.410 4.668 . 0 0 "[ . 1 . 2]" 1 544 1 15 ALA H 1 55 PHE HB3 . . 5.500 4.627 4.483 4.853 . 0 0 "[ . 1 . 2]" 1 545 1 15 ALA HA 1 17 ASN H . . 5.090 4.883 4.555 5.143 0.053 1 0 "[ . 1 . 2]" 1 546 1 15 ALA HA 1 18 GLY H . . 4.100 4.103 3.762 4.171 0.071 4 0 "[ . 1 . 2]" 1 547 1 15 ALA HA 1 18 GLY HA2 . . 4.240 4.264 4.150 4.299 0.059 17 0 "[ . 1 . 2]" 1 548 1 15 ALA HA 1 52 VAL HA . . 4.480 4.244 4.007 4.499 0.019 4 0 "[ . 1 . 2]" 1 549 1 15 ALA HA 1 52 VAL MG1 . . 3.170 2.691 2.330 2.883 . 0 0 "[ . 1 . 2]" 1 550 1 15 ALA HA 1 52 VAL MG2 . . 4.740 4.557 4.174 4.780 0.040 6 0 "[ . 1 . 2]" 1 551 1 15 ALA HA 1 56 LYS HB2 . . 5.040 4.756 4.568 4.925 . 0 0 "[ . 1 . 2]" 1 552 1 15 ALA HA 1 56 LYS HD2 . . 3.510 2.607 2.151 2.763 . 0 0 "[ . 1 . 2]" 1 553 1 15 ALA HA 1 56 LYS HD3 . . 4.070 4.123 3.893 4.153 0.083 17 0 "[ . 1 . 2]" 1 554 1 15 ALA HA 1 56 LYS HE2 . . 4.760 4.017 3.544 4.626 . 0 0 "[ . 1 . 2]" 1 555 1 15 ALA HA 1 56 LYS QE . . 4.020 3.305 2.394 4.014 . 0 0 "[ . 1 . 2]" 1 556 1 15 ALA HA 1 56 LYS HE3 . . 4.760 3.821 2.419 4.829 0.069 18 0 "[ . 1 . 2]" 1 557 1 15 ALA HA 1 56 LYS HG2 . . 3.760 3.052 2.644 3.812 0.052 1 0 "[ . 1 . 2]" 1 558 1 15 ALA HA 1 56 LYS HG3 . . 3.570 2.468 2.209 2.724 . 0 0 "[ . 1 . 2]" 1 559 1 15 ALA MB 1 16 ARG H . . 3.140 2.582 2.431 2.712 . 0 0 "[ . 1 . 2]" 1 560 1 15 ALA MB 1 52 VAL HA . . 3.330 2.438 2.095 2.621 . 0 0 "[ . 1 . 2]" 1 561 1 15 ALA MB 1 52 VAL HB . . 4.700 4.734 4.401 4.788 0.088 17 0 "[ . 1 . 2]" 1 562 1 15 ALA MB 1 52 VAL MG1 . . 2.970 2.658 2.434 2.769 . 0 0 "[ . 1 . 2]" 1 563 1 15 ALA MB 1 52 VAL MG2 . . 3.770 3.692 3.308 3.877 0.107 6 0 "[ . 1 . 2]" 1 564 1 15 ALA MB 1 55 PHE H . . 3.740 3.641 3.558 3.807 0.067 4 0 "[ . 1 . 2]" 1 565 1 15 ALA MB 1 55 PHE HA . . 4.390 4.105 3.978 4.254 . 0 0 "[ . 1 . 2]" 1 566 1 15 ALA MB 1 55 PHE HB2 . . 3.030 2.275 2.173 2.488 . 0 0 "[ . 1 . 2]" 1 567 1 15 ALA MB 1 55 PHE HB3 . . 3.020 2.288 2.178 2.488 . 0 0 "[ . 1 . 2]" 1 568 1 15 ALA MB 1 55 PHE QD . . 3.870 3.639 3.498 3.879 0.009 4 0 "[ . 1 . 2]" 1 569 1 15 ALA MB 1 56 LYS H . . 3.400 2.797 2.649 2.982 . 0 0 "[ . 1 . 2]" 1 570 1 15 ALA MB 1 56 LYS HA . . 3.160 2.767 2.542 3.103 . 0 0 "[ . 1 . 2]" 1 571 1 15 ALA MB 1 56 LYS HB2 . . 3.630 3.626 3.363 3.718 0.088 15 0 "[ . 1 . 2]" 1 572 1 15 ALA MB 1 57 GLU H . . 4.960 4.811 4.698 4.954 . 0 0 "[ . 1 . 2]" 1 573 1 16 ARG H 1 16 ARG HB2 . . 3.760 2.587 2.338 3.585 . 0 0 "[ . 1 . 2]" 1 574 1 16 ARG H 1 16 ARG QB . . 2.960 2.362 2.261 2.517 . 0 0 "[ . 1 . 2]" 1 575 1 16 ARG H 1 16 ARG HB3 . . 3.760 3.398 2.287 3.641 . 0 0 "[ . 1 . 2]" 1 576 1 16 ARG H 1 16 ARG HD2 . . 5.500 4.384 3.957 4.601 . 0 0 "[ . 1 . 2]" 1 577 1 16 ARG H 1 16 ARG QD . . 4.760 4.097 3.776 4.254 . 0 0 "[ . 1 . 2]" 1 578 1 16 ARG H 1 16 ARG HD3 . . 5.500 4.931 4.773 5.047 . 0 0 "[ . 1 . 2]" 1 579 1 16 ARG H 1 16 ARG HG2 . . 3.630 3.412 3.238 3.651 0.021 9 0 "[ . 1 . 2]" 1 580 1 16 ARG H 1 16 ARG HG3 . . 3.630 2.513 2.272 2.794 . 0 0 "[ . 1 . 2]" 1 581 1 16 ARG H 1 17 ASN H . . 3.340 2.685 2.574 2.847 . 0 0 "[ . 1 . 2]" 1 582 1 16 ARG H 1 18 GLY H . . 4.330 4.179 3.829 4.333 0.003 17 0 "[ . 1 . 2]" 1 583 1 16 ARG HA 1 16 ARG QD . . 3.830 3.780 3.475 3.910 0.080 10 0 "[ . 1 . 2]" 1 584 1 16 ARG HA 1 16 ARG QG . . 3.420 2.412 2.115 3.503 0.083 18 0 "[ . 1 . 2]" 1 585 1 16 ARG HA 1 17 ASN HA . . 4.790 4.691 4.649 4.739 . 0 0 "[ . 1 . 2]" 1 586 1 16 ARG HA 1 18 GLY H . . 5.320 4.849 4.171 5.081 . 0 0 "[ . 1 . 2]" 1 587 1 16 ARG QB 1 16 ARG QD . . 3.220 2.137 2.086 2.225 . 0 0 "[ . 1 . 2]" 1 588 1 16 ARG QB 1 17 ASN H . . 3.440 2.570 2.281 3.525 0.085 20 0 "[ . 1 . 2]" 1 589 1 16 ARG QB 1 17 ASN HA . . 4.930 4.008 3.798 4.757 . 0 0 "[ . 1 . 2]" 1 590 1 16 ARG QB 1 17 ASN QD . . 4.020 2.806 2.407 4.106 0.086 20 0 "[ . 1 . 2]" 1 591 1 16 ARG HB2 1 17 ASN HD21 . . 5.500 3.086 2.526 5.098 . 0 0 "[ . 1 . 2]" 1 592 1 16 ARG HB2 1 17 ASN HD22 . . 5.500 3.858 3.267 5.566 0.066 15 0 "[ . 1 . 2]" 1 593 1 16 ARG HB3 1 17 ASN HD21 . . 5.500 3.989 3.658 4.809 . 0 0 "[ . 1 . 2]" 1 594 1 16 ARG HB3 1 17 ASN HD22 . . 5.500 4.447 3.955 5.555 0.055 20 0 "[ . 1 . 2]" 1 595 1 16 ARG HD2 1 17 ASN H . . 5.500 4.874 3.175 5.444 . 0 0 "[ . 1 . 2]" 1 596 1 16 ARG HD3 1 17 ASN H . . 5.500 5.341 4.445 5.572 0.072 16 0 "[ . 1 . 2]" 1 597 1 16 ARG QG 1 17 ASN H . . 4.120 3.780 2.117 4.116 . 0 0 "[ . 1 . 2]" 1 598 1 16 ARG QG 1 17 ASN QD . . 4.390 4.076 2.123 4.481 0.091 14 0 "[ . 1 . 2]" 1 599 1 16 ARG HG2 1 17 ASN H . . 4.730 4.669 3.839 4.801 0.071 17 0 "[ . 1 . 2]" 1 600 1 16 ARG HG3 1 17 ASN H . . 4.730 4.051 2.127 4.482 . 0 0 "[ . 1 . 2]" 1 601 1 17 ASN H 1 17 ASN QB . . 3.480 2.492 2.455 2.528 . 0 0 "[ . 1 . 2]" 1 602 1 17 ASN H 1 17 ASN HD21 . . 4.520 2.102 1.956 2.443 . 0 0 "[ . 1 . 2]" 1 603 1 17 ASN H 1 17 ASN QD . . 3.920 2.089 1.946 2.420 . 0 0 "[ . 1 . 2]" 1 604 1 17 ASN H 1 17 ASN HD22 . . 4.520 3.640 3.464 3.934 . 0 0 "[ . 1 . 2]" 1 605 1 17 ASN H 1 18 GLY H . . 3.210 2.652 2.480 2.766 . 0 0 "[ . 1 . 2]" 1 606 1 17 ASN H 1 18 GLY HA2 . . 5.040 4.855 4.654 5.086 0.046 1 0 "[ . 1 . 2]" 1 607 1 17 ASN HA 1 17 ASN QD . . 4.360 3.471 3.326 3.645 . 0 0 "[ . 1 . 2]" 1 608 1 17 ASN HA 1 17 ASN HD22 . . 5.020 4.255 4.112 4.402 . 0 0 "[ . 1 . 2]" 1 609 1 17 ASN HA 1 21 PHE QE . . 4.890 4.652 4.505 4.859 . 0 0 "[ . 1 . 2]" 1 610 1 17 ASN QB 1 18 GLY H . . 3.800 2.702 2.545 3.328 . 0 0 "[ . 1 . 2]" 1 611 1 17 ASN QB 1 21 PHE HB2 . . 4.160 3.105 2.905 3.378 . 0 0 "[ . 1 . 2]" 1 612 1 17 ASN QB 1 21 PHE HB3 . . 4.630 4.163 3.959 4.442 . 0 0 "[ . 1 . 2]" 1 613 1 17 ASN QB 1 21 PHE QD . . 3.960 2.162 2.053 2.342 . 0 0 "[ . 1 . 2]" 1 614 1 17 ASN QB 1 21 PHE QE . . 4.600 2.415 2.211 2.601 . 0 0 "[ . 1 . 2]" 1 615 1 17 ASN HB2 1 21 PHE QD . . 4.660 2.515 2.335 2.693 . 0 0 "[ . 1 . 2]" 1 616 1 17 ASN HB3 1 21 PHE QD . . 4.660 2.361 2.241 2.636 . 0 0 "[ . 1 . 2]" 1 617 1 17 ASN QD 1 21 PHE QD . . 5.340 4.351 4.134 4.520 . 0 0 "[ . 1 . 2]" 1 618 1 18 GLY H 1 19 PRO HD2 . . 5.010 4.726 4.638 4.806 . 0 0 "[ . 1 . 2]" 1 619 1 18 GLY H 1 19 PRO QD . . 4.390 4.167 4.054 4.229 . 0 0 "[ . 1 . 2]" 1 620 1 18 GLY H 1 19 PRO HD3 . . 5.010 4.633 4.474 4.744 . 0 0 "[ . 1 . 2]" 1 621 1 18 GLY HA2 1 19 PRO HB3 . . 5.220 4.996 4.929 5.085 . 0 0 "[ . 1 . 2]" 1 622 1 18 GLY HA2 1 19 PRO HD2 . . 3.180 2.585 2.480 2.675 . 0 0 "[ . 1 . 2]" 1 623 1 18 GLY HA2 1 19 PRO HD3 . . 3.180 2.528 2.462 2.576 . 0 0 "[ . 1 . 2]" 1 624 1 18 GLY HA2 1 19 PRO HG2 . . 5.270 4.712 4.628 4.793 . 0 0 "[ . 1 . 2]" 1 625 1 18 GLY HA2 1 19 PRO HG3 . . 5.500 4.745 4.678 4.792 . 0 0 "[ . 1 . 2]" 1 626 1 18 GLY HA2 1 20 GLU H . . 5.130 4.226 4.083 4.369 . 0 0 "[ . 1 . 2]" 1 627 1 18 GLY HA2 1 21 PHE QD . . 5.500 5.554 5.464 5.578 0.078 12 0 "[ . 1 . 2]" 1 628 1 18 GLY HA3 1 19 PRO HD2 . . 3.400 2.440 2.273 2.535 . 0 0 "[ . 1 . 2]" 1 629 1 18 GLY HA3 1 19 PRO QD . . 2.940 2.391 2.236 2.474 . 0 0 "[ . 1 . 2]" 1 630 1 18 GLY HA3 1 19 PRO HD3 . . 3.400 3.427 3.311 3.460 0.060 18 0 "[ . 1 . 2]" 1 631 1 18 GLY HA3 1 19 PRO HG2 . . 4.510 4.415 4.264 4.549 0.039 1 0 "[ . 1 . 2]" 1 632 1 18 GLY HA3 1 20 GLU H . . 4.720 3.222 3.073 3.326 . 0 0 "[ . 1 . 2]" 1 633 1 19 PRO HA 1 19 PRO HB3 . . 2.750 2.268 2.253 2.287 . 0 0 "[ . 1 . 2]" 1 634 1 19 PRO HA 1 19 PRO HG2 . . 4.190 3.842 3.813 3.871 . 0 0 "[ . 1 . 2]" 1 635 1 19 PRO HA 1 21 PHE H . . 4.490 3.820 3.523 3.986 . 0 0 "[ . 1 . 2]" 1 636 1 19 PRO HA 1 22 GLU H . . 3.790 2.988 2.805 3.142 . 0 0 "[ . 1 . 2]" 1 637 1 19 PRO HA 1 22 GLU HB2 . . 4.360 2.693 2.464 2.886 . 0 0 "[ . 1 . 2]" 1 638 1 19 PRO HA 1 22 GLU HB3 . . 4.210 3.467 3.119 3.611 . 0 0 "[ . 1 . 2]" 1 639 1 19 PRO HA 1 22 GLU HG2 . . 5.500 5.493 5.145 5.563 0.063 6 0 "[ . 1 . 2]" 1 640 1 19 PRO HA 1 22 GLU HG3 . . 5.500 5.131 4.896 5.348 . 0 0 "[ . 1 . 2]" 1 641 1 19 PRO HA 1 23 ALA H . . 5.040 4.760 4.405 4.985 . 0 0 "[ . 1 . 2]" 1 642 1 19 PRO HB2 1 19 PRO HD2 . . 4.170 4.112 4.069 4.134 . 0 0 "[ . 1 . 2]" 1 643 1 19 PRO HB2 1 19 PRO HD3 . . 4.170 3.907 3.884 3.961 . 0 0 "[ . 1 . 2]" 1 644 1 19 PRO HB2 1 20 GLU H . . 4.090 3.833 3.666 3.922 . 0 0 "[ . 1 . 2]" 1 645 1 19 PRO HB2 1 20 GLU HA . . 4.310 4.346 4.254 4.378 0.068 1 0 "[ . 1 . 2]" 1 646 1 19 PRO HB2 1 22 GLU H . . 5.260 4.700 4.414 4.908 . 0 0 "[ . 1 . 2]" 1 647 1 19 PRO HB3 1 19 PRO HD2 . . 3.870 3.855 3.798 3.898 0.028 13 0 "[ . 1 . 2]" 1 648 1 19 PRO HB3 1 19 PRO HD3 . . 3.870 2.884 2.806 2.996 . 0 0 "[ . 1 . 2]" 1 649 1 19 PRO HB3 1 20 GLU H . . 4.470 4.503 4.419 4.532 0.062 1 0 "[ . 1 . 2]" 1 650 1 19 PRO HB3 1 22 GLU H . . 5.500 5.024 4.784 5.218 . 0 0 "[ . 1 . 2]" 1 651 1 19 PRO QD 1 20 GLU H . . 3.760 3.050 2.896 3.133 . 0 0 "[ . 1 . 2]" 1 652 1 19 PRO HD2 1 20 GLU H . . 4.390 3.137 2.963 3.229 . 0 0 "[ . 1 . 2]" 1 653 1 19 PRO HD3 1 20 GLU H . . 4.390 4.162 4.071 4.230 . 0 0 "[ . 1 . 2]" 1 654 1 19 PRO HG2 1 20 GLU H . . 3.620 3.071 2.877 3.254 . 0 0 "[ . 1 . 2]" 1 655 1 19 PRO HG2 1 21 PHE H . . 5.460 5.494 5.436 5.517 0.057 4 0 "[ . 1 . 2]" 1 656 1 20 GLU H 1 20 GLU HB3 . . 3.450 2.561 2.364 2.798 . 0 0 "[ . 1 . 2]" 1 657 1 20 GLU H 1 20 GLU HG2 . . 3.960 2.440 2.016 3.261 . 0 0 "[ . 1 . 2]" 1 658 1 20 GLU H 1 20 GLU HG3 . . 3.960 3.043 2.516 3.712 . 0 0 "[ . 1 . 2]" 1 659 1 20 GLU H 1 21 PHE H . . 3.650 2.669 2.533 2.762 . 0 0 "[ . 1 . 2]" 1 660 1 20 GLU H 1 21 PHE HA . . 5.500 5.308 5.194 5.397 . 0 0 "[ . 1 . 2]" 1 661 1 20 GLU H 1 21 PHE HB2 . . 5.250 4.641 4.499 4.763 . 0 0 "[ . 1 . 2]" 1 662 1 20 GLU H 1 21 PHE QD . . 4.970 4.524 4.075 4.781 . 0 0 "[ . 1 . 2]" 1 663 1 20 GLU H 1 22 GLU H . . 5.110 4.091 4.006 4.180 . 0 0 "[ . 1 . 2]" 1 664 1 20 GLU H 1 23 ALA MB . . 5.500 5.434 5.257 5.560 0.060 8 0 "[ . 1 . 2]" 1 665 1 20 GLU HA 1 22 GLU H . . 4.460 4.121 3.984 4.298 . 0 0 "[ . 1 . 2]" 1 666 1 20 GLU HA 1 23 ALA H . . 3.870 3.646 3.376 3.830 . 0 0 "[ . 1 . 2]" 1 667 1 20 GLU HA 1 23 ALA MB . . 3.380 3.257 3.031 3.447 0.067 8 0 "[ . 1 . 2]" 1 668 1 20 GLU HA 1 24 ARG H . . 5.090 4.354 4.131 4.655 . 0 0 "[ . 1 . 2]" 1 669 1 20 GLU HB2 1 21 PHE H . . 4.290 3.860 3.749 4.108 . 0 0 "[ . 1 . 2]" 1 670 1 20 GLU HB2 1 21 PHE HA . . 4.880 4.611 4.374 4.926 0.046 1 0 "[ . 1 . 2]" 1 671 1 20 GLU HB2 1 21 PHE QD . . 4.920 4.891 4.603 5.006 0.086 3 0 "[ . 1 . 2]" 1 672 1 20 GLU HB2 1 23 ALA MB . . 4.820 4.607 4.307 4.873 0.053 15 0 "[ . 1 . 2]" 1 673 1 20 GLU HB3 1 21 PHE H . . 4.700 4.028 3.748 4.179 . 0 0 "[ . 1 . 2]" 1 674 1 20 GLU QG 1 21 PHE H . . 3.850 2.158 1.935 2.370 . 0 0 "[ . 1 . 2]" 1 675 1 20 GLU QG 1 21 PHE HA . . 4.870 3.608 3.122 3.924 . 0 0 "[ . 1 . 2]" 1 676 1 20 GLU QG 1 21 PHE QD . . 4.030 2.406 2.144 2.598 . 0 0 "[ . 1 . 2]" 1 677 1 20 GLU HG2 1 21 PHE H . . 4.390 3.068 2.044 3.953 . 0 0 "[ . 1 . 2]" 1 678 1 20 GLU HG2 1 21 PHE QD . . 4.650 3.357 2.343 4.038 . 0 0 "[ . 1 . 2]" 1 679 1 20 GLU HG3 1 21 PHE H . . 4.390 2.370 1.943 3.822 . 0 0 "[ . 1 . 2]" 1 680 1 20 GLU HG3 1 21 PHE QD . . 4.650 2.561 2.232 3.638 . 0 0 "[ . 1 . 2]" 1 681 1 21 PHE H 1 21 PHE HB2 . . 3.520 2.228 2.184 2.258 . 0 0 "[ . 1 . 2]" 1 682 1 21 PHE H 1 21 PHE HB3 . . 3.500 3.507 3.472 3.534 0.034 5 0 "[ . 1 . 2]" 1 683 1 21 PHE H 1 21 PHE QD . . 3.700 2.801 2.594 2.950 . 0 0 "[ . 1 . 2]" 1 684 1 21 PHE H 1 21 PHE QE . . 5.200 4.997 4.746 5.121 . 0 0 "[ . 1 . 2]" 1 685 1 21 PHE H 1 22 GLU H . . 3.290 2.570 2.483 2.635 . 0 0 "[ . 1 . 2]" 1 686 1 21 PHE H 1 22 GLU HB2 . . 5.430 4.631 4.460 4.763 . 0 0 "[ . 1 . 2]" 1 687 1 21 PHE H 1 22 GLU HB3 . . 5.020 5.039 4.884 5.085 0.065 15 0 "[ . 1 . 2]" 1 688 1 21 PHE H 1 23 ALA H . . 4.250 4.260 4.111 4.315 0.065 14 0 "[ . 1 . 2]" 1 689 1 21 PHE HA 1 21 PHE QD . . 3.610 2.810 2.667 2.978 . 0 0 "[ . 1 . 2]" 1 690 1 21 PHE HA 1 21 PHE QE . . 5.060 4.384 4.179 4.557 . 0 0 "[ . 1 . 2]" 1 691 1 21 PHE HA 1 23 ALA H . . 4.500 4.157 3.685 4.426 . 0 0 "[ . 1 . 2]" 1 692 1 21 PHE HA 1 24 ARG H . . 3.350 3.099 2.701 3.289 . 0 0 "[ . 1 . 2]" 1 693 1 21 PHE HA 1 24 ARG HB2 . . 3.230 2.144 2.004 2.289 . 0 0 "[ . 1 . 2]" 1 694 1 21 PHE HA 1 24 ARG HD2 . . 4.080 2.557 2.003 3.633 . 0 0 "[ . 1 . 2]" 1 695 1 21 PHE HA 1 24 ARG HD3 . . 3.870 3.391 2.724 3.880 0.010 10 0 "[ . 1 . 2]" 1 696 1 21 PHE HA 1 24 ARG HG2 . . 5.020 4.748 4.441 5.080 0.060 10 0 "[ . 1 . 2]" 1 697 1 21 PHE HA 1 24 ARG HG3 . . 4.830 3.976 3.370 4.446 . 0 0 "[ . 1 . 2]" 1 698 1 21 PHE HA 1 25 ILE H . . 4.400 3.293 3.146 3.503 . 0 0 "[ . 1 . 2]" 1 699 1 21 PHE HA 1 25 ILE MD . . 4.450 3.802 3.630 3.958 . 0 0 "[ . 1 . 2]" 1 700 1 21 PHE HB2 1 22 GLU H . . 4.050 3.188 2.972 3.445 . 0 0 "[ . 1 . 2]" 1 701 1 21 PHE HB2 1 25 ILE MD . . 5.010 3.705 3.568 3.863 . 0 0 "[ . 1 . 2]" 1 702 1 21 PHE HB3 1 22 GLU H . . 4.000 3.620 3.472 3.828 . 0 0 "[ . 1 . 2]" 1 703 1 21 PHE HB3 1 25 ILE HB . . 4.730 4.485 4.386 4.604 . 0 0 "[ . 1 . 2]" 1 704 1 21 PHE HB3 1 25 ILE MD . . 4.270 2.278 2.155 2.414 . 0 0 "[ . 1 . 2]" 1 705 1 21 PHE QD 1 22 GLU H . . 4.870 4.693 4.592 4.798 . 0 0 "[ . 1 . 2]" 1 706 1 21 PHE QD 1 22 GLU HA . . 5.500 5.577 5.564 5.586 0.086 13 0 "[ . 1 . 2]" 1 707 1 21 PHE QD 1 24 ARG HB2 . . 5.500 3.651 2.804 4.352 . 0 0 "[ . 1 . 2]" 1 708 1 21 PHE QD 1 24 ARG HB3 . . 5.500 4.322 3.662 4.911 . 0 0 "[ . 1 . 2]" 1 709 1 21 PHE QD 1 24 ARG HD2 . . 5.370 4.052 3.349 5.034 . 0 0 "[ . 1 . 2]" 1 710 1 21 PHE QD 1 24 ARG HD3 . . 4.650 4.101 3.363 4.728 0.078 15 0 "[ . 1 . 2]" 1 711 1 21 PHE QD 1 25 ILE HB . . 5.480 4.708 4.485 5.000 . 0 0 "[ . 1 . 2]" 1 712 1 21 PHE QD 1 25 ILE MD . . 3.650 2.314 2.134 2.614 . 0 0 "[ . 1 . 2]" 1 713 1 21 PHE QD 1 25 ILE QG . . 4.430 2.334 2.059 2.690 . 0 0 "[ . 1 . 2]" 1 714 1 21 PHE QE 1 25 ILE MD . . 4.930 4.083 3.898 4.430 . 0 0 "[ . 1 . 2]" 1 715 1 22 GLU H 1 22 GLU HB2 . . 3.370 2.301 2.206 2.404 . 0 0 "[ . 1 . 2]" 1 716 1 22 GLU H 1 22 GLU HB3 . . 3.150 2.683 2.536 2.787 . 0 0 "[ . 1 . 2]" 1 717 1 22 GLU H 1 22 GLU HG2 . . 4.740 4.524 4.479 4.591 . 0 0 "[ . 1 . 2]" 1 718 1 22 GLU H 1 22 GLU HG3 . . 4.520 4.291 4.176 4.423 . 0 0 "[ . 1 . 2]" 1 719 1 22 GLU H 1 23 ALA H . . 3.260 2.610 2.485 2.706 . 0 0 "[ . 1 . 2]" 1 720 1 22 GLU H 1 23 ALA MB . . 4.400 4.310 4.180 4.415 0.015 15 0 "[ . 1 . 2]" 1 721 1 22 GLU H 1 24 ARG H . . 4.510 4.096 3.903 4.238 . 0 0 "[ . 1 . 2]" 1 722 1 22 GLU H 1 25 ILE HB . . 5.500 5.415 5.188 5.526 0.026 12 0 "[ . 1 . 2]" 1 723 1 22 GLU H 1 25 ILE MD . . 5.060 4.401 4.208 4.606 . 0 0 "[ . 1 . 2]" 1 724 1 22 GLU HA 1 22 GLU HG2 . . 3.550 3.043 2.851 3.240 . 0 0 "[ . 1 . 2]" 1 725 1 22 GLU HA 1 22 GLU HG3 . . 3.240 2.444 2.311 2.682 . 0 0 "[ . 1 . 2]" 1 726 1 22 GLU HA 1 24 ARG H . . 4.920 4.727 4.543 4.859 . 0 0 "[ . 1 . 2]" 1 727 1 22 GLU HA 1 25 ILE H . . 4.300 4.194 3.939 4.343 0.043 10 0 "[ . 1 . 2]" 1 728 1 22 GLU HA 1 25 ILE HB . . 3.910 3.424 2.999 3.575 . 0 0 "[ . 1 . 2]" 1 729 1 22 GLU HA 1 25 ILE MD . . 3.880 3.264 3.007 3.472 . 0 0 "[ . 1 . 2]" 1 730 1 22 GLU HA 1 25 ILE MG . . 4.670 4.674 4.228 4.756 0.086 19 0 "[ . 1 . 2]" 1 731 1 22 GLU HA 1 26 ARG H . . 4.810 4.001 3.818 4.122 . 0 0 "[ . 1 . 2]" 1 732 1 22 GLU HA 1 38 LEU MD1 . . 4.180 3.416 3.223 3.660 . 0 0 "[ . 1 . 2]" 1 733 1 22 GLU HA 1 38 LEU MD2 . . 4.520 3.054 2.875 3.432 . 0 0 "[ . 1 . 2]" 1 734 1 22 GLU HA 1 48 TYR HH . . 4.990 3.551 3.203 3.940 . 0 0 "[ . 1 . 2]" 1 735 1 22 GLU HB2 1 23 ALA H . . 3.970 3.659 3.516 3.982 0.012 12 0 "[ . 1 . 2]" 1 736 1 22 GLU HB2 1 38 LEU MD2 . . 4.260 4.292 4.199 4.336 0.076 1 0 "[ . 1 . 2]" 1 737 1 22 GLU HB2 1 48 TYR HH . . 4.820 3.425 3.181 3.566 . 0 0 "[ . 1 . 2]" 1 738 1 22 GLU HB3 1 23 ALA H . . 3.310 2.547 2.285 3.028 . 0 0 "[ . 1 . 2]" 1 739 1 22 GLU HB3 1 23 ALA HA . . 4.480 4.128 3.958 4.377 . 0 0 "[ . 1 . 2]" 1 740 1 22 GLU HB3 1 23 ALA MB . . 3.990 3.709 3.579 3.901 . 0 0 "[ . 1 . 2]" 1 741 1 22 GLU HB3 1 38 LEU MD2 . . 4.950 4.587 4.451 4.727 . 0 0 "[ . 1 . 2]" 1 742 1 22 GLU HB3 1 48 TYR HH . . 4.760 4.768 4.572 4.828 0.068 2 0 "[ . 1 . 2]" 1 743 1 22 GLU HG2 1 23 ALA H . . 4.440 4.122 3.936 4.415 . 0 0 "[ . 1 . 2]" 1 744 1 22 GLU HG2 1 23 ALA HA . . 4.690 4.177 3.979 4.494 . 0 0 "[ . 1 . 2]" 1 745 1 22 GLU HG2 1 38 LEU MD1 . . 4.800 4.104 3.575 4.651 . 0 0 "[ . 1 . 2]" 1 746 1 22 GLU HG2 1 38 LEU MD2 . . 3.650 2.852 2.517 3.238 . 0 0 "[ . 1 . 2]" 1 747 1 22 GLU HG2 1 48 TYR HH . . 4.490 4.120 3.934 4.405 . 0 0 "[ . 1 . 2]" 1 748 1 22 GLU HG3 1 23 ALA H . . 5.020 4.850 4.757 5.040 0.020 12 0 "[ . 1 . 2]" 1 749 1 22 GLU HG3 1 23 ALA HA . . 5.470 5.532 5.517 5.541 0.071 7 0 "[ . 1 . 2]" 1 750 1 22 GLU HG3 1 38 LEU MD1 . . 4.460 3.941 3.497 4.244 . 0 0 "[ . 1 . 2]" 1 751 1 22 GLU HG3 1 38 LEU MD2 . . 3.320 2.231 2.109 2.415 . 0 0 "[ . 1 . 2]" 1 752 1 22 GLU HG3 1 48 TYR HH . . 4.410 2.403 2.177 2.690 . 0 0 "[ . 1 . 2]" 1 753 1 23 ALA H 1 23 ALA MB . . 2.630 2.245 2.204 2.290 . 0 0 "[ . 1 . 2]" 1 754 1 23 ALA H 1 24 ARG H . . 3.240 2.560 2.331 2.687 . 0 0 "[ . 1 . 2]" 1 755 1 23 ALA H 1 24 ARG HA . . 5.270 5.214 5.027 5.310 0.040 1 0 "[ . 1 . 2]" 1 756 1 23 ALA H 1 24 ARG HB2 . . 4.480 4.486 4.285 4.540 0.060 1 0 "[ . 1 . 2]" 1 757 1 23 ALA H 1 25 ILE H . . 4.400 4.425 4.226 4.472 0.072 5 0 "[ . 1 . 2]" 1 758 1 23 ALA HA 1 25 ILE H . . 5.140 4.964 4.890 5.050 . 0 0 "[ . 1 . 2]" 1 759 1 23 ALA HA 1 26 ARG H . . 4.080 3.731 3.662 3.861 . 0 0 "[ . 1 . 2]" 1 760 1 23 ALA HA 1 26 ARG HA . . 5.500 5.515 5.408 5.564 0.064 10 0 "[ . 1 . 2]" 1 761 1 23 ALA HA 1 26 ARG HB2 . . 3.750 3.626 3.422 3.794 0.044 1 0 "[ . 1 . 2]" 1 762 1 23 ALA HA 1 26 ARG QB . . 3.190 2.633 2.521 2.732 . 0 0 "[ . 1 . 2]" 1 763 1 23 ALA HA 1 26 ARG HB3 . . 3.750 2.705 2.560 2.825 . 0 0 "[ . 1 . 2]" 1 764 1 23 ALA HA 1 26 ARG QD . . 4.070 3.970 3.222 4.145 0.075 15 0 "[ . 1 . 2]" 1 765 1 23 ALA HA 1 26 ARG HE . . 5.500 4.116 2.492 5.444 . 0 0 "[ . 1 . 2]" 1 766 1 23 ALA HA 1 26 ARG QG . . 5.340 4.596 4.236 4.795 . 0 0 "[ . 1 . 2]" 1 767 1 23 ALA HA 1 27 GLN H . . 4.320 3.912 3.716 4.115 . 0 0 "[ . 1 . 2]" 1 768 1 23 ALA HA 1 27 GLN HB2 . . 4.990 4.565 4.306 4.868 . 0 0 "[ . 1 . 2]" 1 769 1 23 ALA HA 1 38 LEU MD1 . . 5.330 4.921 4.728 5.156 . 0 0 "[ . 1 . 2]" 1 770 1 23 ALA MB 1 24 ARG H . . 2.980 2.515 2.335 2.640 . 0 0 "[ . 1 . 2]" 1 771 1 23 ALA MB 1 25 ILE H . . 4.790 4.834 4.767 4.879 0.089 9 0 "[ . 1 . 2]" 1 772 1 23 ALA MB 1 26 ARG H . . 4.940 4.815 4.763 4.886 . 0 0 "[ . 1 . 2]" 1 773 1 23 ALA MB 1 27 GLN H . . 5.230 4.503 4.370 4.650 . 0 0 "[ . 1 . 2]" 1 774 1 23 ALA MB 1 27 GLN HB2 . . 4.950 4.229 4.030 4.482 . 0 0 "[ . 1 . 2]" 1 775 1 24 ARG H 1 24 ARG HB2 . . 2.890 2.278 2.127 2.425 . 0 0 "[ . 1 . 2]" 1 776 1 24 ARG H 1 24 ARG HD2 . . 4.300 3.505 3.293 4.080 . 0 0 "[ . 1 . 2]" 1 777 1 24 ARG H 1 24 ARG HD3 . . 4.390 4.442 4.288 4.458 0.068 13 0 "[ . 1 . 2]" 1 778 1 24 ARG H 1 24 ARG HG2 . . 4.420 3.947 3.725 4.182 . 0 0 "[ . 1 . 2]" 1 779 1 24 ARG H 1 24 ARG HG3 . . 3.310 2.656 2.334 3.044 . 0 0 "[ . 1 . 2]" 1 780 1 24 ARG H 1 25 ILE H . . 3.270 2.894 2.760 2.972 . 0 0 "[ . 1 . 2]" 1 781 1 24 ARG H 1 25 ILE HA . . 5.500 5.457 5.360 5.518 0.018 12 0 "[ . 1 . 2]" 1 782 1 24 ARG H 1 25 ILE HB . . 5.280 4.977 4.812 5.079 . 0 0 "[ . 1 . 2]" 1 783 1 24 ARG H 1 25 ILE MD . . 5.100 5.164 5.132 5.179 0.079 4 0 "[ . 1 . 2]" 1 784 1 24 ARG H 1 26 ARG H . . 4.490 4.215 4.070 4.277 . 0 0 "[ . 1 . 2]" 1 785 1 24 ARG HA 1 24 ARG HB3 . . 3.010 2.599 2.519 2.720 . 0 0 "[ . 1 . 2]" 1 786 1 24 ARG HA 1 24 ARG HD2 . . 4.380 4.444 4.429 4.454 0.074 13 0 "[ . 1 . 2]" 1 787 1 24 ARG HA 1 24 ARG HD3 . . 4.720 4.453 4.303 4.552 . 0 0 "[ . 1 . 2]" 1 788 1 24 ARG HA 1 24 ARG HG2 . . 3.440 2.648 2.453 2.792 . 0 0 "[ . 1 . 2]" 1 789 1 24 ARG HA 1 24 ARG HG3 . . 3.400 2.599 2.467 2.715 . 0 0 "[ . 1 . 2]" 1 790 1 24 ARG HA 1 26 ARG H . . 5.440 4.698 4.560 4.854 . 0 0 "[ . 1 . 2]" 1 791 1 24 ARG HA 1 27 GLN H . . 4.180 3.749 3.566 3.922 . 0 0 "[ . 1 . 2]" 1 792 1 24 ARG HA 1 27 GLN HB2 . . 4.170 3.913 3.315 4.173 0.003 19 0 "[ . 1 . 2]" 1 793 1 24 ARG HA 1 27 GLN HB3 . . 3.850 3.453 3.053 3.901 0.051 2 0 "[ . 1 . 2]" 1 794 1 24 ARG HA 1 28 ASN H . . 4.190 4.043 3.881 4.203 0.013 11 0 "[ . 1 . 2]" 1 795 1 24 ARG HB2 1 24 ARG HD2 . . 3.270 2.421 2.194 2.774 . 0 0 "[ . 1 . 2]" 1 796 1 24 ARG HB2 1 24 ARG HD3 . . 3.360 2.619 2.364 2.832 . 0 0 "[ . 1 . 2]" 1 797 1 24 ARG HB2 1 25 ILE H . . 3.540 2.346 2.151 2.681 . 0 0 "[ . 1 . 2]" 1 798 1 24 ARG HB2 1 25 ILE MD . . 4.620 4.434 4.257 4.691 0.071 14 0 "[ . 1 . 2]" 1 799 1 24 ARG HB3 1 24 ARG HG2 . . 2.900 2.336 2.250 2.410 . 0 0 "[ . 1 . 2]" 1 800 1 24 ARG HB3 1 25 ILE HA . . 4.320 4.019 3.859 4.165 . 0 0 "[ . 1 . 2]" 1 801 1 24 ARG HB3 1 28 ASN H . . 5.170 5.006 4.859 5.208 0.038 11 0 "[ . 1 . 2]" 1 802 1 24 ARG HB3 1 28 ASN HD21 . . 4.440 3.183 2.797 3.587 . 0 0 "[ . 1 . 2]" 1 803 1 24 ARG HB3 1 28 ASN HD22 . . 4.940 2.762 2.437 3.251 . 0 0 "[ . 1 . 2]" 1 804 1 24 ARG HD3 1 28 ASN HD22 . . 5.500 4.669 4.289 5.061 . 0 0 "[ . 1 . 2]" 1 805 1 24 ARG HG2 1 25 ILE H . . 5.170 4.890 4.787 4.983 . 0 0 "[ . 1 . 2]" 1 806 1 24 ARG HG2 1 28 ASN HD21 . . 5.230 4.966 4.572 5.271 0.041 8 0 "[ . 1 . 2]" 1 807 1 24 ARG HG2 1 28 ASN HD22 . . 4.490 3.794 3.535 3.952 . 0 0 "[ . 1 . 2]" 1 808 1 24 ARG HG3 1 25 ILE H . . 4.790 4.560 4.432 4.812 0.022 14 0 "[ . 1 . 2]" 1 809 1 24 ARG HG3 1 28 ASN HD22 . . 5.100 5.159 5.142 5.170 0.070 7 0 "[ . 1 . 2]" 1 810 1 25 ILE H 1 25 ILE HB . . 3.250 2.524 2.421 2.609 . 0 0 "[ . 1 . 2]" 1 811 1 25 ILE H 1 25 ILE MD . . 3.790 3.326 3.274 3.396 . 0 0 "[ . 1 . 2]" 1 812 1 25 ILE H 1 25 ILE HG12 . . 3.730 3.518 3.419 3.606 . 0 0 "[ . 1 . 2]" 1 813 1 25 ILE H 1 25 ILE QG . . 3.190 2.094 1.992 2.197 . 0 0 "[ . 1 . 2]" 1 814 1 25 ILE H 1 25 ILE HG13 . . 3.730 2.110 2.005 2.216 . 0 0 "[ . 1 . 2]" 1 815 1 25 ILE H 1 25 ILE MG . . 4.020 3.771 3.732 3.808 . 0 0 "[ . 1 . 2]" 1 816 1 25 ILE H 1 26 ARG H . . 3.680 2.874 2.806 2.925 . 0 0 "[ . 1 . 2]" 1 817 1 25 ILE H 1 27 GLN H . . 5.460 4.457 4.339 4.660 . 0 0 "[ . 1 . 2]" 1 818 1 25 ILE H 1 28 ASN HD21 . . 4.700 4.171 3.897 4.438 . 0 0 "[ . 1 . 2]" 1 819 1 25 ILE H 1 38 LEU MD1 . . 4.680 4.316 4.132 4.458 . 0 0 "[ . 1 . 2]" 1 820 1 25 ILE HA 1 25 ILE MD . . 4.080 3.931 3.893 3.966 . 0 0 "[ . 1 . 2]" 1 821 1 25 ILE HA 1 25 ILE QG . . 3.290 2.500 2.434 2.576 . 0 0 "[ . 1 . 2]" 1 822 1 25 ILE HA 1 25 ILE MG . . 2.940 2.430 2.374 2.525 . 0 0 "[ . 1 . 2]" 1 823 1 25 ILE HA 1 28 ASN H . . 3.860 3.529 3.429 3.694 . 0 0 "[ . 1 . 2]" 1 824 1 25 ILE HA 1 28 ASN HA . . 5.500 5.426 5.282 5.522 0.022 19 0 "[ . 1 . 2]" 1 825 1 25 ILE HA 1 28 ASN HB2 . . 3.480 2.574 2.377 2.666 . 0 0 "[ . 1 . 2]" 1 826 1 25 ILE HA 1 28 ASN HB3 . . 4.200 4.190 3.962 4.248 0.048 17 0 "[ . 1 . 2]" 1 827 1 25 ILE HA 1 28 ASN HD21 . . 4.170 2.633 2.274 2.723 . 0 0 "[ . 1 . 2]" 1 828 1 25 ILE HA 1 28 ASN HD22 . . 4.830 4.106 3.608 4.323 . 0 0 "[ . 1 . 2]" 1 829 1 25 ILE HA 1 29 GLU QG . . 4.260 3.933 3.400 4.328 0.068 15 0 "[ . 1 . 2]" 1 830 1 25 ILE HB 1 25 ILE MD . . 3.400 2.294 2.235 2.345 . 0 0 "[ . 1 . 2]" 1 831 1 25 ILE HB 1 26 ARG H . . 3.670 2.586 2.412 2.669 . 0 0 "[ . 1 . 2]" 1 832 1 25 ILE HB 1 28 ASN HD21 . . 5.500 5.456 5.202 5.561 0.061 10 0 "[ . 1 . 2]" 1 833 1 25 ILE HB 1 35 PHE QE . . 5.500 5.204 4.821 5.576 0.076 19 0 "[ . 1 . 2]" 1 834 1 25 ILE HB 1 38 LEU MD1 . . 3.790 2.551 2.382 2.706 . 0 0 "[ . 1 . 2]" 1 835 1 25 ILE MD 1 25 ILE MG . . 2.560 2.118 2.091 2.151 . 0 0 "[ . 1 . 2]" 1 836 1 25 ILE MD 1 26 ARG H . . 5.220 4.402 4.203 4.540 . 0 0 "[ . 1 . 2]" 1 837 1 25 ILE QG 1 26 ARG H . . 5.280 4.167 4.050 4.236 . 0 0 "[ . 1 . 2]" 1 838 1 25 ILE QG 1 28 ASN HB2 . . 5.340 4.554 4.297 4.709 . 0 0 "[ . 1 . 2]" 1 839 1 25 ILE MG 1 26 ARG H . . 3.720 3.389 3.326 3.476 . 0 0 "[ . 1 . 2]" 1 840 1 25 ILE MG 1 26 ARG HA . . 4.010 3.456 3.393 3.542 . 0 0 "[ . 1 . 2]" 1 841 1 25 ILE MG 1 28 ASN H . . 5.000 4.785 4.648 4.919 . 0 0 "[ . 1 . 2]" 1 842 1 25 ILE MG 1 28 ASN HB2 . . 4.270 3.927 3.777 4.047 . 0 0 "[ . 1 . 2]" 1 843 1 25 ILE MG 1 28 ASN HB3 . . 5.150 5.115 4.952 5.214 0.064 10 0 "[ . 1 . 2]" 1 844 1 25 ILE MG 1 28 ASN HD21 . . 4.400 4.421 4.016 4.484 0.084 11 0 "[ . 1 . 2]" 1 845 1 25 ILE MG 1 29 GLU H . . 4.500 4.042 3.832 4.463 . 0 0 "[ . 1 . 2]" 1 846 1 25 ILE MG 1 29 GLU HB2 . . 4.000 3.349 3.075 3.628 . 0 0 "[ . 1 . 2]" 1 847 1 25 ILE MG 1 29 GLU HB3 . . 5.050 4.583 4.247 4.887 . 0 0 "[ . 1 . 2]" 1 848 1 25 ILE MG 1 29 GLU HG2 . . 4.120 3.792 3.174 4.194 0.074 4 0 "[ . 1 . 2]" 1 849 1 25 ILE MG 1 29 GLU QG . . 3.500 3.079 2.389 3.556 0.056 3 0 "[ . 1 . 2]" 1 850 1 25 ILE MG 1 29 GLU HG3 . . 4.120 3.270 2.470 3.853 . 0 0 "[ . 1 . 2]" 1 851 1 25 ILE MG 1 35 PHE HB2 . . 5.430 4.415 3.700 4.882 . 0 0 "[ . 1 . 2]" 1 852 1 25 ILE MG 1 35 PHE HB3 . . 4.360 3.291 2.635 3.723 . 0 0 "[ . 1 . 2]" 1 853 1 25 ILE MG 1 35 PHE QD . . 3.460 2.107 1.917 2.424 . 0 0 "[ . 1 . 2]" 1 854 1 25 ILE MG 1 35 PHE QE . . 3.230 2.461 2.197 2.836 . 0 0 "[ . 1 . 2]" 1 855 1 25 ILE MG 1 38 LEU MD1 . . 2.780 2.125 1.966 2.210 . 0 0 "[ . 1 . 2]" 1 856 1 26 ARG H 1 26 ARG HB2 . . 3.670 2.409 2.368 2.505 . 0 0 "[ . 1 . 2]" 1 857 1 26 ARG H 1 26 ARG HB3 . . 3.670 2.613 2.434 2.728 . 0 0 "[ . 1 . 2]" 1 858 1 26 ARG H 1 26 ARG QD . . 4.620 4.408 4.251 4.596 . 0 0 "[ . 1 . 2]" 1 859 1 26 ARG H 1 26 ARG HG2 . . 4.680 4.546 4.428 4.594 . 0 0 "[ . 1 . 2]" 1 860 1 26 ARG H 1 26 ARG HG3 . . 4.680 4.361 4.294 4.459 . 0 0 "[ . 1 . 2]" 1 861 1 26 ARG H 1 27 GLN H . . 3.820 2.914 2.854 2.997 . 0 0 "[ . 1 . 2]" 1 862 1 26 ARG H 1 38 LEU MD1 . . 4.060 2.540 2.423 2.662 . 0 0 "[ . 1 . 2]" 1 863 1 26 ARG H 1 38 LEU MD2 . . 4.970 4.322 4.197 4.501 . 0 0 "[ . 1 . 2]" 1 864 1 26 ARG HA 1 26 ARG HD2 . . 5.500 4.560 4.217 4.808 . 0 0 "[ . 1 . 2]" 1 865 1 26 ARG HA 1 26 ARG QD . . 4.640 3.891 3.802 4.001 . 0 0 "[ . 1 . 2]" 1 866 1 26 ARG HA 1 26 ARG HD3 . . 5.500 4.231 4.084 4.540 . 0 0 "[ . 1 . 2]" 1 867 1 26 ARG HA 1 26 ARG HE . . 5.370 5.087 4.974 5.416 0.046 14 0 "[ . 1 . 2]" 1 868 1 26 ARG HA 1 26 ARG HG2 . . 3.690 3.138 2.957 3.333 . 0 0 "[ . 1 . 2]" 1 869 1 26 ARG HA 1 26 ARG HG3 . . 3.690 2.426 2.336 2.569 . 0 0 "[ . 1 . 2]" 1 870 1 26 ARG HA 1 27 GLN HA . . 5.190 4.699 4.602 4.785 . 0 0 "[ . 1 . 2]" 1 871 1 26 ARG HA 1 28 ASN H . . 5.190 4.531 4.258 4.734 . 0 0 "[ . 1 . 2]" 1 872 1 26 ARG HA 1 29 GLU H . . 4.590 3.846 3.603 4.020 . 0 0 "[ . 1 . 2]" 1 873 1 26 ARG HA 1 29 GLU HB2 . . 4.530 4.014 3.665 4.371 . 0 0 "[ . 1 . 2]" 1 874 1 26 ARG HA 1 30 ILE H . . 5.330 4.833 4.490 5.024 . 0 0 "[ . 1 . 2]" 1 875 1 26 ARG HA 1 30 ILE HA . . 5.440 4.482 4.147 4.767 . 0 0 "[ . 1 . 2]" 1 876 1 26 ARG HA 1 35 PHE HB3 . . 3.920 3.493 3.177 3.682 . 0 0 "[ . 1 . 2]" 1 877 1 26 ARG HA 1 38 LEU HB3 . . 4.870 3.736 3.576 3.869 . 0 0 "[ . 1 . 2]" 1 878 1 26 ARG HA 1 38 LEU MD1 . . 3.260 2.251 2.163 2.352 . 0 0 "[ . 1 . 2]" 1 879 1 26 ARG HA 1 38 LEU MD2 . . 4.610 4.635 4.433 4.685 0.075 20 0 "[ . 1 . 2]" 1 880 1 26 ARG QB 1 26 ARG QD . . 2.910 2.141 2.072 2.281 . 0 0 "[ . 1 . 2]" 1 881 1 26 ARG QB 1 27 GLN H . . 3.500 2.502 2.327 2.655 . 0 0 "[ . 1 . 2]" 1 882 1 26 ARG QB 1 38 LEU MD1 . . 3.140 2.239 2.116 2.383 . 0 0 "[ . 1 . 2]" 1 883 1 26 ARG HB2 1 27 GLN H . . 4.030 3.844 3.745 3.944 . 0 0 "[ . 1 . 2]" 1 884 1 26 ARG HB3 1 27 GLN H . . 4.030 2.535 2.350 2.699 . 0 0 "[ . 1 . 2]" 1 885 1 26 ARG QD 1 26 ARG QH1 . . 3.690 2.030 1.945 2.195 . 0 0 "[ . 1 . 2]" 1 886 1 26 ARG QD 1 27 GLN H . . 5.180 4.976 4.436 5.218 0.038 2 0 "[ . 1 . 2]" 1 887 1 26 ARG QD 1 30 ILE MD . . 4.200 3.767 3.415 4.108 . 0 0 "[ . 1 . 2]" 1 888 1 26 ARG QD 1 38 LEU H . . 5.340 4.550 4.293 4.952 . 0 0 "[ . 1 . 2]" 1 889 1 26 ARG QD 1 38 LEU HA . . 4.630 3.921 3.759 4.200 . 0 0 "[ . 1 . 2]" 1 890 1 26 ARG QD 1 38 LEU HB2 . . 4.410 3.033 2.785 3.316 . 0 0 "[ . 1 . 2]" 1 891 1 26 ARG QD 1 38 LEU HB3 . . 3.710 2.245 2.086 2.588 . 0 0 "[ . 1 . 2]" 1 892 1 26 ARG QD 1 38 LEU MD1 . . 4.240 3.633 3.367 3.912 . 0 0 "[ . 1 . 2]" 1 893 1 26 ARG QD 1 38 LEU MD2 . . 4.770 3.834 3.711 4.147 . 0 0 "[ . 1 . 2]" 1 894 1 26 ARG QD 1 38 LEU HG . . 5.340 4.896 4.725 5.199 . 0 0 "[ . 1 . 2]" 1 895 1 26 ARG QD 1 39 ASN H . . 3.910 3.535 3.202 3.972 0.062 12 0 "[ . 1 . 2]" 1 896 1 26 ARG QD 1 39 ASN HA . . 3.810 2.467 2.169 2.926 . 0 0 "[ . 1 . 2]" 1 897 1 26 ARG QD 1 39 ASN QD . . 3.810 3.052 2.473 3.884 0.074 14 0 "[ . 1 . 2]" 1 898 1 26 ARG QD 1 40 PRO QD . . 4.760 3.739 3.214 4.078 . 0 0 "[ . 1 . 2]" 1 899 1 26 ARG HD2 1 38 LEU HA . . 5.500 4.618 4.081 5.296 . 0 0 "[ . 1 . 2]" 1 900 1 26 ARG HD2 1 38 LEU HB3 . . 4.360 3.139 2.237 3.717 . 0 0 "[ . 1 . 2]" 1 901 1 26 ARG HD2 1 38 LEU MD1 . . 4.910 4.552 3.915 4.967 0.057 14 0 "[ . 1 . 2]" 1 902 1 26 ARG HD2 1 38 LEU MD2 . . 5.500 4.936 4.035 5.435 . 0 0 "[ . 1 . 2]" 1 903 1 26 ARG HD3 1 38 LEU HA . . 5.500 4.321 3.970 5.549 0.049 19 0 "[ . 1 . 2]" 1 904 1 26 ARG HD3 1 38 LEU HB3 . . 4.360 2.378 2.117 3.442 . 0 0 "[ . 1 . 2]" 1 905 1 26 ARG HD3 1 38 LEU MD1 . . 4.910 3.840 3.505 4.351 . 0 0 "[ . 1 . 2]" 1 906 1 26 ARG HD3 1 38 LEU MD2 . . 5.500 4.031 3.847 4.676 . 0 0 "[ . 1 . 2]" 1 907 1 26 ARG QG 1 30 ILE MD . . 3.790 2.349 2.009 2.874 . 0 0 "[ . 1 . 2]" 1 908 1 26 ARG QG 1 38 LEU HB2 . . 4.570 2.427 2.205 2.938 . 0 0 "[ . 1 . 2]" 1 909 1 26 ARG QG 1 38 LEU HB3 . . 4.400 2.867 2.694 3.137 . 0 0 "[ . 1 . 2]" 1 910 1 26 ARG QG 1 38 LEU MD1 . . 3.810 3.183 2.855 3.506 . 0 0 "[ . 1 . 2]" 1 911 1 26 ARG HG2 1 27 GLN H . . 4.710 3.814 3.387 3.977 . 0 0 "[ . 1 . 2]" 1 912 1 26 ARG HG2 1 30 ILE MD . . 4.440 2.426 2.053 3.112 . 0 0 "[ . 1 . 2]" 1 913 1 26 ARG HG2 1 38 LEU MD1 . . 4.490 4.377 4.112 4.545 0.055 19 0 "[ . 1 . 2]" 1 914 1 26 ARG HG3 1 27 GLN H . . 4.710 4.697 4.437 4.766 0.056 18 0 "[ . 1 . 2]" 1 915 1 26 ARG HG3 1 30 ILE MD . . 4.440 3.214 2.856 3.518 . 0 0 "[ . 1 . 2]" 1 916 1 26 ARG HG3 1 38 LEU MD1 . . 4.490 3.270 2.913 3.647 . 0 0 "[ . 1 . 2]" 1 917 1 27 GLN H 1 27 GLN HB2 . . 3.180 2.271 2.120 2.417 . 0 0 "[ . 1 . 2]" 1 918 1 27 GLN H 1 27 GLN HB3 . . 3.190 2.776 2.573 3.136 . 0 0 "[ . 1 . 2]" 1 919 1 27 GLN H 1 27 GLN HG2 . . 5.350 4.526 3.844 4.643 . 0 0 "[ . 1 . 2]" 1 920 1 27 GLN H 1 27 GLN QG . . 4.620 4.030 3.631 4.084 . 0 0 "[ . 1 . 2]" 1 921 1 27 GLN H 1 27 GLN HG3 . . 5.350 4.531 4.465 4.609 . 0 0 "[ . 1 . 2]" 1 922 1 27 GLN H 1 28 ASN H . . 3.270 2.656 2.578 2.756 . 0 0 "[ . 1 . 2]" 1 923 1 27 GLN H 1 29 GLU H . . 5.500 4.351 4.165 4.531 . 0 0 "[ . 1 . 2]" 1 924 1 27 GLN H 1 30 ILE MD . . 5.500 4.730 3.961 5.412 . 0 0 "[ . 1 . 2]" 1 925 1 27 GLN H 1 30 ILE MG . . 5.500 5.497 5.356 5.571 0.071 13 0 "[ . 1 . 2]" 1 926 1 27 GLN H 1 38 LEU MD1 . . 5.110 4.686 4.581 4.755 . 0 0 "[ . 1 . 2]" 1 927 1 27 GLN HA 1 27 GLN QE . . 3.850 2.509 1.902 3.273 . 0 0 "[ . 1 . 2]" 1 928 1 27 GLN HA 1 27 GLN QG . . 3.010 2.762 2.451 2.994 . 0 0 "[ . 1 . 2]" 1 929 1 27 GLN HA 1 29 GLU H . . 5.270 4.447 3.998 4.679 . 0 0 "[ . 1 . 2]" 1 930 1 27 GLN HA 1 30 ILE H . . 4.130 3.640 3.380 3.972 . 0 0 "[ . 1 . 2]" 1 931 1 27 GLN HA 1 30 ILE HB . . 3.490 2.310 2.186 2.440 . 0 0 "[ . 1 . 2]" 1 932 1 27 GLN HA 1 30 ILE MD . . 3.790 3.230 2.417 3.851 0.061 12 0 "[ . 1 . 2]" 1 933 1 27 GLN HA 1 30 ILE HG12 . . 4.050 3.711 3.432 3.929 . 0 0 "[ . 1 . 2]" 1 934 1 27 GLN HA 1 30 ILE HG13 . . 5.220 4.968 4.609 5.183 . 0 0 "[ . 1 . 2]" 1 935 1 27 GLN HA 1 30 ILE MG . . 3.330 3.268 3.022 3.403 0.073 15 0 "[ . 1 . 2]" 1 936 1 27 GLN HB2 1 28 ASN H . . 3.780 3.747 3.241 3.841 0.061 11 0 "[ . 1 . 2]" 1 937 1 27 GLN HB2 1 28 ASN HA . . 5.500 5.544 5.249 5.569 0.069 16 0 "[ . 1 . 2]" 1 938 1 27 GLN HB3 1 27 GLN QG . . 2.620 2.201 2.148 2.344 . 0 0 "[ . 1 . 2]" 1 939 1 27 GLN HB3 1 28 ASN H . . 3.490 2.783 2.558 3.325 . 0 0 "[ . 1 . 2]" 1 940 1 27 GLN HB3 1 28 ASN HA . . 4.460 4.090 3.820 4.211 . 0 0 "[ . 1 . 2]" 1 941 1 27 GLN QE 1 27 GLN QG . . 2.810 2.242 2.116 2.795 . 0 0 "[ . 1 . 2]" 1 942 1 27 GLN QE 1 30 ILE HB . . 4.540 3.029 2.596 3.727 . 0 0 "[ . 1 . 2]" 1 943 1 27 GLN QE 1 30 ILE MD . . 4.190 3.402 2.599 3.809 . 0 0 "[ . 1 . 2]" 1 944 1 27 GLN QE 1 30 ILE HG12 . . 4.980 2.610 2.170 3.488 . 0 0 "[ . 1 . 2]" 1 945 1 27 GLN QE 1 30 ILE MG . . 4.040 2.345 1.933 3.691 . 0 0 "[ . 1 . 2]" 1 946 1 27 GLN HE21 1 30 ILE MD . . 4.810 4.091 2.804 4.730 . 0 0 "[ . 1 . 2]" 1 947 1 27 GLN HE21 1 30 ILE MG . . 4.810 2.479 2.031 3.906 . 0 0 "[ . 1 . 2]" 1 948 1 27 GLN HE22 1 30 ILE MD . . 4.810 3.707 3.074 4.673 . 0 0 "[ . 1 . 2]" 1 949 1 27 GLN HE22 1 30 ILE MG . . 4.810 3.135 1.984 4.540 . 0 0 "[ . 1 . 2]" 1 950 1 27 GLN QG 1 30 ILE MD . . 5.320 5.029 4.309 5.401 0.081 3 0 "[ . 1 . 2]" 1 951 1 27 GLN QG 1 30 ILE HG12 . . 5.100 4.958 4.491 5.171 0.071 4 0 "[ . 1 . 2]" 1 952 1 27 GLN QG 1 30 ILE MG . . 4.040 3.723 3.176 4.140 0.100 2 0 "[ . 1 . 2]" 1 953 1 27 GLN HG2 1 28 ASN H . . 5.500 5.053 4.581 5.552 0.052 1 0 "[ . 1 . 2]" 1 954 1 27 GLN HG3 1 28 ASN H . . 5.500 4.405 4.008 5.025 . 0 0 "[ . 1 . 2]" 1 955 1 28 ASN H 1 28 ASN HB2 . . 3.210 2.446 2.374 2.569 . 0 0 "[ . 1 . 2]" 1 956 1 28 ASN H 1 28 ASN HB3 . . 3.650 3.608 3.593 3.629 . 0 0 "[ . 1 . 2]" 1 957 1 28 ASN H 1 28 ASN HD22 . . 4.870 4.176 3.953 4.619 . 0 0 "[ . 1 . 2]" 1 958 1 28 ASN H 1 29 GLU H . . 3.500 2.728 2.466 2.872 . 0 0 "[ . 1 . 2]" 1 959 1 28 ASN H 1 29 GLU QG . . 4.930 4.573 4.070 4.906 . 0 0 "[ . 1 . 2]" 1 960 1 28 ASN H 1 30 ILE H . . 4.580 4.149 3.835 4.393 . 0 0 "[ . 1 . 2]" 1 961 1 28 ASN H 1 30 ILE MG . . 5.330 4.977 4.761 5.084 . 0 0 "[ . 1 . 2]" 1 962 1 28 ASN HA 1 28 ASN HD21 . . 4.650 4.486 4.255 4.588 . 0 0 "[ . 1 . 2]" 1 963 1 28 ASN HA 1 28 ASN HD22 . . 4.670 4.608 4.377 4.728 0.058 6 0 "[ . 1 . 2]" 1 964 1 28 ASN HA 1 29 GLU HA . . 4.910 4.658 4.586 4.780 . 0 0 "[ . 1 . 2]" 1 965 1 28 ASN HA 1 29 GLU QG . . 4.690 4.557 4.368 4.728 0.038 13 0 "[ . 1 . 2]" 1 966 1 28 ASN HA 1 30 ILE H . . 4.470 4.120 3.895 4.281 . 0 0 "[ . 1 . 2]" 1 967 1 28 ASN HA 1 30 ILE MG . . 5.060 4.387 4.150 4.681 . 0 0 "[ . 1 . 2]" 1 968 1 28 ASN HB2 1 29 GLU H . . 4.070 2.713 2.444 3.044 . 0 0 "[ . 1 . 2]" 1 969 1 28 ASN HB2 1 29 GLU HB2 . . 4.660 4.262 4.019 4.615 . 0 0 "[ . 1 . 2]" 1 970 1 28 ASN HB2 1 29 GLU HG2 . . 4.570 2.962 2.518 3.331 . 0 0 "[ . 1 . 2]" 1 971 1 28 ASN HB2 1 29 GLU QG . . 3.790 2.909 2.486 3.229 . 0 0 "[ . 1 . 2]" 1 972 1 28 ASN HB2 1 29 GLU HG3 . . 4.570 4.293 3.831 4.496 . 0 0 "[ . 1 . 2]" 1 973 1 28 ASN HB3 1 29 GLU H . . 4.130 3.605 3.250 3.855 . 0 0 "[ . 1 . 2]" 1 974 1 28 ASN HB3 1 29 GLU HB2 . . 5.380 5.077 4.756 5.334 . 0 0 "[ . 1 . 2]" 1 975 1 28 ASN HB3 1 29 GLU QG . . 3.920 3.052 2.749 3.290 . 0 0 "[ . 1 . 2]" 1 976 1 28 ASN HD21 1 29 GLU QG . . 4.950 4.644 4.139 5.009 0.059 3 0 "[ . 1 . 2]" 1 977 1 29 GLU H 1 29 GLU HG2 . . 4.350 2.847 2.424 3.139 . 0 0 "[ . 1 . 2]" 1 978 1 29 GLU H 1 29 GLU QG . . 3.820 2.774 2.380 3.053 . 0 0 "[ . 1 . 2]" 1 979 1 29 GLU H 1 29 GLU HG3 . . 4.350 3.858 3.469 4.167 . 0 0 "[ . 1 . 2]" 1 980 1 29 GLU H 1 30 ILE H . . 3.340 2.649 2.319 2.915 . 0 0 "[ . 1 . 2]" 1 981 1 29 GLU H 1 30 ILE HA . . 4.830 4.519 4.140 4.722 . 0 0 "[ . 1 . 2]" 1 982 1 29 GLU H 1 30 ILE HB . . 5.390 4.277 4.002 4.526 . 0 0 "[ . 1 . 2]" 1 983 1 29 GLU H 1 30 ILE MG . . 4.850 4.417 4.120 4.760 . 0 0 "[ . 1 . 2]" 1 984 1 29 GLU HA 1 30 ILE HA . . 5.000 4.814 4.671 4.946 . 0 0 "[ . 1 . 2]" 1 985 1 29 GLU HA 1 31 ASN H . . 4.960 3.240 2.833 3.740 . 0 0 "[ . 1 . 2]" 1 986 1 29 GLU HA 1 32 ASN H . . 5.100 4.050 3.310 4.892 . 0 0 "[ . 1 . 2]" 1 987 1 29 GLU HA 1 32 ASN HB2 . . 4.550 3.576 2.950 3.905 . 0 0 "[ . 1 . 2]" 1 988 1 29 GLU HA 1 32 ASN HB3 . . 5.500 4.754 3.315 5.536 0.036 11 0 "[ . 1 . 2]" 1 989 1 29 GLU HB2 1 32 ASN HB2 . . 4.840 4.719 4.043 4.904 0.064 7 0 "[ . 1 . 2]" 1 990 1 29 GLU HB2 1 35 PHE HB2 . . 4.640 2.799 2.325 3.243 . 0 0 "[ . 1 . 2]" 1 991 1 29 GLU HB2 1 35 PHE HB3 . . 4.680 3.107 2.789 3.362 . 0 0 "[ . 1 . 2]" 1 992 1 29 GLU HB2 1 35 PHE QD . . 4.410 3.190 3.033 3.390 . 0 0 "[ . 1 . 2]" 1 993 1 29 GLU HB3 1 32 ASN HB2 . . 4.430 3.075 2.392 3.373 . 0 0 "[ . 1 . 2]" 1 994 1 29 GLU HB3 1 32 ASN HB3 . . 4.500 3.392 2.226 4.383 . 0 0 "[ . 1 . 2]" 1 995 1 29 GLU HB3 1 35 PHE HA . . 5.500 5.368 5.023 5.554 0.054 18 0 "[ . 1 . 2]" 1 996 1 29 GLU HB3 1 35 PHE HB2 . . 4.560 2.800 2.434 3.184 . 0 0 "[ . 1 . 2]" 1 997 1 29 GLU HB3 1 35 PHE HB3 . . 4.430 3.890 3.481 4.206 . 0 0 "[ . 1 . 2]" 1 998 1 29 GLU HB3 1 35 PHE QD . . 4.440 2.557 2.228 3.046 . 0 0 "[ . 1 . 2]" 1 999 1 29 GLU QG 1 32 ASN HB2 . . 5.340 4.779 4.312 5.328 . 0 0 "[ . 1 . 2]" 1 1000 1 29 GLU QG 1 35 PHE HB2 . . 5.340 4.191 3.678 4.638 . 0 0 "[ . 1 . 2]" 1 1001 1 29 GLU HG2 1 35 PHE QD . . 4.860 4.529 4.339 4.751 . 0 0 "[ . 1 . 2]" 1 1002 1 29 GLU HG2 1 35 PHE QE . . 4.940 4.448 4.226 4.668 . 0 0 "[ . 1 . 2]" 1 1003 1 29 GLU HG3 1 35 PHE QD . . 4.860 3.368 3.044 3.646 . 0 0 "[ . 1 . 2]" 1 1004 1 29 GLU HG3 1 35 PHE QE . . 4.940 3.086 2.815 3.267 . 0 0 "[ . 1 . 2]" 1 1005 1 30 ILE H 1 30 ILE HB . . 3.120 2.292 2.118 2.492 . 0 0 "[ . 1 . 2]" 1 1006 1 30 ILE H 1 30 ILE MD . . 4.220 3.922 3.697 4.106 . 0 0 "[ . 1 . 2]" 1 1007 1 30 ILE H 1 30 ILE HG12 . . 4.740 4.526 4.471 4.600 . 0 0 "[ . 1 . 2]" 1 1008 1 30 ILE H 1 30 ILE HG13 . . 4.580 4.537 4.469 4.598 0.018 12 0 "[ . 1 . 2]" 1 1009 1 30 ILE H 1 30 ILE MG . . 2.740 2.197 2.008 2.352 . 0 0 "[ . 1 . 2]" 1 1010 1 30 ILE H 1 31 ASN H . . 4.510 2.841 2.630 3.083 . 0 0 "[ . 1 . 2]" 1 1011 1 30 ILE H 1 32 ASN H . . 4.940 4.508 4.163 4.983 0.043 15 0 "[ . 1 . 2]" 1 1012 1 30 ILE HA 1 30 ILE MD . . 2.830 2.114 2.079 2.222 . 0 0 "[ . 1 . 2]" 1 1013 1 30 ILE HA 1 30 ILE HG12 . . 3.710 3.734 3.674 3.762 0.052 18 0 "[ . 1 . 2]" 1 1014 1 30 ILE HA 1 30 ILE HG13 . . 3.430 3.051 2.721 3.239 . 0 0 "[ . 1 . 2]" 1 1015 1 30 ILE HA 1 32 ASN H . . 4.410 3.752 3.521 4.153 . 0 0 "[ . 1 . 2]" 1 1016 1 30 ILE HB 1 30 ILE MD . . 3.130 2.376 2.259 2.439 . 0 0 "[ . 1 . 2]" 1 1017 1 30 ILE MD 1 32 ASN H . . 5.500 5.080 4.668 5.479 . 0 0 "[ . 1 . 2]" 1 1018 1 30 ILE HG12 1 30 ILE MG . . 3.080 2.333 2.276 2.416 . 0 0 "[ . 1 . 2]" 1 1019 1 30 ILE HG12 1 31 ASN H . . 5.470 5.401 5.058 5.539 0.069 9 0 "[ . 1 . 2]" 1 1020 1 30 ILE HG13 1 30 ILE MG . . 2.900 2.489 2.361 2.749 . 0 0 "[ . 1 . 2]" 1 1021 1 30 ILE HG13 1 31 ASN H . . 5.270 4.536 4.114 4.762 . 0 0 "[ . 1 . 2]" 1 1022 1 30 ILE HG13 1 31 ASN QD . . 4.940 4.653 3.677 4.997 0.057 13 0 "[ . 1 . 2]" 1 1023 1 30 ILE MG 1 31 ASN H . . 3.640 2.667 2.339 2.953 . 0 0 "[ . 1 . 2]" 1 1024 1 30 ILE MG 1 31 ASN QB . . 4.250 3.608 2.867 3.853 . 0 0 "[ . 1 . 2]" 1 1025 1 30 ILE MG 1 31 ASN HD21 . . 4.100 3.676 2.628 4.170 0.070 17 0 "[ . 1 . 2]" 1 1026 1 30 ILE MG 1 31 ASN QD . . 3.320 2.991 2.216 3.411 0.091 19 0 "[ . 1 . 2]" 1 1027 1 30 ILE MG 1 31 ASN HD22 . . 4.100 3.229 2.388 4.188 0.088 16 0 "[ . 1 . 2]" 1 1028 1 30 ILE MG 1 32 ASN H . . 4.910 4.601 4.299 4.874 . 0 0 "[ . 1 . 2]" 1 1029 1 32 ASN H 1 32 ASN HB2 . . 3.880 2.655 2.333 3.116 . 0 0 "[ . 1 . 2]" 1 1030 1 32 ASN H 1 32 ASN HB3 . . 3.740 3.274 2.480 3.720 . 0 0 "[ . 1 . 2]" 1 1031 1 32 ASN H 1 33 PRO HD2 . . 5.140 4.841 4.730 4.965 . 0 0 "[ . 1 . 2]" 1 1032 1 32 ASN H 1 33 PRO QD . . 4.480 4.218 3.979 4.403 . 0 0 "[ . 1 . 2]" 1 1033 1 32 ASN H 1 33 PRO HD3 . . 5.140 4.650 4.280 4.933 . 0 0 "[ . 1 . 2]" 1 1034 1 32 ASN HA 1 33 PRO HA . . 4.630 4.401 4.335 4.495 . 0 0 "[ . 1 . 2]" 1 1035 1 32 ASN HA 1 33 PRO HB2 . . 5.500 5.559 5.542 5.568 0.068 3 0 "[ . 1 . 2]" 1 1036 1 32 ASN HA 1 33 PRO HB3 . . 4.920 4.847 4.504 4.977 0.057 1 0 "[ . 1 . 2]" 1 1037 1 32 ASN HA 1 33 PRO HD2 . . 2.930 2.187 2.027 2.709 . 0 0 "[ . 1 . 2]" 1 1038 1 32 ASN HA 1 33 PRO HD3 . . 2.930 2.320 2.148 2.495 . 0 0 "[ . 1 . 2]" 1 1039 1 32 ASN HA 1 33 PRO HG2 . . 4.940 4.346 4.175 4.689 . 0 0 "[ . 1 . 2]" 1 1040 1 32 ASN HA 1 33 PRO HG3 . . 4.320 4.388 4.370 4.398 0.078 4 0 "[ . 1 . 2]" 1 1041 1 32 ASN HA 1 34 LYS H . . 4.290 3.882 3.689 4.272 . 0 0 "[ . 1 . 2]" 1 1042 1 32 ASN HB2 1 34 LYS H . . 5.130 4.429 3.949 4.844 . 0 0 "[ . 1 . 2]" 1 1043 1 32 ASN HB2 1 35 PHE H . . 5.080 4.589 3.560 5.141 0.061 4 0 "[ . 1 . 2]" 1 1044 1 32 ASN HB2 1 35 PHE QD . . 4.350 3.551 2.526 4.379 0.029 1 0 "[ . 1 . 2]" 1 1045 1 32 ASN HB3 1 33 PRO HD2 . . 4.640 3.454 2.436 4.279 . 0 0 "[ . 1 . 2]" 1 1046 1 32 ASN HB3 1 33 PRO HD3 . . 4.640 4.474 3.604 4.727 0.087 2 0 "[ . 1 . 2]" 1 1047 1 32 ASN HB3 1 34 LYS H . . 5.170 2.930 2.508 3.618 . 0 0 "[ . 1 . 2]" 1 1048 1 32 ASN HB3 1 35 PHE H . . 5.500 3.404 2.917 3.743 . 0 0 "[ . 1 . 2]" 1 1049 1 32 ASN HB3 1 35 PHE HB2 . . 4.960 4.024 3.126 4.984 0.024 19 0 "[ . 1 . 2]" 1 1050 1 32 ASN HB3 1 35 PHE QD . . 4.670 2.701 2.136 3.536 . 0 0 "[ . 1 . 2]" 1 1051 1 32 ASN HB3 1 35 PHE QE . . 4.870 4.160 3.594 4.930 0.060 1 0 "[ . 1 . 2]" 1 1052 1 32 ASN HD21 1 34 LYS HB3 . . 4.800 4.591 3.631 4.872 0.072 15 0 "[ . 1 . 2]" 1 1053 1 32 ASN HD21 1 35 PHE QD . . 4.640 3.782 2.937 4.592 . 0 0 "[ . 1 . 2]" 1 1054 1 32 ASN HD21 1 35 PHE QE . . 4.600 3.788 2.858 4.662 0.062 19 0 "[ . 1 . 2]" 1 1055 1 33 PRO HA 1 33 PRO HD2 . . 4.190 4.053 4.029 4.083 . 0 0 "[ . 1 . 2]" 1 1056 1 33 PRO HA 1 33 PRO HD3 . . 4.190 3.484 3.296 3.730 . 0 0 "[ . 1 . 2]" 1 1057 1 33 PRO HA 1 34 LYS HA . . 4.970 4.899 4.814 4.987 0.017 10 0 "[ . 1 . 2]" 1 1058 1 33 PRO HA 1 35 PHE H . . 4.090 3.704 3.341 4.151 0.061 19 0 "[ . 1 . 2]" 1 1059 1 33 PRO HA 1 36 ASN H . . 3.860 3.022 2.716 3.209 . 0 0 "[ . 1 . 2]" 1 1060 1 33 PRO HA 1 36 ASN HB2 . . 4.630 3.415 2.614 4.035 . 0 0 "[ . 1 . 2]" 1 1061 1 33 PRO HA 1 36 ASN QB . . 3.980 2.570 2.051 3.332 . 0 0 "[ . 1 . 2]" 1 1062 1 33 PRO HA 1 36 ASN HB3 . . 4.630 3.229 2.062 4.584 . 0 0 "[ . 1 . 2]" 1 1063 1 33 PRO HA 1 36 ASN HD21 . . 3.990 3.130 2.266 4.038 0.048 13 0 "[ . 1 . 2]" 1 1064 1 33 PRO HA 1 36 ASN QD . . 3.340 2.836 2.243 3.307 . 0 0 "[ . 1 . 2]" 1 1065 1 33 PRO HA 1 36 ASN HD22 . . 3.990 3.437 2.782 4.046 0.056 15 0 "[ . 1 . 2]" 1 1066 1 33 PRO HB2 1 33 PRO HD2 . . 4.060 4.077 3.992 4.112 0.052 14 0 "[ . 1 . 2]" 1 1067 1 33 PRO HB2 1 33 PRO QD . . 3.570 3.551 3.526 3.580 0.010 1 0 "[ . 1 . 2]" 1 1068 1 33 PRO HB2 1 33 PRO HD3 . . 4.060 3.910 3.837 4.039 . 0 0 "[ . 1 . 2]" 1 1069 1 33 PRO HB2 1 34 LYS H . . 4.100 3.673 3.357 3.939 . 0 0 "[ . 1 . 2]" 1 1070 1 33 PRO HB2 1 34 LYS HA . . 5.090 4.381 4.129 4.566 . 0 0 "[ . 1 . 2]" 1 1071 1 33 PRO HB2 1 36 ASN H . . 5.210 4.764 4.546 4.911 . 0 0 "[ . 1 . 2]" 1 1072 1 33 PRO HB2 1 36 ASN HD21 . . 4.780 4.102 3.205 4.830 0.050 14 0 "[ . 1 . 2]" 1 1073 1 33 PRO HB2 1 36 ASN QD . . 4.110 3.670 2.959 4.164 0.054 7 0 "[ . 1 . 2]" 1 1074 1 33 PRO HB2 1 36 ASN HD22 . . 4.780 4.226 3.266 4.843 0.063 7 0 "[ . 1 . 2]" 1 1075 1 33 PRO HB3 1 33 PRO HD2 . . 4.130 3.836 3.745 3.936 . 0 0 "[ . 1 . 2]" 1 1076 1 33 PRO HB3 1 33 PRO QD . . 3.410 2.819 2.665 3.030 . 0 0 "[ . 1 . 2]" 1 1077 1 33 PRO HB3 1 33 PRO HD3 . . 4.130 2.902 2.727 3.151 . 0 0 "[ . 1 . 2]" 1 1078 1 33 PRO HB3 1 34 LYS H . . 4.560 4.354 4.191 4.552 . 0 0 "[ . 1 . 2]" 1 1079 1 33 PRO HB3 1 36 ASN H . . 5.500 5.122 4.841 5.344 . 0 0 "[ . 1 . 2]" 1 1080 1 33 PRO HB3 1 36 ASN HD21 . . 4.640 3.541 2.530 4.420 . 0 0 "[ . 1 . 2]" 1 1081 1 33 PRO HB3 1 36 ASN QD . . 3.920 3.186 2.494 3.801 . 0 0 "[ . 1 . 2]" 1 1082 1 33 PRO HB3 1 36 ASN HD22 . . 4.640 3.748 3.153 4.551 . 0 0 "[ . 1 . 2]" 1 1083 1 33 PRO QD 1 34 LYS H . . 3.510 2.757 2.295 2.990 . 0 0 "[ . 1 . 2]" 1 1084 1 33 PRO HD2 1 34 LYS H . . 4.090 2.816 2.319 3.071 . 0 0 "[ . 1 . 2]" 1 1085 1 33 PRO HD3 1 34 LYS H . . 4.090 3.946 3.681 4.119 0.029 12 0 "[ . 1 . 2]" 1 1086 1 33 PRO HG2 1 34 LYS H . . 3.630 2.744 2.472 3.196 . 0 0 "[ . 1 . 2]" 1 1087 1 33 PRO HG2 1 34 LYS HG2 . . 4.920 3.947 2.873 4.991 0.071 13 0 "[ . 1 . 2]" 1 1088 1 33 PRO HG2 1 34 LYS QG . . 4.300 3.620 2.840 4.362 0.062 12 0 "[ . 1 . 2]" 1 1089 1 33 PRO HG2 1 34 LYS HG3 . . 4.920 4.683 3.860 4.986 0.066 18 0 "[ . 1 . 2]" 1 1090 1 34 LYS H 1 34 LYS HB2 . . 3.080 2.204 1.995 2.346 . 0 0 "[ . 1 . 2]" 1 1091 1 34 LYS H 1 34 LYS HB3 . . 3.740 3.497 3.318 3.588 . 0 0 "[ . 1 . 2]" 1 1092 1 34 LYS H 1 34 LYS QE . . 5.340 4.768 3.773 5.385 0.045 8 0 "[ . 1 . 2]" 1 1093 1 34 LYS H 1 34 LYS HG2 . . 3.910 3.047 2.481 3.856 . 0 0 "[ . 1 . 2]" 1 1094 1 34 LYS H 1 34 LYS QG . . 3.340 2.767 2.435 3.128 . 0 0 "[ . 1 . 2]" 1 1095 1 34 LYS H 1 34 LYS HG3 . . 3.910 3.463 2.820 3.859 . 0 0 "[ . 1 . 2]" 1 1096 1 34 LYS H 1 35 PHE QD . . 4.540 3.708 3.385 4.141 . 0 0 "[ . 1 . 2]" 1 1097 1 34 LYS H 1 36 ASN QB . . 5.340 5.147 4.908 5.315 . 0 0 "[ . 1 . 2]" 1 1098 1 34 LYS HA 1 34 LYS QD . . 3.800 2.783 2.076 3.846 0.046 7 0 "[ . 1 . 2]" 1 1099 1 34 LYS HA 1 34 LYS HE2 . . 5.500 4.496 2.317 5.301 . 0 0 "[ . 1 . 2]" 1 1100 1 34 LYS HA 1 34 LYS HE3 . . 5.500 4.585 3.747 5.092 . 0 0 "[ . 1 . 2]" 1 1101 1 34 LYS HA 1 34 LYS HG2 . . 3.680 2.433 2.080 2.805 . 0 0 "[ . 1 . 2]" 1 1102 1 34 LYS HA 1 34 LYS QG . . 3.220 2.388 2.044 2.728 . 0 0 "[ . 1 . 2]" 1 1103 1 34 LYS HA 1 34 LYS HG3 . . 3.680 3.513 2.948 3.742 0.062 6 0 "[ . 1 . 2]" 1 1104 1 34 LYS HA 1 35 PHE QD . . 5.230 4.545 4.254 4.871 . 0 0 "[ . 1 . 2]" 1 1105 1 34 LYS HA 1 36 ASN H . . 4.340 4.181 3.963 4.348 0.008 18 0 "[ . 1 . 2]" 1 1106 1 34 LYS HB2 1 34 LYS QE . . 4.550 3.882 2.059 4.558 0.008 8 0 "[ . 1 . 2]" 1 1107 1 34 LYS HB2 1 34 LYS QG . . 2.640 2.191 2.140 2.335 . 0 0 "[ . 1 . 2]" 1 1108 1 34 LYS HB2 1 35 PHE H . . 4.740 3.225 2.752 3.607 . 0 0 "[ . 1 . 2]" 1 1109 1 34 LYS HB2 1 35 PHE QD . . 4.120 2.576 2.300 2.954 . 0 0 "[ . 1 . 2]" 1 1110 1 34 LYS HB2 1 36 ASN H . . 5.500 5.179 4.859 5.365 . 0 0 "[ . 1 . 2]" 1 1111 1 34 LYS HB3 1 34 LYS HE2 . . 5.180 4.334 3.266 4.815 . 0 0 "[ . 1 . 2]" 1 1112 1 34 LYS HB3 1 34 LYS QE . . 4.410 3.588 2.007 4.186 . 0 0 "[ . 1 . 2]" 1 1113 1 34 LYS HB3 1 34 LYS HE3 . . 5.180 3.924 2.026 4.651 . 0 0 "[ . 1 . 2]" 1 1114 1 34 LYS HB3 1 35 PHE H . . 4.100 3.641 3.127 4.146 0.046 20 0 "[ . 1 . 2]" 1 1115 1 34 LYS HB3 1 35 PHE QD . . 4.370 2.981 2.653 3.568 . 0 0 "[ . 1 . 2]" 1 1116 1 34 LYS HB3 1 35 PHE QE . . 3.880 3.041 2.465 3.934 0.054 9 0 "[ . 1 . 2]" 1 1117 1 34 LYS QD 1 37 PHE QE . . 5.340 4.925 4.450 5.424 0.084 7 0 "[ . 1 . 2]" 1 1118 1 34 LYS HD2 1 35 PHE QE . . 5.500 4.445 3.890 5.565 0.065 6 0 "[ . 1 . 2]" 1 1119 1 34 LYS HD3 1 35 PHE QE . . 5.500 5.384 4.740 5.578 0.078 20 0 "[ . 1 . 2]" 1 1120 1 34 LYS QE 1 34 LYS QG . . 3.180 2.214 2.054 2.380 . 0 0 "[ . 1 . 2]" 1 1121 1 34 LYS QG 1 35 PHE QD . . 5.170 4.348 4.040 4.796 . 0 0 "[ . 1 . 2]" 1 1122 1 35 PHE H 1 35 PHE HB2 . . 4.010 2.470 2.242 2.821 . 0 0 "[ . 1 . 2]" 1 1123 1 35 PHE H 1 35 PHE HB3 . . 3.820 3.658 3.511 3.853 0.033 14 0 "[ . 1 . 2]" 1 1124 1 35 PHE H 1 35 PHE QD . . 4.020 2.541 2.184 2.887 . 0 0 "[ . 1 . 2]" 1 1125 1 35 PHE H 1 36 ASN H . . 3.240 2.256 1.851 2.554 . 0 0 "[ . 1 . 2]" 1 1126 1 35 PHE H 1 36 ASN QB . . 4.980 4.185 3.755 4.583 . 0 0 "[ . 1 . 2]" 1 1127 1 35 PHE HA 1 35 PHE QD . . 3.690 3.112 2.964 3.275 . 0 0 "[ . 1 . 2]" 1 1128 1 35 PHE HA 1 37 PHE H . . 4.800 3.463 3.366 3.560 . 0 0 "[ . 1 . 2]" 1 1129 1 35 PHE HA 1 37 PHE QD . . 3.400 3.285 2.721 3.476 0.076 14 0 "[ . 1 . 2]" 1 1130 1 35 PHE HA 1 37 PHE QE . . 3.950 2.624 2.318 2.882 . 0 0 "[ . 1 . 2]" 1 1131 1 35 PHE HA 1 38 LEU HB2 . . 4.620 4.682 4.661 4.692 0.072 19 0 "[ . 1 . 2]" 1 1132 1 35 PHE HA 1 38 LEU MD1 . . 4.710 3.745 3.576 3.922 . 0 0 "[ . 1 . 2]" 1 1133 1 35 PHE HA 1 38 LEU MD2 . . 5.130 5.053 4.713 5.203 0.073 19 0 "[ . 1 . 2]" 1 1134 1 35 PHE HB2 1 36 ASN H . . 4.780 3.699 3.502 3.911 . 0 0 "[ . 1 . 2]" 1 1135 1 35 PHE HB2 1 36 ASN QB . . 5.340 5.297 4.955 5.427 0.087 6 0 "[ . 1 . 2]" 1 1136 1 35 PHE HB2 1 37 PHE QE . . 5.500 5.366 4.997 5.581 0.081 20 0 "[ . 1 . 2]" 1 1137 1 35 PHE HB2 1 38 LEU HB2 . . 5.500 4.992 4.777 5.244 . 0 0 "[ . 1 . 2]" 1 1138 1 35 PHE HB2 1 38 LEU MD1 . . 4.340 3.929 3.570 4.202 . 0 0 "[ . 1 . 2]" 1 1139 1 35 PHE HB2 1 38 LEU HG . . 5.500 5.279 4.857 5.540 0.040 10 0 "[ . 1 . 2]" 1 1140 1 35 PHE HB3 1 36 ASN H . . 4.740 4.359 4.199 4.489 . 0 0 "[ . 1 . 2]" 1 1141 1 35 PHE HB3 1 37 PHE H . . 5.010 5.065 4.974 5.083 0.073 18 0 "[ . 1 . 2]" 1 1142 1 35 PHE HB3 1 37 PHE QE . . 5.250 4.637 4.202 4.888 . 0 0 "[ . 1 . 2]" 1 1143 1 35 PHE HB3 1 38 LEU H . . 4.450 4.309 3.998 4.497 0.047 20 0 "[ . 1 . 2]" 1 1144 1 35 PHE HB3 1 38 LEU HB2 . . 4.610 3.760 3.552 4.021 . 0 0 "[ . 1 . 2]" 1 1145 1 35 PHE HB3 1 38 LEU MD1 . . 3.530 2.434 2.220 2.654 . 0 0 "[ . 1 . 2]" 1 1146 1 35 PHE HB3 1 38 LEU MD2 . . 5.020 4.879 4.550 5.079 0.059 5 0 "[ . 1 . 2]" 1 1147 1 35 PHE HB3 1 38 LEU HG . . 4.960 3.701 3.348 3.961 . 0 0 "[ . 1 . 2]" 1 1148 1 35 PHE QD 1 36 ASN H . . 4.790 4.602 4.433 4.772 . 0 0 "[ . 1 . 2]" 1 1149 1 35 PHE QD 1 38 LEU MD1 . . 3.500 2.606 2.286 2.981 . 0 0 "[ . 1 . 2]" 1 1150 1 35 PHE QD 1 38 LEU MD2 . . 4.770 4.559 4.071 4.852 0.082 3 0 "[ . 1 . 2]" 1 1151 1 35 PHE QD 1 38 LEU HG . . 4.640 4.040 3.276 4.423 . 0 0 "[ . 1 . 2]" 1 1152 1 35 PHE QE 1 38 LEU MD1 . . 4.620 4.260 3.733 4.702 0.082 19 0 "[ . 1 . 2]" 1 1153 1 36 ASN H 1 36 ASN HB2 . . 3.660 2.939 2.048 3.645 . 0 0 "[ . 1 . 2]" 1 1154 1 36 ASN H 1 36 ASN QB . . 3.060 2.369 2.022 2.563 . 0 0 "[ . 1 . 2]" 1 1155 1 36 ASN H 1 36 ASN HB3 . . 3.660 3.026 2.497 3.587 . 0 0 "[ . 1 . 2]" 1 1156 1 36 ASN H 1 36 ASN HD21 . . 5.010 4.418 3.905 4.721 . 0 0 "[ . 1 . 2]" 1 1157 1 36 ASN H 1 36 ASN QD . . 4.220 4.056 3.725 4.292 0.072 16 0 "[ . 1 . 2]" 1 1158 1 36 ASN H 1 36 ASN HD22 . . 5.010 4.748 4.297 5.078 0.068 12 0 "[ . 1 . 2]" 1 1159 1 36 ASN H 1 37 PHE QD . . 4.860 4.139 3.848 4.372 . 0 0 "[ . 1 . 2]" 1 1160 1 36 ASN H 1 38 LEU H . . 5.500 4.465 4.362 4.578 . 0 0 "[ . 1 . 2]" 1 1161 1 36 ASN HA 1 38 LEU H . . 4.280 3.612 3.426 3.925 . 0 0 "[ . 1 . 2]" 1 1162 1 36 ASN HA 1 39 ASN H . . 4.080 3.571 3.205 3.798 . 0 0 "[ . 1 . 2]" 1 1163 1 36 ASN HA 1 39 ASN QB . . 4.690 3.568 3.028 3.878 . 0 0 "[ . 1 . 2]" 1 1164 1 36 ASN HA 1 39 ASN HD21 . . 4.580 2.653 1.969 3.136 . 0 0 "[ . 1 . 2]" 1 1165 1 36 ASN HA 1 39 ASN QD . . 3.730 2.587 1.931 3.088 . 0 0 "[ . 1 . 2]" 1 1166 1 36 ASN HA 1 39 ASN HD22 . . 4.580 3.785 2.554 4.646 0.066 12 0 "[ . 1 . 2]" 1 1167 1 36 ASN QB 1 36 ASN QD . . 3.040 2.221 2.076 2.304 . 0 0 "[ . 1 . 2]" 1 1168 1 36 ASN HB2 1 36 ASN HD22 . . 4.090 3.665 3.428 3.768 . 0 0 "[ . 1 . 2]" 1 1169 1 36 ASN HB3 1 36 ASN HD22 . . 4.090 3.621 3.383 3.932 . 0 0 "[ . 1 . 2]" 1 1170 1 37 PHE H 1 37 PHE HB3 . . 3.780 2.526 2.278 2.628 . 0 0 "[ . 1 . 2]" 1 1171 1 37 PHE H 1 37 PHE QD . . 4.580 2.600 2.456 2.771 . 0 0 "[ . 1 . 2]" 1 1172 1 37 PHE H 1 38 LEU H . . 4.880 2.782 2.651 2.939 . 0 0 "[ . 1 . 2]" 1 1173 1 37 PHE H 1 39 ASN H . . 5.440 4.314 4.150 4.406 . 0 0 "[ . 1 . 2]" 1 1174 1 37 PHE HA 1 39 ASN H . . 4.050 3.711 3.588 3.933 . 0 0 "[ . 1 . 2]" 1 1175 1 37 PHE HA 1 42 ASP HB2 . . 3.510 2.384 2.167 2.725 . 0 0 "[ . 1 . 2]" 1 1176 1 37 PHE HA 1 42 ASP HB3 . . 3.630 2.445 2.315 2.602 . 0 0 "[ . 1 . 2]" 1 1177 1 37 PHE HA 1 44 TYR H . . 4.700 4.519 4.181 4.754 0.054 14 0 "[ . 1 . 2]" 1 1178 1 37 PHE HA 1 44 TYR QD . . 5.500 5.311 4.930 5.566 0.066 20 0 "[ . 1 . 2]" 1 1179 1 37 PHE HA 1 45 HIS H . . 4.750 4.162 3.809 4.446 . 0 0 "[ . 1 . 2]" 1 1180 1 37 PHE HA 1 45 HIS HA . . 4.240 4.077 3.721 4.298 0.058 19 0 "[ . 1 . 2]" 1 1181 1 37 PHE HA 1 45 HIS HB2 . . 4.860 3.805 3.404 4.183 . 0 0 "[ . 1 . 2]" 1 1182 1 37 PHE HB2 1 45 HIS HA . . 4.340 3.729 3.354 4.123 . 0 0 "[ . 1 . 2]" 1 1183 1 37 PHE QD 1 38 LEU HA . . 4.200 3.220 3.033 3.412 . 0 0 "[ . 1 . 2]" 1 1184 1 37 PHE QD 1 38 LEU HB2 . . 5.480 4.861 4.725 5.028 . 0 0 "[ . 1 . 2]" 1 1185 1 37 PHE QD 1 38 LEU MD2 . . 3.200 2.863 2.707 3.072 . 0 0 "[ . 1 . 2]" 1 1186 1 37 PHE QE 1 38 LEU MD1 . . 5.170 3.630 3.366 3.960 . 0 0 "[ . 1 . 2]" 1 1187 1 37 PHE QE 1 38 LEU MD2 . . 3.880 2.366 2.191 2.723 . 0 0 "[ . 1 . 2]" 1 1188 1 37 PHE QE 1 38 LEU HG . . 5.160 2.891 2.630 3.285 . 0 0 "[ . 1 . 2]" 1 1189 1 37 PHE HZ 1 38 LEU MD1 . . 5.200 3.855 3.361 4.495 . 0 0 "[ . 1 . 2]" 1 1190 1 37 PHE HZ 1 38 LEU HG . . 5.500 3.733 3.353 4.246 . 0 0 "[ . 1 . 2]" 1 1191 1 38 LEU H 1 38 LEU HB2 . . 3.850 2.317 2.236 2.386 . 0 0 "[ . 1 . 2]" 1 1192 1 38 LEU H 1 38 LEU HB3 . . 3.970 3.563 3.515 3.600 . 0 0 "[ . 1 . 2]" 1 1193 1 38 LEU H 1 38 LEU MD1 . . 3.980 3.647 3.519 3.734 . 0 0 "[ . 1 . 2]" 1 1194 1 38 LEU H 1 38 LEU MD2 . . 4.670 3.655 3.563 3.746 . 0 0 "[ . 1 . 2]" 1 1195 1 38 LEU H 1 38 LEU HG . . 3.910 2.551 2.468 2.665 . 0 0 "[ . 1 . 2]" 1 1196 1 38 LEU H 1 39 ASN H . . 3.430 2.530 2.435 2.715 . 0 0 "[ . 1 . 2]" 1 1197 1 38 LEU HA 1 38 LEU MD1 . . 3.880 3.859 3.812 3.912 0.032 14 0 "[ . 1 . 2]" 1 1198 1 38 LEU HA 1 38 LEU MD2 . . 2.820 2.069 2.040 2.124 . 0 0 "[ . 1 . 2]" 1 1199 1 38 LEU HA 1 38 LEU HG . . 3.940 2.989 2.888 3.109 . 0 0 "[ . 1 . 2]" 1 1200 1 38 LEU HA 1 45 HIS HE1 . . 4.080 3.794 3.264 4.135 0.055 19 0 "[ . 1 . 2]" 1 1201 1 38 LEU HB2 1 38 LEU MD1 . . 3.230 2.302 2.269 2.344 . 0 0 "[ . 1 . 2]" 1 1202 1 38 LEU HB2 1 39 ASN H . . 4.150 3.206 3.041 3.283 . 0 0 "[ . 1 . 2]" 1 1203 1 38 LEU HB3 1 38 LEU MD1 . . 3.470 2.410 2.330 2.472 . 0 0 "[ . 1 . 2]" 1 1204 1 38 LEU HB3 1 38 LEU MD2 . . 3.270 2.338 2.277 2.398 . 0 0 "[ . 1 . 2]" 1 1205 1 38 LEU HB3 1 39 ASN H . . 4.550 3.981 3.859 4.068 . 0 0 "[ . 1 . 2]" 1 1206 1 38 LEU HB3 1 45 HIS HE1 . . 5.130 4.902 4.438 5.126 . 0 0 "[ . 1 . 2]" 1 1207 1 38 LEU MD1 1 39 ASN H . . 4.940 4.997 4.908 5.029 0.089 3 0 "[ . 1 . 2]" 1 1208 1 38 LEU MD2 1 39 ASN H . . 4.750 4.824 4.809 4.834 0.084 12 0 "[ . 1 . 2]" 1 1209 1 38 LEU MD2 1 45 HIS HE1 . . 4.710 4.663 4.269 4.786 0.076 11 0 "[ . 1 . 2]" 1 1210 1 38 LEU MD2 1 48 TYR QD . . 4.300 3.390 3.161 3.509 . 0 0 "[ . 1 . 2]" 1 1211 1 38 LEU MD2 1 48 TYR QE . . 3.990 2.757 2.588 2.937 . 0 0 "[ . 1 . 2]" 1 1212 1 38 LEU MD2 1 48 TYR HH . . 3.780 2.888 2.604 3.116 . 0 0 "[ . 1 . 2]" 1 1213 1 38 LEU HG 1 39 ASN H . . 4.800 4.702 4.616 4.764 . 0 0 "[ . 1 . 2]" 1 1214 1 39 ASN H 1 39 ASN HB2 . . 3.680 2.410 2.227 2.612 . 0 0 "[ . 1 . 2]" 1 1215 1 39 ASN H 1 39 ASN QB . . 2.950 2.375 2.202 2.563 . 0 0 "[ . 1 . 2]" 1 1216 1 39 ASN H 1 39 ASN HB3 . . 3.680 3.613 3.465 3.724 0.044 8 0 "[ . 1 . 2]" 1 1217 1 39 ASN H 1 39 ASN HD21 . . 4.400 2.965 1.994 3.539 . 0 0 "[ . 1 . 2]" 1 1218 1 39 ASN H 1 39 ASN QD . . 3.790 2.899 1.985 3.404 . 0 0 "[ . 1 . 2]" 1 1219 1 39 ASN H 1 39 ASN HD22 . . 4.400 4.208 3.592 4.475 0.075 7 0 "[ . 1 . 2]" 1 1220 1 39 ASN H 1 40 PRO HD2 . . 5.350 4.852 4.786 4.912 . 0 0 "[ . 1 . 2]" 1 1221 1 39 ASN H 1 40 PRO QD . . 4.660 4.418 4.353 4.467 . 0 0 "[ . 1 . 2]" 1 1222 1 39 ASN H 1 40 PRO HD3 . . 5.350 5.086 5.001 5.191 . 0 0 "[ . 1 . 2]" 1 1223 1 39 ASN HA 1 39 ASN HD21 . . 4.850 3.940 2.968 4.427 . 0 0 "[ . 1 . 2]" 1 1224 1 39 ASN HA 1 39 ASN HD22 . . 4.850 4.330 3.933 4.749 . 0 0 "[ . 1 . 2]" 1 1225 1 39 ASN HA 1 40 PRO HA . . 4.880 4.415 4.360 4.500 . 0 0 "[ . 1 . 2]" 1 1226 1 39 ASN HA 1 40 PRO HB3 . . 4.930 4.886 4.741 4.987 0.057 17 0 "[ . 1 . 2]" 1 1227 1 39 ASN HA 1 40 PRO HD2 . . 3.020 2.352 2.212 2.506 . 0 0 "[ . 1 . 2]" 1 1228 1 39 ASN HA 1 40 PRO HD3 . . 3.020 2.395 2.303 2.551 . 0 0 "[ . 1 . 2]" 1 1229 1 39 ASN HA 1 40 PRO HG2 . . 4.750 4.514 4.416 4.630 . 0 0 "[ . 1 . 2]" 1 1230 1 39 ASN HA 1 40 PRO HG3 . . 4.520 4.560 4.501 4.589 0.069 15 0 "[ . 1 . 2]" 1 1231 1 39 ASN HA 1 41 ASN H . . 4.600 4.034 3.845 4.269 . 0 0 "[ . 1 . 2]" 1 1232 1 39 ASN QB 1 39 ASN QD . . 3.020 2.268 2.117 2.819 . 0 0 "[ . 1 . 2]" 1 1233 1 39 ASN QB 1 40 PRO QD . . 3.400 2.241 2.150 2.342 . 0 0 "[ . 1 . 2]" 1 1234 1 39 ASN QB 1 41 ASN H . . 3.920 2.404 2.182 2.805 . 0 0 "[ . 1 . 2]" 1 1235 1 39 ASN HB2 1 40 PRO HD2 . . 4.760 3.782 3.678 3.858 . 0 0 "[ . 1 . 2]" 1 1236 1 39 ASN HB2 1 40 PRO HD3 . . 4.760 4.821 4.809 4.830 0.070 18 0 "[ . 1 . 2]" 1 1237 1 39 ASN HB3 1 40 PRO HD2 . . 4.760 2.282 2.182 2.393 . 0 0 "[ . 1 . 2]" 1 1238 1 39 ASN HB3 1 40 PRO HD3 . . 4.760 3.707 3.605 3.784 . 0 0 "[ . 1 . 2]" 1 1239 1 40 PRO HA 1 41 ASN H . . 3.500 3.441 3.348 3.480 . 0 0 "[ . 1 . 2]" 1 1240 1 40 PRO HA 1 41 ASN HA . . 5.400 4.825 4.725 4.900 . 0 0 "[ . 1 . 2]" 1 1241 1 40 PRO HA 1 42 ASP H . . 4.210 3.588 3.396 3.889 . 0 0 "[ . 1 . 2]" 1 1242 1 40 PRO HA 1 45 HIS HB2 . . 4.530 3.167 2.887 3.378 . 0 0 "[ . 1 . 2]" 1 1243 1 40 PRO HA 1 45 HIS HB3 . . 4.010 3.105 2.870 3.334 . 0 0 "[ . 1 . 2]" 1 1244 1 40 PRO HA 1 45 HIS HD2 . . 3.480 3.083 2.767 3.531 0.051 19 0 "[ . 1 . 2]" 1 1245 1 40 PRO HA 1 45 HIS HE1 . . 4.440 4.270 3.948 4.488 0.048 12 0 "[ . 1 . 2]" 1 1246 1 40 PRO HB2 1 41 ASN H . . 3.780 3.747 3.547 3.836 0.056 12 0 "[ . 1 . 2]" 1 1247 1 40 PRO HB2 1 41 ASN HA . . 4.310 4.291 4.149 4.358 0.048 9 0 "[ . 1 . 2]" 1 1248 1 40 PRO HB2 1 41 ASN HD21 . . 5.500 5.014 3.638 5.570 0.070 7 0 "[ . 1 . 2]" 1 1249 1 40 PRO HB2 1 41 ASN QD . . 4.830 4.506 3.545 4.897 0.067 11 0 "[ . 1 . 2]" 1 1250 1 40 PRO HB2 1 41 ASN HD22 . . 5.500 5.210 4.662 5.566 0.066 17 0 "[ . 1 . 2]" 1 1251 1 40 PRO HB2 1 45 HIS HD2 . . 5.500 4.848 4.237 5.359 . 0 0 "[ . 1 . 2]" 1 1252 1 40 PRO HB3 1 41 ASN H . . 4.410 4.397 4.279 4.468 0.058 6 0 "[ . 1 . 2]" 1 1253 1 40 PRO HB3 1 45 HIS HD2 . . 4.200 3.880 3.331 4.252 0.052 5 0 "[ . 1 . 2]" 1 1254 1 40 PRO HB3 1 45 HIS HE1 . . 4.920 4.689 4.307 4.945 0.025 20 0 "[ . 1 . 2]" 1 1255 1 40 PRO QD 1 41 ASN H . . 3.720 2.875 2.624 3.075 . 0 0 "[ . 1 . 2]" 1 1256 1 40 PRO QD 1 42 ASP H . . 5.350 4.814 4.678 4.945 . 0 0 "[ . 1 . 2]" 1 1257 1 40 PRO HD2 1 41 ASN H . . 4.340 2.947 2.673 3.173 . 0 0 "[ . 1 . 2]" 1 1258 1 40 PRO HD3 1 41 ASN H . . 4.340 4.007 3.813 4.125 . 0 0 "[ . 1 . 2]" 1 1259 1 40 PRO HG2 1 41 ASN H . . 4.000 2.847 2.534 3.080 . 0 0 "[ . 1 . 2]" 1 1260 1 40 PRO HG2 1 41 ASN HA . . 5.160 4.314 3.983 4.805 . 0 0 "[ . 1 . 2]" 1 1261 1 40 PRO HG2 1 41 ASN HD21 . . 5.080 3.518 2.915 3.746 . 0 0 "[ . 1 . 2]" 1 1262 1 40 PRO HG2 1 41 ASN QD . . 4.450 3.010 2.672 3.206 . 0 0 "[ . 1 . 2]" 1 1263 1 40 PRO HG2 1 41 ASN HD22 . . 5.080 3.343 2.769 3.751 . 0 0 "[ . 1 . 2]" 1 1264 1 40 PRO HG3 1 41 ASN H . . 4.390 4.316 4.024 4.444 0.054 1 0 "[ . 1 . 2]" 1 1265 1 40 PRO HG3 1 41 ASN HD21 . . 5.130 5.094 4.661 5.201 0.071 15 0 "[ . 1 . 2]" 1 1266 1 40 PRO HG3 1 41 ASN QD . . 4.510 4.375 4.005 4.583 0.073 20 0 "[ . 1 . 2]" 1 1267 1 40 PRO HG3 1 41 ASN HD22 . . 5.130 4.815 4.168 5.186 0.056 6 0 "[ . 1 . 2]" 1 1268 1 41 ASN H 1 41 ASN HB2 . . 3.670 2.580 2.282 3.560 . 0 0 "[ . 1 . 2]" 1 1269 1 41 ASN H 1 41 ASN QB . . 3.020 2.495 2.256 2.811 . 0 0 "[ . 1 . 2]" 1 1270 1 41 ASN H 1 41 ASN HB3 . . 3.670 3.556 2.944 3.665 . 0 0 "[ . 1 . 2]" 1 1271 1 41 ASN H 1 41 ASN HD21 . . 4.370 2.842 2.405 3.660 . 0 0 "[ . 1 . 2]" 1 1272 1 41 ASN H 1 41 ASN QD . . 3.790 2.731 2.347 3.435 . 0 0 "[ . 1 . 2]" 1 1273 1 41 ASN H 1 41 ASN HD22 . . 4.370 3.633 2.880 4.162 . 0 0 "[ . 1 . 2]" 1 1274 1 41 ASN H 1 42 ASP H . . 3.260 2.706 2.537 2.830 . 0 0 "[ . 1 . 2]" 1 1275 1 41 ASN HA 1 41 ASN QB . . 2.640 2.349 2.187 2.449 . 0 0 "[ . 1 . 2]" 1 1276 1 41 ASN HA 1 41 ASN QD . . 4.250 3.263 1.986 4.007 . 0 0 "[ . 1 . 2]" 1 1277 1 41 ASN HA 1 41 ASN HD22 . . 5.010 4.258 3.577 5.032 0.022 17 0 "[ . 1 . 2]" 1 1278 1 41 ASN QB 1 41 ASN QD . . 3.050 2.399 2.155 2.874 . 0 0 "[ . 1 . 2]" 1 1279 1 41 ASN QB 1 42 ASP H . . 4.090 3.354 3.065 3.976 . 0 0 "[ . 1 . 2]" 1 1280 1 42 ASP H 1 42 ASP HB2 . . 3.160 2.268 2.131 2.415 . 0 0 "[ . 1 . 2]" 1 1281 1 42 ASP H 1 42 ASP HB3 . . 3.500 3.268 2.741 3.504 0.004 10 0 "[ . 1 . 2]" 1 1282 1 42 ASP H 1 43 PRO HD2 . . 5.340 4.925 4.858 4.984 . 0 0 "[ . 1 . 2]" 1 1283 1 42 ASP H 1 43 PRO HD3 . . 5.500 4.944 4.881 5.079 . 0 0 "[ . 1 . 2]" 1 1284 1 42 ASP H 1 44 TYR H . . 5.500 5.363 4.947 5.550 0.050 14 0 "[ . 1 . 2]" 1 1285 1 42 ASP H 1 45 HIS HB2 . . 3.910 3.116 2.742 3.433 . 0 0 "[ . 1 . 2]" 1 1286 1 42 ASP H 1 45 HIS HB3 . . 4.390 4.015 3.664 4.328 . 0 0 "[ . 1 . 2]" 1 1287 1 42 ASP HA 1 43 PRO HD3 . . 2.810 2.207 2.141 2.408 . 0 0 "[ . 1 . 2]" 1 1288 1 42 ASP HA 1 43 PRO HG3 . . 4.300 4.371 4.367 4.380 0.080 17 0 "[ . 1 . 2]" 1 1289 1 42 ASP HA 1 44 TYR H . . 4.880 4.116 3.857 4.303 . 0 0 "[ . 1 . 2]" 1 1290 1 42 ASP HB2 1 43 PRO HD2 . . 4.340 4.043 3.917 4.150 . 0 0 "[ . 1 . 2]" 1 1291 1 42 ASP HB2 1 43 PRO HD3 . . 5.440 4.826 4.709 4.961 . 0 0 "[ . 1 . 2]" 1 1292 1 42 ASP HB2 1 44 TYR H . . 4.670 4.418 4.194 4.716 0.046 4 0 "[ . 1 . 2]" 1 1293 1 42 ASP HB2 1 45 HIS H . . 4.260 3.939 3.637 4.142 . 0 0 "[ . 1 . 2]" 1 1294 1 42 ASP HB2 1 45 HIS HB2 . . 4.310 3.209 2.858 3.415 . 0 0 "[ . 1 . 2]" 1 1295 1 42 ASP HB2 1 45 HIS HB3 . . 4.790 4.687 4.309 4.855 0.065 2 0 "[ . 1 . 2]" 1 1296 1 42 ASP HB3 1 43 PRO HD2 . . 4.240 2.877 2.446 3.662 . 0 0 "[ . 1 . 2]" 1 1297 1 42 ASP HB3 1 43 PRO HG2 . . 4.890 4.617 4.288 4.960 0.070 20 0 "[ . 1 . 2]" 1 1298 1 42 ASP HB3 1 44 TYR H . . 3.920 2.769 2.496 3.011 . 0 0 "[ . 1 . 2]" 1 1299 1 42 ASP HB3 1 45 HIS H . . 3.850 2.854 2.209 3.168 . 0 0 "[ . 1 . 2]" 1 1300 1 42 ASP HB3 1 45 HIS HA . . 4.940 4.358 3.522 4.917 . 0 0 "[ . 1 . 2]" 1 1301 1 42 ASP HB3 1 45 HIS HB2 . . 4.560 3.258 2.197 3.715 . 0 0 "[ . 1 . 2]" 1 1302 1 42 ASP HB3 1 45 HIS HB3 . . 4.680 4.449 3.619 4.748 0.068 18 0 "[ . 1 . 2]" 1 1303 1 43 PRO HA 1 43 PRO HB3 . . 2.810 2.282 2.259 2.306 . 0 0 "[ . 1 . 2]" 1 1304 1 43 PRO HA 1 43 PRO HD3 . . 3.840 3.606 3.448 3.686 . 0 0 "[ . 1 . 2]" 1 1305 1 43 PRO HA 1 45 HIS H . . 4.310 3.845 3.623 4.140 . 0 0 "[ . 1 . 2]" 1 1306 1 43 PRO HA 1 46 ALA H . . 5.270 4.718 4.165 5.335 0.065 12 0 "[ . 1 . 2]" 1 1307 1 43 PRO HB2 1 43 PRO HD2 . . 3.940 3.986 3.928 4.006 0.066 20 0 "[ . 1 . 2]" 1 1308 1 43 PRO HB2 1 44 TYR H . . 3.990 3.438 3.182 3.637 . 0 0 "[ . 1 . 2]" 1 1309 1 43 PRO HB2 1 44 TYR QD . . 4.320 3.852 3.732 3.973 . 0 0 "[ . 1 . 2]" 1 1310 1 43 PRO HB2 1 44 TYR QE . . 4.840 4.376 4.134 4.559 . 0 0 "[ . 1 . 2]" 1 1311 1 43 PRO HB2 1 45 HIS H . . 5.300 5.143 4.943 5.358 0.058 15 0 "[ . 1 . 2]" 1 1312 1 43 PRO HB3 1 43 PRO HD3 . . 3.530 3.087 2.862 3.194 . 0 0 "[ . 1 . 2]" 1 1313 1 43 PRO HB3 1 44 TYR H . . 4.380 4.218 4.063 4.358 . 0 0 "[ . 1 . 2]" 1 1314 1 43 PRO HB3 1 44 TYR QD . . 4.840 4.910 4.866 4.924 0.084 17 0 "[ . 1 . 2]" 1 1315 1 43 PRO HB3 1 44 TYR QE . . 5.500 5.518 5.282 5.580 0.080 6 0 "[ . 1 . 2]" 1 1316 1 43 PRO HD2 1 43 PRO HG2 . . 2.850 2.270 2.185 2.297 . 0 0 "[ . 1 . 2]" 1 1317 1 43 PRO HD2 1 44 TYR H . . 3.980 2.568 2.423 2.842 . 0 0 "[ . 1 . 2]" 1 1318 1 43 PRO HD2 1 44 TYR QD . . 5.110 2.986 2.676 3.432 . 0 0 "[ . 1 . 2]" 1 1319 1 43 PRO HD2 1 44 TYR QE . . 4.930 4.632 4.297 5.005 0.075 17 0 "[ . 1 . 2]" 1 1320 1 43 PRO HD2 1 45 HIS H . . 4.390 4.446 4.429 4.462 0.072 17 0 "[ . 1 . 2]" 1 1321 1 43 PRO HD3 1 43 PRO HG3 . . 3.070 2.256 2.231 2.279 . 0 0 "[ . 1 . 2]" 1 1322 1 43 PRO HG2 1 44 TYR H . . 3.920 2.681 2.494 3.130 . 0 0 "[ . 1 . 2]" 1 1323 1 43 PRO HG2 1 44 TYR HB3 . . 5.500 5.441 5.252 5.555 0.055 7 0 "[ . 1 . 2]" 1 1324 1 43 PRO HG2 1 44 TYR QD . . 4.170 2.175 2.114 2.278 . 0 0 "[ . 1 . 2]" 1 1325 1 43 PRO HG2 1 44 TYR QE . . 3.910 2.984 2.740 3.223 . 0 0 "[ . 1 . 2]" 1 1326 1 44 TYR H 1 44 TYR HB2 . . 3.570 2.347 2.261 2.456 . 0 0 "[ . 1 . 2]" 1 1327 1 44 TYR H 1 44 TYR HB3 . . 3.740 3.570 3.499 3.627 . 0 0 "[ . 1 . 2]" 1 1328 1 44 TYR H 1 44 TYR QD . . 3.990 2.332 2.057 2.724 . 0 0 "[ . 1 . 2]" 1 1329 1 44 TYR H 1 45 HIS H . . 3.150 2.596 2.361 2.746 . 0 0 "[ . 1 . 2]" 1 1330 1 44 TYR H 1 45 HIS HA . . 5.110 4.947 4.608 5.159 0.049 16 0 "[ . 1 . 2]" 1 1331 1 44 TYR H 1 45 HIS HB2 . . 4.700 4.644 4.409 4.765 0.065 4 0 "[ . 1 . 2]" 1 1332 1 44 TYR H 1 45 HIS HB3 . . 4.950 5.003 4.962 5.022 0.072 14 0 "[ . 1 . 2]" 1 1333 1 44 TYR H 1 46 ALA H . . 5.120 5.035 4.882 5.164 0.044 8 0 "[ . 1 . 2]" 1 1334 1 44 TYR HA 1 44 TYR QD . . 3.610 2.916 2.666 3.113 . 0 0 "[ . 1 . 2]" 1 1335 1 44 TYR HA 1 46 ALA H . . 4.930 4.198 3.977 4.365 . 0 0 "[ . 1 . 2]" 1 1336 1 44 TYR HA 1 46 ALA MB . . 4.610 4.526 4.224 4.691 0.081 20 0 "[ . 1 . 2]" 1 1337 1 44 TYR HA 1 47 TYR H . . 4.120 3.244 2.999 3.351 . 0 0 "[ . 1 . 2]" 1 1338 1 44 TYR HA 1 47 TYR HB2 . . 4.690 3.859 3.333 4.215 . 0 0 "[ . 1 . 2]" 1 1339 1 44 TYR HA 1 47 TYR HB3 . . 4.610 2.843 2.566 3.108 . 0 0 "[ . 1 . 2]" 1 1340 1 44 TYR HB2 1 45 HIS H . . 4.740 3.522 3.408 3.685 . 0 0 "[ . 1 . 2]" 1 1341 1 44 TYR HB2 1 47 TYR H . . 5.500 5.458 5.021 5.567 0.067 7 0 "[ . 1 . 2]" 1 1342 1 44 TYR HB2 1 47 TYR QD . . 5.020 4.774 4.172 5.085 0.065 19 0 "[ . 1 . 2]" 1 1343 1 44 TYR HB2 1 48 TYR H . . 5.500 5.141 4.783 5.326 . 0 0 "[ . 1 . 2]" 1 1344 1 44 TYR HB3 1 45 HIS H . . 4.210 4.172 4.087 4.277 0.067 1 0 "[ . 1 . 2]" 1 1345 1 44 TYR HB3 1 47 TYR H . . 4.600 4.501 3.953 4.655 0.055 18 0 "[ . 1 . 2]" 1 1346 1 44 TYR QD 1 47 TYR H . . 5.440 5.044 4.713 5.321 . 0 0 "[ . 1 . 2]" 1 1347 1 44 TYR QD 1 47 TYR HB3 . . 4.140 3.314 2.946 3.677 . 0 0 "[ . 1 . 2]" 1 1348 1 44 TYR QE 1 47 TYR HB3 . . 5.500 5.323 5.038 5.568 0.068 11 0 "[ . 1 . 2]" 1 1349 1 45 HIS H 1 45 HIS HB2 . . 3.340 2.401 2.320 2.498 . 0 0 "[ . 1 . 2]" 1 1350 1 45 HIS H 1 45 HIS HB3 . . 3.320 2.526 2.401 2.713 . 0 0 "[ . 1 . 2]" 1 1351 1 45 HIS H 1 45 HIS HD2 . . 5.350 5.099 4.950 5.288 . 0 0 "[ . 1 . 2]" 1 1352 1 45 HIS H 1 46 ALA H . . 3.370 2.955 2.790 3.088 . 0 0 "[ . 1 . 2]" 1 1353 1 45 HIS H 1 46 ALA MB . . 4.910 4.564 4.389 4.695 . 0 0 "[ . 1 . 2]" 1 1354 1 45 HIS HA 1 45 HIS HD2 . . 4.620 4.363 4.226 4.469 . 0 0 "[ . 1 . 2]" 1 1355 1 45 HIS HA 1 47 TYR H . . 4.820 4.268 4.087 4.394 . 0 0 "[ . 1 . 2]" 1 1356 1 45 HIS HA 1 48 TYR H . . 3.990 3.367 3.269 3.671 . 0 0 "[ . 1 . 2]" 1 1357 1 45 HIS HA 1 48 TYR HB2 . . 3.820 3.405 3.156 3.888 0.068 1 0 "[ . 1 . 2]" 1 1358 1 45 HIS HA 1 48 TYR QB . . 3.350 2.478 2.316 2.979 . 0 0 "[ . 1 . 2]" 1 1359 1 45 HIS HA 1 48 TYR HB3 . . 3.820 2.546 2.376 3.094 . 0 0 "[ . 1 . 2]" 1 1360 1 45 HIS HA 1 48 TYR QD . . 4.710 4.141 3.886 4.562 . 0 0 "[ . 1 . 2]" 1 1361 1 45 HIS HA 1 49 ARG H . . 4.780 4.080 3.902 4.484 . 0 0 "[ . 1 . 2]" 1 1362 1 45 HIS HB2 1 46 ALA H . . 3.840 3.856 3.793 3.891 0.051 9 0 "[ . 1 . 2]" 1 1363 1 45 HIS HB3 1 45 HIS HD2 . . 3.920 2.719 2.641 2.805 . 0 0 "[ . 1 . 2]" 1 1364 1 45 HIS HB3 1 46 ALA H . . 3.460 2.502 2.440 2.560 . 0 0 "[ . 1 . 2]" 1 1365 1 45 HIS HB3 1 46 ALA HA . . 4.420 4.349 4.249 4.462 0.042 19 0 "[ . 1 . 2]" 1 1366 1 45 HIS HB3 1 46 ALA MB . . 4.710 4.007 3.900 4.142 . 0 0 "[ . 1 . 2]" 1 1367 1 45 HIS HD2 1 46 ALA H . . 4.370 3.721 3.403 4.015 . 0 0 "[ . 1 . 2]" 1 1368 1 45 HIS HD2 1 46 ALA HA . . 4.470 3.561 3.252 3.861 . 0 0 "[ . 1 . 2]" 1 1369 1 45 HIS HD2 1 46 ALA MB . . 4.240 4.016 3.700 4.308 0.068 17 0 "[ . 1 . 2]" 1 1370 1 45 HIS HD2 1 49 ARG H . . 5.500 5.312 5.050 5.496 . 0 0 "[ . 1 . 2]" 1 1371 1 45 HIS HD2 1 49 ARG HD2 . . 5.500 5.493 5.259 5.562 0.062 16 0 "[ . 1 . 2]" 1 1372 1 45 HIS HD2 1 49 ARG HD3 . . 4.620 4.308 4.067 4.692 0.072 8 0 "[ . 1 . 2]" 1 1373 1 45 HIS HD2 1 49 ARG HG2 . . 4.160 3.537 3.078 3.815 . 0 0 "[ . 1 . 2]" 1 1374 1 45 HIS HD2 1 49 ARG HG3 . . 4.160 3.582 3.100 4.139 . 0 0 "[ . 1 . 2]" 1 1375 1 45 HIS HE1 1 48 TYR QD . . 4.850 4.406 3.737 4.858 0.008 13 0 "[ . 1 . 2]" 1 1376 1 45 HIS HE1 1 48 TYR QE . . 5.500 5.146 4.520 5.492 . 0 0 "[ . 1 . 2]" 1 1377 1 45 HIS HE1 1 49 ARG HD2 . . 5.430 4.545 3.888 5.367 . 0 0 "[ . 1 . 2]" 1 1378 1 45 HIS HE1 1 49 ARG HD3 . . 5.170 3.269 2.684 4.201 . 0 0 "[ . 1 . 2]" 1 1379 1 45 HIS HE1 1 49 ARG HG2 . . 5.090 4.467 3.844 5.156 0.066 8 0 "[ . 1 . 2]" 1 1380 1 46 ALA H 1 46 ALA MB . . 2.570 2.226 2.169 2.274 . 0 0 "[ . 1 . 2]" 1 1381 1 46 ALA H 1 47 TYR H . . 3.320 2.837 2.752 2.975 . 0 0 "[ . 1 . 2]" 1 1382 1 46 ALA H 1 47 TYR HB2 . . 5.500 5.438 5.206 5.552 0.052 2 0 "[ . 1 . 2]" 1 1383 1 46 ALA H 1 47 TYR HB3 . . 5.140 4.858 4.728 5.073 . 0 0 "[ . 1 . 2]" 1 1384 1 46 ALA H 1 48 TYR H . . 4.490 4.292 4.168 4.517 0.027 1 0 "[ . 1 . 2]" 1 1385 1 46 ALA HA 1 48 TYR H . . 4.490 4.529 4.466 4.551 0.061 17 0 "[ . 1 . 2]" 1 1386 1 46 ALA HA 1 49 ARG H . . 3.880 3.528 3.345 3.634 . 0 0 "[ . 1 . 2]" 1 1387 1 46 ALA HA 1 49 ARG HB2 . . 3.590 2.928 2.569 3.384 . 0 0 "[ . 1 . 2]" 1 1388 1 46 ALA HA 1 49 ARG HB3 . . 4.780 4.429 4.069 4.732 . 0 0 "[ . 1 . 2]" 1 1389 1 46 ALA HA 1 49 ARG HD2 . . 5.500 5.514 5.346 5.567 0.067 4 0 "[ . 1 . 2]" 1 1390 1 46 ALA HA 1 49 ARG HD3 . . 5.300 5.159 4.828 5.356 0.056 10 0 "[ . 1 . 2]" 1 1391 1 46 ALA HA 1 49 ARG HG2 . . 3.420 3.059 2.557 3.473 0.053 18 0 "[ . 1 . 2]" 1 1392 1 46 ALA HA 1 49 ARG HG3 . . 4.270 3.176 2.625 3.455 . 0 0 "[ . 1 . 2]" 1 1393 1 46 ALA MB 1 47 TYR H . . 3.070 2.754 2.658 2.871 . 0 0 "[ . 1 . 2]" 1 1394 1 46 ALA MB 1 47 TYR HA . . 4.320 3.981 3.897 4.083 . 0 0 "[ . 1 . 2]" 1 1395 1 46 ALA MB 1 47 TYR HB2 . . 4.230 4.211 4.058 4.301 0.071 10 0 "[ . 1 . 2]" 1 1396 1 46 ALA MB 1 47 TYR HB3 . . 4.610 4.481 4.314 4.674 0.064 19 0 "[ . 1 . 2]" 1 1397 1 46 ALA MB 1 48 TYR H . . 4.780 4.647 4.601 4.709 . 0 0 "[ . 1 . 2]" 1 1398 1 46 ALA MB 1 49 ARG H . . 4.920 4.695 4.562 4.799 . 0 0 "[ . 1 . 2]" 1 1399 1 46 ALA MB 1 49 ARG HB2 . . 4.340 4.199 3.911 4.395 0.055 8 0 "[ . 1 . 2]" 1 1400 1 47 TYR H 1 47 TYR HB2 . . 3.280 2.790 2.534 2.920 . 0 0 "[ . 1 . 2]" 1 1401 1 47 TYR H 1 47 TYR HB3 . . 3.290 2.259 2.130 2.417 . 0 0 "[ . 1 . 2]" 1 1402 1 47 TYR H 1 47 TYR QD . . 4.260 4.071 3.940 4.180 . 0 0 "[ . 1 . 2]" 1 1403 1 47 TYR H 1 48 TYR H . . 3.480 2.490 2.349 2.648 . 0 0 "[ . 1 . 2]" 1 1404 1 47 TYR H 1 49 ARG HG2 . . 5.260 5.217 4.938 5.323 0.063 12 0 "[ . 1 . 2]" 1 1405 1 47 TYR HA 1 47 TYR QD . . 3.370 2.662 2.342 3.013 . 0 0 "[ . 1 . 2]" 1 1406 1 47 TYR HA 1 47 TYR QE . . 4.830 4.755 4.567 4.904 0.074 9 0 "[ . 1 . 2]" 1 1407 1 47 TYR HA 1 49 ARG H . . 4.750 4.333 4.162 4.422 . 0 0 "[ . 1 . 2]" 1 1408 1 47 TYR HA 1 50 HIS H . . 4.180 3.358 3.207 3.780 . 0 0 "[ . 1 . 2]" 1 1409 1 47 TYR HB2 1 48 TYR H . . 4.080 4.050 3.918 4.113 0.033 7 0 "[ . 1 . 2]" 1 1410 1 47 TYR HB3 1 48 TYR H . . 3.610 2.749 2.582 2.842 . 0 0 "[ . 1 . 2]" 1 1411 1 47 TYR HB3 1 49 ARG H . . 5.500 5.112 5.038 5.207 . 0 0 "[ . 1 . 2]" 1 1412 1 47 TYR QD 1 48 TYR H . . 3.790 3.461 3.192 3.670 . 0 0 "[ . 1 . 2]" 1 1413 1 47 TYR QD 1 48 TYR HA . . 4.000 3.925 3.520 4.076 0.076 1 0 "[ . 1 . 2]" 1 1414 1 47 TYR QD 1 49 ARG H . . 5.500 5.561 5.452 5.591 0.091 3 0 "[ . 1 . 2]" 1 1415 1 47 TYR QD 1 51 LYS HD3 . . 5.270 4.099 3.693 4.392 . 0 0 "[ . 1 . 2]" 1 1416 1 47 TYR QD 1 51 LYS HG2 . . 4.900 3.789 3.608 4.064 . 0 0 "[ . 1 . 2]" 1 1417 1 47 TYR QE 1 48 TYR HA . . 4.850 4.760 4.473 4.910 0.060 3 0 "[ . 1 . 2]" 1 1418 1 47 TYR QE 1 51 LYS HD2 . . 4.700 3.848 3.322 4.319 . 0 0 "[ . 1 . 2]" 1 1419 1 47 TYR QE 1 51 LYS HD3 . . 4.160 2.747 2.408 3.186 . 0 0 "[ . 1 . 2]" 1 1420 1 47 TYR QE 1 51 LYS HE2 . . 4.620 4.539 4.211 4.687 0.067 18 0 "[ . 1 . 2]" 1 1421 1 47 TYR QE 1 51 LYS HE3 . . 5.320 5.327 4.982 5.407 0.087 8 0 "[ . 1 . 2]" 1 1422 1 47 TYR QE 1 51 LYS HG2 . . 4.410 3.673 3.383 3.989 . 0 0 "[ . 1 . 2]" 1 1423 1 47 TYR QE 1 51 LYS HG3 . . 4.190 3.613 3.233 4.005 . 0 0 "[ . 1 . 2]" 1 1424 1 48 TYR H 1 48 TYR HB2 . . 3.420 2.621 2.534 2.669 . 0 0 "[ . 1 . 2]" 1 1425 1 48 TYR H 1 48 TYR HB3 . . 3.420 2.474 2.354 2.557 . 0 0 "[ . 1 . 2]" 1 1426 1 48 TYR H 1 48 TYR QD . . 4.640 4.214 4.155 4.261 . 0 0 "[ . 1 . 2]" 1 1427 1 48 TYR H 1 49 ARG H . . 3.440 2.702 2.617 2.749 . 0 0 "[ . 1 . 2]" 1 1428 1 48 TYR H 1 49 ARG HG2 . . 4.790 4.577 4.432 4.741 . 0 0 "[ . 1 . 2]" 1 1429 1 48 TYR HA 1 48 TYR QD . . 4.020 3.070 3.007 3.172 . 0 0 "[ . 1 . 2]" 1 1430 1 48 TYR HA 1 51 LYS HB2 . . 4.030 2.882 2.582 3.062 . 0 0 "[ . 1 . 2]" 1 1431 1 48 TYR HA 1 51 LYS HB3 . . 4.470 4.427 4.198 4.534 0.064 4 0 "[ . 1 . 2]" 1 1432 1 48 TYR HA 1 51 LYS HG2 . . 5.260 3.013 2.751 3.369 . 0 0 "[ . 1 . 2]" 1 1433 1 48 TYR HA 1 51 LYS HG3 . . 4.580 3.508 3.351 3.608 . 0 0 "[ . 1 . 2]" 1 1434 1 48 TYR HA 1 52 VAL MG2 . . 4.900 4.230 4.110 4.375 . 0 0 "[ . 1 . 2]" 1 1435 1 48 TYR QB 1 49 ARG H . . 3.550 2.592 2.512 2.679 . 0 0 "[ . 1 . 2]" 1 1436 1 48 TYR QD 1 49 ARG H . . 4.310 3.172 3.049 3.317 . 0 0 "[ . 1 . 2]" 1 1437 1 48 TYR QD 1 49 ARG HA . . 5.050 3.122 2.936 3.296 . 0 0 "[ . 1 . 2]" 1 1438 1 48 TYR QD 1 49 ARG HG2 . . 4.890 3.433 2.967 4.051 . 0 0 "[ . 1 . 2]" 1 1439 1 48 TYR QD 1 49 ARG HG3 . . 5.210 4.907 4.638 5.228 0.018 16 0 "[ . 1 . 2]" 1 1440 1 48 TYR QD 1 52 VAL MG2 . . 4.300 3.169 2.915 3.433 . 0 0 "[ . 1 . 2]" 1 1441 1 48 TYR QE 1 52 VAL MG2 . . 3.790 2.389 2.271 2.562 . 0 0 "[ . 1 . 2]" 1 1442 1 48 TYR HH 1 52 VAL MG1 . . 4.850 4.258 3.910 4.485 . 0 0 "[ . 1 . 2]" 1 1443 1 48 TYR HH 1 52 VAL MG2 . . 3.560 2.742 2.464 2.957 . 0 0 "[ . 1 . 2]" 1 1444 1 49 ARG H 1 49 ARG HB2 . . 3.510 2.603 2.483 2.743 . 0 0 "[ . 1 . 2]" 1 1445 1 49 ARG H 1 49 ARG HB3 . . 3.820 3.685 3.625 3.733 . 0 0 "[ . 1 . 2]" 1 1446 1 49 ARG H 1 49 ARG HD2 . . 4.710 3.890 3.419 4.371 . 0 0 "[ . 1 . 2]" 1 1447 1 49 ARG H 1 49 ARG HD3 . . 4.860 4.146 3.229 4.692 . 0 0 "[ . 1 . 2]" 1 1448 1 49 ARG H 1 49 ARG HG2 . . 3.340 2.375 2.223 2.569 . 0 0 "[ . 1 . 2]" 1 1449 1 49 ARG H 1 49 ARG HG3 . . 3.830 3.740 3.496 3.893 0.063 15 0 "[ . 1 . 2]" 1 1450 1 49 ARG H 1 50 HIS H . . 3.460 2.829 2.758 2.896 . 0 0 "[ . 1 . 2]" 1 1451 1 49 ARG HA 1 49 ARG HD2 . . 3.630 2.270 2.077 2.643 . 0 0 "[ . 1 . 2]" 1 1452 1 49 ARG HA 1 49 ARG HE . . 4.920 4.022 2.812 4.829 . 0 0 "[ . 1 . 2]" 1 1453 1 49 ARG HA 1 49 ARG HG2 . . 3.860 3.147 2.826 3.410 . 0 0 "[ . 1 . 2]" 1 1454 1 49 ARG HA 1 49 ARG HG3 . . 3.940 3.815 3.769 3.870 . 0 0 "[ . 1 . 2]" 1 1455 1 49 ARG HA 1 52 VAL H . . 3.950 3.553 3.355 3.827 . 0 0 "[ . 1 . 2]" 1 1456 1 49 ARG HA 1 52 VAL HB . . 3.540 3.121 2.938 3.487 . 0 0 "[ . 1 . 2]" 1 1457 1 49 ARG HA 1 52 VAL MG1 . . 4.610 4.384 4.229 4.672 0.062 1 0 "[ . 1 . 2]" 1 1458 1 49 ARG HA 1 52 VAL MG2 . . 3.540 2.831 2.322 3.259 . 0 0 "[ . 1 . 2]" 1 1459 1 49 ARG HA 1 53 SER H . . 4.840 4.437 4.220 4.769 . 0 0 "[ . 1 . 2]" 1 1460 1 49 ARG HB2 1 49 ARG HD2 . . 3.990 3.741 3.571 3.839 . 0 0 "[ . 1 . 2]" 1 1461 1 49 ARG HB2 1 50 HIS H . . 3.600 2.610 2.472 2.775 . 0 0 "[ . 1 . 2]" 1 1462 1 49 ARG HB3 1 49 ARG HD2 . . 3.660 2.883 2.372 3.267 . 0 0 "[ . 1 . 2]" 1 1463 1 49 ARG HB3 1 50 HIS H . . 4.040 3.597 3.415 3.717 . 0 0 "[ . 1 . 2]" 1 1464 1 49 ARG HB3 1 50 HIS HA . . 4.430 4.425 4.260 4.492 0.062 19 0 "[ . 1 . 2]" 1 1465 1 49 ARG HD2 1 52 VAL HB . . 4.910 4.583 4.278 4.956 0.046 9 0 "[ . 1 . 2]" 1 1466 1 49 ARG HD2 1 52 VAL MG1 . . 5.500 4.962 4.682 5.361 . 0 0 "[ . 1 . 2]" 1 1467 1 49 ARG HD2 1 52 VAL MG2 . . 4.320 3.829 3.046 4.389 0.069 17 0 "[ . 1 . 2]" 1 1468 1 49 ARG HD3 1 52 VAL MG2 . . 5.450 4.770 3.648 5.531 0.081 13 0 "[ . 1 . 2]" 1 1469 1 49 ARG HG2 1 50 HIS H . . 5.180 4.432 4.319 4.535 . 0 0 "[ . 1 . 2]" 1 1470 1 49 ARG HG3 1 50 HIS H . . 5.110 4.949 4.797 5.119 0.009 5 0 "[ . 1 . 2]" 1 1471 1 50 HIS H 1 50 HIS HB2 . . 3.200 2.613 2.507 2.894 . 0 0 "[ . 1 . 2]" 1 1472 1 50 HIS H 1 50 HIS HB3 . . 3.200 2.424 2.092 2.631 . 0 0 "[ . 1 . 2]" 1 1473 1 50 HIS HA 1 50 HIS HD2 . . 4.770 4.269 3.694 4.750 . 0 0 "[ . 1 . 2]" 1 1474 1 50 HIS HA 1 51 LYS HA . . 5.110 4.805 4.749 4.837 . 0 0 "[ . 1 . 2]" 1 1475 1 50 HIS HA 1 52 VAL H . . 5.470 4.488 4.402 4.552 . 0 0 "[ . 1 . 2]" 1 1476 1 50 HIS HA 1 52 VAL HB . . 5.060 5.120 5.087 5.131 0.071 13 0 "[ . 1 . 2]" 1 1477 1 50 HIS HA 1 53 SER H . . 3.940 3.765 3.545 3.993 0.053 2 0 "[ . 1 . 2]" 1 1478 1 50 HIS HA 1 53 SER QB . . 3.590 3.012 2.576 3.651 0.061 8 0 "[ . 1 . 2]" 1 1479 1 50 HIS HA 1 54 GLU H . . 4.480 4.154 4.023 4.550 0.070 3 0 "[ . 1 . 2]" 1 1480 1 50 HIS HA 1 54 GLU HB2 . . 4.990 4.652 4.504 4.839 . 0 0 "[ . 1 . 2]" 1 1481 1 50 HIS HA 1 54 GLU QG . . 5.340 5.415 5.396 5.431 0.091 2 0 "[ . 1 . 2]" 1 1482 1 50 HIS QB 1 50 HIS HD2 . . 3.450 2.676 2.454 2.927 . 0 0 "[ . 1 . 2]" 1 1483 1 50 HIS QB 1 51 LYS H . . 3.490 2.501 2.364 2.715 . 0 0 "[ . 1 . 2]" 1 1484 1 50 HIS HD2 1 51 LYS H . . 4.200 3.360 2.874 3.684 . 0 0 "[ . 1 . 2]" 1 1485 1 50 HIS HD2 1 51 LYS HA . . 4.600 3.200 2.579 3.829 . 0 0 "[ . 1 . 2]" 1 1486 1 50 HIS HD2 1 51 LYS HB2 . . 5.500 5.102 4.722 5.529 0.029 11 0 "[ . 1 . 2]" 1 1487 1 50 HIS HD2 1 51 LYS HD2 . . 4.030 2.471 2.232 2.816 . 0 0 "[ . 1 . 2]" 1 1488 1 50 HIS HD2 1 51 LYS HD3 . . 4.330 3.588 2.768 4.391 0.061 10 0 "[ . 1 . 2]" 1 1489 1 50 HIS HD2 1 51 LYS HG2 . . 4.570 3.736 2.908 4.313 . 0 0 "[ . 1 . 2]" 1 1490 1 50 HIS HD2 1 54 GLU HB3 . . 5.500 4.753 3.691 5.566 0.066 11 0 "[ . 1 . 2]" 1 1491 1 50 HIS HD2 1 54 GLU QG . . 4.880 3.688 2.814 4.412 . 0 0 "[ . 1 . 2]" 1 1492 1 50 HIS HE1 1 54 GLU QG . . 4.180 3.535 2.460 4.269 0.089 17 0 "[ . 1 . 2]" 1 1493 1 51 LYS H 1 51 LYS HB2 . . 3.470 2.513 2.359 2.677 . 0 0 "[ . 1 . 2]" 1 1494 1 51 LYS H 1 51 LYS HB3 . . 3.680 3.599 3.535 3.681 0.001 13 0 "[ . 1 . 2]" 1 1495 1 51 LYS H 1 51 LYS HD2 . . 4.460 3.238 2.950 3.467 . 0 0 "[ . 1 . 2]" 1 1496 1 51 LYS H 1 51 LYS HD3 . . 4.580 4.135 3.671 4.410 . 0 0 "[ . 1 . 2]" 1 1497 1 51 LYS H 1 51 LYS HE2 . . 5.250 5.201 5.047 5.314 0.064 3 0 "[ . 1 . 2]" 1 1498 1 51 LYS H 1 51 LYS HE3 . . 4.960 4.700 4.519 4.979 0.019 13 0 "[ . 1 . 2]" 1 1499 1 51 LYS H 1 51 LYS HG2 . . 3.780 2.235 2.112 2.375 . 0 0 "[ . 1 . 2]" 1 1500 1 51 LYS H 1 51 LYS HG3 . . 4.160 3.685 3.584 3.799 . 0 0 "[ . 1 . 2]" 1 1501 1 51 LYS H 1 52 VAL H . . 3.300 2.947 2.873 3.069 . 0 0 "[ . 1 . 2]" 1 1502 1 51 LYS H 1 52 VAL HB . . 5.060 5.089 4.967 5.126 0.066 1 0 "[ . 1 . 2]" 1 1503 1 51 LYS H 1 52 VAL MG2 . . 4.550 4.447 4.399 4.583 0.033 19 0 "[ . 1 . 2]" 1 1504 1 51 LYS HA 1 51 LYS HD2 . . 3.300 2.160 2.109 2.205 . 0 0 "[ . 1 . 2]" 1 1505 1 51 LYS HA 1 51 LYS HD3 . . 3.640 3.704 3.687 3.711 0.071 18 0 "[ . 1 . 2]" 1 1506 1 51 LYS HA 1 51 LYS HE2 . . 4.130 3.820 3.544 4.087 . 0 0 "[ . 1 . 2]" 1 1507 1 51 LYS HA 1 51 LYS HE3 . . 4.020 2.541 2.185 3.038 . 0 0 "[ . 1 . 2]" 1 1508 1 51 LYS HA 1 51 LYS HG2 . . 3.950 3.252 3.140 3.370 . 0 0 "[ . 1 . 2]" 1 1509 1 51 LYS HA 1 51 LYS HG3 . . 4.250 3.749 3.728 3.775 . 0 0 "[ . 1 . 2]" 1 1510 1 51 LYS HA 1 53 SER H . . 4.990 4.777 4.596 4.938 . 0 0 "[ . 1 . 2]" 1 1511 1 51 LYS HA 1 54 GLU H . . 3.780 3.350 3.187 3.600 . 0 0 "[ . 1 . 2]" 1 1512 1 51 LYS HA 1 54 GLU HB2 . . 3.370 2.317 2.145 2.540 . 0 0 "[ . 1 . 2]" 1 1513 1 51 LYS HA 1 54 GLU HB3 . . 3.680 2.970 2.628 3.475 . 0 0 "[ . 1 . 2]" 1 1514 1 51 LYS HA 1 54 GLU QG . . 4.010 3.901 3.654 4.072 0.062 12 0 "[ . 1 . 2]" 1 1515 1 51 LYS HA 1 55 PHE H . . 4.470 3.729 3.597 3.897 . 0 0 "[ . 1 . 2]" 1 1516 1 51 LYS HA 1 55 PHE QD . . 5.160 3.404 3.166 3.576 . 0 0 "[ . 1 . 2]" 1 1517 1 51 LYS HB2 1 51 LYS HD2 . . 3.850 3.780 3.719 3.846 . 0 0 "[ . 1 . 2]" 1 1518 1 51 LYS HB2 1 51 LYS HE2 . . 4.100 4.058 3.816 4.168 0.068 16 0 "[ . 1 . 2]" 1 1519 1 51 LYS HB2 1 51 LYS HE3 . . 4.500 3.903 3.653 4.542 0.042 4 0 "[ . 1 . 2]" 1 1520 1 51 LYS HB2 1 52 VAL H . . 3.760 2.597 2.532 2.692 . 0 0 "[ . 1 . 2]" 1 1521 1 51 LYS HB2 1 52 VAL MG2 . . 3.380 3.452 3.404 3.475 0.095 2 0 "[ . 1 . 2]" 1 1522 1 51 LYS HB2 1 55 PHE QD . . 5.090 3.962 3.690 4.424 . 0 0 "[ . 1 . 2]" 1 1523 1 51 LYS HB2 1 55 PHE QE . . 4.900 4.401 4.038 4.637 . 0 0 "[ . 1 . 2]" 1 1524 1 51 LYS HB3 1 51 LYS HE2 . . 4.930 2.761 2.464 2.999 . 0 0 "[ . 1 . 2]" 1 1525 1 51 LYS HB3 1 51 LYS HE3 . . 4.330 2.412 2.080 3.171 . 0 0 "[ . 1 . 2]" 1 1526 1 51 LYS HB3 1 52 VAL H . . 4.380 3.647 3.554 3.741 . 0 0 "[ . 1 . 2]" 1 1527 1 51 LYS HB3 1 54 GLU HB2 . . 4.720 4.604 4.406 4.781 0.061 19 0 "[ . 1 . 2]" 1 1528 1 51 LYS HB3 1 55 PHE QD . . 4.210 2.535 2.259 2.970 . 0 0 "[ . 1 . 2]" 1 1529 1 51 LYS HB3 1 55 PHE QE . . 4.010 2.747 2.448 2.950 . 0 0 "[ . 1 . 2]" 1 1530 1 51 LYS HD2 1 52 VAL H . . 5.500 5.263 5.119 5.364 . 0 0 "[ . 1 . 2]" 1 1531 1 51 LYS HD2 1 55 PHE QD . . 4.800 4.790 4.607 4.871 0.071 6 0 "[ . 1 . 2]" 1 1532 1 51 LYS HD2 1 55 PHE QE . . 5.040 4.670 4.355 4.833 . 0 0 "[ . 1 . 2]" 1 1533 1 51 LYS HD3 1 55 PHE QE . . 5.220 4.780 4.569 4.998 . 0 0 "[ . 1 . 2]" 1 1534 1 51 LYS HE2 1 51 LYS HG2 . . 3.990 3.614 3.522 3.710 . 0 0 "[ . 1 . 2]" 1 1535 1 51 LYS HE2 1 51 LYS HG3 . . 3.520 2.390 2.244 2.553 . 0 0 "[ . 1 . 2]" 1 1536 1 51 LYS HE2 1 55 PHE QE . . 4.270 2.394 2.116 2.899 . 0 0 "[ . 1 . 2]" 1 1537 1 51 LYS HE2 1 55 PHE HZ . . 4.310 4.154 3.845 4.372 0.062 8 0 "[ . 1 . 2]" 1 1538 1 51 LYS HE3 1 51 LYS HG2 . . 4.080 3.835 3.710 4.093 0.013 4 0 "[ . 1 . 2]" 1 1539 1 51 LYS HE3 1 54 GLU HB2 . . 4.590 4.029 3.543 4.595 0.005 19 0 "[ . 1 . 2]" 1 1540 1 51 LYS HE3 1 54 GLU HB3 . . 4.670 3.522 2.807 4.235 . 0 0 "[ . 1 . 2]" 1 1541 1 51 LYS HE3 1 55 PHE QE . . 4.160 2.505 2.163 2.845 . 0 0 "[ . 1 . 2]" 1 1542 1 51 LYS HE3 1 55 PHE HZ . . 4.560 4.467 4.009 4.612 0.052 11 0 "[ . 1 . 2]" 1 1543 1 51 LYS HG2 1 52 VAL H . . 5.350 4.436 4.271 4.561 . 0 0 "[ . 1 . 2]" 1 1544 1 51 LYS HG2 1 55 PHE QE . . 5.500 5.157 4.885 5.349 . 0 0 "[ . 1 . 2]" 1 1545 1 51 LYS HG3 1 52 VAL H . . 5.030 5.054 5.005 5.093 0.063 6 0 "[ . 1 . 2]" 1 1546 1 51 LYS HG3 1 55 PHE QD . . 5.290 4.769 4.455 5.113 . 0 0 "[ . 1 . 2]" 1 1547 1 51 LYS HG3 1 55 PHE QE . . 4.850 3.876 3.507 4.143 . 0 0 "[ . 1 . 2]" 1 1548 1 52 VAL H 1 52 VAL HB . . 3.180 2.470 2.399 2.524 . 0 0 "[ . 1 . 2]" 1 1549 1 52 VAL H 1 52 VAL MG1 . . 3.830 3.792 3.757 3.817 . 0 0 "[ . 1 . 2]" 1 1550 1 52 VAL H 1 52 VAL MG2 . . 2.810 2.196 2.060 2.346 . 0 0 "[ . 1 . 2]" 1 1551 1 52 VAL H 1 53 SER H . . 3.180 2.932 2.834 3.084 . 0 0 "[ . 1 . 2]" 1 1552 1 52 VAL H 1 53 SER QB . . 4.840 4.617 4.493 4.904 0.064 8 0 "[ . 1 . 2]" 1 1553 1 52 VAL H 1 55 PHE QD . . 4.960 4.627 4.454 4.911 . 0 0 "[ . 1 . 2]" 1 1554 1 52 VAL HA 1 52 VAL MG1 . . 2.940 2.450 2.383 2.517 . 0 0 "[ . 1 . 2]" 1 1555 1 52 VAL HA 1 52 VAL MG2 . . 2.870 2.356 2.232 2.428 . 0 0 "[ . 1 . 2]" 1 1556 1 52 VAL HA 1 53 SER HA . . 4.880 4.811 4.714 4.901 0.021 5 0 "[ . 1 . 2]" 1 1557 1 52 VAL HA 1 54 GLU H . . 4.830 4.477 3.790 4.649 . 0 0 "[ . 1 . 2]" 1 1558 1 52 VAL HA 1 55 PHE H . . 3.950 3.713 3.578 3.851 . 0 0 "[ . 1 . 2]" 1 1559 1 52 VAL HA 1 55 PHE HB2 . . 4.110 3.153 3.031 3.235 . 0 0 "[ . 1 . 2]" 1 1560 1 52 VAL HA 1 55 PHE HB3 . . 4.920 4.700 4.571 4.783 . 0 0 "[ . 1 . 2]" 1 1561 1 52 VAL HA 1 55 PHE QD . . 4.180 3.783 3.560 4.079 . 0 0 "[ . 1 . 2]" 1 1562 1 52 VAL HA 1 56 LYS H . . 4.780 4.213 4.069 4.446 . 0 0 "[ . 1 . 2]" 1 1563 1 52 VAL HB 1 53 SER H . . 3.050 2.309 2.169 2.407 . 0 0 "[ . 1 . 2]" 1 1564 1 52 VAL HB 1 53 SER HA . . 4.750 4.376 4.230 4.480 . 0 0 "[ . 1 . 2]" 1 1565 1 52 VAL HB 1 53 SER QB . . 4.270 4.171 3.850 4.326 0.056 9 0 "[ . 1 . 2]" 1 1566 1 52 VAL HB 1 54 GLU H . . 4.890 4.850 4.664 4.949 0.059 4 0 "[ . 1 . 2]" 1 1567 1 52 VAL HB 1 56 LYS HD2 . . 4.830 4.661 4.460 4.865 0.035 4 0 "[ . 1 . 2]" 1 1568 1 52 VAL MG1 1 53 SER H . . 3.460 3.057 2.831 3.190 . 0 0 "[ . 1 . 2]" 1 1569 1 52 VAL MG1 1 53 SER HA . . 3.550 3.323 3.204 3.474 . 0 0 "[ . 1 . 2]" 1 1570 1 52 VAL MG1 1 53 SER QB . . 4.430 4.245 3.846 4.496 0.066 15 0 "[ . 1 . 2]" 1 1571 1 52 VAL MG1 1 55 PHE HB3 . . 5.500 5.560 5.492 5.587 0.087 20 0 "[ . 1 . 2]" 1 1572 1 52 VAL MG1 1 55 PHE QD . . 5.500 5.496 5.300 5.599 0.099 13 0 "[ . 1 . 2]" 1 1573 1 52 VAL MG1 1 56 LYS H . . 4.680 4.365 4.190 4.601 . 0 0 "[ . 1 . 2]" 1 1574 1 52 VAL MG1 1 56 LYS HB2 . . 4.170 4.047 3.688 4.213 0.043 1 0 "[ . 1 . 2]" 1 1575 1 52 VAL MG1 1 56 LYS HD2 . . 3.620 2.141 2.008 2.301 . 0 0 "[ . 1 . 2]" 1 1576 1 52 VAL MG1 1 56 LYS HD3 . . 3.180 2.954 2.550 3.255 0.075 11 0 "[ . 1 . 2]" 1 1577 1 52 VAL MG1 1 56 LYS QE . . 3.400 3.473 3.357 3.513 0.113 5 0 "[ . 1 . 2]" 1 1578 1 52 VAL MG1 1 56 LYS HG2 . . 4.510 4.222 3.921 4.596 0.086 4 0 "[ . 1 . 2]" 1 1579 1 52 VAL MG1 1 56 LYS HG3 . . 3.940 3.200 2.780 3.912 . 0 0 "[ . 1 . 2]" 1 1580 1 52 VAL MG2 1 53 SER H . . 3.760 3.809 3.742 3.848 0.088 7 0 "[ . 1 . 2]" 1 1581 1 52 VAL MG2 1 53 SER HA . . 5.460 5.450 5.381 5.505 0.045 20 0 "[ . 1 . 2]" 1 1582 1 52 VAL MG2 1 53 SER QB . . 5.230 5.266 5.060 5.345 0.115 17 0 "[ . 1 . 2]" 1 1583 1 53 SER H 1 53 SER QB . . 2.760 2.239 2.070 2.365 . 0 0 "[ . 1 . 2]" 1 1584 1 53 SER H 1 54 GLU H . . 3.160 2.835 2.767 2.923 . 0 0 "[ . 1 . 2]" 1 1585 1 53 SER H 1 54 GLU HA . . 5.500 5.426 5.378 5.488 . 0 0 "[ . 1 . 2]" 1 1586 1 53 SER H 1 55 PHE H . . 4.810 4.586 4.438 4.756 . 0 0 "[ . 1 . 2]" 1 1587 1 53 SER HA 1 55 PHE H . . 4.950 4.801 4.686 4.938 . 0 0 "[ . 1 . 2]" 1 1588 1 53 SER HA 1 56 LYS H . . 4.000 3.629 3.395 3.815 . 0 0 "[ . 1 . 2]" 1 1589 1 53 SER HA 1 56 LYS HB2 . . 3.080 2.515 2.251 2.744 . 0 0 "[ . 1 . 2]" 1 1590 1 53 SER HA 1 56 LYS HD2 . . 3.800 3.691 3.378 3.869 0.069 8 0 "[ . 1 . 2]" 1 1591 1 53 SER HA 1 56 LYS HD3 . . 3.630 2.665 2.186 3.143 . 0 0 "[ . 1 . 2]" 1 1592 1 53 SER HA 1 56 LYS HE2 . . 5.500 5.228 4.515 5.559 0.059 13 0 "[ . 1 . 2]" 1 1593 1 53 SER HA 1 56 LYS QE . . 4.760 4.608 4.041 4.851 0.091 10 0 "[ . 1 . 2]" 1 1594 1 53 SER HA 1 56 LYS HE3 . . 5.500 5.210 4.238 5.567 0.067 17 0 "[ . 1 . 2]" 1 1595 1 53 SER HA 1 57 GLU HG2 . . 4.480 4.307 3.767 4.547 0.067 2 0 "[ . 1 . 2]" 1 1596 1 53 SER HA 1 57 GLU HG3 . . 4.690 4.515 4.079 4.760 0.070 6 0 "[ . 1 . 2]" 1 1597 1 53 SER QB 1 54 GLU H . . 3.470 2.657 2.362 3.377 . 0 0 "[ . 1 . 2]" 1 1598 1 53 SER QB 1 56 LYS H . . 5.340 4.958 4.754 5.194 . 0 0 "[ . 1 . 2]" 1 1599 1 53 SER QB 1 56 LYS HB2 . . 4.610 4.411 4.138 4.686 0.076 19 0 "[ . 1 . 2]" 1 1600 1 53 SER HB2 1 54 GLU H . . 4.180 3.053 2.515 3.920 . 0 0 "[ . 1 . 2]" 1 1601 1 53 SER HB3 1 54 GLU H . . 4.180 3.355 2.402 4.173 . 0 0 "[ . 1 . 2]" 1 1602 1 54 GLU H 1 54 GLU HB2 . . 3.000 1.988 1.927 2.235 . 0 0 "[ . 1 . 2]" 1 1603 1 54 GLU H 1 54 GLU HB3 . . 3.350 3.131 2.918 3.346 . 0 0 "[ . 1 . 2]" 1 1604 1 54 GLU H 1 54 GLU QG . . 4.070 3.619 3.404 3.839 . 0 0 "[ . 1 . 2]" 1 1605 1 54 GLU H 1 55 PHE H . . 3.350 2.868 2.326 3.030 . 0 0 "[ . 1 . 2]" 1 1606 1 54 GLU H 1 55 PHE HB2 . . 5.290 4.811 4.103 4.952 . 0 0 "[ . 1 . 2]" 1 1607 1 54 GLU H 1 56 LYS H . . 3.940 3.948 3.387 4.009 0.069 13 0 "[ . 1 . 2]" 1 1608 1 54 GLU HA 1 54 GLU HG2 . . 3.570 3.013 2.262 3.627 0.057 2 0 "[ . 1 . 2]" 1 1609 1 54 GLU HA 1 54 GLU QG . . 3.080 2.439 2.122 2.755 . 0 0 "[ . 1 . 2]" 1 1610 1 54 GLU HA 1 54 GLU HG3 . . 3.570 2.672 2.565 2.855 . 0 0 "[ . 1 . 2]" 1 1611 1 54 GLU HA 1 56 LYS H . . 4.490 4.216 4.076 4.348 . 0 0 "[ . 1 . 2]" 1 1612 1 54 GLU HA 1 57 GLU H . . 4.150 3.442 3.108 3.740 . 0 0 "[ . 1 . 2]" 1 1613 1 54 GLU HA 1 57 GLU HB2 . . 4.340 3.088 2.752 3.600 . 0 0 "[ . 1 . 2]" 1 1614 1 54 GLU HA 1 57 GLU HG2 . . 4.790 4.200 3.704 4.646 . 0 0 "[ . 1 . 2]" 1 1615 1 54 GLU HA 1 57 GLU HG3 . . 4.560 2.809 2.225 3.251 . 0 0 "[ . 1 . 2]" 1 1616 1 54 GLU HA 1 58 GLY H . . 4.660 4.649 4.461 4.733 0.073 3 0 "[ . 1 . 2]" 1 1617 1 54 GLU HA 1 59 LYS H . . 4.320 4.178 3.822 4.389 0.069 6 0 "[ . 1 . 2]" 1 1618 1 54 GLU HA 1 59 LYS HG2 . . 4.760 3.001 2.370 3.539 . 0 0 "[ . 1 . 2]" 1 1619 1 54 GLU HB2 1 55 PHE H . . 3.370 3.164 3.084 3.323 . 0 0 "[ . 1 . 2]" 1 1620 1 54 GLU HB2 1 55 PHE HA . . 5.500 5.234 5.065 5.354 . 0 0 "[ . 1 . 2]" 1 1621 1 54 GLU HB2 1 56 LYS H . . 5.040 5.104 5.074 5.116 0.076 17 0 "[ . 1 . 2]" 1 1622 1 54 GLU HB2 1 60 ALA MB . . 4.270 3.479 3.199 3.633 . 0 0 "[ . 1 . 2]" 1 1623 1 54 GLU HB3 1 55 PHE H . . 3.290 2.655 2.351 2.992 . 0 0 "[ . 1 . 2]" 1 1624 1 54 GLU HB3 1 55 PHE HA . . 3.830 3.894 3.875 3.903 0.073 4 0 "[ . 1 . 2]" 1 1625 1 54 GLU HB3 1 55 PHE QD . . 4.340 3.716 3.291 4.007 . 0 0 "[ . 1 . 2]" 1 1626 1 54 GLU HB3 1 56 LYS H . . 5.150 4.827 4.664 5.033 . 0 0 "[ . 1 . 2]" 1 1627 1 54 GLU HB3 1 59 LYS HG2 . . 5.430 4.421 3.810 5.465 0.035 15 0 "[ . 1 . 2]" 1 1628 1 54 GLU HB3 1 59 LYS HG3 . . 5.500 4.713 4.061 5.381 . 0 0 "[ . 1 . 2]" 1 1629 1 54 GLU HB3 1 60 ALA HA . . 5.250 4.025 3.631 4.396 . 0 0 "[ . 1 . 2]" 1 1630 1 54 GLU HB3 1 60 ALA MB . . 4.020 2.038 1.944 2.169 . 0 0 "[ . 1 . 2]" 1 1631 1 54 GLU HB3 1 61 GLN H . . 5.500 5.434 5.080 5.577 0.077 11 0 "[ . 1 . 2]" 1 1632 1 54 GLU QG 1 55 PHE H . . 4.490 4.334 4.123 4.534 0.044 13 0 "[ . 1 . 2]" 1 1633 1 54 GLU QG 1 55 PHE HA . . 5.340 5.015 4.799 5.259 . 0 0 "[ . 1 . 2]" 1 1634 1 54 GLU QG 1 55 PHE QD . . 5.340 5.379 5.009 5.436 0.096 5 0 "[ . 1 . 2]" 1 1635 1 54 GLU QG 1 59 LYS HD2 . . 4.850 3.120 2.557 4.083 . 0 0 "[ . 1 . 2]" 1 1636 1 54 GLU QG 1 59 LYS HG2 . . 5.340 2.763 2.348 3.551 . 0 0 "[ . 1 . 2]" 1 1637 1 54 GLU QG 1 59 LYS HG3 . . 4.370 2.600 2.101 2.947 . 0 0 "[ . 1 . 2]" 1 1638 1 54 GLU QG 1 60 ALA H . . 3.440 3.481 3.257 3.521 0.081 6 0 "[ . 1 . 2]" 1 1639 1 54 GLU QG 1 60 ALA HA . . 4.320 3.183 2.618 3.740 . 0 0 "[ . 1 . 2]" 1 1640 1 54 GLU QG 1 60 ALA MB . . 3.410 2.638 2.247 2.983 . 0 0 "[ . 1 . 2]" 1 1641 1 54 GLU HG2 1 55 PHE H . . 5.130 4.832 4.429 5.186 0.056 13 0 "[ . 1 . 2]" 1 1642 1 54 GLU HG2 1 60 ALA HA . . 5.000 3.693 2.642 4.882 . 0 0 "[ . 1 . 2]" 1 1643 1 54 GLU HG2 1 60 ALA MB . . 4.100 2.953 2.353 3.584 . 0 0 "[ . 1 . 2]" 1 1644 1 54 GLU HG3 1 55 PHE H . . 5.130 4.943 4.714 5.063 . 0 0 "[ . 1 . 2]" 1 1645 1 54 GLU HG3 1 60 ALA HA . . 5.000 4.039 2.932 4.820 . 0 0 "[ . 1 . 2]" 1 1646 1 54 GLU HG3 1 60 ALA MB . . 4.100 3.352 2.336 4.175 0.075 12 0 "[ . 1 . 2]" 1 1647 1 55 PHE H 1 55 PHE HB2 . . 3.250 2.217 2.125 2.295 . 0 0 "[ . 1 . 2]" 1 1648 1 55 PHE H 1 55 PHE HB3 . . 3.610 3.495 3.417 3.553 . 0 0 "[ . 1 . 2]" 1 1649 1 55 PHE H 1 55 PHE QD . . 3.650 2.734 2.451 2.822 . 0 0 "[ . 1 . 2]" 1 1650 1 55 PHE H 1 55 PHE QE . . 4.840 4.895 4.772 4.926 0.086 2 0 "[ . 1 . 2]" 1 1651 1 55 PHE H 1 56 LYS H . . 3.140 2.570 2.498 2.632 . 0 0 "[ . 1 . 2]" 1 1652 1 55 PHE H 1 56 LYS HA . . 5.410 5.254 5.197 5.305 . 0 0 "[ . 1 . 2]" 1 1653 1 55 PHE H 1 56 LYS HB2 . . 5.470 4.505 4.345 4.586 . 0 0 "[ . 1 . 2]" 1 1654 1 55 PHE H 1 56 LYS HG3 . . 5.500 4.818 4.494 5.561 0.061 20 0 "[ . 1 . 2]" 1 1655 1 55 PHE H 1 57 GLU H . . 4.630 4.239 4.137 4.436 . 0 0 "[ . 1 . 2]" 1 1656 1 55 PHE H 1 60 ALA MB . . 4.980 3.383 2.902 3.985 . 0 0 "[ . 1 . 2]" 1 1657 1 55 PHE HA 1 55 PHE QD . . 3.140 2.939 2.801 3.140 . 0 0 "[ . 1 . 2]" 1 1658 1 55 PHE HA 1 55 PHE QE . . 4.730 4.661 4.520 4.743 0.013 3 0 "[ . 1 . 2]" 1 1659 1 55 PHE HA 1 56 LYS HB2 . . 5.500 5.570 5.557 5.582 0.082 10 0 "[ . 1 . 2]" 1 1660 1 55 PHE HA 1 57 GLU H . . 4.880 4.350 4.212 4.556 . 0 0 "[ . 1 . 2]" 1 1661 1 55 PHE HA 1 58 GLY H . . 4.040 3.357 3.145 3.723 . 0 0 "[ . 1 . 2]" 1 1662 1 55 PHE HA 1 58 GLY HA2 . . 4.480 3.621 3.288 4.084 . 0 0 "[ . 1 . 2]" 1 1663 1 55 PHE HA 1 59 LYS H . . 4.520 3.801 3.406 4.384 . 0 0 "[ . 1 . 2]" 1 1664 1 55 PHE HA 1 60 ALA H . . 4.350 3.272 2.903 3.656 . 0 0 "[ . 1 . 2]" 1 1665 1 55 PHE HA 1 60 ALA MB . . 3.760 2.703 2.175 3.315 . 0 0 "[ . 1 . 2]" 1 1666 1 55 PHE HB2 1 56 LYS H . . 4.080 3.004 2.888 3.105 . 0 0 "[ . 1 . 2]" 1 1667 1 55 PHE HB2 1 56 LYS HA . . 5.300 4.771 4.596 4.853 . 0 0 "[ . 1 . 2]" 1 1668 1 55 PHE HB3 1 56 LYS H . . 4.090 3.602 3.461 3.767 . 0 0 "[ . 1 . 2]" 1 1669 1 55 PHE HB3 1 56 LYS HA . . 5.040 4.303 4.148 4.445 . 0 0 "[ . 1 . 2]" 1 1670 1 55 PHE QD 1 56 LYS H . . 4.590 4.636 4.544 4.672 0.082 16 0 "[ . 1 . 2]" 1 1671 1 55 PHE QD 1 60 ALA MB . . 3.870 3.243 2.773 3.731 . 0 0 "[ . 1 . 2]" 1 1672 1 55 PHE QE 1 60 ALA MB . . 4.290 3.516 3.158 3.898 . 0 0 "[ . 1 . 2]" 1 1673 1 55 PHE QE 1 62 GLU HA . . 3.610 2.884 2.276 3.671 0.061 15 0 "[ . 1 . 2]" 1 1674 1 55 PHE QE 1 63 PRO QD . . 4.720 3.074 2.098 3.867 . 0 0 "[ . 1 . 2]" 1 1675 1 55 PHE HZ 1 60 ALA MB . . 4.370 4.129 3.646 4.442 0.072 18 0 "[ . 1 . 2]" 1 1676 1 55 PHE HZ 1 62 GLU HA . . 4.340 2.802 2.511 3.392 . 0 0 "[ . 1 . 2]" 1 1677 1 55 PHE HZ 1 63 PRO HD2 . . 4.530 3.489 2.925 3.917 . 0 0 "[ . 1 . 2]" 1 1678 1 55 PHE HZ 1 63 PRO QD . . 3.740 2.567 2.108 2.938 . 0 0 "[ . 1 . 2]" 1 1679 1 55 PHE HZ 1 63 PRO HD3 . . 4.530 2.699 2.136 3.341 . 0 0 "[ . 1 . 2]" 1 1680 1 55 PHE HZ 1 63 PRO HG2 . . 5.380 5.228 4.683 5.449 0.069 8 0 "[ . 1 . 2]" 1 1681 1 55 PHE HZ 1 63 PRO HG3 . . 4.920 4.407 3.512 4.980 0.060 3 0 "[ . 1 . 2]" 1 1682 1 56 LYS H 1 56 LYS HB2 . . 2.980 2.185 2.084 2.247 . 0 0 "[ . 1 . 2]" 1 1683 1 56 LYS H 1 56 LYS HD2 . . 4.320 4.299 3.846 4.392 0.072 16 0 "[ . 1 . 2]" 1 1684 1 56 LYS H 1 56 LYS HD3 . . 4.300 4.086 3.659 4.358 0.058 3 0 "[ . 1 . 2]" 1 1685 1 56 LYS H 1 56 LYS HG2 . . 4.430 3.936 3.688 4.390 . 0 0 "[ . 1 . 2]" 1 1686 1 56 LYS H 1 56 LYS HG3 . . 3.440 2.748 2.509 3.338 . 0 0 "[ . 1 . 2]" 1 1687 1 56 LYS H 1 57 GLU H . . 3.050 2.616 2.464 2.743 . 0 0 "[ . 1 . 2]" 1 1688 1 56 LYS H 1 57 GLU HB2 . . 4.990 4.885 4.698 5.035 0.045 20 0 "[ . 1 . 2]" 1 1689 1 56 LYS H 1 57 GLU HG2 . . 4.940 4.658 4.099 4.990 0.050 10 0 "[ . 1 . 2]" 1 1690 1 56 LYS H 1 57 GLU HG3 . . 5.140 4.821 4.442 5.171 0.031 3 0 "[ . 1 . 2]" 1 1691 1 56 LYS H 1 58 GLY H . . 3.900 3.781 3.685 3.847 . 0 0 "[ . 1 . 2]" 1 1692 1 56 LYS H 1 58 GLY HA2 . . 5.500 5.518 5.401 5.557 0.057 19 0 "[ . 1 . 2]" 1 1693 1 56 LYS HA 1 56 LYS QE . . 5.000 4.398 3.880 4.798 . 0 0 "[ . 1 . 2]" 1 1694 1 56 LYS HA 1 56 LYS HG2 . . 3.230 2.481 2.266 2.911 . 0 0 "[ . 1 . 2]" 1 1695 1 56 LYS HA 1 56 LYS HG3 . . 3.410 2.681 2.244 2.928 . 0 0 "[ . 1 . 2]" 1 1696 1 56 LYS HB2 1 56 LYS HD2 . . 3.240 3.254 2.940 3.324 0.084 18 0 "[ . 1 . 2]" 1 1697 1 56 LYS HB2 1 57 GLU H . . 2.870 2.765 2.623 2.925 0.055 4 0 "[ . 1 . 2]" 1 1698 1 56 LYS HB2 1 57 GLU HG2 . . 4.200 3.704 3.364 4.039 . 0 0 "[ . 1 . 2]" 1 1699 1 56 LYS HB3 1 56 LYS QE . . 3.470 3.139 2.594 3.528 0.058 4 0 "[ . 1 . 2]" 1 1700 1 56 LYS HB3 1 57 GLU H . . 4.040 3.367 3.069 3.559 . 0 0 "[ . 1 . 2]" 1 1701 1 56 LYS HB3 1 57 GLU HA . . 4.120 4.146 3.965 4.192 0.072 5 0 "[ . 1 . 2]" 1 1702 1 56 LYS HB3 1 57 GLU HG2 . . 4.470 3.877 3.326 4.319 . 0 0 "[ . 1 . 2]" 1 1703 1 56 LYS HD3 1 57 GLU H . . 5.150 5.037 4.761 5.208 0.058 12 0 "[ . 1 . 2]" 1 1704 1 56 LYS QE 1 56 LYS HG2 . . 3.290 2.357 1.954 3.039 . 0 0 "[ . 1 . 2]" 1 1705 1 56 LYS HG2 1 57 GLU H . . 5.190 5.069 4.866 5.175 . 0 0 "[ . 1 . 2]" 1 1706 1 56 LYS HG3 1 57 GLU H . . 5.020 4.615 4.468 4.903 . 0 0 "[ . 1 . 2]" 1 1707 1 57 GLU H 1 57 GLU HB2 . . 3.340 2.548 2.418 2.687 . 0 0 "[ . 1 . 2]" 1 1708 1 57 GLU H 1 57 GLU HB3 . . 3.710 3.609 3.564 3.659 . 0 0 "[ . 1 . 2]" 1 1709 1 57 GLU H 1 57 GLU HG2 . . 3.460 2.481 1.972 2.781 . 0 0 "[ . 1 . 2]" 1 1710 1 57 GLU H 1 57 GLU HG3 . . 3.410 2.811 2.470 3.051 . 0 0 "[ . 1 . 2]" 1 1711 1 57 GLU HA 1 57 GLU HG2 . . 3.130 2.653 2.509 3.020 . 0 0 "[ . 1 . 2]" 1 1712 1 57 GLU HA 1 57 GLU HG3 . . 3.840 3.761 3.612 3.890 0.050 3 0 "[ . 1 . 2]" 1 1713 1 57 GLU HA 1 58 GLY H . . 3.540 3.414 3.355 3.476 . 0 0 "[ . 1 . 2]" 1 1714 1 57 GLU HA 1 58 GLY HA3 . . 5.100 4.635 4.588 4.701 . 0 0 "[ . 1 . 2]" 1 1715 1 57 GLU HB2 1 58 GLY H . . 4.160 3.125 2.887 3.289 . 0 0 "[ . 1 . 2]" 1 1716 1 57 GLU HB2 1 58 GLY HA2 . . 5.500 4.955 4.845 5.075 . 0 0 "[ . 1 . 2]" 1 1717 1 57 GLU HB2 1 58 GLY HA3 . . 5.500 4.998 4.864 5.098 . 0 0 "[ . 1 . 2]" 1 1718 1 57 GLU HB2 1 59 LYS H . . 4.410 2.930 2.647 3.172 . 0 0 "[ . 1 . 2]" 1 1719 1 57 GLU HB2 1 59 LYS HB3 . . 4.470 3.408 3.151 3.939 . 0 0 "[ . 1 . 2]" 1 1720 1 57 GLU HB2 1 59 LYS HG2 . . 4.050 2.552 2.165 2.811 . 0 0 "[ . 1 . 2]" 1 1721 1 57 GLU HB3 1 58 GLY H . . 4.090 4.093 3.918 4.160 0.070 13 0 "[ . 1 . 2]" 1 1722 1 57 GLU HB3 1 58 GLY HA3 . . 5.250 5.238 5.061 5.309 0.059 15 0 "[ . 1 . 2]" 1 1723 1 57 GLU HB3 1 59 LYS HD3 . . 5.480 4.607 3.040 5.303 . 0 0 "[ . 1 . 2]" 1 1724 1 57 GLU HB3 1 59 LYS HG2 . . 4.230 3.783 3.143 4.238 0.008 20 0 "[ . 1 . 2]" 1 1725 1 57 GLU HG2 1 58 GLY H . . 4.730 4.554 4.172 4.751 0.021 10 0 "[ . 1 . 2]" 1 1726 1 57 GLU HG2 1 59 LYS HE2 . . 5.500 4.555 3.630 5.571 0.071 6 0 "[ . 1 . 2]" 1 1727 1 57 GLU HG2 1 59 LYS QE . . 4.840 3.789 3.447 4.676 . 0 0 "[ . 1 . 2]" 1 1728 1 57 GLU HG2 1 59 LYS HE3 . . 5.500 4.273 3.601 5.424 . 0 0 "[ . 1 . 2]" 1 1729 1 57 GLU HG2 1 59 LYS HG2 . . 5.470 5.209 4.473 5.529 0.059 1 0 "[ . 1 . 2]" 1 1730 1 57 GLU HG3 1 58 GLY H . . 4.690 4.702 4.453 4.761 0.071 6 0 "[ . 1 . 2]" 1 1731 1 57 GLU HG3 1 59 LYS HE2 . . 5.500 3.445 2.064 4.978 . 0 0 "[ . 1 . 2]" 1 1732 1 57 GLU HG3 1 59 LYS HE3 . . 5.500 2.849 1.992 4.054 . 0 0 "[ . 1 . 2]" 1 1733 1 57 GLU HG3 1 59 LYS HG2 . . 4.980 3.956 3.547 4.284 . 0 0 "[ . 1 . 2]" 1 1734 1 58 GLY H 1 58 GLY HA2 . . 2.750 2.303 2.274 2.333 . 0 0 "[ . 1 . 2]" 1 1735 1 58 GLY H 1 59 LYS H . . 3.240 2.555 2.330 2.720 . 0 0 "[ . 1 . 2]" 1 1736 1 58 GLY H 1 59 LYS HB3 . . 4.900 4.841 4.547 4.960 0.060 15 0 "[ . 1 . 2]" 1 1737 1 58 GLY H 1 59 LYS HG2 . . 4.850 4.302 3.698 4.613 . 0 0 "[ . 1 . 2]" 1 1738 1 58 GLY HA2 1 59 LYS H . . 3.050 2.938 2.771 3.083 0.033 16 0 "[ . 1 . 2]" 1 1739 1 58 GLY HA2 1 59 LYS HA . . 5.500 4.562 4.472 4.654 . 0 0 "[ . 1 . 2]" 1 1740 1 58 GLY HA2 1 59 LYS HB3 . . 5.500 5.259 5.046 5.392 . 0 0 "[ . 1 . 2]" 1 1741 1 58 GLY HA2 1 59 LYS HG2 . . 5.370 5.296 5.005 5.425 0.055 4 0 "[ . 1 . 2]" 1 1742 1 58 GLY HA2 1 60 ALA H . . 4.460 3.911 3.649 4.254 . 0 0 "[ . 1 . 2]" 1 1743 1 58 GLY HA3 1 59 LYS HA . . 5.500 4.597 4.542 4.643 . 0 0 "[ . 1 . 2]" 1 1744 1 58 GLY HA3 1 59 LYS HB3 . . 5.500 4.973 4.771 5.119 . 0 0 "[ . 1 . 2]" 1 1745 1 59 LYS H 1 59 LYS HB2 . . 3.890 3.818 3.744 3.918 0.028 9 0 "[ . 1 . 2]" 1 1746 1 59 LYS H 1 59 LYS HB3 . . 2.940 2.887 2.732 2.995 0.055 20 0 "[ . 1 . 2]" 1 1747 1 59 LYS H 1 59 LYS HD2 . . 5.280 4.957 4.795 5.215 . 0 0 "[ . 1 . 2]" 1 1748 1 59 LYS H 1 59 LYS HD3 . . 5.500 4.888 4.385 5.176 . 0 0 "[ . 1 . 2]" 1 1749 1 59 LYS H 1 59 LYS HG2 . . 3.330 2.401 2.088 2.652 . 0 0 "[ . 1 . 2]" 1 1750 1 59 LYS H 1 60 ALA MB . . 4.440 3.788 3.594 3.991 . 0 0 "[ . 1 . 2]" 1 1751 1 59 LYS HA 1 59 LYS HB2 . . 3.010 2.335 2.292 2.433 . 0 0 "[ . 1 . 2]" 1 1752 1 59 LYS HA 1 59 LYS HB3 . . 2.970 2.554 2.458 2.593 . 0 0 "[ . 1 . 2]" 1 1753 1 59 LYS HA 1 59 LYS HG2 . . 4.170 3.815 3.772 3.895 . 0 0 "[ . 1 . 2]" 1 1754 1 59 LYS HA 1 60 ALA H . . 3.510 3.468 3.356 3.555 0.045 9 0 "[ . 1 . 2]" 1 1755 1 59 LYS HA 1 60 ALA MB . . 5.090 4.964 4.862 5.054 . 0 0 "[ . 1 . 2]" 1 1756 1 59 LYS HB2 1 60 ALA H . . 4.260 4.278 4.186 4.325 0.065 12 0 "[ . 1 . 2]" 1 1757 1 59 LYS HB3 1 59 LYS QE . . 4.620 2.718 2.137 4.030 . 0 0 "[ . 1 . 2]" 1 1758 1 59 LYS HB3 1 60 ALA H . . 4.220 4.164 4.034 4.284 0.064 3 0 "[ . 1 . 2]" 1 1759 1 59 LYS HD2 1 60 ALA HA . . 5.060 5.125 5.079 5.138 0.078 6 0 "[ . 1 . 2]" 1 1760 1 59 LYS QE 1 59 LYS HG2 . . 3.250 2.215 2.048 2.447 . 0 0 "[ . 1 . 2]" 1 1761 1 59 LYS HE2 1 59 LYS HG2 . . 3.770 2.803 2.074 3.621 . 0 0 "[ . 1 . 2]" 1 1762 1 59 LYS HE3 1 59 LYS HG2 . . 3.770 2.525 2.155 3.501 . 0 0 "[ . 1 . 2]" 1 1763 1 59 LYS HG2 1 60 ALA H . . 4.320 2.921 2.616 3.294 . 0 0 "[ . 1 . 2]" 1 1764 1 59 LYS HG3 1 60 ALA H . . 4.590 3.166 2.921 3.415 . 0 0 "[ . 1 . 2]" 1 1765 1 59 LYS HG3 1 60 ALA HA . . 3.320 3.231 2.983 3.365 0.045 3 0 "[ . 1 . 2]" 1 1766 1 60 ALA H 1 60 ALA HA . . 2.850 2.840 2.788 2.897 0.047 11 0 "[ . 1 . 2]" 1 1767 1 60 ALA H 1 60 ALA MB . . 2.730 2.212 2.144 2.295 . 0 0 "[ . 1 . 2]" 1 1768 1 60 ALA H 1 61 GLN H . . 4.710 4.597 4.480 4.651 . 0 0 "[ . 1 . 2]" 1 1769 1 60 ALA HA 1 61 GLN H . . 2.650 2.322 2.167 2.563 . 0 0 "[ . 1 . 2]" 1 1770 1 60 ALA HA 1 61 GLN QB . . 4.970 4.427 4.135 4.572 . 0 0 "[ . 1 . 2]" 1 1771 1 60 ALA HA 1 61 GLN QG . . 4.380 3.847 3.350 4.468 0.088 11 0 "[ . 1 . 2]" 1 1772 1 60 ALA MB 1 61 GLN H . . 3.110 2.502 2.181 3.125 0.015 14 0 "[ . 1 . 2]" 1 1773 1 60 ALA MB 1 61 GLN HA . . 4.600 4.192 4.004 4.368 . 0 0 "[ . 1 . 2]" 1 1774 1 60 ALA MB 1 61 GLN QG . . 4.140 4.077 3.442 4.248 0.108 12 0 "[ . 1 . 2]" 1 1775 1 60 ALA MB 1 62 GLU H . . 4.730 4.266 3.478 4.823 0.093 4 0 "[ . 1 . 2]" 1 1776 1 61 GLN H 1 61 GLN HB2 . . 3.770 3.062 2.335 3.790 0.020 15 0 "[ . 1 . 2]" 1 1777 1 61 GLN H 1 61 GLN QB . . 3.110 2.601 2.305 2.920 . 0 0 "[ . 1 . 2]" 1 1778 1 61 GLN H 1 61 GLN HB3 . . 3.770 3.252 2.675 3.688 . 0 0 "[ . 1 . 2]" 1 1779 1 61 GLN H 1 61 GLN QG . . 3.190 2.386 1.956 2.817 . 0 0 "[ . 1 . 2]" 1 1780 1 61 GLN HA 1 61 GLN HG2 . . 4.240 3.285 2.272 4.247 0.007 17 0 "[ . 1 . 2]" 1 1781 1 61 GLN HA 1 61 GLN QG . . 3.580 2.979 2.233 3.590 0.010 5 0 "[ . 1 . 2]" 1 1782 1 61 GLN HA 1 61 GLN HG3 . . 4.240 3.607 3.048 4.287 0.047 2 0 "[ . 1 . 2]" 1 1783 1 61 GLN HA 1 62 GLU H . . 2.540 2.212 2.077 2.349 . 0 0 "[ . 1 . 2]" 1 1784 1 61 GLN QB 1 62 GLU H . . 3.850 3.583 3.014 3.862 0.012 13 0 "[ . 1 . 2]" 1 1785 1 61 GLN HB2 1 62 GLU H . . 4.590 4.039 3.107 4.560 . 0 0 "[ . 1 . 2]" 1 1786 1 61 GLN HB3 1 62 GLU H . . 4.590 4.179 3.574 4.492 . 0 0 "[ . 1 . 2]" 1 1787 1 62 GLU H 1 62 GLU HB2 . . 3.720 3.197 2.229 3.693 . 0 0 "[ . 1 . 2]" 1 1788 1 62 GLU H 1 62 GLU QB . . 2.870 2.389 2.207 2.725 . 0 0 "[ . 1 . 2]" 1 1789 1 62 GLU H 1 62 GLU HB3 . . 3.720 2.785 2.300 3.565 . 0 0 "[ . 1 . 2]" 1 1790 1 62 GLU H 1 62 GLU QG . . 3.260 2.246 1.930 2.907 . 0 0 "[ . 1 . 2]" 1 1791 1 62 GLU H 1 63 PRO HD2 . . 5.000 4.913 4.743 4.998 . 0 0 "[ . 1 . 2]" 1 1792 1 62 GLU H 1 63 PRO QD . . 4.400 4.433 4.355 4.458 0.058 13 0 "[ . 1 . 2]" 1 1793 1 62 GLU H 1 63 PRO HD3 . . 5.000 5.047 4.972 5.071 0.071 2 0 "[ . 1 . 2]" 1 1794 1 62 GLU HA 1 62 GLU HG2 . . 3.920 3.376 2.184 3.960 0.040 11 0 "[ . 1 . 2]" 1 1795 1 62 GLU HA 1 62 GLU QG . . 3.400 3.050 2.149 3.416 0.016 14 0 "[ . 1 . 2]" 1 1796 1 62 GLU HA 1 62 GLU HG3 . . 3.920 3.576 2.489 3.889 . 0 0 "[ . 1 . 2]" 1 1797 1 62 GLU HA 1 63 PRO HD2 . . 2.770 2.626 2.295 2.811 0.041 9 0 "[ . 1 . 2]" 1 1798 1 62 GLU HA 1 63 PRO HD3 . . 2.770 2.341 2.249 2.395 . 0 0 "[ . 1 . 2]" 1 1799 1 62 GLU QB 1 63 PRO QD . . 2.740 2.135 2.010 2.593 . 0 0 "[ . 1 . 2]" 1 1800 1 62 GLU QG 1 63 PRO QD . . 3.810 3.357 2.536 3.884 0.074 6 0 "[ . 1 . 2]" 1 1801 1 63 PRO HA 1 63 PRO HB3 . . 2.980 2.323 2.269 2.352 . 0 0 "[ . 1 . 2]" 1 1802 1 63 PRO HA 1 63 PRO HG2 . . 4.120 3.830 3.720 3.867 . 0 0 "[ . 1 . 2]" 1 1803 1 63 PRO HA 1 64 SER H . . 2.720 2.582 2.472 2.763 0.043 9 0 "[ . 1 . 2]" 1 1804 1 63 PRO HB2 1 63 PRO HD2 . . 4.270 4.102 4.076 4.156 . 0 0 "[ . 1 . 2]" 1 1805 1 63 PRO HB2 1 63 PRO HD3 . . 4.270 3.939 3.856 3.985 . 0 0 "[ . 1 . 2]" 1 1806 1 63 PRO HB2 1 64 SER H . . 3.710 2.262 2.032 2.342 . 0 0 "[ . 1 . 2]" 1 1807 1 63 PRO HB2 1 64 SER HA . . 4.790 4.219 4.101 4.351 . 0 0 "[ . 1 . 2]" 1 1808 1 63 PRO HB3 1 63 PRO HD2 . . 3.950 3.823 3.767 3.856 . 0 0 "[ . 1 . 2]" 1 1809 1 63 PRO HB3 1 63 PRO HD3 . . 3.950 2.903 2.728 2.994 . 0 0 "[ . 1 . 2]" 1 1810 1 63 PRO HB3 1 64 SER H . . 3.440 3.400 3.267 3.493 0.053 13 0 "[ . 1 . 2]" 1 1811 1 63 PRO HG2 1 64 SER H . . 4.700 3.993 3.746 4.110 . 0 0 "[ . 1 . 2]" 1 1812 1 63 PRO HG2 1 64 SER HA . . 4.540 4.531 4.310 4.601 0.061 16 0 "[ . 1 . 2]" 1 1813 1 63 PRO HG3 1 64 SER H . . 4.780 4.793 4.569 4.853 0.073 7 0 "[ . 1 . 2]" 1 1814 1 64 SER H 1 64 SER QB . . 2.970 2.773 2.659 3.065 0.095 6 0 "[ . 1 . 2]" 1 stop_ save_
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