NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
558002 | 2lp2 | 18230 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2lp2 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 2798 _Distance_constraint_stats_list.Viol_count 6861 _Distance_constraint_stats_list.Viol_total 3963.934 _Distance_constraint_stats_list.Viol_max 0.849 _Distance_constraint_stats_list.Viol_rms 0.0177 _Distance_constraint_stats_list.Viol_average_all_restraints 0.0035 _Distance_constraint_stats_list.Viol_average_violations_only 0.0289 _Distance_constraint_stats_list.Cutoff_violation_report 0.500 _Distance_constraint_stats_list.Details ; Description of the tags in this list: * 1 * Administrative tag * 2 * Administrative tag * 3 * Administrative tag * 4 * ID of the restraint list. * 5 * Number of restraints in list. * 6 * Number of violated restraints (each model violation is used). * 7 * Sum of violations in Angstrom. * 8 * Maximum violation of a restraint without averaging in any way. * 9 * Rms of violations over all restraints. * 10 * Average violation over all restraints. * 11 * Average violation over violated restraints. This violation is averaged over only those models in which the restraint is violated. These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998). * 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table. * 13 * This tag Description of the tags in the per residue table below: * 1 * Chain identifier (can be absent if none defined) * 2 * Residue number * 3 * Residue name * 4 * Maximum violation in ensemble of models (without any averaging) * 5 * Model number with the maximum violation * 6 * Number of models with a violation above cutoff * 7 * List of models (1 character per model) with a violation above cutoff. An '*' marks a violation above the cutoff. A '+' indicates the largest violation above the cutoff and a '-' marks the smallest violation over cutoff. For models 5, 15, 25,... a ' ' is replaced by a '.'. For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1. * 8 * Administrative tag * 9 * Administrative tag Description of the tags in the per restraint table below: * 1 * Restraint ID within restraint list. First node, FIRST member, first atom's: * 2 * Chain identifier (can be absent if none defined) * 3 * Residue number * 4 * Residue name * 5 * Name of (pseudo-)atom First node, SECOND member, first atom's: * 6 * Chain identifier (can be absent if none defined) * 7 * Residue number * 8 * Residue name * 9 * Name of (pseudo-)atom FIRST node's: * 10 * Target distance value (Angstrom) * 11 * Lower bound distance (Angstrom) * 12 * Upper bound distance (Angstrom) * 13 * Average distance in ensemble of models * 14 * Minimum distance in ensemble of models * 15 * Maximum distance in ensemble of models * 16 * Maximum violation (without any averaging) * 17 * Model number with the maximum violation * 18 * Number of models with a violation above cutoff * 19 * List of models with a violation above cutoff. See description above. * 20 * Administrative tag * 21 * Administrative tag ; loop_ _Distance_constraint_stats_per_res.Atom_entity_assembly_ID _Distance_constraint_stats_per_res.Atom_comp_index_ID _Distance_constraint_stats_per_res.Atom_comp_ID _Distance_constraint_stats_per_res.Total_violation _Distance_constraint_stats_per_res.Max_violation _Distance_constraint_stats_per_res.Max_violation_model_number _Distance_constraint_stats_per_res.Over_cutoff_viol_count _Distance_constraint_stats_per_res.Over_cutoff_viol_per_model 1 2 SER 0.000 0.000 . 0 "[ . 1 . 2]" 1 3 GLU 3.350 0.183 5 0 "[ . 1 . 2]" 1 4 LEU 7.018 0.153 1 0 "[ . 1 . 2]" 1 5 GLU 2.132 0.117 19 0 "[ . 1 . 2]" 1 6 THR 0.001 0.001 19 0 "[ . 1 . 2]" 1 7 ALA 1.901 0.089 3 0 "[ . 1 . 2]" 1 8 MET 5.022 0.112 17 0 "[ . 1 . 2]" 1 9 GLU 0.001 0.001 19 0 "[ . 1 . 2]" 1 10 THR 4.609 0.095 9 0 "[ . 1 . 2]" 1 11 LEU 3.165 0.059 15 0 "[ . 1 . 2]" 1 12 ILE 2.377 0.069 17 0 "[ . 1 . 2]" 1 13 ASN 0.145 0.011 20 0 "[ . 1 . 2]" 1 14 VAL 6.520 0.182 5 0 "[ . 1 . 2]" 1 15 PHE 1.684 0.048 13 0 "[ . 1 . 2]" 1 16 HIS 1.638 0.085 20 0 "[ . 1 . 2]" 1 17 ALA 1.619 0.125 6 0 "[ . 1 . 2]" 1 18 HIS 2.657 0.134 6 0 "[ . 1 . 2]" 1 19 SER 0.768 0.048 13 0 "[ . 1 . 2]" 1 20 GLY 1.057 0.038 20 0 "[ . 1 . 2]" 1 21 LYS 1.706 0.068 6 0 "[ . 1 . 2]" 1 22 GLU 0.412 0.034 3 0 "[ . 1 . 2]" 1 23 GLY 0.000 0.000 . 0 "[ . 1 . 2]" 1 25 LYS 2.737 0.079 5 0 "[ . 1 . 2]" 1 26 TYR 0.128 0.063 5 0 "[ . 1 . 2]" 1 27 LYS 1.894 0.057 15 0 "[ . 1 . 2]" 1 28 LEU 10.012 0.849 8 3 "[ *. + 1 - . 2]" 1 29 SER 0.679 0.046 19 0 "[ . 1 . 2]" 1 30 LYS 2.357 0.088 6 0 "[ . 1 . 2]" 1 31 LYS 2.328 0.101 20 0 "[ . 1 . 2]" 1 32 GLU 1.967 0.101 20 0 "[ . 1 . 2]" 1 33 LEU 5.650 0.118 20 0 "[ . 1 . 2]" 1 34 LYS 1.113 0.028 14 0 "[ . 1 . 2]" 1 35 GLU 0.000 0.000 . 0 "[ . 1 . 2]" 1 36 LEU 5.870 0.613 4 3 "[ +. * 1 - . 2]" 1 37 LEU 2.211 0.058 5 0 "[ . 1 . 2]" 1 38 GLN 0.210 0.018 20 0 "[ . 1 . 2]" 1 39 THR 0.076 0.010 18 0 "[ . 1 . 2]" 1 40 GLU 0.991 0.062 10 0 "[ . 1 . 2]" 1 41 LEU 3.220 0.118 19 0 "[ . 1 . 2]" 1 42 SER 0.856 0.049 9 0 "[ . 1 . 2]" 1 43 GLY 0.000 0.000 . 0 "[ . 1 . 2]" 1 44 PHE 0.676 0.056 14 0 "[ . 1 . 2]" 1 45 LEU 2.795 0.052 4 0 "[ . 1 . 2]" 1 46 ASP 0.711 0.052 4 0 "[ . 1 . 2]" 1 47 ALA 0.300 0.019 20 0 "[ . 1 . 2]" 1 48 GLN 1.783 0.048 18 0 "[ . 1 . 2]" 1 49 LYS 0.318 0.032 17 0 "[ . 1 . 2]" 1 50 ASP 0.706 0.032 19 0 "[ . 1 . 2]" 1 51 VAL 1.473 0.032 19 0 "[ . 1 . 2]" 1 52 ASP 0.103 0.011 20 0 "[ . 1 . 2]" 1 53 ALA 1.668 0.048 18 0 "[ . 1 . 2]" 1 54 VAL 1.408 0.040 15 0 "[ . 1 . 2]" 1 55 ASP 0.439 0.040 15 0 "[ . 1 . 2]" 1 56 LYS 0.016 0.004 4 0 "[ . 1 . 2]" 1 57 VAL 0.325 0.030 20 0 "[ . 1 . 2]" 1 58 MET 1.111 0.035 8 0 "[ . 1 . 2]" 1 59 LYS 2.395 0.099 8 0 "[ . 1 . 2]" 1 60 GLU 0.266 0.018 17 0 "[ . 1 . 2]" 1 61 LEU 3.757 0.088 1 0 "[ . 1 . 2]" 1 62 ASP 0.055 0.020 9 0 "[ . 1 . 2]" 1 63 GLU 2.197 0.102 9 0 "[ . 1 . 2]" 1 64 ASN 1.828 0.102 9 0 "[ . 1 . 2]" 1 65 GLY 0.147 0.025 4 0 "[ . 1 . 2]" 1 66 ASP 0.379 0.025 4 0 "[ . 1 . 2]" 1 67 GLY 0.029 0.012 8 0 "[ . 1 . 2]" 1 68 GLU 1.648 0.064 2 0 "[ . 1 . 2]" 1 69 VAL 2.542 0.076 20 0 "[ . 1 . 2]" 1 70 ASP 1.119 0.057 15 0 "[ . 1 . 2]" 1 71 PHE 1.448 0.036 14 0 "[ . 1 . 2]" 1 72 GLN 3.638 0.075 13 0 "[ . 1 . 2]" 1 73 GLU 0.996 0.043 18 0 "[ . 1 . 2]" 1 74 TYR 7.238 0.849 8 3 "[ *. + 1 - . 2]" 1 75 VAL 7.150 0.179 12 0 "[ . 1 . 2]" 1 76 VAL 2.132 0.081 16 0 "[ . 1 . 2]" 1 77 LEU 4.011 0.711 12 3 "[ *. - 1 + . 2]" 1 78 VAL 4.134 0.113 12 0 "[ . 1 . 2]" 1 79 ALA 4.819 0.180 12 0 "[ . 1 . 2]" 1 80 ALA 2.924 0.081 16 0 "[ . 1 . 2]" 1 81 LEU 0.432 0.023 19 0 "[ . 1 . 2]" 1 82 THR 2.768 0.101 9 0 "[ . 1 . 2]" 1 83 VAL 5.823 0.058 16 0 "[ . 1 . 2]" 1 84 ALA 1.001 0.034 7 0 "[ . 1 . 2]" 1 85 CYS 0.632 0.045 10 0 "[ . 1 . 2]" 1 86 ASN 0.020 0.009 13 0 "[ . 1 . 2]" 1 87 ASN 0.810 0.059 3 0 "[ . 1 . 2]" 1 88 PHE 0.645 0.082 2 0 "[ . 1 . 2]" 1 89 PHE 0.000 0.000 . 0 "[ . 1 . 2]" 1 90 TRP 1.281 0.083 5 0 "[ . 1 . 2]" 1 91 GLU 1.956 0.082 2 0 "[ . 1 . 2]" 1 93 SER 0.041 0.011 18 0 "[ . 1 . 2]" 2 2 SER 0.000 0.000 . 0 "[ . 1 . 2]" 2 3 GLU 3.346 0.182 5 0 "[ . 1 . 2]" 2 4 LEU 6.998 0.153 1 0 "[ . 1 . 2]" 2 5 GLU 2.125 0.118 19 0 "[ . 1 . 2]" 2 6 THR 0.000 0.000 . 0 "[ . 1 . 2]" 2 7 ALA 1.948 0.092 3 0 "[ . 1 . 2]" 2 8 MET 4.989 0.113 12 0 "[ . 1 . 2]" 2 9 GLU 0.000 0.000 . 0 "[ . 1 . 2]" 2 10 THR 3.568 0.093 9 0 "[ . 1 . 2]" 2 11 LEU 2.073 0.055 18 0 "[ . 1 . 2]" 2 12 ILE 2.363 0.070 17 0 "[ . 1 . 2]" 2 13 ASN 0.139 0.011 20 0 "[ . 1 . 2]" 2 14 VAL 6.512 0.183 5 0 "[ . 1 . 2]" 2 15 PHE 1.669 0.048 13 0 "[ . 1 . 2]" 2 16 HIS 1.639 0.084 20 0 "[ . 1 . 2]" 2 17 ALA 1.613 0.130 6 0 "[ . 1 . 2]" 2 18 HIS 2.208 0.084 20 0 "[ . 1 . 2]" 2 19 SER 0.773 0.048 13 0 "[ . 1 . 2]" 2 20 GLY 1.062 0.038 4 0 "[ . 1 . 2]" 2 21 LYS 1.723 0.068 6 0 "[ . 1 . 2]" 2 22 GLU 0.411 0.033 1 0 "[ . 1 . 2]" 2 23 GLY 0.000 0.000 . 0 "[ . 1 . 2]" 2 25 LYS 2.738 0.078 5 0 "[ . 1 . 2]" 2 26 TYR 0.127 0.064 9 0 "[ . 1 . 2]" 2 27 LYS 1.785 0.062 19 0 "[ . 1 . 2]" 2 28 LEU 9.853 0.848 8 3 "[ *. + 1 - . 2]" 2 29 SER 0.649 0.042 17 0 "[ . 1 . 2]" 2 30 LYS 2.356 0.087 6 0 "[ . 1 . 2]" 2 31 LYS 2.724 0.101 20 0 "[ . 1 . 2]" 2 32 GLU 2.376 0.101 20 0 "[ . 1 . 2]" 2 33 LEU 5.625 0.118 20 0 "[ . 1 . 2]" 2 34 LYS 1.111 0.027 14 0 "[ . 1 . 2]" 2 35 GLU 0.000 0.000 . 0 "[ . 1 . 2]" 2 36 LEU 5.515 0.611 4 3 "[ +. * 1 - . 2]" 2 37 LEU 2.213 0.058 5 0 "[ . 1 . 2]" 2 38 GLN 0.207 0.018 1 0 "[ . 1 . 2]" 2 39 THR 0.078 0.010 1 0 "[ . 1 . 2]" 2 40 GLU 0.987 0.064 10 0 "[ . 1 . 2]" 2 41 LEU 3.219 0.117 19 0 "[ . 1 . 2]" 2 42 SER 0.858 0.051 9 0 "[ . 1 . 2]" 2 43 GLY 0.000 0.000 . 0 "[ . 1 . 2]" 2 44 PHE 0.659 0.056 14 0 "[ . 1 . 2]" 2 45 LEU 2.804 0.052 8 0 "[ . 1 . 2]" 2 46 ASP 0.708 0.052 8 0 "[ . 1 . 2]" 2 47 ALA 0.300 0.019 20 0 "[ . 1 . 2]" 2 48 GLN 1.782 0.048 18 0 "[ . 1 . 2]" 2 49 LYS 0.320 0.032 17 0 "[ . 1 . 2]" 2 50 ASP 0.708 0.032 18 0 "[ . 1 . 2]" 2 51 VAL 1.481 0.032 18 0 "[ . 1 . 2]" 2 52 ASP 0.107 0.012 20 0 "[ . 1 . 2]" 2 53 ALA 1.666 0.048 18 0 "[ . 1 . 2]" 2 54 VAL 1.405 0.040 15 0 "[ . 1 . 2]" 2 55 ASP 0.438 0.040 15 0 "[ . 1 . 2]" 2 56 LYS 0.016 0.004 4 0 "[ . 1 . 2]" 2 57 VAL 0.328 0.031 20 0 "[ . 1 . 2]" 2 58 MET 1.125 0.034 15 0 "[ . 1 . 2]" 2 59 LYS 2.396 0.099 8 0 "[ . 1 . 2]" 2 60 GLU 0.260 0.018 17 0 "[ . 1 . 2]" 2 61 LEU 3.759 0.087 1 0 "[ . 1 . 2]" 2 62 ASP 0.054 0.020 9 0 "[ . 1 . 2]" 2 63 GLU 2.180 0.102 9 0 "[ . 1 . 2]" 2 64 ASN 1.824 0.102 9 0 "[ . 1 . 2]" 2 65 GLY 0.150 0.026 4 0 "[ . 1 . 2]" 2 66 ASP 0.383 0.026 4 0 "[ . 1 . 2]" 2 67 GLY 0.029 0.012 8 0 "[ . 1 . 2]" 2 68 GLU 1.764 0.064 2 0 "[ . 1 . 2]" 2 69 VAL 2.534 0.076 20 0 "[ . 1 . 2]" 2 70 ASP 0.390 0.041 20 0 "[ . 1 . 2]" 2 71 PHE 1.423 0.037 14 0 "[ . 1 . 2]" 2 72 GLN 3.651 0.076 13 0 "[ . 1 . 2]" 2 73 GLU 0.992 0.043 18 0 "[ . 1 . 2]" 2 74 TYR 7.238 0.848 8 3 "[ *. + 1 - . 2]" 2 75 VAL 7.164 0.180 12 0 "[ . 1 . 2]" 2 76 VAL 2.140 0.081 16 0 "[ . 1 . 2]" 2 77 LEU 4.018 0.711 12 3 "[ *. - 1 + . 2]" 2 78 VAL 4.134 0.112 17 0 "[ . 1 . 2]" 2 79 ALA 4.818 0.179 12 0 "[ . 1 . 2]" 2 80 ALA 2.916 0.081 16 0 "[ . 1 . 2]" 2 81 LEU 1.478 0.056 16 0 "[ . 1 . 2]" 2 82 THR 2.746 0.099 9 0 "[ . 1 . 2]" 2 83 VAL 5.867 0.058 14 0 "[ . 1 . 2]" 2 84 ALA 0.994 0.034 7 0 "[ . 1 . 2]" 2 85 CYS 0.624 0.045 10 0 "[ . 1 . 2]" 2 86 ASN 0.019 0.008 13 0 "[ . 1 . 2]" 2 87 ASN 0.806 0.060 3 0 "[ . 1 . 2]" 2 88 PHE 0.642 0.082 2 0 "[ . 1 . 2]" 2 89 PHE 0.000 0.000 . 0 "[ . 1 . 2]" 2 90 TRP 1.268 0.082 5 0 "[ . 1 . 2]" 2 91 GLU 1.945 0.082 2 0 "[ . 1 . 2]" 2 93 SER 0.040 0.010 18 0 "[ . 1 . 2]" stop_ loop_ _Distance_constraint_stats.Restraint_ID _Distance_constraint_stats.Atom_1_entity_assembly_ID _Distance_constraint_stats.Atom_1_comp_index_ID _Distance_constraint_stats.Atom_1_comp_ID _Distance_constraint_stats.Atom_1_ID _Distance_constraint_stats.Atom_2_entity_assembly_ID _Distance_constraint_stats.Atom_2_comp_index_ID _Distance_constraint_stats.Atom_2_comp_ID _Distance_constraint_stats.Atom_2_ID _Distance_constraint_stats.Node_1_distance_val _Distance_constraint_stats.Node_1_distance_lower_bound_val _Distance_constraint_stats.Node_1_distance_upper_bound_val _Distance_constraint_stats.Distance_average _Distance_constraint_stats.Distance_minimum _Distance_constraint_stats.Distance_maximum _Distance_constraint_stats.Max_violation _Distance_constraint_stats.Max_violation_model_number _Distance_constraint_stats.Over_cutoff_violation_count _Distance_constraint_stats.Over_cutoff_viol_per_model _Distance_constraint_stats.Distance_constraint_stats_ID 1 1 25 LYS QB 1 25 LYS QG 2.830 2.200 2.830 2.132 2.121 2.135 0.079 5 0 "[ . 1 . 2]" 1 2 2 25 LYS QB 2 25 LYS QG 2.830 2.200 2.830 2.132 2.122 2.135 0.078 5 0 "[ . 1 . 2]" 1 3 1 61 LEU HA 1 61 LEU QD 2.880 2.200 2.880 2.123 2.112 2.134 0.088 1 0 "[ . 1 . 2]" 1 4 2 61 LEU HA 2 61 LEU QD 2.880 2.200 2.880 2.123 2.113 2.134 0.087 1 0 "[ . 1 . 2]" 1 5 1 14 VAL HA 1 14 VAL MG1 2.900 2.200 2.900 2.325 2.292 2.452 . 0 0 "[ . 1 . 2]" 1 6 1 17 ALA H 1 17 ALA MB 2.900 2.200 2.900 2.228 2.199 2.246 0.001 5 0 "[ . 1 . 2]" 1 7 1 21 LYS HD2 1 21 LYS HG3 2.900 2.200 2.900 2.426 2.410 2.439 . 0 0 "[ . 1 . 2]" 1 8 1 30 LYS HA 1 58 MET ME 2.900 2.200 2.900 2.665 2.291 2.902 0.002 6 0 "[ . 1 . 2]" 1 9 1 31 LYS HA 1 31 LYS HB2 2.900 2.200 2.900 2.424 2.413 2.451 . 0 0 "[ . 1 . 2]" 1 10 1 33 LEU QD 1 58 MET ME 2.900 2.200 2.900 2.574 2.194 2.897 0.006 3 0 "[ . 1 . 2]" 1 11 1 37 LEU HB2 1 37 LEU MD2 2.900 2.200 2.900 2.525 2.493 2.567 . 0 0 "[ . 1 . 2]" 1 12 1 39 THR HA 1 39 THR MG 2.900 2.200 2.900 2.414 2.397 2.425 . 0 0 "[ . 1 . 2]" 1 13 1 41 LEU HA 1 41 LEU MD2 2.900 2.200 2.900 2.145 2.131 2.154 0.069 5 0 "[ . 1 . 2]" 1 14 1 41 LEU HB3 1 41 LEU MD2 2.900 2.200 2.900 2.399 2.362 2.441 . 0 0 "[ . 1 . 2]" 1 15 1 57 VAL HA 1 57 VAL MG1 2.900 2.200 2.900 2.369 2.347 2.397 . 0 0 "[ . 1 . 2]" 1 16 1 58 MET ME 1 68 GLU HA 2.900 2.200 2.900 2.697 2.339 2.916 0.016 20 0 "[ . 1 . 2]" 1 17 1 59 LYS H 1 59 LYS HB2 2.900 2.200 2.900 2.549 2.507 2.598 . 0 0 "[ . 1 . 2]" 1 18 1 63 GLU HB3 1 63 GLU HG2 2.900 2.200 2.900 2.445 2.432 2.466 . 0 0 "[ . 1 . 2]" 1 19 1 65 GLY H 1 65 GLY HA2 2.900 2.200 2.900 2.340 2.317 2.375 . 0 0 "[ . 1 . 2]" 1 20 1 72 GLN H 1 72 GLN HB2 2.900 2.200 2.900 2.463 2.456 2.469 . 0 0 "[ . 1 . 2]" 1 21 1 72 GLN HB3 1 72 GLN HG2 2.900 2.200 2.900 2.451 2.447 2.456 . 0 0 "[ . 1 . 2]" 1 22 1 76 VAL HA 1 76 VAL MG1 2.900 2.200 2.900 2.315 2.299 2.326 . 0 0 "[ . 1 . 2]" 1 23 1 81 LEU HA 1 81 LEU MD1 2.900 2.200 2.900 2.268 2.177 2.528 0.023 19 0 "[ . 1 . 2]" 1 24 2 14 VAL HA 2 14 VAL MG1 2.900 2.200 2.900 2.325 2.292 2.451 . 0 0 "[ . 1 . 2]" 1 25 2 17 ALA H 2 17 ALA MB 2.900 2.200 2.900 2.228 2.199 2.247 0.001 5 0 "[ . 1 . 2]" 1 26 2 21 LYS HD2 2 21 LYS HG3 2.900 2.200 2.900 2.426 2.410 2.439 . 0 0 "[ . 1 . 2]" 1 27 2 30 LYS HA 2 58 MET ME 2.900 2.200 2.900 2.665 2.290 2.901 0.001 6 0 "[ . 1 . 2]" 1 28 2 31 LYS HA 2 31 LYS HB2 2.900 2.200 2.900 2.424 2.414 2.450 . 0 0 "[ . 1 . 2]" 1 29 2 33 LEU QD 2 58 MET ME 2.900 2.200 2.900 2.574 2.195 2.897 0.005 3 0 "[ . 1 . 2]" 1 30 2 37 LEU HB2 2 37 LEU MD2 2.900 2.200 2.900 2.525 2.492 2.567 . 0 0 "[ . 1 . 2]" 1 31 2 39 THR HA 2 39 THR MG 2.900 2.200 2.900 2.413 2.397 2.425 . 0 0 "[ . 1 . 2]" 1 32 2 41 LEU HA 2 41 LEU MD2 2.900 2.200 2.900 2.145 2.131 2.154 0.069 5 0 "[ . 1 . 2]" 1 33 2 41 LEU HB3 2 41 LEU MD2 2.900 2.200 2.900 2.399 2.362 2.441 . 0 0 "[ . 1 . 2]" 1 34 2 57 VAL HA 2 57 VAL MG1 2.900 2.200 2.900 2.369 2.347 2.397 . 0 0 "[ . 1 . 2]" 1 35 2 58 MET ME 2 68 GLU HA 2.900 2.200 2.900 2.697 2.339 2.916 0.016 20 0 "[ . 1 . 2]" 1 36 2 59 LYS H 2 59 LYS HB2 2.900 2.200 2.900 2.549 2.507 2.598 . 0 0 "[ . 1 . 2]" 1 37 2 63 GLU HB3 2 63 GLU HG2 2.900 2.200 2.900 2.445 2.431 2.466 . 0 0 "[ . 1 . 2]" 1 38 2 65 GLY H 2 65 GLY HA2 2.900 2.200 2.900 2.340 2.317 2.374 . 0 0 "[ . 1 . 2]" 1 39 2 72 GLN H 2 72 GLN HB2 2.900 2.200 2.900 2.463 2.457 2.470 . 0 0 "[ . 1 . 2]" 1 40 2 72 GLN HB3 2 72 GLN HG2 2.900 2.200 2.900 2.451 2.447 2.456 . 0 0 "[ . 1 . 2]" 1 41 2 76 VAL HA 2 76 VAL MG1 2.900 2.200 2.900 2.316 2.301 2.326 . 0 0 "[ . 1 . 2]" 1 42 2 81 LEU HA 2 81 LEU MD1 2.900 2.200 2.900 2.266 2.176 2.525 0.024 16 0 "[ . 1 . 2]" 1 43 1 80 ALA H 1 80 ALA MB 2.910 2.200 2.910 2.207 2.201 2.214 . 0 0 "[ . 1 . 2]" 1 44 2 80 ALA H 2 80 ALA MB 2.910 2.200 2.910 2.207 2.202 2.215 . 0 0 "[ . 1 . 2]" 1 45 1 34 LYS HD3 1 34 LYS QE 2.920 2.200 2.920 2.192 2.175 2.281 0.025 14 0 "[ . 1 . 2]" 1 46 1 59 LYS HD2 1 59 LYS QE 2.920 2.200 2.920 2.239 2.183 2.453 0.017 14 0 "[ . 1 . 2]" 1 47 1 84 ALA H 1 84 ALA MB 2.920 2.200 2.920 2.215 2.199 2.236 0.001 14 0 "[ . 1 . 2]" 1 48 2 34 LYS HD3 2 34 LYS QE 2.920 2.200 2.920 2.192 2.173 2.281 0.027 14 0 "[ . 1 . 2]" 1 49 2 59 LYS HD2 2 59 LYS QE 2.920 2.200 2.920 2.239 2.184 2.453 0.016 5 0 "[ . 1 . 2]" 1 50 2 84 ALA H 2 84 ALA MB 2.920 2.200 2.920 2.215 2.199 2.236 0.001 14 0 "[ . 1 . 2]" 1 51 1 35 GLU H 1 35 GLU HB2 2.940 2.200 2.940 2.400 2.378 2.418 . 0 0 "[ . 1 . 2]" 1 52 2 35 GLU H 2 35 GLU HB2 2.940 2.200 2.940 2.400 2.378 2.418 . 0 0 "[ . 1 . 2]" 1 53 1 34 LYS HD3 1 54 VAL MG2 2.950 2.200 2.950 2.191 2.177 2.241 0.023 6 0 "[ . 1 . 2]" 1 54 1 54 VAL HA 1 54 VAL MG2 2.950 2.200 2.950 2.338 2.307 2.355 . 0 0 "[ . 1 . 2]" 1 55 1 59 LYS HB3 1 59 LYS HD2 2.950 2.200 2.950 2.247 2.230 2.257 . 0 0 "[ . 1 . 2]" 1 56 2 34 LYS HD3 2 54 VAL MG2 2.950 2.200 2.950 2.191 2.177 2.241 0.023 6 0 "[ . 1 . 2]" 1 57 2 54 VAL HA 2 54 VAL MG2 2.950 2.200 2.950 2.338 2.308 2.355 . 0 0 "[ . 1 . 2]" 1 58 2 59 LYS HB3 2 59 LYS HD2 2.950 2.200 2.950 2.247 2.229 2.258 . 0 0 "[ . 1 . 2]" 1 59 1 4 LEU HA 1 4 LEU QD 2.960 2.200 2.960 2.726 2.355 2.877 . 0 0 "[ . 1 . 2]" 1 60 1 36 LEU QD 1 37 LEU MD2 2.960 2.200 2.960 2.181 2.172 2.195 0.028 8 0 "[ . 1 . 2]" 1 61 2 4 LEU HA 2 4 LEU QD 2.960 2.200 2.960 2.726 2.355 2.877 . 0 0 "[ . 1 . 2]" 1 62 2 36 LEU QD 2 37 LEU MD2 2.960 2.200 2.960 2.181 2.173 2.194 0.027 11 0 "[ . 1 . 2]" 1 63 1 37 LEU MD1 1 41 LEU MD1 2.970 2.200 2.970 2.180 2.168 2.192 0.032 5 0 "[ . 1 . 2]" 1 64 1 62 ASP HA 1 63 GLU H 2.970 2.200 2.970 2.294 2.180 2.434 0.020 9 0 "[ . 1 . 2]" 1 65 2 37 LEU MD1 2 41 LEU MD1 2.970 2.200 2.970 2.180 2.168 2.193 0.032 5 0 "[ . 1 . 2]" 1 66 2 62 ASP HA 2 63 GLU H 2.970 2.200 2.970 2.294 2.180 2.434 0.020 9 0 "[ . 1 . 2]" 1 67 1 14 VAL HA 1 17 ALA MB 3.000 2.200 3.000 2.190 2.171 2.206 0.029 16 0 "[ . 1 . 2]" 1 68 1 61 LEU QD 1 77 LEU MD1 3.000 2.200 3.000 2.138 2.119 2.154 0.081 9 0 "[ . 1 . 2]" 1 69 2 14 VAL HA 2 17 ALA MB 3.000 2.200 3.000 2.190 2.170 2.206 0.030 16 0 "[ . 1 . 2]" 1 70 2 61 LEU QD 2 77 LEU MD1 3.000 2.200 3.000 2.137 2.118 2.154 0.082 9 0 "[ . 1 . 2]" 1 71 1 30 LYS HG2 1 54 VAL MG2 3.010 2.200 3.010 2.840 2.423 3.014 0.004 8 0 "[ . 1 . 2]" 1 72 2 30 LYS HG2 2 54 VAL MG2 3.010 2.200 3.010 2.840 2.423 3.014 0.004 8 0 "[ . 1 . 2]" 1 73 1 21 LYS HB3 1 21 LYS HE2 3.030 2.200 3.030 2.320 2.270 2.439 . 0 0 "[ . 1 . 2]" 1 74 1 34 LYS QE 1 34 LYS HG2 3.030 2.200 3.030 2.752 2.244 3.050 0.020 3 0 "[ . 1 . 2]" 1 75 1 36 LEU HB2 1 36 LEU QD 3.030 2.200 3.030 2.243 2.196 2.316 0.004 13 0 "[ . 1 . 2]" 1 76 1 69 VAL HA 1 69 VAL MG2 3.030 2.200 3.030 2.374 2.292 2.463 . 0 0 "[ . 1 . 2]" 1 77 2 21 LYS HB3 2 21 LYS HE2 3.030 2.200 3.030 2.320 2.270 2.439 . 0 0 "[ . 1 . 2]" 1 78 2 34 LYS QE 2 34 LYS HG2 3.030 2.200 3.030 2.753 2.244 3.050 0.020 3 0 "[ . 1 . 2]" 1 79 2 36 LEU HB2 2 36 LEU QD 3.030 2.200 3.030 2.239 2.195 2.317 0.005 13 0 "[ . 1 . 2]" 1 80 2 69 VAL HA 2 69 VAL MG2 3.030 2.200 3.030 2.374 2.293 2.464 . 0 0 "[ . 1 . 2]" 1 81 1 37 LEU HA 1 37 LEU MD1 3.040 2.200 3.040 2.209 2.191 2.225 0.009 20 0 "[ . 1 . 2]" 1 82 1 45 LEU MD1 1 57 VAL MG2 3.040 2.200 3.040 2.494 2.313 2.972 . 0 0 "[ . 1 . 2]" 1 83 1 75 VAL HA 1 75 VAL MG2 3.040 2.200 3.040 2.167 2.163 2.171 0.037 2 0 "[ . 1 . 2]" 1 84 2 37 LEU HA 2 37 LEU MD1 3.040 2.200 3.040 2.209 2.191 2.226 0.009 20 0 "[ . 1 . 2]" 1 85 2 45 LEU MD1 2 57 VAL MG2 3.040 2.200 3.040 2.494 2.312 2.973 . 0 0 "[ . 1 . 2]" 1 86 2 75 VAL HA 2 75 VAL MG2 3.040 2.200 3.040 2.167 2.164 2.171 0.036 8 0 "[ . 1 . 2]" 1 87 1 6 THR HA 1 6 THR MG 3.050 2.200 3.050 2.296 2.226 2.358 . 0 0 "[ . 1 . 2]" 1 88 1 7 ALA H 1 7 ALA MB 3.050 2.200 3.050 2.187 2.171 2.240 0.029 3 0 "[ . 1 . 2]" 1 89 1 21 LYS HD2 1 21 LYS HG2 3.050 2.200 3.050 2.514 2.501 2.524 . 0 0 "[ . 1 . 2]" 1 90 1 49 LYS HA 1 49 LYS HB2 3.050 2.200 3.050 2.721 2.465 3.023 . 0 0 "[ . 1 . 2]" 1 91 1 51 VAL HA 1 51 VAL HB 3.050 2.200 3.050 2.387 2.381 2.398 . 0 0 "[ . 1 . 2]" 1 92 1 51 VAL HA 1 51 VAL MG1 3.050 2.200 3.050 2.398 2.371 2.411 . 0 0 "[ . 1 . 2]" 1 93 1 56 LYS H 1 56 LYS HB2 3.050 2.200 3.050 2.476 2.450 2.567 . 0 0 "[ . 1 . 2]" 1 94 1 57 VAL H 1 57 VAL MG2 3.050 2.200 3.050 2.245 2.203 2.295 . 0 0 "[ . 1 . 2]" 1 95 1 59 LYS HB2 1 59 LYS HG2 3.050 2.200 3.050 2.727 2.494 2.969 . 0 0 "[ . 1 . 2]" 1 96 1 62 ASP HA 1 62 ASP QB 3.050 2.200 3.050 2.388 2.360 2.408 . 0 0 "[ . 1 . 2]" 1 97 1 63 GLU H 1 63 GLU HB3 3.050 2.200 3.050 2.401 2.291 2.533 . 0 0 "[ . 1 . 2]" 1 98 1 88 PHE H 1 88 PHE HB2 3.050 2.200 3.050 2.481 2.292 2.554 . 0 0 "[ . 1 . 2]" 1 99 2 6 THR HA 2 6 THR MG 3.050 2.200 3.050 2.295 2.225 2.357 . 0 0 "[ . 1 . 2]" 1 100 2 7 ALA H 2 7 ALA MB 3.050 2.200 3.050 2.187 2.170 2.240 0.030 3 0 "[ . 1 . 2]" 1 101 2 21 LYS HD2 2 21 LYS HG2 3.050 2.200 3.050 2.514 2.499 2.525 . 0 0 "[ . 1 . 2]" 1 102 2 49 LYS HA 2 49 LYS HB2 3.050 2.200 3.050 2.721 2.465 3.022 . 0 0 "[ . 1 . 2]" 1 103 2 51 VAL HA 2 51 VAL HB 3.050 2.200 3.050 2.387 2.381 2.397 . 0 0 "[ . 1 . 2]" 1 104 2 51 VAL HA 2 51 VAL MG1 3.050 2.200 3.050 2.398 2.371 2.412 . 0 0 "[ . 1 . 2]" 1 105 2 56 LYS H 2 56 LYS HB2 3.050 2.200 3.050 2.476 2.451 2.567 . 0 0 "[ . 1 . 2]" 1 106 2 57 VAL H 2 57 VAL MG2 3.050 2.200 3.050 2.245 2.204 2.294 . 0 0 "[ . 1 . 2]" 1 107 2 59 LYS HB2 2 59 LYS HG2 3.050 2.200 3.050 2.727 2.494 2.968 . 0 0 "[ . 1 . 2]" 1 108 2 62 ASP HA 2 62 ASP QB 3.050 2.200 3.050 2.387 2.360 2.408 . 0 0 "[ . 1 . 2]" 1 109 2 63 GLU H 2 63 GLU HB3 3.050 2.200 3.050 2.400 2.291 2.534 . 0 0 "[ . 1 . 2]" 1 110 2 88 PHE H 2 88 PHE HB2 3.050 2.200 3.050 2.481 2.292 2.554 . 0 0 "[ . 1 . 2]" 1 111 1 12 ILE HB 1 12 ILE MD 3.060 2.200 3.060 2.365 2.316 2.381 . 0 0 "[ . 1 . 2]" 1 112 1 61 LEU H 1 61 LEU HG 3.060 2.200 3.060 2.191 2.179 2.211 0.021 8 0 "[ . 1 . 2]" 1 113 2 12 ILE HB 2 12 ILE MD 3.060 2.200 3.060 2.365 2.318 2.381 . 0 0 "[ . 1 . 2]" 1 114 2 61 LEU H 2 61 LEU HG 3.060 2.200 3.060 2.191 2.180 2.211 0.020 8 0 "[ . 1 . 2]" 1 115 1 4 LEU HB3 1 4 LEU QD 3.070 2.200 3.070 2.134 2.124 2.148 0.076 4 0 "[ . 1 . 2]" 1 116 1 53 ALA HA 1 56 LYS HB2 3.070 2.200 3.070 2.480 2.283 2.654 . 0 0 "[ . 1 . 2]" 1 117 1 57 VAL HA 1 57 VAL MG2 3.070 2.200 3.070 2.347 2.303 2.372 . 0 0 "[ . 1 . 2]" 1 118 1 77 LEU MD2 1 78 VAL MG1 3.070 2.200 3.070 3.074 3.032 3.089 0.019 19 0 "[ . 1 . 2]" 1 119 1 93 SER HA 1 93 SER QB 3.070 2.200 3.070 2.302 2.189 2.466 0.011 18 0 "[ . 1 . 2]" 1 120 2 4 LEU HB3 2 4 LEU QD 3.070 2.200 3.070 2.134 2.125 2.148 0.075 4 0 "[ . 1 . 2]" 1 121 2 53 ALA HA 2 56 LYS HB2 3.070 2.200 3.070 2.479 2.284 2.655 . 0 0 "[ . 1 . 2]" 1 122 2 57 VAL HA 2 57 VAL MG2 3.070 2.200 3.070 2.347 2.304 2.370 . 0 0 "[ . 1 . 2]" 1 123 2 77 LEU MD2 2 78 VAL MG1 3.070 2.200 3.070 3.074 3.031 3.089 0.019 19 0 "[ . 1 . 2]" 1 124 2 93 SER HA 2 93 SER QB 3.070 2.200 3.070 2.302 2.190 2.465 0.010 18 0 "[ . 1 . 2]" 1 125 1 25 LYS HA 1 25 LYS QB 3.080 2.200 3.080 2.337 2.314 2.353 . 0 0 "[ . 1 . 2]" 1 126 1 30 LYS HD2 1 30 LYS QE 3.080 2.200 3.080 2.424 2.188 2.546 0.012 7 0 "[ . 1 . 2]" 1 127 1 31 LYS HA 1 31 LYS HB3 3.080 2.200 3.080 2.505 2.476 2.521 . 0 0 "[ . 1 . 2]" 1 128 1 45 LEU HB2 1 45 LEU MD2 3.080 2.200 3.080 2.413 2.195 2.475 0.005 20 0 "[ . 1 . 2]" 1 129 1 53 ALA H 1 53 ALA MB 3.080 2.200 3.080 2.203 2.186 2.219 0.014 19 0 "[ . 1 . 2]" 1 130 1 76 VAL H 1 76 VAL MG2 3.080 2.200 3.080 2.191 2.189 2.193 0.011 16 0 "[ . 1 . 2]" 1 131 1 82 THR HA 1 82 THR MG 3.080 2.200 3.080 2.262 2.215 2.383 . 0 0 "[ . 1 . 2]" 1 132 2 25 LYS HA 2 25 LYS QB 3.080 2.200 3.080 2.337 2.314 2.353 . 0 0 "[ . 1 . 2]" 1 133 2 30 LYS HD2 2 30 LYS QE 3.080 2.200 3.080 2.425 2.188 2.547 0.012 7 0 "[ . 1 . 2]" 1 134 2 31 LYS HA 2 31 LYS HB3 3.080 2.200 3.080 2.507 2.475 2.524 . 0 0 "[ . 1 . 2]" 1 135 2 45 LEU HB2 2 45 LEU MD2 3.080 2.200 3.080 2.413 2.195 2.477 0.005 20 0 "[ . 1 . 2]" 1 136 2 53 ALA H 2 53 ALA MB 3.080 2.200 3.080 2.203 2.185 2.219 0.015 19 0 "[ . 1 . 2]" 1 137 2 76 VAL H 2 76 VAL MG2 3.080 2.200 3.080 2.191 2.190 2.193 0.010 16 0 "[ . 1 . 2]" 1 138 2 82 THR HA 2 82 THR MG 3.080 2.200 3.080 2.262 2.215 2.383 . 0 0 "[ . 1 . 2]" 1 139 1 10 THR MG 1 14 VAL MG1 3.090 2.200 3.090 2.348 2.199 2.476 0.001 6 0 "[ . 1 . 2]" 1 140 1 30 LYS HB2 1 30 LYS HG3 3.090 2.200 3.090 2.431 2.427 2.438 . 0 0 "[ . 1 . 2]" 1 141 1 45 LEU H 1 45 LEU HB2 3.090 2.200 3.090 2.198 2.185 2.262 0.015 13 0 "[ . 1 . 2]" 1 142 1 48 GLN HA 1 48 GLN HB3 3.090 2.200 3.090 2.416 2.379 2.463 . 0 0 "[ . 1 . 2]" 1 143 1 54 VAL HA 1 54 VAL HB 3.090 2.200 3.090 2.527 2.510 2.556 . 0 0 "[ . 1 . 2]" 1 144 1 63 GLU HA 1 63 GLU HB2 3.090 2.200 3.090 2.446 2.422 2.482 . 0 0 "[ . 1 . 2]" 1 145 1 79 ALA H 1 79 ALA MB 3.090 2.200 3.090 2.153 2.147 2.159 0.053 20 0 "[ . 1 . 2]" 1 146 2 10 THR MG 2 14 VAL MG1 3.090 2.200 3.090 2.350 2.199 2.478 0.001 6 0 "[ . 1 . 2]" 1 147 2 30 LYS HB2 2 30 LYS HG3 3.090 2.200 3.090 2.431 2.427 2.439 . 0 0 "[ . 1 . 2]" 1 148 2 45 LEU H 2 45 LEU HB2 3.090 2.200 3.090 2.198 2.184 2.262 0.016 13 0 "[ . 1 . 2]" 1 149 2 48 GLN HA 2 48 GLN HB3 3.090 2.200 3.090 2.416 2.378 2.461 . 0 0 "[ . 1 . 2]" 1 150 2 54 VAL HA 2 54 VAL HB 3.090 2.200 3.090 2.527 2.508 2.556 . 0 0 "[ . 1 . 2]" 1 151 2 63 GLU HA 2 63 GLU HB2 3.090 2.200 3.090 2.446 2.421 2.483 . 0 0 "[ . 1 . 2]" 1 152 2 79 ALA H 2 79 ALA MB 3.090 2.200 3.090 2.153 2.148 2.160 0.052 20 0 "[ . 1 . 2]" 1 153 1 4 LEU HB2 1 4 LEU QD 3.100 2.200 3.100 2.201 2.179 2.288 0.021 15 0 "[ . 1 . 2]" 1 154 1 45 LEU HA 1 45 LEU MD2 3.100 2.200 3.100 2.166 2.151 2.190 0.049 18 0 "[ . 1 . 2]" 1 155 1 64 ASN H 1 65 GLY H 3.100 2.200 3.100 2.733 2.672 2.804 . 0 0 "[ . 1 . 2]" 1 156 2 4 LEU HB2 2 4 LEU QD 3.100 2.200 3.100 2.202 2.180 2.287 0.020 15 0 "[ . 1 . 2]" 1 157 2 45 LEU HA 2 45 LEU MD2 3.100 2.200 3.100 2.166 2.151 2.190 0.049 18 0 "[ . 1 . 2]" 1 158 2 64 ASN H 2 65 GLY H 3.100 2.200 3.100 2.733 2.673 2.804 . 0 0 "[ . 1 . 2]" 1 159 1 45 LEU HB3 1 45 LEU MD1 3.110 2.200 3.110 2.254 2.193 2.475 0.007 10 0 "[ . 1 . 2]" 1 160 1 66 ASP HA 1 66 ASP QB 3.110 2.200 3.110 2.189 2.186 2.196 0.014 1 0 "[ . 1 . 2]" 1 161 1 69 VAL HA 1 70 ASP H 3.110 2.200 3.110 2.210 2.185 2.258 0.015 8 0 "[ . 1 . 2]" 1 162 1 88 PHE HA 1 88 PHE HB2 3.110 2.200 3.110 2.703 2.482 3.039 . 0 0 "[ . 1 . 2]" 1 163 2 45 LEU HB3 2 45 LEU MD1 3.110 2.200 3.110 2.254 2.193 2.475 0.007 10 0 "[ . 1 . 2]" 1 164 2 66 ASP HA 2 66 ASP QB 3.110 2.200 3.110 2.189 2.186 2.196 0.014 10 0 "[ . 1 . 2]" 1 165 2 69 VAL HA 2 70 ASP H 3.110 2.200 3.110 2.209 2.185 2.259 0.015 8 0 "[ . 1 . 2]" 1 166 2 88 PHE HA 2 88 PHE HB2 3.110 2.200 3.110 2.703 2.481 3.039 . 0 0 "[ . 1 . 2]" 1 167 1 26 TYR H 1 27 LYS H 3.120 2.200 3.120 2.692 2.672 2.722 . 0 0 "[ . 1 . 2]" 1 168 1 60 GLU H 1 61 LEU H 3.120 2.200 3.120 2.545 2.476 2.601 . 0 0 "[ . 1 . 2]" 1 169 2 26 TYR H 2 27 LYS H 3.120 2.200 3.120 2.692 2.671 2.720 . 0 0 "[ . 1 . 2]" 1 170 2 60 GLU H 2 61 LEU H 3.120 2.200 3.120 2.545 2.477 2.602 . 0 0 "[ . 1 . 2]" 1 171 1 9 GLU HB2 1 9 GLU HG2 3.130 2.200 3.130 2.924 2.483 3.035 . 0 0 "[ . 1 . 2]" 1 172 1 49 LYS HA 1 49 LYS QG 3.130 2.200 3.130 2.328 2.290 2.371 . 0 0 "[ . 1 . 2]" 1 173 1 80 ALA MB 1 81 LEU MD1 3.130 2.200 3.130 2.650 2.625 2.682 . 0 0 "[ . 1 . 2]" 1 174 2 9 GLU HB2 2 9 GLU HG2 3.130 2.200 3.130 2.924 2.483 3.035 . 0 0 "[ . 1 . 2]" 1 175 2 49 LYS HA 2 49 LYS QG 3.130 2.200 3.130 2.328 2.291 2.370 . 0 0 "[ . 1 . 2]" 1 176 2 80 ALA MB 2 81 LEU MD1 3.130 2.200 3.130 2.651 2.626 2.683 . 0 0 "[ . 1 . 2]" 1 177 1 30 LYS H 1 30 LYS HB3 3.140 2.200 3.140 2.663 2.626 2.706 . 0 0 "[ . 1 . 2]" 1 178 1 34 LYS HB2 1 34 LYS HD3 3.140 2.200 3.140 2.338 2.304 2.362 . 0 0 "[ . 1 . 2]" 1 179 1 56 LYS HB2 1 56 LYS QG 3.140 2.200 3.140 2.328 2.198 2.347 0.002 3 0 "[ . 1 . 2]" 1 180 1 58 MET HB2 1 58 MET ME 3.140 2.200 3.140 2.329 2.186 2.490 0.014 3 0 "[ . 1 . 2]" 1 181 1 68 GLU HA 1 68 GLU QG 3.140 2.200 3.140 2.428 2.307 3.160 0.020 17 0 "[ . 1 . 2]" 1 182 1 91 GLU HB2 1 91 GLU HG2 3.140 2.200 3.140 2.590 2.415 3.009 . 0 0 "[ . 1 . 2]" 1 183 1 91 GLU HB2 1 91 GLU HG3 3.140 2.200 3.140 2.418 2.380 2.491 . 0 0 "[ . 1 . 2]" 1 184 2 30 LYS H 2 30 LYS HB3 3.140 2.200 3.140 2.663 2.625 2.707 . 0 0 "[ . 1 . 2]" 1 185 2 34 LYS HB2 2 34 LYS HD3 3.140 2.200 3.140 2.338 2.305 2.361 . 0 0 "[ . 1 . 2]" 1 186 2 56 LYS HB2 2 56 LYS QG 3.140 2.200 3.140 2.328 2.198 2.349 0.002 3 0 "[ . 1 . 2]" 1 187 2 58 MET HB2 2 58 MET ME 3.140 2.200 3.140 2.329 2.187 2.489 0.013 3 0 "[ . 1 . 2]" 1 188 2 68 GLU HA 2 68 GLU QG 3.140 2.200 3.140 2.428 2.308 3.160 0.020 17 0 "[ . 1 . 2]" 1 189 2 91 GLU HB2 2 91 GLU HG2 3.140 2.200 3.140 2.590 2.415 3.009 . 0 0 "[ . 1 . 2]" 1 190 2 91 GLU HB2 2 91 GLU HG3 3.140 2.200 3.140 2.418 2.379 2.491 . 0 0 "[ . 1 . 2]" 1 191 1 21 LYS HA 1 21 LYS HB2 3.150 2.200 3.150 2.423 2.406 2.441 . 0 0 "[ . 1 . 2]" 1 192 1 58 MET HA 1 58 MET HB3 3.150 2.200 3.150 2.571 2.307 2.661 . 0 0 "[ . 1 . 2]" 1 193 1 60 GLU HA 1 60 GLU HB2 3.150 2.200 3.150 2.434 2.362 2.489 . 0 0 "[ . 1 . 2]" 1 194 1 67 GLY H 1 67 GLY HA2 3.150 2.200 3.150 2.340 2.301 2.395 . 0 0 "[ . 1 . 2]" 1 195 2 21 LYS HA 2 21 LYS HB2 3.150 2.200 3.150 2.423 2.406 2.440 . 0 0 "[ . 1 . 2]" 1 196 2 58 MET HA 2 58 MET HB3 3.150 2.200 3.150 2.571 2.308 2.661 . 0 0 "[ . 1 . 2]" 1 197 2 60 GLU HA 2 60 GLU HB2 3.150 2.200 3.150 2.434 2.361 2.490 . 0 0 "[ . 1 . 2]" 1 198 2 67 GLY H 2 67 GLY HA2 3.150 2.200 3.150 2.340 2.301 2.396 . 0 0 "[ . 1 . 2]" 1 199 1 11 LEU HA 1 11 LEU MD2 3.160 2.200 3.160 2.145 2.143 2.149 0.057 18 0 "[ . 1 . 2]" 1 200 1 21 LYS H 1 21 LYS HB2 3.160 2.200 3.160 2.534 2.506 2.598 . 0 0 "[ . 1 . 2]" 1 201 2 11 LEU HA 2 11 LEU QD 3.160 2.200 3.160 2.147 2.145 2.150 0.055 18 0 "[ . 1 . 2]" 1 202 2 21 LYS H 2 21 LYS HB2 3.160 2.200 3.160 2.533 2.507 2.599 . 0 0 "[ . 1 . 2]" 1 203 1 37 LEU H 1 37 LEU HB2 3.170 2.200 3.170 2.435 2.406 2.490 . 0 0 "[ . 1 . 2]" 1 204 1 44 PHE H 1 44 PHE HB2 3.170 2.200 3.170 2.427 2.403 2.470 . 0 0 "[ . 1 . 2]" 1 205 1 63 GLU HB3 1 64 ASN H 3.170 2.200 3.170 2.320 2.198 2.500 0.002 17 0 "[ . 1 . 2]" 1 206 1 66 ASP H 1 67 GLY H 3.170 2.200 3.170 2.597 2.527 2.730 . 0 0 "[ . 1 . 2]" 1 207 2 37 LEU H 2 37 LEU HB2 3.170 2.200 3.170 2.435 2.407 2.489 . 0 0 "[ . 1 . 2]" 1 208 2 44 PHE H 2 44 PHE HB2 3.170 2.200 3.170 2.427 2.403 2.470 . 0 0 "[ . 1 . 2]" 1 209 2 63 GLU HB3 2 64 ASN H 3.170 2.200 3.170 2.320 2.198 2.501 0.002 17 0 "[ . 1 . 2]" 1 210 2 66 ASP H 2 67 GLY H 3.170 2.200 3.170 2.597 2.527 2.731 . 0 0 "[ . 1 . 2]" 1 211 1 45 LEU MD2 1 57 VAL MG2 3.180 2.200 3.180 3.002 2.578 3.187 0.007 10 0 "[ . 1 . 2]" 1 212 1 87 ASN H 1 87 ASN HB2 3.180 2.200 3.180 2.452 2.380 2.499 . 0 0 "[ . 1 . 2]" 1 213 2 45 LEU MD2 2 57 VAL MG2 3.180 2.200 3.180 3.002 2.578 3.188 0.008 10 0 "[ . 1 . 2]" 1 214 2 87 ASN H 2 87 ASN HB2 3.180 2.200 3.180 2.452 2.380 2.499 . 0 0 "[ . 1 . 2]" 1 215 1 33 LEU HB2 1 37 LEU MD2 3.190 2.200 3.190 2.546 2.249 2.747 . 0 0 "[ . 1 . 2]" 1 216 1 57 VAL HB 1 58 MET H 3.190 2.200 3.190 2.566 2.478 2.718 . 0 0 "[ . 1 . 2]" 1 217 1 63 GLU H 1 64 ASN H 3.190 2.200 3.190 2.401 2.268 2.527 . 0 0 "[ . 1 . 2]" 1 218 2 33 LEU HB2 2 37 LEU MD2 3.190 2.200 3.190 2.546 2.249 2.747 . 0 0 "[ . 1 . 2]" 1 219 2 57 VAL HB 2 58 MET H 3.190 2.200 3.190 2.566 2.479 2.716 . 0 0 "[ . 1 . 2]" 1 220 2 63 GLU H 2 64 ASN H 3.190 2.200 3.190 2.401 2.268 2.527 . 0 0 "[ . 1 . 2]" 1 221 1 21 LYS H 1 21 LYS HB3 3.200 2.200 3.200 2.546 2.505 2.592 . 0 0 "[ . 1 . 2]" 1 222 1 34 LYS HB3 1 34 LYS HG2 3.200 2.200 3.200 2.370 2.360 2.385 . 0 0 "[ . 1 . 2]" 1 223 1 38 GLN HA 1 38 GLN HG2 3.200 2.200 3.200 2.428 2.365 2.453 . 0 0 "[ . 1 . 2]" 1 224 1 45 LEU HA 1 45 LEU MD1 3.200 2.200 3.200 2.203 2.194 2.271 0.006 8 0 "[ . 1 . 2]" 1 225 1 58 MET ME 1 58 MET HG2 3.200 2.200 3.200 2.281 2.193 2.584 0.007 17 0 "[ . 1 . 2]" 1 226 1 61 LEU HB2 1 61 LEU QD 3.200 2.200 3.200 2.219 2.189 2.252 0.011 5 0 "[ . 1 . 2]" 1 227 1 69 VAL HA 1 69 VAL MG1 3.200 2.200 3.200 2.368 2.294 2.443 . 0 0 "[ . 1 . 2]" 1 228 1 79 ALA MB 1 80 ALA H 3.200 2.200 3.200 2.420 2.396 2.440 . 0 0 "[ . 1 . 2]" 1 229 2 21 LYS H 2 21 LYS HB3 3.200 2.200 3.200 2.546 2.505 2.592 . 0 0 "[ . 1 . 2]" 1 230 2 34 LYS HB3 2 34 LYS HG2 3.200 2.200 3.200 2.369 2.359 2.386 . 0 0 "[ . 1 . 2]" 1 231 2 38 GLN HA 2 38 GLN HG2 3.200 2.200 3.200 2.428 2.365 2.452 . 0 0 "[ . 1 . 2]" 1 232 2 45 LEU HA 2 45 LEU MD1 3.200 2.200 3.200 2.203 2.192 2.272 0.008 8 0 "[ . 1 . 2]" 1 233 2 58 MET ME 2 58 MET HG2 3.200 2.200 3.200 2.281 2.192 2.585 0.008 17 0 "[ . 1 . 2]" 1 234 2 61 LEU HB2 2 61 LEU QD 3.200 2.200 3.200 2.219 2.189 2.251 0.011 5 0 "[ . 1 . 2]" 1 235 2 69 VAL HA 2 69 VAL MG1 3.200 2.200 3.200 2.368 2.295 2.444 . 0 0 "[ . 1 . 2]" 1 236 2 79 ALA MB 2 80 ALA H 3.200 2.200 3.200 2.419 2.395 2.439 . 0 0 "[ . 1 . 2]" 1 237 1 28 LEU HB3 1 33 LEU QD 3.210 2.200 3.210 3.236 3.135 3.256 0.046 20 0 "[ . 1 . 2]" 1 238 1 91 GLU H 1 91 GLU HB2 3.210 2.200 3.210 2.309 2.201 2.413 . 0 0 "[ . 1 . 2]" 1 239 2 28 LEU HB3 2 33 LEU QD 3.210 2.200 3.210 3.235 3.134 3.256 0.046 20 0 "[ . 1 . 2]" 1 240 2 91 GLU H 2 91 GLU HB2 3.210 2.200 3.210 2.309 2.201 2.412 . 0 0 "[ . 1 . 2]" 1 241 1 8 MET ME 1 8 MET HG2 3.220 2.200 3.220 2.267 2.204 2.296 . 0 0 "[ . 1 . 2]" 1 242 1 21 LYS HA 1 21 LYS HG2 3.220 2.200 3.220 3.079 3.042 3.127 . 0 0 "[ . 1 . 2]" 1 243 1 34 LYS H 1 34 LYS HB2 3.220 2.200 3.220 2.486 2.459 2.510 . 0 0 "[ . 1 . 2]" 1 244 1 55 ASP HA 1 55 ASP HB2 3.220 2.200 3.220 2.864 2.511 3.019 . 0 0 "[ . 1 . 2]" 1 245 1 72 GLN HA 1 72 GLN HB3 3.220 2.200 3.220 2.499 2.497 2.501 . 0 0 "[ . 1 . 2]" 1 246 2 8 MET ME 2 8 MET HG2 3.220 2.200 3.220 2.267 2.204 2.295 . 0 0 "[ . 1 . 2]" 1 247 2 21 LYS HA 2 21 LYS HG2 3.220 2.200 3.220 3.079 3.043 3.127 . 0 0 "[ . 1 . 2]" 1 248 2 34 LYS H 2 34 LYS HB2 3.220 2.200 3.220 2.486 2.460 2.510 . 0 0 "[ . 1 . 2]" 1 249 2 55 ASP HA 2 55 ASP HB2 3.220 2.200 3.220 2.864 2.511 3.019 . 0 0 "[ . 1 . 2]" 1 250 2 72 GLN HA 2 72 GLN HB3 3.220 2.200 3.220 2.499 2.497 2.500 . 0 0 "[ . 1 . 2]" 1 251 1 47 ALA H 1 47 ALA MB 3.230 2.200 3.230 2.210 2.195 2.232 0.005 19 0 "[ . 1 . 2]" 1 252 1 63 GLU HB2 1 63 GLU HG3 3.230 2.200 3.230 2.472 2.462 2.480 . 0 0 "[ . 1 . 2]" 1 253 1 91 GLU HA 1 91 GLU HB2 3.230 2.200 3.230 2.826 2.574 3.014 . 0 0 "[ . 1 . 2]" 1 254 2 47 ALA H 2 47 ALA MB 3.230 2.200 3.230 2.210 2.195 2.232 0.005 19 0 "[ . 1 . 2]" 1 255 2 63 GLU HB2 2 63 GLU HG3 3.230 2.200 3.230 2.472 2.462 2.480 . 0 0 "[ . 1 . 2]" 1 256 2 91 GLU HA 2 91 GLU HB2 3.230 2.200 3.230 2.826 2.574 3.015 . 0 0 "[ . 1 . 2]" 1 257 1 34 LYS QE 1 54 VAL HB 3.240 2.200 3.240 2.773 2.616 3.044 . 0 0 "[ . 1 . 2]" 1 258 1 78 VAL H 1 78 VAL MG2 3.240 2.200 3.240 2.167 2.162 2.172 0.038 10 0 "[ . 1 . 2]" 1 259 2 34 LYS QE 2 54 VAL HB 3.240 2.200 3.240 2.773 2.617 3.042 . 0 0 "[ . 1 . 2]" 1 260 2 78 VAL H 2 78 VAL MG2 3.240 2.200 3.240 2.167 2.160 2.173 0.040 3 0 "[ . 1 . 2]" 1 261 1 17 ALA H 1 17 ALA HA 3.250 2.200 3.250 2.789 2.784 2.793 . 0 0 "[ . 1 . 2]" 1 262 1 21 LYS HB3 1 21 LYS HG2 3.250 2.200 3.250 2.478 2.453 2.502 . 0 0 "[ . 1 . 2]" 1 263 1 27 LYS HB3 1 27 LYS HG3 3.250 2.200 3.250 2.549 2.496 2.578 . 0 0 "[ . 1 . 2]" 1 264 1 31 LYS HB3 1 31 LYS HG3 3.250 2.200 3.250 3.022 3.017 3.025 . 0 0 "[ . 1 . 2]" 1 265 1 41 LEU HB3 1 41 LEU MD1 3.250 2.200 3.250 2.351 2.333 2.369 . 0 0 "[ . 1 . 2]" 1 266 1 58 MET HB2 1 69 VAL MG2 3.250 2.200 3.250 2.341 2.194 2.684 0.006 16 0 "[ . 1 . 2]" 1 267 1 59 LYS HA 1 59 LYS HD2 3.250 2.200 3.250 2.824 2.304 3.349 0.099 8 0 "[ . 1 . 2]" 1 268 1 60 GLU HA 1 60 GLU HB3 3.250 2.200 3.250 2.813 2.541 3.029 . 0 0 "[ . 1 . 2]" 1 269 1 78 VAL HA 1 78 VAL MG1 3.250 2.200 3.250 2.373 2.233 2.395 . 0 0 "[ . 1 . 2]" 1 270 1 90 TRP HA 1 90 TRP HB2 3.250 2.200 3.250 2.451 2.386 2.466 . 0 0 "[ . 1 . 2]" 1 271 2 17 ALA H 2 17 ALA HA 3.250 2.200 3.250 2.790 2.786 2.793 . 0 0 "[ . 1 . 2]" 1 272 2 21 LYS HB3 2 21 LYS HG2 3.250 2.200 3.250 2.478 2.452 2.502 . 0 0 "[ . 1 . 2]" 1 273 2 27 LYS HB3 2 27 LYS HG3 3.250 2.200 3.250 2.557 2.506 2.585 . 0 0 "[ . 1 . 2]" 1 274 2 31 LYS HB3 2 31 LYS HG3 3.250 2.200 3.250 3.018 3.012 3.024 . 0 0 "[ . 1 . 2]" 1 275 2 41 LEU HB3 2 41 LEU MD1 3.250 2.200 3.250 2.351 2.334 2.370 . 0 0 "[ . 1 . 2]" 1 276 2 58 MET HB2 2 69 VAL MG2 3.250 2.200 3.250 2.341 2.193 2.684 0.007 16 0 "[ . 1 . 2]" 1 277 2 59 LYS HA 2 59 LYS HD2 3.250 2.200 3.250 2.824 2.303 3.349 0.099 8 0 "[ . 1 . 2]" 1 278 2 60 GLU HA 2 60 GLU HB3 3.250 2.200 3.250 2.813 2.542 3.028 . 0 0 "[ . 1 . 2]" 1 279 2 78 VAL HA 2 78 VAL MG1 3.250 2.200 3.250 2.373 2.233 2.396 . 0 0 "[ . 1 . 2]" 1 280 2 90 TRP HA 2 90 TRP HB2 3.250 2.200 3.250 2.451 2.385 2.466 . 0 0 "[ . 1 . 2]" 1 281 1 9 GLU HA 1 12 ILE MD 3.260 2.200 3.260 2.315 2.238 2.454 . 0 0 "[ . 1 . 2]" 1 282 1 20 GLY H 1 20 GLY HA3 3.260 2.200 3.260 2.303 2.285 2.323 . 0 0 "[ . 1 . 2]" 1 283 1 22 GLU HA 1 22 GLU HB3 3.260 2.200 3.260 2.700 2.469 3.022 . 0 0 "[ . 1 . 2]" 1 284 1 27 LYS HA 1 28 LEU H 3.260 2.200 3.260 2.235 2.192 2.302 0.008 7 0 "[ . 1 . 2]" 1 285 1 30 LYS HD2 1 54 VAL MG1 3.260 2.200 3.260 2.507 2.234 2.879 . 0 0 "[ . 1 . 2]" 1 286 1 32 GLU HA 1 32 GLU HB3 3.260 2.200 3.260 2.471 2.446 2.504 . 0 0 "[ . 1 . 2]" 1 287 1 41 LEU MD2 1 44 PHE HD2 3.260 2.200 3.260 2.756 2.649 2.875 . 0 0 "[ . 1 . 2]" 1 288 1 69 VAL MG1 1 74 TYR HA 3.260 2.200 3.260 3.226 3.100 3.277 0.017 19 0 "[ . 1 . 2]" 1 289 1 74 TYR H 1 74 TYR HB2 3.260 2.200 3.260 2.452 2.415 2.513 . 0 0 "[ . 1 . 2]" 1 290 1 77 LEU HB2 1 77 LEU MD1 3.260 2.200 3.260 2.413 2.354 2.456 . 0 0 "[ . 1 . 2]" 1 291 2 9 GLU HA 2 12 ILE MD 3.260 2.200 3.260 2.314 2.236 2.451 . 0 0 "[ . 1 . 2]" 1 292 2 20 GLY H 2 20 GLY HA3 3.260 2.200 3.260 2.303 2.286 2.324 . 0 0 "[ . 1 . 2]" 1 293 2 22 GLU HA 2 22 GLU HB3 3.260 2.200 3.260 2.700 2.469 3.023 . 0 0 "[ . 1 . 2]" 1 294 2 27 LYS HA 2 28 LEU H 3.260 2.200 3.260 2.233 2.192 2.300 0.008 7 0 "[ . 1 . 2]" 1 295 2 30 LYS HD2 2 54 VAL MG1 3.260 2.200 3.260 2.507 2.234 2.878 . 0 0 "[ . 1 . 2]" 1 296 2 32 GLU HA 2 32 GLU HB3 3.260 2.200 3.260 2.471 2.447 2.504 . 0 0 "[ . 1 . 2]" 1 297 2 41 LEU MD2 2 44 PHE HD2 3.260 2.200 3.260 2.755 2.647 2.875 . 0 0 "[ . 1 . 2]" 1 298 2 69 VAL MG1 2 74 TYR HA 3.260 2.200 3.260 3.227 3.100 3.277 0.017 19 0 "[ . 1 . 2]" 1 299 2 74 TYR H 2 74 TYR HB2 3.260 2.200 3.260 2.452 2.415 2.513 . 0 0 "[ . 1 . 2]" 1 300 2 77 LEU HB2 2 77 LEU MD1 3.260 2.200 3.260 2.413 2.353 2.455 . 0 0 "[ . 1 . 2]" 1 301 1 20 GLY HA2 1 25 LYS HA 3.270 2.200 3.270 2.234 2.167 2.452 0.033 9 0 "[ . 1 . 2]" 1 302 1 30 LYS QE 1 30 LYS HG2 3.270 2.200 3.270 2.215 2.205 2.228 . 0 0 "[ . 1 . 2]" 1 303 2 20 GLY HA2 2 25 LYS HA 3.270 2.200 3.270 2.234 2.168 2.451 0.032 12 0 "[ . 1 . 2]" 1 304 2 30 LYS QE 2 30 LYS HG2 3.270 2.200 3.270 2.215 2.206 2.228 . 0 0 "[ . 1 . 2]" 1 305 1 6 THR H 1 6 THR HB 3.280 2.200 3.280 2.607 2.594 2.625 . 0 0 "[ . 1 . 2]" 1 306 1 12 ILE H 1 12 ILE HB 3.280 2.200 3.280 2.491 2.473 2.512 . 0 0 "[ . 1 . 2]" 1 307 1 34 LYS H 1 34 LYS HB3 3.280 2.200 3.280 2.622 2.587 2.693 . 0 0 "[ . 1 . 2]" 1 308 1 64 ASN HA 1 64 ASN HB2 3.280 2.200 3.280 2.748 2.410 2.972 . 0 0 "[ . 1 . 2]" 1 309 1 75 VAL MG1 1 76 VAL MG1 3.280 2.200 3.280 2.215 2.199 2.232 0.001 16 0 "[ . 1 . 2]" 1 310 1 83 VAL H 1 83 VAL MG1 3.280 2.200 3.280 2.161 2.159 2.165 0.041 3 0 "[ . 1 . 2]" 1 311 2 6 THR H 2 6 THR HB 3.280 2.200 3.280 2.608 2.594 2.627 . 0 0 "[ . 1 . 2]" 1 312 2 12 ILE H 2 12 ILE HB 3.280 2.200 3.280 2.491 2.473 2.511 . 0 0 "[ . 1 . 2]" 1 313 2 34 LYS H 2 34 LYS HB3 3.280 2.200 3.280 2.622 2.587 2.693 . 0 0 "[ . 1 . 2]" 1 314 2 64 ASN HA 2 64 ASN HB2 3.280 2.200 3.280 2.748 2.411 2.972 . 0 0 "[ . 1 . 2]" 1 315 2 75 VAL MG1 2 76 VAL MG1 3.280 2.200 3.280 2.214 2.198 2.231 0.002 16 0 "[ . 1 . 2]" 1 316 2 83 VAL H 2 83 VAL MG1 3.280 2.200 3.280 2.161 2.159 2.165 0.041 20 0 "[ . 1 . 2]" 1 317 1 9 GLU HA 1 9 GLU HG2 3.290 2.200 3.290 2.514 2.403 2.948 . 0 0 "[ . 1 . 2]" 1 318 1 10 THR HA 1 10 THR MG 3.290 2.200 3.290 2.320 2.264 2.361 . 0 0 "[ . 1 . 2]" 1 319 1 18 HIS H 1 19 SER H 3.290 2.200 3.290 2.746 2.607 2.872 . 0 0 "[ . 1 . 2]" 1 320 1 33 LEU HB2 1 33 LEU QD 3.290 2.200 3.290 2.131 2.128 2.136 0.072 10 0 "[ . 1 . 2]" 1 321 1 34 LYS QE 1 54 VAL MG1 3.290 2.200 3.290 3.169 2.966 3.293 0.003 20 0 "[ . 1 . 2]" 1 322 1 38 GLN HA 1 38 GLN HB3 3.290 2.200 3.290 2.501 2.492 2.505 . 0 0 "[ . 1 . 2]" 1 323 1 41 LEU HB2 1 41 LEU MD1 3.290 2.200 3.290 2.325 2.287 2.362 . 0 0 "[ . 1 . 2]" 1 324 1 58 MET H 1 59 LYS H 3.290 2.200 3.290 2.787 2.747 2.850 . 0 0 "[ . 1 . 2]" 1 325 1 59 LYS H 1 59 LYS HA 3.290 2.200 3.290 2.812 2.797 2.826 . 0 0 "[ . 1 . 2]" 1 326 2 9 GLU HA 2 9 GLU HG2 3.290 2.200 3.290 2.512 2.400 2.945 . 0 0 "[ . 1 . 2]" 1 327 2 10 THR HA 2 10 THR MG 3.290 2.200 3.290 2.320 2.263 2.361 . 0 0 "[ . 1 . 2]" 1 328 2 18 HIS H 2 19 SER H 3.290 2.200 3.290 2.746 2.608 2.876 . 0 0 "[ . 1 . 2]" 1 329 2 33 LEU HB2 2 33 LEU QD 3.290 2.200 3.290 2.131 2.128 2.137 0.072 15 0 "[ . 1 . 2]" 1 330 2 34 LYS QE 2 54 VAL MG1 3.290 2.200 3.290 3.169 2.966 3.292 0.002 20 0 "[ . 1 . 2]" 1 331 2 38 GLN HA 2 38 GLN HB3 3.290 2.200 3.290 2.501 2.492 2.506 . 0 0 "[ . 1 . 2]" 1 332 2 41 LEU HB2 2 41 LEU MD1 3.290 2.200 3.290 2.325 2.289 2.363 . 0 0 "[ . 1 . 2]" 1 333 2 58 MET H 2 59 LYS H 3.290 2.200 3.290 2.787 2.748 2.849 . 0 0 "[ . 1 . 2]" 1 334 2 59 LYS H 2 59 LYS HA 3.290 2.200 3.290 2.812 2.796 2.825 . 0 0 "[ . 1 . 2]" 1 335 1 21 LYS H 1 22 GLU H 3.300 2.200 3.300 2.861 2.810 2.937 . 0 0 "[ . 1 . 2]" 1 336 1 28 LEU HA 1 28 LEU QD 3.300 2.200 3.300 2.164 2.153 2.181 0.047 16 0 "[ . 1 . 2]" 1 337 2 21 LYS H 2 22 GLU H 3.300 2.200 3.300 2.861 2.810 2.937 . 0 0 "[ . 1 . 2]" 1 338 2 28 LEU HA 2 28 LEU QD 3.300 2.200 3.300 2.164 2.153 2.180 0.047 16 0 "[ . 1 . 2]" 1 339 1 10 THR MG 1 14 VAL MG2 3.310 2.200 3.310 3.325 3.312 3.335 0.025 20 0 "[ . 1 . 2]" 1 340 1 48 GLN HB2 1 53 ALA MB 3.310 2.200 3.310 2.183 2.152 2.246 0.048 18 0 "[ . 1 . 2]" 1 341 1 48 GLN HB3 1 53 ALA MB 3.310 2.200 3.310 2.176 2.163 2.188 0.037 19 0 "[ . 1 . 2]" 1 342 1 56 LYS H 1 57 VAL H 3.310 2.200 3.310 2.654 2.594 2.691 . 0 0 "[ . 1 . 2]" 1 343 2 10 THR MG 2 14 VAL MG2 3.310 2.200 3.310 3.326 3.313 3.334 0.024 20 0 "[ . 1 . 2]" 1 344 2 48 GLN HB2 2 53 ALA MB 3.310 2.200 3.310 2.183 2.152 2.246 0.048 18 0 "[ . 1 . 2]" 1 345 2 48 GLN HB3 2 53 ALA MB 3.310 2.200 3.310 2.176 2.162 2.189 0.038 19 0 "[ . 1 . 2]" 1 346 2 56 LYS H 2 57 VAL H 3.310 2.200 3.310 2.654 2.594 2.691 . 0 0 "[ . 1 . 2]" 1 347 1 34 LYS HB2 1 34 LYS HG2 3.320 2.200 3.320 2.576 2.557 2.592 . 0 0 "[ . 1 . 2]" 1 348 1 69 VAL MG1 1 74 TYR HB2 3.320 2.200 3.320 2.776 2.647 2.858 . 0 0 "[ . 1 . 2]" 1 349 1 75 VAL H 1 75 VAL HB 3.320 2.200 3.320 2.140 2.138 2.144 0.062 9 0 "[ . 1 . 2]" 1 350 2 34 LYS HB2 2 34 LYS HG2 3.320 2.200 3.320 2.576 2.557 2.592 . 0 0 "[ . 1 . 2]" 1 351 2 69 VAL MG1 2 74 TYR HB2 3.320 2.200 3.320 2.776 2.647 2.858 . 0 0 "[ . 1 . 2]" 1 352 2 75 VAL H 2 75 VAL HB 3.320 2.200 3.320 2.141 2.138 2.144 0.062 16 0 "[ . 1 . 2]" 1 353 1 30 LYS HB3 1 30 LYS HG2 3.330 2.200 3.330 2.522 2.512 2.533 . 0 0 "[ . 1 . 2]" 1 354 1 30 LYS QE 1 31 LYS HA 3.330 2.200 3.330 3.367 3.360 3.374 0.044 14 0 "[ . 1 . 2]" 1 355 1 31 LYS H 1 31 LYS HB3 3.330 2.200 3.330 2.397 2.362 2.488 . 0 0 "[ . 1 . 2]" 1 356 1 52 ASP HA 1 52 ASP HB2 3.330 2.200 3.330 2.977 2.526 3.031 . 0 0 "[ . 1 . 2]" 1 357 2 30 LYS HB3 2 30 LYS HG2 3.330 2.200 3.330 2.522 2.514 2.532 . 0 0 "[ . 1 . 2]" 1 358 2 30 LYS QE 2 31 LYS HA 3.330 2.200 3.330 3.367 3.360 3.374 0.044 14 0 "[ . 1 . 2]" 1 359 2 31 LYS H 2 31 LYS HB3 3.330 2.200 3.330 2.396 2.361 2.487 . 0 0 "[ . 1 . 2]" 1 360 2 52 ASP HA 2 52 ASP HB2 3.330 2.200 3.330 2.977 2.526 3.030 . 0 0 "[ . 1 . 2]" 1 361 1 19 SER HA 1 28 LEU QD 3.340 2.200 3.340 2.621 2.291 2.982 . 0 0 "[ . 1 . 2]" 1 362 1 48 GLN HB3 1 48 GLN HG3 3.340 2.200 3.340 2.423 2.413 2.432 . 0 0 "[ . 1 . 2]" 1 363 1 59 LYS HB3 1 59 LYS QE 3.340 2.200 3.340 2.866 2.237 3.429 0.089 3 0 "[ . 1 . 2]" 1 364 2 19 SER HA 2 28 LEU QD 3.340 2.200 3.340 2.620 2.288 2.983 . 0 0 "[ . 1 . 2]" 1 365 2 48 GLN HB3 2 48 GLN HG3 3.340 2.200 3.340 2.423 2.413 2.431 . 0 0 "[ . 1 . 2]" 1 366 2 59 LYS HB3 2 59 LYS QE 3.340 2.200 3.340 2.866 2.236 3.430 0.090 3 0 "[ . 1 . 2]" 1 367 1 30 LYS HA 1 30 LYS HG2 3.350 2.200 3.350 2.910 2.882 2.939 . 0 0 "[ . 1 . 2]" 1 368 1 36 LEU H 1 36 LEU HB2 3.350 2.200 3.350 2.351 2.299 2.464 . 0 0 "[ . 1 . 2]" 1 369 1 40 GLU H 1 41 LEU H 3.350 2.200 3.350 2.506 2.398 2.569 . 0 0 "[ . 1 . 2]" 1 370 1 41 LEU HA 1 42 SER H 3.350 2.200 3.350 2.191 2.183 2.198 0.017 16 0 "[ . 1 . 2]" 1 371 1 46 ASP H 1 46 ASP HB3 3.350 2.200 3.350 2.624 2.595 2.641 . 0 0 "[ . 1 . 2]" 1 372 1 59 LYS HA 1 59 LYS HG2 3.350 2.200 3.350 2.614 2.244 3.006 . 0 0 "[ . 1 . 2]" 1 373 1 59 LYS QE 1 59 LYS HG3 3.350 2.200 3.350 2.404 2.186 2.989 0.014 3 0 "[ . 1 . 2]" 1 374 1 62 ASP H 1 62 ASP HA 3.350 2.200 3.350 2.855 2.840 2.867 . 0 0 "[ . 1 . 2]" 1 375 2 30 LYS HA 2 30 LYS HG2 3.350 2.200 3.350 2.910 2.882 2.938 . 0 0 "[ . 1 . 2]" 1 376 2 36 LEU H 2 36 LEU HB2 3.350 2.200 3.350 2.350 2.298 2.463 . 0 0 "[ . 1 . 2]" 1 377 2 40 GLU H 2 41 LEU H 3.350 2.200 3.350 2.506 2.398 2.569 . 0 0 "[ . 1 . 2]" 1 378 2 41 LEU HA 2 42 SER H 3.350 2.200 3.350 2.191 2.183 2.197 0.017 16 0 "[ . 1 . 2]" 1 379 2 46 ASP H 2 46 ASP HB3 3.350 2.200 3.350 2.623 2.595 2.643 . 0 0 "[ . 1 . 2]" 1 380 2 59 LYS HA 2 59 LYS HG2 3.350 2.200 3.350 2.613 2.244 3.006 . 0 0 "[ . 1 . 2]" 1 381 2 59 LYS QE 2 59 LYS HG3 3.350 2.200 3.350 2.405 2.186 2.989 0.014 20 0 "[ . 1 . 2]" 1 382 2 62 ASP H 2 62 ASP HA 3.350 2.200 3.350 2.855 2.839 2.867 . 0 0 "[ . 1 . 2]" 1 383 1 4 LEU H 1 4 LEU HA 3.360 2.200 3.360 2.832 2.797 2.861 . 0 0 "[ . 1 . 2]" 1 384 1 7 ALA MB 1 8 MET H 3.360 2.200 3.360 2.413 2.377 2.562 . 0 0 "[ . 1 . 2]" 1 385 1 14 VAL H 1 14 VAL MG1 3.360 2.200 3.360 2.274 2.186 2.351 0.014 15 0 "[ . 1 . 2]" 1 386 1 21 LYS HA 1 21 LYS HG3 3.360 2.200 3.360 2.516 2.482 2.549 . 0 0 "[ . 1 . 2]" 1 387 1 34 LYS HB3 1 34 LYS HG3 3.360 2.200 3.360 2.579 2.560 2.590 . 0 0 "[ . 1 . 2]" 1 388 1 37 LEU HB2 1 45 LEU MD2 3.360 2.200 3.360 3.220 3.046 3.361 0.001 17 0 "[ . 1 . 2]" 1 389 1 48 GLN H 1 48 GLN HA 3.360 2.200 3.360 2.896 2.821 2.953 . 0 0 "[ . 1 . 2]" 1 390 1 80 ALA H 1 80 ALA HA 3.360 2.200 3.360 2.823 2.819 2.826 . 0 0 "[ . 1 . 2]" 1 391 1 80 ALA MB 1 81 LEU H 3.360 2.200 3.360 2.598 2.582 2.613 . 0 0 "[ . 1 . 2]" 1 392 2 4 LEU H 2 4 LEU HA 3.360 2.200 3.360 2.832 2.798 2.861 . 0 0 "[ . 1 . 2]" 1 393 2 7 ALA MB 2 8 MET H 3.360 2.200 3.360 2.413 2.378 2.563 . 0 0 "[ . 1 . 2]" 1 394 2 14 VAL H 2 14 VAL MG1 3.360 2.200 3.360 2.274 2.186 2.352 0.014 15 0 "[ . 1 . 2]" 1 395 2 21 LYS HA 2 21 LYS HG3 3.360 2.200 3.360 2.517 2.482 2.549 . 0 0 "[ . 1 . 2]" 1 396 2 34 LYS HB3 2 34 LYS HG3 3.360 2.200 3.360 2.579 2.560 2.590 . 0 0 "[ . 1 . 2]" 1 397 2 37 LEU HB2 2 45 LEU MD2 3.360 2.200 3.360 3.220 3.046 3.360 0.000 17 0 "[ . 1 . 2]" 1 398 2 48 GLN H 2 48 GLN HA 3.360 2.200 3.360 2.896 2.822 2.955 . 0 0 "[ . 1 . 2]" 1 399 2 80 ALA H 2 80 ALA HA 3.360 2.200 3.360 2.823 2.819 2.826 . 0 0 "[ . 1 . 2]" 1 400 2 80 ALA MB 2 81 LEU H 3.360 2.200 3.360 2.598 2.581 2.613 . 0 0 "[ . 1 . 2]" 1 401 1 32 GLU H 1 32 GLU HB2 3.370 2.200 3.370 2.531 2.443 2.587 . 0 0 "[ . 1 . 2]" 1 402 1 33 LEU H 1 33 LEU HB3 3.370 2.200 3.370 2.884 2.688 3.175 . 0 0 "[ . 1 . 2]" 1 403 1 37 LEU MD1 1 41 LEU HB2 3.370 2.200 3.370 2.762 2.484 3.080 . 0 0 "[ . 1 . 2]" 1 404 1 57 VAL H 1 58 MET H 3.370 2.200 3.370 2.749 2.640 2.844 . 0 0 "[ . 1 . 2]" 1 405 1 58 MET HA 1 61 LEU QD 3.370 2.200 3.370 2.636 2.486 2.845 . 0 0 "[ . 1 . 2]" 1 406 1 61 LEU H 1 61 LEU HB2 3.370 2.200 3.370 2.523 2.488 2.567 . 0 0 "[ . 1 . 2]" 1 407 1 64 ASN H 1 64 ASN HB2 3.370 2.200 3.370 2.295 2.247 2.364 . 0 0 "[ . 1 . 2]" 1 408 1 76 VAL H 1 76 VAL MG1 3.370 2.200 3.370 2.205 2.199 2.222 0.001 3 0 "[ . 1 . 2]" 1 409 1 88 PHE H 1 88 PHE HA 3.370 2.200 3.370 2.834 2.814 2.856 . 0 0 "[ . 1 . 2]" 1 410 2 32 GLU H 2 32 GLU HB2 3.370 2.200 3.370 2.534 2.443 2.590 . 0 0 "[ . 1 . 2]" 1 411 2 33 LEU H 2 33 LEU HB3 3.370 2.200 3.370 2.884 2.689 3.174 . 0 0 "[ . 1 . 2]" 1 412 2 37 LEU MD1 2 41 LEU HB2 3.370 2.200 3.370 2.762 2.484 3.080 . 0 0 "[ . 1 . 2]" 1 413 2 57 VAL H 2 58 MET H 3.370 2.200 3.370 2.749 2.639 2.844 . 0 0 "[ . 1 . 2]" 1 414 2 58 MET HA 2 61 LEU QD 3.370 2.200 3.370 2.636 2.486 2.845 . 0 0 "[ . 1 . 2]" 1 415 2 61 LEU H 2 61 LEU HB2 3.370 2.200 3.370 2.523 2.486 2.566 . 0 0 "[ . 1 . 2]" 1 416 2 64 ASN H 2 64 ASN HB2 3.370 2.200 3.370 2.295 2.246 2.364 . 0 0 "[ . 1 . 2]" 1 417 2 76 VAL H 2 76 VAL MG1 3.370 2.200 3.370 2.204 2.198 2.222 0.002 3 0 "[ . 1 . 2]" 1 418 2 88 PHE H 2 88 PHE HA 3.370 2.200 3.370 2.834 2.814 2.856 . 0 0 "[ . 1 . 2]" 1 419 1 38 GLN H 1 39 THR H 3.380 2.200 3.380 2.695 2.664 2.725 . 0 0 "[ . 1 . 2]" 1 420 1 63 GLU HA 1 63 GLU HG3 3.380 2.200 3.380 2.544 2.484 2.588 . 0 0 "[ . 1 . 2]" 1 421 1 67 GLY H 1 67 GLY HA3 3.380 2.200 3.380 2.894 2.824 2.947 . 0 0 "[ . 1 . 2]" 1 422 1 72 GLN H 1 73 GLU H 3.380 2.200 3.380 2.709 2.672 2.772 . 0 0 "[ . 1 . 2]" 1 423 2 11 LEU H 2 11 LEU QD 3.380 2.200 3.380 2.778 2.759 2.796 . 0 0 "[ . 1 . 2]" 1 424 2 38 GLN H 2 39 THR H 3.380 2.200 3.380 2.695 2.663 2.725 . 0 0 "[ . 1 . 2]" 1 425 2 63 GLU HA 2 63 GLU HG3 3.380 2.200 3.380 2.544 2.483 2.588 . 0 0 "[ . 1 . 2]" 1 426 2 67 GLY H 2 67 GLY HA3 3.380 2.200 3.380 2.894 2.824 2.949 . 0 0 "[ . 1 . 2]" 1 427 2 72 GLN H 2 73 GLU H 3.380 2.200 3.380 2.709 2.673 2.772 . 0 0 "[ . 1 . 2]" 1 428 1 11 LEU H 1 11 LEU MD2 3.390 2.200 3.390 2.821 2.803 2.842 . 0 0 "[ . 1 . 2]" 1 429 1 75 VAL H 1 75 VAL HA 3.390 2.200 3.390 2.806 2.804 2.813 . 0 0 "[ . 1 . 2]" 1 430 1 76 VAL HA 1 79 ALA MB 3.390 2.200 3.390 2.609 2.558 2.662 . 0 0 "[ . 1 . 2]" 1 431 1 83 VAL H 1 83 VAL HB 3.390 2.200 3.390 2.662 2.650 2.679 . 0 0 "[ . 1 . 2]" 1 432 1 84 ALA H 1 85 CYS H 3.390 2.200 3.390 2.519 2.503 2.543 . 0 0 "[ . 1 . 2]" 1 433 2 75 VAL H 2 75 VAL HA 3.390 2.200 3.390 2.806 2.803 2.813 . 0 0 "[ . 1 . 2]" 1 434 2 76 VAL HA 2 79 ALA MB 3.390 2.200 3.390 2.608 2.559 2.662 . 0 0 "[ . 1 . 2]" 1 435 2 83 VAL H 2 83 VAL HB 3.390 2.200 3.390 2.662 2.650 2.680 . 0 0 "[ . 1 . 2]" 1 436 2 84 ALA H 2 85 CYS H 3.390 2.200 3.390 2.519 2.503 2.542 . 0 0 "[ . 1 . 2]" 1 437 1 4 LEU H 1 4 LEU HB2 3.400 2.200 3.400 2.290 2.240 2.330 . 0 0 "[ . 1 . 2]" 1 438 1 29 SER HA 1 29 SER HB2 3.400 2.200 3.400 2.469 2.392 3.013 . 0 0 "[ . 1 . 2]" 1 439 1 53 ALA H 1 53 ALA HA 3.400 2.200 3.400 2.775 2.746 2.797 . 0 0 "[ . 1 . 2]" 1 440 1 89 PHE H 1 89 PHE HA 3.400 2.200 3.400 2.827 2.803 2.838 . 0 0 "[ . 1 . 2]" 1 441 2 4 LEU H 2 4 LEU HB2 3.400 2.200 3.400 2.290 2.241 2.329 . 0 0 "[ . 1 . 2]" 1 442 2 29 SER HA 2 29 SER HB2 3.400 2.200 3.400 2.469 2.394 3.013 . 0 0 "[ . 1 . 2]" 1 443 2 53 ALA H 2 53 ALA HA 3.400 2.200 3.400 2.775 2.747 2.799 . 0 0 "[ . 1 . 2]" 1 444 2 89 PHE H 2 89 PHE HA 3.400 2.200 3.400 2.827 2.801 2.839 . 0 0 "[ . 1 . 2]" 1 445 1 8 MET H 1 8 MET HG3 3.410 2.200 3.410 2.185 2.177 2.193 0.023 13 0 "[ . 1 . 2]" 1 446 1 12 ILE HA 1 12 ILE MG 3.410 2.200 3.410 2.350 2.316 2.370 . 0 0 "[ . 1 . 2]" 1 447 1 16 HIS H 1 17 ALA H 3.410 2.200 3.410 2.563 2.481 2.604 . 0 0 "[ . 1 . 2]" 1 448 1 45 LEU HA 1 45 LEU HB2 3.410 2.200 3.410 2.907 2.645 2.958 . 0 0 "[ . 1 . 2]" 1 449 1 61 LEU HB3 1 61 LEU MD1 3.410 2.200 3.410 2.395 2.361 2.440 . 0 0 "[ . 1 . 2]" 1 450 1 61 LEU HB3 1 61 LEU MD2 3.410 2.200 3.410 2.326 2.257 2.382 . 0 0 "[ . 1 . 2]" 1 451 1 63 GLU H 1 63 GLU HA 3.410 2.200 3.410 2.851 2.830 2.873 . 0 0 "[ . 1 . 2]" 1 452 1 68 GLU HA 1 69 VAL H 3.410 2.200 3.410 2.275 2.211 2.407 . 0 0 "[ . 1 . 2]" 1 453 2 8 MET H 2 8 MET HG3 3.410 2.200 3.410 2.185 2.179 2.194 0.021 20 0 "[ . 1 . 2]" 1 454 2 12 ILE HA 2 12 ILE MG 3.410 2.200 3.410 2.351 2.316 2.371 . 0 0 "[ . 1 . 2]" 1 455 2 16 HIS H 2 17 ALA H 3.410 2.200 3.410 2.563 2.482 2.605 . 0 0 "[ . 1 . 2]" 1 456 2 45 LEU HA 2 45 LEU HB2 3.410 2.200 3.410 2.907 2.643 2.958 . 0 0 "[ . 1 . 2]" 1 457 2 61 LEU HB3 2 61 LEU MD1 3.410 2.200 3.410 2.395 2.360 2.440 . 0 0 "[ . 1 . 2]" 1 458 2 61 LEU HB3 2 61 LEU MD2 3.410 2.200 3.410 2.326 2.256 2.381 . 0 0 "[ . 1 . 2]" 1 459 2 63 GLU H 2 63 GLU HA 3.410 2.200 3.410 2.851 2.830 2.872 . 0 0 "[ . 1 . 2]" 1 460 2 68 GLU HA 2 69 VAL H 3.410 2.200 3.410 2.275 2.211 2.407 . 0 0 "[ . 1 . 2]" 1 461 1 58 MET HB3 1 69 VAL MG2 3.420 2.200 3.420 3.327 2.540 3.455 0.035 15 0 "[ . 1 . 2]" 1 462 1 65 GLY HA2 1 66 ASP H 3.420 2.200 3.420 3.116 3.025 3.211 . 0 0 "[ . 1 . 2]" 1 463 1 67 GLY H 1 68 GLU H 3.420 2.200 3.420 2.487 2.200 2.768 0.000 4 0 "[ . 1 . 2]" 1 464 1 81 LEU H 1 81 LEU HA 3.420 2.200 3.420 2.853 2.846 2.860 . 0 0 "[ . 1 . 2]" 1 465 2 58 MET HB3 2 69 VAL MG2 3.420 2.200 3.420 3.327 2.541 3.454 0.034 15 0 "[ . 1 . 2]" 1 466 2 65 GLY HA2 2 66 ASP H 3.420 2.200 3.420 3.116 3.024 3.211 . 0 0 "[ . 1 . 2]" 1 467 2 67 GLY H 2 68 GLU H 3.420 2.200 3.420 2.487 2.200 2.769 0.000 4 0 "[ . 1 . 2]" 1 468 2 81 LEU H 2 81 LEU HA 3.420 2.200 3.420 2.853 2.847 2.861 . 0 0 "[ . 1 . 2]" 1 469 1 3 GLU HA 1 6 THR HB 3.430 2.200 3.430 2.551 2.374 2.805 . 0 0 "[ . 1 . 2]" 1 470 1 12 ILE H 1 12 ILE HG13 3.430 2.200 3.430 2.180 2.175 2.182 0.025 6 0 "[ . 1 . 2]" 1 471 1 18 HIS QB 1 36 LEU QD 3.430 2.200 3.430 2.240 2.066 2.767 0.134 6 0 "[ . 1 . 2]" 1 472 1 32 GLU H 1 32 GLU HA 3.430 2.200 3.430 2.817 2.804 2.849 . 0 0 "[ . 1 . 2]" 1 473 1 34 LYS HA 1 54 VAL MG2 3.430 2.200 3.430 2.829 2.476 3.156 . 0 0 "[ . 1 . 2]" 1 474 1 45 LEU HA 1 45 LEU HB3 3.430 2.200 3.430 2.792 2.741 2.999 . 0 0 "[ . 1 . 2]" 1 475 1 58 MET H 1 58 MET HB3 3.430 2.200 3.430 2.392 2.227 2.954 . 0 0 "[ . 1 . 2]" 1 476 1 64 ASN H 1 64 ASN HA 3.430 2.200 3.430 2.762 2.743 2.774 . 0 0 "[ . 1 . 2]" 1 477 1 75 VAL MG1 1 76 VAL H 3.430 2.200 3.430 2.188 2.186 2.191 0.014 17 0 "[ . 1 . 2]" 1 478 1 77 LEU H 1 77 LEU HB2 3.430 2.200 3.430 2.635 2.575 2.676 . 0 0 "[ . 1 . 2]" 1 479 1 77 LEU H 1 77 LEU HB3 3.430 2.200 3.430 2.479 2.451 2.520 . 0 0 "[ . 1 . 2]" 1 480 1 80 ALA HA 1 83 VAL MG1 3.430 2.200 3.430 2.180 2.175 2.182 0.025 3 0 "[ . 1 . 2]" 1 481 1 83 VAL HA 1 83 VAL MG2 3.430 2.200 3.430 2.225 2.220 2.236 . 0 0 "[ . 1 . 2]" 1 482 1 85 CYS H 1 85 CYS HB3 3.430 2.200 3.430 2.620 2.532 2.780 . 0 0 "[ . 1 . 2]" 1 483 2 3 GLU HA 2 6 THR HB 3.430 2.200 3.430 2.549 2.374 2.804 . 0 0 "[ . 1 . 2]" 1 484 2 12 ILE H 2 12 ILE HG13 3.430 2.200 3.430 2.180 2.175 2.183 0.025 20 0 "[ . 1 . 2]" 1 485 2 32 GLU H 2 32 GLU HA 3.430 2.200 3.430 2.818 2.805 2.850 . 0 0 "[ . 1 . 2]" 1 486 2 34 LYS HA 2 54 VAL MG2 3.430 2.200 3.430 2.829 2.476 3.157 . 0 0 "[ . 1 . 2]" 1 487 2 45 LEU HA 2 45 LEU HB3 3.430 2.200 3.430 2.793 2.743 2.999 . 0 0 "[ . 1 . 2]" 1 488 2 58 MET H 2 58 MET HB3 3.430 2.200 3.430 2.392 2.227 2.954 . 0 0 "[ . 1 . 2]" 1 489 2 64 ASN H 2 64 ASN HA 3.430 2.200 3.430 2.763 2.745 2.774 . 0 0 "[ . 1 . 2]" 1 490 2 75 VAL MG1 2 76 VAL H 3.430 2.200 3.430 2.188 2.185 2.191 0.015 4 0 "[ . 1 . 2]" 1 491 2 77 LEU H 2 77 LEU HB2 3.430 2.200 3.430 2.635 2.575 2.676 . 0 0 "[ . 1 . 2]" 1 492 2 77 LEU H 2 77 LEU HB3 3.430 2.200 3.430 2.479 2.452 2.520 . 0 0 "[ . 1 . 2]" 1 493 2 80 ALA HA 2 83 VAL MG1 3.430 2.200 3.430 2.180 2.175 2.183 0.025 3 0 "[ . 1 . 2]" 1 494 2 83 VAL HA 2 83 VAL MG2 3.430 2.200 3.430 2.225 2.220 2.237 . 0 0 "[ . 1 . 2]" 1 495 2 85 CYS H 2 85 CYS HB3 3.430 2.200 3.430 2.620 2.532 2.782 . 0 0 "[ . 1 . 2]" 1 496 1 31 LYS H 1 31 LYS HA 3.440 2.200 3.440 2.790 2.784 2.796 . 0 0 "[ . 1 . 2]" 1 497 1 38 GLN H 1 38 GLN HA 3.440 2.200 3.440 2.828 2.824 2.833 . 0 0 "[ . 1 . 2]" 1 498 1 42 SER H 1 42 SER QB 3.440 2.200 3.440 2.484 2.310 2.812 . 0 0 "[ . 1 . 2]" 1 499 1 47 ALA H 1 47 ALA HA 3.440 2.200 3.440 2.773 2.754 2.787 . 0 0 "[ . 1 . 2]" 1 500 1 75 VAL HA 1 75 VAL MG1 3.440 2.200 3.440 3.056 3.041 3.065 . 0 0 "[ . 1 . 2]" 1 501 1 80 ALA H 1 81 LEU H 3.440 2.200 3.440 2.621 2.609 2.634 . 0 0 "[ . 1 . 2]" 1 502 1 83 VAL H 1 84 ALA H 3.440 2.200 3.440 2.667 2.645 2.693 . 0 0 "[ . 1 . 2]" 1 503 1 84 ALA HA 1 87 ASN HB2 3.440 2.200 3.440 2.496 2.288 3.169 . 0 0 "[ . 1 . 2]" 1 504 2 31 LYS H 2 31 LYS HA 3.440 2.200 3.440 2.791 2.784 2.796 . 0 0 "[ . 1 . 2]" 1 505 2 38 GLN H 2 38 GLN HA 3.440 2.200 3.440 2.828 2.824 2.833 . 0 0 "[ . 1 . 2]" 1 506 2 42 SER H 2 42 SER QB 3.440 2.200 3.440 2.484 2.310 2.813 . 0 0 "[ . 1 . 2]" 1 507 2 47 ALA H 2 47 ALA HA 3.440 2.200 3.440 2.772 2.754 2.787 . 0 0 "[ . 1 . 2]" 1 508 2 75 VAL HA 2 75 VAL MG1 3.440 2.200 3.440 3.056 3.041 3.065 . 0 0 "[ . 1 . 2]" 1 509 2 80 ALA H 2 81 LEU H 3.440 2.200 3.440 2.621 2.609 2.634 . 0 0 "[ . 1 . 2]" 1 510 2 83 VAL H 2 84 ALA H 3.440 2.200 3.440 2.667 2.644 2.693 . 0 0 "[ . 1 . 2]" 1 511 2 84 ALA HA 2 87 ASN HB2 3.440 2.200 3.440 2.495 2.286 3.168 . 0 0 "[ . 1 . 2]" 1 512 1 8 MET H 1 8 MET HB2 3.450 2.200 3.450 2.410 2.374 2.439 . 0 0 "[ . 1 . 2]" 1 513 1 9 GLU H 1 10 THR H 3.450 2.200 3.450 2.597 2.577 2.613 . 0 0 "[ . 1 . 2]" 1 514 1 39 THR H 1 40 GLU H 3.450 2.200 3.450 2.596 2.534 2.697 . 0 0 "[ . 1 . 2]" 1 515 1 79 ALA H 1 80 ALA H 3.450 2.200 3.450 2.703 2.679 2.726 . 0 0 "[ . 1 . 2]" 1 516 2 8 MET H 2 8 MET HB2 3.450 2.200 3.450 2.409 2.374 2.440 . 0 0 "[ . 1 . 2]" 1 517 2 9 GLU H 2 10 THR H 3.450 2.200 3.450 2.585 2.567 2.597 . 0 0 "[ . 1 . 2]" 1 518 2 39 THR H 2 40 GLU H 3.450 2.200 3.450 2.596 2.537 2.696 . 0 0 "[ . 1 . 2]" 1 519 2 79 ALA H 2 80 ALA H 3.450 2.200 3.450 2.702 2.678 2.725 . 0 0 "[ . 1 . 2]" 1 520 1 10 THR H 1 10 THR HB 3.460 2.200 3.460 2.566 2.539 2.593 . 0 0 "[ . 1 . 2]" 1 521 1 13 ASN H 1 13 ASN HB2 3.460 2.200 3.460 2.437 2.428 2.448 . 0 0 "[ . 1 . 2]" 1 522 1 15 PHE HE1 1 28 LEU QD 3.460 2.200 3.460 2.424 2.185 2.844 0.015 6 0 "[ . 1 . 2]" 1 523 1 28 LEU HA 1 29 SER H 3.460 2.200 3.460 2.185 2.163 2.197 0.037 16 0 "[ . 1 . 2]" 1 524 1 58 MET HA 1 58 MET HB2 3.460 2.200 3.460 2.313 2.255 2.577 . 0 0 "[ . 1 . 2]" 1 525 1 58 MET HB3 1 58 MET HG2 3.460 2.200 3.460 2.283 2.257 2.346 . 0 0 "[ . 1 . 2]" 1 526 1 61 LEU QD 1 77 LEU HA 3.460 2.200 3.460 3.127 2.927 3.311 . 0 0 "[ . 1 . 2]" 1 527 1 85 CYS H 1 85 CYS HB2 3.460 2.200 3.460 2.456 2.325 2.546 . 0 0 "[ . 1 . 2]" 1 528 1 85 CYS HA 1 85 CYS HB2 3.460 2.200 3.460 2.524 2.479 2.611 . 0 0 "[ . 1 . 2]" 1 529 1 89 PHE H 1 89 PHE QB 3.460 2.200 3.460 2.258 2.248 2.269 . 0 0 "[ . 1 . 2]" 1 530 2 10 THR H 2 10 THR HB 3.460 2.200 3.460 2.591 2.561 2.616 . 0 0 "[ . 1 . 2]" 1 531 2 13 ASN H 2 13 ASN HB2 3.460 2.200 3.460 2.437 2.427 2.448 . 0 0 "[ . 1 . 2]" 1 532 2 15 PHE HE1 2 28 LEU QD 3.460 2.200 3.460 2.425 2.185 2.844 0.015 6 0 "[ . 1 . 2]" 1 533 2 28 LEU HA 2 29 SER H 3.460 2.200 3.460 2.185 2.162 2.196 0.038 16 0 "[ . 1 . 2]" 1 534 2 58 MET HA 2 58 MET HB2 3.460 2.200 3.460 2.313 2.255 2.577 . 0 0 "[ . 1 . 2]" 1 535 2 58 MET HB3 2 58 MET HG2 3.460 2.200 3.460 2.283 2.257 2.345 . 0 0 "[ . 1 . 2]" 1 536 2 61 LEU QD 2 77 LEU HA 3.460 2.200 3.460 3.127 2.927 3.311 . 0 0 "[ . 1 . 2]" 1 537 2 85 CYS H 2 85 CYS HB2 3.460 2.200 3.460 2.456 2.324 2.546 . 0 0 "[ . 1 . 2]" 1 538 2 85 CYS HA 2 85 CYS HB2 3.460 2.200 3.460 2.524 2.481 2.612 . 0 0 "[ . 1 . 2]" 1 539 2 89 PHE H 2 89 PHE QB 3.460 2.200 3.460 2.258 2.249 2.268 . 0 0 "[ . 1 . 2]" 1 540 1 35 GLU HA 1 38 GLN HB2 3.470 2.200 3.470 2.867 2.766 2.974 . 0 0 "[ . 1 . 2]" 1 541 1 48 GLN H 1 48 GLN HB2 3.470 2.200 3.470 2.594 2.537 2.647 . 0 0 "[ . 1 . 2]" 1 542 1 72 GLN H 1 72 GLN HG3 3.470 2.200 3.470 2.177 2.171 2.182 0.029 20 0 "[ . 1 . 2]" 1 543 1 77 LEU HA 1 77 LEU MD1 3.470 2.200 3.470 2.184 2.179 2.188 0.021 1 0 "[ . 1 . 2]" 1 544 1 78 VAL H 1 78 VAL MG1 3.470 2.200 3.470 2.276 2.213 2.435 . 0 0 "[ . 1 . 2]" 1 545 1 82 THR H 1 82 THR HB 3.470 2.200 3.470 2.594 2.571 2.606 . 0 0 "[ . 1 . 2]" 1 546 2 8 MET HA 2 11 LEU QD 3.470 2.200 3.470 2.714 2.523 2.783 . 0 0 "[ . 1 . 2]" 1 547 2 35 GLU HA 2 38 GLN HB2 3.470 2.200 3.470 2.867 2.765 2.975 . 0 0 "[ . 1 . 2]" 1 548 2 48 GLN H 2 48 GLN HB2 3.470 2.200 3.470 2.594 2.536 2.645 . 0 0 "[ . 1 . 2]" 1 549 2 72 GLN H 2 72 GLN HG3 3.470 2.200 3.470 2.177 2.171 2.182 0.029 20 0 "[ . 1 . 2]" 1 550 2 77 LEU HA 2 77 LEU MD1 3.470 2.200 3.470 2.184 2.179 2.189 0.021 20 0 "[ . 1 . 2]" 1 551 2 78 VAL H 2 78 VAL MG1 3.470 2.200 3.470 2.276 2.214 2.435 . 0 0 "[ . 1 . 2]" 1 552 2 82 THR H 2 82 THR HB 3.470 2.200 3.470 2.595 2.570 2.607 . 0 0 "[ . 1 . 2]" 1 553 1 8 MET HA 1 11 LEU MD1 3.480 2.200 3.480 2.743 2.547 2.804 . 0 0 "[ . 1 . 2]" 1 554 1 17 ALA H 1 18 HIS H 3.480 2.200 3.480 2.838 2.710 2.916 . 0 0 "[ . 1 . 2]" 1 555 1 61 LEU HB2 1 69 VAL MG2 3.480 2.200 3.480 2.550 2.208 2.644 . 0 0 "[ . 1 . 2]" 1 556 1 61 LEU MD1 1 77 LEU MD1 3.480 2.200 3.480 2.567 2.432 2.720 . 0 0 "[ . 1 . 2]" 1 557 1 61 LEU MD2 1 77 LEU MD1 3.480 2.200 3.480 2.294 2.232 2.359 . 0 0 "[ . 1 . 2]" 1 558 1 91 GLU HA 1 91 GLU HG2 3.480 2.200 3.480 2.446 2.219 2.938 . 0 0 "[ . 1 . 2]" 1 559 2 17 ALA H 2 18 HIS H 3.480 2.200 3.480 2.837 2.718 2.916 . 0 0 "[ . 1 . 2]" 1 560 2 61 LEU HB2 2 69 VAL MG2 3.480 2.200 3.480 2.550 2.207 2.644 . 0 0 "[ . 1 . 2]" 1 561 2 61 LEU MD1 2 77 LEU MD1 3.480 2.200 3.480 2.566 2.433 2.720 . 0 0 "[ . 1 . 2]" 1 562 2 61 LEU MD2 2 77 LEU MD1 3.480 2.200 3.480 2.294 2.231 2.357 . 0 0 "[ . 1 . 2]" 1 563 2 91 GLU HA 2 91 GLU HG2 3.480 2.200 3.480 2.447 2.220 2.940 . 0 0 "[ . 1 . 2]" 1 564 1 6 THR HB 1 7 ALA H 3.490 2.200 3.490 2.560 2.528 2.603 . 0 0 "[ . 1 . 2]" 1 565 1 21 LYS HB3 1 22 GLU H 3.490 2.200 3.490 2.631 2.532 2.732 . 0 0 "[ . 1 . 2]" 1 566 1 30 LYS HA 1 33 LEU QD 3.490 2.200 3.490 2.125 2.112 2.140 0.088 6 0 "[ . 1 . 2]" 1 567 1 34 LYS HD3 1 34 LYS HG2 3.490 2.200 3.490 2.506 2.485 2.541 . 0 0 "[ . 1 . 2]" 1 568 1 58 MET HA 1 69 VAL MG2 3.490 2.200 3.490 2.833 2.635 3.002 . 0 0 "[ . 1 . 2]" 1 569 1 71 PHE HE1 1 75 VAL MG2 3.490 2.200 3.490 2.503 2.441 2.564 . 0 0 "[ . 1 . 2]" 1 570 1 76 VAL H 1 77 LEU H 3.490 2.200 3.490 2.609 2.583 2.626 . 0 0 "[ . 1 . 2]" 1 571 1 78 VAL HA 1 81 LEU MD2 3.490 2.200 3.490 3.314 3.125 3.466 . 0 0 "[ . 1 . 2]" 1 572 1 91 GLU HA 1 91 GLU HB3 3.490 2.200 3.490 2.816 2.569 3.004 . 0 0 "[ . 1 . 2]" 1 573 2 6 THR HB 2 7 ALA H 3.490 2.200 3.490 2.564 2.530 2.604 . 0 0 "[ . 1 . 2]" 1 574 2 21 LYS HB3 2 22 GLU H 3.490 2.200 3.490 2.631 2.532 2.732 . 0 0 "[ . 1 . 2]" 1 575 2 30 LYS HA 2 33 LEU QD 3.490 2.200 3.490 2.125 2.113 2.139 0.087 6 0 "[ . 1 . 2]" 1 576 2 34 LYS HD3 2 34 LYS HG2 3.490 2.200 3.490 2.506 2.485 2.540 . 0 0 "[ . 1 . 2]" 1 577 2 58 MET HA 2 69 VAL MG2 3.490 2.200 3.490 2.834 2.635 3.003 . 0 0 "[ . 1 . 2]" 1 578 2 71 PHE HE1 2 75 VAL MG2 3.490 2.200 3.490 2.502 2.440 2.564 . 0 0 "[ . 1 . 2]" 1 579 2 76 VAL H 2 77 LEU H 3.490 2.200 3.490 2.609 2.582 2.626 . 0 0 "[ . 1 . 2]" 1 580 2 78 VAL HA 2 81 LEU MD2 3.490 2.200 3.490 3.332 3.144 3.484 . 0 0 "[ . 1 . 2]" 1 581 2 91 GLU HA 2 91 GLU HB3 3.490 2.200 3.490 2.816 2.571 3.003 . 0 0 "[ . 1 . 2]" 1 582 1 27 LYS HG2 1 68 GLU QG 3.500 2.200 3.500 2.600 2.240 3.123 . 0 0 "[ . 1 . 2]" 1 583 1 48 GLN HB2 1 48 GLN HG2 3.500 2.200 3.500 2.435 2.429 2.442 . 0 0 "[ . 1 . 2]" 1 584 1 58 MET HB3 1 58 MET HG3 3.500 2.200 3.500 2.779 2.616 2.987 . 0 0 "[ . 1 . 2]" 1 585 1 72 GLN HB2 1 73 GLU H 3.500 2.200 3.500 2.653 2.623 2.678 . 0 0 "[ . 1 . 2]" 1 586 1 77 LEU H 1 78 VAL H 3.500 2.200 3.500 2.936 2.913 2.952 . 0 0 "[ . 1 . 2]" 1 587 2 27 LYS HG2 2 68 GLU QG 3.500 2.200 3.500 2.591 2.235 3.123 . 0 0 "[ . 1 . 2]" 1 588 2 48 GLN HB2 2 48 GLN HG2 3.500 2.200 3.500 2.435 2.429 2.442 . 0 0 "[ . 1 . 2]" 1 589 2 58 MET HB3 2 58 MET HG3 3.500 2.200 3.500 2.779 2.616 2.987 . 0 0 "[ . 1 . 2]" 1 590 2 72 GLN HB2 2 73 GLU H 3.500 2.200 3.500 2.653 2.623 2.679 . 0 0 "[ . 1 . 2]" 1 591 2 77 LEU H 2 78 VAL H 3.500 2.200 3.500 2.936 2.914 2.952 . 0 0 "[ . 1 . 2]" 1 592 1 13 ASN HA 1 13 ASN HB2 3.510 2.200 3.510 3.015 3.012 3.017 . 0 0 "[ . 1 . 2]" 1 593 1 19 SER HA 1 19 SER HB2 3.510 2.200 3.510 2.479 2.443 2.505 . 0 0 "[ . 1 . 2]" 1 594 1 28 LEU QD 1 32 GLU HB3 3.510 2.200 3.510 2.280 2.169 3.119 0.031 14 0 "[ . 1 . 2]" 1 595 1 35 GLU HB3 1 39 THR MG 3.510 2.200 3.510 2.979 2.877 3.168 . 0 0 "[ . 1 . 2]" 1 596 1 61 LEU QD 1 69 VAL MG1 3.510 2.200 3.510 2.392 2.198 2.623 0.002 10 0 "[ . 1 . 2]" 1 597 1 66 ASP H 1 66 ASP QB 3.510 2.200 3.510 2.584 2.406 2.671 . 0 0 "[ . 1 . 2]" 1 598 1 87 ASN HA 1 87 ASN HB3 3.510 2.200 3.510 2.616 2.472 3.010 . 0 0 "[ . 1 . 2]" 1 599 2 13 ASN HA 2 13 ASN HB2 3.510 2.200 3.510 3.015 3.013 3.018 . 0 0 "[ . 1 . 2]" 1 600 2 19 SER HA 2 19 SER HB2 3.510 2.200 3.510 2.478 2.443 2.505 . 0 0 "[ . 1 . 2]" 1 601 2 28 LEU QD 2 32 GLU HB3 3.510 2.200 3.510 2.279 2.168 3.119 0.032 14 0 "[ . 1 . 2]" 1 602 2 35 GLU HB3 2 39 THR MG 3.510 2.200 3.510 2.979 2.877 3.168 . 0 0 "[ . 1 . 2]" 1 603 2 61 LEU QD 2 69 VAL MG1 3.510 2.200 3.510 2.392 2.198 2.623 0.002 10 0 "[ . 1 . 2]" 1 604 2 66 ASP H 2 66 ASP QB 3.510 2.200 3.510 2.584 2.406 2.672 . 0 0 "[ . 1 . 2]" 1 605 2 87 ASN HA 2 87 ASN HB3 3.510 2.200 3.510 2.616 2.471 3.009 . 0 0 "[ . 1 . 2]" 1 606 1 12 ILE HB 1 13 ASN H 3.520 2.200 3.520 2.550 2.513 2.583 . 0 0 "[ . 1 . 2]" 1 607 1 33 LEU HA 1 37 LEU MD2 3.520 2.200 3.520 2.992 2.791 3.145 . 0 0 "[ . 1 . 2]" 1 608 1 33 LEU QD 1 58 MET HB3 3.520 2.200 3.520 2.468 2.190 2.640 0.010 14 0 "[ . 1 . 2]" 1 609 1 43 GLY QA 1 44 PHE H 3.520 2.200 3.520 2.799 2.782 2.821 . 0 0 "[ . 1 . 2]" 1 610 1 45 LEU MD1 1 54 VAL HA 3.520 2.200 3.520 3.010 2.740 3.422 . 0 0 "[ . 1 . 2]" 1 611 1 50 ASP HA 1 51 VAL H 3.520 2.200 3.520 2.204 2.186 2.287 0.014 14 0 "[ . 1 . 2]" 1 612 1 67 GLY HA2 1 68 GLU H 3.520 2.200 3.520 3.274 3.206 3.343 . 0 0 "[ . 1 . 2]" 1 613 2 12 ILE HB 2 13 ASN H 3.520 2.200 3.520 2.550 2.512 2.582 . 0 0 "[ . 1 . 2]" 1 614 2 33 LEU HA 2 37 LEU MD2 3.520 2.200 3.520 2.992 2.793 3.145 . 0 0 "[ . 1 . 2]" 1 615 2 33 LEU QD 2 58 MET HB3 3.520 2.200 3.520 2.468 2.190 2.640 0.010 14 0 "[ . 1 . 2]" 1 616 2 43 GLY QA 2 44 PHE H 3.520 2.200 3.520 2.799 2.781 2.822 . 0 0 "[ . 1 . 2]" 1 617 2 45 LEU MD1 2 54 VAL HA 3.520 2.200 3.520 3.010 2.741 3.423 . 0 0 "[ . 1 . 2]" 1 618 2 50 ASP HA 2 51 VAL H 3.520 2.200 3.520 2.204 2.186 2.287 0.014 10 0 "[ . 1 . 2]" 1 619 2 67 GLY HA2 2 68 GLU H 3.520 2.200 3.520 3.275 3.208 3.343 . 0 0 "[ . 1 . 2]" 1 620 2 81 LEU QB 2 81 LEU MD2 3.520 2.200 3.520 2.148 2.144 2.149 0.056 16 0 "[ . 1 . 2]" 1 621 1 28 LEU HB3 1 28 LEU QD 3.530 2.200 3.530 2.279 2.218 2.335 . 0 0 "[ . 1 . 2]" 1 622 1 69 VAL MG1 1 74 TYR H 3.530 2.200 3.530 2.947 2.842 3.043 . 0 0 "[ . 1 . 2]" 1 623 2 28 LEU HB3 2 28 LEU QD 3.530 2.200 3.530 2.279 2.218 2.335 . 0 0 "[ . 1 . 2]" 1 624 2 69 VAL MG1 2 74 TYR H 3.530 2.200 3.530 2.947 2.841 3.043 . 0 0 "[ . 1 . 2]" 1 625 1 28 LEU QD 1 69 VAL MG1 3.540 2.200 3.540 2.923 2.391 3.319 . 0 0 "[ . 1 . 2]" 1 626 1 61 LEU H 1 61 LEU QD 3.540 2.200 3.540 3.012 2.933 3.088 . 0 0 "[ . 1 . 2]" 1 627 1 78 VAL H 1 79 ALA H 3.540 2.200 3.540 2.655 2.623 2.682 . 0 0 "[ . 1 . 2]" 1 628 1 87 ASN H 1 88 PHE H 3.540 2.200 3.540 2.709 2.613 2.831 . 0 0 "[ . 1 . 2]" 1 629 2 28 LEU QD 2 69 VAL MG1 3.540 2.200 3.540 2.924 2.391 3.322 . 0 0 "[ . 1 . 2]" 1 630 2 61 LEU H 2 61 LEU QD 3.540 2.200 3.540 3.013 2.934 3.089 . 0 0 "[ . 1 . 2]" 1 631 2 78 VAL H 2 79 ALA H 3.540 2.200 3.540 2.655 2.623 2.681 . 0 0 "[ . 1 . 2]" 1 632 2 87 ASN H 2 88 PHE H 3.540 2.200 3.540 2.710 2.614 2.831 . 0 0 "[ . 1 . 2]" 1 633 1 4 LEU HA 1 7 ALA MB 3.550 2.200 3.550 2.802 2.601 2.949 . 0 0 "[ . 1 . 2]" 1 634 1 17 ALA MB 1 18 HIS H 3.550 2.200 3.550 2.231 2.167 2.351 0.033 6 0 "[ . 1 . 2]" 1 635 1 28 LEU QD 1 33 LEU HA 3.550 2.200 3.550 2.512 2.307 2.921 . 0 0 "[ . 1 . 2]" 1 636 1 31 LYS H 1 32 GLU H 3.550 2.200 3.550 2.726 2.693 2.754 . 0 0 "[ . 1 . 2]" 1 637 1 36 LEU MD1 1 74 TYR HE1 3.550 2.200 3.550 2.607 2.238 3.767 0.217 4 0 "[ . 1 . 2]" 1 638 1 36 LEU MD2 1 74 TYR HE1 3.550 2.200 3.550 3.266 2.868 4.163 0.613 4 3 "[ +. * 1 - . 2]" 1 639 1 70 ASP HA 1 71 PHE H 3.550 2.200 3.550 2.376 2.308 2.482 . 0 0 "[ . 1 . 2]" 1 640 2 4 LEU HA 2 7 ALA MB 3.550 2.200 3.550 2.801 2.600 2.949 . 0 0 "[ . 1 . 2]" 1 641 2 17 ALA MB 2 18 HIS H 3.550 2.200 3.550 2.231 2.165 2.350 0.035 6 0 "[ . 1 . 2]" 1 642 2 28 LEU QD 2 33 LEU HA 3.550 2.200 3.550 2.512 2.307 2.921 . 0 0 "[ . 1 . 2]" 1 643 2 31 LYS H 2 32 GLU H 3.550 2.200 3.550 2.726 2.695 2.753 . 0 0 "[ . 1 . 2]" 1 644 2 36 LEU MD1 2 74 TYR HE1 3.550 2.200 3.550 2.611 2.263 3.773 0.223 4 0 "[ . 1 . 2]" 1 645 2 36 LEU MD2 2 74 TYR HE1 3.550 2.200 3.550 3.263 2.867 4.161 0.611 4 3 "[ +. * 1 - . 2]" 1 646 2 70 ASP HA 2 71 PHE H 3.550 2.200 3.550 2.376 2.310 2.478 . 0 0 "[ . 1 . 2]" 1 647 1 18 HIS QB 1 28 LEU QD 3.560 2.200 3.560 2.323 2.163 2.705 0.037 13 0 "[ . 1 . 2]" 1 648 1 35 GLU H 1 36 LEU H 3.560 2.200 3.560 2.605 2.565 2.662 . 0 0 "[ . 1 . 2]" 1 649 1 36 LEU HB3 1 37 LEU MD2 3.560 2.200 3.560 2.291 2.226 2.343 . 0 0 "[ . 1 . 2]" 1 650 1 49 LYS HA 1 50 ASP H 3.560 2.200 3.560 3.446 2.870 3.561 0.001 19 0 "[ . 1 . 2]" 1 651 1 58 MET HA 1 61 LEU H 3.560 2.200 3.560 3.277 3.076 3.389 . 0 0 "[ . 1 . 2]" 1 652 1 65 GLY H 1 66 ASP H 3.560 2.200 3.560 2.328 2.175 2.551 0.025 4 0 "[ . 1 . 2]" 1 653 1 72 GLN HA 1 72 GLN HG3 3.560 2.200 3.560 2.955 2.944 2.963 . 0 0 "[ . 1 . 2]" 1 654 1 72 GLN HA 1 75 VAL HB 3.560 2.200 3.560 2.352 2.331 2.380 . 0 0 "[ . 1 . 2]" 1 655 1 73 GLU HA 1 76 VAL MG2 3.560 2.200 3.560 2.182 2.178 2.185 0.022 20 0 "[ . 1 . 2]" 1 656 2 35 GLU H 2 36 LEU H 3.560 2.200 3.560 2.605 2.564 2.663 . 0 0 "[ . 1 . 2]" 1 657 2 36 LEU HB3 2 37 LEU MD2 3.560 2.200 3.560 2.291 2.226 2.347 . 0 0 "[ . 1 . 2]" 1 658 2 49 LYS HA 2 50 ASP H 3.560 2.200 3.560 3.446 2.870 3.562 0.002 19 0 "[ . 1 . 2]" 1 659 2 58 MET HA 2 61 LEU H 3.560 2.200 3.560 3.277 3.076 3.389 . 0 0 "[ . 1 . 2]" 1 660 2 65 GLY H 2 66 ASP H 3.560 2.200 3.560 2.328 2.174 2.551 0.026 4 0 "[ . 1 . 2]" 1 661 2 72 GLN HA 2 72 GLN HG3 3.560 2.200 3.560 2.955 2.943 2.963 . 0 0 "[ . 1 . 2]" 1 662 2 72 GLN HA 2 75 VAL HB 3.560 2.200 3.560 2.352 2.331 2.379 . 0 0 "[ . 1 . 2]" 1 663 2 73 GLU HA 2 76 VAL MG2 3.560 2.200 3.560 2.181 2.178 2.185 0.022 20 0 "[ . 1 . 2]" 1 664 1 8 MET HB2 1 8 MET ME 3.570 2.200 3.570 3.183 3.119 3.267 . 0 0 "[ . 1 . 2]" 1 665 1 14 VAL H 1 14 VAL MG2 3.570 2.200 3.570 2.167 2.158 2.179 0.042 12 0 "[ . 1 . 2]" 1 666 1 15 PHE H 1 15 PHE HB2 3.570 2.200 3.570 2.613 2.579 2.664 . 0 0 "[ . 1 . 2]" 1 667 1 30 LYS HB3 1 31 LYS H 3.570 2.200 3.570 2.263 2.199 2.338 0.001 4 0 "[ . 1 . 2]" 1 668 1 34 LYS QE 1 54 VAL MG2 3.570 2.200 3.570 3.587 3.574 3.598 0.028 14 0 "[ . 1 . 2]" 1 669 1 54 VAL HA 1 57 VAL MG2 3.570 2.200 3.570 2.873 2.503 3.177 . 0 0 "[ . 1 . 2]" 1 670 2 8 MET HB2 2 8 MET ME 3.570 2.200 3.570 3.184 3.119 3.267 . 0 0 "[ . 1 . 2]" 1 671 2 14 VAL H 2 14 VAL MG2 3.570 2.200 3.570 2.167 2.158 2.180 0.042 12 0 "[ . 1 . 2]" 1 672 2 15 PHE H 2 15 PHE HB2 3.570 2.200 3.570 2.613 2.578 2.665 . 0 0 "[ . 1 . 2]" 1 673 2 30 LYS HB3 2 31 LYS H 3.570 2.200 3.570 2.262 2.197 2.338 0.003 4 0 "[ . 1 . 2]" 1 674 2 34 LYS QE 2 54 VAL MG2 3.570 2.200 3.570 3.587 3.575 3.597 0.027 14 0 "[ . 1 . 2]" 1 675 2 54 VAL HA 2 57 VAL MG2 3.570 2.200 3.570 2.873 2.503 3.178 . 0 0 "[ . 1 . 2]" 1 676 1 38 GLN HA 1 38 GLN HG3 3.580 2.200 3.580 2.940 2.908 3.059 . 0 0 "[ . 1 . 2]" 1 677 2 38 GLN HA 2 38 GLN HG3 3.580 2.200 3.580 2.940 2.908 3.059 . 0 0 "[ . 1 . 2]" 1 678 1 4 LEU QD 1 7 ALA MB 3.590 2.200 3.590 3.037 2.585 3.290 . 0 0 "[ . 1 . 2]" 1 679 1 21 LYS HE2 1 21 LYS HG2 3.590 2.200 3.590 2.283 2.261 2.297 . 0 0 "[ . 1 . 2]" 1 680 1 56 LYS HB2 1 57 VAL H 3.590 2.200 3.590 2.656 2.620 2.751 . 0 0 "[ . 1 . 2]" 1 681 1 58 MET ME 1 69 VAL MG2 3.590 2.200 3.590 2.563 2.288 2.833 . 0 0 "[ . 1 . 2]" 1 682 1 81 LEU HB2 1 81 LEU MD2 3.590 2.200 3.590 2.338 2.274 2.400 . 0 0 "[ . 1 . 2]" 1 683 2 4 LEU QD 2 7 ALA MB 3.590 2.200 3.590 3.036 2.583 3.290 . 0 0 "[ . 1 . 2]" 1 684 2 21 LYS HE2 2 21 LYS HG2 3.590 2.200 3.590 2.283 2.262 2.298 . 0 0 "[ . 1 . 2]" 1 685 2 56 LYS HB2 2 57 VAL H 3.590 2.200 3.590 2.656 2.620 2.752 . 0 0 "[ . 1 . 2]" 1 686 2 58 MET ME 2 69 VAL MG2 3.590 2.200 3.590 2.563 2.289 2.834 . 0 0 "[ . 1 . 2]" 1 687 1 54 VAL H 1 54 VAL HB 3.600 2.200 3.600 2.446 2.370 2.515 . 0 0 "[ . 1 . 2]" 1 688 1 64 ASN H 1 64 ASN HB3 3.600 2.200 3.600 2.975 2.269 3.443 . 0 0 "[ . 1 . 2]" 1 689 2 54 VAL H 2 54 VAL HB 3.600 2.200 3.600 2.446 2.369 2.516 . 0 0 "[ . 1 . 2]" 1 690 2 64 ASN H 2 64 ASN HB3 3.600 2.200 3.600 2.975 2.269 3.443 . 0 0 "[ . 1 . 2]" 1 691 1 14 VAL MG2 1 15 PHE H 3.610 2.200 3.610 2.174 2.162 2.184 0.038 5 0 "[ . 1 . 2]" 1 692 1 15 PHE HA 1 36 LEU QD 3.610 2.200 3.610 2.331 2.182 2.961 0.018 17 0 "[ . 1 . 2]" 1 693 1 20 GLY H 1 21 LYS H 3.610 2.200 3.610 2.613 2.555 2.671 . 0 0 "[ . 1 . 2]" 1 694 1 29 SER H 1 32 GLU HB2 3.610 2.200 3.610 2.220 2.185 2.391 0.015 6 0 "[ . 1 . 2]" 1 695 1 37 LEU HB2 1 38 GLN H 3.610 2.200 3.610 2.699 2.662 2.738 . 0 0 "[ . 1 . 2]" 1 696 1 71 PHE H 1 72 GLN H 3.610 2.200 3.610 2.891 2.863 2.919 . 0 0 "[ . 1 . 2]" 1 697 1 74 TYR H 1 75 VAL H 3.610 2.200 3.610 2.520 2.500 2.530 . 0 0 "[ . 1 . 2]" 1 698 2 14 VAL MG2 2 15 PHE H 3.610 2.200 3.610 2.174 2.163 2.184 0.037 9 0 "[ . 1 . 2]" 1 699 2 15 PHE HA 2 36 LEU QD 3.610 2.200 3.610 2.332 2.183 2.960 0.017 17 0 "[ . 1 . 2]" 1 700 2 20 GLY H 2 21 LYS H 3.610 2.200 3.610 2.613 2.554 2.671 . 0 0 "[ . 1 . 2]" 1 701 2 29 SER H 2 32 GLU HB2 3.610 2.200 3.610 2.219 2.184 2.390 0.016 6 0 "[ . 1 . 2]" 1 702 2 37 LEU HB2 2 38 GLN H 3.610 2.200 3.610 2.699 2.662 2.738 . 0 0 "[ . 1 . 2]" 1 703 2 71 PHE H 2 72 GLN H 3.610 2.200 3.610 2.886 2.860 2.915 . 0 0 "[ . 1 . 2]" 1 704 2 74 TYR H 2 75 VAL H 3.610 2.200 3.610 2.519 2.499 2.530 . 0 0 "[ . 1 . 2]" 1 705 2 81 LEU QB 2 81 LEU MD1 3.610 2.200 3.610 2.429 2.369 2.457 . 0 0 "[ . 1 . 2]" 1 706 1 10 THR HB 1 11 LEU H 3.620 2.200 3.620 2.554 2.514 2.596 . 0 0 "[ . 1 . 2]" 1 707 1 31 LYS H 1 31 LYS HG3 3.620 2.200 3.620 3.481 3.344 3.544 . 0 0 "[ . 1 . 2]" 1 708 1 81 LEU H 1 81 LEU MD1 3.620 2.200 3.620 2.236 2.183 2.327 0.017 13 0 "[ . 1 . 2]" 1 709 1 82 THR H 1 83 VAL H 3.620 2.200 3.620 2.801 2.793 2.816 . 0 0 "[ . 1 . 2]" 1 710 2 10 THR HB 2 11 LEU H 3.620 2.200 3.620 2.553 2.515 2.594 . 0 0 "[ . 1 . 2]" 1 711 2 31 LYS H 2 31 LYS HG3 3.620 2.200 3.620 3.483 3.344 3.547 . 0 0 "[ . 1 . 2]" 1 712 2 81 LEU H 2 81 LEU MD1 3.620 2.200 3.620 2.235 2.183 2.326 0.017 7 0 "[ . 1 . 2]" 1 713 2 82 THR H 2 83 VAL H 3.620 2.200 3.620 2.802 2.793 2.817 . 0 0 "[ . 1 . 2]" 1 714 1 26 TYR HB2 1 26 TYR HD2 3.630 2.200 3.630 2.402 2.379 2.509 . 0 0 "[ . 1 . 2]" 1 715 1 26 TYR HB3 1 26 TYR HD1 3.630 2.200 3.630 2.505 2.429 2.525 . 0 0 "[ . 1 . 2]" 1 716 1 28 LEU HB2 1 28 LEU QD 3.630 2.200 3.630 2.120 2.109 2.131 0.091 19 0 "[ . 1 . 2]" 1 717 1 28 LEU QD 1 36 LEU QD 3.630 2.200 3.630 2.393 2.187 3.164 0.013 15 0 "[ . 1 . 2]" 1 718 1 34 LYS HA 1 34 LYS HD3 3.630 2.200 3.630 3.161 3.001 3.220 . 0 0 "[ . 1 . 2]" 1 719 1 54 VAL H 1 54 VAL MG1 3.630 2.200 3.630 2.208 2.185 2.265 0.015 6 0 "[ . 1 . 2]" 1 720 2 26 TYR HB2 2 26 TYR HD2 3.630 2.200 3.630 2.402 2.378 2.508 . 0 0 "[ . 1 . 2]" 1 721 2 26 TYR HB3 2 26 TYR HD1 3.630 2.200 3.630 2.505 2.430 2.526 . 0 0 "[ . 1 . 2]" 1 722 2 28 LEU HB2 2 28 LEU QD 3.630 2.200 3.630 2.120 2.108 2.131 0.092 19 0 "[ . 1 . 2]" 1 723 2 28 LEU QD 2 36 LEU QD 3.630 2.200 3.630 2.392 2.189 3.164 0.011 15 0 "[ . 1 . 2]" 1 724 2 34 LYS HA 2 34 LYS HD3 3.630 2.200 3.630 3.161 3.003 3.219 . 0 0 "[ . 1 . 2]" 1 725 2 54 VAL H 2 54 VAL MG1 3.630 2.200 3.630 2.208 2.184 2.265 0.016 6 0 "[ . 1 . 2]" 1 726 1 10 THR H 1 11 LEU H 3.640 2.200 3.640 2.659 2.640 2.684 . 0 0 "[ . 1 . 2]" 1 727 1 33 LEU HA 1 36 LEU H 3.640 2.200 3.640 2.760 2.609 2.835 . 0 0 "[ . 1 . 2]" 1 728 1 34 LYS HB3 1 35 GLU H 3.640 2.200 3.640 2.720 2.687 2.744 . 0 0 "[ . 1 . 2]" 1 729 1 37 LEU H 1 38 GLN H 3.640 2.200 3.640 2.720 2.685 2.760 . 0 0 "[ . 1 . 2]" 1 730 1 39 THR H 1 39 THR MG 3.640 2.200 3.640 2.199 2.190 2.216 0.010 18 0 "[ . 1 . 2]" 1 731 1 83 VAL MG1 1 84 ALA H 3.640 2.200 3.640 2.171 2.166 2.175 0.034 7 0 "[ . 1 . 2]" 1 732 2 10 THR H 2 11 LEU H 3.640 2.200 3.640 2.695 2.684 2.713 . 0 0 "[ . 1 . 2]" 1 733 2 32 GLU HA 2 32 GLU QG 3.640 2.200 3.640 2.356 2.323 2.382 . 0 0 "[ . 1 . 2]" 1 734 2 33 LEU HA 2 36 LEU H 3.640 2.200 3.640 2.760 2.608 2.836 . 0 0 "[ . 1 . 2]" 1 735 2 34 LYS HB3 2 35 GLU H 3.640 2.200 3.640 2.720 2.686 2.743 . 0 0 "[ . 1 . 2]" 1 736 2 37 LEU H 2 38 GLN H 3.640 2.200 3.640 2.720 2.684 2.760 . 0 0 "[ . 1 . 2]" 1 737 2 39 THR H 2 39 THR MG 3.640 2.200 3.640 2.199 2.190 2.215 0.010 1 0 "[ . 1 . 2]" 1 738 2 83 VAL MG1 2 84 ALA H 3.640 2.200 3.640 2.172 2.166 2.176 0.034 7 0 "[ . 1 . 2]" 1 739 1 15 PHE HD1 1 28 LEU QD 3.650 2.200 3.650 2.791 2.569 3.348 . 0 0 "[ . 1 . 2]" 1 740 1 34 LYS H 1 35 GLU H 3.650 2.200 3.650 2.678 2.654 2.727 . 0 0 "[ . 1 . 2]" 1 741 1 36 LEU HA 1 36 LEU QD 3.650 2.200 3.650 2.623 2.493 2.775 . 0 0 "[ . 1 . 2]" 1 742 1 75 VAL H 1 76 VAL H 3.650 2.200 3.650 2.801 2.789 2.815 . 0 0 "[ . 1 . 2]" 1 743 1 84 ALA MB 1 85 CYS H 3.650 2.200 3.650 2.697 2.621 2.746 . 0 0 "[ . 1 . 2]" 1 744 1 89 PHE QB 1 89 PHE HD1 3.650 2.200 3.650 2.452 2.450 2.458 . 0 0 "[ . 1 . 2]" 1 745 2 15 PHE HD1 2 28 LEU QD 3.650 2.200 3.650 2.791 2.568 3.348 . 0 0 "[ . 1 . 2]" 1 746 2 34 LYS H 2 35 GLU H 3.650 2.200 3.650 2.678 2.655 2.727 . 0 0 "[ . 1 . 2]" 1 747 2 36 LEU HA 2 36 LEU QD 3.650 2.200 3.650 2.625 2.497 2.775 . 0 0 "[ . 1 . 2]" 1 748 2 75 VAL H 2 76 VAL H 3.650 2.200 3.650 2.802 2.790 2.816 . 0 0 "[ . 1 . 2]" 1 749 2 84 ALA MB 2 85 CYS H 3.650 2.200 3.650 2.698 2.622 2.748 . 0 0 "[ . 1 . 2]" 1 750 2 89 PHE QB 2 89 PHE HD1 3.650 2.200 3.650 2.452 2.450 2.458 . 0 0 "[ . 1 . 2]" 1 751 1 14 VAL H 1 15 PHE H 3.660 2.200 3.660 2.623 2.559 2.668 . 0 0 "[ . 1 . 2]" 1 752 1 36 LEU H 1 37 LEU H 3.660 2.200 3.660 2.829 2.798 2.862 . 0 0 "[ . 1 . 2]" 1 753 1 43 GLY QA 1 46 ASP HB3 3.660 2.200 3.660 2.328 2.250 2.509 . 0 0 "[ . 1 . 2]" 1 754 2 14 VAL H 2 15 PHE H 3.660 2.200 3.660 2.623 2.556 2.668 . 0 0 "[ . 1 . 2]" 1 755 2 36 LEU H 2 37 LEU H 3.660 2.200 3.660 2.829 2.799 2.862 . 0 0 "[ . 1 . 2]" 1 756 2 43 GLY QA 2 46 ASP HB3 3.660 2.200 3.660 2.328 2.251 2.508 . 0 0 "[ . 1 . 2]" 1 757 1 19 SER HB2 1 28 LEU QD 3.670 2.200 3.670 2.527 2.196 2.915 0.004 6 0 "[ . 1 . 2]" 1 758 1 41 LEU H 1 41 LEU HB2 3.670 2.200 3.670 2.607 2.580 2.639 . 0 0 "[ . 1 . 2]" 1 759 2 19 SER HB2 2 28 LEU QD 3.670 2.200 3.670 2.526 2.195 2.915 0.005 6 0 "[ . 1 . 2]" 1 760 2 41 LEU H 2 41 LEU HB2 3.670 2.200 3.670 2.607 2.581 2.639 . 0 0 "[ . 1 . 2]" 1 761 1 12 ILE H 1 13 ASN H 3.680 2.200 3.680 2.730 2.698 2.753 . 0 0 "[ . 1 . 2]" 1 762 1 15 PHE H 1 15 PHE HB3 3.680 2.200 3.680 2.552 2.519 2.619 . 0 0 "[ . 1 . 2]" 1 763 1 22 GLU HA 1 22 GLU QG 3.680 2.200 3.680 2.415 2.275 2.827 . 0 0 "[ . 1 . 2]" 1 764 1 29 SER HA 1 68 GLU QG 3.680 2.200 3.680 3.047 2.199 3.721 0.041 17 0 "[ . 1 . 2]" 1 765 1 33 LEU H 1 34 LYS H 3.680 2.200 3.680 2.677 2.606 2.728 . 0 0 "[ . 1 . 2]" 1 766 2 12 ILE H 2 13 ASN H 3.680 2.200 3.680 2.730 2.699 2.753 . 0 0 "[ . 1 . 2]" 1 767 2 15 PHE H 2 15 PHE HB3 3.680 2.200 3.680 2.553 2.518 2.621 . 0 0 "[ . 1 . 2]" 1 768 2 22 GLU HA 2 22 GLU QG 3.680 2.200 3.680 2.415 2.275 2.827 . 0 0 "[ . 1 . 2]" 1 769 2 29 SER HA 2 68 GLU QG 3.680 2.200 3.680 3.045 2.199 3.722 0.042 17 0 "[ . 1 . 2]" 1 770 2 33 LEU H 2 34 LYS H 3.680 2.200 3.680 2.677 2.606 2.729 . 0 0 "[ . 1 . 2]" 1 771 1 37 LEU HA 1 37 LEU MD2 3.690 2.200 3.690 2.234 2.199 2.320 0.001 17 0 "[ . 1 . 2]" 1 772 2 37 LEU HA 2 37 LEU MD2 3.690 2.200 3.690 2.234 2.201 2.320 . 0 0 "[ . 1 . 2]" 1 773 1 9 GLU H 1 9 GLU HG2 3.700 2.200 3.700 3.245 2.280 3.508 . 0 0 "[ . 1 . 2]" 1 774 1 19 SER H 1 28 LEU QD 3.700 2.200 3.700 2.906 2.737 3.121 . 0 0 "[ . 1 . 2]" 1 775 1 44 PHE HA 1 44 PHE HD1 3.700 2.200 3.700 2.868 2.831 2.921 . 0 0 "[ . 1 . 2]" 1 776 1 45 LEU MD1 1 53 ALA MB 3.700 2.200 3.700 3.196 2.931 3.406 . 0 0 "[ . 1 . 2]" 1 777 1 78 VAL HA 1 78 VAL MG2 3.700 2.200 3.700 3.233 3.229 3.238 . 0 0 "[ . 1 . 2]" 1 778 1 81 LEU HB2 1 81 LEU MD1 3.700 2.200 3.700 2.502 2.431 2.535 . 0 0 "[ . 1 . 2]" 1 779 2 9 GLU H 2 9 GLU HG2 3.700 2.200 3.700 3.242 2.274 3.507 . 0 0 "[ . 1 . 2]" 1 780 2 18 HIS H 2 18 HIS HB3 3.700 2.200 3.700 3.440 2.297 3.624 . 0 0 "[ . 1 . 2]" 1 781 2 19 SER H 2 28 LEU QD 3.700 2.200 3.700 2.904 2.729 3.120 . 0 0 "[ . 1 . 2]" 1 782 2 44 PHE HA 2 44 PHE HD1 3.700 2.200 3.700 2.867 2.828 2.921 . 0 0 "[ . 1 . 2]" 1 783 2 45 LEU MD1 2 53 ALA MB 3.700 2.200 3.700 3.196 2.932 3.406 . 0 0 "[ . 1 . 2]" 1 784 2 78 VAL HA 2 78 VAL MG2 3.700 2.200 3.700 3.233 3.229 3.238 . 0 0 "[ . 1 . 2]" 1 785 1 14 VAL HB 1 36 LEU QD 3.710 2.200 3.710 2.561 2.183 2.789 0.017 14 0 "[ . 1 . 2]" 1 786 1 36 LEU QD 1 40 GLU HG2 3.710 2.200 3.710 2.267 2.216 2.423 . 0 0 "[ . 1 . 2]" 1 787 1 86 ASN H 1 87 ASN H 3.710 2.200 3.710 2.698 2.677 2.749 . 0 0 "[ . 1 . 2]" 1 788 2 14 VAL HB 2 36 LEU QD 3.710 2.200 3.710 2.561 2.184 2.790 0.016 14 0 "[ . 1 . 2]" 1 789 2 36 LEU QD 2 40 GLU HG2 3.710 2.200 3.710 2.269 2.215 2.425 . 0 0 "[ . 1 . 2]" 1 790 2 86 ASN H 2 87 ASN H 3.710 2.200 3.710 2.698 2.677 2.749 . 0 0 "[ . 1 . 2]" 1 791 1 4 LEU QD 1 8 MET HG3 3.720 2.200 3.720 2.161 2.141 2.179 0.059 9 0 "[ . 1 . 2]" 1 792 1 32 GLU H 1 33 LEU H 3.720 2.200 3.720 2.933 2.807 3.036 . 0 0 "[ . 1 . 2]" 1 793 1 33 LEU HA 1 36 LEU HB3 3.720 2.200 3.720 2.719 2.546 2.864 . 0 0 "[ . 1 . 2]" 1 794 1 37 LEU HB3 1 37 LEU MD1 3.720 2.200 3.720 2.198 2.194 2.207 0.006 6 0 "[ . 1 . 2]" 1 795 1 52 ASP HA 1 53 ALA H 3.720 2.200 3.720 3.311 3.207 3.471 . 0 0 "[ . 1 . 2]" 1 796 1 61 LEU MD1 1 77 LEU HB2 3.720 2.200 3.720 2.465 2.221 2.692 . 0 0 "[ . 1 . 2]" 1 797 1 61 LEU MD2 1 77 LEU HB2 3.720 2.200 3.720 2.191 2.172 2.211 0.028 20 0 "[ . 1 . 2]" 1 798 1 72 GLN HA 1 72 GLN HG2 3.720 2.200 3.720 2.447 2.428 2.462 . 0 0 "[ . 1 . 2]" 1 799 1 75 VAL HA 1 78 VAL MG2 3.720 2.200 3.720 2.274 2.222 2.356 . 0 0 "[ . 1 . 2]" 1 800 2 4 LEU QD 2 8 MET HG3 3.720 2.200 3.720 2.161 2.140 2.179 0.060 9 0 "[ . 1 . 2]" 1 801 2 32 GLU H 2 33 LEU H 3.720 2.200 3.720 2.934 2.806 3.037 . 0 0 "[ . 1 . 2]" 1 802 2 33 LEU HA 2 36 LEU HB3 3.720 2.200 3.720 2.720 2.548 2.862 . 0 0 "[ . 1 . 2]" 1 803 2 37 LEU HB3 2 37 LEU MD1 3.720 2.200 3.720 2.199 2.194 2.207 0.006 15 0 "[ . 1 . 2]" 1 804 2 52 ASP HA 2 53 ALA H 3.720 2.200 3.720 3.311 3.208 3.470 . 0 0 "[ . 1 . 2]" 1 805 2 61 LEU MD1 2 77 LEU HB2 3.720 2.200 3.720 2.465 2.222 2.691 . 0 0 "[ . 1 . 2]" 1 806 2 61 LEU MD2 2 77 LEU HB2 3.720 2.200 3.720 2.191 2.172 2.211 0.028 20 0 "[ . 1 . 2]" 1 807 2 72 GLN HA 2 72 GLN HG2 3.720 2.200 3.720 2.448 2.428 2.463 . 0 0 "[ . 1 . 2]" 1 808 2 75 VAL HA 2 78 VAL MG2 3.720 2.200 3.720 2.274 2.223 2.356 . 0 0 "[ . 1 . 2]" 1 809 1 13 ASN HB2 1 13 ASN HD21 3.730 2.200 3.730 2.469 2.465 2.472 . 0 0 "[ . 1 . 2]" 1 810 1 15 PHE H 1 16 HIS H 3.730 2.200 3.730 2.649 2.610 2.714 . 0 0 "[ . 1 . 2]" 1 811 1 25 LYS HA 1 25 LYS QG 3.730 2.200 3.730 2.396 2.345 2.531 . 0 0 "[ . 1 . 2]" 1 812 1 32 GLU HA 1 32 GLU HG2 3.730 2.200 3.730 2.443 2.398 2.473 . 0 0 "[ . 1 . 2]" 1 813 1 35 GLU HB2 1 36 LEU H 3.730 2.200 3.730 2.693 2.637 2.766 . 0 0 "[ . 1 . 2]" 1 814 1 59 LYS HB2 1 60 GLU H 3.730 2.200 3.730 2.711 2.617 2.808 . 0 0 "[ . 1 . 2]" 1 815 2 13 ASN HB2 2 13 ASN HD21 3.730 2.200 3.730 2.469 2.465 2.472 . 0 0 "[ . 1 . 2]" 1 816 2 15 PHE H 2 16 HIS H 3.730 2.200 3.730 2.649 2.608 2.713 . 0 0 "[ . 1 . 2]" 1 817 2 25 LYS HA 2 25 LYS QG 3.730 2.200 3.730 2.396 2.345 2.530 . 0 0 "[ . 1 . 2]" 1 818 2 35 GLU HB2 2 36 LEU H 3.730 2.200 3.730 2.693 2.638 2.766 . 0 0 "[ . 1 . 2]" 1 819 2 59 LYS HB2 2 60 GLU H 3.730 2.200 3.730 2.711 2.617 2.809 . 0 0 "[ . 1 . 2]" 1 820 1 19 SER H 1 19 SER HB2 3.740 2.200 3.740 2.530 2.475 2.557 . 0 0 "[ . 1 . 2]" 1 821 1 26 TYR HA 1 27 LYS H 3.740 2.200 3.740 3.128 3.088 3.181 . 0 0 "[ . 1 . 2]" 1 822 1 29 SER HA 1 58 MET ME 3.740 2.200 3.740 3.673 3.567 3.757 0.017 3 0 "[ . 1 . 2]" 1 823 1 44 PHE HB2 1 44 PHE HD2 3.740 2.200 3.740 2.450 2.411 2.483 . 0 0 "[ . 1 . 2]" 1 824 1 69 VAL MG1 1 70 ASP H 3.740 2.200 3.740 2.662 2.547 2.789 . 0 0 "[ . 1 . 2]" 1 825 1 90 TRP HA 1 90 TRP HD1 3.740 2.200 3.740 3.775 3.752 3.823 0.083 5 0 "[ . 1 . 2]" 1 826 2 19 SER H 2 19 SER HB2 3.740 2.200 3.740 2.530 2.473 2.557 . 0 0 "[ . 1 . 2]" 1 827 2 26 TYR HA 2 27 LYS H 3.740 2.200 3.740 3.128 3.090 3.182 . 0 0 "[ . 1 . 2]" 1 828 2 27 LYS HB2 2 27 LYS QD 3.740 2.200 3.740 2.235 2.202 2.308 . 0 0 "[ . 1 . 2]" 1 829 2 29 SER HA 2 58 MET ME 3.740 2.200 3.740 3.673 3.567 3.756 0.016 3 0 "[ . 1 . 2]" 1 830 2 44 PHE HB2 2 44 PHE HD2 3.740 2.200 3.740 2.450 2.412 2.481 . 0 0 "[ . 1 . 2]" 1 831 2 69 VAL MG1 2 70 ASP H 3.740 2.200 3.740 2.660 2.545 2.789 . 0 0 "[ . 1 . 2]" 1 832 2 90 TRP HA 2 90 TRP HD1 3.740 2.200 3.740 3.774 3.752 3.822 0.082 5 0 "[ . 1 . 2]" 1 833 1 61 LEU HB2 1 61 LEU MD1 3.750 2.200 3.750 2.262 2.228 2.299 . 0 0 "[ . 1 . 2]" 1 834 1 61 LEU HB2 1 61 LEU MD2 3.750 2.200 3.750 3.216 3.203 3.223 . 0 0 "[ . 1 . 2]" 1 835 1 71 PHE HA 1 71 PHE HD1 3.750 2.200 3.750 2.254 2.245 2.267 . 0 0 "[ . 1 . 2]" 1 836 2 61 LEU HB2 2 61 LEU MD1 3.750 2.200 3.750 2.262 2.229 2.298 . 0 0 "[ . 1 . 2]" 1 837 2 61 LEU HB2 2 61 LEU MD2 3.750 2.200 3.750 3.216 3.204 3.224 . 0 0 "[ . 1 . 2]" 1 838 2 71 PHE HA 2 71 PHE HD1 3.750 2.200 3.750 2.254 2.245 2.266 . 0 0 "[ . 1 . 2]" 1 839 1 19 SER H 1 20 GLY H 3.760 2.200 3.760 2.684 2.607 2.755 . 0 0 "[ . 1 . 2]" 1 840 1 30 LYS QE 1 31 LYS H 3.760 2.200 3.760 3.397 3.250 3.484 . 0 0 "[ . 1 . 2]" 1 841 1 33 LEU QD 1 69 VAL HB 3.760 2.200 3.760 2.551 2.394 2.703 . 0 0 "[ . 1 . 2]" 1 842 1 44 PHE HB3 1 44 PHE HD1 3.760 2.200 3.760 2.459 2.441 2.482 . 0 0 "[ . 1 . 2]" 1 843 1 47 ALA MB 1 48 GLN H 3.760 2.200 3.760 2.773 2.646 2.901 . 0 0 "[ . 1 . 2]" 1 844 1 69 VAL H 1 69 VAL MG2 3.760 2.200 3.760 2.451 2.274 2.559 . 0 0 "[ . 1 . 2]" 1 845 1 76 VAL HA 1 76 VAL MG2 3.760 2.200 3.760 3.201 3.198 3.204 . 0 0 "[ . 1 . 2]" 1 846 1 83 VAL HA 1 83 VAL MG1 3.760 2.200 3.760 3.222 3.218 3.225 . 0 0 "[ . 1 . 2]" 1 847 2 18 HIS HB3 2 36 LEU QD 3.760 2.200 3.760 3.082 2.154 3.297 0.046 6 0 "[ . 1 . 2]" 1 848 2 19 SER H 2 20 GLY H 3.760 2.200 3.760 2.685 2.608 2.756 . 0 0 "[ . 1 . 2]" 1 849 2 30 LYS QE 2 31 LYS H 3.760 2.200 3.760 3.396 3.249 3.484 . 0 0 "[ . 1 . 2]" 1 850 2 33 LEU QD 2 69 VAL HB 3.760 2.200 3.760 2.552 2.394 2.704 . 0 0 "[ . 1 . 2]" 1 851 2 44 PHE HB3 2 44 PHE HD1 3.760 2.200 3.760 2.459 2.442 2.482 . 0 0 "[ . 1 . 2]" 1 852 2 47 ALA MB 2 48 GLN H 3.760 2.200 3.760 2.773 2.647 2.901 . 0 0 "[ . 1 . 2]" 1 853 2 69 VAL H 2 69 VAL MG2 3.760 2.200 3.760 2.451 2.273 2.560 . 0 0 "[ . 1 . 2]" 1 854 2 76 VAL HA 2 76 VAL MG2 3.760 2.200 3.760 3.202 3.198 3.205 . 0 0 "[ . 1 . 2]" 1 855 2 83 VAL HA 2 83 VAL MG1 3.760 2.200 3.760 3.222 3.218 3.225 . 0 0 "[ . 1 . 2]" 1 856 1 11 LEU H 1 12 ILE H 3.770 2.200 3.770 2.622 2.600 2.643 . 0 0 "[ . 1 . 2]" 1 857 1 18 HIS H 1 18 HIS HB2 3.770 2.200 3.770 2.538 2.275 3.782 0.012 16 0 "[ . 1 . 2]" 1 858 1 18 HIS H 1 18 HIS HB3 3.770 2.200 3.770 3.439 2.278 3.623 . 0 0 "[ . 1 . 2]" 1 859 1 28 LEU QD 1 33 LEU QD 3.770 2.200 3.770 2.681 2.177 2.949 0.023 14 0 "[ . 1 . 2]" 1 860 1 36 LEU QD 1 37 LEU HA 3.770 2.200 3.770 2.787 2.616 2.853 . 0 0 "[ . 1 . 2]" 1 861 1 38 GLN H 1 38 GLN HG3 3.770 2.200 3.770 2.260 2.221 2.313 . 0 0 "[ . 1 . 2]" 1 862 1 90 TRP HB3 1 91 GLU H 3.770 2.200 3.770 2.536 2.247 2.648 . 0 0 "[ . 1 . 2]" 1 863 2 11 LEU H 2 12 ILE H 3.770 2.200 3.770 2.621 2.598 2.640 . 0 0 "[ . 1 . 2]" 1 864 2 18 HIS H 2 18 HIS HB2 3.770 2.200 3.770 2.540 2.279 3.782 0.012 16 0 "[ . 1 . 2]" 1 865 2 28 LEU QD 2 33 LEU QD 3.770 2.200 3.770 2.682 2.177 2.951 0.023 14 0 "[ . 1 . 2]" 1 866 2 36 LEU QD 2 37 LEU HA 3.770 2.200 3.770 2.788 2.616 2.856 . 0 0 "[ . 1 . 2]" 1 867 2 38 GLN H 2 38 GLN HG3 3.770 2.200 3.770 2.260 2.221 2.312 . 0 0 "[ . 1 . 2]" 1 868 2 90 TRP HB3 2 91 GLU H 3.770 2.200 3.770 2.536 2.244 2.651 . 0 0 "[ . 1 . 2]" 1 869 1 16 HIS HA 1 19 SER HB3 3.780 2.200 3.780 2.920 2.547 3.159 . 0 0 "[ . 1 . 2]" 1 870 1 30 LYS HG2 1 54 VAL MG1 3.780 2.200 3.780 3.191 2.787 3.432 . 0 0 "[ . 1 . 2]" 1 871 1 48 GLN H 1 48 GLN HG2 3.780 2.200 3.780 2.232 2.172 2.298 0.028 12 0 "[ . 1 . 2]" 1 872 1 77 LEU HB3 1 78 VAL H 3.780 2.200 3.780 2.432 2.402 2.466 . 0 0 "[ . 1 . 2]" 1 873 2 16 HIS HA 2 19 SER HB3 3.780 2.200 3.780 2.920 2.548 3.157 . 0 0 "[ . 1 . 2]" 1 874 2 30 LYS HG2 2 54 VAL MG1 3.780 2.200 3.780 3.191 2.789 3.432 . 0 0 "[ . 1 . 2]" 1 875 2 48 GLN H 2 48 GLN HG2 3.780 2.200 3.780 2.232 2.170 2.298 0.030 12 0 "[ . 1 . 2]" 1 876 2 77 LEU HB3 2 78 VAL H 3.780 2.200 3.780 2.432 2.403 2.467 . 0 0 "[ . 1 . 2]" 1 877 1 8 MET HA 1 8 MET HG3 3.790 2.200 3.790 2.960 2.863 3.006 . 0 0 "[ . 1 . 2]" 1 878 1 12 ILE HA 1 71 PHE HE1 3.790 2.200 3.790 3.576 3.432 3.674 . 0 0 "[ . 1 . 2]" 1 879 1 20 GLY HA2 1 25 LYS QB 3.790 2.200 3.790 3.048 2.822 3.386 . 0 0 "[ . 1 . 2]" 1 880 1 33 LEU HB2 1 33 LEU MD1 3.790 2.200 3.790 2.221 2.190 2.242 0.010 7 0 "[ . 1 . 2]" 1 881 1 33 LEU HB2 1 33 LEU MD2 3.790 2.200 3.790 2.758 2.675 2.967 . 0 0 "[ . 1 . 2]" 1 882 1 75 VAL H 1 75 VAL MG2 3.790 2.200 3.790 3.388 3.372 3.407 . 0 0 "[ . 1 . 2]" 1 883 1 79 ALA HA 1 82 THR HB 3.790 2.200 3.790 2.759 2.732 2.798 . 0 0 "[ . 1 . 2]" 1 884 1 86 ASN H 1 86 ASN HB3 3.790 2.200 3.790 2.721 2.667 2.759 . 0 0 "[ . 1 . 2]" 1 885 2 8 MET HA 2 8 MET HG3 3.790 2.200 3.790 2.961 2.863 3.007 . 0 0 "[ . 1 . 2]" 1 886 2 12 ILE HA 2 71 PHE HE1 3.790 2.200 3.790 3.576 3.431 3.673 . 0 0 "[ . 1 . 2]" 1 887 2 20 GLY HA2 2 25 LYS QB 3.790 2.200 3.790 3.048 2.823 3.386 . 0 0 "[ . 1 . 2]" 1 888 2 33 LEU HB2 2 33 LEU MD1 3.790 2.200 3.790 2.221 2.190 2.241 0.010 7 0 "[ . 1 . 2]" 1 889 2 33 LEU HB2 2 33 LEU MD2 3.790 2.200 3.790 2.758 2.676 2.966 . 0 0 "[ . 1 . 2]" 1 890 2 75 VAL H 2 75 VAL MG2 3.790 2.200 3.790 3.388 3.372 3.407 . 0 0 "[ . 1 . 2]" 1 891 2 79 ALA HA 2 82 THR HB 3.790 2.200 3.790 2.759 2.734 2.798 . 0 0 "[ . 1 . 2]" 1 892 2 86 ASN H 2 86 ASN HB3 3.790 2.200 3.790 2.721 2.669 2.759 . 0 0 "[ . 1 . 2]" 1 893 1 44 PHE HA 1 47 ALA MB 3.800 2.200 3.800 3.136 2.992 3.299 . 0 0 "[ . 1 . 2]" 1 894 1 44 PHE HD1 1 81 LEU MD2 3.800 2.200 3.800 3.098 2.496 3.580 . 0 0 "[ . 1 . 2]" 1 895 1 46 ASP HB3 1 47 ALA H 3.800 2.200 3.800 2.883 2.805 2.957 . 0 0 "[ . 1 . 2]" 1 896 1 58 MET HG3 1 59 LYS H 3.800 2.200 3.800 2.179 2.165 2.199 0.035 8 0 "[ . 1 . 2]" 1 897 2 10 THR MG 2 11 LEU QD 3.800 2.200 3.800 3.165 2.990 3.302 . 0 0 "[ . 1 . 2]" 1 898 2 27 LYS HA 2 27 LYS QD 3.800 2.200 3.800 2.168 2.154 2.182 0.046 14 0 "[ . 1 . 2]" 1 899 2 44 PHE HA 2 47 ALA MB 3.800 2.200 3.800 3.137 2.993 3.299 . 0 0 "[ . 1 . 2]" 1 900 2 44 PHE HD1 2 81 LEU MD2 3.800 2.200 3.800 3.096 2.489 3.578 . 0 0 "[ . 1 . 2]" 1 901 2 46 ASP HB3 2 47 ALA H 3.800 2.200 3.800 2.883 2.805 2.956 . 0 0 "[ . 1 . 2]" 1 902 2 58 MET HG3 2 59 LYS H 3.800 2.200 3.800 2.179 2.166 2.199 0.034 8 0 "[ . 1 . 2]" 1 903 1 4 LEU H 1 5 GLU H 3.810 2.200 3.810 2.606 2.511 2.694 . 0 0 "[ . 1 . 2]" 1 904 1 10 THR MG 1 11 LEU MD2 3.810 2.200 3.810 3.163 2.986 3.308 . 0 0 "[ . 1 . 2]" 1 905 1 12 ILE MG 1 13 ASN H 3.810 2.200 3.810 3.297 3.287 3.310 . 0 0 "[ . 1 . 2]" 1 906 1 41 LEU HA 1 41 LEU HG 3.810 2.200 3.810 3.265 3.205 3.313 . 0 0 "[ . 1 . 2]" 1 907 1 61 LEU QD 1 74 TYR HA 3.810 2.200 3.810 3.237 3.103 3.328 . 0 0 "[ . 1 . 2]" 1 908 2 4 LEU H 2 5 GLU H 3.810 2.200 3.810 2.607 2.513 2.694 . 0 0 "[ . 1 . 2]" 1 909 2 12 ILE MG 2 13 ASN H 3.810 2.200 3.810 3.297 3.287 3.310 . 0 0 "[ . 1 . 2]" 1 910 2 41 LEU HA 2 41 LEU HG 3.810 2.200 3.810 3.265 3.203 3.314 . 0 0 "[ . 1 . 2]" 1 911 2 61 LEU QD 2 74 TYR HA 3.810 2.200 3.810 3.237 3.104 3.328 . 0 0 "[ . 1 . 2]" 1 912 1 26 TYR HA 1 26 TYR HD1 3.820 2.200 3.820 2.702 2.647 2.849 . 0 0 "[ . 1 . 2]" 1 913 1 90 TRP HB3 1 90 TRP HE1 4.820 2.200 4.820 4.776 4.759 4.796 . 0 0 "[ . 1 . 2]" 1 914 2 18 HIS HB2 2 36 LEU QD 3.820 2.200 3.820 2.425 2.161 3.800 0.039 5 0 "[ . 1 . 2]" 1 915 2 26 TYR HA 2 26 TYR HD1 3.820 2.200 3.820 2.702 2.647 2.848 . 0 0 "[ . 1 . 2]" 1 916 2 90 TRP HB3 2 90 TRP HE1 4.820 2.200 4.820 4.776 4.759 4.796 . 0 0 "[ . 1 . 2]" 1 917 1 12 ILE HA 1 12 ILE HG13 3.830 2.200 3.830 2.875 2.855 2.905 . 0 0 "[ . 1 . 2]" 1 918 1 15 PHE HA 1 15 PHE HD1 3.830 2.200 3.830 2.543 2.466 2.619 . 0 0 "[ . 1 . 2]" 1 919 1 17 ALA MB 1 36 LEU HG 3.830 2.200 3.830 3.895 3.876 3.955 0.125 6 0 "[ . 1 . 2]" 1 920 1 41 LEU MD2 1 42 SER H 3.830 2.200 3.830 3.551 3.506 3.597 . 0 0 "[ . 1 . 2]" 1 921 1 54 VAL H 1 55 ASP H 3.830 2.200 3.830 2.679 2.638 2.712 . 0 0 "[ . 1 . 2]" 1 922 2 12 ILE HA 2 12 ILE HG13 3.830 2.200 3.830 2.874 2.853 2.905 . 0 0 "[ . 1 . 2]" 1 923 2 15 PHE HA 2 15 PHE HD1 3.830 2.200 3.830 2.543 2.468 2.620 . 0 0 "[ . 1 . 2]" 1 924 2 17 ALA MB 2 36 LEU HG 3.830 2.200 3.830 3.895 3.876 3.960 0.130 6 0 "[ . 1 . 2]" 1 925 2 41 LEU MD2 2 42 SER H 3.830 2.200 3.830 3.551 3.506 3.597 . 0 0 "[ . 1 . 2]" 1 926 2 54 VAL H 2 55 ASP H 3.830 2.200 3.830 2.679 2.639 2.712 . 0 0 "[ . 1 . 2]" 1 927 1 58 MET ME 1 67 GLY HA2 3.840 2.200 3.840 3.651 3.029 3.852 0.012 8 0 "[ . 1 . 2]" 1 928 1 77 LEU HB3 1 77 LEU MD1 3.840 2.200 3.840 3.245 3.226 3.260 . 0 0 "[ . 1 . 2]" 1 929 2 58 MET ME 2 67 GLY HA2 3.840 2.200 3.840 3.651 3.030 3.852 0.012 8 0 "[ . 1 . 2]" 1 930 2 77 LEU HB3 2 77 LEU MD1 3.840 2.200 3.840 3.245 3.227 3.260 . 0 0 "[ . 1 . 2]" 1 931 1 8 MET HA 1 8 MET HG2 3.850 2.200 3.850 2.459 2.442 2.476 . 0 0 "[ . 1 . 2]" 1 932 1 45 LEU HA 1 48 GLN HG2 3.850 2.200 3.850 3.579 3.033 3.859 0.009 6 0 "[ . 1 . 2]" 1 933 1 50 ASP HB2 1 53 ALA MB 3.850 2.200 3.850 2.466 2.198 2.699 0.002 12 0 "[ . 1 . 2]" 1 934 1 58 MET H 1 58 MET HG3 3.850 2.200 3.850 2.895 2.381 3.084 . 0 0 "[ . 1 . 2]" 1 935 1 60 GLU HG2 1 61 LEU H 3.850 2.200 3.850 3.086 2.196 3.848 0.004 13 0 "[ . 1 . 2]" 1 936 1 71 PHE HD1 1 75 VAL MG2 3.850 2.200 3.850 3.049 3.028 3.068 . 0 0 "[ . 1 . 2]" 1 937 1 75 VAL MG1 1 76 VAL HA 3.850 2.200 3.850 2.956 2.946 2.970 . 0 0 "[ . 1 . 2]" 1 938 2 8 MET HA 2 8 MET HG2 3.850 2.200 3.850 2.459 2.443 2.478 . 0 0 "[ . 1 . 2]" 1 939 2 45 LEU HA 2 48 GLN HG2 3.850 2.200 3.850 3.579 3.033 3.858 0.008 6 0 "[ . 1 . 2]" 1 940 2 50 ASP HB2 2 53 ALA MB 3.850 2.200 3.850 2.466 2.199 2.698 0.001 12 0 "[ . 1 . 2]" 1 941 2 58 MET H 2 58 MET HG3 3.850 2.200 3.850 2.894 2.381 3.084 . 0 0 "[ . 1 . 2]" 1 942 2 60 GLU HG2 2 61 LEU H 3.850 2.200 3.850 3.086 2.197 3.848 0.003 13 0 "[ . 1 . 2]" 1 943 2 71 PHE HD1 2 75 VAL MG2 3.850 2.200 3.850 3.049 3.029 3.068 . 0 0 "[ . 1 . 2]" 1 944 2 75 VAL MG1 2 76 VAL HA 3.850 2.200 3.850 2.956 2.947 2.969 . 0 0 "[ . 1 . 2]" 1 945 1 28 LEU QD 1 33 LEU HB3 3.860 2.200 3.860 2.123 2.082 2.161 0.118 20 0 "[ . 1 . 2]" 1 946 1 76 VAL MG2 1 77 LEU H 3.860 2.200 3.860 2.222 2.195 2.255 0.005 5 0 "[ . 1 . 2]" 1 947 2 28 LEU QD 2 33 LEU HB3 3.860 2.200 3.860 2.124 2.082 2.161 0.118 20 0 "[ . 1 . 2]" 1 948 2 76 VAL MG2 2 77 LEU H 3.860 2.200 3.860 2.221 2.195 2.256 0.005 5 0 "[ . 1 . 2]" 1 949 2 81 LEU QB 2 82 THR H 3.860 2.200 3.860 2.908 2.890 2.939 . 0 0 "[ . 1 . 2]" 1 950 1 4 LEU HA 1 4 LEU HG 3.870 2.200 3.870 2.303 2.252 2.429 . 0 0 "[ . 1 . 2]" 1 951 1 77 LEU HB3 1 77 LEU MD2 3.870 2.200 3.870 2.312 2.201 2.367 . 0 0 "[ . 1 . 2]" 1 952 2 4 LEU HA 2 4 LEU HG 3.870 2.200 3.870 2.303 2.251 2.428 . 0 0 "[ . 1 . 2]" 1 953 2 77 LEU HB3 2 77 LEU MD2 3.870 2.200 3.870 2.312 2.202 2.367 . 0 0 "[ . 1 . 2]" 1 954 1 13 ASN HB2 1 14 VAL H 3.880 2.200 3.880 2.676 2.661 2.705 . 0 0 "[ . 1 . 2]" 1 955 1 20 GLY HA3 1 25 LYS QB 3.880 2.200 3.880 3.907 3.894 3.918 0.038 20 0 "[ . 1 . 2]" 1 956 1 41 LEU HB2 1 41 LEU MD2 3.880 2.200 3.880 3.222 3.215 3.226 . 0 0 "[ . 1 . 2]" 1 957 2 13 ASN HB2 2 14 VAL H 3.880 2.200 3.880 2.675 2.660 2.703 . 0 0 "[ . 1 . 2]" 1 958 2 20 GLY HA3 2 25 LYS QB 3.880 2.200 3.880 3.907 3.895 3.918 0.038 4 0 "[ . 1 . 2]" 1 959 2 41 LEU HB2 2 41 LEU MD2 3.880 2.200 3.880 3.222 3.215 3.226 . 0 0 "[ . 1 . 2]" 1 960 1 28 LEU HA 1 32 GLU HB2 3.890 2.200 3.890 3.470 3.356 3.652 . 0 0 "[ . 1 . 2]" 1 961 1 34 LYS HA 1 34 LYS HG3 3.890 2.200 3.890 2.835 2.774 2.899 . 0 0 "[ . 1 . 2]" 1 962 1 37 LEU HB2 1 37 LEU MD1 3.890 2.200 3.890 3.182 3.167 3.197 . 0 0 "[ . 1 . 2]" 1 963 1 82 THR HA 1 85 CYS HB2 3.890 2.200 3.890 2.981 2.736 3.104 . 0 0 "[ . 1 . 2]" 1 964 1 83 VAL MG1 1 84 ALA MB 3.890 2.200 3.890 3.019 2.988 3.070 . 0 0 "[ . 1 . 2]" 1 965 1 86 ASN HB3 1 87 ASN H 3.890 2.200 3.890 2.595 2.537 2.672 . 0 0 "[ . 1 . 2]" 1 966 2 28 LEU HA 2 32 GLU HB2 3.890 2.200 3.890 3.467 3.355 3.651 . 0 0 "[ . 1 . 2]" 1 967 2 34 LYS HA 2 34 LYS HG3 3.890 2.200 3.890 2.835 2.775 2.897 . 0 0 "[ . 1 . 2]" 1 968 2 37 LEU HB2 2 37 LEU MD1 3.890 2.200 3.890 3.182 3.166 3.197 . 0 0 "[ . 1 . 2]" 1 969 2 82 THR HA 2 85 CYS HB2 3.890 2.200 3.890 2.980 2.735 3.103 . 0 0 "[ . 1 . 2]" 1 970 2 83 VAL MG1 2 84 ALA MB 3.890 2.200 3.890 3.019 2.988 3.071 . 0 0 "[ . 1 . 2]" 1 971 2 86 ASN HB3 2 87 ASN H 3.890 2.200 3.890 2.596 2.536 2.672 . 0 0 "[ . 1 . 2]" 1 972 1 66 ASP HA 1 67 GLY H 3.900 2.200 3.900 3.307 3.219 3.517 . 0 0 "[ . 1 . 2]" 1 973 1 81 LEU HB2 1 82 THR H 3.900 2.200 3.900 3.107 3.088 3.137 . 0 0 "[ . 1 . 2]" 1 974 2 66 ASP HA 2 67 GLY H 3.900 2.200 3.900 3.307 3.220 3.518 . 0 0 "[ . 1 . 2]" 1 975 1 4 LEU HB2 1 4 LEU MD1 3.910 2.200 3.910 2.241 2.215 2.342 . 0 0 "[ . 1 . 2]" 1 976 1 4 LEU HB2 1 4 LEU MD2 3.910 2.200 3.910 3.225 3.213 3.232 . 0 0 "[ . 1 . 2]" 1 977 1 11 LEU HA 1 14 VAL MG2 3.910 2.200 3.910 2.183 2.172 2.194 0.028 6 0 "[ . 1 . 2]" 1 978 1 16 HIS HA 1 17 ALA H 3.910 2.200 3.910 3.499 3.478 3.522 . 0 0 "[ . 1 . 2]" 1 979 1 28 LEU HB3 1 69 VAL MG1 3.910 2.200 3.910 3.224 2.981 3.410 . 0 0 "[ . 1 . 2]" 1 980 1 82 THR HA 1 85 CYS HB3 3.910 2.200 3.910 2.804 2.666 3.068 . 0 0 "[ . 1 . 2]" 1 981 2 4 LEU HB2 2 4 LEU MD1 3.910 2.200 3.910 2.241 2.216 2.341 . 0 0 "[ . 1 . 2]" 1 982 2 4 LEU HB2 2 4 LEU MD2 3.910 2.200 3.910 3.225 3.213 3.232 . 0 0 "[ . 1 . 2]" 1 983 2 11 LEU HA 2 14 VAL MG2 3.910 2.200 3.910 2.184 2.172 2.195 0.028 6 0 "[ . 1 . 2]" 1 984 2 16 HIS HA 2 17 ALA H 3.910 2.200 3.910 3.499 3.478 3.522 . 0 0 "[ . 1 . 2]" 1 985 2 28 LEU HB3 2 69 VAL MG1 3.910 2.200 3.910 3.225 2.981 3.411 . 0 0 "[ . 1 . 2]" 1 986 2 82 THR HA 2 85 CYS HB3 3.910 2.200 3.910 2.803 2.666 3.067 . 0 0 "[ . 1 . 2]" 1 987 1 16 HIS HA 1 19 SER H 3.920 2.200 3.920 3.730 3.598 3.826 . 0 0 "[ . 1 . 2]" 1 988 1 30 LYS H 1 31 LYS H 3.920 2.200 3.920 2.877 2.842 2.921 . 0 0 "[ . 1 . 2]" 1 989 1 41 LEU H 1 41 LEU HG 3.920 2.200 3.920 2.515 2.389 2.592 . 0 0 "[ . 1 . 2]" 1 990 1 65 GLY HA2 1 67 GLY H 3.920 2.200 3.920 3.340 3.192 3.762 . 0 0 "[ . 1 . 2]" 1 991 2 16 HIS HA 2 19 SER H 3.920 2.200 3.920 3.731 3.601 3.827 . 0 0 "[ . 1 . 2]" 1 992 2 18 HIS HB2 2 28 LEU QD 3.920 2.200 3.920 2.756 2.516 3.885 . 0 0 "[ . 1 . 2]" 1 993 2 30 LYS H 2 31 LYS H 3.920 2.200 3.920 2.877 2.842 2.920 . 0 0 "[ . 1 . 2]" 1 994 2 41 LEU H 2 41 LEU HG 3.920 2.200 3.920 2.515 2.388 2.592 . 0 0 "[ . 1 . 2]" 1 995 2 65 GLY HA2 2 67 GLY H 3.920 2.200 3.920 3.340 3.192 3.763 . 0 0 "[ . 1 . 2]" 1 996 1 3 GLU HB3 1 4 LEU H 3.930 2.200 3.930 3.568 2.716 3.697 . 0 0 "[ . 1 . 2]" 1 997 1 46 ASP HA 1 47 ALA H 3.930 2.200 3.930 3.492 3.472 3.516 . 0 0 "[ . 1 . 2]" 1 998 1 48 GLN HA 1 48 GLN HG2 3.930 2.200 3.930 3.216 3.187 3.273 . 0 0 "[ . 1 . 2]" 1 999 1 48 GLN HG3 1 53 ALA MB 3.930 2.200 3.930 2.470 2.235 2.622 . 0 0 "[ . 1 . 2]" 1 1000 1 53 ALA MB 1 57 VAL MG2 3.930 2.200 3.930 3.195 2.989 3.336 . 0 0 "[ . 1 . 2]" 1 1001 1 57 VAL MG1 1 58 MET HA 3.930 2.200 3.930 3.204 3.123 3.309 . 0 0 "[ . 1 . 2]" 1 1002 1 75 VAL H 1 75 VAL MG1 3.930 2.200 3.930 3.213 3.195 3.237 . 0 0 "[ . 1 . 2]" 1 1003 1 84 ALA HA 1 87 ASN HB3 3.930 2.200 3.930 3.537 2.591 3.853 . 0 0 "[ . 1 . 2]" 1 1004 2 3 GLU HB3 2 4 LEU H 3.930 2.200 3.930 3.568 2.715 3.698 . 0 0 "[ . 1 . 2]" 1 1005 2 46 ASP HA 2 47 ALA H 3.930 2.200 3.930 3.492 3.471 3.516 . 0 0 "[ . 1 . 2]" 1 1006 2 48 GLN HA 2 48 GLN HG2 3.930 2.200 3.930 3.216 3.186 3.273 . 0 0 "[ . 1 . 2]" 1 1007 2 48 GLN HG3 2 53 ALA MB 3.930 2.200 3.930 2.470 2.236 2.622 . 0 0 "[ . 1 . 2]" 1 1008 2 53 ALA MB 2 57 VAL MG2 3.930 2.200 3.930 3.195 2.990 3.335 . 0 0 "[ . 1 . 2]" 1 1009 2 57 VAL MG1 2 58 MET HA 3.930 2.200 3.930 3.204 3.124 3.309 . 0 0 "[ . 1 . 2]" 1 1010 2 75 VAL H 2 75 VAL MG1 3.930 2.200 3.930 3.213 3.196 3.238 . 0 0 "[ . 1 . 2]" 1 1011 2 84 ALA HA 2 87 ASN HB3 3.930 2.200 3.930 3.536 2.592 3.853 . 0 0 "[ . 1 . 2]" 1 1012 1 20 GLY HA2 1 21 LYS H 3.940 2.200 3.940 3.560 3.538 3.581 . 0 0 "[ . 1 . 2]" 1 1013 1 39 THR HB 1 40 GLU H 3.940 2.200 3.940 3.808 3.715 3.875 . 0 0 "[ . 1 . 2]" 1 1014 2 20 GLY HA2 2 21 LYS H 3.940 2.200 3.940 3.559 3.537 3.581 . 0 0 "[ . 1 . 2]" 1 1015 2 39 THR HB 2 40 GLU H 3.940 2.200 3.940 3.808 3.714 3.876 . 0 0 "[ . 1 . 2]" 1 1016 1 9 GLU HA 1 12 ILE HB 3.950 2.200 3.950 2.516 2.475 2.567 . 0 0 "[ . 1 . 2]" 1 1017 1 59 LYS H 1 59 LYS HG2 3.950 2.200 3.950 2.446 2.170 2.750 0.030 9 0 "[ . 1 . 2]" 1 1018 1 61 LEU HB3 1 69 VAL MG2 3.950 2.200 3.950 3.196 2.927 3.318 . 0 0 "[ . 1 . 2]" 1 1019 2 9 GLU HA 2 12 ILE HB 3.950 2.200 3.950 2.517 2.476 2.568 . 0 0 "[ . 1 . 2]" 1 1020 2 18 HIS HB3 2 28 LEU QD 3.950 2.200 3.950 2.601 2.264 3.591 . 0 0 "[ . 1 . 2]" 1 1021 2 59 LYS H 2 59 LYS HG2 3.950 2.200 3.950 2.446 2.170 2.750 0.030 3 0 "[ . 1 . 2]" 1 1022 2 61 LEU HB3 2 69 VAL MG2 3.950 2.200 3.950 3.196 2.927 3.318 . 0 0 "[ . 1 . 2]" 1 1023 1 10 THR HA 1 13 ASN HB2 3.960 2.200 3.960 2.511 2.448 2.609 . 0 0 "[ . 1 . 2]" 1 1024 1 28 LEU H 1 69 VAL H 3.960 2.200 3.960 3.631 3.443 3.838 . 0 0 "[ . 1 . 2]" 1 1025 1 78 VAL MG2 1 79 ALA H 3.960 2.200 3.960 2.177 2.174 2.180 0.026 3 0 "[ . 1 . 2]" 1 1026 1 90 TRP HB2 1 90 TRP HD1 3.960 2.200 3.960 3.816 3.784 3.844 . 0 0 "[ . 1 . 2]" 1 1027 2 10 THR HA 2 13 ASN HB2 3.960 2.200 3.960 2.510 2.448 2.608 . 0 0 "[ . 1 . 2]" 1 1028 2 28 LEU H 2 69 VAL H 3.960 2.200 3.960 3.631 3.443 3.837 . 0 0 "[ . 1 . 2]" 1 1029 2 78 VAL MG2 2 79 ALA H 3.960 2.200 3.960 2.177 2.173 2.180 0.027 3 0 "[ . 1 . 2]" 1 1030 2 90 TRP HB2 2 90 TRP HD1 3.960 2.200 3.960 3.816 3.784 3.844 . 0 0 "[ . 1 . 2]" 1 1031 1 6 THR MG 1 7 ALA HA 3.970 2.200 3.970 3.677 3.632 3.738 . 0 0 "[ . 1 . 2]" 1 1032 1 12 ILE MG 1 13 ASN HA 3.970 2.200 3.970 3.320 3.291 3.374 . 0 0 "[ . 1 . 2]" 1 1033 1 37 LEU HA 1 41 LEU HB2 3.970 2.200 3.970 3.288 3.204 3.330 . 0 0 "[ . 1 . 2]" 1 1034 2 6 THR MG 2 7 ALA HA 3.970 2.200 3.970 3.675 3.632 3.736 . 0 0 "[ . 1 . 2]" 1 1035 2 12 ILE MG 2 13 ASN HA 3.970 2.200 3.970 3.321 3.290 3.375 . 0 0 "[ . 1 . 2]" 1 1036 2 37 LEU HA 2 41 LEU HB2 3.970 2.200 3.970 3.289 3.204 3.330 . 0 0 "[ . 1 . 2]" 1 1037 1 17 ALA MB 1 36 LEU QD 3.980 2.200 3.980 3.625 3.262 3.803 . 0 0 "[ . 1 . 2]" 1 1038 1 25 LYS QE 1 26 TYR HE2 3.980 2.200 3.980 2.861 2.539 3.975 . 0 0 "[ . 1 . 2]" 1 1039 1 50 ASP HB2 1 53 ALA HA 3.980 2.200 3.980 3.691 3.388 3.990 0.010 19 0 "[ . 1 . 2]" 1 1040 1 74 TYR HA 1 75 VAL H 3.980 2.200 3.980 3.475 3.469 3.482 . 0 0 "[ . 1 . 2]" 1 1041 2 17 ALA MB 2 36 LEU QD 3.980 2.200 3.980 3.620 3.260 3.799 . 0 0 "[ . 1 . 2]" 1 1042 2 25 LYS QE 2 26 TYR HE2 3.980 2.200 3.980 2.861 2.539 3.974 . 0 0 "[ . 1 . 2]" 1 1043 2 50 ASP HB2 2 53 ALA HA 3.980 2.200 3.980 3.691 3.389 3.992 0.012 19 0 "[ . 1 . 2]" 1 1044 2 74 TYR HA 2 75 VAL H 3.980 2.200 3.980 3.474 3.468 3.482 . 0 0 "[ . 1 . 2]" 1 1045 1 45 LEU HB2 1 46 ASP H 3.990 2.200 3.990 3.115 2.971 3.581 . 0 0 "[ . 1 . 2]" 1 1046 1 48 GLN HE21 1 48 GLN HG2 3.990 2.200 3.990 2.239 2.227 2.254 . 0 0 "[ . 1 . 2]" 1 1047 1 48 GLN HE22 1 48 GLN HG2 3.990 2.200 3.990 3.505 3.497 3.515 . 0 0 "[ . 1 . 2]" 1 1048 1 58 MET HA 1 61 LEU HB2 3.990 2.200 3.990 2.535 2.459 2.589 . 0 0 "[ . 1 . 2]" 1 1049 1 61 LEU HG 1 77 LEU MD1 3.990 2.200 3.990 3.818 3.620 3.919 . 0 0 "[ . 1 . 2]" 1 1050 1 83 VAL MG2 1 84 ALA H 3.990 2.200 3.990 3.657 3.646 3.664 . 0 0 "[ . 1 . 2]" 1 1051 2 45 LEU HB2 2 46 ASP H 3.990 2.200 3.990 3.115 2.970 3.581 . 0 0 "[ . 1 . 2]" 1 1052 2 48 GLN HE21 2 48 GLN HG2 3.990 2.200 3.990 2.239 2.226 2.254 . 0 0 "[ . 1 . 2]" 1 1053 2 48 GLN HE22 2 48 GLN HG2 3.990 2.200 3.990 3.505 3.496 3.516 . 0 0 "[ . 1 . 2]" 1 1054 2 58 MET HA 2 61 LEU HB2 3.990 2.200 3.990 2.534 2.459 2.588 . 0 0 "[ . 1 . 2]" 1 1055 2 61 LEU HG 2 77 LEU MD1 3.990 2.200 3.990 3.817 3.619 3.919 . 0 0 "[ . 1 . 2]" 1 1056 2 78 VAL HA 2 81 LEU QB 3.990 2.200 3.990 2.456 2.396 2.519 . 0 0 "[ . 1 . 2]" 1 1057 2 83 VAL MG2 2 84 ALA H 3.990 2.200 3.990 3.657 3.647 3.664 . 0 0 "[ . 1 . 2]" 1 1058 1 20 GLY HA3 1 25 LYS HA 4.000 2.200 4.000 3.697 3.309 4.007 0.007 17 0 "[ . 1 . 2]" 1 1059 2 20 GLY HA3 2 25 LYS HA 4.000 2.200 4.000 3.697 3.308 4.007 0.007 15 0 "[ . 1 . 2]" 1 1060 2 27 LYS QD 2 70 ASP HA 4.000 2.200 4.000 2.444 2.216 2.765 . 0 0 "[ . 1 . 2]" 1 1061 1 18 HIS HA 1 21 LYS HE2 4.010 2.200 4.010 3.439 3.151 3.638 . 0 0 "[ . 1 . 2]" 1 1062 1 72 GLN HE21 1 72 GLN HG3 4.010 2.200 4.010 2.803 2.785 2.810 . 0 0 "[ . 1 . 2]" 1 1063 2 18 HIS HA 2 21 LYS HE2 4.010 2.200 4.010 3.440 3.152 3.639 . 0 0 "[ . 1 . 2]" 1 1064 2 72 GLN HE21 2 72 GLN HG3 4.010 2.200 4.010 2.803 2.786 2.810 . 0 0 "[ . 1 . 2]" 1 1065 1 14 VAL MG2 1 15 PHE HB2 4.020 2.200 4.020 3.414 3.347 3.494 . 0 0 "[ . 1 . 2]" 1 1066 1 25 LYS QB 1 26 TYR H 4.020 2.200 4.020 2.755 2.519 2.803 . 0 0 "[ . 1 . 2]" 1 1067 1 36 LEU HB2 1 37 LEU H 4.020 2.200 4.020 3.727 3.684 3.766 . 0 0 "[ . 1 . 2]" 1 1068 2 14 VAL MG2 2 15 PHE HB2 4.020 2.200 4.020 3.415 3.347 3.496 . 0 0 "[ . 1 . 2]" 1 1069 2 25 LYS QB 2 26 TYR H 4.020 2.200 4.020 2.755 2.520 2.803 . 0 0 "[ . 1 . 2]" 1 1070 2 36 LEU HB2 2 37 LEU H 4.020 2.200 4.020 3.727 3.670 3.765 . 0 0 "[ . 1 . 2]" 1 1071 1 15 PHE HZ 1 27 LYS HA 4.030 2.200 4.030 3.233 3.070 3.465 . 0 0 "[ . 1 . 2]" 1 1072 1 28 LEU QD 1 74 TYR HB2 4.030 2.200 4.030 3.044 2.726 3.216 . 0 0 "[ . 1 . 2]" 1 1073 1 53 ALA MB 1 54 VAL H 4.030 2.200 4.030 2.575 2.505 2.633 . 0 0 "[ . 1 . 2]" 1 1074 1 55 ASP HA 1 56 LYS H 4.030 2.200 4.030 3.544 3.529 3.560 . 0 0 "[ . 1 . 2]" 1 1075 1 66 ASP H 1 68 GLU H 4.030 2.200 4.030 3.571 3.356 4.044 0.014 17 0 "[ . 1 . 2]" 1 1076 1 87 ASN HA 1 91 GLU HB2 4.030 2.200 4.030 3.207 2.838 3.777 . 0 0 "[ . 1 . 2]" 1 1077 2 15 PHE HZ 2 27 LYS HA 4.030 2.200 4.030 3.227 3.066 3.459 . 0 0 "[ . 1 . 2]" 1 1078 2 28 LEU QD 2 74 TYR HB2 4.030 2.200 4.030 3.045 2.727 3.219 . 0 0 "[ . 1 . 2]" 1 1079 2 53 ALA MB 2 54 VAL H 4.030 2.200 4.030 2.575 2.503 2.634 . 0 0 "[ . 1 . 2]" 1 1080 2 55 ASP HA 2 56 LYS H 4.030 2.200 4.030 3.544 3.528 3.559 . 0 0 "[ . 1 . 2]" 1 1081 2 66 ASP H 2 68 GLU H 4.030 2.200 4.030 3.571 3.355 4.044 0.014 17 0 "[ . 1 . 2]" 1 1082 2 87 ASN HA 2 91 GLU HB2 4.030 2.200 4.030 3.207 2.838 3.776 . 0 0 "[ . 1 . 2]" 1 1083 1 19 SER H 1 19 SER HB3 4.040 2.200 4.040 2.654 2.548 2.731 . 0 0 "[ . 1 . 2]" 1 1084 1 33 LEU HA 1 37 LEU H 4.040 2.200 4.040 3.545 3.396 3.677 . 0 0 "[ . 1 . 2]" 1 1085 1 37 LEU HA 1 38 GLN H 4.040 2.200 4.040 3.560 3.546 3.570 . 0 0 "[ . 1 . 2]" 1 1086 1 54 VAL HA 1 57 VAL HB 4.040 2.200 4.040 2.610 2.440 2.811 . 0 0 "[ . 1 . 2]" 1 1087 1 72 GLN HA 1 75 VAL MG1 4.040 2.200 4.040 2.684 2.650 2.746 . 0 0 "[ . 1 . 2]" 1 1088 1 77 LEU HB3 1 78 VAL MG1 4.040 2.200 4.040 3.163 3.072 3.372 . 0 0 "[ . 1 . 2]" 1 1089 1 78 VAL HA 1 81 LEU HB2 4.040 2.200 4.040 2.488 2.425 2.554 . 0 0 "[ . 1 . 2]" 1 1090 2 19 SER H 2 19 SER HB3 4.040 2.200 4.040 2.653 2.547 2.729 . 0 0 "[ . 1 . 2]" 1 1091 2 33 LEU HA 2 37 LEU H 4.040 2.200 4.040 3.545 3.397 3.676 . 0 0 "[ . 1 . 2]" 1 1092 2 37 LEU HA 2 38 GLN H 4.040 2.200 4.040 3.560 3.547 3.571 . 0 0 "[ . 1 . 2]" 1 1093 2 54 VAL HA 2 57 VAL HB 4.040 2.200 4.040 2.610 2.441 2.811 . 0 0 "[ . 1 . 2]" 1 1094 2 72 GLN HA 2 75 VAL MG1 4.040 2.200 4.040 2.684 2.648 2.746 . 0 0 "[ . 1 . 2]" 1 1095 2 77 LEU HB3 2 78 VAL MG1 4.040 2.200 4.040 3.163 3.073 3.371 . 0 0 "[ . 1 . 2]" 1 1096 1 15 PHE HZ 1 70 ASP HA 4.050 2.200 4.050 3.637 3.373 3.862 . 0 0 "[ . 1 . 2]" 1 1097 1 27 LYS HB2 1 27 LYS HD3 4.050 2.200 4.050 2.309 2.263 2.401 . 0 0 "[ . 1 . 2]" 1 1098 1 30 LYS HB3 1 58 MET ME 4.050 2.200 4.050 3.577 3.433 3.990 . 0 0 "[ . 1 . 2]" 1 1099 1 51 VAL HA 1 52 ASP H 4.050 2.200 4.050 3.460 3.425 3.495 . 0 0 "[ . 1 . 2]" 1 1100 1 71 PHE HB2 1 71 PHE HD1 4.050 2.200 4.050 3.647 3.634 3.665 . 0 0 "[ . 1 . 2]" 1 1101 1 75 VAL HB 1 76 VAL H 4.050 2.200 4.050 3.316 3.289 3.341 . 0 0 "[ . 1 . 2]" 1 1102 1 87 ASN HA 1 88 PHE H 4.050 2.200 4.050 3.558 3.524 3.614 . 0 0 "[ . 1 . 2]" 1 1103 2 15 PHE HZ 2 70 ASP HA 4.050 2.200 4.050 3.645 3.375 3.866 . 0 0 "[ . 1 . 2]" 1 1104 2 30 LYS HB3 2 58 MET ME 4.050 2.200 4.050 3.577 3.432 3.990 . 0 0 "[ . 1 . 2]" 1 1105 2 51 VAL HA 2 52 ASP H 4.050 2.200 4.050 3.460 3.423 3.495 . 0 0 "[ . 1 . 2]" 1 1106 2 71 PHE HB2 2 71 PHE HD1 4.050 2.200 4.050 3.647 3.634 3.664 . 0 0 "[ . 1 . 2]" 1 1107 2 75 VAL HB 2 76 VAL H 4.050 2.200 4.050 3.316 3.289 3.340 . 0 0 "[ . 1 . 2]" 1 1108 2 87 ASN HA 2 88 PHE H 4.050 2.200 4.050 3.559 3.523 3.613 . 0 0 "[ . 1 . 2]" 1 1109 1 8 MET H 1 8 MET HG2 4.060 2.200 4.060 3.424 3.385 3.476 . 0 0 "[ . 1 . 2]" 1 1110 1 73 GLU HA 1 76 VAL MG1 4.060 2.200 4.060 3.352 3.295 3.409 . 0 0 "[ . 1 . 2]" 1 1111 1 82 THR HB 1 83 VAL H 4.060 2.200 4.060 2.351 2.285 2.388 . 0 0 "[ . 1 . 2]" 1 1112 1 83 VAL MG2 1 84 ALA HA 4.060 2.200 4.060 3.701 3.678 3.715 . 0 0 "[ . 1 . 2]" 1 1113 2 8 MET H 2 8 MET HG2 4.060 2.200 4.060 3.424 3.384 3.476 . 0 0 "[ . 1 . 2]" 1 1114 2 73 GLU HA 2 76 VAL MG1 4.060 2.200 4.060 3.352 3.295 3.408 . 0 0 "[ . 1 . 2]" 1 1115 2 82 THR HB 2 83 VAL H 4.060 2.200 4.060 2.352 2.286 2.387 . 0 0 "[ . 1 . 2]" 1 1116 2 83 VAL MG2 2 84 ALA HA 4.060 2.200 4.060 3.701 3.678 3.715 . 0 0 "[ . 1 . 2]" 1 1117 1 7 ALA HA 1 10 THR HB 4.070 2.200 4.070 2.710 2.558 2.770 . 0 0 "[ . 1 . 2]" 1 1118 1 13 ASN HB2 1 13 ASN HD22 4.070 2.200 4.070 3.593 3.592 3.596 . 0 0 "[ . 1 . 2]" 1 1119 1 27 LYS HA 1 27 LYS HD3 4.070 2.200 4.070 2.989 2.297 3.198 . 0 0 "[ . 1 . 2]" 1 1120 1 28 LEU QD 1 37 LEU MD2 4.070 2.200 4.070 3.362 3.191 3.610 . 0 0 "[ . 1 . 2]" 1 1121 1 34 LYS HB3 1 35 GLU QG 4.070 2.200 4.070 3.121 3.077 3.175 . 0 0 "[ . 1 . 2]" 1 1122 1 56 LYS HA 1 57 VAL H 4.070 2.200 4.070 3.533 3.515 3.545 . 0 0 "[ . 1 . 2]" 1 1123 1 57 VAL HA 1 58 MET H 4.070 2.200 4.070 3.582 3.554 3.618 . 0 0 "[ . 1 . 2]" 1 1124 1 79 ALA MB 1 80 ALA MB 4.070 2.200 4.070 3.627 3.611 3.641 . 0 0 "[ . 1 . 2]" 1 1125 1 87 ASN HB2 1 88 PHE H 4.070 2.200 4.070 2.926 2.602 3.786 . 0 0 "[ . 1 . 2]" 1 1126 2 7 ALA HA 2 10 THR HB 4.070 2.200 4.070 2.708 2.555 2.769 . 0 0 "[ . 1 . 2]" 1 1127 2 13 ASN HB2 2 13 ASN HD22 4.070 2.200 4.070 3.594 3.591 3.595 . 0 0 "[ . 1 . 2]" 1 1128 2 28 LEU QD 2 37 LEU MD2 4.070 2.200 4.070 3.362 3.191 3.610 . 0 0 "[ . 1 . 2]" 1 1129 2 34 LYS HB3 2 35 GLU QG 4.070 2.200 4.070 3.121 3.078 3.176 . 0 0 "[ . 1 . 2]" 1 1130 2 56 LYS HA 2 57 VAL H 4.070 2.200 4.070 3.533 3.515 3.546 . 0 0 "[ . 1 . 2]" 1 1131 2 57 VAL HA 2 58 MET H 4.070 2.200 4.070 3.582 3.554 3.616 . 0 0 "[ . 1 . 2]" 1 1132 2 79 ALA MB 2 80 ALA MB 4.070 2.200 4.070 3.627 3.611 3.641 . 0 0 "[ . 1 . 2]" 1 1133 2 87 ASN HB2 2 88 PHE H 4.070 2.200 4.070 2.927 2.603 3.786 . 0 0 "[ . 1 . 2]" 1 1134 1 12 ILE HA 1 71 PHE HZ 4.080 2.200 4.080 2.261 2.236 2.282 . 0 0 "[ . 1 . 2]" 1 1135 1 29 SER HA 1 68 GLU HA 4.080 2.200 4.080 3.138 2.701 3.307 . 0 0 "[ . 1 . 2]" 1 1136 1 37 LEU HG 1 45 LEU HG 4.080 2.200 4.080 3.238 3.136 3.373 . 0 0 "[ . 1 . 2]" 1 1137 1 61 LEU HB2 1 62 ASP H 4.080 2.200 4.080 2.801 2.751 2.867 . 0 0 "[ . 1 . 2]" 1 1138 1 73 GLU HA 1 73 GLU QG 4.080 2.200 4.080 2.394 2.371 2.425 . 0 0 "[ . 1 . 2]" 1 1139 1 77 LEU HB3 1 78 VAL MG2 4.080 2.200 4.080 4.075 4.041 4.092 0.012 3 0 "[ . 1 . 2]" 1 1140 2 12 ILE HA 2 71 PHE HZ 4.080 2.200 4.080 2.261 2.237 2.282 . 0 0 "[ . 1 . 2]" 1 1141 2 29 SER HA 2 68 GLU HA 4.080 2.200 4.080 3.138 2.700 3.306 . 0 0 "[ . 1 . 2]" 1 1142 2 37 LEU HG 2 45 LEU HG 4.080 2.200 4.080 3.237 3.135 3.374 . 0 0 "[ . 1 . 2]" 1 1143 2 61 LEU HB2 2 62 ASP H 4.080 2.200 4.080 2.801 2.751 2.866 . 0 0 "[ . 1 . 2]" 1 1144 2 73 GLU HA 2 73 GLU QG 4.080 2.200 4.080 2.394 2.370 2.424 . 0 0 "[ . 1 . 2]" 1 1145 2 77 LEU HB3 2 78 VAL MG2 4.080 2.200 4.080 4.076 4.043 4.092 0.012 3 0 "[ . 1 . 2]" 1 1146 1 6 THR HA 1 9 GLU HG3 4.090 2.200 4.090 3.481 3.156 3.639 . 0 0 "[ . 1 . 2]" 1 1147 1 8 MET ME 1 8 MET HG3 4.090 2.200 4.090 3.339 3.307 3.351 . 0 0 "[ . 1 . 2]" 1 1148 1 63 GLU H 1 65 GLY H 4.090 2.200 4.090 3.951 3.884 4.096 0.006 17 0 "[ . 1 . 2]" 1 1149 1 72 GLN HA 1 75 VAL MG2 4.090 2.200 4.090 3.698 3.669 3.724 . 0 0 "[ . 1 . 2]" 1 1150 2 6 THR HA 2 9 GLU HG3 4.090 2.200 4.090 3.482 3.156 3.640 . 0 0 "[ . 1 . 2]" 1 1151 2 8 MET ME 2 8 MET HG3 4.090 2.200 4.090 3.339 3.307 3.351 . 0 0 "[ . 1 . 2]" 1 1152 2 63 GLU H 2 65 GLY H 4.090 2.200 4.090 3.951 3.883 4.096 0.006 17 0 "[ . 1 . 2]" 1 1153 2 72 GLN HA 2 75 VAL MG2 4.090 2.200 4.090 3.698 3.669 3.724 . 0 0 "[ . 1 . 2]" 1 1154 1 16 HIS HB3 1 17 ALA H 4.100 2.200 4.100 2.790 2.722 2.837 . 0 0 "[ . 1 . 2]" 1 1155 1 28 LEU HB2 1 28 LEU MD1 4.100 2.200 4.100 2.401 2.306 2.443 . 0 0 "[ . 1 . 2]" 1 1156 1 28 LEU HB2 1 28 LEU MD2 4.100 2.200 4.100 2.363 2.319 2.492 . 0 0 "[ . 1 . 2]" 1 1157 1 36 LEU QD 1 37 LEU H 4.100 2.200 4.100 3.209 3.086 3.249 . 0 0 "[ . 1 . 2]" 1 1158 1 61 LEU HA 1 61 LEU HG 4.100 2.200 4.100 3.114 3.009 3.199 . 0 0 "[ . 1 . 2]" 1 1159 2 16 HIS HB3 2 17 ALA H 4.100 2.200 4.100 2.790 2.722 2.838 . 0 0 "[ . 1 . 2]" 1 1160 2 28 LEU HB2 2 28 LEU MD1 4.100 2.200 4.100 2.402 2.307 2.443 . 0 0 "[ . 1 . 2]" 1 1161 2 28 LEU HB2 2 28 LEU MD2 4.100 2.200 4.100 2.363 2.320 2.492 . 0 0 "[ . 1 . 2]" 1 1162 2 36 LEU QD 2 37 LEU H 4.100 2.200 4.100 3.209 3.087 3.250 . 0 0 "[ . 1 . 2]" 1 1163 2 61 LEU HA 2 61 LEU HG 4.100 2.200 4.100 3.115 3.010 3.198 . 0 0 "[ . 1 . 2]" 1 1164 1 13 ASN H 1 13 ASN HD21 4.110 2.200 4.110 3.942 3.934 3.949 . 0 0 "[ . 1 . 2]" 1 1165 1 27 LYS HA 1 27 LYS HG3 4.110 2.200 4.110 2.651 2.508 2.746 . 0 0 "[ . 1 . 2]" 1 1166 1 41 LEU MD1 1 44 PHE HD2 4.110 2.200 4.110 2.919 2.725 3.219 . 0 0 "[ . 1 . 2]" 1 1167 1 50 ASP HA 1 51 VAL MG1 4.110 2.200 4.110 3.537 3.507 3.617 . 0 0 "[ . 1 . 2]" 1 1168 1 73 GLU HB2 1 74 TYR H 4.110 2.200 4.110 2.480 2.413 2.549 . 0 0 "[ . 1 . 2]" 1 1169 1 77 LEU HB2 1 77 LEU MD2 4.110 2.200 4.110 2.381 2.309 2.502 . 0 0 "[ . 1 . 2]" 1 1170 2 13 ASN H 2 13 ASN HD21 4.110 2.200 4.110 3.943 3.934 3.949 . 0 0 "[ . 1 . 2]" 1 1171 2 27 LYS HA 2 27 LYS HG3 4.110 2.200 4.110 2.647 2.504 2.739 . 0 0 "[ . 1 . 2]" 1 1172 2 41 LEU MD1 2 44 PHE HD2 4.110 2.200 4.110 2.919 2.724 3.220 . 0 0 "[ . 1 . 2]" 1 1173 2 50 ASP HA 2 51 VAL MG1 4.110 2.200 4.110 3.537 3.507 3.617 . 0 0 "[ . 1 . 2]" 1 1174 2 73 GLU HB2 2 74 TYR H 4.110 2.200 4.110 2.481 2.415 2.550 . 0 0 "[ . 1 . 2]" 1 1175 2 77 LEU HB2 2 77 LEU MD2 4.110 2.200 4.110 2.382 2.312 2.502 . 0 0 "[ . 1 . 2]" 1 1176 1 10 THR MG 1 11 LEU H 4.120 2.200 4.120 3.530 3.440 3.558 . 0 0 "[ . 1 . 2]" 1 1177 1 12 ILE HA 1 15 PHE HB3 4.120 2.200 4.120 2.956 2.763 3.096 . 0 0 "[ . 1 . 2]" 1 1178 1 20 GLY HA2 1 25 LYS QG 4.120 2.200 4.120 2.206 2.184 2.251 0.016 8 0 "[ . 1 . 2]" 1 1179 1 31 LYS HD2 1 32 GLU H 4.120 2.200 4.120 4.199 4.137 4.221 0.101 20 0 "[ . 1 . 2]" 1 1180 1 33 LEU QD 1 58 MET HG2 4.120 2.200 4.120 3.579 3.345 3.912 . 0 0 "[ . 1 . 2]" 1 1181 1 34 LYS H 1 54 VAL MG2 4.120 2.200 4.120 3.569 3.328 3.790 . 0 0 "[ . 1 . 2]" 1 1182 1 37 LEU HA 1 41 LEU MD1 4.120 2.200 4.120 3.883 3.722 4.054 . 0 0 "[ . 1 . 2]" 1 1183 1 51 VAL MG2 1 52 ASP HA 4.120 2.200 4.120 3.127 3.039 3.233 . 0 0 "[ . 1 . 2]" 1 1184 1 73 GLU HA 1 76 VAL H 4.120 2.200 4.120 3.565 3.528 3.595 . 0 0 "[ . 1 . 2]" 1 1185 1 80 ALA MB 1 83 VAL MG1 4.120 2.200 4.120 3.355 3.329 3.373 . 0 0 "[ . 1 . 2]" 1 1186 2 10 THR MG 2 11 LEU H 4.120 2.200 4.120 3.529 3.440 3.556 . 0 0 "[ . 1 . 2]" 1 1187 2 12 ILE HA 2 15 PHE HB3 4.120 2.200 4.120 2.956 2.763 3.096 . 0 0 "[ . 1 . 2]" 1 1188 2 20 GLY HA2 2 25 LYS QG 4.120 2.200 4.120 2.207 2.185 2.252 0.015 8 0 "[ . 1 . 2]" 1 1189 2 31 LYS HD2 2 32 GLU H 4.120 2.200 4.120 4.200 4.138 4.221 0.101 20 0 "[ . 1 . 2]" 1 1190 2 33 LEU QD 2 58 MET HG2 4.120 2.200 4.120 3.579 3.344 3.912 . 0 0 "[ . 1 . 2]" 1 1191 2 34 LYS H 2 54 VAL MG2 4.120 2.200 4.120 3.569 3.329 3.790 . 0 0 "[ . 1 . 2]" 1 1192 2 37 LEU HA 2 41 LEU MD1 4.120 2.200 4.120 3.883 3.723 4.054 . 0 0 "[ . 1 . 2]" 1 1193 2 51 VAL MG2 2 52 ASP HA 4.120 2.200 4.120 3.127 3.040 3.233 . 0 0 "[ . 1 . 2]" 1 1194 2 73 GLU HA 2 76 VAL H 4.120 2.200 4.120 3.566 3.528 3.595 . 0 0 "[ . 1 . 2]" 1 1195 2 80 ALA MB 2 83 VAL MG1 4.120 2.200 4.120 3.354 3.329 3.373 . 0 0 "[ . 1 . 2]" 1 1196 1 27 LYS HB3 1 68 GLU QG 4.130 2.200 4.130 4.082 3.942 4.177 0.047 9 0 "[ . 1 . 2]" 1 1197 1 28 LEU QD 1 69 VAL HB 4.130 2.200 4.130 2.939 2.466 3.233 . 0 0 "[ . 1 . 2]" 1 1198 1 32 GLU HB2 1 33 LEU QD 4.130 2.200 4.130 4.074 3.607 4.163 0.033 6 0 "[ . 1 . 2]" 1 1199 1 54 VAL MG2 1 55 ASP H 4.130 2.200 4.130 3.585 3.540 3.706 . 0 0 "[ . 1 . 2]" 1 1200 2 27 LYS HB3 2 68 GLU QG 4.130 2.200 4.130 4.080 3.933 4.176 0.046 9 0 "[ . 1 . 2]" 1 1201 2 28 LEU QD 2 69 VAL HB 4.130 2.200 4.130 2.940 2.466 3.235 . 0 0 "[ . 1 . 2]" 1 1202 2 32 GLU HB2 2 33 LEU QD 4.130 2.200 4.130 4.074 3.607 4.164 0.034 6 0 "[ . 1 . 2]" 1 1203 2 54 VAL MG2 2 55 ASP H 4.130 2.200 4.130 3.585 3.538 3.707 . 0 0 "[ . 1 . 2]" 1 1204 1 7 ALA MB 1 8 MET HG3 4.140 2.200 4.140 3.154 3.029 3.393 . 0 0 "[ . 1 . 2]" 1 1205 1 14 VAL MG2 1 15 PHE HA 4.140 2.200 4.140 3.374 3.264 3.462 . 0 0 "[ . 1 . 2]" 1 1206 1 19 SER HA 1 28 LEU HA 4.140 2.200 4.140 3.418 3.079 3.745 . 0 0 "[ . 1 . 2]" 1 1207 1 19 SER HB3 1 28 LEU QD 4.140 2.200 4.140 3.883 3.640 4.156 0.016 20 0 "[ . 1 . 2]" 1 1208 1 28 LEU HB2 1 69 VAL HB 4.140 2.200 4.140 3.804 3.731 3.860 . 0 0 "[ . 1 . 2]" 1 1209 1 34 LYS HD2 1 38 GLN HG3 4.140 2.200 4.140 3.615 3.559 3.660 . 0 0 "[ . 1 . 2]" 1 1210 1 34 LYS HG2 1 54 VAL MG2 4.140 2.200 4.140 3.983 3.851 4.127 . 0 0 "[ . 1 . 2]" 1 1211 1 34 LYS HG3 1 35 GLU H 4.140 2.200 4.140 4.014 3.958 4.063 . 0 0 "[ . 1 . 2]" 1 1212 1 36 LEU QD 1 40 GLU H 4.140 2.200 4.140 3.169 2.800 3.327 . 0 0 "[ . 1 . 2]" 1 1213 1 75 VAL MG1 1 76 VAL MG2 4.140 2.200 4.140 3.571 3.550 3.599 . 0 0 "[ . 1 . 2]" 1 1214 1 76 VAL HB 1 80 ALA MB 4.140 2.200 4.140 3.591 3.526 3.659 . 0 0 "[ . 1 . 2]" 1 1215 1 76 VAL MG2 1 77 LEU HB2 4.140 2.200 4.140 3.484 3.432 3.542 . 0 0 "[ . 1 . 2]" 1 1216 2 7 ALA MB 2 8 MET HG3 4.140 2.200 4.140 3.153 3.029 3.393 . 0 0 "[ . 1 . 2]" 1 1217 2 10 THR HB 2 11 LEU QD 4.140 2.200 4.140 3.160 3.101 3.233 . 0 0 "[ . 1 . 2]" 1 1218 2 14 VAL MG2 2 15 PHE HA 4.140 2.200 4.140 3.374 3.265 3.463 . 0 0 "[ . 1 . 2]" 1 1219 2 19 SER HA 2 28 LEU HA 4.140 2.200 4.140 3.418 3.078 3.745 . 0 0 "[ . 1 . 2]" 1 1220 2 19 SER HB3 2 28 LEU QD 4.140 2.200 4.140 3.882 3.639 4.156 0.016 20 0 "[ . 1 . 2]" 1 1221 2 28 LEU HB2 2 69 VAL HB 4.140 2.200 4.140 3.804 3.731 3.861 . 0 0 "[ . 1 . 2]" 1 1222 2 34 LYS HD2 2 38 GLN HG3 4.140 2.200 4.140 3.615 3.558 3.660 . 0 0 "[ . 1 . 2]" 1 1223 2 34 LYS HG2 2 54 VAL MG2 4.140 2.200 4.140 3.983 3.850 4.126 . 0 0 "[ . 1 . 2]" 1 1224 2 34 LYS HG3 2 35 GLU H 4.140 2.200 4.140 4.014 3.958 4.065 . 0 0 "[ . 1 . 2]" 1 1225 2 36 LEU QD 2 40 GLU H 4.140 2.200 4.140 3.171 2.801 3.327 . 0 0 "[ . 1 . 2]" 1 1226 2 75 VAL MG1 2 76 VAL MG2 4.140 2.200 4.140 3.571 3.550 3.599 . 0 0 "[ . 1 . 2]" 1 1227 2 76 VAL HB 2 80 ALA MB 4.140 2.200 4.140 3.590 3.526 3.658 . 0 0 "[ . 1 . 2]" 1 1228 2 76 VAL MG2 2 77 LEU HB2 4.140 2.200 4.140 3.483 3.432 3.539 . 0 0 "[ . 1 . 2]" 1 1229 1 15 PHE HB3 1 15 PHE HD1 4.150 2.200 4.150 3.748 3.738 3.758 . 0 0 "[ . 1 . 2]" 1 1230 1 28 LEU QD 1 29 SER H 4.150 2.200 4.150 2.872 2.727 3.336 . 0 0 "[ . 1 . 2]" 1 1231 1 33 LEU HA 1 36 LEU HB2 4.150 2.200 4.150 2.917 2.758 3.196 . 0 0 "[ . 1 . 2]" 1 1232 1 41 LEU HB2 1 42 SER H 4.150 2.200 4.150 3.917 3.870 3.953 . 0 0 "[ . 1 . 2]" 1 1233 1 52 ASP HA 1 55 ASP H 4.150 2.200 4.150 3.221 3.063 3.473 . 0 0 "[ . 1 . 2]" 1 1234 1 54 VAL MG2 1 55 ASP HA 4.150 2.200 4.150 3.721 3.596 3.942 . 0 0 "[ . 1 . 2]" 1 1235 2 15 PHE HB3 2 15 PHE HD1 4.150 2.200 4.150 3.748 3.739 3.757 . 0 0 "[ . 1 . 2]" 1 1236 2 28 LEU QD 2 29 SER H 4.150 2.200 4.150 2.874 2.729 3.336 . 0 0 "[ . 1 . 2]" 1 1237 2 33 LEU HA 2 36 LEU HB2 4.150 2.200 4.150 2.916 2.757 3.196 . 0 0 "[ . 1 . 2]" 1 1238 2 41 LEU HB2 2 42 SER H 4.150 2.200 4.150 3.917 3.870 3.952 . 0 0 "[ . 1 . 2]" 1 1239 2 52 ASP HA 2 55 ASP H 4.150 2.200 4.150 3.221 3.063 3.472 . 0 0 "[ . 1 . 2]" 1 1240 2 54 VAL MG2 2 55 ASP HA 4.150 2.200 4.150 3.721 3.594 3.942 . 0 0 "[ . 1 . 2]" 1 1241 1 10 THR HB 1 11 LEU MD2 4.160 2.200 4.160 3.135 3.078 3.210 . 0 0 "[ . 1 . 2]" 1 1242 1 15 PHE HE1 1 69 VAL MG1 4.160 2.200 4.160 4.118 3.838 4.183 0.023 6 0 "[ . 1 . 2]" 1 1243 1 37 LEU HB3 1 45 LEU HG 4.160 2.200 4.160 2.374 2.273 2.755 . 0 0 "[ . 1 . 2]" 1 1244 1 54 VAL MG1 1 55 ASP HA 4.160 2.200 4.160 3.003 2.927 3.109 . 0 0 "[ . 1 . 2]" 1 1245 2 15 PHE HE1 2 69 VAL MG1 4.160 2.200 4.160 4.118 3.838 4.182 0.022 6 0 "[ . 1 . 2]" 1 1246 2 37 LEU HB3 2 45 LEU HG 4.160 2.200 4.160 2.374 2.273 2.756 . 0 0 "[ . 1 . 2]" 1 1247 2 54 VAL MG1 2 55 ASP HA 4.160 2.200 4.160 3.003 2.926 3.108 . 0 0 "[ . 1 . 2]" 1 1248 1 20 GLY HA3 1 25 LYS QG 4.170 2.200 4.170 3.569 3.258 3.724 . 0 0 "[ . 1 . 2]" 1 1249 1 56 LYS HB2 1 57 VAL MG2 4.170 2.200 4.170 3.210 3.122 3.369 . 0 0 "[ . 1 . 2]" 1 1250 2 20 GLY HA3 2 25 LYS QG 4.170 2.200 4.170 3.569 3.257 3.725 . 0 0 "[ . 1 . 2]" 1 1251 2 56 LYS HB2 2 57 VAL MG2 4.170 2.200 4.170 3.210 3.122 3.368 . 0 0 "[ . 1 . 2]" 1 1252 1 8 MET HB3 1 8 MET ME 4.180 2.200 4.180 2.202 2.195 2.229 0.005 17 0 "[ . 1 . 2]" 1 1253 1 44 PHE HB3 1 45 LEU H 4.180 2.200 4.180 3.311 3.187 3.360 . 0 0 "[ . 1 . 2]" 1 1254 1 54 VAL HA 1 57 VAL H 4.180 2.200 4.180 3.346 3.177 3.482 . 0 0 "[ . 1 . 2]" 1 1255 2 8 MET HB3 2 8 MET ME 4.180 2.200 4.180 2.203 2.195 2.230 0.005 17 0 "[ . 1 . 2]" 1 1256 2 44 PHE HB3 2 45 LEU H 4.180 2.200 4.180 3.311 3.187 3.360 . 0 0 "[ . 1 . 2]" 1 1257 2 54 VAL HA 2 57 VAL H 4.180 2.200 4.180 3.347 3.177 3.481 . 0 0 "[ . 1 . 2]" 1 1258 1 15 PHE HB2 1 15 PHE HD1 4.190 2.200 4.190 2.600 2.573 2.634 . 0 0 "[ . 1 . 2]" 1 1259 1 40 GLU HA 1 40 GLU HG2 4.190 2.200 4.190 2.897 2.840 2.971 . 0 0 "[ . 1 . 2]" 1 1260 1 51 VAL MG2 1 52 ASP HB2 4.190 2.200 4.190 3.684 3.251 3.958 . 0 0 "[ . 1 . 2]" 1 1261 1 55 ASP HA 1 58 MET H 4.190 2.200 4.190 3.502 3.319 3.774 . 0 0 "[ . 1 . 2]" 1 1262 1 69 VAL MG1 1 74 TYR HB3 4.190 2.200 4.190 4.091 3.972 4.192 0.002 6 0 "[ . 1 . 2]" 1 1263 2 15 PHE HB2 2 15 PHE HD1 4.190 2.200 4.190 2.600 2.575 2.634 . 0 0 "[ . 1 . 2]" 1 1264 2 31 LYS HD2 2 32 GLU QG 4.190 2.200 4.190 3.774 3.142 3.914 . 0 0 "[ . 1 . 2]" 1 1265 2 40 GLU HA 2 40 GLU HG2 4.190 2.200 4.190 2.897 2.841 2.974 . 0 0 "[ . 1 . 2]" 1 1266 2 51 VAL MG2 2 52 ASP HB2 4.190 2.200 4.190 3.683 3.250 3.957 . 0 0 "[ . 1 . 2]" 1 1267 2 55 ASP HA 2 58 MET H 4.190 2.200 4.190 3.502 3.319 3.774 . 0 0 "[ . 1 . 2]" 1 1268 2 69 VAL MG1 2 74 TYR HB3 4.190 2.200 4.190 4.091 3.972 4.192 0.002 6 0 "[ . 1 . 2]" 1 1269 1 28 LEU HB3 1 69 VAL HB 4.200 2.200 4.200 2.189 2.164 2.225 0.036 20 0 "[ . 1 . 2]" 1 1270 1 37 LEU H 1 37 LEU HB3 4.200 2.200 4.200 3.633 3.621 3.650 . 0 0 "[ . 1 . 2]" 1 1271 1 44 PHE H 1 44 PHE HD2 4.200 2.200 4.200 2.218 2.196 2.268 0.004 15 0 "[ . 1 . 2]" 1 1272 2 28 LEU HB3 2 69 VAL HB 4.200 2.200 4.200 2.189 2.165 2.226 0.035 20 0 "[ . 1 . 2]" 1 1273 2 37 LEU H 2 37 LEU HB3 4.200 2.200 4.200 3.633 3.623 3.651 . 0 0 "[ . 1 . 2]" 1 1274 2 44 PHE H 2 44 PHE HD2 4.200 2.200 4.200 2.218 2.197 2.269 0.003 15 0 "[ . 1 . 2]" 1 1275 1 14 VAL HA 1 17 ALA H 4.210 2.200 4.210 3.059 2.946 3.117 . 0 0 "[ . 1 . 2]" 1 1276 1 18 HIS H 1 36 LEU QD 4.210 2.200 4.210 3.120 2.803 3.324 . 0 0 "[ . 1 . 2]" 1 1277 1 30 LYS QE 1 31 LYS HB3 4.210 2.200 4.210 3.672 3.439 3.804 . 0 0 "[ . 1 . 2]" 1 1278 1 54 VAL MG2 1 58 MET HG2 4.210 2.200 4.210 4.110 3.234 4.232 0.022 17 0 "[ . 1 . 2]" 1 1279 1 58 MET HA 1 58 MET HG3 4.210 2.200 4.210 3.592 3.572 3.647 . 0 0 "[ . 1 . 2]" 1 1280 1 72 GLN HE22 1 72 GLN HG3 4.210 2.200 4.210 3.719 3.710 3.723 . 0 0 "[ . 1 . 2]" 1 1281 1 82 THR H 1 83 VAL MG1 4.210 2.200 4.210 4.033 4.005 4.047 . 0 0 "[ . 1 . 2]" 1 1282 1 82 THR MG 1 83 VAL HA 4.210 2.200 4.210 3.609 3.493 3.661 . 0 0 "[ . 1 . 2]" 1 1283 2 14 VAL HA 2 17 ALA H 4.210 2.200 4.210 3.059 2.947 3.118 . 0 0 "[ . 1 . 2]" 1 1284 2 18 HIS H 2 36 LEU QD 4.210 2.200 4.210 3.111 2.799 3.313 . 0 0 "[ . 1 . 2]" 1 1285 2 18 HIS HB2 2 19 SER H 4.210 2.200 4.210 2.953 2.692 3.788 . 0 0 "[ . 1 . 2]" 1 1286 2 30 LYS QE 2 31 LYS HB3 4.210 2.200 4.210 3.670 3.436 3.801 . 0 0 "[ . 1 . 2]" 1 1287 2 54 VAL MG2 2 58 MET HG2 4.210 2.200 4.210 4.110 3.235 4.233 0.023 17 0 "[ . 1 . 2]" 1 1288 2 58 MET HA 2 58 MET HG3 4.210 2.200 4.210 3.592 3.572 3.646 . 0 0 "[ . 1 . 2]" 1 1289 2 72 GLN HE22 2 72 GLN HG3 4.210 2.200 4.210 3.720 3.711 3.724 . 0 0 "[ . 1 . 2]" 1 1290 2 82 THR H 2 83 VAL MG1 4.210 2.200 4.210 4.033 4.005 4.047 . 0 0 "[ . 1 . 2]" 1 1291 2 82 THR MG 2 83 VAL HA 4.210 2.200 4.210 3.609 3.495 3.663 . 0 0 "[ . 1 . 2]" 1 1292 1 28 LEU H 1 28 LEU HB3 4.220 2.200 4.220 2.665 2.527 2.884 . 0 0 "[ . 1 . 2]" 1 1293 1 28 LEU HB3 1 28 LEU MD1 4.220 2.200 4.220 3.240 3.207 3.252 . 0 0 "[ . 1 . 2]" 1 1294 1 28 LEU HB3 1 28 LEU MD2 4.220 2.200 4.220 2.329 2.261 2.394 . 0 0 "[ . 1 . 2]" 1 1295 1 28 LEU QD 1 74 TYR HB3 4.220 2.200 4.220 4.136 3.840 4.237 0.017 17 0 "[ . 1 . 2]" 1 1296 1 33 LEU H 1 33 LEU HB2 4.220 2.200 4.220 3.690 3.662 3.722 . 0 0 "[ . 1 . 2]" 1 1297 2 28 LEU H 2 28 LEU HB3 4.220 2.200 4.220 2.666 2.527 2.883 . 0 0 "[ . 1 . 2]" 1 1298 2 28 LEU HB3 2 28 LEU MD1 4.220 2.200 4.220 3.241 3.208 3.252 . 0 0 "[ . 1 . 2]" 1 1299 2 28 LEU HB3 2 28 LEU MD2 4.220 2.200 4.220 2.328 2.261 2.394 . 0 0 "[ . 1 . 2]" 1 1300 2 28 LEU QD 2 74 TYR HB3 4.220 2.200 4.220 4.136 3.841 4.237 0.017 17 0 "[ . 1 . 2]" 1 1301 2 33 LEU H 2 33 LEU HB2 4.220 2.200 4.220 3.691 3.662 3.722 . 0 0 "[ . 1 . 2]" 1 1302 1 12 ILE MG 1 71 PHE HZ 4.230 2.200 4.230 2.881 2.696 3.004 . 0 0 "[ . 1 . 2]" 1 1303 1 27 LYS HB2 1 27 LYS HD2 4.230 2.200 4.230 3.120 3.016 3.538 . 0 0 "[ . 1 . 2]" 1 1304 1 91 GLU HA 1 91 GLU HG3 4.230 2.200 4.230 3.438 2.787 3.668 . 0 0 "[ . 1 . 2]" 1 1305 2 12 ILE MG 2 71 PHE HZ 4.230 2.200 4.230 2.881 2.695 3.003 . 0 0 "[ . 1 . 2]" 1 1306 2 27 LYS HB2 2 27 LYS HD2 4.230 2.200 4.230 3.099 2.999 3.528 . 0 0 "[ . 1 . 2]" 1 1307 2 27 LYS HB2 2 27 LYS HD3 4.230 2.200 4.230 2.295 2.257 2.387 . 0 0 "[ . 1 . 2]" 1 1308 2 91 GLU HA 2 91 GLU HG3 4.230 2.200 4.230 3.438 2.788 3.668 . 0 0 "[ . 1 . 2]" 1 1309 1 15 PHE HB2 1 71 PHE HE1 4.240 2.200 4.240 3.295 2.954 3.403 . 0 0 "[ . 1 . 2]" 1 1310 1 41 LEU MD2 1 44 PHE HB2 4.240 2.200 4.240 4.037 3.823 4.246 0.006 11 0 "[ . 1 . 2]" 1 1311 1 52 ASP HA 1 55 ASP HB2 4.240 2.200 4.240 3.311 3.150 3.566 . 0 0 "[ . 1 . 2]" 1 1312 2 15 PHE HB2 2 71 PHE HE1 4.240 2.200 4.240 3.295 2.953 3.403 . 0 0 "[ . 1 . 2]" 1 1313 2 41 LEU MD2 2 44 PHE HB2 4.240 2.200 4.240 4.036 3.824 4.245 0.005 11 0 "[ . 1 . 2]" 1 1314 2 52 ASP HA 2 55 ASP HB2 4.240 2.200 4.240 3.311 3.150 3.566 . 0 0 "[ . 1 . 2]" 1 1315 1 13 ASN HB2 1 14 VAL MG1 4.250 2.200 4.250 3.226 3.054 3.312 . 0 0 "[ . 1 . 2]" 1 1316 1 14 VAL HA 1 14 VAL MG2 4.250 2.200 4.250 3.235 3.211 3.248 . 0 0 "[ . 1 . 2]" 1 1317 1 16 HIS HA 1 20 GLY H 4.250 2.200 4.250 2.823 2.769 2.894 . 0 0 "[ . 1 . 2]" 1 1318 1 26 TYR H 1 26 TYR HB2 4.250 2.200 4.250 2.758 2.377 3.584 . 0 0 "[ . 1 . 2]" 1 1319 1 31 LYS HD2 1 32 GLU HG3 4.250 2.200 4.250 4.009 3.277 4.195 . 0 0 "[ . 1 . 2]" 1 1320 1 34 LYS HB2 1 34 LYS QE 4.250 2.200 4.250 4.028 3.881 4.131 . 0 0 "[ . 1 . 2]" 1 1321 1 41 LEU MD1 1 81 LEU MD2 4.250 2.200 4.250 2.925 2.454 3.369 . 0 0 "[ . 1 . 2]" 1 1322 2 13 ASN HB2 2 14 VAL MG1 4.250 2.200 4.250 3.226 3.053 3.311 . 0 0 "[ . 1 . 2]" 1 1323 2 14 VAL HA 2 14 VAL MG2 4.250 2.200 4.250 3.235 3.212 3.248 . 0 0 "[ . 1 . 2]" 1 1324 2 16 HIS HA 2 20 GLY H 4.250 2.200 4.250 2.823 2.769 2.894 . 0 0 "[ . 1 . 2]" 1 1325 2 26 TYR H 2 26 TYR HB2 4.250 2.200 4.250 2.759 2.376 3.585 . 0 0 "[ . 1 . 2]" 1 1326 2 34 LYS HB2 2 34 LYS QE 4.250 2.200 4.250 4.028 3.881 4.130 . 0 0 "[ . 1 . 2]" 1 1327 2 41 LEU MD1 2 81 LEU MD2 4.250 2.200 4.250 2.923 2.452 3.370 . 0 0 "[ . 1 . 2]" 1 1328 1 2 SER QB 1 3 GLU H 4.260 2.200 4.260 3.358 2.491 3.940 . 0 0 "[ . 1 . 2]" 1 1329 1 10 THR HA 1 13 ASN HD21 4.260 2.200 4.260 2.834 2.698 2.980 . 0 0 "[ . 1 . 2]" 1 1330 1 41 LEU HB3 1 44 PHE HB2 4.260 2.200 4.260 2.399 2.243 2.641 . 0 0 "[ . 1 . 2]" 1 1331 1 63 GLU HG2 1 64 ASN H 4.260 2.200 4.260 3.416 3.190 3.741 . 0 0 "[ . 1 . 2]" 1 1332 1 87 ASN HB3 1 88 PHE H 4.260 2.200 4.260 3.409 2.592 3.709 . 0 0 "[ . 1 . 2]" 1 1333 2 2 SER QB 2 3 GLU H 4.260 2.200 4.260 3.358 2.490 3.940 . 0 0 "[ . 1 . 2]" 1 1334 2 10 THR HA 2 13 ASN HD21 4.260 2.200 4.260 2.829 2.693 2.972 . 0 0 "[ . 1 . 2]" 1 1335 2 41 LEU HB3 2 44 PHE HB2 4.260 2.200 4.260 2.399 2.243 2.640 . 0 0 "[ . 1 . 2]" 1 1336 2 63 GLU HG2 2 64 ASN H 4.260 2.200 4.260 3.416 3.189 3.740 . 0 0 "[ . 1 . 2]" 1 1337 2 87 ASN HB3 2 88 PHE H 4.260 2.200 4.260 3.408 2.591 3.708 . 0 0 "[ . 1 . 2]" 1 1338 1 20 GLY HA2 1 25 LYS QD 4.270 2.200 4.270 3.532 3.267 4.071 . 0 0 "[ . 1 . 2]" 1 1339 1 41 LEU HA 1 44 PHE HD2 4.270 2.200 4.270 3.753 3.519 4.038 . 0 0 "[ . 1 . 2]" 1 1340 1 61 LEU H 1 61 LEU HB3 4.270 2.200 4.270 3.605 3.590 3.619 . 0 0 "[ . 1 . 2]" 1 1341 1 78 VAL MG2 1 79 ALA MB 4.270 2.200 4.270 2.942 2.923 2.969 . 0 0 "[ . 1 . 2]" 1 1342 2 20 GLY HA2 2 25 LYS QD 4.270 2.200 4.270 3.532 3.267 4.072 . 0 0 "[ . 1 . 2]" 1 1343 2 41 LEU HA 2 44 PHE HD2 4.270 2.200 4.270 3.752 3.518 4.036 . 0 0 "[ . 1 . 2]" 1 1344 2 61 LEU H 2 61 LEU HB3 4.270 2.200 4.270 3.605 3.589 3.619 . 0 0 "[ . 1 . 2]" 1 1345 2 78 VAL MG2 2 79 ALA MB 4.270 2.200 4.270 2.942 2.923 2.969 . 0 0 "[ . 1 . 2]" 1 1346 1 10 THR H 1 10 THR MG 4.280 2.200 4.280 3.751 3.736 3.761 . 0 0 "[ . 1 . 2]" 1 1347 1 12 ILE MD 1 71 PHE HZ 4.280 2.200 4.280 3.912 3.877 3.931 . 0 0 "[ . 1 . 2]" 1 1348 1 18 HIS HB2 1 19 SER H 4.280 2.200 4.280 2.949 2.685 3.764 . 0 0 "[ . 1 . 2]" 1 1349 1 18 HIS HB3 1 19 SER H 4.280 2.200 4.280 3.404 2.277 4.157 . 0 0 "[ . 1 . 2]" 1 1350 1 22 GLU HA 1 22 GLU HG2 4.280 2.200 4.280 2.726 2.366 3.682 . 0 0 "[ . 1 . 2]" 1 1351 1 22 GLU HA 1 22 GLU HG3 4.280 2.200 4.280 2.896 2.453 3.670 . 0 0 "[ . 1 . 2]" 1 1352 1 28 LEU HA 1 32 GLU HB3 4.280 2.200 4.280 4.192 4.030 4.285 0.005 18 0 "[ . 1 . 2]" 1 1353 1 34 LYS HD3 1 54 VAL HB 4.280 2.200 4.280 2.358 2.262 2.698 . 0 0 "[ . 1 . 2]" 1 1354 1 37 LEU MD1 1 41 LEU HB3 4.280 2.200 4.280 3.869 3.688 4.080 . 0 0 "[ . 1 . 2]" 1 1355 1 41 LEU H 1 41 LEU MD2 4.280 2.200 4.280 3.297 3.165 3.384 . 0 0 "[ . 1 . 2]" 1 1356 1 45 LEU HA 1 45 LEU HG 4.280 2.200 4.280 3.573 3.546 3.648 . 0 0 "[ . 1 . 2]" 1 1357 1 81 LEU H 1 81 LEU MD2 4.280 2.200 4.280 3.812 3.655 4.019 . 0 0 "[ . 1 . 2]" 1 1358 1 83 VAL MG2 1 84 ALA MB 4.280 2.200 4.280 4.297 4.291 4.301 0.021 15 0 "[ . 1 . 2]" 1 1359 2 10 THR H 2 10 THR MG 4.280 2.200 4.280 3.762 3.747 3.773 . 0 0 "[ . 1 . 2]" 1 1360 2 12 ILE MD 2 71 PHE HZ 4.280 2.200 4.280 3.912 3.877 3.932 . 0 0 "[ . 1 . 2]" 1 1361 2 18 HIS HB3 2 19 SER H 4.280 2.200 4.280 3.405 2.329 4.158 . 0 0 "[ . 1 . 2]" 1 1362 2 22 GLU HA 2 22 GLU HG2 4.280 2.200 4.280 2.726 2.366 3.680 . 0 0 "[ . 1 . 2]" 1 1363 2 22 GLU HA 2 22 GLU HG3 4.280 2.200 4.280 2.896 2.454 3.669 . 0 0 "[ . 1 . 2]" 1 1364 2 28 LEU HA 2 32 GLU HB3 4.280 2.200 4.280 4.190 4.028 4.286 0.006 18 0 "[ . 1 . 2]" 1 1365 2 34 LYS HD3 2 54 VAL HB 4.280 2.200 4.280 2.358 2.261 2.697 . 0 0 "[ . 1 . 2]" 1 1366 2 37 LEU MD1 2 41 LEU HB3 4.280 2.200 4.280 3.869 3.688 4.080 . 0 0 "[ . 1 . 2]" 1 1367 2 41 LEU H 2 41 LEU MD2 4.280 2.200 4.280 3.297 3.164 3.384 . 0 0 "[ . 1 . 2]" 1 1368 2 45 LEU HA 2 45 LEU HG 4.280 2.200 4.280 3.573 3.544 3.648 . 0 0 "[ . 1 . 2]" 1 1369 2 81 LEU H 2 81 LEU MD2 4.280 2.200 4.280 3.832 3.676 4.038 . 0 0 "[ . 1 . 2]" 1 1370 2 83 VAL MG2 2 84 ALA MB 4.280 2.200 4.280 4.297 4.291 4.302 0.022 15 0 "[ . 1 . 2]" 1 1371 1 3 GLU H 1 3 GLU HB3 4.290 2.200 4.290 3.492 2.662 3.595 . 0 0 "[ . 1 . 2]" 1 1372 1 25 LYS QB 1 26 TYR HD2 4.290 2.200 4.290 2.674 2.232 2.981 . 0 0 "[ . 1 . 2]" 1 1373 1 34 LYS HG3 1 35 GLU HA 4.290 2.200 4.290 3.864 3.809 3.930 . 0 0 "[ . 1 . 2]" 1 1374 1 45 LEU HA 1 57 VAL MG2 4.290 2.200 4.290 4.270 4.169 4.308 0.018 16 0 "[ . 1 . 2]" 1 1375 1 52 ASP H 1 52 ASP HB3 4.290 2.200 4.290 3.494 2.623 3.614 . 0 0 "[ . 1 . 2]" 1 1376 2 3 GLU H 2 3 GLU HB3 4.290 2.200 4.290 3.492 2.662 3.596 . 0 0 "[ . 1 . 2]" 1 1377 2 25 LYS QB 2 26 TYR HD2 4.290 2.200 4.290 2.674 2.233 2.982 . 0 0 "[ . 1 . 2]" 1 1378 2 34 LYS HG3 2 35 GLU HA 4.290 2.200 4.290 3.864 3.810 3.931 . 0 0 "[ . 1 . 2]" 1 1379 2 45 LEU HA 2 57 VAL MG2 4.290 2.200 4.290 4.270 4.168 4.308 0.018 16 0 "[ . 1 . 2]" 1 1380 2 52 ASP H 2 52 ASP HB3 4.290 2.200 4.290 3.495 2.625 3.614 . 0 0 "[ . 1 . 2]" 1 1381 1 15 PHE HB2 1 16 HIS H 4.300 2.200 4.300 3.804 3.773 3.903 . 0 0 "[ . 1 . 2]" 1 1382 1 36 LEU HA 1 39 THR MG 4.300 2.200 4.300 3.188 2.861 3.405 . 0 0 "[ . 1 . 2]" 1 1383 1 37 LEU HB3 1 38 GLN H 4.300 2.200 4.300 3.511 3.439 3.573 . 0 0 "[ . 1 . 2]" 1 1384 2 15 PHE HB2 2 16 HIS H 4.300 2.200 4.300 3.804 3.772 3.903 . 0 0 "[ . 1 . 2]" 1 1385 2 36 LEU HA 2 39 THR MG 4.300 2.200 4.300 3.188 2.876 3.403 . 0 0 "[ . 1 . 2]" 1 1386 2 37 LEU HB3 2 38 GLN H 4.300 2.200 4.300 3.511 3.439 3.572 . 0 0 "[ . 1 . 2]" 1 1387 1 29 SER H 1 32 GLU H 4.310 2.200 4.310 3.716 3.550 3.970 . 0 0 "[ . 1 . 2]" 1 1388 2 29 SER H 2 32 GLU H 4.310 2.200 4.310 3.716 3.551 3.968 . 0 0 "[ . 1 . 2]" 1 1389 1 14 VAL MG2 1 36 LEU QD 4.320 2.200 4.320 2.496 2.347 2.706 . 0 0 "[ . 1 . 2]" 1 1390 1 53 ALA MB 1 54 VAL HA 4.320 2.200 4.320 3.799 3.763 3.831 . 0 0 "[ . 1 . 2]" 1 1391 1 68 GLU HA 1 69 VAL MG2 4.320 2.200 4.320 3.375 3.172 3.507 . 0 0 "[ . 1 . 2]" 1 1392 2 14 VAL MG2 2 36 LEU QD 4.320 2.200 4.320 2.497 2.346 2.710 . 0 0 "[ . 1 . 2]" 1 1393 2 53 ALA MB 2 54 VAL HA 4.320 2.200 4.320 3.799 3.763 3.830 . 0 0 "[ . 1 . 2]" 1 1394 2 68 GLU HA 2 69 VAL MG2 4.320 2.200 4.320 3.375 3.171 3.508 . 0 0 "[ . 1 . 2]" 1 1395 1 6 THR MG 1 7 ALA H 4.330 2.200 4.330 3.585 3.552 3.610 . 0 0 "[ . 1 . 2]" 1 1396 1 38 GLN HB3 1 39 THR H 4.330 2.200 4.330 3.670 3.651 3.711 . 0 0 "[ . 1 . 2]" 1 1397 1 47 ALA MB 1 48 GLN HE21 4.330 2.200 4.330 2.482 2.199 2.932 0.001 16 0 "[ . 1 . 2]" 1 1398 1 63 GLU HB3 1 64 ASN HB2 4.330 2.200 4.330 4.185 3.928 4.355 0.025 17 0 "[ . 1 . 2]" 1 1399 2 6 THR MG 2 7 ALA H 4.330 2.200 4.330 3.587 3.555 3.611 . 0 0 "[ . 1 . 2]" 1 1400 2 38 GLN HB3 2 39 THR H 4.330 2.200 4.330 3.670 3.652 3.712 . 0 0 "[ . 1 . 2]" 1 1401 2 47 ALA MB 2 48 GLN HE21 4.330 2.200 4.330 2.482 2.198 2.929 0.002 16 0 "[ . 1 . 2]" 1 1402 2 63 GLU HB3 2 64 ASN HB2 4.330 2.200 4.330 4.185 3.927 4.354 0.024 17 0 "[ . 1 . 2]" 1 1403 1 15 PHE HB3 1 71 PHE HE1 4.340 2.200 4.340 3.522 3.350 3.685 . 0 0 "[ . 1 . 2]" 1 1404 1 33 LEU HB2 1 36 LEU HB3 4.340 2.200 4.340 4.144 3.865 4.387 0.047 16 0 "[ . 1 . 2]" 1 1405 1 37 LEU MD2 1 45 LEU HG 4.340 2.200 4.340 4.364 4.355 4.372 0.032 1 0 "[ . 1 . 2]" 1 1406 1 45 LEU MD1 1 57 VAL HB 4.340 2.200 4.340 3.940 3.619 4.370 0.030 20 0 "[ . 1 . 2]" 1 1407 1 47 ALA MB 1 48 GLN HG2 4.340 2.200 4.340 3.288 2.968 3.753 . 0 0 "[ . 1 . 2]" 1 1408 1 51 VAL MG2 1 52 ASP H 4.340 2.200 4.340 2.195 2.189 2.199 0.011 20 0 "[ . 1 . 2]" 1 1409 1 62 ASP HA 1 69 VAL MG2 4.340 2.200 4.340 3.891 3.702 4.105 . 0 0 "[ . 1 . 2]" 1 1410 1 69 VAL MG1 1 73 GLU HB2 4.340 2.200 4.340 2.170 2.157 2.183 0.043 18 0 "[ . 1 . 2]" 1 1411 1 82 THR HB 1 83 VAL MG1 4.340 2.200 4.340 4.161 4.097 4.199 . 0 0 "[ . 1 . 2]" 1 1412 2 15 PHE HB3 2 71 PHE HE1 4.340 2.200 4.340 3.523 3.351 3.683 . 0 0 "[ . 1 . 2]" 1 1413 2 27 LYS QD 2 70 ASP HB3 4.340 2.200 4.340 3.727 2.630 4.356 0.016 5 0 "[ . 1 . 2]" 1 1414 2 33 LEU HB2 2 36 LEU HB3 4.340 2.200 4.340 4.145 3.866 4.386 0.046 20 0 "[ . 1 . 2]" 1 1415 2 37 LEU MD2 2 45 LEU HG 4.340 2.200 4.340 4.364 4.355 4.372 0.032 1 0 "[ . 1 . 2]" 1 1416 2 45 LEU MD1 2 57 VAL HB 4.340 2.200 4.340 3.940 3.618 4.371 0.031 20 0 "[ . 1 . 2]" 1 1417 2 47 ALA MB 2 48 GLN HG2 4.340 2.200 4.340 3.288 2.967 3.752 . 0 0 "[ . 1 . 2]" 1 1418 2 51 VAL MG2 2 52 ASP H 4.340 2.200 4.340 2.195 2.188 2.199 0.012 20 0 "[ . 1 . 2]" 1 1419 2 62 ASP HA 2 69 VAL MG2 4.340 2.200 4.340 3.891 3.701 4.106 . 0 0 "[ . 1 . 2]" 1 1420 2 69 VAL MG1 2 73 GLU HB2 4.340 2.200 4.340 2.170 2.157 2.185 0.043 18 0 "[ . 1 . 2]" 1 1421 2 82 THR HB 2 83 VAL MG1 4.340 2.200 4.340 4.162 4.098 4.198 . 0 0 "[ . 1 . 2]" 1 1422 1 27 LYS HD3 1 70 ASP HA 4.350 2.200 4.350 3.965 3.475 4.375 0.025 6 0 "[ . 1 . 2]" 1 1423 1 41 LEU MD1 1 44 PHE HB2 4.350 2.200 4.350 2.651 2.464 2.789 . 0 0 "[ . 1 . 2]" 1 1424 1 81 LEU HA 1 81 LEU MD2 4.350 2.200 4.350 3.729 3.685 3.751 . 0 0 "[ . 1 . 2]" 1 1425 2 41 LEU MD1 2 44 PHE HB2 4.350 2.200 4.350 2.651 2.464 2.790 . 0 0 "[ . 1 . 2]" 1 1426 2 81 LEU HA 2 81 LEU MD2 4.350 2.200 4.350 3.742 3.697 3.764 . 0 0 "[ . 1 . 2]" 1 1427 1 25 LYS QB 1 25 LYS QE 4.360 2.200 4.360 2.339 2.180 3.477 0.020 16 0 "[ . 1 . 2]" 1 1428 1 28 LEU HA 1 28 LEU MD1 4.360 2.200 4.360 2.176 2.165 2.193 0.035 16 0 "[ . 1 . 2]" 1 1429 1 28 LEU HA 1 28 LEU MD2 4.360 2.200 4.360 3.812 3.758 3.855 . 0 0 "[ . 1 . 2]" 1 1430 1 71 PHE HZ 1 75 VAL MG2 4.360 2.200 4.360 4.215 4.161 4.296 . 0 0 "[ . 1 . 2]" 1 1431 1 79 ALA MB 1 80 ALA HA 4.360 2.200 4.360 3.712 3.697 3.726 . 0 0 "[ . 1 . 2]" 1 1432 2 25 LYS QB 2 25 LYS QE 4.360 2.200 4.360 2.339 2.180 3.477 0.020 16 0 "[ . 1 . 2]" 1 1433 2 28 LEU HA 2 28 LEU MD1 4.360 2.200 4.360 2.176 2.165 2.192 0.035 16 0 "[ . 1 . 2]" 1 1434 2 28 LEU HA 2 28 LEU MD2 4.360 2.200 4.360 3.811 3.758 3.855 . 0 0 "[ . 1 . 2]" 1 1435 2 71 PHE HZ 2 75 VAL MG2 4.360 2.200 4.360 4.215 4.160 4.294 . 0 0 "[ . 1 . 2]" 1 1436 2 79 ALA MB 2 80 ALA HA 4.360 2.200 4.360 3.711 3.697 3.726 . 0 0 "[ . 1 . 2]" 1 1437 1 72 GLN HA 1 75 VAL H 4.370 2.200 4.370 3.386 3.361 3.420 . 0 0 "[ . 1 . 2]" 1 1438 1 78 VAL HB 1 79 ALA H 4.370 2.200 4.370 3.860 3.844 3.884 . 0 0 "[ . 1 . 2]" 1 1439 2 72 GLN HA 2 75 VAL H 4.370 2.200 4.370 3.386 3.362 3.420 . 0 0 "[ . 1 . 2]" 1 1440 2 78 VAL HB 2 79 ALA H 4.370 2.200 4.370 3.860 3.844 3.885 . 0 0 "[ . 1 . 2]" 1 1441 1 7 ALA MB 1 8 MET HA 4.380 2.200 4.380 3.737 3.694 3.856 . 0 0 "[ . 1 . 2]" 1 1442 1 36 LEU HA 1 36 LEU MD1 4.380 2.200 4.380 3.770 3.651 3.839 . 0 0 "[ . 1 . 2]" 1 1443 1 36 LEU HA 1 36 LEU MD2 4.380 2.200 4.380 2.679 2.526 2.876 . 0 0 "[ . 1 . 2]" 1 1444 2 7 ALA MB 2 8 MET HA 4.380 2.200 4.380 3.736 3.693 3.856 . 0 0 "[ . 1 . 2]" 1 1445 2 36 LEU HA 2 36 LEU MD1 4.380 2.200 4.380 3.766 3.652 3.835 . 0 0 "[ . 1 . 2]" 1 1446 2 36 LEU HA 2 36 LEU MD2 4.380 2.200 4.380 2.681 2.530 2.876 . 0 0 "[ . 1 . 2]" 1 1447 1 11 LEU HA 1 14 VAL MG1 4.390 2.200 4.390 3.564 3.413 3.727 . 0 0 "[ . 1 . 2]" 1 1448 1 13 ASN H 1 14 VAL MG2 4.390 2.200 4.390 4.232 4.193 4.273 . 0 0 "[ . 1 . 2]" 1 1449 1 27 LYS HA 1 27 LYS HD2 4.390 2.200 4.390 2.232 2.179 2.636 0.021 6 0 "[ . 1 . 2]" 1 1450 1 27 LYS HD3 1 70 ASP HB2 4.390 2.200 4.390 4.015 3.707 4.416 0.026 18 0 "[ . 1 . 2]" 1 1451 1 28 LEU QD 1 74 TYR HE1 4.390 2.200 4.390 3.394 2.815 5.239 0.849 8 3 "[ *. + 1 - . 2]" 1 1452 1 31 LYS HA 1 34 LYS H 4.390 2.200 4.390 3.752 3.631 3.919 . 0 0 "[ . 1 . 2]" 1 1453 1 33 LEU H 1 33 LEU QD 4.390 2.200 4.390 2.780 2.460 2.869 . 0 0 "[ . 1 . 2]" 1 1454 1 41 LEU HB2 1 44 PHE HB2 4.390 2.200 4.390 3.195 3.103 3.265 . 0 0 "[ . 1 . 2]" 1 1455 2 11 LEU HA 2 14 VAL MG1 4.390 2.200 4.390 3.561 3.409 3.724 . 0 0 "[ . 1 . 2]" 1 1456 2 13 ASN H 2 14 VAL MG2 4.390 2.200 4.390 4.231 4.193 4.274 . 0 0 "[ . 1 . 2]" 1 1457 2 27 LYS HA 2 27 LYS HD2 4.390 2.200 4.390 2.251 2.201 2.639 . 0 0 "[ . 1 . 2]" 1 1458 2 27 LYS HA 2 27 LYS HD3 4.390 2.200 4.390 3.036 2.327 3.214 . 0 0 "[ . 1 . 2]" 1 1459 2 28 LEU QD 2 74 TYR HE1 4.390 2.200 4.390 3.393 2.812 5.238 0.848 8 3 "[ *. + 1 - . 2]" 1 1460 2 31 LYS HA 2 34 LYS H 4.390 2.200 4.390 3.752 3.630 3.919 . 0 0 "[ . 1 . 2]" 1 1461 2 33 LEU H 2 33 LEU QD 4.390 2.200 4.390 2.779 2.459 2.867 . 0 0 "[ . 1 . 2]" 1 1462 2 41 LEU HB2 2 44 PHE HB2 4.390 2.200 4.390 3.195 3.103 3.265 . 0 0 "[ . 1 . 2]" 1 1463 1 10 THR MG 1 13 ASN HB2 4.400 2.200 4.400 3.568 3.429 3.712 . 0 0 "[ . 1 . 2]" 1 1464 1 37 LEU HB2 1 45 LEU HB2 4.400 2.200 4.400 4.100 3.616 4.220 . 0 0 "[ . 1 . 2]" 1 1465 1 48 GLN HB3 1 53 ALA HA 4.400 2.200 4.400 4.070 3.811 4.252 . 0 0 "[ . 1 . 2]" 1 1466 1 74 TYR HA 1 77 LEU MD2 4.400 2.200 4.400 3.183 3.138 3.243 . 0 0 "[ . 1 . 2]" 1 1467 2 10 THR MG 2 13 ASN HB2 4.400 2.200 4.400 3.567 3.427 3.710 . 0 0 "[ . 1 . 2]" 1 1468 2 11 LEU QD 2 75 VAL MG2 4.400 2.200 4.400 3.091 2.920 3.255 . 0 0 "[ . 1 . 2]" 1 1469 2 37 LEU HB2 2 45 LEU HB2 4.400 2.200 4.400 4.100 3.617 4.221 . 0 0 "[ . 1 . 2]" 1 1470 2 48 GLN HB3 2 53 ALA HA 4.400 2.200 4.400 4.070 3.813 4.251 . 0 0 "[ . 1 . 2]" 1 1471 2 74 TYR HA 2 77 LEU MD2 4.400 2.200 4.400 3.183 3.137 3.242 . 0 0 "[ . 1 . 2]" 1 1472 1 4 LEU QD 1 8 MET HG2 4.410 2.200 4.410 3.059 3.001 3.100 . 0 0 "[ . 1 . 2]" 1 1473 1 15 PHE HE1 1 28 LEU MD1 4.410 2.200 4.410 3.383 2.701 3.630 . 0 0 "[ . 1 . 2]" 1 1474 1 15 PHE HE1 1 28 LEU MD2 4.410 2.200 4.410 2.494 2.218 2.971 . 0 0 "[ . 1 . 2]" 1 1475 1 21 LYS HE2 1 22 GLU HB2 4.410 2.200 4.410 3.530 2.984 4.275 . 0 0 "[ . 1 . 2]" 1 1476 1 58 MET H 1 58 MET HG2 4.410 2.200 4.410 3.328 2.195 3.822 0.005 9 0 "[ . 1 . 2]" 1 1477 2 4 LEU QD 2 8 MET HG2 4.410 2.200 4.410 3.059 3.001 3.101 . 0 0 "[ . 1 . 2]" 1 1478 2 15 PHE HE1 2 28 LEU MD1 4.410 2.200 4.410 3.383 2.701 3.630 . 0 0 "[ . 1 . 2]" 1 1479 2 15 PHE HE1 2 28 LEU MD2 4.410 2.200 4.410 2.495 2.217 2.971 . 0 0 "[ . 1 . 2]" 1 1480 2 21 LYS HE2 2 22 GLU HB2 4.410 2.200 4.410 3.530 2.984 4.275 . 0 0 "[ . 1 . 2]" 1 1481 2 58 MET H 2 58 MET HG2 4.410 2.200 4.410 3.328 2.195 3.822 0.005 9 0 "[ . 1 . 2]" 1 1482 1 11 LEU MD1 1 75 VAL MG2 4.420 2.200 4.420 3.134 2.958 3.306 . 0 0 "[ . 1 . 2]" 1 1483 1 28 LEU MD1 1 33 LEU HA 4.420 2.200 4.420 3.160 2.912 3.975 . 0 0 "[ . 1 . 2]" 1 1484 1 28 LEU MD2 1 33 LEU HA 4.420 2.200 4.420 2.658 2.363 3.090 . 0 0 "[ . 1 . 2]" 1 1485 1 33 LEU QD 1 69 VAL MG1 4.420 2.200 4.420 2.987 2.635 3.282 . 0 0 "[ . 1 . 2]" 1 1486 1 37 LEU HB2 1 45 LEU HG 4.420 2.200 4.420 2.533 2.435 2.639 . 0 0 "[ . 1 . 2]" 1 1487 1 39 THR MG 1 40 GLU H 4.420 2.200 4.420 3.912 3.869 3.971 . 0 0 "[ . 1 . 2]" 1 1488 1 41 LEU HA 1 41 LEU MD1 4.420 2.200 4.420 3.791 3.784 3.802 . 0 0 "[ . 1 . 2]" 1 1489 1 69 VAL H 1 69 VAL MG1 4.420 2.200 4.420 3.802 3.768 3.821 . 0 0 "[ . 1 . 2]" 1 1490 1 82 THR HA 1 85 CYS H 4.420 2.200 4.420 3.407 3.348 3.459 . 0 0 "[ . 1 . 2]" 1 1491 1 88 PHE HA 1 91 GLU HB3 4.420 2.200 4.420 3.941 3.238 4.502 0.082 2 0 "[ . 1 . 2]" 1 1492 2 28 LEU MD1 2 33 LEU HA 4.420 2.200 4.420 3.161 2.913 3.975 . 0 0 "[ . 1 . 2]" 1 1493 2 28 LEU MD2 2 33 LEU HA 4.420 2.200 4.420 2.658 2.362 3.091 . 0 0 "[ . 1 . 2]" 1 1494 2 33 LEU QD 2 69 VAL MG1 4.420 2.200 4.420 2.988 2.636 3.282 . 0 0 "[ . 1 . 2]" 1 1495 2 37 LEU HB2 2 45 LEU HG 4.420 2.200 4.420 2.533 2.434 2.641 . 0 0 "[ . 1 . 2]" 1 1496 2 39 THR MG 2 40 GLU H 4.420 2.200 4.420 3.912 3.868 3.971 . 0 0 "[ . 1 . 2]" 1 1497 2 41 LEU HA 2 41 LEU MD1 4.420 2.200 4.420 3.791 3.784 3.801 . 0 0 "[ . 1 . 2]" 1 1498 2 69 VAL H 2 69 VAL MG1 4.420 2.200 4.420 3.802 3.768 3.820 . 0 0 "[ . 1 . 2]" 1 1499 2 82 THR HA 2 85 CYS H 4.420 2.200 4.420 3.407 3.348 3.459 . 0 0 "[ . 1 . 2]" 1 1500 2 88 PHE HA 2 91 GLU HB3 4.420 2.200 4.420 3.941 3.238 4.502 0.082 2 0 "[ . 1 . 2]" 1 1501 1 3 GLU H 1 4 LEU H 4.430 2.200 4.430 2.809 2.682 2.939 . 0 0 "[ . 1 . 2]" 1 1502 1 55 ASP HA 1 58 MET HG2 4.430 2.200 4.430 2.648 2.228 3.566 . 0 0 "[ . 1 . 2]" 1 1503 1 58 MET ME 1 67 GLY HA3 4.430 2.200 4.430 4.151 3.840 4.406 . 0 0 "[ . 1 . 2]" 1 1504 2 3 GLU H 2 4 LEU H 4.430 2.200 4.430 2.809 2.681 2.939 . 0 0 "[ . 1 . 2]" 1 1505 2 8 MET HG2 2 11 LEU QD 4.430 2.200 4.430 3.636 3.307 3.752 . 0 0 "[ . 1 . 2]" 1 1506 2 55 ASP HA 2 58 MET HG2 4.430 2.200 4.430 2.648 2.230 3.566 . 0 0 "[ . 1 . 2]" 1 1507 2 58 MET ME 2 67 GLY HA3 4.430 2.200 4.430 4.151 3.840 4.407 . 0 0 "[ . 1 . 2]" 1 1508 1 15 PHE HE1 1 71 PHE HA 4.440 2.200 4.440 2.914 2.614 3.224 . 0 0 "[ . 1 . 2]" 1 1509 1 16 HIS HA 1 18 HIS H 4.440 2.200 4.440 4.485 4.368 4.525 0.085 20 0 "[ . 1 . 2]" 1 1510 1 30 LYS H 1 33 LEU QD 4.440 2.200 4.440 3.513 3.423 3.734 . 0 0 "[ . 1 . 2]" 1 1511 1 76 VAL HB 1 79 ALA MB 4.440 2.200 4.440 4.207 4.121 4.308 . 0 0 "[ . 1 . 2]" 1 1512 2 15 PHE HE1 2 71 PHE HA 4.440 2.200 4.440 2.913 2.614 3.224 . 0 0 "[ . 1 . 2]" 1 1513 2 16 HIS HA 2 18 HIS H 4.440 2.200 4.440 4.486 4.371 4.524 0.084 20 0 "[ . 1 . 2]" 1 1514 2 30 LYS H 2 33 LEU QD 4.440 2.200 4.440 3.513 3.423 3.734 . 0 0 "[ . 1 . 2]" 1 1515 2 76 VAL HB 2 79 ALA MB 4.440 2.200 4.440 4.206 4.122 4.309 . 0 0 "[ . 1 . 2]" 1 1516 1 6 THR H 1 6 THR MG 4.450 2.200 4.450 3.747 3.742 3.752 . 0 0 "[ . 1 . 2]" 1 1517 1 8 MET HG2 1 11 LEU MD1 4.450 2.200 4.450 3.672 3.332 3.785 . 0 0 "[ . 1 . 2]" 1 1518 1 18 HIS H 1 28 LEU QD 4.450 2.200 4.450 4.284 4.148 4.461 0.011 19 0 "[ . 1 . 2]" 1 1519 1 62 ASP HA 1 69 VAL HA 4.450 2.200 4.450 3.555 3.331 3.788 . 0 0 "[ . 1 . 2]" 1 1520 1 84 ALA MB 1 85 CYS HA 4.450 2.200 4.450 3.827 3.801 3.853 . 0 0 "[ . 1 . 2]" 1 1521 2 6 THR H 2 6 THR MG 4.450 2.200 4.450 3.748 3.742 3.754 . 0 0 "[ . 1 . 2]" 1 1522 2 18 HIS H 2 28 LEU QD 4.450 2.200 4.450 4.282 4.142 4.461 0.011 19 0 "[ . 1 . 2]" 1 1523 2 62 ASP HA 2 69 VAL HA 4.450 2.200 4.450 3.555 3.330 3.787 . 0 0 "[ . 1 . 2]" 1 1524 2 84 ALA MB 2 85 CYS HA 4.450 2.200 4.450 3.827 3.801 3.854 . 0 0 "[ . 1 . 2]" 1 1525 1 20 GLY HA2 1 25 LYS HB2 4.460 2.200 4.460 4.360 4.207 4.482 0.022 5 0 "[ . 1 . 2]" 1 1526 1 20 GLY HA2 1 25 LYS HB3 4.460 2.200 4.460 3.114 2.867 3.504 . 0 0 "[ . 1 . 2]" 1 1527 1 28 LEU HB2 1 74 TYR HB2 4.460 2.200 4.460 4.379 4.201 4.473 0.013 20 0 "[ . 1 . 2]" 1 1528 1 44 PHE HB3 1 45 LEU MD2 4.460 2.200 4.460 3.217 2.908 4.472 0.012 12 0 "[ . 1 . 2]" 1 1529 1 52 ASP HB3 1 56 LYS QG 4.460 2.200 4.460 3.346 3.075 3.881 . 0 0 "[ . 1 . 2]" 1 1530 2 20 GLY HA2 2 25 LYS HB2 4.460 2.200 4.460 4.360 4.205 4.482 0.022 5 0 "[ . 1 . 2]" 1 1531 2 20 GLY HA2 2 25 LYS HB3 4.460 2.200 4.460 3.114 2.868 3.504 . 0 0 "[ . 1 . 2]" 1 1532 2 28 LEU HB2 2 74 TYR HB2 4.460 2.200 4.460 4.380 4.202 4.474 0.014 20 0 "[ . 1 . 2]" 1 1533 2 44 PHE HB3 2 45 LEU MD2 4.460 2.200 4.460 3.217 2.907 4.472 0.012 12 0 "[ . 1 . 2]" 1 1534 2 52 ASP HB3 2 56 LYS QG 4.460 2.200 4.460 3.346 3.076 3.882 . 0 0 "[ . 1 . 2]" 1 1535 1 29 SER H 1 29 SER HB2 4.470 2.200 4.470 3.263 2.501 3.713 . 0 0 "[ . 1 . 2]" 1 1536 1 82 THR H 1 82 THR MG 4.470 2.200 4.470 3.752 3.737 3.765 . 0 0 "[ . 1 . 2]" 1 1537 2 29 SER H 2 29 SER HB2 4.470 2.200 4.470 3.263 2.503 3.714 . 0 0 "[ . 1 . 2]" 1 1538 2 82 THR H 2 82 THR MG 4.470 2.200 4.470 3.752 3.736 3.764 . 0 0 "[ . 1 . 2]" 1 1539 1 10 THR MG 1 11 LEU HA 4.480 2.200 4.480 3.547 3.436 3.583 . 0 0 "[ . 1 . 2]" 1 1540 1 25 LYS QB 1 26 TYR HE2 4.480 2.200 4.480 3.041 2.735 3.230 . 0 0 "[ . 1 . 2]" 1 1541 1 87 ASN HA 1 91 GLU HB3 4.480 2.200 4.480 4.492 4.276 4.536 0.056 9 0 "[ . 1 . 2]" 1 1542 1 87 ASN HB3 1 88 PHE HA 4.480 2.200 4.480 4.268 3.951 4.452 . 0 0 "[ . 1 . 2]" 1 1543 2 10 THR MG 2 11 LEU HA 4.480 2.200 4.480 3.541 3.431 3.577 . 0 0 "[ . 1 . 2]" 1 1544 2 25 LYS QB 2 26 TYR HE2 4.480 2.200 4.480 3.041 2.734 3.230 . 0 0 "[ . 1 . 2]" 1 1545 2 87 ASN HA 2 91 GLU HB3 4.480 2.200 4.480 4.492 4.275 4.537 0.057 9 0 "[ . 1 . 2]" 1 1546 2 87 ASN HB3 2 88 PHE HA 4.480 2.200 4.480 4.268 3.952 4.451 . 0 0 "[ . 1 . 2]" 1 1547 1 27 LYS HD2 1 70 ASP HB2 4.490 2.200 4.490 3.097 2.841 3.437 . 0 0 "[ . 1 . 2]" 1 1548 1 41 LEU MD1 1 78 VAL HA 4.490 2.200 4.490 4.222 3.914 4.471 . 0 0 "[ . 1 . 2]" 1 1549 1 47 ALA MB 1 48 GLN HE22 4.490 2.200 4.490 3.375 3.006 3.808 . 0 0 "[ . 1 . 2]" 1 1550 2 27 LYS HD2 2 70 ASP HB2 4.490 2.200 4.490 3.134 2.907 3.466 . 0 0 "[ . 1 . 2]" 1 1551 2 27 LYS HD3 2 70 ASP HB2 4.490 2.200 4.490 4.109 3.830 4.495 0.005 10 0 "[ . 1 . 2]" 1 1552 2 41 LEU MD1 2 78 VAL HA 4.490 2.200 4.490 4.222 3.915 4.472 . 0 0 "[ . 1 . 2]" 1 1553 2 47 ALA MB 2 48 GLN HE22 4.490 2.200 4.490 3.375 3.006 3.807 . 0 0 "[ . 1 . 2]" 1 1554 1 30 LYS HB2 1 30 LYS QE 4.500 2.200 4.500 3.224 3.065 3.534 . 0 0 "[ . 1 . 2]" 1 1555 1 36 LEU HB2 1 37 LEU MD2 4.500 2.200 4.500 3.703 3.630 3.799 . 0 0 "[ . 1 . 2]" 1 1556 1 52 ASP HB3 1 53 ALA H 4.500 2.200 4.500 4.025 2.928 4.308 . 0 0 "[ . 1 . 2]" 1 1557 1 64 ASN HB3 1 65 GLY H 4.500 2.200 4.500 3.234 2.587 3.695 . 0 0 "[ . 1 . 2]" 1 1558 2 30 LYS HB2 2 30 LYS QE 4.500 2.200 4.500 3.224 3.065 3.535 . 0 0 "[ . 1 . 2]" 1 1559 2 36 LEU HB2 2 37 LEU MD2 4.500 2.200 4.500 3.702 3.625 3.806 . 0 0 "[ . 1 . 2]" 1 1560 2 52 ASP HB3 2 53 ALA H 4.500 2.200 4.500 4.025 2.927 4.306 . 0 0 "[ . 1 . 2]" 1 1561 2 64 ASN HB3 2 65 GLY H 4.500 2.200 4.500 3.233 2.587 3.696 . 0 0 "[ . 1 . 2]" 1 1562 1 19 SER H 1 36 LEU QD 4.510 2.200 4.510 3.820 3.637 4.173 . 0 0 "[ . 1 . 2]" 1 1563 1 45 LEU HA 1 47 ALA MB 4.510 2.200 4.510 4.360 4.170 4.522 0.012 19 0 "[ . 1 . 2]" 1 1564 1 48 GLN HA 1 48 GLN HE21 4.510 2.200 4.510 3.522 3.391 3.697 . 0 0 "[ . 1 . 2]" 1 1565 1 78 VAL HA 1 81 LEU H 4.510 2.200 4.510 3.512 3.445 3.585 . 0 0 "[ . 1 . 2]" 1 1566 2 19 SER H 2 36 LEU QD 4.510 2.200 4.510 3.812 3.629 4.172 . 0 0 "[ . 1 . 2]" 1 1567 2 45 LEU HA 2 47 ALA MB 4.510 2.200 4.510 4.360 4.170 4.523 0.013 13 0 "[ . 1 . 2]" 1 1568 2 48 GLN HA 2 48 GLN HE21 4.510 2.200 4.510 3.522 3.391 3.698 . 0 0 "[ . 1 . 2]" 1 1569 2 78 VAL HA 2 81 LEU H 4.510 2.200 4.510 3.513 3.445 3.586 . 0 0 "[ . 1 . 2]" 1 1570 1 18 HIS QB 1 36 LEU HB2 4.520 2.200 4.520 2.510 2.186 2.835 0.014 20 0 "[ . 1 . 2]" 1 1571 1 29 SER HB3 1 30 LYS H 4.520 2.200 4.520 3.701 2.520 3.883 . 0 0 "[ . 1 . 2]" 1 1572 1 37 LEU H 1 37 LEU MD1 4.520 2.200 4.520 3.835 3.749 3.887 . 0 0 "[ . 1 . 2]" 1 1573 1 46 ASP H 1 47 ALA H 4.520 2.200 4.520 2.688 2.644 2.754 . 0 0 "[ . 1 . 2]" 1 1574 1 51 VAL H 1 51 VAL HB 4.520 2.200 4.520 3.623 3.617 3.645 . 0 0 "[ . 1 . 2]" 1 1575 1 61 LEU MD1 1 69 VAL MG1 4.520 2.200 4.520 2.423 2.217 2.669 . 0 0 "[ . 1 . 2]" 1 1576 1 61 LEU MD2 1 69 VAL MG1 4.520 2.200 4.520 3.706 3.498 3.937 . 0 0 "[ . 1 . 2]" 1 1577 1 77 LEU H 1 79 ALA H 4.520 2.200 4.520 4.154 4.133 4.174 . 0 0 "[ . 1 . 2]" 1 1578 2 29 SER HB3 2 30 LYS H 4.520 2.200 4.520 3.700 2.519 3.884 . 0 0 "[ . 1 . 2]" 1 1579 2 37 LEU H 2 37 LEU MD1 4.520 2.200 4.520 3.835 3.749 3.888 . 0 0 "[ . 1 . 2]" 1 1580 2 46 ASP H 2 47 ALA H 4.520 2.200 4.520 2.688 2.643 2.754 . 0 0 "[ . 1 . 2]" 1 1581 2 51 VAL H 2 51 VAL HB 4.520 2.200 4.520 3.623 3.617 3.644 . 0 0 "[ . 1 . 2]" 1 1582 2 61 LEU MD1 2 69 VAL MG1 4.520 2.200 4.520 2.423 2.218 2.669 . 0 0 "[ . 1 . 2]" 1 1583 2 61 LEU MD2 2 69 VAL MG1 4.520 2.200 4.520 3.706 3.498 3.937 . 0 0 "[ . 1 . 2]" 1 1584 2 77 LEU H 2 79 ALA H 4.520 2.200 4.520 4.154 4.132 4.174 . 0 0 "[ . 1 . 2]" 1 1585 1 14 VAL HB 1 17 ALA MB 4.530 2.200 4.530 3.697 3.602 3.748 . 0 0 "[ . 1 . 2]" 1 1586 1 27 LYS HD2 1 70 ASP HA 4.530 2.200 4.530 2.443 2.209 2.812 . 0 0 "[ . 1 . 2]" 1 1587 1 37 LEU MD1 1 44 PHE HB2 4.530 2.200 4.530 3.881 3.651 4.097 . 0 0 "[ . 1 . 2]" 1 1588 2 14 VAL HB 2 17 ALA MB 4.530 2.200 4.530 3.697 3.603 3.749 . 0 0 "[ . 1 . 2]" 1 1589 2 27 LYS HD2 2 70 ASP HA 4.530 2.200 4.530 2.469 2.231 2.821 . 0 0 "[ . 1 . 2]" 1 1590 2 27 LYS HD3 2 70 ASP HA 4.530 2.200 4.530 4.024 3.524 4.449 . 0 0 "[ . 1 . 2]" 1 1591 2 37 LEU MD1 2 44 PHE HB2 4.530 2.200 4.530 3.880 3.651 4.096 . 0 0 "[ . 1 . 2]" 1 1592 1 69 VAL HA 1 73 GLU HB2 4.540 2.200 4.540 3.441 3.351 3.546 . 0 0 "[ . 1 . 2]" 1 1593 2 69 VAL HA 2 73 GLU HB2 4.540 2.200 4.540 3.441 3.352 3.547 . 0 0 "[ . 1 . 2]" 1 1594 1 12 ILE HA 1 15 PHE HB2 4.550 2.200 4.550 4.006 3.687 4.143 . 0 0 "[ . 1 . 2]" 1 1595 1 15 PHE HB3 1 16 HIS H 4.550 2.200 4.550 2.466 2.420 2.636 . 0 0 "[ . 1 . 2]" 1 1596 1 27 LYS HD2 1 70 ASP HB3 4.550 2.200 4.550 3.834 2.699 4.575 0.025 5 0 "[ . 1 . 2]" 1 1597 1 38 GLN HG3 1 45 LEU MD1 4.550 2.200 4.550 4.500 4.273 4.568 0.018 20 0 "[ . 1 . 2]" 1 1598 1 60 GLU HG2 1 61 LEU QD 4.550 2.200 4.550 3.275 3.122 3.324 . 0 0 "[ . 1 . 2]" 1 1599 1 73 GLU HB3 1 76 VAL MG2 4.550 2.200 4.550 3.803 3.779 3.829 . 0 0 "[ . 1 . 2]" 1 1600 1 80 ALA HA 1 83 VAL H 4.550 2.200 4.550 3.486 3.422 3.518 . 0 0 "[ . 1 . 2]" 1 1601 2 12 ILE HA 2 15 PHE HB2 4.550 2.200 4.550 4.005 3.686 4.143 . 0 0 "[ . 1 . 2]" 1 1602 2 15 PHE HB3 2 16 HIS H 4.550 2.200 4.550 2.466 2.421 2.636 . 0 0 "[ . 1 . 2]" 1 1603 2 38 GLN HG3 2 45 LEU MD1 4.550 2.200 4.550 4.500 4.273 4.567 0.017 20 0 "[ . 1 . 2]" 1 1604 2 60 GLU HG2 2 61 LEU QD 4.550 2.200 4.550 3.275 3.122 3.323 . 0 0 "[ . 1 . 2]" 1 1605 2 73 GLU HB3 2 76 VAL MG2 4.550 2.200 4.550 3.803 3.778 3.829 . 0 0 "[ . 1 . 2]" 1 1606 2 80 ALA HA 2 83 VAL H 4.550 2.200 4.550 3.486 3.422 3.520 . 0 0 "[ . 1 . 2]" 1 1607 1 43 GLY QA 1 46 ASP H 4.560 2.200 4.560 3.633 3.547 3.742 . 0 0 "[ . 1 . 2]" 1 1608 1 74 TYR HE1 1 78 VAL MG1 4.560 2.200 4.560 3.839 2.368 4.204 . 0 0 "[ . 1 . 2]" 1 1609 2 43 GLY QA 2 46 ASP H 4.560 2.200 4.560 3.633 3.548 3.741 . 0 0 "[ . 1 . 2]" 1 1610 2 74 TYR HE1 2 78 VAL MG1 4.560 2.200 4.560 3.840 2.369 4.205 . 0 0 "[ . 1 . 2]" 1 1611 1 4 LEU HA 1 8 MET H 4.570 2.200 4.570 4.312 4.276 4.380 . 0 0 "[ . 1 . 2]" 1 1612 1 18 HIS H 1 20 GLY H 4.570 2.200 4.570 4.013 3.926 4.099 . 0 0 "[ . 1 . 2]" 1 1613 1 37 LEU HA 1 40 GLU H 4.570 2.200 4.570 3.479 3.337 3.614 . 0 0 "[ . 1 . 2]" 1 1614 1 39 THR HB 1 40 GLU HG2 4.570 2.200 4.570 3.874 3.772 3.959 . 0 0 "[ . 1 . 2]" 1 1615 1 48 GLN HG3 1 53 ALA HA 4.570 2.200 4.570 4.429 4.111 4.581 0.011 8 0 "[ . 1 . 2]" 1 1616 1 50 ASP HB3 1 51 VAL MG1 4.570 2.200 4.570 4.594 4.540 4.602 0.032 19 0 "[ . 1 . 2]" 1 1617 1 61 LEU HB2 1 69 VAL MG1 4.570 2.200 4.570 3.014 2.783 3.237 . 0 0 "[ . 1 . 2]" 1 1618 2 4 LEU HA 2 8 MET H 4.570 2.200 4.570 4.312 4.276 4.380 . 0 0 "[ . 1 . 2]" 1 1619 2 18 HIS H 2 20 GLY H 4.570 2.200 4.570 4.014 3.926 4.100 . 0 0 "[ . 1 . 2]" 1 1620 2 37 LEU HA 2 40 GLU H 4.570 2.200 4.570 3.478 3.338 3.614 . 0 0 "[ . 1 . 2]" 1 1621 2 39 THR HB 2 40 GLU HG2 4.570 2.200 4.570 3.874 3.771 3.959 . 0 0 "[ . 1 . 2]" 1 1622 2 48 GLN HG3 2 53 ALA HA 4.570 2.200 4.570 4.429 4.111 4.582 0.012 10 0 "[ . 1 . 2]" 1 1623 2 50 ASP HB3 2 51 VAL MG1 4.570 2.200 4.570 4.594 4.541 4.602 0.032 18 0 "[ . 1 . 2]" 1 1624 2 61 LEU HB2 2 69 VAL MG1 4.570 2.200 4.570 3.014 2.785 3.239 . 0 0 "[ . 1 . 2]" 1 1625 1 19 SER HB2 1 20 GLY H 4.580 2.200 4.580 3.833 3.782 3.899 . 0 0 "[ . 1 . 2]" 1 1626 1 29 SER H 1 29 SER HB3 4.580 2.200 4.580 2.721 2.475 3.690 . 0 0 "[ . 1 . 2]" 1 1627 1 33 LEU HA 1 33 LEU QD 4.580 2.200 4.580 3.447 3.421 3.466 . 0 0 "[ . 1 . 2]" 1 1628 2 8 MET HB3 2 11 LEU QD 4.580 2.200 4.580 4.450 4.185 4.529 . 0 0 "[ . 1 . 2]" 1 1629 2 19 SER HB2 2 20 GLY H 4.580 2.200 4.580 3.833 3.782 3.897 . 0 0 "[ . 1 . 2]" 1 1630 2 29 SER H 2 29 SER HB3 4.580 2.200 4.580 2.722 2.479 3.692 . 0 0 "[ . 1 . 2]" 1 1631 2 33 LEU HA 2 33 LEU QD 4.580 2.200 4.580 3.447 3.421 3.466 . 0 0 "[ . 1 . 2]" 1 1632 1 3 GLU QG 1 6 THR HB 4.590 2.200 4.590 4.063 2.674 4.288 . 0 0 "[ . 1 . 2]" 1 1633 1 15 PHE HD1 1 28 LEU MD1 4.590 2.200 4.590 3.901 3.356 4.179 . 0 0 "[ . 1 . 2]" 1 1634 1 15 PHE HD1 1 28 LEU MD2 4.590 2.200 4.590 2.872 2.595 3.539 . 0 0 "[ . 1 . 2]" 1 1635 1 19 SER HB2 1 28 LEU HA 4.590 2.200 4.590 3.915 3.751 4.133 . 0 0 "[ . 1 . 2]" 1 1636 1 21 LYS HE2 1 22 GLU H 4.590 2.200 4.590 3.901 3.757 4.108 . 0 0 "[ . 1 . 2]" 1 1637 1 29 SER HB3 1 32 GLU H 4.590 2.200 4.590 3.640 2.579 4.599 0.009 20 0 "[ . 1 . 2]" 1 1638 1 51 VAL H 1 51 VAL MG1 4.590 2.200 4.590 2.178 2.173 2.195 0.027 3 0 "[ . 1 . 2]" 1 1639 2 3 GLU QG 2 6 THR HB 4.590 2.200 4.590 4.061 2.673 4.286 . 0 0 "[ . 1 . 2]" 1 1640 2 15 PHE HD1 2 28 LEU MD1 4.590 2.200 4.590 3.901 3.356 4.179 . 0 0 "[ . 1 . 2]" 1 1641 2 15 PHE HD1 2 28 LEU MD2 4.590 2.200 4.590 2.871 2.593 3.540 . 0 0 "[ . 1 . 2]" 1 1642 2 18 HIS HB3 2 36 LEU HB2 4.590 2.200 4.590 2.817 2.227 3.520 . 0 0 "[ . 1 . 2]" 1 1643 2 19 SER HB2 2 28 LEU HA 4.590 2.200 4.590 3.915 3.749 4.132 . 0 0 "[ . 1 . 2]" 1 1644 2 21 LYS HE2 2 22 GLU H 4.590 2.200 4.590 3.901 3.757 4.109 . 0 0 "[ . 1 . 2]" 1 1645 2 29 SER HB3 2 32 GLU H 4.590 2.200 4.590 3.637 2.578 4.598 0.008 20 0 "[ . 1 . 2]" 1 1646 2 51 VAL H 2 51 VAL MG1 4.590 2.200 4.590 2.178 2.173 2.195 0.027 15 0 "[ . 1 . 2]" 1 1647 1 8 MET HB3 1 11 LEU MD1 4.600 2.200 4.600 4.540 4.257 4.609 0.009 17 0 "[ . 1 . 2]" 1 1648 1 25 LYS QE 1 26 TYR HD2 4.600 2.200 4.600 3.814 3.321 4.663 0.063 5 0 "[ . 1 . 2]" 1 1649 1 43 GLY QA 1 44 PHE HA 4.600 2.200 4.600 4.027 4.011 4.039 . 0 0 "[ . 1 . 2]" 1 1650 1 48 GLN HA 1 53 ALA MB 4.600 2.200 4.600 4.108 4.047 4.213 . 0 0 "[ . 1 . 2]" 1 1651 1 69 VAL MG2 1 70 ASP H 4.600 2.200 4.600 4.079 3.959 4.195 . 0 0 "[ . 1 . 2]" 1 1652 1 83 VAL MG2 1 87 ASN HB2 4.600 2.200 4.600 4.149 3.339 4.495 . 0 0 "[ . 1 . 2]" 1 1653 2 25 LYS QE 2 26 TYR HD2 4.600 2.200 4.600 3.814 3.321 4.664 0.064 9 0 "[ . 1 . 2]" 1 1654 2 43 GLY QA 2 44 PHE HA 4.600 2.200 4.600 4.027 4.010 4.039 . 0 0 "[ . 1 . 2]" 1 1655 2 48 GLN HA 2 53 ALA MB 4.600 2.200 4.600 4.108 4.047 4.213 . 0 0 "[ . 1 . 2]" 1 1656 2 69 VAL MG2 2 70 ASP H 4.600 2.200 4.600 4.078 3.958 4.196 . 0 0 "[ . 1 . 2]" 1 1657 2 83 VAL MG2 2 87 ASN HB2 4.600 2.200 4.600 4.149 3.339 4.495 . 0 0 "[ . 1 . 2]" 1 1658 1 10 THR HA 1 14 VAL MG1 4.610 2.200 4.610 3.706 3.627 3.843 . 0 0 "[ . 1 . 2]" 1 1659 1 36 LEU QD 1 40 GLU HB3 4.610 2.200 4.610 3.478 3.343 3.638 . 0 0 "[ . 1 . 2]" 1 1660 1 48 GLN HG2 1 57 VAL MG2 4.610 2.200 4.610 4.317 3.757 4.613 0.003 16 0 "[ . 1 . 2]" 1 1661 1 61 LEU HB3 1 62 ASP H 4.610 2.200 4.610 3.817 3.753 3.851 . 0 0 "[ . 1 . 2]" 1 1662 1 82 THR MG 1 85 CYS HB3 4.610 2.200 4.610 3.548 3.425 3.709 . 0 0 "[ . 1 . 2]" 1 1663 1 83 VAL HA 1 86 ASN HB3 4.610 2.200 4.610 3.289 3.197 3.398 . 0 0 "[ . 1 . 2]" 1 1664 2 10 THR HA 2 14 VAL MG1 4.610 2.200 4.610 3.709 3.629 3.846 . 0 0 "[ . 1 . 2]" 1 1665 2 36 LEU QD 2 40 GLU HB3 4.610 2.200 4.610 3.480 3.343 3.638 . 0 0 "[ . 1 . 2]" 1 1666 2 48 GLN HG2 2 57 VAL MG2 4.610 2.200 4.610 4.317 3.757 4.612 0.002 16 0 "[ . 1 . 2]" 1 1667 2 61 LEU HB3 2 62 ASP H 4.610 2.200 4.610 3.817 3.754 3.850 . 0 0 "[ . 1 . 2]" 1 1668 2 82 THR MG 2 85 CYS HB3 4.610 2.200 4.610 3.548 3.425 3.709 . 0 0 "[ . 1 . 2]" 1 1669 2 83 VAL HA 2 86 ASN HB3 4.610 2.200 4.610 3.289 3.196 3.399 . 0 0 "[ . 1 . 2]" 1 1670 1 26 TYR HB2 1 27 LYS H 4.620 2.200 4.620 3.961 3.827 4.020 . 0 0 "[ . 1 . 2]" 1 1671 1 27 LYS HA 1 27 LYS HG2 4.620 2.200 4.620 3.659 3.610 3.703 . 0 0 "[ . 1 . 2]" 1 1672 1 30 LYS H 1 68 GLU HA 4.620 2.200 4.620 4.217 3.849 4.493 . 0 0 "[ . 1 . 2]" 1 1673 1 33 LEU QD 1 34 LYS H 4.620 2.200 4.620 2.670 2.546 2.964 . 0 0 "[ . 1 . 2]" 1 1674 1 38 GLN H 1 38 GLN HG2 4.620 2.200 4.620 3.485 3.411 3.526 . 0 0 "[ . 1 . 2]" 1 1675 1 49 LYS QG 1 50 ASP H 4.620 2.200 4.620 3.987 3.657 4.508 . 0 0 "[ . 1 . 2]" 1 1676 1 61 LEU QD 1 74 TYR HB2 4.620 2.200 4.620 4.576 4.444 4.633 0.013 19 0 "[ . 1 . 2]" 1 1677 1 85 CYS HB2 1 86 ASN H 4.620 2.200 4.620 3.632 3.502 3.709 . 0 0 "[ . 1 . 2]" 1 1678 2 26 TYR HB2 2 27 LYS H 4.620 2.200 4.620 3.962 3.828 4.021 . 0 0 "[ . 1 . 2]" 1 1679 2 27 LYS HA 2 27 LYS HG2 4.620 2.200 4.620 3.666 3.619 3.715 . 0 0 "[ . 1 . 2]" 1 1680 2 30 LYS H 2 68 GLU HA 4.620 2.200 4.620 4.216 3.846 4.493 . 0 0 "[ . 1 . 2]" 1 1681 2 33 LEU QD 2 34 LYS H 4.620 2.200 4.620 2.670 2.546 2.965 . 0 0 "[ . 1 . 2]" 1 1682 2 38 GLN H 2 38 GLN HG2 4.620 2.200 4.620 3.485 3.412 3.526 . 0 0 "[ . 1 . 2]" 1 1683 2 49 LYS QG 2 50 ASP H 4.620 2.200 4.620 3.987 3.657 4.508 . 0 0 "[ . 1 . 2]" 1 1684 2 61 LEU QD 2 74 TYR HB2 4.620 2.200 4.620 4.576 4.444 4.634 0.014 19 0 "[ . 1 . 2]" 1 1685 2 85 CYS HB2 2 86 ASN H 4.620 2.200 4.620 3.632 3.502 3.711 . 0 0 "[ . 1 . 2]" 1 1686 1 52 ASP HA 1 54 VAL H 4.630 2.200 4.630 3.812 3.600 4.117 . 0 0 "[ . 1 . 2]" 1 1687 1 57 VAL HB 1 58 MET HB3 4.630 2.200 4.630 4.113 3.889 4.632 0.002 9 0 "[ . 1 . 2]" 1 1688 1 82 THR MG 1 85 CYS HB2 4.630 2.200 4.630 4.445 4.185 4.633 0.003 12 0 "[ . 1 . 2]" 1 1689 2 52 ASP HA 2 54 VAL H 4.630 2.200 4.630 3.812 3.601 4.116 . 0 0 "[ . 1 . 2]" 1 1690 2 57 VAL HB 2 58 MET HB3 4.630 2.200 4.630 4.113 3.889 4.634 0.004 9 0 "[ . 1 . 2]" 1 1691 2 82 THR MG 2 85 CYS HB2 4.630 2.200 4.630 4.444 4.184 4.632 0.002 12 0 "[ . 1 . 2]" 1 1692 1 15 PHE HE1 1 74 TYR HB3 4.640 2.200 4.640 3.613 3.323 3.948 . 0 0 "[ . 1 . 2]" 1 1693 1 48 GLN HB2 1 53 ALA HA 4.640 2.200 4.640 4.640 4.483 4.674 0.034 18 0 "[ . 1 . 2]" 1 1694 1 61 LEU QD 1 69 VAL HB 4.640 2.200 4.640 4.265 4.055 4.500 . 0 0 "[ . 1 . 2]" 1 1695 1 64 ASN HB2 1 65 GLY H 4.640 2.200 4.640 3.107 2.528 3.935 . 0 0 "[ . 1 . 2]" 1 1696 1 69 VAL MG1 1 73 GLU H 4.640 2.200 4.640 4.021 3.892 4.110 . 0 0 "[ . 1 . 2]" 1 1697 2 15 PHE HE1 2 74 TYR HB3 4.640 2.200 4.640 3.613 3.324 3.947 . 0 0 "[ . 1 . 2]" 1 1698 2 48 GLN HB2 2 53 ALA HA 4.640 2.200 4.640 4.640 4.483 4.674 0.034 18 0 "[ . 1 . 2]" 1 1699 2 61 LEU QD 2 69 VAL HB 4.640 2.200 4.640 4.265 4.053 4.499 . 0 0 "[ . 1 . 2]" 1 1700 2 64 ASN HB2 2 65 GLY H 4.640 2.200 4.640 3.107 2.528 3.935 . 0 0 "[ . 1 . 2]" 1 1701 2 69 VAL MG1 2 73 GLU H 4.640 2.200 4.640 4.021 3.892 4.109 . 0 0 "[ . 1 . 2]" 1 1702 1 6 THR H 1 7 ALA MB 4.650 2.200 4.650 4.283 4.235 4.322 . 0 0 "[ . 1 . 2]" 1 1703 1 25 LYS HB2 1 26 TYR H 4.650 2.200 4.650 3.071 2.559 3.833 . 0 0 "[ . 1 . 2]" 1 1704 1 25 LYS HB3 1 26 TYR H 4.650 2.200 4.650 3.602 2.784 3.897 . 0 0 "[ . 1 . 2]" 1 1705 1 34 LYS HA 1 54 VAL HB 4.650 2.200 4.650 4.478 4.167 4.665 0.015 16 0 "[ . 1 . 2]" 1 1706 1 41 LEU HB3 1 44 PHE HD2 4.650 2.200 4.650 2.262 2.243 2.372 . 0 0 "[ . 1 . 2]" 1 1707 1 45 LEU MD1 1 48 GLN HB2 4.650 2.200 4.650 3.773 3.534 3.951 . 0 0 "[ . 1 . 2]" 1 1708 1 47 ALA H 1 48 GLN HE21 4.650 2.200 4.650 4.661 4.654 4.669 0.019 20 0 "[ . 1 . 2]" 1 1709 1 76 VAL MG2 1 80 ALA MB 4.650 2.200 4.650 3.901 3.824 3.967 . 0 0 "[ . 1 . 2]" 1 1710 1 77 LEU H 1 78 VAL MG2 4.650 2.200 4.650 4.215 4.188 4.236 . 0 0 "[ . 1 . 2]" 1 1711 1 90 TRP H 1 91 GLU HB2 4.650 2.200 4.650 4.650 4.545 4.681 0.031 8 0 "[ . 1 . 2]" 1 1712 2 6 THR H 2 7 ALA MB 4.650 2.200 4.650 4.283 4.237 4.322 . 0 0 "[ . 1 . 2]" 1 1713 2 25 LYS HB2 2 26 TYR H 4.650 2.200 4.650 3.070 2.560 3.832 . 0 0 "[ . 1 . 2]" 1 1714 2 25 LYS HB3 2 26 TYR H 4.650 2.200 4.650 3.602 2.783 3.896 . 0 0 "[ . 1 . 2]" 1 1715 2 34 LYS HA 2 54 VAL HB 4.650 2.200 4.650 4.477 4.167 4.664 0.014 16 0 "[ . 1 . 2]" 1 1716 2 41 LEU HB3 2 44 PHE HD2 4.650 2.200 4.650 2.261 2.240 2.371 . 0 0 "[ . 1 . 2]" 1 1717 2 45 LEU MD1 2 48 GLN HB2 4.650 2.200 4.650 3.773 3.534 3.951 . 0 0 "[ . 1 . 2]" 1 1718 2 47 ALA H 2 48 GLN HE21 4.650 2.200 4.650 4.661 4.654 4.669 0.019 20 0 "[ . 1 . 2]" 1 1719 2 76 VAL MG2 2 80 ALA MB 4.650 2.200 4.650 3.900 3.824 3.967 . 0 0 "[ . 1 . 2]" 1 1720 2 77 LEU H 2 78 VAL MG2 4.650 2.200 4.650 4.215 4.186 4.235 . 0 0 "[ . 1 . 2]" 1 1721 2 90 TRP H 2 91 GLU HB2 4.650 2.200 4.650 4.650 4.545 4.681 0.031 8 0 "[ . 1 . 2]" 1 1722 1 19 SER HB2 1 28 LEU MD1 4.660 2.200 4.660 2.551 2.202 2.959 . 0 0 "[ . 1 . 2]" 1 1723 1 19 SER HB2 1 28 LEU MD2 4.660 2.200 4.660 4.153 3.689 4.563 . 0 0 "[ . 1 . 2]" 1 1724 1 33 LEU HA 1 36 LEU QD 4.660 2.200 4.660 3.581 3.419 3.896 . 0 0 "[ . 1 . 2]" 1 1725 1 58 MET HG3 1 59 LYS HG2 4.660 2.200 4.660 2.663 2.530 2.817 . 0 0 "[ . 1 . 2]" 1 1726 2 10 THR H 2 11 LEU QD 4.660 2.200 4.660 4.523 4.506 4.537 . 0 0 "[ . 1 . 2]" 1 1727 2 19 SER HB2 2 28 LEU MD1 4.660 2.200 4.660 2.550 2.201 2.959 . 0 0 "[ . 1 . 2]" 1 1728 2 19 SER HB2 2 28 LEU MD2 4.660 2.200 4.660 4.153 3.688 4.564 . 0 0 "[ . 1 . 2]" 1 1729 2 33 LEU HA 2 36 LEU QD 4.660 2.200 4.660 3.582 3.422 3.896 . 0 0 "[ . 1 . 2]" 1 1730 2 58 MET HG3 2 59 LYS HG2 4.660 2.200 4.660 2.663 2.530 2.818 . 0 0 "[ . 1 . 2]" 1 1731 1 28 LEU QD 1 33 LEU H 4.670 2.200 4.670 3.213 2.894 3.758 . 0 0 "[ . 1 . 2]" 1 1732 1 45 LEU HA 1 47 ALA H 4.670 2.200 4.670 4.016 3.877 4.145 . 0 0 "[ . 1 . 2]" 1 1733 1 52 ASP H 1 52 ASP HB2 4.670 2.200 4.670 2.401 2.386 2.418 . 0 0 "[ . 1 . 2]" 1 1734 1 70 ASP H 1 70 ASP HB2 4.670 2.200 4.670 3.163 2.742 3.775 . 0 0 "[ . 1 . 2]" 1 1735 2 28 LEU QD 2 33 LEU H 4.670 2.200 4.670 3.214 2.895 3.759 . 0 0 "[ . 1 . 2]" 1 1736 2 45 LEU HA 2 47 ALA H 4.670 2.200 4.670 4.017 3.878 4.145 . 0 0 "[ . 1 . 2]" 1 1737 2 52 ASP H 2 52 ASP HB2 4.670 2.200 4.670 2.401 2.386 2.418 . 0 0 "[ . 1 . 2]" 1 1738 2 70 ASP H 2 70 ASP HB2 4.670 2.200 4.670 3.154 2.733 3.774 . 0 0 "[ . 1 . 2]" 1 1739 1 10 THR H 1 11 LEU MD2 4.680 2.200 4.680 4.732 4.724 4.739 0.059 15 0 "[ . 1 . 2]" 1 1740 1 12 ILE HG13 1 71 PHE HE1 4.680 2.200 4.680 4.698 4.694 4.703 0.023 12 0 "[ . 1 . 2]" 1 1741 1 12 ILE MG 1 16 HIS HB2 4.680 2.200 4.680 3.193 3.037 3.383 . 0 0 "[ . 1 . 2]" 1 1742 1 28 LEU HB3 1 69 VAL MG2 4.680 2.200 4.680 3.813 3.753 3.868 . 0 0 "[ . 1 . 2]" 1 1743 1 36 LEU QD 1 40 GLU HB2 4.680 2.200 4.680 2.424 2.185 2.611 0.015 20 0 "[ . 1 . 2]" 1 1744 1 52 ASP H 1 53 ALA H 4.680 2.200 4.680 2.496 2.469 2.561 . 0 0 "[ . 1 . 2]" 1 1745 1 61 LEU QD 1 74 TYR H 4.680 2.200 4.680 4.448 4.335 4.539 . 0 0 "[ . 1 . 2]" 1 1746 1 62 ASP QB 1 69 VAL MG2 4.680 2.200 4.680 3.352 3.072 3.581 . 0 0 "[ . 1 . 2]" 1 1747 2 12 ILE HG13 2 71 PHE HE1 4.680 2.200 4.680 4.698 4.694 4.705 0.025 12 0 "[ . 1 . 2]" 1 1748 2 12 ILE MG 2 16 HIS HB2 4.680 2.200 4.680 3.193 3.037 3.382 . 0 0 "[ . 1 . 2]" 1 1749 2 28 LEU HB3 2 69 VAL MG2 4.680 2.200 4.680 3.813 3.754 3.868 . 0 0 "[ . 1 . 2]" 1 1750 2 36 LEU QD 2 40 GLU HB2 4.680 2.200 4.680 2.424 2.185 2.611 0.015 20 0 "[ . 1 . 2]" 1 1751 2 52 ASP H 2 53 ALA H 4.680 2.200 4.680 2.496 2.469 2.561 . 0 0 "[ . 1 . 2]" 1 1752 2 61 LEU QD 2 74 TYR H 4.680 2.200 4.680 4.448 4.335 4.538 . 0 0 "[ . 1 . 2]" 1 1753 2 62 ASP QB 2 69 VAL MG2 4.680 2.200 4.680 3.352 3.072 3.582 . 0 0 "[ . 1 . 2]" 1 1754 1 28 LEU H 1 28 LEU QD 4.690 2.200 4.690 3.772 3.557 3.857 . 0 0 "[ . 1 . 2]" 1 1755 1 40 GLU HB2 1 41 LEU HG 4.690 2.200 4.690 2.990 2.849 3.141 . 0 0 "[ . 1 . 2]" 1 1756 1 45 LEU MD1 1 46 ASP H 4.690 2.200 4.690 4.349 3.635 4.490 . 0 0 "[ . 1 . 2]" 1 1757 1 58 MET HA 1 61 LEU HB3 4.690 2.200 4.690 4.143 4.030 4.228 . 0 0 "[ . 1 . 2]" 1 1758 1 60 GLU HB2 1 61 LEU QD 4.690 2.200 4.690 4.513 4.285 4.694 0.004 15 0 "[ . 1 . 2]" 1 1759 1 79 ALA H 1 81 LEU H 4.690 2.200 4.690 3.948 3.912 3.976 . 0 0 "[ . 1 . 2]" 1 1760 2 28 LEU H 2 28 LEU QD 4.690 2.200 4.690 3.773 3.558 3.857 . 0 0 "[ . 1 . 2]" 1 1761 2 40 GLU HB2 2 41 LEU HG 4.690 2.200 4.690 2.990 2.848 3.141 . 0 0 "[ . 1 . 2]" 1 1762 2 45 LEU MD1 2 46 ASP H 4.690 2.200 4.690 4.349 3.636 4.489 . 0 0 "[ . 1 . 2]" 1 1763 2 58 MET HA 2 61 LEU HB3 4.690 2.200 4.690 4.142 4.030 4.228 . 0 0 "[ . 1 . 2]" 1 1764 2 60 GLU HB2 2 61 LEU QD 4.690 2.200 4.690 4.513 4.284 4.694 0.004 15 0 "[ . 1 . 2]" 1 1765 2 79 ALA H 2 81 LEU H 4.690 2.200 4.690 3.948 3.910 3.977 . 0 0 "[ . 1 . 2]" 1 1766 1 12 ILE HG12 1 71 PHE HZ 4.700 2.200 4.700 2.222 2.201 2.243 . 0 0 "[ . 1 . 2]" 1 1767 1 14 VAL MG1 1 17 ALA MB 4.700 2.200 4.700 3.622 3.543 3.691 . 0 0 "[ . 1 . 2]" 1 1768 1 14 VAL MG1 1 40 GLU HB3 4.700 2.200 4.700 4.248 4.053 4.407 . 0 0 "[ . 1 . 2]" 1 1769 1 17 ALA H 1 36 LEU QD 4.700 2.200 4.700 4.518 4.410 4.720 0.020 6 0 "[ . 1 . 2]" 1 1770 1 17 ALA MB 1 18 HIS HA 4.700 2.200 4.700 3.723 3.582 3.768 . 0 0 "[ . 1 . 2]" 1 1771 1 19 SER HB2 1 27 LYS H 4.700 2.200 4.700 3.839 3.800 3.893 . 0 0 "[ . 1 . 2]" 1 1772 1 20 GLY HA3 1 25 LYS QD 4.700 2.200 4.700 4.110 3.819 4.448 . 0 0 "[ . 1 . 2]" 1 1773 1 45 LEU HB3 1 46 ASP HA 4.700 2.200 4.700 3.983 3.934 4.040 . 0 0 "[ . 1 . 2]" 1 1774 1 46 ASP HA 1 48 GLN H 4.700 2.200 4.700 3.963 3.746 4.209 . 0 0 "[ . 1 . 2]" 1 1775 1 58 MET HA 1 58 MET HG2 4.700 2.200 4.700 4.153 3.756 4.222 . 0 0 "[ . 1 . 2]" 1 1776 1 60 GLU H 1 61 LEU QD 4.700 2.200 4.700 4.552 4.485 4.619 . 0 0 "[ . 1 . 2]" 1 1777 1 91 GLU H 1 91 GLU HG2 4.700 2.200 4.700 3.838 2.829 4.335 . 0 0 "[ . 1 . 2]" 1 1778 2 12 ILE HG12 2 71 PHE HZ 4.700 2.200 4.700 2.222 2.200 2.243 . 10 0 "[ . 1 . 2]" 1 1779 2 14 VAL MG1 2 17 ALA MB 4.700 2.200 4.700 3.622 3.544 3.692 . 0 0 "[ . 1 . 2]" 1 1780 2 14 VAL MG1 2 40 GLU HB3 4.700 2.200 4.700 4.248 4.053 4.408 . 0 0 "[ . 1 . 2]" 1 1781 2 17 ALA H 2 36 LEU QD 4.700 2.200 4.700 4.513 4.408 4.706 0.006 6 0 "[ . 1 . 2]" 1 1782 2 17 ALA MB 2 18 HIS HA 4.700 2.200 4.700 3.723 3.577 3.768 . 0 0 "[ . 1 . 2]" 1 1783 2 19 SER HB2 2 27 LYS H 4.700 2.200 4.700 3.838 3.799 3.892 . 0 0 "[ . 1 . 2]" 1 1784 2 20 GLY HA3 2 25 LYS QD 4.700 2.200 4.700 4.110 3.818 4.447 . 0 0 "[ . 1 . 2]" 1 1785 2 45 LEU HB3 2 46 ASP HA 4.700 2.200 4.700 3.983 3.934 4.039 . 0 0 "[ . 1 . 2]" 1 1786 2 46 ASP HA 2 48 GLN H 4.700 2.200 4.700 3.963 3.746 4.208 . 0 0 "[ . 1 . 2]" 1 1787 2 58 MET HA 2 58 MET HG2 4.700 2.200 4.700 4.152 3.756 4.221 . 0 0 "[ . 1 . 2]" 1 1788 2 60 GLU H 2 61 LEU QD 4.700 2.200 4.700 4.552 4.484 4.619 . 0 0 "[ . 1 . 2]" 1 1789 2 91 GLU H 2 91 GLU HG2 4.700 2.200 4.700 3.839 2.830 4.334 . 0 0 "[ . 1 . 2]" 1 1790 1 10 THR H 1 12 ILE H 4.710 2.200 4.710 4.045 4.031 4.070 . 0 0 "[ . 1 . 2]" 1 1791 1 14 VAL HB 1 36 LEU MD1 4.710 2.200 4.710 3.216 2.249 3.636 . 0 0 "[ . 1 . 2]" 1 1792 1 14 VAL HB 1 36 LEU MD2 4.710 2.200 4.710 2.773 2.608 2.983 . 0 0 "[ . 1 . 2]" 1 1793 1 15 PHE HE1 1 19 SER HB2 4.710 2.200 4.710 3.589 3.457 3.695 . 0 0 "[ . 1 . 2]" 1 1794 1 29 SER HB2 1 30 LYS H 4.710 2.200 4.710 3.156 2.411 3.954 . 0 0 "[ . 1 . 2]" 1 1795 1 41 LEU HB2 1 44 PHE HD2 4.710 2.200 4.710 3.958 3.878 4.108 . 0 0 "[ . 1 . 2]" 1 1796 1 46 ASP HB2 1 47 ALA H 4.710 2.200 4.710 3.995 3.943 4.035 . 0 0 "[ . 1 . 2]" 1 1797 1 46 ASP HB3 1 47 ALA HA 4.710 2.200 4.710 4.142 4.112 4.170 . 0 0 "[ . 1 . 2]" 1 1798 1 55 ASP HA 1 58 MET HG3 4.710 2.200 4.710 3.091 2.706 3.475 . 0 0 "[ . 1 . 2]" 1 1799 1 60 GLU HG2 1 61 LEU HA 4.710 2.200 4.710 3.914 3.684 4.220 . 0 0 "[ . 1 . 2]" 1 1800 1 74 TYR HE1 1 77 LEU MD2 4.710 2.200 4.710 3.820 3.379 5.421 0.711 12 3 "[ *. - 1 + . 2]" 1 1801 2 10 THR H 2 12 ILE H 4.710 2.200 4.710 4.062 4.045 4.088 . 0 0 "[ . 1 . 2]" 1 1802 2 14 VAL HB 2 36 LEU MD1 4.710 2.200 4.710 3.216 2.249 3.637 . 0 0 "[ . 1 . 2]" 1 1803 2 14 VAL HB 2 36 LEU MD2 4.710 2.200 4.710 2.774 2.608 2.983 . 0 0 "[ . 1 . 2]" 1 1804 2 15 PHE HE1 2 19 SER HB2 4.710 2.200 4.710 3.589 3.460 3.695 . 0 0 "[ . 1 . 2]" 1 1805 2 29 SER HB2 2 30 LYS H 4.710 2.200 4.710 3.156 2.409 3.955 . 0 0 "[ . 1 . 2]" 1 1806 2 41 LEU HB2 2 44 PHE HD2 4.710 2.200 4.710 3.958 3.878 4.107 . 0 0 "[ . 1 . 2]" 1 1807 2 46 ASP HB2 2 47 ALA H 4.710 2.200 4.710 3.995 3.943 4.033 . 0 0 "[ . 1 . 2]" 1 1808 2 46 ASP HB3 2 47 ALA HA 4.710 2.200 4.710 4.142 4.113 4.171 . 0 0 "[ . 1 . 2]" 1 1809 2 55 ASP HA 2 58 MET HG3 4.710 2.200 4.710 3.091 2.707 3.475 . 0 0 "[ . 1 . 2]" 1 1810 2 60 GLU HG2 2 61 LEU HA 4.710 2.200 4.710 3.914 3.683 4.219 . 0 0 "[ . 1 . 2]" 1 1811 2 74 TYR HE1 2 77 LEU MD2 4.710 2.200 4.710 3.821 3.378 5.421 0.711 12 3 "[ *. - 1 + . 2]" 1 1812 1 32 GLU H 1 34 LYS H 4.720 2.200 4.720 4.103 3.967 4.159 . 0 0 "[ . 1 . 2]" 1 1813 1 70 ASP H 1 73 GLU H 4.720 2.200 4.720 3.495 3.403 3.598 . 0 0 "[ . 1 . 2]" 1 1814 2 32 GLU H 2 34 LYS H 4.720 2.200 4.720 4.105 3.967 4.162 . 0 0 "[ . 1 . 2]" 1 1815 2 70 ASP H 2 73 GLU H 4.720 2.200 4.720 3.494 3.403 3.598 . 0 0 "[ . 1 . 2]" 1 1816 1 37 LEU MD1 1 45 LEU HB2 4.730 2.200 4.730 3.970 2.539 4.457 . 0 0 "[ . 1 . 2]" 1 1817 1 41 LEU MD1 1 42 SER H 4.730 2.200 4.730 4.742 4.732 4.751 0.021 15 0 "[ . 1 . 2]" 1 1818 1 41 LEU MD1 1 44 PHE H 4.730 2.200 4.730 4.280 4.174 4.475 . 0 0 "[ . 1 . 2]" 1 1819 1 51 VAL H 1 51 VAL MG2 4.730 2.200 4.730 2.186 2.180 2.188 0.020 12 0 "[ . 1 . 2]" 1 1820 1 51 VAL MG2 1 52 ASP HB3 4.730 2.200 4.730 4.353 4.153 4.523 . 0 0 "[ . 1 . 2]" 1 1821 1 60 GLU HG3 1 61 LEU QD 4.730 2.200 4.730 3.667 2.242 4.748 0.018 17 0 "[ . 1 . 2]" 1 1822 1 61 LEU HB3 1 69 VAL MG1 4.730 2.200 4.730 2.369 2.199 2.589 0.001 10 0 "[ . 1 . 2]" 1 1823 1 87 ASN HB3 1 91 GLU HB3 4.730 2.200 4.730 4.277 4.063 4.789 0.059 3 0 "[ . 1 . 2]" 1 1824 1 90 TRP HE1 1 91 GLU HA 4.730 2.200 4.730 4.651 3.874 4.760 0.030 16 0 "[ . 1 . 2]" 1 1825 2 27 LYS QE 2 70 ASP HB2 4.730 2.200 4.730 3.666 2.964 4.511 . 0 0 "[ . 1 . 2]" 1 1826 2 37 LEU MD1 2 45 LEU HB2 4.730 2.200 4.730 3.970 2.539 4.458 . 0 0 "[ . 1 . 2]" 1 1827 2 41 LEU MD1 2 42 SER H 4.730 2.200 4.730 4.742 4.733 4.750 0.020 15 0 "[ . 1 . 2]" 1 1828 2 41 LEU MD1 2 44 PHE H 4.730 2.200 4.730 4.280 4.176 4.476 . 0 0 "[ . 1 . 2]" 1 1829 2 51 VAL H 2 51 VAL MG2 4.730 2.200 4.730 2.186 2.179 2.189 0.021 12 0 "[ . 1 . 2]" 1 1830 2 51 VAL MG2 2 52 ASP HB3 4.730 2.200 4.730 4.353 4.154 4.523 . 0 0 "[ . 1 . 2]" 1 1831 2 60 GLU HG3 2 61 LEU QD 4.730 2.200 4.730 3.667 2.240 4.748 0.018 17 0 "[ . 1 . 2]" 1 1832 2 61 LEU HB3 2 69 VAL MG1 4.730 2.200 4.730 2.369 2.199 2.589 0.001 10 0 "[ . 1 . 2]" 1 1833 2 87 ASN HB3 2 91 GLU HB3 4.730 2.200 4.730 4.278 4.063 4.790 0.060 3 0 "[ . 1 . 2]" 1 1834 2 90 TRP HE1 2 91 GLU HA 4.730 2.200 4.730 4.651 3.873 4.760 0.030 12 0 "[ . 1 . 2]" 1 1835 1 16 HIS HA 1 19 SER HB2 4.740 2.200 4.740 4.333 4.047 4.599 . 0 0 "[ . 1 . 2]" 1 1836 1 45 LEU MD1 1 46 ASP HA 4.740 2.200 4.740 4.581 3.399 4.792 0.052 4 0 "[ . 1 . 2]" 1 1837 1 74 TYR HB2 1 77 LEU MD2 4.740 2.200 4.740 4.731 4.641 4.747 0.007 13 0 "[ . 1 . 2]" 1 1838 1 79 ALA MB 1 82 THR HB 4.740 2.200 4.740 3.997 3.964 4.025 . 0 0 "[ . 1 . 2]" 1 1839 1 84 ALA MB 1 87 ASN HB2 4.740 2.200 4.740 3.924 3.669 4.706 . 0 0 "[ . 1 . 2]" 1 1840 2 16 HIS HA 2 19 SER HB2 4.740 2.200 4.740 4.333 4.047 4.598 . 0 0 "[ . 1 . 2]" 1 1841 2 45 LEU MD1 2 46 ASP HA 4.740 2.200 4.740 4.581 3.399 4.792 0.052 8 0 "[ . 1 . 2]" 1 1842 2 74 TYR HB2 2 77 LEU MD2 4.740 2.200 4.740 4.731 4.642 4.746 0.006 11 0 "[ . 1 . 2]" 1 1843 2 79 ALA MB 2 82 THR HB 4.740 2.200 4.740 3.997 3.965 4.026 . 0 0 "[ . 1 . 2]" 1 1844 2 84 ALA MB 2 87 ASN HB2 4.740 2.200 4.740 3.924 3.668 4.706 . 0 0 "[ . 1 . 2]" 1 1845 1 17 ALA H 1 19 SER H 4.750 2.200 4.750 4.487 4.296 4.573 . 0 0 "[ . 1 . 2]" 1 1846 1 36 LEU QD 1 40 GLU HG3 4.750 2.200 4.750 2.183 2.173 2.199 0.027 4 0 "[ . 1 . 2]" 1 1847 1 41 LEU HB3 1 44 PHE H 4.750 2.200 4.750 3.135 3.034 3.288 . 0 0 "[ . 1 . 2]" 1 1848 1 45 LEU MD2 1 48 GLN HG2 4.750 2.200 4.750 4.553 4.151 4.768 0.018 17 0 "[ . 1 . 2]" 1 1849 1 51 VAL MG2 1 53 ALA H 4.750 2.200 4.750 4.072 4.006 4.198 . 0 0 "[ . 1 . 2]" 1 1850 2 17 ALA H 2 19 SER H 4.750 2.200 4.750 4.488 4.297 4.572 . 0 0 "[ . 1 . 2]" 1 1851 2 36 LEU QD 2 40 GLU HG3 4.750 2.200 4.750 2.183 2.174 2.199 0.026 20 0 "[ . 1 . 2]" 1 1852 2 41 LEU HB3 2 44 PHE H 4.750 2.200 4.750 3.135 3.034 3.287 . 0 0 "[ . 1 . 2]" 1 1853 2 45 LEU MD2 2 48 GLN HG2 4.750 2.200 4.750 4.553 4.152 4.768 0.018 17 0 "[ . 1 . 2]" 1 1854 2 51 VAL MG2 2 53 ALA H 4.750 2.200 4.750 4.072 4.006 4.197 . 0 0 "[ . 1 . 2]" 1 1855 1 9 GLU HB3 1 13 ASN HD21 4.760 2.200 4.760 3.939 3.766 4.173 . 0 0 "[ . 1 . 2]" 1 1856 1 48 GLN HG3 1 57 VAL MG2 4.760 2.200 4.760 3.435 2.811 3.823 . 0 0 "[ . 1 . 2]" 1 1857 1 53 ALA HA 1 57 VAL MG2 4.760 2.200 4.760 3.867 3.654 4.010 . 0 0 "[ . 1 . 2]" 1 1858 1 87 ASN HA 1 91 GLU H 4.760 2.200 4.760 3.325 2.997 3.664 . 0 0 "[ . 1 . 2]" 1 1859 1 90 TRP HE1 1 91 GLU HG2 4.760 2.200 4.760 4.618 4.247 4.790 0.030 5 0 "[ . 1 . 2]" 1 1860 2 9 GLU HB3 2 13 ASN HD21 4.760 2.200 4.760 3.940 3.767 4.173 . 0 0 "[ . 1 . 2]" 1 1861 2 48 GLN HG3 2 57 VAL MG2 4.760 2.200 4.760 3.435 2.811 3.824 . 0 0 "[ . 1 . 2]" 1 1862 2 53 ALA HA 2 57 VAL MG2 4.760 2.200 4.760 3.867 3.655 4.010 . 0 0 "[ . 1 . 2]" 1 1863 2 87 ASN HA 2 91 GLU H 4.760 2.200 4.760 3.325 2.997 3.664 . 0 0 "[ . 1 . 2]" 1 1864 2 90 TRP HE1 2 91 GLU HG2 4.760 2.200 4.760 4.618 4.248 4.791 0.031 5 0 "[ . 1 . 2]" 1 1865 1 6 THR HB 1 7 ALA MB 4.770 2.200 4.770 3.881 3.847 3.988 . 0 0 "[ . 1 . 2]" 1 1866 1 14 VAL MG2 1 78 VAL MG1 4.770 2.200 4.770 3.871 3.507 4.100 . 0 0 "[ . 1 . 2]" 1 1867 1 37 LEU HB2 1 45 LEU HB3 4.770 2.200 4.770 4.647 3.993 4.776 0.006 13 0 "[ . 1 . 2]" 1 1868 1 38 GLN H 1 45 LEU HG 4.770 2.200 4.770 4.398 4.174 4.606 . 0 0 "[ . 1 . 2]" 1 1869 1 61 LEU HA 1 76 VAL MG2 4.770 2.200 4.770 4.289 3.955 4.544 . 0 0 "[ . 1 . 2]" 1 1870 1 69 VAL MG1 1 77 LEU MD2 4.770 2.200 4.770 3.864 3.643 4.009 . 0 0 "[ . 1 . 2]" 1 1871 2 6 THR HB 2 7 ALA MB 4.770 2.200 4.770 3.881 3.848 3.988 . 0 0 "[ . 1 . 2]" 1 1872 2 14 VAL MG2 2 78 VAL MG1 4.770 2.200 4.770 3.871 3.508 4.100 . 0 0 "[ . 1 . 2]" 1 1873 2 37 LEU HB2 2 45 LEU HB3 4.770 2.200 4.770 4.647 3.995 4.776 0.006 13 0 "[ . 1 . 2]" 1 1874 2 38 GLN H 2 45 LEU HG 4.770 2.200 4.770 4.399 4.172 4.607 . 0 0 "[ . 1 . 2]" 1 1875 2 61 LEU HA 2 76 VAL MG2 4.770 2.200 4.770 4.289 3.956 4.544 . 0 0 "[ . 1 . 2]" 1 1876 2 69 VAL MG1 2 77 LEU MD2 4.770 2.200 4.770 3.864 3.642 4.009 . 0 0 "[ . 1 . 2]" 1 1877 1 9 GLU HG2 1 12 ILE MD 4.780 2.200 4.780 3.366 3.124 3.997 . 0 0 "[ . 1 . 2]" 1 1878 1 45 LEU MD2 1 54 VAL HA 4.780 2.200 4.780 4.645 3.934 4.793 0.013 15 0 "[ . 1 . 2]" 1 1879 1 50 ASP HA 1 53 ALA MB 4.780 2.200 4.780 4.338 4.231 4.458 . 0 0 "[ . 1 . 2]" 1 1880 1 51 VAL HB 1 52 ASP H 4.780 2.200 4.780 4.014 3.950 4.047 . 0 0 "[ . 1 . 2]" 1 1881 1 53 ALA HA 1 55 ASP H 4.780 2.200 4.780 4.369 4.302 4.424 . 0 0 "[ . 1 . 2]" 1 1882 1 69 VAL H 1 70 ASP H 4.780 2.200 4.780 4.456 4.389 4.544 . 0 0 "[ . 1 . 2]" 1 1883 1 83 VAL H 1 85 CYS H 4.780 2.200 4.780 3.941 3.900 3.996 . 0 0 "[ . 1 . 2]" 1 1884 1 86 ASN H 1 88 PHE H 4.780 2.200 4.780 4.118 3.989 4.276 . 0 0 "[ . 1 . 2]" 1 1885 2 9 GLU HG2 2 12 ILE MD 4.780 2.200 4.780 3.367 3.127 3.997 . 0 0 "[ . 1 . 2]" 1 1886 2 45 LEU MD2 2 54 VAL HA 4.780 2.200 4.780 4.645 3.934 4.793 0.013 15 0 "[ . 1 . 2]" 1 1887 2 50 ASP HA 2 53 ALA MB 4.780 2.200 4.780 4.339 4.232 4.458 . 0 0 "[ . 1 . 2]" 1 1888 2 51 VAL HB 2 52 ASP H 4.780 2.200 4.780 4.013 3.948 4.047 . 0 0 "[ . 1 . 2]" 1 1889 2 53 ALA HA 2 55 ASP H 4.780 2.200 4.780 4.369 4.301 4.424 . 0 0 "[ . 1 . 2]" 1 1890 2 69 VAL H 2 70 ASP H 4.780 2.200 4.780 4.456 4.390 4.545 . 0 0 "[ . 1 . 2]" 1 1891 2 83 VAL H 2 85 CYS H 4.780 2.200 4.780 3.941 3.899 3.996 . 0 0 "[ . 1 . 2]" 1 1892 2 86 ASN H 2 88 PHE H 4.780 2.200 4.780 4.119 3.992 4.276 . 0 0 "[ . 1 . 2]" 1 1893 1 6 THR MG 1 7 ALA MB 4.790 2.200 4.790 4.293 4.267 4.333 . 0 0 "[ . 1 . 2]" 1 1894 1 13 ASN H 1 13 ASN HD22 4.790 2.200 4.790 4.182 4.170 4.188 . 0 0 "[ . 1 . 2]" 1 1895 1 21 LYS HB2 1 21 LYS HE2 4.790 2.200 4.790 3.560 3.514 3.638 . 0 0 "[ . 1 . 2]" 1 1896 1 52 ASP HB2 1 53 ALA H 4.790 2.200 4.790 3.449 2.856 3.938 . 0 0 "[ . 1 . 2]" 1 1897 1 76 VAL HA 1 79 ALA H 4.790 2.200 4.790 3.299 3.240 3.372 . 0 0 "[ . 1 . 2]" 1 1898 2 6 THR MG 2 7 ALA MB 4.790 2.200 4.790 4.293 4.265 4.333 . 0 0 "[ . 1 . 2]" 1 1899 2 13 ASN H 2 13 ASN HD22 4.790 2.200 4.790 4.182 4.171 4.189 . 0 0 "[ . 1 . 2]" 1 1900 2 21 LYS HB2 2 21 LYS HE2 4.790 2.200 4.790 3.560 3.514 3.638 . 0 0 "[ . 1 . 2]" 1 1901 2 52 ASP HB2 2 53 ALA H 4.790 2.200 4.790 3.449 2.854 3.937 . 0 0 "[ . 1 . 2]" 1 1902 2 76 VAL HA 2 79 ALA H 4.790 2.200 4.790 3.299 3.238 3.371 . 0 0 "[ . 1 . 2]" 1 1903 1 10 THR HA 1 14 VAL H 4.800 2.200 4.800 3.970 3.918 4.009 . 0 0 "[ . 1 . 2]" 1 1904 1 43 GLY H 1 44 PHE H 4.800 2.200 4.800 2.907 2.880 2.941 . 0 0 "[ . 1 . 2]" 1 1905 1 76 VAL HA 1 80 ALA MB 4.800 2.200 4.800 4.065 3.971 4.123 . 0 0 "[ . 1 . 2]" 1 1906 2 10 THR HA 2 14 VAL H 4.800 2.200 4.800 3.973 3.920 4.013 . 0 0 "[ . 1 . 2]" 1 1907 2 43 GLY H 2 44 PHE H 4.800 2.200 4.800 2.907 2.879 2.942 . 0 0 "[ . 1 . 2]" 1 1908 2 76 VAL HA 2 80 ALA MB 4.800 2.200 4.800 4.065 3.971 4.123 . 0 0 "[ . 1 . 2]" 1 1909 1 27 LYS HA 1 28 LEU HB2 4.810 2.200 4.810 4.050 3.893 4.152 . 0 0 "[ . 1 . 2]" 1 1910 1 75 VAL H 1 77 LEU H 4.810 2.200 4.810 3.921 3.892 3.948 . 0 0 "[ . 1 . 2]" 1 1911 2 27 LYS HA 2 28 LEU HB2 4.810 2.200 4.810 4.044 3.890 4.144 . 0 0 "[ . 1 . 2]" 1 1912 2 27 LYS QD 2 68 GLU QG 4.810 2.200 4.810 3.901 3.105 4.361 . 0 0 "[ . 1 . 2]" 1 1913 2 75 VAL H 2 77 LEU H 4.810 2.200 4.810 3.921 3.892 3.949 . 0 0 "[ . 1 . 2]" 1 1914 1 15 PHE HA 1 18 HIS H 4.820 2.200 4.820 3.639 3.548 3.758 . 0 0 "[ . 1 . 2]" 1 1915 1 27 LYS HB2 1 68 GLU QG 4.820 2.200 4.820 4.787 4.378 4.877 0.057 15 0 "[ . 1 . 2]" 1 1916 1 27 LYS HE3 1 70 ASP HB2 4.820 2.200 4.820 3.787 2.977 4.670 . 0 0 "[ . 1 . 2]" 1 1917 1 33 LEU HB3 1 36 LEU HB3 4.820 2.200 4.820 4.410 4.177 4.671 . 0 0 "[ . 1 . 2]" 1 1918 1 41 LEU HA 1 42 SER QB 4.820 2.200 4.820 4.068 3.920 4.297 . 0 0 "[ . 1 . 2]" 1 1919 1 45 LEU HG 1 57 VAL MG2 4.820 2.200 4.820 4.826 4.789 4.835 0.015 17 0 "[ . 1 . 2]" 1 1920 1 71 PHE HA 1 71 PHE HE1 4.820 2.200 4.820 4.539 4.514 4.557 . 0 0 "[ . 1 . 2]" 1 1921 2 15 PHE HA 2 18 HIS H 4.820 2.200 4.820 3.637 3.548 3.757 . 0 0 "[ . 1 . 2]" 1 1922 2 27 LYS HB2 2 68 GLU QG 4.820 2.200 4.820 4.786 4.381 4.873 0.053 15 0 "[ . 1 . 2]" 1 1923 2 27 LYS QE 2 68 GLU QG 4.820 2.200 4.820 2.761 2.138 3.278 0.062 19 0 "[ . 1 . 2]" 1 1924 2 33 LEU HB3 2 36 LEU HB3 4.820 2.200 4.820 4.410 4.178 4.671 . 0 0 "[ . 1 . 2]" 1 1925 2 41 LEU HA 2 42 SER QB 4.820 2.200 4.820 4.068 3.920 4.297 . 0 0 "[ . 1 . 2]" 1 1926 2 45 LEU HG 2 57 VAL MG2 4.820 2.200 4.820 4.826 4.790 4.835 0.015 17 0 "[ . 1 . 2]" 1 1927 2 71 PHE HA 2 71 PHE HE1 4.820 2.200 4.820 4.539 4.513 4.557 . 0 0 "[ . 1 . 2]" 1 1928 1 16 HIS H 1 17 ALA MB 4.830 2.200 4.830 4.264 4.193 4.306 . 0 0 "[ . 1 . 2]" 1 1929 1 44 PHE HD1 1 81 LEU MD1 4.830 2.200 4.830 4.807 4.588 4.847 0.017 20 0 "[ . 1 . 2]" 1 1930 1 82 THR MG 1 86 ASN H 4.830 2.200 4.830 4.002 3.867 4.074 . 0 0 "[ . 1 . 2]" 1 1931 2 16 HIS H 2 17 ALA MB 4.830 2.200 4.830 4.264 4.193 4.307 . 0 0 "[ . 1 . 2]" 1 1932 2 44 PHE HD1 2 81 LEU MD1 4.830 2.200 4.830 4.806 4.586 4.846 0.016 20 0 "[ . 1 . 2]" 1 1933 2 82 THR MG 2 86 ASN H 4.830 2.200 4.830 4.002 3.868 4.075 . 0 0 "[ . 1 . 2]" 1 1934 1 12 ILE MG 1 16 HIS H 4.840 2.200 4.840 3.891 3.840 3.946 . 0 0 "[ . 1 . 2]" 1 1935 1 13 ASN HB2 1 14 VAL MG2 4.840 2.200 4.840 4.380 4.299 4.455 . 0 0 "[ . 1 . 2]" 1 1936 1 34 LYS HD2 1 45 LEU MD1 4.840 2.200 4.840 3.377 3.078 3.695 . 0 0 "[ . 1 . 2]" 1 1937 1 52 ASP HB3 1 56 LYS QD 4.840 2.200 4.840 4.573 4.080 4.844 0.004 4 0 "[ . 1 . 2]" 1 1938 1 53 ALA MB 1 54 VAL HB 4.840 2.200 4.840 4.130 4.062 4.193 . 0 0 "[ . 1 . 2]" 1 1939 2 12 ILE MG 2 16 HIS H 4.840 2.200 4.840 3.890 3.839 3.945 . 0 0 "[ . 1 . 2]" 1 1940 2 13 ASN HB2 2 14 VAL MG2 4.840 2.200 4.840 4.380 4.299 4.454 . 0 0 "[ . 1 . 2]" 1 1941 2 34 LYS HD2 2 45 LEU MD1 4.840 2.200 4.840 3.377 3.078 3.695 . 0 0 "[ . 1 . 2]" 1 1942 2 52 ASP HB3 2 56 LYS QD 4.840 2.200 4.840 4.572 4.080 4.844 0.004 4 0 "[ . 1 . 2]" 1 1943 2 53 ALA MB 2 54 VAL HB 4.840 2.200 4.840 4.130 4.062 4.192 . 0 0 "[ . 1 . 2]" 1 1944 1 15 PHE HD1 1 36 LEU QD 4.850 2.200 4.850 3.321 3.074 4.020 . 0 0 "[ . 1 . 2]" 1 1945 2 15 PHE HD1 2 36 LEU QD 4.850 2.200 4.850 3.322 3.074 4.018 . 0 0 "[ . 1 . 2]" 1 1946 1 7 ALA MB 1 9 GLU H 4.860 2.200 4.860 4.413 4.396 4.442 . 0 0 "[ . 1 . 2]" 1 1947 1 75 VAL MG2 1 76 VAL H 4.860 2.200 4.860 4.168 4.156 4.175 . 0 0 "[ . 1 . 2]" 1 1948 1 84 ALA MB 1 88 PHE H 4.860 2.200 4.860 4.459 4.411 4.502 . 0 0 "[ . 1 . 2]" 1 1949 2 7 ALA MB 2 9 GLU H 4.860 2.200 4.860 4.415 4.399 4.445 . 0 0 "[ . 1 . 2]" 1 1950 2 75 VAL MG2 2 76 VAL H 4.860 2.200 4.860 4.168 4.155 4.174 . 0 0 "[ . 1 . 2]" 1 1951 2 84 ALA MB 2 88 PHE H 4.860 2.200 4.860 4.459 4.412 4.501 . 0 0 "[ . 1 . 2]" 1 1952 1 90 TRP HB3 1 91 GLU HA 4.870 2.200 4.870 4.365 4.248 4.428 . 0 0 "[ . 1 . 2]" 1 1953 2 90 TRP HB3 2 91 GLU HA 4.870 2.200 4.870 4.365 4.246 4.429 . 0 0 "[ . 1 . 2]" 1 1954 1 3 GLU QG 1 6 THR MG 4.880 2.200 4.880 4.463 3.427 4.651 . 0 0 "[ . 1 . 2]" 1 1955 1 4 LEU H 1 4 LEU QD 4.880 2.200 4.880 3.764 3.752 3.784 . 0 0 "[ . 1 . 2]" 1 1956 1 34 LYS HA 1 34 LYS QE 4.880 2.200 4.880 4.119 3.975 4.261 . 0 0 "[ . 1 . 2]" 1 1957 2 3 GLU QG 2 6 THR MG 4.880 2.200 4.880 4.463 3.426 4.652 . 0 0 "[ . 1 . 2]" 1 1958 2 4 LEU H 2 4 LEU QD 4.880 2.200 4.880 3.764 3.752 3.784 . 0 0 "[ . 1 . 2]" 1 1959 2 34 LYS HA 2 34 LYS QE 4.880 2.200 4.880 4.119 3.975 4.261 . 0 0 "[ . 1 . 2]" 1 1960 1 9 GLU HB3 1 13 ASN HD22 4.890 2.200 4.890 2.896 2.763 3.060 . 0 0 "[ . 1 . 2]" 1 1961 1 21 LYS HB3 1 22 GLU HB2 4.890 2.200 4.890 4.024 3.822 4.290 . 0 0 "[ . 1 . 2]" 1 1962 1 69 VAL MG1 1 77 LEU HB2 4.890 2.200 4.890 4.542 4.411 4.653 . 0 0 "[ . 1 . 2]" 1 1963 2 9 GLU HB3 2 13 ASN HD22 4.890 2.200 4.890 2.894 2.762 3.058 . 0 0 "[ . 1 . 2]" 1 1964 2 21 LYS HB3 2 22 GLU HB2 4.890 2.200 4.890 4.024 3.822 4.290 . 0 0 "[ . 1 . 2]" 1 1965 2 69 VAL MG1 2 77 LEU HB2 4.890 2.200 4.890 4.542 4.412 4.653 . 0 0 "[ . 1 . 2]" 1 1966 1 36 LEU QD 1 41 LEU HG 4.900 2.200 4.900 4.091 3.774 4.261 . 0 0 "[ . 1 . 2]" 1 1967 1 54 VAL MG1 1 56 LYS H 4.900 2.200 4.900 3.957 3.899 3.999 . 0 0 "[ . 1 . 2]" 1 1968 1 58 MET HB2 1 61 LEU QD 4.900 2.200 4.900 3.988 3.681 4.676 . 0 0 "[ . 1 . 2]" 1 1969 2 36 LEU QD 2 41 LEU HG 4.900 2.200 4.900 4.093 3.773 4.263 . 0 0 "[ . 1 . 2]" 1 1970 2 54 VAL MG1 2 56 LYS H 4.900 2.200 4.900 3.957 3.900 4.000 . 0 0 "[ . 1 . 2]" 1 1971 2 58 MET HB2 2 61 LEU QD 4.900 2.200 4.900 3.988 3.681 4.676 . 0 0 "[ . 1 . 2]" 1 1972 1 27 LYS HD2 1 68 GLU QG 4.910 2.200 4.910 4.254 3.244 4.912 0.002 6 0 "[ . 1 . 2]" 1 1973 2 31 LYS HG3 2 32 GLU QG 4.910 2.200 4.910 2.181 2.172 2.211 0.028 16 0 "[ . 1 . 2]" 1 1974 1 17 ALA MB 1 18 HIS QB 4.920 2.200 4.920 3.719 3.079 3.825 . 0 0 "[ . 1 . 2]" 1 1975 1 27 LYS HE3 1 68 GLU QG 4.920 2.200 4.920 3.440 2.316 4.030 . 0 0 "[ . 1 . 2]" 1 1976 1 50 ASP HA 1 51 VAL HA 4.920 2.200 4.920 4.351 4.334 4.363 . 0 0 "[ . 1 . 2]" 1 1977 1 53 ALA MB 1 55 ASP H 4.920 2.200 4.920 4.539 4.497 4.577 . 0 0 "[ . 1 . 2]" 1 1978 1 71 PHE HA 1 75 VAL MG2 4.920 2.200 4.920 4.938 4.931 4.943 0.023 20 0 "[ . 1 . 2]" 1 1979 2 50 ASP HA 2 51 VAL HA 4.920 2.200 4.920 4.351 4.335 4.363 . 0 0 "[ . 1 . 2]" 1 1980 2 53 ALA MB 2 55 ASP H 4.920 2.200 4.920 4.539 4.496 4.577 . 0 0 "[ . 1 . 2]" 1 1981 2 71 PHE HA 2 75 VAL MG2 4.920 2.200 4.920 4.938 4.931 4.942 0.022 20 0 "[ . 1 . 2]" 1 1982 1 39 THR HB 1 40 GLU HA 4.930 2.200 4.930 4.552 4.492 4.613 . 0 0 "[ . 1 . 2]" 1 1983 1 71 PHE HD1 1 72 GLN HA 4.930 2.200 4.930 4.184 4.150 4.219 . 0 0 "[ . 1 . 2]" 1 1984 1 84 ALA MB 1 87 ASN HB3 4.930 2.200 4.930 4.693 3.755 4.943 0.013 4 0 "[ . 1 . 2]" 1 1985 2 39 THR HB 2 40 GLU HA 4.930 2.200 4.930 4.553 4.493 4.614 . 0 0 "[ . 1 . 2]" 1 1986 2 71 PHE HD1 2 72 GLN HA 4.930 2.200 4.930 4.184 4.150 4.220 . 0 0 "[ . 1 . 2]" 1 1987 2 84 ALA MB 2 87 ASN HB3 4.930 2.200 4.930 4.693 3.755 4.942 0.012 4 0 "[ . 1 . 2]" 1 1988 1 17 ALA MB 1 19 SER H 4.940 2.200 4.940 4.612 4.448 4.688 . 0 0 "[ . 1 . 2]" 1 1989 1 28 LEU QD 1 74 TYR HA 4.940 2.200 4.940 4.382 4.121 4.544 . 0 0 "[ . 1 . 2]" 1 1990 1 29 SER HA 1 30 LYS HA 4.940 2.200 4.940 4.305 4.273 4.327 . 0 0 "[ . 1 . 2]" 1 1991 1 61 LEU HA 1 69 VAL MG2 4.940 2.200 4.940 4.934 4.619 4.958 0.018 16 0 "[ . 1 . 2]" 1 1992 1 72 GLN HB3 1 73 GLU HA 4.940 2.200 4.940 4.422 4.401 4.444 . 0 0 "[ . 1 . 2]" 1 1993 2 17 ALA MB 2 19 SER H 4.940 2.200 4.940 4.613 4.449 4.688 . 0 0 "[ . 1 . 2]" 1 1994 2 28 LEU QD 2 74 TYR HA 4.940 2.200 4.940 4.382 4.121 4.547 . 0 0 "[ . 1 . 2]" 1 1995 2 29 SER HA 2 30 LYS HA 4.940 2.200 4.940 4.304 4.272 4.326 . 0 0 "[ . 1 . 2]" 1 1996 2 61 LEU HA 2 69 VAL MG2 4.940 2.200 4.940 4.934 4.620 4.959 0.019 16 0 "[ . 1 . 2]" 1 1997 2 72 GLN HB3 2 73 GLU HA 4.940 2.200 4.940 4.423 4.401 4.444 . 0 0 "[ . 1 . 2]" 1 1998 1 12 ILE MG 1 16 HIS HB3 4.950 2.200 4.950 3.785 3.681 4.025 . 0 0 "[ . 1 . 2]" 1 1999 1 27 LYS H 1 28 LEU H 4.950 2.200 4.950 4.322 4.195 4.398 . 0 0 "[ . 1 . 2]" 1 2000 1 29 SER H 1 33 LEU H 4.950 2.200 4.950 3.777 3.625 4.038 . 0 0 "[ . 1 . 2]" 1 2001 1 49 LYS HA 1 50 ASP HA 4.950 2.200 4.950 4.672 4.376 4.750 . 0 0 "[ . 1 . 2]" 1 2002 1 59 LYS HA 1 59 LYS QE 4.950 2.200 4.950 4.160 4.001 4.703 . 0 0 "[ . 1 . 2]" 1 2003 2 12 ILE MG 2 16 HIS HB3 4.950 2.200 4.950 3.785 3.681 4.023 . 0 0 "[ . 1 . 2]" 1 2004 2 27 LYS H 2 28 LEU H 4.950 2.200 4.950 4.324 4.197 4.400 . 0 0 "[ . 1 . 2]" 1 2005 2 29 SER H 2 33 LEU H 4.950 2.200 4.950 3.776 3.623 4.038 . 0 0 "[ . 1 . 2]" 1 2006 2 49 LYS HA 2 50 ASP HA 4.950 2.200 4.950 4.672 4.378 4.749 . 0 0 "[ . 1 . 2]" 1 2007 2 59 LYS HA 2 59 LYS QE 4.950 2.200 4.950 4.160 4.002 4.702 . 0 0 "[ . 1 . 2]" 1 2008 1 10 THR HB 1 11 LEU HA 4.960 2.200 4.960 4.186 4.137 4.206 . 0 0 "[ . 1 . 2]" 1 2009 1 11 LEU HA 1 15 PHE H 4.960 2.200 4.960 3.964 3.918 4.119 . 0 0 "[ . 1 . 2]" 1 2010 1 21 LYS HE2 1 22 GLU HA 4.960 2.200 4.960 4.981 4.961 4.994 0.034 3 0 "[ . 1 . 2]" 1 2011 1 38 GLN HB3 1 39 THR HA 4.960 2.200 4.960 4.358 4.320 4.414 . 0 0 "[ . 1 . 2]" 1 2012 1 58 MET HA 1 69 VAL MG1 4.960 2.200 4.960 4.246 3.959 4.535 . 0 0 "[ . 1 . 2]" 1 2013 1 63 GLU HB3 1 64 ASN HA 4.960 2.200 4.960 4.080 4.034 4.112 . 0 0 "[ . 1 . 2]" 1 2014 1 78 VAL HB 1 79 ALA HA 4.960 2.200 4.960 4.422 4.405 4.453 . 0 0 "[ . 1 . 2]" 1 2015 1 80 ALA MB 1 81 LEU MD2 4.960 2.200 4.960 4.717 4.555 4.920 . 0 0 "[ . 1 . 2]" 1 2016 2 10 THR HB 2 11 LEU HA 4.960 2.200 4.960 4.184 4.136 4.205 . 0 0 "[ . 1 . 2]" 1 2017 2 11 LEU HA 2 15 PHE H 4.960 2.200 4.960 3.966 3.920 4.118 . 0 0 "[ . 1 . 2]" 1 2018 2 21 LYS HE2 2 22 GLU HA 4.960 2.200 4.960 4.981 4.961 4.993 0.033 1 0 "[ . 1 . 2]" 1 2019 2 38 GLN HB3 2 39 THR HA 4.960 2.200 4.960 4.358 4.318 4.416 . 0 0 "[ . 1 . 2]" 1 2020 2 58 MET HA 2 69 VAL MG1 4.960 2.200 4.960 4.246 3.959 4.536 . 0 0 "[ . 1 . 2]" 1 2021 2 63 GLU HB3 2 64 ASN HA 4.960 2.200 4.960 4.080 4.034 4.112 . 0 0 "[ . 1 . 2]" 1 2022 2 78 VAL HB 2 79 ALA HA 4.960 2.200 4.960 4.422 4.406 4.454 . 0 0 "[ . 1 . 2]" 1 2023 2 80 ALA MB 2 81 LEU MD2 4.960 2.200 4.960 4.726 4.564 4.928 . 0 0 "[ . 1 . 2]" 1 2024 1 26 TYR HA 1 27 LYS HA 4.970 2.200 4.970 4.386 4.349 4.419 . 0 0 "[ . 1 . 2]" 1 2025 1 61 LEU QD 1 69 VAL HA 4.970 2.200 4.970 4.625 4.366 4.969 . 0 0 "[ . 1 . 2]" 1 2026 1 63 GLU HG2 1 64 ASN HB2 4.970 2.200 4.970 5.034 4.977 5.072 0.102 9 0 "[ . 1 . 2]" 1 2027 2 26 TYR HA 2 27 LYS HA 4.970 2.200 4.970 4.382 4.344 4.415 . 0 0 "[ . 1 . 2]" 1 2028 2 61 LEU QD 2 69 VAL HA 4.970 2.200 4.970 4.625 4.366 4.970 . 0 0 "[ . 1 . 2]" 1 2029 2 63 GLU HG2 2 64 ASN HB2 4.970 2.200 4.970 5.034 4.977 5.072 0.102 9 0 "[ . 1 . 2]" 1 2030 1 69 VAL MG1 1 71 PHE HA 4.980 2.200 4.980 4.698 4.520 4.865 . 0 0 "[ . 1 . 2]" 1 2031 2 69 VAL MG1 2 71 PHE HA 4.980 2.200 4.980 4.697 4.521 4.865 . 0 0 "[ . 1 . 2]" 1 2032 1 25 LYS HB2 1 26 TYR HD2 4.990 2.200 4.990 2.738 2.257 3.025 . 0 0 "[ . 1 . 2]" 1 2033 1 25 LYS HB3 1 26 TYR HD2 4.990 2.200 4.990 3.927 2.681 4.495 . 0 0 "[ . 1 . 2]" 1 2034 1 28 LEU QD 1 32 GLU HA 4.990 2.200 4.990 4.177 3.903 4.999 0.009 6 0 "[ . 1 . 2]" 1 2035 1 66 ASP HA 1 67 GLY HA3 4.990 2.200 4.990 4.486 4.448 4.566 . 0 0 "[ . 1 . 2]" 1 2036 2 25 LYS HB2 2 26 TYR HD2 4.990 2.200 4.990 2.739 2.256 3.026 . 0 0 "[ . 1 . 2]" 1 2037 2 25 LYS HB3 2 26 TYR HD2 4.990 2.200 4.990 3.928 2.682 4.497 . 0 0 "[ . 1 . 2]" 1 2038 2 28 LEU QD 2 32 GLU HA 4.990 2.200 4.990 4.177 3.903 4.999 0.009 6 0 "[ . 1 . 2]" 1 2039 2 66 ASP HA 2 67 GLY HA3 4.990 2.200 4.990 4.486 4.449 4.567 . 0 0 "[ . 1 . 2]" 1 2040 1 28 LEU HA 1 33 LEU H 5.000 2.200 5.000 4.958 4.818 5.066 0.066 14 0 "[ . 1 . 2]" 1 2041 1 49 LYS HB3 1 50 ASP H 5.000 2.200 5.000 3.302 2.673 4.466 . 0 0 "[ . 1 . 2]" 1 2042 1 83 VAL MG2 1 87 ASN H 5.000 2.200 5.000 3.922 3.855 3.956 . 0 0 "[ . 1 . 2]" 1 2043 2 28 LEU HA 2 33 LEU H 5.000 2.200 5.000 4.957 4.815 5.064 0.064 14 0 "[ . 1 . 2]" 1 2044 2 49 LYS HB3 2 50 ASP H 5.000 2.200 5.000 3.302 2.672 4.466 . 0 0 "[ . 1 . 2]" 1 2045 2 83 VAL MG2 2 87 ASN H 5.000 2.200 5.000 3.923 3.855 3.957 . 0 0 "[ . 1 . 2]" 1 2046 1 18 HIS QB 1 36 LEU HA 5.010 2.200 5.010 4.005 3.536 4.425 . 0 0 "[ . 1 . 2]" 1 2047 1 28 LEU HA 1 29 SER HA 5.010 2.200 5.010 4.421 4.386 4.443 . 0 0 "[ . 1 . 2]" 1 2048 1 31 LYS HG3 1 32 GLU HG3 5.010 2.200 5.010 2.234 2.204 2.266 . 0 0 "[ . 1 . 2]" 1 2049 1 39 THR H 1 40 GLU HG2 5.010 2.200 5.010 4.619 4.512 4.718 . 0 0 "[ . 1 . 2]" 1 2050 1 69 VAL MG1 1 73 GLU HA 5.010 2.200 5.010 4.308 4.227 4.357 . 0 0 "[ . 1 . 2]" 1 2051 1 72 GLN HA 1 76 VAL MG1 5.010 2.200 5.010 4.038 3.997 4.067 . 0 0 "[ . 1 . 2]" 1 2052 2 28 LEU HA 2 29 SER HA 5.010 2.200 5.010 4.421 4.386 4.444 . 0 0 "[ . 1 . 2]" 1 2053 2 39 THR H 2 40 GLU HG2 5.010 2.200 5.010 4.619 4.512 4.718 . 0 0 "[ . 1 . 2]" 1 2054 2 69 VAL MG1 2 73 GLU HA 5.010 2.200 5.010 4.308 4.227 4.356 . 0 0 "[ . 1 . 2]" 1 2055 2 72 GLN HA 2 76 VAL MG1 5.010 2.200 5.010 4.037 3.997 4.067 . 0 0 "[ . 1 . 2]" 1 2056 1 16 HIS HA 1 21 LYS H 5.020 2.200 5.020 5.053 5.039 5.088 0.068 6 0 "[ . 1 . 2]" 1 2057 1 17 ALA MB 1 36 LEU MD1 5.020 2.200 5.020 3.814 3.322 4.121 . 0 0 "[ . 1 . 2]" 1 2058 1 17 ALA MB 1 36 LEU MD2 5.020 2.200 5.020 4.593 4.458 4.782 . 0 0 "[ . 1 . 2]" 1 2059 1 37 LEU HA 1 41 LEU HB3 5.020 2.200 5.020 4.973 4.878 5.024 0.004 9 0 "[ . 1 . 2]" 1 2060 2 16 HIS HA 2 21 LYS H 5.020 2.200 5.020 5.053 5.038 5.088 0.068 6 0 "[ . 1 . 2]" 1 2061 2 17 ALA MB 2 18 HIS HB3 5.020 2.200 5.020 4.723 3.770 4.986 . 0 0 "[ . 1 . 2]" 1 2062 2 17 ALA MB 2 36 LEU MD1 5.020 2.200 5.020 3.807 3.319 4.112 . 0 0 "[ . 1 . 2]" 1 2063 2 17 ALA MB 2 36 LEU MD2 5.020 2.200 5.020 4.593 4.459 4.782 . 0 0 "[ . 1 . 2]" 1 2064 2 37 LEU HA 2 41 LEU HB3 5.020 2.200 5.020 4.973 4.879 5.026 0.006 9 0 "[ . 1 . 2]" 1 2065 1 18 HIS HA 1 28 LEU QD 5.030 2.200 5.030 4.274 4.144 4.589 . 0 0 "[ . 1 . 2]" 1 2066 1 58 MET H 1 60 GLU H 5.030 2.200 5.030 4.568 4.431 4.672 . 0 0 "[ . 1 . 2]" 1 2067 1 65 GLY HA2 1 66 ASP HA 5.030 2.200 5.030 4.712 4.637 4.880 . 0 0 "[ . 1 . 2]" 1 2068 1 68 GLU H 1 69 VAL MG2 5.030 2.200 5.030 4.819 4.563 5.032 0.002 17 0 "[ . 1 . 2]" 1 2069 1 84 ALA MB 1 87 ASN H 5.030 2.200 5.030 4.591 4.471 4.686 . 0 0 "[ . 1 . 2]" 1 2070 1 88 PHE HA 1 88 PHE HE1 5.030 2.200 5.030 4.668 4.424 4.786 . 0 0 "[ . 1 . 2]" 1 2071 2 18 HIS HA 2 28 LEU QD 5.030 2.200 5.030 4.270 4.131 4.587 . 0 0 "[ . 1 . 2]" 1 2072 2 58 MET H 2 60 GLU H 5.030 2.200 5.030 4.568 4.431 4.672 . 0 0 "[ . 1 . 2]" 1 2073 2 65 GLY HA2 2 66 ASP HA 5.030 2.200 5.030 4.711 4.636 4.881 . 0 0 "[ . 1 . 2]" 1 2074 2 68 GLU H 2 69 VAL MG2 5.030 2.200 5.030 4.819 4.563 5.033 0.003 17 0 "[ . 1 . 2]" 1 2075 2 84 ALA MB 2 87 ASN H 5.030 2.200 5.030 4.591 4.470 4.686 . 0 0 "[ . 1 . 2]" 1 2076 2 88 PHE HA 2 88 PHE HE1 5.030 2.200 5.030 4.668 4.423 4.786 . 0 0 "[ . 1 . 2]" 1 2077 1 12 ILE MG 1 13 ASN HB2 5.040 2.200 5.040 5.047 5.042 5.051 0.011 20 0 "[ . 1 . 2]" 1 2078 1 35 GLU HB3 1 36 LEU HA 5.040 2.200 5.040 4.321 4.254 4.385 . 0 0 "[ . 1 . 2]" 1 2079 2 12 ILE MG 2 13 ASN HB2 5.040 2.200 5.040 5.047 5.042 5.051 0.011 20 0 "[ . 1 . 2]" 1 2080 2 35 GLU HB3 2 36 LEU HA 5.040 2.200 5.040 4.321 4.253 4.385 . 0 0 "[ . 1 . 2]" 1 2081 1 22 GLU HB3 1 23 GLY QA 5.050 2.200 5.050 4.009 3.720 4.407 . 0 0 "[ . 1 . 2]" 1 2082 1 62 ASP HA 1 63 GLU HA 5.050 2.200 5.050 4.549 4.504 4.602 . 0 0 "[ . 1 . 2]" 1 2083 1 68 GLU H 1 69 VAL H 5.050 2.200 5.050 4.467 4.442 4.494 . 0 0 "[ . 1 . 2]" 1 2084 2 22 GLU HB3 2 23 GLY QA 5.050 2.200 5.050 4.009 3.720 4.407 . 0 0 "[ . 1 . 2]" 1 2085 2 62 ASP HA 2 63 GLU HA 5.050 2.200 5.050 4.549 4.504 4.601 . 0 0 "[ . 1 . 2]" 1 2086 2 68 GLU H 2 69 VAL H 5.050 2.200 5.050 4.467 4.443 4.495 . 0 0 "[ . 1 . 2]" 1 2087 1 38 GLN HG3 1 45 LEU HB3 5.060 2.200 5.060 4.402 4.007 4.655 . 0 0 "[ . 1 . 2]" 1 2088 1 66 ASP QB 1 68 GLU H 5.060 2.200 5.060 3.399 3.053 3.640 . 0 0 "[ . 1 . 2]" 1 2089 2 38 GLN HG3 2 45 LEU HB3 5.060 2.200 5.060 4.402 4.007 4.654 . 0 0 "[ . 1 . 2]" 1 2090 2 66 ASP QB 2 68 GLU H 5.060 2.200 5.060 3.399 3.053 3.641 . 0 0 "[ . 1 . 2]" 1 2091 1 20 GLY H 1 22 GLU H 5.070 2.200 5.070 4.274 4.215 4.396 . 0 0 "[ . 1 . 2]" 1 2092 1 31 LYS H 1 33 LEU QD 5.070 2.200 5.070 4.436 4.399 4.494 . 0 0 "[ . 1 . 2]" 1 2093 1 31 LYS HG3 1 32 GLU HB2 5.070 2.200 5.070 3.980 3.919 4.078 . 0 0 "[ . 1 . 2]" 1 2094 1 34 LYS HG3 1 38 GLN HG3 5.070 2.200 5.070 3.326 3.200 3.496 . 0 0 "[ . 1 . 2]" 1 2095 1 69 VAL MG1 1 75 VAL H 5.070 2.200 5.070 4.971 4.872 5.051 . 0 0 "[ . 1 . 2]" 1 2096 1 70 ASP H 1 74 TYR H 5.070 2.200 5.070 4.146 4.066 4.227 . 0 0 "[ . 1 . 2]" 1 2097 2 20 GLY H 2 22 GLU H 5.070 2.200 5.070 4.273 4.217 4.393 . 0 0 "[ . 1 . 2]" 1 2098 2 31 LYS H 2 33 LEU QD 5.070 2.200 5.070 4.436 4.399 4.493 . 0 0 "[ . 1 . 2]" 1 2099 2 31 LYS HG3 2 32 GLU HB2 5.070 2.200 5.070 3.993 3.934 4.086 . 0 0 "[ . 1 . 2]" 1 2100 2 34 LYS HG3 2 38 GLN HG3 5.070 2.200 5.070 3.326 3.201 3.496 . 0 0 "[ . 1 . 2]" 1 2101 2 69 VAL MG1 2 75 VAL H 5.070 2.200 5.070 4.971 4.871 5.050 . 0 0 "[ . 1 . 2]" 1 2102 2 70 ASP H 2 74 TYR H 5.070 2.200 5.070 4.145 4.066 4.229 . 0 0 "[ . 1 . 2]" 1 2103 1 13 ASN HA 1 17 ALA H 5.080 2.200 5.080 3.953 3.897 4.068 . 0 0 "[ . 1 . 2]" 1 2104 1 29 SER HB2 1 68 GLU QG 5.080 2.200 5.080 4.004 3.399 5.070 . 0 0 "[ . 1 . 2]" 1 2105 1 41 LEU MD2 1 44 PHE H 5.080 2.200 5.080 4.463 4.372 4.596 . 0 0 "[ . 1 . 2]" 1 2106 2 13 ASN HA 2 17 ALA H 5.080 2.200 5.080 3.952 3.898 4.067 . 0 0 "[ . 1 . 2]" 1 2107 2 29 SER HB2 2 68 GLU QG 5.080 2.200 5.080 4.002 3.399 5.062 . 0 0 "[ . 1 . 2]" 1 2108 2 41 LEU MD2 2 44 PHE H 5.080 2.200 5.080 4.463 4.372 4.594 . 0 0 "[ . 1 . 2]" 1 2109 1 17 ALA HA 1 18 HIS HA 5.090 2.200 5.090 4.563 4.497 4.652 . 0 0 "[ . 1 . 2]" 1 2110 1 56 LYS H 1 58 MET H 5.090 2.200 5.090 4.342 4.201 4.492 . 0 0 "[ . 1 . 2]" 1 2111 1 72 GLN H 1 75 VAL HB 5.090 2.200 5.090 4.508 4.484 4.537 . 0 0 "[ . 1 . 2]" 1 2112 1 81 LEU H 1 83 VAL H 5.090 2.200 5.090 4.457 4.437 4.484 . 0 0 "[ . 1 . 2]" 1 2113 2 17 ALA HA 2 18 HIS HA 5.090 2.200 5.090 4.564 4.496 4.648 . 0 0 "[ . 1 . 2]" 1 2114 2 56 LYS H 2 58 MET H 5.090 2.200 5.090 4.342 4.199 4.494 . 0 0 "[ . 1 . 2]" 1 2115 2 72 GLN H 2 75 VAL HB 5.090 2.200 5.090 4.508 4.483 4.538 . 0 0 "[ . 1 . 2]" 1 2116 2 81 LEU H 2 83 VAL H 5.090 2.200 5.090 4.456 4.438 4.484 . 0 0 "[ . 1 . 2]" 1 2117 1 41 LEU MD1 1 44 PHE HA 5.100 2.200 5.100 4.991 4.810 5.109 0.009 17 0 "[ . 1 . 2]" 1 2118 1 53 ALA MB 1 57 VAL H 5.100 2.200 5.100 4.388 4.306 4.465 . 0 0 "[ . 1 . 2]" 1 2119 1 56 LYS HB2 1 57 VAL HA 5.100 2.200 5.100 4.298 4.178 4.392 . 0 0 "[ . 1 . 2]" 1 2120 2 41 LEU MD1 2 44 PHE HA 5.100 2.200 5.100 4.991 4.810 5.108 0.008 17 0 "[ . 1 . 2]" 1 2121 2 53 ALA MB 2 57 VAL H 5.100 2.200 5.100 4.388 4.305 4.463 . 0 0 "[ . 1 . 2]" 1 2122 2 56 LYS HB2 2 57 VAL HA 5.100 2.200 5.100 4.298 4.178 4.392 . 0 0 "[ . 1 . 2]" 1 2123 1 7 ALA MB 1 8 MET HG2 5.110 2.200 5.110 4.163 4.088 4.349 . 0 0 "[ . 1 . 2]" 1 2124 1 63 GLU HB3 1 65 GLY H 5.110 2.200 5.110 4.828 4.661 5.019 . 0 0 "[ . 1 . 2]" 1 2125 2 7 ALA MB 2 8 MET HG2 5.110 2.200 5.110 4.161 4.086 4.350 . 0 0 "[ . 1 . 2]" 1 2126 2 18 HIS HB3 2 36 LEU HA 5.110 2.200 5.110 4.590 3.624 5.143 0.033 6 0 "[ . 1 . 2]" 1 2127 2 63 GLU HB3 2 65 GLY H 5.110 2.200 5.110 4.828 4.661 5.020 . 0 0 "[ . 1 . 2]" 1 2128 1 39 THR MG 1 40 GLU HG2 5.120 2.200 5.120 4.610 4.536 4.708 . 0 0 "[ . 1 . 2]" 1 2129 1 51 VAL HA 1 53 ALA MB 5.120 2.200 5.120 3.954 3.765 4.171 . 0 0 "[ . 1 . 2]" 1 2130 1 77 LEU HA 1 79 ALA H 5.120 2.200 5.120 4.545 4.517 4.597 . 0 0 "[ . 1 . 2]" 1 2131 2 39 THR MG 2 40 GLU HG2 5.120 2.200 5.120 4.610 4.535 4.708 . 0 0 "[ . 1 . 2]" 1 2132 2 51 VAL HA 2 53 ALA MB 5.120 2.200 5.120 3.954 3.764 4.171 . 0 0 "[ . 1 . 2]" 1 2133 2 77 LEU HA 2 79 ALA H 5.120 2.200 5.120 4.545 4.517 4.597 . 0 0 "[ . 1 . 2]" 1 2134 1 31 LYS H 1 32 GLU HB2 5.130 2.200 5.130 4.906 4.789 5.006 . 0 0 "[ . 1 . 2]" 1 2135 2 31 LYS H 2 32 GLU HB2 5.130 2.200 5.130 4.909 4.791 5.007 . 0 0 "[ . 1 . 2]" 1 2136 1 40 GLU HA 1 41 LEU HA 5.140 2.200 5.140 4.560 4.547 4.578 . 0 0 "[ . 1 . 2]" 1 2137 1 46 ASP HB3 1 47 ALA MB 5.140 2.200 5.140 4.247 4.159 4.355 . 0 0 "[ . 1 . 2]" 1 2138 2 40 GLU HA 2 41 LEU HA 5.140 2.200 5.140 4.561 4.548 4.580 . 0 0 "[ . 1 . 2]" 1 2139 2 46 ASP HB3 2 47 ALA MB 5.140 2.200 5.140 4.247 4.158 4.354 . 0 0 "[ . 1 . 2]" 1 2140 1 21 LYS HA 1 22 GLU HA 5.150 2.200 5.150 4.521 4.493 4.537 . 0 0 "[ . 1 . 2]" 1 2141 1 27 LYS HA 1 70 ASP HB2 5.150 2.200 5.150 4.552 4.238 4.806 . 0 0 "[ . 1 . 2]" 1 2142 1 74 TYR H 1 76 VAL H 5.150 2.200 5.150 4.244 4.234 4.257 . 0 0 "[ . 1 . 2]" 1 2143 2 21 LYS HA 2 22 GLU HA 5.150 2.200 5.150 4.521 4.494 4.538 . 0 0 "[ . 1 . 2]" 1 2144 2 27 LYS HA 2 70 ASP HB2 5.150 2.200 5.150 4.590 4.245 4.870 . 0 0 "[ . 1 . 2]" 1 2145 2 74 TYR H 2 76 VAL H 5.150 2.200 5.150 4.245 4.234 4.259 . 0 0 "[ . 1 . 2]" 1 2146 1 14 VAL HA 1 36 LEU QD 5.160 2.200 5.160 3.848 3.554 4.042 . 0 0 "[ . 1 . 2]" 1 2147 1 15 PHE HE1 1 19 SER HB3 5.160 2.200 5.160 5.017 4.783 5.164 0.004 6 0 "[ . 1 . 2]" 1 2148 1 28 LEU HB2 1 69 VAL MG2 5.160 2.200 5.160 5.206 5.181 5.236 0.076 20 0 "[ . 1 . 2]" 1 2149 1 34 LYS HG2 1 54 VAL HB 5.160 2.200 5.160 4.814 4.651 5.161 0.001 16 0 "[ . 1 . 2]" 1 2150 1 56 LYS H 1 57 VAL MG2 5.160 2.200 5.160 4.220 4.160 4.268 . 0 0 "[ . 1 . 2]" 1 2151 2 14 VAL HA 2 36 LEU QD 5.160 2.200 5.160 3.846 3.554 4.041 . 0 0 "[ . 1 . 2]" 1 2152 2 15 PHE HE1 2 19 SER HB3 5.160 2.200 5.160 5.017 4.785 5.164 0.004 6 0 "[ . 1 . 2]" 1 2153 2 28 LEU HB2 2 69 VAL MG2 5.160 2.200 5.160 5.206 5.180 5.236 0.076 20 0 "[ . 1 . 2]" 1 2154 2 34 LYS HG2 2 54 VAL HB 5.160 2.200 5.160 4.814 4.650 5.161 0.001 16 0 "[ . 1 . 2]" 1 2155 2 56 LYS H 2 57 VAL MG2 5.160 2.200 5.160 4.220 4.160 4.269 . 0 0 "[ . 1 . 2]" 1 2156 1 10 THR HA 1 13 ASN HD22 5.170 2.200 5.170 3.938 3.731 4.092 . 0 0 "[ . 1 . 2]" 1 2157 1 21 LYS H 1 21 LYS HE2 5.170 2.200 5.170 4.847 4.773 4.982 . 0 0 "[ . 1 . 2]" 1 2158 1 77 LEU MD1 1 78 VAL HA 5.170 2.200 5.170 4.389 4.156 4.667 . 0 0 "[ . 1 . 2]" 1 2159 2 10 THR HA 2 13 ASN HD22 5.170 2.200 5.170 3.932 3.723 4.087 . 0 0 "[ . 1 . 2]" 1 2160 2 21 LYS H 2 21 LYS HE2 5.170 2.200 5.170 4.847 4.774 4.982 . 0 0 "[ . 1 . 2]" 1 2161 2 77 LEU MD1 2 78 VAL HA 5.170 2.200 5.170 4.390 4.157 4.667 . 0 0 "[ . 1 . 2]" 1 2162 1 12 ILE HA 1 15 PHE H 5.180 2.200 5.180 3.706 3.525 3.764 . 0 0 "[ . 1 . 2]" 1 2163 1 41 LEU HA 1 44 PHE HB2 5.180 2.200 5.180 4.764 4.572 5.031 . 0 0 "[ . 1 . 2]" 1 2164 1 44 PHE HB3 1 45 LEU HB2 5.180 2.200 5.180 4.947 4.482 5.089 . 0 0 "[ . 1 . 2]" 1 2165 1 52 ASP HA 1 53 ALA MB 5.180 2.200 5.180 4.805 4.711 4.942 . 0 0 "[ . 1 . 2]" 1 2166 2 12 ILE HA 2 15 PHE H 5.180 2.200 5.180 3.706 3.525 3.765 . 0 0 "[ . 1 . 2]" 1 2167 2 41 LEU HA 2 44 PHE HB2 5.180 2.200 5.180 4.764 4.572 5.030 . 0 0 "[ . 1 . 2]" 1 2168 2 44 PHE HB3 2 45 LEU HB2 5.180 2.200 5.180 4.947 4.482 5.088 . 0 0 "[ . 1 . 2]" 1 2169 2 52 ASP HA 2 53 ALA MB 5.180 2.200 5.180 4.805 4.711 4.942 . 0 0 "[ . 1 . 2]" 1 2170 1 15 PHE HA 1 74 TYR HE1 5.200 2.200 5.200 5.115 4.559 5.219 0.019 5 0 "[ . 1 . 2]" 1 2171 1 37 LEU MD1 1 78 VAL HA 5.200 2.200 5.200 5.227 5.215 5.242 0.042 14 0 "[ . 1 . 2]" 1 2172 1 49 LYS HA 1 53 ALA MB 5.200 2.200 5.200 5.172 4.886 5.232 0.032 17 0 "[ . 1 . 2]" 1 2173 1 67 GLY HA3 1 68 GLU HA 5.200 2.200 5.200 4.552 4.519 4.594 . 0 0 "[ . 1 . 2]" 1 2174 2 15 PHE HA 2 74 TYR HE1 5.200 2.200 5.200 5.115 4.558 5.219 0.019 5 0 "[ . 1 . 2]" 1 2175 2 37 LEU MD1 2 78 VAL HA 5.200 2.200 5.200 5.227 5.216 5.242 0.042 14 0 "[ . 1 . 2]" 1 2176 2 49 LYS HA 2 53 ALA MB 5.200 2.200 5.200 5.172 4.886 5.232 0.032 17 0 "[ . 1 . 2]" 1 2177 2 67 GLY HA3 2 68 GLU HA 5.200 2.200 5.200 4.553 4.519 4.593 . 0 0 "[ . 1 . 2]" 1 2178 1 26 TYR HB2 1 26 TYR HE2 5.210 2.200 5.210 4.693 4.678 4.754 . 0 0 "[ . 1 . 2]" 1 2179 2 26 TYR HB2 2 26 TYR HE2 5.210 2.200 5.210 4.693 4.676 4.754 . 0 0 "[ . 1 . 2]" 1 2180 2 32 GLU QG 2 33 LEU H 5.210 2.200 5.210 4.032 3.941 4.090 . 0 0 "[ . 1 . 2]" 1 2181 1 6 THR MG 1 9 GLU HG3 5.220 2.200 5.220 5.008 4.608 5.221 0.001 19 0 "[ . 1 . 2]" 1 2182 1 12 ILE H 1 14 VAL H 5.220 2.200 5.220 4.315 4.255 4.347 . 0 0 "[ . 1 . 2]" 1 2183 1 15 PHE HA 1 28 LEU QD 5.220 2.200 5.220 3.704 3.528 4.096 . 0 0 "[ . 1 . 2]" 1 2184 1 15 PHE HE1 1 27 LYS HA 5.220 2.200 5.220 4.788 4.405 5.100 . 0 0 "[ . 1 . 2]" 1 2185 2 6 THR MG 2 9 GLU HG3 5.220 2.200 5.220 5.007 4.609 5.219 . 0 0 "[ . 1 . 2]" 1 2186 2 12 ILE H 2 14 VAL H 5.220 2.200 5.220 4.315 4.253 4.346 . 0 0 "[ . 1 . 2]" 1 2187 2 15 PHE HA 2 28 LEU QD 5.220 2.200 5.220 3.704 3.524 4.096 . 0 0 "[ . 1 . 2]" 1 2188 2 15 PHE HE1 2 27 LYS HA 5.220 2.200 5.220 4.782 4.398 5.096 . 0 0 "[ . 1 . 2]" 1 2189 1 15 PHE HB2 1 75 VAL MG2 5.230 2.200 5.230 5.027 4.819 5.117 . 0 0 "[ . 1 . 2]" 1 2190 1 18 HIS HA 1 21 LYS HD2 5.230 2.200 5.230 5.262 5.253 5.273 0.043 20 0 "[ . 1 . 2]" 1 2191 1 34 LYS HD3 1 38 GLN HG3 5.230 2.200 5.230 5.237 5.222 5.247 0.017 1 0 "[ . 1 . 2]" 1 2192 2 11 LEU QD 2 14 VAL MG2 5.230 2.200 5.230 3.107 3.042 3.218 . 0 0 "[ . 1 . 2]" 1 2193 2 15 PHE HB2 2 75 VAL MG2 5.230 2.200 5.230 5.027 4.819 5.116 . 0 0 "[ . 1 . 2]" 1 2194 2 18 HIS HA 2 21 LYS HD2 5.230 2.200 5.230 5.263 5.255 5.273 0.043 20 0 "[ . 1 . 2]" 1 2195 2 34 LYS HD3 2 38 GLN HG3 5.230 2.200 5.230 5.237 5.221 5.248 0.018 1 0 "[ . 1 . 2]" 1 2196 1 38 GLN HA 1 39 THR HA 5.240 2.200 5.240 4.721 4.703 4.742 . 0 0 "[ . 1 . 2]" 1 2197 1 39 THR HA 1 40 GLU HA 5.240 2.200 5.240 4.598 4.570 4.620 . 0 0 "[ . 1 . 2]" 1 2198 1 69 VAL MG1 1 77 LEU HB3 5.240 2.200 5.240 4.856 4.691 4.955 . 0 0 "[ . 1 . 2]" 1 2199 1 72 GLN HG3 1 75 VAL HB 5.240 2.200 5.240 5.074 5.034 5.104 . 0 0 "[ . 1 . 2]" 1 2200 2 38 GLN HA 2 39 THR HA 5.240 2.200 5.240 4.720 4.701 4.742 . 0 0 "[ . 1 . 2]" 1 2201 2 39 THR HA 2 40 GLU HA 5.240 2.200 5.240 4.598 4.570 4.620 . 0 0 "[ . 1 . 2]" 1 2202 2 69 VAL MG1 2 77 LEU HB3 5.240 2.200 5.240 4.856 4.691 4.955 . 0 0 "[ . 1 . 2]" 1 2203 2 72 GLN HG3 2 75 VAL HB 5.240 2.200 5.240 5.074 5.033 5.106 . 0 0 "[ . 1 . 2]" 1 2204 1 6 THR MG 1 9 GLU H 5.260 2.200 5.260 4.659 4.512 4.745 . 0 0 "[ . 1 . 2]" 1 2205 1 15 PHE HZ 1 28 LEU H 5.260 2.200 5.260 3.840 3.397 4.355 . 0 0 "[ . 1 . 2]" 1 2206 1 37 LEU HG 1 45 LEU MD1 5.260 2.200 5.260 3.991 3.870 4.432 . 0 0 "[ . 1 . 2]" 1 2207 1 41 LEU HA 1 42 SER HA 5.260 2.200 5.260 4.382 4.370 4.391 . 0 0 "[ . 1 . 2]" 1 2208 1 51 VAL HA 1 52 ASP HA 5.260 2.200 5.260 4.775 4.682 4.888 . 0 0 "[ . 1 . 2]" 1 2209 1 66 ASP H 1 67 GLY HA2 5.260 2.200 5.260 4.890 4.808 5.054 . 0 0 "[ . 1 . 2]" 1 2210 2 6 THR MG 2 9 GLU H 5.260 2.200 5.260 4.657 4.510 4.743 . 0 0 "[ . 1 . 2]" 1 2211 2 15 PHE HZ 2 28 LEU H 5.260 2.200 5.260 3.840 3.396 4.357 . 0 0 "[ . 1 . 2]" 1 2212 2 37 LEU HG 2 45 LEU MD1 5.260 2.200 5.260 3.991 3.869 4.432 . 0 0 "[ . 1 . 2]" 1 2213 2 41 LEU HA 2 42 SER HA 5.260 2.200 5.260 4.382 4.371 4.391 . 0 0 "[ . 1 . 2]" 1 2214 2 51 VAL HA 2 52 ASP HA 5.260 2.200 5.260 4.775 4.682 4.888 . 0 0 "[ . 1 . 2]" 1 2215 2 66 ASP H 2 67 GLY HA2 5.260 2.200 5.260 4.890 4.808 5.054 . 0 0 "[ . 1 . 2]" 1 2216 1 11 LEU MD1 1 14 VAL MG2 5.270 2.200 5.270 4.823 4.771 4.879 . 0 0 "[ . 1 . 2]" 1 2217 1 14 VAL MG1 1 40 GLU HA 5.270 2.200 5.270 5.144 4.948 5.284 0.014 9 0 "[ . 1 . 2]" 1 2218 1 15 PHE HE1 1 28 LEU HA 5.270 2.200 5.270 4.681 4.549 4.963 . 0 0 "[ . 1 . 2]" 1 2219 1 18 HIS HA 1 21 LYS HA 5.270 2.200 5.270 5.120 4.983 5.211 . 0 0 "[ . 1 . 2]" 1 2220 1 21 LYS HB3 1 22 GLU HA 5.270 2.200 5.270 4.704 4.668 4.747 . 0 0 "[ . 1 . 2]" 1 2221 1 63 GLU H 1 64 ASN HB2 5.270 2.200 5.270 4.307 4.231 4.390 . 0 0 "[ . 1 . 2]" 1 2222 1 63 GLU HG3 1 64 ASN HA 5.270 2.200 5.270 5.028 4.818 5.313 0.043 20 0 "[ . 1 . 2]" 1 2223 1 73 GLU HB2 1 74 TYR HB3 5.270 2.200 5.270 4.847 4.772 4.922 . 0 0 "[ . 1 . 2]" 1 2224 2 14 VAL MG1 2 40 GLU HA 5.270 2.200 5.270 5.144 4.948 5.284 0.014 9 0 "[ . 1 . 2]" 1 2225 2 15 PHE HE1 2 28 LEU HA 5.270 2.200 5.270 4.681 4.550 4.964 . 0 0 "[ . 1 . 2]" 1 2226 2 18 HIS HA 2 21 LYS HA 5.270 2.200 5.270 5.124 4.985 5.214 . 0 0 "[ . 1 . 2]" 1 2227 2 21 LYS HB3 2 22 GLU HA 5.270 2.200 5.270 4.704 4.667 4.747 . 0 0 "[ . 1 . 2]" 1 2228 2 63 GLU H 2 64 ASN HB2 5.270 2.200 5.270 4.307 4.232 4.389 . 0 0 "[ . 1 . 2]" 1 2229 2 63 GLU HG3 2 64 ASN HA 5.270 2.200 5.270 5.028 4.818 5.313 0.043 20 0 "[ . 1 . 2]" 1 2230 2 73 GLU HB2 2 74 TYR HB3 5.270 2.200 5.270 4.848 4.774 4.923 . 0 0 "[ . 1 . 2]" 1 2231 1 15 PHE HB3 1 16 HIS HB3 5.280 2.200 5.280 4.857 4.798 4.998 . 0 0 "[ . 1 . 2]" 1 2232 1 22 GLU HA 1 23 GLY HA2 5.280 2.200 5.280 4.426 4.362 4.477 . 0 0 "[ . 1 . 2]" 1 2233 1 22 GLU HA 1 23 GLY HA3 5.280 2.200 5.280 4.493 4.446 4.539 . 0 0 "[ . 1 . 2]" 1 2234 1 27 LYS HD3 1 70 ASP HB3 5.280 2.200 5.280 4.857 3.716 5.337 0.057 15 0 "[ . 1 . 2]" 1 2235 1 28 LEU MD1 1 69 VAL HB 5.280 2.200 5.280 4.833 4.590 4.976 . 0 0 "[ . 1 . 2]" 1 2236 1 28 LEU MD2 1 69 VAL HB 5.280 2.200 5.280 2.966 2.475 3.278 . 0 0 "[ . 1 . 2]" 1 2237 1 61 LEU HB3 1 73 GLU HA 5.280 2.200 5.280 4.410 4.275 4.538 . 0 0 "[ . 1 . 2]" 1 2238 2 15 PHE HB3 2 16 HIS HB3 5.280 2.200 5.280 4.856 4.799 4.999 . 0 0 "[ . 1 . 2]" 1 2239 2 22 GLU HA 2 23 GLY HA2 5.280 2.200 5.280 4.426 4.361 4.478 . 0 0 "[ . 1 . 2]" 1 2240 2 22 GLU HA 2 23 GLY HA3 5.280 2.200 5.280 4.493 4.445 4.540 . 0 0 "[ . 1 . 2]" 1 2241 2 28 LEU MD1 2 69 VAL HB 5.280 2.200 5.280 4.835 4.591 4.980 . 0 0 "[ . 1 . 2]" 1 2242 2 28 LEU MD2 2 69 VAL HB 5.280 2.200 5.280 2.967 2.475 3.278 . 0 0 "[ . 1 . 2]" 1 2243 2 61 LEU HB3 2 73 GLU HA 5.280 2.200 5.280 4.410 4.274 4.539 . 0 0 "[ . 1 . 2]" 1 2244 1 14 VAL MG2 1 74 TYR HE1 5.290 2.200 5.290 4.585 2.948 5.161 . 0 0 "[ . 1 . 2]" 1 2245 1 45 LEU HB3 1 47 ALA H 5.290 2.200 5.290 5.123 4.881 5.236 . 0 0 "[ . 1 . 2]" 1 2246 1 55 ASP HA 1 56 LYS HA 5.290 2.200 5.290 4.789 4.760 4.806 . 0 0 "[ . 1 . 2]" 1 2247 1 75 VAL HA 1 76 VAL HA 5.290 2.200 5.290 4.629 4.625 4.637 . 0 0 "[ . 1 . 2]" 1 2248 2 14 VAL MG2 2 74 TYR HE1 5.290 2.200 5.290 4.585 2.947 5.162 . 0 0 "[ . 1 . 2]" 1 2249 2 45 LEU HB3 2 47 ALA H 5.290 2.200 5.290 5.124 4.880 5.238 . 0 0 "[ . 1 . 2]" 1 2250 2 55 ASP HA 2 56 LYS HA 5.290 2.200 5.290 4.789 4.760 4.806 . 0 0 "[ . 1 . 2]" 1 2251 2 75 VAL HA 2 76 VAL HA 5.290 2.200 5.290 4.629 4.624 4.638 . 0 0 "[ . 1 . 2]" 1 2252 1 54 VAL MG2 1 55 ASP HB2 5.300 2.200 5.300 5.193 4.803 5.340 0.040 15 0 "[ . 1 . 2]" 1 2253 2 54 VAL MG2 2 55 ASP HB2 5.300 2.200 5.300 5.193 4.803 5.340 0.040 15 0 "[ . 1 . 2]" 1 2254 1 29 SER HA 1 30 LYS HB2 5.310 2.200 5.310 4.684 4.628 4.726 . 0 0 "[ . 1 . 2]" 1 2255 1 35 GLU H 1 37 LEU H 5.310 2.200 5.310 4.386 4.331 4.456 . 0 0 "[ . 1 . 2]" 1 2256 1 40 GLU HA 1 41 LEU MD2 5.310 2.200 5.310 4.196 4.046 4.356 . 0 0 "[ . 1 . 2]" 1 2257 1 64 ASN H 1 64 ASN HD21 5.310 2.200 5.310 3.932 3.535 4.483 . 0 0 "[ . 1 . 2]" 1 2258 2 29 SER HA 2 30 LYS HB2 5.310 2.200 5.310 4.683 4.628 4.722 . 0 0 "[ . 1 . 2]" 1 2259 2 35 GLU H 2 37 LEU H 5.310 2.200 5.310 4.386 4.329 4.455 . 0 0 "[ . 1 . 2]" 1 2260 2 40 GLU HA 2 41 LEU MD2 5.310 2.200 5.310 4.196 4.045 4.355 . 0 0 "[ . 1 . 2]" 1 2261 2 64 ASN H 2 64 ASN HD21 5.310 2.200 5.310 3.932 3.533 4.482 . 0 0 "[ . 1 . 2]" 1 2262 1 13 ASN H 1 14 VAL MG1 5.320 2.200 5.320 4.323 4.275 4.376 . 0 0 "[ . 1 . 2]" 1 2263 1 32 GLU HG2 1 33 LEU H 5.320 2.200 5.320 4.933 4.839 4.986 . 0 0 "[ . 1 . 2]" 1 2264 2 13 ASN H 2 14 VAL MG1 5.320 2.200 5.320 4.322 4.274 4.375 . 0 0 "[ . 1 . 2]" 1 2265 1 63 GLU H 1 70 ASP H 5.330 2.200 5.330 5.301 5.004 5.370 0.040 20 0 "[ . 1 . 2]" 1 2266 1 81 LEU H 1 82 THR HB 5.330 2.200 5.330 4.940 4.914 4.960 . 0 0 "[ . 1 . 2]" 1 2267 2 63 GLU H 2 70 ASP H 5.330 2.200 5.330 5.300 5.001 5.371 0.041 20 0 "[ . 1 . 2]" 1 2268 2 81 LEU H 2 82 THR HB 5.330 2.200 5.330 4.939 4.914 4.958 . 0 0 "[ . 1 . 2]" 1 2269 1 10 THR MG 1 14 VAL HA 5.340 2.200 5.340 5.231 5.105 5.302 . 0 0 "[ . 1 . 2]" 1 2270 1 28 LEU H 1 68 GLU HA 5.340 2.200 5.340 5.342 5.228 5.404 0.064 2 0 "[ . 1 . 2]" 1 2271 1 77 LEU HA 1 78 VAL HA 5.340 2.200 5.340 4.642 4.632 4.656 . 0 0 "[ . 1 . 2]" 1 2272 2 10 THR MG 2 14 VAL HA 5.340 2.200 5.340 5.232 5.105 5.303 . 0 0 "[ . 1 . 2]" 1 2273 2 28 LEU H 2 68 GLU HA 5.340 2.200 5.340 5.343 5.229 5.404 0.064 2 0 "[ . 1 . 2]" 1 2274 2 77 LEU HA 2 78 VAL HA 5.340 2.200 5.340 4.642 4.633 4.656 . 0 0 "[ . 1 . 2]" 1 2275 1 30 LYS HB2 1 33 LEU QD 5.350 2.200 5.350 3.672 3.641 3.713 . 0 0 "[ . 1 . 2]" 1 2276 1 37 LEU MD1 1 45 LEU HG 5.350 2.200 5.350 3.633 3.496 3.850 . 0 0 "[ . 1 . 2]" 1 2277 1 38 GLN HG3 1 45 LEU HG 5.350 2.200 5.350 3.958 3.684 4.139 . 0 0 "[ . 1 . 2]" 1 2278 1 41 LEU HG 1 42 SER H 5.350 2.200 5.350 5.133 5.096 5.168 . 0 0 "[ . 1 . 2]" 1 2279 1 71 PHE HE1 1 75 VAL HB 5.350 2.200 5.350 4.256 4.183 4.319 . 0 0 "[ . 1 . 2]" 1 2280 2 30 LYS HB2 2 33 LEU QD 5.350 2.200 5.350 3.672 3.641 3.713 . 0 0 "[ . 1 . 2]" 1 2281 2 37 LEU MD1 2 45 LEU HG 5.350 2.200 5.350 3.633 3.497 3.850 . 0 0 "[ . 1 . 2]" 1 2282 2 38 GLN HG3 2 45 LEU HG 5.350 2.200 5.350 3.958 3.683 4.140 . 0 0 "[ . 1 . 2]" 1 2283 2 41 LEU HG 2 42 SER H 5.350 2.200 5.350 5.133 5.096 5.166 . 0 0 "[ . 1 . 2]" 1 2284 2 71 PHE HE1 2 75 VAL HB 5.350 2.200 5.350 4.256 4.183 4.318 . 0 0 "[ . 1 . 2]" 1 2285 1 14 VAL HA 1 17 ALA HA 5.360 2.200 5.360 4.727 4.667 4.780 . 0 0 "[ . 1 . 2]" 1 2286 1 67 GLY HA3 1 68 GLU QB 5.360 2.200 5.360 4.757 4.302 5.106 . 0 0 "[ . 1 . 2]" 1 2287 1 72 GLN HB3 1 75 VAL HB 5.360 2.200 5.360 4.653 4.627 4.683 . 0 0 "[ . 1 . 2]" 1 2288 1 90 TRP HA 1 91 GLU HA 5.360 2.200 5.360 4.618 4.568 4.714 . 0 0 "[ . 1 . 2]" 1 2289 2 14 VAL HA 2 17 ALA HA 5.360 2.200 5.360 4.728 4.669 4.782 . 0 0 "[ . 1 . 2]" 1 2290 2 67 GLY HA3 2 68 GLU QB 5.360 2.200 5.360 4.757 4.303 5.106 . 0 0 "[ . 1 . 2]" 1 2291 2 72 GLN HB3 2 75 VAL HB 5.360 2.200 5.360 4.653 4.627 4.684 . 0 0 "[ . 1 . 2]" 1 2292 2 90 TRP HA 2 91 GLU HA 5.360 2.200 5.360 4.618 4.569 4.712 . 0 0 "[ . 1 . 2]" 1 2293 1 51 VAL HB 1 52 ASP HA 5.370 2.200 5.370 4.810 4.722 4.889 . 0 0 "[ . 1 . 2]" 1 2294 2 8 MET HB2 2 11 LEU QD 5.370 2.200 5.370 5.152 4.928 5.220 . 0 0 "[ . 1 . 2]" 1 2295 2 51 VAL HB 2 52 ASP HA 5.370 2.200 5.370 4.810 4.722 4.889 . 0 0 "[ . 1 . 2]" 1 2296 1 13 ASN H 1 15 PHE H 5.380 2.200 5.380 4.323 4.173 4.392 . 0 0 "[ . 1 . 2]" 1 2297 1 36 LEU HA 1 40 GLU HG2 5.380 2.200 5.380 3.897 3.742 4.148 . 0 0 "[ . 1 . 2]" 1 2298 2 13 ASN H 2 15 PHE H 5.380 2.200 5.380 4.321 4.172 4.390 . 0 0 "[ . 1 . 2]" 1 2299 2 36 LEU HA 2 40 GLU HG2 5.380 2.200 5.380 3.897 3.743 4.154 . 0 0 "[ . 1 . 2]" 1 2300 1 15 PHE HE1 1 74 TYR H 5.390 2.200 5.390 4.724 4.522 4.931 . 0 0 "[ . 1 . 2]" 1 2301 1 15 PHE HZ 1 28 LEU QD 5.390 2.200 5.390 3.948 3.305 4.367 . 0 0 "[ . 1 . 2]" 1 2302 2 15 PHE HE1 2 74 TYR H 5.390 2.200 5.390 4.724 4.523 4.930 . 0 0 "[ . 1 . 2]" 1 2303 2 15 PHE HZ 2 28 LEU QD 5.390 2.200 5.390 3.949 3.306 4.368 . 0 0 "[ . 1 . 2]" 1 2304 1 27 LYS HA 1 68 GLU QG 5.400 2.200 5.400 4.969 4.098 5.440 0.040 13 0 "[ . 1 . 2]" 1 2305 1 28 LEU QD 1 32 GLU H 5.400 2.200 5.400 4.478 4.209 5.252 . 0 0 "[ . 1 . 2]" 1 2306 1 69 VAL HB 1 73 GLU HB2 5.400 2.200 5.400 4.680 4.575 4.744 . 0 0 "[ . 1 . 2]" 1 2307 2 27 LYS HA 2 68 GLU QG 5.400 2.200 5.400 4.973 4.106 5.443 0.043 13 0 "[ . 1 . 2]" 1 2308 2 28 LEU QD 2 32 GLU H 5.400 2.200 5.400 4.480 4.211 5.252 . 0 0 "[ . 1 . 2]" 1 2309 2 69 VAL HB 2 73 GLU HB2 5.400 2.200 5.400 4.680 4.576 4.744 . 0 0 "[ . 1 . 2]" 1 2310 1 8 MET HB2 1 11 LEU MD1 5.410 2.200 5.410 5.340 5.095 5.409 . 0 0 "[ . 1 . 2]" 1 2311 1 12 ILE H 1 15 PHE H 5.420 2.200 5.420 4.864 4.766 4.895 . 0 0 "[ . 1 . 2]" 1 2312 1 30 LYS HG2 1 54 VAL HB 5.420 2.200 5.420 5.293 5.053 5.431 0.011 1 0 "[ . 1 . 2]" 1 2313 1 37 LEU HB2 1 41 LEU MD1 5.420 2.200 5.420 5.278 5.022 5.423 0.003 12 0 "[ . 1 . 2]" 1 2314 2 12 ILE H 2 15 PHE H 5.420 2.200 5.420 4.864 4.767 4.895 . 0 0 "[ . 1 . 2]" 1 2315 2 30 LYS HG2 2 54 VAL HB 5.420 2.200 5.420 5.293 5.053 5.431 0.011 1 0 "[ . 1 . 2]" 1 2316 2 37 LEU HB2 2 41 LEU MD1 5.420 2.200 5.420 5.278 5.022 5.422 0.002 12 0 "[ . 1 . 2]" 1 2317 1 33 LEU H 1 35 GLU H 5.430 2.200 5.430 4.065 4.007 4.136 . 0 0 "[ . 1 . 2]" 1 2318 1 62 ASP HA 1 70 ASP H 5.430 2.200 5.430 4.506 4.250 4.782 . 0 0 "[ . 1 . 2]" 1 2319 2 33 LEU H 2 35 GLU H 5.430 2.200 5.430 4.066 4.008 4.136 . 0 0 "[ . 1 . 2]" 1 2320 2 62 ASP HA 2 70 ASP H 5.430 2.200 5.430 4.505 4.249 4.783 . 0 0 "[ . 1 . 2]" 1 2321 1 14 VAL HA 1 15 PHE HA 5.440 2.200 5.440 4.775 4.753 4.793 . 0 0 "[ . 1 . 2]" 1 2322 1 53 ALA HA 1 54 VAL HA 5.440 2.200 5.440 4.805 4.762 4.826 . 0 0 "[ . 1 . 2]" 1 2323 1 61 LEU HA 1 62 ASP HA 5.440 2.200 5.440 4.636 4.618 4.666 . 0 0 "[ . 1 . 2]" 1 2324 1 61 LEU HA 1 69 VAL MG1 5.440 2.200 5.440 4.490 4.269 4.712 . 0 0 "[ . 1 . 2]" 1 2325 1 74 TYR HB2 1 74 TYR HE1 5.440 2.200 5.440 4.813 4.684 5.448 0.008 4 0 "[ . 1 . 2]" 1 2326 2 14 VAL HA 2 15 PHE HA 5.440 2.200 5.440 4.774 4.752 4.793 . 0 0 "[ . 1 . 2]" 1 2327 2 53 ALA HA 2 54 VAL HA 5.440 2.200 5.440 4.805 4.762 4.826 . 0 0 "[ . 1 . 2]" 1 2328 2 61 LEU HA 2 62 ASP HA 5.440 2.200 5.440 4.636 4.618 4.665 . 0 0 "[ . 1 . 2]" 1 2329 2 61 LEU HA 2 69 VAL MG1 5.440 2.200 5.440 4.490 4.269 4.713 . 0 0 "[ . 1 . 2]" 1 2330 2 74 TYR HB2 2 74 TYR HE1 5.440 2.200 5.440 4.813 4.682 5.449 0.009 8 0 "[ . 1 . 2]" 1 2331 1 58 MET HG3 1 59 LYS HG3 5.450 2.200 5.450 3.867 3.257 4.551 . 0 0 "[ . 1 . 2]" 1 2332 1 63 GLU HA 1 64 ASN HA 5.450 2.200 5.450 4.852 4.836 4.872 . 0 0 "[ . 1 . 2]" 1 2333 1 72 GLN HB3 1 75 VAL MG1 5.450 2.200 5.450 3.741 3.709 3.809 . 0 0 "[ . 1 . 2]" 1 2334 1 82 THR MG 1 86 ASN HB3 5.450 2.200 5.450 5.002 4.864 5.096 . 0 0 "[ . 1 . 2]" 1 2335 2 58 MET HG3 2 59 LYS HG3 5.450 2.200 5.450 3.867 3.259 4.549 . 0 0 "[ . 1 . 2]" 1 2336 2 63 GLU HA 2 64 ASN HA 5.450 2.200 5.450 4.853 4.838 4.872 . 0 0 "[ . 1 . 2]" 1 2337 2 72 GLN HB3 2 75 VAL MG1 5.450 2.200 5.450 3.741 3.709 3.808 . 0 0 "[ . 1 . 2]" 1 2338 2 82 THR MG 2 86 ASN HB3 5.450 2.200 5.450 5.003 4.864 5.096 . 0 0 "[ . 1 . 2]" 1 2339 1 44 PHE HD1 1 81 LEU HA 5.460 2.200 5.460 5.302 4.884 5.468 0.008 5 0 "[ . 1 . 2]" 1 2340 1 48 GLN HB3 1 53 ALA H 5.460 2.200 5.460 4.866 4.662 5.045 . 0 0 "[ . 1 . 2]" 1 2341 2 44 PHE HD1 2 81 LEU HA 5.460 2.200 5.460 5.300 4.885 5.467 0.007 16 0 "[ . 1 . 2]" 1 2342 2 48 GLN HB3 2 53 ALA H 5.460 2.200 5.460 4.867 4.661 5.046 . 0 0 "[ . 1 . 2]" 1 2343 1 15 PHE HB3 1 71 PHE HD1 5.470 2.200 5.470 4.547 4.345 4.632 . 0 0 "[ . 1 . 2]" 1 2344 2 15 PHE HB3 2 71 PHE HD1 5.470 2.200 5.470 4.546 4.347 4.632 . 0 0 "[ . 1 . 2]" 1 2345 1 29 SER HB3 1 68 GLU QG 5.480 2.200 5.480 4.308 3.327 5.526 0.046 19 0 "[ . 1 . 2]" 1 2346 1 36 LEU HA 1 39 THR HB 5.480 2.200 5.480 4.480 4.266 4.624 . 0 0 "[ . 1 . 2]" 1 2347 2 29 SER HB3 2 68 GLU QG 5.480 2.200 5.480 4.307 3.327 5.516 0.036 18 0 "[ . 1 . 2]" 1 2348 2 36 LEU HA 2 39 THR HB 5.480 2.200 5.480 4.480 4.266 4.625 . 0 0 "[ . 1 . 2]" 1 2349 1 2 SER HA 1 3 GLU HA 5.490 2.200 5.490 4.609 4.306 4.892 . 0 0 "[ . 1 . 2]" 1 2350 1 33 LEU QD 1 69 VAL HA 5.490 2.200 5.490 4.564 4.456 4.720 . 0 0 "[ . 1 . 2]" 1 2351 1 76 VAL HA 1 77 LEU HA 5.490 2.200 5.490 4.813 4.802 4.825 . 0 0 "[ . 1 . 2]" 1 2352 2 2 SER HA 2 3 GLU HA 5.490 2.200 5.490 4.609 4.306 4.893 . 0 0 "[ . 1 . 2]" 1 2353 2 33 LEU QD 2 69 VAL HA 5.490 2.200 5.490 4.564 4.455 4.720 . 0 0 "[ . 1 . 2]" 1 2354 2 76 VAL HA 2 77 LEU HA 5.490 2.200 5.490 4.813 4.802 4.827 . 0 0 "[ . 1 . 2]" 1 2355 1 3 GLU HB3 1 6 THR HB 5.500 2.200 5.500 4.180 3.949 5.029 . 0 0 "[ . 1 . 2]" 1 2356 1 4 LEU H 1 7 ALA H 5.500 2.200 5.500 4.707 4.599 4.814 . 0 0 "[ . 1 . 2]" 1 2357 1 18 HIS HA 1 36 LEU QD 5.500 2.200 5.500 4.492 4.196 4.565 . 0 0 "[ . 1 . 2]" 1 2358 1 20 GLY H 1 28 LEU QD 5.500 2.200 5.500 4.776 4.589 4.962 . 0 0 "[ . 1 . 2]" 1 2359 1 28 LEU MD1 1 37 LEU MD2 5.500 2.200 5.500 4.716 4.473 5.028 . 0 0 "[ . 1 . 2]" 1 2360 1 28 LEU MD2 1 37 LEU MD2 5.500 2.200 5.500 3.444 3.264 3.738 . 0 0 "[ . 1 . 2]" 1 2361 2 3 GLU HB3 2 6 THR HB 5.500 2.200 5.500 4.178 3.946 5.027 . 0 0 "[ . 1 . 2]" 1 2362 2 4 LEU H 2 7 ALA H 5.500 2.200 5.500 4.705 4.599 4.814 . 0 0 "[ . 1 . 2]" 1 2363 2 18 HIS HA 2 36 LEU QD 5.500 2.200 5.500 4.481 4.152 4.551 . 0 0 "[ . 1 . 2]" 1 2364 2 20 GLY H 2 28 LEU QD 5.500 2.200 5.500 4.775 4.583 4.961 . 0 0 "[ . 1 . 2]" 1 2365 2 28 LEU MD1 2 37 LEU MD2 5.500 2.200 5.500 4.717 4.473 5.028 . 0 0 "[ . 1 . 2]" 1 2366 2 28 LEU MD2 2 37 LEU MD2 5.500 2.200 5.500 3.444 3.264 3.738 . 0 0 "[ . 1 . 2]" 1 2367 1 44 PHE HA 1 45 LEU HA 5.510 2.200 5.510 4.666 4.646 4.689 . 0 0 "[ . 1 . 2]" 1 2368 1 76 VAL H 1 78 VAL H 5.510 2.200 5.510 4.530 4.498 4.562 . 0 0 "[ . 1 . 2]" 1 2369 2 44 PHE HA 2 45 LEU HA 5.510 2.200 5.510 4.667 4.647 4.688 . 0 0 "[ . 1 . 2]" 1 2370 2 76 VAL H 2 78 VAL H 5.510 2.200 5.510 4.530 4.500 4.562 . 0 0 "[ . 1 . 2]" 1 2371 1 16 HIS HA 1 17 ALA HA 5.520 2.200 5.520 4.757 4.723 4.796 . 0 0 "[ . 1 . 2]" 1 2372 1 52 ASP HA 1 53 ALA HA 5.520 2.200 5.520 4.874 4.845 4.918 . 0 0 "[ . 1 . 2]" 1 2373 1 73 GLU HA 1 75 VAL HB 5.520 2.200 5.520 5.507 5.463 5.525 0.005 10 0 "[ . 1 . 2]" 1 2374 1 78 VAL HB 1 79 ALA MB 5.520 2.200 5.520 4.898 4.879 4.924 . 0 0 "[ . 1 . 2]" 1 2375 2 16 HIS HA 2 17 ALA HA 5.520 2.200 5.520 4.757 4.724 4.797 . 0 0 "[ . 1 . 2]" 1 2376 2 52 ASP HA 2 53 ALA HA 5.520 2.200 5.520 4.874 4.845 4.917 . 0 0 "[ . 1 . 2]" 1 2377 2 73 GLU HA 2 75 VAL HB 5.520 2.200 5.520 5.507 5.465 5.525 0.005 10 0 "[ . 1 . 2]" 1 2378 2 78 VAL HB 2 79 ALA MB 5.520 2.200 5.520 4.898 4.878 4.923 . 0 0 "[ . 1 . 2]" 1 2379 1 19 SER HB2 1 27 LYS HA 5.530 2.200 5.530 4.887 4.701 5.082 . 0 0 "[ . 1 . 2]" 1 2380 1 29 SER HB2 1 68 GLU HA 5.530 2.200 5.530 5.113 4.856 5.557 0.027 15 0 "[ . 1 . 2]" 1 2381 2 19 SER HB2 2 27 LYS HA 5.530 2.200 5.530 4.878 4.691 5.074 . 0 0 "[ . 1 . 2]" 1 2382 2 29 SER HB2 2 68 GLU HA 5.530 2.200 5.530 5.114 4.855 5.556 0.026 15 0 "[ . 1 . 2]" 1 2383 1 28 LEU HB3 1 74 TYR HB2 5.540 2.200 5.540 4.492 4.280 4.634 . 0 0 "[ . 1 . 2]" 1 2384 1 29 SER H 1 32 GLU HA 5.540 2.200 5.540 5.136 5.038 5.335 . 0 0 "[ . 1 . 2]" 1 2385 1 60 GLU HB2 1 61 LEU HA 5.540 2.200 5.540 5.199 4.730 5.554 0.014 9 0 "[ . 1 . 2]" 1 2386 1 82 THR HA 1 85 CYS HA 5.540 2.200 5.540 5.210 5.131 5.292 . 0 0 "[ . 1 . 2]" 1 2387 2 28 LEU HB3 2 74 TYR HB2 5.540 2.200 5.540 4.492 4.281 4.635 . 0 0 "[ . 1 . 2]" 1 2388 2 29 SER H 2 32 GLU HA 5.540 2.200 5.540 5.135 5.038 5.334 . 0 0 "[ . 1 . 2]" 1 2389 2 60 GLU HB2 2 61 LEU HA 5.540 2.200 5.540 5.199 4.729 5.554 0.014 9 0 "[ . 1 . 2]" 1 2390 2 82 THR HA 2 85 CYS HA 5.540 2.200 5.540 5.210 5.131 5.291 . 0 0 "[ . 1 . 2]" 1 2391 1 14 VAL H 1 17 ALA H 5.550 2.200 5.550 4.356 4.323 4.424 . 0 0 "[ . 1 . 2]" 1 2392 2 14 VAL H 2 17 ALA H 5.550 2.200 5.550 4.357 4.325 4.425 . 0 0 "[ . 1 . 2]" 1 2393 1 9 GLU H 1 10 THR HB 5.560 2.200 5.560 4.914 4.860 4.934 . 0 0 "[ . 1 . 2]" 1 2394 1 10 THR MG 1 13 ASN HB3 5.560 2.200 5.560 4.775 4.636 4.929 . 0 0 "[ . 1 . 2]" 1 2395 1 15 PHE HE1 1 19 SER HA 5.560 2.200 5.560 5.596 5.584 5.608 0.048 13 0 "[ . 1 . 2]" 1 2396 2 9 GLU H 2 10 THR HB 5.560 2.200 5.560 4.910 4.857 4.929 . 0 0 "[ . 1 . 2]" 1 2397 2 10 THR MG 2 13 ASN HB3 5.560 2.200 5.560 4.774 4.635 4.929 . 0 0 "[ . 1 . 2]" 1 2398 2 15 PHE HE1 2 19 SER HA 5.560 2.200 5.560 5.596 5.585 5.608 0.048 13 0 "[ . 1 . 2]" 1 2399 1 69 VAL HA 1 74 TYR H 5.570 2.200 5.570 5.479 5.423 5.549 . 0 0 "[ . 1 . 2]" 1 2400 2 69 VAL HA 2 74 TYR H 5.570 2.200 5.570 5.480 5.424 5.551 . 0 0 "[ . 1 . 2]" 1 2401 1 79 ALA HA 1 80 ALA MB 5.590 2.200 5.590 5.037 5.035 5.040 . 0 0 "[ . 1 . 2]" 1 2402 2 79 ALA HA 2 80 ALA MB 5.590 2.200 5.590 5.037 5.035 5.041 . 0 0 "[ . 1 . 2]" 1 2403 1 84 ALA H 1 85 CYS HA 5.600 2.200 5.600 5.151 5.133 5.173 . 0 0 "[ . 1 . 2]" 1 2404 2 84 ALA H 2 85 CYS HA 5.600 2.200 5.600 5.151 5.133 5.173 . 0 0 "[ . 1 . 2]" 1 2405 2 7 ALA HA 2 11 LEU QD 5.610 2.200 5.610 4.330 4.302 4.367 . 0 0 "[ . 1 . 2]" 1 2406 1 39 THR HA 1 41 LEU H 5.620 2.200 5.620 5.420 5.072 5.624 0.004 9 0 "[ . 1 . 2]" 1 2407 2 39 THR HA 2 41 LEU H 5.620 2.200 5.620 5.420 5.073 5.624 0.004 9 0 "[ . 1 . 2]" 1 2408 1 41 LEU HB3 1 44 PHE HA 5.630 2.200 5.630 5.105 4.983 5.243 . 0 0 "[ . 1 . 2]" 1 2409 2 41 LEU HB3 2 44 PHE HA 5.630 2.200 5.630 5.105 4.982 5.243 . 0 0 "[ . 1 . 2]" 1 2410 1 20 GLY HA2 1 25 LYS QE 5.640 2.200 5.640 4.993 4.818 5.292 . 0 0 "[ . 1 . 2]" 1 2411 1 55 ASP HA 1 57 VAL HB 5.640 2.200 5.640 5.122 4.981 5.314 . 0 0 "[ . 1 . 2]" 1 2412 2 20 GLY HA2 2 25 LYS QE 5.640 2.200 5.640 4.993 4.819 5.291 . 0 0 "[ . 1 . 2]" 1 2413 2 55 ASP HA 2 57 VAL HB 5.640 2.200 5.640 5.123 4.983 5.314 . 0 0 "[ . 1 . 2]" 1 2414 1 13 ASN HD21 1 14 VAL H 5.650 2.200 5.650 5.120 5.100 5.151 . 0 0 "[ . 1 . 2]" 1 2415 1 21 LYS H 1 22 GLU HB2 5.650 2.200 5.650 5.441 5.291 5.623 . 0 0 "[ . 1 . 2]" 1 2416 2 13 ASN HD21 2 14 VAL H 5.650 2.200 5.650 5.119 5.098 5.151 . 0 0 "[ . 1 . 2]" 1 2417 2 21 LYS H 2 22 GLU HB2 5.650 2.200 5.650 5.441 5.291 5.624 . 0 0 "[ . 1 . 2]" 1 2418 1 7 ALA HA 1 11 LEU MD2 5.660 2.200 5.660 4.541 4.495 4.574 . 0 0 "[ . 1 . 2]" 1 2419 1 29 SER HB3 1 58 MET ME 5.660 2.200 5.660 5.550 4.544 5.671 0.011 11 0 "[ . 1 . 2]" 1 2420 1 62 ASP HA 1 69 VAL MG1 5.660 2.200 5.660 4.355 4.097 4.678 . 0 0 "[ . 1 . 2]" 1 2421 2 29 SER HB3 2 58 MET ME 5.660 2.200 5.660 5.550 4.542 5.671 0.011 11 0 "[ . 1 . 2]" 1 2422 2 62 ASP HA 2 69 VAL MG1 5.660 2.200 5.660 4.355 4.098 4.678 . 0 0 "[ . 1 . 2]" 1 2423 1 22 GLU HB2 1 23 GLY QA 5.670 2.200 5.670 4.751 4.411 5.253 . 0 0 "[ . 1 . 2]" 1 2424 2 22 GLU HB2 2 23 GLY QA 5.670 2.200 5.670 4.751 4.411 5.252 . 0 0 "[ . 1 . 2]" 1 2425 1 61 LEU HB3 1 74 TYR HA 5.680 2.200 5.680 4.898 4.681 5.144 . 0 0 "[ . 1 . 2]" 1 2426 2 61 LEU HB3 2 74 TYR HA 5.680 2.200 5.680 4.899 4.681 5.144 . 0 0 "[ . 1 . 2]" 1 2427 1 26 TYR H 1 26 TYR HE2 5.700 2.200 5.700 4.746 4.517 4.940 . 0 0 "[ . 1 . 2]" 1 2428 1 64 ASN HA 1 65 GLY HA2 5.700 2.200 5.700 5.306 5.283 5.318 . 0 0 "[ . 1 . 2]" 1 2429 2 26 TYR H 2 26 TYR HE2 5.700 2.200 5.700 4.745 4.515 4.940 . 0 0 "[ . 1 . 2]" 1 2430 2 64 ASN HA 2 65 GLY HA2 5.700 2.200 5.700 5.306 5.282 5.319 . 0 0 "[ . 1 . 2]" 1 2431 1 29 SER H 1 31 LYS H 5.730 2.200 5.730 5.240 5.086 5.417 . 0 0 "[ . 1 . 2]" 1 2432 1 50 ASP H 1 51 VAL MG1 5.730 2.200 5.730 5.424 5.085 5.519 . 0 0 "[ . 1 . 2]" 1 2433 2 29 SER H 2 31 LYS H 5.730 2.200 5.730 5.240 5.086 5.417 . 0 0 "[ . 1 . 2]" 1 2434 2 50 ASP H 2 51 VAL MG1 5.730 2.200 5.730 5.423 5.085 5.518 . 0 0 "[ . 1 . 2]" 1 2435 1 29 SER HB2 1 68 GLU HG2 5.740 2.200 5.740 5.091 4.270 5.773 0.033 20 0 "[ . 1 . 2]" 1 2436 1 29 SER HB2 1 68 GLU HG3 5.740 2.200 5.740 4.232 3.469 5.616 . 0 0 "[ . 1 . 2]" 1 2437 2 29 SER HB2 2 68 GLU HG2 5.740 2.200 5.740 5.088 4.272 5.766 0.026 20 0 "[ . 1 . 2]" 1 2438 2 29 SER HB2 2 68 GLU HG3 5.740 2.200 5.740 4.230 3.469 5.605 . 0 0 "[ . 1 . 2]" 1 2439 1 37 LEU HA 1 41 LEU HA 5.770 2.200 5.770 5.338 5.256 5.411 . 0 0 "[ . 1 . 2]" 1 2440 2 37 LEU HA 2 41 LEU HA 5.770 2.200 5.770 5.339 5.256 5.411 . 0 0 "[ . 1 . 2]" 1 2441 1 10 THR HB 1 12 ILE H 5.780 2.200 5.780 4.932 4.883 4.958 . 0 0 "[ . 1 . 2]" 1 2442 1 45 LEU HB2 1 47 ALA H 5.780 2.200 5.780 5.263 5.180 5.521 . 0 0 "[ . 1 . 2]" 1 2443 1 85 CYS HB3 1 86 ASN HB3 5.780 2.200 5.780 4.905 4.836 4.971 . 0 0 "[ . 1 . 2]" 1 2444 2 10 THR HB 2 12 ILE H 5.780 2.200 5.780 4.929 4.881 4.956 . 0 0 "[ . 1 . 2]" 1 2445 2 45 LEU HB2 2 47 ALA H 5.780 2.200 5.780 5.264 5.181 5.523 . 0 0 "[ . 1 . 2]" 1 2446 2 85 CYS HB3 2 86 ASN HB3 5.780 2.200 5.780 4.906 4.837 4.970 . 0 0 "[ . 1 . 2]" 1 2447 1 61 LEU HA 1 63 GLU H 5.800 2.200 5.800 4.344 3.935 4.998 . 0 0 "[ . 1 . 2]" 1 2448 2 61 LEU HA 2 63 GLU H 5.800 2.200 5.800 4.344 3.935 4.999 . 0 0 "[ . 1 . 2]" 1 2449 1 74 TYR H 1 75 VAL MG2 5.810 2.200 5.810 5.389 5.357 5.417 . 0 0 "[ . 1 . 2]" 1 2450 2 74 TYR H 2 75 VAL MG2 5.810 2.200 5.810 5.389 5.357 5.417 . 0 0 "[ . 1 . 2]" 1 2451 1 18 HIS H 1 36 LEU HB2 5.820 2.200 5.820 4.837 4.476 5.246 . 0 0 "[ . 1 . 2]" 1 2452 2 18 HIS H 2 36 LEU HB2 5.820 2.200 5.820 4.838 4.477 5.254 . 0 0 "[ . 1 . 2]" 1 2453 1 30 LYS HB2 1 54 VAL MG2 5.830 2.200 5.830 4.726 4.434 5.000 . 0 0 "[ . 1 . 2]" 1 2454 2 30 LYS HB2 2 54 VAL MG2 5.830 2.200 5.830 4.726 4.434 5.000 . 0 0 "[ . 1 . 2]" 1 2455 1 53 ALA H 1 56 LYS HB2 5.860 2.200 5.860 5.087 4.921 5.268 . 0 0 "[ . 1 . 2]" 1 2456 2 53 ALA H 2 56 LYS HB2 5.860 2.200 5.860 5.087 4.922 5.267 . 0 0 "[ . 1 . 2]" 1 2457 1 45 LEU HA 1 46 ASP HA 5.930 2.200 5.930 4.775 4.746 4.855 . 0 0 "[ . 1 . 2]" 1 2458 2 45 LEU HA 2 46 ASP HA 5.930 2.200 5.930 4.775 4.746 4.855 . 0 0 "[ . 1 . 2]" 1 2459 1 15 PHE HB2 1 28 LEU QD 5.940 2.200 5.940 4.752 4.586 5.230 . 0 0 "[ . 1 . 2]" 1 2460 1 15 PHE HB2 1 36 LEU QD 5.940 2.200 5.940 3.881 3.731 4.378 . 0 0 "[ . 1 . 2]" 1 2461 2 15 PHE HB2 2 28 LEU QD 5.940 2.200 5.940 4.752 4.586 5.230 . 0 0 "[ . 1 . 2]" 1 2462 2 15 PHE HB2 2 36 LEU QD 5.940 2.200 5.940 3.882 3.733 4.378 . 0 0 "[ . 1 . 2]" 1 2463 1 45 LEU MD1 1 47 ALA H 5.970 2.200 5.970 5.187 4.541 5.422 . 0 0 "[ . 1 . 2]" 1 2464 2 45 LEU MD1 2 47 ALA H 5.970 2.200 5.970 5.187 4.541 5.422 . 0 0 "[ . 1 . 2]" 1 2465 1 12 ILE H 1 13 ASN HA 6.000 2.200 6.000 5.328 5.304 5.344 . 0 0 "[ . 1 . 2]" 1 2466 1 13 ASN HA 1 14 VAL MG1 6.000 2.200 6.000 4.870 4.786 4.899 . 0 0 "[ . 1 . 2]" 1 2467 1 13 ASN HA 1 14 VAL MG2 6.000 2.200 6.000 5.221 5.203 5.232 . 0 0 "[ . 1 . 2]" 1 2468 1 25 LYS HG2 1 26 TYR HD2 6.000 2.200 6.000 5.654 5.050 6.001 0.001 13 0 "[ . 1 . 2]" 1 2469 1 25 LYS HG3 1 26 TYR HD2 6.000 2.200 6.000 4.835 4.030 5.030 . 0 0 "[ . 1 . 2]" 1 2470 1 28 LEU HB2 1 74 TYR HB3 6.000 2.200 6.000 5.492 5.284 5.597 . 0 0 "[ . 1 . 2]" 1 2471 1 45 LEU MD2 1 47 ALA H 6.000 2.200 6.000 5.226 5.061 5.700 . 0 0 "[ . 1 . 2]" 1 2472 1 48 GLN HA 1 50 ASP HB2 6.000 2.200 6.000 5.409 4.938 5.684 . 0 0 "[ . 1 . 2]" 1 2473 1 49 LYS HA 1 50 ASP HB2 6.000 2.200 6.000 5.772 5.402 5.864 . 0 0 "[ . 1 . 2]" 1 2474 2 12 ILE H 2 13 ASN HA 6.000 2.200 6.000 5.329 5.306 5.344 . 0 0 "[ . 1 . 2]" 1 2475 2 13 ASN HA 2 14 VAL MG1 6.000 2.200 6.000 4.870 4.785 4.900 . 0 0 "[ . 1 . 2]" 1 2476 2 13 ASN HA 2 14 VAL MG2 6.000 2.200 6.000 5.221 5.202 5.233 . 0 0 "[ . 1 . 2]" 1 2477 2 25 LYS HG2 2 26 TYR HD2 6.000 2.200 6.000 5.654 5.051 6.001 0.001 13 0 "[ . 1 . 2]" 1 2478 2 25 LYS HG3 2 26 TYR HD2 6.000 2.200 6.000 4.835 4.030 5.029 . 0 0 "[ . 1 . 2]" 1 2479 2 28 LEU HB2 2 74 TYR HB3 6.000 2.200 6.000 5.493 5.285 5.597 . 0 0 "[ . 1 . 2]" 1 2480 2 45 LEU MD2 2 47 ALA H 6.000 2.200 6.000 5.226 5.060 5.701 . 0 0 "[ . 1 . 2]" 1 2481 2 48 GLN HA 2 50 ASP HB2 6.000 2.200 6.000 5.409 4.937 5.684 . 0 0 "[ . 1 . 2]" 1 2482 2 49 LYS HA 2 50 ASP HB2 6.000 2.200 6.000 5.772 5.400 5.865 . 0 0 "[ . 1 . 2]" 1 2483 1 7 ALA MB 2 10 THR MG 2.900 2.200 2.900 2.224 2.151 2.316 0.049 5 0 "[ . 1 . 2]" 1 2484 1 10 THR MG 2 7 ALA MB 2.900 2.200 2.900 2.225 2.152 2.317 0.048 5 0 "[ . 1 . 2]" 1 2485 1 72 GLN HA 2 83 VAL MG1 2.900 2.200 2.900 2.863 2.790 2.909 0.009 16 0 "[ . 1 . 2]" 1 2486 1 75 VAL MG1 2 79 ALA MB 2.900 2.200 2.900 2.033 2.021 2.044 0.179 12 0 "[ . 1 . 2]" 1 2487 1 75 VAL MG1 2 80 ALA HA 2.900 2.200 2.900 2.731 2.687 2.759 . 0 0 "[ . 1 . 2]" 1 2488 1 79 ALA MB 2 75 VAL MG1 2.900 2.200 2.900 2.033 2.020 2.044 0.180 12 0 "[ . 1 . 2]" 1 2489 1 80 ALA HA 2 75 VAL MG1 2.900 2.200 2.900 2.731 2.688 2.759 . 0 0 "[ . 1 . 2]" 1 2490 1 83 VAL MG1 2 72 GLN HA 2.900 2.200 2.900 2.863 2.790 2.909 0.009 16 0 "[ . 1 . 2]" 1 2491 1 75 VAL MG2 2 83 VAL MG1 2.940 2.200 2.940 2.979 2.964 2.990 0.050 18 0 "[ . 1 . 2]" 1 2492 1 83 VAL MG1 2 75 VAL MG2 2.940 2.200 2.940 2.979 2.964 2.990 0.050 18 0 "[ . 1 . 2]" 1 2493 1 4 LEU HA 2 10 THR MG 3.020 2.200 3.020 2.525 2.350 2.695 . 0 0 "[ . 1 . 2]" 1 2494 1 10 THR MG 2 4 LEU HA 3.020 2.200 3.020 2.522 2.346 2.693 . 0 0 "[ . 1 . 2]" 1 2495 1 7 ALA MB 2 10 THR HB 3.050 2.200 3.050 2.149 2.111 2.196 0.089 3 0 "[ . 1 . 2]" 1 2496 1 10 THR HB 2 7 ALA MB 3.050 2.200 3.050 2.146 2.108 2.194 0.092 3 0 "[ . 1 . 2]" 1 2497 1 7 ALA MB 2 11 LEU QD 3.060 2.200 3.060 2.179 2.160 2.264 0.040 15 0 "[ . 1 . 2]" 1 2498 1 11 LEU MD2 2 7 ALA MB 3.060 2.200 3.060 2.180 2.159 2.273 0.041 19 0 "[ . 1 . 2]" 1 2499 1 75 VAL MG1 2 83 VAL MG1 3.120 2.200 3.120 2.540 2.496 2.585 . 0 0 "[ . 1 . 2]" 1 2500 1 83 VAL MG1 2 75 VAL MG1 3.120 2.200 3.120 2.539 2.495 2.587 . 0 0 "[ . 1 . 2]" 1 2501 1 4 LEU QD 2 14 VAL MG2 3.130 2.200 3.130 2.229 2.146 2.620 0.054 9 0 "[ . 1 . 2]" 1 2502 1 14 VAL MG2 2 4 LEU QD 3.130 2.200 3.130 2.228 2.145 2.619 0.055 9 0 "[ . 1 . 2]" 1 2503 1 8 MET ME 2 82 THR HA 3.190 2.200 3.190 2.116 2.101 2.144 0.099 9 0 "[ . 1 . 2]" 1 2504 1 82 THR HA 2 8 MET ME 3.190 2.200 3.190 2.115 2.099 2.143 0.101 9 0 "[ . 1 . 2]" 1 2505 1 75 VAL MG2 2 82 THR MG 3.220 2.200 3.220 2.938 2.855 3.032 . 0 0 "[ . 1 . 2]" 1 2506 1 82 THR MG 2 75 VAL MG2 3.220 2.200 3.220 2.938 2.855 3.032 . 0 0 "[ . 1 . 2]" 1 2507 1 4 LEU HG 2 14 VAL MG2 3.260 2.200 3.260 2.268 2.207 2.351 . 0 0 "[ . 1 . 2]" 1 2508 1 14 VAL MG2 2 4 LEU HG 3.260 2.200 3.260 2.268 2.207 2.351 . 0 0 "[ . 1 . 2]" 1 2509 1 4 LEU HB2 2 14 VAL MG1 3.270 2.200 3.270 2.656 2.464 2.743 . 0 0 "[ . 1 . 2]" 1 2510 1 14 VAL MG1 2 4 LEU HB2 3.270 2.200 3.270 2.656 2.463 2.742 . 0 0 "[ . 1 . 2]" 1 2511 1 72 GLN HA 2 83 VAL MG2 3.280 2.200 3.280 2.676 2.595 2.781 . 0 0 "[ . 1 . 2]" 1 2512 1 83 VAL MG2 2 72 GLN HA 3.280 2.200 3.280 2.676 2.596 2.781 . 0 0 "[ . 1 . 2]" 1 2513 1 3 GLU HB3 2 10 THR MG 3.290 2.200 3.290 2.307 2.160 3.311 0.040 17 0 "[ . 1 . 2]" 1 2514 1 7 ALA HA 2 7 ALA MB 3.290 2.200 3.290 2.420 2.299 2.679 . 0 0 "[ . 1 . 2]" 1 2515 1 7 ALA MB 2 7 ALA HA 3.290 2.200 3.290 2.421 2.300 2.679 . 0 0 "[ . 1 . 2]" 1 2516 1 10 THR MG 2 3 GLU HB3 3.290 2.200 3.290 2.306 2.159 3.310 0.041 12 0 "[ . 1 . 2]" 1 2517 1 82 THR MG 2 11 LEU QD 3.290 2.200 3.290 2.437 2.258 2.549 . 0 0 "[ . 1 . 2]" 1 2518 1 11 LEU MD1 2 82 THR MG 3.300 2.200 3.300 2.455 2.272 2.570 . 0 0 "[ . 1 . 2]" 1 2519 1 8 MET ME 2 78 VAL HA 3.360 2.200 3.360 3.322 3.126 3.366 0.006 16 0 "[ . 1 . 2]" 1 2520 1 78 VAL HA 2 8 MET ME 3.360 2.200 3.360 3.322 3.127 3.365 0.005 16 0 "[ . 1 . 2]" 1 2521 1 4 LEU QD 2 37 LEU MD1 3.370 2.200 3.370 3.376 3.226 3.428 0.058 5 0 "[ . 1 . 2]" 1 2522 1 37 LEU MD1 2 4 LEU QD 3.370 2.200 3.370 3.376 3.225 3.428 0.058 5 0 "[ . 1 . 2]" 1 2523 1 12 ILE MD 2 82 THR MG 3.390 2.200 3.390 2.615 2.465 2.724 . 0 0 "[ . 1 . 2]" 1 2524 1 82 THR MG 2 12 ILE MD 3.390 2.200 3.390 2.615 2.466 2.722 . 0 0 "[ . 1 . 2]" 1 2525 1 4 LEU QD 2 78 VAL MG2 3.410 2.200 3.410 3.313 2.870 3.426 0.016 10 0 "[ . 1 . 2]" 1 2526 1 78 VAL MG2 2 4 LEU QD 3.410 2.200 3.410 3.312 2.871 3.425 0.015 15 0 "[ . 1 . 2]" 1 2527 1 4 LEU HA 2 14 VAL MG1 3.420 2.200 3.420 3.280 3.075 3.420 0.000 17 0 "[ . 1 . 2]" 1 2528 1 14 VAL MG1 2 4 LEU HA 3.420 2.200 3.420 3.281 3.076 3.422 0.002 17 0 "[ . 1 . 2]" 1 2529 1 72 GLN HG3 2 83 VAL MG2 3.490 2.200 3.490 2.257 2.227 2.276 . 0 0 "[ . 1 . 2]" 1 2530 1 75 VAL MG2 2 83 VAL HA 3.490 2.200 3.490 3.443 3.392 3.491 0.001 4 0 "[ . 1 . 2]" 1 2531 1 83 VAL HA 2 75 VAL MG2 3.490 2.200 3.490 3.443 3.393 3.490 . 0 0 "[ . 1 . 2]" 1 2532 1 83 VAL MG2 2 72 GLN HG3 3.490 2.200 3.490 2.258 2.228 2.278 . 0 0 "[ . 1 . 2]" 1 2533 1 4 LEU QD 2 41 LEU HG 3.540 2.200 3.540 2.755 2.551 3.171 . 0 0 "[ . 1 . 2]" 1 2534 1 41 LEU HG 2 4 LEU QD 3.540 2.200 3.540 2.755 2.551 3.171 . 0 0 "[ . 1 . 2]" 1 2535 1 75 VAL MG1 2 79 ALA HA 3.550 2.200 3.550 3.550 3.528 3.562 0.012 4 0 "[ . 1 . 2]" 1 2536 1 79 ALA HA 2 75 VAL MG1 3.550 2.200 3.550 3.550 3.527 3.562 0.012 4 0 "[ . 1 . 2]" 1 2537 1 4 LEU MD1 2 14 VAL MG2 3.560 2.200 3.560 2.253 2.162 2.695 0.038 9 0 "[ . 1 . 2]" 1 2538 1 4 LEU MD2 2 14 VAL MG2 3.560 2.200 3.560 3.650 3.574 3.713 0.153 1 0 "[ . 1 . 2]" 1 2539 1 14 VAL MG2 2 4 LEU MD1 3.560 2.200 3.560 2.252 2.161 2.694 0.039 9 0 "[ . 1 . 2]" 1 2540 1 14 VAL MG2 2 4 LEU MD2 3.560 2.200 3.560 3.650 3.574 3.713 0.153 1 0 "[ . 1 . 2]" 1 2541 1 72 GLN HG2 2 83 VAL MG1 3.570 2.200 3.570 2.166 2.162 2.174 0.038 16 0 "[ . 1 . 2]" 1 2542 1 83 VAL MG1 2 72 GLN HG2 3.570 2.200 3.570 2.166 2.163 2.173 0.037 16 0 "[ . 1 . 2]" 1 2543 1 4 LEU QD 2 36 LEU QD 3.590 2.200 3.590 2.227 2.132 2.353 0.068 14 0 "[ . 1 . 2]" 1 2544 1 36 LEU QD 2 4 LEU QD 3.590 2.200 3.590 2.226 2.134 2.350 0.066 14 0 "[ . 1 . 2]" 1 2545 1 4 LEU QD 2 40 GLU HB3 3.630 2.200 3.630 2.633 2.409 3.275 . 0 0 "[ . 1 . 2]" 1 2546 1 4 LEU QD 2 41 LEU MD1 3.630 2.200 3.630 2.690 2.355 2.974 . 0 0 "[ . 1 . 2]" 1 2547 1 8 MET HA 2 82 THR MG 3.630 2.200 3.630 2.430 2.254 2.736 . 0 0 "[ . 1 . 2]" 1 2548 1 40 GLU HB3 2 4 LEU QD 3.630 2.200 3.630 2.633 2.409 3.275 . 0 0 "[ . 1 . 2]" 1 2549 1 41 LEU MD1 2 4 LEU QD 3.630 2.200 3.630 2.690 2.355 2.974 . 0 0 "[ . 1 . 2]" 1 2550 1 82 THR MG 2 8 MET HA 3.630 2.200 3.630 2.431 2.255 2.736 . 0 0 "[ . 1 . 2]" 1 2551 1 5 GLU QG 2 41 LEU MD2 3.640 2.200 3.640 2.290 2.083 2.687 0.117 19 0 "[ . 1 . 2]" 1 2552 1 41 LEU MD2 2 5 GLU QG 3.640 2.200 3.640 2.289 2.082 2.686 0.118 19 0 "[ . 1 . 2]" 1 2553 1 72 GLN HG3 2 83 VAL MG1 3.650 2.200 3.650 3.514 3.486 3.542 . 0 0 "[ . 1 . 2]" 1 2554 1 83 VAL MG1 2 72 GLN HG3 3.650 2.200 3.650 3.514 3.486 3.541 . 0 0 "[ . 1 . 2]" 1 2555 1 75 VAL MG2 2 82 THR HB 3.670 2.200 3.670 2.461 2.394 2.501 . 0 0 "[ . 1 . 2]" 1 2556 1 82 THR HB 2 75 VAL MG2 3.670 2.200 3.670 2.461 2.395 2.500 . 0 0 "[ . 1 . 2]" 1 2557 1 12 ILE MD 2 85 CYS HB3 3.690 2.200 3.690 2.505 2.427 2.557 . 0 0 "[ . 1 . 2]" 1 2558 1 85 CYS HB3 2 12 ILE MD 3.690 2.200 3.690 2.505 2.427 2.557 . 0 0 "[ . 1 . 2]" 1 2559 1 4 LEU QD 2 14 VAL HB 3.710 2.200 3.710 3.251 2.989 3.733 0.023 14 0 "[ . 1 . 2]" 1 2560 1 14 VAL HB 2 4 LEU QD 3.710 2.200 3.710 3.251 2.988 3.735 0.025 14 0 "[ . 1 . 2]" 1 2561 1 3 GLU HB3 2 14 VAL MG1 3.750 2.200 3.750 3.724 3.137 3.804 0.054 12 0 "[ . 1 . 2]" 1 2562 1 14 VAL MG1 2 3 GLU HB3 3.750 2.200 3.750 3.724 3.137 3.805 0.055 12 0 "[ . 1 . 2]" 1 2563 1 4 LEU HB2 2 40 GLU HB3 3.760 2.200 3.760 2.339 2.240 2.732 . 0 0 "[ . 1 . 2]" 1 2564 1 40 GLU HB3 2 4 LEU HB2 3.760 2.200 3.760 2.339 2.239 2.732 . 0 0 "[ . 1 . 2]" 1 2565 1 3 GLU QG 2 10 THR MG 3.790 2.200 3.790 3.680 2.107 3.873 0.093 9 0 "[ . 1 . 2]" 1 2566 1 10 THR MG 2 3 GLU QG 3.790 2.200 3.790 3.679 2.105 3.871 0.095 9 0 "[ . 1 . 2]" 1 2567 1 4 LEU QD 2 78 VAL HB 3.830 2.200 3.830 2.689 2.313 2.937 . 0 0 "[ . 1 . 2]" 1 2568 1 76 VAL HA 2 79 ALA MB 3.830 2.200 3.830 3.185 3.126 3.261 . 0 0 "[ . 1 . 2]" 1 2569 1 78 VAL HB 2 4 LEU QD 3.830 2.200 3.830 2.688 2.314 2.936 . 0 0 "[ . 1 . 2]" 1 2570 1 79 ALA MB 2 76 VAL HA 3.830 2.200 3.830 3.184 3.126 3.259 . 0 0 "[ . 1 . 2]" 1 2571 1 75 VAL HB 2 83 VAL MG1 3.840 2.200 3.840 3.653 3.600 3.702 . 0 0 "[ . 1 . 2]" 1 2572 1 83 VAL MG1 2 75 VAL HB 3.840 2.200 3.840 3.652 3.599 3.701 . 0 0 "[ . 1 . 2]" 1 2573 1 4 LEU QD 2 11 LEU HA 3.870 2.200 3.870 3.805 3.527 3.920 0.050 16 0 "[ . 1 . 2]" 1 2574 1 4 LEU QD 2 40 GLU HB2 3.870 2.200 3.870 2.727 2.382 3.257 . 0 0 "[ . 1 . 2]" 1 2575 1 11 LEU HA 2 4 LEU QD 3.870 2.200 3.870 3.805 3.527 3.920 0.050 16 0 "[ . 1 . 2]" 1 2576 1 12 ILE MD 2 86 ASN HA 3.870 2.200 3.870 3.133 3.031 3.266 . 0 0 "[ . 1 . 2]" 1 2577 1 40 GLU HB2 2 4 LEU QD 3.870 2.200 3.870 2.727 2.381 3.258 . 0 0 "[ . 1 . 2]" 1 2578 1 86 ASN HA 2 12 ILE MD 3.870 2.200 3.870 3.133 3.031 3.266 . 0 0 "[ . 1 . 2]" 1 2579 1 71 PHE HZ 2 82 THR MG 3.880 2.200 3.880 3.394 3.288 3.499 . 0 0 "[ . 1 . 2]" 1 2580 1 82 THR MG 2 71 PHE HZ 3.880 2.200 3.880 3.394 3.288 3.498 . 0 0 "[ . 1 . 2]" 1 2581 1 71 PHE HE2 2 83 VAL HA 3.890 2.200 3.890 3.907 3.896 3.921 0.031 20 0 "[ . 1 . 2]" 1 2582 1 83 VAL HA 2 71 PHE HE2 3.890 2.200 3.890 3.906 3.895 3.920 0.030 20 0 "[ . 1 . 2]" 1 2583 1 75 VAL MG1 2 80 ALA H 3.930 2.200 3.930 3.694 3.663 3.714 . 0 0 "[ . 1 . 2]" 1 2584 1 80 ALA H 2 75 VAL MG1 3.930 2.200 3.930 3.694 3.664 3.715 . 0 0 "[ . 1 . 2]" 1 2585 1 75 VAL MG2 2 83 VAL MG2 3.940 2.200 3.940 3.573 3.555 3.591 . 0 0 "[ . 1 . 2]" 1 2586 1 83 VAL MG2 2 75 VAL MG2 3.940 2.200 3.940 3.573 3.556 3.590 . 0 0 "[ . 1 . 2]" 1 2587 1 75 VAL MG2 2 83 VAL H 3.960 2.200 3.960 2.430 2.394 2.473 . 0 0 "[ . 1 . 2]" 1 2588 1 83 VAL H 2 75 VAL MG2 3.960 2.200 3.960 2.429 2.393 2.472 . 0 0 "[ . 1 . 2]" 1 2589 1 12 ILE MD 2 85 CYS HB2 3.980 2.200 3.980 3.978 3.913 4.000 0.020 16 0 "[ . 1 . 2]" 1 2590 1 71 PHE HE1 2 82 THR MG 3.980 2.200 3.980 3.466 3.370 3.580 . 0 0 "[ . 1 . 2]" 1 2591 1 82 THR MG 2 71 PHE HE1 3.980 2.200 3.980 3.466 3.371 3.580 . 0 0 "[ . 1 . 2]" 1 2592 1 85 CYS HB2 2 12 ILE MD 3.980 2.200 3.980 3.978 3.912 4.000 0.020 16 0 "[ . 1 . 2]" 1 2593 1 4 LEU HB2 2 40 GLU HG3 4.000 2.200 4.000 2.525 2.307 2.679 . 0 0 "[ . 1 . 2]" 1 2594 1 12 ILE H 2 82 THR MG 4.000 2.200 4.000 3.241 3.189 3.301 . 0 0 "[ . 1 . 2]" 1 2595 1 12 ILE HA 2 82 THR MG 4.000 2.200 4.000 3.848 3.791 3.894 . 0 0 "[ . 1 . 2]" 1 2596 1 12 ILE MD 2 82 THR HA 4.000 2.200 4.000 3.581 3.422 3.721 . 0 0 "[ . 1 . 2]" 1 2597 1 40 GLU HG3 2 4 LEU HB2 4.000 2.200 4.000 2.525 2.308 2.677 . 0 0 "[ . 1 . 2]" 1 2598 1 82 THR HA 2 12 ILE MD 4.000 2.200 4.000 3.581 3.423 3.722 . 0 0 "[ . 1 . 2]" 1 2599 1 82 THR MG 2 12 ILE H 4.000 2.200 4.000 3.241 3.189 3.301 . 0 0 "[ . 1 . 2]" 1 2600 1 82 THR MG 2 12 ILE HA 4.000 2.200 4.000 3.847 3.789 3.893 . 0 0 "[ . 1 . 2]" 1 2601 1 4 LEU QD 2 10 THR MG 4.020 2.200 4.020 3.956 3.802 4.052 0.032 10 0 "[ . 1 . 2]" 1 2602 1 10 THR MG 2 4 LEU QD 4.020 2.200 4.020 3.954 3.801 4.051 0.031 10 0 "[ . 1 . 2]" 1 2603 1 76 VAL MG1 2 79 ALA MB 4.030 2.200 4.030 3.385 3.305 3.494 . 0 0 "[ . 1 . 2]" 1 2604 1 79 ALA MB 2 76 VAL MG1 4.030 2.200 4.030 3.385 3.305 3.492 . 0 0 "[ . 1 . 2]" 1 2605 1 75 VAL MG1 2 82 THR HB 4.040 2.200 4.040 4.055 4.041 4.072 0.032 3 0 "[ . 1 . 2]" 1 2606 1 82 THR HB 2 75 VAL MG1 4.040 2.200 4.040 4.056 4.041 4.071 0.031 3 0 "[ . 1 . 2]" 1 2607 1 71 PHE HB2 2 83 VAL MG2 4.060 2.200 4.060 3.816 3.725 3.878 . 0 0 "[ . 1 . 2]" 1 2608 1 83 VAL MG2 2 71 PHE HB2 4.060 2.200 4.060 3.816 3.726 3.878 . 0 0 "[ . 1 . 2]" 1 2609 1 8 MET ME 2 78 VAL MG1 4.070 2.200 4.070 4.067 3.948 4.103 0.033 20 0 "[ . 1 . 2]" 1 2610 1 72 GLN HG2 2 83 VAL MG2 4.070 2.200 4.070 2.193 2.177 2.263 0.023 9 0 "[ . 1 . 2]" 1 2611 1 78 VAL MG1 2 8 MET ME 4.070 2.200 4.070 4.067 3.948 4.105 0.035 20 0 "[ . 1 . 2]" 1 2612 1 83 VAL MG2 2 72 GLN HG2 4.070 2.200 4.070 2.193 2.178 2.263 0.022 9 0 "[ . 1 . 2]" 1 2613 1 8 MET ME 2 82 THR MG 4.080 2.200 4.080 3.018 2.780 3.135 . 0 0 "[ . 1 . 2]" 1 2614 1 82 THR MG 2 8 MET ME 4.080 2.200 4.080 3.019 2.780 3.135 . 0 0 "[ . 1 . 2]" 1 2615 1 4 LEU H 2 14 VAL MG1 4.120 2.200 4.120 3.336 3.032 3.529 . 0 0 "[ . 1 . 2]" 1 2616 1 12 ILE MD 2 86 ASN HB3 4.120 2.200 4.120 4.040 3.929 4.128 0.008 13 0 "[ . 1 . 2]" 1 2617 1 14 VAL MG1 2 4 LEU H 4.120 2.200 4.120 3.335 3.032 3.529 . 0 0 "[ . 1 . 2]" 1 2618 1 86 ASN HB3 2 12 ILE MD 4.120 2.200 4.120 4.039 3.929 4.129 0.009 13 0 "[ . 1 . 2]" 1 2619 1 71 PHE HD1 2 83 VAL MG2 4.130 2.200 4.130 3.665 3.596 3.730 . 0 0 "[ . 1 . 2]" 1 2620 1 83 VAL MG2 2 71 PHE HD1 4.130 2.200 4.130 3.665 3.595 3.729 . 0 0 "[ . 1 . 2]" 1 2621 1 12 ILE HG13 2 82 THR MG 4.150 2.200 4.150 2.162 2.131 2.178 0.069 17 0 "[ . 1 . 2]" 1 2622 1 82 THR MG 2 12 ILE HG13 4.150 2.200 4.150 2.162 2.130 2.177 0.070 17 0 "[ . 1 . 2]" 1 2623 1 72 GLN HE21 2 83 VAL MG2 4.180 2.200 4.180 2.843 2.832 2.858 . 0 0 "[ . 1 . 2]" 1 2624 1 75 VAL MG2 2 79 ALA MB 4.180 2.200 4.180 2.622 2.564 2.700 . 0 0 "[ . 1 . 2]" 1 2625 1 76 VAL MG1 2 80 ALA MB 4.180 2.200 4.180 4.247 4.229 4.261 0.081 16 0 "[ . 1 . 2]" 1 2626 1 79 ALA MB 2 75 VAL MG2 4.180 2.200 4.180 2.622 2.563 2.701 . 0 0 "[ . 1 . 2]" 1 2627 1 80 ALA MB 2 76 VAL MG1 4.180 2.200 4.180 4.246 4.229 4.261 0.081 16 0 "[ . 1 . 2]" 1 2628 1 83 VAL MG2 2 72 GLN HE21 4.180 2.200 4.180 2.843 2.831 2.858 . 0 0 "[ . 1 . 2]" 1 2629 1 82 THR HB 2 11 LEU QD 4.200 2.200 4.200 3.476 3.167 3.744 . 0 0 "[ . 1 . 2]" 1 2630 1 7 ALA MB 2 11 LEU H 4.210 2.200 4.210 3.500 3.431 3.707 . 0 0 "[ . 1 . 2]" 1 2631 1 11 LEU H 2 7 ALA MB 4.210 2.200 4.210 3.500 3.430 3.706 . 0 0 "[ . 1 . 2]" 1 2632 1 75 VAL MG1 2 80 ALA MB 4.210 2.200 4.210 3.722 3.691 3.750 . 0 0 "[ . 1 . 2]" 1 2633 1 80 ALA MB 2 75 VAL MG1 4.210 2.200 4.210 3.722 3.691 3.750 . 0 0 "[ . 1 . 2]" 1 2634 1 11 LEU MD1 2 82 THR HB 4.220 2.200 4.220 3.499 3.182 3.776 . 0 0 "[ . 1 . 2]" 1 2635 1 7 ALA MB 2 10 THR H 4.230 2.200 4.230 4.042 3.954 4.199 . 0 0 "[ . 1 . 2]" 1 2636 1 10 THR H 2 7 ALA MB 4.230 2.200 4.230 4.013 3.922 4.177 . 0 0 "[ . 1 . 2]" 1 2637 1 72 GLN HE22 2 83 VAL MG2 4.230 2.200 4.230 4.284 4.278 4.288 0.058 14 0 "[ . 1 . 2]" 1 2638 1 83 VAL MG2 2 72 GLN HE22 4.230 2.200 4.230 4.284 4.279 4.288 0.058 16 0 "[ . 1 . 2]" 1 2639 1 5 GLU HB2 2 41 LEU MD2 4.240 2.200 4.240 3.424 2.182 4.282 0.042 1 0 "[ . 1 . 2]" 1 2640 1 41 LEU MD2 2 5 GLU HB2 4.240 2.200 4.240 3.423 2.181 4.280 0.040 1 0 "[ . 1 . 2]" 1 2641 1 4 LEU HB3 2 14 VAL MG1 4.250 2.200 4.250 4.214 4.066 4.274 0.024 14 0 "[ . 1 . 2]" 1 2642 1 14 VAL MG1 2 4 LEU HB3 4.250 2.200 4.250 4.213 4.065 4.275 0.025 14 0 "[ . 1 . 2]" 1 2643 1 12 ILE MG 2 86 ASN HB3 4.260 2.200 4.260 3.842 3.643 3.977 . 0 0 "[ . 1 . 2]" 1 2644 1 72 GLN HB2 2 83 VAL MG2 4.260 2.200 4.260 4.095 4.047 4.153 . 0 0 "[ . 1 . 2]" 1 2645 1 83 VAL MG2 2 72 GLN HB2 4.260 2.200 4.260 4.096 4.047 4.155 . 0 0 "[ . 1 . 2]" 1 2646 1 86 ASN HB3 2 12 ILE MG 4.260 2.200 4.260 3.841 3.642 3.977 . 0 0 "[ . 1 . 2]" 1 2647 1 72 GLN HA 2 83 VAL HB 4.280 2.200 4.280 3.111 3.068 3.196 . 0 0 "[ . 1 . 2]" 1 2648 1 83 VAL HB 2 72 GLN HA 4.280 2.200 4.280 3.111 3.068 3.198 . 0 0 "[ . 1 . 2]" 1 2649 1 12 ILE MD 2 86 ASN HB2 4.290 2.200 4.290 2.630 2.494 2.723 . 0 0 "[ . 1 . 2]" 1 2650 1 12 ILE MG 2 86 ASN HB2 4.290 2.200 4.290 2.652 2.463 2.785 . 0 0 "[ . 1 . 2]" 1 2651 1 86 ASN HB2 2 12 ILE MD 4.290 2.200 4.290 2.630 2.493 2.722 . 0 0 "[ . 1 . 2]" 1 2652 1 86 ASN HB2 2 12 ILE MG 4.290 2.200 4.290 2.651 2.462 2.785 . 0 0 "[ . 1 . 2]" 1 2653 1 75 VAL MG1 2 83 VAL H 4.300 2.200 4.300 3.480 3.457 3.517 . 0 0 "[ . 1 . 2]" 1 2654 1 83 VAL H 2 75 VAL MG1 4.300 2.200 4.300 3.479 3.457 3.517 . 0 0 "[ . 1 . 2]" 1 2655 1 4 LEU HB3 2 40 GLU HB3 4.340 2.200 4.340 2.197 2.162 2.229 0.038 4 0 "[ . 1 . 2]" 1 2656 1 40 GLU HB3 2 4 LEU HB3 4.340 2.200 4.340 2.197 2.162 2.230 0.038 4 0 "[ . 1 . 2]" 1 2657 1 8 MET HG3 2 11 LEU QD 4.360 2.200 4.360 3.415 3.292 3.667 . 0 0 "[ . 1 . 2]" 1 2658 1 71 PHE HE2 2 83 VAL MG2 4.370 2.200 4.370 3.834 3.735 3.877 . 0 0 "[ . 1 . 2]" 1 2659 1 83 VAL MG2 2 71 PHE HE2 4.370 2.200 4.370 3.833 3.735 3.878 . 0 0 "[ . 1 . 2]" 1 2660 1 11 LEU MD2 2 8 MET HG3 4.380 2.200 4.380 3.488 3.361 3.754 . 0 0 "[ . 1 . 2]" 1 2661 1 5 GLU QG 2 44 PHE HD2 4.390 2.200 4.390 4.267 3.972 4.446 0.056 14 0 "[ . 1 . 2]" 1 2662 1 44 PHE HD2 2 5 GLU QG 4.390 2.200 4.390 4.267 3.971 4.446 0.056 14 0 "[ . 1 . 2]" 1 2663 1 8 MET HG2 2 11 LEU QD 4.430 2.200 4.430 3.647 3.522 3.846 . 0 0 "[ . 1 . 2]" 1 2664 1 8 MET H 2 11 LEU QD 4.440 2.200 4.440 3.926 3.812 4.082 . 0 0 "[ . 1 . 2]" 1 2665 1 8 MET HG3 2 78 VAL MG1 4.440 2.200 4.440 4.534 4.505 4.552 0.112 17 0 "[ . 1 . 2]" 1 2666 1 12 ILE MG 2 86 ASN HA 4.440 2.200 4.440 3.511 3.416 3.620 . 0 0 "[ . 1 . 2]" 1 2667 1 78 VAL MG1 2 8 MET HG3 4.440 2.200 4.440 4.535 4.505 4.553 0.113 12 0 "[ . 1 . 2]" 1 2668 1 86 ASN HA 2 12 ILE MG 4.440 2.200 4.440 3.510 3.415 3.620 . 0 0 "[ . 1 . 2]" 1 2669 1 4 LEU QD 2 74 TYR HE1 4.450 2.200 4.450 3.843 2.698 4.153 . 0 0 "[ . 1 . 2]" 1 2670 1 11 LEU MD2 2 8 MET HG2 4.450 2.200 4.450 3.814 3.696 4.027 . 0 0 "[ . 1 . 2]" 1 2671 1 71 PHE HE2 2 86 ASN HB2 4.450 2.200 4.450 2.729 2.627 2.950 . 0 0 "[ . 1 . 2]" 1 2672 1 74 TYR HE1 2 4 LEU QD 4.450 2.200 4.450 3.842 2.700 4.151 . 0 0 "[ . 1 . 2]" 1 2673 1 86 ASN HB2 2 71 PHE HE2 4.450 2.200 4.450 2.729 2.626 2.949 . 0 0 "[ . 1 . 2]" 1 2674 1 11 LEU MD2 2 8 MET H 4.460 2.200 4.460 4.011 3.896 4.177 . 0 0 "[ . 1 . 2]" 1 2675 1 8 MET HG2 2 78 VAL MG1 4.470 2.200 4.470 4.436 4.374 4.492 0.022 16 0 "[ . 1 . 2]" 1 2676 1 78 VAL MG1 2 8 MET HG2 4.470 2.200 4.470 4.437 4.374 4.491 0.021 16 0 "[ . 1 . 2]" 1 2677 1 12 ILE HG12 2 83 VAL HA 4.490 2.200 4.490 4.252 4.135 4.302 . 0 0 "[ . 1 . 2]" 1 2678 1 83 VAL HA 2 12 ILE HG12 4.490 2.200 4.490 4.251 4.133 4.302 . 0 0 "[ . 1 . 2]" 1 2679 1 75 VAL MG2 2 79 ALA HA 4.500 2.200 4.500 2.925 2.840 2.992 . 0 0 "[ . 1 . 2]" 1 2680 1 79 ALA HA 2 75 VAL MG2 4.500 2.200 4.500 2.925 2.840 2.993 . 0 0 "[ . 1 . 2]" 1 2681 1 4 LEU HB2 2 14 VAL HB 4.510 2.200 4.510 3.968 3.717 4.224 . 0 0 "[ . 1 . 2]" 1 2682 1 12 ILE MD 2 85 CYS H 4.510 2.200 4.510 4.533 4.514 4.555 0.045 10 0 "[ . 1 . 2]" 1 2683 1 14 VAL HB 2 4 LEU HB2 4.510 2.200 4.510 3.968 3.717 4.226 . 0 0 "[ . 1 . 2]" 1 2684 1 85 CYS H 2 12 ILE MD 4.510 2.200 4.510 4.534 4.514 4.555 0.045 10 0 "[ . 1 . 2]" 1 2685 1 71 PHE HE2 2 86 ASN HB3 4.520 2.200 4.520 2.273 2.246 2.314 . 0 0 "[ . 1 . 2]" 1 2686 1 86 ASN HB3 2 71 PHE HE2 4.520 2.200 4.520 2.273 2.246 2.313 . 0 0 "[ . 1 . 2]" 1 2687 1 5 GLU QG 2 41 LEU HA 4.530 2.200 4.530 3.755 3.290 4.175 . 0 0 "[ . 1 . 2]" 1 2688 1 8 MET HB3 2 82 THR MG 4.530 2.200 4.530 2.596 2.460 2.702 . 0 0 "[ . 1 . 2]" 1 2689 1 12 ILE HB 2 82 THR MG 4.530 2.200 4.530 4.221 4.163 4.254 . 0 0 "[ . 1 . 2]" 1 2690 1 41 LEU HA 2 5 GLU QG 4.530 2.200 4.530 3.754 3.288 4.174 . 0 0 "[ . 1 . 2]" 1 2691 1 75 VAL HA 2 79 ALA MB 4.530 2.200 4.530 3.680 3.612 3.722 . 0 0 "[ . 1 . 2]" 1 2692 1 79 ALA MB 2 75 VAL HA 4.530 2.200 4.530 3.680 3.611 3.722 . 0 0 "[ . 1 . 2]" 1 2693 1 82 THR MG 2 8 MET HB3 4.530 2.200 4.530 2.597 2.459 2.702 . 0 0 "[ . 1 . 2]" 1 2694 1 82 THR MG 2 12 ILE HB 4.530 2.200 4.530 4.220 4.163 4.253 . 0 0 "[ . 1 . 2]" 1 2695 1 8 MET ME 2 82 THR HB 4.540 2.200 4.540 3.700 3.675 3.724 . 0 0 "[ . 1 . 2]" 1 2696 1 82 THR HB 2 8 MET ME 4.540 2.200 4.540 3.700 3.674 3.723 . 0 0 "[ . 1 . 2]" 1 2697 1 8 MET ME 2 85 CYS HB2 4.550 2.200 4.550 3.031 2.926 3.194 . 0 0 "[ . 1 . 2]" 1 2698 1 85 CYS HB2 2 8 MET ME 4.550 2.200 4.550 3.031 2.926 3.195 . 0 0 "[ . 1 . 2]" 1 2699 1 75 VAL HB 2 83 VAL MG2 4.570 2.200 4.570 3.686 3.629 3.731 . 0 0 "[ . 1 . 2]" 1 2700 1 83 VAL MG2 2 75 VAL HB 4.570 2.200 4.570 3.685 3.629 3.731 . 0 0 "[ . 1 . 2]" 1 2701 1 7 ALA H 2 10 THR MG 4.580 2.200 4.580 3.258 3.170 3.373 . 0 0 "[ . 1 . 2]" 1 2702 1 10 THR MG 2 7 ALA H 4.580 2.200 4.580 3.258 3.170 3.372 . 0 0 "[ . 1 . 2]" 1 2703 1 4 LEU QD 2 14 VAL MG1 4.590 2.200 4.590 3.191 3.050 3.379 . 0 0 "[ . 1 . 2]" 1 2704 1 14 VAL MG1 2 4 LEU QD 4.590 2.200 4.590 3.191 3.049 3.379 . 0 0 "[ . 1 . 2]" 1 2705 1 71 PHE HZ 2 83 VAL HA 4.590 2.200 4.590 3.632 3.535 3.677 . 0 0 "[ . 1 . 2]" 1 2706 1 75 VAL HB 2 83 VAL HB 4.590 2.200 4.590 2.867 2.814 2.930 . 0 0 "[ . 1 . 2]" 1 2707 1 83 VAL HA 2 71 PHE HZ 4.590 2.200 4.590 3.631 3.533 3.677 . 0 0 "[ . 1 . 2]" 1 2708 1 83 VAL HB 2 75 VAL HB 4.590 2.200 4.590 2.867 2.814 2.930 . 0 0 "[ . 1 . 2]" 1 2709 1 71 PHE HD1 2 83 VAL HB 4.610 2.200 4.610 3.928 3.881 3.968 . 0 0 "[ . 1 . 2]" 1 2710 1 83 VAL HB 2 71 PHE HD1 4.610 2.200 4.610 3.928 3.878 3.970 . 0 0 "[ . 1 . 2]" 1 2711 1 4 LEU HA 2 10 THR HB 4.660 2.200 4.660 4.244 3.943 4.471 . 0 0 "[ . 1 . 2]" 1 2712 1 4 LEU HG 2 14 VAL MG1 4.660 2.200 4.660 3.353 3.060 3.513 . 0 0 "[ . 1 . 2]" 1 2713 1 10 THR HB 2 4 LEU HA 4.660 2.200 4.660 4.237 3.935 4.466 . 0 0 "[ . 1 . 2]" 1 2714 1 14 VAL MG1 2 4 LEU HG 4.660 2.200 4.660 3.353 3.060 3.513 . 0 0 "[ . 1 . 2]" 1 2715 1 75 VAL MG2 2 83 VAL HB 4.700 2.200 4.700 2.191 2.185 2.199 0.015 6 0 "[ . 1 . 2]" 1 2716 1 83 VAL HB 2 75 VAL MG2 4.700 2.200 4.700 2.190 2.185 2.198 0.015 8 0 "[ . 1 . 2]" 1 2717 1 75 VAL MG1 2 83 VAL HB 4.710 2.200 4.710 2.896 2.857 2.942 . 0 0 "[ . 1 . 2]" 1 2718 1 83 VAL HB 2 75 VAL MG1 4.710 2.200 4.710 2.896 2.857 2.942 . 0 0 "[ . 1 . 2]" 1 2719 1 71 PHE HD1 2 83 VAL HA 4.730 2.200 4.730 4.750 4.736 4.766 0.036 14 0 "[ . 1 . 2]" 1 2720 1 83 VAL HA 2 71 PHE HD1 4.730 2.200 4.730 4.750 4.737 4.767 0.037 14 0 "[ . 1 . 2]" 1 2721 1 4 LEU H 2 40 GLU HB3 4.750 2.200 4.750 3.383 2.978 3.536 . 0 0 "[ . 1 . 2]" 1 2722 1 40 GLU HB3 2 4 LEU H 4.750 2.200 4.750 3.382 2.976 3.533 . 0 0 "[ . 1 . 2]" 1 2723 1 75 VAL MG2 2 80 ALA HA 4.750 2.200 4.750 3.828 3.768 3.881 . 0 0 "[ . 1 . 2]" 1 2724 1 80 ALA HA 2 75 VAL MG2 4.750 2.200 4.750 3.828 3.769 3.879 . 0 0 "[ . 1 . 2]" 1 2725 1 5 GLU QG 2 42 SER H 4.780 2.200 4.780 4.644 4.485 4.761 . 0 0 "[ . 1 . 2]" 1 2726 1 42 SER H 2 5 GLU QG 4.780 2.200 4.780 4.643 4.485 4.761 . 0 0 "[ . 1 . 2]" 1 2727 1 12 ILE MG 2 82 THR MG 4.790 2.200 4.790 4.199 4.085 4.239 . 0 0 "[ . 1 . 2]" 1 2728 1 82 THR MG 2 12 ILE MG 4.790 2.200 4.790 4.199 4.084 4.241 . 0 0 "[ . 1 . 2]" 1 2729 1 8 MET HB2 2 82 THR MG 4.800 2.200 4.800 3.985 3.861 4.075 . 0 0 "[ . 1 . 2]" 1 2730 1 72 GLN H 2 83 VAL MG1 4.800 2.200 4.800 4.676 4.646 4.711 . 0 0 "[ . 1 . 2]" 1 2731 1 82 THR MG 2 8 MET HB2 4.800 2.200 4.800 3.986 3.860 4.079 . 0 0 "[ . 1 . 2]" 1 2732 1 83 VAL MG1 2 72 GLN H 4.800 2.200 4.800 4.676 4.645 4.711 . 0 0 "[ . 1 . 2]" 1 2733 1 8 MET ME 2 78 VAL MG2 4.830 2.200 4.830 4.530 4.432 4.591 . 0 0 "[ . 1 . 2]" 1 2734 1 78 VAL MG2 2 8 MET ME 4.830 2.200 4.830 4.530 4.431 4.591 . 0 0 "[ . 1 . 2]" 1 2735 1 71 PHE HE2 2 87 ASN H 4.920 2.200 4.920 4.751 4.661 4.868 . 0 0 "[ . 1 . 2]" 1 2736 1 87 ASN H 2 71 PHE HE2 4.920 2.200 4.920 4.750 4.660 4.867 . 0 0 "[ . 1 . 2]" 1 2737 1 75 VAL HB 2 83 VAL H 4.960 2.200 4.960 4.709 4.673 4.744 . 0 0 "[ . 1 . 2]" 1 2738 1 83 VAL H 2 75 VAL HB 4.960 2.200 4.960 4.710 4.673 4.744 . 0 0 "[ . 1 . 2]" 1 2739 1 4 LEU HG 2 40 GLU HB3 4.970 2.200 4.970 4.409 4.250 4.908 . 0 0 "[ . 1 . 2]" 1 2740 1 40 GLU HB3 2 4 LEU HG 4.970 2.200 4.970 4.409 4.248 4.907 . 0 0 "[ . 1 . 2]" 1 2741 1 4 LEU H 2 14 VAL MG2 4.990 2.200 4.990 4.694 4.326 5.030 0.040 16 0 "[ . 1 . 2]" 1 2742 1 14 VAL MG2 2 4 LEU H 4.990 2.200 4.990 4.694 4.327 5.030 0.040 16 0 "[ . 1 . 2]" 1 2743 1 8 MET ME 2 85 CYS HB3 5.000 2.200 5.000 3.542 3.434 3.694 . 0 0 "[ . 1 . 2]" 1 2744 1 85 CYS HB3 2 8 MET ME 5.000 2.200 5.000 3.543 3.435 3.695 . 0 0 "[ . 1 . 2]" 1 2745 1 75 VAL MG1 2 83 VAL MG2 5.020 2.200 5.020 3.862 3.824 3.899 . 0 0 "[ . 1 . 2]" 1 2746 1 83 VAL MG2 2 75 VAL MG1 5.020 2.200 5.020 3.862 3.824 3.898 . 0 0 "[ . 1 . 2]" 1 2747 1 7 ALA MB 2 11 LEU HA 5.060 2.200 5.060 4.206 4.137 4.325 . 0 0 "[ . 1 . 2]" 1 2748 1 11 LEU HA 2 7 ALA MB 5.060 2.200 5.060 4.209 4.138 4.328 . 0 0 "[ . 1 . 2]" 1 2749 1 75 VAL HB 2 79 ALA MB 5.060 2.200 5.060 4.386 4.341 4.409 . 0 0 "[ . 1 . 2]" 1 2750 1 79 ALA MB 2 75 VAL HB 5.060 2.200 5.060 4.386 4.341 4.410 . 0 0 "[ . 1 . 2]" 1 2751 1 72 GLN HA 2 80 ALA HA 5.080 2.200 5.080 5.139 5.124 5.155 0.075 13 0 "[ . 1 . 2]" 1 2752 1 80 ALA HA 2 72 GLN HA 5.080 2.200 5.080 5.140 5.127 5.156 0.076 13 0 "[ . 1 . 2]" 1 2753 1 7 ALA H 2 10 THR HB 5.090 2.200 5.090 4.508 4.412 4.784 . 0 0 "[ . 1 . 2]" 1 2754 1 10 THR HB 2 7 ALA H 5.090 2.200 5.090 4.504 4.408 4.781 . 0 0 "[ . 1 . 2]" 1 2755 1 7 ALA H 2 11 LEU QD 5.110 2.200 5.110 4.441 4.389 4.537 . 0 0 "[ . 1 . 2]" 1 2756 1 7 ALA MB 2 14 VAL MG1 5.140 2.200 5.140 4.512 4.329 4.562 . 0 0 "[ . 1 . 2]" 1 2757 1 14 VAL MG1 2 7 ALA MB 5.140 2.200 5.140 4.512 4.330 4.562 . 0 0 "[ . 1 . 2]" 1 2758 1 11 LEU MD2 2 7 ALA H 5.150 2.200 5.150 4.503 4.451 4.599 . 0 0 "[ . 1 . 2]" 1 2759 1 12 ILE MD 2 85 CYS HA 5.150 2.200 5.150 4.901 4.821 5.011 . 0 0 "[ . 1 . 2]" 1 2760 1 85 CYS HA 2 12 ILE MD 5.150 2.200 5.150 4.901 4.822 5.011 . 0 0 "[ . 1 . 2]" 1 2761 1 5 GLU HG2 2 44 PHE HD2 5.190 2.200 5.190 4.651 4.245 5.168 . 0 0 "[ . 1 . 2]" 1 2762 1 5 GLU HG3 2 44 PHE HD2 5.190 2.200 5.190 5.047 4.747 5.239 0.049 20 0 "[ . 1 . 2]" 1 2763 1 44 PHE HD2 2 5 GLU HG2 5.190 2.200 5.190 4.650 4.244 5.168 . 0 0 "[ . 1 . 2]" 1 2764 1 44 PHE HD2 2 5 GLU HG3 5.190 2.200 5.190 5.046 4.745 5.239 0.049 20 0 "[ . 1 . 2]" 1 2765 1 4 LEU HB2 2 40 GLU HA 5.250 2.200 5.250 4.248 4.038 4.768 . 0 0 "[ . 1 . 2]" 1 2766 1 40 GLU HA 2 4 LEU HB2 5.250 2.200 5.250 4.248 4.038 4.769 . 0 0 "[ . 1 . 2]" 1 2767 1 4 LEU QD 2 10 THR HB 5.270 2.200 5.270 5.168 4.858 5.318 0.048 6 0 "[ . 1 . 2]" 1 2768 1 10 THR HB 2 4 LEU QD 5.270 2.200 5.270 5.163 4.851 5.315 0.045 6 0 "[ . 1 . 2]" 1 2769 1 3 GLU HA 2 14 VAL MG1 5.290 2.200 5.290 5.320 5.144 5.473 0.183 5 0 "[ . 1 . 2]" 1 2770 1 14 VAL MG1 2 3 GLU HA 5.290 2.200 5.290 5.320 5.144 5.472 0.182 5 0 "[ . 1 . 2]" 1 2771 1 71 PHE HZ 2 83 VAL MG2 5.300 2.200 5.300 4.432 4.298 4.486 . 0 0 "[ . 1 . 2]" 1 2772 1 83 VAL MG2 2 71 PHE HZ 5.300 2.200 5.300 4.431 4.296 4.485 . 0 0 "[ . 1 . 2]" 1 2773 1 8 MET HG3 2 78 VAL HB 5.310 2.200 5.310 3.927 3.778 4.024 . 0 0 "[ . 1 . 2]" 1 2774 1 78 VAL HB 2 8 MET HG3 5.310 2.200 5.310 3.927 3.777 4.025 . 0 0 "[ . 1 . 2]" 1 2775 1 4 LEU HB3 2 40 GLU HA 5.330 2.200 5.330 4.325 4.172 4.575 . 0 0 "[ . 1 . 2]" 1 2776 1 40 GLU HA 2 4 LEU HB3 5.330 2.200 5.330 4.325 4.172 4.575 . 0 0 "[ . 1 . 2]" 1 2777 1 3 GLU H 2 40 GLU HB3 5.400 2.200 5.400 5.289 4.451 5.464 0.064 10 0 "[ . 1 . 2]" 1 2778 1 40 GLU HB3 2 3 GLU H 5.400 2.200 5.400 5.288 4.453 5.462 0.062 10 0 "[ . 1 . 2]" 1 2779 1 71 PHE HE1 2 82 THR HB 5.450 2.200 5.450 4.879 4.770 4.982 . 0 0 "[ . 1 . 2]" 1 2780 1 82 THR HB 2 71 PHE HE1 5.450 2.200 5.450 4.879 4.771 4.982 . 0 0 "[ . 1 . 2]" 1 2781 1 5 GLU HG2 2 42 SER H 5.460 2.200 5.460 5.451 5.077 5.511 0.051 9 0 "[ . 1 . 2]" 1 2782 1 5 GLU HG3 2 42 SER H 5.460 2.200 5.460 5.039 4.795 5.240 . 0 0 "[ . 1 . 2]" 1 2783 1 42 SER H 2 5 GLU HG2 5.460 2.200 5.460 5.450 5.076 5.509 0.049 9 0 "[ . 1 . 2]" 1 2784 1 42 SER H 2 5 GLU HG3 5.460 2.200 5.460 5.038 4.794 5.240 . 0 0 "[ . 1 . 2]" 1 2785 1 4 LEU HA 2 14 VAL HB 5.490 2.200 5.490 5.454 5.260 5.511 0.021 11 0 "[ . 1 . 2]" 1 2786 1 4 LEU HG 2 14 VAL HB 5.490 2.200 5.490 4.518 4.139 4.677 . 0 0 "[ . 1 . 2]" 1 2787 1 14 VAL HB 2 4 LEU HA 5.490 2.200 5.490 5.454 5.261 5.511 0.021 13 0 "[ . 1 . 2]" 1 2788 1 14 VAL HB 2 4 LEU HG 5.490 2.200 5.490 4.518 4.141 4.676 . 0 0 "[ . 1 . 2]" 1 2789 1 7 ALA MB 2 14 VAL MG2 5.570 2.200 5.570 4.582 4.505 4.640 . 0 0 "[ . 1 . 2]" 1 2790 1 14 VAL MG2 2 7 ALA MB 5.570 2.200 5.570 4.582 4.504 4.641 . 0 0 "[ . 1 . 2]" 1 2791 1 71 PHE HE1 2 83 VAL H 5.610 2.200 5.610 5.288 5.243 5.354 . 0 0 "[ . 1 . 2]" 1 2792 1 83 VAL H 2 71 PHE HE1 5.610 2.200 5.610 5.287 5.243 5.353 . 0 0 "[ . 1 . 2]" 1 2793 1 4 LEU QD 2 78 VAL H 5.700 2.200 5.700 4.878 4.585 5.087 . 0 0 "[ . 1 . 2]" 1 2794 1 78 VAL H 2 4 LEU QD 5.700 2.200 5.700 4.878 4.585 5.086 . 0 0 "[ . 1 . 2]" 1 2795 1 12 ILE HA 2 83 VAL HA 5.760 2.200 5.760 5.742 5.603 5.774 0.014 2 0 "[ . 1 . 2]" 1 2796 1 83 VAL HA 2 12 ILE HA 5.760 2.200 5.760 5.740 5.602 5.772 0.012 2 0 "[ . 1 . 2]" 1 2797 1 7 ALA HA 2 11 LEU QD 5.940 2.200 5.940 4.455 4.431 4.555 . 0 0 "[ . 1 . 2]" 1 2798 1 11 LEU MD2 2 7 ALA HA 6.000 2.200 6.000 4.603 4.575 4.701 . 0 0 "[ . 1 . 2]" 1 stop_ save_ save_distance_constraint_statistics_2 _Distance_constraint_stats_list.Sf_category distance_constraint_statistics _Distance_constraint_stats_list.Constraint_list_ID 2 _Distance_constraint_stats_list.Constraint_count 200 _Distance_constraint_stats_list.Viol_count 2275 _Distance_constraint_stats_list.Viol_total 1213.808 _Distance_constraint_stats_list.Viol_max 0.122 _Distance_constraint_stats_list.Viol_rms 0.0207 _Distance_constraint_stats_list.Viol_average_all_restraints 0.0152 _Distance_constraint_stats_list.Viol_average_violations_only 0.0267 _Distance_constraint_stats_list.Cutoff_violation_report 0.500 _Distance_constraint_stats_list.Details . loop_ _Distance_constraint_stats_per_res.Atom_entity_assembly_ID _Distance_constraint_stats_per_res.Atom_comp_index_ID _Distance_constraint_stats_per_res.Atom_comp_ID _Distance_constraint_stats_per_res.Total_violation _Distance_constraint_stats_per_res.Max_violation _Distance_constraint_stats_per_res.Max_violation_model_number _Distance_constraint_stats_per_res.Over_cutoff_viol_count _Distance_constraint_stats_per_res.Over_cutoff_viol_per_model 1 3 GLU 0.434 0.054 5 0 "[ . 1 . 2]" 1 4 LEU 1.096 0.051 15 0 "[ . 1 . 2]" 1 5 GLU 0.236 0.027 10 0 "[ . 1 . 2]" 1 6 THR 0.350 0.036 16 0 "[ . 1 . 2]" 1 7 ALA 0.839 0.054 5 0 "[ . 1 . 2]" 1 8 MET 2.156 0.059 9 0 "[ . 1 . 2]" 1 9 GLU 0.666 0.028 5 0 "[ . 1 . 2]" 1 10 THR 0.456 0.036 16 0 "[ . 1 . 2]" 1 11 LEU 1.142 0.040 6 0 "[ . 1 . 2]" 1 12 ILE 1.448 0.059 9 0 "[ . 1 . 2]" 1 13 ASN 0.829 0.028 5 0 "[ . 1 . 2]" 1 14 VAL 1.856 0.070 5 0 "[ . 1 . 2]" 1 15 PHE 1.006 0.066 20 0 "[ . 1 . 2]" 1 16 HIS 0.860 0.045 3 0 "[ . 1 . 2]" 1 17 ALA 0.950 0.048 19 0 "[ . 1 . 2]" 1 18 HIS 2.249 0.070 5 0 "[ . 1 . 2]" 1 19 SER 3.227 0.122 6 0 "[ . 1 . 2]" 1 20 GLY 0.827 0.045 3 0 "[ . 1 . 2]" 1 21 LYS 0.551 0.048 19 0 "[ . 1 . 2]" 1 22 GLU 0.500 0.040 16 0 "[ . 1 . 2]" 1 27 LYS 2.957 0.122 6 0 "[ . 1 . 2]" 1 28 LEU 0.614 0.056 15 0 "[ . 1 . 2]" 1 29 SER 0.101 0.021 14 0 "[ . 1 . 2]" 1 30 LYS 0.766 0.053 6 0 "[ . 1 . 2]" 1 32 GLU 2.482 0.090 4 0 "[ . 1 . 2]" 1 33 LEU 0.228 0.021 14 0 "[ . 1 . 2]" 1 34 LYS 0.766 0.053 6 0 "[ . 1 . 2]" 1 35 GLU 2.421 0.090 4 0 "[ . 1 . 2]" 1 36 LEU 0.396 0.068 6 0 "[ . 1 . 2]" 1 37 LEU 0.126 0.018 12 0 "[ . 1 . 2]" 1 39 THR 0.237 0.025 20 0 "[ . 1 . 2]" 1 40 GLU 0.447 0.032 10 0 "[ . 1 . 2]" 1 42 SER 0.016 0.004 12 0 "[ . 1 . 2]" 1 46 ASP 0.016 0.004 12 0 "[ . 1 . 2]" 1 52 ASP 0.367 0.029 6 0 "[ . 1 . 2]" 1 53 ALA 0.078 0.025 20 0 "[ . 1 . 2]" 1 54 VAL 0.450 0.042 8 0 "[ . 1 . 2]" 1 56 LYS 0.367 0.029 6 0 "[ . 1 . 2]" 1 57 VAL 0.078 0.025 20 0 "[ . 1 . 2]" 1 58 MET 0.703 0.042 8 0 "[ . 1 . 2]" 1 62 ASP 0.252 0.023 5 0 "[ . 1 . 2]" 1 69 VAL 0.614 0.056 15 0 "[ . 1 . 2]" 1 70 ASP 0.101 0.012 15 0 "[ . 1 . 2]" 1 71 PHE 0.704 0.045 2 0 "[ . 1 . 2]" 1 72 GLN 1.042 0.052 2 0 "[ . 1 . 2]" 1 73 GLU 0.980 0.060 2 0 "[ . 1 . 2]" 1 74 TYR 0.779 0.042 20 0 "[ . 1 . 2]" 1 75 VAL 1.981 0.061 20 0 "[ . 1 . 2]" 1 76 VAL 1.605 0.052 2 0 "[ . 1 . 2]" 1 77 LEU 1.701 0.060 2 0 "[ . 1 . 2]" 1 78 VAL 0.937 0.042 20 0 "[ . 1 . 2]" 1 79 ALA 2.567 0.061 20 0 "[ . 1 . 2]" 1 80 ALA 0.931 0.036 3 0 "[ . 1 . 2]" 1 81 LEU 1.634 0.055 9 0 "[ . 1 . 2]" 1 82 THR 1.341 0.042 7 0 "[ . 1 . 2]" 1 83 VAL 1.810 0.051 20 0 "[ . 1 . 2]" 1 84 ALA 0.495 0.027 16 0 "[ . 1 . 2]" 1 85 CYS 1.075 0.055 9 0 "[ . 1 . 2]" 1 86 ASN 1.518 0.042 7 0 "[ . 1 . 2]" 1 87 ASN 1.542 0.095 3 0 "[ . 1 . 2]" 1 88 PHE 0.127 0.019 19 0 "[ . 1 . 2]" 1 89 PHE 0.161 0.021 18 0 "[ . 1 . 2]" 1 90 TRP 0.436 0.035 2 0 "[ . 1 . 2]" 1 91 GLU 1.022 0.095 3 0 "[ . 1 . 2]" 2 3 GLU 0.425 0.054 5 0 "[ . 1 . 2]" 2 4 LEU 1.092 0.051 15 0 "[ . 1 . 2]" 2 5 GLU 0.241 0.027 10 0 "[ . 1 . 2]" 2 6 THR 0.175 0.027 16 0 "[ . 1 . 2]" 2 7 ALA 0.808 0.054 5 0 "[ . 1 . 2]" 2 8 MET 2.169 0.059 9 0 "[ . 1 . 2]" 2 9 GLU 0.766 0.033 3 0 "[ . 1 . 2]" 2 10 THR 0.298 0.027 16 0 "[ . 1 . 2]" 2 11 LEU 1.135 0.040 6 0 "[ . 1 . 2]" 2 12 ILE 1.455 0.059 9 0 "[ . 1 . 2]" 2 13 ASN 0.929 0.033 3 0 "[ . 1 . 2]" 2 14 VAL 1.849 0.071 5 0 "[ . 1 . 2]" 2 15 PHE 1.026 0.066 20 0 "[ . 1 . 2]" 2 16 HIS 0.861 0.045 3 0 "[ . 1 . 2]" 2 17 ALA 0.959 0.048 19 0 "[ . 1 . 2]" 2 18 HIS 2.254 0.071 5 0 "[ . 1 . 2]" 2 19 SER 3.253 0.121 6 0 "[ . 1 . 2]" 2 20 GLY 0.831 0.045 3 0 "[ . 1 . 2]" 2 21 LYS 0.556 0.048 19 0 "[ . 1 . 2]" 2 22 GLU 0.528 0.040 16 0 "[ . 1 . 2]" 2 27 LYS 2.979 0.121 6 0 "[ . 1 . 2]" 2 28 LEU 0.589 0.055 15 0 "[ . 1 . 2]" 2 29 SER 0.101 0.023 14 0 "[ . 1 . 2]" 2 30 LYS 0.765 0.054 6 0 "[ . 1 . 2]" 2 32 GLU 2.489 0.091 4 0 "[ . 1 . 2]" 2 33 LEU 0.226 0.023 14 0 "[ . 1 . 2]" 2 34 LYS 0.765 0.054 6 0 "[ . 1 . 2]" 2 35 GLU 2.422 0.091 4 0 "[ . 1 . 2]" 2 36 LEU 0.398 0.068 6 0 "[ . 1 . 2]" 2 37 LEU 0.124 0.017 12 0 "[ . 1 . 2]" 2 39 THR 0.236 0.022 20 0 "[ . 1 . 2]" 2 40 GLU 0.451 0.032 10 0 "[ . 1 . 2]" 2 42 SER 0.014 0.004 12 0 "[ . 1 . 2]" 2 46 ASP 0.014 0.004 12 0 "[ . 1 . 2]" 2 52 ASP 0.368 0.030 6 0 "[ . 1 . 2]" 2 53 ALA 0.081 0.025 20 0 "[ . 1 . 2]" 2 54 VAL 0.444 0.042 8 0 "[ . 1 . 2]" 2 56 LYS 0.368 0.030 6 0 "[ . 1 . 2]" 2 57 VAL 0.081 0.025 20 0 "[ . 1 . 2]" 2 58 MET 0.698 0.042 8 0 "[ . 1 . 2]" 2 62 ASP 0.254 0.024 5 0 "[ . 1 . 2]" 2 69 VAL 0.589 0.055 15 0 "[ . 1 . 2]" 2 70 ASP 0.103 0.012 15 0 "[ . 1 . 2]" 2 71 PHE 0.707 0.044 2 0 "[ . 1 . 2]" 2 72 GLN 1.044 0.052 2 0 "[ . 1 . 2]" 2 73 GLU 0.986 0.060 2 0 "[ . 1 . 2]" 2 74 TYR 0.778 0.043 20 0 "[ . 1 . 2]" 2 75 VAL 1.979 0.060 20 0 "[ . 1 . 2]" 2 76 VAL 1.611 0.052 2 0 "[ . 1 . 2]" 2 77 LEU 1.721 0.060 2 0 "[ . 1 . 2]" 2 78 VAL 0.941 0.043 20 0 "[ . 1 . 2]" 2 79 ALA 2.578 0.060 20 0 "[ . 1 . 2]" 2 80 ALA 0.938 0.035 15 0 "[ . 1 . 2]" 2 81 LEU 1.668 0.057 9 0 "[ . 1 . 2]" 2 82 THR 1.344 0.043 18 0 "[ . 1 . 2]" 2 83 VAL 1.827 0.051 4 0 "[ . 1 . 2]" 2 84 ALA 0.502 0.026 16 0 "[ . 1 . 2]" 2 85 CYS 1.098 0.057 9 0 "[ . 1 . 2]" 2 86 ASN 1.525 0.043 18 0 "[ . 1 . 2]" 2 87 ASN 1.549 0.095 3 0 "[ . 1 . 2]" 2 88 PHE 0.130 0.018 19 0 "[ . 1 . 2]" 2 89 PHE 0.165 0.021 17 0 "[ . 1 . 2]" 2 90 TRP 0.446 0.036 2 0 "[ . 1 . 2]" 2 91 GLU 1.029 0.095 3 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 4 LEU H 2 40 GLU OE1 1.850 . 1.950 1.967 1.933 1.982 0.032 10 0 "[ . 1 . 2]" 2 2 1 4 LEU N 2 40 GLU OE1 2.850 2.750 2.950 2.914 2.875 2.944 . 0 0 "[ . 1 . 2]" 2 3 1 3 GLU O 1 7 ALA H 1.850 . 1.950 1.972 1.949 2.004 0.054 5 0 "[ . 1 . 2]" 2 4 1 3 GLU O 1 7 ALA N 2.850 2.750 2.950 2.886 2.829 2.937 . 0 0 "[ . 1 . 2]" 2 5 1 4 LEU O 1 8 MET H 1.850 . 1.950 1.987 1.977 2.001 0.051 15 0 "[ . 1 . 2]" 2 6 1 4 LEU O 1 8 MET N 2.850 2.750 2.950 2.926 2.889 2.942 . 0 0 "[ . 1 . 2]" 2 7 1 5 GLU O 1 9 GLU H 1.850 . 1.950 1.863 1.782 1.966 0.016 9 0 "[ . 1 . 2]" 2 8 1 5 GLU O 1 9 GLU N 2.850 2.750 2.950 2.797 2.723 2.889 0.027 10 0 "[ . 1 . 2]" 2 9 1 6 THR O 1 10 THR H 1.850 . 1.950 1.967 1.946 1.986 0.036 16 0 "[ . 1 . 2]" 2 10 1 6 THR O 1 10 THR N 2.850 2.750 2.950 2.794 2.755 2.846 . 0 0 "[ . 1 . 2]" 2 11 1 7 ALA O 1 11 LEU H 1.850 . 1.950 1.970 1.960 1.976 0.026 3 0 "[ . 1 . 2]" 2 12 1 7 ALA O 1 11 LEU N 2.850 2.750 2.950 2.903 2.884 2.911 . 0 0 "[ . 1 . 2]" 2 13 1 8 MET O 1 12 ILE H 1.850 . 1.950 2.006 2.003 2.009 0.059 9 0 "[ . 1 . 2]" 2 14 1 8 MET O 1 12 ILE N 2.850 2.750 2.950 2.965 2.958 2.972 0.022 9 0 "[ . 1 . 2]" 2 15 1 9 GLU O 1 13 ASN H 1.850 . 1.950 1.786 1.775 1.795 . 0 0 "[ . 1 . 2]" 2 16 1 9 GLU O 1 13 ASN N 2.850 2.750 2.950 2.728 2.722 2.737 0.028 5 0 "[ . 1 . 2]" 2 17 1 10 THR O 1 14 VAL H 1.850 . 1.950 1.948 1.868 1.968 0.018 14 0 "[ . 1 . 2]" 2 18 1 10 THR O 1 14 VAL N 2.850 2.750 2.950 2.895 2.808 2.921 . 0 0 "[ . 1 . 2]" 2 19 1 11 LEU O 1 15 PHE H 1.850 . 1.950 1.985 1.978 1.990 0.040 6 0 "[ . 1 . 2]" 2 20 1 11 LEU O 1 15 PHE N 2.850 2.750 2.950 2.948 2.930 2.959 0.009 6 0 "[ . 1 . 2]" 2 21 1 12 ILE O 1 16 HIS H 1.850 . 1.950 1.919 1.854 1.965 0.015 6 0 "[ . 1 . 2]" 2 22 1 12 ILE O 1 16 HIS N 2.850 2.750 2.950 2.859 2.785 2.933 . 0 0 "[ . 1 . 2]" 2 23 1 13 ASN O 1 17 ALA H 1.850 . 1.950 1.959 1.942 1.963 0.013 12 0 "[ . 1 . 2]" 2 24 1 13 ASN O 1 17 ALA N 2.850 2.750 2.950 2.741 2.726 2.774 0.024 3 0 "[ . 1 . 2]" 2 25 1 14 VAL O 1 18 HIS H 1.850 . 1.950 2.009 1.995 2.020 0.070 5 0 "[ . 1 . 2]" 2 26 1 14 VAL O 1 18 HIS N 2.850 2.750 2.950 2.978 2.966 2.986 0.036 18 0 "[ . 1 . 2]" 2 27 1 15 PHE O 1 19 SER H 1.850 . 1.950 1.866 1.789 2.016 0.066 20 0 "[ . 1 . 2]" 2 28 1 15 PHE O 1 19 SER N 2.850 2.750 2.950 2.773 2.731 2.917 0.019 6 0 "[ . 1 . 2]" 2 29 1 16 HIS O 1 20 GLY H 1.850 . 1.950 1.966 1.918 1.984 0.034 14 0 "[ . 1 . 2]" 2 30 1 16 HIS O 1 20 GLY N 2.850 2.750 2.950 2.730 2.705 2.779 0.045 3 0 "[ . 1 . 2]" 2 31 1 17 ALA O 1 21 LYS H 1.850 . 1.950 1.977 1.957 1.998 0.048 19 0 "[ . 1 . 2]" 2 32 1 17 ALA O 1 21 LYS N 2.850 2.750 2.950 2.803 2.746 2.840 0.004 6 0 "[ . 1 . 2]" 2 33 1 18 HIS O 1 22 GLU H 1.850 . 1.950 1.973 1.950 1.990 0.040 16 0 "[ . 1 . 2]" 2 34 1 18 HIS O 1 22 GLU N 2.850 2.750 2.950 2.944 2.904 2.963 0.013 16 0 "[ . 1 . 2]" 2 35 1 19 SER OG 1 27 LYS H 1.850 . 1.950 2.051 2.020 2.072 0.122 6 0 "[ . 1 . 2]" 2 36 1 19 SER OG 1 27 LYS N 2.850 2.750 2.950 2.703 2.652 2.747 0.098 15 0 "[ . 1 . 2]" 2 37 1 28 LEU H 1 69 VAL O 1.850 . 1.950 1.855 1.771 1.963 0.013 6 0 "[ . 1 . 2]" 2 38 1 28 LEU N 1 69 VAL O 2.850 2.750 2.950 2.738 2.698 2.807 0.052 9 0 "[ . 1 . 2]" 2 39 1 29 SER O 1 33 LEU H 1.850 . 1.950 1.813 1.762 1.971 0.021 14 0 "[ . 1 . 2]" 2 40 1 29 SER O 1 33 LEU N 2.850 2.750 2.950 2.789 2.740 2.951 0.010 11 0 "[ . 1 . 2]" 2 41 1 30 LYS O 1 34 LYS H 1.850 . 1.950 1.988 1.975 2.003 0.053 6 0 "[ . 1 . 2]" 2 42 1 30 LYS O 1 34 LYS N 2.850 2.750 2.950 2.913 2.887 2.945 . 0 0 "[ . 1 . 2]" 2 43 1 32 GLU O 1 35 GLU H 1.850 . 1.950 2.028 2.010 2.040 0.090 4 0 "[ . 1 . 2]" 2 44 1 32 GLU O 1 35 GLU N 2.850 2.750 2.950 2.719 2.706 2.729 0.044 14 0 "[ . 1 . 2]" 2 45 1 32 GLU O 1 36 LEU H 1.850 . 1.950 1.960 1.868 2.018 0.068 6 0 "[ . 1 . 2]" 2 46 1 32 GLU O 1 36 LEU N 2.850 2.750 2.950 2.881 2.802 2.943 . 0 0 "[ . 1 . 2]" 2 47 1 33 LEU O 1 37 LEU H 1.850 . 1.950 1.935 1.858 1.968 0.018 12 0 "[ . 1 . 2]" 2 48 1 33 LEU O 1 37 LEU N 2.850 2.750 2.950 2.907 2.809 2.952 0.002 12 0 "[ . 1 . 2]" 2 49 1 35 GLU O 1 39 THR H 1.850 . 1.950 1.962 1.954 1.975 0.025 20 0 "[ . 1 . 2]" 2 50 1 35 GLU O 1 39 THR N 2.850 2.750 2.950 2.866 2.851 2.892 . 0 0 "[ . 1 . 2]" 2 51 1 36 LEU O 1 40 GLU H 1.850 . 1.950 1.938 1.825 1.964 0.014 9 0 "[ . 1 . 2]" 2 52 1 36 LEU O 1 40 GLU N 2.850 2.750 2.950 2.847 2.795 2.907 . 0 0 "[ . 1 . 2]" 2 53 1 42 SER O 1 46 ASP H 1.850 . 1.950 1.900 1.852 1.954 0.004 12 0 "[ . 1 . 2]" 2 54 1 42 SER O 1 46 ASP N 2.850 2.750 2.950 2.790 2.748 2.849 0.002 9 0 "[ . 1 . 2]" 2 55 1 52 ASP O 1 56 LYS H 1.850 . 1.950 1.968 1.962 1.979 0.029 6 0 "[ . 1 . 2]" 2 56 1 52 ASP O 1 56 LYS N 2.850 2.750 2.950 2.911 2.893 2.935 . 0 0 "[ . 1 . 2]" 2 57 1 53 ALA O 1 57 VAL H 1.850 . 1.950 1.863 1.817 1.927 . 0 0 "[ . 1 . 2]" 2 58 1 53 ALA O 1 57 VAL N 2.850 2.750 2.950 2.765 2.725 2.826 0.025 20 0 "[ . 1 . 2]" 2 59 1 54 VAL O 1 58 MET H 1.850 . 1.950 1.972 1.957 1.992 0.042 8 0 "[ . 1 . 2]" 2 60 1 54 VAL O 1 58 MET N 2.850 2.750 2.950 2.930 2.914 2.953 0.003 6 0 "[ . 1 . 2]" 2 61 1 58 MET O 1 62 ASP H 1.850 . 1.950 1.947 1.845 1.973 0.023 5 0 "[ . 1 . 2]" 2 62 1 58 MET O 1 62 ASP N 2.850 2.750 2.950 2.832 2.731 2.874 0.019 9 0 "[ . 1 . 2]" 2 63 1 28 LEU O 1 69 VAL H 1.850 . 1.950 1.866 1.746 1.980 0.030 9 0 "[ . 1 . 2]" 2 64 1 28 LEU O 1 69 VAL N 2.850 2.750 2.950 2.777 2.694 2.909 0.056 15 0 "[ . 1 . 2]" 2 65 1 70 ASP O 1 74 TYR H 1.850 . 1.950 1.850 1.785 1.957 0.007 3 0 "[ . 1 . 2]" 2 66 1 70 ASP O 1 74 TYR N 2.850 2.750 2.950 2.800 2.738 2.907 0.012 15 0 "[ . 1 . 2]" 2 67 1 71 PHE O 1 75 VAL H 1.850 . 1.950 1.820 1.809 1.835 . 0 0 "[ . 1 . 2]" 2 68 1 71 PHE O 1 75 VAL N 2.850 2.750 2.950 2.715 2.705 2.725 0.045 2 0 "[ . 1 . 2]" 2 69 1 72 GLN O 1 76 VAL H 1.850 . 1.950 1.998 1.991 2.002 0.052 2 0 "[ . 1 . 2]" 2 70 1 72 GLN O 1 76 VAL N 2.850 2.750 2.950 2.953 2.942 2.957 0.007 12 0 "[ . 1 . 2]" 2 71 1 73 GLU O 1 77 LEU H 1.850 . 1.950 1.999 1.985 2.010 0.060 2 0 "[ . 1 . 2]" 2 72 1 73 GLU O 1 77 LEU N 2.850 2.750 2.950 2.910 2.888 2.926 . 0 0 "[ . 1 . 2]" 2 73 1 74 TYR O 1 78 VAL H 1.850 . 1.950 1.982 1.971 1.992 0.042 20 0 "[ . 1 . 2]" 2 74 1 74 TYR O 1 78 VAL N 2.850 2.750 2.950 2.949 2.931 2.960 0.010 20 0 "[ . 1 . 2]" 2 75 1 75 VAL O 1 79 ALA H 1.850 . 1.950 2.006 2.001 2.011 0.061 20 0 "[ . 1 . 2]" 2 76 1 75 VAL O 1 79 ALA N 2.850 2.750 2.950 2.958 2.954 2.966 0.016 20 0 "[ . 1 . 2]" 2 77 1 76 VAL O 1 80 ALA H 1.850 . 1.950 1.763 1.753 1.776 . 0 0 "[ . 1 . 2]" 2 78 1 76 VAL O 1 80 ALA N 2.850 2.750 2.950 2.722 2.714 2.728 0.036 3 0 "[ . 1 . 2]" 2 79 1 77 LEU O 1 81 LEU H 1.850 . 1.950 1.986 1.979 1.997 0.047 13 0 "[ . 1 . 2]" 2 80 1 77 LEU O 1 81 LEU N 2.850 2.750 2.950 2.892 2.872 2.903 . 0 0 "[ . 1 . 2]" 2 81 1 78 VAL O 1 82 THR H 1.850 . 1.950 1.963 1.955 1.972 0.022 3 0 "[ . 1 . 2]" 2 82 1 78 VAL O 1 82 THR N 2.850 2.750 2.950 2.768 2.752 2.792 . 0 0 "[ . 1 . 2]" 2 83 1 79 ALA O 1 83 VAL H 1.850 . 1.950 1.997 1.992 2.001 0.051 20 0 "[ . 1 . 2]" 2 84 1 79 ALA O 1 83 VAL N 2.850 2.750 2.950 2.967 2.963 2.971 0.021 3 0 "[ . 1 . 2]" 2 85 1 80 ALA O 1 84 ALA H 1.850 . 1.950 1.968 1.960 1.977 0.027 16 0 "[ . 1 . 2]" 2 86 1 80 ALA O 1 84 ALA N 2.850 2.750 2.950 2.903 2.880 2.922 . 0 0 "[ . 1 . 2]" 2 87 1 81 LEU O 1 85 CYS H 1.850 . 1.950 1.930 1.882 1.954 0.004 13 0 "[ . 1 . 2]" 2 88 1 81 LEU O 1 85 CYS N 2.850 2.750 2.950 2.705 2.695 2.712 0.055 9 0 "[ . 1 . 2]" 2 89 1 82 THR O 1 86 ASN H 1.850 . 1.950 1.989 1.985 1.992 0.042 7 0 "[ . 1 . 2]" 2 90 1 82 THR O 1 86 ASN N 2.850 2.750 2.950 2.965 2.961 2.972 0.022 17 0 "[ . 1 . 2]" 2 91 1 83 VAL O 1 87 ASN H 1.850 . 1.950 1.976 1.963 1.983 0.033 9 0 "[ . 1 . 2]" 2 92 1 83 VAL O 1 87 ASN N 2.850 2.750 2.950 2.916 2.885 2.945 . 0 0 "[ . 1 . 2]" 2 93 1 84 ALA O 1 88 PHE H 1.850 . 1.950 1.927 1.880 1.957 0.007 19 0 "[ . 1 . 2]" 2 94 1 84 ALA O 1 88 PHE N 2.850 2.750 2.950 2.753 2.731 2.821 0.019 19 0 "[ . 1 . 2]" 2 95 1 85 CYS O 1 89 PHE H 1.850 . 1.950 1.956 1.909 1.971 0.021 18 0 "[ . 1 . 2]" 2 96 1 85 CYS O 1 89 PHE N 2.850 2.750 2.950 2.890 2.827 2.919 . 0 0 "[ . 1 . 2]" 2 97 1 86 ASN O 1 90 TRP H 1.850 . 1.950 1.971 1.956 1.985 0.035 2 0 "[ . 1 . 2]" 2 98 1 86 ASN O 1 90 TRP N 2.850 2.750 2.950 2.937 2.909 2.955 0.005 11 0 "[ . 1 . 2]" 2 99 1 87 ASN O 1 91 GLU H 1.850 . 1.950 1.923 1.864 1.972 0.022 12 0 "[ . 1 . 2]" 2 100 1 87 ASN O 1 91 GLU N 2.850 2.750 2.950 2.706 2.655 2.751 0.095 3 0 "[ . 1 . 2]" 2 101 1 40 GLU OE1 2 4 LEU H 1.850 . 1.950 1.967 1.933 1.982 0.032 10 0 "[ . 1 . 2]" 2 102 1 40 GLU OE1 2 4 LEU N 2.850 2.750 2.950 2.914 2.876 2.946 . 0 0 "[ . 1 . 2]" 2 103 2 3 GLU O 2 7 ALA H 1.850 . 1.950 1.971 1.948 2.004 0.054 5 0 "[ . 1 . 2]" 2 104 2 3 GLU O 2 7 ALA N 2.850 2.750 2.950 2.884 2.828 2.935 . 0 0 "[ . 1 . 2]" 2 105 2 4 LEU O 2 8 MET H 1.850 . 1.950 1.987 1.978 2.001 0.051 15 0 "[ . 1 . 2]" 2 106 2 4 LEU O 2 8 MET N 2.850 2.750 2.950 2.926 2.889 2.943 . 0 0 "[ . 1 . 2]" 2 107 2 5 GLU O 2 9 GLU H 1.850 . 1.950 1.862 1.781 1.966 0.016 9 0 "[ . 1 . 2]" 2 108 2 5 GLU O 2 9 GLU N 2.850 2.750 2.950 2.796 2.723 2.889 0.027 10 0 "[ . 1 . 2]" 2 109 2 6 THR O 2 10 THR H 1.850 . 1.950 1.954 1.918 1.977 0.027 16 0 "[ . 1 . 2]" 2 110 2 6 THR O 2 10 THR N 2.850 2.750 2.950 2.797 2.748 2.851 0.002 8 0 "[ . 1 . 2]" 2 111 2 7 ALA O 2 11 LEU H 1.850 . 1.950 1.969 1.959 1.974 0.024 7 0 "[ . 1 . 2]" 2 112 2 7 ALA O 2 11 LEU N 2.850 2.750 2.950 2.900 2.882 2.909 . 0 0 "[ . 1 . 2]" 2 113 2 8 MET O 2 12 ILE H 1.850 . 1.950 2.006 2.002 2.009 0.059 9 0 "[ . 1 . 2]" 2 114 2 8 MET O 2 12 ILE N 2.850 2.750 2.950 2.965 2.957 2.972 0.022 9 0 "[ . 1 . 2]" 2 115 2 9 GLU O 2 13 ASN H 1.850 . 1.950 1.781 1.770 1.792 . 0 0 "[ . 1 . 2]" 2 116 2 9 GLU O 2 13 ASN N 2.850 2.750 2.950 2.724 2.717 2.733 0.033 3 0 "[ . 1 . 2]" 2 117 2 10 THR O 2 14 VAL H 1.850 . 1.950 1.950 1.872 1.968 0.018 14 0 "[ . 1 . 2]" 2 118 2 10 THR O 2 14 VAL N 2.850 2.750 2.950 2.898 2.812 2.922 . 0 0 "[ . 1 . 2]" 2 119 2 11 LEU O 2 15 PHE H 1.850 . 1.950 1.985 1.979 1.990 0.040 6 0 "[ . 1 . 2]" 2 120 2 11 LEU O 2 15 PHE N 2.850 2.750 2.950 2.949 2.930 2.958 0.008 6 0 "[ . 1 . 2]" 2 121 2 12 ILE O 2 16 HIS H 1.850 . 1.950 1.917 1.852 1.964 0.014 6 0 "[ . 1 . 2]" 2 122 2 12 ILE O 2 16 HIS N 2.850 2.750 2.950 2.858 2.784 2.932 . 0 0 "[ . 1 . 2]" 2 123 2 13 ASN O 2 17 ALA H 1.850 . 1.950 1.958 1.937 1.963 0.013 17 0 "[ . 1 . 2]" 2 124 2 13 ASN O 2 17 ALA N 2.850 2.750 2.950 2.741 2.725 2.775 0.025 3 0 "[ . 1 . 2]" 2 125 2 14 VAL O 2 18 HIS H 1.850 . 1.950 2.009 1.991 2.021 0.071 5 0 "[ . 1 . 2]" 2 126 2 14 VAL O 2 18 HIS N 2.850 2.750 2.950 2.978 2.962 2.985 0.035 5 0 "[ . 1 . 2]" 2 127 2 15 PHE O 2 19 SER H 1.850 . 1.950 1.866 1.788 2.016 0.066 20 0 "[ . 1 . 2]" 2 128 2 15 PHE O 2 19 SER N 2.850 2.750 2.950 2.773 2.731 2.917 0.019 6 0 "[ . 1 . 2]" 2 129 2 16 HIS O 2 20 GLY H 1.850 . 1.950 1.965 1.916 1.985 0.035 16 0 "[ . 1 . 2]" 2 130 2 16 HIS O 2 20 GLY N 2.850 2.750 2.950 2.730 2.705 2.778 0.045 3 0 "[ . 1 . 2]" 2 131 2 17 ALA O 2 21 LYS H 1.850 . 1.950 1.978 1.957 1.998 0.048 19 0 "[ . 1 . 2]" 2 132 2 17 ALA O 2 21 LYS N 2.850 2.750 2.950 2.803 2.746 2.841 0.004 6 0 "[ . 1 . 2]" 2 133 2 18 HIS O 2 22 GLU H 1.850 . 1.950 1.974 1.952 1.990 0.040 16 0 "[ . 1 . 2]" 2 134 2 18 HIS O 2 22 GLU N 2.850 2.750 2.950 2.945 2.905 2.963 0.013 16 0 "[ . 1 . 2]" 2 135 2 19 SER OG 2 27 LYS H 1.850 . 1.950 2.050 2.019 2.071 0.121 6 0 "[ . 1 . 2]" 2 136 2 19 SER OG 2 27 LYS N 2.850 2.750 2.950 2.701 2.649 2.746 0.101 15 0 "[ . 1 . 2]" 2 137 2 28 LEU H 2 69 VAL O 1.850 . 1.950 1.857 1.773 1.964 0.014 6 0 "[ . 1 . 2]" 2 138 2 28 LEU N 2 69 VAL O 2.850 2.750 2.950 2.741 2.698 2.810 0.052 9 0 "[ . 1 . 2]" 2 139 2 29 SER O 2 33 LEU H 1.850 . 1.950 1.813 1.762 1.973 0.023 14 0 "[ . 1 . 2]" 2 140 2 29 SER O 2 33 LEU N 2.850 2.750 2.950 2.789 2.741 2.952 0.009 3 0 "[ . 1 . 2]" 2 141 2 30 LYS O 2 34 LYS H 1.850 . 1.950 1.988 1.976 2.004 0.054 6 0 "[ . 1 . 2]" 2 142 2 30 LYS O 2 34 LYS N 2.850 2.750 2.950 2.913 2.887 2.946 . 0 0 "[ . 1 . 2]" 2 143 2 32 GLU O 2 35 GLU H 1.850 . 1.950 2.029 2.010 2.041 0.091 4 0 "[ . 1 . 2]" 2 144 2 32 GLU O 2 35 GLU N 2.850 2.750 2.950 2.719 2.706 2.729 0.044 14 0 "[ . 1 . 2]" 2 145 2 32 GLU O 2 36 LEU H 1.850 . 1.950 1.960 1.867 2.018 0.068 6 0 "[ . 1 . 2]" 2 146 2 32 GLU O 2 36 LEU N 2.850 2.750 2.950 2.881 2.802 2.942 . 0 0 "[ . 1 . 2]" 2 147 2 33 LEU O 2 37 LEU H 1.850 . 1.950 1.935 1.857 1.967 0.017 12 0 "[ . 1 . 2]" 2 148 2 33 LEU O 2 37 LEU N 2.850 2.750 2.950 2.907 2.810 2.950 . 0 0 "[ . 1 . 2]" 2 149 2 35 GLU O 2 39 THR H 1.850 . 1.950 1.962 1.953 1.972 0.022 20 0 "[ . 1 . 2]" 2 150 2 35 GLU O 2 39 THR N 2.850 2.750 2.950 2.866 2.851 2.892 . 0 0 "[ . 1 . 2]" 2 151 2 36 LEU O 2 40 GLU H 1.850 . 1.950 1.938 1.826 1.964 0.014 9 0 "[ . 1 . 2]" 2 152 2 36 LEU O 2 40 GLU N 2.850 2.750 2.950 2.847 2.795 2.906 . 0 0 "[ . 1 . 2]" 2 153 2 42 SER O 2 46 ASP H 1.850 . 1.950 1.900 1.852 1.954 0.004 12 0 "[ . 1 . 2]" 2 154 2 42 SER O 2 46 ASP N 2.850 2.750 2.950 2.790 2.748 2.849 0.002 9 0 "[ . 1 . 2]" 2 155 2 52 ASP O 2 56 LYS H 1.850 . 1.950 1.968 1.963 1.980 0.030 6 0 "[ . 1 . 2]" 2 156 2 52 ASP O 2 56 LYS N 2.850 2.750 2.950 2.911 2.893 2.935 . 0 0 "[ . 1 . 2]" 2 157 2 53 ALA O 2 57 VAL H 1.850 . 1.950 1.863 1.818 1.928 . 0 0 "[ . 1 . 2]" 2 158 2 53 ALA O 2 57 VAL N 2.850 2.750 2.950 2.764 2.725 2.828 0.025 20 0 "[ . 1 . 2]" 2 159 2 54 VAL O 2 58 MET H 1.850 . 1.950 1.972 1.957 1.992 0.042 8 0 "[ . 1 . 2]" 2 160 2 54 VAL O 2 58 MET N 2.850 2.750 2.950 2.929 2.915 2.953 0.003 6 0 "[ . 1 . 2]" 2 161 2 58 MET O 2 62 ASP H 1.850 . 1.950 1.947 1.846 1.974 0.024 5 0 "[ . 1 . 2]" 2 162 2 58 MET O 2 62 ASP N 2.850 2.750 2.950 2.832 2.730 2.874 0.020 9 0 "[ . 1 . 2]" 2 163 2 28 LEU O 2 69 VAL H 1.850 . 1.950 1.867 1.747 1.980 0.030 9 0 "[ . 1 . 2]" 2 164 2 28 LEU O 2 69 VAL N 2.850 2.750 2.950 2.777 2.695 2.910 0.055 15 0 "[ . 1 . 2]" 2 165 2 70 ASP O 2 74 TYR H 1.850 . 1.950 1.849 1.784 1.957 0.007 3 0 "[ . 1 . 2]" 2 166 2 70 ASP O 2 74 TYR N 2.850 2.750 2.950 2.799 2.738 2.907 0.012 15 0 "[ . 1 . 2]" 2 167 2 71 PHE O 2 75 VAL H 1.850 . 1.950 1.820 1.810 1.835 . 0 0 "[ . 1 . 2]" 2 168 2 71 PHE O 2 75 VAL N 2.850 2.750 2.950 2.715 2.706 2.726 0.044 2 0 "[ . 1 . 2]" 2 169 2 72 GLN O 2 76 VAL H 1.850 . 1.950 1.998 1.991 2.002 0.052 2 0 "[ . 1 . 2]" 2 170 2 72 GLN O 2 76 VAL N 2.850 2.750 2.950 2.953 2.940 2.957 0.007 12 0 "[ . 1 . 2]" 2 171 2 73 GLU O 2 77 LEU H 1.850 . 1.950 1.999 1.985 2.010 0.060 2 0 "[ . 1 . 2]" 2 172 2 73 GLU O 2 77 LEU N 2.850 2.750 2.950 2.910 2.889 2.927 . 0 0 "[ . 1 . 2]" 2 173 2 74 TYR O 2 78 VAL H 1.850 . 1.950 1.982 1.971 1.993 0.043 20 0 "[ . 1 . 2]" 2 174 2 74 TYR O 2 78 VAL N 2.850 2.750 2.950 2.949 2.931 2.960 0.010 20 0 "[ . 1 . 2]" 2 175 2 75 VAL O 2 79 ALA H 1.850 . 1.950 2.006 2.002 2.010 0.060 20 0 "[ . 1 . 2]" 2 176 2 75 VAL O 2 79 ALA N 2.850 2.750 2.950 2.957 2.953 2.965 0.015 20 0 "[ . 1 . 2]" 2 177 2 76 VAL O 2 80 ALA H 1.850 . 1.950 1.763 1.754 1.777 . 0 0 "[ . 1 . 2]" 2 178 2 76 VAL O 2 80 ALA N 2.850 2.750 2.950 2.722 2.715 2.727 0.035 15 0 "[ . 1 . 2]" 2 179 2 77 LEU O 2 81 LEU H 1.850 . 1.950 1.987 1.978 1.998 0.048 13 0 "[ . 1 . 2]" 2 180 2 77 LEU O 2 81 LEU N 2.850 2.750 2.950 2.893 2.873 2.904 . 0 0 "[ . 1 . 2]" 2 181 2 78 VAL O 2 82 THR H 1.850 . 1.950 1.963 1.957 1.971 0.021 3 0 "[ . 1 . 2]" 2 182 2 78 VAL O 2 82 THR N 2.850 2.750 2.950 2.769 2.754 2.792 . 0 0 "[ . 1 . 2]" 2 183 2 79 ALA O 2 83 VAL H 1.850 . 1.950 1.998 1.992 2.001 0.051 4 0 "[ . 1 . 2]" 2 184 2 79 ALA O 2 83 VAL N 2.850 2.750 2.950 2.967 2.963 2.973 0.023 3 0 "[ . 1 . 2]" 2 185 2 80 ALA O 2 84 ALA H 1.850 . 1.950 1.969 1.961 1.976 0.026 16 0 "[ . 1 . 2]" 2 186 2 80 ALA O 2 84 ALA N 2.850 2.750 2.950 2.903 2.881 2.921 . 0 0 "[ . 1 . 2]" 2 187 2 81 LEU O 2 85 CYS H 1.850 . 1.950 1.929 1.881 1.953 0.003 5 0 "[ . 1 . 2]" 2 188 2 81 LEU O 2 85 CYS N 2.850 2.750 2.950 2.704 2.693 2.710 0.057 9 0 "[ . 1 . 2]" 2 189 2 82 THR O 2 86 ASN H 1.850 . 1.950 1.989 1.986 1.993 0.043 18 0 "[ . 1 . 2]" 2 190 2 82 THR O 2 86 ASN N 2.850 2.750 2.950 2.965 2.960 2.972 0.022 17 0 "[ . 1 . 2]" 2 191 2 83 VAL O 2 87 ASN H 1.850 . 1.950 1.976 1.963 1.984 0.034 12 0 "[ . 1 . 2]" 2 192 2 83 VAL O 2 87 ASN N 2.850 2.750 2.950 2.916 2.884 2.945 . 0 0 "[ . 1 . 2]" 2 193 2 84 ALA O 2 88 PHE H 1.850 . 1.950 1.928 1.879 1.959 0.009 19 0 "[ . 1 . 2]" 2 194 2 84 ALA O 2 88 PHE N 2.850 2.750 2.950 2.753 2.732 2.822 0.018 19 0 "[ . 1 . 2]" 2 195 2 85 CYS O 2 89 PHE H 1.850 . 1.950 1.956 1.909 1.971 0.021 17 0 "[ . 1 . 2]" 2 196 2 85 CYS O 2 89 PHE N 2.850 2.750 2.950 2.891 2.828 2.920 . 0 0 "[ . 1 . 2]" 2 197 2 86 ASN O 2 90 TRP H 1.850 . 1.950 1.971 1.956 1.986 0.036 2 0 "[ . 1 . 2]" 2 198 2 86 ASN O 2 90 TRP N 2.850 2.750 2.950 2.937 2.909 2.957 0.007 11 0 "[ . 1 . 2]" 2 199 2 87 ASN O 2 91 GLU H 1.850 . 1.950 1.923 1.864 1.973 0.023 12 0 "[ . 1 . 2]" 2 200 2 87 ASN O 2 91 GLU N 2.850 2.750 2.950 2.706 2.655 2.750 0.095 3 0 "[ . 1 . 2]" 2 stop_ save_
Contact the webmaster for help, if required. Thursday, May 23, 2024 11:08:32 AM GMT (wattos1)