NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
414846 | 2czn | 6829 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2czn 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 2089 _Distance_constraint_stats_list.Viol_count 3026 _Distance_constraint_stats_list.Viol_total 6363.529 _Distance_constraint_stats_list.Viol_max 0.260 _Distance_constraint_stats_list.Viol_rms 0.0141 _Distance_constraint_stats_list.Viol_average_all_restraints 0.0021 _Distance_constraint_stats_list.Viol_average_violations_only 0.0553 _Distance_constraint_stats_list.Cutoff_violation_report 0.500 _Distance_constraint_stats_list.Details ; Description of the tags in this list: * 1 * Administrative tag * 2 * Administrative tag * 3 * Administrative tag * 4 * ID of the restraint list. * 5 * Number of restraints in list. * 6 * Number of violated restraints (each model violation is used). * 7 * Sum of violations in Angstrom. * 8 * Maximum violation of a restraint without averaging in any way. * 9 * Rms of violations over all restraints. * 10 * Average violation over all restraints. * 11 * Average violation over violated restraints. This violation is averaged over only those models in which the restraint is violated. These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998). * 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table. * 13 * This tag Description of the tags in the per residue table below: * 1 * Chain identifier (can be absent if none defined) * 2 * Residue number * 3 * Residue name * 4 * Maximum violation in ensemble of models (without any averaging) * 5 * Model number with the maximum violation * 6 * Number of models with a violation above cutoff * 7 * List of models (1 character per model) with a violation above cutoff. An '*' marks a violation above the cutoff. A '+' indicates the largest violation above the cutoff and a '-' marks the smallest violation over cutoff. For models 5, 15, 25,... a ' ' is replaced by a '.'. For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1. * 8 * Administrative tag * 9 * Administrative tag Description of the tags in the per restraint table below: * 1 * Restraint ID within restraint list. First node, FIRST member, first atom's: * 2 * Chain identifier (can be absent if none defined) * 3 * Residue number * 4 * Residue name * 5 * Name of (pseudo-)atom First node, SECOND member, first atom's: * 6 * Chain identifier (can be absent if none defined) * 7 * Residue number * 8 * Residue name * 9 * Name of (pseudo-)atom FIRST node's: * 10 * Target distance value (Angstrom) * 11 * Lower bound distance (Angstrom) * 12 * Upper bound distance (Angstrom) * 13 * Average distance in ensemble of models * 14 * Minimum distance in ensemble of models * 15 * Maximum distance in ensemble of models * 16 * Maximum violation (without any averaging) * 17 * Model number with the maximum violation * 18 * Number of models with a violation above cutoff * 19 * List of models with a violation above cutoff. See description above. * 20 * Administrative tag * 21 * Administrative tag ; loop_ _Distance_constraint_stats_per_res.Atom_entity_assembly_ID _Distance_constraint_stats_per_res.Atom_comp_index_ID _Distance_constraint_stats_per_res.Atom_comp_ID _Distance_constraint_stats_per_res.Total_violation _Distance_constraint_stats_per_res.Max_violation _Distance_constraint_stats_per_res.Max_violation_model_number _Distance_constraint_stats_per_res.Over_cutoff_viol_count _Distance_constraint_stats_per_res.Over_cutoff_viol_per_model 1 1 GLY 0.000 0.000 . 0 "[ . 1 . 2 . 3 . ]" 1 2 PRO 0.000 0.000 . 0 "[ . 1 . 2 . 3 . ]" 1 3 THR 0.000 0.000 . 0 "[ . 1 . 2 . 3 . ]" 1 4 THR 0.240 0.031 35 0 "[ . 1 . 2 . 3 . ]" 1 5 PRO 0.000 0.000 . 0 "[ . 1 . 2 . 3 . ]" 1 6 VAL 0.018 0.017 8 0 "[ . 1 . 2 . 3 . ]" 1 7 PRO 0.000 0.000 . 0 "[ . 1 . 2 . 3 . ]" 1 8 VAL 2.109 0.079 36 0 "[ . 1 . 2 . 3 . ]" 1 9 SER 1.330 0.202 11 0 "[ . 1 . 2 . 3 . ]" 1 10 GLY 0.088 0.060 11 0 "[ . 1 . 2 . 3 . ]" 1 11 SER 8.408 0.149 11 0 "[ . 1 . 2 . 3 . ]" 1 12 LEU 6.857 0.149 2 0 "[ . 1 . 2 . 3 . ]" 1 13 GLU 0.385 0.060 25 0 "[ . 1 . 2 . 3 . ]" 1 14 VAL 1.547 0.120 32 0 "[ . 1 . 2 . 3 . ]" 1 15 LYS 2.337 0.148 2 0 "[ . 1 . 2 . 3 . ]" 1 16 VAL 1.223 0.096 38 0 "[ . 1 . 2 . 3 . ]" 1 17 ASN 6.285 0.141 31 0 "[ . 1 . 2 . 3 . ]" 1 18 ASP 0.473 0.134 27 0 "[ . 1 . 2 . 3 . ]" 1 19 TRP 9.874 0.141 31 0 "[ . 1 . 2 . 3 . ]" 1 20 GLY 0.171 0.056 38 0 "[ . 1 . 2 . 3 . ]" 1 21 SER 0.259 0.046 31 0 "[ . 1 . 2 . 3 . ]" 1 22 GLY 2.033 0.106 11 0 "[ . 1 . 2 . 3 . ]" 1 23 ALA 0.037 0.012 6 0 "[ . 1 . 2 . 3 . ]" 1 24 GLU 2.484 0.097 16 0 "[ . 1 . 2 . 3 . ]" 1 25 TYR 1.337 0.096 38 0 "[ . 1 . 2 . 3 . ]" 1 26 ASP 2.351 0.148 2 0 "[ . 1 . 2 . 3 . ]" 1 27 VAL 2.521 0.106 36 0 "[ . 1 . 2 . 3 . ]" 1 28 THR 0.258 0.060 25 0 "[ . 1 . 2 . 3 . ]" 1 29 LEU 11.178 0.260 14 0 "[ . 1 . 2 . 3 . ]" 1 30 ASN 8.440 0.149 11 0 "[ . 1 . 2 . 3 . ]" 1 31 LEU 3.816 0.106 32 0 "[ . 1 . 2 . 3 . ]" 1 32 ASP 1.374 0.088 13 0 "[ . 1 . 2 . 3 . ]" 1 33 GLY 5.848 0.144 7 0 "[ . 1 . 2 . 3 . ]" 1 34 GLN 0.125 0.047 10 0 "[ . 1 . 2 . 3 . ]" 1 35 TYR 0.475 0.075 8 0 "[ . 1 . 2 . 3 . ]" 1 36 ASP 1.749 0.096 25 0 "[ . 1 . 2 . 3 . ]" 1 37 TRP 10.248 0.142 24 0 "[ . 1 . 2 . 3 . ]" 1 38 THR 0.547 0.056 23 0 "[ . 1 . 2 . 3 . ]" 1 39 VAL 5.050 0.109 5 0 "[ . 1 . 2 . 3 . ]" 1 40 LYS 1.363 0.089 15 0 "[ . 1 . 2 . 3 . ]" 1 41 VAL 8.148 0.253 29 0 "[ . 1 . 2 . 3 . ]" 1 42 LYS 1.532 0.075 23 0 "[ . 1 . 2 . 3 . ]" 1 43 LEU 11.071 0.235 33 0 "[ . 1 . 2 . 3 . ]" 1 44 ALA 4.760 0.113 21 0 "[ . 1 . 2 . 3 . ]" 1 45 PRO 1.446 0.049 36 0 "[ . 1 . 2 . 3 . ]" 1 46 GLY 0.000 0.000 . 0 "[ . 1 . 2 . 3 . ]" 1 47 ALA 5.695 0.172 5 0 "[ . 1 . 2 . 3 . ]" 1 48 THR 6.806 0.116 18 0 "[ . 1 . 2 . 3 . ]" 1 49 VAL 6.505 0.177 23 0 "[ . 1 . 2 . 3 . ]" 1 50 GLY 0.012 0.012 18 0 "[ . 1 . 2 . 3 . ]" 1 51 SER 0.470 0.049 32 0 "[ . 1 . 2 . 3 . ]" 1 52 PHE 0.000 0.000 . 0 "[ . 1 . 2 . 3 . ]" 1 53 TRP 3.863 0.121 27 0 "[ . 1 . 2 . 3 . ]" 1 54 SER 2.276 0.093 37 0 "[ . 1 . 2 . 3 . ]" 1 55 ALA 10.279 0.160 36 0 "[ . 1 . 2 . 3 . ]" 1 56 ASN 5.740 0.131 27 0 "[ . 1 . 2 . 3 . ]" 1 57 LYS 3.515 0.177 23 0 "[ . 1 . 2 . 3 . ]" 1 58 GLN 4.870 0.233 18 0 "[ . 1 . 2 . 3 . ]" 1 59 GLU 1.336 0.133 6 0 "[ . 1 . 2 . 3 . ]" 1 60 GLY 0.000 0.000 . 0 "[ . 1 . 2 . 3 . ]" 1 61 ASN 0.105 0.082 30 0 "[ . 1 . 2 . 3 . ]" 1 62 GLY 0.000 0.000 . 0 "[ . 1 . 2 . 3 . ]" 1 63 TYR 1.604 0.075 23 0 "[ . 1 . 2 . 3 . ]" 1 64 VAL 2.360 0.159 12 0 "[ . 1 . 2 . 3 . ]" 1 65 ILE 6.123 0.233 18 0 "[ . 1 . 2 . 3 . ]" 1 66 PHE 3.086 0.106 9 0 "[ . 1 . 2 . 3 . ]" 1 67 THR 3.243 0.131 27 0 "[ . 1 . 2 . 3 . ]" 1 68 PRO 0.317 0.069 4 0 "[ . 1 . 2 . 3 . ]" 1 69 VAL 4.342 0.106 23 0 "[ . 1 . 2 . 3 . ]" 1 70 SER 0.322 0.086 7 0 "[ . 1 . 2 . 3 . ]" 1 71 TRP 4.321 0.160 31 0 "[ . 1 . 2 . 3 . ]" 1 72 ASN 2.641 0.142 24 0 "[ . 1 . 2 . 3 . ]" 1 73 LYS 2.130 0.140 7 0 "[ . 1 . 2 . 3 . ]" 1 74 GLY 0.705 0.074 24 0 "[ . 1 . 2 . 3 . ]" 1 75 PRO 0.000 0.000 . 0 "[ . 1 . 2 . 3 . ]" 1 76 THR 7.139 0.144 7 0 "[ . 1 . 2 . 3 . ]" 1 77 ALA 0.548 0.049 15 0 "[ . 1 . 2 . 3 . ]" 1 78 THR 1.637 0.092 16 0 "[ . 1 . 2 . 3 . ]" 1 79 PHE 10.826 0.160 36 0 "[ . 1 . 2 . 3 . ]" 1 80 GLY 0.000 0.000 . 0 "[ . 1 . 2 . 3 . ]" 1 81 PHE 4.395 0.095 4 0 "[ . 1 . 2 . 3 . ]" 1 82 ILE 9.373 0.106 9 0 "[ . 1 . 2 . 3 . ]" 1 83 VAL 15.068 0.235 33 0 "[ . 1 . 2 . 3 . ]" 1 84 ASN 1.315 0.052 22 0 "[ . 1 . 2 . 3 . ]" 1 85 GLY 2.193 0.068 34 0 "[ . 1 . 2 . 3 . ]" 1 86 PRO 0.009 0.009 4 0 "[ . 1 . 2 . 3 . ]" 1 87 GLN 1.026 0.118 34 0 "[ . 1 . 2 . 3 . ]" 1 88 GLY 0.086 0.086 15 0 "[ . 1 . 2 . 3 . ]" 1 89 ASP 0.425 0.042 13 0 "[ . 1 . 2 . 3 . ]" 1 90 LYS 4.989 0.137 29 0 "[ . 1 . 2 . 3 . ]" 1 91 VAL 15.785 0.253 29 0 "[ . 1 . 2 . 3 . ]" 1 92 GLU 0.188 0.040 11 0 "[ . 1 . 2 . 3 . ]" 1 93 GLU 1.686 0.086 33 0 "[ . 1 . 2 . 3 . ]" 1 94 ILE 0.030 0.030 3 0 "[ . 1 . 2 . 3 . ]" 1 95 THR 0.000 0.000 . 0 "[ . 1 . 2 . 3 . ]" 1 96 LEU 15.562 0.260 14 0 "[ . 1 . 2 . 3 . ]" 1 97 GLU 1.905 0.080 32 0 "[ . 1 . 2 . 3 . ]" 1 98 ILE 2.211 0.096 36 0 "[ . 1 . 2 . 3 . ]" 1 99 ASN 0.346 0.052 34 0 "[ . 1 . 2 . 3 . ]" 1 100 GLY 0.346 0.052 34 0 "[ . 1 . 2 . 3 . ]" 1 101 GLN 0.010 0.003 14 0 "[ . 1 . 2 . 3 . ]" 1 102 VAL 0.000 0.000 . 0 "[ . 1 . 2 . 3 . ]" 1 103 ILE 1.287 0.202 11 0 "[ . 1 . 2 . 3 . ]" stop_ loop_ _Distance_constraint_stats.Restraint_ID _Distance_constraint_stats.Atom_1_entity_assembly_ID _Distance_constraint_stats.Atom_1_comp_index_ID _Distance_constraint_stats.Atom_1_comp_ID _Distance_constraint_stats.Atom_1_ID _Distance_constraint_stats.Atom_2_entity_assembly_ID _Distance_constraint_stats.Atom_2_comp_index_ID _Distance_constraint_stats.Atom_2_comp_ID _Distance_constraint_stats.Atom_2_ID _Distance_constraint_stats.Node_1_distance_val _Distance_constraint_stats.Node_1_distance_lower_bound_val _Distance_constraint_stats.Node_1_distance_upper_bound_val _Distance_constraint_stats.Distance_average _Distance_constraint_stats.Distance_minimum _Distance_constraint_stats.Distance_maximum _Distance_constraint_stats.Max_violation _Distance_constraint_stats.Max_violation_model_number _Distance_constraint_stats.Over_cutoff_violation_count _Distance_constraint_stats.Over_cutoff_viol_per_model _Distance_constraint_stats.Distance_constraint_stats_ID 1 1 1 GLY QA 1 2 PRO QG 5.000 . 6.900 3.740 3.676 3.867 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2 1 2 PRO QB 1 3 THR HB 4.000 . 4.900 4.249 4.189 4.337 . 0 0 "[ . 1 . 2 . 3 . ]" 1 3 1 3 THR HA 1 3 THR MG 3.000 . 4.000 3.185 3.174 3.192 . 0 0 "[ . 1 . 2 . 3 . ]" 1 4 1 3 THR HA 1 3 THR HB 3.000 . 3.000 2.570 2.504 2.641 . 0 0 "[ . 1 . 2 . 3 . ]" 1 5 1 2 PRO QG 1 3 THR MG 5.000 . 7.000 4.203 3.921 4.783 . 0 0 "[ . 1 . 2 . 3 . ]" 1 6 1 4 THR HA 1 4 THR HB 3.000 . 3.000 2.708 2.393 3.031 0.031 35 0 "[ . 1 . 2 . 3 . ]" 1 7 1 4 THR HA 1 4 THR MG 3.000 . 4.000 2.436 1.907 3.197 . 0 0 "[ . 1 . 2 . 3 . ]" 1 8 1 4 THR HA 1 5 PRO QD 3.000 . 3.900 1.964 1.894 2.179 . 0 0 "[ . 1 . 2 . 3 . ]" 1 9 1 4 THR HB 1 5 PRO QD 4.000 . 4.900 3.477 2.055 4.294 . 0 0 "[ . 1 . 2 . 3 . ]" 1 10 1 4 THR MG 1 5 PRO QD 5.000 . 6.900 2.970 1.858 4.084 . 0 0 "[ . 1 . 2 . 3 . ]" 1 11 1 5 PRO QD 1 95 THR MG 5.000 . 6.900 4.169 2.840 4.935 . 0 0 "[ . 1 . 2 . 3 . ]" 1 12 1 6 VAL HA 1 6 VAL HB 3.000 . 3.000 2.415 2.391 2.442 . 0 0 "[ . 1 . 2 . 3 . ]" 1 13 1 6 VAL HA 1 6 VAL MG1 3.000 . 4.000 3.183 3.172 3.195 . 0 0 "[ . 1 . 2 . 3 . ]" 1 14 1 6 VAL HA 1 6 VAL MG2 3.000 . 4.000 2.495 2.441 2.527 . 0 0 "[ . 1 . 2 . 3 . ]" 1 15 1 6 VAL HA 1 7 PRO QD 3.000 . 3.900 1.955 1.897 2.006 . 0 0 "[ . 1 . 2 . 3 . ]" 1 16 1 6 VAL MG1 1 7 PRO QD 5.000 . 6.900 3.798 3.717 3.891 . 0 0 "[ . 1 . 2 . 3 . ]" 1 17 1 6 VAL MG1 1 7 PRO QG 5.000 . 7.000 5.060 4.877 5.210 . 0 0 "[ . 1 . 2 . 3 . ]" 1 18 1 6 VAL MG2 1 7 PRO HA 4.000 . 5.000 3.896 3.871 3.966 . 0 0 "[ . 1 . 2 . 3 . ]" 1 19 1 6 VAL MG2 1 7 PRO QG 5.000 . 7.000 3.116 2.869 3.391 . 0 0 "[ . 1 . 2 . 3 . ]" 1 20 1 7 PRO QB 1 11 SER HA 5.000 . 5.900 3.982 2.886 4.309 . 0 0 "[ . 1 . 2 . 3 . ]" 1 21 1 6 VAL HA 1 7 PRO QB 5.000 . 5.900 4.538 4.516 4.560 . 0 0 "[ . 1 . 2 . 3 . ]" 1 22 1 6 VAL HB 1 7 PRO QD 3.000 . 3.900 3.454 3.356 3.536 . 0 0 "[ . 1 . 2 . 3 . ]" 1 23 1 8 VAL HA 1 8 VAL HB 3.000 . 3.000 3.028 3.018 3.033 0.033 37 0 "[ . 1 . 2 . 3 . ]" 1 24 1 8 VAL HA 1 8 VAL MG1 3.000 . 4.000 2.264 2.106 2.390 . 0 0 "[ . 1 . 2 . 3 . ]" 1 25 1 8 VAL HA 1 8 VAL MG2 3.000 . 4.000 2.401 2.192 2.542 . 0 0 "[ . 1 . 2 . 3 . ]" 1 26 1 8 VAL HB 1 103 ILE MD 4.000 . 5.000 3.694 2.786 4.236 . 0 0 "[ . 1 . 2 . 3 . ]" 1 27 1 8 VAL HB 1 9 SER QB 4.000 . 4.900 3.605 3.295 4.277 . 0 0 "[ . 1 . 2 . 3 . ]" 1 28 1 8 VAL MG1 1 9 SER QB 5.000 . 6.900 3.765 3.262 4.313 . 0 0 "[ . 1 . 2 . 3 . ]" 1 29 1 9 SER HA 1 103 ILE MD 5.000 . 6.000 3.949 3.452 4.433 . 0 0 "[ . 1 . 2 . 3 . ]" 1 30 1 9 SER HA 1 103 ILE MG 5.000 . 6.000 4.832 4.585 4.922 . 0 0 "[ . 1 . 2 . 3 . ]" 1 31 1 9 SER QB 1 103 ILE MD 5.000 . 6.900 2.249 1.598 3.237 0.202 11 0 "[ . 1 . 2 . 3 . ]" 1 32 1 9 SER QB 1 103 ILE MG 5.000 . 6.900 4.005 2.904 4.633 . 0 0 "[ . 1 . 2 . 3 . ]" 1 33 1 9 SER QB 1 98 ILE MD 5.000 . 6.900 3.787 2.943 4.411 . 0 0 "[ . 1 . 2 . 3 . ]" 1 34 1 9 SER QB 1 98 ILE QG 5.000 . 6.800 4.511 3.505 5.035 . 0 0 "[ . 1 . 2 . 3 . ]" 1 35 1 9 SER QB 1 98 ILE MG 5.000 . 6.900 4.433 3.637 4.921 . 0 0 "[ . 1 . 2 . 3 . ]" 1 36 1 10 GLY QA 1 103 ILE MG 5.000 . 6.900 3.158 2.034 4.213 . 0 0 "[ . 1 . 2 . 3 . ]" 1 37 1 10 GLY QA 1 31 LEU HA 5.000 . 5.900 2.431 2.257 2.600 . 0 0 "[ . 1 . 2 . 3 . ]" 1 38 1 10 GLY QA 1 31 LEU MD1 5.000 . 6.900 4.315 4.113 4.477 . 0 0 "[ . 1 . 2 . 3 . ]" 1 39 1 10 GLY QA 1 31 LEU MD2 5.000 . 6.900 2.007 1.809 2.238 . 0 0 "[ . 1 . 2 . 3 . ]" 1 40 1 10 GLY QA 1 98 ILE MD 5.000 . 6.900 3.330 2.904 3.590 . 0 0 "[ . 1 . 2 . 3 . ]" 1 41 1 11 SER HA 1 30 ASN QB 4.000 . 4.900 4.067 3.999 4.134 . 0 0 "[ . 1 . 2 . 3 . ]" 1 42 1 11 SER QB 1 30 ASN QB 5.000 . 6.800 1.718 1.669 1.839 0.131 33 0 "[ . 1 . 2 . 3 . ]" 1 43 1 11 SER QB 1 31 LEU MD2 5.000 . 6.900 4.311 3.993 4.786 . 0 0 "[ . 1 . 2 . 3 . ]" 1 44 1 12 LEU HA 1 12 LEU MD1 4.000 . 5.000 3.471 3.178 3.800 . 0 0 "[ . 1 . 2 . 3 . ]" 1 45 1 12 LEU HA 1 12 LEU MD2 4.000 . 5.000 1.803 1.730 1.962 0.070 32 0 "[ . 1 . 2 . 3 . ]" 1 46 1 12 LEU HA 1 13 GLU QB 5.000 . 5.900 4.120 3.920 4.561 . 0 0 "[ . 1 . 2 . 3 . ]" 1 47 1 12 LEU HA 1 29 LEU HG 3.000 . 3.000 2.971 2.913 3.057 0.057 12 0 "[ . 1 . 2 . 3 . ]" 1 48 1 11 SER HA 1 12 LEU QB 5.000 . 5.900 3.771 3.715 3.818 . 0 0 "[ . 1 . 2 . 3 . ]" 1 49 1 12 LEU QB 1 27 VAL MG1 5.000 . 6.900 4.368 4.269 4.494 . 0 0 "[ . 1 . 2 . 3 . ]" 1 50 1 12 LEU QB 1 29 LEU HA 5.000 . 5.900 3.509 3.233 4.078 . 0 0 "[ . 1 . 2 . 3 . ]" 1 51 1 12 LEU QB 1 29 LEU MD2 5.000 . 6.900 2.334 2.025 2.985 . 0 0 "[ . 1 . 2 . 3 . ]" 1 52 1 12 LEU QB 1 31 LEU MD2 5.000 . 6.900 4.803 4.629 4.931 . 0 0 "[ . 1 . 2 . 3 . ]" 1 53 1 12 LEU MD1 1 14 VAL MG2 5.000 . 7.000 1.934 1.680 2.352 0.120 32 0 "[ . 1 . 2 . 3 . ]" 1 54 1 12 LEU MD1 1 27 VAL MG1 5.000 . 7.000 2.959 2.525 3.209 . 0 0 "[ . 1 . 2 . 3 . ]" 1 55 1 12 LEU MD2 1 13 GLU HA 5.000 . 6.000 3.451 3.119 4.110 . 0 0 "[ . 1 . 2 . 3 . ]" 1 56 1 12 LEU MD2 1 28 THR HB 5.000 . 6.000 3.934 3.740 4.209 . 0 0 "[ . 1 . 2 . 3 . ]" 1 57 1 12 LEU MD2 1 29 LEU HA 5.000 . 6.000 2.596 2.214 3.064 . 0 0 "[ . 1 . 2 . 3 . ]" 1 58 1 12 LEU MD2 1 29 LEU MD1 5.000 . 7.000 2.840 2.290 3.454 . 0 0 "[ . 1 . 2 . 3 . ]" 1 59 1 12 LEU MD2 1 29 LEU MD2 4.000 . 6.000 3.104 2.610 3.595 . 0 0 "[ . 1 . 2 . 3 . ]" 1 60 1 12 LEU MD2 1 29 LEU HG 5.000 . 6.000 2.055 1.698 2.685 0.102 32 0 "[ . 1 . 2 . 3 . ]" 1 61 1 13 GLU HA 1 14 VAL MG2 5.000 . 6.000 3.518 3.171 3.860 . 0 0 "[ . 1 . 2 . 3 . ]" 1 62 1 13 GLU HA 1 28 THR HB 5.000 . 5.000 4.856 4.649 5.025 0.025 25 0 "[ . 1 . 2 . 3 . ]" 1 63 1 13 GLU QB 1 28 THR HB 3.000 . 3.900 2.238 1.919 3.168 . 0 0 "[ . 1 . 2 . 3 . ]" 1 64 1 13 GLU QB 1 28 THR MG 5.000 . 6.900 3.401 3.067 4.161 . 0 0 "[ . 1 . 2 . 3 . ]" 1 65 1 13 GLU QG 1 28 THR HB 5.000 . 6.000 4.005 1.740 4.480 0.060 25 0 "[ . 1 . 2 . 3 . ]" 1 66 1 13 GLU QG 1 28 THR MG 5.000 . 7.000 4.419 2.986 4.915 . 0 0 "[ . 1 . 2 . 3 . ]" 1 67 1 12 LEU MD2 1 14 VAL HA 5.000 . 6.000 3.828 3.474 4.124 . 0 0 "[ . 1 . 2 . 3 . ]" 1 68 1 14 VAL HA 1 14 VAL HB 3.000 . 3.000 3.026 3.021 3.030 0.030 21 0 "[ . 1 . 2 . 3 . ]" 1 69 1 14 VAL HA 1 14 VAL MG1 3.000 . 4.000 2.374 2.233 2.462 . 0 0 "[ . 1 . 2 . 3 . ]" 1 70 1 14 VAL HA 1 15 LYS QB 5.000 . 5.900 3.998 3.812 4.490 . 0 0 "[ . 1 . 2 . 3 . ]" 1 71 1 14 VAL HA 1 27 VAL HA 4.000 . 4.000 2.450 2.320 2.543 . 0 0 "[ . 1 . 2 . 3 . ]" 1 72 1 14 VAL HA 1 27 VAL MG1 5.000 . 6.000 3.911 3.757 4.056 . 0 0 "[ . 1 . 2 . 3 . ]" 1 73 1 14 VAL HA 1 27 VAL MG2 5.000 . 6.000 3.637 3.480 3.909 . 0 0 "[ . 1 . 2 . 3 . ]" 1 74 1 14 VAL HB 1 16 VAL MG2 5.000 . 6.000 4.386 4.223 4.527 . 0 0 "[ . 1 . 2 . 3 . ]" 1 75 1 14 VAL HB 1 27 VAL MG1 5.000 . 6.000 4.690 4.419 4.836 . 0 0 "[ . 1 . 2 . 3 . ]" 1 76 1 14 VAL HB 1 27 VAL MG2 5.000 . 6.000 4.682 4.458 4.836 . 0 0 "[ . 1 . 2 . 3 . ]" 1 77 1 14 VAL HB 1 94 ILE MD 5.000 . 6.000 3.838 3.255 4.859 . 0 0 "[ . 1 . 2 . 3 . ]" 1 78 1 14 VAL MG1 1 16 VAL HA 5.000 . 6.000 4.566 4.439 4.678 . 0 0 "[ . 1 . 2 . 3 . ]" 1 79 1 14 VAL MG1 1 16 VAL HB 5.000 . 6.000 4.872 4.684 4.938 . 0 0 "[ . 1 . 2 . 3 . ]" 1 80 1 14 VAL MG1 1 16 VAL MG2 4.000 . 6.000 2.588 2.366 2.677 . 0 0 "[ . 1 . 2 . 3 . ]" 1 81 1 14 VAL MG1 1 25 TYR HA 5.000 . 6.000 3.366 3.246 3.495 . 0 0 "[ . 1 . 2 . 3 . ]" 1 82 1 14 VAL MG1 1 27 VAL HA 5.000 . 6.000 3.129 2.817 3.312 . 0 0 "[ . 1 . 2 . 3 . ]" 1 83 1 14 VAL MG1 1 27 VAL HB 5.000 . 6.000 4.781 4.599 4.893 . 0 0 "[ . 1 . 2 . 3 . ]" 1 84 1 14 VAL MG1 1 27 VAL MG1 5.000 . 7.000 3.334 3.196 3.447 . 0 0 "[ . 1 . 2 . 3 . ]" 1 85 1 14 VAL MG1 1 27 VAL MG2 4.000 . 6.000 2.239 2.074 2.519 . 0 0 "[ . 1 . 2 . 3 . ]" 1 86 1 14 VAL MG1 1 15 LYS HA 4.000 . 5.000 3.720 3.533 3.979 . 0 0 "[ . 1 . 2 . 3 . ]" 1 87 1 15 LYS HA 1 15 LYS QG 3.000 . 3.900 2.280 1.939 3.352 . 0 0 "[ . 1 . 2 . 3 . ]" 1 88 1 15 LYS HA 1 16 VAL MG2 5.000 . 6.000 3.339 3.233 3.526 . 0 0 "[ . 1 . 2 . 3 . ]" 1 89 1 15 LYS HA 1 15 LYS QD 4.000 . 5.000 3.476 1.890 4.124 . 0 0 "[ . 1 . 2 . 3 . ]" 1 90 1 15 LYS QB 1 15 LYS QD 3.000 . 4.800 2.097 1.883 2.389 . 0 0 "[ . 1 . 2 . 3 . ]" 1 91 1 16 VAL HA 1 16 VAL HB 3.000 . 3.000 3.023 3.018 3.026 0.026 28 0 "[ . 1 . 2 . 3 . ]" 1 92 1 16 VAL HA 1 25 TYR HA 4.000 . 4.000 2.599 2.509 2.710 . 0 0 "[ . 1 . 2 . 3 . ]" 1 93 1 16 VAL MG1 1 17 ASN HA 5.000 . 6.000 3.441 3.299 3.591 . 0 0 "[ . 1 . 2 . 3 . ]" 1 94 1 16 VAL MG1 1 18 ASP HA 5.000 . 6.000 4.140 3.980 4.338 . 0 0 "[ . 1 . 2 . 3 . ]" 1 95 1 16 VAL MG1 1 18 ASP QB 5.000 . 6.900 3.824 3.260 4.332 . 0 0 "[ . 1 . 2 . 3 . ]" 1 96 1 16 VAL MG1 1 23 ALA HA 5.000 . 6.000 3.972 3.761 4.184 . 0 0 "[ . 1 . 2 . 3 . ]" 1 97 1 16 VAL MG1 1 23 ALA MB 5.000 . 7.000 2.704 2.488 2.883 . 0 0 "[ . 1 . 2 . 3 . ]" 1 98 1 16 VAL MG1 1 25 TYR HA 5.000 . 6.000 3.333 3.153 3.550 . 0 0 "[ . 1 . 2 . 3 . ]" 1 99 1 16 VAL MG1 1 25 TYR QB 5.000 . 6.900 4.168 4.058 4.404 . 0 0 "[ . 1 . 2 . 3 . ]" 1 100 1 16 VAL MG2 1 25 TYR HA 5.000 . 6.000 1.836 1.805 1.886 . 0 0 "[ . 1 . 2 . 3 . ]" 1 101 1 17 ASN QB 1 24 GLU QB 5.000 . 6.800 2.414 1.959 3.135 . 0 0 "[ . 1 . 2 . 3 . ]" 1 102 1 18 ASP HA 1 23 ALA HA 3.000 . 3.000 1.832 1.788 1.888 0.012 6 0 "[ . 1 . 2 . 3 . ]" 1 103 1 18 ASP HA 1 23 ALA MB 4.000 . 5.000 2.890 2.610 3.062 . 0 0 "[ . 1 . 2 . 3 . ]" 1 104 1 17 ASN HA 1 18 ASP QB 5.000 . 5.900 4.440 4.128 4.605 . 0 0 "[ . 1 . 2 . 3 . ]" 1 105 1 18 ASP QB 1 23 ALA HA 5.000 . 5.900 3.377 3.123 3.707 . 0 0 "[ . 1 . 2 . 3 . ]" 1 106 1 18 ASP QB 1 23 ALA MB 5.000 . 6.900 2.822 2.391 3.374 . 0 0 "[ . 1 . 2 . 3 . ]" 1 107 1 17 ASN QB 1 19 TRP HE3 5.000 . 5.900 4.187 3.017 4.460 . 0 0 "[ . 1 . 2 . 3 . ]" 1 108 1 19 TRP HH2 1 22 GLY QA 5.000 . 5.900 3.968 3.871 4.077 . 0 0 "[ . 1 . 2 . 3 . ]" 1 109 1 19 TRP HH2 1 24 GLU QB 5.000 . 5.900 3.613 3.536 3.744 . 0 0 "[ . 1 . 2 . 3 . ]" 1 110 1 19 TRP HH2 1 24 GLU QG 5.000 . 5.900 2.251 2.005 2.508 . 0 0 "[ . 1 . 2 . 3 . ]" 1 111 1 19 TRP HH2 1 82 ILE MD 5.000 . 6.000 3.615 3.579 3.655 . 0 0 "[ . 1 . 2 . 3 . ]" 1 112 1 19 TRP HH2 1 82 ILE QG 5.000 . 5.900 1.825 1.800 1.866 . 0 0 "[ . 1 . 2 . 3 . ]" 1 113 1 19 TRP HH2 1 82 ILE MG 3.000 . 4.000 1.755 1.738 1.778 0.062 31 0 "[ . 1 . 2 . 3 . ]" 1 114 1 17 ASN QB 1 19 TRP HZ3 5.000 . 5.900 3.806 3.075 4.372 . 0 0 "[ . 1 . 2 . 3 . ]" 1 115 1 19 TRP HZ3 1 24 GLU QB 5.000 . 5.900 1.893 1.835 2.149 . 0 0 "[ . 1 . 2 . 3 . ]" 1 116 1 19 TRP HZ3 1 24 GLU QG 5.000 . 5.900 1.946 1.835 2.094 . 0 0 "[ . 1 . 2 . 3 . ]" 1 117 1 19 TRP HZ3 1 82 ILE QG 5.000 . 5.900 3.252 3.155 3.326 . 0 0 "[ . 1 . 2 . 3 . ]" 1 118 1 19 TRP HZ3 1 82 ILE MG 5.000 . 6.000 3.800 3.784 3.817 . 0 0 "[ . 1 . 2 . 3 . ]" 1 119 1 20 GLY QA 1 87 GLN QG 5.000 . 6.800 3.207 1.781 4.886 0.019 15 0 "[ . 1 . 2 . 3 . ]" 1 120 1 22 GLY QA 1 82 ILE MG 5.000 . 6.900 2.924 2.864 2.991 . 0 0 "[ . 1 . 2 . 3 . ]" 1 121 1 22 GLY QA 1 84 ASN HA 4.000 . 4.900 2.077 1.826 2.298 . 0 0 "[ . 1 . 2 . 3 . ]" 1 122 1 23 ALA HA 1 82 ILE MG 5.000 . 6.000 4.102 3.992 4.192 . 0 0 "[ . 1 . 2 . 3 . ]" 1 123 1 23 ALA MB 1 82 ILE QG 5.000 . 6.900 4.930 4.876 4.958 . 0 0 "[ . 1 . 2 . 3 . ]" 1 124 1 23 ALA MB 1 89 ASP HA 5.000 . 6.000 3.739 2.960 4.423 . 0 0 "[ . 1 . 2 . 3 . ]" 1 125 1 24 GLU HA 1 82 ILE HA 5.000 . 5.000 2.401 2.352 2.461 . 0 0 "[ . 1 . 2 . 3 . ]" 1 126 1 24 GLU HA 1 82 ILE MD 5.000 . 6.000 2.347 2.286 2.418 . 0 0 "[ . 1 . 2 . 3 . ]" 1 127 1 24 GLU HA 1 82 ILE QG 5.000 . 5.900 1.832 1.796 1.863 0.004 18 0 "[ . 1 . 2 . 3 . ]" 1 128 1 24 GLU HA 1 82 ILE MG 5.000 . 6.000 3.395 3.274 3.475 . 0 0 "[ . 1 . 2 . 3 . ]" 1 129 1 16 VAL HA 1 24 GLU QB 5.000 . 5.900 3.317 3.206 3.454 . 0 0 "[ . 1 . 2 . 3 . ]" 1 130 1 17 ASN HA 1 24 GLU QB 5.000 . 5.900 4.145 3.932 4.332 . 0 0 "[ . 1 . 2 . 3 . ]" 1 131 1 24 GLU QB 1 82 ILE MD 5.000 . 6.900 3.485 3.418 3.575 . 0 0 "[ . 1 . 2 . 3 . ]" 1 132 1 24 GLU QB 1 82 ILE MG 5.000 . 6.900 4.537 4.461 4.616 . 0 0 "[ . 1 . 2 . 3 . ]" 1 133 1 17 ASN QB 1 24 GLU QG 5.000 . 6.800 4.148 3.441 4.836 . 0 0 "[ . 1 . 2 . 3 . ]" 1 134 1 24 GLU QG 1 82 ILE HA 5.000 . 5.900 3.670 3.613 3.772 . 0 0 "[ . 1 . 2 . 3 . ]" 1 135 1 24 GLU QG 1 82 ILE MD 4.000 . 5.900 2.055 1.965 2.313 . 0 0 "[ . 1 . 2 . 3 . ]" 1 136 1 24 GLU QG 1 82 ILE MG 5.000 . 6.900 3.153 3.047 3.306 . 0 0 "[ . 1 . 2 . 3 . ]" 1 137 1 25 TYR HA 1 94 ILE MD 5.000 . 6.000 3.939 3.638 4.362 . 0 0 "[ . 1 . 2 . 3 . ]" 1 138 1 14 VAL MG1 1 25 TYR QB 4.000 . 5.900 3.122 2.956 3.258 . 0 0 "[ . 1 . 2 . 3 . ]" 1 139 1 16 VAL HA 1 25 TYR QB 5.000 . 5.900 4.614 4.526 4.748 . 0 0 "[ . 1 . 2 . 3 . ]" 1 140 1 25 TYR QB 1 27 VAL MG2 5.000 . 6.900 3.193 2.867 3.352 . 0 0 "[ . 1 . 2 . 3 . ]" 1 141 1 25 TYR QB 1 94 ILE MD 5.000 . 6.900 2.320 2.020 2.638 . 0 0 "[ . 1 . 2 . 3 . ]" 1 142 1 14 VAL MG1 1 25 TYR QD 3.000 . 6.000 3.416 2.980 3.652 . 0 0 "[ . 1 . 2 . 3 . ]" 1 143 1 16 VAL HA 1 25 TYR QD 5.000 . 7.000 4.250 3.985 4.483 . 0 0 "[ . 1 . 2 . 3 . ]" 1 144 1 16 VAL HB 1 25 TYR QD 4.000 . 6.000 4.488 4.265 4.746 . 0 0 "[ . 1 . 2 . 3 . ]" 1 145 1 16 VAL MG2 1 25 TYR QD 5.000 . 8.000 1.897 1.704 2.133 0.096 38 0 "[ . 1 . 2 . 3 . ]" 1 146 1 24 GLU HA 1 25 TYR QD 5.000 . 7.000 3.018 2.834 3.447 . 0 0 "[ . 1 . 2 . 3 . ]" 1 147 1 25 TYR HA 1 25 TYR QD 4.000 . 6.000 2.873 2.587 2.979 . 0 0 "[ . 1 . 2 . 3 . ]" 1 148 1 25 TYR QD 1 82 ILE MG 5.000 . 8.000 4.272 4.110 4.438 . 0 0 "[ . 1 . 2 . 3 . ]" 1 149 1 25 TYR QD 1 83 VAL HA 5.000 . 7.000 5.214 5.011 5.426 . 0 0 "[ . 1 . 2 . 3 . ]" 1 150 1 25 TYR QD 1 83 VAL MG2 3.000 . 6.000 3.672 3.421 3.986 . 0 0 "[ . 1 . 2 . 3 . ]" 1 151 1 25 TYR QD 1 91 VAL MG1 4.000 . 7.000 2.948 2.612 3.402 . 0 0 "[ . 1 . 2 . 3 . ]" 1 152 1 25 TYR QD 1 91 VAL MG2 3.000 . 6.000 3.959 3.742 4.253 . 0 0 "[ . 1 . 2 . 3 . ]" 1 153 1 25 TYR QD 1 94 ILE MD 4.000 . 7.000 2.173 1.927 2.559 . 0 0 "[ . 1 . 2 . 3 . ]" 1 154 1 16 VAL MG1 1 25 TYR QE 5.000 . 8.000 2.474 2.088 2.877 . 0 0 "[ . 1 . 2 . 3 . ]" 1 155 1 16 VAL MG2 1 25 TYR QE 5.000 . 8.000 2.675 2.095 2.978 . 0 0 "[ . 1 . 2 . 3 . ]" 1 156 1 23 ALA HA 1 25 TYR QE 5.000 . 7.000 4.007 3.791 4.319 . 0 0 "[ . 1 . 2 . 3 . ]" 1 157 1 25 TYR QE 1 82 ILE MD 5.000 . 8.000 5.204 5.036 5.507 . 0 0 "[ . 1 . 2 . 3 . ]" 1 158 1 25 TYR QE 1 82 ILE QG 5.000 . 7.900 4.949 4.795 5.454 . 0 0 "[ . 1 . 2 . 3 . ]" 1 159 1 25 TYR QE 1 82 ILE MG 5.000 . 8.000 4.072 3.826 4.524 . 0 0 "[ . 1 . 2 . 3 . ]" 1 160 1 25 TYR QE 1 83 VAL HA 5.000 . 7.000 4.650 4.355 4.869 . 0 0 "[ . 1 . 2 . 3 . ]" 1 161 1 25 TYR QE 1 83 VAL HB 4.000 . 6.000 2.261 1.969 2.543 . 0 0 "[ . 1 . 2 . 3 . ]" 1 162 1 25 TYR QE 1 90 LYS QB 5.000 . 7.900 3.585 3.189 3.956 . 0 0 "[ . 1 . 2 . 3 . ]" 1 163 1 25 TYR QE 1 91 VAL HB 4.000 . 6.000 3.488 3.260 3.700 . 0 0 "[ . 1 . 2 . 3 . ]" 1 164 1 26 ASP HA 1 27 VAL MG2 5.000 . 6.000 3.149 2.956 3.599 . 0 0 "[ . 1 . 2 . 3 . ]" 1 165 1 26 ASP HA 1 80 GLY QA 5.000 . 5.900 2.242 2.069 2.391 . 0 0 "[ . 1 . 2 . 3 . ]" 1 166 1 15 LYS HA 1 26 ASP QB 4.000 . 4.900 4.347 4.054 4.492 . 0 0 "[ . 1 . 2 . 3 . ]" 1 167 1 15 LYS QB 1 26 ASP QB 4.000 . 5.800 2.216 1.909 3.040 . 0 0 "[ . 1 . 2 . 3 . ]" 1 168 1 15 LYS QG 1 26 ASP QB 5.000 . 6.800 3.740 1.652 4.317 0.148 2 0 "[ . 1 . 2 . 3 . ]" 1 169 1 16 VAL HA 1 26 ASP QB 5.000 . 5.900 4.382 4.148 4.715 . 0 0 "[ . 1 . 2 . 3 . ]" 1 170 1 12 LEU MD2 1 27 VAL HA 5.000 . 6.000 2.857 2.548 3.043 . 0 0 "[ . 1 . 2 . 3 . ]" 1 171 1 27 VAL HA 1 28 THR HB 5.000 . 5.000 4.813 4.672 4.929 . 0 0 "[ . 1 . 2 . 3 . ]" 1 172 1 27 VAL HA 1 29 LEU MD1 5.000 . 6.000 4.817 4.774 4.907 . 0 0 "[ . 1 . 2 . 3 . ]" 1 173 1 12 LEU HA 1 27 VAL MG1 5.000 . 6.000 4.522 4.223 4.723 . 0 0 "[ . 1 . 2 . 3 . ]" 1 174 1 14 VAL MG2 1 27 VAL MG1 4.000 . 6.000 2.043 1.840 2.310 . 0 0 "[ . 1 . 2 . 3 . ]" 1 175 1 27 VAL MG1 1 29 LEU HA 5.000 . 6.000 4.605 4.283 4.797 . 0 0 "[ . 1 . 2 . 3 . ]" 1 176 1 27 VAL MG1 1 29 LEU MD1 5.000 . 7.000 2.154 2.034 2.351 . 0 0 "[ . 1 . 2 . 3 . ]" 1 177 1 27 VAL MG1 1 29 LEU MD2 4.000 . 6.000 3.977 3.767 4.089 . 0 0 "[ . 1 . 2 . 3 . ]" 1 178 1 27 VAL MG1 1 29 LEU HG 5.000 . 6.000 3.118 2.834 3.361 . 0 0 "[ . 1 . 2 . 3 . ]" 1 179 1 27 VAL MG1 1 39 VAL MG2 5.000 . 7.000 2.229 2.064 2.391 . 0 0 "[ . 1 . 2 . 3 . ]" 1 180 1 27 VAL MG1 1 78 THR HA 5.000 . 6.000 4.853 4.772 4.947 . 0 0 "[ . 1 . 2 . 3 . ]" 1 181 1 27 VAL MG1 1 94 ILE MD 5.000 . 7.000 4.181 3.755 4.527 . 0 0 "[ . 1 . 2 . 3 . ]" 1 182 1 27 VAL MG1 1 96 LEU MD1 4.000 . 6.000 3.800 3.591 4.076 . 0 0 "[ . 1 . 2 . 3 . ]" 1 183 1 14 VAL MG2 1 27 VAL MG2 4.000 . 6.000 2.660 2.202 2.939 . 0 0 "[ . 1 . 2 . 3 . ]" 1 184 1 27 VAL MG2 1 39 VAL MG1 5.000 . 7.000 2.901 2.655 3.203 . 0 0 "[ . 1 . 2 . 3 . ]" 1 185 1 27 VAL MG2 1 80 GLY QA 5.000 . 6.900 2.532 2.269 2.904 . 0 0 "[ . 1 . 2 . 3 . ]" 1 186 1 27 VAL MG2 1 94 ILE MD 5.000 . 7.000 3.197 2.699 3.575 . 0 0 "[ . 1 . 2 . 3 . ]" 1 187 1 27 VAL MG2 1 94 ILE MG 5.000 . 7.000 3.115 2.763 3.532 . 0 0 "[ . 1 . 2 . 3 . ]" 1 188 1 27 VAL MG1 1 28 THR HA 5.000 . 6.000 4.521 4.380 4.612 . 0 0 "[ . 1 . 2 . 3 . ]" 1 189 1 28 THR HA 1 78 THR HA 3.000 . 3.000 1.950 1.843 2.082 . 0 0 "[ . 1 . 2 . 3 . ]" 1 190 1 28 THR HA 1 78 THR MG 5.000 . 6.000 2.222 1.847 2.733 . 0 0 "[ . 1 . 2 . 3 . ]" 1 191 1 28 THR HB 1 78 THR MG 5.000 . 6.000 3.830 3.316 4.371 . 0 0 "[ . 1 . 2 . 3 . ]" 1 192 1 28 THR MG 1 30 ASN QB 5.000 . 6.900 4.919 4.676 5.051 . 0 0 "[ . 1 . 2 . 3 . ]" 1 193 1 28 THR MG 1 78 THR HA 5.000 . 6.000 3.368 3.175 3.547 . 0 0 "[ . 1 . 2 . 3 . ]" 1 194 1 28 THR MG 1 78 THR MG 3.000 . 5.000 2.518 1.923 3.074 . 0 0 "[ . 1 . 2 . 3 . ]" 1 195 1 29 LEU HA 1 29 LEU MD2 4.000 . 5.000 2.661 2.525 2.749 . 0 0 "[ . 1 . 2 . 3 . ]" 1 196 1 12 LEU HA 1 29 LEU QB 4.000 . 4.900 4.329 4.273 4.413 . 0 0 "[ . 1 . 2 . 3 . ]" 1 197 1 29 LEU QB 1 31 LEU MD1 3.000 . 4.900 3.185 3.013 3.329 . 0 0 "[ . 1 . 2 . 3 . ]" 1 198 1 29 LEU QB 1 77 ALA MB 5.000 . 6.900 2.895 2.487 3.190 . 0 0 "[ . 1 . 2 . 3 . ]" 1 199 1 29 LEU MD1 1 31 LEU MD1 5.000 . 7.000 4.246 4.056 4.433 . 0 0 "[ . 1 . 2 . 3 . ]" 1 200 1 29 LEU MD1 1 31 LEU MD2 5.000 . 7.000 4.411 4.039 4.619 . 0 0 "[ . 1 . 2 . 3 . ]" 1 201 1 29 LEU MD1 1 39 VAL MG2 5.000 . 7.000 1.834 1.696 1.963 0.104 5 0 "[ . 1 . 2 . 3 . ]" 1 202 1 29 LEU MD1 1 77 ALA MB 4.000 . 6.000 3.419 2.843 3.778 . 0 0 "[ . 1 . 2 . 3 . ]" 1 203 1 29 LEU MD1 1 96 LEU MD1 5.000 . 7.000 2.896 2.668 3.248 . 0 0 "[ . 1 . 2 . 3 . ]" 1 204 1 29 LEU MD1 1 98 ILE MD 5.000 . 7.000 4.410 4.076 4.622 . 0 0 "[ . 1 . 2 . 3 . ]" 1 205 1 11 SER HA 1 29 LEU MD2 5.000 . 6.000 4.832 4.722 4.882 . 0 0 "[ . 1 . 2 . 3 . ]" 1 206 1 12 LEU HA 1 29 LEU MD2 4.000 . 5.000 3.272 3.153 3.364 . 0 0 "[ . 1 . 2 . 3 . ]" 1 207 1 12 LEU MD1 1 29 LEU MD2 5.000 . 7.000 4.095 3.348 4.381 . 0 0 "[ . 1 . 2 . 3 . ]" 1 208 1 29 LEU MD2 1 31 LEU MD1 5.000 . 7.000 3.226 3.010 3.417 . 0 0 "[ . 1 . 2 . 3 . ]" 1 209 1 29 LEU MD2 1 31 LEU MD2 5.000 . 7.000 2.453 2.115 2.650 . 0 0 "[ . 1 . 2 . 3 . ]" 1 210 1 29 LEU MD2 1 39 VAL MG2 5.000 . 7.000 3.002 2.779 3.145 . 0 0 "[ . 1 . 2 . 3 . ]" 1 211 1 29 LEU MD2 1 96 LEU HA 5.000 . 6.000 4.745 4.518 4.857 . 0 0 "[ . 1 . 2 . 3 . ]" 1 212 1 29 LEU MD2 1 96 LEU MD1 4.000 . 6.000 1.565 1.540 1.660 0.260 14 0 "[ . 1 . 2 . 3 . ]" 1 213 1 29 LEU MD2 1 96 LEU MD2 4.000 . 6.000 1.951 1.789 2.067 0.011 21 0 "[ . 1 . 2 . 3 . ]" 1 214 1 12 LEU MD1 1 29 LEU HG 4.000 . 5.000 4.163 3.746 4.293 . 0 0 "[ . 1 . 2 . 3 . ]" 1 215 1 29 LEU HA 1 29 LEU HG 4.000 . 4.000 2.116 2.079 2.179 . 0 0 "[ . 1 . 2 . 3 . ]" 1 216 1 30 ASN HA 1 31 LEU MD1 5.000 . 6.000 4.742 4.530 5.015 . 0 0 "[ . 1 . 2 . 3 . ]" 1 217 1 30 ASN HA 1 31 LEU MD2 5.000 . 6.000 4.037 3.714 4.261 . 0 0 "[ . 1 . 2 . 3 . ]" 1 218 1 30 ASN HA 1 31 LEU HG 5.000 . 5.000 3.336 3.136 3.550 . 0 0 "[ . 1 . 2 . 3 . ]" 1 219 1 30 ASN HA 1 76 THR HA 3.000 . 3.000 2.250 2.071 2.486 . 0 0 "[ . 1 . 2 . 3 . ]" 1 220 1 30 ASN HA 1 76 THR HB 5.000 . 5.000 4.666 4.498 4.873 . 0 0 "[ . 1 . 2 . 3 . ]" 1 221 1 30 ASN QB 1 76 THR HA 5.000 . 5.900 4.215 4.000 4.459 . 0 0 "[ . 1 . 2 . 3 . ]" 1 222 1 31 LEU HA 1 31 LEU MD2 4.000 . 5.000 2.070 1.916 2.419 . 0 0 "[ . 1 . 2 . 3 . ]" 1 223 1 31 LEU HA 1 31 LEU HG 4.000 . 4.000 3.193 3.108 3.400 . 0 0 "[ . 1 . 2 . 3 . ]" 1 224 1 31 LEU HA 1 98 ILE MD 5.000 . 6.000 4.898 4.546 5.054 . 0 0 "[ . 1 . 2 . 3 . ]" 1 225 1 31 LEU QB 1 75 PRO HA 4.000 . 4.900 1.990 1.816 2.150 . 0 0 "[ . 1 . 2 . 3 . ]" 1 226 1 31 LEU MD1 1 34 GLN HA 5.000 . 6.000 3.771 3.298 4.313 . 0 0 "[ . 1 . 2 . 3 . ]" 1 227 1 31 LEU MD1 1 35 TYR HA 5.000 . 6.000 4.375 4.051 4.712 . 0 0 "[ . 1 . 2 . 3 . ]" 1 228 1 31 LEU MD1 1 35 TYR QB 5.000 . 6.900 2.181 1.725 2.525 0.075 8 0 "[ . 1 . 2 . 3 . ]" 1 229 1 31 LEU MD1 1 37 TRP QB 5.000 . 6.900 2.515 2.094 2.927 . 0 0 "[ . 1 . 2 . 3 . ]" 1 230 1 31 LEU MD1 1 74 GLY QA 5.000 . 6.900 4.661 4.352 4.931 . 0 0 "[ . 1 . 2 . 3 . ]" 1 231 1 31 LEU MD1 1 75 PRO HA 5.000 . 6.000 3.533 3.023 3.737 . 0 0 "[ . 1 . 2 . 3 . ]" 1 232 1 31 LEU MD1 1 98 ILE MD 5.000 . 7.000 2.680 1.995 3.130 . 0 0 "[ . 1 . 2 . 3 . ]" 1 233 1 31 LEU MD1 1 98 ILE MG 5.000 . 7.000 3.776 3.371 4.149 . 0 0 "[ . 1 . 2 . 3 . ]" 1 234 1 29 LEU QB 1 31 LEU MD2 5.000 . 6.900 3.079 2.476 3.397 . 0 0 "[ . 1 . 2 . 3 . ]" 1 235 1 10 GLY QA 1 32 ASP QB 5.000 . 6.800 4.714 4.376 5.003 . 0 0 "[ . 1 . 2 . 3 . ]" 1 236 1 32 ASP QB 1 75 PRO QB 5.000 . 6.800 4.521 4.231 4.783 . 0 0 "[ . 1 . 2 . 3 . ]" 1 237 1 33 GLY QA 1 75 PRO QB 5.000 . 6.800 2.570 2.028 2.973 . 0 0 "[ . 1 . 2 . 3 . ]" 1 238 1 34 GLN HA 1 34 GLN QG 3.000 . 3.900 2.281 2.019 2.674 . 0 0 "[ . 1 . 2 . 3 . ]" 1 239 1 34 GLN QB 1 74 GLY QA 5.000 . 6.800 3.691 2.513 4.395 . 0 0 "[ . 1 . 2 . 3 . ]" 1 240 1 35 TYR HA 1 98 ILE MD 5.000 . 6.000 4.764 4.334 4.926 . 0 0 "[ . 1 . 2 . 3 . ]" 1 241 1 35 TYR HA 1 98 ILE MG 5.000 . 6.000 3.912 3.637 4.213 . 0 0 "[ . 1 . 2 . 3 . ]" 1 242 1 31 LEU MD2 1 35 TYR QB 5.000 . 6.900 3.051 2.479 3.995 . 0 0 "[ . 1 . 2 . 3 . ]" 1 243 1 35 TYR QB 1 98 ILE MD 5.000 . 6.900 2.516 2.289 2.638 . 0 0 "[ . 1 . 2 . 3 . ]" 1 244 1 35 TYR QB 1 98 ILE QG 5.000 . 6.800 4.387 4.206 4.499 . 0 0 "[ . 1 . 2 . 3 . ]" 1 245 1 35 TYR QB 1 98 ILE MG 5.000 . 6.900 2.333 2.185 2.450 . 0 0 "[ . 1 . 2 . 3 . ]" 1 246 1 31 LEU HA 1 35 TYR QD 5.000 . 7.000 4.085 3.332 4.664 . 0 0 "[ . 1 . 2 . 3 . ]" 1 247 1 31 LEU QB 1 35 TYR QD 5.000 . 7.900 1.963 1.729 2.583 0.071 21 0 "[ . 1 . 2 . 3 . ]" 1 248 1 31 LEU MD1 1 35 TYR QD 4.000 . 7.000 2.488 1.838 3.223 . 0 0 "[ . 1 . 2 . 3 . ]" 1 249 1 31 LEU MD2 1 35 TYR QD 5.000 . 8.000 3.189 2.321 3.753 . 0 0 "[ . 1 . 2 . 3 . ]" 1 250 1 31 LEU HG 1 35 TYR QD 5.000 . 7.000 4.339 3.887 5.021 . 0 0 "[ . 1 . 2 . 3 . ]" 1 251 1 33 GLY QA 1 35 TYR QD 5.000 . 7.900 4.218 3.460 4.540 . 0 0 "[ . 1 . 2 . 3 . ]" 1 252 1 34 GLN HA 1 35 TYR QD 5.000 . 7.000 3.600 2.882 4.430 . 0 0 "[ . 1 . 2 . 3 . ]" 1 253 1 35 TYR HA 1 35 TYR QD 3.000 . 5.000 2.789 2.054 3.223 . 0 0 "[ . 1 . 2 . 3 . ]" 1 254 1 35 TYR QD 1 98 ILE MD 5.000 . 8.000 3.660 3.075 4.096 . 0 0 "[ . 1 . 2 . 3 . ]" 1 255 1 35 TYR QD 1 98 ILE MG 5.000 . 8.000 3.784 3.175 4.094 . 0 0 "[ . 1 . 2 . 3 . ]" 1 256 1 31 LEU HA 1 35 TYR QE 5.000 . 7.000 3.903 3.150 4.900 . 0 0 "[ . 1 . 2 . 3 . ]" 1 257 1 31 LEU QB 1 35 TYR QE 5.000 . 7.900 2.622 2.053 3.538 . 0 0 "[ . 1 . 2 . 3 . ]" 1 258 1 31 LEU MD1 1 35 TYR QE 5.000 . 8.000 4.185 3.626 4.791 . 0 0 "[ . 1 . 2 . 3 . ]" 1 259 1 31 LEU MD2 1 35 TYR QE 5.000 . 8.000 4.241 3.631 4.739 . 0 0 "[ . 1 . 2 . 3 . ]" 1 260 1 31 LEU HG 1 35 TYR QE 5.000 . 7.000 5.394 4.725 6.292 . 0 0 "[ . 1 . 2 . 3 . ]" 1 261 1 33 GLY QA 1 35 TYR QE 5.000 . 7.900 2.738 2.126 3.102 . 0 0 "[ . 1 . 2 . 3 . ]" 1 262 1 35 TYR QE 1 98 ILE MD 5.000 . 8.000 5.251 4.905 5.487 . 0 0 "[ . 1 . 2 . 3 . ]" 1 263 1 35 TYR QE 1 98 ILE MG 5.000 . 8.000 5.518 5.154 5.719 . 0 0 "[ . 1 . 2 . 3 . ]" 1 264 1 36 ASP HA 1 68 PRO QB 5.000 . 5.900 3.927 3.587 4.197 . 0 0 "[ . 1 . 2 . 3 . ]" 1 265 1 36 ASP HA 1 68 PRO QG 4.000 . 4.900 2.110 1.842 2.388 . 0 0 "[ . 1 . 2 . 3 . ]" 1 266 1 36 ASP QB 1 98 ILE HA 5.000 . 5.900 4.338 4.185 4.606 . 0 0 "[ . 1 . 2 . 3 . ]" 1 267 1 29 LEU MD1 1 37 TRP HA 5.000 . 6.000 4.701 4.569 4.844 . 0 0 "[ . 1 . 2 . 3 . ]" 1 268 1 29 LEU MD2 1 37 TRP HA 5.000 . 6.000 4.228 4.030 4.456 . 0 0 "[ . 1 . 2 . 3 . ]" 1 269 1 31 LEU MD2 1 37 TRP HA 5.000 . 6.000 4.774 4.588 4.876 . 0 0 "[ . 1 . 2 . 3 . ]" 1 270 1 37 TRP HA 1 39 VAL MG2 5.000 . 6.000 4.669 4.580 4.751 . 0 0 "[ . 1 . 2 . 3 . ]" 1 271 1 37 TRP HA 1 96 LEU MD2 4.000 . 5.000 3.615 3.466 3.739 . 0 0 "[ . 1 . 2 . 3 . ]" 1 272 1 37 TRP HA 1 98 ILE HA 3.000 . 3.000 2.011 1.844 2.234 . 0 0 "[ . 1 . 2 . 3 . ]" 1 273 1 37 TRP HA 1 98 ILE HB 5.000 . 5.000 4.055 3.891 4.224 . 0 0 "[ . 1 . 2 . 3 . ]" 1 274 1 37 TRP HA 1 98 ILE MD 5.000 . 6.000 2.560 2.255 2.872 . 0 0 "[ . 1 . 2 . 3 . ]" 1 275 1 37 TRP HA 1 98 ILE QG 4.000 . 4.900 1.873 1.836 2.151 . 0 0 "[ . 1 . 2 . 3 . ]" 1 276 1 37 TRP HA 1 98 ILE MG 4.000 . 5.000 2.405 2.179 2.595 . 0 0 "[ . 1 . 2 . 3 . ]" 1 277 1 29 LEU MD1 1 37 TRP QB 5.000 . 6.900 2.498 2.372 2.696 . 0 0 "[ . 1 . 2 . 3 . ]" 1 278 1 29 LEU MD2 1 37 TRP QB 5.000 . 6.900 2.231 2.061 2.435 . 0 0 "[ . 1 . 2 . 3 . ]" 1 279 1 31 LEU MD2 1 37 TRP QB 5.000 . 6.900 2.908 2.726 3.079 . 0 0 "[ . 1 . 2 . 3 . ]" 1 280 1 31 LEU HG 1 37 TRP QB 5.000 . 5.900 4.601 4.224 4.814 . 0 0 "[ . 1 . 2 . 3 . ]" 1 281 1 37 TRP QB 1 39 VAL MG2 5.000 . 6.900 3.309 3.213 3.415 . 0 0 "[ . 1 . 2 . 3 . ]" 1 282 1 37 TRP QB 1 96 LEU MD1 4.000 . 5.900 3.338 3.133 3.649 . 0 0 "[ . 1 . 2 . 3 . ]" 1 283 1 37 TRP QB 1 98 ILE HA 5.000 . 5.900 3.819 3.676 4.032 . 0 0 "[ . 1 . 2 . 3 . ]" 1 284 1 37 TRP QB 1 98 ILE MD 5.000 . 6.900 1.851 1.704 2.151 0.096 36 0 "[ . 1 . 2 . 3 . ]" 1 285 1 37 TRP QB 1 98 ILE QG 5.000 . 6.800 2.509 2.338 2.766 . 0 0 "[ . 1 . 2 . 3 . ]" 1 286 1 37 TRP QB 1 98 ILE MG 5.000 . 6.900 3.003 2.725 3.246 . 0 0 "[ . 1 . 2 . 3 . ]" 1 287 1 29 LEU MD1 1 37 TRP HD1 5.000 . 6.000 4.779 4.707 4.832 . 0 0 "[ . 1 . 2 . 3 . ]" 1 288 1 31 LEU MD1 1 37 TRP HD1 4.000 . 5.000 2.020 1.855 2.297 . 0 0 "[ . 1 . 2 . 3 . ]" 1 289 1 31 LEU MD2 1 37 TRP HD1 5.000 . 6.000 3.866 3.471 4.350 . 0 0 "[ . 1 . 2 . 3 . ]" 1 290 1 35 TYR QB 1 37 TRP HD1 5.000 . 5.900 3.507 3.188 3.804 . 0 0 "[ . 1 . 2 . 3 . ]" 1 291 1 37 TRP HA 1 37 TRP HD1 5.000 . 5.000 4.267 4.229 4.305 . 0 0 "[ . 1 . 2 . 3 . ]" 1 292 1 37 TRP HD1 1 73 LYS HA 4.000 . 4.000 3.545 3.282 3.788 . 0 0 "[ . 1 . 2 . 3 . ]" 1 293 1 37 TRP HD1 1 98 ILE MD 5.000 . 6.000 3.570 3.324 3.885 . 0 0 "[ . 1 . 2 . 3 . ]" 1 294 1 37 TRP HD1 1 98 ILE MG 5.000 . 6.000 4.233 3.981 4.469 . 0 0 "[ . 1 . 2 . 3 . ]" 1 295 1 27 VAL MG1 1 37 TRP HE3 5.000 . 6.000 4.485 4.344 4.603 . 0 0 "[ . 1 . 2 . 3 . ]" 1 296 1 29 LEU MD1 1 37 TRP HE3 5.000 . 6.000 1.882 1.803 2.011 . 0 0 "[ . 1 . 2 . 3 . ]" 1 297 1 29 LEU MD2 1 37 TRP HE3 5.000 . 6.000 3.382 3.283 3.528 . 0 0 "[ . 1 . 2 . 3 . ]" 1 298 1 37 TRP HE3 1 38 THR HA 4.000 . 4.000 3.761 3.620 3.895 . 0 0 "[ . 1 . 2 . 3 . ]" 1 299 1 37 TRP HE3 1 39 VAL HB 5.000 . 5.000 4.403 4.228 4.607 . 0 0 "[ . 1 . 2 . 3 . ]" 1 300 1 37 TRP HE3 1 39 VAL MG2 4.000 . 5.000 2.030 1.916 2.167 . 0 0 "[ . 1 . 2 . 3 . ]" 1 301 1 37 TRP HE3 1 55 ALA MB 5.000 . 6.000 4.835 4.729 4.897 . 0 0 "[ . 1 . 2 . 3 . ]" 1 302 1 37 TRP HE3 1 67 THR HA 5.000 . 5.000 3.807 3.714 3.898 . 0 0 "[ . 1 . 2 . 3 . ]" 1 303 1 37 TRP HE3 1 96 LEU MD1 5.000 . 6.000 4.532 4.325 4.865 . 0 0 "[ . 1 . 2 . 3 . ]" 1 304 1 29 LEU MD1 1 37 TRP HH2 5.000 . 6.000 3.830 3.743 3.902 . 0 0 "[ . 1 . 2 . 3 . ]" 1 305 1 37 TRP HH2 1 39 VAL MG2 5.000 . 6.000 4.470 4.363 4.579 . 0 0 "[ . 1 . 2 . 3 . ]" 1 306 1 37 TRP HH2 1 55 ALA HA 5.000 . 5.000 3.169 3.043 3.327 . 0 0 "[ . 1 . 2 . 3 . ]" 1 307 1 37 TRP HH2 1 55 ALA MB 5.000 . 6.000 1.997 1.847 2.188 . 0 0 "[ . 1 . 2 . 3 . ]" 1 308 1 37 TRP HH2 1 68 PRO HA 5.000 . 5.000 3.308 3.126 3.535 . 0 0 "[ . 1 . 2 . 3 . ]" 1 309 1 37 TRP HH2 1 68 PRO QB 5.000 . 5.900 4.646 4.427 4.915 . 0 0 "[ . 1 . 2 . 3 . ]" 1 310 1 37 TRP HH2 1 79 PHE HA 5.000 . 5.000 5.018 4.896 5.057 0.057 32 0 "[ . 1 . 2 . 3 . ]" 1 311 1 37 TRP HZ2 1 55 ALA HA 5.000 . 5.000 4.397 4.212 4.595 . 0 0 "[ . 1 . 2 . 3 . ]" 1 312 1 37 TRP HZ2 1 55 ALA MB 5.000 . 6.000 4.101 3.899 4.355 . 0 0 "[ . 1 . 2 . 3 . ]" 1 313 1 37 TRP HZ2 1 68 PRO HA 4.000 . 4.000 2.163 2.018 2.404 . 0 0 "[ . 1 . 2 . 3 . ]" 1 314 1 37 TRP HZ2 1 68 PRO QB 5.000 . 5.900 2.845 2.628 3.132 . 0 0 "[ . 1 . 2 . 3 . ]" 1 315 1 37 TRP HZ2 1 72 ASN HA 5.000 . 5.000 4.146 3.721 4.959 . 0 0 "[ . 1 . 2 . 3 . ]" 1 316 1 27 VAL MG1 1 37 TRP HZ3 5.000 . 6.000 4.067 3.933 4.216 . 0 0 "[ . 1 . 2 . 3 . ]" 1 317 1 29 LEU MD1 1 37 TRP HZ3 5.000 . 6.000 2.747 2.696 2.799 . 0 0 "[ . 1 . 2 . 3 . ]" 1 318 1 29 LEU MD2 1 37 TRP HZ3 5.000 . 6.000 4.987 4.938 5.023 . 0 0 "[ . 1 . 2 . 3 . ]" 1 319 1 37 TRP HZ3 1 38 THR HA 5.000 . 5.000 4.852 4.683 4.994 . 0 0 "[ . 1 . 2 . 3 . ]" 1 320 1 37 TRP HZ3 1 39 VAL HB 5.000 . 5.000 4.035 3.780 4.280 . 0 0 "[ . 1 . 2 . 3 . ]" 1 321 1 37 TRP HZ3 1 39 VAL MG2 5.000 . 6.000 2.249 2.124 2.378 . 0 0 "[ . 1 . 2 . 3 . ]" 1 322 1 37 TRP HZ3 1 55 ALA MB 4.000 . 5.000 2.865 2.798 2.912 . 0 0 "[ . 1 . 2 . 3 . ]" 1 323 1 37 TRP HZ3 1 66 PHE QB 5.000 . 5.900 2.797 2.662 2.927 . 0 0 "[ . 1 . 2 . 3 . ]" 1 324 1 37 TRP HZ3 1 67 THR HA 5.000 . 5.000 3.979 3.871 4.141 . 0 0 "[ . 1 . 2 . 3 . ]" 1 325 1 37 TRP HZ3 1 96 LEU MD2 5.000 . 6.000 4.816 4.700 4.912 . 0 0 "[ . 1 . 2 . 3 . ]" 1 326 1 38 THR HA 1 67 THR HA 4.000 . 4.000 2.517 2.229 2.654 . 0 0 "[ . 1 . 2 . 3 . ]" 1 327 1 38 THR HA 1 67 THR HB 5.000 . 5.000 4.280 3.637 4.526 . 0 0 "[ . 1 . 2 . 3 . ]" 1 328 1 38 THR HA 1 67 THR MG 4.000 . 5.000 2.146 1.855 2.771 . 0 0 "[ . 1 . 2 . 3 . ]" 1 329 1 38 THR HB 1 65 ILE MD 5.000 . 6.000 4.814 4.614 4.911 . 0 0 "[ . 1 . 2 . 3 . ]" 1 330 1 38 THR HB 1 65 ILE MG 4.000 . 5.000 3.681 3.434 3.933 . 0 0 "[ . 1 . 2 . 3 . ]" 1 331 1 38 THR HB 1 96 LEU MD2 5.000 . 6.000 4.472 4.270 4.701 . 0 0 "[ . 1 . 2 . 3 . ]" 1 332 1 38 THR HB 1 97 GLU QB 4.000 . 5.000 3.180 2.952 4.037 . 0 0 "[ . 1 . 2 . 3 . ]" 1 333 1 38 THR HB 1 97 GLU QG 5.000 . 6.000 3.933 2.066 4.749 . 0 0 "[ . 1 . 2 . 3 . ]" 1 334 1 38 THR HB 1 98 ILE HA 4.000 . 4.000 3.981 3.706 4.056 0.056 23 0 "[ . 1 . 2 . 3 . ]" 1 335 1 38 THR MG 1 65 ILE MD 4.000 . 6.000 2.946 2.725 3.146 . 0 0 "[ . 1 . 2 . 3 . ]" 1 336 1 29 LEU MD1 1 39 VAL HA 5.000 . 6.000 4.561 4.463 4.699 . 0 0 "[ . 1 . 2 . 3 . ]" 1 337 1 39 VAL HA 1 40 LYS QB 5.000 . 6.000 4.103 4.072 4.146 . 0 0 "[ . 1 . 2 . 3 . ]" 1 338 1 39 VAL HA 1 94 ILE MG 5.000 . 6.000 4.701 4.462 4.908 . 0 0 "[ . 1 . 2 . 3 . ]" 1 339 1 39 VAL HA 1 96 LEU HA 4.000 . 4.000 2.054 1.920 2.241 . 0 0 "[ . 1 . 2 . 3 . ]" 1 340 1 39 VAL HA 1 96 LEU MD1 5.000 . 6.000 4.661 4.501 4.943 . 0 0 "[ . 1 . 2 . 3 . ]" 1 341 1 39 VAL HA 1 96 LEU MD2 5.000 . 6.000 1.970 1.836 2.295 . 0 0 "[ . 1 . 2 . 3 . ]" 1 342 1 27 VAL MG1 1 39 VAL HB 5.000 . 6.000 3.228 2.992 3.540 . 0 0 "[ . 1 . 2 . 3 . ]" 1 343 1 29 LEU MD1 1 39 VAL HB 5.000 . 6.000 4.071 3.842 4.248 . 0 0 "[ . 1 . 2 . 3 . ]" 1 344 1 39 VAL HB 1 66 PHE HA 5.000 . 5.000 4.795 4.653 4.871 . 0 0 "[ . 1 . 2 . 3 . ]" 1 345 1 39 VAL HB 1 94 ILE MG 5.000 . 6.000 4.481 4.151 4.836 . 0 0 "[ . 1 . 2 . 3 . ]" 1 346 1 39 VAL MG1 1 94 ILE HA 5.000 . 6.000 4.306 4.126 4.507 . 0 0 "[ . 1 . 2 . 3 . ]" 1 347 1 39 VAL MG1 1 96 LEU HA 4.000 . 5.000 2.597 2.276 2.867 . 0 0 "[ . 1 . 2 . 3 . ]" 1 348 1 27 VAL HB 1 39 VAL MG2 5.000 . 6.000 3.896 3.781 4.055 . 0 0 "[ . 1 . 2 . 3 . ]" 1 349 1 39 VAL MG2 1 66 PHE QB 5.000 . 6.900 2.545 2.348 2.719 . 0 0 "[ . 1 . 2 . 3 . ]" 1 350 1 39 VAL MG2 1 96 LEU QB 5.000 . 6.900 4.066 3.893 4.296 . 0 0 "[ . 1 . 2 . 3 . ]" 1 351 1 39 VAL MG2 1 96 LEU MD2 4.000 . 6.000 1.740 1.691 1.903 0.109 5 0 "[ . 1 . 2 . 3 . ]" 1 352 1 40 LYS HA 1 40 LYS QE 5.000 . 6.000 4.076 3.374 4.406 . 0 0 "[ . 1 . 2 . 3 . ]" 1 353 1 40 LYS HA 1 41 VAL HB 5.000 . 5.000 4.312 4.199 4.437 . 0 0 "[ . 1 . 2 . 3 . ]" 1 354 1 40 LYS HA 1 64 VAL MG1 5.000 . 6.000 4.744 4.512 4.874 . 0 0 "[ . 1 . 2 . 3 . ]" 1 355 1 40 LYS HA 1 65 ILE HA 4.000 . 4.000 2.214 2.035 2.382 . 0 0 "[ . 1 . 2 . 3 . ]" 1 356 1 40 LYS HA 1 65 ILE MD 5.000 . 6.000 2.116 1.716 3.801 0.084 27 0 "[ . 1 . 2 . 3 . ]" 1 357 1 40 LYS HA 1 65 ILE QG 5.000 . 5.900 3.536 1.830 3.954 . 0 0 "[ . 1 . 2 . 3 . ]" 1 358 1 40 LYS HA 1 65 ILE MG 5.000 . 6.000 3.085 2.820 3.348 . 0 0 "[ . 1 . 2 . 3 . ]" 1 359 1 38 THR MG 1 40 LYS QB 5.000 . 7.000 3.923 3.558 4.195 . 0 0 "[ . 1 . 2 . 3 . ]" 1 360 1 40 LYS QB 1 65 ILE QG 5.000 . 6.900 4.158 2.329 4.676 . 0 0 "[ . 1 . 2 . 3 . ]" 1 361 1 40 LYS QB 1 95 THR HB 5.000 . 6.000 3.190 2.859 3.581 . 0 0 "[ . 1 . 2 . 3 . ]" 1 362 1 40 LYS QB 1 95 THR MG 5.000 . 7.000 4.434 4.104 4.741 . 0 0 "[ . 1 . 2 . 3 . ]" 1 363 1 40 LYS QD 1 65 ILE HA 5.000 . 6.000 5.221 4.714 5.458 . 0 0 "[ . 1 . 2 . 3 . ]" 1 364 1 40 LYS QD 1 65 ILE MG 5.000 . 7.000 4.449 3.766 5.140 . 0 0 "[ . 1 . 2 . 3 . ]" 1 365 1 40 LYS QD 1 97 GLU QB 5.000 . 7.000 5.015 4.547 5.472 . 0 0 "[ . 1 . 2 . 3 . ]" 1 366 1 40 LYS QE 1 42 LYS QD 5.000 . 6.900 4.966 4.439 5.434 . 0 0 "[ . 1 . 2 . 3 . ]" 1 367 1 40 LYS QE 1 65 ILE MD 5.000 . 7.000 3.085 1.738 4.228 0.062 12 0 "[ . 1 . 2 . 3 . ]" 1 368 1 40 LYS QE 1 65 ILE QG 5.000 . 6.900 4.791 2.004 5.564 . 0 0 "[ . 1 . 2 . 3 . ]" 1 369 1 40 LYS QE 1 65 ILE MG 5.000 . 7.000 4.560 3.366 5.120 . 0 0 "[ . 1 . 2 . 3 . ]" 1 370 1 40 LYS QE 1 95 THR HB 5.000 . 6.000 3.784 2.846 5.178 . 0 0 "[ . 1 . 2 . 3 . ]" 1 371 1 40 LYS QG 1 42 LYS QD 3.000 . 4.800 3.430 3.102 3.619 . 0 0 "[ . 1 . 2 . 3 . ]" 1 372 1 40 LYS QG 1 65 ILE HA 4.000 . 4.900 3.760 3.489 4.100 . 0 0 "[ . 1 . 2 . 3 . ]" 1 373 1 40 LYS QG 1 65 ILE MD 3.000 . 4.900 1.966 1.711 3.233 0.089 15 0 "[ . 1 . 2 . 3 . ]" 1 374 1 40 LYS QG 1 65 ILE QG 4.000 . 5.800 3.317 1.904 3.682 . 0 0 "[ . 1 . 2 . 3 . ]" 1 375 1 39 VAL MG1 1 41 VAL HA 5.000 . 6.000 4.795 4.640 4.891 . 0 0 "[ . 1 . 2 . 3 . ]" 1 376 1 41 VAL HA 1 94 ILE HA 4.000 . 4.000 2.050 1.978 2.342 . 0 0 "[ . 1 . 2 . 3 . ]" 1 377 1 41 VAL HA 1 94 ILE MD 5.000 . 6.000 4.607 3.229 4.853 . 0 0 "[ . 1 . 2 . 3 . ]" 1 378 1 41 VAL HA 1 94 ILE MG 5.000 . 6.000 3.621 3.229 3.914 . 0 0 "[ . 1 . 2 . 3 . ]" 1 379 1 41 VAL HB 1 43 LEU MD2 5.000 . 6.000 4.061 3.829 4.297 . 0 0 "[ . 1 . 2 . 3 . ]" 1 380 1 41 VAL HB 1 64 VAL HB 3.000 . 3.000 2.987 2.726 3.052 0.052 8 0 "[ . 1 . 2 . 3 . ]" 1 381 1 41 VAL HB 1 64 VAL MG1 5.000 . 6.000 3.336 3.004 3.615 . 0 0 "[ . 1 . 2 . 3 . ]" 1 382 1 41 VAL HB 1 94 ILE HA 5.000 . 5.000 4.521 4.343 4.757 . 0 0 "[ . 1 . 2 . 3 . ]" 1 383 1 41 VAL HB 1 94 ILE MD 5.000 . 6.000 4.833 3.785 4.961 . 0 0 "[ . 1 . 2 . 3 . ]" 1 384 1 41 VAL HB 1 94 ILE MG 5.000 . 6.000 4.507 4.231 4.846 . 0 0 "[ . 1 . 2 . 3 . ]" 1 385 1 41 VAL MG1 1 64 VAL HB 5.000 . 6.000 3.590 3.259 3.849 . 0 0 "[ . 1 . 2 . 3 . ]" 1 386 1 41 VAL MG2 1 94 ILE HA 4.000 . 5.000 2.196 1.916 2.635 . 0 0 "[ . 1 . 2 . 3 . ]" 1 387 1 41 VAL MG1 1 42 LYS HA 5.000 . 6.000 4.244 4.077 4.370 . 0 0 "[ . 1 . 2 . 3 . ]" 1 388 1 42 LYS HA 1 42 LYS QD 4.000 . 4.900 2.366 2.083 2.681 . 0 0 "[ . 1 . 2 . 3 . ]" 1 389 1 42 LYS HA 1 42 LYS QG 3.000 . 3.900 2.794 2.665 2.913 . 0 0 "[ . 1 . 2 . 3 . ]" 1 390 1 42 LYS HA 1 63 TYR HA 4.000 . 4.000 2.269 2.095 2.395 . 0 0 "[ . 1 . 2 . 3 . ]" 1 391 1 42 LYS HA 1 63 TYR QB 4.000 . 4.900 1.994 1.844 2.523 . 0 0 "[ . 1 . 2 . 3 . ]" 1 392 1 42 LYS QB 1 93 GLU QG 5.000 . 6.900 2.094 1.831 3.789 . 0 0 "[ . 1 . 2 . 3 . ]" 1 393 1 42 LYS QD 1 63 TYR HA 5.000 . 6.000 3.922 3.627 4.287 . 0 0 "[ . 1 . 2 . 3 . ]" 1 394 1 42 LYS QD 1 63 TYR QB 4.000 . 5.800 2.256 1.876 2.804 . 0 0 "[ . 1 . 2 . 3 . ]" 1 395 1 42 LYS QD 1 93 GLU QG 4.000 . 5.900 3.948 3.670 4.753 . 0 0 "[ . 1 . 2 . 3 . ]" 1 396 1 42 LYS QG 1 63 TYR HA 5.000 . 5.900 4.772 4.553 4.866 . 0 0 "[ . 1 . 2 . 3 . ]" 1 397 1 41 VAL MG1 1 43 LEU HA 5.000 . 6.000 3.756 3.615 3.865 . 0 0 "[ . 1 . 2 . 3 . ]" 1 398 1 43 LEU HA 1 43 LEU MD2 4.000 . 5.000 2.025 1.840 2.166 . 0 0 "[ . 1 . 2 . 3 . ]" 1 399 1 43 LEU HA 1 43 LEU HG 4.000 . 4.000 2.912 2.829 2.996 . 0 0 "[ . 1 . 2 . 3 . ]" 1 400 1 43 LEU HA 1 47 ALA MB 5.000 . 6.000 3.133 3.014 3.369 . 0 0 "[ . 1 . 2 . 3 . ]" 1 401 1 43 LEU HA 1 83 VAL MG1 5.000 . 6.000 3.603 3.458 3.799 . 0 0 "[ . 1 . 2 . 3 . ]" 1 402 1 43 LEU HA 1 83 VAL MG2 5.000 . 6.000 3.518 3.393 3.660 . 0 0 "[ . 1 . 2 . 3 . ]" 1 403 1 43 LEU HA 1 91 VAL HB 5.000 . 5.000 3.567 3.404 3.754 . 0 0 "[ . 1 . 2 . 3 . ]" 1 404 1 43 LEU HA 1 91 VAL MG1 5.000 . 6.000 4.564 4.496 4.664 . 0 0 "[ . 1 . 2 . 3 . ]" 1 405 1 43 LEU MD1 1 47 ALA MB 5.000 . 7.000 3.582 3.438 3.737 . 0 0 "[ . 1 . 2 . 3 . ]" 1 406 1 43 LEU MD1 1 48 THR HA 4.000 . 5.000 1.708 1.684 1.744 0.116 18 0 "[ . 1 . 2 . 3 . ]" 1 407 1 43 LEU MD1 1 48 THR HB 5.000 . 6.000 3.514 3.405 3.632 . 0 0 "[ . 1 . 2 . 3 . ]" 1 408 1 43 LEU MD1 1 49 VAL HA 5.000 . 6.000 4.300 4.143 4.531 . 0 0 "[ . 1 . 2 . 3 . ]" 1 409 1 43 LEU MD1 1 59 GLU HA 5.000 . 6.000 4.081 3.765 4.339 . 0 0 "[ . 1 . 2 . 3 . ]" 1 410 1 43 LEU MD1 1 63 TYR HA 5.000 . 6.000 2.888 2.678 3.071 . 0 0 "[ . 1 . 2 . 3 . ]" 1 411 1 43 LEU MD1 1 64 VAL HA 5.000 . 6.000 4.298 4.106 4.503 . 0 0 "[ . 1 . 2 . 3 . ]" 1 412 1 43 LEU MD1 1 64 VAL MG1 5.000 . 7.000 4.198 4.009 4.393 . 0 0 "[ . 1 . 2 . 3 . ]" 1 413 1 43 LEU MD1 1 64 VAL MG2 4.000 . 6.000 1.987 1.807 2.188 . 0 0 "[ . 1 . 2 . 3 . ]" 1 414 1 43 LEU MD2 1 47 ALA MB 5.000 . 7.000 2.557 2.418 2.756 . 0 0 "[ . 1 . 2 . 3 . ]" 1 415 1 43 LEU MD2 1 48 THR HA 4.000 . 5.000 2.868 2.780 2.947 . 0 0 "[ . 1 . 2 . 3 . ]" 1 416 1 43 LEU MD2 1 48 THR HB 5.000 . 6.000 4.878 4.825 4.906 . 0 0 "[ . 1 . 2 . 3 . ]" 1 417 1 43 LEU MD2 1 49 VAL HA 5.000 . 6.000 3.700 3.559 3.870 . 0 0 "[ . 1 . 2 . 3 . ]" 1 418 1 43 LEU MD2 1 49 VAL MG2 4.000 . 6.000 1.972 1.754 2.403 0.046 18 0 "[ . 1 . 2 . 3 . ]" 1 419 1 43 LEU MD2 1 63 TYR HA 5.000 . 6.000 3.531 3.417 3.750 . 0 0 "[ . 1 . 2 . 3 . ]" 1 420 1 43 LEU MD2 1 83 VAL HA 5.000 . 6.000 3.822 3.706 3.950 . 0 0 "[ . 1 . 2 . 3 . ]" 1 421 1 43 LEU MD2 1 83 VAL MG1 3.000 . 5.000 2.265 2.145 2.447 . 0 0 "[ . 1 . 2 . 3 . ]" 1 422 1 43 LEU MD2 1 83 VAL MG2 4.000 . 6.000 1.603 1.565 1.666 0.235 33 0 "[ . 1 . 2 . 3 . ]" 1 423 1 41 VAL MG1 1 43 LEU HG 4.000 . 5.000 3.837 3.567 3.948 . 0 0 "[ . 1 . 2 . 3 . ]" 1 424 1 43 LEU HG 1 63 TYR HA 5.000 . 5.000 1.848 1.790 2.088 0.010 32 0 "[ . 1 . 2 . 3 . ]" 1 425 1 44 ALA HA 1 45 PRO QD 3.000 . 3.900 2.316 2.268 2.346 . 0 0 "[ . 1 . 2 . 3 . ]" 1 426 1 44 ALA HA 1 92 GLU QG 4.000 . 4.900 2.932 2.242 4.075 . 0 0 "[ . 1 . 2 . 3 . ]" 1 427 1 43 LEU HA 1 44 ALA MB 5.000 . 6.000 3.979 3.951 4.017 . 0 0 "[ . 1 . 2 . 3 . ]" 1 428 1 44 ALA MB 1 45 PRO QB 5.000 . 6.900 4.299 4.238 4.357 . 0 0 "[ . 1 . 2 . 3 . ]" 1 429 1 44 ALA MB 1 45 PRO QD 4.000 . 5.900 1.782 1.751 1.813 0.049 36 0 "[ . 1 . 2 . 3 . ]" 1 430 1 44 ALA MB 1 45 PRO QG 5.000 . 6.900 3.257 3.198 3.311 . 0 0 "[ . 1 . 2 . 3 . ]" 1 431 1 44 ALA MB 1 47 ALA MB 5.000 . 7.000 1.742 1.687 1.885 0.113 21 0 "[ . 1 . 2 . 3 . ]" 1 432 1 44 ALA MB 1 86 PRO QD 5.000 . 6.900 2.989 2.496 3.571 . 0 0 "[ . 1 . 2 . 3 . ]" 1 433 1 44 ALA MB 1 90 LYS HA 4.000 . 5.000 1.767 1.708 1.891 0.092 21 0 "[ . 1 . 2 . 3 . ]" 1 434 1 44 ALA MB 1 90 LYS QD 4.000 . 5.900 4.318 3.907 4.412 . 0 0 "[ . 1 . 2 . 3 . ]" 1 435 1 44 ALA MB 1 91 VAL HA 5.000 . 6.000 3.394 3.347 3.433 . 0 0 "[ . 1 . 2 . 3 . ]" 1 436 1 44 ALA MB 1 92 GLU HA 5.000 . 6.000 4.401 4.065 4.624 . 0 0 "[ . 1 . 2 . 3 . ]" 1 437 1 45 PRO HA 1 45 PRO QG 3.000 . 3.900 3.505 3.501 3.510 . 0 0 "[ . 1 . 2 . 3 . ]" 1 438 1 44 ALA HA 1 45 PRO QB 5.000 . 5.900 4.713 4.686 4.731 . 0 0 "[ . 1 . 2 . 3 . ]" 1 439 1 45 PRO QD 1 47 ALA MB 5.000 . 6.900 3.959 3.802 4.101 . 0 0 "[ . 1 . 2 . 3 . ]" 1 440 1 45 PRO QD 1 92 GLU QG 5.000 . 6.800 3.511 3.088 4.256 . 0 0 "[ . 1 . 2 . 3 . ]" 1 441 1 46 GLY QA 1 86 PRO QD 5.000 . 6.800 3.428 2.652 3.923 . 0 0 "[ . 1 . 2 . 3 . ]" 1 442 1 46 GLY QA 1 86 PRO QG 5.000 . 6.800 4.532 3.640 5.098 . 0 0 "[ . 1 . 2 . 3 . ]" 1 443 1 43 LEU MD2 1 47 ALA HA 5.000 . 6.000 4.635 4.495 4.790 . 0 0 "[ . 1 . 2 . 3 . ]" 1 444 1 44 ALA MB 1 47 ALA HA 5.000 . 6.000 3.995 3.795 4.252 . 0 0 "[ . 1 . 2 . 3 . ]" 1 445 1 47 ALA HA 1 48 THR MG 5.000 . 6.000 3.649 3.338 3.887 . 0 0 "[ . 1 . 2 . 3 . ]" 1 446 1 47 ALA HA 1 83 VAL MG2 5.000 . 6.000 4.882 4.784 4.952 . 0 0 "[ . 1 . 2 . 3 . ]" 1 447 1 47 ALA HA 1 85 GLY QA 4.000 . 4.900 2.504 2.343 2.662 . 0 0 "[ . 1 . 2 . 3 . ]" 1 448 1 47 ALA HA 1 86 PRO QD 5.000 . 5.900 3.396 3.183 3.497 . 0 0 "[ . 1 . 2 . 3 . ]" 1 449 1 47 ALA HA 1 86 PRO QG 5.000 . 5.900 5.209 4.992 5.319 . 0 0 "[ . 1 . 2 . 3 . ]" 1 450 1 47 ALA HA 1 90 LYS QD 5.000 . 5.900 4.381 3.622 5.351 . 0 0 "[ . 1 . 2 . 3 . ]" 1 451 1 47 ALA HA 1 90 LYS QG 5.000 . 5.900 3.157 2.817 3.504 . 0 0 "[ . 1 . 2 . 3 . ]" 1 452 1 45 PRO HA 1 47 ALA MB 5.000 . 6.000 4.773 4.720 4.859 . 0 0 "[ . 1 . 2 . 3 . ]" 1 453 1 47 ALA MB 1 48 THR HA 5.000 . 6.000 3.910 3.848 3.987 . 0 0 "[ . 1 . 2 . 3 . ]" 1 454 1 47 ALA MB 1 83 VAL HA 5.000 . 6.000 4.679 4.496 4.847 . 0 0 "[ . 1 . 2 . 3 . ]" 1 455 1 47 ALA MB 1 83 VAL MG1 4.000 . 6.000 1.736 1.628 1.831 0.172 5 0 "[ . 1 . 2 . 3 . ]" 1 456 1 47 ALA MB 1 83 VAL MG2 5.000 . 7.000 3.259 3.119 3.405 . 0 0 "[ . 1 . 2 . 3 . ]" 1 457 1 47 ALA MB 1 85 GLY QA 5.000 . 6.900 2.978 2.756 3.269 . 0 0 "[ . 1 . 2 . 3 . ]" 1 458 1 47 ALA MB 1 86 PRO QD 5.000 . 6.900 2.755 2.446 3.037 . 0 0 "[ . 1 . 2 . 3 . ]" 1 459 1 47 ALA MB 1 90 LYS HA 4.000 . 5.000 2.852 2.611 3.066 . 0 0 "[ . 1 . 2 . 3 . ]" 1 460 1 47 ALA MB 1 91 VAL HA 5.000 . 6.000 3.504 3.420 3.604 . 0 0 "[ . 1 . 2 . 3 . ]" 1 461 1 48 THR HA 1 48 THR HB 3.000 . 3.000 2.543 2.465 2.594 . 0 0 "[ . 1 . 2 . 3 . ]" 1 462 1 48 THR HA 1 48 THR MG 3.000 . 4.000 2.211 2.080 2.336 . 0 0 "[ . 1 . 2 . 3 . ]" 1 463 1 48 THR HA 1 83 VAL MG1 4.000 . 5.000 3.349 3.135 3.630 . 0 0 "[ . 1 . 2 . 3 . ]" 1 464 1 43 LEU MD1 1 48 THR MG 5.000 . 7.000 2.405 2.252 2.609 . 0 0 "[ . 1 . 2 . 3 . ]" 1 465 1 43 LEU MD2 1 48 THR MG 5.000 . 7.000 4.156 4.077 4.274 . 0 0 "[ . 1 . 2 . 3 . ]" 1 466 1 49 VAL HA 1 49 VAL MG2 3.000 . 4.000 2.259 2.066 2.438 . 0 0 "[ . 1 . 2 . 3 . ]" 1 467 1 49 VAL HA 1 83 VAL HA 3.000 . 3.000 2.059 1.947 2.169 . 0 0 "[ . 1 . 2 . 3 . ]" 1 468 1 49 VAL HA 1 83 VAL MG1 4.000 . 5.000 3.904 3.682 4.082 . 0 0 "[ . 1 . 2 . 3 . ]" 1 469 1 43 LEU MD1 1 49 VAL HB 5.000 . 6.000 3.781 3.545 4.146 . 0 0 "[ . 1 . 2 . 3 . ]" 1 470 1 49 VAL HA 1 49 VAL HB 3.000 . 3.000 3.027 3.015 3.032 0.032 9 0 "[ . 1 . 2 . 3 . ]" 1 471 1 49 VAL HB 1 57 LYS QD 4.000 . 4.900 2.093 1.809 2.465 . 0 0 "[ . 1 . 2 . 3 . ]" 1 472 1 49 VAL HB 1 57 LYS QE 4.000 . 4.900 3.936 3.012 4.422 . 0 0 "[ . 1 . 2 . 3 . ]" 1 473 1 49 VAL HB 1 57 LYS QG 5.000 . 5.900 3.055 2.758 3.588 . 0 0 "[ . 1 . 2 . 3 . ]" 1 474 1 49 VAL HB 1 64 VAL MG1 4.000 . 5.000 2.919 2.728 3.147 . 0 0 "[ . 1 . 2 . 3 . ]" 1 475 1 49 VAL HB 1 83 VAL HA 5.000 . 5.000 4.949 4.833 5.027 0.027 30 0 "[ . 1 . 2 . 3 . ]" 1 476 1 49 VAL MG1 1 50 GLY QA 5.000 . 6.900 3.559 3.299 3.886 . 0 0 "[ . 1 . 2 . 3 . ]" 1 477 1 49 VAL MG1 1 51 SER HA 5.000 . 6.000 4.266 4.034 4.813 . 0 0 "[ . 1 . 2 . 3 . ]" 1 478 1 49 VAL MG1 1 52 PHE HA 5.000 . 6.000 4.269 4.019 4.646 . 0 0 "[ . 1 . 2 . 3 . ]" 1 479 1 49 VAL MG1 1 52 PHE QB 5.000 . 6.900 2.546 2.250 2.898 . 0 0 "[ . 1 . 2 . 3 . ]" 1 480 1 49 VAL MG1 1 57 LYS QD 4.000 . 5.900 1.841 1.623 2.323 0.177 23 0 "[ . 1 . 2 . 3 . ]" 1 481 1 49 VAL MG1 1 57 LYS QE 5.000 . 6.900 3.535 1.805 4.053 . 0 0 "[ . 1 . 2 . 3 . ]" 1 482 1 49 VAL MG1 1 57 LYS QG 5.000 . 6.900 1.951 1.812 3.593 . 0 0 "[ . 1 . 2 . 3 . ]" 1 483 1 49 VAL MG1 1 64 VAL MG1 5.000 . 7.000 2.521 2.135 2.914 . 0 0 "[ . 1 . 2 . 3 . ]" 1 484 1 49 VAL MG1 1 64 VAL MG2 5.000 . 7.000 3.138 2.876 3.728 . 0 0 "[ . 1 . 2 . 3 . ]" 1 485 1 49 VAL MG1 1 81 PHE QB 5.000 . 6.900 2.151 1.854 2.498 . 0 0 "[ . 1 . 2 . 3 . ]" 1 486 1 49 VAL MG1 1 83 VAL HA 5.000 . 6.000 4.011 3.783 4.227 . 0 0 "[ . 1 . 2 . 3 . ]" 1 487 1 49 VAL MG2 1 64 VAL MG1 5.000 . 7.000 1.825 1.775 2.032 0.025 17 0 "[ . 1 . 2 . 3 . ]" 1 488 1 49 VAL MG2 1 64 VAL MG2 4.000 . 6.000 1.792 1.641 2.205 0.159 12 0 "[ . 1 . 2 . 3 . ]" 1 489 1 50 GLY QA 1 82 ILE HB 5.000 . 5.900 4.582 4.200 5.080 . 0 0 "[ . 1 . 2 . 3 . ]" 1 490 1 50 GLY QA 1 82 ILE MG 5.000 . 6.900 4.010 3.556 4.772 . 0 0 "[ . 1 . 2 . 3 . ]" 1 491 1 51 SER QB 1 82 ILE HB 4.000 . 4.900 2.201 1.864 2.714 . 0 0 "[ . 1 . 2 . 3 . ]" 1 492 1 51 SER QB 1 82 ILE MD 4.000 . 5.900 2.900 2.505 3.174 . 0 0 "[ . 1 . 2 . 3 . ]" 1 493 1 51 SER QB 1 82 ILE MG 5.000 . 6.900 3.208 2.764 3.533 . 0 0 "[ . 1 . 2 . 3 . ]" 1 494 1 51 SER QB 1 52 PHE HA 5.000 . 5.900 4.167 3.887 4.708 . 0 0 "[ . 1 . 2 . 3 . ]" 1 495 1 52 PHE HA 1 81 PHE HA 4.000 . 4.000 2.056 1.950 2.140 . 0 0 "[ . 1 . 2 . 3 . ]" 1 496 1 52 PHE HA 1 81 PHE QB 5.000 . 5.900 3.536 3.421 3.679 . 0 0 "[ . 1 . 2 . 3 . ]" 1 497 1 49 VAL MG2 1 52 PHE QB 5.000 . 6.900 4.294 3.648 4.932 . 0 0 "[ . 1 . 2 . 3 . ]" 1 498 1 52 PHE QB 1 64 VAL MG1 5.000 . 6.900 4.323 4.122 4.816 . 0 0 "[ . 1 . 2 . 3 . ]" 1 499 1 52 PHE QB 1 81 PHE HA 5.000 . 5.900 2.436 2.119 2.735 . 0 0 "[ . 1 . 2 . 3 . ]" 1 500 1 52 PHE QB 1 82 ILE MD 5.000 . 6.900 4.233 3.886 4.452 . 0 0 "[ . 1 . 2 . 3 . ]" 1 501 1 49 VAL MG1 1 52 PHE QD 5.000 . 8.000 2.732 2.182 3.539 . 0 0 "[ . 1 . 2 . 3 . ]" 1 502 1 49 VAL MG2 1 52 PHE QD 5.000 . 8.000 5.108 4.527 5.811 . 0 0 "[ . 1 . 2 . 3 . ]" 1 503 1 52 PHE HA 1 52 PHE QD 4.000 . 6.000 3.688 3.623 3.713 . 0 0 "[ . 1 . 2 . 3 . ]" 1 504 1 52 PHE QD 1 56 ASN HA 5.000 . 7.000 4.008 3.580 4.650 . 0 0 "[ . 1 . 2 . 3 . ]" 1 505 1 52 PHE QD 1 57 LYS HA 5.000 . 7.000 4.546 4.006 4.966 . 0 0 "[ . 1 . 2 . 3 . ]" 1 506 1 52 PHE QD 1 57 LYS QB 5.000 . 7.900 2.705 2.394 3.331 . 0 0 "[ . 1 . 2 . 3 . ]" 1 507 1 52 PHE QD 1 57 LYS QD 5.000 . 7.900 2.502 1.917 4.415 . 0 0 "[ . 1 . 2 . 3 . ]" 1 508 1 52 PHE QD 1 57 LYS QE 5.000 . 7.900 3.973 2.410 5.002 . 0 0 "[ . 1 . 2 . 3 . ]" 1 509 1 52 PHE QD 1 57 LYS QG 5.000 . 7.900 3.807 3.345 4.922 . 0 0 "[ . 1 . 2 . 3 . ]" 1 510 1 52 PHE QD 1 64 VAL MG1 5.000 . 8.000 4.964 4.706 5.414 . 0 0 "[ . 1 . 2 . 3 . ]" 1 511 1 52 PHE QD 1 81 PHE HA 5.000 . 7.000 4.389 4.069 4.664 . 0 0 "[ . 1 . 2 . 3 . ]" 1 512 1 53 TRP HA 1 53 TRP HD1 4.000 . 4.000 4.061 4.010 4.121 0.121 27 0 "[ . 1 . 2 . 3 . ]" 1 513 1 53 TRP HD1 1 54 SER HA 5.000 . 5.000 4.716 4.495 4.985 . 0 0 "[ . 1 . 2 . 3 . ]" 1 514 1 53 TRP HD1 1 54 SER QB 5.000 . 5.900 2.573 1.869 3.122 . 0 0 "[ . 1 . 2 . 3 . ]" 1 515 1 51 SER QB 1 53 TRP HE3 5.000 . 5.900 4.315 3.734 5.302 . 0 0 "[ . 1 . 2 . 3 . ]" 1 516 1 24 GLU QG 1 53 TRP HZ2 5.000 . 5.900 4.098 3.694 4.297 . 0 0 "[ . 1 . 2 . 3 . ]" 1 517 1 53 TRP HZ2 1 80 GLY QA 5.000 . 5.900 2.844 2.514 3.101 . 0 0 "[ . 1 . 2 . 3 . ]" 1 518 1 53 TRP HZ2 1 82 ILE MD 5.000 . 6.000 3.229 2.810 3.596 . 0 0 "[ . 1 . 2 . 3 . ]" 1 519 1 54 SER HA 1 69 VAL HB 5.000 . 5.000 4.823 4.382 5.028 0.028 23 0 "[ . 1 . 2 . 3 . ]" 1 520 1 54 SER HA 1 69 VAL MG1 5.000 . 6.000 2.777 2.413 3.008 . 0 0 "[ . 1 . 2 . 3 . ]" 1 521 1 54 SER HA 1 69 VAL MG2 4.000 . 5.000 2.659 2.295 3.024 . 0 0 "[ . 1 . 2 . 3 . ]" 1 522 1 54 SER HA 1 71 TRP HZ2 5.000 . 5.000 2.759 2.285 3.411 . 0 0 "[ . 1 . 2 . 3 . ]" 1 523 1 54 SER QB 1 55 ALA MB 5.000 . 6.900 3.377 3.177 3.455 . 0 0 "[ . 1 . 2 . 3 . ]" 1 524 1 54 SER QB 1 69 VAL MG2 5.000 . 6.900 3.974 3.509 4.362 . 0 0 "[ . 1 . 2 . 3 . ]" 1 525 1 54 SER QB 1 79 PHE HA 4.000 . 4.900 1.818 1.751 1.858 0.049 14 0 "[ . 1 . 2 . 3 . ]" 1 526 1 54 SER QB 1 79 PHE QB 5.000 . 6.800 2.178 2.033 2.393 . 0 0 "[ . 1 . 2 . 3 . ]" 1 527 1 55 ALA HA 1 68 PRO HA 4.000 . 4.000 3.535 3.353 3.764 . 0 0 "[ . 1 . 2 . 3 . ]" 1 528 1 55 ALA HA 1 69 VAL HB 5.000 . 5.000 4.908 4.673 5.066 0.066 5 0 "[ . 1 . 2 . 3 . ]" 1 529 1 55 ALA HA 1 69 VAL MG1 4.000 . 5.000 1.945 1.819 2.166 . 0 0 "[ . 1 . 2 . 3 . ]" 1 530 1 55 ALA HA 1 69 VAL MG2 5.000 . 6.000 3.592 3.315 3.895 . 0 0 "[ . 1 . 2 . 3 . ]" 1 531 1 54 SER HA 1 55 ALA MB 5.000 . 6.000 4.332 4.261 4.355 . 0 0 "[ . 1 . 2 . 3 . ]" 1 532 1 55 ALA MB 1 56 ASN HA 5.000 . 6.000 4.394 4.335 4.431 . 0 0 "[ . 1 . 2 . 3 . ]" 1 533 1 55 ALA MB 1 66 PHE HA 5.000 . 6.000 2.974 2.696 3.115 . 0 0 "[ . 1 . 2 . 3 . ]" 1 534 1 55 ALA MB 1 68 PRO HA 5.000 . 6.000 4.168 3.916 4.489 . 0 0 "[ . 1 . 2 . 3 . ]" 1 535 1 55 ALA MB 1 69 VAL MG1 5.000 . 7.000 3.352 3.204 3.476 . 0 0 "[ . 1 . 2 . 3 . ]" 1 536 1 55 ALA MB 1 79 PHE HA 5.000 . 6.000 3.747 3.690 3.945 . 0 0 "[ . 1 . 2 . 3 . ]" 1 537 1 55 ALA MB 1 79 PHE QB 5.000 . 6.900 1.685 1.640 1.851 0.160 36 0 "[ . 1 . 2 . 3 . ]" 1 538 1 56 ASN HA 1 69 VAL MG1 5.000 . 6.000 3.498 3.360 3.703 . 0 0 "[ . 1 . 2 . 3 . ]" 1 539 1 55 ALA HA 1 56 ASN QB 5.000 . 5.900 4.292 4.255 4.338 . 0 0 "[ . 1 . 2 . 3 . ]" 1 540 1 57 LYS HA 1 57 LYS QD 4.000 . 4.900 4.227 3.895 4.291 . 0 0 "[ . 1 . 2 . 3 . ]" 1 541 1 57 LYS HA 1 57 LYS QE 4.000 . 4.900 4.023 2.286 4.313 . 0 0 "[ . 1 . 2 . 3 . ]" 1 542 1 57 LYS HA 1 64 VAL MG1 5.000 . 6.000 2.937 2.807 3.062 . 0 0 "[ . 1 . 2 . 3 . ]" 1 543 1 57 LYS HA 1 64 VAL MG2 5.000 . 6.000 4.952 4.912 5.002 . 0 0 "[ . 1 . 2 . 3 . ]" 1 544 1 57 LYS HA 1 65 ILE MG 5.000 . 6.000 4.976 4.708 5.066 . 0 0 "[ . 1 . 2 . 3 . ]" 1 545 1 57 LYS HA 1 66 PHE HA 4.000 . 4.000 2.859 2.583 3.139 . 0 0 "[ . 1 . 2 . 3 . ]" 1 546 1 57 LYS QB 1 59 GLU QG 5.000 . 6.900 5.070 4.634 5.384 . 0 0 "[ . 1 . 2 . 3 . ]" 1 547 1 57 LYS QB 1 64 VAL MG1 5.000 . 6.900 3.358 3.216 3.566 . 0 0 "[ . 1 . 2 . 3 . ]" 1 548 1 49 VAL MG2 1 57 LYS QD 3.000 . 4.900 3.307 2.247 3.489 . 0 0 "[ . 1 . 2 . 3 . ]" 1 549 1 57 LYS QD 1 59 GLU QG 5.000 . 6.900 3.460 2.912 3.957 . 0 0 "[ . 1 . 2 . 3 . ]" 1 550 1 49 VAL MG2 1 57 LYS QE 5.000 . 6.900 4.622 1.856 5.105 . 0 0 "[ . 1 . 2 . 3 . ]" 1 551 1 57 LYS QE 1 59 GLU QG 5.000 . 6.900 2.835 1.778 5.039 0.022 22 0 "[ . 1 . 2 . 3 . ]" 1 552 1 57 LYS QE 1 64 VAL MG1 5.000 . 6.900 3.601 1.754 4.163 0.046 27 0 "[ . 1 . 2 . 3 . ]" 1 553 1 57 LYS QE 1 64 VAL MG2 5.000 . 6.900 3.668 2.962 4.433 . 0 0 "[ . 1 . 2 . 3 . ]" 1 554 1 57 LYS QG 1 58 GLN HA 4.000 . 4.900 3.628 3.488 3.800 . 0 0 "[ . 1 . 2 . 3 . ]" 1 555 1 57 LYS QG 1 64 VAL MG2 4.000 . 5.900 2.767 2.653 2.964 . 0 0 "[ . 1 . 2 . 3 . ]" 1 556 1 58 GLN QB 1 64 VAL HA 4.000 . 4.900 3.508 3.425 3.600 . 0 0 "[ . 1 . 2 . 3 . ]" 1 557 1 58 GLN QB 1 65 ILE HB 4.000 . 4.900 1.713 1.567 1.881 0.233 18 0 "[ . 1 . 2 . 3 . ]" 1 558 1 58 GLN QB 1 65 ILE MD 4.000 . 5.900 3.676 3.015 3.883 . 0 0 "[ . 1 . 2 . 3 . ]" 1 559 1 58 GLN QB 1 65 ILE QG 5.000 . 6.800 2.408 1.942 3.610 . 0 0 "[ . 1 . 2 . 3 . ]" 1 560 1 58 GLN QB 1 65 ILE MG 5.000 . 6.900 3.171 2.832 3.450 . 0 0 "[ . 1 . 2 . 3 . ]" 1 561 1 58 GLN QB 1 67 THR MG 5.000 . 6.900 4.491 3.845 5.026 . 0 0 "[ . 1 . 2 . 3 . ]" 1 562 1 58 GLN QG 1 65 ILE HB 5.000 . 6.000 3.233 1.810 3.715 . 0 0 "[ . 1 . 2 . 3 . ]" 1 563 1 58 GLN QG 1 65 ILE MD 5.000 . 7.000 4.917 3.741 5.264 . 0 0 "[ . 1 . 2 . 3 . ]" 1 564 1 58 GLN QG 1 65 ILE MG 5.000 . 7.000 4.057 2.839 4.589 . 0 0 "[ . 1 . 2 . 3 . ]" 1 565 1 58 GLN QG 1 67 THR MG 5.000 . 7.000 4.848 3.644 5.239 . 0 0 "[ . 1 . 2 . 3 . ]" 1 566 1 59 GLU HA 1 64 VAL HA 3.000 . 3.000 2.246 2.093 2.342 . 0 0 "[ . 1 . 2 . 3 . ]" 1 567 1 59 GLU HA 1 64 VAL HB 5.000 . 5.000 4.594 4.383 4.786 . 0 0 "[ . 1 . 2 . 3 . ]" 1 568 1 59 GLU HA 1 64 VAL MG1 5.000 . 6.000 3.852 3.776 3.952 . 0 0 "[ . 1 . 2 . 3 . ]" 1 569 1 59 GLU HA 1 64 VAL MG2 5.000 . 6.000 1.987 1.850 2.243 . 0 0 "[ . 1 . 2 . 3 . ]" 1 570 1 57 LYS QG 1 59 GLU QB 5.000 . 6.800 5.082 4.820 5.246 . 0 0 "[ . 1 . 2 . 3 . ]" 1 571 1 59 GLU QB 1 60 GLY QA 5.000 . 6.800 4.175 4.077 4.283 . 0 0 "[ . 1 . 2 . 3 . ]" 1 572 1 59 GLU QB 1 64 VAL HA 4.000 . 4.900 4.391 4.162 4.479 . 0 0 "[ . 1 . 2 . 3 . ]" 1 573 1 59 GLU QB 1 64 VAL MG1 5.000 . 6.900 5.008 4.802 5.088 . 0 0 "[ . 1 . 2 . 3 . ]" 1 574 1 59 GLU QB 1 64 VAL MG2 5.000 . 6.900 3.465 2.984 3.686 . 0 0 "[ . 1 . 2 . 3 . ]" 1 575 1 59 GLU QG 1 64 VAL HA 5.000 . 6.000 3.533 3.315 3.731 . 0 0 "[ . 1 . 2 . 3 . ]" 1 576 1 59 GLU QG 1 64 VAL MG2 5.000 . 7.000 2.025 1.804 2.297 . 0 0 "[ . 1 . 2 . 3 . ]" 1 577 1 60 GLY QA 1 61 ASN QB 5.000 . 6.800 3.483 3.345 4.068 . 0 0 "[ . 1 . 2 . 3 . ]" 1 578 1 60 GLY QA 1 65 ILE MD 5.000 . 6.900 4.367 3.817 4.934 . 0 0 "[ . 1 . 2 . 3 . ]" 1 579 1 43 LEU MD1 1 62 GLY QA 5.000 . 6.900 3.043 2.687 3.416 . 0 0 "[ . 1 . 2 . 3 . ]" 1 580 1 63 TYR HA 1 64 VAL MG2 5.000 . 6.000 3.751 3.514 3.876 . 0 0 "[ . 1 . 2 . 3 . ]" 1 581 1 40 LYS QD 1 63 TYR QB 5.000 . 6.900 3.821 3.462 4.134 . 0 0 "[ . 1 . 2 . 3 . ]" 1 582 1 63 TYR QB 1 65 ILE MD 4.000 . 5.900 3.904 3.632 4.353 . 0 0 "[ . 1 . 2 . 3 . ]" 1 583 1 63 TYR QB 1 65 ILE QG 5.000 . 6.800 4.154 3.772 4.354 . 0 0 "[ . 1 . 2 . 3 . ]" 1 584 1 40 LYS QB 1 63 TYR QD 5.000 . 8.000 6.533 6.277 6.614 . 0 0 "[ . 1 . 2 . 3 . ]" 1 585 1 40 LYS QD 1 63 TYR QD 5.000 . 8.000 4.552 4.162 4.804 . 0 0 "[ . 1 . 2 . 3 . ]" 1 586 1 40 LYS QE 1 63 TYR QD 5.000 . 8.000 6.243 5.665 6.473 . 0 0 "[ . 1 . 2 . 3 . ]" 1 587 1 42 LYS HA 1 63 TYR QD 4.000 . 6.000 1.760 1.725 1.786 0.075 23 0 "[ . 1 . 2 . 3 . ]" 1 588 1 42 LYS QG 1 63 TYR QD 5.000 . 7.900 3.698 3.463 3.835 . 0 0 "[ . 1 . 2 . 3 . ]" 1 589 1 60 GLY QA 1 63 TYR QD 5.000 . 7.900 2.590 2.225 3.408 . 0 0 "[ . 1 . 2 . 3 . ]" 1 590 1 61 ASN QB 1 63 TYR QD 5.000 . 7.900 4.085 3.349 5.258 . 0 0 "[ . 1 . 2 . 3 . ]" 1 591 1 63 TYR HA 1 63 TYR QD 4.000 . 6.000 2.605 2.348 2.849 . 0 0 "[ . 1 . 2 . 3 . ]" 1 592 1 63 TYR QD 1 65 ILE QG 5.000 . 7.900 5.503 5.261 5.775 . 0 0 "[ . 1 . 2 . 3 . ]" 1 593 1 42 LYS QB 1 63 TYR QE 5.000 . 7.900 2.958 2.725 3.084 . 0 0 "[ . 1 . 2 . 3 . ]" 1 594 1 42 LYS QD 1 63 TYR QE 5.000 . 7.900 2.697 2.468 2.888 . 0 0 "[ . 1 . 2 . 3 . ]" 1 595 1 42 LYS QG 1 63 TYR QE 5.000 . 7.900 4.468 4.338 4.584 . 0 0 "[ . 1 . 2 . 3 . ]" 1 596 1 49 VAL MG2 1 64 VAL HA 5.000 . 6.000 4.228 4.049 4.511 . 0 0 "[ . 1 . 2 . 3 . ]" 1 597 1 57 LYS QG 1 64 VAL HA 5.000 . 5.900 4.150 3.996 4.461 . 0 0 "[ . 1 . 2 . 3 . ]" 1 598 1 58 GLN QG 1 64 VAL HA 5.000 . 6.000 5.349 4.941 5.472 . 0 0 "[ . 1 . 2 . 3 . ]" 1 599 1 49 VAL MG2 1 64 VAL HB 4.000 . 5.000 2.270 2.026 2.529 . 0 0 "[ . 1 . 2 . 3 . ]" 1 600 1 57 LYS QG 1 64 VAL HB 5.000 . 5.900 4.142 4.013 4.566 . 0 0 "[ . 1 . 2 . 3 . ]" 1 601 1 59 GLU QG 1 64 VAL HB 5.000 . 6.000 4.746 4.466 5.046 . 0 0 "[ . 1 . 2 . 3 . ]" 1 602 1 49 VAL HA 1 64 VAL MG1 5.000 . 6.000 4.793 4.724 4.883 . 0 0 "[ . 1 . 2 . 3 . ]" 1 603 1 57 LYS QD 1 64 VAL MG1 5.000 . 6.900 2.979 1.856 3.156 . 0 0 "[ . 1 . 2 . 3 . ]" 1 604 1 59 GLU QG 1 64 VAL MG1 5.000 . 7.000 3.561 3.240 3.843 . 0 0 "[ . 1 . 2 . 3 . ]" 1 605 1 41 VAL HB 1 64 VAL MG2 5.000 . 6.000 4.563 4.337 4.618 . 0 0 "[ . 1 . 2 . 3 . ]" 1 606 1 57 LYS QD 1 64 VAL MG2 5.000 . 6.900 2.891 2.204 3.268 . 0 0 "[ . 1 . 2 . 3 . ]" 1 607 1 38 THR MG 1 65 ILE HA 4.000 . 5.000 3.873 3.625 4.095 . 0 0 "[ . 1 . 2 . 3 . ]" 1 608 1 40 LYS QB 1 65 ILE HA 5.000 . 6.000 4.051 3.595 4.355 . 0 0 "[ . 1 . 2 . 3 . ]" 1 609 1 65 ILE HA 1 65 ILE MD 4.000 . 5.000 2.349 1.952 3.774 . 0 0 "[ . 1 . 2 . 3 . ]" 1 610 1 65 ILE HB 1 65 ILE MD 3.000 . 4.000 3.067 2.118 3.191 . 0 0 "[ . 1 . 2 . 3 . ]" 1 611 1 40 LYS QB 1 65 ILE MD 5.000 . 7.000 2.437 1.977 3.318 . 0 0 "[ . 1 . 2 . 3 . ]" 1 612 1 40 LYS QD 1 65 ILE MD 5.000 . 7.000 2.391 1.956 3.167 . 0 0 "[ . 1 . 2 . 3 . ]" 1 613 1 40 LYS QD 1 65 ILE QG 5.000 . 6.900 3.978 2.847 4.691 . 0 0 "[ . 1 . 2 . 3 . ]" 1 614 1 58 GLN QG 1 65 ILE QG 5.000 . 6.900 3.851 3.044 5.172 . 0 0 "[ . 1 . 2 . 3 . ]" 1 615 1 64 VAL HA 1 65 ILE QG 5.000 . 5.900 3.146 2.999 3.831 . 0 0 "[ . 1 . 2 . 3 . ]" 1 616 1 65 ILE QG 1 65 ILE MG 3.000 . 4.900 2.374 2.165 2.557 . 0 0 "[ . 1 . 2 . 3 . ]" 1 617 1 38 THR HA 1 65 ILE MG 5.000 . 6.000 3.496 3.244 3.664 . 0 0 "[ . 1 . 2 . 3 . ]" 1 618 1 40 LYS QG 1 65 ILE MG 4.000 . 5.900 4.047 3.894 4.173 . 0 0 "[ . 1 . 2 . 3 . ]" 1 619 1 65 ILE MG 1 66 PHE HA 5.000 . 6.000 3.845 3.643 4.019 . 0 0 "[ . 1 . 2 . 3 . ]" 1 620 1 65 ILE MG 1 67 THR MG 4.000 . 6.000 2.357 2.104 2.617 . 0 0 "[ . 1 . 2 . 3 . ]" 1 621 1 38 THR MG 1 66 PHE HA 5.000 . 6.000 4.641 4.358 4.785 . 0 0 "[ . 1 . 2 . 3 . ]" 1 622 1 57 LYS QG 1 66 PHE HA 5.000 . 5.900 4.885 4.618 5.085 . 0 0 "[ . 1 . 2 . 3 . ]" 1 623 1 64 VAL MG1 1 66 PHE HA 5.000 . 6.000 4.337 4.260 4.413 . 0 0 "[ . 1 . 2 . 3 . ]" 1 624 1 66 PHE HA 1 67 THR MG 4.000 . 5.000 3.913 3.459 4.086 . 0 0 "[ . 1 . 2 . 3 . ]" 1 625 1 27 VAL MG1 1 66 PHE QB 5.000 . 6.900 3.929 3.806 4.111 . 0 0 "[ . 1 . 2 . 3 . ]" 1 626 1 29 LEU MD1 1 66 PHE QB 5.000 . 6.900 4.199 4.103 4.287 . 0 0 "[ . 1 . 2 . 3 . ]" 1 627 1 39 VAL MG1 1 66 PHE QB 5.000 . 6.900 3.471 3.388 3.638 . 0 0 "[ . 1 . 2 . 3 . ]" 1 628 1 55 ALA MB 1 66 PHE QB 4.000 . 5.900 2.004 1.797 2.233 0.003 26 0 "[ . 1 . 2 . 3 . ]" 1 629 1 39 VAL HB 1 66 PHE QD 5.000 . 7.000 2.260 2.014 2.533 . 0 0 "[ . 1 . 2 . 3 . ]" 1 630 1 39 VAL MG1 1 66 PHE QD 5.000 . 8.000 2.889 2.552 3.378 . 0 0 "[ . 1 . 2 . 3 . ]" 1 631 1 39 VAL MG2 1 66 PHE QD 5.000 . 8.000 3.822 3.640 4.065 . 0 0 "[ . 1 . 2 . 3 . ]" 1 632 1 41 VAL MG2 1 66 PHE QD 5.000 . 8.000 2.432 1.939 2.718 . 0 0 "[ . 1 . 2 . 3 . ]" 1 633 1 49 VAL MG2 1 66 PHE QD 5.000 . 8.000 4.951 4.734 5.223 . 0 0 "[ . 1 . 2 . 3 . ]" 1 634 1 55 ALA HA 1 66 PHE QD 5.000 . 7.000 5.108 4.797 5.453 . 0 0 "[ . 1 . 2 . 3 . ]" 1 635 1 55 ALA MB 1 66 PHE QD 4.000 . 7.000 2.698 2.194 3.079 . 0 0 "[ . 1 . 2 . 3 . ]" 1 636 1 57 LYS HA 1 66 PHE QD 4.000 . 6.000 2.793 2.315 3.901 . 0 0 "[ . 1 . 2 . 3 . ]" 1 637 1 57 LYS QB 1 66 PHE QD 5.000 . 7.900 3.037 2.654 4.063 . 0 0 "[ . 1 . 2 . 3 . ]" 1 638 1 57 LYS QG 1 66 PHE QD 5.000 . 7.900 3.928 3.567 5.153 . 0 0 "[ . 1 . 2 . 3 . ]" 1 639 1 64 VAL MG1 1 66 PHE QD 5.000 . 8.000 3.488 3.404 3.598 . 0 0 "[ . 1 . 2 . 3 . ]" 1 640 1 64 VAL MG2 1 66 PHE QD 5.000 . 8.000 5.663 5.545 5.818 . 0 0 "[ . 1 . 2 . 3 . ]" 1 641 1 65 ILE HA 1 66 PHE QD 5.000 . 7.000 3.841 3.108 4.354 . 0 0 "[ . 1 . 2 . 3 . ]" 1 642 1 66 PHE HA 1 66 PHE QD 4.000 . 6.000 2.465 2.126 2.933 . 0 0 "[ . 1 . 2 . 3 . ]" 1 643 1 66 PHE QD 1 94 ILE MG 5.000 . 8.000 4.337 3.898 4.853 . 0 0 "[ . 1 . 2 . 3 . ]" 1 644 1 27 VAL MG2 1 66 PHE QE 5.000 . 8.000 3.949 3.614 4.381 . 0 0 "[ . 1 . 2 . 3 . ]" 1 645 1 41 VAL HB 1 66 PHE QE 5.000 . 7.000 2.511 2.043 2.919 . 0 0 "[ . 1 . 2 . 3 . ]" 1 646 1 41 VAL MG2 1 66 PHE QE 5.000 . 8.000 1.952 1.754 2.156 0.046 20 0 "[ . 1 . 2 . 3 . ]" 1 647 1 43 LEU MD2 1 66 PHE QE 5.000 . 8.000 4.975 4.749 5.134 . 0 0 "[ . 1 . 2 . 3 . ]" 1 648 1 49 VAL MG2 1 66 PHE QE 5.000 . 8.000 3.315 2.906 3.631 . 0 0 "[ . 1 . 2 . 3 . ]" 1 649 1 52 PHE HA 1 66 PHE QE 5.000 . 7.000 4.514 3.953 4.952 . 0 0 "[ . 1 . 2 . 3 . ]" 1 650 1 52 PHE QB 1 66 PHE QE 5.000 . 7.900 2.377 2.089 2.729 . 0 0 "[ . 1 . 2 . 3 . ]" 1 651 1 57 LYS HA 1 66 PHE QE 5.000 . 7.000 3.403 2.961 4.405 . 0 0 "[ . 1 . 2 . 3 . ]" 1 652 1 57 LYS QB 1 66 PHE QE 5.000 . 7.900 2.435 2.039 3.683 . 0 0 "[ . 1 . 2 . 3 . ]" 1 653 1 57 LYS QD 1 66 PHE QE 5.000 . 7.900 3.899 3.308 4.806 . 0 0 "[ . 1 . 2 . 3 . ]" 1 654 1 57 LYS QE 1 66 PHE QE 5.000 . 7.900 5.010 2.488 5.500 . 0 0 "[ . 1 . 2 . 3 . ]" 1 655 1 57 LYS QG 1 66 PHE QE 5.000 . 7.900 2.546 2.021 4.692 . 0 0 "[ . 1 . 2 . 3 . ]" 1 656 1 64 VAL HB 1 66 PHE QE 5.000 . 7.000 3.945 3.579 4.340 . 0 0 "[ . 1 . 2 . 3 . ]" 1 657 1 64 VAL MG1 1 66 PHE QE 5.000 . 8.000 2.640 2.470 2.840 . 0 0 "[ . 1 . 2 . 3 . ]" 1 658 1 64 VAL MG2 1 66 PHE QE 5.000 . 8.000 4.466 4.262 4.775 . 0 0 "[ . 1 . 2 . 3 . ]" 1 659 1 65 ILE HA 1 66 PHE QE 5.000 . 7.000 4.747 4.306 5.172 . 0 0 "[ . 1 . 2 . 3 . ]" 1 660 1 66 PHE HA 1 66 PHE QE 5.000 . 7.000 4.454 4.317 4.627 . 0 0 "[ . 1 . 2 . 3 . ]" 1 661 1 66 PHE QE 1 83 VAL MG2 5.000 . 8.000 4.854 4.676 4.968 . 0 0 "[ . 1 . 2 . 3 . ]" 1 662 1 66 PHE QE 1 94 ILE MD 5.000 . 8.000 4.464 3.890 4.867 . 0 0 "[ . 1 . 2 . 3 . ]" 1 663 1 66 PHE QE 1 94 ILE MG 5.000 . 8.000 4.292 3.802 4.811 . 0 0 "[ . 1 . 2 . 3 . ]" 1 664 1 27 VAL MG2 1 66 PHE HZ 5.000 . 6.000 5.023 4.982 5.066 . 0 0 "[ . 1 . 2 . 3 . ]" 1 665 1 49 VAL MG1 1 66 PHE HZ 5.000 . 6.000 2.797 2.025 3.404 . 0 0 "[ . 1 . 2 . 3 . ]" 1 666 1 49 VAL MG2 1 66 PHE HZ 5.000 . 6.000 2.379 2.066 2.849 . 0 0 "[ . 1 . 2 . 3 . ]" 1 667 1 64 VAL MG1 1 66 PHE HZ 5.000 . 6.000 2.517 2.248 3.005 . 0 0 "[ . 1 . 2 . 3 . ]" 1 668 1 66 PHE HZ 1 83 VAL MG2 5.000 . 6.000 4.228 4.060 4.389 . 0 0 "[ . 1 . 2 . 3 . ]" 1 669 1 29 LEU MD1 1 67 THR HA 5.000 . 6.000 5.059 5.026 5.096 . 0 0 "[ . 1 . 2 . 3 . ]" 1 670 1 39 VAL MG2 1 67 THR HA 5.000 . 6.000 4.168 4.048 4.278 . 0 0 "[ . 1 . 2 . 3 . ]" 1 671 1 65 ILE MG 1 67 THR HA 5.000 . 6.000 4.477 4.336 4.616 . 0 0 "[ . 1 . 2 . 3 . ]" 1 672 1 67 THR HA 1 67 THR HB 3.000 . 3.000 2.587 2.343 2.672 . 0 0 "[ . 1 . 2 . 3 . ]" 1 673 1 67 THR HA 1 68 PRO QD 4.000 . 4.900 2.252 2.215 2.352 . 0 0 "[ . 1 . 2 . 3 . ]" 1 674 1 67 THR HB 1 68 PRO QB 5.000 . 5.900 4.715 4.640 4.938 . 0 0 "[ . 1 . 2 . 3 . ]" 1 675 1 67 THR HB 1 68 PRO QD 4.000 . 4.900 1.807 1.740 1.845 0.060 24 0 "[ . 1 . 2 . 3 . ]" 1 676 1 67 THR HB 1 68 PRO QG 5.000 . 5.900 3.444 3.344 3.692 . 0 0 "[ . 1 . 2 . 3 . ]" 1 677 1 67 THR MG 1 68 PRO QD 5.000 . 6.900 2.773 2.457 3.369 . 0 0 "[ . 1 . 2 . 3 . ]" 1 678 1 68 PRO HA 1 69 VAL MG1 5.000 . 6.000 3.695 3.353 4.054 . 0 0 "[ . 1 . 2 . 3 . ]" 1 679 1 68 PRO HA 1 69 VAL MG2 5.000 . 6.000 3.536 3.263 4.047 . 0 0 "[ . 1 . 2 . 3 . ]" 1 680 1 68 PRO HA 1 73 LYS QG 5.000 . 5.900 3.978 3.417 4.908 . 0 0 "[ . 1 . 2 . 3 . ]" 1 681 1 68 PRO QB 1 69 VAL MG2 5.000 . 6.900 4.032 3.846 4.396 . 0 0 "[ . 1 . 2 . 3 . ]" 1 682 1 68 PRO QB 1 72 ASN QB 5.000 . 6.800 3.540 2.969 4.996 . 0 0 "[ . 1 . 2 . 3 . ]" 1 683 1 36 ASP QB 1 68 PRO QG 5.000 . 6.800 3.718 3.290 4.212 . 0 0 "[ . 1 . 2 . 3 . ]" 1 684 1 67 THR HA 1 68 PRO QG 5.000 . 5.900 4.162 4.125 4.286 . 0 0 "[ . 1 . 2 . 3 . ]" 1 685 1 68 PRO QG 1 73 LYS HA 5.000 . 5.900 3.469 3.104 3.930 . 0 0 "[ . 1 . 2 . 3 . ]" 1 686 1 68 PRO QG 1 73 LYS QG 4.000 . 5.800 3.708 3.120 4.431 . 0 0 "[ . 1 . 2 . 3 . ]" 1 687 1 55 ALA HA 1 69 VAL HA 5.000 . 5.000 4.289 3.843 4.540 . 0 0 "[ . 1 . 2 . 3 . ]" 1 688 1 69 VAL HA 1 69 VAL HB 3.000 . 3.000 2.521 2.387 2.592 . 0 0 "[ . 1 . 2 . 3 . ]" 1 689 1 69 VAL HA 1 69 VAL MG1 3.000 . 4.000 2.359 2.235 2.508 . 0 0 "[ . 1 . 2 . 3 . ]" 1 690 1 69 VAL MG1 1 72 ASN QB 5.000 . 6.900 3.474 2.582 4.894 . 0 0 "[ . 1 . 2 . 3 . ]" 1 691 1 69 VAL MG2 1 72 ASN QB 5.000 . 6.900 1.957 1.694 3.167 0.106 23 0 "[ . 1 . 2 . 3 . ]" 1 692 1 69 VAL MG2 1 71 TRP HD1 5.000 . 6.000 3.377 2.766 4.049 . 0 0 "[ . 1 . 2 . 3 . ]" 1 693 1 71 TRP HA 1 71 TRP HD1 4.000 . 4.000 4.091 4.023 4.160 0.160 31 0 "[ . 1 . 2 . 3 . ]" 1 694 1 69 VAL MG2 1 71 TRP HE3 5.000 . 6.000 3.911 3.717 4.197 . 0 0 "[ . 1 . 2 . 3 . ]" 1 695 1 71 TRP HE3 1 72 ASN HA 4.000 . 4.000 3.259 3.001 3.556 . 0 0 "[ . 1 . 2 . 3 . ]" 1 696 1 54 SER HA 1 71 TRP HH2 4.000 . 4.000 2.368 2.002 2.870 . 0 0 "[ . 1 . 2 . 3 . ]" 1 697 1 54 SER QB 1 71 TRP HH2 5.000 . 5.900 2.492 1.860 3.462 . 0 0 "[ . 1 . 2 . 3 . ]" 1 698 1 69 VAL MG1 1 71 TRP HH2 5.000 . 6.000 4.702 4.445 4.857 . 0 0 "[ . 1 . 2 . 3 . ]" 1 699 1 69 VAL MG2 1 71 TRP HH2 5.000 . 6.000 3.949 3.711 4.218 . 0 0 "[ . 1 . 2 . 3 . ]" 1 700 1 54 SER QB 1 71 TRP HZ2 5.000 . 5.900 4.249 3.629 4.954 . 0 0 "[ . 1 . 2 . 3 . ]" 1 701 1 69 VAL MG1 1 71 TRP HZ2 5.000 . 6.000 3.831 3.416 4.302 . 0 0 "[ . 1 . 2 . 3 . ]" 1 702 1 69 VAL MG2 1 71 TRP HZ2 5.000 . 6.000 3.196 2.808 3.431 . 0 0 "[ . 1 . 2 . 3 . ]" 1 703 1 54 SER HA 1 71 TRP HZ3 5.000 . 5.000 3.910 3.488 4.796 . 0 0 "[ . 1 . 2 . 3 . ]" 1 704 1 54 SER QB 1 71 TRP HZ3 5.000 . 5.900 3.287 2.373 4.895 . 0 0 "[ . 1 . 2 . 3 . ]" 1 705 1 69 VAL MG2 1 71 TRP HZ3 5.000 . 6.000 4.271 3.969 4.480 . 0 0 "[ . 1 . 2 . 3 . ]" 1 706 1 72 ASN HA 1 77 ALA MB 5.000 . 6.000 2.647 2.174 3.651 . 0 0 "[ . 1 . 2 . 3 . ]" 1 707 1 54 SER HA 1 72 ASN QB 5.000 . 5.900 3.611 3.193 4.328 . 0 0 "[ . 1 . 2 . 3 . ]" 1 708 1 68 PRO HA 1 72 ASN QB 5.000 . 5.900 2.757 2.014 4.983 . 0 0 "[ . 1 . 2 . 3 . ]" 1 709 1 72 ASN QB 1 73 LYS HA 5.000 . 5.900 4.390 4.221 4.930 . 0 0 "[ . 1 . 2 . 3 . ]" 1 710 1 31 LEU MD1 1 73 LYS HA 5.000 . 6.000 3.920 3.434 4.535 . 0 0 "[ . 1 . 2 . 3 . ]" 1 711 1 68 PRO QB 1 73 LYS HA 5.000 . 5.900 2.223 1.874 2.614 . 0 0 "[ . 1 . 2 . 3 . ]" 1 712 1 68 PRO QD 1 73 LYS HA 5.000 . 5.900 4.740 4.433 5.111 . 0 0 "[ . 1 . 2 . 3 . ]" 1 713 1 68 PRO QB 1 73 LYS QB 5.000 . 6.800 2.238 1.787 3.050 0.013 15 0 "[ . 1 . 2 . 3 . ]" 1 714 1 73 LYS QB 1 74 GLY QA 5.000 . 6.800 3.877 3.754 4.121 . 0 0 "[ . 1 . 2 . 3 . ]" 1 715 1 68 PRO QB 1 73 LYS QE 5.000 . 6.800 4.260 3.348 4.701 . 0 0 "[ . 1 . 2 . 3 . ]" 1 716 1 70 SER HA 1 73 LYS QE 5.000 . 5.900 2.704 2.123 3.376 . 0 0 "[ . 1 . 2 . 3 . ]" 1 717 1 70 SER QB 1 73 LYS QE 4.000 . 5.800 4.099 3.541 4.519 . 0 0 "[ . 1 . 2 . 3 . ]" 1 718 1 73 LYS HA 1 73 LYS QE 5.000 . 5.900 5.067 4.559 5.355 . 0 0 "[ . 1 . 2 . 3 . ]" 1 719 1 68 PRO QB 1 73 LYS QG 5.000 . 6.800 2.129 1.731 2.981 0.069 4 0 "[ . 1 . 2 . 3 . ]" 1 720 1 69 VAL MG2 1 73 LYS QG 5.000 . 6.900 3.613 3.105 3.987 . 0 0 "[ . 1 . 2 . 3 . ]" 1 721 1 70 SER HA 1 73 LYS QG 5.000 . 5.900 3.743 2.898 4.289 . 0 0 "[ . 1 . 2 . 3 . ]" 1 722 1 70 SER QB 1 73 LYS QG 5.000 . 6.800 4.997 4.258 5.400 . 0 0 "[ . 1 . 2 . 3 . ]" 1 723 1 74 GLY QA 1 75 PRO QB 5.000 . 6.800 4.271 4.252 4.292 . 0 0 "[ . 1 . 2 . 3 . ]" 1 724 1 74 GLY QA 1 75 PRO QG 5.000 . 6.800 3.686 3.648 3.722 . 0 0 "[ . 1 . 2 . 3 . ]" 1 725 1 74 GLY QA 1 77 ALA MB 5.000 . 6.900 4.652 4.361 5.039 . 0 0 "[ . 1 . 2 . 3 . ]" 1 726 1 31 LEU HG 1 75 PRO HA 5.000 . 5.000 4.034 3.813 4.203 . 0 0 "[ . 1 . 2 . 3 . ]" 1 727 1 31 LEU MD1 1 75 PRO QB 5.000 . 6.900 4.957 4.544 5.122 . 0 0 "[ . 1 . 2 . 3 . ]" 1 728 1 34 GLN QG 1 75 PRO QD 5.000 . 6.800 4.040 2.936 5.231 . 0 0 "[ . 1 . 2 . 3 . ]" 1 729 1 31 LEU MD1 1 76 THR HA 5.000 . 6.000 4.183 3.792 4.462 . 0 0 "[ . 1 . 2 . 3 . ]" 1 730 1 76 THR HA 1 76 THR HB 3.000 . 3.000 3.008 2.935 3.031 0.031 15 0 "[ . 1 . 2 . 3 . ]" 1 731 1 76 THR HA 1 76 THR MG 3.000 . 4.000 2.166 1.921 2.370 . 0 0 "[ . 1 . 2 . 3 . ]" 1 732 1 76 THR HA 1 77 ALA MB 3.000 . 5.000 3.922 3.789 4.009 . 0 0 "[ . 1 . 2 . 3 . ]" 1 733 1 30 ASN HA 1 76 THR MG 5.000 . 6.000 2.448 2.035 2.717 . 0 0 "[ . 1 . 2 . 3 . ]" 1 734 1 30 ASN QB 1 76 THR MG 5.000 . 6.900 3.345 3.128 3.516 . 0 0 "[ . 1 . 2 . 3 . ]" 1 735 1 73 LYS HA 1 77 ALA MB 5.000 . 6.000 3.278 3.027 3.557 . 0 0 "[ . 1 . 2 . 3 . ]" 1 736 1 77 ALA MB 1 78 THR HA 5.000 . 6.000 4.243 4.135 4.324 . 0 0 "[ . 1 . 2 . 3 . ]" 1 737 1 29 LEU MD1 1 78 THR HA 5.000 . 6.000 4.226 4.048 4.419 . 0 0 "[ . 1 . 2 . 3 . ]" 1 738 1 78 THR HA 1 78 THR HB 3.000 . 3.000 3.029 3.018 3.035 0.035 11 0 "[ . 1 . 2 . 3 . ]" 1 739 1 28 THR MG 1 78 THR HB 5.000 . 6.000 3.707 3.509 3.967 . 0 0 "[ . 1 . 2 . 3 . ]" 1 740 1 78 THR HB 1 79 PHE HA 5.000 . 5.000 4.757 4.567 4.945 . 0 0 "[ . 1 . 2 . 3 . ]" 1 741 1 29 LEU MD1 1 79 PHE QB 5.000 . 6.900 4.458 4.362 4.584 . 0 0 "[ . 1 . 2 . 3 . ]" 1 742 1 39 VAL MG2 1 79 PHE QB 5.000 . 6.900 4.975 4.888 5.012 . 0 0 "[ . 1 . 2 . 3 . ]" 1 743 1 54 SER HA 1 79 PHE QB 5.000 . 5.900 4.034 3.929 4.238 . 0 0 "[ . 1 . 2 . 3 . ]" 1 744 1 27 VAL HB 1 79 PHE QD 5.000 . 7.000 3.092 3.014 3.142 . 0 0 "[ . 1 . 2 . 3 . ]" 1 745 1 27 VAL MG1 1 79 PHE QD 5.000 . 8.000 3.545 3.355 3.707 . 0 0 "[ . 1 . 2 . 3 . ]" 1 746 1 27 VAL MG2 1 79 PHE QD 5.000 . 8.000 3.330 3.165 3.567 . 0 0 "[ . 1 . 2 . 3 . ]" 1 747 1 29 LEU MD1 1 79 PHE QD 5.000 . 8.000 2.710 2.613 2.854 . 0 0 "[ . 1 . 2 . 3 . ]" 1 748 1 29 LEU HG 1 79 PHE QD 5.000 . 7.000 5.005 4.849 5.175 . 0 0 "[ . 1 . 2 . 3 . ]" 1 749 1 54 SER QB 1 79 PHE QD 5.000 . 7.900 4.098 3.979 4.284 . 0 0 "[ . 1 . 2 . 3 . ]" 1 750 1 55 ALA MB 1 79 PHE QD 5.000 . 8.000 2.495 2.369 2.770 . 0 0 "[ . 1 . 2 . 3 . ]" 1 751 1 79 PHE HA 1 79 PHE QD 4.000 . 6.000 3.649 3.620 3.673 . 0 0 "[ . 1 . 2 . 3 . ]" 1 752 1 27 VAL MG1 1 79 PHE QE 5.000 . 8.000 2.057 1.869 2.260 . 0 0 "[ . 1 . 2 . 3 . ]" 1 753 1 29 LEU MD1 1 79 PHE QE 5.000 . 8.000 1.825 1.772 1.950 0.028 13 0 "[ . 1 . 2 . 3 . ]" 1 754 1 29 LEU MD2 1 79 PHE QE 5.000 . 8.000 4.295 4.200 4.413 . 0 0 "[ . 1 . 2 . 3 . ]" 1 755 1 39 VAL HB 1 79 PHE QE 5.000 . 7.000 3.139 2.933 3.307 . 0 0 "[ . 1 . 2 . 3 . ]" 1 756 1 39 VAL MG2 1 79 PHE QE 5.000 . 8.000 1.749 1.702 1.825 0.098 28 0 "[ . 1 . 2 . 3 . ]" 1 757 1 41 VAL MG2 1 79 PHE QE 5.000 . 8.000 3.966 3.823 4.120 . 0 0 "[ . 1 . 2 . 3 . ]" 1 758 1 55 ALA MB 1 79 PHE QE 5.000 . 8.000 3.607 3.489 3.803 . 0 0 "[ . 1 . 2 . 3 . ]" 1 759 1 66 PHE QB 1 79 PHE QE 5.000 . 7.900 2.814 2.678 2.990 . 0 0 "[ . 1 . 2 . 3 . ]" 1 760 1 79 PHE QE 1 94 ILE MG 5.000 . 8.000 4.757 4.443 5.172 . 0 0 "[ . 1 . 2 . 3 . ]" 1 761 1 79 PHE QE 1 96 LEU MD2 5.000 . 8.000 4.127 4.040 4.190 . 0 0 "[ . 1 . 2 . 3 . ]" 1 762 1 27 VAL MG1 1 79 PHE HZ 5.000 . 6.000 1.938 1.830 2.195 . 0 0 "[ . 1 . 2 . 3 . ]" 1 763 1 39 VAL MG2 1 79 PHE HZ 5.000 . 6.000 2.575 2.432 2.761 . 0 0 "[ . 1 . 2 . 3 . ]" 1 764 1 79 PHE HZ 1 96 LEU MD2 5.000 . 6.000 4.850 4.765 4.893 . 0 0 "[ . 1 . 2 . 3 . ]" 1 765 1 79 PHE QB 1 80 GLY H 5.000 . 5.900 2.602 2.502 2.927 . 0 0 "[ . 1 . 2 . 3 . ]" 1 766 1 81 PHE HA 1 82 ILE MD 5.000 . 6.000 2.650 2.607 2.693 . 0 0 "[ . 1 . 2 . 3 . ]" 1 767 1 49 VAL MG2 1 81 PHE QB 5.000 . 6.900 2.907 2.311 3.524 . 0 0 "[ . 1 . 2 . 3 . ]" 1 768 1 64 VAL MG1 1 81 PHE QB 5.000 . 6.900 3.543 3.377 3.990 . 0 0 "[ . 1 . 2 . 3 . ]" 1 769 1 81 PHE QB 1 82 ILE MD 5.000 . 6.900 3.925 3.898 3.954 . 0 0 "[ . 1 . 2 . 3 . ]" 1 770 1 81 PHE QB 1 83 VAL MG2 5.000 . 6.900 4.131 4.018 4.304 . 0 0 "[ . 1 . 2 . 3 . ]" 1 771 1 39 VAL MG1 1 81 PHE QD 5.000 . 8.000 4.736 4.411 4.888 . 0 0 "[ . 1 . 2 . 3 . ]" 1 772 1 49 VAL HA 1 81 PHE QD 5.000 . 7.000 3.214 3.086 3.428 . 0 0 "[ . 1 . 2 . 3 . ]" 1 773 1 49 VAL MG1 1 81 PHE QD 5.000 . 8.000 2.739 2.110 3.372 . 0 0 "[ . 1 . 2 . 3 . ]" 1 774 1 49 VAL MG2 1 81 PHE QD 4.000 . 7.000 2.458 1.992 3.076 . 0 0 "[ . 1 . 2 . 3 . ]" 1 775 1 52 PHE HA 1 81 PHE QD 4.000 . 6.000 5.235 5.155 5.296 . 0 0 "[ . 1 . 2 . 3 . ]" 1 776 1 64 VAL MG1 1 81 PHE QD 5.000 . 8.000 4.242 4.105 4.569 . 0 0 "[ . 1 . 2 . 3 . ]" 1 777 1 80 GLY QA 1 81 PHE QD 5.000 . 7.900 3.881 3.779 3.987 . 0 0 "[ . 1 . 2 . 3 . ]" 1 778 1 81 PHE QD 1 83 VAL MG2 4.000 . 7.000 2.253 2.076 2.475 . 0 0 "[ . 1 . 2 . 3 . ]" 1 779 1 27 VAL MG2 1 81 PHE QE 3.000 . 6.000 3.282 3.066 3.451 . 0 0 "[ . 1 . 2 . 3 . ]" 1 780 1 41 VAL HB 1 81 PHE QE 5.000 . 7.000 4.069 3.665 4.378 . 0 0 "[ . 1 . 2 . 3 . ]" 1 781 1 41 VAL MG1 1 81 PHE QE 5.000 . 8.000 2.303 2.067 2.611 . 0 0 "[ . 1 . 2 . 3 . ]" 1 782 1 43 LEU MD2 1 81 PHE QE 5.000 . 8.000 3.343 3.148 3.486 . 0 0 "[ . 1 . 2 . 3 . ]" 1 783 1 49 VAL MG2 1 81 PHE QE 5.000 . 8.000 3.141 2.877 3.483 . 0 0 "[ . 1 . 2 . 3 . ]" 1 784 1 64 VAL MG1 1 81 PHE QE 5.000 . 8.000 4.968 4.774 5.179 . 0 0 "[ . 1 . 2 . 3 . ]" 1 785 1 81 PHE QE 1 94 ILE QG 5.000 . 7.900 2.935 2.468 4.262 . 0 0 "[ . 1 . 2 . 3 . ]" 1 786 1 81 PHE QE 1 94 ILE MG 5.000 . 8.000 3.125 2.483 3.587 . 0 0 "[ . 1 . 2 . 3 . ]" 1 787 1 80 GLY QA 1 81 PHE H 4.000 . 4.900 2.257 2.217 2.297 . 0 0 "[ . 1 . 2 . 3 . ]" 1 788 1 81 PHE HZ 1 91 VAL HA 5.000 . 5.000 5.070 5.034 5.095 0.095 4 0 "[ . 1 . 2 . 3 . ]" 1 789 1 81 PHE HZ 1 91 VAL MG1 4.000 . 5.000 3.120 2.839 3.440 . 0 0 "[ . 1 . 2 . 3 . ]" 1 790 1 51 SER QB 1 82 ILE HA 5.000 . 5.900 4.909 4.461 5.309 . 0 0 "[ . 1 . 2 . 3 . ]" 1 791 1 82 ILE HA 1 83 VAL HB 5.000 . 5.000 4.293 4.215 4.350 . 0 0 "[ . 1 . 2 . 3 . ]" 1 792 1 82 ILE HA 1 83 VAL MG2 5.000 . 6.000 4.108 3.930 4.297 . 0 0 "[ . 1 . 2 . 3 . ]" 1 793 1 24 GLU QG 1 82 ILE QG 5.000 . 6.800 1.735 1.703 1.809 0.097 16 0 "[ . 1 . 2 . 3 . ]" 1 794 1 51 SER QB 1 82 ILE QG 4.000 . 5.800 3.186 2.876 3.628 . 0 0 "[ . 1 . 2 . 3 . ]" 1 795 1 82 ILE MG 1 83 VAL HB 5.000 . 6.000 4.529 4.441 4.600 . 0 0 "[ . 1 . 2 . 3 . ]" 1 796 1 82 ILE MG 1 84 ASN HA 5.000 . 6.000 4.301 4.177 4.427 . 0 0 "[ . 1 . 2 . 3 . ]" 1 797 1 43 LEU MD1 1 83 VAL HA 5.000 . 6.000 4.797 4.706 4.837 . 0 0 "[ . 1 . 2 . 3 . ]" 1 798 1 49 VAL MG2 1 83 VAL HA 4.000 . 5.000 3.454 3.286 3.608 . 0 0 "[ . 1 . 2 . 3 . ]" 1 799 1 22 GLY QA 1 83 VAL HB 5.000 . 5.900 5.080 4.867 5.256 . 0 0 "[ . 1 . 2 . 3 . ]" 1 800 1 43 LEU MD2 1 83 VAL HB 5.000 . 6.000 3.546 3.470 3.691 . 0 0 "[ . 1 . 2 . 3 . ]" 1 801 1 83 VAL HB 1 91 VAL MG2 5.000 . 6.000 4.871 4.584 4.989 . 0 0 "[ . 1 . 2 . 3 . ]" 1 802 1 22 GLY QA 1 83 VAL MG1 5.000 . 6.900 4.108 3.893 4.272 . 0 0 "[ . 1 . 2 . 3 . ]" 1 803 1 44 ALA MB 1 83 VAL MG1 5.000 . 7.000 3.350 3.199 3.517 . 0 0 "[ . 1 . 2 . 3 . ]" 1 804 1 47 ALA HA 1 83 VAL MG1 5.000 . 6.000 2.859 2.702 3.050 . 0 0 "[ . 1 . 2 . 3 . ]" 1 805 1 83 VAL MG1 1 84 ASN HA 5.000 . 6.000 3.428 3.305 3.544 . 0 0 "[ . 1 . 2 . 3 . ]" 1 806 1 83 VAL MG1 1 85 GLY QA 5.000 . 6.900 3.741 3.578 3.921 . 0 0 "[ . 1 . 2 . 3 . ]" 1 807 1 83 VAL MG1 1 86 PRO QD 5.000 . 6.900 4.115 3.854 4.435 . 0 0 "[ . 1 . 2 . 3 . ]" 1 808 1 83 VAL MG1 1 90 LYS QD 4.000 . 5.900 2.905 2.461 4.065 . 0 0 "[ . 1 . 2 . 3 . ]" 1 809 1 83 VAL MG1 1 90 LYS QG 5.000 . 6.900 2.738 2.371 3.139 . 0 0 "[ . 1 . 2 . 3 . ]" 1 810 1 83 VAL MG1 1 91 VAL HB 5.000 . 6.000 3.588 3.327 3.858 . 0 0 "[ . 1 . 2 . 3 . ]" 1 811 1 43 LEU MD1 1 83 VAL MG2 4.000 . 6.000 2.915 2.795 3.050 . 0 0 "[ . 1 . 2 . 3 . ]" 1 812 1 48 THR HA 1 83 VAL MG2 5.000 . 6.000 3.208 3.053 3.466 . 0 0 "[ . 1 . 2 . 3 . ]" 1 813 1 49 VAL HA 1 83 VAL MG2 3.000 . 4.000 2.304 2.119 2.549 . 0 0 "[ . 1 . 2 . 3 . ]" 1 814 1 83 VAL MG2 1 90 LYS QB 4.000 . 5.900 3.736 3.542 3.881 . 0 0 "[ . 1 . 2 . 3 . ]" 1 815 1 83 VAL MG2 1 91 VAL MG2 4.000 . 6.000 3.407 3.140 3.640 . 0 0 "[ . 1 . 2 . 3 . ]" 1 816 1 22 GLY QA 1 84 ASN QB 5.000 . 6.800 3.809 3.610 4.038 . 0 0 "[ . 1 . 2 . 3 . ]" 1 817 1 48 THR HB 1 84 ASN QB 5.000 . 5.900 5.054 4.964 5.097 . 0 0 "[ . 1 . 2 . 3 . ]" 1 818 1 48 THR MG 1 84 ASN QB 5.000 . 6.900 4.930 4.618 5.075 . 0 0 "[ . 1 . 2 . 3 . ]" 1 819 1 82 ILE MG 1 84 ASN QB 5.000 . 6.900 4.521 4.270 4.806 . 0 0 "[ . 1 . 2 . 3 . ]" 1 820 1 83 VAL HA 1 84 ASN QB 5.000 . 5.900 4.050 3.942 4.590 . 0 0 "[ . 1 . 2 . 3 . ]" 1 821 1 85 GLY QA 1 86 PRO QD 4.000 . 5.800 1.861 1.820 1.922 . 0 0 "[ . 1 . 2 . 3 . ]" 1 822 1 85 GLY QA 1 86 PRO QG 4.000 . 5.800 3.662 3.633 3.686 . 0 0 "[ . 1 . 2 . 3 . ]" 1 823 1 85 GLY QA 1 90 LYS QD 5.000 . 6.800 2.842 2.390 3.765 . 0 0 "[ . 1 . 2 . 3 . ]" 1 824 1 86 PRO HA 1 86 PRO QG 3.000 . 3.900 3.507 3.497 3.525 . 0 0 "[ . 1 . 2 . 3 . ]" 1 825 1 86 PRO HA 1 87 GLN QB 5.000 . 6.000 4.476 4.191 4.851 . 0 0 "[ . 1 . 2 . 3 . ]" 1 826 1 85 GLY QA 1 86 PRO QB 5.000 . 6.800 4.290 4.243 4.313 . 0 0 "[ . 1 . 2 . 3 . ]" 1 827 1 86 PRO QD 1 90 LYS QD 5.000 . 6.800 2.816 2.323 3.103 . 0 0 "[ . 1 . 2 . 3 . ]" 1 828 1 47 ALA MB 1 86 PRO QG 5.000 . 6.900 3.903 3.647 4.188 . 0 0 "[ . 1 . 2 . 3 . ]" 1 829 1 20 GLY QA 1 87 GLN HA 5.000 . 5.900 2.905 2.292 3.739 . 0 0 "[ . 1 . 2 . 3 . ]" 1 830 1 20 GLY QA 1 87 GLN QB 5.000 . 6.900 2.792 1.744 3.899 0.056 38 0 "[ . 1 . 2 . 3 . ]" 1 831 1 87 GLN QB 1 88 GLY QA 5.000 . 6.900 3.829 3.692 3.968 . 0 0 "[ . 1 . 2 . 3 . ]" 1 832 1 87 GLN QG 1 88 GLY QA 5.000 . 6.800 4.685 3.379 5.443 . 0 0 "[ . 1 . 2 . 3 . ]" 1 833 1 83 VAL MG1 1 90 LYS HA 4.000 . 5.000 3.777 3.591 3.980 . 0 0 "[ . 1 . 2 . 3 . ]" 1 834 1 90 LYS HA 1 90 LYS QD 4.000 . 4.900 3.885 3.128 3.986 . 0 0 "[ . 1 . 2 . 3 . ]" 1 835 1 90 LYS HA 1 90 LYS QE 5.000 . 6.000 3.686 3.332 4.506 . 0 0 "[ . 1 . 2 . 3 . ]" 1 836 1 23 ALA MB 1 90 LYS QB 4.000 . 5.900 2.436 2.091 2.650 . 0 0 "[ . 1 . 2 . 3 . ]" 1 837 1 43 LEU MD2 1 90 LYS QB 5.000 . 6.900 4.074 3.900 4.316 . 0 0 "[ . 1 . 2 . 3 . ]" 1 838 1 44 ALA MB 1 90 LYS QB 5.000 . 6.900 3.000 2.676 3.187 . 0 0 "[ . 1 . 2 . 3 . ]" 1 839 1 47 ALA HA 1 90 LYS QB 5.000 . 5.900 4.021 3.517 4.609 . 0 0 "[ . 1 . 2 . 3 . ]" 1 840 1 47 ALA MB 1 90 LYS QB 4.000 . 5.900 2.174 1.788 2.725 0.012 38 0 "[ . 1 . 2 . 3 . ]" 1 841 1 83 VAL MG1 1 90 LYS QB 4.000 . 5.900 1.713 1.663 1.780 0.137 29 0 "[ . 1 . 2 . 3 . ]" 1 842 1 84 ASN HA 1 90 LYS QB 4.000 . 4.900 4.437 4.288 4.485 . 0 0 "[ . 1 . 2 . 3 . ]" 1 843 1 23 ALA MB 1 90 LYS QD 4.000 . 5.900 3.208 2.666 3.758 . 0 0 "[ . 1 . 2 . 3 . ]" 1 844 1 47 ALA MB 1 90 LYS QD 4.000 . 5.900 3.531 3.054 4.033 . 0 0 "[ . 1 . 2 . 3 . ]" 1 845 1 84 ASN HA 1 90 LYS QD 5.000 . 5.900 3.052 2.530 5.049 . 0 0 "[ . 1 . 2 . 3 . ]" 1 846 1 23 ALA MB 1 90 LYS QE 5.000 . 7.000 2.428 1.858 3.387 . 0 0 "[ . 1 . 2 . 3 . ]" 1 847 1 83 VAL MG1 1 90 LYS QE 5.000 . 7.000 3.899 2.545 4.525 . 0 0 "[ . 1 . 2 . 3 . ]" 1 848 1 85 GLY QA 1 90 LYS QE 5.000 . 6.900 4.304 2.764 4.669 . 0 0 "[ . 1 . 2 . 3 . ]" 1 849 1 86 PRO HA 1 90 LYS QE 5.000 . 6.000 4.835 4.209 5.317 . 0 0 "[ . 1 . 2 . 3 . ]" 1 850 1 23 ALA MB 1 90 LYS QG 4.000 . 5.900 4.132 3.811 4.358 . 0 0 "[ . 1 . 2 . 3 . ]" 1 851 1 44 ALA HA 1 90 LYS QG 5.000 . 5.900 5.384 5.198 5.444 . 0 0 "[ . 1 . 2 . 3 . ]" 1 852 1 41 VAL MG1 1 91 VAL HA 5.000 . 6.000 3.920 3.763 4.014 . 0 0 "[ . 1 . 2 . 3 . ]" 1 853 1 43 LEU MD2 1 91 VAL HA 4.000 . 5.000 3.053 2.753 3.224 . 0 0 "[ . 1 . 2 . 3 . ]" 1 854 1 43 LEU HG 1 91 VAL HA 5.000 . 5.000 4.671 4.532 4.814 . 0 0 "[ . 1 . 2 . 3 . ]" 1 855 1 83 VAL MG1 1 91 VAL HA 5.000 . 6.000 3.676 3.429 3.918 . 0 0 "[ . 1 . 2 . 3 . ]" 1 856 1 83 VAL MG2 1 91 VAL HA 5.000 . 6.000 3.899 3.707 4.110 . 0 0 "[ . 1 . 2 . 3 . ]" 1 857 1 90 LYS QB 1 91 VAL HA 5.000 . 5.900 4.290 4.236 4.354 . 0 0 "[ . 1 . 2 . 3 . ]" 1 858 1 43 LEU MD2 1 91 VAL HB 3.000 . 4.000 3.307 3.225 3.386 . 0 0 "[ . 1 . 2 . 3 . ]" 1 859 1 44 ALA MB 1 91 VAL MG1 5.000 . 7.000 4.301 4.101 4.405 . 0 0 "[ . 1 . 2 . 3 . ]" 1 860 1 91 VAL MG1 1 92 GLU HA 5.000 . 6.000 4.565 4.361 4.695 . 0 0 "[ . 1 . 2 . 3 . ]" 1 861 1 91 VAL MG1 1 93 GLU HA 5.000 . 6.000 3.657 3.414 3.885 . 0 0 "[ . 1 . 2 . 3 . ]" 1 862 1 91 VAL MG1 1 94 ILE MD 4.000 . 6.000 2.910 2.374 3.232 . 0 0 "[ . 1 . 2 . 3 . ]" 1 863 1 91 VAL MG1 1 94 ILE QG 5.000 . 6.900 2.935 2.642 3.181 . 0 0 "[ . 1 . 2 . 3 . ]" 1 864 1 41 VAL MG1 1 91 VAL MG2 4.000 . 6.000 1.600 1.547 1.703 0.253 29 0 "[ . 1 . 2 . 3 . ]" 1 865 1 43 LEU HA 1 91 VAL MG2 5.000 . 6.000 2.774 2.612 2.974 . 0 0 "[ . 1 . 2 . 3 . ]" 1 866 1 43 LEU MD2 1 91 VAL MG2 4.000 . 6.000 2.647 2.414 2.966 . 0 0 "[ . 1 . 2 . 3 . ]" 1 867 1 43 LEU HG 1 91 VAL MG2 5.000 . 6.000 4.095 3.826 4.405 . 0 0 "[ . 1 . 2 . 3 . ]" 1 868 1 44 ALA MB 1 91 VAL MG2 5.000 . 7.000 4.805 4.750 4.844 . 0 0 "[ . 1 . 2 . 3 . ]" 1 869 1 47 ALA MB 1 91 VAL MG2 5.000 . 7.000 4.682 4.501 4.772 . 0 0 "[ . 1 . 2 . 3 . ]" 1 870 1 83 VAL MG1 1 91 VAL MG2 5.000 . 7.000 4.369 4.144 4.509 . 0 0 "[ . 1 . 2 . 3 . ]" 1 871 1 91 VAL MG2 1 92 GLU HA 5.000 . 6.000 4.397 4.281 4.577 . 0 0 "[ . 1 . 2 . 3 . ]" 1 872 1 91 VAL MG2 1 94 ILE MD 5.000 . 7.000 2.835 1.964 3.111 . 0 0 "[ . 1 . 2 . 3 . ]" 1 873 1 91 VAL MG2 1 94 ILE QG 5.000 . 6.900 2.163 1.896 3.022 . 0 0 "[ . 1 . 2 . 3 . ]" 1 874 1 42 LYS QD 1 92 GLU QB 3.000 . 4.800 3.744 3.547 3.889 . 0 0 "[ . 1 . 2 . 3 . ]" 1 875 1 93 GLU HA 1 94 ILE MD 5.000 . 6.000 4.842 4.310 5.011 . 0 0 "[ . 1 . 2 . 3 . ]" 1 876 1 42 LYS QB 1 93 GLU QB 5.000 . 6.900 3.780 2.735 3.986 . 0 0 "[ . 1 . 2 . 3 . ]" 1 877 1 42 LYS QG 1 93 GLU QB 5.000 . 6.900 3.930 2.718 4.221 . 0 0 "[ . 1 . 2 . 3 . ]" 1 878 1 91 VAL MG1 1 93 GLU QB 5.000 . 7.000 5.002 4.844 5.147 . 0 0 "[ . 1 . 2 . 3 . ]" 1 879 1 93 GLU QB 1 95 THR MG 5.000 . 7.000 4.118 3.622 4.622 . 0 0 "[ . 1 . 2 . 3 . ]" 1 880 1 93 GLU QG 1 94 ILE HA 5.000 . 5.900 4.024 3.452 4.548 . 0 0 "[ . 1 . 2 . 3 . ]" 1 881 1 93 GLU QG 1 95 THR MG 5.000 . 7.000 4.151 2.929 4.868 . 0 0 "[ . 1 . 2 . 3 . ]" 1 882 1 41 VAL MG1 1 94 ILE HA 5.000 . 6.000 2.984 2.731 3.315 . 0 0 "[ . 1 . 2 . 3 . ]" 1 883 1 94 ILE HA 1 95 THR MG 5.000 . 6.000 4.873 4.647 4.976 . 0 0 "[ . 1 . 2 . 3 . ]" 1 884 1 94 ILE HB 1 94 ILE MD 3.000 . 4.000 2.413 2.172 3.182 . 0 0 "[ . 1 . 2 . 3 . ]" 1 885 1 16 VAL MG1 1 94 ILE MD 5.000 . 7.000 4.412 4.154 4.622 . 0 0 "[ . 1 . 2 . 3 . ]" 1 886 1 93 GLU HA 1 94 ILE QG 5.000 . 5.900 3.450 3.047 3.756 . 0 0 "[ . 1 . 2 . 3 . ]" 1 887 1 39 VAL MG1 1 94 ILE MG 3.000 . 5.000 2.403 2.197 2.618 . 0 0 "[ . 1 . 2 . 3 . ]" 1 888 1 94 ILE MG 1 95 THR HA 5.000 . 6.000 3.827 3.527 4.103 . 0 0 "[ . 1 . 2 . 3 . ]" 1 889 1 95 THR HA 1 95 THR HB 3.000 . 3.000 2.838 2.764 2.883 . 0 0 "[ . 1 . 2 . 3 . ]" 1 890 1 95 THR HA 1 95 THR MG 3.000 . 4.000 2.004 1.894 2.146 . 0 0 "[ . 1 . 2 . 3 . ]" 1 891 1 95 THR HB 1 102 VAL MG2 4.000 . 5.000 3.831 3.437 4.100 . 0 0 "[ . 1 . 2 . 3 . ]" 1 892 1 40 LYS QD 1 95 THR HB 5.000 . 6.000 5.180 4.326 5.428 . 0 0 "[ . 1 . 2 . 3 . ]" 1 893 1 27 VAL MG1 1 96 LEU HA 5.000 . 6.000 4.975 4.814 5.057 . 0 0 "[ . 1 . 2 . 3 . ]" 1 894 1 29 LEU MD1 1 96 LEU HA 5.000 . 6.000 4.894 4.839 4.961 . 0 0 "[ . 1 . 2 . 3 . ]" 1 895 1 39 VAL MG2 1 96 LEU HA 4.000 . 5.000 3.314 3.183 3.443 . 0 0 "[ . 1 . 2 . 3 . ]" 1 896 1 96 LEU HA 1 96 LEU MD2 4.000 . 5.000 1.840 1.784 1.936 0.016 17 0 "[ . 1 . 2 . 3 . ]" 1 897 1 96 LEU QB 1 103 ILE HA 4.000 . 4.900 4.026 3.797 4.218 . 0 0 "[ . 1 . 2 . 3 . ]" 1 898 1 96 LEU QB 1 103 ILE HB 4.000 . 4.900 2.111 1.849 2.462 . 0 0 "[ . 1 . 2 . 3 . ]" 1 899 1 96 LEU QB 1 103 ILE QG 4.000 . 5.800 3.443 3.118 3.917 . 0 0 "[ . 1 . 2 . 3 . ]" 1 900 1 96 LEU QB 1 103 ILE MG 5.000 . 6.900 3.474 3.271 3.775 . 0 0 "[ . 1 . 2 . 3 . ]" 1 901 1 12 LEU QB 1 96 LEU QB 5.000 . 6.800 3.282 2.925 3.508 . 0 0 "[ . 1 . 2 . 3 . ]" 1 902 1 12 LEU MD1 1 96 LEU QB 5.000 . 6.900 2.711 1.778 3.308 0.022 28 0 "[ . 1 . 2 . 3 . ]" 1 903 1 29 LEU MD1 1 96 LEU QB 5.000 . 6.900 4.721 4.599 4.964 . 0 0 "[ . 1 . 2 . 3 . ]" 1 904 1 29 LEU MD2 1 96 LEU QB 5.000 . 6.900 3.809 3.775 3.938 . 0 0 "[ . 1 . 2 . 3 . ]" 1 905 1 95 THR HA 1 96 LEU QB 4.000 . 4.900 3.904 3.807 4.015 . 0 0 "[ . 1 . 2 . 3 . ]" 1 906 1 10 GLY QA 1 96 LEU MD1 5.000 . 6.900 4.650 4.029 5.002 . 0 0 "[ . 1 . 2 . 3 . ]" 1 907 1 96 LEU MD1 1 103 ILE HB 5.000 . 6.000 2.014 1.770 2.249 0.030 28 0 "[ . 1 . 2 . 3 . ]" 1 908 1 12 LEU QB 1 96 LEU MD1 5.000 . 6.900 1.692 1.651 1.776 0.149 2 0 "[ . 1 . 2 . 3 . ]" 1 909 1 31 LEU MD2 1 96 LEU MD1 4.000 . 6.000 3.871 3.407 4.077 . 0 0 "[ . 1 . 2 . 3 . ]" 1 910 1 29 LEU QB 1 96 LEU MD2 5.000 . 6.900 4.506 4.419 4.564 . 0 0 "[ . 1 . 2 . 3 . ]" 1 911 1 39 VAL MG1 1 96 LEU MD2 3.000 . 5.000 2.670 2.484 2.979 . 0 0 "[ . 1 . 2 . 3 . ]" 1 912 1 39 VAL MG1 1 96 LEU HG 4.000 . 5.000 2.323 2.004 2.776 . 0 0 "[ . 1 . 2 . 3 . ]" 1 913 1 94 ILE MG 1 96 LEU HG 5.000 . 6.000 4.589 4.395 4.830 . 0 0 "[ . 1 . 2 . 3 . ]" 1 914 1 96 LEU HA 1 96 LEU HG 4.000 . 4.000 2.693 2.597 2.847 . 0 0 "[ . 1 . 2 . 3 . ]" 1 915 1 97 GLU HA 1 102 VAL HA 3.000 . 3.000 1.936 1.835 2.107 . 0 0 "[ . 1 . 2 . 3 . ]" 1 916 1 97 GLU HA 1 102 VAL HB 5.000 . 5.000 4.097 3.948 4.515 . 0 0 "[ . 1 . 2 . 3 . ]" 1 917 1 97 GLU HA 1 102 VAL MG2 4.000 . 5.000 3.676 2.980 3.898 . 0 0 "[ . 1 . 2 . 3 . ]" 1 918 1 97 GLU HA 1 103 ILE HB 5.000 . 5.000 4.740 4.343 5.014 0.014 38 0 "[ . 1 . 2 . 3 . ]" 1 919 1 97 GLU HA 1 103 ILE MD 5.000 . 6.000 4.605 4.146 4.988 . 0 0 "[ . 1 . 2 . 3 . ]" 1 920 1 97 GLU HA 1 103 ILE QG 4.000 . 4.900 3.356 2.998 3.732 . 0 0 "[ . 1 . 2 . 3 . ]" 1 921 1 97 GLU HA 1 98 ILE QG 5.000 . 5.900 3.863 3.746 4.025 . 0 0 "[ . 1 . 2 . 3 . ]" 1 922 1 97 GLU QB 1 102 VAL HA 5.000 . 6.000 3.169 2.870 3.610 . 0 0 "[ . 1 . 2 . 3 . ]" 1 923 1 97 GLU QB 1 102 VAL MG2 5.000 . 7.000 3.574 2.623 4.148 . 0 0 "[ . 1 . 2 . 3 . ]" 1 924 1 38 THR MG 1 97 GLU QB 5.000 . 7.000 3.982 3.629 4.902 . 0 0 "[ . 1 . 2 . 3 . ]" 1 925 1 40 LYS QE 1 97 GLU QB 5.000 . 6.900 3.661 3.354 4.069 . 0 0 "[ . 1 . 2 . 3 . ]" 1 926 1 95 THR MG 1 97 GLU QB 5.000 . 7.000 4.806 4.638 4.999 . 0 0 "[ . 1 . 2 . 3 . ]" 1 927 1 98 ILE HA 1 98 ILE HB 3.000 . 3.000 3.029 3.024 3.032 0.032 16 0 "[ . 1 . 2 . 3 . ]" 1 928 1 98 ILE HA 1 98 ILE MD 4.000 . 5.000 3.413 3.198 3.545 . 0 0 "[ . 1 . 2 . 3 . ]" 1 929 1 98 ILE HA 1 98 ILE MG 3.000 . 4.000 2.442 2.413 2.480 . 0 0 "[ . 1 . 2 . 3 . ]" 1 930 1 98 ILE HB 1 101 GLN QB 5.000 . 5.900 1.882 1.803 2.070 . 0 0 "[ . 1 . 2 . 3 . ]" 1 931 1 98 ILE HB 1 101 GLN QG 5.000 . 6.000 3.510 2.828 3.901 . 0 0 "[ . 1 . 2 . 3 . ]" 1 932 1 98 ILE HB 1 103 ILE MD 4.000 . 5.000 3.902 3.525 4.114 . 0 0 "[ . 1 . 2 . 3 . ]" 1 933 1 98 ILE HB 1 99 ASN QB 5.000 . 5.900 4.272 4.140 4.460 . 0 0 "[ . 1 . 2 . 3 . ]" 1 934 1 98 ILE MD 1 103 ILE HB 5.000 . 6.000 4.266 3.675 4.754 . 0 0 "[ . 1 . 2 . 3 . ]" 1 935 1 98 ILE MD 1 103 ILE QG 5.000 . 6.900 2.819 2.369 3.208 . 0 0 "[ . 1 . 2 . 3 . ]" 1 936 1 31 LEU MD2 1 98 ILE MD 4.000 . 6.000 2.074 1.807 2.321 . 0 0 "[ . 1 . 2 . 3 . ]" 1 937 1 98 ILE QG 1 101 GLN QB 5.000 . 6.800 3.317 3.086 3.584 . 0 0 "[ . 1 . 2 . 3 . ]" 1 938 1 98 ILE QG 1 103 ILE MD 4.000 . 5.900 3.408 2.993 3.724 . 0 0 "[ . 1 . 2 . 3 . ]" 1 939 1 96 LEU MD2 1 98 ILE QG 3.000 . 4.900 2.767 2.581 2.949 . 0 0 "[ . 1 . 2 . 3 . ]" 1 940 1 98 ILE QG 1 99 ASN QB 5.000 . 6.800 5.180 5.126 5.217 . 0 0 "[ . 1 . 2 . 3 . ]" 1 941 1 98 ILE MG 1 101 GLN QB 5.000 . 6.900 3.146 2.836 3.431 . 0 0 "[ . 1 . 2 . 3 . ]" 1 942 1 98 ILE MG 1 99 ASN HA 5.000 . 6.000 4.438 4.291 4.612 . 0 0 "[ . 1 . 2 . 3 . ]" 1 943 1 98 ILE MG 1 99 ASN QB 5.000 . 6.900 2.373 2.272 2.475 . 0 0 "[ . 1 . 2 . 3 . ]" 1 944 1 99 ASN QB 1 101 GLN QB 5.000 . 6.800 4.369 3.936 5.177 . 0 0 "[ . 1 . 2 . 3 . ]" 1 945 1 36 ASP QB 1 99 ASN QB 5.000 . 6.800 2.927 2.264 3.387 . 0 0 "[ . 1 . 2 . 3 . ]" 1 946 1 100 GLY QA 1 101 GLN QG 5.000 . 6.900 4.218 3.203 5.156 . 0 0 "[ . 1 . 2 . 3 . ]" 1 947 1 100 GLY QA 1 101 GLN QB 5.000 . 6.800 4.493 4.279 4.715 . 0 0 "[ . 1 . 2 . 3 . ]" 1 948 1 101 GLN QB 1 103 ILE MD 5.000 . 6.900 2.563 2.207 2.935 . 0 0 "[ . 1 . 2 . 3 . ]" 1 949 1 98 ILE MD 1 101 GLN QB 5.000 . 6.900 3.805 3.668 4.142 . 0 0 "[ . 1 . 2 . 3 . ]" 1 950 1 101 GLN QG 1 103 ILE MD 5.000 . 7.000 3.922 3.044 4.530 . 0 0 "[ . 1 . 2 . 3 . ]" 1 951 1 98 ILE MD 1 101 GLN QG 5.000 . 7.000 4.812 4.385 5.068 . 0 0 "[ . 1 . 2 . 3 . ]" 1 952 1 98 ILE MG 1 101 GLN QG 5.000 . 7.000 3.834 3.190 4.555 . 0 0 "[ . 1 . 2 . 3 . ]" 1 953 1 99 ASN QB 1 101 GLN QG 5.000 . 6.900 4.483 3.276 5.515 . 0 0 "[ . 1 . 2 . 3 . ]" 1 954 1 102 VAL HA 1 102 VAL HB 3.000 . 3.000 2.530 2.425 2.907 . 0 0 "[ . 1 . 2 . 3 . ]" 1 955 1 102 VAL HA 1 102 VAL MG2 3.000 . 4.000 2.275 1.977 2.478 . 0 0 "[ . 1 . 2 . 3 . ]" 1 956 1 102 VAL HA 1 103 ILE HB 5.000 . 5.000 4.700 4.541 4.884 . 0 0 "[ . 1 . 2 . 3 . ]" 1 957 1 102 VAL HA 1 103 ILE MD 5.000 . 6.000 4.041 3.597 4.510 . 0 0 "[ . 1 . 2 . 3 . ]" 1 958 1 102 VAL HA 1 103 ILE QG 5.000 . 5.900 3.330 3.068 3.772 . 0 0 "[ . 1 . 2 . 3 . ]" 1 959 1 96 LEU MD2 1 102 VAL HA 5.000 . 6.000 4.650 4.461 4.761 . 0 0 "[ . 1 . 2 . 3 . ]" 1 960 1 97 GLU QG 1 102 VAL HA 5.000 . 6.000 3.273 2.263 4.618 . 0 0 "[ . 1 . 2 . 3 . ]" 1 961 1 102 VAL MG1 1 103 ILE HA 5.000 . 6.000 3.766 3.393 4.125 . 0 0 "[ . 1 . 2 . 3 . ]" 1 962 1 95 THR MG 1 102 VAL MG2 3.000 . 5.000 2.997 2.669 3.299 . 0 0 "[ . 1 . 2 . 3 . ]" 1 963 1 97 GLU QG 1 102 VAL MG2 5.000 . 7.000 4.254 3.061 4.956 . 0 0 "[ . 1 . 2 . 3 . ]" 1 964 1 103 ILE HA 1 103 ILE HB 3.000 . 3.000 3.027 3.018 3.033 0.033 22 0 "[ . 1 . 2 . 3 . ]" 1 965 1 103 ILE HA 1 103 ILE MD 3.000 . 4.000 1.960 1.835 2.211 . 0 0 "[ . 1 . 2 . 3 . ]" 1 966 1 103 ILE HA 1 103 ILE MG 3.000 . 4.000 2.290 2.159 2.423 . 0 0 "[ . 1 . 2 . 3 . ]" 1 967 1 12 LEU MD1 1 103 ILE HB 5.000 . 6.000 4.789 4.210 5.004 . 0 0 "[ . 1 . 2 . 3 . ]" 1 968 1 96 LEU MD2 1 103 ILE HB 4.000 . 5.000 3.299 2.874 3.620 . 0 0 "[ . 1 . 2 . 3 . ]" 1 969 1 7 PRO QD 1 103 ILE MD 5.000 . 6.900 4.985 4.898 5.060 . 0 0 "[ . 1 . 2 . 3 . ]" 1 970 1 8 VAL HA 1 103 ILE MD 5.000 . 6.000 4.330 3.750 4.791 . 0 0 "[ . 1 . 2 . 3 . ]" 1 971 1 101 GLN QB 1 103 ILE QG 5.000 . 6.800 3.109 2.710 3.444 . 0 0 "[ . 1 . 2 . 3 . ]" 1 972 1 101 GLN QG 1 103 ILE QG 5.000 . 7.000 4.730 4.027 5.218 . 0 0 "[ . 1 . 2 . 3 . ]" 1 973 1 31 LEU MD2 1 103 ILE QG 5.000 . 7.000 4.235 3.790 4.760 . 0 0 "[ . 1 . 2 . 3 . ]" 1 974 1 98 ILE HB 1 103 ILE QG 5.000 . 6.000 3.326 2.968 3.719 . 0 0 "[ . 1 . 2 . 3 . ]" 1 975 1 98 ILE MG 1 103 ILE QG 5.000 . 7.000 4.181 3.874 4.484 . 0 0 "[ . 1 . 2 . 3 . ]" 1 976 1 12 LEU QB 1 103 ILE MG 5.000 . 6.900 2.954 2.506 3.523 . 0 0 "[ . 1 . 2 . 3 . ]" 1 977 1 7 PRO QD 1 103 ILE MG 5.000 . 6.900 4.201 3.939 4.399 . 0 0 "[ . 1 . 2 . 3 . ]" 1 978 1 2 PRO HA 1 3 THR H 3.000 . 3.000 2.600 2.540 2.619 . 0 0 "[ . 1 . 2 . 3 . ]" 1 979 1 3 THR HA 1 4 THR H 3.000 . 3.000 2.239 2.205 2.297 . 0 0 "[ . 1 . 2 . 3 . ]" 1 980 1 3 THR H 1 3 THR HB 4.000 . 4.000 2.235 2.132 2.308 . 0 0 "[ . 1 . 2 . 3 . ]" 1 981 1 4 THR H 1 4 THR HB 4.000 . 4.000 3.156 2.431 3.737 . 0 0 "[ . 1 . 2 . 3 . ]" 1 982 1 5 PRO HA 1 6 VAL H 3.000 . 3.000 2.301 2.218 2.423 . 0 0 "[ . 1 . 2 . 3 . ]" 1 983 1 5 PRO QB 1 6 VAL H 5.000 . 5.900 3.058 2.734 3.418 . 0 0 "[ . 1 . 2 . 3 . ]" 1 984 1 5 PRO QD 1 6 VAL H 5.000 . 6.000 4.999 4.949 5.019 . 0 0 "[ . 1 . 2 . 3 . ]" 1 985 1 6 VAL H 1 6 VAL HB 3.000 . 3.000 2.763 2.543 3.017 0.017 8 0 "[ . 1 . 2 . 3 . ]" 1 986 1 6 VAL H 1 6 VAL MG1 4.000 . 5.000 1.870 1.813 1.990 . 0 0 "[ . 1 . 2 . 3 . ]" 1 987 1 6 VAL H 1 6 VAL MG2 4.000 . 5.000 3.700 3.679 3.746 . 0 0 "[ . 1 . 2 . 3 . ]" 1 988 1 7 PRO HA 1 8 VAL H 3.000 . 3.000 2.283 2.216 2.377 . 0 0 "[ . 1 . 2 . 3 . ]" 1 989 1 7 PRO QB 1 12 LEU H 5.000 . 5.900 5.056 3.965 5.329 . 0 0 "[ . 1 . 2 . 3 . ]" 1 990 1 7 PRO QB 1 8 VAL H 4.000 . 4.900 3.117 2.806 3.424 . 0 0 "[ . 1 . 2 . 3 . ]" 1 991 1 7 PRO QB 1 9 SER H 5.000 . 5.900 2.879 2.503 3.174 . 0 0 "[ . 1 . 2 . 3 . ]" 1 992 1 7 PRO QG 1 12 LEU H 5.000 . 6.000 4.716 3.892 5.238 . 0 0 "[ . 1 . 2 . 3 . ]" 1 993 1 8 VAL H 1 8 VAL HA 3.000 . 3.000 2.994 2.975 3.002 0.002 13 0 "[ . 1 . 2 . 3 . ]" 1 994 1 8 VAL HA 1 9 SER H 3.000 . 3.000 3.021 3.000 3.079 0.079 36 0 "[ . 1 . 2 . 3 . ]" 1 995 1 8 VAL H 1 8 VAL HB 3.000 . 3.000 2.628 2.355 2.851 . 0 0 "[ . 1 . 2 . 3 . ]" 1 996 1 8 VAL HB 1 9 SER H 4.000 . 4.000 3.987 3.886 4.022 0.022 13 0 "[ . 1 . 2 . 3 . ]" 1 997 1 8 VAL H 1 8 VAL MG1 4.000 . 5.000 3.850 3.731 3.952 . 0 0 "[ . 1 . 2 . 3 . ]" 1 998 1 8 VAL MG1 1 9 SER H 5.000 . 6.000 4.173 4.071 4.271 . 0 0 "[ . 1 . 2 . 3 . ]" 1 999 1 9 SER HA 1 10 GLY H 3.000 . 3.000 2.408 2.199 3.060 0.060 11 0 "[ . 1 . 2 . 3 . ]" 1 1000 1 9 SER H 1 9 SER HA 3.000 . 3.000 2.865 2.803 2.986 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1001 1 9 SER QB 1 10 GLY H 5.000 . 6.000 3.753 2.056 4.082 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1002 1 9 SER H 1 9 SER QB 3.000 . 3.900 2.897 2.597 3.461 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1003 1 10 GLY QA 1 11 SER H 3.000 . 3.900 2.296 2.165 2.328 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1004 1 10 GLY QA 1 32 ASP H 5.000 . 5.900 3.833 3.549 4.104 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1005 1 11 SER HA 1 12 LEU H 3.000 . 3.000 2.429 2.312 2.504 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1006 1 11 SER HA 1 30 ASN HD21 5.000 . 5.000 3.926 3.889 3.973 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1007 1 11 SER HA 1 30 ASN HD22 5.000 . 5.000 5.127 5.098 5.149 0.149 11 0 "[ . 1 . 2 . 3 . ]" 1 1008 1 11 SER QB 1 12 LEU H 4.000 . 4.900 3.020 2.675 3.292 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1009 1 11 SER QB 1 30 ASN HD21 5.000 . 5.900 1.912 1.840 2.065 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1010 1 11 SER QB 1 30 ASN HD22 5.000 . 5.900 2.771 2.662 2.814 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1011 1 11 SER QB 1 30 ASN H 5.000 . 5.900 3.037 2.910 3.257 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1012 1 11 SER H 1 30 ASN HD21 5.000 . 5.000 3.298 3.136 3.375 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1013 1 11 SER H 1 30 ASN HD22 5.000 . 5.000 4.964 4.791 5.054 0.054 28 0 "[ . 1 . 2 . 3 . ]" 1 1014 1 11 SER H 1 30 ASN H 5.000 . 5.000 2.495 2.357 2.626 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1015 1 12 LEU HA 1 13 GLU H 3.000 . 3.000 2.188 2.165 2.224 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1016 1 12 LEU HA 1 30 ASN HD21 5.000 . 5.000 2.800 2.595 2.974 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1017 1 12 LEU QB 1 13 GLU H 5.000 . 5.900 3.764 3.677 3.897 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1018 1 12 LEU MD1 1 13 GLU H 5.000 . 6.000 3.320 2.531 4.574 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1019 1 12 LEU MD1 1 14 VAL H 5.000 . 6.000 3.680 2.867 4.651 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1020 1 12 LEU H 1 12 LEU MD2 5.000 . 6.000 4.110 4.009 4.214 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1021 1 12 LEU MD2 1 13 GLU H 5.000 . 6.000 1.840 1.768 2.223 0.032 27 0 "[ . 1 . 2 . 3 . ]" 1 1022 1 12 LEU MD2 1 14 VAL H 5.000 . 6.000 3.868 3.117 4.467 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1023 1 12 LEU MD2 1 29 LEU H 5.000 . 6.000 3.972 3.757 4.318 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1024 1 12 LEU MD2 1 30 ASN H 5.000 . 6.000 4.434 4.095 4.809 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1025 1 12 LEU H 1 13 GLU H 5.000 . 5.000 4.183 4.018 4.283 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1026 1 13 GLU HA 1 14 VAL H 3.000 . 3.000 2.282 2.231 2.408 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1027 1 13 GLU QB 1 14 VAL H 4.000 . 4.900 3.354 2.821 3.659 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1028 1 13 GLU QB 1 28 THR H 5.000 . 5.900 3.457 3.269 4.167 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1029 1 13 GLU QB 1 30 ASN HD21 5.000 . 5.900 4.913 4.622 5.114 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1030 1 13 GLU QB 1 30 ASN HD22 5.000 . 5.900 3.585 3.175 3.770 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1031 1 13 GLU QG 1 14 VAL H 5.000 . 6.000 4.092 3.418 4.687 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1032 1 13 GLU QG 1 28 THR H 5.000 . 6.000 5.184 2.053 5.431 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1033 1 13 GLU QG 1 30 ASN HD21 5.000 . 6.000 4.600 3.263 5.388 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1034 1 13 GLU QG 1 30 ASN HD22 5.000 . 6.000 3.555 1.987 4.354 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1035 1 13 GLU H 1 14 VAL H 5.000 . 5.000 4.311 4.157 4.480 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1036 1 13 GLU H 1 30 ASN HD21 5.000 . 5.000 4.161 3.631 4.475 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1037 1 13 GLU H 1 30 ASN HD22 5.000 . 5.000 3.444 2.692 3.857 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1038 1 14 VAL HA 1 15 LYS H 4.000 . 4.000 2.201 2.171 2.238 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1039 1 14 VAL H 1 14 VAL HB 3.000 . 3.000 2.553 2.411 2.752 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1040 1 14 VAL MG1 1 15 LYS H 5.000 . 6.000 2.272 1.983 2.853 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1041 1 14 VAL MG1 1 16 VAL H 5.000 . 6.000 4.752 4.613 4.894 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1042 1 14 VAL MG1 1 26 ASP H 5.000 . 6.000 3.505 3.333 3.714 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1043 1 14 VAL MG1 1 27 VAL H 5.000 . 6.000 4.504 4.167 4.659 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1044 1 14 VAL MG1 1 28 THR H 5.000 . 6.000 4.758 4.425 4.929 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1045 1 13 GLU H 1 14 VAL MG2 5.000 . 6.000 3.621 3.402 3.856 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1046 1 15 LYS HA 1 16 VAL H 3.000 . 3.000 2.433 2.394 2.445 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1047 1 15 LYS QB 1 16 VAL H 4.000 . 4.900 3.148 2.781 3.584 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1048 1 15 LYS QB 1 26 ASP H 5.000 . 5.900 3.380 3.101 4.316 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1049 1 15 LYS QG 1 16 VAL H 5.000 . 6.000 3.008 1.858 4.460 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1050 1 15 LYS QG 1 26 ASP H 5.000 . 6.000 4.864 2.181 5.414 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1051 1 16 VAL HA 1 17 ASN H 3.000 . 3.000 2.244 2.215 2.263 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1052 1 16 VAL HA 1 24 GLU H 5.000 . 5.000 4.215 4.109 4.321 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1053 1 16 VAL HA 1 26 ASP H 5.000 . 5.000 3.237 3.116 3.342 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1054 1 16 VAL H 1 16 VAL HB 3.000 . 3.000 2.679 2.628 2.719 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1055 1 16 VAL HB 1 17 ASN H 5.000 . 5.000 4.059 4.004 4.171 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1056 1 16 VAL MG1 1 17 ASN H 5.000 . 6.000 2.073 1.943 2.449 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1057 1 16 VAL MG1 1 18 ASP H 5.000 . 6.000 3.614 3.463 3.738 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1058 1 16 VAL MG1 1 24 GLU H 5.000 . 6.000 3.014 2.883 3.201 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1059 1 16 VAL MG1 1 26 ASP H 5.000 . 6.000 4.871 4.720 4.955 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1060 1 15 LYS H 1 16 VAL MG2 5.000 . 6.000 3.724 3.597 3.903 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1061 1 16 VAL MG2 1 17 ASN H 5.000 . 6.000 3.827 3.755 3.885 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1062 1 16 VAL MG2 1 24 GLU H 5.000 . 6.000 4.933 4.868 4.990 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1063 1 16 VAL MG2 1 25 TYR H 5.000 . 6.000 4.363 4.247 4.469 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1064 1 16 VAL MG2 1 26 ASP H 5.000 . 6.000 3.414 3.225 3.563 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1065 1 17 ASN HA 1 18 ASP H 3.000 . 3.000 2.228 2.201 2.251 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1066 1 17 ASN QB 1 18 ASP H 4.000 . 4.900 3.860 3.624 3.986 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1067 1 17 ASN QB 1 24 GLU H 5.000 . 5.900 3.817 3.317 4.337 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1068 1 17 ASN H 1 17 ASN HD21 5.000 . 5.000 3.989 3.514 4.654 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1069 1 17 ASN HD21 1 18 ASP H 5.000 . 5.000 4.055 3.269 4.694 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1070 1 17 ASN H 1 17 ASN HD22 5.000 . 5.000 5.039 4.746 5.096 0.096 15 0 "[ . 1 . 2 . 3 . ]" 1 1071 1 17 ASN HD22 1 18 ASP H 5.000 . 5.000 4.905 4.670 5.134 0.134 27 0 "[ . 1 . 2 . 3 . ]" 1 1072 1 17 ASN H 1 18 ASP H 5.000 . 5.000 4.032 3.990 4.074 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1073 1 17 ASN H 1 24 GLU H 4.000 . 4.000 2.413 2.303 2.532 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1074 1 18 ASP HA 1 19 TRP H 3.000 . 3.000 2.255 2.203 2.281 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1075 1 18 ASP HA 1 20 GLY H 4.000 . 4.000 3.798 3.579 3.898 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1076 1 18 ASP HA 1 24 GLU H 4.000 . 4.000 3.122 3.004 3.255 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1077 1 18 ASP H 1 18 ASP QB 3.000 . 3.900 2.509 2.126 2.727 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1078 1 18 ASP QB 1 19 TRP H 5.000 . 5.900 2.998 2.873 3.320 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1079 1 18 ASP QB 1 20 GLY H 5.000 . 5.900 2.904 2.729 3.058 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1080 1 18 ASP QB 1 22 GLY H 4.000 . 5.900 4.947 4.737 5.104 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1081 1 18 ASP H 1 19 TRP H 5.000 . 5.000 4.598 4.521 4.617 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1082 1 19 TRP HA 1 20 GLY H 4.000 . 4.000 3.118 3.063 3.163 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1083 1 19 TRP HA 1 21 SER H 5.000 . 5.000 4.654 4.538 4.962 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1084 1 19 TRP HA 1 22 GLY H 5.000 . 5.000 5.054 5.015 5.106 0.106 11 0 "[ . 1 . 2 . 3 . ]" 1 1085 1 19 TRP QB 1 20 GLY H 5.000 . 5.900 3.970 3.946 3.998 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1086 1 19 TRP QB 1 21 SER H 5.000 . 5.900 3.719 3.539 4.076 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1087 1 19 TRP QB 1 22 GLY H 5.000 . 5.900 4.211 4.146 4.305 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1088 1 19 TRP H 1 19 TRP HD1 5.000 . 5.000 3.985 3.912 4.038 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1089 1 19 TRP HD1 1 20 GLY H 5.000 . 5.000 4.445 4.330 4.571 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1090 1 19 TRP HD1 1 21 SER H 3.000 . 3.000 2.190 1.999 2.683 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1091 1 19 TRP HD1 1 22 GLY H 3.000 . 3.000 2.816 2.689 2.973 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1092 1 19 TRP HE1 1 21 SER H 5.000 . 5.000 3.858 3.689 4.238 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1093 1 19 TRP HE1 1 22 GLY H 5.000 . 5.000 2.600 2.499 2.780 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1094 1 17 ASN H 1 19 TRP HE3 5.000 . 5.000 4.987 4.914 5.028 0.028 6 0 "[ . 1 . 2 . 3 . ]" 1 1095 1 19 TRP H 1 19 TRP HE3 4.000 . 4.000 2.963 2.652 3.085 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1096 1 19 TRP HE3 1 20 GLY H 5.000 . 5.500 5.075 4.925 5.196 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1097 1 19 TRP HE3 1 24 GLU H 5.000 . 5.000 3.643 3.567 3.781 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1098 1 19 TRP H 1 20 GLY H 3.000 . 4.000 2.191 2.084 2.403 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1099 1 19 TRP H 1 22 GLY H 5.000 . 5.000 3.001 2.914 3.157 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1100 1 19 TRP HZ2 1 83 VAL H 5.000 . 5.000 4.858 4.676 4.971 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1101 1 19 TRP HZ3 1 24 GLU H 4.000 . 4.000 1.960 1.870 2.071 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1102 1 19 TRP H 1 20 GLY QA 5.000 . 5.900 4.094 4.017 4.269 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1103 1 20 GLY QA 1 21 SER H 3.000 . 3.900 2.526 2.369 2.611 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1104 1 20 GLY QA 1 87 GLN HE21 5.000 . 5.900 4.354 3.561 5.213 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1105 1 20 GLY QA 1 87 GLN HE22 5.000 . 5.900 5.061 4.122 5.296 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1106 1 20 GLY H 1 21 SER H 4.000 . 4.000 3.597 3.396 3.884 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1107 1 20 GLY H 1 22 GLY H 4.000 . 4.000 3.275 3.142 3.480 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1108 1 21 SER HA 1 22 GLY H 4.000 . 4.000 3.491 3.446 3.535 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1109 1 21 SER HA 1 85 GLY H 5.000 . 5.000 4.892 4.455 5.046 0.046 31 0 "[ . 1 . 2 . 3 . ]" 1 1110 1 21 SER QB 1 22 GLY H 5.000 . 5.900 3.009 2.813 3.438 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1111 1 21 SER H 1 22 GLY H 3.000 . 3.000 2.641 2.490 2.837 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1112 1 19 TRP HE1 1 22 GLY QA 5.000 . 5.900 2.525 2.301 2.781 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1113 1 22 GLY QA 1 23 ALA H 3.000 . 3.900 2.318 2.303 2.329 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1114 1 22 GLY QA 1 83 VAL H 5.000 . 5.900 4.557 4.378 4.673 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1115 1 22 GLY QA 1 84 ASN HD21 5.000 . 5.900 3.126 2.806 3.358 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1116 1 22 GLY QA 1 84 ASN HD22 5.000 . 5.900 2.863 2.592 4.157 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1117 1 22 GLY QA 1 84 ASN H 5.000 . 5.900 4.467 4.208 4.625 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1118 1 22 GLY QA 1 85 GLY H 4.000 . 4.900 2.975 2.614 3.209 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1119 1 22 GLY H 1 23 ALA H 5.000 . 5.000 4.393 4.368 4.411 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1120 1 17 ASN H 1 23 ALA HA 5.000 . 5.000 4.376 4.262 4.505 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1121 1 18 ASP H 1 23 ALA HA 5.000 . 5.000 4.415 4.327 4.483 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1122 1 19 TRP H 1 23 ALA HA 4.000 . 4.000 3.210 3.084 3.296 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1123 1 20 GLY H 1 23 ALA HA 5.000 . 5.000 4.860 4.653 4.979 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1124 1 23 ALA HA 1 24 GLU H 3.000 . 3.000 2.259 2.232 2.299 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1125 1 17 ASN H 1 23 ALA MB 5.000 . 6.000 4.202 3.937 4.416 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1126 1 18 ASP H 1 23 ALA MB 5.000 . 6.000 4.515 4.279 4.692 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1127 1 19 TRP H 1 23 ALA MB 5.000 . 6.000 4.093 3.900 4.250 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1128 1 20 GLY H 1 23 ALA MB 5.000 . 6.000 4.782 4.636 4.823 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1129 1 22 GLY H 1 23 ALA MB 5.000 . 6.000 4.788 4.718 4.845 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1130 1 23 ALA MB 1 24 GLU H 5.000 . 6.000 2.987 2.889 3.088 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1131 1 23 ALA MB 1 90 LYS H 5.000 . 6.000 3.287 2.867 3.657 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1132 1 19 TRP HE1 1 23 ALA H 5.000 . 5.000 4.870 4.701 5.008 0.008 11 0 "[ . 1 . 2 . 3 . ]" 1 1133 1 23 ALA H 1 24 GLU H 5.000 . 5.000 4.405 4.326 4.463 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1134 1 23 ALA H 1 83 VAL H 4.000 . 4.000 2.933 2.748 3.032 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1135 1 23 ALA H 1 84 ASN HD21 5.000 . 5.000 3.793 3.484 4.077 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1136 1 23 ALA H 1 84 ASN HD22 5.000 . 5.000 4.283 3.936 4.928 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1137 1 24 GLU HA 1 25 TYR H 3.000 . 3.000 2.287 2.272 2.302 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1138 1 17 ASN HD21 1 24 GLU QB 5.000 . 5.900 3.044 1.879 4.390 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1139 1 17 ASN HD22 1 24 GLU QB 5.000 . 5.900 3.756 3.123 5.335 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1140 1 17 ASN H 1 24 GLU QB 5.000 . 5.900 2.260 2.130 2.405 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1141 1 24 GLU QB 1 25 TYR H 5.000 . 5.900 3.093 3.011 3.139 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1142 1 17 ASN H 1 24 GLU QG 5.000 . 5.900 4.325 4.176 4.458 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1143 1 24 GLU QG 1 25 TYR H 4.000 . 4.900 3.327 3.234 3.592 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1144 1 24 GLU QG 1 83 VAL H 5.000 . 5.900 5.272 5.184 5.335 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1145 1 18 ASP H 1 24 GLU H 5.000 . 5.000 4.352 4.291 4.442 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1146 1 24 GLU H 1 25 TYR H 5.000 . 5.000 4.597 4.579 4.615 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1147 1 25 TYR HA 1 26 ASP H 3.000 . 3.000 2.362 2.280 2.424 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1148 1 25 TYR QB 1 26 ASP H 5.000 . 5.900 3.844 3.778 3.883 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1149 1 25 TYR QB 1 81 PHE H 5.000 . 5.900 2.839 2.577 2.995 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1150 1 25 TYR H 1 25 TYR QD 3.000 . 5.000 2.795 2.626 3.205 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1151 1 25 TYR QD 1 26 ASP H 5.000 . 7.000 4.806 4.597 4.894 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1152 1 17 ASN H 1 25 TYR QE 5.000 . 7.000 5.239 5.099 5.463 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1153 1 23 ALA H 1 25 TYR QE 5.000 . 7.000 3.211 3.030 3.544 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1154 1 24 GLU H 1 25 TYR QE 5.000 . 7.000 4.199 3.971 4.489 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1155 1 25 TYR QE 1 83 VAL H 4.000 . 6.000 2.117 1.915 2.525 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1156 1 25 TYR QE 1 90 LYS H 5.000 . 7.000 3.757 3.350 4.230 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1157 1 25 TYR QE 1 91 VAL H 5.000 . 7.000 4.109 3.676 4.413 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1158 1 25 TYR H 1 81 PHE H 5.000 . 5.000 2.754 2.591 2.904 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1159 1 26 ASP HA 1 27 VAL H 3.000 . 3.000 2.276 2.192 2.329 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1160 1 26 ASP HA 1 53 TRP HE1 5.000 . 5.000 3.856 3.626 4.063 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1161 1 26 ASP HA 1 79 PHE H 5.000 . 5.000 5.058 5.011 5.104 0.104 14 0 "[ . 1 . 2 . 3 . ]" 1 1162 1 26 ASP HA 1 81 PHE H 4.000 . 4.000 3.699 3.471 4.012 0.012 16 0 "[ . 1 . 2 . 3 . ]" 1 1163 1 15 LYS H 1 26 ASP QB 5.000 . 5.900 2.389 1.993 2.720 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1164 1 26 ASP QB 1 27 VAL H 5.000 . 5.900 3.333 2.914 3.859 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1165 1 26 ASP H 1 27 VAL H 5.000 . 5.000 4.606 4.312 4.666 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1166 1 13 GLU H 1 27 VAL HA 5.000 . 5.000 4.324 4.067 4.740 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1167 1 15 LYS H 1 27 VAL HA 4.000 . 4.000 4.043 3.836 4.106 0.106 36 0 "[ . 1 . 2 . 3 . ]" 1 1168 1 27 VAL H 1 27 VAL HA 3.000 . 3.000 2.982 2.967 2.995 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1169 1 27 VAL HA 1 28 THR H 3.000 . 3.000 2.360 2.320 2.392 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1170 1 27 VAL H 1 27 VAL HB 3.000 . 3.000 2.780 2.515 2.938 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1171 1 27 VAL MG1 1 28 THR H 5.000 . 6.000 3.616 3.503 3.709 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1172 1 27 VAL MG1 1 29 LEU H 5.000 . 6.000 4.594 4.252 4.821 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1173 1 27 VAL MG1 1 79 PHE H 5.000 . 6.000 4.217 4.135 4.305 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1174 1 15 LYS H 1 27 VAL MG2 5.000 . 6.000 4.229 4.065 4.599 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1175 1 27 VAL MG2 1 28 THR H 5.000 . 6.000 4.392 4.350 4.427 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1176 1 27 VAL MG2 1 80 GLY H 5.000 . 6.000 4.632 4.454 4.850 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1177 1 27 VAL MG2 1 81 PHE H 5.000 . 6.000 3.585 3.321 3.887 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1178 1 27 VAL H 1 53 TRP HE1 5.000 . 5.000 4.546 4.350 4.716 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1179 1 27 VAL H 1 79 PHE H 4.000 . 4.000 3.194 3.057 3.589 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1180 1 28 THR HA 1 29 LEU H 3.000 . 3.000 2.219 2.205 2.235 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1181 1 28 THR HA 1 78 THR H 5.000 . 5.000 4.514 4.369 4.665 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1182 1 13 GLU H 1 28 THR HB 5.000 . 5.000 3.036 2.749 3.201 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1183 1 28 THR H 1 28 THR HB 3.000 . 3.000 2.492 2.331 2.634 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1184 1 28 THR HB 1 29 LEU H 5.000 . 5.000 4.260 4.152 4.341 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1185 1 13 GLU H 1 28 THR MG 5.000 . 6.000 4.171 3.898 4.435 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1186 1 28 THR MG 1 29 LEU H 5.000 . 6.000 2.801 2.600 3.068 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1187 1 28 THR MG 1 30 ASN HD21 5.000 . 6.000 4.416 4.037 4.785 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1188 1 28 THR MG 1 30 ASN HD22 5.000 . 6.000 3.284 2.785 3.702 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1189 1 28 THR MG 1 77 ALA H 5.000 . 6.000 4.549 4.234 4.768 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1190 1 28 THR MG 1 79 PHE H 5.000 . 6.000 4.892 4.791 4.938 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1191 1 28 THR H 1 29 LEU H 5.000 . 5.000 4.487 4.396 4.555 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1192 1 29 LEU HA 1 30 ASN HD22 5.000 . 5.000 3.187 3.071 3.313 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1193 1 29 LEU HA 1 30 ASN H 3.000 . 3.000 2.297 2.246 2.357 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1194 1 11 SER H 1 29 LEU QB 5.000 . 5.900 4.746 4.580 4.906 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1195 1 29 LEU QB 1 30 ASN H 5.000 . 5.900 3.011 2.933 3.119 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1196 1 29 LEU QB 1 77 ALA H 5.000 . 5.900 2.887 2.688 3.011 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1197 1 29 LEU H 1 29 LEU MD1 5.000 . 6.000 3.495 3.323 3.646 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1198 1 29 LEU MD1 1 30 ASN H 5.000 . 6.000 4.894 4.816 4.979 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1199 1 29 LEU MD1 1 37 TRP HE1 5.000 . 6.000 4.788 4.658 4.889 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1200 1 29 LEU MD1 1 77 ALA H 5.000 . 6.000 4.625 4.403 4.790 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1201 1 29 LEU MD1 1 79 PHE H 5.000 . 6.000 4.372 4.134 4.570 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1202 1 12 LEU H 1 29 LEU MD2 5.000 . 6.000 4.724 4.621 4.765 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1203 1 13 GLU H 1 29 LEU MD2 5.000 . 6.000 4.918 4.876 4.950 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1204 1 29 LEU H 1 29 LEU MD2 5.000 . 6.000 4.411 4.315 4.466 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1205 1 29 LEU MD2 1 30 ASN H 5.000 . 6.000 3.034 2.891 3.139 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1206 1 29 LEU MD2 1 77 ALA H 5.000 . 6.000 4.843 4.706 4.929 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1207 1 29 LEU H 1 30 ASN H 5.000 . 5.000 4.566 4.525 4.609 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1208 1 29 LEU H 1 77 ALA H 5.000 . 5.000 3.374 3.130 3.596 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1209 1 30 ASN HA 1 30 ASN HD22 5.000 . 5.000 4.441 4.405 4.489 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1210 1 30 ASN HA 1 31 LEU H 3.000 . 3.000 2.262 2.229 2.297 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1211 1 30 ASN HA 1 76 THR H 4.000 . 5.000 4.898 4.712 5.012 0.012 4 0 "[ . 1 . 2 . 3 . ]" 1 1212 1 30 ASN HA 1 77 ALA H 5.000 . 5.000 3.634 3.456 3.808 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1213 1 11 SER H 1 30 ASN QB 5.000 . 5.900 2.753 2.458 3.033 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1214 1 30 ASN QB 1 31 LEU H 5.000 . 5.900 3.415 3.157 3.655 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1215 1 30 ASN H 1 30 ASN HD21 5.000 . 5.000 1.862 1.833 1.902 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1216 1 30 ASN H 1 30 ASN HD22 5.000 . 5.000 3.330 3.270 3.387 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1217 1 30 ASN H 1 31 LEU H 5.000 . 5.000 4.247 4.026 4.434 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1218 1 10 GLY H 1 31 LEU HA 5.000 . 5.000 4.614 4.124 5.028 0.028 20 0 "[ . 1 . 2 . 3 . ]" 1 1219 1 11 SER H 1 31 LEU HA 5.000 . 5.000 3.694 3.481 3.859 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1220 1 31 LEU HA 1 32 ASP H 3.000 . 3.000 2.380 2.282 2.528 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1221 1 31 LEU HA 1 33 GLY H 5.000 . 5.000 4.168 4.043 4.313 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1222 1 31 LEU QB 1 32 ASP H 4.000 . 4.900 2.726 2.472 2.920 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1223 1 31 LEU QB 1 33 GLY H 4.000 . 4.900 2.579 2.467 2.634 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1224 1 11 SER H 1 31 LEU MD1 5.000 . 6.000 5.068 5.016 5.108 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1225 1 30 ASN H 1 31 LEU MD1 5.000 . 6.000 4.720 4.513 4.858 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1226 1 31 LEU H 1 31 LEU MD1 5.000 . 6.000 3.768 3.524 3.932 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1227 1 31 LEU MD1 1 32 ASP H 5.000 . 6.000 4.796 4.560 4.995 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1228 1 31 LEU MD1 1 33 GLY H 5.000 . 6.000 4.342 4.084 4.508 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1229 1 31 LEU MD1 1 35 TYR H 5.000 . 6.000 2.507 2.080 3.039 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1230 1 31 LEU MD1 1 37 TRP HE1 5.000 . 6.000 3.258 3.005 3.605 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1231 1 31 LEU MD1 1 76 THR H 5.000 . 6.000 4.357 3.874 4.890 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1232 1 11 SER H 1 31 LEU MD2 5.000 . 6.000 2.552 2.304 2.725 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1233 1 31 LEU H 1 31 LEU MD2 5.000 . 6.000 3.456 3.017 3.723 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1234 1 31 LEU MD2 1 32 ASP H 5.000 . 6.000 3.800 3.674 4.018 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1235 1 31 LEU MD2 1 33 GLY H 5.000 . 6.000 4.986 4.869 5.061 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1236 1 30 ASN H 1 31 LEU HG 5.000 . 5.000 3.709 3.520 3.948 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1237 1 31 LEU H 1 31 LEU HG 4.000 . 4.000 2.354 2.062 2.583 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1238 1 31 LEU HG 1 32 ASP H 5.000 . 5.000 5.031 4.933 5.088 0.088 13 0 "[ . 1 . 2 . 3 . ]" 1 1239 1 31 LEU HG 1 33 GLY H 5.000 . 5.000 5.045 4.860 5.106 0.106 32 0 "[ . 1 . 2 . 3 . ]" 1 1240 1 31 LEU H 1 32 ASP H 5.000 . 5.000 4.471 4.388 4.546 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1241 1 31 LEU H 1 33 GLY H 5.000 . 5.000 4.261 4.057 4.538 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1242 1 32 ASP HA 1 33 GLY H 4.000 . 4.000 2.968 2.918 3.062 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1243 1 32 ASP QB 1 33 GLY H 5.000 . 5.900 3.815 3.734 4.071 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1244 1 32 ASP H 1 33 GLY H 4.000 . 4.000 3.036 2.740 3.171 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1245 1 33 GLY QA 1 34 GLN H 3.000 . 3.900 2.219 2.168 2.411 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1246 1 33 GLY H 1 34 GLN H 5.000 . 5.000 4.102 3.321 4.415 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1247 1 33 GLY H 1 76 THR H 5.000 . 5.000 5.103 5.057 5.144 0.144 7 0 "[ . 1 . 2 . 3 . ]" 1 1248 1 34 GLN HA 1 34 GLN HE21 5.000 . 5.000 3.917 2.697 4.891 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1249 1 34 GLN HA 1 34 GLN HE22 5.000 . 5.000 4.729 3.770 5.020 0.020 38 0 "[ . 1 . 2 . 3 . ]" 1 1250 1 34 GLN HA 1 35 TYR H 3.000 . 3.000 2.256 2.203 2.332 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1251 1 34 GLN HA 1 74 GLY H 5.000 . 5.000 4.786 4.028 5.047 0.047 10 0 "[ . 1 . 2 . 3 . ]" 1 1252 1 34 GLN QB 1 35 TYR H 5.000 . 5.900 3.747 3.438 4.047 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1253 1 34 GLN HE22 1 73 LYS H 5.000 . 5.000 4.530 3.220 5.004 0.004 18 0 "[ . 1 . 2 . 3 . ]" 1 1254 1 34 GLN HE22 1 74 GLY H 5.000 . 5.000 3.979 3.024 4.708 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1255 1 34 GLN H 1 34 GLN QG 4.000 . 4.900 3.320 2.013 4.202 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1256 1 34 GLN QG 1 35 TYR H 5.000 . 5.900 4.039 2.888 4.649 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1257 1 34 GLN QG 1 74 GLY H 5.000 . 5.900 4.610 3.604 5.269 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1258 1 34 GLN H 1 35 TYR H 5.000 . 5.000 4.134 3.827 4.427 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1259 1 35 TYR HA 1 36 ASP H 3.000 . 3.000 2.275 2.218 2.506 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1260 1 35 TYR QB 1 36 ASP H 3.000 . 3.900 3.098 2.514 3.303 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1261 1 31 LEU H 1 35 TYR QD 5.000 . 7.000 5.342 4.940 5.744 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1262 1 32 ASP H 1 35 TYR QD 5.000 . 7.000 3.907 3.455 4.441 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1263 1 33 GLY H 1 35 TYR QD 5.000 . 7.000 3.871 3.133 4.649 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1264 1 34 GLN H 1 35 TYR QD 5.000 . 7.000 3.588 2.689 4.516 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1265 1 35 TYR H 1 35 TYR QD 4.000 . 6.000 2.640 2.000 3.361 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1266 1 35 TYR QD 1 36 ASP H 4.000 . 6.000 4.501 4.204 4.772 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1267 1 31 LEU H 1 35 TYR QE 5.000 . 7.000 5.413 4.724 6.233 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1268 1 32 ASP H 1 35 TYR QE 4.000 . 6.000 2.420 1.832 3.286 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1269 1 33 GLY H 1 35 TYR QE 3.000 . 5.000 2.546 1.846 3.829 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1270 1 34 GLN H 1 35 TYR QE 5.000 . 7.000 2.975 2.029 3.906 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1271 1 35 TYR H 1 35 TYR QE 5.000 . 7.000 4.431 4.153 4.724 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1272 1 35 TYR H 1 36 ASP H 5.000 . 5.000 4.392 4.219 4.536 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1273 1 36 ASP HA 1 37 TRP HE1 5.000 . 5.000 4.937 4.741 5.042 0.042 36 0 "[ . 1 . 2 . 3 . ]" 1 1274 1 36 ASP HA 1 37 TRP H 3.000 . 3.000 2.283 2.236 2.312 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1275 1 36 ASP H 1 36 ASP QB 3.000 . 3.900 2.221 1.927 2.510 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1276 1 36 ASP QB 1 37 TRP H 5.000 . 5.900 3.811 3.622 4.024 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1277 1 36 ASP H 1 37 TRP H 5.000 . 5.000 4.269 4.187 4.431 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1278 1 37 TRP HA 1 38 THR H 3.000 . 3.000 2.190 2.160 2.214 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1279 1 37 TRP HA 1 97 GLU H 5.000 . 5.000 5.050 5.004 5.080 0.080 32 0 "[ . 1 . 2 . 3 . ]" 1 1280 1 37 TRP QB 1 38 THR H 4.000 . 4.900 3.548 3.462 3.622 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1281 1 35 TYR H 1 37 TRP HD1 5.000 . 5.000 3.576 3.401 3.818 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1282 1 36 ASP H 1 37 TRP HD1 5.000 . 5.000 5.044 4.996 5.096 0.096 25 0 "[ . 1 . 2 . 3 . ]" 1 1283 1 37 TRP H 1 37 TRP HD1 4.000 . 4.000 2.345 2.275 2.449 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1284 1 37 TRP H 1 37 TRP HE1 5.000 . 5.000 3.799 3.759 3.828 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1285 1 37 TRP HE1 1 73 LYS H 5.000 . 5.000 4.370 4.213 4.551 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1286 1 37 TRP HE1 1 74 GLY H 5.000 . 5.000 4.590 4.172 4.892 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1287 1 37 TRP HE3 1 38 THR H 5.000 . 5.000 4.541 4.380 4.668 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1288 1 37 TRP HE3 1 39 VAL H 4.000 . 4.000 3.380 3.224 3.484 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1289 1 37 TRP HH2 1 55 ALA H 5.000 . 5.000 5.065 5.020 5.129 0.129 9 0 "[ . 1 . 2 . 3 . ]" 1 1290 1 37 TRP HH2 1 56 ASN H 5.000 . 5.000 4.903 4.782 5.012 0.012 38 0 "[ . 1 . 2 . 3 . ]" 1 1291 1 37 TRP H 1 38 THR H 5.000 . 5.000 4.345 4.281 4.396 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1292 1 37 TRP HZ2 1 72 ASN H 5.000 . 5.000 4.756 4.606 4.946 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1293 1 37 TRP HZ2 1 73 LYS H 5.000 . 5.000 5.044 4.931 5.113 0.113 24 0 "[ . 1 . 2 . 3 . ]" 1 1294 1 37 TRP HZ3 1 39 VAL H 4.000 . 4.000 3.921 3.736 4.031 0.031 14 0 "[ . 1 . 2 . 3 . ]" 1 1295 1 37 TRP HZ3 1 67 THR H 5.000 . 5.000 4.705 4.455 4.977 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1296 1 38 THR HA 1 39 VAL H 3.000 . 3.000 2.227 2.213 2.240 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1297 1 38 THR H 1 38 THR HB 4.000 . 4.000 2.590 2.407 2.716 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1298 1 38 THR HB 1 39 VAL H 5.000 . 5.000 4.280 4.200 4.404 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1299 1 38 THR HB 1 97 GLU H 5.000 . 5.000 3.879 3.725 4.016 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1300 1 38 THR MG 1 39 VAL H 4.000 . 5.000 3.030 2.880 3.153 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1301 1 38 THR H 1 39 VAL H 5.000 . 5.000 4.331 4.271 4.373 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1302 1 38 THR H 1 97 GLU H 5.000 . 5.000 3.723 3.583 3.837 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1303 1 39 VAL HA 1 40 LYS H 3.000 . 3.000 2.219 2.194 2.242 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1304 1 39 VAL HA 1 97 GLU H 4.000 . 4.000 2.664 2.499 2.789 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1305 1 39 VAL H 1 39 VAL HB 4.000 . 4.000 2.591 2.472 2.660 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1306 1 39 VAL HB 1 40 LYS H 5.000 . 5.000 4.287 4.237 4.342 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1307 1 39 VAL MG1 1 40 LYS H 5.000 . 6.000 3.075 3.003 3.224 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1308 1 39 VAL MG1 1 97 GLU H 5.000 . 6.000 4.155 3.939 4.373 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1309 1 39 VAL H 1 40 LYS H 5.000 . 5.000 4.347 4.332 4.380 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1310 1 40 LYS HA 1 41 VAL H 3.000 . 3.000 2.294 2.213 2.338 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1311 1 40 LYS HA 1 64 VAL H 5.000 . 5.000 4.387 4.244 4.526 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1312 1 40 LYS QB 1 41 VAL H 5.000 . 6.000 3.630 3.551 3.820 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1313 1 40 LYS QB 1 95 THR H 5.000 . 6.000 3.455 3.057 3.818 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1314 1 40 LYS QE 1 41 VAL H 5.000 . 6.000 4.920 4.633 5.249 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1315 1 40 LYS QG 1 41 VAL H 5.000 . 5.900 2.404 2.213 2.790 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1316 1 40 LYS QG 1 95 THR H 4.000 . 4.900 4.138 3.905 4.276 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1317 1 40 LYS H 1 41 VAL H 5.000 . 5.000 4.615 4.533 4.655 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1318 1 41 VAL HA 1 42 LYS H 4.000 . 4.000 2.247 2.223 2.271 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1319 1 41 VAL HA 1 93 GLU H 5.000 . 5.000 4.360 4.235 4.499 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1320 1 41 VAL H 1 41 VAL HB 3.000 . 3.000 2.633 2.464 2.717 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1321 1 41 VAL HB 1 64 VAL H 5.000 . 5.000 3.478 3.259 3.718 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1322 1 41 VAL MG1 1 42 LYS H 5.000 . 6.000 3.139 2.954 3.333 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1323 1 41 VAL MG1 1 64 VAL H 5.000 . 6.000 4.170 3.957 4.412 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1324 1 41 VAL MG1 1 94 ILE H 5.000 . 6.000 4.548 4.296 4.867 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1325 1 41 VAL MG2 1 42 LYS H 5.000 . 6.000 4.149 4.053 4.242 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1326 1 41 VAL MG2 1 95 THR H 5.000 . 6.000 3.196 2.843 3.488 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1327 1 41 VAL H 1 42 LYS H 5.000 . 5.000 3.987 3.886 4.235 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1328 1 41 VAL H 1 64 VAL H 4.000 . 4.000 2.599 2.472 2.788 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1329 1 42 LYS HA 1 43 LEU H 3.000 . 3.000 2.238 2.199 2.287 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1330 1 42 LYS HA 1 64 VAL H 5.000 . 5.000 3.593 3.342 3.769 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1331 1 42 LYS QB 1 43 LEU H 5.000 . 5.900 3.214 3.074 3.309 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1332 1 42 LYS QB 1 92 GLU H 5.000 . 5.900 3.281 3.130 3.412 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1333 1 42 LYS QD 1 43 LEU H 4.000 . 5.000 3.972 3.831 4.131 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1334 1 42 LYS QD 1 63 TYR H 5.000 . 6.000 5.135 4.912 5.375 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1335 1 42 LYS QG 1 43 LEU H 5.000 . 5.900 4.657 4.574 4.717 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1336 1 42 LYS QG 1 64 VAL H 5.000 . 5.900 4.938 4.615 5.062 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1337 1 42 LYS QG 1 93 GLU H 5.000 . 5.900 3.689 3.530 3.892 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1338 1 43 LEU HA 1 44 ALA H 3.000 . 3.000 2.342 2.266 2.428 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1339 1 43 LEU QB 1 44 ALA H 4.000 . 4.900 2.672 2.482 2.883 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1340 1 43 LEU QB 1 63 TYR H 5.000 . 6.000 4.057 3.764 4.313 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1341 1 43 LEU H 1 43 LEU MD1 5.000 . 6.000 3.467 3.376 3.607 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1342 1 43 LEU MD1 1 47 ALA H 5.000 . 6.000 4.369 4.236 4.469 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1343 1 43 LEU MD1 1 48 THR H 5.000 . 6.000 3.922 3.792 4.023 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1344 1 43 LEU MD1 1 49 VAL H 5.000 . 6.000 2.115 1.954 2.299 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1345 1 43 LEU MD1 1 60 GLY H 5.000 . 6.000 4.517 4.274 4.806 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1346 1 43 LEU MD1 1 63 TYR H 5.000 . 6.000 2.879 2.757 3.121 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1347 1 43 LEU H 1 43 LEU MD2 5.000 . 6.000 3.482 3.359 3.646 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1348 1 43 LEU MD2 1 44 ALA H 5.000 . 6.000 3.301 3.039 3.409 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1349 1 43 LEU MD2 1 47 ALA H 5.000 . 6.000 4.878 4.843 4.915 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1350 1 43 LEU MD2 1 48 THR H 5.000 . 6.000 3.800 3.569 4.023 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1351 1 43 LEU MD2 1 63 TYR H 5.000 . 6.000 5.158 5.110 5.207 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1352 1 43 LEU H 1 44 ALA H 5.000 . 5.000 4.626 4.607 4.642 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1353 1 44 ALA H 1 44 ALA HA 3.000 . 3.000 2.870 2.822 2.926 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1354 1 44 ALA MB 1 46 GLY H 5.000 . 6.000 4.125 3.968 4.291 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1355 1 44 ALA MB 1 47 ALA H 5.000 . 6.000 3.501 3.290 3.720 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1356 1 44 ALA MB 1 91 VAL H 5.000 . 6.000 3.071 2.903 3.198 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1357 1 44 ALA MB 1 92 GLU H 5.000 . 6.000 3.818 3.556 4.041 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1358 1 44 ALA H 1 91 VAL H 5.000 . 5.000 3.920 3.702 4.179 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1359 1 44 ALA H 1 92 GLU H 5.000 . 5.000 3.179 2.803 3.447 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1360 1 45 PRO HA 1 46 GLY H 3.000 . 3.000 2.405 2.367 2.454 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1361 1 45 PRO HA 1 47 ALA H 4.000 . 4.000 4.014 3.953 4.046 0.046 33 0 "[ . 1 . 2 . 3 . ]" 1 1362 1 45 PRO QB 1 46 GLY H 4.000 . 4.900 3.914 3.876 3.945 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1363 1 44 ALA H 1 45 PRO QD 5.000 . 5.900 4.346 4.309 4.378 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1364 1 45 PRO QD 1 46 GLY H 5.000 . 5.900 4.479 4.390 4.574 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1365 1 45 PRO QG 1 46 GLY H 5.000 . 5.900 4.682 4.645 4.718 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1366 1 46 GLY QA 1 47 ALA H 4.000 . 4.900 2.866 2.831 2.892 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1367 1 46 GLY H 1 47 ALA H 3.000 . 3.000 1.908 1.861 2.000 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1368 1 47 ALA H 1 47 ALA HA 3.000 . 3.000 2.995 2.981 3.005 0.005 9 0 "[ . 1 . 2 . 3 . ]" 1 1369 1 47 ALA HA 1 48 THR H 3.000 . 3.000 2.299 2.248 2.357 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1370 1 46 GLY H 1 47 ALA MB 5.000 . 6.000 3.543 3.463 3.684 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1371 1 47 ALA MB 1 48 THR H 4.000 . 5.000 2.970 2.808 3.132 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1372 1 47 ALA MB 1 84 ASN H 5.000 . 6.000 4.075 3.835 4.329 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1373 1 47 ALA MB 1 91 VAL H 5.000 . 6.000 4.382 4.273 4.464 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1374 1 47 ALA H 1 48 THR H 5.000 . 5.000 4.543 4.432 4.596 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1375 1 48 THR HA 1 49 VAL H 3.000 . 3.000 2.266 2.243 2.285 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1376 1 48 THR H 1 48 THR HB 4.000 . 4.000 3.824 3.738 3.908 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1377 1 48 THR HB 1 49 VAL H 3.000 . 3.000 3.057 3.028 3.080 0.080 25 0 "[ . 1 . 2 . 3 . ]" 1 1378 1 48 THR HB 1 84 ASN H 5.000 . 5.000 4.737 4.601 4.850 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1379 1 48 THR MG 1 84 ASN H 5.000 . 6.000 4.722 4.454 4.898 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1380 1 48 THR H 1 85 GLY H 5.000 . 5.000 5.027 4.955 5.068 0.068 34 0 "[ . 1 . 2 . 3 . ]" 1 1381 1 49 VAL HA 1 84 ASN H 4.000 . 4.000 3.942 3.800 4.031 0.031 4 0 "[ . 1 . 2 . 3 . ]" 1 1382 1 49 VAL H 1 49 VAL HB 3.000 . 3.000 2.327 2.186 2.551 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1383 1 49 VAL HB 1 50 GLY H 5.000 . 5.000 4.287 4.072 4.444 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1384 1 49 VAL MG1 1 50 GLY H 5.000 . 6.000 2.699 2.318 3.030 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1385 1 49 VAL MG1 1 52 PHE H 5.000 . 6.000 4.318 3.894 4.913 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1386 1 49 VAL MG1 1 82 ILE H 5.000 . 6.000 2.775 2.540 3.055 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1387 1 49 VAL H 1 49 VAL MG2 4.000 . 5.000 2.182 1.869 2.516 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1388 1 49 VAL MG2 1 64 VAL H 5.000 . 6.000 4.591 4.344 4.855 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1389 1 50 GLY QA 1 51 SER H 3.000 . 3.900 2.799 2.693 2.910 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1390 1 50 GLY QA 1 82 ILE H 5.000 . 5.900 4.982 4.765 5.235 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1391 1 50 GLY QA 1 84 ASN HD21 5.000 . 5.900 3.818 3.231 4.464 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1392 1 50 GLY QA 1 84 ASN HD22 5.000 . 5.900 4.044 2.591 4.873 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1393 1 50 GLY H 1 51 SER H 4.000 . 4.000 2.043 1.846 2.286 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1394 1 50 GLY H 1 82 ILE H 5.000 . 5.000 3.475 3.131 3.866 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1395 1 50 GLY H 1 84 ASN HD21 5.000 . 5.000 3.684 3.090 4.140 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1396 1 50 GLY H 1 84 ASN HD22 5.000 . 5.000 4.532 2.779 5.012 0.012 18 0 "[ . 1 . 2 . 3 . ]" 1 1397 1 50 GLY H 1 84 ASN H 5.000 . 5.000 4.280 3.717 4.716 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1398 1 51 SER HA 1 52 PHE H 3.000 . 3.000 2.224 2.197 2.331 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1399 1 50 GLY H 1 51 SER QB 5.000 . 5.900 4.185 3.806 4.620 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1400 1 51 SER QB 1 52 PHE H 5.000 . 6.000 3.481 2.899 3.947 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1401 1 51 SER QB 1 82 ILE H 5.000 . 5.900 3.461 3.110 3.757 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1402 1 51 SER H 1 52 PHE H 5.000 . 5.000 4.305 4.000 4.493 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1403 1 51 SER H 1 82 ILE H 5.000 . 5.000 2.648 2.445 2.852 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1404 1 51 SER H 1 84 ASN HD21 5.000 . 5.000 4.711 4.386 5.049 0.049 32 0 "[ . 1 . 2 . 3 . ]" 1 1405 1 51 SER H 1 84 ASN HD22 5.000 . 5.000 4.931 3.564 5.036 0.036 8 0 "[ . 1 . 2 . 3 . ]" 1 1406 1 52 PHE HA 1 53 TRP H 3.000 . 3.000 2.470 2.318 2.644 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1407 1 52 PHE HA 1 82 ILE H 4.000 . 4.000 3.650 3.427 3.767 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1408 1 51 SER H 1 52 PHE QB 5.000 . 5.900 4.407 4.018 4.631 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1409 1 52 PHE QB 1 53 TRP H 4.000 . 4.900 2.619 2.262 2.983 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1410 1 52 PHE QB 1 82 ILE H 5.000 . 5.900 3.540 3.144 3.813 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1411 1 51 SER H 1 52 PHE QD 5.000 . 7.000 4.115 3.514 4.669 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1412 1 52 PHE H 1 52 PHE QD 3.000 . 5.000 2.456 1.870 3.121 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1413 1 52 PHE QD 1 57 LYS H 5.000 . 7.000 3.396 3.019 4.342 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1414 1 52 PHE QD 1 82 ILE H 5.000 . 7.000 4.681 4.201 5.169 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1415 1 52 PHE H 1 53 TRP H 5.000 . 5.000 4.443 4.381 4.493 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1416 1 52 PHE H 1 82 ILE H 5.000 . 5.000 4.719 4.477 4.900 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1417 1 53 TRP HA 1 54 SER H 3.000 . 3.000 2.360 2.286 2.440 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1418 1 53 TRP HA 1 55 ALA H 4.000 . 4.000 3.378 3.260 3.565 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1419 1 53 TRP QB 1 54 SER H 4.000 . 4.900 2.673 2.497 2.849 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1420 1 53 TRP H 1 53 TRP HD1 4.000 . 4.000 3.125 2.898 3.273 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1421 1 53 TRP HD1 1 54 SER H 5.000 . 5.000 3.959 3.758 4.212 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1422 1 53 TRP HD1 1 79 PHE H 5.000 . 5.000 5.023 4.942 5.081 0.081 32 0 "[ . 1 . 2 . 3 . ]" 1 1423 1 53 TRP HD1 1 80 GLY H 5.000 . 5.000 2.244 1.973 2.457 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1424 1 53 TRP H 1 53 TRP HE1 5.000 . 5.000 4.254 4.080 4.418 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1425 1 53 TRP HE1 1 80 GLY H 5.000 . 5.000 2.747 2.569 3.039 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1426 1 53 TRP HE1 1 81 PHE H 5.000 . 5.000 4.836 4.657 5.001 0.001 33 0 "[ . 1 . 2 . 3 . ]" 1 1427 1 53 TRP H 1 54 SER H 5.000 . 5.000 4.417 4.336 4.470 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1428 1 53 TRP H 1 55 ALA H 5.000 . 5.000 4.315 4.116 4.502 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1429 1 53 TRP H 1 80 GLY H 4.000 . 4.000 2.398 2.209 2.563 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1430 1 25 TYR H 1 53 TRP HZ2 5.000 . 5.000 4.926 4.728 5.041 0.041 32 0 "[ . 1 . 2 . 3 . ]" 1 1431 1 53 TRP HZ2 1 81 PHE H 5.000 . 5.000 4.645 4.340 4.898 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1432 1 54 SER H 1 54 SER HA 3.000 . 3.000 2.356 2.350 2.362 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1433 1 54 SER HA 1 55 ALA H 3.000 . 3.000 3.051 2.993 3.093 0.093 37 0 "[ . 1 . 2 . 3 . ]" 1 1434 1 54 SER H 1 55 ALA H 4.000 . 4.000 2.724 2.625 2.861 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1435 1 55 ALA H 1 55 ALA HA 3.000 . 3.000 2.882 2.873 2.888 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1436 1 55 ALA HA 1 56 ASN HD21 5.000 . 5.000 3.034 2.936 3.146 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1437 1 55 ALA HA 1 56 ASN H 3.000 . 3.000 2.282 2.252 2.325 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1438 1 55 ALA HA 1 67 THR H 5.000 . 5.000 3.704 3.433 4.049 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1439 1 55 ALA HA 1 69 VAL H 5.000 . 5.000 2.915 2.543 3.195 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1440 1 53 TRP H 1 55 ALA MB 5.000 . 6.000 3.839 3.589 4.222 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1441 1 54 SER H 1 55 ALA MB 5.000 . 6.000 4.623 4.517 4.675 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1442 1 55 ALA MB 1 56 ASN H 5.000 . 6.000 2.963 2.818 3.079 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1443 1 55 ALA MB 1 69 VAL H 5.000 . 6.000 4.283 3.951 4.537 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1444 1 55 ALA MB 1 80 GLY H 5.000 . 6.000 3.600 3.400 4.036 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1445 1 55 ALA H 1 56 ASN H 5.000 . 5.000 4.224 4.163 4.298 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1446 1 56 ASN HA 1 57 LYS H 3.000 . 3.000 2.187 2.167 2.234 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1447 1 56 ASN HA 1 67 THR H 5.000 . 5.000 4.275 4.111 4.353 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1448 1 56 ASN QB 1 57 LYS H 4.000 . 4.900 3.469 3.318 3.647 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1449 1 55 ALA H 1 56 ASN HD21 5.000 . 5.000 4.329 4.178 4.547 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1450 1 56 ASN H 1 56 ASN HD21 4.000 . 4.000 1.975 1.880 2.172 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1451 1 56 ASN HD21 1 57 LYS H 5.000 . 5.000 5.056 4.933 5.103 0.103 4 0 "[ . 1 . 2 . 3 . ]" 1 1452 1 56 ASN HD21 1 67 THR H 4.000 . 4.000 4.080 4.027 4.131 0.131 27 0 "[ . 1 . 2 . 3 . ]" 1 1453 1 56 ASN H 1 57 LYS H 5.000 . 5.000 4.471 4.383 4.547 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1454 1 56 ASN H 1 67 THR H 4.000 . 4.000 2.228 2.107 2.352 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1455 1 56 ASN H 1 69 VAL H 5.000 . 5.000 4.077 3.882 4.332 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1456 1 57 LYS HA 1 58 GLN H 3.000 . 3.000 2.197 2.148 2.252 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1457 1 57 LYS QB 1 58 GLN H 5.000 . 5.900 3.698 3.556 3.919 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1458 1 57 LYS H 1 57 LYS QD 5.000 . 5.900 4.422 4.205 4.826 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1459 1 57 LYS QD 1 58 GLN H 5.000 . 5.900 4.504 3.769 5.141 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1460 1 57 LYS QG 1 58 GLN H 4.000 . 4.900 2.353 1.918 3.040 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1461 1 57 LYS QG 1 59 GLU H 5.000 . 5.900 4.968 4.762 5.070 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1462 1 57 LYS QG 1 65 ILE H 5.000 . 5.900 3.508 3.274 3.868 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1463 1 57 LYS H 1 58 GLN H 5.000 . 5.000 4.563 4.411 4.618 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1464 1 58 GLN HA 1 58 GLN HE22 5.000 . 5.000 5.007 4.832 5.181 0.181 24 0 "[ . 1 . 2 . 3 . ]" 1 1465 1 58 GLN HA 1 59 GLU H 3.000 . 3.000 2.551 2.483 2.588 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1466 1 58 GLN QB 1 59 GLU H 3.000 . 3.900 2.700 2.205 2.959 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1467 1 58 GLN QB 1 65 ILE H 4.000 . 4.900 2.221 1.893 2.476 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1468 1 58 GLN H 1 58 GLN HE21 5.000 . 5.000 4.137 2.072 5.073 0.073 37 0 "[ . 1 . 2 . 3 . ]" 1 1469 1 59 GLU H 1 59 GLU HA 3.000 . 3.000 2.990 2.980 2.999 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1470 1 59 GLU HA 1 60 GLY H 3.000 . 3.000 2.244 2.208 2.298 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1471 1 59 GLU HA 1 61 ASN H 5.000 . 5.000 3.903 3.523 4.861 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1472 1 59 GLU HA 1 63 TYR H 5.000 . 5.000 4.138 3.938 4.346 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1473 1 59 GLU H 1 59 GLU QB 3.000 . 3.900 2.502 2.366 2.817 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1474 1 59 GLU QB 1 60 GLY H 4.000 . 4.900 3.690 3.569 3.769 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1475 1 59 GLU QB 1 61 ASN H 5.000 . 5.900 3.132 2.820 5.300 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1476 1 59 GLU H 1 59 GLU QG 4.000 . 5.000 3.310 2.563 3.697 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1477 1 60 GLY QA 1 61 ASN H 3.000 . 3.900 2.689 2.306 2.818 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1478 1 59 GLU H 1 60 GLY H 5.000 . 5.000 3.993 3.743 4.186 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1479 1 60 GLY H 1 61 ASN H 5.000 . 5.000 3.115 2.794 3.349 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1480 1 60 GLY H 1 62 GLY H 5.000 . 5.000 4.726 4.275 4.972 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1481 1 60 GLY H 1 63 TYR H 4.000 . 4.000 3.168 2.876 3.685 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1482 1 60 GLY H 1 64 VAL H 5.000 . 5.000 3.939 3.674 4.431 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1483 1 60 GLY H 1 65 ILE H 5.000 . 5.000 4.662 4.362 4.913 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1484 1 61 ASN HA 1 61 ASN HD22 5.000 . 5.000 3.616 3.152 5.082 0.082 30 0 "[ . 1 . 2 . 3 . ]" 1 1485 1 61 ASN H 1 61 ASN HA 3.000 . 3.000 2.411 2.360 2.958 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1486 1 61 ASN HA 1 62 GLY H 3.000 . 3.000 2.402 2.327 2.463 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1487 1 61 ASN HA 1 63 TYR H 4.000 . 4.000 3.917 3.800 4.018 0.018 30 0 "[ . 1 . 2 . 3 . ]" 1 1488 1 61 ASN QB 1 62 GLY H 5.000 . 5.900 3.967 3.824 4.068 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1489 1 61 ASN QB 1 63 TYR H 5.000 . 5.900 4.466 4.275 4.905 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1490 1 61 ASN HD21 1 62 GLY H 5.000 . 5.000 4.348 3.017 4.987 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1491 1 61 ASN H 1 62 GLY H 4.000 . 4.000 3.333 3.146 3.457 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1492 1 61 ASN H 1 63 TYR H 5.000 . 5.000 3.420 2.614 3.777 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1493 1 62 GLY QA 1 63 TYR H 4.000 . 4.900 2.929 2.872 2.938 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1494 1 62 GLY H 1 63 TYR H 3.000 . 3.000 2.333 2.138 2.513 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1495 1 41 VAL H 1 63 TYR HA 5.000 . 5.000 4.798 4.569 5.029 0.029 7 0 "[ . 1 . 2 . 3 . ]" 1 1496 1 43 LEU H 1 63 TYR HA 5.000 . 5.000 1.937 1.807 2.233 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1497 1 63 TYR H 1 63 TYR HA 3.000 . 3.000 2.973 2.963 2.991 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1498 1 63 TYR HA 1 64 VAL H 3.000 . 3.000 2.711 2.589 2.769 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1499 1 41 VAL H 1 63 TYR QB 5.000 . 5.900 3.586 3.422 3.978 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1500 1 43 LEU H 1 63 TYR QB 5.000 . 5.900 3.424 3.252 3.816 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1501 1 60 GLY H 1 63 TYR QB 5.000 . 5.900 2.869 2.466 3.415 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1502 1 63 TYR H 1 63 TYR QB 3.000 . 3.900 2.931 2.794 3.041 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1503 1 63 TYR QB 1 64 VAL H 3.000 . 3.900 2.240 2.158 2.371 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1504 1 60 GLY H 1 63 TYR QD 5.000 . 7.000 3.830 3.527 4.335 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1505 1 63 TYR H 1 63 TYR QD 3.000 . 5.000 3.369 3.281 3.473 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1506 1 63 TYR QD 1 64 VAL H 5.000 . 7.000 4.296 4.248 4.346 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1507 1 42 LYS H 1 63 TYR QE 5.000 . 7.000 6.095 5.979 6.156 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1508 1 43 LEU H 1 63 TYR QE 5.000 . 7.000 3.973 3.737 4.293 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1509 1 61 ASN H 1 63 TYR QE 5.000 . 7.000 5.624 3.482 6.081 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1510 1 63 TYR H 1 64 VAL H 5.000 . 5.000 4.357 4.318 4.418 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1511 1 59 GLU H 1 64 VAL HA 5.000 . 5.000 4.083 3.885 4.240 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1512 1 64 VAL HA 1 65 ILE H 3.000 . 3.000 2.377 2.309 2.436 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1513 1 49 VAL H 1 64 VAL HB 5.000 . 5.000 4.593 4.412 4.776 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1514 1 64 VAL H 1 64 VAL HB 3.000 . 3.000 2.814 2.741 2.850 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1515 1 41 VAL H 1 64 VAL MG1 5.000 . 6.000 4.195 3.787 4.369 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1516 1 58 GLN H 1 64 VAL MG1 5.000 . 6.000 2.044 1.836 2.507 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1517 1 59 GLU H 1 64 VAL MG1 5.000 . 6.000 4.799 4.708 4.907 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1518 1 60 GLY H 1 64 VAL MG1 5.000 . 6.000 4.912 4.774 5.009 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1519 1 64 VAL MG1 1 65 ILE H 5.000 . 6.000 1.947 1.816 2.293 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1520 1 64 VAL MG1 1 66 PHE H 5.000 . 6.000 4.337 3.973 4.549 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1521 1 49 VAL H 1 64 VAL MG2 5.000 . 6.000 2.605 2.454 2.828 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1522 1 59 GLU H 1 64 VAL MG2 5.000 . 6.000 4.284 4.130 4.577 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1523 1 64 VAL H 1 65 ILE H 5.000 . 5.000 4.368 4.311 4.401 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1524 1 41 VAL H 1 65 ILE HA 4.000 . 4.000 3.443 3.239 3.593 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1525 1 65 ILE HA 1 66 PHE H 3.000 . 3.000 2.284 2.185 2.342 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1526 1 58 GLN H 1 65 ILE HB 4.000 . 4.000 3.244 2.705 3.631 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1527 1 59 GLU H 1 65 ILE HB 5.000 . 5.000 5.031 4.942 5.133 0.133 6 0 "[ . 1 . 2 . 3 . ]" 1 1528 1 65 ILE H 1 65 ILE HB 3.000 . 3.000 2.615 2.469 2.693 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1529 1 65 ILE HB 1 66 PHE H 5.000 . 5.000 3.947 3.783 4.344 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1530 1 58 GLN HE21 1 65 ILE MD 5.000 . 6.000 4.249 2.343 5.028 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1531 1 58 GLN HE22 1 65 ILE MD 5.000 . 6.000 4.724 3.362 4.998 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1532 1 60 GLY H 1 65 ILE MD 5.000 . 6.000 4.707 4.319 4.910 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1533 1 65 ILE H 1 65 ILE MD 5.000 . 6.000 3.798 3.556 4.183 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1534 1 65 ILE MD 1 66 PHE H 5.000 . 6.000 3.826 3.495 5.047 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1535 1 58 GLN HE21 1 65 ILE QG 5.000 . 5.900 3.078 2.018 4.890 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1536 1 58 GLN HE22 1 65 ILE QG 5.000 . 5.900 3.842 3.058 5.344 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1537 1 58 GLN H 1 65 ILE QG 5.000 . 5.900 4.095 3.692 4.794 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1538 1 60 GLY H 1 65 ILE QG 5.000 . 5.900 3.907 3.642 4.883 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1539 1 65 ILE H 1 65 ILE QG 4.000 . 4.900 2.579 2.323 3.251 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1540 1 65 ILE QG 1 66 PHE H 5.000 . 5.900 4.508 3.787 4.655 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1541 1 58 GLN H 1 65 ILE MG 5.000 . 6.000 4.374 4.016 4.647 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1542 1 65 ILE MG 1 67 THR H 5.000 . 6.000 4.281 3.877 4.631 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1543 1 65 ILE H 1 66 PHE H 5.000 . 5.000 4.496 4.378 4.575 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1544 1 56 ASN H 1 66 PHE HA 5.000 . 5.000 3.870 3.562 4.058 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1545 1 58 GLN H 1 66 PHE HA 5.000 . 5.000 4.138 3.915 4.314 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1546 1 66 PHE HA 1 67 THR H 3.000 . 3.000 2.250 2.223 2.285 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1547 1 66 PHE QB 1 67 THR H 4.000 . 4.900 3.344 3.080 3.595 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1548 1 40 LYS H 1 66 PHE QD 5.000 . 7.000 5.083 4.796 5.389 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1549 1 41 VAL H 1 66 PHE QD 5.000 . 7.000 4.807 4.177 5.302 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1550 1 66 PHE H 1 66 PHE QD 4.000 . 6.000 3.060 2.254 3.540 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1551 1 41 VAL H 1 66 PHE QE 5.000 . 7.000 4.509 3.814 4.974 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1552 1 53 TRP H 1 66 PHE QE 5.000 . 7.000 5.032 4.354 5.567 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1553 1 57 LYS H 1 66 PHE QE 5.000 . 7.000 4.929 4.620 5.873 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1554 1 58 GLN H 1 66 PHE QE 5.000 . 7.000 4.675 4.238 5.275 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1555 1 66 PHE QE 1 81 PHE H 5.000 . 7.000 4.979 4.766 5.133 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1556 1 66 PHE H 1 67 THR H 5.000 . 5.000 4.360 4.138 4.570 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1557 1 66 PHE HZ 1 82 ILE H 5.000 . 5.000 5.073 5.037 5.106 0.106 9 0 "[ . 1 . 2 . 3 . ]" 1 1558 1 39 VAL H 1 67 THR HA 5.000 . 5.000 3.642 3.544 3.722 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1559 1 56 ASN H 1 67 THR HA 5.000 . 5.000 4.420 4.220 4.513 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1560 1 56 ASN H 1 67 THR HB 5.000 . 5.000 4.400 4.183 4.835 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1561 1 67 THR MG 1 99 ASN HD21 5.000 . 6.000 4.868 4.698 4.945 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1562 1 37 TRP HE1 1 68 PRO HA 5.000 . 5.000 3.639 3.366 3.869 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1563 1 56 ASN H 1 68 PRO HA 5.000 . 5.000 4.555 4.379 4.685 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1564 1 68 PRO HA 1 69 VAL H 5.000 . 5.000 2.197 2.182 2.219 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1565 1 37 TRP HE1 1 68 PRO QB 4.000 . 4.900 1.977 1.840 2.279 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1566 1 37 TRP H 1 68 PRO QB 5.000 . 5.900 3.576 3.249 3.826 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1567 1 68 PRO QB 1 69 VAL H 5.000 . 5.900 3.509 3.358 3.642 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1568 1 68 PRO QB 1 72 ASN H 5.000 . 5.900 4.092 3.602 4.606 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1569 1 37 TRP HE1 1 68 PRO QD 5.000 . 5.900 3.957 3.674 4.598 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1570 1 37 TRP H 1 68 PRO QD 5.000 . 5.900 2.530 2.265 2.800 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1571 1 67 THR H 1 68 PRO QD 5.000 . 5.900 4.388 4.327 4.414 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1572 1 68 PRO QD 1 69 VAL H 5.000 . 5.900 4.910 4.841 4.970 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1573 1 36 ASP H 1 68 PRO QG 5.000 . 5.900 4.731 4.502 4.996 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1574 1 37 TRP HE1 1 68 PRO QG 5.000 . 5.900 3.497 3.235 3.843 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1575 1 37 TRP H 1 68 PRO QG 4.000 . 4.900 2.491 2.302 2.730 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1576 1 56 ASN HD21 1 69 VAL HA 5.000 . 5.000 2.383 2.125 2.567 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1577 1 69 VAL HA 1 70 SER H 3.000 . 4.000 3.315 3.048 3.606 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1578 1 55 ALA H 1 69 VAL HB 5.000 . 5.000 5.012 4.755 5.081 0.081 19 0 "[ . 1 . 2 . 3 . ]" 1 1579 1 56 ASN HD21 1 69 VAL HB 5.000 . 5.000 3.795 3.295 4.359 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1580 1 69 VAL HB 1 70 SER H 3.000 . 3.000 2.038 1.882 3.086 0.086 7 0 "[ . 1 . 2 . 3 . ]" 1 1581 1 69 VAL HB 1 71 TRP HE1 5.000 . 5.000 3.703 3.037 4.432 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1582 1 69 VAL HB 1 71 TRP H 5.000 . 5.000 3.712 3.568 4.011 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1583 1 69 VAL HB 1 72 ASN H 5.000 . 5.000 4.565 4.322 5.011 0.011 25 0 "[ . 1 . 2 . 3 . ]" 1 1584 1 55 ALA H 1 69 VAL MG1 5.000 . 6.000 2.333 2.154 2.503 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1585 1 56 ASN HD21 1 69 VAL MG1 5.000 . 6.000 1.857 1.725 2.508 0.075 15 0 "[ . 1 . 2 . 3 . ]" 1 1586 1 56 ASN H 1 69 VAL MG1 5.000 . 6.000 2.716 2.448 3.171 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1587 1 69 VAL MG1 1 70 SER H 5.000 . 6.000 3.582 3.535 3.887 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1588 1 69 VAL MG1 1 71 TRP H 5.000 . 6.000 4.510 4.235 4.858 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1589 1 69 VAL MG1 1 72 ASN H 5.000 . 6.000 4.493 4.246 5.015 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1590 1 54 SER H 1 69 VAL MG2 5.000 . 6.000 4.313 4.054 4.704 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1591 1 55 ALA H 1 69 VAL MG2 5.000 . 6.000 3.866 3.645 4.227 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1592 1 56 ASN HD21 1 69 VAL MG2 5.000 . 6.000 4.131 3.963 4.315 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1593 1 56 ASN H 1 69 VAL MG2 5.000 . 6.000 4.901 4.751 5.036 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1594 1 69 VAL MG2 1 70 SER H 5.000 . 6.000 1.908 1.739 2.124 0.061 29 0 "[ . 1 . 2 . 3 . ]" 1 1595 1 69 VAL MG2 1 71 TRP HE1 5.000 . 6.000 2.808 2.399 3.387 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1596 1 69 VAL MG2 1 71 TRP H 5.000 . 6.000 1.954 1.695 2.333 0.105 23 0 "[ . 1 . 2 . 3 . ]" 1 1597 1 69 VAL MG2 1 72 ASN H 5.000 . 6.000 1.918 1.776 2.473 0.024 26 0 "[ . 1 . 2 . 3 . ]" 1 1598 1 69 VAL MG2 1 73 LYS H 5.000 . 6.000 4.433 4.166 4.694 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1599 1 55 ALA H 1 69 VAL H 5.000 . 5.000 4.788 4.529 5.018 0.018 27 0 "[ . 1 . 2 . 3 . ]" 1 1600 1 69 VAL H 1 71 TRP H 5.000 . 5.000 4.326 3.962 4.667 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1601 1 70 SER H 1 70 SER HA 3.000 . 3.000 2.974 2.856 3.000 0.000 17 0 "[ . 1 . 2 . 3 . ]" 1 1602 1 70 SER HA 1 71 TRP H 4.000 . 4.000 3.471 3.432 3.565 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1603 1 70 SER HA 1 72 ASN H 5.000 . 5.000 4.469 4.190 4.873 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1604 1 70 SER H 1 70 SER QB 3.000 . 3.900 2.523 2.062 3.406 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1605 1 70 SER QB 1 72 ASN H 5.000 . 5.900 4.775 4.419 5.181 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1606 1 70 SER H 1 71 TRP H 5.000 . 5.000 2.107 1.812 2.554 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1607 1 70 SER H 1 72 ASN H 5.000 . 5.000 3.405 2.649 3.889 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1608 1 71 TRP HA 1 72 ASN H 4.000 . 4.000 3.337 3.113 3.527 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1609 1 71 TRP HA 1 73 LYS H 5.000 . 5.000 3.649 3.404 4.057 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1610 1 71 TRP QB 1 72 ASN H 5.000 . 5.900 3.746 3.449 3.976 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1611 1 71 TRP QB 1 73 LYS H 5.000 . 5.900 4.736 4.475 5.247 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1612 1 70 SER H 1 71 TRP HD1 5.000 . 5.000 3.381 2.983 3.900 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1613 1 71 TRP H 1 71 TRP HD1 3.000 . 3.000 2.783 2.518 3.001 0.001 15 0 "[ . 1 . 2 . 3 . ]" 1 1614 1 71 TRP HD1 1 72 ASN H 5.000 . 5.000 4.634 4.265 4.994 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1615 1 71 TRP H 1 71 TRP HE1 5.000 . 5.000 3.866 3.734 4.009 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1616 1 54 SER H 1 71 TRP HH2 5.000 . 5.000 3.472 3.074 4.355 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1617 1 71 TRP H 1 72 ASN H 3.000 . 3.000 1.986 1.849 2.476 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1618 1 71 TRP H 1 73 LYS H 5.000 . 5.000 4.512 3.839 4.872 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1619 1 71 TRP HZ3 1 78 THR H 5.000 . 5.000 4.548 4.083 4.889 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1620 1 37 TRP HE1 1 72 ASN HA 5.000 . 5.000 4.817 4.567 5.142 0.142 24 0 "[ . 1 . 2 . 3 . ]" 1 1621 1 71 TRP H 1 72 ASN HA 5.000 . 5.000 4.649 4.545 4.848 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1622 1 72 ASN HA 1 73 LYS H 3.000 . 3.000 2.878 2.753 3.140 0.140 7 0 "[ . 1 . 2 . 3 . ]" 1 1623 1 72 ASN HA 1 74 GLY H 5.000 . 5.000 3.499 3.142 3.683 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1624 1 37 TRP HE1 1 72 ASN QB 5.000 . 5.900 4.049 3.743 4.904 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1625 1 69 VAL H 1 72 ASN QB 5.000 . 5.900 2.683 1.874 4.562 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1626 1 71 TRP H 1 72 ASN QB 5.000 . 5.900 3.520 3.258 4.321 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1627 1 72 ASN QB 1 73 LYS H 5.000 . 5.900 3.878 3.750 4.077 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1628 1 72 ASN QB 1 78 THR H 5.000 . 5.900 4.674 3.296 5.280 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1629 1 69 VAL H 1 72 ASN H 5.000 . 5.000 3.510 3.067 4.299 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1630 1 72 ASN H 1 73 LYS H 4.000 . 4.000 3.018 2.641 3.303 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1631 1 72 ASN H 1 74 GLY H 5.000 . 5.000 4.851 4.533 5.046 0.046 14 0 "[ . 1 . 2 . 3 . ]" 1 1632 1 35 TYR H 1 73 LYS HA 5.000 . 5.000 4.420 4.141 4.708 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1633 1 37 TRP HE1 1 73 LYS HA 3.000 . 3.000 1.934 1.803 2.118 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1634 1 73 LYS HA 1 74 GLY H 5.000 . 5.000 3.342 3.194 3.425 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1635 1 35 TYR H 1 73 LYS QB 4.000 . 4.900 4.328 3.989 4.516 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1636 1 37 TRP HE1 1 73 LYS QB 5.000 . 5.900 3.734 3.431 3.982 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1637 1 73 LYS QB 1 74 GLY H 5.000 . 5.900 3.481 3.135 3.823 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1638 1 72 ASN H 1 73 LYS QD 5.000 . 6.000 4.121 2.249 5.125 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1639 1 73 LYS H 1 73 LYS QD 5.000 . 6.000 3.600 1.848 4.305 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1640 1 73 LYS H 1 73 LYS QE 5.000 . 5.900 3.884 3.454 4.279 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1641 1 73 LYS QE 1 74 GLY H 5.000 . 5.900 5.054 4.506 5.324 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1642 1 37 TRP HE1 1 73 LYS QG 5.000 . 5.900 4.244 3.678 4.678 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1643 1 71 TRP H 1 73 LYS QG 5.000 . 5.900 3.791 3.306 4.390 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1644 1 72 ASN H 1 73 LYS QG 5.000 . 5.900 2.831 2.468 3.202 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1645 1 73 LYS H 1 73 LYS QG 4.000 . 4.900 2.031 1.794 2.673 0.006 3 0 "[ . 1 . 2 . 3 . ]" 1 1646 1 73 LYS QG 1 74 GLY H 5.000 . 5.900 3.488 2.668 4.108 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1647 1 73 LYS H 1 74 GLY H 3.000 . 3.000 2.026 1.816 2.497 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1648 1 35 TYR H 1 74 GLY QA 5.000 . 5.900 4.696 3.908 5.106 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1649 1 74 GLY QA 1 76 THR H 4.000 . 4.900 3.219 2.969 3.945 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1650 1 74 GLY H 1 76 THR H 5.000 . 5.000 4.223 3.706 5.074 0.074 24 0 "[ . 1 . 2 . 3 . ]" 1 1651 1 31 LEU H 1 75 PRO HA 5.000 . 5.000 3.315 3.073 3.694 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1652 1 75 PRO HA 1 76 THR H 4.000 . 4.000 3.348 3.245 3.577 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1653 1 31 LEU H 1 75 PRO QB 5.000 . 6.000 3.583 3.151 3.852 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1654 1 32 ASP H 1 75 PRO QB 5.000 . 6.000 4.408 4.089 4.643 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1655 1 33 GLY H 1 75 PRO QB 5.000 . 6.000 2.171 2.005 2.473 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1656 1 75 PRO QB 1 76 THR H 5.000 . 6.000 3.523 2.697 3.807 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1657 1 34 GLN HE21 1 75 PRO QD 5.000 . 5.900 4.267 3.050 5.246 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1658 1 34 GLN HE22 1 75 PRO QD 5.000 . 5.900 4.776 3.783 5.287 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1659 1 75 PRO QD 1 76 THR H 4.000 . 5.900 2.806 2.497 2.973 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1660 1 75 PRO QG 1 76 THR H 5.000 . 5.900 3.071 1.859 3.558 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1661 1 29 LEU H 1 76 THR HA 5.000 . 5.000 5.002 4.851 5.049 0.049 32 0 "[ . 1 . 2 . 3 . ]" 1 1662 1 31 LEU H 1 76 THR HA 5.000 . 5.000 2.664 2.372 2.920 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1663 1 76 THR H 1 76 THR HA 3.000 . 3.000 2.943 2.917 3.000 . 31 0 "[ . 1 . 2 . 3 . ]" 1 1664 1 76 THR HA 1 77 ALA H 3.000 . 3.000 2.218 2.198 2.250 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1665 1 76 THR H 1 76 THR HB 3.000 . 3.000 3.001 2.569 3.101 0.101 4 0 "[ . 1 . 2 . 3 . ]" 1 1666 1 76 THR HB 1 77 ALA H 5.000 . 5.000 4.144 3.645 4.279 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1667 1 30 ASN HD21 1 76 THR MG 5.000 . 6.000 4.825 4.527 4.922 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1668 1 30 ASN HD22 1 76 THR MG 5.000 . 6.000 4.672 4.385 4.805 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1669 1 30 ASN H 1 76 THR MG 5.000 . 6.000 4.631 4.333 4.815 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1670 1 31 LEU H 1 76 THR MG 5.000 . 6.000 3.781 3.333 4.009 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1671 1 76 THR MG 1 77 ALA H 4.000 . 5.000 2.942 2.559 3.278 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1672 1 31 LEU H 1 76 THR H 5.000 . 5.000 4.010 3.794 4.234 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1673 1 76 THR H 1 77 ALA H 5.000 . 5.000 4.104 3.908 4.573 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1674 1 77 ALA HA 1 78 THR H 3.000 . 3.000 2.225 2.200 2.260 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1675 1 29 LEU H 1 77 ALA MB 5.000 . 6.000 4.074 3.741 4.294 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1676 1 37 TRP HE1 1 77 ALA MB 5.000 . 6.000 2.406 2.242 2.597 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1677 1 74 GLY H 1 77 ALA MB 5.000 . 6.000 3.701 3.133 4.307 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1678 1 77 ALA MB 1 78 THR H 5.000 . 6.000 3.435 3.245 3.550 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1679 1 77 ALA H 1 78 THR H 5.000 . 5.000 4.078 3.879 4.290 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1680 1 27 VAL H 1 78 THR HA 5.000 . 5.000 4.804 4.579 5.092 0.092 16 0 "[ . 1 . 2 . 3 . ]" 1 1681 1 28 THR H 1 78 THR HA 5.000 . 5.000 4.586 4.452 4.742 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1682 1 29 LEU H 1 78 THR HA 4.000 . 4.000 2.430 2.317 2.614 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1683 1 78 THR HA 1 79 PHE H 3.000 . 3.000 2.235 2.174 2.313 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1684 1 29 LEU H 1 78 THR HB 5.000 . 5.000 4.857 4.662 5.022 0.022 33 0 "[ . 1 . 2 . 3 . ]" 1 1685 1 78 THR H 1 78 THR HB 4.000 . 4.000 2.385 2.237 2.574 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1686 1 27 VAL H 1 78 THR MG 5.000 . 6.000 3.401 3.025 4.210 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1687 1 28 THR H 1 78 THR MG 5.000 . 6.000 3.618 3.261 4.052 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1688 1 53 TRP HE1 1 78 THR MG 5.000 . 6.000 4.245 3.915 4.710 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1689 1 78 THR MG 1 79 PHE H 5.000 . 6.000 2.447 1.880 3.001 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1690 1 78 THR H 1 79 PHE H 5.000 . 5.000 4.514 4.373 4.591 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1691 1 53 TRP HE1 1 79 PHE HA 5.000 . 5.000 3.461 3.131 3.745 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1692 1 54 SER H 1 79 PHE HA 5.000 . 5.000 4.888 4.735 5.009 0.009 24 0 "[ . 1 . 2 . 3 . ]" 1 1693 1 79 PHE H 1 79 PHE HA 3.000 . 3.000 2.974 2.939 2.996 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1694 1 79 PHE HA 1 80 GLY H 3.000 . 3.000 2.559 2.383 2.604 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1695 1 55 ALA H 1 79 PHE QB 5.000 . 5.900 3.395 3.298 3.500 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1696 1 27 VAL H 1 79 PHE QD 5.000 . 7.000 4.313 3.859 4.575 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1697 1 53 TRP HE1 1 79 PHE QD 5.000 . 7.000 4.800 4.549 5.244 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1698 1 53 TRP H 1 79 PHE QD 4.000 . 6.000 3.692 3.537 3.948 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1699 1 55 ALA H 1 79 PHE QD 5.000 . 7.000 5.093 4.965 5.279 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1700 1 56 ASN H 1 79 PHE QD 5.000 . 7.000 6.065 5.831 6.260 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1701 1 79 PHE H 1 79 PHE QD 4.000 . 6.000 2.880 2.708 3.107 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1702 1 79 PHE QD 1 80 GLY H 4.000 . 6.000 2.454 2.247 2.942 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1703 1 39 VAL H 1 79 PHE QE 5.000 . 7.000 4.269 4.102 4.455 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1704 1 79 PHE H 1 80 GLY H 5.000 . 5.000 4.436 4.365 4.478 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1705 1 25 TYR H 1 80 GLY QA 5.000 . 5.900 4.068 3.886 4.170 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1706 1 27 VAL H 1 80 GLY QA 5.000 . 5.900 2.823 2.399 2.996 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1707 1 53 TRP HE1 1 80 GLY QA 5.000 . 5.900 2.004 1.846 2.216 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1708 1 79 PHE H 1 80 GLY QA 5.000 . 5.900 4.381 4.311 4.489 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1709 1 80 GLY H 1 81 PHE H 5.000 . 5.000 4.423 4.385 4.491 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1710 1 52 PHE H 1 81 PHE HA 5.000 . 5.000 4.379 4.166 4.490 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1711 1 53 TRP H 1 81 PHE HA 4.000 . 4.000 3.969 3.821 4.061 0.061 28 0 "[ . 1 . 2 . 3 . ]" 1 1712 1 81 PHE HA 1 82 ILE H 3.000 . 3.000 2.295 2.268 2.328 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1713 1 51 SER H 1 81 PHE QB 5.000 . 5.900 4.885 4.627 5.050 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1714 1 52 PHE H 1 81 PHE QB 5.000 . 5.900 5.248 5.145 5.304 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1715 1 81 PHE QB 1 82 ILE H 4.000 . 4.900 3.096 2.977 3.162 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1716 1 25 TYR H 1 81 PHE QD 4.000 . 6.000 4.366 4.306 4.444 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1717 1 50 GLY H 1 81 PHE QD 5.000 . 7.000 4.293 3.999 4.580 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1718 1 51 SER H 1 81 PHE QD 5.000 . 7.000 4.782 4.380 5.074 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1719 1 81 PHE H 1 81 PHE QD 3.000 . 5.000 3.207 3.054 3.361 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1720 1 81 PHE QD 1 82 ILE H 4.000 . 6.000 2.927 2.829 3.047 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1721 1 81 PHE H 1 82 ILE H 5.000 . 5.000 4.374 4.322 4.441 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1722 1 23 ALA H 1 82 ILE HA 5.000 . 5.000 4.030 3.914 4.129 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1723 1 25 TYR H 1 82 ILE HA 5.000 . 5.000 3.386 3.296 3.466 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1724 1 51 SER H 1 82 ILE HA 5.000 . 5.000 4.730 4.517 4.957 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1725 1 82 ILE HA 1 83 VAL H 3.000 . 3.000 2.215 2.203 2.231 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1726 1 51 SER H 1 82 ILE HB 4.000 . 4.000 2.588 2.236 2.998 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1727 1 82 ILE H 1 82 ILE HB 3.000 . 3.000 2.406 2.373 2.442 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1728 1 82 ILE HB 1 83 VAL H 5.000 . 5.000 4.453 4.374 4.487 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1729 1 24 GLU H 1 82 ILE MD 5.000 . 6.000 4.914 4.872 4.967 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1730 1 25 TYR H 1 82 ILE MD 5.000 . 6.000 2.367 2.233 2.495 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1731 1 51 SER H 1 82 ILE MD 5.000 . 6.000 3.883 3.647 4.149 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1732 1 53 TRP HE1 1 82 ILE MD 5.000 . 6.000 4.880 4.502 5.055 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1733 1 53 TRP H 1 82 ILE MD 5.000 . 6.000 4.953 4.677 5.054 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1734 1 81 PHE H 1 82 ILE MD 5.000 . 6.000 2.984 2.861 3.126 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1735 1 82 ILE MD 1 83 VAL H 5.000 . 6.000 4.425 4.357 4.486 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1736 1 23 ALA H 1 82 ILE QG 5.000 . 5.900 4.525 4.319 4.642 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1737 1 24 GLU H 1 82 ILE QG 5.000 . 5.900 3.946 3.869 4.015 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1738 1 25 TYR H 1 82 ILE QG 5.000 . 5.900 3.584 3.521 3.634 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1739 1 51 SER H 1 82 ILE QG 5.000 . 5.900 4.636 4.290 5.010 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1740 1 82 ILE QG 1 83 VAL H 5.000 . 5.900 4.158 4.084 4.207 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1741 1 19 TRP HE1 1 82 ILE MG 5.000 . 6.000 4.007 3.963 4.039 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1742 1 22 GLY H 1 82 ILE MG 5.000 . 6.000 5.015 4.969 5.060 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1743 1 23 ALA H 1 82 ILE MG 5.000 . 6.000 2.532 2.249 2.687 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1744 1 51 SER H 1 82 ILE MG 5.000 . 6.000 3.445 3.199 3.742 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1745 1 82 ILE MG 1 83 VAL H 5.000 . 6.000 2.829 2.635 2.908 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1746 1 82 ILE MG 1 84 ASN HD21 5.000 . 6.000 2.508 2.255 2.733 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1747 1 82 ILE MG 1 84 ASN HD22 5.000 . 6.000 2.210 1.902 2.565 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1748 1 82 ILE H 1 83 VAL H 5.000 . 5.000 4.318 4.268 4.426 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1749 1 48 THR H 1 83 VAL HA 5.000 . 5.000 3.665 3.462 3.859 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1750 1 50 GLY H 1 83 VAL HA 4.000 . 4.000 2.932 2.506 3.360 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1751 1 51 SER H 1 83 VAL HA 5.000 . 5.000 4.675 4.308 4.985 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1752 1 83 VAL HA 1 84 ASN HD21 5.000 . 5.000 3.215 3.089 3.643 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1753 1 83 VAL HA 1 84 ASN HD22 5.000 . 5.000 4.763 3.518 4.952 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1754 1 83 VAL HA 1 84 ASN H 3.000 . 3.000 2.311 2.236 2.403 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1755 1 23 ALA H 1 83 VAL HB 4.000 . 4.000 3.825 3.652 3.979 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1756 1 83 VAL H 1 83 VAL HB 4.000 . 4.000 2.167 2.112 2.227 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1757 1 83 VAL HB 1 84 ASN H 5.000 . 5.000 4.170 3.965 4.329 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1758 1 23 ALA H 1 83 VAL MG1 5.000 . 6.000 3.967 3.726 4.130 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1759 1 44 ALA H 1 83 VAL MG1 5.000 . 6.000 3.141 2.977 3.353 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1760 1 47 ALA H 1 83 VAL MG1 5.000 . 6.000 4.371 4.143 4.577 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1761 1 48 THR H 1 83 VAL MG1 5.000 . 6.000 1.963 1.835 2.170 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1762 1 83 VAL MG1 1 84 ASN H 5.000 . 6.000 2.328 1.979 2.627 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1763 1 83 VAL MG1 1 85 GLY H 5.000 . 6.000 3.986 3.800 4.229 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1764 1 83 VAL MG1 1 91 VAL H 5.000 . 6.000 4.408 4.204 4.645 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1765 1 50 GLY H 1 83 VAL MG2 5.000 . 6.000 3.967 3.753 4.257 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1766 1 25 TYR H 1 83 VAL H 5.000 . 5.000 4.989 4.856 5.058 0.058 27 0 "[ . 1 . 2 . 3 . ]" 1 1767 1 22 GLY H 1 84 ASN HA 5.000 . 5.000 4.780 4.433 4.992 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1768 1 23 ALA H 1 84 ASN HA 4.000 . 4.000 3.638 3.384 3.845 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1769 1 84 ASN HA 1 84 ASN HD22 5.000 . 5.000 3.633 3.538 3.938 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1770 1 84 ASN HA 1 85 GLY H 3.000 . 3.000 2.216 2.188 2.245 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1771 1 48 THR H 1 84 ASN QB 5.000 . 5.900 3.563 3.418 3.751 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1772 1 84 ASN QB 1 85 GLY H 3.000 . 3.900 3.284 3.099 3.404 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1773 1 84 ASN H 1 84 ASN HD21 5.000 . 5.000 2.863 2.633 3.272 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1774 1 84 ASN HD21 1 85 GLY H 5.000 . 5.000 4.996 4.620 5.052 0.052 22 0 "[ . 1 . 2 . 3 . ]" 1 1775 1 84 ASN H 1 84 ASN HD22 5.000 . 5.000 4.463 3.767 4.747 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1776 1 84 ASN H 1 85 GLY H 5.000 . 5.000 4.418 4.332 4.517 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1777 1 47 ALA H 1 85 GLY QA 5.000 . 5.900 4.482 4.229 4.769 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1778 1 48 THR H 1 85 GLY QA 5.000 . 5.900 4.063 3.961 4.144 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1779 1 86 PRO HA 1 87 GLN H 3.000 . 3.000 2.748 2.217 2.974 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1780 1 86 PRO QB 1 87 GLN H 3.000 . 3.900 2.104 1.791 3.551 0.009 4 0 "[ . 1 . 2 . 3 . ]" 1 1781 1 47 ALA H 1 86 PRO QD 5.000 . 5.900 4.234 3.987 4.476 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1782 1 48 THR H 1 86 PRO QD 5.000 . 5.900 5.244 5.093 5.371 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1783 1 85 GLY H 1 86 PRO QD 5.000 . 5.900 3.884 3.678 4.150 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1784 1 86 PRO QD 1 87 GLN H 5.000 . 5.900 4.741 4.613 4.963 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1785 1 86 PRO QG 1 87 GLN HE21 5.000 . 5.900 5.038 4.171 5.289 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1786 1 86 PRO QG 1 87 GLN HE22 5.000 . 5.900 5.250 4.993 5.340 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1787 1 87 GLN HA 1 87 GLN HE21 5.000 . 5.000 3.397 2.686 4.127 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1788 1 87 GLN HA 1 87 GLN HE22 5.000 . 5.000 4.409 3.770 5.118 0.118 34 0 "[ . 1 . 2 . 3 . ]" 1 1789 1 87 GLN H 1 87 GLN HA 3.000 . 3.000 2.974 2.719 3.004 0.004 3 0 "[ . 1 . 2 . 3 . ]" 1 1790 1 87 GLN HA 1 88 GLY H 3.000 . 3.000 2.265 2.194 3.086 0.086 15 0 "[ . 1 . 2 . 3 . ]" 1 1791 1 87 GLN HA 1 89 ASP H 5.000 . 5.000 4.665 3.516 5.042 0.042 13 0 "[ . 1 . 2 . 3 . ]" 1 1792 1 87 GLN H 1 87 GLN QB 3.000 . 4.000 2.627 2.207 3.176 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1793 1 87 GLN QB 1 88 GLY H 5.000 . 6.000 3.146 2.718 3.615 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1794 1 87 GLN QB 1 89 ASP H 5.000 . 6.000 5.286 4.830 5.399 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1795 1 87 GLN QG 1 88 GLY H 5.000 . 6.000 4.201 3.588 4.913 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1796 1 88 GLY QA 1 89 ASP H 3.000 . 3.900 2.414 2.269 2.850 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1797 1 87 GLN H 1 88 GLY H 5.000 . 5.000 4.433 2.459 4.705 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1798 1 88 GLY H 1 89 ASP H 4.000 . 4.000 3.155 2.360 3.992 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1799 1 89 ASP H 1 89 ASP HA 3.000 . 3.000 2.663 2.361 3.004 0.004 35 0 "[ . 1 . 2 . 3 . ]" 1 1800 1 89 ASP HA 1 90 LYS H 3.000 . 3.000 2.262 2.221 2.364 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1801 1 89 ASP HA 1 91 VAL H 4.000 . 4.000 3.769 3.520 4.032 0.032 19 0 "[ . 1 . 2 . 3 . ]" 1 1802 1 89 ASP H 1 89 ASP QB 3.000 . 3.900 2.798 2.146 3.430 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1803 1 89 ASP QB 1 90 LYS H 4.000 . 4.900 3.457 2.909 3.799 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1804 1 89 ASP QB 1 91 VAL H 4.000 . 4.900 3.608 3.120 4.101 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1805 1 89 ASP H 1 90 LYS H 5.000 . 5.000 4.291 3.920 4.546 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1806 1 44 ALA H 1 90 LYS HA 5.000 . 5.000 3.539 3.421 3.670 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1807 1 90 LYS HA 1 91 VAL H 4.000 . 4.000 3.155 3.016 3.291 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1808 1 48 THR H 1 90 LYS QB 5.000 . 5.900 4.462 4.124 4.831 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1809 1 85 GLY H 1 90 LYS QB 4.000 . 4.900 4.361 4.052 4.468 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1810 1 90 LYS QB 1 91 VAL H 5.000 . 5.900 3.574 3.387 3.724 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1811 1 85 GLY H 1 90 LYS QD 5.000 . 5.900 2.226 1.769 4.094 0.031 6 0 "[ . 1 . 2 . 3 . ]" 1 1812 1 88 GLY H 1 90 LYS QD 5.000 . 5.900 4.702 3.254 5.246 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1813 1 22 GLY H 1 90 LYS QE 5.000 . 6.000 4.742 3.756 5.327 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1814 1 23 ALA H 1 90 LYS QE 5.000 . 6.000 4.037 2.876 4.936 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1815 1 87 GLN H 1 90 LYS QE 5.000 . 6.000 4.357 3.136 5.143 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1816 1 88 GLY H 1 90 LYS QE 5.000 . 6.000 3.223 2.599 5.170 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1817 1 44 ALA H 1 90 LYS QG 3.000 . 4.900 4.246 4.118 4.430 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1818 1 88 GLY H 1 90 LYS QG 5.000 . 5.900 5.059 4.260 5.348 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1819 1 90 LYS H 1 90 LYS QG 4.000 . 4.900 3.794 3.638 3.998 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1820 1 90 LYS H 1 91 VAL H 3.000 . 3.000 2.130 1.866 2.386 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1821 1 91 VAL HA 1 92 GLU H 3.000 . 3.000 2.204 2.179 2.234 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1822 1 91 VAL HA 1 93 GLU H 4.000 . 4.000 4.039 4.006 4.086 0.086 33 0 "[ . 1 . 2 . 3 . ]" 1 1823 1 91 VAL H 1 91 VAL HB 3.000 . 3.000 3.096 3.034 3.158 0.158 6 0 "[ . 1 . 2 . 3 . ]" 1 1824 1 90 LYS H 1 91 VAL MG1 5.000 . 6.000 2.755 2.557 3.108 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1825 1 91 VAL MG1 1 92 GLU H 5.000 . 6.000 4.078 3.952 4.175 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1826 1 91 VAL MG1 1 93 GLU H 4.000 . 5.000 3.806 3.618 4.106 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1827 1 42 LYS H 1 91 VAL MG2 5.000 . 6.000 3.441 3.280 3.629 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1828 1 44 ALA H 1 91 VAL MG2 5.000 . 6.000 4.246 4.095 4.446 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1829 1 90 LYS H 1 91 VAL MG2 5.000 . 6.000 5.097 5.031 5.146 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1830 1 91 VAL MG2 1 92 GLU H 5.000 . 6.000 2.995 2.763 3.156 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1831 1 91 VAL MG2 1 93 GLU H 5.000 . 6.000 2.161 2.041 2.448 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1832 1 91 VAL H 1 92 GLU H 5.000 . 5.000 4.192 4.094 4.298 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1833 1 92 GLU HA 1 93 GLU H 4.000 . 4.000 3.584 3.575 3.592 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1834 1 44 ALA H 1 92 GLU QB 5.000 . 5.900 4.683 4.413 4.959 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1835 1 92 GLU QB 1 93 GLU H 3.000 . 3.900 2.550 2.472 2.709 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1836 1 92 GLU H 1 93 GLU H 3.000 . 3.000 2.950 2.765 3.040 0.040 11 0 "[ . 1 . 2 . 3 . ]" 1 1837 1 93 GLU HA 1 94 ILE H 3.000 . 3.000 2.372 2.317 2.389 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1838 1 93 GLU QB 1 94 ILE H 5.000 . 6.000 2.754 2.681 3.430 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1839 1 42 LYS H 1 93 GLU QG 5.000 . 6.000 2.652 2.242 3.382 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1840 1 93 GLU QG 1 94 ILE H 5.000 . 6.000 3.792 2.954 4.184 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1841 1 93 GLU QG 1 95 THR H 5.000 . 6.000 4.300 3.226 5.124 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1842 1 42 LYS H 1 93 GLU H 4.000 . 4.000 2.971 2.829 3.049 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1843 1 93 GLU H 1 94 ILE H 5.000 . 5.000 4.350 4.288 4.366 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1844 1 42 LYS H 1 94 ILE HA 5.000 . 5.000 3.537 3.316 3.832 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1845 1 94 ILE HA 1 95 THR H 3.000 . 3.000 2.229 2.198 2.263 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1846 1 94 ILE H 1 94 ILE HB 3.000 . 3.000 2.440 2.311 2.599 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1847 1 94 ILE H 1 94 ILE QG 4.000 . 4.900 2.780 2.193 3.042 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1848 1 94 ILE QG 1 95 THR H 5.000 . 5.900 4.249 3.988 4.764 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1849 1 40 LYS H 1 94 ILE MG 5.000 . 6.000 4.708 4.475 4.904 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1850 1 94 ILE MG 1 95 THR H 5.000 . 6.000 2.998 2.577 3.317 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1851 1 95 THR HA 1 96 LEU H 3.000 . 3.000 2.294 2.221 2.395 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1852 1 40 LYS H 1 95 THR HB 5.000 . 5.000 4.041 3.757 4.321 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1853 1 95 THR H 1 95 THR HB 4.000 . 4.000 3.271 3.203 3.404 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1854 1 95 THR HB 1 96 LEU H 4.000 . 4.000 3.321 2.960 3.686 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1855 1 94 ILE H 1 95 THR MG 5.000 . 6.000 4.726 4.407 4.873 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1856 1 95 THR MG 1 96 LEU H 5.000 . 6.000 3.095 2.696 3.489 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1857 1 94 ILE H 1 95 THR H 5.000 . 5.000 4.228 4.061 4.422 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1858 1 40 LYS H 1 96 LEU HA 5.000 . 5.000 3.124 2.974 3.344 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1859 1 96 LEU HA 1 97 GLU H 3.000 . 3.000 2.224 2.205 2.240 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1860 1 40 LYS H 1 96 LEU QB 5.000 . 5.900 5.134 5.001 5.303 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1861 1 96 LEU QB 1 97 GLU H 5.000 . 5.900 3.653 3.535 3.736 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1862 1 96 LEU H 1 96 LEU MD1 5.000 . 6.000 4.358 4.259 4.465 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1863 1 96 LEU MD1 1 97 GLU H 5.000 . 6.000 4.305 4.200 4.412 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1864 1 38 THR H 1 96 LEU MD2 5.000 . 6.000 3.421 3.182 3.672 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1865 1 40 LYS H 1 96 LEU MD2 5.000 . 6.000 3.809 3.651 4.076 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1866 1 96 LEU H 1 96 LEU MD2 5.000 . 6.000 4.089 4.061 4.118 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1867 1 96 LEU MD2 1 97 GLU H 5.000 . 6.000 1.991 1.876 2.112 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1868 1 96 LEU MD2 1 98 ILE H 5.000 . 6.000 3.854 3.661 4.043 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1869 1 96 LEU HG 1 97 GLU H 5.000 . 5.000 4.312 4.177 4.483 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1870 1 96 LEU H 1 103 ILE H 5.000 . 5.000 3.661 3.258 4.032 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1871 1 97 GLU HA 1 101 GLN H 5.000 . 5.000 4.290 3.420 4.912 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1872 1 97 GLU HA 1 103 ILE H 5.000 . 5.000 2.979 2.715 3.274 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1873 1 97 GLU HA 1 98 ILE H 3.000 . 3.000 2.236 2.211 2.259 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1874 1 97 GLU QB 1 100 GLY H 5.000 . 5.900 4.018 3.329 4.315 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1875 1 97 GLU QB 1 101 GLN H 5.000 . 5.900 5.040 4.067 5.322 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1876 1 38 THR H 1 97 GLU QB 5.000 . 6.000 4.297 4.073 4.823 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1877 1 97 GLU QB 1 98 ILE H 5.000 . 6.000 3.930 3.481 4.000 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1878 1 38 THR H 1 97 GLU QG 5.000 . 6.000 4.691 3.534 5.365 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1879 1 97 GLU QG 1 98 ILE H 5.000 . 6.000 3.113 2.710 4.314 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1880 1 40 LYS H 1 97 GLU H 5.000 . 5.000 3.460 3.290 3.601 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1881 1 96 LEU H 1 97 GLU H 5.000 . 5.000 4.479 4.349 4.572 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1882 1 97 GLU H 1 98 ILE H 5.000 . 5.000 4.102 4.013 4.214 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1883 1 98 ILE HA 1 100 GLY H 5.000 . 5.000 3.975 3.821 4.276 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1884 1 98 ILE HA 1 101 GLN H 5.000 . 5.000 4.259 3.959 4.671 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1885 1 38 THR H 1 98 ILE HA 5.000 . 5.000 2.079 1.933 2.228 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1886 1 98 ILE H 1 98 ILE HA 3.000 . 3.000 2.962 2.957 2.974 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1887 1 98 ILE HA 1 99 ASN H 3.000 . 3.000 2.202 2.167 2.263 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1888 1 98 ILE H 1 98 ILE HB 4.000 . 4.000 2.371 2.309 2.417 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1889 1 98 ILE HB 1 99 ASN H 5.000 . 5.000 4.416 4.342 4.491 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1890 1 36 ASP H 1 98 ILE MD 5.000 . 6.000 4.582 3.982 4.810 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1891 1 38 THR H 1 98 ILE MD 5.000 . 6.000 4.327 4.046 4.586 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1892 1 98 ILE H 1 98 ILE MD 5.000 . 6.000 4.009 3.934 4.093 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1893 1 98 ILE MD 1 99 ASN H 5.000 . 6.000 5.014 4.951 5.071 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1894 1 98 ILE QG 1 101 GLN H 5.000 . 5.900 4.635 4.385 5.024 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1895 1 37 TRP H 1 98 ILE QG 5.000 . 5.900 4.527 4.433 4.827 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1896 1 38 THR H 1 98 ILE QG 5.000 . 5.900 3.033 2.861 3.164 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1897 1 98 ILE QG 1 99 ASN H 5.000 . 5.900 4.289 4.227 4.360 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1898 1 98 ILE MG 1 100 GLY H 5.000 . 6.000 4.526 4.329 4.791 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1899 1 98 ILE MG 1 101 GLN H 5.000 . 6.000 3.924 3.697 4.467 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1900 1 35 TYR H 1 98 ILE MG 5.000 . 6.000 4.964 4.687 5.035 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1901 1 98 ILE MG 1 99 ASN HD21 5.000 . 6.000 3.922 3.470 4.122 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1902 1 98 ILE MG 1 99 ASN HD22 5.000 . 6.000 4.766 4.479 4.878 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1903 1 98 ILE H 1 103 ILE H 5.000 . 5.000 4.087 3.609 4.540 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1904 1 98 ILE H 1 99 ASN H 5.000 . 5.000 4.291 4.098 4.395 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1905 1 99 ASN HA 1 100 GLY H 3.000 . 3.000 2.983 2.829 3.052 0.052 34 0 "[ . 1 . 2 . 3 . ]" 1 1906 1 99 ASN HA 1 99 ASN HD22 5.000 . 5.000 3.272 3.176 3.592 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1907 1 99 ASN H 1 99 ASN HA 3.000 . 3.000 2.376 2.362 2.388 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1908 1 99 ASN QB 1 100 GLY H 5.000 . 5.900 3.769 3.699 3.883 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1909 1 99 ASN QB 1 101 GLN H 5.000 . 5.900 3.875 3.553 4.675 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1910 1 36 ASP H 1 99 ASN QB 5.000 . 5.900 4.136 3.790 4.641 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1911 1 99 ASN H 1 100 GLY H 5.000 . 5.000 2.979 2.855 3.136 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1912 1 99 ASN H 1 101 GLN H 5.000 . 5.000 4.187 3.979 4.657 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1913 1 100 GLY QA 1 101 GLN HE22 5.000 . 5.900 4.388 2.950 5.234 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1914 1 100 GLY QA 1 101 GLN H 4.000 . 4.900 2.883 2.719 2.943 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1915 1 100 GLY H 1 101 GLN H 4.000 . 4.000 2.385 2.047 2.861 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1916 1 101 GLN HA 1 101 GLN HE21 5.000 . 5.000 3.169 1.997 4.591 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1917 1 101 GLN HA 1 101 GLN HE22 5.000 . 5.000 3.763 2.798 4.829 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1918 1 101 GLN H 1 101 GLN HA 3.000 . 3.000 2.956 2.875 3.003 0.003 14 0 "[ . 1 . 2 . 3 . ]" 1 1919 1 101 GLN HA 1 102 VAL H 3.000 . 3.000 2.244 2.203 2.552 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1920 1 100 GLY H 1 101 GLN QB 5.000 . 5.900 4.279 3.994 4.646 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1921 1 101 GLN H 1 101 GLN QB 3.000 . 3.900 2.258 1.972 2.716 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1922 1 101 GLN QB 1 102 VAL H 4.000 . 4.900 3.617 2.367 3.841 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1923 1 98 ILE H 1 101 GLN QB 5.000 . 5.900 2.731 2.270 2.965 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1924 1 101 GLN QG 1 102 VAL H 5.000 . 6.000 4.420 3.750 4.926 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1925 1 101 GLN H 1 102 VAL H 5.000 . 5.000 4.331 3.882 4.637 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1926 1 98 ILE H 1 101 GLN H 4.000 . 4.000 3.002 2.517 3.456 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1927 1 102 VAL H 1 102 VAL HA 3.000 . 3.000 2.907 2.866 2.988 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1928 1 102 VAL HA 1 103 ILE H 3.000 . 3.000 2.229 2.206 2.265 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1929 1 97 GLU H 1 102 VAL HA 5.000 . 5.000 4.449 4.374 4.595 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1930 1 102 VAL HB 1 103 ILE H 5.000 . 5.000 4.396 4.227 4.582 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1931 1 102 VAL H 1 102 VAL MG2 4.000 . 5.000 3.693 3.160 3.941 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1932 1 102 VAL MG2 1 103 ILE H 5.000 . 6.000 2.705 2.226 3.383 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1933 1 103 ILE H 1 103 ILE HB 4.000 . 4.000 2.697 2.467 2.831 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1934 1 10 GLY H 1 103 ILE MD 5.000 . 6.000 4.315 3.304 4.787 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1935 1 103 ILE H 1 103 ILE MD 5.000 . 6.000 3.460 2.993 3.782 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1936 1 9 SER H 1 103 ILE MD 5.000 . 6.000 2.368 2.003 2.828 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1937 1 98 ILE H 1 103 ILE QG 5.000 . 6.000 2.841 2.688 3.128 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1938 1 10 GLY H 1 103 ILE MG 5.000 . 6.000 4.212 2.974 4.818 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1939 1 16 VAL MG1 1 81 PHE QE 4.000 . 7.000 5.245 5.185 5.315 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1940 1 17 ASN HA 1 19 TRP HZ3 5.000 . 5.000 5.094 4.988 5.141 0.141 31 0 "[ . 1 . 2 . 3 . ]" 1 1941 1 18 ASP HA 1 19 TRP HE3 5.000 . 5.000 2.948 2.826 3.178 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1942 1 18 ASP HA 1 19 TRP HZ3 5.000 . 5.000 3.616 3.466 3.839 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1943 1 18 ASP QB 1 19 TRP HE3 5.000 . 5.900 4.641 4.547 4.845 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1944 1 19 TRP HA 1 19 TRP HD1 4.000 . 5.000 4.451 4.407 4.495 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1945 1 19 TRP HA 1 19 TRP HE3 4.000 . 5.000 4.144 4.072 4.221 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1946 1 19 TRP HE3 1 23 ALA HA 5.000 . 5.000 3.471 3.328 3.566 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1947 1 19 TRP HH2 1 23 ALA HA 5.000 . 5.000 3.535 3.441 3.651 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1948 1 19 TRP HZ3 1 23 ALA HA 5.000 . 5.000 2.961 2.828 3.048 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1949 1 19 TRP HE3 1 23 ALA MB 5.000 . 6.000 4.944 4.792 5.045 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1950 1 23 ALA MB 1 25 TYR QE 4.000 . 7.000 1.908 1.789 2.175 0.011 20 0 "[ . 1 . 2 . 3 . ]" 1 1951 1 19 TRP HH2 1 24 GLU HA 5.000 . 5.000 2.678 2.626 2.730 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1952 1 19 TRP HZ3 1 24 GLU HA 5.000 . 5.000 3.187 3.074 3.276 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1953 1 19 TRP HE3 1 24 GLU QB 5.000 . 5.900 3.738 3.613 3.978 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1954 1 19 TRP HE3 1 24 GLU QG 5.000 . 5.900 3.917 3.681 4.022 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1955 1 19 TRP HZ2 1 24 GLU QG 4.000 . 4.900 4.206 4.071 4.358 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1956 1 25 TYR QB 1 81 PHE QD 5.000 . 7.900 2.738 2.602 2.830 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1957 1 25 TYR QB 1 81 PHE QE 4.000 . 6.900 2.254 2.211 2.297 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1958 1 26 ASP HA 1 53 TRP HZ2 5.000 . 5.000 4.246 3.783 4.617 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1959 1 26 ASP HA 1 79 PHE QD 5.000 . 7.000 5.116 4.857 5.319 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1960 1 27 VAL HB 1 37 TRP HZ3 5.000 . 5.000 4.562 4.517 4.671 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1961 1 27 VAL HB 1 79 PHE QE 5.000 . 7.000 2.734 2.705 2.776 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1962 1 27 VAL HB 1 79 PHE HZ 5.000 . 5.000 2.958 2.869 3.137 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1963 1 27 VAL MG2 1 66 PHE QD 5.000 . 8.000 3.674 3.274 4.280 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1964 1 27 VAL MG2 1 79 PHE QE 5.000 . 8.000 2.240 2.031 2.483 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1965 1 27 VAL MG2 1 79 PHE HZ 5.000 . 6.000 2.294 2.038 2.457 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1966 1 28 THR HA 1 78 THR HB 4.000 . 4.000 3.950 3.737 4.041 0.041 24 0 "[ . 1 . 2 . 3 . ]" 1 1967 1 29 LEU QB 1 37 TRP HZ3 5.000 . 5.900 4.685 4.550 4.826 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1968 1 29 LEU MD1 1 37 TRP HZ2 5.000 . 6.000 4.356 4.210 4.473 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1969 1 29 LEU MD1 1 79 PHE HZ 5.000 . 6.000 3.773 3.665 3.886 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1970 1 29 LEU MD2 1 37 TRP HD1 5.000 . 6.000 4.415 4.183 4.656 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1971 1 35 TYR HA 1 35 TYR QE 4.000 . 6.000 4.708 4.430 4.918 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1972 1 36 ASP HA 1 37 TRP HD1 5.000 . 5.000 3.816 3.630 3.910 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1973 1 35 TYR QD 1 37 TRP QB 5.000 . 7.900 5.098 4.638 5.556 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1974 1 37 TRP HH2 1 79 PHE QD 4.000 . 6.000 2.484 2.339 2.706 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1975 1 37 TRP HH2 1 79 PHE QE 5.000 . 7.000 4.230 4.128 4.461 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1976 1 37 TRP HZ2 1 79 PHE QD 4.000 . 6.000 4.330 4.182 4.563 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1977 1 37 TRP HZ3 1 66 PHE QD 4.000 . 6.000 4.864 4.660 5.027 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1978 1 37 TRP HZ3 1 79 PHE QD 4.000 . 6.000 2.297 2.199 2.414 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1979 1 37 TRP HZ3 1 79 PHE QE 5.000 . 7.000 2.299 2.195 2.521 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1980 1 37 TRP HE3 1 39 VAL HA 5.000 . 5.000 4.891 4.770 4.991 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1981 1 39 VAL MG1 1 79 PHE QE 5.000 . 8.000 3.075 2.899 3.230 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1982 1 39 VAL MG2 1 79 PHE QD 5.000 . 8.000 3.532 3.454 3.615 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1983 1 40 LYS QD 1 63 TYR QE 5.000 . 8.000 5.723 5.311 6.072 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1984 1 40 LYS QG 1 63 TYR QD 5.000 . 7.900 4.711 4.486 4.828 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1985 1 41 VAL MG1 1 66 PHE QE 5.000 . 8.000 3.044 2.594 3.313 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1986 1 41 VAL MG1 1 66 PHE HZ 5.000 . 6.000 4.113 3.698 4.459 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1987 1 41 VAL MG2 1 66 PHE HZ 5.000 . 6.000 3.978 3.634 4.192 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1988 1 41 VAL MG2 1 81 PHE QE 4.000 . 7.000 2.180 1.841 2.539 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1989 1 42 LYS HA 1 63 TYR QE 5.000 . 7.000 3.987 3.802 4.095 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1990 1 42 LYS QB 1 63 TYR QD 5.000 . 7.900 2.315 1.925 2.684 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1991 1 42 LYS QD 1 63 TYR QD 5.000 . 7.900 2.404 2.180 2.571 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1992 1 42 LYS QE 1 63 TYR QD 5.000 . 8.000 4.079 3.608 4.413 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1993 1 43 LEU QB 1 63 TYR QD 5.000 . 7.900 3.826 3.754 4.039 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1994 1 43 LEU QB 1 63 TYR QE 5.000 . 7.900 4.989 4.797 5.256 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1995 1 43 LEU MD1 1 63 TYR QD 5.000 . 8.000 4.483 4.259 4.800 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1996 1 43 LEU MD2 1 63 TYR QD 5.000 . 8.000 4.987 4.819 5.235 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1997 1 43 LEU MD2 1 66 PHE HZ 5.000 . 6.000 4.778 4.567 4.920 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1998 1 49 VAL MG1 1 66 PHE QE 5.000 . 8.000 2.693 2.408 2.994 . 0 0 "[ . 1 . 2 . 3 . ]" 1 1999 1 49 VAL MG1 1 81 PHE QE 5.000 . 8.000 4.501 3.918 5.050 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2000 1 51 SER HA 1 52 PHE QD 4.000 . 6.000 3.136 2.541 3.763 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2001 1 52 PHE HA 1 79 PHE QD 5.000 . 7.000 4.903 4.786 5.023 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2002 1 52 PHE QB 1 66 PHE QD 5.000 . 7.900 3.380 2.998 3.635 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2003 1 52 PHE QB 1 66 PHE HZ 5.000 . 5.900 3.954 3.803 4.180 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2004 1 52 PHE QD 1 66 PHE QD 5.000 . 9.000 3.819 3.142 4.441 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2005 1 53 TRP HD1 1 79 PHE QD 5.000 . 7.000 4.455 4.220 4.788 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2006 1 52 PHE QD 1 55 ALA MB 5.000 . 8.000 3.605 3.191 4.003 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2007 1 53 TRP HD1 1 55 ALA MB 5.000 . 6.000 4.530 4.307 4.810 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2008 1 52 PHE HZ 1 57 LYS QB 3.000 . 3.900 3.255 3.039 3.449 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2009 1 57 LYS QB 1 66 PHE HZ 5.000 . 5.900 4.515 4.277 4.922 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2010 1 57 LYS QD 1 66 PHE HZ 5.000 . 5.900 4.816 4.034 5.229 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2011 1 57 LYS QG 1 66 PHE HZ 5.000 . 5.900 3.493 3.187 5.097 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2012 1 60 GLY QA 1 63 TYR QE 5.000 . 7.900 4.352 3.983 4.999 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2013 1 61 ASN QB 1 63 TYR QE 5.000 . 7.900 3.626 2.486 4.904 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2014 1 64 VAL MG2 1 66 PHE HZ 5.000 . 6.000 4.281 4.077 4.882 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2015 1 63 TYR QD 1 65 ILE MD 5.000 . 8.000 5.085 4.855 5.505 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2016 1 65 ILE QG 1 66 PHE QD 5.000 . 7.900 5.851 4.900 6.166 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2017 1 37 TRP HZ3 1 66 PHE HA 5.000 . 5.000 4.950 4.756 5.044 0.044 7 0 "[ . 1 . 2 . 3 . ]" 1 2018 1 37 TRP HE3 1 66 PHE QB 5.000 . 5.900 4.174 4.062 4.270 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2019 1 66 PHE QB 1 79 PHE QD 5.000 . 7.900 3.334 3.174 3.481 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2020 1 66 PHE QD 1 79 PHE QD 5.000 . 9.000 3.615 2.750 4.051 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2021 1 66 PHE QD 1 79 PHE QE 5.000 . 9.000 2.857 2.582 3.262 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2022 1 66 PHE QD 1 79 PHE HZ 5.000 . 7.000 2.677 2.245 3.360 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2023 1 52 PHE QD 1 66 PHE QE 4.000 . 8.000 3.793 3.424 4.004 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2024 1 66 PHE QE 1 79 PHE QD 4.000 . 8.000 4.274 3.434 4.621 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2025 1 66 PHE QE 1 81 PHE QD 4.000 . 8.000 2.637 2.129 3.142 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2026 1 66 PHE QE 1 81 PHE QE 5.000 . 9.000 3.109 2.770 3.664 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2027 1 66 PHE HZ 1 79 PHE QE 5.000 . 7.000 4.107 3.875 4.252 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2028 1 66 PHE HZ 1 81 PHE QD 4.000 . 6.000 2.797 2.726 2.848 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2029 1 66 PHE HZ 1 81 PHE QE 5.000 . 7.000 4.004 3.903 4.082 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2030 1 37 TRP HD1 1 68 PRO QB 5.000 . 5.900 3.596 3.413 3.756 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2031 1 37 TRP HE3 1 68 PRO QD 5.000 . 5.900 3.911 3.763 4.473 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2032 1 37 TRP HZ2 1 68 PRO QD 5.000 . 5.900 4.317 4.079 4.917 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2033 1 37 TRP HD1 1 68 PRO QG 5.000 . 5.900 3.627 3.451 3.975 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2034 1 37 TRP HZ2 1 68 PRO QG 5.000 . 5.900 4.663 4.461 4.958 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2035 1 70 SER HA 1 71 TRP HD1 5.000 . 5.000 4.690 4.464 4.925 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2036 1 70 SER QB 1 71 TRP HD1 5.000 . 5.900 2.483 2.050 3.534 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2037 1 37 TRP HZ2 1 72 ASN QB 5.000 . 5.900 2.140 1.798 3.686 0.002 32 0 "[ . 1 . 2 . 3 . ]" 1 2038 1 71 TRP HE3 1 72 ASN QB 5.000 . 5.900 3.420 2.301 4.254 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2039 1 71 TRP HZ3 1 72 ASN QB 5.000 . 5.900 3.682 2.446 4.606 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2040 1 37 TRP HZ2 1 73 LYS HA 5.000 . 5.000 4.060 3.704 4.360 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2041 1 37 TRP HD1 1 73 LYS QB 5.000 . 5.900 4.610 4.320 4.922 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2042 1 37 TRP HZ2 1 73 LYS QG 5.000 . 5.900 4.741 4.160 5.358 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2043 1 35 TYR QD 1 75 PRO HA 5.000 . 7.000 4.138 3.406 5.244 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2044 1 71 TRP HZ3 1 77 ALA HA 5.000 . 5.000 4.970 4.676 5.049 0.049 15 0 "[ . 1 . 2 . 3 . ]" 1 2045 1 37 TRP HD1 1 77 ALA MB 5.000 . 6.000 3.922 3.622 4.127 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2046 1 37 TRP HH2 1 77 ALA MB 5.000 . 6.000 3.416 3.185 3.629 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2047 1 37 TRP HZ2 1 77 ALA MB 5.000 . 6.000 1.951 1.793 2.203 0.007 1 0 "[ . 1 . 2 . 3 . ]" 1 2048 1 78 THR HA 1 79 PHE QD 5.000 . 7.000 3.746 3.557 4.064 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2049 1 53 TRP HD1 1 79 PHE HA 4.000 . 4.000 2.221 2.121 2.371 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2050 1 54 SER HA 1 79 PHE HA 5.000 . 5.000 4.596 4.414 4.764 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2051 1 53 TRP HD1 1 79 PHE QB 5.000 . 5.900 3.366 3.217 3.705 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2052 1 66 PHE QE 1 79 PHE QE 5.000 . 9.000 3.346 3.145 3.581 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2053 1 79 PHE QD 1 80 GLY QA 5.000 . 7.900 2.947 2.786 3.197 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2054 1 66 PHE QD 1 81 PHE HA 5.000 . 7.000 5.542 5.283 5.814 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2055 1 66 PHE QE 1 81 PHE HA 5.000 . 7.000 3.874 3.495 4.264 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2056 1 79 PHE QD 1 81 PHE HA 5.000 . 7.000 4.844 4.725 4.909 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2057 1 52 PHE QD 1 81 PHE QB 5.000 . 7.900 4.194 3.910 4.384 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2058 1 66 PHE QE 1 81 PHE QB 5.000 . 7.900 2.187 1.874 2.468 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2059 1 66 PHE HZ 1 81 PHE QB 5.000 . 5.900 1.961 1.891 2.068 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2060 1 79 PHE QD 1 81 PHE QB 5.000 . 7.900 3.437 3.325 3.576 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2061 1 79 PHE QE 1 81 PHE QD 4.000 . 8.000 2.497 2.286 2.729 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2062 1 66 PHE QD 1 81 PHE QE 5.000 . 9.000 4.648 4.337 5.031 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2063 1 79 PHE QE 1 81 PHE QE 4.000 . 8.000 4.423 4.154 4.715 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2064 1 19 TRP HH2 1 82 ILE HA 5.000 . 5.000 3.068 2.970 3.177 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2065 1 25 TYR QD 1 82 ILE HA 5.000 . 7.000 2.411 2.237 2.619 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2066 1 81 PHE QD 1 82 ILE HA 5.000 . 7.000 3.235 3.136 3.347 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2067 1 19 TRP HZ2 1 82 ILE MD 5.000 . 6.000 5.108 5.091 5.124 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2068 1 19 TRP HZ3 1 82 ILE MD 5.000 . 6.000 4.592 4.472 4.665 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2069 1 25 TYR QD 1 82 ILE MD 5.000 . 8.000 3.672 3.531 3.917 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2070 1 53 TRP HE3 1 82 ILE MD 5.000 . 6.000 4.414 4.098 4.714 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2071 1 19 TRP HE3 1 82 ILE QG 5.000 . 5.900 5.217 5.114 5.275 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2072 1 19 TRP HZ2 1 82 ILE QG 5.000 . 5.900 3.574 3.540 3.609 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2073 1 25 TYR QD 1 82 ILE QG 5.000 . 7.900 4.124 4.002 4.464 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2074 1 53 TRP HZ2 1 82 ILE QG 5.000 . 5.900 4.998 4.569 5.313 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2075 1 19 TRP HE3 1 82 ILE MG 5.000 . 6.000 5.036 5.020 5.052 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2076 1 19 TRP HZ2 1 82 ILE MG 5.000 . 6.000 1.737 1.724 1.748 0.076 18 0 "[ . 1 . 2 . 3 . ]" 1 2077 1 25 TYR QD 1 83 VAL HB 4.000 . 6.000 3.715 3.321 3.918 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2078 1 81 PHE QE 1 83 VAL MG2 3.000 . 6.000 1.767 1.728 1.841 0.072 5 0 "[ . 1 . 2 . 3 . ]" 1 2079 1 81 PHE QE 1 91 VAL HB 5.000 . 7.000 3.384 3.147 3.600 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2080 1 81 PHE HZ 1 91 VAL HB 4.000 . 4.000 2.983 2.899 3.133 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2081 1 25 TYR QE 1 91 VAL MG1 5.000 . 8.000 1.885 1.730 2.183 0.070 33 0 "[ . 1 . 2 . 3 . ]" 1 2082 1 25 TYR QE 1 91 VAL MG2 5.000 . 8.000 3.892 3.591 4.140 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2083 1 81 PHE QD 1 91 VAL MG2 5.000 . 8.000 5.036 4.828 5.254 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2084 1 81 PHE QE 1 91 VAL MG2 5.000 . 8.000 3.393 3.223 3.588 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2085 1 79 PHE QE 1 94 ILE MD 5.000 . 8.000 5.233 4.668 5.552 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2086 1 81 PHE QE 1 94 ILE MD 4.000 . 7.000 2.000 1.770 2.334 0.030 3 0 "[ . 1 . 2 . 3 . ]" 1 2087 1 37 TRP HE3 1 96 LEU MD2 5.000 . 6.000 3.121 2.981 3.290 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2088 1 35 TYR QD 1 98 ILE HB 5.000 . 7.000 5.954 5.140 6.447 . 0 0 "[ . 1 . 2 . 3 . ]" 1 2089 1 35 TYR QD 1 98 ILE QG 5.000 . 7.900 5.688 5.198 6.065 . 0 0 "[ . 1 . 2 . 3 . ]" 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 64 _Distance_constraint_stats_list.Viol_count 822 _Distance_constraint_stats_list.Viol_total 1500.887 _Distance_constraint_stats_list.Viol_max 0.181 _Distance_constraint_stats_list.Viol_rms 0.0314 _Distance_constraint_stats_list.Viol_average_all_restraints 0.0162 _Distance_constraint_stats_list.Viol_average_violations_only 0.0480 _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 11 SER 4.333 0.138 9 0 "[ . 1 . 2 . 3 . ]" 1 13 GLU 1.778 0.058 26 0 "[ . 1 . 2 . 3 . ]" 1 15 LYS 3.202 0.115 11 0 "[ . 1 . 2 . 3 . ]" 1 17 ASN 1.407 0.064 12 0 "[ . 1 . 2 . 3 . ]" 1 23 ALA 0.000 0.000 . 0 "[ . 1 . 2 . 3 . ]" 1 24 GLU 1.407 0.064 12 0 "[ . 1 . 2 . 3 . ]" 1 25 TYR 2.032 0.071 27 0 "[ . 1 . 2 . 3 . ]" 1 26 ASP 3.202 0.115 11 0 "[ . 1 . 2 . 3 . ]" 1 27 VAL 5.378 0.176 4 0 "[ . 1 . 2 . 3 . ]" 1 28 THR 1.778 0.058 26 0 "[ . 1 . 2 . 3 . ]" 1 29 LEU 0.211 0.038 34 0 "[ . 1 . 2 . 3 . ]" 1 30 ASN 4.333 0.138 9 0 "[ . 1 . 2 . 3 . ]" 1 38 THR 1.450 0.075 16 0 "[ . 1 . 2 . 3 . ]" 1 39 VAL 2.535 0.107 26 0 "[ . 1 . 2 . 3 . ]" 1 40 LYS 1.992 0.083 9 0 "[ . 1 . 2 . 3 . ]" 1 41 VAL 2.214 0.114 26 0 "[ . 1 . 2 . 3 . ]" 1 42 LYS 3.124 0.107 18 0 "[ . 1 . 2 . 3 . ]" 1 48 THR 1.337 0.078 3 0 "[ . 1 . 2 . 3 . ]" 1 53 TRP 0.481 0.063 35 0 "[ . 1 . 2 . 3 . ]" 1 56 ASN 2.970 0.109 13 0 "[ . 1 . 2 . 3 . ]" 1 58 GLN 5.054 0.181 14 0 "[ . 1 . 2 . 3 . ]" 1 64 VAL 2.214 0.114 26 0 "[ . 1 . 2 . 3 . ]" 1 65 ILE 5.054 0.181 14 0 "[ . 1 . 2 . 3 . ]" 1 66 PHE 2.535 0.107 26 0 "[ . 1 . 2 . 3 . ]" 1 67 THR 2.970 0.109 13 0 "[ . 1 . 2 . 3 . ]" 1 77 ALA 0.211 0.038 34 0 "[ . 1 . 2 . 3 . ]" 1 79 PHE 5.378 0.176 4 0 "[ . 1 . 2 . 3 . ]" 1 80 GLY 0.481 0.063 35 0 "[ . 1 . 2 . 3 . ]" 1 81 PHE 2.032 0.071 27 0 "[ . 1 . 2 . 3 . ]" 1 83 VAL 0.000 0.000 . 0 "[ . 1 . 2 . 3 . ]" 1 84 ASN 1.337 0.078 3 0 "[ . 1 . 2 . 3 . ]" 1 93 GLU 3.124 0.107 18 0 "[ . 1 . 2 . 3 . ]" 1 95 THR 1.992 0.083 9 0 "[ . 1 . 2 . 3 . ]" 1 97 GLU 1.450 0.075 16 0 "[ . 1 . 2 . 3 . ]" 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 11 SER O 1 30 ASN H 2.150 . 2.300 1.918 1.848 2.075 . 0 0 "[ . 1 . 2 . 3 . ]" 2 2 1 11 SER O 1 30 ASN N 2.900 2.800 3.300 2.860 2.786 3.025 0.014 3 0 "[ . 1 . 2 . 3 . ]" 2 3 1 11 SER H 1 30 ASN O 2.150 . 2.300 1.879 1.771 2.032 0.029 2 0 "[ . 1 . 2 . 3 . ]" 2 4 1 11 SER N 1 30 ASN O 2.900 2.800 3.300 2.690 2.662 2.733 0.138 9 0 "[ . 1 . 2 . 3 . ]" 2 5 1 13 GLU O 1 28 THR H 2.150 . 2.300 1.895 1.814 2.084 . 0 0 "[ . 1 . 2 . 3 . ]" 2 6 1 13 GLU O 1 28 THR N 2.900 2.800 3.300 2.776 2.742 2.840 0.058 26 0 "[ . 1 . 2 . 3 . ]" 2 7 1 13 GLU H 1 28 THR O 2.150 . 2.300 1.850 1.783 1.946 0.017 21 0 "[ . 1 . 2 . 3 . ]" 2 8 1 13 GLU N 1 28 THR O 2.900 2.800 3.300 2.782 2.750 2.832 0.050 13 0 "[ . 1 . 2 . 3 . ]" 2 9 1 15 LYS O 1 26 ASP H 2.150 . 2.300 1.937 1.852 1.994 . 0 0 "[ . 1 . 2 . 3 . ]" 2 10 1 15 LYS O 1 26 ASP N 2.900 2.800 3.300 2.724 2.685 2.758 0.115 11 0 "[ . 1 . 2 . 3 . ]" 2 11 1 15 LYS H 1 26 ASP O 2.150 . 2.300 2.222 1.881 2.343 0.043 2 0 "[ . 1 . 2 . 3 . ]" 2 12 1 15 LYS N 1 26 ASP O 2.900 2.800 3.300 3.074 2.798 3.180 0.002 17 0 "[ . 1 . 2 . 3 . ]" 2 13 1 17 ASN H 1 24 GLU O 2.150 . 2.300 2.326 2.279 2.362 0.062 10 0 "[ . 1 . 2 . 3 . ]" 2 14 1 17 ASN N 1 24 GLU O 2.900 2.800 3.300 3.162 3.118 3.197 . 0 0 "[ . 1 . 2 . 3 . ]" 2 15 1 17 ASN O 1 24 GLU H 2.150 . 2.300 1.888 1.826 1.975 . 0 0 "[ . 1 . 2 . 3 . ]" 2 16 1 17 ASN O 1 24 GLU N 2.900 2.800 3.300 2.800 2.736 2.866 0.064 12 0 "[ . 1 . 2 . 3 . ]" 2 17 1 23 ALA O 1 83 VAL H 2.150 . 2.300 2.152 2.030 2.276 . 0 0 "[ . 1 . 2 . 3 . ]" 2 18 1 23 ALA O 1 83 VAL N 2.900 2.800 3.300 2.927 2.805 3.047 . 0 0 "[ . 1 . 2 . 3 . ]" 2 19 1 25 TYR O 1 81 PHE H 2.150 . 2.300 2.296 2.172 2.347 0.047 35 0 "[ . 1 . 2 . 3 . ]" 2 20 1 25 TYR O 1 81 PHE N 2.900 2.800 3.300 3.174 3.034 3.260 . 0 0 "[ . 1 . 2 . 3 . ]" 2 21 1 25 TYR H 1 81 PHE O 2.150 . 2.300 2.070 2.016 2.151 . 0 0 "[ . 1 . 2 . 3 . ]" 2 22 1 25 TYR N 1 81 PHE O 2.900 2.800 3.300 2.758 2.729 2.794 0.071 27 0 "[ . 1 . 2 . 3 . ]" 2 23 1 27 VAL O 1 79 PHE H 2.150 . 2.300 2.090 2.025 2.167 . 0 0 "[ . 1 . 2 . 3 . ]" 2 24 1 27 VAL O 1 79 PHE N 2.900 2.800 3.300 3.043 2.976 3.124 . 0 0 "[ . 1 . 2 . 3 . ]" 2 25 1 27 VAL H 1 79 PHE O 2.150 . 2.300 1.812 1.751 1.992 0.049 30 0 "[ . 1 . 2 . 3 . ]" 2 26 1 27 VAL N 1 79 PHE O 2.900 2.800 3.300 2.669 2.624 2.704 0.176 4 0 "[ . 1 . 2 . 3 . ]" 2 27 1 29 LEU O 1 77 ALA H 2.150 . 2.300 2.236 1.993 2.338 0.038 34 0 "[ . 1 . 2 . 3 . ]" 2 28 1 29 LEU O 1 77 ALA N 2.900 2.800 3.300 3.068 2.902 3.208 . 0 0 "[ . 1 . 2 . 3 . ]" 2 29 1 29 LEU H 1 77 ALA O 2.150 . 2.300 2.134 1.911 2.306 0.006 2 0 "[ . 1 . 2 . 3 . ]" 2 30 1 29 LEU N 1 77 ALA O 2.900 2.800 3.300 3.006 2.800 3.182 . 0 0 "[ . 1 . 2 . 3 . ]" 2 31 1 38 THR O 1 97 GLU H 2.150 . 2.300 1.862 1.792 1.907 0.008 24 0 "[ . 1 . 2 . 3 . ]" 2 32 1 38 THR O 1 97 GLU N 2.900 2.800 3.300 2.768 2.725 2.804 0.075 16 0 "[ . 1 . 2 . 3 . ]" 2 33 1 38 THR H 1 97 GLU O 2.150 . 2.300 2.030 1.916 2.205 . 0 0 "[ . 1 . 2 . 3 . ]" 2 34 1 38 THR N 1 97 GLU O 2.900 2.800 3.300 2.841 2.751 3.019 0.049 5 0 "[ . 1 . 2 . 3 . ]" 2 35 1 40 LYS O 1 95 THR H 2.150 . 2.300 1.930 1.794 2.087 0.006 15 0 "[ . 1 . 2 . 3 . ]" 2 36 1 40 LYS O 1 95 THR N 2.900 2.800 3.300 2.780 2.732 2.822 0.068 15 0 "[ . 1 . 2 . 3 . ]" 2 37 1 40 LYS H 1 95 THR O 2.150 . 2.300 2.101 1.954 2.306 0.006 5 0 "[ . 1 . 2 . 3 . ]" 2 38 1 40 LYS N 1 95 THR O 2.900 2.800 3.300 2.778 2.717 2.875 0.083 9 0 "[ . 1 . 2 . 3 . ]" 2 39 1 42 LYS O 1 93 GLU H 2.150 . 2.300 2.342 2.284 2.381 0.081 6 0 "[ . 1 . 2 . 3 . ]" 2 40 1 42 LYS O 1 93 GLU N 2.900 2.800 3.300 3.265 3.208 3.299 . 0 0 "[ . 1 . 2 . 3 . ]" 2 41 1 42 LYS H 1 93 GLU O 2.150 . 2.300 2.017 1.895 2.178 . 0 0 "[ . 1 . 2 . 3 . ]" 2 42 1 42 LYS N 1 93 GLU O 2.900 2.800 3.300 2.765 2.693 2.912 0.107 18 0 "[ . 1 . 2 . 3 . ]" 2 43 1 48 THR O 1 84 ASN H 2.150 . 2.300 1.882 1.804 1.944 . 0 0 "[ . 1 . 2 . 3 . ]" 2 44 1 48 THR O 1 84 ASN N 2.900 2.800 3.300 2.766 2.722 2.822 0.078 3 0 "[ . 1 . 2 . 3 . ]" 2 45 1 53 TRP O 1 80 GLY H 2.150 . 2.300 2.288 2.153 2.363 0.063 35 0 "[ . 1 . 2 . 3 . ]" 2 46 1 53 TRP O 1 80 GLY N 2.900 2.800 3.300 3.164 3.022 3.238 . 0 0 "[ . 1 . 2 . 3 . ]" 2 47 1 53 TRP H 1 80 GLY O 2.150 . 2.300 2.115 1.989 2.181 . 0 0 "[ . 1 . 2 . 3 . ]" 2 48 1 53 TRP N 1 80 GLY O 2.900 2.800 3.300 2.950 2.838 3.040 . 0 0 "[ . 1 . 2 . 3 . ]" 2 49 1 56 ASN O 1 67 THR H 2.150 . 2.300 2.378 2.345 2.409 0.109 13 0 "[ . 1 . 2 . 3 . ]" 2 50 1 56 ASN O 1 67 THR N 2.900 2.800 3.300 3.171 3.062 3.252 . 0 0 "[ . 1 . 2 . 3 . ]" 2 51 1 56 ASN H 1 67 THR O 2.150 . 2.300 2.013 1.869 2.118 . 0 0 "[ . 1 . 2 . 3 . ]" 2 52 1 56 ASN N 1 67 THR O 2.900 2.800 3.300 2.904 2.793 2.988 0.007 9 0 "[ . 1 . 2 . 3 . ]" 2 53 1 58 GLN O 1 65 ILE H 2.150 . 2.300 2.399 2.348 2.481 0.181 14 0 "[ . 1 . 2 . 3 . ]" 2 54 1 58 GLN O 1 65 ILE N 2.900 2.800 3.300 3.215 3.177 3.282 . 0 0 "[ . 1 . 2 . 3 . ]" 2 55 1 58 GLN H 1 65 ILE O 2.150 . 2.300 2.082 1.882 2.240 . 0 0 "[ . 1 . 2 . 3 . ]" 2 56 1 58 GLN N 1 65 ILE O 2.900 2.800 3.300 2.776 2.702 2.919 0.098 35 0 "[ . 1 . 2 . 3 . ]" 2 57 1 41 VAL H 1 64 VAL O 2.150 . 2.300 1.881 1.762 1.998 0.038 7 0 "[ . 1 . 2 . 3 . ]" 2 58 1 41 VAL N 1 64 VAL O 2.900 2.800 3.300 2.744 2.686 2.797 0.114 26 0 "[ . 1 . 2 . 3 . ]" 2 59 1 41 VAL O 1 64 VAL H 2.150 . 2.300 2.214 2.080 2.307 0.007 12 0 "[ . 1 . 2 . 3 . ]" 2 60 1 41 VAL O 1 64 VAL N 2.900 2.800 3.300 2.888 2.789 2.996 0.011 18 0 "[ . 1 . 2 . 3 . ]" 2 61 1 39 VAL H 1 66 PHE O 2.150 . 2.300 1.815 1.776 1.908 0.024 19 0 "[ . 1 . 2 . 3 . ]" 2 62 1 39 VAL N 1 66 PHE O 2.900 2.800 3.300 2.739 2.693 2.800 0.107 26 0 "[ . 1 . 2 . 3 . ]" 2 63 1 39 VAL O 1 66 PHE H 2.150 . 2.300 2.039 1.812 2.201 . 0 0 "[ . 1 . 2 . 3 . ]" 2 64 1 39 VAL O 1 66 PHE N 2.900 2.800 3.300 2.842 2.765 2.927 0.035 20 0 "[ . 1 . 2 . 3 . ]" 2 stop_ save_
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