NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | cing | stage | program | type | subtype | subsubtype |
373070 | 1djm | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1djm 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 1041 _Distance_constraint_stats_list.Viol_count 3108 _Distance_constraint_stats_list.Viol_total 12938.716 _Distance_constraint_stats_list.Viol_max 0.390 _Distance_constraint_stats_list.Viol_rms 0.0590 _Distance_constraint_stats_list.Viol_average_all_restraints 0.0170 _Distance_constraint_stats_list.Viol_average_violations_only 0.1542 _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 3 ASP 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 4 LYS 0.750 0.082 9 0 "[ . 1 . 2 . ]" 1 5 GLU 0.716 0.082 8 0 "[ . 1 . 2 . ]" 1 6 LEU 0.801 0.082 9 0 "[ . 1 . 2 . ]" 1 7 LYS 0.870 0.086 9 0 "[ . 1 . 2 . ]" 1 8 PHE 6.462 0.273 19 0 "[ . 1 . 2 . ]" 1 9 LEU 1.262 0.066 1 0 "[ . 1 . 2 . ]" 1 10 VAL 13.474 0.337 14 0 "[ . 1 . 2 . ]" 1 11 VAL 21.699 0.368 22 0 "[ . 1 . 2 . ]" 1 12 ASP 0.007 0.007 8 0 "[ . 1 . 2 . ]" 1 13 ASP 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 14 PHE 0.073 0.073 26 0 "[ . 1 . 2 . ]" 1 15 SER 11.913 0.294 18 0 "[ . 1 . 2 . ]" 1 16 THR 9.479 0.363 4 0 "[ . 1 . 2 . ]" 1 17 MET 4.722 0.263 27 0 "[ . 1 . 2 . ]" 1 18 ARG 20.690 0.370 8 0 "[ . 1 . 2 . ]" 1 19 ARG 11.471 0.345 3 0 "[ . 1 . 2 . ]" 1 20 ILE 14.705 0.363 4 0 "[ . 1 . 2 . ]" 1 21 VAL 12.696 0.263 27 0 "[ . 1 . 2 . ]" 1 22 ARG 19.328 0.370 8 0 "[ . 1 . 2 . ]" 1 23 ASN 20.994 0.352 16 0 "[ . 1 . 2 . ]" 1 24 LEU 5.150 0.269 11 0 "[ . 1 . 2 . ]" 1 25 LEU 7.855 0.262 12 0 "[ . 1 . 2 . ]" 1 26 LYS 10.664 0.359 16 0 "[ . 1 . 2 . ]" 1 27 GLU 9.763 0.352 16 0 "[ . 1 . 2 . ]" 1 28 LEU 1.845 0.089 26 0 "[ . 1 . 2 . ]" 1 29 GLY 0.336 0.089 26 0 "[ . 1 . 2 . ]" 1 30 PHE 0.317 0.080 7 0 "[ . 1 . 2 . ]" 1 31 ASN 0.234 0.080 22 0 "[ . 1 . 2 . ]" 1 32 ASN 0.234 0.080 22 0 "[ . 1 . 2 . ]" 1 33 VAL 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 34 GLU 19.255 0.337 14 0 "[ . 1 . 2 . ]" 1 35 GLU 0.127 0.064 7 0 "[ . 1 . 2 . ]" 1 36 ALA 0.372 0.085 7 0 "[ . 1 . 2 . ]" 1 37 GLU 1.516 0.099 13 0 "[ . 1 . 2 . ]" 1 38 ASP 5.553 0.203 22 0 "[ . 1 . 2 . ]" 1 39 GLY 16.599 0.379 8 0 "[ . 1 . 2 . ]" 1 40 VAL 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 41 ASP 9.523 0.353 23 0 "[ . 1 . 2 . ]" 1 42 ALA 14.203 0.357 24 0 "[ . 1 . 2 . ]" 1 43 LEU 31.791 0.390 22 0 "[ . 1 . 2 . ]" 1 44 ASN 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 45 LYS 7.542 0.353 23 0 "[ . 1 . 2 . ]" 1 46 LEU 12.049 0.357 24 0 "[ . 1 . 2 . ]" 1 47 GLN 16.402 0.390 22 0 "[ . 1 . 2 . ]" 1 48 ALA 0.577 0.074 5 0 "[ . 1 . 2 . ]" 1 49 GLY 0.215 0.073 8 0 "[ . 1 . 2 . ]" 1 50 GLY 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 51 TYR 0.287 0.081 21 0 "[ . 1 . 2 . ]" 1 52 GLY 0.685 0.086 9 0 "[ . 1 . 2 . ]" 1 53 PHE 0.103 0.062 12 0 "[ . 1 . 2 . ]" 1 54 VAL 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 55 ILE 7.541 0.264 15 0 "[ . 1 . 2 . ]" 1 56 SER 21.164 0.355 23 0 "[ . 1 . 2 . ]" 1 57 ASP 11.937 0.368 22 0 "[ . 1 . 2 . ]" 1 58 TRP 9.499 0.372 17 0 "[ . 1 . 2 . ]" 1 59 ASN 0.634 0.073 27 0 "[ . 1 . 2 . ]" 1 60 MET 1.553 0.086 20 0 "[ . 1 . 2 . ]" 1 61 PRO 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 62 ASN 1.470 0.082 3 0 "[ . 1 . 2 . ]" 1 63 MET 0.840 0.082 3 0 "[ . 1 . 2 . ]" 1 64 ASP 9.749 0.343 4 0 "[ . 1 . 2 . ]" 1 65 GLY 22.652 0.372 17 0 "[ . 1 . 2 . ]" 1 66 LEU 5.419 0.332 5 0 "[ . 1 . 2 . ]" 1 67 GLU 6.740 0.245 16 0 "[ . 1 . 2 . ]" 1 68 LEU 20.712 0.357 10 0 "[ . 1 . 2 . ]" 1 69 LEU 16.988 0.365 17 0 "[ . 1 . 2 . ]" 1 70 LYS 7.331 0.332 5 0 "[ . 1 . 2 . ]" 1 71 THR 6.647 0.245 16 0 "[ . 1 . 2 . ]" 1 72 ILE 12.732 0.357 10 0 "[ . 1 . 2 . ]" 1 73 ARG 1.983 0.143 15 0 "[ . 1 . 2 . ]" 1 74 ALA 0.035 0.035 24 0 "[ . 1 . 2 . ]" 1 75 ASP 1.164 0.099 24 0 "[ . 1 . 2 . ]" 1 76 GLY 0.234 0.082 24 0 "[ . 1 . 2 . ]" 1 77 ALA 0.234 0.082 24 0 "[ . 1 . 2 . ]" 1 78 MET 2.140 0.099 24 0 "[ . 1 . 2 . ]" 1 79 SER 2.065 0.089 19 0 "[ . 1 . 2 . ]" 1 80 ALA 0.027 0.018 1 0 "[ . 1 . 2 . ]" 1 81 LEU 0.027 0.018 1 0 "[ . 1 . 2 . ]" 1 82 PRO 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 83 VAL 10.744 0.317 12 0 "[ . 1 . 2 . ]" 1 84 LEU 15.484 0.355 23 0 "[ . 1 . 2 . ]" 1 85 MET 22.352 0.378 15 0 "[ . 1 . 2 . ]" 1 86 VAL 5.680 0.292 7 0 "[ . 1 . 2 . ]" 1 87 THR 10.889 0.272 4 0 "[ . 1 . 2 . ]" 1 88 ALA 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 89 GLU 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 90 ALA 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 91 LYS 16.313 0.375 4 0 "[ . 1 . 2 . ]" 1 92 LYS 7.359 0.267 1 0 "[ . 1 . 2 . ]" 1 93 GLU 5.635 0.331 27 0 "[ . 1 . 2 . ]" 1 94 ASN 6.351 0.306 15 0 "[ . 1 . 2 . ]" 1 95 ILE 29.017 0.375 4 0 "[ . 1 . 2 . ]" 1 96 ILE 7.869 0.267 1 0 "[ . 1 . 2 . ]" 1 97 ALA 10.424 0.331 27 0 "[ . 1 . 2 . ]" 1 98 ALA 11.447 0.306 15 0 "[ . 1 . 2 . ]" 1 99 ALA 13.959 0.360 2 0 "[ . 1 . 2 . ]" 1 100 GLN 0.579 0.070 1 0 "[ . 1 . 2 . ]" 1 101 ALA 5.346 0.238 10 0 "[ . 1 . 2 . ]" 1 102 GLY 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 103 ALA 7.099 0.227 18 0 "[ . 1 . 2 . ]" 1 104 SER 10.495 0.317 12 0 "[ . 1 . 2 . ]" 1 105 GLY 16.350 0.378 15 0 "[ . 1 . 2 . ]" 1 106 TYR 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 107 VAL 6.002 0.264 16 0 "[ . 1 . 2 . ]" 1 108 VAL 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 109 LYS 10.939 0.272 4 0 "[ . 1 . 2 . ]" 1 110 PRO 0.145 0.095 11 0 "[ . 1 . 2 . ]" 1 111 PHE 0.712 0.095 11 0 "[ . 1 . 2 . ]" 1 112 THR 14.882 0.374 12 0 "[ . 1 . 2 . ]" 1 113 ALA 5.049 0.324 6 0 "[ . 1 . 2 . ]" 1 114 ALA 0.095 0.058 16 0 "[ . 1 . 2 . ]" 1 115 THR 2.013 0.084 6 0 "[ . 1 . 2 . ]" 1 116 LEU 24.044 0.374 12 0 "[ . 1 . 2 . ]" 1 117 GLU 12.077 0.330 21 0 "[ . 1 . 2 . ]" 1 118 GLU 9.814 0.353 12 0 "[ . 1 . 2 . ]" 1 119 LYS 16.270 0.370 25 0 "[ . 1 . 2 . ]" 1 120 LEU 13.936 0.361 27 0 "[ . 1 . 2 . ]" 1 121 ASN 21.081 0.379 12 0 "[ . 1 . 2 . ]" 1 122 LYS 9.662 0.353 12 0 "[ . 1 . 2 . ]" 1 123 ILE 32.727 0.385 27 0 "[ . 1 . 2 . ]" 1 124 PHE 5.401 0.155 7 0 "[ . 1 . 2 . ]" 1 125 GLU 16.037 0.379 12 0 "[ . 1 . 2 . ]" 1 126 LYS 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 127 LEU 0.925 0.078 8 0 "[ . 1 . 2 . ]" 1 128 GLY 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 129 MET 19.499 0.385 27 0 "[ . 1 . 2 . ]" stop_ loop_ _Distance_constraint_stats.Restraint_ID _Distance_constraint_stats.Atom_1_entity_assembly_ID _Distance_constraint_stats.Atom_1_comp_index_ID _Distance_constraint_stats.Atom_1_comp_ID _Distance_constraint_stats.Atom_1_ID _Distance_constraint_stats.Atom_2_entity_assembly_ID _Distance_constraint_stats.Atom_2_comp_index_ID _Distance_constraint_stats.Atom_2_comp_ID _Distance_constraint_stats.Atom_2_ID _Distance_constraint_stats.Node_1_distance_val _Distance_constraint_stats.Node_1_distance_lower_bound_val _Distance_constraint_stats.Node_1_distance_upper_bound_val _Distance_constraint_stats.Distance_average _Distance_constraint_stats.Distance_minimum _Distance_constraint_stats.Distance_maximum _Distance_constraint_stats.Max_violation _Distance_constraint_stats.Max_violation_model_number _Distance_constraint_stats.Over_cutoff_violation_count _Distance_constraint_stats.Over_cutoff_viol_per_model _Distance_constraint_stats.Distance_constraint_stats_ID 1 1 3 ASP HA 1 5 GLU H . . 5.000 3.807 3.040 4.164 . 0 0 "[ . 1 . 2 . ]" 1 2 1 3 ASP QB 1 6 LEU H . . 5.000 4.157 3.292 4.570 . 0 0 "[ . 1 . 2 . ]" 1 3 1 4 LYS H 1 4 LYS HD2 . . 5.000 4.136 2.325 5.075 0.075 19 0 "[ . 1 . 2 . ]" 1 4 1 4 LYS H 1 4 LYS HD3 . . 5.000 3.894 1.859 5.057 0.057 6 0 "[ . 1 . 2 . ]" 1 5 1 4 LYS H 1 5 GLU H . . 5.000 2.694 2.217 3.547 . 0 0 "[ . 1 . 2 . ]" 1 6 1 4 LYS HA 1 4 LYS QD . . 5.000 3.449 2.091 4.470 . 0 0 "[ . 1 . 2 . ]" 1 7 1 4 LYS HA 1 6 LEU H . . 5.000 4.575 3.292 5.082 0.082 9 0 "[ . 1 . 2 . ]" 1 8 1 4 LYS QB 1 4 LYS QD . . 3.300 2.264 2.120 2.535 . 0 0 "[ . 1 . 2 . ]" 1 9 1 5 GLU H 1 5 GLU HA . . 2.900 2.361 2.184 2.963 0.063 21 0 "[ . 1 . 2 . ]" 1 10 1 5 GLU H 1 5 GLU HG2 . . 5.000 3.856 2.046 5.082 0.082 8 0 "[ . 1 . 2 . ]" 1 11 1 5 GLU H 1 5 GLU HG3 . . 5.000 3.545 2.662 4.661 . 0 0 "[ . 1 . 2 . ]" 1 12 1 5 GLU H 1 6 LEU H . . 2.900 2.737 1.718 2.974 0.074 7 0 "[ . 1 . 2 . ]" 1 13 1 5 GLU H 1 6 LEU QB . . 5.880 4.406 3.506 4.774 . 0 0 "[ . 1 . 2 . ]" 1 14 1 6 LEU H 1 7 LYS H . . 5.000 4.451 4.206 4.641 . 0 0 "[ . 1 . 2 . ]" 1 15 1 6 LEU HA 1 7 LYS H . . 2.900 2.136 2.033 2.227 . 0 0 "[ . 1 . 2 . ]" 1 16 1 6 LEU MD1 1 7 LYS H . . 5.000 4.066 2.515 4.258 . 0 0 "[ . 1 . 2 . ]" 1 17 1 6 LEU MD1 1 52 GLY H . . 5.000 3.729 2.778 4.123 . 0 0 "[ . 1 . 2 . ]" 1 18 1 6 LEU MD1 1 52 GLY QA . . 3.300 2.057 1.908 2.251 . 0 0 "[ . 1 . 2 . ]" 1 19 1 6 LEU MD2 1 7 LYS H . . 5.000 3.961 3.332 4.283 . 0 0 "[ . 1 . 2 . ]" 1 20 1 6 LEU MD2 1 8 PHE QD . . 5.000 2.719 2.274 3.468 . 0 0 "[ . 1 . 2 . ]" 1 21 1 6 LEU MD2 1 8 PHE HZ . . 5.000 3.861 3.223 4.269 . 0 0 "[ . 1 . 2 . ]" 1 22 1 6 LEU MD2 1 52 GLY H . . 5.000 3.735 2.927 4.158 . 0 0 "[ . 1 . 2 . ]" 1 23 1 6 LEU HG 1 7 LYS H . . 3.300 2.849 2.638 3.007 . 0 0 "[ . 1 . 2 . ]" 1 24 1 7 LYS H 1 8 PHE H . . 5.000 4.562 4.403 4.695 . 0 0 "[ . 1 . 2 . ]" 1 25 1 7 LYS H 1 51 TYR HA . . 5.000 3.332 2.283 5.011 0.011 21 0 "[ . 1 . 2 . ]" 1 26 1 7 LYS H 1 52 GLY H . . 5.000 3.276 2.609 4.293 . 0 0 "[ . 1 . 2 . ]" 1 27 1 7 LYS HA 1 8 PHE H . . 2.900 2.243 2.086 2.464 . 0 0 "[ . 1 . 2 . ]" 1 28 1 7 LYS HA 1 32 ASN QB . . 3.300 2.685 1.996 3.109 . 0 0 "[ . 1 . 2 . ]" 1 29 1 7 LYS HB2 1 8 PHE H . . 5.000 3.971 2.010 4.420 . 0 0 "[ . 1 . 2 . ]" 1 30 1 7 LYS HB2 1 51 TYR HA . . 5.000 3.754 2.321 5.061 0.061 21 0 "[ . 1 . 2 . ]" 1 31 1 7 LYS HB2 1 52 GLY H . . 5.000 4.660 3.937 5.080 0.080 8 0 "[ . 1 . 2 . ]" 1 32 1 7 LYS HB3 1 8 PHE H . . 5.000 3.692 2.562 4.256 . 0 0 "[ . 1 . 2 . ]" 1 33 1 7 LYS HB3 1 51 TYR HA . . 5.000 3.065 2.047 5.081 0.081 21 0 "[ . 1 . 2 . ]" 1 34 1 7 LYS HB3 1 52 GLY H . . 5.000 3.974 2.865 5.086 0.086 9 0 "[ . 1 . 2 . ]" 1 35 1 7 LYS QD 1 8 PHE H . . 5.000 4.103 3.265 4.601 . 0 0 "[ . 1 . 2 . ]" 1 36 1 7 LYS QE 1 34 GLU QG . . 5.000 3.173 1.789 4.129 . 0 0 "[ . 1 . 2 . ]" 1 37 1 7 LYS QE 1 51 TYR QE . . 5.000 3.618 2.526 4.314 . 0 0 "[ . 1 . 2 . ]" 1 38 1 7 LYS QG 1 8 PHE H . . 3.300 2.655 2.373 3.085 . 0 0 "[ . 1 . 2 . ]" 1 39 1 8 PHE H 1 9 LEU H . . 5.000 4.311 3.894 4.626 . 0 0 "[ . 1 . 2 . ]" 1 40 1 8 PHE H 1 33 VAL HA . . 5.000 2.419 1.842 3.063 . 0 0 "[ . 1 . 2 . ]" 1 41 1 8 PHE H 1 33 VAL QG . . 5.000 3.626 2.614 3.980 . 0 0 "[ . 1 . 2 . ]" 1 42 1 8 PHE HA 1 9 LEU H . . 2.900 2.329 2.252 2.443 . 0 0 "[ . 1 . 2 . ]" 1 43 1 8 PHE HA 1 53 PHE H . . 5.000 2.981 2.381 3.633 . 0 0 "[ . 1 . 2 . ]" 1 44 1 8 PHE QB 1 33 VAL QG . . 5.000 2.078 1.929 2.264 . 0 0 "[ . 1 . 2 . ]" 1 45 1 8 PHE QD 1 25 LEU MD1 . . 5.000 2.471 2.201 2.790 . 0 0 "[ . 1 . 2 . ]" 1 46 1 8 PHE QD 1 25 LEU MD2 . . 5.000 3.116 2.546 3.694 . 0 0 "[ . 1 . 2 . ]" 1 47 1 8 PHE QD 1 53 PHE QR . . 5.000 3.388 3.099 3.621 . 0 0 "[ . 1 . 2 . ]" 1 48 1 8 PHE QD 1 55 ILE MD . . 5.000 2.071 1.953 2.238 . 0 0 "[ . 1 . 2 . ]" 1 49 1 8 PHE QE 1 25 LEU MD2 . . 5.000 2.294 2.147 2.608 . 0 0 "[ . 1 . 2 . ]" 1 50 1 8 PHE QE 1 55 ILE MD . . 5.000 2.431 2.129 2.836 . 0 0 "[ . 1 . 2 . ]" 1 51 1 8 PHE QE 1 120 LEU MD2 . . 5.000 2.891 2.133 3.718 . 0 0 "[ . 1 . 2 . ]" 1 52 1 8 PHE HZ 1 25 LEU MD2 . . 5.000 3.112 2.519 3.714 . 0 0 "[ . 1 . 2 . ]" 1 53 1 8 PHE HZ 1 120 LEU MD2 . . 5.000 2.812 2.344 3.491 . 0 0 "[ . 1 . 2 . ]" 1 54 1 8 PHE O 1 34 GLU H . . 1.800 1.921 1.774 2.073 0.273 19 0 "[ . 1 . 2 . ]" 1 55 1 8 PHE O 1 34 GLU N . . 2.700 2.818 2.729 2.948 0.248 19 0 "[ . 1 . 2 . ]" 1 56 1 9 LEU H 1 9 LEU HA . . 2.900 2.947 2.916 2.966 0.066 1 0 "[ . 1 . 2 . ]" 1 57 1 9 LEU HA 1 10 VAL H . . 2.900 2.216 2.097 2.280 . 0 0 "[ . 1 . 2 . ]" 1 58 1 9 LEU HA 1 10 VAL MG2 . . 5.000 3.519 3.172 3.793 . 0 0 "[ . 1 . 2 . ]" 1 59 1 9 LEU HA 1 34 GLU H . . 5.000 2.755 2.376 3.329 . 0 0 "[ . 1 . 2 . ]" 1 60 1 9 LEU MD1 1 10 VAL H . . 5.000 2.711 2.311 3.232 . 0 0 "[ . 1 . 2 . ]" 1 61 1 9 LEU MD1 1 34 GLU QB . . 3.300 2.093 1.974 2.328 . 0 0 "[ . 1 . 2 . ]" 1 62 1 9 LEU MD1 1 34 GLU QG . . 5.000 3.461 2.281 3.792 . 0 0 "[ . 1 . 2 . ]" 1 63 1 9 LEU MD1 1 35 GLU HA . . 5.000 2.925 2.390 3.637 . 0 0 "[ . 1 . 2 . ]" 1 64 1 9 LEU MD1 1 36 ALA MB . . 5.000 2.365 2.065 2.848 . 0 0 "[ . 1 . 2 . ]" 1 65 1 9 LEU MD1 1 42 ALA HA . . 5.000 3.584 3.253 3.807 . 0 0 "[ . 1 . 2 . ]" 1 66 1 9 LEU MD1 1 45 LYS QD . . 5.000 3.067 2.209 3.654 . 0 0 "[ . 1 . 2 . ]" 1 67 1 9 LEU MD1 1 45 LYS QG . . 5.000 2.298 2.022 2.934 . 0 0 "[ . 1 . 2 . ]" 1 68 1 9 LEU MD1 1 51 TYR QE . . 5.000 2.479 2.099 3.138 . 0 0 "[ . 1 . 2 . ]" 1 69 1 9 LEU MD2 1 10 VAL H . . 5.000 4.273 4.219 4.300 . 0 0 "[ . 1 . 2 . ]" 1 70 1 9 LEU MD2 1 11 VAL MG2 . . 5.000 2.222 2.080 2.433 . 0 0 "[ . 1 . 2 . ]" 1 71 1 9 LEU MD2 1 36 ALA MB . . 5.000 2.467 2.187 2.727 . 0 0 "[ . 1 . 2 . ]" 1 72 1 9 LEU MD2 1 42 ALA HA . . 3.300 2.106 1.960 2.355 . 0 0 "[ . 1 . 2 . ]" 1 73 1 9 LEU MD2 1 42 ALA MB . . 5.000 2.235 2.029 2.530 . 0 0 "[ . 1 . 2 . ]" 1 74 1 9 LEU MD2 1 45 LYS QG . . 5.000 3.062 2.376 3.497 . 0 0 "[ . 1 . 2 . ]" 1 75 1 9 LEU MD2 1 46 LEU MD2 . . 3.300 2.085 1.970 2.197 . 0 0 "[ . 1 . 2 . ]" 1 76 1 9 LEU HG 1 10 VAL H . . 5.000 2.678 2.558 2.781 . 0 0 "[ . 1 . 2 . ]" 1 77 1 9 LEU HG 1 11 VAL QG . . 5.000 2.136 2.023 2.642 . 0 0 "[ . 1 . 2 . ]" 1 78 1 10 VAL H 1 10 VAL HB . . 2.900 2.742 2.511 2.909 0.009 26 0 "[ . 1 . 2 . ]" 1 79 1 10 VAL H 1 34 GLU HB2 . . 5.000 4.733 4.003 5.082 0.082 24 0 "[ . 1 . 2 . ]" 1 80 1 10 VAL H 1 34 GLU HB3 . . 5.000 4.439 3.551 5.088 0.088 21 0 "[ . 1 . 2 . ]" 1 81 1 10 VAL H 1 34 GLU O . . 1.800 2.012 1.870 2.083 0.283 13 0 "[ . 1 . 2 . ]" 1 82 1 10 VAL H 1 35 GLU HA . . 3.300 2.652 1.997 3.364 0.064 7 0 "[ . 1 . 2 . ]" 1 83 1 10 VAL HA 1 11 VAL H . . 2.900 2.214 2.171 2.302 . 0 0 "[ . 1 . 2 . ]" 1 84 1 10 VAL HA 1 55 ILE H . . 5.000 3.262 2.956 3.678 . 0 0 "[ . 1 . 2 . ]" 1 85 1 10 VAL HB 1 21 VAL HB . . 5.000 4.903 4.557 5.084 0.084 23 0 "[ . 1 . 2 . ]" 1 86 1 10 VAL HB 1 35 GLU QG . . 5.000 3.635 2.195 4.576 . 0 0 "[ . 1 . 2 . ]" 1 87 1 10 VAL MG1 1 11 VAL H . . 5.000 3.227 2.942 3.603 . 0 0 "[ . 1 . 2 . ]" 1 88 1 10 VAL MG1 1 18 ARG HA . . 3.300 2.453 2.036 2.821 . 0 0 "[ . 1 . 2 . ]" 1 89 1 10 VAL MG1 1 18 ARG QG . . 5.000 2.575 2.017 3.729 . 0 0 "[ . 1 . 2 . ]" 1 90 1 10 VAL MG1 1 55 ILE MG . . 5.000 2.713 2.138 3.135 . 0 0 "[ . 1 . 2 . ]" 1 91 1 10 VAL MG2 1 22 ARG HA . . 5.000 3.739 2.897 4.146 . 0 0 "[ . 1 . 2 . ]" 1 92 1 10 VAL MG2 1 55 ILE MD . . 5.000 2.667 2.108 3.277 . 0 0 "[ . 1 . 2 . ]" 1 93 1 10 VAL N 1 34 GLU O . . 2.700 2.923 2.810 3.037 0.337 14 0 "[ . 1 . 2 . ]" 1 94 1 11 VAL H 1 11 VAL MG2 . . 3.300 2.505 2.057 2.617 . 0 0 "[ . 1 . 2 . ]" 1 95 1 11 VAL H 1 12 ASP H . . 5.000 3.347 2.674 4.136 . 0 0 "[ . 1 . 2 . ]" 1 96 1 11 VAL H 1 55 ILE HB . . 5.000 3.964 3.592 4.399 . 0 0 "[ . 1 . 2 . ]" 1 97 1 11 VAL H 1 55 ILE O . . 1.800 1.905 1.810 2.054 0.254 19 0 "[ . 1 . 2 . ]" 1 98 1 11 VAL H 1 56 SER HA . . 5.000 2.455 2.164 2.746 . 0 0 "[ . 1 . 2 . ]" 1 99 1 11 VAL HA 1 11 VAL MG1 . . 3.300 2.265 2.198 2.332 . 0 0 "[ . 1 . 2 . ]" 1 100 1 11 VAL HA 1 12 ASP H . . 2.900 2.505 2.200 2.907 0.007 8 0 "[ . 1 . 2 . ]" 1 101 1 11 VAL HA 1 36 ALA H . . 3.300 3.136 2.398 3.385 0.085 7 0 "[ . 1 . 2 . ]" 1 102 1 11 VAL HA 1 36 ALA MB . . 5.000 3.865 2.349 4.027 . 0 0 "[ . 1 . 2 . ]" 1 103 1 11 VAL HB 1 39 GLY H . . 5.000 5.063 4.934 5.089 0.089 25 0 "[ . 1 . 2 . ]" 1 104 1 11 VAL HB 1 42 ALA MB . . 5.000 3.273 2.771 3.822 . 0 0 "[ . 1 . 2 . ]" 1 105 1 11 VAL HB 1 56 SER HA . . 5.000 3.008 2.365 3.630 . 0 0 "[ . 1 . 2 . ]" 1 106 1 11 VAL HB 1 57 ASP H . . 5.000 3.784 2.803 4.342 . 0 0 "[ . 1 . 2 . ]" 1 107 1 11 VAL QG 1 36 ALA H . . 5.000 2.377 1.884 3.442 . 0 0 "[ . 1 . 2 . ]" 1 108 1 11 VAL QG 1 42 ALA HA . . 5.000 2.882 2.528 3.244 . 0 0 "[ . 1 . 2 . ]" 1 109 1 11 VAL QG 1 42 ALA MB . . 5.000 1.895 1.790 1.992 . 0 0 "[ . 1 . 2 . ]" 1 110 1 11 VAL QG 1 56 SER HA . . 5.000 3.565 2.719 3.951 . 0 0 "[ . 1 . 2 . ]" 1 111 1 11 VAL MG1 1 36 ALA MB . . 5.000 2.103 1.990 2.222 . 0 0 "[ . 1 . 2 . ]" 1 112 1 11 VAL MG1 1 38 ASP H . . 3.300 2.810 2.694 2.857 . 0 0 "[ . 1 . 2 . ]" 1 113 1 11 VAL MG1 1 39 GLY H . . 5.000 3.315 2.874 3.554 . 0 0 "[ . 1 . 2 . ]" 1 114 1 11 VAL MG1 1 42 ALA H . . 5.000 3.606 3.341 3.920 . 0 0 "[ . 1 . 2 . ]" 1 115 1 11 VAL MG2 1 42 ALA H . . 5.000 3.922 3.845 4.075 . 0 0 "[ . 1 . 2 . ]" 1 116 1 11 VAL N 1 55 ILE O . . 2.700 2.875 2.798 2.964 0.264 15 0 "[ . 1 . 2 . ]" 1 117 1 11 VAL O 1 57 ASP H . . 1.800 1.995 1.863 2.074 0.274 7 0 "[ . 1 . 2 . ]" 1 118 1 11 VAL O 1 57 ASP N . . 2.700 2.947 2.801 3.068 0.368 22 0 "[ . 1 . 2 . ]" 1 119 1 12 ASP H 1 13 ASP H . . 5.000 4.564 4.227 4.743 . 0 0 "[ . 1 . 2 . ]" 1 120 1 12 ASP HA 1 13 ASP H . . 2.900 2.341 2.161 2.534 . 0 0 "[ . 1 . 2 . ]" 1 121 1 12 ASP HA 1 57 ASP H . . 5.000 2.601 1.992 3.989 . 0 0 "[ . 1 . 2 . ]" 1 122 1 12 ASP QB 1 18 ARG H . . 5.000 3.173 2.328 4.355 . 0 0 "[ . 1 . 2 . ]" 1 123 1 13 ASP H 1 14 PHE H . . 3.300 2.628 2.288 3.041 . 0 0 "[ . 1 . 2 . ]" 1 124 1 13 ASP QB 1 57 ASP QB . . 3.300 2.516 2.123 2.838 . 0 0 "[ . 1 . 2 . ]" 1 125 1 14 PHE H 1 14 PHE HB2 . . 3.300 2.748 2.309 3.256 . 0 0 "[ . 1 . 2 . ]" 1 126 1 14 PHE H 1 14 PHE HB3 . . 3.300 2.422 2.220 2.752 . 0 0 "[ . 1 . 2 . ]" 1 127 1 14 PHE QB 1 17 MET QB . . 5.000 2.175 1.951 3.210 . 0 0 "[ . 1 . 2 . ]" 1 128 1 14 PHE QB 1 17 MET QG . . 5.000 3.723 3.325 4.062 . 0 0 "[ . 1 . 2 . ]" 1 129 1 14 PHE HB2 1 17 MET H . . 5.000 4.434 3.761 5.073 0.073 26 0 "[ . 1 . 2 . ]" 1 130 1 14 PHE HB3 1 17 MET H . . 5.000 2.955 2.192 3.499 . 0 0 "[ . 1 . 2 . ]" 1 131 1 14 PHE QR 1 16 THR HB . . 5.000 2.631 2.319 2.870 . 0 0 "[ . 1 . 2 . ]" 1 132 1 14 PHE QR 1 16 THR MG . . 5.000 2.928 2.370 3.490 . 0 0 "[ . 1 . 2 . ]" 1 133 1 15 SER O 1 18 ARG H . . 1.800 2.084 2.071 2.094 0.294 18 0 "[ . 1 . 2 . ]" 1 134 1 15 SER O 1 18 ARG N . . 2.700 2.857 2.780 2.969 0.269 11 0 "[ . 1 . 2 . ]" 1 135 1 16 THR HA 1 19 ARG QD . . 5.000 3.418 2.039 4.583 . 0 0 "[ . 1 . 2 . ]" 1 136 1 16 THR HA 1 19 ARG QG . . 5.000 3.367 2.200 4.436 . 0 0 "[ . 1 . 2 . ]" 1 137 1 16 THR HB 1 17 MET H . . 5.000 2.966 2.519 3.379 . 0 0 "[ . 1 . 2 . ]" 1 138 1 16 THR MG 1 17 MET H . . 5.000 3.707 3.349 4.013 . 0 0 "[ . 1 . 2 . ]" 1 139 1 16 THR MG 1 19 ARG QB . . 5.000 3.208 2.887 3.590 . 0 0 "[ . 1 . 2 . ]" 1 140 1 16 THR MG 1 20 ILE H . . 5.000 3.843 3.561 4.025 . 0 0 "[ . 1 . 2 . ]" 1 141 1 16 THR MG 1 20 ILE MD . . 3.300 2.082 1.985 2.183 . 0 0 "[ . 1 . 2 . ]" 1 142 1 16 THR O 1 20 ILE H . . 1.800 1.931 1.825 2.073 0.273 4 0 "[ . 1 . 2 . ]" 1 143 1 16 THR O 1 20 ILE N . . 2.700 2.920 2.823 3.063 0.363 4 0 "[ . 1 . 2 . ]" 1 144 1 17 MET H 1 17 MET HB2 . . 3.300 2.243 1.990 2.650 . 0 0 "[ . 1 . 2 . ]" 1 145 1 17 MET H 1 17 MET HB3 . . 3.300 2.909 2.492 3.381 0.081 15 0 "[ . 1 . 2 . ]" 1 146 1 17 MET H 1 17 MET HG2 . . 5.000 4.428 3.921 4.683 . 0 0 "[ . 1 . 2 . ]" 1 147 1 17 MET H 1 17 MET HG3 . . 5.000 4.133 3.285 4.532 . 0 0 "[ . 1 . 2 . ]" 1 148 1 17 MET H 1 18 ARG H . . 3.300 2.668 2.515 2.952 . 0 0 "[ . 1 . 2 . ]" 1 149 1 17 MET H 1 20 ILE HB . . 5.000 4.873 4.642 5.061 0.061 25 0 "[ . 1 . 2 . ]" 1 150 1 17 MET HA 1 20 ILE H . . 5.000 3.303 2.844 3.729 . 0 0 "[ . 1 . 2 . ]" 1 151 1 17 MET HA 1 20 ILE HB . . 3.300 2.359 2.074 2.690 . 0 0 "[ . 1 . 2 . ]" 1 152 1 17 MET HA 1 20 ILE MD . . 5.000 3.401 2.465 3.973 . 0 0 "[ . 1 . 2 . ]" 1 153 1 17 MET HA 1 20 ILE QG . . 5.000 3.929 3.413 4.361 . 0 0 "[ . 1 . 2 . ]" 1 154 1 17 MET HA 1 20 ILE MG . . 5.000 3.506 3.264 3.774 . 0 0 "[ . 1 . 2 . ]" 1 155 1 17 MET QG 1 20 ILE HB . . 5.000 3.685 2.788 4.266 . 0 0 "[ . 1 . 2 . ]" 1 156 1 17 MET QG 1 21 VAL MG2 . . 5.000 2.947 2.222 3.731 . 0 0 "[ . 1 . 2 . ]" 1 157 1 17 MET O 1 21 VAL H . . 1.800 1.824 1.747 1.953 0.153 27 0 "[ . 1 . 2 . ]" 1 158 1 17 MET O 1 21 VAL N . . 2.700 2.820 2.733 2.963 0.263 27 0 "[ . 1 . 2 . ]" 1 159 1 18 ARG H 1 18 ARG QB . . 2.900 2.288 2.042 2.569 . 0 0 "[ . 1 . 2 . ]" 1 160 1 18 ARG H 1 19 ARG H . . 2.900 2.523 2.351 2.666 . 0 0 "[ . 1 . 2 . ]" 1 161 1 18 ARG HA 1 21 VAL H . . 5.000 3.475 3.018 4.023 . 0 0 "[ . 1 . 2 . ]" 1 162 1 18 ARG HA 1 21 VAL HB . . 5.000 2.627 2.288 3.240 . 0 0 "[ . 1 . 2 . ]" 1 163 1 18 ARG HA 1 21 VAL MG2 . . 5.000 3.452 3.031 4.133 . 0 0 "[ . 1 . 2 . ]" 1 164 1 18 ARG O 1 22 ARG H . . 1.800 1.912 1.742 2.080 0.280 12 0 "[ . 1 . 2 . ]" 1 165 1 18 ARG O 1 22 ARG N . . 2.700 2.908 2.735 3.070 0.370 8 0 "[ . 1 . 2 . ]" 1 166 1 19 ARG H 1 19 ARG QB . . 3.300 2.377 2.081 2.710 . 0 0 "[ . 1 . 2 . ]" 1 167 1 19 ARG H 1 19 ARG QD . . 5.000 2.981 2.048 4.281 . 0 0 "[ . 1 . 2 . ]" 1 168 1 19 ARG H 1 19 ARG HG2 . . 5.000 3.643 1.991 4.590 . 0 0 "[ . 1 . 2 . ]" 1 169 1 19 ARG H 1 19 ARG HG3 . . 5.000 3.895 2.971 4.550 . 0 0 "[ . 1 . 2 . ]" 1 170 1 19 ARG HA 1 19 ARG QD . . 3.300 2.607 2.162 3.037 . 0 0 "[ . 1 . 2 . ]" 1 171 1 19 ARG HA 1 22 ARG H . . 5.000 3.827 3.396 4.254 . 0 0 "[ . 1 . 2 . ]" 1 172 1 19 ARG HA 1 23 ASN H . . 5.000 4.011 3.799 4.291 . 0 0 "[ . 1 . 2 . ]" 1 173 1 19 ARG QB 1 19 ARG QD . . 3.300 2.331 2.109 2.546 . 0 0 "[ . 1 . 2 . ]" 1 174 1 19 ARG O 1 23 ASN H . . 1.800 1.986 1.821 2.076 0.276 5 0 "[ . 1 . 2 . ]" 1 175 1 19 ARG O 1 23 ASN N . . 2.700 2.939 2.783 3.045 0.345 3 0 "[ . 1 . 2 . ]" 1 176 1 20 ILE H 1 20 ILE HB . . 2.900 2.218 2.125 2.371 . 0 0 "[ . 1 . 2 . ]" 1 177 1 20 ILE H 1 20 ILE MD . . 3.300 2.397 2.224 2.541 . 0 0 "[ . 1 . 2 . ]" 1 178 1 20 ILE H 1 20 ILE HG12 . . 5.000 4.046 3.812 4.192 . 0 0 "[ . 1 . 2 . ]" 1 179 1 20 ILE H 1 20 ILE HG13 . . 5.000 3.968 3.844 4.050 . 0 0 "[ . 1 . 2 . ]" 1 180 1 20 ILE H 1 21 VAL H . . 3.300 3.045 2.906 3.155 . 0 0 "[ . 1 . 2 . ]" 1 181 1 20 ILE HA 1 20 ILE MD . . 3.300 2.515 2.329 2.616 . 0 0 "[ . 1 . 2 . ]" 1 182 1 20 ILE HA 1 20 ILE MG . . 3.300 2.734 2.667 2.770 . 0 0 "[ . 1 . 2 . ]" 1 183 1 20 ILE HA 1 23 ASN H . . 5.000 3.571 3.366 3.861 . 0 0 "[ . 1 . 2 . ]" 1 184 1 20 ILE HA 1 23 ASN QB . . 5.000 2.710 2.457 3.096 . 0 0 "[ . 1 . 2 . ]" 1 185 1 20 ILE HB 1 21 VAL H . . 2.900 2.775 2.575 2.901 0.001 18 0 "[ . 1 . 2 . ]" 1 186 1 20 ILE HB 1 21 VAL MG2 . . 5.000 3.755 3.447 3.931 . 0 0 "[ . 1 . 2 . ]" 1 187 1 20 ILE QG 1 20 ILE MG . . 3.300 2.045 2.022 2.071 . 0 0 "[ . 1 . 2 . ]" 1 188 1 20 ILE MG 1 21 VAL H . . 3.300 2.482 2.458 2.513 . 0 0 "[ . 1 . 2 . ]" 1 189 1 20 ILE MG 1 21 VAL HA . . 5.000 3.020 2.855 3.217 . 0 0 "[ . 1 . 2 . ]" 1 190 1 20 ILE MG 1 21 VAL MG2 . . 5.000 2.691 2.468 2.932 . 0 0 "[ . 1 . 2 . ]" 1 191 1 20 ILE MG 1 24 LEU MD1 . . 3.300 2.120 2.038 2.170 . 0 0 "[ . 1 . 2 . ]" 1 192 1 20 ILE MG 1 111 PHE QR . . 5.000 2.226 2.034 2.774 . 0 0 "[ . 1 . 2 . ]" 1 193 1 20 ILE O 1 24 LEU H . . 1.800 1.848 1.757 1.983 0.183 11 0 "[ . 1 . 2 . ]" 1 194 1 20 ILE O 1 24 LEU N . . 2.700 2.838 2.771 2.969 0.269 11 0 "[ . 1 . 2 . ]" 1 195 1 21 VAL H 1 21 VAL MG2 . . 2.900 2.122 2.024 2.156 . 0 0 "[ . 1 . 2 . ]" 1 196 1 21 VAL H 1 22 ARG H . . 3.300 3.051 2.948 3.149 . 0 0 "[ . 1 . 2 . ]" 1 197 1 21 VAL HA 1 21 VAL MG2 . . 3.300 2.353 2.307 2.448 . 0 0 "[ . 1 . 2 . ]" 1 198 1 21 VAL HA 1 24 LEU MD1 . . 3.300 2.350 2.127 2.461 . 0 0 "[ . 1 . 2 . ]" 1 199 1 21 VAL HA 1 25 LEU H . . 5.000 3.960 3.823 4.112 . 0 0 "[ . 1 . 2 . ]" 1 200 1 21 VAL MG1 1 22 ARG H . . 5.000 3.290 3.121 3.489 . 0 0 "[ . 1 . 2 . ]" 1 201 1 21 VAL MG1 1 25 LEU H . . 5.000 4.060 4.018 4.074 . 0 0 "[ . 1 . 2 . ]" 1 202 1 21 VAL MG1 1 25 LEU HG . . 5.000 3.253 2.996 3.698 . 0 0 "[ . 1 . 2 . ]" 1 203 1 21 VAL MG1 1 55 ILE HB . . 5.000 3.472 3.099 3.886 . 0 0 "[ . 1 . 2 . ]" 1 204 1 21 VAL MG1 1 55 ILE MD . . 5.000 2.663 2.114 3.348 . 0 0 "[ . 1 . 2 . ]" 1 205 1 21 VAL MG1 1 55 ILE MG . . 5.000 2.223 2.038 2.444 . 0 0 "[ . 1 . 2 . ]" 1 206 1 21 VAL MG2 1 22 ARG H . . 5.000 4.045 3.907 4.202 . 0 0 "[ . 1 . 2 . ]" 1 207 1 21 VAL MG2 1 55 ILE MG . . 5.000 3.093 2.706 3.310 . 0 0 "[ . 1 . 2 . ]" 1 208 1 21 VAL MG2 1 86 VAL MG1 . . 3.300 2.075 1.964 2.139 . 0 0 "[ . 1 . 2 . ]" 1 209 1 21 VAL MG2 1 86 VAL MG2 . . 5.000 3.131 2.579 3.250 . 0 0 "[ . 1 . 2 . ]" 1 210 1 21 VAL MG2 1 111 PHE QR . . 5.000 2.206 1.998 2.519 . 0 0 "[ . 1 . 2 . ]" 1 211 1 21 VAL O 1 25 LEU H . . 1.800 1.911 1.834 1.966 0.166 12 0 "[ . 1 . 2 . ]" 1 212 1 21 VAL O 1 25 LEU N . . 2.700 2.880 2.803 2.962 0.262 12 0 "[ . 1 . 2 . ]" 1 213 1 22 ARG H 1 22 ARG HB2 . . 3.300 2.426 2.107 2.594 . 0 0 "[ . 1 . 2 . ]" 1 214 1 22 ARG H 1 22 ARG HB3 . . 3.300 2.681 2.304 3.393 0.093 8 0 "[ . 1 . 2 . ]" 1 215 1 22 ARG H 1 23 ASN H . . 3.300 2.805 2.646 2.970 . 0 0 "[ . 1 . 2 . ]" 1 216 1 22 ARG HA 1 22 ARG QG . . 3.300 2.414 2.220 2.582 . 0 0 "[ . 1 . 2 . ]" 1 217 1 22 ARG HA 1 25 LEU H . . 5.000 3.495 3.266 3.735 . 0 0 "[ . 1 . 2 . ]" 1 218 1 22 ARG HA 1 25 LEU MD1 . . 5.000 2.531 2.157 2.824 . 0 0 "[ . 1 . 2 . ]" 1 219 1 22 ARG HA 1 33 VAL QG . . 5.000 2.657 2.168 3.613 . 0 0 "[ . 1 . 2 . ]" 1 220 1 22 ARG QB 1 33 VAL QG . . 5.000 2.635 2.011 3.361 . 0 0 "[ . 1 . 2 . ]" 1 221 1 22 ARG HB2 1 23 ASN H . . 5.000 3.775 2.615 4.237 . 0 0 "[ . 1 . 2 . ]" 1 222 1 22 ARG HB3 1 23 ASN H . . 5.000 2.747 2.485 3.498 . 0 0 "[ . 1 . 2 . ]" 1 223 1 22 ARG QD 1 33 VAL QG . . 5.000 2.675 2.044 3.331 . 0 0 "[ . 1 . 2 . ]" 1 224 1 22 ARG QG 1 23 ASN H . . 5.000 4.041 3.445 4.584 . 0 0 "[ . 1 . 2 . ]" 1 225 1 22 ARG QG 1 33 VAL QG . . 3.300 1.884 1.759 2.113 . 0 0 "[ . 1 . 2 . ]" 1 226 1 22 ARG O 1 26 LYS H . . 1.800 1.954 1.753 2.077 0.277 8 0 "[ . 1 . 2 . ]" 1 227 1 22 ARG O 1 26 LYS N . . 2.700 2.924 2.736 3.059 0.359 16 0 "[ . 1 . 2 . ]" 1 228 1 23 ASN H 1 23 ASN HB2 . . 3.300 2.494 2.127 2.840 . 0 0 "[ . 1 . 2 . ]" 1 229 1 23 ASN H 1 23 ASN HB3 . . 3.300 2.673 2.319 3.393 0.093 16 0 "[ . 1 . 2 . ]" 1 230 1 23 ASN H 1 24 LEU H . . 3.300 2.720 2.560 2.850 . 0 0 "[ . 1 . 2 . ]" 1 231 1 23 ASN HA 1 26 LYS H . . 5.000 3.379 3.000 3.674 . 0 0 "[ . 1 . 2 . ]" 1 232 1 23 ASN HA 1 26 LYS QB . . 5.000 2.802 2.280 4.286 . 0 0 "[ . 1 . 2 . ]" 1 233 1 23 ASN HA 1 27 GLU H . . 5.000 4.120 3.734 4.416 . 0 0 "[ . 1 . 2 . ]" 1 234 1 23 ASN HB2 1 24 LEU H . . 5.000 3.736 2.340 4.094 . 0 0 "[ . 1 . 2 . ]" 1 235 1 23 ASN HB3 1 24 LEU H . . 5.000 2.680 2.348 3.432 . 0 0 "[ . 1 . 2 . ]" 1 236 1 23 ASN O 1 27 GLU H . . 1.800 1.963 1.760 2.077 0.277 4 0 "[ . 1 . 2 . ]" 1 237 1 23 ASN O 1 27 GLU N . . 2.700 2.879 2.745 3.052 0.352 16 0 "[ . 1 . 2 . ]" 1 238 1 24 LEU H 1 24 LEU MD2 . . 5.000 3.237 2.665 3.761 . 0 0 "[ . 1 . 2 . ]" 1 239 1 24 LEU H 1 25 LEU H . . 3.300 2.734 2.579 2.893 . 0 0 "[ . 1 . 2 . ]" 1 240 1 24 LEU HA 1 27 GLU H . . 5.000 3.382 3.028 3.772 . 0 0 "[ . 1 . 2 . ]" 1 241 1 24 LEU HA 1 28 LEU HG . . 5.000 4.685 4.221 5.026 0.026 25 0 "[ . 1 . 2 . ]" 1 242 1 24 LEU HA 1 113 ALA MB . . 5.000 2.741 2.292 3.197 . 0 0 "[ . 1 . 2 . ]" 1 243 1 24 LEU QB 1 25 LEU H . . 5.000 2.574 2.406 2.819 . 0 0 "[ . 1 . 2 . ]" 1 244 1 24 LEU QB 1 113 ALA MB . . 5.000 2.797 2.342 3.290 . 0 0 "[ . 1 . 2 . ]" 1 245 1 24 LEU QB 1 116 LEU QB . . 5.880 2.792 2.341 3.245 . 0 0 "[ . 1 . 2 . ]" 1 246 1 24 LEU MD1 1 111 PHE QR . . 5.000 2.030 1.904 2.308 . 0 0 "[ . 1 . 2 . ]" 1 247 1 24 LEU MD1 1 113 ALA HA . . 5.000 3.376 2.603 4.010 . 0 0 "[ . 1 . 2 . ]" 1 248 1 24 LEU MD2 1 112 THR MG . . 5.000 3.055 2.404 3.290 . 0 0 "[ . 1 . 2 . ]" 1 249 1 25 LEU H 1 25 LEU MD1 . . 5.000 3.355 3.170 3.564 . 0 0 "[ . 1 . 2 . ]" 1 250 1 25 LEU H 1 25 LEU MD2 . . 5.000 4.006 3.839 4.237 . 0 0 "[ . 1 . 2 . ]" 1 251 1 25 LEU H 1 25 LEU HG . . 3.300 2.765 2.524 3.315 0.015 11 0 "[ . 1 . 2 . ]" 1 252 1 25 LEU H 1 26 LYS H . . 3.300 2.770 2.546 3.041 . 0 0 "[ . 1 . 2 . ]" 1 253 1 25 LEU HA 1 25 LEU MD2 . . 3.300 2.205 2.114 2.365 . 0 0 "[ . 1 . 2 . ]" 1 254 1 25 LEU HA 1 28 LEU H . . 5.000 3.598 3.183 4.243 . 0 0 "[ . 1 . 2 . ]" 1 255 1 25 LEU HA 1 28 LEU MD1 . . 5.000 3.074 2.448 3.772 . 0 0 "[ . 1 . 2 . ]" 1 256 1 25 LEU QB 1 26 LYS H . . 3.300 2.578 2.295 2.935 . 0 0 "[ . 1 . 2 . ]" 1 257 1 25 LEU QB 1 26 LYS QG . . 5.000 3.577 3.054 3.981 . 0 0 "[ . 1 . 2 . ]" 1 258 1 25 LEU MD1 1 55 ILE MD . . 5.000 2.210 1.985 2.685 . 0 0 "[ . 1 . 2 . ]" 1 259 1 25 LEU MD1 1 116 LEU MD2 . . 5.000 3.096 3.005 3.218 . 0 0 "[ . 1 . 2 . ]" 1 260 1 25 LEU MD2 1 30 PHE QD . . 5.000 2.672 2.216 3.732 . 0 0 "[ . 1 . 2 . ]" 1 261 1 25 LEU MD2 1 55 ILE MD . . 5.000 3.039 2.597 3.359 . 0 0 "[ . 1 . 2 . ]" 1 262 1 25 LEU MD2 1 116 LEU MD1 . . 5.000 2.056 1.953 2.173 . 0 0 "[ . 1 . 2 . ]" 1 263 1 25 LEU MD2 1 116 LEU MD2 . . 5.000 3.012 2.575 3.233 . 0 0 "[ . 1 . 2 . ]" 1 264 1 25 LEU MD2 1 120 LEU MD1 . . 5.000 2.680 2.302 3.133 . 0 0 "[ . 1 . 2 . ]" 1 265 1 25 LEU MD2 1 120 LEU MD2 . . 5.000 2.962 2.416 3.279 . 0 0 "[ . 1 . 2 . ]" 1 266 1 25 LEU HG 1 116 LEU MD2 . . 5.000 2.550 2.260 2.886 . 0 0 "[ . 1 . 2 . ]" 1 267 1 26 LYS H 1 26 LYS HA . . 2.900 2.861 2.772 2.924 0.024 8 0 "[ . 1 . 2 . ]" 1 268 1 26 LYS HA 1 26 LYS QE . . 5.000 3.557 1.859 4.417 . 0 0 "[ . 1 . 2 . ]" 1 269 1 26 LYS HA 1 28 LEU H . . 5.000 4.061 3.237 4.831 . 0 0 "[ . 1 . 2 . ]" 1 270 1 26 LYS HA 1 29 GLY H . . 5.000 3.303 2.420 4.663 . 0 0 "[ . 1 . 2 . ]" 1 271 1 26 LYS HA 1 30 PHE H . . 5.000 3.955 2.504 5.080 0.080 7 0 "[ . 1 . 2 . ]" 1 272 1 26 LYS QB 1 27 GLU H . . 5.000 3.051 2.624 3.903 . 0 0 "[ . 1 . 2 . ]" 1 273 1 26 LYS QE 1 31 ASN QB . . 5.000 3.134 1.991 4.061 . 0 0 "[ . 1 . 2 . ]" 1 274 1 27 GLU H 1 27 GLU HA . . 2.900 2.849 2.806 2.899 . 0 0 "[ . 1 . 2 . ]" 1 275 1 27 GLU H 1 27 GLU QG . . 3.300 2.451 2.180 3.091 . 0 0 "[ . 1 . 2 . ]" 1 276 1 27 GLU H 1 28 LEU H . . 3.300 2.760 2.588 3.106 . 0 0 "[ . 1 . 2 . ]" 1 277 1 27 GLU QB 1 113 ALA MB . . 5.000 2.802 2.269 3.865 . 0 0 "[ . 1 . 2 . ]" 1 278 1 27 GLU HB2 1 28 LEU H . . 5.000 2.956 2.236 4.408 . 0 0 "[ . 1 . 2 . ]" 1 279 1 27 GLU HB3 1 28 LEU H . . 5.000 3.693 3.092 4.425 . 0 0 "[ . 1 . 2 . ]" 1 280 1 27 GLU QG 1 113 ALA MB . . 5.000 3.011 2.131 3.731 . 0 0 "[ . 1 . 2 . ]" 1 281 1 27 GLU HG2 1 28 LEU H . . 5.000 4.444 3.471 4.787 . 0 0 "[ . 1 . 2 . ]" 1 282 1 27 GLU HG3 1 28 LEU H . . 5.000 4.567 2.450 5.084 0.084 9 0 "[ . 1 . 2 . ]" 1 283 1 28 LEU H 1 28 LEU HA . . 2.900 2.925 2.847 2.971 0.071 9 0 "[ . 1 . 2 . ]" 1 284 1 28 LEU H 1 28 LEU MD1 . . 5.000 3.292 2.353 3.798 . 0 0 "[ . 1 . 2 . ]" 1 285 1 28 LEU H 1 28 LEU MD2 . . 5.000 3.831 3.234 4.295 . 0 0 "[ . 1 . 2 . ]" 1 286 1 28 LEU H 1 28 LEU HG . . 2.900 2.574 2.171 2.980 0.080 20 0 "[ . 1 . 2 . ]" 1 287 1 28 LEU H 1 29 GLY H . . 3.300 2.494 1.980 3.380 0.080 27 0 "[ . 1 . 2 . ]" 1 288 1 28 LEU QB 1 117 GLU QB . . 5.000 3.713 3.253 3.950 . 0 0 "[ . 1 . 2 . ]" 1 289 1 28 LEU MD1 1 113 ALA MB . . 5.000 2.599 2.205 3.082 . 0 0 "[ . 1 . 2 . ]" 1 290 1 28 LEU MD1 1 117 GLU QB . . 5.000 2.096 1.987 2.161 . 0 0 "[ . 1 . 2 . ]" 1 291 1 28 LEU MD1 1 117 GLU QG . . 5.000 3.484 3.034 3.652 . 0 0 "[ . 1 . 2 . ]" 1 292 1 28 LEU MD2 1 117 GLU QB . . 3.300 2.082 1.953 2.184 . 0 0 "[ . 1 . 2 . ]" 1 293 1 28 LEU MD2 1 117 GLU QG . . 5.000 2.929 2.300 3.626 . 0 0 "[ . 1 . 2 . ]" 1 294 1 28 LEU HG 1 29 GLY H . . 5.000 4.513 3.981 5.089 0.089 26 0 "[ . 1 . 2 . ]" 1 295 1 28 LEU HG 1 113 ALA MB . . 5.000 2.439 2.138 3.068 . 0 0 "[ . 1 . 2 . ]" 1 296 1 29 GLY H 1 30 PHE H . . 5.000 3.141 1.876 4.582 . 0 0 "[ . 1 . 2 . ]" 1 297 1 30 PHE HA 1 31 ASN H . . 2.900 2.427 2.142 2.731 . 0 0 "[ . 1 . 2 . ]" 1 298 1 30 PHE QE 1 124 PHE QE . . 5.000 3.388 2.446 4.365 . 0 0 "[ . 1 . 2 . ]" 1 299 1 31 ASN H 1 32 ASN H . . 5.000 3.963 1.713 4.605 . 0 0 "[ . 1 . 2 . ]" 1 300 1 31 ASN HA 1 32 ASN H . . 3.300 2.777 2.396 3.380 0.080 22 0 "[ . 1 . 2 . ]" 1 301 1 32 ASN H 1 32 ASN QB . . 3.680 3.005 2.387 3.400 . 0 0 "[ . 1 . 2 . ]" 1 302 1 32 ASN H 1 33 VAL H . . 5.000 3.174 2.615 4.293 . 0 0 "[ . 1 . 2 . ]" 1 303 1 32 ASN H 1 33 VAL QG . . 5.000 3.455 2.720 3.658 . 0 0 "[ . 1 . 2 . ]" 1 304 1 32 ASN HB2 1 33 VAL H . . 5.000 4.513 2.999 4.695 . 0 0 "[ . 1 . 2 . ]" 1 305 1 32 ASN HB3 1 33 VAL H . . 5.000 4.198 2.584 4.491 . 0 0 "[ . 1 . 2 . ]" 1 306 1 33 VAL H 1 33 VAL QG . . 3.300 2.078 1.760 2.536 . 0 0 "[ . 1 . 2 . ]" 1 307 1 33 VAL H 1 34 GLU H . . 5.000 4.454 3.572 4.678 . 0 0 "[ . 1 . 2 . ]" 1 308 1 33 VAL HA 1 34 GLU H . . 2.900 2.340 2.135 2.491 . 0 0 "[ . 1 . 2 . ]" 1 309 1 33 VAL QG 1 34 GLU H . . 5.000 3.197 2.587 3.779 . 0 0 "[ . 1 . 2 . ]" 1 310 1 34 GLU H 1 34 GLU QG . . 5.000 3.819 2.989 4.430 . 0 0 "[ . 1 . 2 . ]" 1 311 1 34 GLU HA 1 35 GLU H . . 2.900 2.544 2.272 2.964 0.064 13 0 "[ . 1 . 2 . ]" 1 312 1 34 GLU QB 1 51 TYR QE . . 5.000 2.329 2.009 3.517 . 0 0 "[ . 1 . 2 . ]" 1 313 1 34 GLU HB2 1 35 GLU H . . 5.000 3.808 3.259 4.233 . 0 0 "[ . 1 . 2 . ]" 1 314 1 34 GLU HB3 1 35 GLU H . . 5.000 2.587 1.865 3.365 . 0 0 "[ . 1 . 2 . ]" 1 315 1 34 GLU QG 1 35 GLU H . . 5.000 3.318 1.830 4.447 . 0 0 "[ . 1 . 2 . ]" 1 316 1 34 GLU QG 1 51 TYR QE . . 5.000 2.910 2.112 4.032 . 0 0 "[ . 1 . 2 . ]" 1 317 1 35 GLU HA 1 36 ALA H . . 2.900 2.402 2.143 2.634 . 0 0 "[ . 1 . 2 . ]" 1 318 1 35 GLU HA 1 36 ALA MB . . 5.000 4.030 3.571 4.179 . 0 0 "[ . 1 . 2 . ]" 1 319 1 35 GLU HB2 1 36 ALA H . . 5.000 3.626 2.212 4.561 . 0 0 "[ . 1 . 2 . ]" 1 320 1 35 GLU HB3 1 36 ALA H . . 5.000 3.108 2.056 4.129 . 0 0 "[ . 1 . 2 . ]" 1 321 1 36 ALA H 1 36 ALA MB . . 3.300 2.611 2.347 2.776 . 0 0 "[ . 1 . 2 . ]" 1 322 1 36 ALA H 1 37 GLU H . . 5.000 4.358 4.273 4.670 . 0 0 "[ . 1 . 2 . ]" 1 323 1 36 ALA HA 1 37 GLU H . . 2.900 2.457 2.270 2.562 . 0 0 "[ . 1 . 2 . ]" 1 324 1 36 ALA HA 1 38 ASP H . . 5.000 4.297 4.005 4.476 . 0 0 "[ . 1 . 2 . ]" 1 325 1 36 ALA MB 1 38 ASP H . . 3.300 2.597 2.430 2.647 . 0 0 "[ . 1 . 2 . ]" 1 326 1 36 ALA MB 1 42 ALA HA . . 3.300 2.292 2.101 2.625 . 0 0 "[ . 1 . 2 . ]" 1 327 1 36 ALA MB 1 42 ALA MB . . 5.000 2.681 2.363 2.903 . 0 0 "[ . 1 . 2 . ]" 1 328 1 36 ALA MB 1 45 LYS QD . . 5.000 2.900 2.068 3.657 . 0 0 "[ . 1 . 2 . ]" 1 329 1 36 ALA MB 1 45 LYS QE . . 5.000 2.860 2.111 3.447 . 0 0 "[ . 1 . 2 . ]" 1 330 1 36 ALA MB 1 45 LYS QG . . 5.000 2.635 1.982 3.397 . 0 0 "[ . 1 . 2 . ]" 1 331 1 37 GLU H 1 37 GLU QB . . 3.300 2.492 2.191 2.802 . 0 0 "[ . 1 . 2 . ]" 1 332 1 37 GLU H 1 37 GLU HG2 . . 2.900 2.638 1.950 2.983 0.083 8 0 "[ . 1 . 2 . ]" 1 333 1 37 GLU H 1 37 GLU HG3 . . 2.900 2.668 2.021 2.999 0.099 13 0 "[ . 1 . 2 . ]" 1 334 1 37 GLU H 1 38 ASP H . . 2.900 2.627 2.406 2.781 . 0 0 "[ . 1 . 2 . ]" 1 335 1 37 GLU H 1 41 ASP QB . . 5.880 2.369 2.130 2.796 . 0 0 "[ . 1 . 2 . ]" 1 336 1 38 ASP H 1 41 ASP HA . . 5.000 4.971 4.752 5.070 0.070 16 0 "[ . 1 . 2 . ]" 1 337 1 38 ASP H 1 41 ASP HB2 . . 3.300 3.360 3.261 3.382 0.082 9 0 "[ . 1 . 2 . ]" 1 338 1 38 ASP H 1 41 ASP QB . . 2.980 2.034 1.925 2.109 . 0 0 "[ . 1 . 2 . ]" 1 339 1 38 ASP H 1 41 ASP HB3 . . 3.300 2.051 1.936 2.132 . 0 0 "[ . 1 . 2 . ]" 1 340 1 38 ASP HB2 1 39 GLY H . . 5.000 3.203 2.227 4.244 . 0 0 "[ . 1 . 2 . ]" 1 341 1 38 ASP HB3 1 39 GLY H . . 5.000 3.644 2.569 4.082 . 0 0 "[ . 1 . 2 . ]" 1 342 1 38 ASP O 1 42 ALA H . . 1.800 1.879 1.774 2.003 0.203 22 0 "[ . 1 . 2 . ]" 1 343 1 38 ASP O 1 42 ALA N . . 2.700 2.750 2.693 2.866 0.166 22 0 "[ . 1 . 2 . ]" 1 344 1 39 GLY QA 1 42 ALA MB . . 5.000 2.098 1.961 2.275 . 0 0 "[ . 1 . 2 . ]" 1 345 1 39 GLY QA 1 43 LEU H . . 5.000 3.777 3.592 3.924 . 0 0 "[ . 1 . 2 . ]" 1 346 1 39 GLY QA 1 68 LEU MD2 . . 5.000 2.205 1.982 2.438 . 0 0 "[ . 1 . 2 . ]" 1 347 1 39 GLY O 1 43 LEU H . . 1.800 2.028 1.835 2.079 0.279 8 0 "[ . 1 . 2 . ]" 1 348 1 39 GLY O 1 43 LEU N . . 2.700 3.019 2.819 3.079 0.379 8 0 "[ . 1 . 2 . ]" 1 349 1 40 VAL H 1 40 VAL HB . . 2.900 2.532 2.270 2.671 . 0 0 "[ . 1 . 2 . ]" 1 350 1 40 VAL H 1 41 ASP H . . 3.300 2.611 2.284 2.883 . 0 0 "[ . 1 . 2 . ]" 1 351 1 40 VAL HA 1 40 VAL MG1 . . 3.300 2.404 2.291 2.600 . 0 0 "[ . 1 . 2 . ]" 1 352 1 40 VAL HA 1 43 LEU H . . 5.000 3.692 3.264 4.131 . 0 0 "[ . 1 . 2 . ]" 1 353 1 40 VAL HB 1 41 ASP H . . 2.900 2.614 2.357 2.874 . 0 0 "[ . 1 . 2 . ]" 1 354 1 40 VAL MG1 1 41 ASP H . . 5.000 3.534 3.144 3.736 . 0 0 "[ . 1 . 2 . ]" 1 355 1 40 VAL MG1 1 41 ASP HA . . 5.000 3.746 3.418 3.951 . 0 0 "[ . 1 . 2 . ]" 1 356 1 40 VAL MG2 1 62 ASN QB . . 3.300 2.216 1.882 2.592 . 0 0 "[ . 1 . 2 . ]" 1 357 1 40 VAL MG2 1 63 MET QB . . 3.300 2.112 1.952 2.266 . 0 0 "[ . 1 . 2 . ]" 1 358 1 41 ASP H 1 41 ASP HB2 . . 2.900 2.533 2.378 2.692 . 0 0 "[ . 1 . 2 . ]" 1 359 1 41 ASP H 1 41 ASP HB3 . . 2.900 2.523 2.399 2.614 . 0 0 "[ . 1 . 2 . ]" 1 360 1 41 ASP H 1 42 ALA H . . 3.300 2.579 2.311 2.815 . 0 0 "[ . 1 . 2 . ]" 1 361 1 41 ASP HA 1 44 ASN H . . 5.000 3.326 3.118 3.691 . 0 0 "[ . 1 . 2 . ]" 1 362 1 41 ASP HA 1 44 ASN QB . . 3.300 2.432 2.080 2.908 . 0 0 "[ . 1 . 2 . ]" 1 363 1 41 ASP HB2 1 42 ALA H . . 5.000 4.072 3.828 4.222 . 0 0 "[ . 1 . 2 . ]" 1 364 1 41 ASP HB3 1 42 ALA H . . 5.000 2.937 2.645 3.182 . 0 0 "[ . 1 . 2 . ]" 1 365 1 41 ASP O 1 45 LYS H . . 1.800 1.927 1.723 2.078 0.278 4 0 "[ . 1 . 2 . ]" 1 366 1 41 ASP O 1 45 LYS N . . 2.700 2.846 2.717 3.053 0.353 23 0 "[ . 1 . 2 . ]" 1 367 1 42 ALA H 1 42 ALA MB . . 2.900 2.193 2.143 2.264 . 0 0 "[ . 1 . 2 . ]" 1 368 1 42 ALA H 1 43 LEU H . . 5.000 2.763 2.631 2.894 . 0 0 "[ . 1 . 2 . ]" 1 369 1 42 ALA H 1 68 LEU MD1 . . 5.000 4.088 4.040 4.127 . 0 0 "[ . 1 . 2 . ]" 1 370 1 42 ALA HA 1 45 LYS H . . 5.000 3.331 3.136 3.533 . 0 0 "[ . 1 . 2 . ]" 1 371 1 42 ALA HA 1 46 LEU H . . 5.000 4.165 3.874 4.343 . 0 0 "[ . 1 . 2 . ]" 1 372 1 42 ALA MB 1 43 LEU H . . 3.300 2.370 2.259 2.549 . 0 0 "[ . 1 . 2 . ]" 1 373 1 42 ALA MB 1 68 LEU MD1 . . 5.000 2.177 2.020 2.324 . 0 0 "[ . 1 . 2 . ]" 1 374 1 42 ALA MB 1 68 LEU MD2 . . 5.000 2.185 2.010 2.477 . 0 0 "[ . 1 . 2 . ]" 1 375 1 42 ALA MB 1 68 LEU HG . . 5.000 4.009 3.875 4.130 . 0 0 "[ . 1 . 2 . ]" 1 376 1 42 ALA O 1 46 LEU H . . 1.800 1.959 1.794 2.065 0.265 24 0 "[ . 1 . 2 . ]" 1 377 1 42 ALA O 1 46 LEU N . . 2.700 2.936 2.753 3.057 0.357 24 0 "[ . 1 . 2 . ]" 1 378 1 43 LEU H 1 43 LEU HB2 . . 3.300 2.284 2.122 2.475 . 0 0 "[ . 1 . 2 . ]" 1 379 1 43 LEU H 1 43 LEU HB3 . . 3.300 2.808 2.581 3.356 0.056 27 0 "[ . 1 . 2 . ]" 1 380 1 43 LEU H 1 43 LEU HG . . 5.000 4.468 4.316 4.575 . 0 0 "[ . 1 . 2 . ]" 1 381 1 43 LEU H 1 44 ASN H . . 3.300 2.754 2.568 2.903 . 0 0 "[ . 1 . 2 . ]" 1 382 1 43 LEU HA 1 46 LEU H . . 3.300 3.341 3.238 3.374 0.074 16 0 "[ . 1 . 2 . ]" 1 383 1 43 LEU HA 1 47 GLN H . . 5.000 4.192 3.729 4.391 . 0 0 "[ . 1 . 2 . ]" 1 384 1 43 LEU QB 1 68 LEU MD1 . . 5.000 2.490 2.119 3.526 . 0 0 "[ . 1 . 2 . ]" 1 385 1 43 LEU MD1 1 71 THR HB . . 5.000 2.552 2.151 3.855 . 0 0 "[ . 1 . 2 . ]" 1 386 1 43 LEU MD1 1 71 THR MG . . 3.300 1.999 1.978 2.022 . 0 0 "[ . 1 . 2 . ]" 1 387 1 43 LEU MD1 1 72 ILE MD . . 5.000 2.959 2.493 3.322 . 0 0 "[ . 1 . 2 . ]" 1 388 1 43 LEU MD1 1 72 ILE QG . . 5.000 2.265 2.041 2.609 . 0 0 "[ . 1 . 2 . ]" 1 389 1 43 LEU MD2 1 71 THR HB . . 5.000 3.716 2.276 4.060 . 0 0 "[ . 1 . 2 . ]" 1 390 1 43 LEU MD2 1 71 THR MG . . 3.300 2.039 1.934 2.125 . 0 0 "[ . 1 . 2 . ]" 1 391 1 43 LEU HG 1 68 LEU MD1 . . 5.000 4.218 4.042 4.281 . 0 0 "[ . 1 . 2 . ]" 1 392 1 43 LEU HG 1 71 THR MG . . 5.000 3.734 2.037 3.883 . 0 0 "[ . 1 . 2 . ]" 1 393 1 43 LEU HG 1 72 ILE QG . . 5.000 4.422 3.889 4.573 . 0 0 "[ . 1 . 2 . ]" 1 394 1 43 LEU O 1 47 GLN H . . 1.800 2.047 1.862 2.087 0.287 11 0 "[ . 1 . 2 . ]" 1 395 1 43 LEU O 1 47 GLN N . . 2.700 3.037 2.817 3.090 0.390 22 0 "[ . 1 . 2 . ]" 1 396 1 44 ASN HA 1 47 GLN QG . . 5.000 3.261 2.060 4.394 . 0 0 "[ . 1 . 2 . ]" 1 397 1 45 LYS H 1 45 LYS HD2 . . 5.000 3.817 2.576 5.049 0.049 15 0 "[ . 1 . 2 . ]" 1 398 1 45 LYS H 1 45 LYS HD3 . . 5.000 3.593 2.307 4.587 . 0 0 "[ . 1 . 2 . ]" 1 399 1 45 LYS H 1 46 LEU H . . 3.300 2.765 2.586 2.917 . 0 0 "[ . 1 . 2 . ]" 1 400 1 45 LYS HA 1 45 LYS QD . . 3.300 2.607 2.305 2.873 . 0 0 "[ . 1 . 2 . ]" 1 401 1 45 LYS HA 1 45 LYS QE . . 5.000 4.279 3.595 4.576 . 0 0 "[ . 1 . 2 . ]" 1 402 1 45 LYS HA 1 48 ALA H . . 5.000 3.680 3.205 4.262 . 0 0 "[ . 1 . 2 . ]" 1 403 1 45 LYS HA 1 48 ALA MB . . 5.000 2.831 2.148 3.656 . 0 0 "[ . 1 . 2 . ]" 1 404 1 46 LEU H 1 46 LEU MD1 . . 5.000 3.758 3.528 4.095 . 0 0 "[ . 1 . 2 . ]" 1 405 1 46 LEU H 1 46 LEU MD2 . . 3.300 2.568 2.367 2.669 . 0 0 "[ . 1 . 2 . ]" 1 406 1 46 LEU H 1 47 GLN H . . 3.300 2.853 2.692 3.070 . 0 0 "[ . 1 . 2 . ]" 1 407 1 46 LEU HA 1 46 LEU MD2 . . 3.300 2.398 2.090 2.587 . 0 0 "[ . 1 . 2 . ]" 1 408 1 46 LEU HA 1 49 GLY H . . 5.000 4.106 3.203 5.071 0.071 15 0 "[ . 1 . 2 . ]" 1 409 1 46 LEU HA 1 51 TYR QE . . 5.000 3.926 2.952 4.844 . 0 0 "[ . 1 . 2 . ]" 1 410 1 46 LEU QB 1 47 GLN H . . 5.000 2.566 2.292 2.830 . 0 0 "[ . 1 . 2 . ]" 1 411 1 46 LEU QB 1 72 ILE QG . . 5.000 3.837 3.355 4.044 . 0 0 "[ . 1 . 2 . ]" 1 412 1 46 LEU MD1 1 72 ILE MD . . 5.000 2.409 1.879 3.363 . 0 0 "[ . 1 . 2 . ]" 1 413 1 46 LEU MD2 1 51 TYR QB . . 5.000 2.933 2.082 3.665 . 0 0 "[ . 1 . 2 . ]" 1 414 1 46 LEU MD2 1 54 VAL MG1 . . 3.300 1.992 1.941 2.085 . 0 0 "[ . 1 . 2 . ]" 1 415 1 46 LEU MD2 1 72 ILE MD . . 5.000 3.099 2.409 3.402 . 0 0 "[ . 1 . 2 . ]" 1 416 1 47 GLN H 1 47 GLN QB . . 3.300 2.449 2.180 2.813 . 0 0 "[ . 1 . 2 . ]" 1 417 1 47 GLN H 1 47 GLN QG . . 3.300 2.332 1.920 2.687 . 0 0 "[ . 1 . 2 . ]" 1 418 1 47 GLN H 1 48 ALA H . . 5.000 2.931 2.680 3.268 . 0 0 "[ . 1 . 2 . ]" 1 419 1 47 GLN HA 1 48 ALA H . . 3.300 3.254 2.879 3.374 0.074 5 0 "[ . 1 . 2 . ]" 1 420 1 47 GLN HA 1 49 GLY H . . 5.000 3.569 2.786 5.073 0.073 8 0 "[ . 1 . 2 . ]" 1 421 1 47 GLN QG 1 48 ALA H . . 5.000 4.108 2.918 4.583 . 0 0 "[ . 1 . 2 . ]" 1 422 1 48 ALA H 1 48 ALA MB . . 2.900 2.338 2.157 2.430 . 0 0 "[ . 1 . 2 . ]" 1 423 1 49 GLY H 1 50 GLY H . . 5.000 3.718 1.932 4.477 . 0 0 "[ . 1 . 2 . ]" 1 424 1 50 GLY H 1 51 TYR H . . 5.000 3.244 1.927 4.432 . 0 0 "[ . 1 . 2 . ]" 1 425 1 51 TYR HA 1 52 GLY H . . 2.900 2.334 2.117 2.565 . 0 0 "[ . 1 . 2 . ]" 1 426 1 51 TYR HA 1 53 PHE H . . 5.000 3.997 3.220 4.920 . 0 0 "[ . 1 . 2 . ]" 1 427 1 51 TYR QB 1 53 PHE H . . 5.880 3.011 2.467 3.986 . 0 0 "[ . 1 . 2 . ]" 1 428 1 51 TYR HB2 1 52 GLY H . . 5.000 4.072 3.543 4.536 . 0 0 "[ . 1 . 2 . ]" 1 429 1 51 TYR HB3 1 52 GLY H . . 5.000 2.989 2.191 4.252 . 0 0 "[ . 1 . 2 . ]" 1 430 1 52 GLY H 1 53 PHE H . . 2.900 2.316 1.865 2.962 0.062 12 0 "[ . 1 . 2 . ]" 1 431 1 52 GLY QA 1 81 LEU MD2 . . 5.000 2.919 2.117 3.679 . 0 0 "[ . 1 . 2 . ]" 1 432 1 53 PHE H 1 54 VAL H . . 5.000 4.308 4.106 4.537 . 0 0 "[ . 1 . 2 . ]" 1 433 1 53 PHE HA 1 54 VAL H . . 2.900 2.216 2.134 2.343 . 0 0 "[ . 1 . 2 . ]" 1 434 1 53 PHE HA 1 81 LEU MD2 . . 5.000 3.329 2.829 4.049 . 0 0 "[ . 1 . 2 . ]" 1 435 1 53 PHE HA 1 82 PRO QG . . 3.300 2.148 1.989 2.538 . 0 0 "[ . 1 . 2 . ]" 1 436 1 53 PHE HB2 1 54 VAL H . . 5.000 4.254 3.902 4.498 . 0 0 "[ . 1 . 2 . ]" 1 437 1 53 PHE HB3 1 54 VAL H . . 5.000 3.247 2.685 3.978 . 0 0 "[ . 1 . 2 . ]" 1 438 1 53 PHE QR 1 55 ILE MD . . 5.000 2.478 2.201 3.316 . 0 0 "[ . 1 . 2 . ]" 1 439 1 54 VAL H 1 55 ILE H . . 5.000 3.742 3.226 4.326 . 0 0 "[ . 1 . 2 . ]" 1 440 1 54 VAL H 1 81 LEU MD2 . . 5.000 3.919 3.884 3.963 . 0 0 "[ . 1 . 2 . ]" 1 441 1 54 VAL H 1 83 VAL HA . . 5.000 3.455 2.810 3.978 . 0 0 "[ . 1 . 2 . ]" 1 442 1 54 VAL HA 1 54 VAL MG1 . . 3.300 2.319 2.180 2.505 . 0 0 "[ . 1 . 2 . ]" 1 443 1 54 VAL HA 1 55 ILE H . . 2.900 2.308 2.167 2.458 . 0 0 "[ . 1 . 2 . ]" 1 444 1 54 VAL HB 1 84 LEU H . . 5.000 3.992 3.453 4.732 . 0 0 "[ . 1 . 2 . ]" 1 445 1 54 VAL MG1 1 72 ILE MD . . 3.300 2.049 1.983 2.162 . 0 0 "[ . 1 . 2 . ]" 1 446 1 54 VAL MG1 1 81 LEU MD1 . . 5.000 3.202 2.959 3.302 . 0 0 "[ . 1 . 2 . ]" 1 447 1 54 VAL MG2 1 81 LEU QB . . 5.000 2.349 1.928 3.063 . 0 0 "[ . 1 . 2 . ]" 1 448 1 54 VAL MG2 1 81 LEU MD1 . . 5.000 1.903 1.853 1.979 . 0 0 "[ . 1 . 2 . ]" 1 449 1 54 VAL MG2 1 81 LEU HG . . 5.000 3.938 3.778 4.133 . 0 0 "[ . 1 . 2 . ]" 1 450 1 54 VAL MG2 1 83 VAL MG1 . . 5.000 3.039 2.657 3.388 . 0 0 "[ . 1 . 2 . ]" 1 451 1 55 ILE HA 1 55 ILE MG . . 3.300 2.395 2.255 2.587 . 0 0 "[ . 1 . 2 . ]" 1 452 1 55 ILE HA 1 56 SER H . . 2.900 2.296 2.197 2.373 . 0 0 "[ . 1 . 2 . ]" 1 453 1 55 ILE HA 1 84 LEU H . . 5.000 2.630 2.425 2.988 . 0 0 "[ . 1 . 2 . ]" 1 454 1 55 ILE HB 1 55 ILE MD . . 3.300 2.486 2.244 2.726 . 0 0 "[ . 1 . 2 . ]" 1 455 1 55 ILE MD 1 116 LEU MD2 . . 5.000 3.138 2.780 3.428 . 0 0 "[ . 1 . 2 . ]" 1 456 1 55 ILE QG 1 84 LEU QB . . 5.000 2.231 1.935 2.535 . 0 0 "[ . 1 . 2 . ]" 1 457 1 55 ILE MG 1 56 SER H . . 5.000 2.655 2.413 3.094 . 0 0 "[ . 1 . 2 . ]" 1 458 1 55 ILE MG 1 84 LEU QB . . 5.000 2.802 2.227 3.285 . 0 0 "[ . 1 . 2 . ]" 1 459 1 55 ILE MG 1 86 VAL HB . . 5.000 2.693 2.393 2.986 . 0 0 "[ . 1 . 2 . ]" 1 460 1 55 ILE MG 1 86 VAL MG1 . . 5.000 3.298 3.067 3.451 . 0 0 "[ . 1 . 2 . ]" 1 461 1 55 ILE MG 1 86 VAL MG2 . . 3.300 1.963 1.876 2.041 . 0 0 "[ . 1 . 2 . ]" 1 462 1 56 SER H 1 84 LEU O . . 1.800 2.051 1.965 2.087 0.287 16 0 "[ . 1 . 2 . ]" 1 463 1 56 SER H 1 85 MET HA . . 5.000 3.212 2.594 3.664 . 0 0 "[ . 1 . 2 . ]" 1 464 1 56 SER HA 1 57 ASP H . . 2.900 2.330 2.202 2.441 . 0 0 "[ . 1 . 2 . ]" 1 465 1 56 SER HA 1 86 VAL H . . 5.000 4.791 4.482 5.060 0.060 27 0 "[ . 1 . 2 . ]" 1 466 1 56 SER N 1 84 LEU O . . 2.700 3.022 2.950 3.055 0.355 23 0 "[ . 1 . 2 . ]" 1 467 1 56 SER O 1 86 VAL H . . 1.800 1.858 1.780 2.015 0.215 7 0 "[ . 1 . 2 . ]" 1 468 1 56 SER O 1 86 VAL N . . 2.700 2.847 2.788 2.992 0.292 7 0 "[ . 1 . 2 . ]" 1 469 1 57 ASP H 1 58 TRP H . . 5.000 4.491 4.200 4.599 . 0 0 "[ . 1 . 2 . ]" 1 470 1 57 ASP HA 1 86 VAL H . . 5.000 3.045 2.726 3.805 . 0 0 "[ . 1 . 2 . ]" 1 471 1 58 TRP H 1 58 TRP HB2 . . 3.300 2.737 2.460 3.237 . 0 0 "[ . 1 . 2 . ]" 1 472 1 58 TRP H 1 58 TRP HB3 . . 3.300 2.506 2.247 2.827 . 0 0 "[ . 1 . 2 . ]" 1 473 1 58 TRP H 1 59 ASN H . . 3.300 2.189 1.777 2.702 . 0 0 "[ . 1 . 2 . ]" 1 474 1 58 TRP H 1 87 THR HG1 . . 5.000 2.547 1.903 4.233 . 0 0 "[ . 1 . 2 . ]" 1 475 1 58 TRP HA 1 65 GLY H . . 5.000 2.849 2.242 3.486 . 0 0 "[ . 1 . 2 . ]" 1 476 1 58 TRP HB2 1 59 ASN H . . 5.000 3.737 3.516 4.135 . 0 0 "[ . 1 . 2 . ]" 1 477 1 58 TRP HB3 1 59 ASN H . . 5.000 2.449 1.959 3.029 . 0 0 "[ . 1 . 2 . ]" 1 478 1 58 TRP HD1 1 59 ASN HA . . 3.300 2.848 2.233 3.373 0.073 27 0 "[ . 1 . 2 . ]" 1 479 1 58 TRP HE3 1 87 THR MG . . 5.000 3.715 3.053 4.111 . 0 0 "[ . 1 . 2 . ]" 1 480 1 58 TRP HE3 1 106 TYR QE . . 5.000 2.755 1.974 4.286 . 0 0 "[ . 1 . 2 . ]" 1 481 1 58 TRP HH2 1 66 LEU MD2 . . 3.300 2.441 2.095 2.668 . 0 0 "[ . 1 . 2 . ]" 1 482 1 58 TRP HH2 1 94 ASN HA . . 5.000 2.867 2.444 3.536 . 0 0 "[ . 1 . 2 . ]" 1 483 1 58 TRP HH2 1 97 ALA MB . . 3.300 2.018 1.906 2.397 . 0 0 "[ . 1 . 2 . ]" 1 484 1 58 TRP HH2 1 98 ALA H . . 5.000 3.127 2.387 4.004 . 0 0 "[ . 1 . 2 . ]" 1 485 1 58 TRP HZ2 1 66 LEU MD2 . . 5.000 3.972 3.306 4.163 . 0 0 "[ . 1 . 2 . ]" 1 486 1 58 TRP HZ2 1 97 ALA MB . . 5.000 3.159 2.267 4.130 . 0 0 "[ . 1 . 2 . ]" 1 487 1 58 TRP HZ3 1 97 ALA MB . . 5.000 3.695 2.760 4.067 . 0 0 "[ . 1 . 2 . ]" 1 488 1 58 TRP HZ3 1 98 ALA MB . . 3.300 2.153 1.993 2.387 . 0 0 "[ . 1 . 2 . ]" 1 489 1 58 TRP HZ3 1 106 TYR QE . . 5.000 2.616 2.121 3.952 . 0 0 "[ . 1 . 2 . ]" 1 490 1 58 TRP O 1 65 GLY H . . 1.800 1.931 1.833 2.076 0.276 2 0 "[ . 1 . 2 . ]" 1 491 1 58 TRP O 1 65 GLY N . . 2.700 2.906 2.783 3.072 0.372 17 0 "[ . 1 . 2 . ]" 1 492 1 59 ASN HA 1 60 MET H . . 2.900 2.565 2.143 2.968 0.068 18 0 "[ . 1 . 2 . ]" 1 493 1 60 MET H 1 61 PRO QD . . 5.000 4.149 2.369 4.521 . 0 0 "[ . 1 . 2 . ]" 1 494 1 60 MET H 1 64 ASP HB2 . . 5.000 4.283 2.416 5.081 0.081 5 0 "[ . 1 . 2 . ]" 1 495 1 60 MET H 1 64 ASP HB3 . . 5.000 4.444 3.287 5.086 0.086 20 0 "[ . 1 . 2 . ]" 1 496 1 60 MET HA 1 61 PRO QD . . 2.900 2.176 2.031 2.350 . 0 0 "[ . 1 . 2 . ]" 1 497 1 60 MET QB 1 64 ASP HA . . 5.000 2.792 1.968 4.565 . 0 0 "[ . 1 . 2 . ]" 1 498 1 62 ASN H 1 62 ASN HA . . 2.900 2.589 2.158 2.972 0.072 10 0 "[ . 1 . 2 . ]" 1 499 1 62 ASN H 1 63 MET H . . 5.000 3.457 2.226 4.692 . 0 0 "[ . 1 . 2 . ]" 1 500 1 62 ASN HB2 1 63 MET H . . 3.300 2.766 1.886 3.382 0.082 3 0 "[ . 1 . 2 . ]" 1 501 1 62 ASN HB3 1 63 MET H . . 3.300 2.225 1.810 2.870 . 0 0 "[ . 1 . 2 . ]" 1 502 1 63 MET H 1 63 MET QB . . 3.300 2.335 2.193 2.458 . 0 0 "[ . 1 . 2 . ]" 1 503 1 63 MET H 1 64 ASP H . . 5.000 4.001 3.594 4.359 . 0 0 "[ . 1 . 2 . ]" 1 504 1 63 MET HA 1 63 MET QG . . 3.300 2.365 2.156 2.540 . 0 0 "[ . 1 . 2 . ]" 1 505 1 63 MET HA 1 64 ASP H . . 2.900 2.245 2.140 2.326 . 0 0 "[ . 1 . 2 . ]" 1 506 1 63 MET HA 1 67 GLU QG . . 5.000 3.393 2.356 4.322 . 0 0 "[ . 1 . 2 . ]" 1 507 1 63 MET QG 1 64 ASP H . . 5.000 3.636 3.155 4.234 . 0 0 "[ . 1 . 2 . ]" 1 508 1 63 MET QG 1 67 GLU QB . . 5.000 2.180 1.893 3.932 . 0 0 "[ . 1 . 2 . ]" 1 509 1 63 MET QG 1 67 GLU QG . . 5.000 3.603 2.159 4.046 . 0 0 "[ . 1 . 2 . ]" 1 510 1 63 MET QG 1 68 LEU H . . 5.000 2.823 2.394 4.579 . 0 0 "[ . 1 . 2 . ]" 1 511 1 64 ASP H 1 65 GLY H . . 5.000 4.675 4.585 4.742 . 0 0 "[ . 1 . 2 . ]" 1 512 1 64 ASP H 1 67 GLU HB2 . . 5.000 3.079 2.578 5.060 0.060 18 0 "[ . 1 . 2 . ]" 1 513 1 64 ASP H 1 67 GLU HB3 . . 5.000 4.403 3.998 5.043 0.043 4 0 "[ . 1 . 2 . ]" 1 514 1 64 ASP HA 1 65 GLY H . . 2.900 2.408 2.235 2.639 . 0 0 "[ . 1 . 2 . ]" 1 515 1 64 ASP HB2 1 65 GLY H . . 5.000 3.190 2.229 4.425 . 0 0 "[ . 1 . 2 . ]" 1 516 1 64 ASP HB3 1 65 GLY H . . 5.000 3.548 2.420 4.191 . 0 0 "[ . 1 . 2 . ]" 1 517 1 64 ASP O 1 68 LEU H . . 1.800 1.909 1.748 2.069 0.269 4 0 "[ . 1 . 2 . ]" 1 518 1 64 ASP O 1 68 LEU N . . 2.700 2.897 2.762 3.043 0.343 4 0 "[ . 1 . 2 . ]" 1 519 1 65 GLY H 1 66 LEU H . . 5.000 2.876 2.761 3.011 . 0 0 "[ . 1 . 2 . ]" 1 520 1 65 GLY QA 1 69 LEU H . . 5.000 3.719 3.554 3.883 . 0 0 "[ . 1 . 2 . ]" 1 521 1 65 GLY O 1 69 LEU H . . 1.800 2.009 1.892 2.077 0.277 17 0 "[ . 1 . 2 . ]" 1 522 1 65 GLY O 1 69 LEU N . . 2.700 2.993 2.871 3.065 0.365 17 0 "[ . 1 . 2 . ]" 1 523 1 66 LEU H 1 67 GLU H . . 2.900 2.439 2.256 2.667 . 0 0 "[ . 1 . 2 . ]" 1 524 1 66 LEU H 1 67 GLU QG . . 5.000 4.185 3.828 4.482 . 0 0 "[ . 1 . 2 . ]" 1 525 1 66 LEU HA 1 66 LEU MD2 . . 3.300 2.049 1.994 2.169 . 0 0 "[ . 1 . 2 . ]" 1 526 1 66 LEU HA 1 69 LEU H . . 5.000 3.412 3.181 3.703 . 0 0 "[ . 1 . 2 . ]" 1 527 1 66 LEU HA 1 69 LEU MD2 . . 5.000 2.980 2.688 3.258 . 0 0 "[ . 1 . 2 . ]" 1 528 1 66 LEU HA 1 70 LYS H . . 5.000 3.932 3.809 4.120 . 0 0 "[ . 1 . 2 . ]" 1 529 1 66 LEU QB 1 97 ALA MB . . 5.000 3.684 3.521 3.731 . 0 0 "[ . 1 . 2 . ]" 1 530 1 66 LEU HB2 1 67 GLU H . . 5.000 3.734 3.367 3.922 . 0 0 "[ . 1 . 2 . ]" 1 531 1 66 LEU HB3 1 67 GLU H . . 5.000 2.812 2.459 3.223 . 0 0 "[ . 1 . 2 . ]" 1 532 1 66 LEU MD1 1 70 LYS QE . . 3.300 2.014 1.793 2.540 . 0 0 "[ . 1 . 2 . ]" 1 533 1 66 LEU MD1 1 97 ALA MB . . 5.000 2.633 2.306 2.978 . 0 0 "[ . 1 . 2 . ]" 1 534 1 66 LEU MD1 1 98 ALA HA . . 5.000 3.937 2.859 4.157 . 0 0 "[ . 1 . 2 . ]" 1 535 1 66 LEU MD1 1 101 ALA H . . 5.000 3.913 3.492 4.056 . 0 0 "[ . 1 . 2 . ]" 1 536 1 66 LEU MD2 1 69 LEU MD2 . . 5.000 2.080 1.949 2.551 . 0 0 "[ . 1 . 2 . ]" 1 537 1 66 LEU MD2 1 97 ALA MB . . 5.000 2.582 2.036 2.997 . 0 0 "[ . 1 . 2 . ]" 1 538 1 66 LEU MD2 1 101 ALA MB . . 5.000 2.373 2.047 3.241 . 0 0 "[ . 1 . 2 . ]" 1 539 1 66 LEU O 1 70 LYS H . . 1.800 1.848 1.754 2.037 0.237 5 0 "[ . 1 . 2 . ]" 1 540 1 66 LEU O 1 70 LYS N . . 2.700 2.850 2.752 3.032 0.332 5 0 "[ . 1 . 2 . ]" 1 541 1 67 GLU H 1 67 GLU QG . . 3.300 2.399 2.127 2.709 . 0 0 "[ . 1 . 2 . ]" 1 542 1 67 GLU HA 1 70 LYS H . . 5.000 3.216 2.846 3.381 . 0 0 "[ . 1 . 2 . ]" 1 543 1 67 GLU HA 1 71 THR H . . 5.000 3.826 3.579 4.047 . 0 0 "[ . 1 . 2 . ]" 1 544 1 67 GLU QG 1 68 LEU H . . 5.000 4.057 2.447 4.310 . 0 0 "[ . 1 . 2 . ]" 1 545 1 67 GLU O 1 71 THR H . . 1.800 1.913 1.764 2.045 0.245 16 0 "[ . 1 . 2 . ]" 1 546 1 67 GLU O 1 71 THR N . . 2.700 2.832 2.729 2.897 0.197 26 0 "[ . 1 . 2 . ]" 1 547 1 68 LEU H 1 68 LEU HB2 . . 2.900 2.570 2.420 2.657 . 0 0 "[ . 1 . 2 . ]" 1 548 1 68 LEU H 1 68 LEU HB3 . . 2.900 2.488 2.369 2.633 . 0 0 "[ . 1 . 2 . ]" 1 549 1 68 LEU H 1 69 LEU H . . 2.900 2.827 2.688 2.950 0.050 13 0 "[ . 1 . 2 . ]" 1 550 1 68 LEU HA 1 71 THR H . . 5.000 3.611 3.421 3.819 . 0 0 "[ . 1 . 2 . ]" 1 551 1 68 LEU HA 1 71 THR HB . . 5.000 2.814 2.570 2.938 . 0 0 "[ . 1 . 2 . ]" 1 552 1 68 LEU HA 1 71 THR MG . . 5.000 4.045 3.829 4.191 . 0 0 "[ . 1 . 2 . ]" 1 553 1 68 LEU HA 1 72 ILE H . . 5.000 4.097 3.908 4.278 . 0 0 "[ . 1 . 2 . ]" 1 554 1 68 LEU MD1 1 71 THR HB . . 5.000 3.383 3.089 3.639 . 0 0 "[ . 1 . 2 . ]" 1 555 1 68 LEU MD1 1 72 ILE MD . . 5.000 2.455 2.221 2.987 . 0 0 "[ . 1 . 2 . ]" 1 556 1 68 LEU MD1 1 72 ILE QG . . 5.000 2.943 2.294 3.408 . 0 0 "[ . 1 . 2 . ]" 1 557 1 68 LEU MD2 1 72 ILE MD . . 5.000 3.114 2.915 3.369 . 0 0 "[ . 1 . 2 . ]" 1 558 1 68 LEU HG 1 72 ILE MD . . 3.300 2.287 2.062 2.510 . 0 0 "[ . 1 . 2 . ]" 1 559 1 68 LEU O 1 72 ILE H . . 1.800 1.979 1.837 2.073 0.273 22 0 "[ . 1 . 2 . ]" 1 560 1 68 LEU O 1 72 ILE N . . 2.700 2.975 2.847 3.057 0.357 10 0 "[ . 1 . 2 . ]" 1 561 1 69 LEU H 1 69 LEU HB2 . . 3.300 2.832 2.703 2.973 . 0 0 "[ . 1 . 2 . ]" 1 562 1 69 LEU H 1 69 LEU HB3 . . 3.300 2.192 2.131 2.312 . 0 0 "[ . 1 . 2 . ]" 1 563 1 69 LEU H 1 70 LYS H . . 2.900 2.961 2.925 2.973 0.073 5 0 "[ . 1 . 2 . ]" 1 564 1 69 LEU HA 1 72 ILE H . . 5.000 3.633 3.478 3.776 . 0 0 "[ . 1 . 2 . ]" 1 565 1 69 LEU HA 1 72 ILE MD . . 5.000 2.949 2.238 3.851 . 0 0 "[ . 1 . 2 . ]" 1 566 1 69 LEU HA 1 72 ILE MG . . 5.000 3.819 3.448 4.189 . 0 0 "[ . 1 . 2 . ]" 1 567 1 69 LEU HA 1 73 ARG H . . 5.000 3.904 3.780 4.072 . 0 0 "[ . 1 . 2 . ]" 1 568 1 69 LEU HA 1 83 VAL MG1 . . 3.300 2.352 2.161 2.546 . 0 0 "[ . 1 . 2 . ]" 1 569 1 69 LEU HA 1 83 VAL MG2 . . 5.000 2.842 2.124 4.072 . 0 0 "[ . 1 . 2 . ]" 1 570 1 69 LEU QB 1 70 LYS H . . 5.000 2.664 2.513 2.860 . 0 0 "[ . 1 . 2 . ]" 1 571 1 69 LEU QB 1 70 LYS QG . . 5.000 3.672 3.499 3.909 . 0 0 "[ . 1 . 2 . ]" 1 572 1 69 LEU QB 1 83 VAL MG1 . . 5.000 3.302 2.800 3.431 . 0 0 "[ . 1 . 2 . ]" 1 573 1 69 LEU MD1 1 70 LYS H . . 5.000 3.835 3.659 3.989 . 0 0 "[ . 1 . 2 . ]" 1 574 1 69 LEU MD1 1 73 ARG HA . . 5.000 4.096 3.927 4.168 . 0 0 "[ . 1 . 2 . ]" 1 575 1 69 LEU MD1 1 83 VAL MG2 . . 5.000 1.899 1.822 1.956 . 0 0 "[ . 1 . 2 . ]" 1 576 1 69 LEU MD1 1 103 ALA HA . . 3.300 2.318 2.139 2.569 . 0 0 "[ . 1 . 2 . ]" 1 577 1 69 LEU MD1 1 103 ALA MB . . 5.000 3.209 3.001 3.343 . 0 0 "[ . 1 . 2 . ]" 1 578 1 69 LEU MD2 1 83 VAL MG2 . . 5.000 2.758 2.181 3.272 . 0 0 "[ . 1 . 2 . ]" 1 579 1 69 LEU MD2 1 98 ALA HA . . 3.300 2.624 2.333 2.772 . 0 0 "[ . 1 . 2 . ]" 1 580 1 69 LEU MD2 1 98 ALA MB . . 5.000 3.261 2.983 3.450 . 0 0 "[ . 1 . 2 . ]" 1 581 1 69 LEU MD2 1 101 ALA H . . 5.000 4.023 3.784 4.082 . 0 0 "[ . 1 . 2 . ]" 1 582 1 69 LEU MD2 1 101 ALA MB . . 3.300 2.008 1.965 2.052 . 0 0 "[ . 1 . 2 . ]" 1 583 1 69 LEU MD2 1 102 GLY H . . 5.000 3.449 2.962 3.941 . 0 0 "[ . 1 . 2 . ]" 1 584 1 69 LEU MD2 1 103 ALA H . . 3.300 2.474 2.325 2.600 . 0 0 "[ . 1 . 2 . ]" 1 585 1 69 LEU MD2 1 103 ALA HA . . 5.000 2.436 2.148 2.693 . 0 0 "[ . 1 . 2 . ]" 1 586 1 69 LEU MD2 1 103 ALA MB . . 2.900 1.861 1.832 1.886 . 0 0 "[ . 1 . 2 . ]" 1 587 1 69 LEU HG 1 70 LYS H . . 5.000 2.815 2.660 3.048 . 0 0 "[ . 1 . 2 . ]" 1 588 1 69 LEU HG 1 70 LYS QE . . 5.000 4.340 4.182 4.517 . 0 0 "[ . 1 . 2 . ]" 1 589 1 69 LEU HG 1 101 ALA MB . . 5.000 2.122 1.990 2.246 . 0 0 "[ . 1 . 2 . ]" 1 590 1 69 LEU O 1 73 ARG H . . 1.800 1.766 1.688 1.907 0.107 24 0 "[ . 1 . 2 . ]" 1 591 1 69 LEU O 1 73 ARG N . . 2.700 2.754 2.680 2.843 0.143 15 0 "[ . 1 . 2 . ]" 1 592 1 70 LYS H 1 70 LYS HA . . 2.900 2.863 2.827 2.913 0.013 5 0 "[ . 1 . 2 . ]" 1 593 1 70 LYS H 1 71 THR H . . 2.900 2.810 2.718 2.877 . 0 0 "[ . 1 . 2 . ]" 1 594 1 70 LYS H 1 101 ALA MB . . 5.000 3.899 3.597 4.103 . 0 0 "[ . 1 . 2 . ]" 1 595 1 70 LYS HA 1 70 LYS QG . . 3.300 2.273 2.106 2.536 . 0 0 "[ . 1 . 2 . ]" 1 596 1 70 LYS HA 1 73 ARG H . . 3.300 3.189 2.884 3.357 0.057 3 0 "[ . 1 . 2 . ]" 1 597 1 70 LYS HA 1 74 ALA H . . 5.000 4.348 3.694 5.035 0.035 24 0 "[ . 1 . 2 . ]" 1 598 1 70 LYS HA 1 101 ALA MB . . 5.000 3.584 3.169 3.895 . 0 0 "[ . 1 . 2 . ]" 1 599 1 70 LYS QB 1 70 LYS QD . . 3.300 2.115 2.035 2.191 . 0 0 "[ . 1 . 2 . ]" 1 600 1 70 LYS QB 1 73 ARG QB . . 5.000 3.944 3.709 4.042 . 0 0 "[ . 1 . 2 . ]" 1 601 1 70 LYS QE 1 101 ALA MB . . 3.300 1.948 1.798 2.174 . 0 0 "[ . 1 . 2 . ]" 1 602 1 70 LYS QG 1 101 ALA MB . . 3.300 2.147 1.958 2.334 . 0 0 "[ . 1 . 2 . ]" 1 603 1 71 THR H 1 71 THR HA . . 2.900 2.868 2.822 2.906 0.006 9 0 "[ . 1 . 2 . ]" 1 604 1 71 THR H 1 71 THR HB . . 3.300 2.472 2.321 2.635 . 0 0 "[ . 1 . 2 . ]" 1 605 1 71 THR H 1 72 ILE H . . 2.900 2.689 2.508 2.845 . 0 0 "[ . 1 . 2 . ]" 1 606 1 71 THR HA 1 71 THR MG . . 3.300 2.416 2.343 2.522 . 0 0 "[ . 1 . 2 . ]" 1 607 1 71 THR HA 1 74 ALA H . . 5.000 3.749 3.261 4.399 . 0 0 "[ . 1 . 2 . ]" 1 608 1 71 THR HA 1 74 ALA MB . . 5.000 3.062 2.471 3.976 . 0 0 "[ . 1 . 2 . ]" 1 609 1 71 THR MG 1 72 ILE H . . 5.000 3.474 2.923 3.863 . 0 0 "[ . 1 . 2 . ]" 1 610 1 72 ILE H 1 72 ILE HB . . 2.900 2.234 2.060 2.684 . 0 0 "[ . 1 . 2 . ]" 1 611 1 72 ILE H 1 72 ILE MD . . 5.000 3.432 3.180 3.801 . 0 0 "[ . 1 . 2 . ]" 1 612 1 72 ILE H 1 72 ILE HG12 . . 5.000 3.723 3.119 3.957 . 0 0 "[ . 1 . 2 . ]" 1 613 1 72 ILE H 1 72 ILE HG13 . . 5.000 2.440 1.874 2.693 . 0 0 "[ . 1 . 2 . ]" 1 614 1 72 ILE H 1 73 ARG H . . 3.300 2.695 2.502 2.881 . 0 0 "[ . 1 . 2 . ]" 1 615 1 72 ILE H 1 73 ARG QB . . 5.000 4.346 4.162 4.474 . 0 0 "[ . 1 . 2 . ]" 1 616 1 72 ILE HA 1 72 ILE MG . . 3.300 2.608 2.398 2.770 . 0 0 "[ . 1 . 2 . ]" 1 617 1 72 ILE HA 1 75 ASP H . . 5.000 4.433 3.551 5.086 0.086 10 0 "[ . 1 . 2 . ]" 1 618 1 72 ILE HB 1 72 ILE MD . . 3.300 2.335 2.151 2.578 . 0 0 "[ . 1 . 2 . ]" 1 619 1 72 ILE HB 1 73 ARG H . . 3.300 2.694 2.447 2.975 . 0 0 "[ . 1 . 2 . ]" 1 620 1 72 ILE QG 1 72 ILE MG . . 3.300 2.292 2.166 2.422 . 0 0 "[ . 1 . 2 . ]" 1 621 1 72 ILE MG 1 73 ARG H . . 5.000 3.138 2.843 3.627 . 0 0 "[ . 1 . 2 . ]" 1 622 1 72 ILE MG 1 73 ARG HA . . 5.000 3.328 3.006 3.814 . 0 0 "[ . 1 . 2 . ]" 1 623 1 72 ILE MG 1 78 MET QB . . 3.300 2.087 1.958 2.233 . 0 0 "[ . 1 . 2 . ]" 1 624 1 72 ILE MG 1 79 SER HA . . 5.000 3.037 2.208 3.854 . 0 0 "[ . 1 . 2 . ]" 1 625 1 72 ILE MG 1 81 LEU H . . 5.000 3.405 3.228 3.764 . 0 0 "[ . 1 . 2 . ]" 1 626 1 72 ILE MG 1 81 LEU QB . . 3.300 2.210 1.925 2.371 . 0 0 "[ . 1 . 2 . ]" 1 627 1 72 ILE MG 1 81 LEU QD . . 5.000 2.218 1.938 2.581 . 0 0 "[ . 1 . 2 . ]" 1 628 1 72 ILE MG 1 81 LEU HG . . 5.000 3.714 3.494 3.957 . 0 0 "[ . 1 . 2 . ]" 1 629 1 72 ILE MG 1 83 VAL QG . . 5.000 2.167 1.995 2.520 . 0 0 "[ . 1 . 2 . ]" 1 630 1 73 ARG H 1 73 ARG QB . . 2.900 2.098 2.002 2.210 . 0 0 "[ . 1 . 2 . ]" 1 631 1 73 ARG H 1 74 ALA H . . 3.300 2.867 2.666 3.062 . 0 0 "[ . 1 . 2 . ]" 1 632 1 73 ARG HA 1 79 SER HA . . 3.300 2.404 1.950 3.376 0.076 3 0 "[ . 1 . 2 . ]" 1 633 1 74 ALA H 1 74 ALA MB . . 2.900 2.240 2.145 2.418 . 0 0 "[ . 1 . 2 . ]" 1 634 1 74 ALA H 1 75 ASP H . . 3.300 2.776 2.122 3.237 . 0 0 "[ . 1 . 2 . ]" 1 635 1 75 ASP H 1 76 GLY H . . 5.000 3.968 1.810 4.686 . 0 0 "[ . 1 . 2 . ]" 1 636 1 75 ASP H 1 79 SER HA . . 5.000 4.387 3.212 5.082 0.082 24 0 "[ . 1 . 2 . ]" 1 637 1 75 ASP H 1 79 SER QB . . 5.000 3.521 2.497 4.342 . 0 0 "[ . 1 . 2 . ]" 1 638 1 75 ASP HA 1 78 MET H . . 5.000 4.530 3.117 5.099 0.099 24 0 "[ . 1 . 2 . ]" 1 639 1 75 ASP QB 1 77 ALA H . . 5.000 3.757 2.310 4.598 . 0 0 "[ . 1 . 2 . ]" 1 640 1 76 GLY H 1 77 ALA H . . 3.300 2.841 1.868 3.382 0.082 24 0 "[ . 1 . 2 . ]" 1 641 1 77 ALA H 1 78 MET QG . . 5.000 4.190 3.596 4.574 . 0 0 "[ . 1 . 2 . ]" 1 642 1 77 ALA HA 1 78 MET HA . . 5.000 4.654 4.251 4.825 . 0 0 "[ . 1 . 2 . ]" 1 643 1 78 MET H 1 78 MET QG . . 3.300 2.395 1.863 3.001 . 0 0 "[ . 1 . 2 . ]" 1 644 1 78 MET H 1 79 SER H . . 2.900 2.552 1.984 2.989 0.089 19 0 "[ . 1 . 2 . ]" 1 645 1 78 MET HA 1 78 MET QG . . 3.300 2.515 2.242 3.001 . 0 0 "[ . 1 . 2 . ]" 1 646 1 78 MET HA 1 79 SER H . . 3.300 3.334 2.993 3.388 0.088 25 0 "[ . 1 . 2 . ]" 1 647 1 78 MET HA 1 80 ALA H . . 5.000 3.639 3.126 4.550 . 0 0 "[ . 1 . 2 . ]" 1 648 1 78 MET HA 1 81 LEU H . . 5.000 3.666 2.923 4.212 . 0 0 "[ . 1 . 2 . ]" 1 649 1 78 MET HA 1 81 LEU QB . . 5.000 4.090 2.832 4.359 . 0 0 "[ . 1 . 2 . ]" 1 650 1 78 MET HA 1 81 LEU QD . . 5.000 3.154 2.627 3.856 . 0 0 "[ . 1 . 2 . ]" 1 651 1 78 MET HA 1 81 LEU HG . . 5.000 2.936 2.280 3.601 . 0 0 "[ . 1 . 2 . ]" 1 652 1 78 MET HB2 1 79 SER H . . 5.000 3.541 3.041 4.439 . 0 0 "[ . 1 . 2 . ]" 1 653 1 78 MET HB3 1 79 SER H . . 5.000 4.296 3.985 4.613 . 0 0 "[ . 1 . 2 . ]" 1 654 1 78 MET QG 1 81 LEU MD1 . . 5.000 3.225 2.423 3.653 . 0 0 "[ . 1 . 2 . ]" 1 655 1 79 SER H 1 80 ALA H . . 3.300 2.904 2.689 3.203 . 0 0 "[ . 1 . 2 . ]" 1 656 1 79 SER HA 1 81 LEU H . . 5.000 3.773 3.416 4.275 . 0 0 "[ . 1 . 2 . ]" 1 657 1 80 ALA H 1 80 ALA MB . . 2.900 2.226 2.141 2.355 . 0 0 "[ . 1 . 2 . ]" 1 658 1 80 ALA H 1 81 LEU H . . 2.900 2.707 2.468 2.918 0.018 1 0 "[ . 1 . 2 . ]" 1 659 1 81 LEU HA 1 82 PRO QD . . 2.900 2.065 2.003 2.141 . 0 0 "[ . 1 . 2 . ]" 1 660 1 81 LEU QD 1 82 PRO QD . . 5.000 2.366 2.019 2.712 . 0 0 "[ . 1 . 2 . ]" 1 661 1 82 PRO HA 1 123 ILE MG . . 5.000 3.772 3.169 3.996 . 0 0 "[ . 1 . 2 . ]" 1 662 1 82 PRO HA 1 127 LEU MD1 . . 5.000 2.666 2.082 3.246 . 0 0 "[ . 1 . 2 . ]" 1 663 1 82 PRO QB 1 123 ILE MG . . 5.000 2.718 2.101 3.350 . 0 0 "[ . 1 . 2 . ]" 1 664 1 82 PRO QB 1 127 LEU MD1 . . 5.000 2.224 2.016 2.576 . 0 0 "[ . 1 . 2 . ]" 1 665 1 82 PRO QG 1 127 LEU MD1 . . 5.000 3.521 2.960 3.666 . 0 0 "[ . 1 . 2 . ]" 1 666 1 83 VAL H 1 83 VAL MG2 . . 3.300 1.978 1.666 2.532 . 0 0 "[ . 1 . 2 . ]" 1 667 1 83 VAL H 1 104 SER QB . . 5.000 3.102 2.460 4.437 . 0 0 "[ . 1 . 2 . ]" 1 668 1 83 VAL HA 1 84 LEU H . . 2.900 2.183 2.097 2.321 . 0 0 "[ . 1 . 2 . ]" 1 669 1 83 VAL HB 1 103 ALA HA . . 5.000 4.351 3.372 5.063 0.063 25 0 "[ . 1 . 2 . ]" 1 670 1 83 VAL QG 1 104 SER H . . 5.000 2.428 1.909 3.169 . 0 0 "[ . 1 . 2 . ]" 1 671 1 83 VAL MG2 1 103 ALA HA . . 5.000 2.223 1.972 2.518 . 0 0 "[ . 1 . 2 . ]" 1 672 1 83 VAL MG2 1 103 ALA MB . . 5.000 2.939 2.188 3.284 . 0 0 "[ . 1 . 2 . ]" 1 673 1 83 VAL O 1 104 SER H . . 1.800 2.001 1.815 2.078 0.278 25 0 "[ . 1 . 2 . ]" 1 674 1 83 VAL O 1 104 SER N . . 2.700 2.887 2.779 3.017 0.317 12 0 "[ . 1 . 2 . ]" 1 675 1 84 LEU H 1 85 MET H . . 5.000 4.249 4.029 4.494 . 0 0 "[ . 1 . 2 . ]" 1 676 1 84 LEU HA 1 84 LEU MD1 . . 3.300 2.169 2.074 2.243 . 0 0 "[ . 1 . 2 . ]" 1 677 1 84 LEU HA 1 85 MET H . . 2.900 2.149 2.094 2.228 . 0 0 "[ . 1 . 2 . ]" 1 678 1 84 LEU HA 1 105 GLY H . . 5.000 2.983 2.742 3.300 . 0 0 "[ . 1 . 2 . ]" 1 679 1 84 LEU MD1 1 85 MET H . . 3.300 2.367 2.299 2.438 . 0 0 "[ . 1 . 2 . ]" 1 680 1 84 LEU MD1 1 105 GLY H . . 5.000 3.125 2.549 3.549 . 0 0 "[ . 1 . 2 . ]" 1 681 1 84 LEU MD1 1 105 GLY QA . . 5.000 2.439 2.048 3.129 . 0 0 "[ . 1 . 2 . ]" 1 682 1 84 LEU MD1 1 106 TYR HA . . 5.000 3.344 2.907 3.835 . 0 0 "[ . 1 . 2 . ]" 1 683 1 84 LEU MD1 1 107 VAL HB . . 5.000 3.811 3.187 4.073 . 0 0 "[ . 1 . 2 . ]" 1 684 1 84 LEU MD1 1 119 LYS QB . . 5.000 2.780 2.342 3.471 . 0 0 "[ . 1 . 2 . ]" 1 685 1 84 LEU MD2 1 86 VAL MG2 . . 5.000 3.012 2.716 3.545 . 0 0 "[ . 1 . 2 . ]" 1 686 1 84 LEU MD2 1 123 ILE MD . . 5.000 2.994 2.200 3.332 . 0 0 "[ . 1 . 2 . ]" 1 687 1 84 LEU HG 1 86 VAL MG2 . . 5.000 2.148 2.020 2.532 . 0 0 "[ . 1 . 2 . ]" 1 688 1 85 MET H 1 85 MET QG . . 5.000 2.366 2.115 2.649 . 0 0 "[ . 1 . 2 . ]" 1 689 1 85 MET H 1 86 VAL H . . 5.000 4.494 4.291 4.566 . 0 0 "[ . 1 . 2 . ]" 1 690 1 85 MET H 1 105 GLY H . . 5.000 3.488 3.070 3.673 . 0 0 "[ . 1 . 2 . ]" 1 691 1 85 MET H 1 105 GLY O . . 1.800 2.053 1.971 2.077 0.277 9 0 "[ . 1 . 2 . ]" 1 692 1 85 MET H 1 106 TYR HA . . 5.000 3.117 2.816 3.511 . 0 0 "[ . 1 . 2 . ]" 1 693 1 85 MET HA 1 86 VAL H . . 2.900 2.216 2.146 2.275 . 0 0 "[ . 1 . 2 . ]" 1 694 1 85 MET HA 1 86 VAL MG2 . . 5.000 3.733 3.518 3.953 . 0 0 "[ . 1 . 2 . ]" 1 695 1 85 MET QB 1 107 VAL H . . 5.000 3.304 2.976 3.580 . 0 0 "[ . 1 . 2 . ]" 1 696 1 85 MET QG 1 98 ALA MB . . 5.000 2.589 2.030 3.352 . 0 0 "[ . 1 . 2 . ]" 1 697 1 85 MET QG 1 103 ALA MB . . 3.300 2.420 2.151 2.580 . 0 0 "[ . 1 . 2 . ]" 1 698 1 85 MET QG 1 105 GLY H . . 5.000 4.090 3.660 4.522 . 0 0 "[ . 1 . 2 . ]" 1 699 1 85 MET N 1 105 GLY O . . 2.700 3.052 2.977 3.078 0.378 15 0 "[ . 1 . 2 . ]" 1 700 1 85 MET O 1 107 VAL H . . 1.800 1.910 1.794 2.064 0.264 16 0 "[ . 1 . 2 . ]" 1 701 1 85 MET O 1 107 VAL N . . 2.700 2.813 2.749 2.921 0.221 7 0 "[ . 1 . 2 . ]" 1 702 1 86 VAL H 1 86 VAL HB . . 2.900 2.696 2.529 2.804 . 0 0 "[ . 1 . 2 . ]" 1 703 1 86 VAL H 1 87 THR H . . 5.000 4.010 3.654 4.300 . 0 0 "[ . 1 . 2 . ]" 1 704 1 86 VAL HA 1 86 VAL MG1 . . 3.300 2.400 2.317 2.483 . 0 0 "[ . 1 . 2 . ]" 1 705 1 86 VAL HA 1 86 VAL MG2 . . 3.300 2.449 2.339 2.521 . 0 0 "[ . 1 . 2 . ]" 1 706 1 86 VAL HA 1 87 THR H . . 2.900 2.240 2.172 2.322 . 0 0 "[ . 1 . 2 . ]" 1 707 1 86 VAL HA 1 107 VAL H . . 3.300 3.014 2.802 3.272 . 0 0 "[ . 1 . 2 . ]" 1 708 1 86 VAL HA 1 107 VAL HB . . 5.000 2.291 2.036 2.930 . 0 0 "[ . 1 . 2 . ]" 1 709 1 86 VAL MG1 1 87 THR H . . 5.000 3.321 2.866 3.703 . 0 0 "[ . 1 . 2 . ]" 1 710 1 86 VAL MG1 1 111 PHE QR . . 5.000 2.509 2.356 2.732 . 0 0 "[ . 1 . 2 . ]" 1 711 1 87 THR H 1 88 ALA H . . 5.000 4.391 4.228 4.497 . 0 0 "[ . 1 . 2 . ]" 1 712 1 87 THR H 1 107 VAL MG1 . . 5.000 3.759 3.463 4.002 . 0 0 "[ . 1 . 2 . ]" 1 713 1 87 THR H 1 109 LYS H . . 5.000 4.085 3.787 4.418 . 0 0 "[ . 1 . 2 . ]" 1 714 1 87 THR HA 1 88 ALA H . . 3.300 2.506 2.360 2.795 . 0 0 "[ . 1 . 2 . ]" 1 715 1 87 THR HA 1 89 GLU H . . 5.000 4.054 3.725 4.672 . 0 0 "[ . 1 . 2 . ]" 1 716 1 87 THR HB 1 88 ALA H . . 5.000 3.728 3.548 3.925 . 0 0 "[ . 1 . 2 . ]" 1 717 1 87 THR HG1 1 88 ALA H . . 5.000 2.612 2.125 3.481 . 0 0 "[ . 1 . 2 . ]" 1 718 1 87 THR HG1 1 89 GLU H . . 5.000 3.131 2.417 4.082 . 0 0 "[ . 1 . 2 . ]" 1 719 1 87 THR MG 1 89 GLU H . . 3.300 2.395 2.166 2.603 . 0 0 "[ . 1 . 2 . ]" 1 720 1 87 THR MG 1 106 TYR QE . . 5.000 2.438 2.113 3.169 . 0 0 "[ . 1 . 2 . ]" 1 721 1 87 THR MG 1 108 VAL HA . . 5.000 3.084 2.834 3.597 . 0 0 "[ . 1 . 2 . ]" 1 722 1 87 THR MG 1 108 VAL QG . . 5.000 2.723 2.219 2.931 . 0 0 "[ . 1 . 2 . ]" 1 723 1 87 THR O 1 109 LYS H . . 1.800 2.028 1.908 2.072 0.272 4 0 "[ . 1 . 2 . ]" 1 724 1 87 THR O 1 109 LYS N . . 2.700 2.875 2.784 2.968 0.268 22 0 "[ . 1 . 2 . ]" 1 725 1 88 ALA H 1 88 ALA MB . . 3.300 2.303 2.203 2.505 . 0 0 "[ . 1 . 2 . ]" 1 726 1 88 ALA H 1 89 GLU H . . 3.300 2.257 1.833 2.539 . 0 0 "[ . 1 . 2 . ]" 1 727 1 88 ALA HA 1 108 VAL QG . . 5.000 3.035 2.629 3.333 . 0 0 "[ . 1 . 2 . ]" 1 728 1 88 ALA HA 1 109 LYS H . . 5.000 2.442 1.930 3.006 . 0 0 "[ . 1 . 2 . ]" 1 729 1 88 ALA MB 1 89 GLU HA . . 5.000 3.840 3.585 4.089 . 0 0 "[ . 1 . 2 . ]" 1 730 1 88 ALA MB 1 89 GLU QG . . 5.000 3.103 2.522 3.552 . 0 0 "[ . 1 . 2 . ]" 1 731 1 88 ALA MB 1 109 LYS QB . . 5.000 3.245 2.325 3.708 . 0 0 "[ . 1 . 2 . ]" 1 732 1 89 GLU H 1 89 GLU QB . . 3.300 2.316 2.095 2.457 . 0 0 "[ . 1 . 2 . ]" 1 733 1 89 GLU H 1 89 GLU QG . . 2.900 2.441 2.172 2.669 . 0 0 "[ . 1 . 2 . ]" 1 734 1 89 GLU HA 1 89 GLU QG . . 3.300 2.561 2.195 2.930 . 0 0 "[ . 1 . 2 . ]" 1 735 1 89 GLU HA 1 90 ALA H . . 2.900 2.219 2.109 2.315 . 0 0 "[ . 1 . 2 . ]" 1 736 1 89 GLU HA 1 90 ALA MB . . 5.000 4.099 3.973 4.173 . 0 0 "[ . 1 . 2 . ]" 1 737 1 90 ALA H 1 90 ALA MB . . 3.300 2.280 2.167 2.374 . 0 0 "[ . 1 . 2 . ]" 1 738 1 90 ALA H 1 91 LYS H . . 5.000 2.854 2.441 3.229 . 0 0 "[ . 1 . 2 . ]" 1 739 1 90 ALA H 1 108 VAL MG1 . . 5.000 2.981 2.774 3.310 . 0 0 "[ . 1 . 2 . ]" 1 740 1 90 ALA HA 1 95 ILE MD . . 3.300 2.582 2.392 2.790 . 0 0 "[ . 1 . 2 . ]" 1 741 1 90 ALA HA 1 108 VAL QG . . 2.900 2.044 1.950 2.146 . 0 0 "[ . 1 . 2 . ]" 1 742 1 90 ALA MB 1 95 ILE MD . . 5.000 3.152 2.533 3.444 . 0 0 "[ . 1 . 2 . ]" 1 743 1 90 ALA MB 1 108 VAL HB . . 5.000 3.913 3.571 4.078 . 0 0 "[ . 1 . 2 . ]" 1 744 1 90 ALA MB 1 108 VAL QG . . 5.000 2.040 1.908 2.227 . 0 0 "[ . 1 . 2 . ]" 1 745 1 91 LYS H 1 91 LYS HA . . 2.900 2.548 2.175 2.912 0.012 26 0 "[ . 1 . 2 . ]" 1 746 1 91 LYS H 1 91 LYS QB . . 3.680 2.475 2.119 3.007 . 0 0 "[ . 1 . 2 . ]" 1 747 1 91 LYS HA 1 91 LYS QG . . 3.300 2.728 2.360 3.023 . 0 0 "[ . 1 . 2 . ]" 1 748 1 91 LYS HA 1 94 ASN H . . 5.000 4.354 4.178 4.526 . 0 0 "[ . 1 . 2 . ]" 1 749 1 91 LYS QB 1 91 LYS QD . . 3.300 2.304 2.105 2.474 . 0 0 "[ . 1 . 2 . ]" 1 750 1 91 LYS QB 1 94 ASN H . . 5.000 3.038 2.430 3.498 . 0 0 "[ . 1 . 2 . ]" 1 751 1 91 LYS QG 1 93 GLU H . . 5.000 2.654 2.181 3.475 . 0 0 "[ . 1 . 2 . ]" 1 752 1 91 LYS QG 1 94 ASN H . . 3.300 2.238 1.808 2.678 . 0 0 "[ . 1 . 2 . ]" 1 753 1 91 LYS QG 1 94 ASN HA . . 5.000 4.273 4.013 4.570 . 0 0 "[ . 1 . 2 . ]" 1 754 1 91 LYS O 1 95 ILE H . . 1.800 2.067 1.991 2.086 0.286 9 0 "[ . 1 . 2 . ]" 1 755 1 91 LYS O 1 95 ILE N . . 2.700 3.037 2.967 3.075 0.375 4 0 "[ . 1 . 2 . ]" 1 756 1 92 LYS HA 1 95 ILE H . . 5.000 3.216 2.958 3.657 . 0 0 "[ . 1 . 2 . ]" 1 757 1 92 LYS HA 1 95 ILE HB . . 3.300 2.455 2.064 2.819 . 0 0 "[ . 1 . 2 . ]" 1 758 1 92 LYS HA 1 95 ILE MD . . 3.300 2.369 2.214 2.497 . 0 0 "[ . 1 . 2 . ]" 1 759 1 92 LYS HA 1 95 ILE MG . . 5.000 3.876 3.408 4.180 . 0 0 "[ . 1 . 2 . ]" 1 760 1 92 LYS HA 1 96 ILE MD . . 5.000 3.698 3.131 4.040 . 0 0 "[ . 1 . 2 . ]" 1 761 1 92 LYS QB 1 93 GLU H . . 3.300 2.739 2.437 3.080 . 0 0 "[ . 1 . 2 . ]" 1 762 1 92 LYS QB 1 96 ILE MD . . 5.000 2.901 2.488 3.719 . 0 0 "[ . 1 . 2 . ]" 1 763 1 92 LYS O 1 96 ILE H . . 1.800 1.895 1.802 2.012 0.212 1 0 "[ . 1 . 2 . ]" 1 764 1 92 LYS O 1 96 ILE N . . 2.700 2.878 2.781 2.967 0.267 1 0 "[ . 1 . 2 . ]" 1 765 1 93 GLU H 1 93 GLU QB . . 3.300 2.233 2.000 2.566 . 0 0 "[ . 1 . 2 . ]" 1 766 1 93 GLU H 1 93 GLU HG2 . . 5.000 4.017 2.852 4.608 . 0 0 "[ . 1 . 2 . ]" 1 767 1 93 GLU H 1 93 GLU HG3 . . 5.000 3.494 2.372 4.583 . 0 0 "[ . 1 . 2 . ]" 1 768 1 93 GLU H 1 94 ASN H . . 3.300 2.908 2.680 3.059 . 0 0 "[ . 1 . 2 . ]" 1 769 1 93 GLU HA 1 93 GLU QG . . 3.300 2.312 2.107 2.632 . 0 0 "[ . 1 . 2 . ]" 1 770 1 93 GLU HA 1 96 ILE H . . 5.000 3.272 2.982 3.629 . 0 0 "[ . 1 . 2 . ]" 1 771 1 93 GLU HA 1 96 ILE HB . . 3.300 2.484 2.077 2.913 . 0 0 "[ . 1 . 2 . ]" 1 772 1 93 GLU HA 1 96 ILE MD . . 3.300 2.301 1.959 2.467 . 0 0 "[ . 1 . 2 . ]" 1 773 1 93 GLU HA 1 96 ILE MG . . 5.000 3.857 3.517 4.222 . 0 0 "[ . 1 . 2 . ]" 1 774 1 93 GLU HA 1 97 ALA H . . 5.000 3.863 3.537 4.254 . 0 0 "[ . 1 . 2 . ]" 1 775 1 93 GLU QB 1 94 ASN H . . 3.300 2.832 2.528 3.104 . 0 0 "[ . 1 . 2 . ]" 1 776 1 93 GLU QG 1 94 ASN H . . 5.000 4.361 3.783 4.586 . 0 0 "[ . 1 . 2 . ]" 1 777 1 93 GLU O 1 97 ALA H . . 1.800 1.854 1.750 2.054 0.254 27 0 "[ . 1 . 2 . ]" 1 778 1 93 GLU O 1 97 ALA N . . 2.700 2.850 2.730 3.031 0.331 27 0 "[ . 1 . 2 . ]" 1 779 1 94 ASN H 1 95 ILE HB . . 5.000 4.557 4.312 4.822 . 0 0 "[ . 1 . 2 . ]" 1 780 1 94 ASN HA 1 97 ALA H . . 5.000 3.265 2.783 3.590 . 0 0 "[ . 1 . 2 . ]" 1 781 1 94 ASN HB2 1 95 ILE H . . 5.000 2.732 2.430 3.247 . 0 0 "[ . 1 . 2 . ]" 1 782 1 94 ASN HB3 1 95 ILE H . . 5.000 3.575 2.656 3.815 . 0 0 "[ . 1 . 2 . ]" 1 783 1 94 ASN O 1 98 ALA H . . 1.800 1.870 1.803 2.011 0.211 15 0 "[ . 1 . 2 . ]" 1 784 1 94 ASN O 1 98 ALA N . . 2.700 2.865 2.788 3.006 0.306 15 0 "[ . 1 . 2 . ]" 1 785 1 95 ILE H 1 95 ILE HB . . 2.900 2.400 2.279 2.510 . 0 0 "[ . 1 . 2 . ]" 1 786 1 95 ILE H 1 95 ILE MD . . 5.000 2.484 2.107 3.422 . 0 0 "[ . 1 . 2 . ]" 1 787 1 95 ILE H 1 95 ILE HG12 . . 5.000 4.115 3.935 4.284 . 0 0 "[ . 1 . 2 . ]" 1 788 1 95 ILE H 1 95 ILE HG13 . . 5.000 3.415 2.565 3.899 . 0 0 "[ . 1 . 2 . ]" 1 789 1 95 ILE H 1 96 ILE H . . 2.900 2.855 2.682 2.974 0.074 23 0 "[ . 1 . 2 . ]" 1 790 1 95 ILE HA 1 95 ILE QG . . 3.300 2.278 2.212 2.360 . 0 0 "[ . 1 . 2 . ]" 1 791 1 95 ILE HA 1 95 ILE MG . . 3.300 2.603 2.540 2.738 . 0 0 "[ . 1 . 2 . ]" 1 792 1 95 ILE HA 1 98 ALA H . . 5.000 3.577 3.274 3.805 . 0 0 "[ . 1 . 2 . ]" 1 793 1 95 ILE HA 1 98 ALA MB . . 5.000 2.697 2.522 2.897 . 0 0 "[ . 1 . 2 . ]" 1 794 1 95 ILE HA 1 106 TYR QE . . 5.000 3.281 2.253 4.710 . 0 0 "[ . 1 . 2 . ]" 1 795 1 95 ILE HB 1 95 ILE MD . . 2.900 2.325 2.248 2.396 . 0 0 "[ . 1 . 2 . ]" 1 796 1 95 ILE MD 1 106 TYR QE . . 5.000 2.874 2.168 3.721 . 0 0 "[ . 1 . 2 . ]" 1 797 1 95 ILE QG 1 95 ILE MG . . 3.300 2.090 2.005 2.272 . 0 0 "[ . 1 . 2 . ]" 1 798 1 95 ILE MG 1 96 ILE H . . 5.000 3.074 2.878 3.271 . 0 0 "[ . 1 . 2 . ]" 1 799 1 95 ILE MG 1 96 ILE HA . . 5.000 3.313 3.114 3.518 . 0 0 "[ . 1 . 2 . ]" 1 800 1 95 ILE MG 1 99 ALA H . . 5.000 4.049 3.916 4.083 . 0 0 "[ . 1 . 2 . ]" 1 801 1 95 ILE MG 1 99 ALA MB . . 5.000 3.274 3.117 3.352 . 0 0 "[ . 1 . 2 . ]" 1 802 1 95 ILE O 1 99 ALA H . . 1.800 1.983 1.884 2.055 0.255 14 0 "[ . 1 . 2 . ]" 1 803 1 95 ILE O 1 99 ALA N . . 2.700 2.969 2.874 3.060 0.360 2 0 "[ . 1 . 2 . ]" 1 804 1 96 ILE H 1 96 ILE HB . . 3.300 2.389 2.161 2.601 . 0 0 "[ . 1 . 2 . ]" 1 805 1 96 ILE H 1 96 ILE MD . . 3.300 2.385 2.188 2.690 . 0 0 "[ . 1 . 2 . ]" 1 806 1 96 ILE H 1 96 ILE HG12 . . 5.000 4.006 3.473 4.233 . 0 0 "[ . 1 . 2 . ]" 1 807 1 96 ILE H 1 96 ILE HG13 . . 5.000 3.189 1.987 3.818 . 0 0 "[ . 1 . 2 . ]" 1 808 1 96 ILE HA 1 96 ILE QG . . 3.300 2.307 2.160 2.609 . 0 0 "[ . 1 . 2 . ]" 1 809 1 96 ILE HA 1 96 ILE MG . . 3.300 2.607 2.330 2.707 . 0 0 "[ . 1 . 2 . ]" 1 810 1 96 ILE HA 1 99 ALA H . . 5.000 3.483 3.183 3.746 . 0 0 "[ . 1 . 2 . ]" 1 811 1 96 ILE HA 1 100 GLN H . . 5.000 3.865 3.675 4.312 . 0 0 "[ . 1 . 2 . ]" 1 812 1 96 ILE HB 1 96 ILE MD . . 2.900 2.250 2.082 2.369 . 0 0 "[ . 1 . 2 . ]" 1 813 1 96 ILE HB 1 100 GLN QG . . 5.000 4.441 4.082 4.578 . 0 0 "[ . 1 . 2 . ]" 1 814 1 96 ILE QG 1 96 ILE MG . . 3.300 2.081 2.001 2.252 . 0 0 "[ . 1 . 2 . ]" 1 815 1 96 ILE MG 1 97 ALA H . . 5.000 3.013 2.719 3.632 . 0 0 "[ . 1 . 2 . ]" 1 816 1 96 ILE MG 1 97 ALA HA . . 5.000 3.140 2.832 3.699 . 0 0 "[ . 1 . 2 . ]" 1 817 1 96 ILE MG 1 100 GLN H . . 5.000 3.864 3.670 4.068 . 0 0 "[ . 1 . 2 . ]" 1 818 1 96 ILE MG 1 100 GLN QB . . 5.000 3.498 3.312 3.665 . 0 0 "[ . 1 . 2 . ]" 1 819 1 96 ILE MG 1 100 GLN QG . . 3.300 2.146 2.010 2.260 . 0 0 "[ . 1 . 2 . ]" 1 820 1 97 ALA H 1 98 ALA H . . 3.300 2.898 2.816 3.045 . 0 0 "[ . 1 . 2 . ]" 1 821 1 97 ALA HA 1 100 GLN QB . . 3.300 2.378 2.225 2.572 . 0 0 "[ . 1 . 2 . ]" 1 822 1 97 ALA HA 1 100 GLN QG . . 5.000 3.112 2.363 3.629 . 0 0 "[ . 1 . 2 . ]" 1 823 1 97 ALA HA 1 101 ALA H . . 5.000 3.793 3.670 3.936 . 0 0 "[ . 1 . 2 . ]" 1 824 1 97 ALA MB 1 98 ALA H . . 3.300 2.534 2.391 2.703 . 0 0 "[ . 1 . 2 . ]" 1 825 1 97 ALA O 1 101 ALA H . . 1.800 1.834 1.761 1.930 0.130 10 0 "[ . 1 . 2 . ]" 1 826 1 97 ALA O 1 101 ALA N . . 2.700 2.837 2.769 2.938 0.238 10 0 "[ . 1 . 2 . ]" 1 827 1 98 ALA H 1 99 ALA H . . 2.900 2.806 2.734 2.873 . 0 0 "[ . 1 . 2 . ]" 1 828 1 98 ALA HA 1 101 ALA H . . 5.000 3.619 3.414 3.806 . 0 0 "[ . 1 . 2 . ]" 1 829 1 98 ALA HA 1 101 ALA MB . . 5.000 2.698 2.333 2.947 . 0 0 "[ . 1 . 2 . ]" 1 830 1 98 ALA MB 1 99 ALA HA . . 5.000 3.836 3.636 4.013 . 0 0 "[ . 1 . 2 . ]" 1 831 1 98 ALA O 1 103 ALA H . . 1.800 1.838 1.773 1.911 0.111 18 0 "[ . 1 . 2 . ]" 1 832 1 98 ALA O 1 103 ALA N . . 2.700 2.847 2.784 2.927 0.227 18 0 "[ . 1 . 2 . ]" 1 833 1 99 ALA H 1 100 GLN H . . 2.900 2.671 2.573 2.766 . 0 0 "[ . 1 . 2 . ]" 1 834 1 99 ALA HA 1 102 GLY H . . 5.000 3.382 3.059 3.586 . 0 0 "[ . 1 . 2 . ]" 1 835 1 99 ALA HA 1 103 ALA H . . 3.300 3.364 3.283 3.378 0.078 3 0 "[ . 1 . 2 . ]" 1 836 1 100 GLN H 1 100 GLN HA . . 2.900 2.850 2.809 2.913 0.013 23 0 "[ . 1 . 2 . ]" 1 837 1 100 GLN H 1 100 GLN HG2 . . 5.000 2.565 2.334 2.864 . 0 0 "[ . 1 . 2 . ]" 1 838 1 100 GLN H 1 100 GLN HG3 . . 5.000 3.575 2.614 4.102 . 0 0 "[ . 1 . 2 . ]" 1 839 1 100 GLN H 1 101 ALA H . . 2.900 2.787 2.545 2.922 0.022 19 0 "[ . 1 . 2 . ]" 1 840 1 100 GLN HA 1 100 GLN QG . . 3.300 2.739 2.440 3.089 . 0 0 "[ . 1 . 2 . ]" 1 841 1 100 GLN HA 1 102 GLY H . . 5.000 4.126 3.709 4.483 . 0 0 "[ . 1 . 2 . ]" 1 842 1 100 GLN QB 1 102 GLY H . . 5.000 4.405 4.244 4.546 . 0 0 "[ . 1 . 2 . ]" 1 843 1 100 GLN HB2 1 101 ALA H . . 3.300 2.497 2.319 2.708 . 0 0 "[ . 1 . 2 . ]" 1 844 1 100 GLN HB3 1 101 ALA H . . 3.300 3.286 3.132 3.370 0.070 1 0 "[ . 1 . 2 . ]" 1 845 1 100 GLN QG 1 101 ALA H . . 5.000 4.170 3.975 4.312 . 0 0 "[ . 1 . 2 . ]" 1 846 1 101 ALA H 1 101 ALA MB . . 2.900 2.151 2.097 2.201 . 0 0 "[ . 1 . 2 . ]" 1 847 1 102 GLY H 1 103 ALA H . . 2.900 2.302 2.024 2.627 . 0 0 "[ . 1 . 2 . ]" 1 848 1 103 ALA H 1 103 ALA MB . . 2.900 2.210 2.113 2.276 . 0 0 "[ . 1 . 2 . ]" 1 849 1 103 ALA H 1 104 SER H . . 5.000 4.697 4.622 4.767 . 0 0 "[ . 1 . 2 . ]" 1 850 1 103 ALA HA 1 104 SER H . . 2.900 2.349 2.243 2.506 . 0 0 "[ . 1 . 2 . ]" 1 851 1 103 ALA MB 1 105 GLY H . . 3.300 2.621 2.464 2.663 . 0 0 "[ . 1 . 2 . ]" 1 852 1 104 SER H 1 105 GLY H . . 3.300 2.642 2.481 2.781 . 0 0 "[ . 1 . 2 . ]" 1 853 1 104 SER QB 1 123 ILE MD . . 5.000 3.271 2.134 3.635 . 0 0 "[ . 1 . 2 . ]" 1 854 1 104 SER QB 1 123 ILE MG . . 5.000 1.965 1.861 2.655 . 0 0 "[ . 1 . 2 . ]" 1 855 1 104 SER HB2 1 105 GLY H . . 5.000 3.984 2.805 4.512 . 0 0 "[ . 1 . 2 . ]" 1 856 1 104 SER HB3 1 105 GLY H . . 5.000 4.160 2.511 4.511 . 0 0 "[ . 1 . 2 . ]" 1 857 1 106 TYR H 1 107 VAL H . . 5.000 4.143 3.656 4.460 . 0 0 "[ . 1 . 2 . ]" 1 858 1 106 TYR HA 1 107 VAL H . . 2.900 2.205 2.144 2.276 . 0 0 "[ . 1 . 2 . ]" 1 859 1 106 TYR HB2 1 107 VAL H . . 5.000 4.468 4.294 4.670 . 0 0 "[ . 1 . 2 . ]" 1 860 1 106 TYR HB3 1 107 VAL H . . 5.000 4.081 3.617 4.493 . 0 0 "[ . 1 . 2 . ]" 1 861 1 106 TYR QE 1 108 VAL MG2 . . 5.000 2.169 1.994 2.383 . 0 0 "[ . 1 . 2 . ]" 1 862 1 107 VAL H 1 107 VAL HB . . 3.300 2.503 2.290 2.683 . 0 0 "[ . 1 . 2 . ]" 1 863 1 107 VAL H 1 108 VAL H . . 5.000 4.244 3.612 4.568 . 0 0 "[ . 1 . 2 . ]" 1 864 1 107 VAL HA 1 107 VAL QG . . 2.900 2.156 2.042 2.209 . 0 0 "[ . 1 . 2 . ]" 1 865 1 107 VAL HA 1 108 VAL H . . 2.900 2.233 2.116 2.324 . 0 0 "[ . 1 . 2 . ]" 1 866 1 107 VAL HA 1 111 PHE QB . . 5.000 4.365 3.954 4.564 . 0 0 "[ . 1 . 2 . ]" 1 867 1 107 VAL MG1 1 111 PHE QB . . 5.000 1.994 1.891 2.148 . 0 0 "[ . 1 . 2 . ]" 1 868 1 107 VAL MG2 1 111 PHE QB . . 5.000 3.689 3.468 3.751 . 0 0 "[ . 1 . 2 . ]" 1 869 1 107 VAL MG2 1 119 LYS QD . . 5.000 2.994 1.951 3.571 . 0 0 "[ . 1 . 2 . ]" 1 870 1 107 VAL MG2 1 119 LYS QG . . 3.300 2.171 1.976 2.558 . 0 0 "[ . 1 . 2 . ]" 1 871 1 108 VAL H 1 108 VAL HB . . 3.300 2.754 2.551 2.910 . 0 0 "[ . 1 . 2 . ]" 1 872 1 108 VAL HA 1 108 VAL QG . . 2.900 2.135 2.080 2.201 . 0 0 "[ . 1 . 2 . ]" 1 873 1 108 VAL HA 1 109 LYS H . . 2.900 2.280 2.169 2.407 . 0 0 "[ . 1 . 2 . ]" 1 874 1 108 VAL MG1 1 109 LYS H . . 5.000 2.382 2.075 3.193 . 0 0 "[ . 1 . 2 . ]" 1 875 1 109 LYS H 1 110 PRO HA . . 5.000 4.900 4.728 5.021 0.021 2 0 "[ . 1 . 2 . ]" 1 876 1 109 LYS HA 1 110 PRO HA . . 3.300 2.331 2.110 2.584 . 0 0 "[ . 1 . 2 . ]" 1 877 1 109 LYS HA 1 110 PRO QB . . 5.000 4.093 3.971 4.211 . 0 0 "[ . 1 . 2 . ]" 1 878 1 109 LYS HA 1 111 PHE H . . 5.000 3.065 1.988 3.886 . 0 0 "[ . 1 . 2 . ]" 1 879 1 110 PRO HA 1 111 PHE H . . 2.900 2.360 2.155 2.995 0.095 11 0 "[ . 1 . 2 . ]" 1 880 1 111 PHE H 1 111 PHE QR . . 5.000 3.145 2.394 3.719 . 0 0 "[ . 1 . 2 . ]" 1 881 1 111 PHE H 1 112 THR H . . 5.000 4.329 3.949 4.592 . 0 0 "[ . 1 . 2 . ]" 1 882 1 111 PHE HA 1 112 THR H . . 2.900 2.305 2.119 2.418 . 0 0 "[ . 1 . 2 . ]" 1 883 1 111 PHE HA 1 115 THR H . . 5.000 4.889 4.514 5.071 0.071 11 0 "[ . 1 . 2 . ]" 1 884 1 111 PHE HA 1 115 THR HB . . 5.000 3.881 3.520 4.340 . 0 0 "[ . 1 . 2 . ]" 1 885 1 111 PHE HA 1 115 THR MG . . 5.000 2.811 2.097 3.490 . 0 0 "[ . 1 . 2 . ]" 1 886 1 111 PHE QB 1 115 THR HB . . 5.000 3.963 3.339 4.513 . 0 0 "[ . 1 . 2 . ]" 1 887 1 111 PHE QB 1 115 THR MG . . 3.300 2.008 1.904 2.297 . 0 0 "[ . 1 . 2 . ]" 1 888 1 112 THR H 1 113 ALA H . . 5.000 4.374 4.298 4.631 . 0 0 "[ . 1 . 2 . ]" 1 889 1 112 THR H 1 115 THR HB . . 3.300 3.307 2.988 3.384 0.084 6 0 "[ . 1 . 2 . ]" 1 890 1 112 THR HA 1 112 THR MG . . 3.300 2.244 2.138 2.348 . 0 0 "[ . 1 . 2 . ]" 1 891 1 112 THR HA 1 113 ALA H . . 2.900 2.647 2.417 2.808 . 0 0 "[ . 1 . 2 . ]" 1 892 1 112 THR HA 1 114 ALA H . . 5.000 4.350 4.014 4.464 . 0 0 "[ . 1 . 2 . ]" 1 893 1 112 THR HA 1 115 THR H . . 5.000 4.663 4.356 4.805 . 0 0 "[ . 1 . 2 . ]" 1 894 1 112 THR HA 1 116 LEU H . . 5.000 5.033 4.927 5.072 0.072 11 0 "[ . 1 . 2 . ]" 1 895 1 112 THR MG 1 113 ALA H . . 5.000 3.346 3.103 3.579 . 0 0 "[ . 1 . 2 . ]" 1 896 1 112 THR MG 1 114 ALA H . . 5.000 4.214 3.820 4.298 . 0 0 "[ . 1 . 2 . ]" 1 897 1 112 THR O 1 116 LEU H . . 1.800 1.994 1.862 2.072 0.272 26 0 "[ . 1 . 2 . ]" 1 898 1 112 THR O 1 116 LEU N . . 2.700 2.968 2.863 3.074 0.374 12 0 "[ . 1 . 2 . ]" 1 899 1 113 ALA H 1 113 ALA MB . . 2.900 2.237 2.168 2.275 . 0 0 "[ . 1 . 2 . ]" 1 900 1 113 ALA H 1 114 ALA H . . 3.300 2.587 2.380 2.739 . 0 0 "[ . 1 . 2 . ]" 1 901 1 113 ALA HA 1 116 LEU H . . 5.000 3.020 2.745 3.298 . 0 0 "[ . 1 . 2 . ]" 1 902 1 113 ALA O 1 117 GLU H . . 1.800 1.835 1.771 2.011 0.211 6 0 "[ . 1 . 2 . ]" 1 903 1 113 ALA O 1 117 GLU N . . 2.700 2.847 2.784 3.024 0.324 6 0 "[ . 1 . 2 . ]" 1 904 1 114 ALA H 1 114 ALA MB . . 2.900 2.207 2.103 2.248 . 0 0 "[ . 1 . 2 . ]" 1 905 1 114 ALA H 1 115 THR H . . 3.300 2.994 2.864 3.098 . 0 0 "[ . 1 . 2 . ]" 1 906 1 114 ALA HA 1 117 GLU QB . . 5.000 4.296 3.787 4.523 . 0 0 "[ . 1 . 2 . ]" 1 907 1 114 ALA HA 1 117 GLU QG . . 5.000 2.510 2.202 2.732 . 0 0 "[ . 1 . 2 . ]" 1 908 1 114 ALA HA 1 118 GLU H . . 5.000 4.611 4.136 5.058 0.058 16 0 "[ . 1 . 2 . ]" 1 909 1 114 ALA MB 1 115 THR HA . . 5.000 4.066 3.854 4.192 . 0 0 "[ . 1 . 2 . ]" 1 910 1 115 THR H 1 115 THR HB . . 2.900 2.673 2.324 2.973 0.073 18 0 "[ . 1 . 2 . ]" 1 911 1 115 THR H 1 116 LEU H . . 3.300 2.143 1.889 2.536 . 0 0 "[ . 1 . 2 . ]" 1 912 1 115 THR HA 1 117 GLU QG . . 5.000 4.030 3.479 4.543 . 0 0 "[ . 1 . 2 . ]" 1 913 1 115 THR MG 1 116 LEU H . . 5.000 2.577 2.388 2.852 . 0 0 "[ . 1 . 2 . ]" 1 914 1 115 THR MG 1 116 LEU HA . . 5.000 3.361 3.121 3.569 . 0 0 "[ . 1 . 2 . ]" 1 915 1 115 THR MG 1 119 LYS QG . . 5.000 3.287 2.687 3.584 . 0 0 "[ . 1 . 2 . ]" 1 916 1 116 LEU H 1 116 LEU HB2 . . 2.900 2.269 2.163 2.501 . 0 0 "[ . 1 . 2 . ]" 1 917 1 116 LEU H 1 116 LEU HB3 . . 2.900 2.695 2.427 2.831 . 0 0 "[ . 1 . 2 . ]" 1 918 1 116 LEU H 1 117 GLU H . . 3.300 2.845 2.714 2.997 . 0 0 "[ . 1 . 2 . ]" 1 919 1 116 LEU HA 1 116 LEU MD2 . . 3.300 2.332 2.175 2.504 . 0 0 "[ . 1 . 2 . ]" 1 920 1 116 LEU HA 1 119 LYS H . . 5.000 3.694 3.452 3.988 . 0 0 "[ . 1 . 2 . ]" 1 921 1 116 LEU HA 1 120 LEU H . . 5.000 4.171 4.002 4.351 . 0 0 "[ . 1 . 2 . ]" 1 922 1 116 LEU HB2 1 117 GLU H . . 5.000 3.662 3.553 3.888 . 0 0 "[ . 1 . 2 . ]" 1 923 1 116 LEU HB3 1 117 GLU H . . 5.000 2.414 2.293 2.529 . 0 0 "[ . 1 . 2 . ]" 1 924 1 116 LEU MD1 1 120 LEU H . . 5.000 3.660 3.277 3.931 . 0 0 "[ . 1 . 2 . ]" 1 925 1 116 LEU MD1 1 120 LEU MD2 . . 5.000 2.929 2.283 3.307 . 0 0 "[ . 1 . 2 . ]" 1 926 1 116 LEU O 1 120 LEU H . . 1.800 1.970 1.838 2.066 0.266 7 0 "[ . 1 . 2 . ]" 1 927 1 116 LEU O 1 120 LEU N . . 2.700 2.919 2.808 3.061 0.361 27 0 "[ . 1 . 2 . ]" 1 928 1 117 GLU H 1 118 GLU H . . 3.300 2.749 2.627 2.898 . 0 0 "[ . 1 . 2 . ]" 1 929 1 117 GLU HA 1 119 LYS H . . 5.000 4.527 4.257 4.842 . 0 0 "[ . 1 . 2 . ]" 1 930 1 117 GLU HA 1 121 ASN H . . 5.000 3.840 3.495 4.093 . 0 0 "[ . 1 . 2 . ]" 1 931 1 117 GLU QG 1 118 GLU H . . 3.300 2.249 1.853 2.695 . 0 0 "[ . 1 . 2 . ]" 1 932 1 117 GLU QG 1 118 GLU HA . . 5.000 3.845 3.275 4.213 . 0 0 "[ . 1 . 2 . ]" 1 933 1 117 GLU O 1 121 ASN H . . 1.800 1.877 1.755 2.045 0.245 12 0 "[ . 1 . 2 . ]" 1 934 1 117 GLU O 1 121 ASN N . . 2.700 2.879 2.761 3.030 0.330 21 0 "[ . 1 . 2 . ]" 1 935 1 118 GLU H 1 118 GLU HA . . 2.900 2.866 2.787 2.919 0.019 21 0 "[ . 1 . 2 . ]" 1 936 1 118 GLU HA 1 118 GLU QG . . 3.300 2.570 2.287 3.071 . 0 0 "[ . 1 . 2 . ]" 1 937 1 118 GLU HA 1 121 ASN H . . 5.000 3.465 3.049 3.856 . 0 0 "[ . 1 . 2 . ]" 1 938 1 118 GLU HA 1 121 ASN QB . . 5.000 2.754 2.187 3.453 . 0 0 "[ . 1 . 2 . ]" 1 939 1 118 GLU HA 1 122 LYS H . . 5.000 4.038 3.765 4.263 . 0 0 "[ . 1 . 2 . ]" 1 940 1 118 GLU QG 1 122 LYS QE . . 3.300 2.094 1.817 2.500 . 0 0 "[ . 1 . 2 . ]" 1 941 1 118 GLU O 1 122 LYS H . . 1.800 1.948 1.779 2.066 0.266 23 0 "[ . 1 . 2 . ]" 1 942 1 118 GLU O 1 122 LYS N . . 2.700 2.909 2.753 3.053 0.353 12 0 "[ . 1 . 2 . ]" 1 943 1 119 LYS H 1 119 LYS HA . . 2.900 2.897 2.843 2.937 0.037 20 0 "[ . 1 . 2 . ]" 1 944 1 119 LYS H 1 120 LEU H . . 2.900 2.621 2.482 2.819 . 0 0 "[ . 1 . 2 . ]" 1 945 1 119 LYS H 1 122 LYS QE . . 5.000 3.939 3.387 4.529 . 0 0 "[ . 1 . 2 . ]" 1 946 1 119 LYS HA 1 119 LYS QD . . 5.000 2.700 2.067 4.177 . 0 0 "[ . 1 . 2 . ]" 1 947 1 119 LYS HA 1 122 LYS H . . 5.000 3.280 2.896 3.474 . 0 0 "[ . 1 . 2 . ]" 1 948 1 119 LYS HA 1 122 LYS QB . . 3.300 2.283 2.049 2.583 . 0 0 "[ . 1 . 2 . ]" 1 949 1 119 LYS HA 1 122 LYS QE . . 3.300 2.418 2.044 3.045 . 0 0 "[ . 1 . 2 . ]" 1 950 1 119 LYS QB 1 122 LYS QE . . 5.000 3.963 3.103 4.149 . 0 0 "[ . 1 . 2 . ]" 1 951 1 119 LYS HB2 1 120 LEU H . . 5.000 2.924 2.519 4.153 . 0 0 "[ . 1 . 2 . ]" 1 952 1 119 LYS HB3 1 120 LEU H . . 5.000 3.826 3.389 4.268 . 0 0 "[ . 1 . 2 . ]" 1 953 1 119 LYS O 1 123 ILE H . . 1.800 2.054 1.932 2.091 0.291 18 0 "[ . 1 . 2 . ]" 1 954 1 119 LYS O 1 123 ILE N . . 2.700 3.042 2.930 3.070 0.370 25 0 "[ . 1 . 2 . ]" 1 955 1 120 LEU H 1 120 LEU MD1 . . 5.000 3.779 3.451 3.931 . 0 0 "[ . 1 . 2 . ]" 1 956 1 120 LEU H 1 120 LEU MD2 . . 5.000 3.672 3.162 4.101 . 0 0 "[ . 1 . 2 . ]" 1 957 1 120 LEU H 1 120 LEU HG . . 2.900 2.687 2.339 2.952 0.052 22 0 "[ . 1 . 2 . ]" 1 958 1 120 LEU HA 1 120 LEU MD2 . . 3.300 2.131 2.076 2.260 . 0 0 "[ . 1 . 2 . ]" 1 959 1 120 LEU HA 1 123 ILE H . . 5.000 3.514 3.397 3.716 . 0 0 "[ . 1 . 2 . ]" 1 960 1 120 LEU HA 1 123 ILE MD . . 5.000 2.526 2.319 2.924 . 0 0 "[ . 1 . 2 . ]" 1 961 1 120 LEU HA 1 124 PHE H . . 5.000 3.938 3.786 4.097 . 0 0 "[ . 1 . 2 . ]" 1 962 1 120 LEU QB 1 121 ASN HA . . 5.000 3.802 3.621 3.940 . 0 0 "[ . 1 . 2 . ]" 1 963 1 120 LEU HB2 1 121 ASN H . . 5.000 2.461 2.298 2.632 . 0 0 "[ . 1 . 2 . ]" 1 964 1 120 LEU HB3 1 121 ASN H . . 5.000 3.219 3.036 3.492 . 0 0 "[ . 1 . 2 . ]" 1 965 1 120 LEU MD1 1 124 PHE QE . . 5.000 3.437 3.025 3.789 . 0 0 "[ . 1 . 2 . ]" 1 966 1 120 LEU MD1 1 124 PHE HZ . . 5.000 2.870 2.372 3.529 . 0 0 "[ . 1 . 2 . ]" 1 967 1 120 LEU MD2 1 123 ILE MD . . 5.000 2.380 2.122 2.934 . 0 0 "[ . 1 . 2 . ]" 1 968 1 120 LEU MD2 1 124 PHE QE . . 5.000 2.718 2.139 3.537 . 0 0 "[ . 1 . 2 . ]" 1 969 1 120 LEU MD2 1 124 PHE HZ . . 5.000 3.085 2.484 3.878 . 0 0 "[ . 1 . 2 . ]" 1 970 1 120 LEU HG 1 121 ASN H . . 5.000 4.564 4.236 4.778 . 0 0 "[ . 1 . 2 . ]" 1 971 1 120 LEU O 1 124 PHE H . . 1.800 1.825 1.779 1.904 0.104 7 0 "[ . 1 . 2 . ]" 1 972 1 120 LEU O 1 124 PHE N . . 2.700 2.796 2.755 2.855 0.155 7 0 "[ . 1 . 2 . ]" 1 973 1 121 ASN H 1 121 ASN HB2 . . 3.300 2.498 2.179 2.758 . 0 0 "[ . 1 . 2 . ]" 1 974 1 121 ASN H 1 121 ASN HB3 . . 3.300 2.646 2.332 3.392 0.092 17 0 "[ . 1 . 2 . ]" 1 975 1 121 ASN H 1 122 LYS H . . 3.300 2.850 2.647 2.962 . 0 0 "[ . 1 . 2 . ]" 1 976 1 121 ASN HA 1 124 PHE H . . 5.000 3.421 3.039 3.708 . 0 0 "[ . 1 . 2 . ]" 1 977 1 121 ASN HA 1 124 PHE QB . . 5.000 2.364 2.078 2.702 . 0 0 "[ . 1 . 2 . ]" 1 978 1 121 ASN HA 1 124 PHE QR . . 5.000 2.602 2.112 3.785 . 0 0 "[ . 1 . 2 . ]" 1 979 1 121 ASN HA 1 125 GLU H . . 5.000 3.793 3.598 4.069 . 0 0 "[ . 1 . 2 . ]" 1 980 1 121 ASN O 1 125 GLU H . . 1.800 2.005 1.879 2.072 0.272 12 0 "[ . 1 . 2 . ]" 1 981 1 121 ASN O 1 125 GLU N . . 2.700 3.012 2.887 3.079 0.379 12 0 "[ . 1 . 2 . ]" 1 982 1 122 LYS H 1 123 ILE H . . 5.000 3.039 2.882 3.169 . 0 0 "[ . 1 . 2 . ]" 1 983 1 122 LYS HA 1 126 LYS H . . 5.000 3.834 3.655 4.063 . 0 0 "[ . 1 . 2 . ]" 1 984 1 122 LYS QB 1 123 ILE H . . 5.000 2.525 2.187 2.801 . 0 0 "[ . 1 . 2 . ]" 1 985 1 123 ILE H 1 123 ILE MD . . 5.000 3.347 2.485 3.710 . 0 0 "[ . 1 . 2 . ]" 1 986 1 123 ILE H 1 123 ILE QG . . 3.300 1.959 1.859 2.323 . 0 0 "[ . 1 . 2 . ]" 1 987 1 123 ILE H 1 123 ILE MG . . 3.300 2.451 2.204 2.594 . 0 0 "[ . 1 . 2 . ]" 1 988 1 123 ILE H 1 124 PHE H . . 2.900 2.677 2.559 2.777 . 0 0 "[ . 1 . 2 . ]" 1 989 1 123 ILE HA 1 123 ILE MG . . 3.300 2.190 2.129 2.277 . 0 0 "[ . 1 . 2 . ]" 1 990 1 123 ILE HA 1 126 LYS H . . 5.000 3.174 2.839 3.568 . 0 0 "[ . 1 . 2 . ]" 1 991 1 123 ILE HA 1 126 LYS QB . . 3.300 2.456 2.059 2.807 . 0 0 "[ . 1 . 2 . ]" 1 992 1 123 ILE HA 1 127 LEU H . . 5.000 2.472 2.191 2.686 . 0 0 "[ . 1 . 2 . ]" 1 993 1 123 ILE HB 1 124 PHE H . . 5.000 3.994 3.841 4.179 . 0 0 "[ . 1 . 2 . ]" 1 994 1 123 ILE HB 1 127 LEU QB . . 5.000 3.317 2.370 3.546 . 0 0 "[ . 1 . 2 . ]" 1 995 1 123 ILE HB 1 127 LEU HG . . 5.000 2.415 2.189 2.673 . 0 0 "[ . 1 . 2 . ]" 1 996 1 123 ILE HB 1 129 MET QB . . 5.000 3.278 2.808 4.391 . 0 0 "[ . 1 . 2 . ]" 1 997 1 123 ILE HB 1 129 MET QG . . 3.300 2.562 2.150 3.080 . 0 0 "[ . 1 . 2 . ]" 1 998 1 123 ILE MD 1 123 ILE MG . . 3.300 2.004 1.950 2.061 . 0 0 "[ . 1 . 2 . ]" 1 999 1 123 ILE QG 1 129 MET QB . . 5.000 2.692 2.283 3.755 . 0 0 "[ . 1 . 2 . ]" 1 1000 1 123 ILE MG 1 127 LEU MD1 . . 5.000 2.523 2.099 3.334 . 0 0 "[ . 1 . 2 . ]" 1 1001 1 123 ILE MG 1 127 LEU HG . . 3.300 2.485 2.244 2.564 . 0 0 "[ . 1 . 2 . ]" 1 1002 1 123 ILE O 1 129 MET H . . 1.800 2.078 2.059 2.094 0.294 7 0 "[ . 1 . 2 . ]" 1 1003 1 123 ILE O 1 129 MET N . . 2.700 3.038 2.962 3.085 0.385 27 0 "[ . 1 . 2 . ]" 1 1004 1 124 PHE H 1 124 PHE QR . . 5.000 2.945 2.411 3.334 . 0 0 "[ . 1 . 2 . ]" 1 1005 1 124 PHE H 1 125 GLU H . . 2.900 2.828 2.720 2.951 0.051 4 0 "[ . 1 . 2 . ]" 1 1006 1 124 PHE HA 1 125 GLU HA . . 5.000 4.636 4.518 4.735 . 0 0 "[ . 1 . 2 . ]" 1 1007 1 124 PHE HA 1 127 LEU H . . 5.000 4.971 4.726 5.078 0.078 8 0 "[ . 1 . 2 . ]" 1 1008 1 124 PHE HA 1 128 GLY H . . 5.000 3.710 3.556 3.901 . 0 0 "[ . 1 . 2 . ]" 1 1009 1 124 PHE HA 1 129 MET H . . 5.000 2.223 2.079 2.321 . 0 0 "[ . 1 . 2 . ]" 1 1010 1 124 PHE QB 1 126 LYS H . . 5.000 4.497 4.428 4.560 . 0 0 "[ . 1 . 2 . ]" 1 1011 1 124 PHE HB2 1 125 GLU H . . 5.000 2.321 2.125 2.664 . 0 0 "[ . 1 . 2 . ]" 1 1012 1 124 PHE HB2 1 129 MET H . . 5.000 5.032 4.933 5.075 0.075 23 0 "[ . 1 . 2 . ]" 1 1013 1 124 PHE HB3 1 125 GLU H . . 5.000 3.252 2.940 3.577 . 0 0 "[ . 1 . 2 . ]" 1 1014 1 124 PHE HB3 1 129 MET H . . 5.000 4.516 4.362 4.673 . 0 0 "[ . 1 . 2 . ]" 1 1015 1 125 GLU H 1 125 GLU HA . . 2.900 2.874 2.804 2.927 0.027 26 0 "[ . 1 . 2 . ]" 1 1016 1 125 GLU H 1 125 GLU QG . . 2.900 2.290 2.063 2.456 . 0 0 "[ . 1 . 2 . ]" 1 1017 1 125 GLU H 1 126 LYS H . . 3.300 2.617 2.368 2.807 . 0 0 "[ . 1 . 2 . ]" 1 1018 1 125 GLU H 1 126 LYS QB . . 5.000 4.375 4.112 4.560 . 0 0 "[ . 1 . 2 . ]" 1 1019 1 125 GLU HA 1 125 GLU QG . . 3.300 2.636 2.269 2.933 . 0 0 "[ . 1 . 2 . ]" 1 1020 1 125 GLU HA 1 128 GLY H . . 5.000 4.241 4.076 4.599 . 0 0 "[ . 1 . 2 . ]" 1 1021 1 125 GLU HA 1 129 MET H . . 5.000 5.067 5.003 5.088 0.088 17 0 "[ . 1 . 2 . ]" 1 1022 1 125 GLU QB 1 126 LYS H . . 3.300 2.596 2.280 2.899 . 0 0 "[ . 1 . 2 . ]" 1 1023 1 126 LYS H 1 126 LYS QB . . 2.900 2.252 2.042 2.350 . 0 0 "[ . 1 . 2 . ]" 1 1024 1 126 LYS H 1 126 LYS QD . . 5.000 4.451 4.344 4.533 . 0 0 "[ . 1 . 2 . ]" 1 1025 1 126 LYS H 1 127 LEU H . . 3.300 2.913 2.638 3.128 . 0 0 "[ . 1 . 2 . ]" 1 1026 1 126 LYS QB 1 127 LEU H . . 4.180 2.228 2.048 2.425 . 0 0 "[ . 1 . 2 . ]" 1 1027 1 126 LYS QE 1 127 LEU MD2 . . 3.300 2.209 1.820 2.635 . 0 0 "[ . 1 . 2 . ]" 1 1028 1 127 LEU H 1 127 LEU MD1 . . 5.000 3.780 3.619 4.274 . 0 0 "[ . 1 . 2 . ]" 1 1029 1 127 LEU H 1 127 LEU MD2 . . 3.300 2.597 2.504 2.701 . 0 0 "[ . 1 . 2 . ]" 1 1030 1 127 LEU H 1 127 LEU HG . . 5.000 2.187 1.957 3.283 . 0 0 "[ . 1 . 2 . ]" 1 1031 1 127 LEU HA 1 127 LEU MD2 . . 3.300 2.348 2.195 2.467 . 0 0 "[ . 1 . 2 . ]" 1 1032 1 127 LEU QB 1 128 GLY H . . 5.000 2.819 2.354 3.038 . 0 0 "[ . 1 . 2 . ]" 1 1033 1 127 LEU QB 1 129 MET QB . . 5.000 3.579 3.262 3.811 . 0 0 "[ . 1 . 2 . ]" 1 1034 1 127 LEU QB 1 129 MET QG . . 5.000 2.107 1.939 2.710 . 0 0 "[ . 1 . 2 . ]" 1 1035 1 127 LEU HB2 1 129 MET H . . 5.000 2.902 2.631 3.236 . 0 0 "[ . 1 . 2 . ]" 1 1036 1 127 LEU HB3 1 129 MET H . . 5.000 4.479 4.176 4.642 . 0 0 "[ . 1 . 2 . ]" 1 1037 1 128 GLY H 1 129 MET H . . 2.900 2.104 1.837 2.221 . 0 0 "[ . 1 . 2 . ]" 1 1038 1 128 GLY H 1 129 MET QB . . 5.000 4.188 3.774 4.576 . 0 0 "[ . 1 . 2 . ]" 1 1039 1 128 GLY H 1 129 MET QG . . 5.000 4.008 3.014 4.398 . 0 0 "[ . 1 . 2 . ]" 1 1040 1 129 MET H 1 129 MET HG2 . . 5.000 2.883 2.199 3.461 . 0 0 "[ . 1 . 2 . ]" 1 1041 1 129 MET H 1 129 MET HG3 . . 5.000 4.027 2.655 4.278 . 0 0 "[ . 1 . 2 . ]" 1 stop_ save_
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