NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
414894 | 2d7n | 10329 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2d7n 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 1770 _Distance_constraint_stats_list.Viol_count 410 _Distance_constraint_stats_list.Viol_total 64.037 _Distance_constraint_stats_list.Viol_max 0.050 _Distance_constraint_stats_list.Viol_rms 0.0014 _Distance_constraint_stats_list.Viol_average_all_restraints 0.0001 _Distance_constraint_stats_list.Viol_average_violations_only 0.0078 _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 6 SER 0.000 0.000 . 0 "[ . 1 . 2]" 1 7 GLY 0.000 0.000 . 0 "[ . 1 . 2]" 1 8 LEU 0.047 0.010 12 0 "[ . 1 . 2]" 1 9 ARG 0.030 0.005 8 0 "[ . 1 . 2]" 1 10 PRO 0.018 0.006 5 0 "[ . 1 . 2]" 1 11 PHE 0.054 0.008 12 0 "[ . 1 . 2]" 1 12 ASN 0.000 0.000 . 0 "[ . 1 . 2]" 1 13 LEU 0.009 0.005 7 0 "[ . 1 . 2]" 1 14 VAL 0.000 0.000 . 0 "[ . 1 . 2]" 1 15 ILE 0.094 0.008 17 0 "[ . 1 . 2]" 1 16 PRO 0.036 0.009 3 0 "[ . 1 . 2]" 1 17 PHE 0.030 0.005 9 0 "[ . 1 . 2]" 1 18 ALA 0.015 0.005 9 0 "[ . 1 . 2]" 1 19 VAL 0.011 0.004 17 0 "[ . 1 . 2]" 1 20 GLN 0.004 0.004 17 0 "[ . 1 . 2]" 1 21 LYS 0.024 0.019 2 0 "[ . 1 . 2]" 1 22 GLY 0.027 0.019 2 0 "[ . 1 . 2]" 1 23 GLU 0.054 0.028 18 0 "[ . 1 . 2]" 1 24 LEU 0.075 0.028 18 0 "[ . 1 . 2]" 1 25 THR 0.002 0.001 19 0 "[ . 1 . 2]" 1 26 GLY 0.006 0.003 10 0 "[ . 1 . 2]" 1 27 GLU 0.002 0.001 10 0 "[ . 1 . 2]" 1 28 VAL 0.009 0.003 10 0 "[ . 1 . 2]" 1 29 ARG 0.004 0.003 8 0 "[ . 1 . 2]" 1 30 MET 0.042 0.011 6 0 "[ . 1 . 2]" 1 31 PRO 0.008 0.002 17 0 "[ . 1 . 2]" 1 32 SER 0.026 0.014 2 0 "[ . 1 . 2]" 1 33 GLY 0.002 0.001 6 0 "[ . 1 . 2]" 1 34 LYS 0.323 0.034 15 0 "[ . 1 . 2]" 1 35 THR 0.013 0.009 16 0 "[ . 1 . 2]" 1 36 ALA 0.005 0.003 10 0 "[ . 1 . 2]" 1 37 ARG 0.005 0.005 7 0 "[ . 1 . 2]" 1 38 PRO 0.816 0.050 14 0 "[ . 1 . 2]" 1 39 ASN 0.812 0.050 14 0 "[ . 1 . 2]" 1 40 ILE 0.016 0.008 18 0 "[ . 1 . 2]" 1 41 THR 0.225 0.023 14 0 "[ . 1 . 2]" 1 42 ASP 0.141 0.015 14 0 "[ . 1 . 2]" 1 43 ASN 0.001 0.001 9 0 "[ . 1 . 2]" 1 44 LYS 0.011 0.006 16 0 "[ . 1 . 2]" 1 45 ASP 0.001 0.001 9 0 "[ . 1 . 2]" 1 46 GLY 0.000 0.000 . 0 "[ . 1 . 2]" 1 47 THR 0.007 0.005 11 0 "[ . 1 . 2]" 1 48 ILE 0.094 0.009 3 0 "[ . 1 . 2]" 1 49 THR 0.001 0.001 16 0 "[ . 1 . 2]" 1 50 VAL 0.030 0.005 7 0 "[ . 1 . 2]" 1 51 ARG 0.024 0.004 1 0 "[ . 1 . 2]" 1 52 TYR 0.041 0.006 10 0 "[ . 1 . 2]" 1 53 ALA 0.406 0.034 13 0 "[ . 1 . 2]" 1 54 PRO 0.391 0.034 13 0 "[ . 1 . 2]" 1 55 THR 0.000 0.000 . 0 "[ . 1 . 2]" 1 56 GLU 0.029 0.010 12 0 "[ . 1 . 2]" 1 57 LYS 0.086 0.040 13 0 "[ . 1 . 2]" 1 58 GLY 0.007 0.002 17 0 "[ . 1 . 2]" 1 59 LEU 0.007 0.003 12 0 "[ . 1 . 2]" 1 60 HIS 0.020 0.006 15 0 "[ . 1 . 2]" 1 61 GLN 0.017 0.005 15 0 "[ . 1 . 2]" 1 62 MET 0.011 0.004 16 0 "[ . 1 . 2]" 1 63 GLY 0.052 0.009 18 0 "[ . 1 . 2]" 1 64 ILE 0.020 0.007 15 0 "[ . 1 . 2]" 1 65 LYS 0.049 0.007 15 0 "[ . 1 . 2]" 1 66 TYR 0.014 0.003 19 0 "[ . 1 . 2]" 1 67 ASP 0.020 0.009 18 0 "[ . 1 . 2]" 1 68 GLY 0.000 0.000 . 0 "[ . 1 . 2]" 1 69 ASN 0.014 0.009 18 0 "[ . 1 . 2]" 1 70 HIS 0.449 0.032 17 0 "[ . 1 . 2]" 1 71 ILE 0.153 0.014 6 0 "[ . 1 . 2]" 1 72 PRO 0.094 0.014 6 0 "[ . 1 . 2]" 1 73 GLY 0.138 0.041 14 0 "[ . 1 . 2]" 1 74 SER 0.173 0.041 14 0 "[ . 1 . 2]" 1 75 PRO 0.465 0.032 17 0 "[ . 1 . 2]" 1 76 LEU 0.041 0.016 15 0 "[ . 1 . 2]" 1 77 GLN 0.057 0.016 15 0 "[ . 1 . 2]" 1 78 PHE 0.022 0.005 12 0 "[ . 1 . 2]" 1 79 TYR 0.018 0.006 15 0 "[ . 1 . 2]" 1 80 VAL 0.001 0.001 2 0 "[ . 1 . 2]" 1 81 ASP 0.002 0.002 11 0 "[ . 1 . 2]" 1 82 ALA 0.000 0.000 . 0 "[ . 1 . 2]" 1 83 ILE 0.009 0.004 1 0 "[ . 1 . 2]" 1 84 ASN 0.000 0.000 . 0 "[ . 1 . 2]" 1 86 ARG 0.000 0.000 . 0 "[ . 1 . 2]" 1 87 HIS 0.000 0.000 . 0 "[ . 1 . 2]" 1 89 GLY 0.000 0.000 . 0 "[ . 1 . 2]" 1 90 PRO 0.000 0.000 . 0 "[ . 1 . 2]" 1 92 SER 0.000 0.000 . 0 "[ . 1 . 2]" 1 93 GLY 0.000 0.000 . 0 "[ . 1 . 2]" stop_ loop_ _Distance_constraint_stats.Restraint_ID _Distance_constraint_stats.Atom_1_entity_assembly_ID _Distance_constraint_stats.Atom_1_comp_index_ID _Distance_constraint_stats.Atom_1_comp_ID _Distance_constraint_stats.Atom_1_ID _Distance_constraint_stats.Atom_2_entity_assembly_ID _Distance_constraint_stats.Atom_2_comp_index_ID _Distance_constraint_stats.Atom_2_comp_ID _Distance_constraint_stats.Atom_2_ID _Distance_constraint_stats.Node_1_distance_val _Distance_constraint_stats.Node_1_distance_lower_bound_val _Distance_constraint_stats.Node_1_distance_upper_bound_val _Distance_constraint_stats.Distance_average _Distance_constraint_stats.Distance_minimum _Distance_constraint_stats.Distance_maximum _Distance_constraint_stats.Max_violation _Distance_constraint_stats.Max_violation_model_number _Distance_constraint_stats.Over_cutoff_violation_count _Distance_constraint_stats.Over_cutoff_viol_per_model _Distance_constraint_stats.Distance_constraint_stats_ID 1 1 6 SER HA 1 6 SER QB . . 2.730 2.336 2.189 2.490 . 0 0 "[ . 1 . 2]" 1 2 1 6 SER QB 1 8 LEU MD1 . . 4.440 3.506 2.876 4.389 . 0 0 "[ . 1 . 2]" 1 3 1 6 SER QB 1 8 LEU HG . . 4.080 3.426 2.568 3.957 . 0 0 "[ . 1 . 2]" 1 4 1 7 GLY H 1 8 LEU H . . 4.690 3.739 1.903 4.593 . 0 0 "[ . 1 . 2]" 1 5 1 7 GLY QA 1 8 LEU H . . 2.850 2.245 2.115 2.733 . 0 0 "[ . 1 . 2]" 1 6 1 7 GLY QA 1 8 LEU HA . . 4.360 3.956 3.935 3.997 . 0 0 "[ . 1 . 2]" 1 7 1 7 GLY QA 1 8 LEU HG . . 4.080 3.757 3.345 3.942 . 0 0 "[ . 1 . 2]" 1 8 1 7 GLY QA 1 9 ARG H . . 5.500 5.304 5.169 5.475 . 0 0 "[ . 1 . 2]" 1 9 1 7 GLY QA 1 83 ILE MD . . 3.710 2.314 2.025 2.631 . 0 0 "[ . 1 . 2]" 1 10 1 8 LEU H 1 8 LEU HB2 . . 3.100 2.783 2.692 2.884 . 0 0 "[ . 1 . 2]" 1 11 1 8 LEU H 1 8 LEU HB3 . . 3.900 3.835 3.785 3.897 . 0 0 "[ . 1 . 2]" 1 12 1 8 LEU H 1 8 LEU MD1 . . 4.240 3.962 3.828 4.119 . 0 0 "[ . 1 . 2]" 1 13 1 8 LEU H 1 8 LEU MD2 . . 3.930 3.781 3.528 3.921 . 0 0 "[ . 1 . 2]" 1 14 1 8 LEU H 1 8 LEU HG . . 3.370 2.836 2.713 3.040 . 0 0 "[ . 1 . 2]" 1 15 1 8 LEU H 1 9 ARG H . . 4.370 4.307 4.196 4.370 . 0 0 "[ . 1 . 2]" 1 16 1 8 LEU H 1 83 ILE MD . . 4.690 2.483 2.165 3.106 . 0 0 "[ . 1 . 2]" 1 17 1 8 LEU H 1 83 ILE HG12 . . 4.570 4.361 4.147 4.572 0.002 2 0 "[ . 1 . 2]" 1 18 1 8 LEU H 1 83 ILE HG13 . . 3.510 3.291 3.136 3.498 . 0 0 "[ . 1 . 2]" 1 19 1 8 LEU HA 1 8 LEU MD1 . . 4.010 3.940 3.895 3.963 . 0 0 "[ . 1 . 2]" 1 20 1 8 LEU HA 1 8 LEU MD2 . . 2.910 2.184 2.024 2.462 . 0 0 "[ . 1 . 2]" 1 21 1 8 LEU HA 1 8 LEU HG . . 4.060 3.174 3.073 3.343 . 0 0 "[ . 1 . 2]" 1 22 1 8 LEU HA 1 9 ARG H . . 2.950 2.160 2.140 2.199 . 0 0 "[ . 1 . 2]" 1 23 1 8 LEU HA 1 9 ARG HB2 . . 4.690 4.365 4.318 4.474 . 0 0 "[ . 1 . 2]" 1 24 1 8 LEU HA 1 80 VAL MG1 . . 4.060 3.530 3.314 3.701 . 0 0 "[ . 1 . 2]" 1 25 1 8 LEU HA 1 83 ILE HB . . 5.050 4.623 4.364 4.851 . 0 0 "[ . 1 . 2]" 1 26 1 8 LEU HA 1 83 ILE MD . . 4.620 3.410 3.155 3.807 . 0 0 "[ . 1 . 2]" 1 27 1 8 LEU HA 1 83 ILE HG12 . . 4.780 3.407 3.121 3.901 . 0 0 "[ . 1 . 2]" 1 28 1 8 LEU HA 1 83 ILE HG13 . . 4.540 2.264 2.001 2.525 . 0 0 "[ . 1 . 2]" 1 29 1 8 LEU HB2 1 8 LEU MD1 . . 3.130 2.267 2.107 2.370 . 0 0 "[ . 1 . 2]" 1 30 1 8 LEU HB2 1 9 ARG H . . 4.150 4.060 3.927 4.144 . 0 0 "[ . 1 . 2]" 1 31 1 8 LEU HB2 1 54 PRO HB2 . . 4.170 3.593 3.427 3.668 . 0 0 "[ . 1 . 2]" 1 32 1 8 LEU HB2 1 54 PRO HB3 . . 5.030 5.000 4.813 5.038 0.008 12 0 "[ . 1 . 2]" 1 33 1 8 LEU HB2 1 54 PRO HD2 . . 4.690 4.092 3.897 4.264 . 0 0 "[ . 1 . 2]" 1 34 1 8 LEU HB2 1 54 PRO HG2 . . 3.920 2.436 2.259 2.506 . 0 0 "[ . 1 . 2]" 1 35 1 8 LEU HB2 1 54 PRO HG3 . . 4.580 4.101 3.956 4.165 . 0 0 "[ . 1 . 2]" 1 36 1 8 LEU HB2 1 80 VAL MG1 . . 3.540 3.010 2.811 3.181 . 0 0 "[ . 1 . 2]" 1 37 1 8 LEU HB3 1 8 LEU MD1 . . 3.140 2.415 2.331 2.565 . 0 0 "[ . 1 . 2]" 1 38 1 8 LEU HB3 1 8 LEU MD2 . . 3.020 2.305 2.119 2.420 . 0 0 "[ . 1 . 2]" 1 39 1 8 LEU HB3 1 9 ARG H . . 3.510 3.240 3.025 3.416 . 0 0 "[ . 1 . 2]" 1 40 1 8 LEU HB3 1 54 PRO HB2 . . 4.620 3.613 3.430 3.838 . 0 0 "[ . 1 . 2]" 1 41 1 8 LEU HB3 1 54 PRO HG2 . . 4.250 2.765 2.579 2.993 . 0 0 "[ . 1 . 2]" 1 42 1 8 LEU MD1 1 54 PRO HB2 . . 3.720 2.359 2.233 2.538 . 0 0 "[ . 1 . 2]" 1 43 1 8 LEU MD1 1 54 PRO HB3 . . 4.060 3.940 3.833 4.048 . 0 0 "[ . 1 . 2]" 1 44 1 8 LEU MD1 1 54 PRO HG2 . . 4.140 3.046 2.822 3.210 . 0 0 "[ . 1 . 2]" 1 45 1 8 LEU MD1 1 54 PRO HG3 . . 4.810 4.113 3.969 4.257 . 0 0 "[ . 1 . 2]" 1 46 1 8 LEU MD1 1 55 THR H . . 4.900 3.687 3.362 3.909 . 0 0 "[ . 1 . 2]" 1 47 1 8 LEU MD1 1 55 THR HA . . 3.590 2.854 2.494 3.188 . 0 0 "[ . 1 . 2]" 1 48 1 8 LEU MD1 1 56 GLU H . . 3.780 2.868 2.639 3.108 . 0 0 "[ . 1 . 2]" 1 49 1 8 LEU MD1 1 56 GLU HA . . 3.920 2.205 1.967 2.517 . 0 0 "[ . 1 . 2]" 1 50 1 8 LEU MD1 1 56 GLU QB . . 4.620 3.688 3.576 3.856 . 0 0 "[ . 1 . 2]" 1 51 1 8 LEU MD1 1 57 LYS H . . 4.120 2.990 2.470 3.292 . 0 0 "[ . 1 . 2]" 1 52 1 8 LEU MD1 1 57 LYS HA . . 4.210 3.039 2.510 3.358 . 0 0 "[ . 1 . 2]" 1 53 1 8 LEU MD1 1 57 LYS QB . . 4.180 3.292 2.786 4.025 . 0 0 "[ . 1 . 2]" 1 54 1 8 LEU MD1 1 80 VAL MG1 . . 3.140 2.120 1.933 2.398 . 0 0 "[ . 1 . 2]" 1 55 1 8 LEU MD2 1 9 ARG H . . 3.830 3.786 3.673 3.835 0.005 8 0 "[ . 1 . 2]" 1 56 1 8 LEU MD2 1 56 GLU HA . . 3.970 3.766 3.411 3.980 0.010 12 0 "[ . 1 . 2]" 1 57 1 8 LEU MD2 1 57 LYS H . . 4.530 3.504 2.780 3.981 . 0 0 "[ . 1 . 2]" 1 58 1 8 LEU MD2 1 57 LYS HA . . 4.210 3.038 2.675 3.601 . 0 0 "[ . 1 . 2]" 1 59 1 8 LEU MD2 1 57 LYS QB . . 3.530 2.322 1.946 3.514 . 0 0 "[ . 1 . 2]" 1 60 1 8 LEU MD2 1 57 LYS QD . . 4.080 3.289 2.754 3.675 . 0 0 "[ . 1 . 2]" 1 61 1 8 LEU MD2 1 82 ALA HA . . 4.050 2.196 1.939 2.605 . 0 0 "[ . 1 . 2]" 1 62 1 8 LEU MD2 1 83 ILE H . . 4.020 3.591 3.205 3.861 . 0 0 "[ . 1 . 2]" 1 63 1 8 LEU HG 1 56 GLU HA . . 4.750 4.491 4.142 4.711 . 0 0 "[ . 1 . 2]" 1 64 1 9 ARG H 1 9 ARG HB2 . . 3.230 2.253 2.188 2.380 . 0 0 "[ . 1 . 2]" 1 65 1 9 ARG H 1 9 ARG HB3 . . 3.650 3.528 3.494 3.572 . 0 0 "[ . 1 . 2]" 1 66 1 9 ARG H 1 9 ARG QD . . 4.760 3.808 3.308 4.371 . 0 0 "[ . 1 . 2]" 1 67 1 9 ARG H 1 9 ARG HG2 . . 4.180 3.877 3.652 4.042 . 0 0 "[ . 1 . 2]" 1 68 1 9 ARG H 1 9 ARG HG3 . . 4.080 2.725 2.416 2.997 . 0 0 "[ . 1 . 2]" 1 69 1 9 ARG H 1 10 PRO HD2 . . 5.000 4.780 4.766 4.795 . 0 0 "[ . 1 . 2]" 1 70 1 9 ARG H 1 10 PRO HD3 . . 5.000 4.923 4.868 4.983 . 0 0 "[ . 1 . 2]" 1 71 1 9 ARG H 1 80 VAL MG1 . . 4.240 3.632 3.399 3.934 . 0 0 "[ . 1 . 2]" 1 72 1 9 ARG H 1 83 ILE MD . . 4.870 3.578 3.316 3.834 . 0 0 "[ . 1 . 2]" 1 73 1 9 ARG H 1 83 ILE HG13 . . 4.230 2.659 2.363 2.989 . 0 0 "[ . 1 . 2]" 1 74 1 9 ARG HA 1 9 ARG HD2 . . 4.760 4.631 4.416 4.765 0.005 7 0 "[ . 1 . 2]" 1 75 1 9 ARG HA 1 9 ARG HD3 . . 4.760 4.453 3.926 4.597 . 0 0 "[ . 1 . 2]" 1 76 1 9 ARG HA 1 9 ARG HG2 . . 3.990 2.489 2.168 2.772 . 0 0 "[ . 1 . 2]" 1 77 1 9 ARG HA 1 9 ARG HG3 . . 3.840 2.743 2.498 3.128 . 0 0 "[ . 1 . 2]" 1 78 1 9 ARG HA 1 10 PRO HD2 . . 3.140 2.241 2.197 2.305 . 0 0 "[ . 1 . 2]" 1 79 1 9 ARG HA 1 10 PRO HD3 . . 3.140 2.257 2.252 2.269 . 0 0 "[ . 1 . 2]" 1 80 1 9 ARG HA 1 10 PRO QG . . 3.950 3.907 3.882 3.944 . 0 0 "[ . 1 . 2]" 1 81 1 9 ARG HA 1 54 PRO HG2 . . 5.500 5.484 5.419 5.503 0.003 16 0 "[ . 1 . 2]" 1 82 1 9 ARG HA 1 83 ILE MD . . 3.880 2.826 2.580 3.069 . 0 0 "[ . 1 . 2]" 1 83 1 9 ARG HA 1 83 ILE HG12 . . 4.700 2.469 2.096 2.873 . 0 0 "[ . 1 . 2]" 1 84 1 9 ARG HA 1 83 ILE HG13 . . 4.600 3.762 3.348 4.166 . 0 0 "[ . 1 . 2]" 1 85 1 9 ARG HB2 1 9 ARG HD2 . . 3.830 3.227 2.204 3.726 . 0 0 "[ . 1 . 2]" 1 86 1 9 ARG HB2 1 9 ARG QD . . 3.240 2.356 2.154 2.647 . 0 0 "[ . 1 . 2]" 1 87 1 9 ARG HB2 1 9 ARG HD3 . . 3.830 2.581 2.223 3.534 . 0 0 "[ . 1 . 2]" 1 88 1 9 ARG HB2 1 10 PRO QD . . 4.340 3.843 3.767 3.913 . 0 0 "[ . 1 . 2]" 1 89 1 9 ARG HB2 1 80 VAL MG1 . . 5.170 4.196 3.899 4.457 . 0 0 "[ . 1 . 2]" 1 90 1 9 ARG HB2 1 81 ASP H . . 4.510 4.193 3.729 4.448 . 0 0 "[ . 1 . 2]" 1 91 1 9 ARG HB2 1 83 ILE HG12 . . 5.500 3.659 3.371 4.014 . 0 0 "[ . 1 . 2]" 1 92 1 9 ARG HB3 1 9 ARG HD2 . . 3.870 3.536 2.504 3.849 . 0 0 "[ . 1 . 2]" 1 93 1 9 ARG HB3 1 9 ARG QD . . 3.360 2.697 2.234 3.114 . 0 0 "[ . 1 . 2]" 1 94 1 9 ARG HB3 1 9 ARG HD3 . . 3.870 2.817 2.338 3.315 . 0 0 "[ . 1 . 2]" 1 95 1 9 ARG HB3 1 10 PRO HA . . 5.150 4.851 4.802 4.914 . 0 0 "[ . 1 . 2]" 1 96 1 9 ARG HB3 1 10 PRO HD2 . . 4.340 2.593 2.477 2.742 . 0 0 "[ . 1 . 2]" 1 97 1 9 ARG HB3 1 10 PRO QD . . 3.750 2.559 2.448 2.700 . 0 0 "[ . 1 . 2]" 1 98 1 9 ARG HB3 1 10 PRO HD3 . . 4.340 3.932 3.839 4.045 . 0 0 "[ . 1 . 2]" 1 99 1 9 ARG HB3 1 83 ILE HG12 . . 4.900 4.215 3.980 4.501 . 0 0 "[ . 1 . 2]" 1 100 1 9 ARG HG2 1 10 PRO HD2 . . 4.480 2.749 2.556 3.074 . 0 0 "[ . 1 . 2]" 1 101 1 9 ARG HG2 1 10 PRO QD . . 3.770 2.693 2.510 2.999 . 0 0 "[ . 1 . 2]" 1 102 1 9 ARG HG2 1 10 PRO HD3 . . 4.480 3.864 3.645 4.219 . 0 0 "[ . 1 . 2]" 1 103 1 9 ARG HG2 1 83 ILE HG12 . . 4.440 3.014 2.219 3.629 . 0 0 "[ . 1 . 2]" 1 104 1 9 ARG HG3 1 10 PRO QD . . 4.060 3.835 3.631 4.048 . 0 0 "[ . 1 . 2]" 1 105 1 9 ARG HG3 1 83 ILE HA . . 3.940 2.311 2.013 2.907 . 0 0 "[ . 1 . 2]" 1 106 1 9 ARG HG3 1 83 ILE HG12 . . 4.870 2.038 1.999 2.173 . 0 0 "[ . 1 . 2]" 1 107 1 9 ARG HG3 1 83 ILE HG13 . . 4.040 3.413 2.745 3.726 . 0 0 "[ . 1 . 2]" 1 108 1 10 PRO HA 1 11 PHE H . . 3.000 2.403 2.365 2.455 . 0 0 "[ . 1 . 2]" 1 109 1 10 PRO HA 1 52 TYR H . . 5.230 4.839 4.616 5.148 . 0 0 "[ . 1 . 2]" 1 110 1 10 PRO HA 1 53 ALA HA . . 4.140 3.033 2.862 3.209 . 0 0 "[ . 1 . 2]" 1 111 1 10 PRO HA 1 53 ALA MB . . 4.340 4.173 3.990 4.319 . 0 0 "[ . 1 . 2]" 1 112 1 10 PRO HA 1 54 PRO HD2 . . 3.650 2.442 2.346 2.545 . 0 0 "[ . 1 . 2]" 1 113 1 10 PRO HA 1 54 PRO HD3 . . 3.640 3.238 3.090 3.362 . 0 0 "[ . 1 . 2]" 1 114 1 10 PRO HA 1 54 PRO HG2 . . 4.330 4.067 3.907 4.185 . 0 0 "[ . 1 . 2]" 1 115 1 10 PRO HA 1 54 PRO HG3 . . 4.490 4.011 3.857 4.112 . 0 0 "[ . 1 . 2]" 1 116 1 10 PRO HB2 1 11 PHE H . . 3.760 2.607 2.479 2.704 . 0 0 "[ . 1 . 2]" 1 117 1 10 PRO HB2 1 52 TYR H . . 4.870 4.368 3.962 4.630 . 0 0 "[ . 1 . 2]" 1 118 1 10 PRO HB3 1 11 PHE H . . 3.810 3.451 3.387 3.500 . 0 0 "[ . 1 . 2]" 1 119 1 10 PRO HB3 1 53 ALA HA . . 4.170 3.986 3.588 4.173 0.003 8 0 "[ . 1 . 2]" 1 120 1 10 PRO HB3 1 54 PRO HD2 . . 4.790 4.260 4.068 4.394 . 0 0 "[ . 1 . 2]" 1 121 1 10 PRO HB3 1 54 PRO HD3 . . 5.410 5.232 5.009 5.399 . 0 0 "[ . 1 . 2]" 1 122 1 10 PRO QD 1 83 ILE MD . . 3.880 3.397 2.920 3.604 . 0 0 "[ . 1 . 2]" 1 123 1 10 PRO HD2 1 83 ILE MD . . 4.460 4.323 3.993 4.464 0.004 1 0 "[ . 1 . 2]" 1 124 1 10 PRO HD3 1 83 ILE MD . . 4.460 3.554 3.002 3.804 . 0 0 "[ . 1 . 2]" 1 125 1 10 PRO QG 1 11 PHE H . . 4.220 4.162 4.074 4.226 0.006 5 0 "[ . 1 . 2]" 1 126 1 11 PHE H 1 11 PHE HB2 . . 3.490 2.897 2.773 3.034 . 0 0 "[ . 1 . 2]" 1 127 1 11 PHE H 1 11 PHE HB3 . . 3.500 2.629 2.513 2.773 . 0 0 "[ . 1 . 2]" 1 128 1 11 PHE H 1 11 PHE QD . . 4.450 4.274 4.186 4.329 . 0 0 "[ . 1 . 2]" 1 129 1 11 PHE H 1 12 ASN H . . 4.430 4.078 3.932 4.251 . 0 0 "[ . 1 . 2]" 1 130 1 11 PHE H 1 51 ARG HA . . 4.630 4.213 4.132 4.382 . 0 0 "[ . 1 . 2]" 1 131 1 11 PHE H 1 52 TYR H . . 3.740 2.726 2.593 2.940 . 0 0 "[ . 1 . 2]" 1 132 1 11 PHE H 1 52 TYR HB2 . . 5.500 5.326 4.985 5.505 0.005 16 0 "[ . 1 . 2]" 1 133 1 11 PHE H 1 52 TYR HB3 . . 4.390 3.891 3.501 4.105 . 0 0 "[ . 1 . 2]" 1 134 1 11 PHE H 1 53 ALA HA . . 3.800 3.797 3.720 3.808 0.008 12 0 "[ . 1 . 2]" 1 135 1 11 PHE H 1 54 PRO HD2 . . 4.080 3.840 3.705 3.949 . 0 0 "[ . 1 . 2]" 1 136 1 11 PHE H 1 54 PRO HD3 . . 3.820 3.463 3.326 3.672 . 0 0 "[ . 1 . 2]" 1 137 1 11 PHE HA 1 11 PHE QD . . 4.090 2.688 2.298 3.105 . 0 0 "[ . 1 . 2]" 1 138 1 11 PHE HA 1 12 ASN H . . 2.880 2.192 2.140 2.224 . 0 0 "[ . 1 . 2]" 1 139 1 11 PHE HA 1 52 TYR H . . 4.680 4.575 4.507 4.651 . 0 0 "[ . 1 . 2]" 1 140 1 11 PHE HB2 1 12 ASN H . . 4.750 4.515 4.443 4.576 . 0 0 "[ . 1 . 2]" 1 141 1 11 PHE HB2 1 52 TYR H . . 4.400 4.020 3.805 4.235 . 0 0 "[ . 1 . 2]" 1 142 1 11 PHE HB2 1 52 TYR HB2 . . 5.150 4.913 4.653 5.135 . 0 0 "[ . 1 . 2]" 1 143 1 11 PHE HB2 1 52 TYR HB3 . . 4.080 3.160 2.898 3.383 . 0 0 "[ . 1 . 2]" 1 144 1 11 PHE HB2 1 78 PHE QD . . 4.140 3.660 3.405 3.987 . 0 0 "[ . 1 . 2]" 1 145 1 11 PHE HB3 1 12 ASN H . . 4.630 4.396 4.197 4.480 . 0 0 "[ . 1 . 2]" 1 146 1 11 PHE HB3 1 52 TYR H . . 4.060 2.490 2.213 2.669 . 0 0 "[ . 1 . 2]" 1 147 1 11 PHE HB3 1 52 TYR HB2 . . 4.710 3.666 3.546 3.755 . 0 0 "[ . 1 . 2]" 1 148 1 11 PHE HB3 1 52 TYR HB3 . . 4.060 2.016 1.998 2.072 . 0 0 "[ . 1 . 2]" 1 149 1 11 PHE HB3 1 78 PHE QD . . 5.380 4.995 4.682 5.322 . 0 0 "[ . 1 . 2]" 1 150 1 11 PHE QD 1 12 ASN H . . 4.300 4.034 3.662 4.241 . 0 0 "[ . 1 . 2]" 1 151 1 11 PHE QD 1 13 LEU H . . 4.820 4.350 3.587 4.788 . 0 0 "[ . 1 . 2]" 1 152 1 11 PHE QD 1 13 LEU HB2 . . 5.350 4.860 4.658 5.053 . 0 0 "[ . 1 . 2]" 1 153 1 11 PHE QD 1 50 VAL MG1 . . 4.280 2.504 2.173 2.796 . 0 0 "[ . 1 . 2]" 1 154 1 11 PHE QD 1 52 TYR H . . 4.100 3.576 3.110 3.901 . 0 0 "[ . 1 . 2]" 1 155 1 11 PHE QD 1 52 TYR HB3 . . 4.360 2.985 2.532 3.310 . 0 0 "[ . 1 . 2]" 1 156 1 11 PHE QD 1 76 LEU MD2 . . 5.500 4.905 4.516 5.355 . 0 0 "[ . 1 . 2]" 1 157 1 11 PHE QD 1 78 PHE QB . . 4.430 3.153 2.910 3.345 . 0 0 "[ . 1 . 2]" 1 158 1 11 PHE QE 1 13 LEU HB2 . . 4.630 4.001 3.626 4.273 . 0 0 "[ . 1 . 2]" 1 159 1 11 PHE QE 1 13 LEU HB3 . . 4.520 3.085 2.429 3.627 . 0 0 "[ . 1 . 2]" 1 160 1 11 PHE QE 1 13 LEU MD2 . . 4.000 3.041 2.686 3.383 . 0 0 "[ . 1 . 2]" 1 161 1 11 PHE QE 1 50 VAL MG1 . . 4.010 2.466 2.067 3.044 . 0 0 "[ . 1 . 2]" 1 162 1 11 PHE QE 1 50 VAL MG2 . . 4.730 3.761 3.253 4.357 . 0 0 "[ . 1 . 2]" 1 163 1 11 PHE QE 1 76 LEU MD1 . . 3.940 2.747 2.057 3.089 . 0 0 "[ . 1 . 2]" 1 164 1 11 PHE QE 1 76 LEU MD2 . . 4.440 3.018 2.557 3.541 . 0 0 "[ . 1 . 2]" 1 165 1 11 PHE QE 1 78 PHE QB . . 4.400 2.051 1.908 2.386 . 0 0 "[ . 1 . 2]" 1 166 1 11 PHE QE 1 78 PHE QD . . 4.330 3.202 2.709 3.645 . 0 0 "[ . 1 . 2]" 1 167 1 11 PHE HZ 1 13 LEU HB2 . . 4.740 4.035 3.503 4.344 . 0 0 "[ . 1 . 2]" 1 168 1 11 PHE HZ 1 13 LEU HB3 . . 4.990 3.759 3.305 4.285 . 0 0 "[ . 1 . 2]" 1 169 1 11 PHE HZ 1 13 LEU MD2 . . 3.840 2.619 2.067 3.104 . 0 0 "[ . 1 . 2]" 1 170 1 11 PHE HZ 1 76 LEU MD1 . . 4.040 2.167 1.972 2.494 . 0 0 "[ . 1 . 2]" 1 171 1 11 PHE HZ 1 76 LEU MD2 . . 3.720 2.993 2.100 3.687 . 0 0 "[ . 1 . 2]" 1 172 1 12 ASN H 1 12 ASN HB2 . . 3.930 3.574 2.847 3.797 . 0 0 "[ . 1 . 2]" 1 173 1 12 ASN H 1 12 ASN QB . . 3.430 2.984 2.769 3.111 . 0 0 "[ . 1 . 2]" 1 174 1 12 ASN H 1 12 ASN HB3 . . 3.930 3.295 2.965 3.813 . 0 0 "[ . 1 . 2]" 1 175 1 12 ASN H 1 12 ASN HD21 . . 4.820 3.633 2.169 4.591 . 0 0 "[ . 1 . 2]" 1 176 1 12 ASN H 1 12 ASN QD . . 4.240 3.267 2.144 4.034 . 0 0 "[ . 1 . 2]" 1 177 1 12 ASN H 1 12 ASN HD22 . . 4.820 3.801 2.992 4.471 . 0 0 "[ . 1 . 2]" 1 178 1 12 ASN H 1 13 LEU H . . 4.330 4.209 4.059 4.296 . 0 0 "[ . 1 . 2]" 1 179 1 12 ASN HA 1 13 LEU H . . 2.820 2.147 2.140 2.165 . 0 0 "[ . 1 . 2]" 1 180 1 12 ASN HA 1 13 LEU HB2 . . 4.990 4.859 4.816 4.918 . 0 0 "[ . 1 . 2]" 1 181 1 12 ASN HA 1 49 THR MG . . 5.080 3.824 3.685 3.933 . 0 0 "[ . 1 . 2]" 1 182 1 12 ASN HA 1 50 VAL HB . . 4.890 4.377 4.155 4.543 . 0 0 "[ . 1 . 2]" 1 183 1 12 ASN HA 1 51 ARG H . . 5.290 5.183 5.029 5.269 . 0 0 "[ . 1 . 2]" 1 184 1 12 ASN HA 1 51 ARG HA . . 3.710 3.115 2.878 3.268 . 0 0 "[ . 1 . 2]" 1 185 1 12 ASN HA 1 51 ARG QG . . 4.450 3.222 3.044 3.404 . 0 0 "[ . 1 . 2]" 1 186 1 12 ASN HA 1 52 TYR H . . 4.590 4.409 4.233 4.555 . 0 0 "[ . 1 . 2]" 1 187 1 12 ASN QB 1 13 LEU H . . 3.770 3.430 3.311 3.551 . 0 0 "[ . 1 . 2]" 1 188 1 12 ASN QB 1 49 THR MG . . 4.250 3.685 3.538 3.874 . 0 0 "[ . 1 . 2]" 1 189 1 12 ASN QB 1 51 ARG QG . . 4.050 3.165 3.007 3.331 . 0 0 "[ . 1 . 2]" 1 190 1 12 ASN HB2 1 13 LEU H . . 4.380 3.701 3.471 4.189 . 0 0 "[ . 1 . 2]" 1 191 1 12 ASN HB2 1 49 THR MG . . 4.950 4.093 3.811 4.949 . 0 0 "[ . 1 . 2]" 1 192 1 12 ASN HB2 1 51 ARG QG . . 4.650 4.178 3.721 4.622 . 0 0 "[ . 1 . 2]" 1 193 1 12 ASN HB3 1 13 LEU H . . 4.380 4.176 3.505 4.362 . 0 0 "[ . 1 . 2]" 1 194 1 12 ASN HB3 1 49 THR MG . . 4.950 4.393 3.630 4.862 . 0 0 "[ . 1 . 2]" 1 195 1 12 ASN HB3 1 51 ARG QG . . 4.650 3.288 3.112 3.499 . 0 0 "[ . 1 . 2]" 1 196 1 13 LEU H 1 13 LEU HB2 . . 3.590 3.470 3.387 3.564 . 0 0 "[ . 1 . 2]" 1 197 1 13 LEU H 1 13 LEU HB3 . . 3.590 2.699 2.609 2.779 . 0 0 "[ . 1 . 2]" 1 198 1 13 LEU H 1 13 LEU HG . . 4.530 4.263 4.194 4.301 . 0 0 "[ . 1 . 2]" 1 199 1 13 LEU H 1 14 VAL H . . 4.760 4.359 4.239 4.432 . 0 0 "[ . 1 . 2]" 1 200 1 13 LEU H 1 49 THR MG . . 3.830 3.483 3.289 3.670 . 0 0 "[ . 1 . 2]" 1 201 1 13 LEU H 1 50 VAL H . . 3.640 2.836 2.664 2.978 . 0 0 "[ . 1 . 2]" 1 202 1 13 LEU H 1 50 VAL HB . . 4.010 2.993 2.790 3.220 . 0 0 "[ . 1 . 2]" 1 203 1 13 LEU H 1 50 VAL MG1 . . 4.550 4.195 4.066 4.415 . 0 0 "[ . 1 . 2]" 1 204 1 13 LEU H 1 50 VAL MG2 . . 4.530 4.165 3.995 4.422 . 0 0 "[ . 1 . 2]" 1 205 1 13 LEU H 1 51 ARG HA . . 4.560 4.369 4.167 4.493 . 0 0 "[ . 1 . 2]" 1 206 1 13 LEU H 1 51 ARG QG . . 4.570 4.356 4.155 4.503 . 0 0 "[ . 1 . 2]" 1 207 1 13 LEU HA 1 13 LEU MD1 . . 3.380 2.266 2.087 2.666 . 0 0 "[ . 1 . 2]" 1 208 1 13 LEU HA 1 13 LEU MD2 . . 4.710 3.979 3.936 4.016 . 0 0 "[ . 1 . 2]" 1 209 1 13 LEU HA 1 14 VAL H . . 3.130 2.266 2.163 2.338 . 0 0 "[ . 1 . 2]" 1 210 1 13 LEU HA 1 14 VAL HB . . 4.830 4.611 4.580 4.655 . 0 0 "[ . 1 . 2]" 1 211 1 13 LEU HA 1 14 VAL MG2 . . 4.360 3.492 3.308 3.660 . 0 0 "[ . 1 . 2]" 1 212 1 13 LEU HB2 1 50 VAL HB . . 4.690 4.647 4.444 4.695 0.005 7 0 "[ . 1 . 2]" 1 213 1 13 LEU HB3 1 13 LEU MD1 . . 3.500 3.171 3.127 3.184 . 0 0 "[ . 1 . 2]" 1 214 1 13 LEU HB3 1 13 LEU MD2 . . 3.430 2.202 2.032 2.358 . 0 0 "[ . 1 . 2]" 1 215 1 13 LEU HB3 1 14 VAL H . . 4.580 4.050 3.889 4.271 . 0 0 "[ . 1 . 2]" 1 216 1 13 LEU HB3 1 50 VAL H . . 4.620 4.125 3.959 4.317 . 0 0 "[ . 1 . 2]" 1 217 1 13 LEU HB3 1 50 VAL HB . . 3.810 2.937 2.730 3.000 . 0 0 "[ . 1 . 2]" 1 218 1 13 LEU MD1 1 14 VAL H . . 3.230 2.099 1.809 2.736 . 0 0 "[ . 1 . 2]" 1 219 1 13 LEU MD1 1 15 ILE HG13 . . 4.190 3.893 3.567 4.139 . 0 0 "[ . 1 . 2]" 1 220 1 13 LEU MD2 1 15 ILE HG13 . . 3.960 2.848 2.504 3.267 . 0 0 "[ . 1 . 2]" 1 221 1 13 LEU HG 1 14 VAL H . . 4.190 2.645 2.449 2.935 . 0 0 "[ . 1 . 2]" 1 222 1 13 LEU HG 1 15 ILE H . . 4.620 3.677 3.292 3.953 . 0 0 "[ . 1 . 2]" 1 223 1 13 LEU HG 1 15 ILE HG13 . . 3.860 2.634 2.406 2.821 . 0 0 "[ . 1 . 2]" 1 224 1 13 LEU HG 1 50 VAL HB . . 4.470 4.313 4.115 4.468 . 0 0 "[ . 1 . 2]" 1 225 1 13 LEU HG 1 50 VAL MG2 . . 3.800 3.723 3.546 3.802 0.002 1 0 "[ . 1 . 2]" 1 226 1 14 VAL H 1 14 VAL HB . . 3.430 2.631 2.542 2.707 . 0 0 "[ . 1 . 2]" 1 227 1 14 VAL H 1 14 VAL MG1 . . 4.160 3.847 3.807 3.882 . 0 0 "[ . 1 . 2]" 1 228 1 14 VAL H 1 14 VAL MG2 . . 3.440 2.730 2.504 2.887 . 0 0 "[ . 1 . 2]" 1 229 1 14 VAL H 1 15 ILE H . . 4.570 4.201 4.040 4.332 . 0 0 "[ . 1 . 2]" 1 230 1 14 VAL HA 1 14 VAL MG1 . . 3.410 2.378 2.288 2.456 . 0 0 "[ . 1 . 2]" 1 231 1 14 VAL HA 1 14 VAL MG2 . . 3.290 2.356 2.279 2.434 . 0 0 "[ . 1 . 2]" 1 232 1 14 VAL HA 1 15 ILE H . . 2.970 2.152 2.140 2.189 . 0 0 "[ . 1 . 2]" 1 233 1 14 VAL HA 1 15 ILE HB . . 4.940 4.731 4.700 4.780 . 0 0 "[ . 1 . 2]" 1 234 1 14 VAL HA 1 48 ILE H . . 4.710 4.135 3.982 4.306 . 0 0 "[ . 1 . 2]" 1 235 1 14 VAL HA 1 49 THR HA . . 3.680 2.417 2.277 2.608 . 0 0 "[ . 1 . 2]" 1 236 1 14 VAL HA 1 50 VAL H . . 4.270 3.398 3.218 3.543 . 0 0 "[ . 1 . 2]" 1 237 1 14 VAL HB 1 15 ILE H . . 4.500 4.337 4.235 4.430 . 0 0 "[ . 1 . 2]" 1 238 1 14 VAL MG1 1 15 ILE H . . 3.430 2.907 2.582 3.206 . 0 0 "[ . 1 . 2]" 1 239 1 14 VAL MG1 1 17 PHE H . . 4.930 4.688 4.618 4.769 . 0 0 "[ . 1 . 2]" 1 240 1 14 VAL MG1 1 43 ASN HD21 . . 4.300 4.066 3.844 4.243 . 0 0 "[ . 1 . 2]" 1 241 1 14 VAL MG1 1 43 ASN HD22 . . 4.250 3.680 3.488 3.813 . 0 0 "[ . 1 . 2]" 1 242 1 14 VAL MG1 1 47 THR HA . . 4.090 3.971 3.837 4.066 . 0 0 "[ . 1 . 2]" 1 243 1 14 VAL MG1 1 47 THR HB . . 3.140 2.145 2.020 2.319 . 0 0 "[ . 1 . 2]" 1 244 1 14 VAL MG1 1 48 ILE H . . 3.810 2.759 2.650 2.945 . 0 0 "[ . 1 . 2]" 1 245 1 14 VAL MG1 1 49 THR HA . . 4.250 3.453 3.282 3.733 . 0 0 "[ . 1 . 2]" 1 246 1 14 VAL MG2 1 43 ASN HD22 . . 4.600 4.259 4.012 4.411 . 0 0 "[ . 1 . 2]" 1 247 1 14 VAL MG2 1 49 THR HA . . 3.750 2.730 2.504 3.151 . 0 0 "[ . 1 . 2]" 1 248 1 14 VAL MG2 1 49 THR HG1 . . 4.070 3.053 2.415 3.664 . 0 0 "[ . 1 . 2]" 1 249 1 15 ILE H 1 15 ILE HB . . 3.500 2.599 2.537 2.641 . 0 0 "[ . 1 . 2]" 1 250 1 15 ILE H 1 15 ILE MD . . 3.740 3.550 3.370 3.657 . 0 0 "[ . 1 . 2]" 1 251 1 15 ILE H 1 15 ILE HG12 . . 3.720 3.675 3.569 3.728 0.008 17 0 "[ . 1 . 2]" 1 252 1 15 ILE H 1 15 ILE HG13 . . 3.940 2.306 2.182 2.405 . 0 0 "[ . 1 . 2]" 1 253 1 15 ILE H 1 15 ILE MG . . 4.300 3.816 3.786 3.841 . 0 0 "[ . 1 . 2]" 1 254 1 15 ILE H 1 16 PRO HD2 . . 5.090 4.831 4.823 4.837 . 0 0 "[ . 1 . 2]" 1 255 1 15 ILE H 1 16 PRO QD . . 4.450 4.292 4.260 4.311 . 0 0 "[ . 1 . 2]" 1 256 1 15 ILE H 1 16 PRO HD3 . . 5.090 4.805 4.744 4.842 . 0 0 "[ . 1 . 2]" 1 257 1 15 ILE H 1 47 THR HB . . 4.530 4.423 4.246 4.530 . 0 0 "[ . 1 . 2]" 1 258 1 15 ILE H 1 48 ILE H . . 3.520 3.234 3.116 3.367 . 0 0 "[ . 1 . 2]" 1 259 1 15 ILE H 1 48 ILE MD . . 4.200 3.803 3.602 3.920 . 0 0 "[ . 1 . 2]" 1 260 1 15 ILE H 1 48 ILE HG12 . . 4.550 3.233 3.020 3.421 . 0 0 "[ . 1 . 2]" 1 261 1 15 ILE H 1 48 ILE HG13 . . 4.050 2.527 2.250 2.646 . 0 0 "[ . 1 . 2]" 1 262 1 15 ILE H 1 49 THR HA . . 3.820 3.720 3.624 3.815 . 0 0 "[ . 1 . 2]" 1 263 1 15 ILE H 1 50 VAL H . . 4.770 4.377 4.140 4.646 . 0 0 "[ . 1 . 2]" 1 264 1 15 ILE H 1 50 VAL MG2 . . 4.280 3.581 3.361 3.884 . 0 0 "[ . 1 . 2]" 1 265 1 15 ILE HA 1 15 ILE MD . . 4.440 3.904 3.869 3.935 . 0 0 "[ . 1 . 2]" 1 266 1 15 ILE HA 1 15 ILE HG12 . . 4.110 2.705 2.614 2.807 . 0 0 "[ . 1 . 2]" 1 267 1 15 ILE HA 1 15 ILE HG13 . . 4.080 2.968 2.923 3.011 . 0 0 "[ . 1 . 2]" 1 268 1 15 ILE HA 1 15 ILE MG . . 3.500 2.386 2.356 2.426 . 0 0 "[ . 1 . 2]" 1 269 1 15 ILE HA 1 16 PRO HD2 . . 3.380 2.088 2.056 2.113 . 0 0 "[ . 1 . 2]" 1 270 1 15 ILE HA 1 16 PRO HD3 . . 3.380 2.263 2.257 2.272 . 0 0 "[ . 1 . 2]" 1 271 1 15 ILE HB 1 15 ILE MD . . 3.260 2.316 2.196 2.401 . 0 0 "[ . 1 . 2]" 1 272 1 15 ILE HB 1 16 PRO QD . . 4.760 3.859 3.822 3.908 . 0 0 "[ . 1 . 2]" 1 273 1 15 ILE HB 1 48 ILE H . . 4.310 3.964 3.887 4.095 . 0 0 "[ . 1 . 2]" 1 274 1 15 ILE HB 1 48 ILE MD . . 3.470 2.265 2.101 2.432 . 0 0 "[ . 1 . 2]" 1 275 1 15 ILE HB 1 48 ILE HG12 . . 3.650 2.324 2.207 2.407 . 0 0 "[ . 1 . 2]" 1 276 1 15 ILE HB 1 48 ILE HG13 . . 3.650 2.529 2.375 2.614 . 0 0 "[ . 1 . 2]" 1 277 1 15 ILE HB 1 71 ILE MD . . 4.890 3.634 3.478 3.923 . 0 0 "[ . 1 . 2]" 1 278 1 15 ILE MD 1 15 ILE MG . . 2.600 2.187 2.071 2.362 . 0 0 "[ . 1 . 2]" 1 279 1 15 ILE MD 1 48 ILE MD . . 2.930 2.236 1.976 2.481 . 0 0 "[ . 1 . 2]" 1 280 1 15 ILE MD 1 48 ILE HG12 . . 4.150 3.842 3.659 3.989 . 0 0 "[ . 1 . 2]" 1 281 1 15 ILE MD 1 48 ILE HG13 . . 4.540 3.271 3.006 3.486 . 0 0 "[ . 1 . 2]" 1 282 1 15 ILE MD 1 50 VAL MG2 . . 2.720 2.180 1.999 2.386 . 0 0 "[ . 1 . 2]" 1 283 1 15 ILE MD 1 64 ILE QG . . 3.580 3.076 2.893 3.312 . 0 0 "[ . 1 . 2]" 1 284 1 15 ILE MD 1 71 ILE MD . . 3.250 2.283 2.117 2.622 . 0 0 "[ . 1 . 2]" 1 285 1 15 ILE HG12 1 16 PRO HD2 . . 5.210 3.798 3.675 3.892 . 0 0 "[ . 1 . 2]" 1 286 1 15 ILE HG12 1 16 PRO QD . . 4.530 3.647 3.533 3.736 . 0 0 "[ . 1 . 2]" 1 287 1 15 ILE HG12 1 16 PRO HD3 . . 5.210 4.709 4.584 4.820 . 0 0 "[ . 1 . 2]" 1 288 1 15 ILE HG12 1 48 ILE HG13 . . 4.940 4.902 4.808 4.945 0.005 1 0 "[ . 1 . 2]" 1 289 1 15 ILE HG13 1 16 PRO HD2 . . 5.270 4.693 4.659 4.743 . 0 0 "[ . 1 . 2]" 1 290 1 15 ILE HG13 1 16 PRO QD . . 4.540 4.373 4.344 4.417 . 0 0 "[ . 1 . 2]" 1 291 1 15 ILE HG13 1 16 PRO HD3 . . 5.270 5.221 5.174 5.268 . 0 0 "[ . 1 . 2]" 1 292 1 15 ILE HG13 1 48 ILE HG12 . . 4.470 4.386 4.178 4.475 0.005 4 0 "[ . 1 . 2]" 1 293 1 15 ILE MG 1 16 PRO HD2 . . 3.550 1.954 1.900 2.043 . 0 0 "[ . 1 . 2]" 1 294 1 15 ILE MG 1 16 PRO QD . . 3.090 1.940 1.887 2.026 . 0 0 "[ . 1 . 2]" 1 295 1 15 ILE MG 1 16 PRO HD3 . . 3.550 3.290 3.232 3.350 . 0 0 "[ . 1 . 2]" 1 296 1 15 ILE MG 1 16 PRO HG2 . . 4.600 3.114 3.037 3.169 . 0 0 "[ . 1 . 2]" 1 297 1 15 ILE MG 1 16 PRO QG . . 4.020 3.022 2.950 3.070 . 0 0 "[ . 1 . 2]" 1 298 1 15 ILE MG 1 16 PRO HG3 . . 4.600 4.079 4.004 4.134 . 0 0 "[ . 1 . 2]" 1 299 1 15 ILE MG 1 17 PHE H . . 3.930 3.847 3.757 3.934 0.004 17 0 "[ . 1 . 2]" 1 300 1 15 ILE MG 1 17 PHE HB2 . . 3.730 2.888 2.780 3.037 . 0 0 "[ . 1 . 2]" 1 301 1 15 ILE MG 1 17 PHE HB3 . . 4.030 3.569 3.305 3.724 . 0 0 "[ . 1 . 2]" 1 302 1 15 ILE MG 1 48 ILE MD . . 3.260 3.069 2.892 3.218 . 0 0 "[ . 1 . 2]" 1 303 1 15 ILE MG 1 48 ILE HG12 . . 3.620 3.578 3.471 3.626 0.006 18 0 "[ . 1 . 2]" 1 304 1 15 ILE MG 1 48 ILE HG13 . . 4.220 4.152 4.008 4.226 0.006 5 0 "[ . 1 . 2]" 1 305 1 15 ILE MG 1 71 ILE MD . . 3.250 2.636 2.378 2.963 . 0 0 "[ . 1 . 2]" 1 306 1 16 PRO HA 1 17 PHE H . . 2.860 2.380 2.333 2.407 . 0 0 "[ . 1 . 2]" 1 307 1 16 PRO HA 1 17 PHE HA . . 4.800 4.351 4.339 4.366 . 0 0 "[ . 1 . 2]" 1 308 1 16 PRO HA 1 17 PHE HB3 . . 5.160 5.092 4.929 5.162 0.002 1 0 "[ . 1 . 2]" 1 309 1 16 PRO HA 1 47 THR HA . . 3.390 2.879 2.687 2.961 . 0 0 "[ . 1 . 2]" 1 310 1 16 PRO HA 1 47 THR HB . . 3.890 3.342 3.102 3.526 . 0 0 "[ . 1 . 2]" 1 311 1 16 PRO HA 1 47 THR MG . . 3.050 2.261 2.038 2.589 . 0 0 "[ . 1 . 2]" 1 312 1 16 PRO HA 1 48 ILE H . . 4.100 4.042 3.933 4.109 0.009 3 0 "[ . 1 . 2]" 1 313 1 16 PRO QB 1 17 PHE H . . 3.960 3.884 3.845 3.903 . 0 0 "[ . 1 . 2]" 1 314 1 16 PRO QB 1 47 THR HA . . 4.710 4.649 4.486 4.715 0.005 11 0 "[ . 1 . 2]" 1 315 1 16 PRO QB 1 47 THR MG . . 3.750 3.338 3.149 3.614 . 0 0 "[ . 1 . 2]" 1 316 1 17 PHE H 1 17 PHE HB2 . . 3.920 3.272 3.197 3.439 . 0 0 "[ . 1 . 2]" 1 317 1 17 PHE H 1 17 PHE HB3 . . 3.770 2.922 2.840 3.065 . 0 0 "[ . 1 . 2]" 1 318 1 17 PHE H 1 17 PHE QD . . 4.560 4.436 4.410 4.467 . 0 0 "[ . 1 . 2]" 1 319 1 17 PHE H 1 18 ALA H . . 4.050 4.024 3.881 4.055 0.005 9 0 "[ . 1 . 2]" 1 320 1 17 PHE H 1 47 THR H . . 4.810 4.732 4.659 4.805 . 0 0 "[ . 1 . 2]" 1 321 1 17 PHE H 1 47 THR HA . . 2.950 1.967 1.898 2.053 . 0 0 "[ . 1 . 2]" 1 322 1 17 PHE H 1 47 THR HB . . 3.950 3.747 3.534 3.892 . 0 0 "[ . 1 . 2]" 1 323 1 17 PHE H 1 47 THR MG . . 3.920 3.418 3.237 3.581 . 0 0 "[ . 1 . 2]" 1 324 1 17 PHE H 1 48 ILE H . . 3.680 3.148 2.982 3.326 . 0 0 "[ . 1 . 2]" 1 325 1 17 PHE H 1 48 ILE MD . . 4.940 4.433 4.217 4.764 . 0 0 "[ . 1 . 2]" 1 326 1 17 PHE H 1 48 ILE HG12 . . 4.570 3.351 3.167 3.556 . 0 0 "[ . 1 . 2]" 1 327 1 17 PHE H 1 48 ILE HG13 . . 5.310 4.958 4.737 5.233 . 0 0 "[ . 1 . 2]" 1 328 1 17 PHE H 1 48 ILE MG . . 4.410 3.373 3.260 3.492 . 0 0 "[ . 1 . 2]" 1 329 1 17 PHE HA 1 17 PHE QD . . 3.560 2.178 2.024 2.351 . 0 0 "[ . 1 . 2]" 1 330 1 17 PHE HA 1 17 PHE QE . . 4.620 4.358 4.256 4.475 . 0 0 "[ . 1 . 2]" 1 331 1 17 PHE HA 1 18 ALA H . . 2.590 2.141 2.138 2.153 . 0 0 "[ . 1 . 2]" 1 332 1 17 PHE HA 1 18 ALA MB . . 4.150 3.973 3.922 4.019 . 0 0 "[ . 1 . 2]" 1 333 1 17 PHE HB2 1 18 ALA H . . 4.500 4.388 4.288 4.437 . 0 0 "[ . 1 . 2]" 1 334 1 17 PHE HB2 1 48 ILE MD . . 4.240 3.721 3.434 4.054 . 0 0 "[ . 1 . 2]" 1 335 1 17 PHE HB2 1 48 ILE HG12 . . 4.660 4.026 3.801 4.381 . 0 0 "[ . 1 . 2]" 1 336 1 17 PHE HB2 1 48 ILE MG . . 4.440 4.230 4.098 4.391 . 0 0 "[ . 1 . 2]" 1 337 1 17 PHE HB2 1 71 ILE MD . . 4.050 3.944 3.643 4.047 . 0 0 "[ . 1 . 2]" 1 338 1 17 PHE HB2 1 72 PRO HG2 . . 5.010 3.034 2.875 3.150 . 0 0 "[ . 1 . 2]" 1 339 1 17 PHE HB3 1 18 ALA H . . 4.480 4.277 4.165 4.392 . 0 0 "[ . 1 . 2]" 1 340 1 17 PHE HB3 1 48 ILE MD . . 3.940 2.657 2.281 3.135 . 0 0 "[ . 1 . 2]" 1 341 1 17 PHE HB3 1 48 ILE HG12 . . 4.480 2.881 2.676 3.166 . 0 0 "[ . 1 . 2]" 1 342 1 17 PHE HB3 1 48 ILE HG13 . . 4.870 4.506 4.283 4.773 . 0 0 "[ . 1 . 2]" 1 343 1 17 PHE HB3 1 48 ILE MG . . 3.820 2.761 2.653 2.921 . 0 0 "[ . 1 . 2]" 1 344 1 17 PHE HB3 1 71 ILE MD . . 4.220 4.045 3.835 4.208 . 0 0 "[ . 1 . 2]" 1 345 1 17 PHE HB3 1 72 PRO HG2 . . 4.740 4.683 4.496 4.744 0.004 11 0 "[ . 1 . 2]" 1 346 1 17 PHE QD 1 18 ALA H . . 3.870 3.187 2.889 3.440 . 0 0 "[ . 1 . 2]" 1 347 1 17 PHE QD 1 19 VAL MG2 . . 3.400 2.912 2.630 3.296 . 0 0 "[ . 1 . 2]" 1 348 1 17 PHE QD 1 24 LEU MD1 . . 4.000 2.264 2.010 2.507 . 0 0 "[ . 1 . 2]" 1 349 1 17 PHE QD 1 24 LEU MD2 . . 3.980 3.471 3.006 3.761 . 0 0 "[ . 1 . 2]" 1 350 1 17 PHE QD 1 48 ILE MD . . 4.050 2.668 2.168 3.367 . 0 0 "[ . 1 . 2]" 1 351 1 17 PHE QD 1 48 ILE MG . . 3.860 2.935 2.522 3.251 . 0 0 "[ . 1 . 2]" 1 352 1 17 PHE QD 1 71 ILE HA . . 4.930 4.679 4.549 4.923 . 0 0 "[ . 1 . 2]" 1 353 1 17 PHE QD 1 71 ILE HB . . 4.260 3.500 3.298 3.748 . 0 0 "[ . 1 . 2]" 1 354 1 17 PHE QD 1 71 ILE MD . . 4.230 3.743 3.342 4.088 . 0 0 "[ . 1 . 2]" 1 355 1 17 PHE QD 1 71 ILE MG . . 4.410 2.852 2.548 3.057 . 0 0 "[ . 1 . 2]" 1 356 1 17 PHE QD 1 72 PRO HD2 . . 4.270 3.238 3.029 3.548 . 0 0 "[ . 1 . 2]" 1 357 1 17 PHE QD 1 72 PRO HD3 . . 4.640 3.867 3.473 4.317 . 0 0 "[ . 1 . 2]" 1 358 1 17 PHE QE 1 19 VAL MG2 . . 3.640 3.221 2.797 3.489 . 0 0 "[ . 1 . 2]" 1 359 1 17 PHE QE 1 66 TYR HB2 . . 4.890 2.112 2.020 2.330 . 0 0 "[ . 1 . 2]" 1 360 1 17 PHE QE 1 66 TYR HB3 . . 4.970 3.038 2.778 3.456 . 0 0 "[ . 1 . 2]" 1 361 1 17 PHE QE 1 71 ILE HB . . 4.490 3.911 3.597 4.251 . 0 0 "[ . 1 . 2]" 1 362 1 17 PHE QE 1 71 ILE MG . . 4.090 2.481 1.969 2.744 . 0 0 "[ . 1 . 2]" 1 363 1 17 PHE QE 1 72 PRO HD2 . . 4.450 3.509 3.166 3.795 . 0 0 "[ . 1 . 2]" 1 364 1 17 PHE QE 1 72 PRO HD3 . . 4.510 3.322 2.873 3.929 . 0 0 "[ . 1 . 2]" 1 365 1 17 PHE QE 1 72 PRO HG3 . . 4.900 3.376 2.758 4.026 . 0 0 "[ . 1 . 2]" 1 366 1 17 PHE HZ 1 66 TYR HB2 . . 4.820 3.578 3.121 4.040 . 0 0 "[ . 1 . 2]" 1 367 1 17 PHE HZ 1 66 TYR HB3 . . 4.650 3.182 2.842 3.391 . 0 0 "[ . 1 . 2]" 1 368 1 17 PHE HZ 1 66 TYR QD . . 4.010 2.927 2.093 3.249 . 0 0 "[ . 1 . 2]" 1 369 1 17 PHE HZ 1 71 ILE MG . . 4.350 3.603 3.191 3.969 . 0 0 "[ . 1 . 2]" 1 370 1 18 ALA H 1 18 ALA MB . . 2.850 2.160 2.063 2.258 . 0 0 "[ . 1 . 2]" 1 371 1 18 ALA H 1 19 VAL H . . 4.840 4.611 4.547 4.635 . 0 0 "[ . 1 . 2]" 1 372 1 18 ALA HA 1 19 VAL H . . 2.660 2.246 2.166 2.333 . 0 0 "[ . 1 . 2]" 1 373 1 18 ALA HA 1 19 VAL HB . . 4.670 4.505 4.435 4.619 . 0 0 "[ . 1 . 2]" 1 374 1 18 ALA HA 1 19 VAL MG2 . . 3.640 3.522 3.377 3.627 . 0 0 "[ . 1 . 2]" 1 375 1 18 ALA HA 1 46 GLY H . . 4.070 3.282 3.061 3.570 . 0 0 "[ . 1 . 2]" 1 376 1 18 ALA HA 1 46 GLY QA . . 4.010 2.257 2.067 2.511 . 0 0 "[ . 1 . 2]" 1 377 1 18 ALA MB 1 19 VAL H . . 3.240 2.796 2.557 3.054 . 0 0 "[ . 1 . 2]" 1 378 1 18 ALA MB 1 20 GLN HE21 . . 4.560 2.624 2.146 3.235 . 0 0 "[ . 1 . 2]" 1 379 1 18 ALA MB 1 20 GLN QE . . 3.840 2.422 1.814 3.167 . 0 0 "[ . 1 . 2]" 1 380 1 18 ALA MB 1 20 GLN HE22 . . 4.560 3.262 1.850 4.505 . 0 0 "[ . 1 . 2]" 1 381 1 18 ALA MB 1 20 GLN QG . . 4.280 3.531 2.955 4.024 . 0 0 "[ . 1 . 2]" 1 382 1 18 ALA MB 1 46 GLY HA2 . . 4.000 2.130 1.927 2.473 . 0 0 "[ . 1 . 2]" 1 383 1 18 ALA MB 1 46 GLY QA . . 3.450 2.111 1.911 2.442 . 0 0 "[ . 1 . 2]" 1 384 1 18 ALA MB 1 46 GLY HA3 . . 4.000 3.469 3.161 3.774 . 0 0 "[ . 1 . 2]" 1 385 1 19 VAL H 1 19 VAL HB . . 2.970 2.778 2.533 2.967 . 0 0 "[ . 1 . 2]" 1 386 1 19 VAL H 1 19 VAL MG1 . . 4.360 3.888 3.794 3.961 . 0 0 "[ . 1 . 2]" 1 387 1 19 VAL H 1 19 VAL MG2 . . 3.130 2.951 2.639 3.130 . 10 0 "[ . 1 . 2]" 1 388 1 19 VAL H 1 20 GLN H . . 4.670 4.077 3.859 4.327 . 0 0 "[ . 1 . 2]" 1 389 1 19 VAL H 1 20 GLN QE . . 4.690 3.582 2.504 4.497 . 0 0 "[ . 1 . 2]" 1 390 1 19 VAL H 1 66 TYR QE . . 5.500 5.443 5.303 5.501 0.001 13 0 "[ . 1 . 2]" 1 391 1 19 VAL HA 1 19 VAL MG1 . . 3.100 2.410 2.320 2.483 . 0 0 "[ . 1 . 2]" 1 392 1 19 VAL HA 1 19 VAL MG2 . . 3.080 2.351 2.270 2.422 . 0 0 "[ . 1 . 2]" 1 393 1 19 VAL HA 1 20 GLN H . . 2.980 2.154 2.141 2.199 . 0 0 "[ . 1 . 2]" 1 394 1 19 VAL HA 1 20 GLN QG . . 4.390 4.109 3.737 4.380 . 0 0 "[ . 1 . 2]" 1 395 1 19 VAL HA 1 24 LEU MD1 . . 4.860 4.378 4.031 4.805 . 0 0 "[ . 1 . 2]" 1 396 1 19 VAL HA 1 66 TYR QE . . 4.030 2.716 2.493 2.941 . 0 0 "[ . 1 . 2]" 1 397 1 19 VAL HB 1 20 GLN H . . 4.770 4.332 4.207 4.444 . 0 0 "[ . 1 . 2]" 1 398 1 19 VAL HB 1 20 GLN HA . . 5.100 4.848 4.740 5.011 . 0 0 "[ . 1 . 2]" 1 399 1 19 VAL HB 1 24 LEU MD1 . . 4.770 4.458 4.078 4.772 0.002 2 0 "[ . 1 . 2]" 1 400 1 19 VAL HB 1 42 ASP HA . . 4.690 4.368 3.988 4.611 . 0 0 "[ . 1 . 2]" 1 401 1 19 VAL HB 1 44 LYS H . . 4.330 3.789 3.446 4.134 . 0 0 "[ . 1 . 2]" 1 402 1 19 VAL HB 1 44 LYS HA . . 4.100 3.735 3.277 4.102 0.002 19 0 "[ . 1 . 2]" 1 403 1 19 VAL HB 1 48 ILE MG . . 4.530 3.339 2.836 3.739 . 0 0 "[ . 1 . 2]" 1 404 1 19 VAL MG1 1 20 GLN H . . 3.570 2.799 2.348 3.160 . 0 0 "[ . 1 . 2]" 1 405 1 19 VAL MG1 1 20 GLN HA . . 4.570 3.658 3.253 4.028 . 0 0 "[ . 1 . 2]" 1 406 1 19 VAL MG1 1 22 GLY H . . 4.350 3.168 2.383 4.208 . 0 0 "[ . 1 . 2]" 1 407 1 19 VAL MG1 1 42 ASP HB2 . . 4.780 3.921 3.223 4.247 . 0 0 "[ . 1 . 2]" 1 408 1 19 VAL MG1 1 42 ASP QB . . 3.900 3.677 3.106 3.871 . 0 0 "[ . 1 . 2]" 1 409 1 19 VAL MG1 1 42 ASP HB3 . . 4.780 4.468 4.063 4.728 . 0 0 "[ . 1 . 2]" 1 410 1 19 VAL MG1 1 66 TYR QD . . 3.950 3.204 2.771 3.611 . 0 0 "[ . 1 . 2]" 1 411 1 19 VAL MG1 1 66 TYR QE . . 3.290 2.072 1.840 2.329 . 0 0 "[ . 1 . 2]" 1 412 1 19 VAL MG2 1 20 GLN H . . 4.220 4.093 3.969 4.224 0.004 17 0 "[ . 1 . 2]" 1 413 1 19 VAL MG2 1 24 LEU MD1 . . 3.020 2.060 1.800 2.291 . 0 0 "[ . 1 . 2]" 1 414 1 19 VAL MG2 1 24 LEU MD2 . . 3.040 2.671 2.453 3.005 . 0 0 "[ . 1 . 2]" 1 415 1 19 VAL MG2 1 24 LEU HG . . 4.570 4.400 4.035 4.572 0.002 1 0 "[ . 1 . 2]" 1 416 1 19 VAL MG2 1 46 GLY H . . 5.500 5.267 4.991 5.492 . 0 0 "[ . 1 . 2]" 1 417 1 20 GLN H 1 20 GLN QB . . 3.390 2.575 2.330 2.772 . 0 0 "[ . 1 . 2]" 1 418 1 20 GLN H 1 20 GLN HG2 . . 4.470 3.761 2.546 4.363 . 0 0 "[ . 1 . 2]" 1 419 1 20 GLN H 1 20 GLN HG3 . . 4.470 3.553 2.936 4.205 . 0 0 "[ . 1 . 2]" 1 420 1 20 GLN H 1 22 GLY H . . 4.640 3.573 2.800 3.968 . 0 0 "[ . 1 . 2]" 1 421 1 20 GLN H 1 66 TYR QE . . 4.240 3.338 2.764 3.834 . 0 0 "[ . 1 . 2]" 1 422 1 20 GLN HA 1 20 GLN HG2 . . 3.960 3.165 2.614 3.610 . 0 0 "[ . 1 . 2]" 1 423 1 20 GLN HA 1 20 GLN QG . . 3.390 2.634 2.420 3.063 . 0 0 "[ . 1 . 2]" 1 424 1 20 GLN HA 1 20 GLN HG3 . . 3.960 3.027 2.462 3.805 . 0 0 "[ . 1 . 2]" 1 425 1 20 GLN QB 1 21 LYS H . . 3.890 2.585 1.901 3.590 . 0 0 "[ . 1 . 2]" 1 426 1 20 GLN QB 1 21 LYS QG . . 4.270 3.196 2.541 4.255 . 0 0 "[ . 1 . 2]" 1 427 1 20 GLN QB 1 22 GLY H . . 4.730 4.244 3.509 4.684 . 0 0 "[ . 1 . 2]" 1 428 1 20 GLN HB2 1 21 LYS H . . 4.460 3.025 1.918 4.393 . 0 0 "[ . 1 . 2]" 1 429 1 20 GLN HB2 1 22 GLY H . . 5.500 4.546 3.593 5.188 . 0 0 "[ . 1 . 2]" 1 430 1 20 GLN HB3 1 21 LYS H . . 4.460 3.238 2.772 3.807 . 0 0 "[ . 1 . 2]" 1 431 1 20 GLN HB3 1 22 GLY H . . 5.500 5.215 4.781 5.492 . 0 0 "[ . 1 . 2]" 1 432 1 21 LYS H 1 21 LYS QG . . 4.880 2.732 1.954 3.365 . 0 0 "[ . 1 . 2]" 1 433 1 21 LYS HA 1 21 LYS QD . . 4.450 3.478 1.987 4.405 . 0 0 "[ . 1 . 2]" 1 434 1 21 LYS HA 1 21 LYS HG2 . . 4.180 2.881 2.238 3.791 . 0 0 "[ . 1 . 2]" 1 435 1 21 LYS HA 1 21 LYS QG . . 3.570 2.707 2.196 3.343 . 0 0 "[ . 1 . 2]" 1 436 1 21 LYS HA 1 21 LYS HG3 . . 4.180 3.449 2.672 3.894 . 0 0 "[ . 1 . 2]" 1 437 1 21 LYS HB2 1 22 GLY H . . 4.590 3.852 2.458 4.501 . 0 0 "[ . 1 . 2]" 1 438 1 21 LYS HB3 1 22 GLY H . . 4.590 4.148 3.053 4.609 0.019 2 0 "[ . 1 . 2]" 1 439 1 21 LYS QE 1 21 LYS QG . . 3.190 2.288 2.032 2.648 . 0 0 "[ . 1 . 2]" 1 440 1 21 LYS QG 1 22 GLY H . . 5.060 4.153 1.828 4.786 . 0 0 "[ . 1 . 2]" 1 441 1 22 GLY H 1 23 GLU H . . 4.720 4.532 4.357 4.642 . 0 0 "[ . 1 . 2]" 1 442 1 22 GLY H 1 66 TYR QE . . 4.100 3.583 3.190 4.031 . 0 0 "[ . 1 . 2]" 1 443 1 22 GLY HA2 1 23 GLU H . . 2.820 2.300 2.199 2.439 . 0 0 "[ . 1 . 2]" 1 444 1 22 GLY HA2 1 23 GLU HB2 . . 4.830 4.465 4.333 4.592 . 0 0 "[ . 1 . 2]" 1 445 1 22 GLY HA2 1 23 GLU QB . . 4.190 4.047 4.023 4.077 . 0 0 "[ . 1 . 2]" 1 446 1 22 GLY HA2 1 23 GLU HB3 . . 4.830 4.641 4.497 4.802 . 0 0 "[ . 1 . 2]" 1 447 1 22 GLY HA2 1 66 TYR QD . . 5.500 5.170 4.906 5.452 . 0 0 "[ . 1 . 2]" 1 448 1 22 GLY HA2 1 66 TYR QE . . 4.370 4.119 3.851 4.354 . 0 0 "[ . 1 . 2]" 1 449 1 22 GLY HA2 1 67 ASP HB2 . . 3.900 3.312 2.795 3.795 . 0 0 "[ . 1 . 2]" 1 450 1 22 GLY HA2 1 67 ASP HB3 . . 5.410 4.879 4.320 5.412 0.002 8 0 "[ . 1 . 2]" 1 451 1 22 GLY HA3 1 23 GLU H . . 3.110 2.877 2.697 3.036 . 0 0 "[ . 1 . 2]" 1 452 1 22 GLY HA3 1 23 GLU HA . . 4.690 4.569 4.485 4.650 . 0 0 "[ . 1 . 2]" 1 453 1 22 GLY HA3 1 66 TYR QD . . 5.000 3.921 3.648 4.234 . 0 0 "[ . 1 . 2]" 1 454 1 22 GLY HA3 1 66 TYR QE . . 4.100 2.592 2.299 2.906 . 0 0 "[ . 1 . 2]" 1 455 1 23 GLU H 1 23 GLU HB2 . . 3.180 2.828 2.655 3.014 . 0 0 "[ . 1 . 2]" 1 456 1 23 GLU H 1 23 GLU HB3 . . 3.180 2.469 2.359 2.595 . 0 0 "[ . 1 . 2]" 1 457 1 23 GLU H 1 23 GLU HG2 . . 4.730 4.435 4.280 4.691 . 0 0 "[ . 1 . 2]" 1 458 1 23 GLU H 1 23 GLU QG . . 4.040 3.985 3.925 4.038 . 0 0 "[ . 1 . 2]" 1 459 1 23 GLU H 1 23 GLU HG3 . . 4.730 4.531 4.269 4.674 . 0 0 "[ . 1 . 2]" 1 460 1 23 GLU H 1 24 LEU H . . 4.490 4.390 4.221 4.518 0.028 18 0 "[ . 1 . 2]" 1 461 1 23 GLU H 1 66 TYR HA . . 4.840 4.535 4.394 4.773 . 0 0 "[ . 1 . 2]" 1 462 1 23 GLU H 1 66 TYR QD . . 4.850 4.628 3.880 4.788 . 0 0 "[ . 1 . 2]" 1 463 1 23 GLU H 1 66 TYR QE . . 4.630 4.507 3.595 4.631 0.001 10 0 "[ . 1 . 2]" 1 464 1 23 GLU H 1 67 ASP H . . 3.750 3.220 2.833 3.504 . 0 0 "[ . 1 . 2]" 1 465 1 23 GLU H 1 67 ASP HA . . 3.700 3.310 3.072 3.701 0.001 1 0 "[ . 1 . 2]" 1 466 1 23 GLU H 1 67 ASP HB2 . . 4.690 2.833 2.644 3.221 . 0 0 "[ . 1 . 2]" 1 467 1 23 GLU H 1 67 ASP HB3 . . 5.330 4.498 4.316 4.902 . 0 0 "[ . 1 . 2]" 1 468 1 23 GLU HA 1 23 GLU HG2 . . 4.130 3.329 2.885 3.834 . 0 0 "[ . 1 . 2]" 1 469 1 23 GLU HA 1 23 GLU QG . . 3.490 2.513 2.299 3.063 . 0 0 "[ . 1 . 2]" 1 470 1 23 GLU HA 1 23 GLU HG3 . . 4.130 2.614 2.341 3.220 . 0 0 "[ . 1 . 2]" 1 471 1 23 GLU HA 1 24 LEU H . . 2.580 2.156 2.140 2.185 . 0 0 "[ . 1 . 2]" 1 472 1 23 GLU HA 1 24 LEU HA . . 5.050 4.397 4.379 4.428 . 0 0 "[ . 1 . 2]" 1 473 1 23 GLU HA 1 24 LEU HB2 . . 4.630 4.274 4.148 4.407 . 0 0 "[ . 1 . 2]" 1 474 1 23 GLU HA 1 24 LEU HB3 . . 5.020 4.949 4.922 4.986 . 0 0 "[ . 1 . 2]" 1 475 1 23 GLU QB 1 67 ASP H . . 4.350 3.111 2.742 3.755 . 0 0 "[ . 1 . 2]" 1 476 1 23 GLU QB 1 67 ASP HA . . 4.120 3.025 2.576 3.758 . 0 0 "[ . 1 . 2]" 1 477 1 23 GLU HB2 1 24 LEU H . . 4.530 4.291 4.033 4.519 . 0 0 "[ . 1 . 2]" 1 478 1 23 GLU HB3 1 24 LEU H . . 4.530 4.293 4.084 4.491 . 0 0 "[ . 1 . 2]" 1 479 1 23 GLU QG 1 24 LEU H . . 3.680 2.947 2.443 3.386 . 0 0 "[ . 1 . 2]" 1 480 1 23 GLU QG 1 25 THR MG . . 3.340 2.134 1.949 2.334 . 0 0 "[ . 1 . 2]" 1 481 1 23 GLU HG2 1 24 LEU H . . 4.260 3.658 2.866 4.267 0.007 18 0 "[ . 1 . 2]" 1 482 1 23 GLU HG2 1 25 THR MG . . 4.130 2.279 1.965 2.926 . 0 0 "[ . 1 . 2]" 1 483 1 23 GLU HG3 1 24 LEU H . . 4.260 3.207 2.460 3.857 . 0 0 "[ . 1 . 2]" 1 484 1 23 GLU HG3 1 25 THR MG . . 4.130 2.861 2.140 3.427 . 0 0 "[ . 1 . 2]" 1 485 1 24 LEU H 1 24 LEU HB2 . . 3.090 2.560 2.371 2.680 . 0 0 "[ . 1 . 2]" 1 486 1 24 LEU H 1 24 LEU HB3 . . 3.160 2.840 2.807 2.905 . 0 0 "[ . 1 . 2]" 1 487 1 24 LEU H 1 24 LEU MD1 . . 4.150 4.063 3.885 4.134 . 0 0 "[ . 1 . 2]" 1 488 1 24 LEU H 1 24 LEU HG . . 4.780 4.578 4.523 4.614 . 0 0 "[ . 1 . 2]" 1 489 1 24 LEU H 1 25 THR H . . 4.490 4.231 4.107 4.391 . 0 0 "[ . 1 . 2]" 1 490 1 24 LEU H 1 66 TYR QD . . 4.890 4.534 4.244 4.793 . 0 0 "[ . 1 . 2]" 1 491 1 24 LEU HA 1 24 LEU MD1 . . 3.350 2.511 2.423 2.615 . 0 0 "[ . 1 . 2]" 1 492 1 24 LEU HA 1 24 LEU MD2 . . 3.910 3.798 3.783 3.814 . 0 0 "[ . 1 . 2]" 1 493 1 24 LEU HA 1 24 LEU HG . . 3.470 2.506 2.472 2.543 . 0 0 "[ . 1 . 2]" 1 494 1 24 LEU HA 1 25 THR H . . 2.680 2.155 2.138 2.179 . 0 0 "[ . 1 . 2]" 1 495 1 24 LEU HA 1 25 THR HA . . 4.620 4.395 4.391 4.402 . 0 0 "[ . 1 . 2]" 1 496 1 24 LEU HA 1 65 LYS H . . 4.940 4.274 4.103 4.669 . 0 0 "[ . 1 . 2]" 1 497 1 24 LEU HA 1 66 TYR H . . 5.500 4.965 4.836 5.181 . 0 0 "[ . 1 . 2]" 1 498 1 24 LEU HA 1 66 TYR HA . . 3.660 2.613 2.505 2.776 . 0 0 "[ . 1 . 2]" 1 499 1 24 LEU HA 1 66 TYR QD . . 4.060 3.365 2.931 3.489 . 0 0 "[ . 1 . 2]" 1 500 1 24 LEU HA 1 67 ASP H . . 4.300 3.802 3.629 4.002 . 0 0 "[ . 1 . 2]" 1 501 1 24 LEU HB2 1 24 LEU MD1 . . 3.240 2.092 2.027 2.143 . 0 0 "[ . 1 . 2]" 1 502 1 24 LEU HB2 1 24 LEU MD2 . . 3.050 2.646 2.575 2.710 . 0 0 "[ . 1 . 2]" 1 503 1 24 LEU HB2 1 25 THR H . . 4.620 4.539 4.475 4.584 . 0 0 "[ . 1 . 2]" 1 504 1 24 LEU HB2 1 40 ILE MD . . 4.590 4.346 4.071 4.550 . 0 0 "[ . 1 . 2]" 1 505 1 24 LEU HB2 1 40 ILE MG . . 4.570 4.176 3.578 4.369 . 0 0 "[ . 1 . 2]" 1 506 1 24 LEU HB2 1 48 ILE MD . . 5.250 4.918 4.535 5.175 . 0 0 "[ . 1 . 2]" 1 507 1 24 LEU HB2 1 64 ILE MG . . 5.500 4.824 4.596 4.982 . 0 0 "[ . 1 . 2]" 1 508 1 24 LEU HB2 1 66 TYR QD . . 4.410 3.083 2.909 3.341 . 0 0 "[ . 1 . 2]" 1 509 1 24 LEU HB3 1 24 LEU MD1 . . 3.130 3.119 3.107 3.134 0.004 11 0 "[ . 1 . 2]" 1 510 1 24 LEU HB3 1 24 LEU MD2 . . 3.130 2.054 1.967 2.184 . 0 0 "[ . 1 . 2]" 1 511 1 24 LEU HB3 1 25 THR H . . 4.280 4.157 4.052 4.242 . 0 0 "[ . 1 . 2]" 1 512 1 24 LEU HB3 1 40 ILE MD . . 3.200 2.931 2.589 3.185 . 0 0 "[ . 1 . 2]" 1 513 1 24 LEU HB3 1 40 ILE MG . . 3.350 3.105 2.556 3.322 . 0 0 "[ . 1 . 2]" 1 514 1 24 LEU HB3 1 48 ILE MD . . 5.050 4.758 4.365 5.038 . 0 0 "[ . 1 . 2]" 1 515 1 24 LEU HB3 1 64 ILE MG . . 5.370 4.384 4.055 4.557 . 0 0 "[ . 1 . 2]" 1 516 1 24 LEU HB3 1 66 TYR QD . . 4.930 4.657 4.529 4.861 . 0 0 "[ . 1 . 2]" 1 517 1 24 LEU MD1 1 25 THR H . . 4.310 3.989 3.829 4.087 . 0 0 "[ . 1 . 2]" 1 518 1 24 LEU MD1 1 48 ILE MG . . 3.150 2.918 2.267 3.118 . 0 0 "[ . 1 . 2]" 1 519 1 24 LEU MD1 1 66 TYR HA . . 3.930 2.787 2.647 3.329 . 0 0 "[ . 1 . 2]" 1 520 1 24 LEU MD1 1 66 TYR HB2 . . 3.700 2.074 1.961 2.462 . 0 0 "[ . 1 . 2]" 1 521 1 24 LEU MD1 1 66 TYR HB3 . . 4.060 3.630 3.524 3.939 . 0 0 "[ . 1 . 2]" 1 522 1 24 LEU MD1 1 66 TYR QD . . 3.450 1.842 1.771 1.971 . 0 0 "[ . 1 . 2]" 1 523 1 24 LEU MD1 1 66 TYR QE . . 4.020 3.350 3.181 3.437 . 0 0 "[ . 1 . 2]" 1 524 1 24 LEU MD1 1 67 ASP H . . 4.670 4.564 4.461 4.671 0.001 17 0 "[ . 1 . 2]" 1 525 1 24 LEU MD2 1 48 ILE HB . . 4.120 2.769 2.522 2.935 . 0 0 "[ . 1 . 2]" 1 526 1 24 LEU MD2 1 48 ILE MD . . 3.080 1.893 1.702 2.079 . 0 0 "[ . 1 . 2]" 1 527 1 24 LEU MD2 1 48 ILE MG . . 3.390 2.202 1.991 2.519 . 0 0 "[ . 1 . 2]" 1 528 1 24 LEU MD2 1 64 ILE MG . . 2.980 2.659 2.036 2.924 . 0 0 "[ . 1 . 2]" 1 529 1 24 LEU MD2 1 71 ILE MG . . 3.950 3.642 3.290 3.947 . 0 0 "[ . 1 . 2]" 1 530 1 24 LEU HG 1 25 THR H . . 3.660 3.320 3.070 3.525 . 0 0 "[ . 1 . 2]" 1 531 1 24 LEU HG 1 64 ILE MG . . 4.250 2.432 2.235 2.585 . 0 0 "[ . 1 . 2]" 1 532 1 24 LEU HG 1 66 TYR HA . . 4.940 4.264 4.065 4.424 . 0 0 "[ . 1 . 2]" 1 533 1 24 LEU HG 1 66 TYR QD . . 4.160 4.151 4.106 4.163 0.003 19 0 "[ . 1 . 2]" 1 534 1 25 THR H 1 25 THR HB . . 4.000 3.769 3.730 3.850 . 0 0 "[ . 1 . 2]" 1 535 1 25 THR H 1 25 THR MG . . 3.590 2.979 2.742 3.130 . 0 0 "[ . 1 . 2]" 1 536 1 25 THR H 1 26 GLY H . . 4.670 4.483 4.445 4.518 . 0 0 "[ . 1 . 2]" 1 537 1 25 THR H 1 40 ILE MD . . 4.290 3.998 3.595 4.173 . 0 0 "[ . 1 . 2]" 1 538 1 25 THR H 1 64 ILE MG . . 4.050 3.458 3.177 3.596 . 0 0 "[ . 1 . 2]" 1 539 1 25 THR H 1 65 LYS H . . 3.520 3.050 2.892 3.169 . 0 0 "[ . 1 . 2]" 1 540 1 25 THR H 1 65 LYS HA . . 4.990 4.903 4.804 4.981 . 0 0 "[ . 1 . 2]" 1 541 1 25 THR H 1 65 LYS HB2 . . 4.460 3.675 3.493 3.887 . 0 0 "[ . 1 . 2]" 1 542 1 25 THR H 1 65 LYS HB3 . . 4.710 4.167 3.992 4.372 . 0 0 "[ . 1 . 2]" 1 543 1 25 THR H 1 66 TYR HA . . 3.940 3.719 3.600 3.857 . 0 0 "[ . 1 . 2]" 1 544 1 25 THR H 1 66 TYR QD . . 5.390 5.305 4.822 5.390 . 0 0 "[ . 1 . 2]" 1 545 1 25 THR HA 1 25 THR MG . . 3.150 2.289 2.162 2.407 . 0 0 "[ . 1 . 2]" 1 546 1 25 THR HA 1 26 GLY H . . 2.880 2.420 2.326 2.544 . 0 0 "[ . 1 . 2]" 1 547 1 25 THR HA 1 40 ILE MD . . 3.900 2.893 2.341 3.142 . 0 0 "[ . 1 . 2]" 1 548 1 25 THR HB 1 26 GLY H . . 3.100 2.362 2.087 2.591 . 0 0 "[ . 1 . 2]" 1 549 1 25 THR HB 1 26 GLY HA3 . . 4.830 4.743 4.573 4.831 0.001 19 0 "[ . 1 . 2]" 1 550 1 25 THR MG 1 26 GLY H . . 3.870 3.584 3.423 3.713 . 0 0 "[ . 1 . 2]" 1 551 1 25 THR MG 1 65 LYS H . . 5.500 5.194 5.115 5.278 . 0 0 "[ . 1 . 2]" 1 552 1 26 GLY H 1 27 GLU H . . 4.440 4.397 4.382 4.409 . 0 0 "[ . 1 . 2]" 1 553 1 26 GLY H 1 37 ARG QG . . 4.510 3.776 3.502 3.984 . 0 0 "[ . 1 . 2]" 1 554 1 26 GLY H 1 38 PRO HD2 . . 4.430 4.123 3.948 4.259 . 0 0 "[ . 1 . 2]" 1 555 1 26 GLY H 1 38 PRO QG . . 4.530 3.820 3.619 4.027 . 0 0 "[ . 1 . 2]" 1 556 1 26 GLY H 1 40 ILE MD . . 3.750 3.377 3.131 3.600 . 0 0 "[ . 1 . 2]" 1 557 1 26 GLY H 1 64 ILE MD . . 4.720 3.995 3.845 4.263 . 0 0 "[ . 1 . 2]" 1 558 1 26 GLY H 1 65 LYS H . . 4.950 4.861 4.593 4.948 . 0 0 "[ . 1 . 2]" 1 559 1 26 GLY HA2 1 27 GLU H . . 2.980 2.509 2.434 2.581 . 0 0 "[ . 1 . 2]" 1 560 1 26 GLY HA2 1 38 PRO HD2 . . 5.100 4.879 4.667 4.986 . 0 0 "[ . 1 . 2]" 1 561 1 26 GLY HA2 1 38 PRO QG . . 4.460 4.096 3.971 4.204 . 0 0 "[ . 1 . 2]" 1 562 1 26 GLY HA2 1 40 ILE MD . . 4.290 4.236 4.036 4.291 0.001 8 0 "[ . 1 . 2]" 1 563 1 26 GLY HA2 1 63 GLY H . . 4.760 4.602 4.404 4.702 . 0 0 "[ . 1 . 2]" 1 564 1 26 GLY HA2 1 64 ILE HA . . 4.060 2.243 2.096 2.385 . 0 0 "[ . 1 . 2]" 1 565 1 26 GLY HA2 1 64 ILE MD . . 4.150 2.762 2.597 2.886 . 0 0 "[ . 1 . 2]" 1 566 1 26 GLY HA2 1 64 ILE MG . . 4.400 3.614 3.437 3.828 . 0 0 "[ . 1 . 2]" 1 567 1 26 GLY HA2 1 65 LYS H . . 3.840 3.522 3.144 3.641 . 0 0 "[ . 1 . 2]" 1 568 1 26 GLY HA3 1 27 GLU H . . 3.180 2.620 2.547 2.700 . 0 0 "[ . 1 . 2]" 1 569 1 26 GLY HA3 1 38 PRO QG . . 3.900 2.809 2.656 2.919 . 0 0 "[ . 1 . 2]" 1 570 1 26 GLY HA3 1 40 ILE MD . . 3.620 3.118 2.953 3.199 . 0 0 "[ . 1 . 2]" 1 571 1 26 GLY HA3 1 64 ILE HA . . 4.130 2.787 2.666 2.921 . 0 0 "[ . 1 . 2]" 1 572 1 26 GLY HA3 1 64 ILE MD . . 3.870 1.939 1.857 2.125 . 0 0 "[ . 1 . 2]" 1 573 1 26 GLY HA3 1 64 ILE QG . . 4.960 4.020 3.874 4.217 . 0 0 "[ . 1 . 2]" 1 574 1 26 GLY HA3 1 64 ILE MG . . 4.590 3.400 3.127 3.631 . 0 0 "[ . 1 . 2]" 1 575 1 26 GLY HA3 1 65 LYS H . . 4.360 4.259 4.041 4.363 0.003 10 0 "[ . 1 . 2]" 1 576 1 27 GLU H 1 27 GLU QB . . 3.260 2.741 2.667 2.794 . 0 0 "[ . 1 . 2]" 1 577 1 27 GLU H 1 27 GLU HG2 . . 4.390 4.330 4.258 4.378 . 0 0 "[ . 1 . 2]" 1 578 1 27 GLU H 1 28 VAL H . . 4.460 4.318 4.250 4.394 . 0 0 "[ . 1 . 2]" 1 579 1 27 GLU H 1 28 VAL HA . . 4.890 4.652 4.591 4.733 . 0 0 "[ . 1 . 2]" 1 580 1 27 GLU H 1 38 PRO HD2 . . 4.320 3.861 3.642 4.041 . 0 0 "[ . 1 . 2]" 1 581 1 27 GLU H 1 38 PRO HD3 . . 4.220 3.980 3.773 4.164 . 0 0 "[ . 1 . 2]" 1 582 1 27 GLU H 1 38 PRO QG . . 4.030 3.056 2.865 3.273 . 0 0 "[ . 1 . 2]" 1 583 1 27 GLU H 1 62 MET HA . . 4.270 4.077 3.936 4.200 . 0 0 "[ . 1 . 2]" 1 584 1 27 GLU H 1 62 MET HG2 . . 4.640 4.500 4.222 4.640 0.000 20 0 "[ . 1 . 2]" 1 585 1 27 GLU H 1 62 MET HG3 . . 4.470 3.642 3.353 3.972 . 0 0 "[ . 1 . 2]" 1 586 1 27 GLU H 1 63 GLY H . . 3.550 2.741 2.509 2.873 . 0 0 "[ . 1 . 2]" 1 587 1 27 GLU H 1 63 GLY HA3 . . 4.270 4.156 4.005 4.242 . 0 0 "[ . 1 . 2]" 1 588 1 27 GLU H 1 64 ILE HA . . 3.980 3.824 3.693 3.921 . 0 0 "[ . 1 . 2]" 1 589 1 27 GLU H 1 64 ILE MD . . 4.380 2.949 2.791 3.296 . 0 0 "[ . 1 . 2]" 1 590 1 27 GLU H 1 64 ILE MG . . 5.430 5.174 4.979 5.349 . 0 0 "[ . 1 . 2]" 1 591 1 27 GLU HA 1 27 GLU HG2 . . 3.870 3.377 3.300 3.477 . 0 0 "[ . 1 . 2]" 1 592 1 27 GLU HA 1 27 GLU HG3 . . 4.110 2.687 2.618 2.788 . 0 0 "[ . 1 . 2]" 1 593 1 27 GLU HA 1 28 VAL H . . 2.990 2.269 2.207 2.351 . 0 0 "[ . 1 . 2]" 1 594 1 27 GLU HA 1 28 VAL HB . . 4.830 4.555 4.444 4.694 . 0 0 "[ . 1 . 2]" 1 595 1 27 GLU HA 1 28 VAL MG2 . . 4.100 3.561 3.340 3.668 . 0 0 "[ . 1 . 2]" 1 596 1 27 GLU HA 1 37 ARG HB3 . . 5.500 5.359 5.143 5.490 . 0 0 "[ . 1 . 2]" 1 597 1 27 GLU HA 1 37 ARG HG2 . . 4.220 3.908 3.673 4.160 . 0 0 "[ . 1 . 2]" 1 598 1 27 GLU HA 1 37 ARG HG3 . . 4.220 3.687 3.443 3.929 . 0 0 "[ . 1 . 2]" 1 599 1 27 GLU HA 1 38 PRO HD2 . . 4.300 2.052 2.006 2.107 . 0 0 "[ . 1 . 2]" 1 600 1 27 GLU HA 1 38 PRO HD3 . . 4.120 2.122 2.027 2.252 . 0 0 "[ . 1 . 2]" 1 601 1 27 GLU HA 1 38 PRO QG . . 5.050 3.097 3.031 3.311 . 0 0 "[ . 1 . 2]" 1 602 1 27 GLU QB 1 28 VAL H . . 4.350 3.483 3.358 3.588 . 0 0 "[ . 1 . 2]" 1 603 1 27 GLU QB 1 38 PRO HD2 . . 4.330 3.829 3.738 3.941 . 0 0 "[ . 1 . 2]" 1 604 1 27 GLU QB 1 38 PRO HD3 . . 4.940 4.159 4.073 4.270 . 0 0 "[ . 1 . 2]" 1 605 1 27 GLU HG2 1 28 VAL H . . 4.020 2.814 2.517 3.126 . 0 0 "[ . 1 . 2]" 1 606 1 27 GLU HG2 1 35 THR HB . . 3.750 3.575 3.301 3.742 . 0 0 "[ . 1 . 2]" 1 607 1 27 GLU HG2 1 35 THR MG . . 4.000 3.876 3.620 3.999 . 0 0 "[ . 1 . 2]" 1 608 1 27 GLU HG2 1 36 ALA H . . 4.700 4.621 4.408 4.701 0.001 10 0 "[ . 1 . 2]" 1 609 1 27 GLU HG3 1 28 VAL H . . 3.450 2.293 1.932 2.524 . 0 0 "[ . 1 . 2]" 1 610 1 27 GLU HG3 1 35 THR HB . . 3.690 3.027 2.850 3.203 . 0 0 "[ . 1 . 2]" 1 611 1 27 GLU HG3 1 35 THR MG . . 4.260 4.119 3.891 4.261 0.001 17 0 "[ . 1 . 2]" 1 612 1 27 GLU HG3 1 36 ALA H . . 4.090 3.857 3.668 3.984 . 0 0 "[ . 1 . 2]" 1 613 1 27 GLU HG3 1 38 PRO HD3 . . 5.380 4.071 3.923 4.302 . 0 0 "[ . 1 . 2]" 1 614 1 28 VAL H 1 28 VAL HB . . 3.250 2.630 2.512 2.732 . 0 0 "[ . 1 . 2]" 1 615 1 28 VAL H 1 28 VAL MG1 . . 4.150 3.838 3.776 3.891 . 0 0 "[ . 1 . 2]" 1 616 1 28 VAL H 1 28 VAL MG2 . . 3.660 2.845 2.620 3.072 . 0 0 "[ . 1 . 2]" 1 617 1 28 VAL H 1 29 ARG H . . 4.700 4.460 4.374 4.515 . 0 0 "[ . 1 . 2]" 1 618 1 28 VAL H 1 35 THR HA . . 5.020 4.930 4.799 5.017 . 0 0 "[ . 1 . 2]" 1 619 1 28 VAL H 1 35 THR HB . . 4.250 4.160 3.796 4.252 0.002 18 0 "[ . 1 . 2]" 1 620 1 28 VAL H 1 36 ALA H . . 3.460 3.266 3.138 3.348 . 0 0 "[ . 1 . 2]" 1 621 1 28 VAL H 1 37 ARG HA . . 3.960 3.143 2.953 3.339 . 0 0 "[ . 1 . 2]" 1 622 1 28 VAL H 1 38 PRO HD2 . . 4.400 3.570 3.355 3.741 . 0 0 "[ . 1 . 2]" 1 623 1 28 VAL H 1 38 PRO HD3 . . 4.160 2.342 2.066 2.592 . 0 0 "[ . 1 . 2]" 1 624 1 28 VAL H 1 38 PRO QG . . 4.800 3.932 3.711 4.131 . 0 0 "[ . 1 . 2]" 1 625 1 28 VAL H 1 62 MET HA . . 5.280 4.929 4.810 5.049 . 0 0 "[ . 1 . 2]" 1 626 1 28 VAL HA 1 28 VAL MG1 . . 3.540 2.356 2.267 2.502 . 0 0 "[ . 1 . 2]" 1 627 1 28 VAL HA 1 28 VAL MG2 . . 3.500 2.318 2.217 2.472 . 0 0 "[ . 1 . 2]" 1 628 1 28 VAL HA 1 29 ARG H . . 3.000 2.233 2.185 2.295 . 0 0 "[ . 1 . 2]" 1 629 1 28 VAL HA 1 36 ALA H . . 4.950 4.805 4.709 4.901 . 0 0 "[ . 1 . 2]" 1 630 1 28 VAL HA 1 62 MET HA . . 3.760 2.595 2.475 2.733 . 0 0 "[ . 1 . 2]" 1 631 1 28 VAL HA 1 62 MET HG3 . . 4.840 4.216 3.922 4.388 . 0 0 "[ . 1 . 2]" 1 632 1 28 VAL HA 1 63 GLY H . . 3.930 3.894 3.758 3.932 0.002 11 0 "[ . 1 . 2]" 1 633 1 28 VAL HB 1 29 ARG H . . 4.270 3.952 3.732 4.124 . 0 0 "[ . 1 . 2]" 1 634 1 28 VAL HB 1 35 THR HA . . 5.500 4.896 4.732 5.046 . 0 0 "[ . 1 . 2]" 1 635 1 28 VAL HB 1 36 ALA H . . 3.370 3.147 2.913 3.281 . 0 0 "[ . 1 . 2]" 1 636 1 28 VAL MG1 1 29 ARG H . . 3.420 2.046 1.879 2.298 . 0 0 "[ . 1 . 2]" 1 637 1 28 VAL MG1 1 29 ARG HA . . 3.760 3.584 3.303 3.744 . 0 0 "[ . 1 . 2]" 1 638 1 28 VAL MG1 1 30 MET H . . 4.590 3.864 3.416 4.253 . 0 0 "[ . 1 . 2]" 1 639 1 28 VAL MG1 1 30 MET HA . . 4.760 3.938 3.746 4.128 . 0 0 "[ . 1 . 2]" 1 640 1 28 VAL MG1 1 30 MET ME . . 4.590 4.023 3.533 4.463 . 0 0 "[ . 1 . 2]" 1 641 1 28 VAL MG1 1 36 ALA H . . 4.480 3.743 3.433 4.208 . 0 0 "[ . 1 . 2]" 1 642 1 28 VAL MG1 1 36 ALA MB . . 4.140 3.621 3.366 3.977 . 0 0 "[ . 1 . 2]" 1 643 1 28 VAL MG1 1 52 TYR QD . . 5.050 3.441 3.179 3.647 . 0 0 "[ . 1 . 2]" 1 644 1 28 VAL MG1 1 52 TYR QE . . 3.850 2.747 2.597 2.906 . 0 0 "[ . 1 . 2]" 1 645 1 28 VAL MG1 1 60 HIS HB2 . . 4.670 3.577 3.307 3.835 . 0 0 "[ . 1 . 2]" 1 646 1 28 VAL MG1 1 60 HIS QB . . 3.830 2.372 2.143 2.550 . 0 0 "[ . 1 . 2]" 1 647 1 28 VAL MG1 1 60 HIS HB3 . . 4.670 2.408 2.165 2.593 . 0 0 "[ . 1 . 2]" 1 648 1 28 VAL MG1 1 60 HIS HD2 . . 3.090 2.572 2.300 2.873 . 0 0 "[ . 1 . 2]" 1 649 1 28 VAL MG1 1 61 GLN H . . 4.230 3.418 3.191 3.631 . 0 0 "[ . 1 . 2]" 1 650 1 28 VAL MG1 1 62 MET HA . . 4.530 3.916 3.665 4.175 . 0 0 "[ . 1 . 2]" 1 651 1 28 VAL MG1 1 78 PHE QE . . 4.360 3.200 2.651 3.720 . 0 0 "[ . 1 . 2]" 1 652 1 28 VAL MG1 1 78 PHE HZ . . 3.210 2.361 1.932 3.092 . 0 0 "[ . 1 . 2]" 1 653 1 28 VAL MG2 1 29 ARG H . . 4.120 3.857 3.697 4.043 . 0 0 "[ . 1 . 2]" 1 654 1 28 VAL MG2 1 36 ALA H . . 4.680 4.574 4.402 4.683 0.003 10 0 "[ . 1 . 2]" 1 655 1 28 VAL MG2 1 36 ALA MB . . 4.270 3.938 3.720 4.093 . 0 0 "[ . 1 . 2]" 1 656 1 28 VAL MG2 1 38 PRO HA . . 4.060 3.229 3.086 3.564 . 0 0 "[ . 1 . 2]" 1 657 1 28 VAL MG2 1 38 PRO HB2 . . 4.110 3.471 3.344 3.602 . 0 0 "[ . 1 . 2]" 1 658 1 28 VAL MG2 1 38 PRO HB3 . . 3.510 2.048 1.937 2.224 . 0 0 "[ . 1 . 2]" 1 659 1 28 VAL MG2 1 38 PRO HD2 . . 4.110 3.595 3.393 3.804 . 0 0 "[ . 1 . 2]" 1 660 1 28 VAL MG2 1 38 PRO HD3 . . 3.640 2.136 1.975 2.429 . 0 0 "[ . 1 . 2]" 1 661 1 28 VAL MG2 1 38 PRO QG . . 3.930 2.356 2.078 2.508 . 0 0 "[ . 1 . 2]" 1 662 1 28 VAL MG2 1 39 ASN H . . 5.500 4.660 4.509 4.852 . 0 0 "[ . 1 . 2]" 1 663 1 28 VAL MG2 1 52 TYR HB2 . . 4.420 2.998 2.718 3.111 . 0 0 "[ . 1 . 2]" 1 664 1 28 VAL MG2 1 52 TYR HB3 . . 4.900 3.783 3.524 3.952 . 0 0 "[ . 1 . 2]" 1 665 1 28 VAL MG2 1 52 TYR QD . . 4.420 2.883 2.576 3.123 . 0 0 "[ . 1 . 2]" 1 666 1 28 VAL MG2 1 52 TYR QE . . 4.290 3.352 3.106 3.689 . 0 0 "[ . 1 . 2]" 1 667 1 28 VAL MG2 1 62 MET HA . . 4.060 3.095 2.860 3.300 . 0 0 "[ . 1 . 2]" 1 668 1 28 VAL MG2 1 62 MET HB2 . . 4.620 2.821 2.441 3.053 . 0 0 "[ . 1 . 2]" 1 669 1 28 VAL MG2 1 62 MET QB . . 3.960 2.784 2.421 3.004 . 0 0 "[ . 1 . 2]" 1 670 1 28 VAL MG2 1 62 MET HB3 . . 4.620 4.298 4.016 4.477 . 0 0 "[ . 1 . 2]" 1 671 1 28 VAL MG2 1 62 MET ME . . 3.170 2.159 1.821 2.589 . 0 0 "[ . 1 . 2]" 1 672 1 28 VAL MG2 1 62 MET HG2 . . 4.550 4.356 4.170 4.518 . 0 0 "[ . 1 . 2]" 1 673 1 28 VAL MG2 1 62 MET HG3 . . 3.640 2.914 2.674 3.101 . 0 0 "[ . 1 . 2]" 1 674 1 28 VAL MG2 1 78 PHE QE . . 4.140 3.573 3.265 3.833 . 0 0 "[ . 1 . 2]" 1 675 1 28 VAL MG2 1 78 PHE HZ . . 4.280 3.043 2.667 3.557 . 0 0 "[ . 1 . 2]" 1 676 1 29 ARG H 1 29 ARG HB2 . . 3.580 3.078 2.703 3.374 . 0 0 "[ . 1 . 2]" 1 677 1 29 ARG H 1 29 ARG HB3 . . 3.580 2.681 2.419 2.966 . 0 0 "[ . 1 . 2]" 1 678 1 29 ARG H 1 29 ARG QG . . 4.660 4.054 3.826 4.272 . 0 0 "[ . 1 . 2]" 1 679 1 29 ARG H 1 30 MET H . . 4.690 4.233 4.101 4.408 . 0 0 "[ . 1 . 2]" 1 680 1 29 ARG H 1 61 GLN H . . 3.720 2.678 2.449 2.899 . 0 0 "[ . 1 . 2]" 1 681 1 29 ARG H 1 61 GLN HB2 . . 4.770 4.623 4.309 4.764 . 0 0 "[ . 1 . 2]" 1 682 1 29 ARG H 1 61 GLN HB3 . . 3.840 3.524 3.198 3.747 . 0 0 "[ . 1 . 2]" 1 683 1 29 ARG H 1 62 MET HA . . 4.050 3.979 3.806 4.053 0.003 8 0 "[ . 1 . 2]" 1 684 1 29 ARG HA 1 29 ARG QD . . 3.050 2.350 2.017 2.806 . 0 0 "[ . 1 . 2]" 1 685 1 29 ARG HA 1 29 ARG QG . . 3.800 2.814 2.262 3.209 . 0 0 "[ . 1 . 2]" 1 686 1 29 ARG HA 1 30 MET H . . 2.900 2.146 2.141 2.170 . 0 0 "[ . 1 . 2]" 1 687 1 29 ARG HA 1 30 MET HA . . 4.560 4.394 4.382 4.411 . 0 0 "[ . 1 . 2]" 1 688 1 29 ARG HA 1 35 THR HA . . 3.550 2.485 2.317 2.604 . 0 0 "[ . 1 . 2]" 1 689 1 29 ARG HA 1 35 THR HB . . 3.810 3.670 3.426 3.799 . 0 0 "[ . 1 . 2]" 1 690 1 29 ARG HA 1 35 THR MG . . 2.880 2.616 2.348 2.830 . 0 0 "[ . 1 . 2]" 1 691 1 29 ARG HA 1 36 ALA H . . 3.710 3.602 3.468 3.688 . 0 0 "[ . 1 . 2]" 1 692 1 29 ARG QB 1 29 ARG QD . . 2.970 2.433 2.195 2.773 . 0 0 "[ . 1 . 2]" 1 693 1 29 ARG QB 1 30 MET H . . 4.140 3.810 3.650 3.894 . 0 0 "[ . 1 . 2]" 1 694 1 29 ARG QB 1 35 THR MG . . 3.930 2.940 2.322 3.513 . 0 0 "[ . 1 . 2]" 1 695 1 29 ARG QB 1 61 GLN H . . 3.790 2.788 2.454 3.200 . 0 0 "[ . 1 . 2]" 1 696 1 29 ARG QB 1 61 GLN HB2 . . 3.950 3.233 2.979 3.559 . 0 0 "[ . 1 . 2]" 1 697 1 29 ARG QB 1 61 GLN HB3 . . 3.430 2.301 2.042 2.939 . 0 0 "[ . 1 . 2]" 1 698 1 29 ARG HB2 1 29 ARG QD . . 3.790 2.829 2.229 3.479 . 0 0 "[ . 1 . 2]" 1 699 1 29 ARG HB2 1 35 THR MG . . 4.550 3.010 2.340 3.686 . 0 0 "[ . 1 . 2]" 1 700 1 29 ARG HB2 1 61 GLN H . . 4.420 4.270 3.624 4.417 . 0 0 "[ . 1 . 2]" 1 701 1 29 ARG HB2 1 61 GLN HB3 . . 3.950 3.328 2.623 3.647 . 0 0 "[ . 1 . 2]" 1 702 1 29 ARG HB3 1 29 ARG QD . . 3.790 3.031 2.341 3.486 . 0 0 "[ . 1 . 2]" 1 703 1 29 ARG HB3 1 35 THR MG . . 4.550 4.228 3.883 4.443 . 0 0 "[ . 1 . 2]" 1 704 1 29 ARG HB3 1 61 GLN H . . 4.420 2.832 2.496 3.311 . 0 0 "[ . 1 . 2]" 1 705 1 29 ARG HB3 1 61 GLN HB3 . . 3.950 2.381 2.055 3.203 . 0 0 "[ . 1 . 2]" 1 706 1 29 ARG QD 1 30 MET H . . 4.530 2.393 1.887 2.935 . 0 0 "[ . 1 . 2]" 1 707 1 29 ARG QD 1 30 MET ME . . 4.670 4.502 3.962 4.662 . 0 0 "[ . 1 . 2]" 1 708 1 29 ARG QD 1 30 MET QG . . 4.080 3.326 3.008 3.661 . 0 0 "[ . 1 . 2]" 1 709 1 29 ARG QD 1 35 THR MG . . 3.850 2.346 1.798 3.169 . 0 0 "[ . 1 . 2]" 1 710 1 29 ARG QG 1 30 MET H . . 3.790 3.473 2.899 3.757 . 0 0 "[ . 1 . 2]" 1 711 1 29 ARG QG 1 35 THR HA . . 5.500 4.469 3.261 5.150 . 0 0 "[ . 1 . 2]" 1 712 1 29 ARG QG 1 35 THR MG . . 3.720 2.957 1.838 3.710 . 0 0 "[ . 1 . 2]" 1 713 1 29 ARG QG 1 61 GLN H . . 5.500 4.174 3.292 5.253 . 0 0 "[ . 1 . 2]" 1 714 1 30 MET H 1 30 MET HB2 . . 3.750 3.655 3.626 3.720 . 0 0 "[ . 1 . 2]" 1 715 1 30 MET H 1 30 MET HB3 . . 3.570 2.691 2.550 2.883 . 0 0 "[ . 1 . 2]" 1 716 1 30 MET H 1 30 MET ME . . 3.790 2.995 2.737 3.246 . 0 0 "[ . 1 . 2]" 1 717 1 30 MET H 1 30 MET QG . . 3.240 2.067 1.890 2.217 . 0 0 "[ . 1 . 2]" 1 718 1 30 MET H 1 31 PRO HD2 . . 4.990 4.809 4.798 4.820 . 0 0 "[ . 1 . 2]" 1 719 1 30 MET H 1 34 LYS H . . 3.780 3.760 3.679 3.791 0.011 6 0 "[ . 1 . 2]" 1 720 1 30 MET H 1 35 THR HA . . 3.970 2.929 2.816 3.122 . 0 0 "[ . 1 . 2]" 1 721 1 30 MET H 1 35 THR HB . . 5.210 5.076 4.858 5.193 . 0 0 "[ . 1 . 2]" 1 722 1 30 MET H 1 35 THR MG . . 4.160 3.551 3.346 3.760 . 0 0 "[ . 1 . 2]" 1 723 1 30 MET H 1 36 ALA H . . 4.970 4.303 4.076 4.712 . 0 0 "[ . 1 . 2]" 1 724 1 30 MET HA 1 30 MET ME . . 4.460 4.366 4.173 4.450 . 0 0 "[ . 1 . 2]" 1 725 1 30 MET HA 1 30 MET QG . . 3.590 3.334 3.323 3.338 . 0 0 "[ . 1 . 2]" 1 726 1 30 MET HA 1 31 PRO HD2 . . 3.710 2.361 2.335 2.388 . 0 0 "[ . 1 . 2]" 1 727 1 30 MET HA 1 31 PRO HD3 . . 3.330 2.286 2.278 2.295 . 0 0 "[ . 1 . 2]" 1 728 1 30 MET HA 1 31 PRO HG2 . . 4.540 4.481 4.460 4.502 . 0 0 "[ . 1 . 2]" 1 729 1 30 MET HA 1 31 PRO HG3 . . 4.590 4.449 4.435 4.465 . 0 0 "[ . 1 . 2]" 1 730 1 30 MET HA 1 60 HIS HA . . 4.430 3.571 3.372 3.751 . 0 0 "[ . 1 . 2]" 1 731 1 30 MET HA 1 60 HIS HD2 . . 4.250 2.238 2.012 2.595 . 0 0 "[ . 1 . 2]" 1 732 1 30 MET HA 1 61 GLN H . . 4.690 4.535 4.330 4.691 0.001 19 0 "[ . 1 . 2]" 1 733 1 30 MET HB2 1 30 MET ME . . 3.700 3.478 3.270 3.656 . 0 0 "[ . 1 . 2]" 1 734 1 30 MET HB2 1 31 PRO HD3 . . 5.500 3.479 3.427 3.544 . 0 0 "[ . 1 . 2]" 1 735 1 30 MET HB2 1 31 PRO HG2 . . 5.450 3.906 3.839 3.971 . 0 0 "[ . 1 . 2]" 1 736 1 30 MET HB2 1 32 SER H . . 4.810 2.692 2.567 2.808 . 0 0 "[ . 1 . 2]" 1 737 1 30 MET HB2 1 34 LYS H . . 4.950 4.649 4.570 4.777 . 0 0 "[ . 1 . 2]" 1 738 1 30 MET HB2 1 60 HIS HD2 . . 4.500 3.546 3.117 3.877 . 0 0 "[ . 1 . 2]" 1 739 1 30 MET HB3 1 30 MET ME . . 3.470 2.376 2.203 2.532 . 0 0 "[ . 1 . 2]" 1 740 1 30 MET HB3 1 32 SER H . . 4.270 4.161 4.099 4.241 . 0 0 "[ . 1 . 2]" 1 741 1 30 MET HB3 1 33 GLY H . . 5.310 5.030 4.936 5.115 . 0 0 "[ . 1 . 2]" 1 742 1 30 MET HB3 1 34 LYS H . . 4.850 4.722 4.591 4.849 . 0 0 "[ . 1 . 2]" 1 743 1 30 MET HB3 1 35 THR HA . . 4.910 4.663 4.449 4.833 . 0 0 "[ . 1 . 2]" 1 744 1 30 MET HB3 1 60 HIS HD2 . . 4.840 2.842 2.585 3.141 . 0 0 "[ . 1 . 2]" 1 745 1 30 MET ME 1 30 MET QG . . 3.400 2.214 2.137 2.309 . 0 0 "[ . 1 . 2]" 1 746 1 30 MET ME 1 33 GLY H . . 4.950 4.783 4.582 4.930 . 0 0 "[ . 1 . 2]" 1 747 1 30 MET ME 1 34 LYS H . . 4.290 3.775 3.546 4.017 . 0 0 "[ . 1 . 2]" 1 748 1 30 MET ME 1 34 LYS HB2 . . 3.600 2.299 2.004 2.566 . 0 0 "[ . 1 . 2]" 1 749 1 30 MET ME 1 35 THR H . . 4.410 3.344 2.910 3.599 . 0 0 "[ . 1 . 2]" 1 750 1 30 MET ME 1 35 THR HA . . 3.860 2.914 2.217 3.097 . 0 0 "[ . 1 . 2]" 1 751 1 30 MET ME 1 36 ALA H . . 3.670 3.455 3.099 3.616 . 0 0 "[ . 1 . 2]" 1 752 1 30 MET ME 1 36 ALA MB . . 2.810 2.498 2.206 2.730 . 0 0 "[ . 1 . 2]" 1 753 1 30 MET ME 1 52 TYR QE . . 4.460 4.292 4.011 4.448 . 0 0 "[ . 1 . 2]" 1 754 1 30 MET ME 1 55 THR H . . 4.940 4.279 3.847 4.839 . 0 0 "[ . 1 . 2]" 1 755 1 30 MET QG 1 31 PRO HA . . 4.700 4.511 4.381 4.667 . 0 0 "[ . 1 . 2]" 1 756 1 30 MET QG 1 31 PRO HD2 . . 3.880 3.622 3.498 3.768 . 0 0 "[ . 1 . 2]" 1 757 1 30 MET QG 1 31 PRO HD3 . . 4.770 4.607 4.513 4.704 . 0 0 "[ . 1 . 2]" 1 758 1 30 MET QG 1 32 SER H . . 3.580 2.125 1.926 2.357 . 0 0 "[ . 1 . 2]" 1 759 1 30 MET QG 1 32 SER HA . . 4.620 4.130 3.962 4.281 . 0 0 "[ . 1 . 2]" 1 760 1 30 MET QG 1 32 SER QB . . 4.100 2.080 1.974 2.680 . 0 0 "[ . 1 . 2]" 1 761 1 30 MET QG 1 33 GLY H . . 3.880 2.162 2.086 2.309 . 0 0 "[ . 1 . 2]" 1 762 1 30 MET QG 1 34 LYS H . . 3.180 2.078 2.006 2.163 . 0 0 "[ . 1 . 2]" 1 763 1 30 MET QG 1 34 LYS HA . . 4.170 4.087 4.005 4.159 . 0 0 "[ . 1 . 2]" 1 764 1 30 MET QG 1 35 THR MG . . 5.110 4.126 3.995 4.333 . 0 0 "[ . 1 . 2]" 1 765 1 31 PRO HA 1 33 GLY H . . 4.370 4.129 4.017 4.260 . 0 0 "[ . 1 . 2]" 1 766 1 31 PRO QB 1 32 SER H . . 3.800 3.548 3.451 3.631 . 0 0 "[ . 1 . 2]" 1 767 1 31 PRO HB2 1 32 SER H . . 4.670 3.750 3.630 3.853 . 0 0 "[ . 1 . 2]" 1 768 1 31 PRO HB2 1 58 GLY HA3 . . 5.020 4.434 4.177 4.615 . 0 0 "[ . 1 . 2]" 1 769 1 31 PRO HB3 1 32 SER H . . 4.670 4.382 4.313 4.441 . 0 0 "[ . 1 . 2]" 1 770 1 31 PRO HB3 1 58 GLY HA3 . . 5.020 4.088 3.825 4.405 . 0 0 "[ . 1 . 2]" 1 771 1 31 PRO HD2 1 32 SER H . . 4.170 2.806 2.723 2.894 . 0 0 "[ . 1 . 2]" 1 772 1 31 PRO HD2 1 56 GLU HB2 . . 4.720 3.939 3.352 4.713 . 0 0 "[ . 1 . 2]" 1 773 1 31 PRO HD2 1 56 GLU QB . . 3.990 3.395 3.028 3.756 . 0 0 "[ . 1 . 2]" 1 774 1 31 PRO HD2 1 56 GLU HB3 . . 4.720 3.943 3.078 4.494 . 0 0 "[ . 1 . 2]" 1 775 1 31 PRO HD2 1 60 HIS HE1 . . 4.980 3.526 3.184 3.808 . 0 0 "[ . 1 . 2]" 1 776 1 31 PRO HD3 1 58 GLY HA3 . . 4.440 4.194 3.899 4.442 0.002 17 0 "[ . 1 . 2]" 1 777 1 31 PRO HD3 1 60 HIS HA . . 4.610 3.325 3.055 3.627 . 0 0 "[ . 1 . 2]" 1 778 1 31 PRO HD3 1 60 HIS HE1 . . 4.570 3.671 3.297 4.004 . 0 0 "[ . 1 . 2]" 1 779 1 31 PRO HG2 1 32 SER H . . 4.130 2.968 2.777 3.141 . 0 0 "[ . 1 . 2]" 1 780 1 31 PRO HG2 1 32 SER HA . . 4.390 4.231 4.156 4.307 . 0 0 "[ . 1 . 2]" 1 781 1 31 PRO HG2 1 56 GLU QB . . 3.590 3.332 3.039 3.592 0.002 11 0 "[ . 1 . 2]" 1 782 1 31 PRO HG2 1 58 GLY HA2 . . 5.500 5.474 5.355 5.502 0.002 4 0 "[ . 1 . 2]" 1 783 1 31 PRO HG2 1 58 GLY HA3 . . 4.180 3.735 3.621 3.766 . 0 0 "[ . 1 . 2]" 1 784 1 31 PRO HG3 1 32 SER H . . 4.470 4.329 4.185 4.461 . 0 0 "[ . 1 . 2]" 1 785 1 31 PRO HG3 1 56 GLU QB . . 4.620 4.316 4.027 4.529 . 0 0 "[ . 1 . 2]" 1 786 1 31 PRO HG3 1 58 GLY HA2 . . 4.340 4.097 3.910 4.194 . 0 0 "[ . 1 . 2]" 1 787 1 31 PRO HG3 1 58 GLY HA3 . . 3.850 2.375 2.183 2.495 . 0 0 "[ . 1 . 2]" 1 788 1 31 PRO HG3 1 59 LEU H . . 4.230 3.688 3.460 4.009 . 0 0 "[ . 1 . 2]" 1 789 1 32 SER H 1 32 SER HB2 . . 3.580 2.553 2.186 3.556 . 0 0 "[ . 1 . 2]" 1 790 1 32 SER H 1 32 SER QB . . 2.960 2.234 2.165 2.320 . 0 0 "[ . 1 . 2]" 1 791 1 32 SER H 1 32 SER HB3 . . 3.580 2.859 2.271 3.571 . 0 0 "[ . 1 . 2]" 1 792 1 32 SER H 1 33 GLY H . . 3.380 2.611 2.497 2.718 . 0 0 "[ . 1 . 2]" 1 793 1 32 SER H 1 34 LYS H . . 4.250 3.934 3.773 4.060 . 0 0 "[ . 1 . 2]" 1 794 1 32 SER H 1 56 GLU QB . . 4.810 4.091 3.711 4.479 . 0 0 "[ . 1 . 2]" 1 795 1 32 SER QB 1 33 GLY H . . 3.630 2.738 2.523 3.402 . 0 0 "[ . 1 . 2]" 1 796 1 32 SER QB 1 34 LYS H . . 4.000 3.421 3.172 4.014 0.014 2 0 "[ . 1 . 2]" 1 797 1 32 SER HB2 1 33 GLY H . . 4.440 3.536 2.704 4.070 . 0 0 "[ . 1 . 2]" 1 798 1 32 SER HB3 1 33 GLY H . . 4.440 3.053 2.566 3.654 . 0 0 "[ . 1 . 2]" 1 799 1 33 GLY H 1 34 LYS H . . 3.150 1.818 1.798 1.845 . 0 0 "[ . 1 . 2]" 1 800 1 33 GLY H 1 34 LYS HA . . 4.610 4.589 4.567 4.611 0.001 17 0 "[ . 1 . 2]" 1 801 1 33 GLY H 1 34 LYS HG3 . . 4.190 3.919 3.527 4.191 0.001 6 0 "[ . 1 . 2]" 1 802 1 33 GLY QA 1 34 LYS HG3 . . 4.250 3.929 3.701 4.112 . 0 0 "[ . 1 . 2]" 1 803 1 33 GLY HA2 1 34 LYS HG2 . . 4.990 4.783 4.680 4.970 . 0 0 "[ . 1 . 2]" 1 804 1 33 GLY HA3 1 34 LYS HG2 . . 4.990 3.985 3.878 4.113 . 0 0 "[ . 1 . 2]" 1 805 1 34 LYS H 1 34 LYS HB2 . . 3.050 2.885 2.749 3.022 . 0 0 "[ . 1 . 2]" 1 806 1 34 LYS H 1 34 LYS HB3 . . 4.200 3.890 3.818 3.943 . 0 0 "[ . 1 . 2]" 1 807 1 34 LYS H 1 34 LYS HD2 . . 5.500 5.339 5.029 5.465 . 0 0 "[ . 1 . 2]" 1 808 1 34 LYS H 1 34 LYS HD3 . . 5.500 5.238 5.059 5.394 . 0 0 "[ . 1 . 2]" 1 809 1 34 LYS H 1 34 LYS QE . . 5.100 4.907 4.301 5.116 0.016 10 0 "[ . 1 . 2]" 1 810 1 34 LYS H 1 34 LYS HG2 . . 3.620 3.525 3.288 3.604 . 0 0 "[ . 1 . 2]" 1 811 1 34 LYS H 1 34 LYS HG3 . . 3.260 3.090 2.833 3.243 . 0 0 "[ . 1 . 2]" 1 812 1 34 LYS H 1 35 THR H . . 4.510 4.388 4.370 4.410 . 0 0 "[ . 1 . 2]" 1 813 1 34 LYS HA 1 34 LYS QD . . 4.040 3.963 3.695 4.074 0.034 15 0 "[ . 1 . 2]" 1 814 1 34 LYS HA 1 34 LYS HG2 . . 3.470 2.567 2.467 2.706 . 0 0 "[ . 1 . 2]" 1 815 1 34 LYS HA 1 34 LYS HG3 . . 3.810 3.531 3.449 3.607 . 0 0 "[ . 1 . 2]" 1 816 1 34 LYS HA 1 35 THR H . . 2.740 2.612 2.547 2.642 . 0 0 "[ . 1 . 2]" 1 817 1 34 LYS HA 1 35 THR HA . . 4.870 4.516 4.493 4.534 . 0 0 "[ . 1 . 2]" 1 818 1 34 LYS HA 1 35 THR MG . . 4.100 3.417 3.217 3.639 . 0 0 "[ . 1 . 2]" 1 819 1 34 LYS HB2 1 34 LYS QE . . 4.420 3.316 2.142 4.272 . 0 0 "[ . 1 . 2]" 1 820 1 34 LYS HB2 1 35 THR H . . 3.610 3.018 2.846 3.184 . 0 0 "[ . 1 . 2]" 1 821 1 34 LYS HB3 1 34 LYS HD2 . . 3.970 3.102 2.191 3.570 . 0 0 "[ . 1 . 2]" 1 822 1 34 LYS HB3 1 34 LYS QD . . 3.490 2.266 2.057 2.428 . 0 0 "[ . 1 . 2]" 1 823 1 34 LYS HB3 1 34 LYS HD3 . . 3.970 2.682 2.088 3.569 . 0 0 "[ . 1 . 2]" 1 824 1 34 LYS HB3 1 34 LYS QE . . 3.990 2.692 2.104 3.640 . 0 0 "[ . 1 . 2]" 1 825 1 34 LYS HB3 1 35 THR H . . 3.140 2.135 2.054 2.225 . 0 0 "[ . 1 . 2]" 1 826 1 34 LYS QE 1 34 LYS HG2 . . 3.740 2.591 2.065 3.485 . 0 0 "[ . 1 . 2]" 1 827 1 34 LYS QE 1 34 LYS HG3 . . 3.400 2.953 2.209 3.407 0.007 10 0 "[ . 1 . 2]" 1 828 1 34 LYS QE 1 35 THR H . . 5.500 4.187 3.351 5.444 . 0 0 "[ . 1 . 2]" 1 829 1 34 LYS HG2 1 35 THR H . . 4.410 4.338 4.244 4.419 0.009 16 0 "[ . 1 . 2]" 1 830 1 34 LYS HG3 1 35 THR H . . 4.960 4.800 4.757 4.885 . 0 0 "[ . 1 . 2]" 1 831 1 35 THR H 1 35 THR HB . . 4.060 3.883 3.848 3.922 . 0 0 "[ . 1 . 2]" 1 832 1 35 THR H 1 35 THR MG . . 3.520 3.064 2.935 3.227 . 0 0 "[ . 1 . 2]" 1 833 1 35 THR H 1 36 ALA H . . 4.470 4.367 4.308 4.428 . 0 0 "[ . 1 . 2]" 1 834 1 35 THR H 1 36 ALA HA . . 5.110 4.818 4.757 4.890 . 0 0 "[ . 1 . 2]" 1 835 1 35 THR HA 1 35 THR MG . . 3.210 2.321 2.200 2.447 . 0 0 "[ . 1 . 2]" 1 836 1 35 THR HA 1 36 ALA H . . 2.870 2.234 2.187 2.316 . 0 0 "[ . 1 . 2]" 1 837 1 35 THR HA 1 36 ALA MB . . 4.420 3.848 3.781 3.897 . 0 0 "[ . 1 . 2]" 1 838 1 35 THR HB 1 36 ALA H . . 3.130 2.868 2.614 3.051 . 0 0 "[ . 1 . 2]" 1 839 1 35 THR MG 1 36 ALA H . . 4.060 3.866 3.781 3.966 . 0 0 "[ . 1 . 2]" 1 840 1 36 ALA H 1 36 ALA MB . . 3.210 2.580 2.516 2.690 . 0 0 "[ . 1 . 2]" 1 841 1 36 ALA HA 1 37 ARG H . . 3.070 2.260 2.160 2.445 . 0 0 "[ . 1 . 2]" 1 842 1 36 ALA HA 1 37 ARG HB2 . . 4.420 4.217 4.158 4.265 . 0 0 "[ . 1 . 2]" 1 843 1 36 ALA HA 1 37 ARG HB3 . . 5.500 5.027 4.983 5.109 . 0 0 "[ . 1 . 2]" 1 844 1 36 ALA MB 1 37 ARG H . . 3.290 2.807 2.442 3.094 . 0 0 "[ . 1 . 2]" 1 845 1 36 ALA MB 1 52 TYR QE . . 3.270 2.364 2.036 2.762 . 0 0 "[ . 1 . 2]" 1 846 1 37 ARG H 1 37 ARG HB2 . . 3.280 2.404 2.283 2.612 . 0 0 "[ . 1 . 2]" 1 847 1 37 ARG H 1 37 ARG HB3 . . 3.770 2.815 2.779 2.844 . 0 0 "[ . 1 . 2]" 1 848 1 37 ARG H 1 37 ARG HG2 . . 4.790 4.525 4.485 4.589 . 0 0 "[ . 1 . 2]" 1 849 1 37 ARG H 1 37 ARG QG . . 4.100 3.951 3.885 4.046 . 0 0 "[ . 1 . 2]" 1 850 1 37 ARG H 1 37 ARG HG3 . . 4.790 4.359 4.239 4.539 . 0 0 "[ . 1 . 2]" 1 851 1 37 ARG HA 1 37 ARG HD2 . . 4.760 4.554 4.417 4.724 . 0 0 "[ . 1 . 2]" 1 852 1 37 ARG HA 1 37 ARG QD . . 4.160 4.058 3.965 4.105 . 0 0 "[ . 1 . 2]" 1 853 1 37 ARG HA 1 37 ARG HD3 . . 4.760 4.574 4.336 4.714 . 0 0 "[ . 1 . 2]" 1 854 1 37 ARG HA 1 37 ARG HG2 . . 3.870 2.600 2.510 2.799 . 0 0 "[ . 1 . 2]" 1 855 1 37 ARG HA 1 37 ARG HG3 . . 3.870 2.633 2.417 2.726 . 0 0 "[ . 1 . 2]" 1 856 1 37 ARG HA 1 38 PRO HD2 . . 3.410 1.988 1.975 2.010 . 0 0 "[ . 1 . 2]" 1 857 1 37 ARG HA 1 38 PRO HD3 . . 3.480 2.315 2.298 2.326 . 0 0 "[ . 1 . 2]" 1 858 1 37 ARG HA 1 38 PRO QG . . 4.340 3.783 3.779 3.791 . 0 0 "[ . 1 . 2]" 1 859 1 37 ARG HB2 1 37 ARG HD2 . . 3.980 3.326 2.624 3.786 . 0 0 "[ . 1 . 2]" 1 860 1 37 ARG HB2 1 37 ARG QD . . 3.340 2.771 2.298 3.161 . 0 0 "[ . 1 . 2]" 1 861 1 37 ARG HB2 1 37 ARG HD3 . . 3.980 3.269 2.330 3.884 . 0 0 "[ . 1 . 2]" 1 862 1 37 ARG HB2 1 38 PRO HD2 . . 4.590 4.208 4.157 4.253 . 0 0 "[ . 1 . 2]" 1 863 1 37 ARG HB3 1 37 ARG HD2 . . 3.750 2.888 2.189 3.755 0.005 7 0 "[ . 1 . 2]" 1 864 1 37 ARG HB3 1 37 ARG QD . . 3.260 2.394 2.161 2.866 . 0 0 "[ . 1 . 2]" 1 865 1 37 ARG HB3 1 37 ARG HD3 . . 3.750 3.084 2.199 3.615 . 0 0 "[ . 1 . 2]" 1 866 1 37 ARG HB3 1 38 PRO HD2 . . 4.540 4.105 4.061 4.159 . 0 0 "[ . 1 . 2]" 1 867 1 37 ARG QG 1 38 PRO HD2 . . 3.840 2.317 2.199 2.455 . 0 0 "[ . 1 . 2]" 1 868 1 37 ARG QG 1 38 PRO HD3 . . 4.240 3.701 3.622 3.780 . 0 0 "[ . 1 . 2]" 1 869 1 37 ARG HG2 1 38 PRO HD2 . . 4.580 2.398 2.248 2.614 . 0 0 "[ . 1 . 2]" 1 870 1 37 ARG HG2 1 38 PRO HD3 . . 5.020 3.953 3.822 4.166 . 0 0 "[ . 1 . 2]" 1 871 1 37 ARG HG3 1 38 PRO HD2 . . 4.580 3.111 2.823 3.256 . 0 0 "[ . 1 . 2]" 1 872 1 37 ARG HG3 1 38 PRO HD3 . . 5.020 4.479 4.189 4.617 . 0 0 "[ . 1 . 2]" 1 873 1 38 PRO HA 1 39 ASN H . . 3.080 2.722 2.698 2.728 . 0 0 "[ . 1 . 2]" 1 874 1 38 PRO HA 1 52 TYR HB2 . . 4.750 3.195 3.100 3.257 . 0 0 "[ . 1 . 2]" 1 875 1 38 PRO HA 1 52 TYR HB3 . . 4.940 4.889 4.799 4.942 0.002 3 0 "[ . 1 . 2]" 1 876 1 38 PRO HA 1 52 TYR QD . . 4.500 2.543 2.227 2.870 . 0 0 "[ . 1 . 2]" 1 877 1 38 PRO HA 1 53 ALA H . . 4.760 4.414 4.239 4.569 . 0 0 "[ . 1 . 2]" 1 878 1 38 PRO HB2 1 39 ASN H . . 3.470 1.905 1.896 1.953 . 0 0 "[ . 1 . 2]" 1 879 1 38 PRO HB2 1 39 ASN HA . . 4.380 4.115 4.099 4.139 . 0 0 "[ . 1 . 2]" 1 880 1 38 PRO HB2 1 40 ILE QG . . 4.750 3.719 3.649 3.762 . 0 0 "[ . 1 . 2]" 1 881 1 38 PRO HB2 1 50 VAL MG1 . . 3.410 3.157 2.958 3.282 . 0 0 "[ . 1 . 2]" 1 882 1 38 PRO HB2 1 52 TYR HB2 . . 4.670 3.315 3.151 3.377 . 0 0 "[ . 1 . 2]" 1 883 1 38 PRO HB2 1 52 TYR HB3 . . 4.930 4.901 4.758 4.936 0.006 10 0 "[ . 1 . 2]" 1 884 1 38 PRO HB2 1 62 MET ME . . 4.010 3.024 2.660 3.733 . 0 0 "[ . 1 . 2]" 1 885 1 38 PRO HB2 1 64 ILE MD . . 5.160 4.061 3.930 4.169 . 0 0 "[ . 1 . 2]" 1 886 1 38 PRO HB3 1 39 ASN H . . 3.430 3.147 3.144 3.164 . 0 0 "[ . 1 . 2]" 1 887 1 38 PRO HB3 1 39 ASN HA . . 5.500 5.539 5.533 5.550 0.050 14 0 "[ . 1 . 2]" 1 888 1 38 PRO HB3 1 50 VAL MG1 . . 4.260 3.876 3.698 4.023 . 0 0 "[ . 1 . 2]" 1 889 1 38 PRO HB3 1 52 TYR HB2 . . 4.350 2.522 2.443 2.586 . 0 0 "[ . 1 . 2]" 1 890 1 38 PRO HB3 1 52 TYR HB3 . . 4.500 4.148 4.073 4.213 . 0 0 "[ . 1 . 2]" 1 891 1 38 PRO HB3 1 62 MET ME . . 3.500 2.565 2.270 3.178 . 0 0 "[ . 1 . 2]" 1 892 1 38 PRO HB3 1 64 ILE MD . . 4.850 4.615 4.441 4.704 . 0 0 "[ . 1 . 2]" 1 893 1 38 PRO QG 1 39 ASN H . . 4.430 3.601 3.592 3.647 . 0 0 "[ . 1 . 2]" 1 894 1 38 PRO QG 1 40 ILE MD . . 4.050 3.457 3.259 3.601 . 0 0 "[ . 1 . 2]" 1 895 1 38 PRO QG 1 50 VAL MG1 . . 4.070 3.910 3.762 4.060 . 0 0 "[ . 1 . 2]" 1 896 1 38 PRO QG 1 62 MET ME . . 3.870 2.953 2.524 3.543 . 0 0 "[ . 1 . 2]" 1 897 1 38 PRO QG 1 62 MET HG2 . . 4.690 4.488 4.287 4.628 . 0 0 "[ . 1 . 2]" 1 898 1 38 PRO QG 1 62 MET HG3 . . 4.280 3.032 2.859 3.242 . 0 0 "[ . 1 . 2]" 1 899 1 38 PRO QG 1 63 GLY H . . 4.900 4.592 4.395 4.771 . 0 0 "[ . 1 . 2]" 1 900 1 38 PRO QG 1 64 ILE MD . . 3.770 2.962 2.804 3.050 . 0 0 "[ . 1 . 2]" 1 901 1 39 ASN H 1 39 ASN HB2 . . 3.190 2.631 2.588 2.660 . 0 0 "[ . 1 . 2]" 1 902 1 39 ASN H 1 39 ASN HB3 . . 3.830 3.680 3.658 3.705 . 0 0 "[ . 1 . 2]" 1 903 1 39 ASN H 1 40 ILE HA . . 5.240 4.822 4.761 4.873 . 0 0 "[ . 1 . 2]" 1 904 1 39 ASN H 1 40 ILE QG . . 4.890 3.733 3.690 3.793 . 0 0 "[ . 1 . 2]" 1 905 1 39 ASN H 1 50 VAL HA . . 5.500 4.668 4.506 4.822 . 0 0 "[ . 1 . 2]" 1 906 1 39 ASN H 1 50 VAL MG1 . . 4.310 3.472 3.275 3.644 . 0 0 "[ . 1 . 2]" 1 907 1 39 ASN H 1 51 ARG HB2 . . 4.500 4.396 4.240 4.485 . 0 0 "[ . 1 . 2]" 1 908 1 39 ASN H 1 51 ARG HB3 . . 4.860 4.840 4.755 4.864 0.004 1 0 "[ . 1 . 2]" 1 909 1 39 ASN H 1 52 TYR HA . . 3.850 3.684 3.482 3.789 . 0 0 "[ . 1 . 2]" 1 910 1 39 ASN H 1 52 TYR HB2 . . 4.320 3.562 3.440 3.656 . 0 0 "[ . 1 . 2]" 1 911 1 39 ASN H 1 52 TYR QD . . 4.850 4.546 4.348 4.761 . 0 0 "[ . 1 . 2]" 1 912 1 39 ASN H 1 62 MET ME . . 5.350 4.184 3.874 4.875 . 0 0 "[ . 1 . 2]" 1 913 1 39 ASN HA 1 40 ILE H . . 2.880 2.224 2.165 2.253 . 0 0 "[ . 1 . 2]" 1 914 1 39 ASN HA 1 40 ILE HB . . 4.820 4.600 4.535 4.668 . 0 0 "[ . 1 . 2]" 1 915 1 39 ASN HA 1 40 ILE QG . . 4.580 3.437 3.265 3.559 . 0 0 "[ . 1 . 2]" 1 916 1 39 ASN HA 1 51 ARG H . . 4.960 4.729 4.634 4.827 . 0 0 "[ . 1 . 2]" 1 917 1 39 ASN HB2 1 40 ILE H . . 4.340 4.213 4.147 4.348 0.008 18 0 "[ . 1 . 2]" 1 918 1 39 ASN HB2 1 51 ARG H . . 4.070 3.607 3.466 3.779 . 0 0 "[ . 1 . 2]" 1 919 1 39 ASN HB2 1 51 ARG HB2 . . 4.080 3.006 2.768 3.142 . 0 0 "[ . 1 . 2]" 1 920 1 39 ASN HB2 1 51 ARG HB3 . . 3.770 3.254 3.136 3.354 . 0 0 "[ . 1 . 2]" 1 921 1 39 ASN HB3 1 40 ILE H . . 3.330 3.032 2.921 3.284 . 0 0 "[ . 1 . 2]" 1 922 1 39 ASN HB3 1 51 ARG H . . 4.270 3.929 3.822 4.171 . 0 0 "[ . 1 . 2]" 1 923 1 39 ASN HB3 1 51 ARG HB2 . . 4.040 3.035 2.872 3.136 . 0 0 "[ . 1 . 2]" 1 924 1 39 ASN HB3 1 51 ARG HB3 . . 4.010 3.952 3.899 4.004 . 0 0 "[ . 1 . 2]" 1 925 1 40 ILE H 1 40 ILE HB . . 3.340 2.802 2.705 2.896 . 0 0 "[ . 1 . 2]" 1 926 1 40 ILE H 1 40 ILE MD . . 4.350 3.808 3.569 3.942 . 0 0 "[ . 1 . 2]" 1 927 1 40 ILE H 1 40 ILE HG12 . . 4.710 4.246 4.164 4.345 . 0 0 "[ . 1 . 2]" 1 928 1 40 ILE H 1 40 ILE QG . . 3.960 2.860 2.734 2.984 . 0 0 "[ . 1 . 2]" 1 929 1 40 ILE H 1 40 ILE HG13 . . 4.710 2.907 2.773 3.039 . 0 0 "[ . 1 . 2]" 1 930 1 40 ILE H 1 40 ILE MG . . 4.140 3.914 3.878 3.956 . 0 0 "[ . 1 . 2]" 1 931 1 40 ILE H 1 41 THR H . . 4.340 4.249 4.131 4.296 . 0 0 "[ . 1 . 2]" 1 932 1 40 ILE HA 1 40 ILE MD . . 4.110 3.908 3.888 3.941 . 0 0 "[ . 1 . 2]" 1 933 1 40 ILE HA 1 40 ILE HG12 . . 4.060 2.816 2.730 2.872 . 0 0 "[ . 1 . 2]" 1 934 1 40 ILE HA 1 40 ILE QG . . 3.510 2.499 2.464 2.557 . 0 0 "[ . 1 . 2]" 1 935 1 40 ILE HA 1 40 ILE HG13 . . 4.060 2.796 2.724 2.880 . 0 0 "[ . 1 . 2]" 1 936 1 40 ILE HA 1 40 ILE MG . . 3.150 2.324 2.223 2.441 . 0 0 "[ . 1 . 2]" 1 937 1 40 ILE HB 1 40 ILE MD . . 2.980 2.175 2.101 2.318 . 0 0 "[ . 1 . 2]" 1 938 1 40 ILE HB 1 41 THR H . . 4.490 4.154 4.033 4.238 . 0 0 "[ . 1 . 2]" 1 939 1 40 ILE MD 1 65 LYS H . . 4.540 4.274 4.059 4.453 . 0 0 "[ . 1 . 2]" 1 940 1 40 ILE QG 1 41 THR H . . 4.750 4.207 4.146 4.260 . 0 0 "[ . 1 . 2]" 1 941 1 40 ILE QG 1 50 VAL HA . . 4.360 3.094 2.920 3.432 . 0 0 "[ . 1 . 2]" 1 942 1 40 ILE QG 1 50 VAL MG2 . . 3.440 2.830 2.641 2.978 . 0 0 "[ . 1 . 2]" 1 943 1 40 ILE QG 1 51 ARG H . . 4.210 3.867 3.694 4.122 . 0 0 "[ . 1 . 2]" 1 944 1 40 ILE HG12 1 50 VAL MG2 . . 4.210 2.884 2.684 3.050 . 0 0 "[ . 1 . 2]" 1 945 1 40 ILE HG13 1 50 VAL MG2 . . 4.210 4.118 3.916 4.211 0.001 20 0 "[ . 1 . 2]" 1 946 1 40 ILE MG 1 41 THR H . . 3.200 2.441 2.227 2.650 . 0 0 "[ . 1 . 2]" 1 947 1 40 ILE MG 1 41 THR HA . . 4.490 3.903 3.744 4.021 . 0 0 "[ . 1 . 2]" 1 948 1 40 ILE MG 1 48 ILE HA . . 4.630 3.953 3.856 4.158 . 0 0 "[ . 1 . 2]" 1 949 1 40 ILE MG 1 48 ILE HB . . 3.400 2.534 2.445 2.687 . 0 0 "[ . 1 . 2]" 1 950 1 40 ILE MG 1 48 ILE MD . . 2.850 2.708 2.542 2.838 . 0 0 "[ . 1 . 2]" 1 951 1 40 ILE MG 1 48 ILE HG13 . . 5.020 3.892 3.582 4.187 . 0 0 "[ . 1 . 2]" 1 952 1 40 ILE MG 1 49 THR H . . 4.040 3.201 3.003 3.545 . 0 0 "[ . 1 . 2]" 1 953 1 40 ILE MG 1 50 VAL MG2 . . 3.130 3.071 2.667 3.133 0.003 10 0 "[ . 1 . 2]" 1 954 1 40 ILE MG 1 51 ARG H . . 5.290 4.898 4.546 5.104 . 0 0 "[ . 1 . 2]" 1 955 1 41 THR H 1 41 THR HB . . 3.250 2.628 2.534 2.781 . 0 0 "[ . 1 . 2]" 1 956 1 41 THR H 1 41 THR MG . . 3.840 3.837 3.804 3.863 0.023 14 0 "[ . 1 . 2]" 1 957 1 41 THR H 1 42 ASP H . . 4.420 4.066 4.005 4.143 . 0 0 "[ . 1 . 2]" 1 958 1 41 THR H 1 49 THR HA . . 4.880 4.783 4.682 4.876 . 0 0 "[ . 1 . 2]" 1 959 1 41 THR H 1 49 THR HB . . 3.910 3.060 2.855 3.298 . 0 0 "[ . 1 . 2]" 1 960 1 41 THR H 1 49 THR MG . . 4.210 3.594 3.047 3.947 . 0 0 "[ . 1 . 2]" 1 961 1 41 THR H 1 50 VAL MG2 . . 4.730 4.712 4.516 4.733 0.003 17 0 "[ . 1 . 2]" 1 962 1 41 THR H 1 51 ARG H . . 5.030 4.665 4.484 4.865 . 0 0 "[ . 1 . 2]" 1 963 1 41 THR HA 1 41 THR MG . . 3.210 2.307 2.218 2.441 . 0 0 "[ . 1 . 2]" 1 964 1 41 THR HA 1 42 ASP H . . 2.820 2.222 2.207 2.235 . 0 0 "[ . 1 . 2]" 1 965 1 41 THR HA 1 42 ASP HA . . 4.480 4.487 4.476 4.495 0.015 14 0 "[ . 1 . 2]" 1 966 1 41 THR HA 1 42 ASP HB2 . . 4.970 4.459 4.407 4.631 . 0 0 "[ . 1 . 2]" 1 967 1 41 THR HA 1 42 ASP QB . . 4.270 4.130 4.115 4.156 . 0 0 "[ . 1 . 2]" 1 968 1 41 THR HA 1 42 ASP HB3 . . 4.970 4.887 4.700 4.958 . 0 0 "[ . 1 . 2]" 1 969 1 41 THR HB 1 42 ASP H . . 4.570 4.412 4.349 4.452 . 0 0 "[ . 1 . 2]" 1 970 1 41 THR HB 1 49 THR H . . 3.730 3.641 3.538 3.727 . 0 0 "[ . 1 . 2]" 1 971 1 41 THR HB 1 49 THR MG . . 3.430 3.203 2.847 3.398 . 0 0 "[ . 1 . 2]" 1 972 1 41 THR MG 1 42 ASP H . . 3.460 3.308 3.166 3.429 . 0 0 "[ . 1 . 2]" 1 973 1 41 THR MG 1 43 ASN HA . . 4.160 3.969 3.818 4.150 . 0 0 "[ . 1 . 2]" 1 974 1 42 ASP H 1 42 ASP HB2 . . 3.310 2.258 2.198 2.423 . 0 0 "[ . 1 . 2]" 1 975 1 42 ASP H 1 42 ASP QB . . 2.870 2.172 2.138 2.242 . 0 0 "[ . 1 . 2]" 1 976 1 42 ASP H 1 42 ASP HB3 . . 3.310 2.844 2.642 2.926 . 0 0 "[ . 1 . 2]" 1 977 1 42 ASP H 1 43 ASN H . . 4.710 4.474 4.451 4.513 . 0 0 "[ . 1 . 2]" 1 978 1 42 ASP HA 1 43 ASN H . . 2.880 2.140 2.139 2.142 . 0 0 "[ . 1 . 2]" 1 979 1 42 ASP HA 1 43 ASN HD21 . . 4.730 4.201 3.837 4.466 . 0 0 "[ . 1 . 2]" 1 980 1 42 ASP HA 1 43 ASN HD22 . . 4.800 4.630 4.380 4.774 . 0 0 "[ . 1 . 2]" 1 981 1 42 ASP HA 1 44 LYS H . . 3.730 3.556 3.479 3.647 . 0 0 "[ . 1 . 2]" 1 982 1 42 ASP HA 1 48 ILE HA . . 3.890 3.618 3.288 3.841 . 0 0 "[ . 1 . 2]" 1 983 1 42 ASP HA 1 48 ILE HB . . 4.370 4.129 3.811 4.362 . 0 0 "[ . 1 . 2]" 1 984 1 42 ASP HA 1 48 ILE MG . . 3.530 3.272 3.068 3.524 . 0 0 "[ . 1 . 2]" 1 985 1 42 ASP HA 1 49 THR H . . 4.290 4.127 3.898 4.288 . 0 0 "[ . 1 . 2]" 1 986 1 42 ASP QB 1 43 ASN H . . 4.150 3.799 3.735 3.840 . 0 0 "[ . 1 . 2]" 1 987 1 42 ASP QB 1 44 LYS H . . 4.440 4.103 3.824 4.297 . 0 0 "[ . 1 . 2]" 1 988 1 43 ASN H 1 43 ASN HB2 . . 3.430 2.619 2.580 2.660 . 0 0 "[ . 1 . 2]" 1 989 1 43 ASN H 1 43 ASN HB3 . . 3.700 3.661 3.647 3.685 . 0 0 "[ . 1 . 2]" 1 990 1 43 ASN H 1 43 ASN HD21 . . 4.080 2.627 2.342 2.902 . 0 0 "[ . 1 . 2]" 1 991 1 43 ASN H 1 43 ASN HD22 . . 4.200 3.539 3.377 3.703 . 0 0 "[ . 1 . 2]" 1 992 1 43 ASN H 1 44 LYS H . . 3.040 2.222 2.137 2.273 . 0 0 "[ . 1 . 2]" 1 993 1 43 ASN H 1 44 LYS HA . . 4.530 4.477 4.392 4.527 . 0 0 "[ . 1 . 2]" 1 994 1 43 ASN H 1 45 ASP H . . 4.170 4.049 3.947 4.140 . 0 0 "[ . 1 . 2]" 1 995 1 43 ASN H 1 46 GLY H . . 5.290 5.163 4.947 5.279 . 0 0 "[ . 1 . 2]" 1 996 1 43 ASN H 1 47 THR H . . 5.090 4.854 4.624 5.048 . 0 0 "[ . 1 . 2]" 1 997 1 43 ASN H 1 48 ILE HA . . 3.430 3.199 3.017 3.315 . 0 0 "[ . 1 . 2]" 1 998 1 43 ASN H 1 48 ILE HB . . 5.080 4.847 4.598 4.981 . 0 0 "[ . 1 . 2]" 1 999 1 43 ASN H 1 48 ILE MG . . 3.850 3.567 3.315 3.716 . 0 0 "[ . 1 . 2]" 1 1000 1 43 ASN H 1 49 THR H . . 4.440 4.227 4.110 4.332 . 0 0 "[ . 1 . 2]" 1 1001 1 43 ASN HA 1 45 ASP H . . 4.590 4.450 4.300 4.586 . 0 0 "[ . 1 . 2]" 1 1002 1 43 ASN HB2 1 43 ASN HD22 . . 3.740 3.447 3.436 3.467 . 0 0 "[ . 1 . 2]" 1 1003 1 43 ASN HB2 1 44 LYS H . . 4.020 3.021 2.861 3.157 . 0 0 "[ . 1 . 2]" 1 1004 1 43 ASN HB2 1 44 LYS HA . . 5.310 4.723 4.640 4.833 . 0 0 "[ . 1 . 2]" 1 1005 1 43 ASN HB2 1 45 ASP H . . 3.710 2.621 2.548 2.753 . 0 0 "[ . 1 . 2]" 1 1006 1 43 ASN HB2 1 46 GLY H . . 5.050 3.892 3.554 4.244 . 0 0 "[ . 1 . 2]" 1 1007 1 43 ASN HB2 1 47 THR H . . 4.410 3.296 3.123 3.444 . 0 0 "[ . 1 . 2]" 1 1008 1 43 ASN HB3 1 43 ASN HD22 . . 4.080 4.001 3.968 4.036 . 0 0 "[ . 1 . 2]" 1 1009 1 43 ASN HB3 1 44 LYS H . . 4.170 4.092 3.992 4.171 0.001 3 0 "[ . 1 . 2]" 1 1010 1 43 ASN HB3 1 45 ASP H . . 3.930 3.596 3.422 3.850 . 0 0 "[ . 1 . 2]" 1 1011 1 43 ASN HB3 1 47 THR H . . 5.000 4.746 4.547 4.948 . 0 0 "[ . 1 . 2]" 1 1012 1 43 ASN HD21 1 44 LYS H . . 5.000 4.102 3.915 4.318 . 0 0 "[ . 1 . 2]" 1 1013 1 43 ASN HD21 1 45 ASP H . . 4.430 4.362 4.282 4.431 0.001 9 0 "[ . 1 . 2]" 1 1014 1 43 ASN HD21 1 47 THR HB . . 4.500 4.172 3.906 4.460 . 0 0 "[ . 1 . 2]" 1 1015 1 43 ASN HD21 1 47 THR MG . . 4.860 4.734 4.545 4.857 . 0 0 "[ . 1 . 2]" 1 1016 1 43 ASN HD21 1 48 ILE HA . . 4.350 2.170 1.982 2.537 . 0 0 "[ . 1 . 2]" 1 1017 1 43 ASN HD21 1 48 ILE MG . . 4.800 3.678 3.437 4.024 . 0 0 "[ . 1 . 2]" 1 1018 1 43 ASN HD21 1 49 THR H . . 4.250 3.397 3.175 3.674 . 0 0 "[ . 1 . 2]" 1 1019 1 43 ASN HD21 1 49 THR HB . . 4.970 4.850 4.746 4.956 . 0 0 "[ . 1 . 2]" 1 1020 1 43 ASN HD21 1 49 THR HG1 . . 4.080 3.662 3.473 3.989 . 0 0 "[ . 1 . 2]" 1 1021 1 43 ASN HD22 1 47 THR HB . . 5.120 4.733 4.576 4.943 . 0 0 "[ . 1 . 2]" 1 1022 1 43 ASN HD22 1 48 ILE H . . 4.730 4.250 4.058 4.542 . 0 0 "[ . 1 . 2]" 1 1023 1 43 ASN HD22 1 48 ILE HA . . 4.260 2.537 2.333 2.877 . 0 0 "[ . 1 . 2]" 1 1024 1 43 ASN HD22 1 48 ILE MG . . 5.140 4.485 4.294 4.760 . 0 0 "[ . 1 . 2]" 1 1025 1 43 ASN HD22 1 49 THR H . . 4.060 2.419 2.148 2.789 . 0 0 "[ . 1 . 2]" 1 1026 1 43 ASN HD22 1 49 THR HB . . 4.320 3.231 3.101 3.349 . 0 0 "[ . 1 . 2]" 1 1027 1 43 ASN HD22 1 49 THR HG1 . . 3.810 2.024 1.900 2.279 . 0 0 "[ . 1 . 2]" 1 1028 1 43 ASN HD22 1 49 THR MG . . 5.440 4.386 4.286 4.551 . 0 0 "[ . 1 . 2]" 1 1029 1 44 LYS H 1 44 LYS HA . . 2.730 2.276 2.274 2.279 . 0 0 "[ . 1 . 2]" 1 1030 1 44 LYS H 1 44 LYS HB2 . . 4.050 3.569 3.405 3.648 . 0 0 "[ . 1 . 2]" 1 1031 1 44 LYS H 1 44 LYS HB3 . . 4.050 4.028 3.988 4.056 0.006 16 0 "[ . 1 . 2]" 1 1032 1 44 LYS H 1 44 LYS HD2 . . 4.740 3.758 2.548 4.686 . 0 0 "[ . 1 . 2]" 1 1033 1 44 LYS H 1 44 LYS QD . . 3.980 3.164 2.428 3.633 . 0 0 "[ . 1 . 2]" 1 1034 1 44 LYS H 1 44 LYS HD3 . . 4.740 3.685 2.468 4.374 . 0 0 "[ . 1 . 2]" 1 1035 1 44 LYS H 1 44 LYS QG . . 3.330 2.732 2.484 3.135 . 0 0 "[ . 1 . 2]" 1 1036 1 44 LYS H 1 45 ASP H . . 3.420 2.698 2.612 2.756 . 0 0 "[ . 1 . 2]" 1 1037 1 44 LYS H 1 46 GLY H . . 4.410 3.906 3.804 3.983 . 0 0 "[ . 1 . 2]" 1 1038 1 44 LYS H 1 47 THR H . . 4.690 4.508 4.277 4.685 . 0 0 "[ . 1 . 2]" 1 1039 1 44 LYS H 1 48 ILE HA . . 5.030 4.892 4.792 5.010 . 0 0 "[ . 1 . 2]" 1 1040 1 44 LYS H 1 48 ILE MG . . 4.520 4.245 4.051 4.443 . 0 0 "[ . 1 . 2]" 1 1041 1 44 LYS HA 1 44 LYS HD2 . . 4.440 3.081 2.294 4.206 . 0 0 "[ . 1 . 2]" 1 1042 1 44 LYS HA 1 44 LYS QD . . 3.750 2.748 2.273 3.444 . 0 0 "[ . 1 . 2]" 1 1043 1 44 LYS HA 1 44 LYS HD3 . . 4.440 3.528 2.544 4.202 . 0 0 "[ . 1 . 2]" 1 1044 1 44 LYS HA 1 44 LYS QE . . 4.810 4.270 3.700 4.754 . 0 0 "[ . 1 . 2]" 1 1045 1 44 LYS HA 1 44 LYS HG2 . . 4.020 3.125 2.834 3.626 . 0 0 "[ . 1 . 2]" 1 1046 1 44 LYS HA 1 44 LYS QG . . 3.300 2.645 2.273 2.857 . 0 0 "[ . 1 . 2]" 1 1047 1 44 LYS HA 1 44 LYS HG3 . . 4.020 3.331 2.302 3.879 . 0 0 "[ . 1 . 2]" 1 1048 1 44 LYS HA 1 45 ASP H . . 3.520 2.927 2.862 2.973 . 0 0 "[ . 1 . 2]" 1 1049 1 44 LYS HA 1 45 ASP HA . . 5.100 4.466 4.436 4.485 . 0 0 "[ . 1 . 2]" 1 1050 1 44 LYS HA 1 46 GLY H . . 4.150 3.587 3.432 3.872 . 0 0 "[ . 1 . 2]" 1 1051 1 44 LYS QB 1 44 LYS QD . . 3.120 2.264 2.047 2.443 . 0 0 "[ . 1 . 2]" 1 1052 1 44 LYS QB 1 45 ASP H . . 4.210 3.782 3.739 3.828 . 0 0 "[ . 1 . 2]" 1 1053 1 44 LYS HB2 1 45 ASP H . . 4.830 4.083 4.043 4.166 . 0 0 "[ . 1 . 2]" 1 1054 1 44 LYS HB3 1 45 ASP H . . 4.830 4.469 4.392 4.512 . 0 0 "[ . 1 . 2]" 1 1055 1 44 LYS QE 1 44 LYS HG2 . . 3.820 2.862 2.196 3.496 . 0 0 "[ . 1 . 2]" 1 1056 1 44 LYS QE 1 44 LYS QG . . 3.320 2.238 2.071 2.592 . 0 0 "[ . 1 . 2]" 1 1057 1 44 LYS QE 1 44 LYS HG3 . . 3.820 2.553 2.096 3.272 . 0 0 "[ . 1 . 2]" 1 1058 1 44 LYS QG 1 45 ASP H . . 4.760 4.571 4.433 4.747 . 0 0 "[ . 1 . 2]" 1 1059 1 45 ASP H 1 45 ASP HB2 . . 4.010 3.005 2.431 3.779 . 0 0 "[ . 1 . 2]" 1 1060 1 45 ASP H 1 45 ASP QB . . 3.440 2.537 2.396 3.010 . 0 0 "[ . 1 . 2]" 1 1061 1 45 ASP H 1 45 ASP HB3 . . 4.010 2.978 2.453 3.765 . 0 0 "[ . 1 . 2]" 1 1062 1 45 ASP H 1 46 GLY H . . 2.990 1.951 1.814 2.073 . 0 0 "[ . 1 . 2]" 1 1063 1 45 ASP H 1 46 GLY HA2 . . 4.840 4.432 4.313 4.524 . 0 0 "[ . 1 . 2]" 1 1064 1 45 ASP H 1 46 GLY QA . . 4.180 4.035 3.951 4.101 . 0 0 "[ . 1 . 2]" 1 1065 1 45 ASP H 1 46 GLY HA3 . . 4.840 4.644 4.586 4.694 . 0 0 "[ . 1 . 2]" 1 1066 1 45 ASP H 1 47 THR H . . 3.260 2.910 2.749 3.115 . 0 0 "[ . 1 . 2]" 1 1067 1 45 ASP H 1 47 THR MG . . 5.370 5.100 4.877 5.225 . 0 0 "[ . 1 . 2]" 1 1068 1 45 ASP QB 1 46 GLY H . . 4.430 3.372 3.023 3.829 . 0 0 "[ . 1 . 2]" 1 1069 1 45 ASP QB 1 47 THR H . . 4.680 3.491 3.198 4.298 . 0 0 "[ . 1 . 2]" 1 1070 1 45 ASP HB2 1 46 GLY H . . 5.260 4.072 3.143 4.473 . 0 0 "[ . 1 . 2]" 1 1071 1 45 ASP HB3 1 46 GLY H . . 5.260 3.726 3.113 4.430 . 0 0 "[ . 1 . 2]" 1 1072 1 46 GLY H 1 47 THR H . . 3.050 2.047 1.880 2.226 . 0 0 "[ . 1 . 2]" 1 1073 1 46 GLY QA 1 47 THR MG . . 4.080 3.169 3.045 3.274 . 0 0 "[ . 1 . 2]" 1 1074 1 46 GLY HA2 1 47 THR MG . . 4.720 4.200 4.046 4.307 . 0 0 "[ . 1 . 2]" 1 1075 1 46 GLY HA3 1 47 THR MG . . 4.720 3.279 3.149 3.393 . 0 0 "[ . 1 . 2]" 1 1076 1 47 THR H 1 47 THR MG . . 3.430 2.814 2.581 2.985 . 0 0 "[ . 1 . 2]" 1 1077 1 47 THR H 1 48 ILE H . . 4.540 4.433 4.412 4.466 . 0 0 "[ . 1 . 2]" 1 1078 1 47 THR HA 1 47 THR MG . . 3.290 2.433 2.347 2.520 . 0 0 "[ . 1 . 2]" 1 1079 1 47 THR HA 1 48 ILE H . . 2.960 2.469 2.400 2.541 . 0 0 "[ . 1 . 2]" 1 1080 1 47 THR HA 1 48 ILE MG . . 3.490 3.256 3.162 3.443 . 0 0 "[ . 1 . 2]" 1 1081 1 47 THR HB 1 48 ILE H . . 3.120 2.295 2.164 2.419 . 0 0 "[ . 1 . 2]" 1 1082 1 47 THR MG 1 48 ILE H . . 3.850 3.741 3.659 3.836 . 0 0 "[ . 1 . 2]" 1 1083 1 48 ILE H 1 48 ILE MD . . 4.160 4.027 3.961 4.102 . 0 0 "[ . 1 . 2]" 1 1084 1 48 ILE H 1 48 ILE HG12 . . 3.420 2.453 2.350 2.646 . 0 0 "[ . 1 . 2]" 1 1085 1 48 ILE H 1 48 ILE HG13 . . 3.680 3.064 2.822 3.219 . 0 0 "[ . 1 . 2]" 1 1086 1 48 ILE H 1 48 ILE MG . . 3.690 2.883 2.749 3.035 . 0 0 "[ . 1 . 2]" 1 1087 1 48 ILE H 1 49 THR H . . 4.650 4.360 4.303 4.402 . 0 0 "[ . 1 . 2]" 1 1088 1 48 ILE HA 1 48 ILE MD . . 4.220 4.166 4.141 4.176 . 0 0 "[ . 1 . 2]" 1 1089 1 48 ILE HA 1 48 ILE MG . . 3.210 2.408 2.282 2.462 . 0 0 "[ . 1 . 2]" 1 1090 1 48 ILE HA 1 49 THR H . . 2.870 2.208 2.176 2.254 . 0 0 "[ . 1 . 2]" 1 1091 1 48 ILE HA 1 49 THR HB . . 4.640 4.522 4.407 4.603 . 0 0 "[ . 1 . 2]" 1 1092 1 48 ILE HB 1 48 ILE MD . . 3.310 2.347 2.279 2.412 . 0 0 "[ . 1 . 2]" 1 1093 1 48 ILE HB 1 49 THR H . . 3.250 2.949 2.778 3.086 . 0 0 "[ . 1 . 2]" 1 1094 1 48 ILE HB 1 50 VAL MG2 . . 4.190 3.980 3.823 4.148 . 0 0 "[ . 1 . 2]" 1 1095 1 48 ILE MD 1 48 ILE MG . . 2.930 2.014 1.924 2.263 . 0 0 "[ . 1 . 2]" 1 1096 1 48 ILE MD 1 49 THR H . . 4.820 4.620 4.308 4.821 0.001 16 0 "[ . 1 . 2]" 1 1097 1 48 ILE MD 1 50 VAL MG2 . . 3.230 2.981 2.550 3.171 . 0 0 "[ . 1 . 2]" 1 1098 1 48 ILE MD 1 71 ILE HB . . 5.090 4.078 3.878 4.316 . 0 0 "[ . 1 . 2]" 1 1099 1 48 ILE MD 1 71 ILE MD . . 3.400 2.509 2.394 2.678 . 0 0 "[ . 1 . 2]" 1 1100 1 48 ILE MD 1 71 ILE MG . . 4.710 3.435 3.192 3.684 . 0 0 "[ . 1 . 2]" 1 1101 1 48 ILE HG12 1 48 ILE MG . . 3.410 2.361 2.129 2.429 . 0 0 "[ . 1 . 2]" 1 1102 1 48 ILE HG12 1 49 THR H . . 5.160 4.960 4.814 5.033 . 0 0 "[ . 1 . 2]" 1 1103 1 48 ILE HG13 1 48 ILE MG . . 3.600 3.196 3.164 3.202 . 0 0 "[ . 1 . 2]" 1 1104 1 48 ILE HG13 1 49 THR H . . 4.510 3.986 3.758 4.113 . 0 0 "[ . 1 . 2]" 1 1105 1 48 ILE HG13 1 50 VAL MG2 . . 3.810 3.115 2.976 3.384 . 0 0 "[ . 1 . 2]" 1 1106 1 48 ILE MG 1 49 THR H . . 4.780 3.921 3.850 3.977 . 0 0 "[ . 1 . 2]" 1 1107 1 49 THR H 1 49 THR HB . . 3.230 2.495 2.385 2.549 . 0 0 "[ . 1 . 2]" 1 1108 1 49 THR H 1 49 THR HG1 . . 4.410 2.923 2.639 3.166 . 0 0 "[ . 1 . 2]" 1 1109 1 49 THR H 1 49 THR MG . . 3.850 3.779 3.695 3.815 . 0 0 "[ . 1 . 2]" 1 1110 1 49 THR H 1 50 VAL H . . 4.760 4.436 4.356 4.513 . 0 0 "[ . 1 . 2]" 1 1111 1 49 THR H 1 50 VAL MG2 . . 4.650 4.451 4.340 4.551 . 0 0 "[ . 1 . 2]" 1 1112 1 49 THR HA 1 49 THR MG . . 3.270 2.469 2.418 2.528 . 0 0 "[ . 1 . 2]" 1 1113 1 49 THR HA 1 50 VAL H . . 3.060 2.160 2.143 2.195 . 0 0 "[ . 1 . 2]" 1 1114 1 49 THR HA 1 50 VAL HA . . 4.960 4.390 4.386 4.399 . 0 0 "[ . 1 . 2]" 1 1115 1 49 THR HA 1 50 VAL HB . . 4.900 4.665 4.615 4.717 . 0 0 "[ . 1 . 2]" 1 1116 1 49 THR HA 1 50 VAL MG2 . . 4.140 3.652 3.557 3.799 . 0 0 "[ . 1 . 2]" 1 1117 1 49 THR HB 1 50 VAL H . . 4.670 4.226 4.075 4.372 . 0 0 "[ . 1 . 2]" 1 1118 1 49 THR MG 1 50 VAL H . . 3.550 2.513 2.214 2.723 . 0 0 "[ . 1 . 2]" 1 1119 1 49 THR MG 1 50 VAL HA . . 3.740 3.646 3.446 3.740 . 0 0 "[ . 1 . 2]" 1 1120 1 49 THR MG 1 51 ARG H . . 4.500 4.161 3.698 4.442 . 0 0 "[ . 1 . 2]" 1 1121 1 49 THR MG 1 51 ARG QD . . 4.070 3.209 2.390 3.790 . 0 0 "[ . 1 . 2]" 1 1122 1 49 THR MG 1 51 ARG QG . . 3.410 2.601 2.438 2.749 . 0 0 "[ . 1 . 2]" 1 1123 1 50 VAL H 1 50 VAL HB . . 3.750 2.606 2.535 2.692 . 0 0 "[ . 1 . 2]" 1 1124 1 50 VAL H 1 50 VAL MG1 . . 4.410 3.834 3.805 3.874 . 0 0 "[ . 1 . 2]" 1 1125 1 50 VAL H 1 50 VAL MG2 . . 3.550 2.639 2.564 2.737 . 0 0 "[ . 1 . 2]" 1 1126 1 50 VAL H 1 51 ARG H . . 4.630 4.447 4.297 4.538 . 0 0 "[ . 1 . 2]" 1 1127 1 50 VAL HA 1 50 VAL MG1 . . 3.350 2.389 2.280 2.456 . 0 0 "[ . 1 . 2]" 1 1128 1 50 VAL HA 1 50 VAL MG2 . . 3.430 2.352 2.293 2.404 . 0 0 "[ . 1 . 2]" 1 1129 1 50 VAL HA 1 51 ARG H . . 2.760 2.167 2.141 2.222 . 0 0 "[ . 1 . 2]" 1 1130 1 50 VAL HA 1 51 ARG HA . . 4.670 4.409 4.394 4.440 . 0 0 "[ . 1 . 2]" 1 1131 1 50 VAL HB 1 51 ARG H . . 4.220 4.092 3.905 4.221 0.001 4 0 "[ . 1 . 2]" 1 1132 1 50 VAL MG1 1 51 ARG H . . 3.380 2.371 2.049 2.726 . 0 0 "[ . 1 . 2]" 1 1133 1 50 VAL MG1 1 51 ARG HA . . 4.340 3.547 3.413 3.769 . 0 0 "[ . 1 . 2]" 1 1134 1 50 VAL MG1 1 62 MET ME . . 3.100 2.058 1.831 2.276 . 0 0 "[ . 1 . 2]" 1 1135 1 50 VAL MG1 1 62 MET HG2 . . 4.500 4.360 4.215 4.462 . 0 0 "[ . 1 . 2]" 1 1136 1 50 VAL MG1 1 62 MET HG3 . . 4.660 4.084 3.929 4.343 . 0 0 "[ . 1 . 2]" 1 1137 1 50 VAL MG1 1 64 ILE MD . . 3.100 2.995 2.767 3.098 . 0 0 "[ . 1 . 2]" 1 1138 1 50 VAL MG2 1 51 ARG H . . 4.240 4.048 3.979 4.142 . 0 0 "[ . 1 . 2]" 1 1139 1 51 ARG H 1 51 ARG HB2 . . 3.620 2.559 2.465 2.684 . 0 0 "[ . 1 . 2]" 1 1140 1 51 ARG H 1 51 ARG HB3 . . 3.850 3.644 3.591 3.721 . 0 0 "[ . 1 . 2]" 1 1141 1 51 ARG H 1 51 ARG QD . . 4.630 4.418 4.123 4.634 0.004 9 0 "[ . 1 . 2]" 1 1142 1 51 ARG H 1 51 ARG QG . . 3.570 3.523 3.425 3.571 0.001 16 0 "[ . 1 . 2]" 1 1143 1 51 ARG HA 1 51 ARG QD . . 4.450 4.001 3.902 4.084 . 0 0 "[ . 1 . 2]" 1 1144 1 51 ARG HA 1 51 ARG QG . . 3.490 2.287 2.230 2.320 . 0 0 "[ . 1 . 2]" 1 1145 1 51 ARG HA 1 52 TYR H . . 2.830 2.143 2.140 2.152 . 0 0 "[ . 1 . 2]" 1 1146 1 51 ARG HA 1 52 TYR HA . . 4.610 4.399 4.390 4.409 . 0 0 "[ . 1 . 2]" 1 1147 1 51 ARG HA 1 52 TYR HB3 . . 4.640 4.407 4.356 4.464 . 0 0 "[ . 1 . 2]" 1 1148 1 51 ARG HB2 1 51 ARG QD . . 3.230 2.283 2.153 2.490 . 0 0 "[ . 1 . 2]" 1 1149 1 51 ARG HB2 1 52 TYR H . . 5.270 4.440 4.376 4.495 . 0 0 "[ . 1 . 2]" 1 1150 1 51 ARG HB3 1 51 ARG QD . . 2.870 2.594 2.289 2.847 . 0 0 "[ . 1 . 2]" 1 1151 1 51 ARG HB3 1 52 TYR H . . 3.820 3.484 3.358 3.610 . 0 0 "[ . 1 . 2]" 1 1152 1 51 ARG QG 1 52 TYR H . . 3.830 3.774 3.690 3.830 . 0 0 "[ . 1 . 2]" 1 1153 1 52 TYR H 1 52 TYR HB2 . . 3.830 3.434 3.387 3.486 . 0 0 "[ . 1 . 2]" 1 1154 1 52 TYR H 1 52 TYR HB3 . . 3.610 2.697 2.622 2.756 . 0 0 "[ . 1 . 2]" 1 1155 1 52 TYR H 1 52 TYR QD . . 4.590 4.271 4.221 4.313 . 0 0 "[ . 1 . 2]" 1 1156 1 52 TYR H 1 53 ALA H . . 4.410 4.361 4.265 4.415 0.005 8 0 "[ . 1 . 2]" 1 1157 1 52 TYR H 1 53 ALA HA . . 4.900 4.734 4.682 4.774 . 0 0 "[ . 1 . 2]" 1 1158 1 52 TYR HA 1 53 ALA H . . 2.990 2.235 2.163 2.303 . 0 0 "[ . 1 . 2]" 1 1159 1 52 TYR HA 1 53 ALA MB . . 3.960 3.841 3.795 3.918 . 0 0 "[ . 1 . 2]" 1 1160 1 52 TYR HB2 1 53 ALA H . . 4.340 3.874 3.754 4.014 . 0 0 "[ . 1 . 2]" 1 1161 1 52 TYR HB2 1 62 MET ME . . 3.960 2.752 2.550 3.150 . 0 0 "[ . 1 . 2]" 1 1162 1 52 TYR HB2 1 78 PHE QE . . 5.500 5.199 4.987 5.426 . 0 0 "[ . 1 . 2]" 1 1163 1 52 TYR HB2 1 78 PHE HZ . . 5.500 4.915 4.323 5.374 . 0 0 "[ . 1 . 2]" 1 1164 1 52 TYR HB3 1 53 ALA H . . 4.760 4.089 3.924 4.284 . 0 0 "[ . 1 . 2]" 1 1165 1 52 TYR HB3 1 62 MET ME . . 4.110 2.990 2.773 3.294 . 0 0 "[ . 1 . 2]" 1 1166 1 52 TYR HB3 1 78 PHE QE . . 4.880 4.202 3.966 4.406 . 0 0 "[ . 1 . 2]" 1 1167 1 52 TYR HB3 1 78 PHE HZ . . 5.260 4.370 3.585 4.958 . 0 0 "[ . 1 . 2]" 1 1168 1 52 TYR QD 1 53 ALA H . . 4.130 2.551 2.151 2.944 . 0 0 "[ . 1 . 2]" 1 1169 1 52 TYR QD 1 54 PRO HB3 . . 4.860 3.586 3.349 3.801 . 0 0 "[ . 1 . 2]" 1 1170 1 52 TYR QD 1 54 PRO HG3 . . 4.380 3.995 3.780 4.267 . 0 0 "[ . 1 . 2]" 1 1171 1 52 TYR QD 1 62 MET ME . . 4.020 3.589 3.281 3.869 . 0 0 "[ . 1 . 2]" 1 1172 1 52 TYR QD 1 78 PHE QE . . 4.750 2.353 2.052 2.601 . 0 0 "[ . 1 . 2]" 1 1173 1 52 TYR QD 1 78 PHE HZ . . 4.690 2.902 2.080 3.555 . 0 0 "[ . 1 . 2]" 1 1174 1 52 TYR QE 1 53 ALA H . . 4.790 3.719 3.459 4.001 . 0 0 "[ . 1 . 2]" 1 1175 1 52 TYR QE 1 54 PRO HA . . 3.530 2.719 2.243 3.024 . 0 0 "[ . 1 . 2]" 1 1176 1 52 TYR QE 1 54 PRO HB2 . . 4.340 3.718 3.610 3.968 . 0 0 "[ . 1 . 2]" 1 1177 1 52 TYR QE 1 54 PRO HB3 . . 3.760 2.061 1.995 2.317 . 0 0 "[ . 1 . 2]" 1 1178 1 52 TYR QE 1 54 PRO HG3 . . 4.290 3.828 3.538 4.052 . 0 0 "[ . 1 . 2]" 1 1179 1 52 TYR QE 1 55 THR H . . 4.580 4.290 4.061 4.543 . 0 0 "[ . 1 . 2]" 1 1180 1 52 TYR QE 1 60 HIS HD2 . . 4.030 3.650 3.259 4.030 . 12 0 "[ . 1 . 2]" 1 1181 1 52 TYR QE 1 78 PHE QE . . 4.220 2.686 2.004 3.316 . 0 0 "[ . 1 . 2]" 1 1182 1 52 TYR QE 1 78 PHE HZ . . 4.660 2.982 2.294 3.446 . 0 0 "[ . 1 . 2]" 1 1183 1 53 ALA H 1 53 ALA MB . . 3.050 2.348 2.211 2.488 . 0 0 "[ . 1 . 2]" 1 1184 1 53 ALA H 1 54 PRO HD3 . . 4.910 4.014 3.915 4.143 . 0 0 "[ . 1 . 2]" 1 1185 1 53 ALA HA 1 54 PRO HD2 . . 3.350 1.920 1.915 1.926 . 0 0 "[ . 1 . 2]" 1 1186 1 53 ALA HA 1 54 PRO HD3 . . 3.310 2.561 2.518 2.597 . 0 0 "[ . 1 . 2]" 1 1187 1 53 ALA HA 1 54 PRO HG2 . . 4.660 4.118 4.116 4.119 . 0 0 "[ . 1 . 2]" 1 1188 1 53 ALA HA 1 54 PRO HG3 . . 4.710 4.416 4.392 4.436 . 0 0 "[ . 1 . 2]" 1 1189 1 53 ALA MB 1 54 PRO HD2 . . 4.050 3.424 3.381 3.481 . 0 0 "[ . 1 . 2]" 1 1190 1 53 ALA MB 1 54 PRO HD3 . . 4.080 4.098 4.076 4.114 0.034 13 0 "[ . 1 . 2]" 1 1191 1 54 PRO HA 1 55 THR H . . 3.390 2.161 2.150 2.264 . 0 0 "[ . 1 . 2]" 1 1192 1 54 PRO HA 1 56 GLU H . . 3.900 3.743 3.530 3.901 0.001 2 0 "[ . 1 . 2]" 1 1193 1 54 PRO HB2 1 55 THR H . . 4.340 3.513 2.992 3.649 . 0 0 "[ . 1 . 2]" 1 1194 1 54 PRO HB2 1 56 GLU H . . 3.930 3.469 3.125 3.741 . 0 0 "[ . 1 . 2]" 1 1195 1 54 PRO HB2 1 60 HIS HE1 . . 4.920 4.015 3.751 4.242 . 0 0 "[ . 1 . 2]" 1 1196 1 54 PRO HB2 1 80 VAL HB . . 4.250 3.706 3.451 3.891 . 0 0 "[ . 1 . 2]" 1 1197 1 54 PRO HB2 1 80 VAL MG1 . . 3.360 2.172 2.034 2.445 . 0 0 "[ . 1 . 2]" 1 1198 1 54 PRO HB2 1 80 VAL MG2 . . 3.850 2.501 2.284 2.702 . 0 0 "[ . 1 . 2]" 1 1199 1 54 PRO HB3 1 55 THR H . . 4.190 3.988 3.660 4.080 . 0 0 "[ . 1 . 2]" 1 1200 1 54 PRO HB3 1 56 GLU H . . 4.810 4.520 4.288 4.748 . 0 0 "[ . 1 . 2]" 1 1201 1 54 PRO HB3 1 60 HIS HE1 . . 4.350 4.258 4.062 4.343 . 0 0 "[ . 1 . 2]" 1 1202 1 54 PRO HB3 1 80 VAL MG1 . . 3.340 3.133 2.953 3.308 . 0 0 "[ . 1 . 2]" 1 1203 1 54 PRO HB3 1 80 VAL MG2 . . 3.360 2.162 1.965 2.368 . 0 0 "[ . 1 . 2]" 1 1204 1 54 PRO HG2 1 55 THR HA . . 5.500 5.209 5.016 5.287 . 0 0 "[ . 1 . 2]" 1 1205 1 54 PRO HG2 1 80 VAL HA . . 5.500 5.394 5.208 5.501 0.001 2 0 "[ . 1 . 2]" 1 1206 1 54 PRO HG2 1 80 VAL MG1 . . 3.460 2.401 2.200 2.715 . 0 0 "[ . 1 . 2]" 1 1207 1 54 PRO HG2 1 80 VAL MG2 . . 3.780 3.255 3.040 3.471 . 0 0 "[ . 1 . 2]" 1 1208 1 54 PRO HG3 1 78 PHE QE . . 4.230 3.724 3.204 4.230 0.000 12 0 "[ . 1 . 2]" 1 1209 1 54 PRO HG3 1 80 VAL HA . . 5.070 4.548 4.293 4.700 . 0 0 "[ . 1 . 2]" 1 1210 1 54 PRO HG3 1 80 VAL MG1 . . 3.490 2.412 2.133 2.720 . 0 0 "[ . 1 . 2]" 1 1211 1 54 PRO HG3 1 80 VAL MG2 . . 3.640 2.178 1.989 2.508 . 0 0 "[ . 1 . 2]" 1 1212 1 55 THR H 1 55 THR MG . . 4.100 3.266 2.327 3.880 . 0 0 "[ . 1 . 2]" 1 1213 1 55 THR H 1 56 GLU H . . 3.070 2.289 1.967 2.429 . 0 0 "[ . 1 . 2]" 1 1214 1 55 THR HA 1 55 THR MG . . 2.900 2.343 2.249 2.442 . 0 0 "[ . 1 . 2]" 1 1215 1 55 THR HB 1 56 GLU H . . 4.630 3.283 2.650 3.974 . 0 0 "[ . 1 . 2]" 1 1216 1 55 THR MG 1 56 GLU H . . 4.480 3.845 3.483 4.111 . 0 0 "[ . 1 . 2]" 1 1217 1 56 GLU H 1 56 GLU HB2 . . 4.120 2.585 2.396 2.875 . 0 0 "[ . 1 . 2]" 1 1218 1 56 GLU H 1 56 GLU QB . . 3.530 2.487 2.361 2.599 . 0 0 "[ . 1 . 2]" 1 1219 1 56 GLU H 1 56 GLU HB3 . . 4.120 3.452 2.896 3.714 . 0 0 "[ . 1 . 2]" 1 1220 1 56 GLU H 1 56 GLU QG . . 4.900 3.767 3.337 4.270 . 0 0 "[ . 1 . 2]" 1 1221 1 56 GLU H 1 57 LYS H . . 4.680 4.457 4.403 4.499 . 0 0 "[ . 1 . 2]" 1 1222 1 56 GLU H 1 60 HIS HE1 . . 4.430 4.275 4.013 4.432 0.002 10 0 "[ . 1 . 2]" 1 1223 1 56 GLU HA 1 57 LYS H . . 2.790 2.402 2.269 2.558 . 0 0 "[ . 1 . 2]" 1 1224 1 56 GLU HA 1 57 LYS QB . . 4.960 4.320 4.178 4.643 . 0 0 "[ . 1 . 2]" 1 1225 1 56 GLU HA 1 57 LYS QG . . 5.000 4.081 3.431 4.368 . 0 0 "[ . 1 . 2]" 1 1226 1 56 GLU QB 1 57 LYS H . . 3.300 2.624 2.114 3.303 0.003 13 0 "[ . 1 . 2]" 1 1227 1 56 GLU QB 1 60 HIS HE1 . . 4.360 3.982 3.715 4.292 . 0 0 "[ . 1 . 2]" 1 1228 1 56 GLU HB2 1 57 LYS H . . 4.120 3.888 3.603 4.115 . 0 0 "[ . 1 . 2]" 1 1229 1 56 GLU HB3 1 57 LYS H . . 4.120 2.687 2.129 3.481 . 0 0 "[ . 1 . 2]" 1 1230 1 56 GLU QG 1 57 LYS H . . 3.800 3.184 1.969 3.803 0.003 11 0 "[ . 1 . 2]" 1 1231 1 57 LYS H 1 57 LYS QB . . 2.970 2.660 2.501 2.797 . 0 0 "[ . 1 . 2]" 1 1232 1 57 LYS H 1 57 LYS QD . . 3.680 3.538 3.144 3.720 0.040 13 0 "[ . 1 . 2]" 1 1233 1 57 LYS H 1 57 LYS QE . . 5.340 4.183 2.574 4.929 . 0 0 "[ . 1 . 2]" 1 1234 1 57 LYS H 1 57 LYS HG2 . . 3.780 2.186 1.894 3.709 . 0 0 "[ . 1 . 2]" 1 1235 1 57 LYS H 1 57 LYS QG . . 3.280 2.022 1.885 2.217 . 0 0 "[ . 1 . 2]" 1 1236 1 57 LYS H 1 57 LYS HG3 . . 3.780 3.305 2.117 3.646 . 0 0 "[ . 1 . 2]" 1 1237 1 57 LYS H 1 58 GLY H . . 4.620 4.564 4.492 4.621 0.001 10 0 "[ . 1 . 2]" 1 1238 1 57 LYS H 1 80 VAL MG1 . . 4.650 4.436 4.160 4.649 . 0 0 "[ . 1 . 2]" 1 1239 1 57 LYS HA 1 57 LYS HG2 . . 4.130 3.597 2.914 3.713 . 0 0 "[ . 1 . 2]" 1 1240 1 57 LYS HA 1 57 LYS QG . . 3.600 3.264 2.559 3.343 . 0 0 "[ . 1 . 2]" 1 1241 1 57 LYS HA 1 57 LYS HG3 . . 4.130 3.746 2.834 3.963 . 0 0 "[ . 1 . 2]" 1 1242 1 57 LYS HA 1 58 GLY H . . 3.110 2.304 2.160 2.522 . 0 0 "[ . 1 . 2]" 1 1243 1 57 LYS HA 1 58 GLY HA3 . . 4.830 4.389 4.360 4.460 . 0 0 "[ . 1 . 2]" 1 1244 1 57 LYS HA 1 60 HIS HE1 . . 4.500 3.191 2.963 3.502 . 0 0 "[ . 1 . 2]" 1 1245 1 57 LYS HA 1 80 VAL H . . 4.180 3.987 3.845 4.124 . 0 0 "[ . 1 . 2]" 1 1246 1 57 LYS HA 1 80 VAL HB . . 3.500 2.117 1.997 2.370 . 0 0 "[ . 1 . 2]" 1 1247 1 57 LYS HA 1 80 VAL MG1 . . 3.380 2.481 2.150 2.750 . 0 0 "[ . 1 . 2]" 1 1248 1 57 LYS HA 1 80 VAL MG2 . . 4.090 3.729 3.584 4.011 . 0 0 "[ . 1 . 2]" 1 1249 1 57 LYS QB 1 57 LYS HE2 . . 4.340 3.700 2.089 4.252 . 0 0 "[ . 1 . 2]" 1 1250 1 57 LYS QB 1 57 LYS QE . . 3.810 3.188 1.954 3.663 . 0 0 "[ . 1 . 2]" 1 1251 1 57 LYS QB 1 57 LYS HE3 . . 4.340 3.673 1.972 4.249 . 0 0 "[ . 1 . 2]" 1 1252 1 57 LYS QB 1 58 GLY H . . 3.350 2.701 2.199 3.167 . 0 0 "[ . 1 . 2]" 1 1253 1 57 LYS QB 1 80 VAL HB . . 4.330 3.640 3.428 3.878 . 0 0 "[ . 1 . 2]" 1 1254 1 57 LYS QB 1 80 VAL MG1 . . 3.740 3.229 2.886 3.707 . 0 0 "[ . 1 . 2]" 1 1255 1 57 LYS QB 1 82 ALA H . . 4.720 3.973 3.494 4.415 . 0 0 "[ . 1 . 2]" 1 1256 1 57 LYS QB 1 82 ALA HA . . 5.370 4.701 4.251 5.340 . 0 0 "[ . 1 . 2]" 1 1257 1 57 LYS QD 1 81 ASP HA . . 4.560 3.860 3.341 4.530 . 0 0 "[ . 1 . 2]" 1 1258 1 57 LYS QD 1 82 ALA H . . 4.360 3.911 3.309 4.335 . 0 0 "[ . 1 . 2]" 1 1259 1 57 LYS QE 1 57 LYS QG . . 3.170 2.265 2.046 2.656 . 0 0 "[ . 1 . 2]" 1 1260 1 57 LYS QG 1 58 GLY H . . 4.160 3.765 3.280 4.072 . 0 0 "[ . 1 . 2]" 1 1261 1 57 LYS HG2 1 58 GLY H . . 4.850 4.604 4.152 4.841 . 0 0 "[ . 1 . 2]" 1 1262 1 57 LYS HG3 1 58 GLY H . . 4.850 4.033 3.425 4.705 . 0 0 "[ . 1 . 2]" 1 1263 1 58 GLY H 1 59 LEU H . . 4.600 4.420 4.355 4.509 . 0 0 "[ . 1 . 2]" 1 1264 1 58 GLY H 1 60 HIS HE1 . . 4.560 3.318 2.663 3.709 . 0 0 "[ . 1 . 2]" 1 1265 1 58 GLY H 1 79 TYR QE . . 4.860 3.978 3.640 4.409 . 0 0 "[ . 1 . 2]" 1 1266 1 58 GLY H 1 80 VAL H . . 3.730 2.440 2.262 2.748 . 0 0 "[ . 1 . 2]" 1 1267 1 58 GLY H 1 80 VAL HA . . 4.930 4.426 4.250 4.746 . 0 0 "[ . 1 . 2]" 1 1268 1 58 GLY H 1 80 VAL HB . . 3.390 2.438 2.076 2.947 . 0 0 "[ . 1 . 2]" 1 1269 1 58 GLY H 1 80 VAL MG1 . . 4.020 3.748 3.497 4.011 . 0 0 "[ . 1 . 2]" 1 1270 1 58 GLY H 1 80 VAL MG2 . . 4.260 3.737 3.251 4.222 . 0 0 "[ . 1 . 2]" 1 1271 1 58 GLY HA2 1 59 LEU H . . 3.170 2.558 2.445 2.664 . 0 0 "[ . 1 . 2]" 1 1272 1 58 GLY HA2 1 59 LEU HB3 . . 5.380 5.270 5.184 5.338 . 0 0 "[ . 1 . 2]" 1 1273 1 58 GLY HA2 1 79 TYR QD . . 5.020 3.445 3.232 3.641 . 0 0 "[ . 1 . 2]" 1 1274 1 58 GLY HA2 1 79 TYR QE . . 4.380 2.240 2.029 2.403 . 0 0 "[ . 1 . 2]" 1 1275 1 58 GLY HA2 1 80 VAL H . . 4.810 3.834 3.647 4.034 . 0 0 "[ . 1 . 2]" 1 1276 1 58 GLY HA3 1 59 LEU H . . 3.340 2.570 2.467 2.688 . 0 0 "[ . 1 . 2]" 1 1277 1 58 GLY HA3 1 59 LEU HB2 . . 5.050 4.874 4.804 4.978 . 0 0 "[ . 1 . 2]" 1 1278 1 58 GLY HA3 1 79 TYR QD . . 4.970 4.631 4.482 4.828 . 0 0 "[ . 1 . 2]" 1 1279 1 58 GLY HA3 1 79 TYR QE . . 3.860 3.695 3.527 3.842 . 0 0 "[ . 1 . 2]" 1 1280 1 58 GLY HA3 1 80 VAL H . . 4.660 4.535 4.413 4.608 . 0 0 "[ . 1 . 2]" 1 1281 1 59 LEU H 1 59 LEU HB2 . . 3.340 2.338 2.246 2.482 . 0 0 "[ . 1 . 2]" 1 1282 1 59 LEU H 1 59 LEU HB3 . . 3.190 2.756 2.702 2.829 . 0 0 "[ . 1 . 2]" 1 1283 1 59 LEU H 1 59 LEU MD1 . . 3.920 3.811 3.643 3.893 . 0 0 "[ . 1 . 2]" 1 1284 1 59 LEU H 1 59 LEU MD2 . . 4.370 4.252 4.206 4.353 . 0 0 "[ . 1 . 2]" 1 1285 1 59 LEU H 1 59 LEU HG . . 4.630 4.559 4.523 4.593 . 0 0 "[ . 1 . 2]" 1 1286 1 59 LEU H 1 60 HIS H . . 4.660 4.512 4.441 4.580 . 0 0 "[ . 1 . 2]" 1 1287 1 59 LEU H 1 79 TYR HA . . 4.630 4.410 4.176 4.605 . 0 0 "[ . 1 . 2]" 1 1288 1 59 LEU H 1 79 TYR QD . . 4.410 3.101 2.868 3.335 . 0 0 "[ . 1 . 2]" 1 1289 1 59 LEU H 1 79 TYR QE . . 4.300 2.855 2.593 3.241 . 0 0 "[ . 1 . 2]" 1 1290 1 59 LEU HA 1 59 LEU MD1 . . 3.400 2.155 1.971 2.345 . 0 0 "[ . 1 . 2]" 1 1291 1 59 LEU HA 1 59 LEU MD2 . . 4.250 3.843 3.823 3.864 . 0 0 "[ . 1 . 2]" 1 1292 1 59 LEU HA 1 59 LEU HG . . 4.260 2.801 2.643 2.922 . 0 0 "[ . 1 . 2]" 1 1293 1 59 LEU HA 1 60 HIS H . . 3.010 2.152 2.139 2.182 . 0 0 "[ . 1 . 2]" 1 1294 1 59 LEU HA 1 60 HIS HD1 . . 4.990 3.322 3.051 3.684 . 0 0 "[ . 1 . 2]" 1 1295 1 59 LEU HA 1 78 PHE H . . 4.640 4.246 3.821 4.458 . 0 0 "[ . 1 . 2]" 1 1296 1 59 LEU HA 1 79 TYR HA . . 3.720 2.387 2.114 2.556 . 0 0 "[ . 1 . 2]" 1 1297 1 59 LEU HA 1 79 TYR QD . . 3.920 2.675 2.478 2.817 . 0 0 "[ . 1 . 2]" 1 1298 1 59 LEU HA 1 80 VAL H . . 3.960 3.815 3.541 3.958 . 0 0 "[ . 1 . 2]" 1 1299 1 59 LEU HB2 1 59 LEU MD1 . . 3.480 2.248 2.132 2.359 . 0 0 "[ . 1 . 2]" 1 1300 1 59 LEU HB2 1 59 LEU MD2 . . 3.350 2.449 2.314 2.569 . 0 0 "[ . 1 . 2]" 1 1301 1 59 LEU HB2 1 60 HIS H . . 4.760 4.383 4.283 4.480 . 0 0 "[ . 1 . 2]" 1 1302 1 59 LEU HB2 1 79 TYR QD . . 3.750 2.625 2.257 2.804 . 0 0 "[ . 1 . 2]" 1 1303 1 59 LEU HB2 1 79 TYR QE . . 4.060 3.498 3.292 3.644 . 0 0 "[ . 1 . 2]" 1 1304 1 59 LEU HB3 1 59 LEU MD1 . . 3.500 3.178 3.159 3.194 . 0 0 "[ . 1 . 2]" 1 1305 1 59 LEU HB3 1 59 LEU MD2 . . 3.230 2.204 2.060 2.382 . 0 0 "[ . 1 . 2]" 1 1306 1 59 LEU HB3 1 60 HIS H . . 4.080 3.996 3.861 4.081 0.001 3 0 "[ . 1 . 2]" 1 1307 1 59 LEU HB3 1 79 TYR QD . . 4.280 4.177 3.907 4.283 0.003 12 0 "[ . 1 . 2]" 1 1308 1 59 LEU HB3 1 79 TYR QE . . 5.020 4.895 4.611 5.020 0.000 9 0 "[ . 1 . 2]" 1 1309 1 59 LEU MD1 1 60 HIS H . . 3.390 3.166 2.710 3.373 . 0 0 "[ . 1 . 2]" 1 1310 1 59 LEU MD1 1 77 GLN HA . . 4.540 4.074 3.779 4.542 0.002 15 0 "[ . 1 . 2]" 1 1311 1 59 LEU MD1 1 77 GLN QB . . 3.340 2.586 2.329 2.907 . 0 0 "[ . 1 . 2]" 1 1312 1 59 LEU MD1 1 78 PHE H . . 3.720 3.159 2.824 3.513 . 0 0 "[ . 1 . 2]" 1 1313 1 59 LEU MD1 1 79 TYR H . . 4.260 3.397 2.812 3.878 . 0 0 "[ . 1 . 2]" 1 1314 1 59 LEU MD1 1 79 TYR HA . . 4.100 2.833 2.320 3.171 . 0 0 "[ . 1 . 2]" 1 1315 1 59 LEU MD1 1 79 TYR HB2 . . 4.450 2.581 2.164 2.856 . 0 0 "[ . 1 . 2]" 1 1316 1 59 LEU MD1 1 79 TYR QB . . 3.670 2.551 2.147 2.814 . 0 0 "[ . 1 . 2]" 1 1317 1 59 LEU MD1 1 79 TYR HB3 . . 4.450 4.006 3.588 4.297 . 0 0 "[ . 1 . 2]" 1 1318 1 59 LEU MD1 1 79 TYR QD . . 3.430 2.242 2.076 2.429 . 0 0 "[ . 1 . 2]" 1 1319 1 59 LEU MD1 1 79 TYR QE . . 4.350 4.114 3.896 4.235 . 0 0 "[ . 1 . 2]" 1 1320 1 59 LEU MD2 1 60 HIS H . . 4.750 4.510 4.300 4.731 . 0 0 "[ . 1 . 2]" 1 1321 1 59 LEU MD2 1 77 GLN HE21 . . 4.170 3.062 2.069 4.093 . 0 0 "[ . 1 . 2]" 1 1322 1 59 LEU MD2 1 77 GLN HE22 . . 4.170 3.071 1.983 3.725 . 0 0 "[ . 1 . 2]" 1 1323 1 59 LEU HG 1 60 HIS H . . 4.290 2.993 2.768 3.287 . 0 0 "[ . 1 . 2]" 1 1324 1 59 LEU HG 1 79 TYR HA . . 5.200 4.722 4.279 4.973 . 0 0 "[ . 1 . 2]" 1 1325 1 60 HIS H 1 60 HIS HB2 . . 4.200 2.519 2.439 2.611 . 0 0 "[ . 1 . 2]" 1 1326 1 60 HIS H 1 60 HIS QB . . 3.330 2.480 2.405 2.565 . 0 0 "[ . 1 . 2]" 1 1327 1 60 HIS H 1 60 HIS HB3 . . 4.200 3.704 3.658 3.761 . 0 0 "[ . 1 . 2]" 1 1328 1 60 HIS H 1 60 HIS HD1 . . 3.820 2.724 2.348 3.151 . 0 0 "[ . 1 . 2]" 1 1329 1 60 HIS H 1 61 GLN H . . 4.560 4.494 4.415 4.540 . 0 0 "[ . 1 . 2]" 1 1330 1 60 HIS H 1 77 GLN HA . . 5.500 4.516 4.316 4.810 . 0 0 "[ . 1 . 2]" 1 1331 1 60 HIS H 1 78 PHE H . . 3.780 3.010 2.710 3.191 . 0 0 "[ . 1 . 2]" 1 1332 1 60 HIS H 1 78 PHE QB . . 5.500 4.950 4.757 5.109 . 0 0 "[ . 1 . 2]" 1 1333 1 60 HIS H 1 78 PHE QD . . 4.860 4.225 4.008 4.415 . 0 0 "[ . 1 . 2]" 1 1334 1 60 HIS H 1 78 PHE QE . . 4.830 4.514 4.294 4.832 0.002 3 0 "[ . 1 . 2]" 1 1335 1 60 HIS H 1 79 TYR HA . . 3.660 3.463 3.269 3.666 0.006 15 0 "[ . 1 . 2]" 1 1336 1 60 HIS H 1 79 TYR QB . . 5.340 5.072 4.750 5.342 0.002 9 0 "[ . 1 . 2]" 1 1337 1 60 HIS H 1 79 TYR QD . . 4.900 4.716 4.503 4.883 . 0 0 "[ . 1 . 2]" 1 1338 1 60 HIS H 1 80 VAL H . . 4.780 4.695 4.498 4.780 . 0 0 "[ . 1 . 2]" 1 1339 1 60 HIS HA 1 60 HIS HD2 . . 4.940 3.720 3.496 3.911 . 0 0 "[ . 1 . 2]" 1 1340 1 60 HIS HA 1 61 GLN H . . 3.330 2.309 2.204 2.437 . 0 0 "[ . 1 . 2]" 1 1341 1 60 HIS QB 1 61 GLN H . . 3.830 2.647 2.331 2.962 . 0 0 "[ . 1 . 2]" 1 1342 1 60 HIS QB 1 78 PHE H . . 4.160 3.791 3.471 3.973 . 0 0 "[ . 1 . 2]" 1 1343 1 60 HIS QB 1 78 PHE QE . . 3.820 2.710 2.484 3.203 . 0 0 "[ . 1 . 2]" 1 1344 1 60 HIS QB 1 78 PHE HZ . . 4.210 2.575 2.237 3.198 . 0 0 "[ . 1 . 2]" 1 1345 1 60 HIS HB2 1 78 PHE HZ . . 4.940 2.910 2.655 3.373 . 0 0 "[ . 1 . 2]" 1 1346 1 60 HIS HB3 1 78 PHE HZ . . 4.940 2.938 2.374 4.024 . 0 0 "[ . 1 . 2]" 1 1347 1 60 HIS HD1 1 80 VAL H . . 4.290 3.405 3.142 3.708 . 0 0 "[ . 1 . 2]" 1 1348 1 60 HIS HD1 1 80 VAL HB . . 4.800 3.603 3.217 3.887 . 0 0 "[ . 1 . 2]" 1 1349 1 60 HIS HD1 1 80 VAL MG2 . . 4.040 2.436 2.047 2.767 . 0 0 "[ . 1 . 2]" 1 1350 1 60 HIS HD2 1 61 GLN H . . 4.690 4.413 4.102 4.681 . 0 0 "[ . 1 . 2]" 1 1351 1 60 HIS HE1 1 80 VAL H . . 4.730 4.095 3.731 4.699 . 0 0 "[ . 1 . 2]" 1 1352 1 60 HIS HE1 1 80 VAL HB . . 3.800 2.772 2.325 3.351 . 0 0 "[ . 1 . 2]" 1 1353 1 60 HIS HE1 1 80 VAL MG1 . . 4.450 3.843 3.532 4.191 . 0 0 "[ . 1 . 2]" 1 1354 1 60 HIS HE1 1 80 VAL MG2 . . 3.890 2.813 2.397 3.326 . 0 0 "[ . 1 . 2]" 1 1355 1 61 GLN H 1 61 GLN HB2 . . 3.990 2.737 2.553 2.891 . 0 0 "[ . 1 . 2]" 1 1356 1 61 GLN H 1 61 GLN HB3 . . 3.160 2.773 2.631 2.934 . 0 0 "[ . 1 . 2]" 1 1357 1 61 GLN H 1 61 GLN QG . . 4.610 4.097 4.022 4.179 . 0 0 "[ . 1 . 2]" 1 1358 1 61 GLN H 1 62 MET H . . 4.900 4.329 4.154 4.422 . 0 0 "[ . 1 . 2]" 1 1359 1 61 GLN H 1 62 MET HA . . 5.390 4.969 4.774 5.092 . 0 0 "[ . 1 . 2]" 1 1360 1 61 GLN HA 1 61 GLN QG . . 3.570 2.388 2.195 2.836 . 0 0 "[ . 1 . 2]" 1 1361 1 61 GLN HA 1 62 MET H . . 2.950 2.144 2.139 2.176 . 0 0 "[ . 1 . 2]" 1 1362 1 61 GLN HA 1 62 MET HB2 . . 4.790 4.709 4.595 4.782 . 0 0 "[ . 1 . 2]" 1 1363 1 61 GLN HA 1 62 MET HB3 . . 4.790 4.471 4.389 4.531 . 0 0 "[ . 1 . 2]" 1 1364 1 61 GLN HA 1 77 GLN HA . . 3.510 3.311 2.657 3.511 0.001 13 0 "[ . 1 . 2]" 1 1365 1 61 GLN HA 1 77 GLN QG . . 4.730 3.851 3.294 4.735 0.005 15 0 "[ . 1 . 2]" 1 1366 1 61 GLN HA 1 78 PHE H . . 4.530 4.442 4.272 4.533 0.003 14 0 "[ . 1 . 2]" 1 1367 1 61 GLN HB2 1 61 GLN QE . . 4.440 3.598 2.441 4.358 . 0 0 "[ . 1 . 2]" 1 1368 1 61 GLN HB2 1 62 MET H . . 4.530 4.424 4.307 4.518 . 0 0 "[ . 1 . 2]" 1 1369 1 61 GLN HB3 1 61 GLN QE . . 4.440 3.522 2.096 4.102 . 0 0 "[ . 1 . 2]" 1 1370 1 61 GLN HB3 1 62 MET H . . 4.470 4.118 3.888 4.207 . 0 0 "[ . 1 . 2]" 1 1371 1 61 GLN HB3 1 62 MET HA . . 4.780 4.623 4.486 4.734 . 0 0 "[ . 1 . 2]" 1 1372 1 61 GLN QE 1 61 GLN QG . . 3.090 2.172 2.067 2.455 . 0 0 "[ . 1 . 2]" 1 1373 1 61 GLN QG 1 62 MET H . . 3.570 2.992 2.792 3.206 . 0 0 "[ . 1 . 2]" 1 1374 1 61 GLN QG 1 62 MET HA . . 5.340 4.356 4.010 5.069 . 0 0 "[ . 1 . 2]" 1 1375 1 61 GLN QG 1 77 GLN HA . . 5.340 4.615 3.973 5.248 . 0 0 "[ . 1 . 2]" 1 1376 1 62 MET H 1 62 MET HB2 . . 3.560 3.136 3.047 3.235 . 0 0 "[ . 1 . 2]" 1 1377 1 62 MET H 1 62 MET QB . . 3.110 2.405 2.357 2.498 . 0 0 "[ . 1 . 2]" 1 1378 1 62 MET H 1 62 MET HB3 . . 3.560 2.499 2.440 2.599 . 0 0 "[ . 1 . 2]" 1 1379 1 62 MET H 1 62 MET HG2 . . 4.980 4.278 4.181 4.349 . 0 0 "[ . 1 . 2]" 1 1380 1 62 MET H 1 62 MET HG3 . . 4.990 4.670 4.615 4.728 . 0 0 "[ . 1 . 2]" 1 1381 1 62 MET H 1 63 GLY H . . 4.560 4.322 4.176 4.421 . 0 0 "[ . 1 . 2]" 1 1382 1 62 MET H 1 76 LEU H . . 3.820 2.941 2.596 3.245 . 0 0 "[ . 1 . 2]" 1 1383 1 62 MET H 1 76 LEU MD1 . . 4.360 3.345 2.871 3.702 . 0 0 "[ . 1 . 2]" 1 1384 1 62 MET H 1 78 PHE QE . . 4.250 3.361 2.894 4.230 . 0 0 "[ . 1 . 2]" 1 1385 1 62 MET HA 1 62 MET ME . . 4.560 3.782 3.611 3.999 . 0 0 "[ . 1 . 2]" 1 1386 1 62 MET HA 1 62 MET HG2 . . 4.140 3.263 3.167 3.383 . 0 0 "[ . 1 . 2]" 1 1387 1 62 MET HA 1 62 MET HG3 . . 3.830 2.665 2.579 2.747 . 0 0 "[ . 1 . 2]" 1 1388 1 62 MET HA 1 63 GLY H . . 2.860 2.150 2.144 2.191 . 0 0 "[ . 1 . 2]" 1 1389 1 62 MET HA 1 63 GLY HA3 . . 4.660 4.375 4.335 4.398 . 0 0 "[ . 1 . 2]" 1 1390 1 62 MET HA 1 76 LEU H . . 5.180 4.666 4.464 4.767 . 0 0 "[ . 1 . 2]" 1 1391 1 62 MET QB 1 76 LEU MD1 . . 2.900 2.056 1.927 2.265 . 0 0 "[ . 1 . 2]" 1 1392 1 62 MET QB 1 78 PHE QD . . 3.630 3.377 3.031 3.611 . 0 0 "[ . 1 . 2]" 1 1393 1 62 MET QB 1 78 PHE QE . . 3.380 2.243 2.015 2.374 . 0 0 "[ . 1 . 2]" 1 1394 1 62 MET HB2 1 62 MET ME . . 3.480 2.207 2.044 2.418 . 0 0 "[ . 1 . 2]" 1 1395 1 62 MET HB2 1 63 GLY H . . 4.550 4.212 4.077 4.305 . 0 0 "[ . 1 . 2]" 1 1396 1 62 MET HB2 1 78 PHE QD . . 4.150 3.977 3.488 4.154 0.004 16 0 "[ . 1 . 2]" 1 1397 1 62 MET HB2 1 78 PHE QE . . 3.980 2.310 2.056 2.452 . 0 0 "[ . 1 . 2]" 1 1398 1 62 MET HB3 1 62 MET ME . . 3.480 3.237 2.810 3.377 . 0 0 "[ . 1 . 2]" 1 1399 1 62 MET HB3 1 63 GLY H . . 4.550 4.344 4.140 4.440 . 0 0 "[ . 1 . 2]" 1 1400 1 62 MET HB3 1 78 PHE QD . . 4.150 3.657 3.330 3.982 . 0 0 "[ . 1 . 2]" 1 1401 1 62 MET HB3 1 78 PHE QE . . 3.980 3.055 2.723 3.247 . 0 0 "[ . 1 . 2]" 1 1402 1 62 MET ME 1 62 MET HG3 . . 3.670 2.363 2.226 2.518 . 0 0 "[ . 1 . 2]" 1 1403 1 62 MET ME 1 78 PHE QD . . 4.620 4.222 3.525 4.570 . 0 0 "[ . 1 . 2]" 1 1404 1 62 MET ME 1 78 PHE QE . . 3.450 3.127 2.468 3.451 0.001 16 0 "[ . 1 . 2]" 1 1405 1 62 MET ME 1 78 PHE HZ . . 3.750 3.276 2.652 3.689 . 0 0 "[ . 1 . 2]" 1 1406 1 62 MET HG2 1 63 GLY H . . 3.650 3.410 3.044 3.642 . 0 0 "[ . 1 . 2]" 1 1407 1 62 MET HG2 1 64 ILE MD . . 3.710 2.693 2.264 3.060 . 0 0 "[ . 1 . 2]" 1 1408 1 62 MET HG2 1 64 ILE HG12 . . 4.210 2.614 2.330 2.853 . 0 0 "[ . 1 . 2]" 1 1409 1 62 MET HG2 1 64 ILE HG13 . . 4.210 3.877 3.614 4.015 . 0 0 "[ . 1 . 2]" 1 1410 1 62 MET HG2 1 76 LEU MD1 . . 4.750 3.672 3.317 4.002 . 0 0 "[ . 1 . 2]" 1 1411 1 62 MET HG2 1 76 LEU MD2 . . 4.930 3.198 2.775 3.632 . 0 0 "[ . 1 . 2]" 1 1412 1 62 MET HG2 1 78 PHE QE . . 5.240 5.073 4.658 5.223 . 0 0 "[ . 1 . 2]" 1 1413 1 62 MET HG3 1 63 GLY H . . 3.660 3.196 2.729 3.427 . 0 0 "[ . 1 . 2]" 1 1414 1 62 MET HG3 1 64 ILE MD . . 4.070 2.677 2.440 2.970 . 0 0 "[ . 1 . 2]" 1 1415 1 62 MET HG3 1 64 ILE HG12 . . 4.880 3.788 3.326 4.159 . 0 0 "[ . 1 . 2]" 1 1416 1 62 MET HG3 1 64 ILE QG . . 4.110 3.645 3.246 3.935 . 0 0 "[ . 1 . 2]" 1 1417 1 62 MET HG3 1 64 ILE HG13 . . 4.880 4.760 4.532 4.857 . 0 0 "[ . 1 . 2]" 1 1418 1 62 MET HG3 1 76 LEU MD1 . . 4.780 4.278 3.994 4.634 . 0 0 "[ . 1 . 2]" 1 1419 1 62 MET HG3 1 76 LEU MD2 . . 5.160 4.363 3.982 4.885 . 0 0 "[ . 1 . 2]" 1 1420 1 62 MET HG3 1 76 LEU HG . . 4.550 4.377 4.076 4.506 . 0 0 "[ . 1 . 2]" 1 1421 1 62 MET HG3 1 78 PHE QE . . 4.800 4.675 4.397 4.796 . 0 0 "[ . 1 . 2]" 1 1422 1 63 GLY H 1 64 ILE H . . 4.580 4.174 4.016 4.295 . 0 0 "[ . 1 . 2]" 1 1423 1 63 GLY H 1 75 PRO HB2 . . 5.130 5.107 4.996 5.139 0.009 18 0 "[ . 1 . 2]" 1 1424 1 63 GLY H 1 75 PRO HB3 . . 4.390 4.264 4.123 4.368 . 0 0 "[ . 1 . 2]" 1 1425 1 63 GLY HA2 1 64 ILE H . . 3.450 2.154 2.142 2.176 . 0 0 "[ . 1 . 2]" 1 1426 1 63 GLY HA2 1 70 HIS HE1 . . 3.970 3.899 3.702 3.975 0.005 3 0 "[ . 1 . 2]" 1 1427 1 63 GLY HA2 1 74 SER HG . . 4.620 3.127 3.030 3.207 . 0 0 "[ . 1 . 2]" 1 1428 1 63 GLY HA2 1 75 PRO HA . . 3.820 2.235 2.122 2.426 . 0 0 "[ . 1 . 2]" 1 1429 1 63 GLY HA2 1 75 PRO HB2 . . 4.930 3.597 3.439 3.716 . 0 0 "[ . 1 . 2]" 1 1430 1 63 GLY HA2 1 75 PRO HB3 . . 4.260 2.279 2.212 2.399 . 0 0 "[ . 1 . 2]" 1 1431 1 63 GLY HA2 1 76 LEU H . . 4.180 3.781 3.580 3.959 . 0 0 "[ . 1 . 2]" 1 1432 1 63 GLY HA3 1 64 ILE HA . . 4.900 4.601 4.575 4.619 . 0 0 "[ . 1 . 2]" 1 1433 1 63 GLY HA3 1 70 HIS HE1 . . 3.670 3.561 3.427 3.674 0.004 9 0 "[ . 1 . 2]" 1 1434 1 63 GLY HA3 1 74 SER HG . . 4.630 4.275 4.150 4.393 . 0 0 "[ . 1 . 2]" 1 1435 1 63 GLY HA3 1 75 PRO HA . . 4.240 3.866 3.751 4.101 . 0 0 "[ . 1 . 2]" 1 1436 1 63 GLY HA3 1 75 PRO HB2 . . 4.700 4.416 4.294 4.578 . 0 0 "[ . 1 . 2]" 1 1437 1 63 GLY HA3 1 75 PRO HB3 . . 4.500 2.883 2.752 3.024 . 0 0 "[ . 1 . 2]" 1 1438 1 64 ILE H 1 64 ILE HB . . 3.990 2.610 2.554 2.676 . 0 0 "[ . 1 . 2]" 1 1439 1 64 ILE H 1 64 ILE MD . . 4.500 3.251 2.759 3.618 . 0 0 "[ . 1 . 2]" 1 1440 1 64 ILE H 1 64 ILE HG12 . . 4.540 2.388 2.249 2.497 . 0 0 "[ . 1 . 2]" 1 1441 1 64 ILE H 1 64 ILE HG13 . . 4.540 3.837 3.716 3.937 . 0 0 "[ . 1 . 2]" 1 1442 1 64 ILE H 1 64 ILE MG . . 4.560 3.823 3.805 3.840 . 0 0 "[ . 1 . 2]" 1 1443 1 64 ILE H 1 65 LYS H . . 4.710 4.557 4.520 4.573 . 0 0 "[ . 1 . 2]" 1 1444 1 64 ILE H 1 70 HIS HE1 . . 4.680 4.635 4.503 4.687 0.007 15 0 "[ . 1 . 2]" 1 1445 1 64 ILE H 1 71 ILE H . . 5.300 5.272 5.194 5.303 0.003 12 0 "[ . 1 . 2]" 1 1446 1 64 ILE H 1 71 ILE HG12 . . 4.600 3.764 3.657 3.883 . 0 0 "[ . 1 . 2]" 1 1447 1 64 ILE H 1 74 SER HB2 . . 4.290 2.445 1.928 2.741 . 0 0 "[ . 1 . 2]" 1 1448 1 64 ILE H 1 74 SER HB3 . . 4.120 3.095 2.995 3.308 . 0 0 "[ . 1 . 2]" 1 1449 1 64 ILE H 1 74 SER HG . . 3.450 2.386 2.046 2.540 . 0 0 "[ . 1 . 2]" 1 1450 1 64 ILE H 1 75 PRO HA . . 4.470 3.016 2.843 3.146 . 0 0 "[ . 1 . 2]" 1 1451 1 64 ILE HA 1 64 ILE MD . . 3.640 2.152 2.049 2.266 . 0 0 "[ . 1 . 2]" 1 1452 1 64 ILE HA 1 64 ILE MG . . 3.380 2.267 2.204 2.346 . 0 0 "[ . 1 . 2]" 1 1453 1 64 ILE HA 1 65 LYS H . . 2.770 2.323 2.174 2.424 . 0 0 "[ . 1 . 2]" 1 1454 1 64 ILE HB 1 64 ILE MD . . 3.260 3.221 3.192 3.230 . 0 0 "[ . 1 . 2]" 1 1455 1 64 ILE HB 1 65 LYS H . . 4.260 3.646 3.432 4.053 . 0 0 "[ . 1 . 2]" 1 1456 1 64 ILE HB 1 71 ILE H . . 4.950 4.144 4.052 4.354 . 0 0 "[ . 1 . 2]" 1 1457 1 64 ILE HB 1 71 ILE MD . . 3.270 1.959 1.895 2.072 . 0 0 "[ . 1 . 2]" 1 1458 1 64 ILE HB 1 71 ILE HG12 . . 3.650 2.015 1.996 2.105 . 0 0 "[ . 1 . 2]" 1 1459 1 64 ILE HB 1 71 ILE HG13 . . 4.100 3.281 3.076 3.401 . 0 0 "[ . 1 . 2]" 1 1460 1 64 ILE HB 1 71 ILE MG . . 4.640 3.103 2.942 3.430 . 0 0 "[ . 1 . 2]" 1 1461 1 64 ILE HB 1 74 SER HB2 . . 4.730 2.946 2.767 3.206 . 0 0 "[ . 1 . 2]" 1 1462 1 64 ILE HB 1 74 SER HB3 . . 4.330 2.752 2.448 3.016 . 0 0 "[ . 1 . 2]" 1 1463 1 64 ILE MD 1 64 ILE MG . . 2.780 2.045 1.931 2.353 . 0 0 "[ . 1 . 2]" 1 1464 1 64 ILE MD 1 65 LYS H . . 3.790 3.598 3.434 3.770 . 0 0 "[ . 1 . 2]" 1 1465 1 64 ILE QG 1 71 ILE MD . . 3.410 2.508 2.427 2.761 . 0 0 "[ . 1 . 2]" 1 1466 1 64 ILE HG12 1 64 ILE MG . . 3.440 3.188 3.141 3.200 . 0 0 "[ . 1 . 2]" 1 1467 1 64 ILE HG12 1 71 ILE MD . . 4.230 3.223 2.874 3.520 . 0 0 "[ . 1 . 2]" 1 1468 1 64 ILE HG13 1 64 ILE MG . . 3.440 2.268 2.090 2.426 . 0 0 "[ . 1 . 2]" 1 1469 1 64 ILE HG13 1 71 ILE MD . . 4.230 2.623 2.504 2.918 . 0 0 "[ . 1 . 2]" 1 1470 1 64 ILE MG 1 65 LYS H . . 3.290 1.933 1.757 2.478 . 0 0 "[ . 1 . 2]" 1 1471 1 64 ILE MG 1 65 LYS HA . . 4.500 3.536 3.399 3.740 . 0 0 "[ . 1 . 2]" 1 1472 1 64 ILE MG 1 71 ILE H . . 4.610 3.940 3.797 4.302 . 0 0 "[ . 1 . 2]" 1 1473 1 64 ILE MG 1 71 ILE HB . . 5.400 4.104 3.892 4.348 . 0 0 "[ . 1 . 2]" 1 1474 1 64 ILE MG 1 71 ILE MD . . 3.000 1.965 1.885 2.076 . 0 0 "[ . 1 . 2]" 1 1475 1 64 ILE MG 1 71 ILE HG12 . . 3.310 2.818 2.502 2.955 . 0 0 "[ . 1 . 2]" 1 1476 1 64 ILE MG 1 71 ILE HG13 . . 4.190 4.099 3.885 4.191 0.001 4 0 "[ . 1 . 2]" 1 1477 1 64 ILE MG 1 71 ILE MG . . 3.470 2.119 1.951 2.466 . 0 0 "[ . 1 . 2]" 1 1478 1 65 LYS H 1 65 LYS HB2 . . 3.450 2.658 2.452 2.753 . 0 0 "[ . 1 . 2]" 1 1479 1 65 LYS H 1 65 LYS HB3 . . 3.750 3.685 3.577 3.742 . 0 0 "[ . 1 . 2]" 1 1480 1 65 LYS H 1 65 LYS QD . . 5.340 4.742 4.677 4.770 . 0 0 "[ . 1 . 2]" 1 1481 1 65 LYS H 1 65 LYS HG2 . . 4.220 3.806 3.679 3.868 . 0 0 "[ . 1 . 2]" 1 1482 1 65 LYS H 1 65 LYS HG3 . . 4.610 4.477 4.274 4.570 . 0 0 "[ . 1 . 2]" 1 1483 1 65 LYS H 1 70 HIS HA . . 5.460 5.296 5.244 5.355 . 0 0 "[ . 1 . 2]" 1 1484 1 65 LYS H 1 71 ILE MG . . 4.450 3.455 3.145 3.933 . 0 0 "[ . 1 . 2]" 1 1485 1 65 LYS HA 1 65 LYS HD2 . . 4.070 3.776 3.741 3.831 . 0 0 "[ . 1 . 2]" 1 1486 1 65 LYS HA 1 65 LYS QD . . 3.470 2.476 2.465 2.494 . 0 0 "[ . 1 . 2]" 1 1487 1 65 LYS HA 1 65 LYS HD3 . . 4.070 2.510 2.499 2.528 . 0 0 "[ . 1 . 2]" 1 1488 1 65 LYS HA 1 65 LYS QE . . 3.820 3.737 3.633 3.805 . 0 0 "[ . 1 . 2]" 1 1489 1 65 LYS HA 1 65 LYS HG2 . . 3.930 2.377 2.362 2.394 . 0 0 "[ . 1 . 2]" 1 1490 1 65 LYS HA 1 65 LYS HG3 . . 4.070 3.609 3.602 3.617 . 0 0 "[ . 1 . 2]" 1 1491 1 65 LYS HA 1 66 TYR H . . 2.900 2.315 2.286 2.374 . 0 0 "[ . 1 . 2]" 1 1492 1 65 LYS HA 1 66 TYR HA . . 4.550 4.446 4.426 4.466 . 0 0 "[ . 1 . 2]" 1 1493 1 65 LYS HA 1 69 ASN H . . 3.920 3.741 3.620 3.807 . 0 0 "[ . 1 . 2]" 1 1494 1 65 LYS HA 1 70 HIS HA . . 3.470 2.714 2.646 2.792 . 0 0 "[ . 1 . 2]" 1 1495 1 65 LYS HA 1 71 ILE H . . 3.840 2.575 2.526 2.629 . 0 0 "[ . 1 . 2]" 1 1496 1 65 LYS HA 1 71 ILE MG . . 4.070 2.787 2.648 2.976 . 0 0 "[ . 1 . 2]" 1 1497 1 65 LYS HB2 1 65 LYS HD2 . . 4.000 3.538 3.516 3.570 . 0 0 "[ . 1 . 2]" 1 1498 1 65 LYS HB2 1 65 LYS HD3 . . 4.000 3.712 3.676 3.737 . 0 0 "[ . 1 . 2]" 1 1499 1 65 LYS HB2 1 66 TYR H . . 4.120 4.042 3.941 4.092 . 0 0 "[ . 1 . 2]" 1 1500 1 65 LYS HB2 1 68 GLY H . . 5.030 4.745 4.604 5.002 . 0 0 "[ . 1 . 2]" 1 1501 1 65 LYS HB2 1 69 ASN H . . 4.880 4.819 4.690 4.877 . 0 0 "[ . 1 . 2]" 1 1502 1 65 LYS HB3 1 66 TYR H . . 3.480 2.745 2.587 2.825 . 0 0 "[ . 1 . 2]" 1 1503 1 65 LYS HB3 1 68 GLY H . . 3.770 3.100 2.954 3.371 . 0 0 "[ . 1 . 2]" 1 1504 1 65 LYS HB3 1 69 ASN H . . 3.530 3.129 3.006 3.187 . 0 0 "[ . 1 . 2]" 1 1505 1 65 LYS QD 1 66 TYR H . . 3.750 2.688 2.621 2.746 . 0 0 "[ . 1 . 2]" 1 1506 1 65 LYS QD 1 68 GLY H . . 4.430 3.405 3.305 3.708 . 0 0 "[ . 1 . 2]" 1 1507 1 65 LYS QD 1 68 GLY HA2 . . 4.020 2.549 2.434 2.795 . 0 0 "[ . 1 . 2]" 1 1508 1 65 LYS QD 1 68 GLY HA3 . . 4.410 4.059 3.949 4.251 . 0 0 "[ . 1 . 2]" 1 1509 1 65 LYS QD 1 69 ASN H . . 3.800 2.267 2.154 2.391 . 0 0 "[ . 1 . 2]" 1 1510 1 65 LYS QD 1 70 HIS H . . 5.270 3.062 2.880 3.180 . 0 0 "[ . 1 . 2]" 1 1511 1 65 LYS QD 1 70 HIS HA . . 4.210 2.803 2.692 2.965 . 0 0 "[ . 1 . 2]" 1 1512 1 65 LYS HD2 1 68 GLY HA2 . . 4.750 2.596 2.472 2.867 . 0 0 "[ . 1 . 2]" 1 1513 1 65 LYS HD2 1 68 GLY HA3 . . 5.260 4.261 4.131 4.492 . 0 0 "[ . 1 . 2]" 1 1514 1 65 LYS HD2 1 70 HIS HA . . 4.990 4.458 4.379 4.557 . 0 0 "[ . 1 . 2]" 1 1515 1 65 LYS HD3 1 68 GLY HA2 . . 4.750 3.721 3.555 3.870 . 0 0 "[ . 1 . 2]" 1 1516 1 65 LYS HD3 1 68 GLY HA3 . . 5.260 5.109 4.958 5.251 . 0 0 "[ . 1 . 2]" 1 1517 1 65 LYS HD3 1 70 HIS HA . . 4.990 2.833 2.717 3.004 . 0 0 "[ . 1 . 2]" 1 1518 1 65 LYS QE 1 65 LYS HG2 . . 3.580 2.342 2.272 2.433 . 0 0 "[ . 1 . 2]" 1 1519 1 65 LYS QE 1 65 LYS HG3 . . 3.540 2.626 2.348 2.909 . 0 0 "[ . 1 . 2]" 1 1520 1 65 LYS QE 1 69 ASN H . . 4.410 4.007 3.717 4.280 . 0 0 "[ . 1 . 2]" 1 1521 1 65 LYS QE 1 70 HIS H . . 4.260 2.659 2.322 3.068 . 0 0 "[ . 1 . 2]" 1 1522 1 65 LYS QE 1 70 HIS HD2 . . 4.690 2.482 2.347 2.606 . 0 0 "[ . 1 . 2]" 1 1523 1 65 LYS QE 1 70 HIS HE1 . . 4.050 3.691 3.450 3.857 . 0 0 "[ . 1 . 2]" 1 1524 1 65 LYS HE2 1 65 LYS HG2 . . 4.120 3.102 2.513 3.623 . 0 0 "[ . 1 . 2]" 1 1525 1 65 LYS HE2 1 65 LYS HG3 . . 4.050 3.579 3.193 3.814 . 0 0 "[ . 1 . 2]" 1 1526 1 65 LYS HE3 1 65 LYS HG2 . . 4.120 2.539 2.302 2.934 . 0 0 "[ . 1 . 2]" 1 1527 1 65 LYS HE3 1 65 LYS HG3 . . 4.050 2.703 2.392 3.020 . 0 0 "[ . 1 . 2]" 1 1528 1 65 LYS HG2 1 66 TYR H . . 4.260 4.183 4.146 4.213 . 0 0 "[ . 1 . 2]" 1 1529 1 65 LYS HG2 1 69 ASN H . . 4.790 4.666 4.534 4.778 . 0 0 "[ . 1 . 2]" 1 1530 1 65 LYS HG2 1 70 HIS HA . . 4.030 3.069 2.987 3.110 . 0 0 "[ . 1 . 2]" 1 1531 1 65 LYS HG2 1 71 ILE H . . 4.250 4.251 4.222 4.257 0.007 15 0 "[ . 1 . 2]" 1 1532 1 65 LYS HG3 1 66 TYR H . . 4.930 4.817 4.709 4.874 . 0 0 "[ . 1 . 2]" 1 1533 1 65 LYS HG3 1 69 ASN H . . 4.980 4.826 4.698 4.926 . 0 0 "[ . 1 . 2]" 1 1534 1 65 LYS HG3 1 70 HIS HA . . 4.700 4.640 4.569 4.684 . 0 0 "[ . 1 . 2]" 1 1535 1 66 TYR H 1 66 TYR HB2 . . 3.670 3.257 3.202 3.312 . 0 0 "[ . 1 . 2]" 1 1536 1 66 TYR H 1 66 TYR HB3 . . 3.420 2.713 2.660 2.772 . 0 0 "[ . 1 . 2]" 1 1537 1 66 TYR H 1 66 TYR QD . . 4.410 4.298 4.207 4.374 . 0 0 "[ . 1 . 2]" 1 1538 1 66 TYR H 1 67 ASP H . . 4.480 3.938 3.821 4.183 . 0 0 "[ . 1 . 2]" 1 1539 1 66 TYR H 1 68 GLY H . . 4.410 3.306 3.089 3.444 . 0 0 "[ . 1 . 2]" 1 1540 1 66 TYR H 1 68 GLY HA2 . . 5.110 4.518 4.391 4.594 . 0 0 "[ . 1 . 2]" 1 1541 1 66 TYR H 1 69 ASN H . . 3.130 2.112 1.982 2.198 . 0 0 "[ . 1 . 2]" 1 1542 1 66 TYR H 1 69 ASN HA . . 4.740 4.334 4.239 4.414 . 0 0 "[ . 1 . 2]" 1 1543 1 66 TYR H 1 69 ASN QB . . 4.020 3.437 3.317 3.546 . 0 0 "[ . 1 . 2]" 1 1544 1 66 TYR H 1 70 HIS HA . . 4.110 3.985 3.877 4.069 . 0 0 "[ . 1 . 2]" 1 1545 1 66 TYR H 1 71 ILE H . . 4.140 3.538 3.417 3.680 . 0 0 "[ . 1 . 2]" 1 1546 1 66 TYR H 1 71 ILE MG . . 3.620 3.093 2.950 3.337 . 0 0 "[ . 1 . 2]" 1 1547 1 66 TYR HA 1 66 TYR QD . . 3.530 2.782 2.438 2.902 . 0 0 "[ . 1 . 2]" 1 1548 1 66 TYR HA 1 66 TYR QE . . 4.900 4.668 4.529 4.752 . 0 0 "[ . 1 . 2]" 1 1549 1 66 TYR HA 1 67 ASP H . . 3.010 2.175 2.138 2.207 . 0 0 "[ . 1 . 2]" 1 1550 1 66 TYR HA 1 67 ASP HA . . 4.580 4.391 4.358 4.408 . 0 0 "[ . 1 . 2]" 1 1551 1 66 TYR HA 1 67 ASP HB3 . . 5.030 4.939 4.910 4.988 . 0 0 "[ . 1 . 2]" 1 1552 1 66 TYR HA 1 68 GLY H . . 4.320 3.870 3.661 4.017 . 0 0 "[ . 1 . 2]" 1 1553 1 66 TYR HA 1 69 ASN H . . 4.550 4.350 4.212 4.432 . 0 0 "[ . 1 . 2]" 1 1554 1 66 TYR HA 1 71 ILE MG . . 4.830 3.655 3.490 3.797 . 0 0 "[ . 1 . 2]" 1 1555 1 66 TYR HB2 1 67 ASP H . . 4.600 4.434 4.272 4.492 . 0 0 "[ . 1 . 2]" 1 1556 1 66 TYR HB2 1 69 ASN H . . 5.260 5.054 4.895 5.136 . 0 0 "[ . 1 . 2]" 1 1557 1 66 TYR HB2 1 71 ILE MG . . 3.510 2.014 1.864 2.149 . 0 0 "[ . 1 . 2]" 1 1558 1 66 TYR HB3 1 69 ASN H . . 4.050 3.968 3.833 4.048 . 0 0 "[ . 1 . 2]" 1 1559 1 66 TYR HB3 1 71 ILE H . . 4.790 4.207 3.989 4.335 . 0 0 "[ . 1 . 2]" 1 1560 1 66 TYR HB3 1 71 ILE MG . . 3.550 2.492 2.208 2.749 . 0 0 "[ . 1 . 2]" 1 1561 1 66 TYR QD 1 67 ASP H . . 4.160 3.996 3.254 4.157 . 0 0 "[ . 1 . 2]" 1 1562 1 66 TYR QD 1 67 ASP HB2 . . 3.780 3.726 3.626 3.779 . 0 0 "[ . 1 . 2]" 1 1563 1 66 TYR QD 1 67 ASP HB3 . . 4.290 3.623 3.502 3.918 . 0 0 "[ . 1 . 2]" 1 1564 1 66 TYR QD 1 71 ILE MG . . 4.150 3.603 3.427 3.750 . 0 0 "[ . 1 . 2]" 1 1565 1 66 TYR QE 1 67 ASP HB2 . . 4.100 3.830 3.738 3.922 . 0 0 "[ . 1 . 2]" 1 1566 1 66 TYR QE 1 67 ASP HB3 . . 4.300 4.092 3.880 4.282 . 0 0 "[ . 1 . 2]" 1 1567 1 67 ASP H 1 67 ASP HB2 . . 3.910 2.970 2.845 3.039 . 0 0 "[ . 1 . 2]" 1 1568 1 67 ASP H 1 67 ASP HB3 . . 4.090 3.766 3.676 3.802 . 0 0 "[ . 1 . 2]" 1 1569 1 67 ASP H 1 68 GLY H . . 3.500 2.759 2.670 2.892 . 0 0 "[ . 1 . 2]" 1 1570 1 67 ASP H 1 69 ASN H . . 4.820 4.344 4.248 4.506 . 0 0 "[ . 1 . 2]" 1 1571 1 67 ASP HA 1 68 GLY H . . 3.090 2.915 2.847 2.981 . 0 0 "[ . 1 . 2]" 1 1572 1 67 ASP HA 1 69 ASN H . . 5.040 4.990 4.889 5.049 0.009 18 0 "[ . 1 . 2]" 1 1573 1 67 ASP HB2 1 68 GLY H . . 4.570 4.483 4.432 4.523 . 0 0 "[ . 1 . 2]" 1 1574 1 67 ASP HB3 1 68 GLY H . . 4.580 4.108 4.041 4.173 . 0 0 "[ . 1 . 2]" 1 1575 1 67 ASP HB3 1 68 GLY HA3 . . 5.500 4.779 4.697 4.824 . 0 0 "[ . 1 . 2]" 1 1576 1 67 ASP HB3 1 69 ASN H . . 4.940 4.882 4.771 4.936 . 0 0 "[ . 1 . 2]" 1 1577 1 68 GLY H 1 69 ASN H . . 3.250 2.403 2.296 2.480 . 0 0 "[ . 1 . 2]" 1 1578 1 68 GLY HA2 1 69 ASN HA . . 5.090 4.344 4.335 4.356 . 0 0 "[ . 1 . 2]" 1 1579 1 69 ASN H 1 69 ASN QB . . 2.880 2.775 2.710 2.838 . 0 0 "[ . 1 . 2]" 1 1580 1 69 ASN H 1 69 ASN QD . . 4.550 4.232 3.787 4.533 . 0 0 "[ . 1 . 2]" 1 1581 1 69 ASN H 1 70 HIS HA . . 4.870 4.561 4.481 4.629 . 0 0 "[ . 1 . 2]" 1 1582 1 69 ASN HA 1 69 ASN QD . . 4.350 3.236 1.965 4.117 . 0 0 "[ . 1 . 2]" 1 1583 1 69 ASN HA 1 69 ASN HD22 . . 4.950 4.157 3.336 4.901 . 0 0 "[ . 1 . 2]" 1 1584 1 69 ASN HA 1 70 HIS H . . 3.290 2.144 2.140 2.157 . 0 0 "[ . 1 . 2]" 1 1585 1 69 ASN QB 1 69 ASN QD . . 3.040 2.256 2.067 2.506 . 0 0 "[ . 1 . 2]" 1 1586 1 69 ASN QB 1 69 ASN HD22 . . 3.500 3.316 3.223 3.413 . 0 0 "[ . 1 . 2]" 1 1587 1 69 ASN QB 1 70 HIS H . . 3.970 3.700 3.372 3.855 . 0 0 "[ . 1 . 2]" 1 1588 1 70 HIS H 1 70 HIS HB2 . . 3.730 2.165 2.139 2.203 . 0 0 "[ . 1 . 2]" 1 1589 1 70 HIS H 1 70 HIS HB3 . . 4.070 3.478 3.455 3.507 . 0 0 "[ . 1 . 2]" 1 1590 1 70 HIS H 1 70 HIS HD2 . . 4.300 3.404 3.304 3.530 . 0 0 "[ . 1 . 2]" 1 1591 1 70 HIS HA 1 70 HIS HD2 . . 5.120 4.133 4.036 4.247 . 0 0 "[ . 1 . 2]" 1 1592 1 70 HIS HA 1 71 ILE H . . 3.010 2.187 2.160 2.214 . 0 0 "[ . 1 . 2]" 1 1593 1 70 HIS HA 1 71 ILE HG12 . . 4.680 4.036 3.926 4.149 . 0 0 "[ . 1 . 2]" 1 1594 1 70 HIS HA 1 71 ILE MG . . 4.540 3.814 3.705 3.950 . 0 0 "[ . 1 . 2]" 1 1595 1 70 HIS HA 1 74 SER HG . . 4.930 3.903 3.662 4.078 . 0 0 "[ . 1 . 2]" 1 1596 1 70 HIS HB2 1 70 HIS HD2 . . 3.940 2.715 2.697 2.736 . 0 0 "[ . 1 . 2]" 1 1597 1 70 HIS HB2 1 71 ILE H . . 4.710 4.605 4.579 4.620 . 0 0 "[ . 1 . 2]" 1 1598 1 70 HIS HB2 1 74 SER HG . . 5.500 5.465 5.404 5.500 . 0 0 "[ . 1 . 2]" 1 1599 1 70 HIS HB3 1 71 ILE H . . 4.080 3.919 3.818 3.992 . 0 0 "[ . 1 . 2]" 1 1600 1 70 HIS HB3 1 74 SER H . . 4.860 4.557 4.441 4.627 . 0 0 "[ . 1 . 2]" 1 1601 1 70 HIS HB3 1 74 SER HG . . 4.590 4.059 4.009 4.166 . 0 0 "[ . 1 . 2]" 1 1602 1 70 HIS HE1 1 74 SER HG . . 4.210 3.555 3.484 3.715 . 0 0 "[ . 1 . 2]" 1 1603 1 70 HIS HE1 1 75 PRO HA . . 4.740 4.757 4.722 4.772 0.032 17 0 "[ . 1 . 2]" 1 1604 1 70 HIS HE1 1 75 PRO HB2 . . 5.500 5.479 5.401 5.518 0.018 20 0 "[ . 1 . 2]" 1 1605 1 70 HIS HE1 1 75 PRO HB3 . . 3.960 3.826 3.771 3.852 . 0 0 "[ . 1 . 2]" 1 1606 1 70 HIS HE1 1 75 PRO QD . . 4.390 2.820 2.684 3.107 . 0 0 "[ . 1 . 2]" 1 1607 1 70 HIS HE1 1 75 PRO QG . . 4.530 3.938 3.789 4.117 . 0 0 "[ . 1 . 2]" 1 1608 1 71 ILE H 1 71 ILE HB . . 3.950 3.614 3.604 3.631 . 0 0 "[ . 1 . 2]" 1 1609 1 71 ILE H 1 71 ILE MD . . 4.160 3.925 3.864 4.050 . 0 0 "[ . 1 . 2]" 1 1610 1 71 ILE H 1 71 ILE HG12 . . 3.450 2.471 2.325 2.632 . 0 0 "[ . 1 . 2]" 1 1611 1 71 ILE H 1 71 ILE HG13 . . 3.730 3.313 2.968 3.491 . 0 0 "[ . 1 . 2]" 1 1612 1 71 ILE H 1 71 ILE MG . . 3.360 2.070 1.887 2.217 . 0 0 "[ . 1 . 2]" 1 1613 1 71 ILE H 1 74 SER HB3 . . 4.410 4.028 3.823 4.420 0.010 14 0 "[ . 1 . 2]" 1 1614 1 71 ILE H 1 74 SER HG . . 4.670 4.232 4.048 4.407 . 0 0 "[ . 1 . 2]" 1 1615 1 71 ILE HA 1 71 ILE MD . . 4.200 4.136 4.088 4.149 . 0 0 "[ . 1 . 2]" 1 1616 1 71 ILE HA 1 71 ILE MG . . 3.310 2.329 2.244 2.424 . 0 0 "[ . 1 . 2]" 1 1617 1 71 ILE HA 1 72 PRO HD2 . . 3.640 2.377 2.369 2.392 . 0 0 "[ . 1 . 2]" 1 1618 1 71 ILE HA 1 72 PRO HD3 . . 3.360 2.291 2.288 2.297 . 0 0 "[ . 1 . 2]" 1 1619 1 71 ILE HA 1 72 PRO HG2 . . 4.920 4.494 4.487 4.506 . 0 0 "[ . 1 . 2]" 1 1620 1 71 ILE HA 1 72 PRO HG3 . . 4.830 4.458 4.453 4.467 . 0 0 "[ . 1 . 2]" 1 1621 1 71 ILE HB 1 71 ILE MD . . 3.200 2.244 2.152 2.345 . 0 0 "[ . 1 . 2]" 1 1622 1 71 ILE HB 1 72 PRO HD2 . . 3.550 1.960 1.953 1.968 . 0 0 "[ . 1 . 2]" 1 1623 1 71 ILE HB 1 72 PRO HD3 . . 3.650 3.408 3.400 3.422 . 0 0 "[ . 1 . 2]" 1 1624 1 71 ILE HB 1 72 PRO HG2 . . 4.690 3.797 3.742 3.829 . 0 0 "[ . 1 . 2]" 1 1625 1 71 ILE MD 1 71 ILE MG . . 3.060 2.295 2.100 2.458 . 0 0 "[ . 1 . 2]" 1 1626 1 71 ILE MD 1 72 PRO HD2 . . 4.300 3.700 3.539 3.746 . 0 0 "[ . 1 . 2]" 1 1627 1 71 ILE MD 1 72 PRO HD3 . . 5.080 5.059 4.918 5.094 0.014 6 0 "[ . 1 . 2]" 1 1628 1 71 ILE MD 1 74 SER H . . 4.920 3.847 3.486 4.321 . 0 0 "[ . 1 . 2]" 1 1629 1 71 ILE MD 1 74 SER HB2 . . 4.610 2.859 2.680 3.301 . 0 0 "[ . 1 . 2]" 1 1630 1 71 ILE MD 1 74 SER HB3 . . 4.760 2.497 1.966 2.674 . 0 0 "[ . 1 . 2]" 1 1631 1 71 ILE HG12 1 71 ILE MG . . 3.440 2.184 2.090 2.330 . 0 0 "[ . 1 . 2]" 1 1632 1 71 ILE HG12 1 74 SER H . . 4.670 4.065 3.786 4.674 0.004 14 0 "[ . 1 . 2]" 1 1633 1 71 ILE HG12 1 74 SER HB2 . . 4.900 3.477 3.293 3.791 . 0 0 "[ . 1 . 2]" 1 1634 1 71 ILE HG12 1 74 SER HB3 . . 4.210 2.249 2.011 2.746 . 0 0 "[ . 1 . 2]" 1 1635 1 71 ILE HG13 1 71 ILE MG . . 3.690 3.173 3.140 3.188 . 0 0 "[ . 1 . 2]" 1 1636 1 71 ILE HG13 1 72 PRO HD2 . . 4.960 3.908 3.775 4.123 . 0 0 "[ . 1 . 2]" 1 1637 1 71 ILE HG13 1 74 SER H . . 4.210 2.726 2.432 3.242 . 0 0 "[ . 1 . 2]" 1 1638 1 71 ILE HG13 1 74 SER HB3 . . 4.450 2.033 1.993 2.144 . 0 0 "[ . 1 . 2]" 1 1639 1 71 ILE MG 1 72 PRO HD2 . . 4.280 3.238 3.018 3.341 . 0 0 "[ . 1 . 2]" 1 1640 1 71 ILE MG 1 72 PRO HD3 . . 4.220 3.956 3.735 4.036 . 0 0 "[ . 1 . 2]" 1 1641 1 72 PRO HA 1 73 GLY H . . 2.890 2.323 2.275 2.387 . 0 0 "[ . 1 . 2]" 1 1642 1 72 PRO HA 1 73 GLY QA . . 4.310 3.912 3.904 3.923 . 0 0 "[ . 1 . 2]" 1 1643 1 72 PRO HA 1 74 SER H . . 3.930 3.845 3.775 3.937 0.007 1 0 "[ . 1 . 2]" 1 1644 1 72 PRO QB 1 73 GLY H . . 3.930 3.834 3.782 3.891 . 0 0 "[ . 1 . 2]" 1 1645 1 72 PRO HB2 1 73 GLY H . . 4.630 4.169 4.107 4.236 . 0 0 "[ . 1 . 2]" 1 1646 1 72 PRO HB3 1 73 GLY H . . 4.630 4.476 4.424 4.534 . 0 0 "[ . 1 . 2]" 1 1647 1 73 GLY H 1 74 SER H . . 3.320 1.786 1.759 1.796 . 0 0 "[ . 1 . 2]" 1 1648 1 73 GLY H 1 74 SER HB2 . . 5.500 5.267 5.136 5.541 0.041 14 0 "[ . 1 . 2]" 1 1649 1 73 GLY H 1 74 SER HB3 . . 4.450 4.165 4.032 4.335 . 0 0 "[ . 1 . 2]" 1 1650 1 74 SER H 1 74 SER HB2 . . 4.050 3.572 3.462 3.883 . 0 0 "[ . 1 . 2]" 1 1651 1 74 SER H 1 74 SER HB3 . . 3.520 2.551 2.448 2.880 . 0 0 "[ . 1 . 2]" 1 1652 1 74 SER H 1 74 SER HG . . 4.310 3.844 3.762 4.040 . 0 0 "[ . 1 . 2]" 1 1653 1 74 SER H 1 75 PRO HA . . 4.940 4.774 4.763 4.778 . 0 0 "[ . 1 . 2]" 1 1654 1 74 SER HA 1 75 PRO HA . . 3.400 2.394 2.386 2.419 . 0 0 "[ . 1 . 2]" 1 1655 1 74 SER HA 1 75 PRO HB3 . . 5.010 4.497 4.490 4.518 . 0 0 "[ . 1 . 2]" 1 1656 1 74 SER HA 1 76 LEU H . . 3.800 3.525 3.223 3.656 . 0 0 "[ . 1 . 2]" 1 1657 1 74 SER HB2 1 75 PRO HA . . 4.770 2.598 1.956 2.767 . 0 0 "[ . 1 . 2]" 1 1658 1 74 SER HB3 1 75 PRO HA . . 4.840 3.693 3.573 3.726 . 0 0 "[ . 1 . 2]" 1 1659 1 74 SER HG 1 75 PRO HA . . 4.180 2.902 2.805 3.031 . 0 0 "[ . 1 . 2]" 1 1660 1 75 PRO HA 1 76 LEU H . . 3.110 2.485 2.339 2.561 . 0 0 "[ . 1 . 2]" 1 1661 1 75 PRO HA 1 76 LEU HA . . 4.590 4.499 4.438 4.557 . 0 0 "[ . 1 . 2]" 1 1662 1 75 PRO HA 1 76 LEU HB3 . . 4.590 4.361 4.283 4.445 . 0 0 "[ . 1 . 2]" 1 1663 1 75 PRO HA 1 76 LEU MD2 . . 4.480 4.296 4.136 4.449 . 0 0 "[ . 1 . 2]" 1 1664 1 75 PRO HA 1 76 LEU HG . . 4.090 3.847 3.680 4.030 . 0 0 "[ . 1 . 2]" 1 1665 1 75 PRO HB2 1 76 LEU H . . 3.550 2.413 2.237 2.779 . 0 0 "[ . 1 . 2]" 1 1666 1 75 PRO HB3 1 76 LEU H . . 3.740 3.358 3.277 3.541 . 0 0 "[ . 1 . 2]" 1 1667 1 75 PRO QG 1 76 LEU H . . 4.680 4.022 3.890 4.274 . 0 0 "[ . 1 . 2]" 1 1668 1 76 LEU H 1 76 LEU HB3 . . 3.760 3.279 3.182 3.404 . 0 0 "[ . 1 . 2]" 1 1669 1 76 LEU H 1 76 LEU MD1 . . 4.030 3.378 3.160 3.554 . 0 0 "[ . 1 . 2]" 1 1670 1 76 LEU H 1 76 LEU MD2 . . 4.500 3.689 3.504 3.819 . 0 0 "[ . 1 . 2]" 1 1671 1 76 LEU H 1 76 LEU HG . . 3.340 2.237 2.068 2.420 . 0 0 "[ . 1 . 2]" 1 1672 1 76 LEU H 1 77 GLN H . . 4.450 4.396 4.297 4.454 0.004 13 0 "[ . 1 . 2]" 1 1673 1 76 LEU H 1 77 GLN HA . . 5.500 4.753 4.644 4.855 . 0 0 "[ . 1 . 2]" 1 1674 1 76 LEU HA 1 76 LEU MD1 . . 4.120 3.628 3.521 3.694 . 0 0 "[ . 1 . 2]" 1 1675 1 76 LEU HA 1 76 LEU MD2 . . 4.590 4.049 4.025 4.086 . 0 0 "[ . 1 . 2]" 1 1676 1 76 LEU HA 1 77 GLN H . . 2.890 2.314 2.216 2.493 . 0 0 "[ . 1 . 2]" 1 1677 1 76 LEU HA 1 77 GLN QG . . 4.820 3.760 3.231 4.176 . 0 0 "[ . 1 . 2]" 1 1678 1 76 LEU HB2 1 76 LEU MD1 . . 3.630 2.142 2.019 2.223 . 0 0 "[ . 1 . 2]" 1 1679 1 76 LEU HB2 1 77 GLN H . . 3.270 2.667 2.245 2.942 . 0 0 "[ . 1 . 2]" 1 1680 1 76 LEU HB3 1 76 LEU MD2 . . 3.160 2.120 1.997 2.233 . 0 0 "[ . 1 . 2]" 1 1681 1 76 LEU HB3 1 77 GLN H . . 3.990 3.873 3.629 4.006 0.016 15 0 "[ . 1 . 2]" 1 1682 1 76 LEU MD1 1 77 GLN H . . 3.860 3.233 2.704 3.600 . 0 0 "[ . 1 . 2]" 1 1683 1 76 LEU MD1 1 77 GLN HA . . 4.430 3.279 2.999 3.604 . 0 0 "[ . 1 . 2]" 1 1684 1 76 LEU MD1 1 78 PHE H . . 4.770 3.714 3.357 4.190 . 0 0 "[ . 1 . 2]" 1 1685 1 76 LEU MD1 1 78 PHE QB . . 4.110 2.802 2.512 3.359 . 0 0 "[ . 1 . 2]" 1 1686 1 76 LEU MD1 1 78 PHE QD . . 3.400 2.127 1.900 2.592 . 0 0 "[ . 1 . 2]" 1 1687 1 77 GLN H 1 77 GLN QB . . 3.130 2.511 2.277 3.086 . 0 0 "[ . 1 . 2]" 1 1688 1 77 GLN H 1 77 GLN HG2 . . 4.330 3.671 1.900 4.245 . 0 0 "[ . 1 . 2]" 1 1689 1 77 GLN H 1 77 GLN QG . . 3.660 2.882 1.863 3.288 . 0 0 "[ . 1 . 2]" 1 1690 1 77 GLN H 1 77 GLN HG3 . . 4.330 3.237 2.669 4.305 . 0 0 "[ . 1 . 2]" 1 1691 1 77 GLN H 1 78 PHE H . . 4.730 4.432 4.272 4.570 . 0 0 "[ . 1 . 2]" 1 1692 1 77 GLN HA 1 77 GLN HG2 . . 4.100 2.679 2.345 3.610 . 0 0 "[ . 1 . 2]" 1 1693 1 77 GLN HA 1 77 GLN QG . . 3.530 2.533 2.244 3.316 . 0 0 "[ . 1 . 2]" 1 1694 1 77 GLN HA 1 77 GLN HG3 . . 4.100 3.172 2.759 3.871 . 0 0 "[ . 1 . 2]" 1 1695 1 77 GLN HA 1 78 PHE H . . 2.960 2.189 2.141 2.295 . 0 0 "[ . 1 . 2]" 1 1696 1 77 GLN HA 1 78 PHE QD . . 4.220 2.959 2.699 3.183 . 0 0 "[ . 1 . 2]" 1 1697 1 77 GLN QB 1 77 GLN QE . . 4.000 3.120 1.899 3.630 . 0 0 "[ . 1 . 2]" 1 1698 1 77 GLN QB 1 78 PHE H . . 3.560 3.048 2.674 3.317 . 0 0 "[ . 1 . 2]" 1 1699 1 77 GLN QG 1 78 PHE H . . 4.300 3.992 3.642 4.291 . 0 0 "[ . 1 . 2]" 1 1700 1 77 GLN HG2 1 78 PHE H . . 5.040 4.310 3.769 5.036 . 0 0 "[ . 1 . 2]" 1 1701 1 77 GLN HG3 1 78 PHE H . . 5.040 4.863 4.487 5.045 0.005 12 0 "[ . 1 . 2]" 1 1702 1 78 PHE H 1 78 PHE QD . . 3.730 2.346 2.069 2.751 . 0 0 "[ . 1 . 2]" 1 1703 1 78 PHE H 1 78 PHE QE . . 4.150 4.026 3.815 4.152 0.002 3 0 "[ . 1 . 2]" 1 1704 1 78 PHE HA 1 78 PHE QD . . 4.470 3.684 3.654 3.718 . 0 0 "[ . 1 . 2]" 1 1705 1 78 PHE HA 1 79 TYR H . . 3.420 2.177 2.139 2.359 . 0 0 "[ . 1 . 2]" 1 1706 1 78 PHE HA 1 79 TYR QB . . 4.790 4.037 3.980 4.076 . 0 0 "[ . 1 . 2]" 1 1707 1 78 PHE QD 1 79 TYR H . . 4.640 4.324 3.781 4.578 . 0 0 "[ . 1 . 2]" 1 1708 1 78 PHE QD 1 80 VAL MG2 . . 3.110 2.768 2.387 3.079 . 0 0 "[ . 1 . 2]" 1 1709 1 78 PHE QE 1 80 VAL MG2 . . 3.110 2.758 2.377 3.035 . 0 0 "[ . 1 . 2]" 1 1710 1 78 PHE HZ 1 80 VAL MG2 . . 4.800 4.345 4.012 4.554 . 0 0 "[ . 1 . 2]" 1 1711 1 79 TYR H 1 79 TYR HB2 . . 3.790 2.589 2.451 2.720 . 0 0 "[ . 1 . 2]" 1 1712 1 79 TYR H 1 79 TYR QB . . 3.250 2.340 2.283 2.426 . 0 0 "[ . 1 . 2]" 1 1713 1 79 TYR H 1 79 TYR HB3 . . 3.790 2.673 2.616 2.736 . 0 0 "[ . 1 . 2]" 1 1714 1 79 TYR H 1 79 TYR QD . . 4.760 4.242 4.167 4.305 . 0 0 "[ . 1 . 2]" 1 1715 1 79 TYR H 1 80 VAL H . . 5.420 4.547 4.458 4.595 . 0 0 "[ . 1 . 2]" 1 1716 1 79 TYR HA 1 79 TYR QD . . 3.790 2.658 2.383 2.929 . 0 0 "[ . 1 . 2]" 1 1717 1 79 TYR HA 1 79 TYR QE . . 5.080 4.482 4.353 4.613 . 0 0 "[ . 1 . 2]" 1 1718 1 79 TYR HA 1 80 VAL H . . 3.110 2.207 2.158 2.248 . 0 0 "[ . 1 . 2]" 1 1719 1 79 TYR HA 1 80 VAL MG2 . . 4.540 3.569 3.377 3.716 . 0 0 "[ . 1 . 2]" 1 1720 1 79 TYR QB 1 80 VAL H . . 3.940 3.569 3.488 3.690 . 0 0 "[ . 1 . 2]" 1 1721 1 79 TYR HB2 1 80 VAL H . . 4.610 4.196 4.097 4.313 . 0 0 "[ . 1 . 2]" 1 1722 1 79 TYR HB3 1 80 VAL H . . 4.610 3.864 3.768 4.009 . 0 0 "[ . 1 . 2]" 1 1723 1 79 TYR QD 1 80 VAL H . . 4.420 3.359 3.191 3.538 . 0 0 "[ . 1 . 2]" 1 1724 1 79 TYR QD 1 81 ASP H . . 4.990 4.573 4.212 4.964 . 0 0 "[ . 1 . 2]" 1 1725 1 79 TYR QE 1 81 ASP HB2 . . 4.770 4.162 3.017 4.769 . 0 0 "[ . 1 . 2]" 1 1726 1 79 TYR QE 1 81 ASP QB . . 4.000 3.261 2.762 3.993 . 0 0 "[ . 1 . 2]" 1 1727 1 79 TYR QE 1 81 ASP HB3 . . 4.770 3.722 2.831 4.772 0.002 11 0 "[ . 1 . 2]" 1 1728 1 80 VAL H 1 80 VAL HB . . 3.380 2.578 2.503 2.633 . 0 0 "[ . 1 . 2]" 1 1729 1 80 VAL H 1 80 VAL MG1 . . 4.280 3.823 3.781 3.851 . 0 0 "[ . 1 . 2]" 1 1730 1 80 VAL H 1 80 VAL MG2 . . 3.420 2.672 2.425 2.836 . 0 0 "[ . 1 . 2]" 1 1731 1 80 VAL H 1 81 ASP H . . 4.870 4.435 4.271 4.550 . 0 0 "[ . 1 . 2]" 1 1732 1 80 VAL HA 1 80 VAL MG1 . . 3.410 2.371 2.262 2.489 . 0 0 "[ . 1 . 2]" 1 1733 1 80 VAL HA 1 80 VAL MG2 . . 3.410 2.350 2.250 2.462 . 0 0 "[ . 1 . 2]" 1 1734 1 80 VAL HA 1 81 ASP H . . 2.910 2.178 2.140 2.275 . 0 0 "[ . 1 . 2]" 1 1735 1 80 VAL HB 1 81 ASP H . . 4.900 4.104 3.837 4.302 . 0 0 "[ . 1 . 2]" 1 1736 1 80 VAL MG1 1 81 ASP H . . 3.750 2.370 1.917 2.832 . 0 0 "[ . 1 . 2]" 1 1737 1 80 VAL MG2 1 81 ASP H . . 4.110 3.975 3.817 4.092 . 0 0 "[ . 1 . 2]" 1 1738 1 81 ASP H 1 81 ASP HB2 . . 3.950 3.591 2.590 3.862 . 0 0 "[ . 1 . 2]" 1 1739 1 81 ASP H 1 81 ASP HB3 . . 3.950 3.131 2.662 3.765 . 0 0 "[ . 1 . 2]" 1 1740 1 81 ASP HA 1 82 ALA H . . 3.240 2.398 2.201 2.549 . 0 0 "[ . 1 . 2]" 1 1741 1 81 ASP QB 1 82 ALA H . . 3.460 2.621 2.109 3.398 . 0 0 "[ . 1 . 2]" 1 1742 1 81 ASP HB2 1 82 ALA H . . 4.010 2.860 2.130 4.008 . 0 0 "[ . 1 . 2]" 1 1743 1 81 ASP HB3 1 82 ALA H . . 4.010 3.646 2.594 3.942 . 0 0 "[ . 1 . 2]" 1 1744 1 82 ALA H 1 82 ALA MB . . 3.120 2.207 2.110 2.258 . 0 0 "[ . 1 . 2]" 1 1745 1 82 ALA H 1 83 ILE H . . 4.650 4.612 4.521 4.649 . 0 0 "[ . 1 . 2]" 1 1746 1 82 ALA HA 1 83 ILE H . . 2.830 2.250 2.146 2.369 . 0 0 "[ . 1 . 2]" 1 1747 1 82 ALA HA 1 83 ILE HB . . 5.460 4.760 4.662 4.871 . 0 0 "[ . 1 . 2]" 1 1748 1 82 ALA MB 1 83 ILE H . . 3.390 2.766 2.442 3.151 . 0 0 "[ . 1 . 2]" 1 1749 1 83 ILE H 1 83 ILE HB . . 3.160 2.551 2.488 2.679 . 0 0 "[ . 1 . 2]" 1 1750 1 83 ILE H 1 83 ILE MD . . 3.700 3.503 3.161 3.690 . 0 0 "[ . 1 . 2]" 1 1751 1 83 ILE H 1 83 ILE HG12 . . 3.810 3.472 3.173 3.749 . 0 0 "[ . 1 . 2]" 1 1752 1 83 ILE H 1 83 ILE HG13 . . 3.510 2.134 1.923 2.397 . 0 0 "[ . 1 . 2]" 1 1753 1 83 ILE H 1 83 ILE MG . . 3.970 3.771 3.764 3.790 . 0 0 "[ . 1 . 2]" 1 1754 1 83 ILE H 1 84 ASN H . . 4.560 4.003 2.421 4.558 . 0 0 "[ . 1 . 2]" 1 1755 1 83 ILE HA 1 83 ILE MD . . 3.910 3.860 3.825 3.895 . 0 0 "[ . 1 . 2]" 1 1756 1 83 ILE HA 1 83 ILE HG12 . . 3.810 2.607 2.522 2.775 . 0 0 "[ . 1 . 2]" 1 1757 1 83 ILE HA 1 83 ILE HG13 . . 3.880 2.947 2.779 3.045 . 0 0 "[ . 1 . 2]" 1 1758 1 83 ILE HA 1 83 ILE MG . . 3.360 2.387 2.298 2.457 . 0 0 "[ . 1 . 2]" 1 1759 1 83 ILE HB 1 83 ILE MD . . 3.140 2.336 2.234 2.448 . 0 0 "[ . 1 . 2]" 1 1760 1 83 ILE HB 1 84 ASN H . . 4.960 3.949 2.223 4.467 . 0 0 "[ . 1 . 2]" 1 1761 1 83 ILE HG12 1 83 ILE MG . . 3.340 2.269 2.075 2.439 . 0 0 "[ . 1 . 2]" 1 1762 1 83 ILE HG13 1 83 ILE MG . . 3.510 3.188 3.145 3.202 . 0 0 "[ . 1 . 2]" 1 1763 1 83 ILE MG 1 84 ASN H . . 4.750 3.027 2.277 3.653 . 0 0 "[ . 1 . 2]" 1 1764 1 84 ASN HA 1 84 ASN HD21 . . 2.910 2.419 1.984 2.829 . 0 0 "[ . 1 . 2]" 1 1765 1 84 ASN HA 1 84 ASN HD22 . . 3.670 3.557 3.351 3.663 . 0 0 "[ . 1 . 2]" 1 1766 1 86 ARG HB2 1 86 ARG QD . . 3.730 2.710 2.134 3.498 . 0 0 "[ . 1 . 2]" 1 1767 1 86 ARG HB3 1 86 ARG QD . . 3.730 2.531 2.126 3.511 . 0 0 "[ . 1 . 2]" 1 1768 1 87 HIS HA 1 87 HIS HD2 . . 5.150 3.737 2.187 4.865 . 0 0 "[ . 1 . 2]" 1 1769 1 89 GLY QA 1 90 PRO QD . . 2.840 1.975 1.878 2.168 . 0 0 "[ . 1 . 2]" 1 1770 1 92 SER HA 1 93 GLY H . . 3.110 2.280 2.143 2.777 . 0 0 "[ . 1 . 2]" 1 stop_ save_
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