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NMR Restraints Grid |
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Result table
(Save to zip file containing files for each block)
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
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451038 |
2ro0 ![]() ![]() |
11032 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2ro0 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 1642 _Distance_constraint_stats_list.Viol_count 1204 _Distance_constraint_stats_list.Viol_total 252.971 _Distance_constraint_stats_list.Viol_max 0.129 _Distance_constraint_stats_list.Viol_rms 0.0033 _Distance_constraint_stats_list.Viol_average_all_restraints 0.0004 _Distance_constraint_stats_list.Viol_average_violations_only 0.0105 _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 4 MET 0.000 0.000 . 0 "[ . 1 . 2]" 1 5 SER 0.000 0.000 . 0 "[ . 1 . 2]" 1 7 ASP 0.033 0.024 1 0 "[ . 1 . 2]" 1 8 GLY 0.033 0.024 1 0 "[ . 1 . 2]" 1 9 LYS 0.044 0.044 10 0 "[ . 1 . 2]" 1 10 GLU 0.037 0.019 9 0 "[ . 1 . 2]" 1 11 GLU 0.057 0.020 4 0 "[ . 1 . 2]" 1 12 PRO 0.007 0.004 20 0 "[ . 1 . 2]" 1 13 GLY 0.096 0.015 18 0 "[ . 1 . 2]" 1 14 ILE 0.080 0.016 5 0 "[ . 1 . 2]" 1 15 ALA 0.116 0.020 18 0 "[ . 1 . 2]" 1 16 LYS 0.046 0.013 7 0 "[ . 1 . 2]" 1 17 LYS 0.552 0.035 14 0 "[ . 1 . 2]" 1 18 ILE 0.437 0.021 7 0 "[ . 1 . 2]" 1 19 ASN 0.133 0.019 5 0 "[ . 1 . 2]" 1 20 SER 0.022 0.009 5 0 "[ . 1 . 2]" 1 21 VAL 0.652 0.026 1 0 "[ . 1 . 2]" 1 22 ASP 0.000 0.000 . 0 "[ . 1 . 2]" 1 23 ASP 0.518 0.025 4 0 "[ . 1 . 2]" 1 24 ILE 1.442 0.044 2 0 "[ . 1 . 2]" 1 25 ILE 0.321 0.043 7 0 "[ . 1 . 2]" 1 26 ILE 0.546 0.129 7 0 "[ . 1 . 2]" 1 27 LYS 0.216 0.056 7 0 "[ . 1 . 2]" 1 28 CYS 0.728 0.061 13 0 "[ . 1 . 2]" 1 29 GLN 0.622 0.043 7 0 "[ . 1 . 2]" 1 30 CYS 0.178 0.066 6 0 "[ . 1 . 2]" 1 31 TRP 0.437 0.030 11 0 "[ . 1 . 2]" 1 32 VAL 0.341 0.019 3 0 "[ . 1 . 2]" 1 33 GLN 0.286 0.029 17 0 "[ . 1 . 2]" 1 34 LYS 0.159 0.055 14 0 "[ . 1 . 2]" 1 35 ASN 0.000 0.000 . 0 "[ . 1 . 2]" 1 36 ASP 0.000 0.000 . 0 "[ . 1 . 2]" 1 37 GLU 0.000 0.000 . 0 "[ . 1 . 2]" 1 38 GLU 0.493 0.101 17 0 "[ . 1 . 2]" 1 39 ARG 0.048 0.008 6 0 "[ . 1 . 2]" 1 40 LEU 0.699 0.029 20 0 "[ . 1 . 2]" 1 41 ALA 0.160 0.018 14 0 "[ . 1 . 2]" 1 42 GLU 0.129 0.019 11 0 "[ . 1 . 2]" 1 43 ILE 0.533 0.129 7 0 "[ . 1 . 2]" 1 44 LEU 0.091 0.012 11 0 "[ . 1 . 2]" 1 45 SER 0.140 0.013 20 0 "[ . 1 . 2]" 1 46 ILE 0.349 0.031 17 0 "[ . 1 . 2]" 1 47 ASN 0.090 0.011 7 0 "[ . 1 . 2]" 1 48 THR 0.456 0.022 16 0 "[ . 1 . 2]" 1 49 ARG 0.556 0.073 12 0 "[ . 1 . 2]" 1 50 LYS 0.019 0.007 13 0 "[ . 1 . 2]" 1 51 ALA 1.300 0.082 7 0 "[ . 1 . 2]" 1 52 PRO 0.060 0.008 8 0 "[ . 1 . 2]" 1 53 PRO 1.979 0.082 7 0 "[ . 1 . 2]" 1 54 LYS 0.161 0.020 20 0 "[ . 1 . 2]" 1 55 PHE 0.529 0.014 17 0 "[ . 1 . 2]" 1 56 TYR 0.045 0.022 11 0 "[ . 1 . 2]" 1 57 VAL 0.193 0.012 11 0 "[ . 1 . 2]" 1 58 HIS 0.911 0.071 11 0 "[ . 1 . 2]" 1 59 TYR 0.253 0.055 14 0 "[ . 1 . 2]" 1 60 VAL 0.350 0.016 16 0 "[ . 1 . 2]" 1 61 ASN 0.004 0.004 4 0 "[ . 1 . 2]" 1 62 TYR 0.020 0.012 11 0 "[ . 1 . 2]" 1 63 ASN 0.010 0.007 11 0 "[ . 1 . 2]" 1 64 LYS 0.013 0.004 10 0 "[ . 1 . 2]" 1 65 ARG 0.010 0.010 16 0 "[ . 1 . 2]" 1 66 LEU 0.832 0.071 11 0 "[ . 1 . 2]" 1 67 ASP 0.062 0.040 16 0 "[ . 1 . 2]" 1 68 GLU 0.054 0.035 11 0 "[ . 1 . 2]" 1 69 TRP 0.055 0.035 11 0 "[ . 1 . 2]" 1 70 ILE 0.096 0.026 11 0 "[ . 1 . 2]" 1 71 THR 0.002 0.002 16 0 "[ . 1 . 2]" 1 72 THR 0.176 0.010 11 0 "[ . 1 . 2]" 1 73 ASP 0.010 0.008 11 0 "[ . 1 . 2]" 1 74 ARG 0.132 0.026 11 0 "[ . 1 . 2]" 1 75 ILE 0.593 0.026 1 0 "[ . 1 . 2]" 1 76 ASN 0.012 0.006 17 0 "[ . 1 . 2]" 1 77 LEU 0.211 0.019 5 0 "[ . 1 . 2]" 1 78 ASP 0.014 0.007 12 0 "[ . 1 . 2]" 1 79 LYS 0.319 0.030 11 0 "[ . 1 . 2]" 1 80 GLU 0.634 0.035 14 0 "[ . 1 . 2]" 1 81 VAL 1.442 0.061 13 0 "[ . 1 . 2]" 1 82 LEU 0.372 0.026 11 0 "[ . 1 . 2]" 1 83 TYR 0.261 0.038 11 0 "[ . 1 . 2]" 1 84 PRO 0.006 0.005 13 0 "[ . 1 . 2]" 1 85 LYS 0.355 0.124 8 0 "[ . 1 . 2]" 1 86 LEU 0.007 0.004 11 0 "[ . 1 . 2]" 1 87 LYS 0.042 0.034 9 0 "[ . 1 . 2]" 1 88 ALA 0.008 0.007 3 0 "[ . 1 . 2]" 1 89 THR 0.000 0.000 . 0 "[ . 1 . 2]" 1 90 ASP 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 4 MET H 1 4 MET QB . . 3.300 2.487 2.142 3.169 . 0 0 "[ . 1 . 2]" 1 2 1 4 MET QB 1 4 MET ME . . 2.860 2.427 1.980 2.855 . 0 0 "[ . 1 . 2]" 1 3 1 4 MET HB2 1 5 SER H . . 5.500 3.726 2.102 4.485 . 0 0 "[ . 1 . 2]" 1 4 1 4 MET HB3 1 5 SER H . . 5.500 3.368 2.112 4.652 . 0 0 "[ . 1 . 2]" 1 5 1 7 ASP HA 1 7 ASP QB . . 2.480 2.349 2.169 2.479 . 0 0 "[ . 1 . 2]" 1 6 1 7 ASP HA 1 8 GLY H . . 3.550 2.586 2.146 3.574 0.024 1 0 "[ . 1 . 2]" 1 7 1 7 ASP QB 1 8 GLY H . . 4.470 2.712 1.966 3.983 . 0 0 "[ . 1 . 2]" 1 8 1 8 GLY H 1 9 LYS H . . 5.500 3.851 1.971 4.583 . 0 0 "[ . 1 . 2]" 1 9 1 9 LYS H 1 9 LYS QB . . 3.100 2.624 2.249 3.144 0.044 10 0 "[ . 1 . 2]" 1 10 1 9 LYS H 1 9 LYS QG . . 4.110 3.391 1.939 4.109 . 0 0 "[ . 1 . 2]" 1 11 1 9 LYS H 1 10 GLU H . . 4.340 3.702 2.456 4.332 . 0 0 "[ . 1 . 2]" 1 12 1 9 LYS HA 1 9 LYS QB . . 2.590 2.393 2.177 2.525 . 0 0 "[ . 1 . 2]" 1 13 1 9 LYS HA 1 9 LYS QD . . 4.550 3.231 2.074 4.265 . 0 0 "[ . 1 . 2]" 1 14 1 9 LYS HA 1 10 GLU H . . 3.140 2.420 2.141 3.051 . 0 0 "[ . 1 . 2]" 1 15 1 9 LYS QB 1 9 LYS QD . . 2.540 2.181 2.005 2.464 . 0 0 "[ . 1 . 2]" 1 16 1 9 LYS QE 1 9 LYS QG . . 3.370 2.245 2.080 2.499 . 0 0 "[ . 1 . 2]" 1 17 1 10 GLU H 1 10 GLU HB2 . . 3.710 2.931 2.249 3.695 . 0 0 "[ . 1 . 2]" 1 18 1 10 GLU H 1 10 GLU QB . . 2.890 2.523 2.224 2.732 . 0 0 "[ . 1 . 2]" 1 19 1 10 GLU H 1 10 GLU HB3 . . 3.710 2.890 2.497 3.676 . 0 0 "[ . 1 . 2]" 1 20 1 10 GLU H 1 10 GLU QG . . 4.250 3.880 2.155 4.246 . 0 0 "[ . 1 . 2]" 1 21 1 10 GLU H 1 11 GLU HA . . 5.210 4.971 4.497 5.229 0.019 9 0 "[ . 1 . 2]" 1 22 1 10 GLU HA 1 10 GLU QB . . 2.600 2.403 2.168 2.513 . 0 0 "[ . 1 . 2]" 1 23 1 10 GLU HA 1 10 GLU QG . . 3.840 2.572 2.070 3.436 . 0 0 "[ . 1 . 2]" 1 24 1 10 GLU HA 1 11 GLU H . . 2.400 2.239 2.140 2.406 0.006 9 0 "[ . 1 . 2]" 1 25 1 10 GLU HB2 1 10 GLU QG . . 2.740 2.356 2.132 2.482 . 0 0 "[ . 1 . 2]" 1 26 1 10 GLU HB3 1 10 GLU QG . . 2.740 2.257 2.137 2.496 . 0 0 "[ . 1 . 2]" 1 27 1 10 GLU QG 1 11 GLU H . . 3.280 2.864 2.356 3.278 . 0 0 "[ . 1 . 2]" 1 28 1 11 GLU H 1 11 GLU QB . . 2.930 2.361 2.151 2.950 0.020 4 0 "[ . 1 . 2]" 1 29 1 11 GLU HA 1 11 GLU QB . . 2.520 2.458 2.171 2.513 . 0 0 "[ . 1 . 2]" 1 30 1 11 GLU HA 1 11 GLU QG . . 3.730 2.463 2.135 3.443 . 0 0 "[ . 1 . 2]" 1 31 1 11 GLU HA 1 12 PRO HD2 . . 2.770 2.502 2.441 2.514 . 0 0 "[ . 1 . 2]" 1 32 1 11 GLU HA 1 12 PRO QD . . 2.370 2.150 2.113 2.157 . 0 0 "[ . 1 . 2]" 1 33 1 11 GLU HA 1 12 PRO HD3 . . 2.770 2.343 2.314 2.348 . 0 0 "[ . 1 . 2]" 1 34 1 11 GLU QB 1 12 PRO QD . . 4.190 1.997 1.936 2.099 . 0 0 "[ . 1 . 2]" 1 35 1 11 GLU QG 1 12 PRO QD . . 4.040 2.671 2.069 3.789 . 0 0 "[ . 1 . 2]" 1 36 1 12 PRO HA 1 13 GLY H . . 2.700 2.543 2.419 2.642 . 0 0 "[ . 1 . 2]" 1 37 1 12 PRO HA 1 14 ILE MD . . 5.320 4.518 4.033 5.213 . 0 0 "[ . 1 . 2]" 1 38 1 12 PRO HA 1 85 LYS QB . . 5.340 3.274 1.985 3.883 . 0 0 "[ . 1 . 2]" 1 39 1 12 PRO HA 1 85 LYS QD . . 5.500 2.680 1.909 4.433 . 0 0 "[ . 1 . 2]" 1 40 1 12 PRO HA 1 85 LYS HG2 . . 5.500 3.347 1.991 5.494 . 0 0 "[ . 1 . 2]" 1 41 1 12 PRO HA 1 85 LYS QG . . 4.790 3.099 1.981 4.093 . 0 0 "[ . 1 . 2]" 1 42 1 12 PRO HA 1 85 LYS HG3 . . 5.500 4.336 3.609 5.370 . 0 0 "[ . 1 . 2]" 1 43 1 12 PRO HB2 1 13 GLY H . . 3.660 2.291 2.077 2.579 . 0 0 "[ . 1 . 2]" 1 44 1 12 PRO HB2 1 13 GLY HA2 . . 4.150 3.878 3.749 4.013 . 0 0 "[ . 1 . 2]" 1 45 1 12 PRO HB2 1 14 ILE MD . . 5.030 4.708 4.325 5.034 0.004 20 0 "[ . 1 . 2]" 1 46 1 12 PRO HB2 1 85 LYS QB . . 4.210 2.576 1.923 3.183 . 0 0 "[ . 1 . 2]" 1 47 1 12 PRO HB3 1 13 GLY H . . 3.820 3.305 3.213 3.438 . 0 0 "[ . 1 . 2]" 1 48 1 12 PRO QG 1 85 LYS QB . . 5.150 4.007 3.245 4.660 . 0 0 "[ . 1 . 2]" 1 49 1 13 GLY H 1 13 GLY HA2 . . 2.540 2.393 2.313 2.425 . 0 0 "[ . 1 . 2]" 1 50 1 13 GLY H 1 14 ILE H . . 3.710 3.465 3.274 3.688 . 0 0 "[ . 1 . 2]" 1 51 1 13 GLY H 1 14 ILE MD . . 4.140 3.032 2.612 3.772 . 0 0 "[ . 1 . 2]" 1 52 1 13 GLY H 1 14 ILE QG . . 4.890 3.752 3.184 4.255 . 0 0 "[ . 1 . 2]" 1 53 1 13 GLY H 1 85 LYS H . . 5.090 4.406 3.223 5.058 . 0 0 "[ . 1 . 2]" 1 54 1 13 GLY H 1 85 LYS QB . . 4.290 2.046 1.879 2.557 . 0 0 "[ . 1 . 2]" 1 55 1 13 GLY HA2 1 14 ILE H . . 3.070 2.163 2.139 2.193 . 0 0 "[ . 1 . 2]" 1 56 1 13 GLY HA2 1 14 ILE MD . . 4.930 3.501 2.935 4.846 . 0 0 "[ . 1 . 2]" 1 57 1 13 GLY HA2 1 14 ILE QG . . 4.580 4.247 3.964 4.510 . 0 0 "[ . 1 . 2]" 1 58 1 13 GLY HA2 1 82 LEU MD1 . . 5.500 4.312 2.737 5.501 0.001 9 0 "[ . 1 . 2]" 1 59 1 13 GLY HA2 1 82 LEU QD . . 4.220 3.627 2.728 4.228 0.008 13 0 "[ . 1 . 2]" 1 60 1 13 GLY HA2 1 82 LEU MD2 . . 5.500 4.856 3.948 5.515 0.015 1 0 "[ . 1 . 2]" 1 61 1 13 GLY HA2 1 83 TYR H . . 4.930 4.728 4.446 4.941 0.011 11 0 "[ . 1 . 2]" 1 62 1 13 GLY HA2 1 85 LYS H . . 5.000 4.840 4.508 5.015 0.015 18 0 "[ . 1 . 2]" 1 63 1 13 GLY HA2 1 85 LYS QB . . 5.140 3.469 2.849 4.211 . 0 0 "[ . 1 . 2]" 1 64 1 13 GLY HA2 1 85 LYS QD . . 5.490 4.110 1.918 5.237 . 0 0 "[ . 1 . 2]" 1 65 1 13 GLY HA3 1 14 ILE H . . 3.460 3.360 3.253 3.421 . 0 0 "[ . 1 . 2]" 1 66 1 13 GLY HA3 1 14 ILE QG . . 5.320 4.875 4.413 5.173 . 0 0 "[ . 1 . 2]" 1 67 1 13 GLY HA3 1 82 LEU QD . . 4.970 3.727 3.048 4.518 . 0 0 "[ . 1 . 2]" 1 68 1 13 GLY HA3 1 85 LYS QB . . 5.340 4.487 4.119 5.079 . 0 0 "[ . 1 . 2]" 1 69 1 13 GLY HA3 1 85 LYS QD . . 5.500 4.646 2.933 5.405 . 0 0 "[ . 1 . 2]" 1 70 1 14 ILE H 1 14 ILE HB . . 3.530 2.614 2.538 2.731 . 0 0 "[ . 1 . 2]" 1 71 1 14 ILE H 1 14 ILE MD . . 3.690 2.454 1.941 3.674 . 0 0 "[ . 1 . 2]" 1 72 1 14 ILE H 1 14 ILE HG12 . . 4.220 4.125 4.011 4.224 0.004 5 0 "[ . 1 . 2]" 1 73 1 14 ILE H 1 14 ILE QG . . 3.470 2.994 2.723 3.183 . 0 0 "[ . 1 . 2]" 1 74 1 14 ILE H 1 14 ILE HG13 . . 4.220 3.079 2.763 3.310 . 0 0 "[ . 1 . 2]" 1 75 1 14 ILE H 1 82 LEU QD . . 4.170 3.696 2.612 4.186 0.016 5 0 "[ . 1 . 2]" 1 76 1 14 ILE H 1 83 TYR H . . 3.750 3.252 2.853 3.508 . 0 0 "[ . 1 . 2]" 1 77 1 14 ILE H 1 83 TYR HB2 . . 4.310 4.054 3.595 4.285 . 0 0 "[ . 1 . 2]" 1 78 1 14 ILE HA 1 14 ILE MD . . 4.040 3.573 3.391 3.879 . 0 0 "[ . 1 . 2]" 1 79 1 14 ILE HA 1 14 ILE QG . . 3.670 2.390 2.314 2.449 . 0 0 "[ . 1 . 2]" 1 80 1 14 ILE HA 1 14 ILE MG . . 2.480 2.298 2.227 2.382 . 0 0 "[ . 1 . 2]" 1 81 1 14 ILE HA 1 15 ALA H . . 2.400 2.157 2.139 2.229 . 0 0 "[ . 1 . 2]" 1 82 1 14 ILE HA 1 15 ALA MB . . 4.930 3.976 3.894 4.028 . 0 0 "[ . 1 . 2]" 1 83 1 14 ILE HA 1 85 LYS QD . . 5.500 4.762 4.035 5.504 0.004 8 0 "[ . 1 . 2]" 1 84 1 14 ILE HB 1 14 ILE MD . . 2.810 2.118 2.051 2.226 . 0 0 "[ . 1 . 2]" 1 85 1 14 ILE HB 1 15 ALA H . . 4.250 4.157 3.936 4.256 0.006 7 0 "[ . 1 . 2]" 1 86 1 14 ILE HB 1 83 TYR H . . 4.210 3.259 2.762 3.751 . 0 0 "[ . 1 . 2]" 1 87 1 14 ILE HB 1 83 TYR HB2 . . 3.820 2.372 2.060 2.709 . 0 0 "[ . 1 . 2]" 1 88 1 14 ILE HB 1 83 TYR HB3 . . 4.520 3.527 3.071 3.954 . 0 0 "[ . 1 . 2]" 1 89 1 14 ILE MD 1 83 TYR HB2 . . 5.500 3.289 2.849 3.686 . 0 0 "[ . 1 . 2]" 1 90 1 14 ILE MD 1 83 TYR HB3 . . 5.310 3.420 2.892 3.856 . 0 0 "[ . 1 . 2]" 1 91 1 14 ILE MD 1 84 PRO HA . . 5.500 4.026 3.626 4.516 . 0 0 "[ . 1 . 2]" 1 92 1 14 ILE MD 1 84 PRO QG . . 5.500 4.447 4.145 4.713 . 0 0 "[ . 1 . 2]" 1 93 1 14 ILE MD 1 85 LYS H . . 5.260 3.700 3.282 4.228 . 0 0 "[ . 1 . 2]" 1 94 1 14 ILE MD 1 85 LYS HA . . 4.210 2.105 1.915 2.494 . 0 0 "[ . 1 . 2]" 1 95 1 14 ILE MD 1 85 LYS QB . . 4.420 2.269 1.875 3.032 . 0 0 "[ . 1 . 2]" 1 96 1 14 ILE MD 1 85 LYS QD . . 3.290 2.156 1.803 2.916 . 0 0 "[ . 1 . 2]" 1 97 1 14 ILE MD 1 85 LYS QE . . 5.500 3.756 3.322 4.425 . 0 0 "[ . 1 . 2]" 1 98 1 14 ILE QG 1 14 ILE MG . . 2.560 2.021 1.937 2.200 . 0 0 "[ . 1 . 2]" 1 99 1 14 ILE QG 1 15 ALA H . . 5.330 4.212 4.016 4.357 . 0 0 "[ . 1 . 2]" 1 100 1 14 ILE MG 1 15 ALA H . . 3.090 2.546 2.015 2.951 . 0 0 "[ . 1 . 2]" 1 101 1 14 ILE MG 1 15 ALA MB . . 4.600 4.076 3.829 4.294 . 0 0 "[ . 1 . 2]" 1 102 1 14 ILE MG 1 16 LYS QE . . 3.990 2.368 1.970 2.727 . 0 0 "[ . 1 . 2]" 1 103 1 14 ILE MG 1 16 LYS HG2 . . 4.870 3.789 3.531 4.077 . 0 0 "[ . 1 . 2]" 1 104 1 14 ILE MG 1 83 TYR HB2 . . 4.300 3.155 2.496 3.571 . 0 0 "[ . 1 . 2]" 1 105 1 14 ILE MG 1 83 TYR HB3 . . 5.500 4.315 3.757 4.795 . 0 0 "[ . 1 . 2]" 1 106 1 14 ILE MG 1 83 TYR QD . . 5.500 3.664 3.250 4.046 . 0 0 "[ . 1 . 2]" 1 107 1 15 ALA H 1 16 LYS H . . 4.510 4.271 4.064 4.404 . 0 0 "[ . 1 . 2]" 1 108 1 15 ALA HA 1 16 LYS H . . 2.400 2.146 2.140 2.188 . 0 0 "[ . 1 . 2]" 1 109 1 15 ALA HA 1 80 GLU HB2 . . 5.340 5.067 4.783 5.301 . 0 0 "[ . 1 . 2]" 1 110 1 15 ALA HA 1 80 GLU HB3 . . 5.010 4.133 3.925 4.403 . 0 0 "[ . 1 . 2]" 1 111 1 15 ALA HA 1 82 LEU HA . . 3.840 2.800 2.655 2.920 . 0 0 "[ . 1 . 2]" 1 112 1 15 ALA HA 1 82 LEU HB3 . . 5.500 5.386 5.032 5.520 0.020 18 0 "[ . 1 . 2]" 1 113 1 15 ALA HA 1 82 LEU QD . . 3.000 2.731 2.532 2.989 . 0 0 "[ . 1 . 2]" 1 114 1 15 ALA HA 1 83 TYR H . . 4.200 3.716 3.456 3.931 . 0 0 "[ . 1 . 2]" 1 115 1 15 ALA HA 1 83 TYR QD . . 5.500 4.224 3.899 4.545 . 0 0 "[ . 1 . 2]" 1 116 1 15 ALA MB 1 80 GLU HA . . 5.060 4.974 4.862 5.044 . 0 0 "[ . 1 . 2]" 1 117 1 15 ALA MB 1 80 GLU HB2 . . 3.730 3.504 3.318 3.609 . 0 0 "[ . 1 . 2]" 1 118 1 15 ALA MB 1 80 GLU HB3 . . 2.920 2.859 2.734 2.929 0.009 17 0 "[ . 1 . 2]" 1 119 1 15 ALA MB 1 81 VAL H . . 5.150 4.488 4.163 4.660 . 0 0 "[ . 1 . 2]" 1 120 1 15 ALA MB 1 82 LEU HA . . 4.150 3.832 3.571 4.063 . 0 0 "[ . 1 . 2]" 1 121 1 15 ALA MB 1 82 LEU QD . . 2.550 2.384 2.137 2.547 . 0 0 "[ . 1 . 2]" 1 122 1 15 ALA MB 1 83 TYR H . . 5.110 4.821 4.568 5.065 . 0 0 "[ . 1 . 2]" 1 123 1 16 LYS H 1 16 LYS HG2 . . 2.840 2.490 2.368 2.570 . 0 0 "[ . 1 . 2]" 1 124 1 16 LYS H 1 17 LYS H . . 5.500 4.397 4.375 4.454 . 0 0 "[ . 1 . 2]" 1 125 1 16 LYS H 1 18 ILE MG . . 5.500 5.073 4.880 5.191 . 0 0 "[ . 1 . 2]" 1 126 1 16 LYS H 1 81 VAL H . . 3.720 3.163 2.964 3.300 . 0 0 "[ . 1 . 2]" 1 127 1 16 LYS H 1 81 VAL MG2 . . 5.500 4.749 4.558 4.924 . 0 0 "[ . 1 . 2]" 1 128 1 16 LYS H 1 83 TYR QD . . 4.450 3.360 3.126 3.565 . 0 0 "[ . 1 . 2]" 1 129 1 16 LYS HA 1 16 LYS HB2 . . 2.900 2.375 2.360 2.411 . 0 0 "[ . 1 . 2]" 1 130 1 16 LYS HA 1 16 LYS HB3 . . 2.600 2.529 2.487 2.547 . 0 0 "[ . 1 . 2]" 1 131 1 16 LYS HA 1 17 LYS H . . 2.400 2.257 2.230 2.300 . 0 0 "[ . 1 . 2]" 1 132 1 16 LYS HB2 1 16 LYS HD2 . . 4.060 3.634 3.499 3.744 . 0 0 "[ . 1 . 2]" 1 133 1 16 LYS HB2 1 16 LYS QD . . 3.470 2.386 2.209 2.540 . 0 0 "[ . 1 . 2]" 1 134 1 16 LYS HB2 1 16 LYS HD3 . . 4.060 2.420 2.233 2.584 . 0 0 "[ . 1 . 2]" 1 135 1 16 LYS HB2 1 16 LYS QE . . 4.640 3.339 3.072 3.698 . 0 0 "[ . 1 . 2]" 1 136 1 16 LYS HB2 1 17 LYS H . . 3.000 2.864 2.728 2.958 . 0 0 "[ . 1 . 2]" 1 137 1 16 LYS HB2 1 18 ILE MG . . 4.200 3.845 3.661 3.949 . 0 0 "[ . 1 . 2]" 1 138 1 16 LYS HB2 1 83 TYR QD . . 5.210 4.937 4.731 5.132 . 0 0 "[ . 1 . 2]" 1 139 1 16 LYS HB2 1 83 TYR QE . . 4.710 4.658 4.598 4.723 0.013 7 0 "[ . 1 . 2]" 1 140 1 16 LYS HB3 1 16 LYS QD . . 3.520 2.786 2.701 2.862 . 0 0 "[ . 1 . 2]" 1 141 1 16 LYS HB3 1 16 LYS QE . . 4.430 2.378 1.992 2.789 . 0 0 "[ . 1 . 2]" 1 142 1 16 LYS HB3 1 18 ILE MG . . 4.880 4.768 4.616 4.877 . 0 0 "[ . 1 . 2]" 1 143 1 16 LYS HB3 1 83 TYR QD . . 5.390 3.984 3.755 4.184 . 0 0 "[ . 1 . 2]" 1 144 1 16 LYS HB3 1 83 TYR QE . . 4.600 4.576 4.490 4.609 0.009 7 0 "[ . 1 . 2]" 1 145 1 16 LYS QD 1 16 LYS QE . . 2.420 2.050 2.026 2.087 . 0 0 "[ . 1 . 2]" 1 146 1 16 LYS QD 1 16 LYS HG2 . . 2.510 2.408 2.370 2.453 . 0 0 "[ . 1 . 2]" 1 147 1 16 LYS QD 1 16 LYS HG3 . . 2.430 2.171 2.163 2.177 . 0 0 "[ . 1 . 2]" 1 148 1 16 LYS QD 1 83 TYR QD . . 5.340 3.237 2.688 3.631 . 0 0 "[ . 1 . 2]" 1 149 1 16 LYS QD 1 83 TYR QE . . 3.860 2.357 2.211 2.552 . 0 0 "[ . 1 . 2]" 1 150 1 16 LYS QE 1 16 LYS HG2 . . 2.400 2.195 2.101 2.308 . 0 0 "[ . 1 . 2]" 1 151 1 16 LYS QE 1 18 ILE MG . . 4.470 4.301 4.089 4.472 0.002 5 0 "[ . 1 . 2]" 1 152 1 16 LYS QE 1 83 TYR QD . . 4.940 2.321 1.961 2.805 . 0 0 "[ . 1 . 2]" 1 153 1 16 LYS QE 1 83 TYR QE . . 4.780 3.321 2.998 3.713 . 0 0 "[ . 1 . 2]" 1 154 1 16 LYS HG2 1 81 VAL H . . 5.500 4.382 4.135 4.608 . 0 0 "[ . 1 . 2]" 1 155 1 16 LYS HG2 1 83 TYR QD . . 5.500 2.066 1.991 2.232 . 0 0 "[ . 1 . 2]" 1 156 1 16 LYS HG2 1 83 TYR QE . . 4.120 2.264 2.154 2.420 . 0 0 "[ . 1 . 2]" 1 157 1 16 LYS HG3 1 17 LYS H . . 3.860 3.734 3.663 3.854 . 0 0 "[ . 1 . 2]" 1 158 1 16 LYS HG3 1 18 ILE MG . . 4.030 2.328 2.083 2.575 . 0 0 "[ . 1 . 2]" 1 159 1 16 LYS HG3 1 83 TYR QD . . 5.500 3.593 3.409 3.807 . 0 0 "[ . 1 . 2]" 1 160 1 16 LYS HG3 1 83 TYR QE . . 4.980 2.445 2.308 2.536 . 0 0 "[ . 1 . 2]" 1 161 1 17 LYS H 1 18 ILE H . . 4.480 4.357 4.253 4.501 0.021 7 0 "[ . 1 . 2]" 1 162 1 17 LYS H 1 80 GLU HB3 . . 4.890 4.881 4.770 4.909 0.019 5 0 "[ . 1 . 2]" 1 163 1 17 LYS HA 1 17 LYS QB . . 2.520 2.456 2.321 2.530 0.010 1 0 "[ . 1 . 2]" 1 164 1 17 LYS HA 1 17 LYS QG . . 3.600 2.327 2.174 2.524 . 0 0 "[ . 1 . 2]" 1 165 1 17 LYS HA 1 18 ILE H . . 2.400 2.146 2.140 2.178 . 0 0 "[ . 1 . 2]" 1 166 1 17 LYS HA 1 18 ILE MG . . 4.540 3.877 3.669 4.005 . 0 0 "[ . 1 . 2]" 1 167 1 17 LYS HA 1 80 GLU HA . . 2.700 2.718 2.703 2.735 0.035 14 0 "[ . 1 . 2]" 1 168 1 17 LYS HA 1 80 GLU QG . . 4.320 4.225 3.949 4.332 0.012 17 0 "[ . 1 . 2]" 1 169 1 17 LYS HA 1 81 VAL H . . 4.230 2.820 2.660 2.961 . 0 0 "[ . 1 . 2]" 1 170 1 17 LYS HA 1 81 VAL MG2 . . 4.680 3.045 2.813 3.400 . 0 0 "[ . 1 . 2]" 1 171 1 17 LYS QB 1 17 LYS QE . . 4.180 2.922 1.976 3.653 . 0 0 "[ . 1 . 2]" 1 172 1 17 LYS QB 1 18 ILE H . . 3.750 3.448 3.143 3.749 . 0 0 "[ . 1 . 2]" 1 173 1 17 LYS QB 1 80 GLU HA . . 4.650 3.843 3.564 4.113 . 0 0 "[ . 1 . 2]" 1 174 1 17 LYS HB2 1 80 GLU QG . . 4.710 4.296 3.197 4.713 0.003 20 0 "[ . 1 . 2]" 1 175 1 17 LYS HB3 1 80 GLU QG . . 4.710 4.616 4.234 4.716 0.006 4 0 "[ . 1 . 2]" 1 176 1 17 LYS QD 1 80 GLU H . . 4.370 3.841 2.678 4.374 0.004 9 0 "[ . 1 . 2]" 1 177 1 17 LYS QD 1 80 GLU HA . . 4.790 3.169 2.003 3.819 . 0 0 "[ . 1 . 2]" 1 178 1 17 LYS QD 1 80 GLU QG . . 3.800 2.532 2.074 3.379 . 0 0 "[ . 1 . 2]" 1 179 1 17 LYS QE 1 17 LYS QG . . 3.330 2.196 1.948 2.680 . 0 0 "[ . 1 . 2]" 1 180 1 17 LYS QE 1 80 GLU H . . 4.850 4.253 2.654 4.854 0.004 9 0 "[ . 1 . 2]" 1 181 1 17 LYS QG 1 80 GLU H . . 4.910 3.695 3.432 4.087 . 0 0 "[ . 1 . 2]" 1 182 1 17 LYS QG 1 80 GLU HA . . 4.000 2.048 1.899 2.512 . 0 0 "[ . 1 . 2]" 1 183 1 17 LYS QG 1 80 GLU QG . . 3.100 2.089 1.957 3.069 . 0 0 "[ . 1 . 2]" 1 184 1 17 LYS QG 1 81 VAL H . . 5.340 3.495 3.316 4.022 . 0 0 "[ . 1 . 2]" 1 185 1 18 ILE H 1 18 ILE HB . . 3.990 3.729 3.675 3.851 . 0 0 "[ . 1 . 2]" 1 186 1 18 ILE H 1 18 ILE QG . . 3.840 2.156 2.081 2.320 . 0 0 "[ . 1 . 2]" 1 187 1 18 ILE H 1 18 ILE MG . . 3.890 2.792 2.589 3.113 . 0 0 "[ . 1 . 2]" 1 188 1 18 ILE H 1 19 ASN H . . 5.180 4.498 4.435 4.543 . 0 0 "[ . 1 . 2]" 1 189 1 18 ILE H 1 77 LEU QD . . 4.530 3.818 3.567 4.233 . 0 0 "[ . 1 . 2]" 1 190 1 18 ILE H 1 80 GLU HA . . 4.820 4.396 4.245 4.511 . 0 0 "[ . 1 . 2]" 1 191 1 18 ILE H 1 81 VAL MG2 . . 4.160 2.478 2.301 2.848 . 0 0 "[ . 1 . 2]" 1 192 1 18 ILE HA 1 18 ILE HB . . 2.550 2.469 2.433 2.496 . 0 0 "[ . 1 . 2]" 1 193 1 18 ILE HA 1 18 ILE MD . . 4.370 4.115 4.052 4.156 . 0 0 "[ . 1 . 2]" 1 194 1 18 ILE HA 1 18 ILE QG . . 4.010 3.307 3.303 3.310 . 0 0 "[ . 1 . 2]" 1 195 1 18 ILE HA 1 18 ILE MG . . 2.400 2.302 2.208 2.396 . 0 0 "[ . 1 . 2]" 1 196 1 18 ILE HA 1 19 ASN H . . 2.680 2.472 2.344 2.571 . 0 0 "[ . 1 . 2]" 1 197 1 18 ILE HB 1 18 ILE MD . . 2.640 2.226 2.122 2.323 . 0 0 "[ . 1 . 2]" 1 198 1 18 ILE HB 1 19 ASN H . . 3.810 2.242 2.047 2.519 . 0 0 "[ . 1 . 2]" 1 199 1 18 ILE HB 1 19 ASN QB . . 4.990 4.649 4.437 4.960 . 0 0 "[ . 1 . 2]" 1 200 1 18 ILE HB 1 20 SER H . . 3.760 2.505 2.418 2.811 . 0 0 "[ . 1 . 2]" 1 201 1 18 ILE HB 1 23 ASP HB2 . . 4.560 3.782 3.592 4.568 0.008 3 0 "[ . 1 . 2]" 1 202 1 18 ILE HB 1 23 ASP QB . . 3.810 3.560 3.464 3.808 . 0 0 "[ . 1 . 2]" 1 203 1 18 ILE HB 1 23 ASP HB3 . . 4.560 4.500 3.719 4.578 0.018 1 0 "[ . 1 . 2]" 1 204 1 18 ILE HB 1 77 LEU QD . . 4.360 3.760 3.569 4.150 . 0 0 "[ . 1 . 2]" 1 205 1 18 ILE MD 1 18 ILE MG . . 2.750 2.381 2.024 2.563 . 0 0 "[ . 1 . 2]" 1 206 1 18 ILE MD 1 20 SER H . . 4.280 2.809 2.374 3.647 . 0 0 "[ . 1 . 2]" 1 207 1 18 ILE MD 1 21 VAL HA . . 4.110 3.195 2.996 3.289 . 0 0 "[ . 1 . 2]" 1 208 1 18 ILE MD 1 21 VAL HB . . 5.200 5.175 4.948 5.215 0.015 14 0 "[ . 1 . 2]" 1 209 1 18 ILE MD 1 21 VAL QG . . 4.590 3.950 3.822 4.059 . 0 0 "[ . 1 . 2]" 1 210 1 18 ILE MD 1 23 ASP H . . 4.040 3.719 3.568 3.900 . 0 0 "[ . 1 . 2]" 1 211 1 18 ILE MD 1 23 ASP HB2 . . 3.760 2.898 2.593 3.760 0.000 7 0 "[ . 1 . 2]" 1 212 1 18 ILE MD 1 23 ASP QB . . 3.150 2.667 2.494 2.926 . 0 0 "[ . 1 . 2]" 1 213 1 18 ILE MD 1 23 ASP HB3 . . 3.760 3.311 2.531 3.666 . 0 0 "[ . 1 . 2]" 1 214 1 18 ILE MD 1 24 ILE HA . . 4.510 4.146 3.976 4.481 . 0 0 "[ . 1 . 2]" 1 215 1 18 ILE MD 1 24 ILE MD . . 4.030 3.183 2.972 3.525 . 0 0 "[ . 1 . 2]" 1 216 1 18 ILE MD 1 24 ILE HG13 . . 3.840 3.145 2.962 3.432 . 0 0 "[ . 1 . 2]" 1 217 1 18 ILE MD 1 77 LEU QD . . 2.550 2.364 1.993 2.544 . 0 0 "[ . 1 . 2]" 1 218 1 18 ILE MD 1 81 VAL HB . . 4.150 4.079 3.762 4.156 0.006 14 0 "[ . 1 . 2]" 1 219 1 18 ILE MD 1 81 VAL MG2 . . 2.410 2.395 2.251 2.425 0.015 17 0 "[ . 1 . 2]" 1 220 1 18 ILE MD 1 83 TYR QE . . 4.400 3.929 3.539 4.171 . 0 0 "[ . 1 . 2]" 1 221 1 18 ILE QG 1 18 ILE MG . . 2.400 2.120 1.991 2.323 . 0 0 "[ . 1 . 2]" 1 222 1 18 ILE QG 1 19 ASN H . . 4.070 3.562 3.138 3.824 . 0 0 "[ . 1 . 2]" 1 223 1 18 ILE QG 1 20 SER H . . 4.210 3.445 2.821 4.213 0.003 13 0 "[ . 1 . 2]" 1 224 1 18 ILE QG 1 77 LEU MD1 . . 4.740 3.450 1.992 4.741 0.001 17 0 "[ . 1 . 2]" 1 225 1 18 ILE QG 1 77 LEU QD . . 3.560 2.325 1.988 2.771 . 0 0 "[ . 1 . 2]" 1 226 1 18 ILE QG 1 77 LEU MD2 . . 4.740 3.254 2.127 4.444 . 0 0 "[ . 1 . 2]" 1 227 1 18 ILE QG 1 81 VAL HB . . 4.280 3.044 2.701 3.481 . 0 0 "[ . 1 . 2]" 1 228 1 18 ILE QG 1 81 VAL MG2 . . 3.390 1.896 1.834 2.016 . 0 0 "[ . 1 . 2]" 1 229 1 18 ILE MG 1 19 ASN H . . 3.700 3.589 3.534 3.696 . 0 0 "[ . 1 . 2]" 1 230 1 18 ILE MG 1 20 SER H . . 4.380 4.120 4.062 4.298 . 0 0 "[ . 1 . 2]" 1 231 1 18 ILE MG 1 23 ASP HB2 . . 4.080 3.464 3.126 4.084 0.004 7 0 "[ . 1 . 2]" 1 232 1 18 ILE MG 1 23 ASP QB . . 3.580 2.987 2.786 3.089 . 0 0 "[ . 1 . 2]" 1 233 1 18 ILE MG 1 23 ASP HB3 . . 4.080 3.283 3.087 3.409 . 0 0 "[ . 1 . 2]" 1 234 1 18 ILE MG 1 81 VAL HB . . 4.340 3.353 3.071 3.667 . 0 0 "[ . 1 . 2]" 1 235 1 18 ILE MG 1 81 VAL MG1 . . 4.060 3.658 3.468 4.057 . 0 0 "[ . 1 . 2]" 1 236 1 18 ILE MG 1 83 TYR QE . . 3.020 2.656 2.297 2.974 . 0 0 "[ . 1 . 2]" 1 237 1 19 ASN H 1 19 ASN HB2 . . 4.040 2.920 2.405 3.885 . 0 0 "[ . 1 . 2]" 1 238 1 19 ASN H 1 19 ASN QB . . 3.330 2.655 2.370 3.086 . 0 0 "[ . 1 . 2]" 1 239 1 19 ASN H 1 19 ASN HB3 . . 4.040 3.397 2.858 3.903 . 0 0 "[ . 1 . 2]" 1 240 1 19 ASN H 1 20 SER H . . 2.550 2.043 1.891 2.286 . 0 0 "[ . 1 . 2]" 1 241 1 19 ASN H 1 20 SER QB . . 5.340 4.027 3.435 4.323 . 0 0 "[ . 1 . 2]" 1 242 1 19 ASN H 1 77 LEU QB . . 5.340 5.346 5.331 5.359 0.019 5 0 "[ . 1 . 2]" 1 243 1 19 ASN H 1 77 LEU QD . . 4.810 3.644 3.352 4.170 . 0 0 "[ . 1 . 2]" 1 244 1 19 ASN HA 1 19 ASN QD . . 3.830 3.043 2.195 3.830 0.000 15 0 "[ . 1 . 2]" 1 245 1 19 ASN HA 1 20 SER H . . 3.460 3.127 3.031 3.458 . 0 0 "[ . 1 . 2]" 1 246 1 19 ASN HA 1 77 LEU HB2 . . 4.570 4.235 4.141 4.366 . 0 0 "[ . 1 . 2]" 1 247 1 19 ASN HA 1 77 LEU QB . . 3.850 2.820 2.741 2.959 . 0 0 "[ . 1 . 2]" 1 248 1 19 ASN HA 1 77 LEU HB3 . . 4.570 2.863 2.778 3.010 . 0 0 "[ . 1 . 2]" 1 249 1 19 ASN HA 1 77 LEU MD1 . . 4.620 2.501 2.025 3.234 . 0 0 "[ . 1 . 2]" 1 250 1 19 ASN HA 1 77 LEU QD . . 4.000 2.273 2.021 2.628 . 0 0 "[ . 1 . 2]" 1 251 1 19 ASN HA 1 77 LEU MD2 . . 4.620 3.399 2.188 4.555 . 0 0 "[ . 1 . 2]" 1 252 1 19 ASN QB 1 20 SER H . . 4.080 3.616 2.922 3.999 . 0 0 "[ . 1 . 2]" 1 253 1 19 ASN QB 1 20 SER QB . . 5.180 4.676 3.914 5.181 0.001 15 0 "[ . 1 . 2]" 1 254 1 19 ASN QB 1 77 LEU QD . . 4.850 3.693 3.306 4.062 . 0 0 "[ . 1 . 2]" 1 255 1 20 SER H 1 20 SER HB2 . . 4.200 2.999 2.706 3.790 . 0 0 "[ . 1 . 2]" 1 256 1 20 SER H 1 20 SER QB . . 3.670 2.849 2.595 3.205 . 0 0 "[ . 1 . 2]" 1 257 1 20 SER H 1 20 SER HB3 . . 4.200 3.796 2.672 3.920 . 0 0 "[ . 1 . 2]" 1 258 1 20 SER H 1 21 VAL H . . 4.920 4.303 4.164 4.544 . 0 0 "[ . 1 . 2]" 1 259 1 20 SER H 1 77 LEU QD . . 4.200 2.852 2.536 3.569 . 0 0 "[ . 1 . 2]" 1 260 1 20 SER HA 1 20 SER QB . . 2.310 2.273 2.183 2.309 . 0 0 "[ . 1 . 2]" 1 261 1 20 SER HA 1 21 VAL H . . 2.410 2.175 2.141 2.238 . 0 0 "[ . 1 . 2]" 1 262 1 20 SER HA 1 21 VAL MG1 . . 5.260 3.529 3.447 3.589 . 0 0 "[ . 1 . 2]" 1 263 1 20 SER HA 1 21 VAL QG . . 4.430 3.301 3.264 3.333 . 0 0 "[ . 1 . 2]" 1 264 1 20 SER HA 1 21 VAL MG2 . . 5.260 3.975 3.848 4.054 . 0 0 "[ . 1 . 2]" 1 265 1 20 SER HA 1 77 LEU MD1 . . 4.810 3.590 3.134 3.868 . 0 0 "[ . 1 . 2]" 1 266 1 20 SER HA 1 77 LEU QD . . 3.700 3.421 3.035 3.709 0.009 5 0 "[ . 1 . 2]" 1 267 1 20 SER HA 1 77 LEU MD2 . . 4.810 4.334 3.767 4.811 0.001 7 0 "[ . 1 . 2]" 1 268 1 20 SER QB 1 21 VAL H . . 4.200 3.107 2.843 3.669 . 0 0 "[ . 1 . 2]" 1 269 1 20 SER QB 1 21 VAL QG . . 5.110 3.788 3.664 4.291 . 0 0 "[ . 1 . 2]" 1 270 1 20 SER QB 1 22 ASP H . . 4.010 2.726 2.551 3.592 . 0 0 "[ . 1 . 2]" 1 271 1 20 SER QB 1 22 ASP QB . . 4.070 2.891 2.784 3.590 . 0 0 "[ . 1 . 2]" 1 272 1 20 SER QB 1 23 ASP H . . 4.450 2.958 2.791 3.523 . 0 0 "[ . 1 . 2]" 1 273 1 20 SER QB 1 77 LEU QD . . 5.280 4.393 4.226 4.532 . 0 0 "[ . 1 . 2]" 1 274 1 21 VAL H 1 21 VAL HB . . 3.950 3.633 3.616 3.657 . 0 0 "[ . 1 . 2]" 1 275 1 21 VAL H 1 21 VAL QG . . 2.460 1.912 1.839 1.969 . 0 0 "[ . 1 . 2]" 1 276 1 21 VAL H 1 22 ASP H . . 3.500 2.481 2.364 2.599 . 0 0 "[ . 1 . 2]" 1 277 1 21 VAL H 1 23 ASP H . . 5.280 4.472 4.399 4.637 . 0 0 "[ . 1 . 2]" 1 278 1 21 VAL H 1 77 LEU QD . . 4.180 3.675 3.171 4.029 . 0 0 "[ . 1 . 2]" 1 279 1 21 VAL HA 1 21 VAL HB . . 2.550 2.413 2.408 2.418 . 0 0 "[ . 1 . 2]" 1 280 1 21 VAL HA 1 21 VAL QG . . 2.530 2.338 2.314 2.361 . 0 0 "[ . 1 . 2]" 1 281 1 21 VAL HA 1 23 ASP H . . 4.460 3.992 3.886 4.038 . 0 0 "[ . 1 . 2]" 1 282 1 21 VAL HA 1 24 ILE H . . 5.350 5.083 5.028 5.129 . 0 0 "[ . 1 . 2]" 1 283 1 21 VAL HA 1 24 ILE HB . . 4.820 4.348 4.131 4.481 . 0 0 "[ . 1 . 2]" 1 284 1 21 VAL HA 1 24 ILE MD . . 2.400 1.931 1.919 1.954 . 0 0 "[ . 1 . 2]" 1 285 1 21 VAL HA 1 24 ILE HG12 . . 4.050 3.642 3.557 3.746 . 0 0 "[ . 1 . 2]" 1 286 1 21 VAL HA 1 24 ILE HG13 . . 4.310 2.585 2.511 2.691 . 0 0 "[ . 1 . 2]" 1 287 1 21 VAL HA 1 55 PHE HZ . . 5.500 5.021 4.939 5.175 . 0 0 "[ . 1 . 2]" 1 288 1 21 VAL HA 1 75 ILE MD . . 5.490 3.902 3.765 4.089 . 0 0 "[ . 1 . 2]" 1 289 1 21 VAL HA 1 77 LEU MD1 . . 4.700 4.177 3.707 4.615 . 0 0 "[ . 1 . 2]" 1 290 1 21 VAL HA 1 77 LEU QD . . 4.090 3.496 3.285 3.679 . 0 0 "[ . 1 . 2]" 1 291 1 21 VAL HA 1 77 LEU MD2 . . 4.700 3.821 3.408 4.143 . 0 0 "[ . 1 . 2]" 1 292 1 21 VAL HB 1 24 ILE MD . . 3.670 2.190 1.944 2.346 . 0 0 "[ . 1 . 2]" 1 293 1 21 VAL HB 1 24 ILE HG12 . . 5.500 4.962 4.671 5.133 . 0 0 "[ . 1 . 2]" 1 294 1 21 VAL HB 1 24 ILE HG13 . . 4.780 4.001 3.797 4.067 . 0 0 "[ . 1 . 2]" 1 295 1 21 VAL HB 1 55 PHE HZ . . 3.780 3.256 3.215 3.340 . 0 0 "[ . 1 . 2]" 1 296 1 21 VAL HB 1 72 THR MG . . 4.680 3.223 3.015 3.525 . 0 0 "[ . 1 . 2]" 1 297 1 21 VAL HB 1 75 ILE MD . . 4.930 2.827 2.752 2.880 . 0 0 "[ . 1 . 2]" 1 298 1 21 VAL HB 1 75 ILE HG12 . . 5.500 5.512 5.501 5.526 0.026 1 0 "[ . 1 . 2]" 1 299 1 21 VAL QG 1 22 ASP H . . 3.490 2.358 2.214 2.605 . 0 0 "[ . 1 . 2]" 1 300 1 21 VAL QG 1 22 ASP HA . . 4.220 3.241 3.095 3.331 . 0 0 "[ . 1 . 2]" 1 301 1 21 VAL QG 1 24 ILE MD . . 2.660 2.629 2.493 2.669 0.009 11 0 "[ . 1 . 2]" 1 302 1 21 VAL QG 1 24 ILE HG13 . . 4.800 4.043 3.953 4.072 . 0 0 "[ . 1 . 2]" 1 303 1 21 VAL QG 1 53 PRO HD2 . . 4.260 3.644 3.446 3.785 . 0 0 "[ . 1 . 2]" 1 304 1 21 VAL QG 1 53 PRO HG2 . . 4.080 3.017 2.818 3.213 . 0 0 "[ . 1 . 2]" 1 305 1 21 VAL QG 1 55 PHE QE . . 4.180 2.551 2.329 2.767 . 0 0 "[ . 1 . 2]" 1 306 1 21 VAL QG 1 55 PHE HZ . . 3.250 2.211 2.085 2.384 . 0 0 "[ . 1 . 2]" 1 307 1 21 VAL QG 1 72 THR HA . . 3.900 2.395 2.181 2.556 . 0 0 "[ . 1 . 2]" 1 308 1 21 VAL QG 1 72 THR HB . . 4.090 2.381 2.224 2.625 . 0 0 "[ . 1 . 2]" 1 309 1 21 VAL QG 1 72 THR MG . . 2.390 1.785 1.694 1.929 . 0 0 "[ . 1 . 2]" 1 310 1 21 VAL QG 1 75 ILE H . . 5.440 4.766 4.645 4.924 . 0 0 "[ . 1 . 2]" 1 311 1 21 VAL QG 1 75 ILE HB . . 4.180 3.111 3.018 3.220 . 0 0 "[ . 1 . 2]" 1 312 1 21 VAL QG 1 75 ILE MD . . 2.780 1.984 1.867 2.104 . 0 0 "[ . 1 . 2]" 1 313 1 21 VAL QG 1 77 LEU QD . . 4.290 2.438 2.153 2.749 . 0 0 "[ . 1 . 2]" 1 314 1 21 VAL QG 1 77 LEU HG . . 5.230 3.662 3.428 3.830 . 0 0 "[ . 1 . 2]" 1 315 1 21 VAL MG1 1 24 ILE HB . . 5.500 5.481 5.302 5.510 0.010 20 0 "[ . 1 . 2]" 1 316 1 21 VAL MG1 1 24 ILE MD . . 3.920 2.726 2.593 2.761 . 0 0 "[ . 1 . 2]" 1 317 1 21 VAL MG1 1 55 PHE HZ . . 4.510 4.518 4.510 4.524 0.014 15 0 "[ . 1 . 2]" 1 318 1 21 VAL MG1 1 72 THR HA . . 4.570 2.418 2.194 2.589 . 0 0 "[ . 1 . 2]" 1 319 1 21 VAL MG1 1 72 THR MG . . 3.270 2.137 1.965 2.368 . 0 0 "[ . 1 . 2]" 1 320 1 21 VAL MG2 1 24 ILE HB . . 5.500 4.953 4.815 5.046 . 0 0 "[ . 1 . 2]" 1 321 1 21 VAL MG2 1 24 ILE MD . . 3.920 3.454 3.235 3.641 . 0 0 "[ . 1 . 2]" 1 322 1 21 VAL MG2 1 55 PHE HZ . . 4.510 2.216 2.088 2.392 . 0 0 "[ . 1 . 2]" 1 323 1 21 VAL MG2 1 72 THR HA . . 4.570 3.900 3.790 4.027 . 0 0 "[ . 1 . 2]" 1 324 1 21 VAL MG2 1 72 THR MG . . 3.270 1.917 1.849 2.097 . 0 0 "[ . 1 . 2]" 1 325 1 22 ASP H 1 22 ASP HB2 . . 3.620 2.455 2.328 2.677 . 0 0 "[ . 1 . 2]" 1 326 1 22 ASP H 1 22 ASP QB . . 2.830 2.269 2.211 2.395 . 0 0 "[ . 1 . 2]" 1 327 1 22 ASP H 1 22 ASP HB3 . . 3.620 2.872 2.393 3.585 . 0 0 "[ . 1 . 2]" 1 328 1 22 ASP H 1 23 ASP H . . 3.080 2.672 2.649 2.744 . 0 0 "[ . 1 . 2]" 1 329 1 22 ASP H 1 24 ILE H . . 5.350 5.056 5.028 5.082 . 0 0 "[ . 1 . 2]" 1 330 1 22 ASP H 1 24 ILE MD . . 5.100 4.474 4.412 4.609 . 0 0 "[ . 1 . 2]" 1 331 1 22 ASP HA 1 22 ASP QB . . 2.520 2.386 2.303 2.438 . 0 0 "[ . 1 . 2]" 1 332 1 22 ASP HA 1 24 ILE H . . 4.940 3.809 3.791 3.822 . 0 0 "[ . 1 . 2]" 1 333 1 22 ASP QB 1 23 ASP H . . 3.690 2.650 2.611 2.730 . 0 0 "[ . 1 . 2]" 1 334 1 22 ASP QB 1 24 ILE H . . 5.320 4.709 4.499 4.864 . 0 0 "[ . 1 . 2]" 1 335 1 23 ASP H 1 23 ASP QB . . 3.000 2.216 2.210 2.240 . 0 0 "[ . 1 . 2]" 1 336 1 23 ASP H 1 24 ILE H . . 3.470 3.487 3.478 3.495 0.025 4 0 "[ . 1 . 2]" 1 337 1 23 ASP QB 1 24 ILE H . . 4.400 3.918 3.912 3.967 . 0 0 "[ . 1 . 2]" 1 338 1 23 ASP QB 1 24 ILE MD . . 5.340 5.054 4.974 5.125 . 0 0 "[ . 1 . 2]" 1 339 1 23 ASP QB 1 77 LEU QD . . 5.280 5.216 5.120 5.290 0.010 17 0 "[ . 1 . 2]" 1 340 1 24 ILE H 1 24 ILE HB . . 2.660 2.677 2.651 2.704 0.044 2 0 "[ . 1 . 2]" 1 341 1 24 ILE H 1 24 ILE MD . . 5.060 4.124 4.077 4.229 . 0 0 "[ . 1 . 2]" 1 342 1 24 ILE H 1 24 ILE HG12 . . 4.170 4.098 4.057 4.157 . 0 0 "[ . 1 . 2]" 1 343 1 24 ILE H 1 24 ILE HG13 . . 3.580 3.004 2.969 3.076 . 0 0 "[ . 1 . 2]" 1 344 1 24 ILE H 1 24 ILE MG . . 4.570 3.849 3.839 3.864 . 0 0 "[ . 1 . 2]" 1 345 1 24 ILE H 1 25 ILE H . . 4.920 4.361 4.180 4.425 . 0 0 "[ . 1 . 2]" 1 346 1 24 ILE H 1 55 PHE QE . . 4.390 4.376 4.234 4.403 0.013 10 0 "[ . 1 . 2]" 1 347 1 24 ILE HA 1 24 ILE MD . . 4.500 3.820 3.795 3.839 . 0 0 "[ . 1 . 2]" 1 348 1 24 ILE HA 1 24 ILE HG12 . . 2.910 2.514 2.467 2.551 . 0 0 "[ . 1 . 2]" 1 349 1 24 ILE HA 1 24 ILE HG13 . . 4.180 2.961 2.901 3.006 . 0 0 "[ . 1 . 2]" 1 350 1 24 ILE HA 1 24 ILE MG . . 2.550 2.396 2.349 2.420 . 0 0 "[ . 1 . 2]" 1 351 1 24 ILE HA 1 25 ILE H . . 2.440 2.192 2.139 2.222 . 0 0 "[ . 1 . 2]" 1 352 1 24 ILE HA 1 25 ILE HG13 . . 4.720 4.602 4.400 4.742 0.022 7 0 "[ . 1 . 2]" 1 353 1 24 ILE HA 1 25 ILE MG . . 4.700 3.917 3.759 4.089 . 0 0 "[ . 1 . 2]" 1 354 1 24 ILE HA 1 43 ILE HG13 . . 5.030 4.511 4.115 4.629 . 0 0 "[ . 1 . 2]" 1 355 1 24 ILE HA 1 81 VAL MG1 . . 4.540 4.538 4.352 4.577 0.037 13 0 "[ . 1 . 2]" 1 356 1 24 ILE HA 1 83 TYR QE . . 4.330 3.613 2.765 4.334 0.004 7 0 "[ . 1 . 2]" 1 357 1 24 ILE HB 1 24 ILE MD . . 2.800 2.400 2.343 2.421 . 0 0 "[ . 1 . 2]" 1 358 1 24 ILE HB 1 25 ILE H . . 4.670 4.090 3.984 4.325 . 0 0 "[ . 1 . 2]" 1 359 1 24 ILE HB 1 55 PHE QE . . 4.350 2.863 2.741 2.987 . 0 0 "[ . 1 . 2]" 1 360 1 24 ILE HB 1 55 PHE HZ . . 5.040 4.519 4.374 4.618 . 0 0 "[ . 1 . 2]" 1 361 1 24 ILE MD 1 55 PHE HB3 . . 4.980 4.374 4.194 4.720 . 0 0 "[ . 1 . 2]" 1 362 1 24 ILE MD 1 55 PHE QE . . 4.000 3.372 3.222 3.701 . 0 0 "[ . 1 . 2]" 1 363 1 24 ILE MD 1 55 PHE HZ . . 4.760 3.831 3.660 4.206 . 0 0 "[ . 1 . 2]" 1 364 1 24 ILE MD 1 72 THR MG . . 5.290 4.579 4.446 4.740 . 0 0 "[ . 1 . 2]" 1 365 1 24 ILE MD 1 75 ILE MD . . 2.830 2.616 2.489 2.675 . 0 0 "[ . 1 . 2]" 1 366 1 24 ILE HG12 1 24 ILE MG . . 3.700 2.381 2.316 2.421 . 0 0 "[ . 1 . 2]" 1 367 1 24 ILE HG12 1 75 ILE MD . . 5.010 5.000 4.831 5.022 0.012 11 0 "[ . 1 . 2]" 1 368 1 24 ILE HG12 1 81 VAL MG1 . . 4.140 4.065 3.720 4.148 0.008 3 0 "[ . 1 . 2]" 1 369 1 24 ILE HG12 1 81 VAL MG2 . . 4.540 4.503 4.195 4.555 0.015 4 0 "[ . 1 . 2]" 1 370 1 24 ILE HG13 1 75 ILE MD . . 5.140 5.026 4.871 5.139 . 0 0 "[ . 1 . 2]" 1 371 1 24 ILE MG 1 25 ILE H . . 3.220 2.373 2.085 2.719 . 0 0 "[ . 1 . 2]" 1 372 1 24 ILE MG 1 25 ILE HA . . 4.540 3.491 3.344 3.794 . 0 0 "[ . 1 . 2]" 1 373 1 24 ILE MG 1 26 ILE HA . . 4.840 4.559 4.402 4.717 . 0 0 "[ . 1 . 2]" 1 374 1 24 ILE MG 1 28 CYS HB2 . . 4.000 3.393 3.043 3.693 . 0 0 "[ . 1 . 2]" 1 375 1 24 ILE MG 1 28 CYS QB . . 3.420 2.347 2.221 2.517 . 0 0 "[ . 1 . 2]" 1 376 1 24 ILE MG 1 28 CYS HB3 . . 4.000 2.397 2.253 2.622 . 0 0 "[ . 1 . 2]" 1 377 1 24 ILE MG 1 43 ILE HA . . 5.500 4.649 4.484 4.789 . 0 0 "[ . 1 . 2]" 1 378 1 24 ILE MG 1 43 ILE HB . . 4.450 3.534 3.421 3.742 . 0 0 "[ . 1 . 2]" 1 379 1 24 ILE MG 1 43 ILE MD . . 2.430 2.113 1.934 2.299 . 0 0 "[ . 1 . 2]" 1 380 1 24 ILE MG 1 43 ILE HG12 . . 3.530 3.321 3.236 3.355 . 0 0 "[ . 1 . 2]" 1 381 1 24 ILE MG 1 43 ILE HG13 . . 2.480 1.962 1.907 2.014 . 0 0 "[ . 1 . 2]" 1 382 1 24 ILE MG 1 43 ILE MG . . 2.700 2.261 2.071 2.551 . 0 0 "[ . 1 . 2]" 1 383 1 24 ILE MG 1 55 PHE QD . . 4.460 3.047 2.576 3.264 . 0 0 "[ . 1 . 2]" 1 384 1 24 ILE MG 1 55 PHE QE . . 3.870 3.687 3.456 3.873 0.003 11 0 "[ . 1 . 2]" 1 385 1 25 ILE H 1 25 ILE HB . . 4.080 3.771 3.682 3.833 . 0 0 "[ . 1 . 2]" 1 386 1 25 ILE H 1 25 ILE HG12 . . 3.630 2.358 2.038 2.525 . 0 0 "[ . 1 . 2]" 1 387 1 25 ILE H 1 25 ILE HG13 . . 2.700 2.603 2.415 2.704 0.004 20 0 "[ . 1 . 2]" 1 388 1 25 ILE H 1 28 CYS H . . 5.070 3.476 3.404 3.719 . 0 0 "[ . 1 . 2]" 1 389 1 25 ILE H 1 83 TYR QE . . 4.260 3.792 2.876 4.267 0.007 4 0 "[ . 1 . 2]" 1 390 1 25 ILE HA 1 25 ILE HB . . 2.550 2.511 2.484 2.533 . 0 0 "[ . 1 . 2]" 1 391 1 25 ILE HA 1 25 ILE MG . . 2.400 2.170 2.129 2.230 . 0 0 "[ . 1 . 2]" 1 392 1 25 ILE HA 1 26 ILE H . . 3.120 2.583 2.381 2.630 . 0 0 "[ . 1 . 2]" 1 393 1 25 ILE HA 1 46 ILE MD . . 2.760 2.092 1.930 2.281 . 0 0 "[ . 1 . 2]" 1 394 1 25 ILE HB 1 25 ILE MD . . 3.250 2.264 2.160 2.421 . 0 0 "[ . 1 . 2]" 1 395 1 25 ILE HB 1 26 ILE H . . 2.690 2.006 1.929 2.427 . 0 0 "[ . 1 . 2]" 1 396 1 25 ILE MD 1 25 ILE MG . . 2.400 2.275 2.030 2.397 . 0 0 "[ . 1 . 2]" 1 397 1 25 ILE MD 1 28 CYS H . . 3.550 3.434 3.205 3.593 0.043 7 0 "[ . 1 . 2]" 1 398 1 25 ILE MD 1 28 CYS QB . . 5.110 3.274 3.117 3.479 . 0 0 "[ . 1 . 2]" 1 399 1 25 ILE MD 1 83 TYR HB3 . . 4.860 4.050 3.653 4.297 . 0 0 "[ . 1 . 2]" 1 400 1 25 ILE MD 1 83 TYR QD . . 4.850 2.687 2.350 2.956 . 0 0 "[ . 1 . 2]" 1 401 1 25 ILE MD 1 83 TYR QE . . 4.040 3.582 3.066 4.008 . 0 0 "[ . 1 . 2]" 1 402 1 25 ILE MD 1 84 PRO HD2 . . 4.500 2.536 2.354 2.749 . 0 0 "[ . 1 . 2]" 1 403 1 25 ILE MD 1 84 PRO QD . . 3.780 2.166 1.951 2.322 . 0 0 "[ . 1 . 2]" 1 404 1 25 ILE MD 1 84 PRO HD3 . . 4.500 2.366 2.016 2.578 . 0 0 "[ . 1 . 2]" 1 405 1 25 ILE MD 1 84 PRO QG . . 3.970 2.105 1.931 2.421 . 0 0 "[ . 1 . 2]" 1 406 1 25 ILE HG12 1 25 ILE MG . . 2.400 2.176 2.102 2.272 . 0 0 "[ . 1 . 2]" 1 407 1 25 ILE HG12 1 28 CYS H . . 3.980 3.721 3.566 3.855 . 0 0 "[ . 1 . 2]" 1 408 1 25 ILE HG12 1 83 TYR QD . . 4.750 3.250 2.796 3.569 . 0 0 "[ . 1 . 2]" 1 409 1 25 ILE HG12 1 83 TYR QE . . 4.440 2.839 2.441 3.069 . 0 0 "[ . 1 . 2]" 1 410 1 25 ILE HG12 1 84 PRO HD2 . . 5.500 4.357 4.112 4.491 . 0 0 "[ . 1 . 2]" 1 411 1 25 ILE HG12 1 84 PRO QD . . 4.830 3.889 3.754 4.114 . 0 0 "[ . 1 . 2]" 1 412 1 25 ILE HG12 1 84 PRO HD3 . . 5.500 4.391 4.145 4.854 . 0 0 "[ . 1 . 2]" 1 413 1 25 ILE HG13 1 28 CYS QB . . 4.660 2.208 1.956 2.488 . 0 0 "[ . 1 . 2]" 1 414 1 25 ILE HG13 1 83 TYR QD . . 4.410 4.078 3.435 4.400 . 0 0 "[ . 1 . 2]" 1 415 1 25 ILE HG13 1 83 TYR QE . . 4.420 4.239 3.441 4.458 0.038 11 0 "[ . 1 . 2]" 1 416 1 25 ILE MG 1 46 ILE MD . . 3.470 3.304 3.128 3.475 0.005 7 0 "[ . 1 . 2]" 1 417 1 25 ILE MG 1 83 TYR QD . . 4.440 4.388 4.213 4.456 0.016 7 0 "[ . 1 . 2]" 1 418 1 25 ILE MG 1 83 TYR QE . . 3.860 3.663 3.404 3.874 0.014 20 0 "[ . 1 . 2]" 1 419 1 26 ILE H 1 26 ILE HB . . 3.090 2.472 2.447 2.548 . 0 0 "[ . 1 . 2]" 1 420 1 26 ILE H 1 26 ILE QG . . 3.970 2.953 2.087 3.081 . 0 0 "[ . 1 . 2]" 1 421 1 26 ILE H 1 27 LYS H . . 5.080 2.521 2.478 2.672 . 0 0 "[ . 1 . 2]" 1 422 1 26 ILE H 1 43 ILE MG . . 4.320 3.935 3.703 4.023 . 0 0 "[ . 1 . 2]" 1 423 1 26 ILE HA 1 26 ILE MD . . 3.920 3.291 3.184 3.867 . 0 0 "[ . 1 . 2]" 1 424 1 26 ILE HA 1 26 ILE QG . . 3.710 2.284 2.263 2.428 . 0 0 "[ . 1 . 2]" 1 425 1 26 ILE HA 1 26 ILE MG . . 2.550 2.368 2.315 2.408 . 0 0 "[ . 1 . 2]" 1 426 1 26 ILE HA 1 27 LYS HA . . 5.390 4.637 4.624 4.677 . 0 0 "[ . 1 . 2]" 1 427 1 26 ILE HA 1 27 LYS QG . . 5.500 5.230 4.907 5.507 0.007 1 0 "[ . 1 . 2]" 1 428 1 26 ILE HA 1 28 CYS H . . 3.740 3.639 3.522 3.676 . 0 0 "[ . 1 . 2]" 1 429 1 26 ILE HA 1 43 ILE HB . . 3.650 2.842 1.988 3.063 . 0 0 "[ . 1 . 2]" 1 430 1 26 ILE HA 1 43 ILE MD . . 5.500 4.952 4.464 5.120 . 0 0 "[ . 1 . 2]" 1 431 1 26 ILE HA 1 43 ILE HG12 . . 5.500 5.291 4.428 5.503 0.003 6 0 "[ . 1 . 2]" 1 432 1 26 ILE HA 1 43 ILE MG . . 2.400 2.014 1.939 2.161 . 0 0 "[ . 1 . 2]" 1 433 1 26 ILE HA 1 46 ILE MD . . 5.010 4.270 3.415 4.823 . 0 0 "[ . 1 . 2]" 1 434 1 26 ILE HA 1 46 ILE HG13 . . 5.500 4.562 4.162 5.027 . 0 0 "[ . 1 . 2]" 1 435 1 26 ILE HB 1 26 ILE MD . . 2.530 2.172 2.089 2.209 . 0 0 "[ . 1 . 2]" 1 436 1 26 ILE HB 1 27 LYS H . . 3.800 2.984 2.846 3.093 . 0 0 "[ . 1 . 2]" 1 437 1 26 ILE HB 1 27 LYS QD . . 3.630 3.139 2.331 3.634 0.004 14 0 "[ . 1 . 2]" 1 438 1 26 ILE HB 1 28 CYS H . . 5.010 4.886 4.792 4.947 . 0 0 "[ . 1 . 2]" 1 439 1 26 ILE MD 1 27 LYS H . . 4.600 3.906 3.815 4.656 0.056 7 0 "[ . 1 . 2]" 1 440 1 26 ILE MD 1 43 ILE MG . . 3.910 3.927 3.911 4.039 0.129 7 0 "[ . 1 . 2]" 1 441 1 26 ILE MD 1 45 SER HA . . 3.900 3.240 2.479 3.313 . 0 0 "[ . 1 . 2]" 1 442 1 26 ILE MD 1 45 SER HB2 . . 5.390 5.323 4.042 5.400 0.010 9 0 "[ . 1 . 2]" 1 443 1 26 ILE MD 1 45 SER HB3 . . 5.500 5.469 4.863 5.512 0.012 12 0 "[ . 1 . 2]" 1 444 1 26 ILE MD 1 46 ILE H . . 4.180 3.945 3.364 4.116 . 0 0 "[ . 1 . 2]" 1 445 1 26 ILE QG 1 26 ILE MG . . 2.460 2.036 1.982 2.263 . 0 0 "[ . 1 . 2]" 1 446 1 26 ILE QG 1 43 ILE MG . . 4.710 3.062 2.559 3.267 . 0 0 "[ . 1 . 2]" 1 447 1 26 ILE QG 1 44 LEU HB3 . . 5.340 5.085 4.931 5.227 . 0 0 "[ . 1 . 2]" 1 448 1 26 ILE QG 1 45 SER HA . . 5.340 2.161 2.083 2.282 . 0 0 "[ . 1 . 2]" 1 449 1 26 ILE QG 1 46 ILE MD . . 4.560 3.654 2.610 4.282 . 0 0 "[ . 1 . 2]" 1 450 1 26 ILE QG 1 46 ILE HG13 . . 5.340 3.619 2.751 4.516 . 0 0 "[ . 1 . 2]" 1 451 1 26 ILE MG 1 27 LYS H . . 4.100 3.657 3.544 3.800 . 0 0 "[ . 1 . 2]" 1 452 1 26 ILE MG 1 27 LYS HA . . 4.690 3.578 3.470 3.720 . 0 0 "[ . 1 . 2]" 1 453 1 26 ILE MG 1 44 LEU HA . . 4.050 2.254 2.049 2.390 . 0 0 "[ . 1 . 2]" 1 454 1 26 ILE MG 1 45 SER H . . 4.760 4.240 3.805 4.526 . 0 0 "[ . 1 . 2]" 1 455 1 27 LYS H 1 27 LYS QG . . 3.740 2.837 2.242 3.421 . 0 0 "[ . 1 . 2]" 1 456 1 27 LYS H 1 28 CYS H . . 3.700 2.438 2.403 2.532 . 0 0 "[ . 1 . 2]" 1 457 1 27 LYS HA 1 27 LYS HB3 . . 2.550 2.495 2.416 2.568 0.018 1 0 "[ . 1 . 2]" 1 458 1 27 LYS HA 1 27 LYS HD2 . . 4.550 2.796 1.998 4.261 . 0 0 "[ . 1 . 2]" 1 459 1 27 LYS HA 1 27 LYS QD . . 3.780 2.644 1.987 3.568 . 0 0 "[ . 1 . 2]" 1 460 1 27 LYS HA 1 27 LYS HD3 . . 4.550 3.756 2.248 4.473 . 0 0 "[ . 1 . 2]" 1 461 1 27 LYS HA 1 27 LYS QG . . 3.200 2.666 2.217 3.018 . 0 0 "[ . 1 . 2]" 1 462 1 27 LYS HA 1 42 GLU HG2 . . 5.500 5.146 4.979 5.390 . 0 0 "[ . 1 . 2]" 1 463 1 27 LYS HA 1 42 GLU HG3 . . 4.510 4.463 4.324 4.529 0.019 11 0 "[ . 1 . 2]" 1 464 1 27 LYS HA 1 84 PRO QD . . 5.350 4.383 4.188 4.596 . 0 0 "[ . 1 . 2]" 1 465 1 27 LYS HB2 1 84 PRO QB . . 4.440 3.096 2.591 3.502 . 0 0 "[ . 1 . 2]" 1 466 1 27 LYS HB2 1 84 PRO QG . . 2.810 1.990 1.976 2.027 . 0 0 "[ . 1 . 2]" 1 467 1 27 LYS QE 1 27 LYS QG . . 3.230 2.261 2.046 2.769 . 0 0 "[ . 1 . 2]" 1 468 1 27 LYS QG 1 84 PRO QD . . 5.350 4.142 3.862 4.499 . 0 0 "[ . 1 . 2]" 1 469 1 27 LYS QG 1 84 PRO QG . . 4.600 3.010 2.771 3.294 . 0 0 "[ . 1 . 2]" 1 470 1 28 CYS H 1 43 ILE HB . . 3.470 2.961 2.834 3.087 . 0 0 "[ . 1 . 2]" 1 471 1 28 CYS HA 1 29 GLN H . . 2.430 2.235 2.198 2.395 . 0 0 "[ . 1 . 2]" 1 472 1 28 CYS QB 1 43 ILE HG12 . . 5.300 3.473 2.927 3.694 . 0 0 "[ . 1 . 2]" 1 473 1 28 CYS QB 1 43 ILE HG13 . . 4.380 2.629 2.305 2.900 . 0 0 "[ . 1 . 2]" 1 474 1 28 CYS QB 1 81 VAL MG1 . . 3.600 3.598 3.277 3.661 0.061 13 0 "[ . 1 . 2]" 1 475 1 29 GLN H 1 29 GLN QB . . 3.690 2.630 2.536 2.809 . 0 0 "[ . 1 . 2]" 1 476 1 29 GLN H 1 29 GLN QG . . 3.560 2.922 2.564 3.389 . 0 0 "[ . 1 . 2]" 1 477 1 29 GLN H 1 30 CYS H . . 5.410 4.316 4.227 4.371 . 0 0 "[ . 1 . 2]" 1 478 1 29 GLN H 1 81 VAL MG1 . . 3.770 2.908 2.708 3.030 . 0 0 "[ . 1 . 2]" 1 479 1 29 GLN H 1 81 VAL MG2 . . 5.230 5.188 4.965 5.244 0.014 11 0 "[ . 1 . 2]" 1 480 1 29 GLN H 1 82 LEU H . . 3.690 3.036 2.811 3.210 . 0 0 "[ . 1 . 2]" 1 481 1 29 GLN H 1 82 LEU HB2 . . 3.850 3.530 3.194 3.829 . 0 0 "[ . 1 . 2]" 1 482 1 29 GLN H 1 82 LEU HB3 . . 4.380 3.783 3.458 4.383 0.003 19 0 "[ . 1 . 2]" 1 483 1 29 GLN HA 1 29 GLN QB . . 2.530 2.360 2.286 2.398 . 0 0 "[ . 1 . 2]" 1 484 1 29 GLN HA 1 29 GLN QG . . 3.720 2.448 2.307 2.570 . 0 0 "[ . 1 . 2]" 1 485 1 29 GLN HA 1 30 CYS H . . 2.480 2.154 2.141 2.170 . 0 0 "[ . 1 . 2]" 1 486 1 29 GLN HA 1 30 CYS QB . . 5.340 4.322 4.025 4.459 . 0 0 "[ . 1 . 2]" 1 487 1 29 GLN HA 1 40 LEU MD1 . . 5.500 5.240 5.109 5.357 . 0 0 "[ . 1 . 2]" 1 488 1 29 GLN HA 1 40 LEU QD . . 4.780 4.766 4.670 4.796 0.016 7 0 "[ . 1 . 2]" 1 489 1 29 GLN HA 1 40 LEU MD2 . . 5.500 5.480 5.378 5.515 0.015 20 0 "[ . 1 . 2]" 1 490 1 29 GLN HA 1 40 LEU HG . . 5.500 5.197 5.119 5.239 . 0 0 "[ . 1 . 2]" 1 491 1 29 GLN HA 1 42 GLU HA . . 2.400 2.259 2.125 2.351 . 0 0 "[ . 1 . 2]" 1 492 1 29 GLN HA 1 42 GLU HB3 . . 5.500 5.181 5.050 5.330 . 0 0 "[ . 1 . 2]" 1 493 1 29 GLN HA 1 42 GLU HG2 . . 5.500 5.045 4.792 5.383 . 0 0 "[ . 1 . 2]" 1 494 1 29 GLN HA 1 43 ILE H . . 4.520 2.615 2.502 2.754 . 0 0 "[ . 1 . 2]" 1 495 1 29 GLN HA 1 43 ILE HG12 . . 4.960 2.993 2.860 3.064 . 0 0 "[ . 1 . 2]" 1 496 1 29 GLN HA 1 43 ILE MG . . 5.500 5.489 5.397 5.543 0.043 7 0 "[ . 1 . 2]" 1 497 1 29 GLN HA 1 81 VAL MG1 . . 5.500 4.512 4.292 4.608 . 0 0 "[ . 1 . 2]" 1 498 1 29 GLN QB 1 40 LEU HA . . 5.340 5.344 5.187 5.369 0.029 20 0 "[ . 1 . 2]" 1 499 1 29 GLN QB 1 40 LEU QD . . 3.070 2.960 2.874 2.998 . 0 0 "[ . 1 . 2]" 1 500 1 29 GLN QB 1 40 LEU HG . . 4.750 3.334 3.202 3.399 . 0 0 "[ . 1 . 2]" 1 501 1 29 GLN QB 1 41 ALA H . . 4.970 4.761 4.143 4.976 0.006 14 0 "[ . 1 . 2]" 1 502 1 29 GLN QB 1 82 LEU HA . . 4.750 4.591 4.401 4.771 0.021 8 0 "[ . 1 . 2]" 1 503 1 29 GLN QB 1 82 LEU HB2 . . 3.530 2.072 1.961 2.264 . 0 0 "[ . 1 . 2]" 1 504 1 29 GLN QB 1 82 LEU HB3 . . 4.500 2.761 2.416 3.466 . 0 0 "[ . 1 . 2]" 1 505 1 29 GLN QB 1 82 LEU QD . . 4.000 3.245 2.733 3.786 . 0 0 "[ . 1 . 2]" 1 506 1 29 GLN HB2 1 40 LEU MD1 . . 4.710 4.049 3.762 4.231 . 0 0 "[ . 1 . 2]" 1 507 1 29 GLN HB2 1 40 LEU MD2 . . 4.710 4.414 4.030 4.620 . 0 0 "[ . 1 . 2]" 1 508 1 29 GLN HB2 1 40 LEU HG . . 5.500 4.821 4.422 5.023 . 0 0 "[ . 1 . 2]" 1 509 1 29 GLN HB2 1 82 LEU HB2 . . 4.200 2.086 1.969 2.279 . 0 0 "[ . 1 . 2]" 1 510 1 29 GLN HB3 1 40 LEU MD1 . . 4.710 3.499 3.237 3.763 . 0 0 "[ . 1 . 2]" 1 511 1 29 GLN HB3 1 40 LEU MD2 . . 4.710 3.485 3.336 3.582 . 0 0 "[ . 1 . 2]" 1 512 1 29 GLN HB3 1 40 LEU HG . . 5.500 3.400 3.286 3.469 . 0 0 "[ . 1 . 2]" 1 513 1 29 GLN HB3 1 82 LEU HB2 . . 4.200 3.561 3.338 3.880 . 0 0 "[ . 1 . 2]" 1 514 1 29 GLN QE 1 40 LEU QD . . 5.120 3.320 2.001 4.652 . 0 0 "[ . 1 . 2]" 1 515 1 29 GLN QE 1 82 LEU QD . . 4.230 3.482 2.856 4.239 0.009 7 0 "[ . 1 . 2]" 1 516 1 29 GLN QG 1 30 CYS H . . 4.630 4.158 4.039 4.364 . 0 0 "[ . 1 . 2]" 1 517 1 29 GLN QG 1 42 GLU HA . . 4.100 2.379 2.071 2.891 . 0 0 "[ . 1 . 2]" 1 518 1 29 GLN QG 1 82 LEU H . . 5.020 4.852 4.513 5.028 0.008 13 0 "[ . 1 . 2]" 1 519 1 29 GLN QG 1 82 LEU QD . . 5.130 4.269 3.569 4.790 . 0 0 "[ . 1 . 2]" 1 520 1 30 CYS H 1 31 TRP H . . 4.600 4.384 4.350 4.446 . 0 0 "[ . 1 . 2]" 1 521 1 30 CYS H 1 41 ALA H . . 4.020 3.838 3.590 3.982 . 0 0 "[ . 1 . 2]" 1 522 1 30 CYS H 1 41 ALA MB . . 4.080 3.874 3.585 3.993 . 0 0 "[ . 1 . 2]" 1 523 1 30 CYS H 1 42 GLU HA . . 4.130 3.240 3.149 3.444 . 0 0 "[ . 1 . 2]" 1 524 1 30 CYS H 1 81 VAL MG1 . . 4.640 4.515 4.142 4.643 0.003 12 0 "[ . 1 . 2]" 1 525 1 30 CYS HA 1 30 CYS HB2 . . 2.940 2.468 2.395 2.634 . 0 0 "[ . 1 . 2]" 1 526 1 30 CYS HA 1 30 CYS QB . . 2.540 2.211 2.182 2.471 . 0 0 "[ . 1 . 2]" 1 527 1 30 CYS HA 1 30 CYS HB3 . . 2.940 2.510 2.383 3.006 0.066 6 0 "[ . 1 . 2]" 1 528 1 30 CYS HA 1 31 TRP H . . 2.720 2.604 2.361 2.700 . 0 0 "[ . 1 . 2]" 1 529 1 30 CYS HA 1 31 TRP HD1 . . 4.660 3.260 2.971 3.524 . 0 0 "[ . 1 . 2]" 1 530 1 30 CYS HA 1 40 LEU QD . . 4.320 3.975 3.554 4.225 . 0 0 "[ . 1 . 2]" 1 531 1 30 CYS HA 1 81 VAL HA . . 3.940 3.240 3.030 3.339 . 0 0 "[ . 1 . 2]" 1 532 1 30 CYS HA 1 81 VAL MG1 . . 3.890 3.466 3.005 3.690 . 0 0 "[ . 1 . 2]" 1 533 1 30 CYS HA 1 81 VAL MG2 . . 3.910 3.417 3.091 3.598 . 0 0 "[ . 1 . 2]" 1 534 1 30 CYS HA 1 82 LEU HB2 . . 5.500 5.084 4.839 5.324 . 0 0 "[ . 1 . 2]" 1 535 1 30 CYS HA 1 82 LEU QD . . 5.440 5.208 4.879 5.336 . 0 0 "[ . 1 . 2]" 1 536 1 30 CYS QB 1 31 TRP H . . 3.360 2.164 1.933 3.246 . 0 0 "[ . 1 . 2]" 1 537 1 30 CYS QB 1 75 ILE MG . . 3.130 3.004 2.797 3.128 . 0 0 "[ . 1 . 2]" 1 538 1 30 CYS QB 1 77 LEU QD . . 5.280 4.096 3.819 4.608 . 0 0 "[ . 1 . 2]" 1 539 1 30 CYS QB 1 81 VAL HA . . 4.310 4.011 3.799 4.313 0.003 6 0 "[ . 1 . 2]" 1 540 1 30 CYS QB 1 81 VAL MG1 . . 3.280 3.022 2.537 3.244 . 0 0 "[ . 1 . 2]" 1 541 1 30 CYS QB 1 81 VAL MG2 . . 3.000 2.937 2.738 3.019 0.019 17 0 "[ . 1 . 2]" 1 542 1 30 CYS QB 1 82 LEU H . . 5.300 4.665 4.435 4.827 . 0 0 "[ . 1 . 2]" 1 543 1 30 CYS HB2 1 31 TRP HD1 . . 5.500 4.554 4.079 5.507 0.007 6 0 "[ . 1 . 2]" 1 544 1 30 CYS HB3 1 31 TRP HD1 . . 5.500 5.390 5.078 5.507 0.007 7 0 "[ . 1 . 2]" 1 545 1 31 TRP H 1 31 TRP HB2 . . 3.380 2.442 2.343 2.529 . 0 0 "[ . 1 . 2]" 1 546 1 31 TRP H 1 31 TRP HD1 . . 4.180 2.859 2.264 3.116 . 0 0 "[ . 1 . 2]" 1 547 1 31 TRP H 1 41 ALA MB . . 5.430 5.091 4.841 5.419 . 0 0 "[ . 1 . 2]" 1 548 1 31 TRP H 1 75 ILE MG . . 4.350 4.037 3.813 4.363 0.013 17 0 "[ . 1 . 2]" 1 549 1 31 TRP H 1 79 LYS HB2 . . 5.330 4.034 3.626 4.266 . 0 0 "[ . 1 . 2]" 1 550 1 31 TRP HA 1 32 VAL H . . 2.420 2.197 2.175 2.246 . 0 0 "[ . 1 . 2]" 1 551 1 31 TRP HA 1 39 ARG H . . 4.590 4.463 4.209 4.557 . 0 0 "[ . 1 . 2]" 1 552 1 31 TRP HA 1 40 LEU HA . . 4.630 2.444 2.226 2.614 . 0 0 "[ . 1 . 2]" 1 553 1 31 TRP HA 1 41 ALA H . . 4.170 2.468 2.302 2.771 . 0 0 "[ . 1 . 2]" 1 554 1 31 TRP HB2 1 31 TRP HD1 . . 3.610 2.756 2.705 2.852 . 0 0 "[ . 1 . 2]" 1 555 1 31 TRP HB2 1 31 TRP HE1 . . 5.000 4.821 4.803 4.855 . 0 0 "[ . 1 . 2]" 1 556 1 31 TRP HB2 1 32 VAL H . . 4.390 4.158 3.979 4.230 . 0 0 "[ . 1 . 2]" 1 557 1 31 TRP HB2 1 40 LEU HA . . 5.500 4.832 4.586 4.901 . 0 0 "[ . 1 . 2]" 1 558 1 31 TRP HB2 1 76 ASN QB . . 5.130 2.279 2.146 2.393 . 0 0 "[ . 1 . 2]" 1 559 1 31 TRP HB2 1 76 ASN QD . . 4.600 3.550 2.695 4.420 . 0 0 "[ . 1 . 2]" 1 560 1 31 TRP HB2 1 78 ASP H . . 5.500 5.069 4.872 5.307 . 0 0 "[ . 1 . 2]" 1 561 1 31 TRP HB2 1 79 LYS H . . 4.650 4.115 3.985 4.298 . 0 0 "[ . 1 . 2]" 1 562 1 31 TRP HB2 1 79 LYS HA . . 5.500 5.506 5.489 5.530 0.030 11 0 "[ . 1 . 2]" 1 563 1 31 TRP HB2 1 79 LYS HB2 . . 4.870 2.558 2.515 2.662 . 0 0 "[ . 1 . 2]" 1 564 1 31 TRP HB2 1 79 LYS HB3 . . 4.750 3.597 3.398 3.810 . 0 0 "[ . 1 . 2]" 1 565 1 31 TRP HB2 1 79 LYS HD2 . . 5.220 4.105 2.821 4.901 . 0 0 "[ . 1 . 2]" 1 566 1 31 TRP HB2 1 79 LYS QD . . 4.380 2.775 2.396 3.183 . 0 0 "[ . 1 . 2]" 1 567 1 31 TRP HB2 1 79 LYS HD3 . . 5.220 2.904 2.415 3.522 . 0 0 "[ . 1 . 2]" 1 568 1 31 TRP HB3 1 31 TRP HE3 . . 3.800 2.479 2.420 2.522 . 0 0 "[ . 1 . 2]" 1 569 1 31 TRP HB3 1 32 VAL MG2 . . 5.500 4.864 4.766 4.941 . 0 0 "[ . 1 . 2]" 1 570 1 31 TRP HB3 1 38 GLU HB2 . . 5.070 3.449 2.542 4.984 . 0 0 "[ . 1 . 2]" 1 571 1 31 TRP HB3 1 38 GLU QB . . 4.340 2.848 2.514 3.645 . 0 0 "[ . 1 . 2]" 1 572 1 31 TRP HB3 1 38 GLU HB3 . . 5.070 3.818 2.798 4.470 . 0 0 "[ . 1 . 2]" 1 573 1 31 TRP HB3 1 38 GLU HG2 . . 5.500 4.817 2.474 5.517 0.017 14 0 "[ . 1 . 2]" 1 574 1 31 TRP HB3 1 38 GLU QG . . 4.700 3.917 2.143 4.321 . 0 0 "[ . 1 . 2]" 1 575 1 31 TRP HB3 1 38 GLU HG3 . . 5.500 4.269 2.349 4.517 . 0 0 "[ . 1 . 2]" 1 576 1 31 TRP HB3 1 40 LEU HA . . 5.500 4.118 3.873 4.211 . 0 0 "[ . 1 . 2]" 1 577 1 31 TRP HB3 1 79 LYS HD2 . . 5.500 4.562 3.157 5.427 . 0 0 "[ . 1 . 2]" 1 578 1 31 TRP HB3 1 79 LYS QD . . 4.640 3.134 2.668 3.736 . 0 0 "[ . 1 . 2]" 1 579 1 31 TRP HB3 1 79 LYS HD3 . . 5.500 3.243 2.723 3.842 . 0 0 "[ . 1 . 2]" 1 580 1 31 TRP HB3 1 79 LYS QE . . 5.340 3.907 2.606 5.059 . 0 0 "[ . 1 . 2]" 1 581 1 31 TRP HD1 1 40 LEU QD . . 5.440 3.241 2.983 3.413 . 0 0 "[ . 1 . 2]" 1 582 1 31 TRP HD1 1 40 LEU HG . . 5.500 5.478 5.176 5.509 0.009 5 0 "[ . 1 . 2]" 1 583 1 31 TRP HD1 1 79 LYS H . . 5.500 4.800 4.595 4.972 . 0 0 "[ . 1 . 2]" 1 584 1 31 TRP HD1 1 79 LYS HA . . 5.180 5.006 4.766 5.170 . 0 0 "[ . 1 . 2]" 1 585 1 31 TRP HD1 1 79 LYS HB2 . . 3.580 2.925 2.619 3.236 . 0 0 "[ . 1 . 2]" 1 586 1 31 TRP HD1 1 79 LYS HB3 . . 3.490 2.399 2.108 2.583 . 0 0 "[ . 1 . 2]" 1 587 1 31 TRP HD1 1 79 LYS QD . . 4.290 3.940 3.203 4.292 0.002 19 0 "[ . 1 . 2]" 1 588 1 31 TRP HD1 1 79 LYS QE . . 5.180 5.061 3.774 5.194 0.014 11 0 "[ . 1 . 2]" 1 589 1 31 TRP HD1 1 79 LYS HG2 . . 4.360 3.831 3.360 4.181 . 0 0 "[ . 1 . 2]" 1 590 1 31 TRP HE1 1 40 LEU MD1 . . 5.460 2.400 2.312 2.630 . 0 0 "[ . 1 . 2]" 1 591 1 31 TRP HE1 1 40 LEU QD . . 3.940 2.393 2.307 2.623 . 0 0 "[ . 1 . 2]" 1 592 1 31 TRP HE1 1 40 LEU MD2 . . 5.460 4.781 4.454 5.164 . 0 0 "[ . 1 . 2]" 1 593 1 31 TRP HE1 1 40 LEU HG . . 5.500 5.032 4.907 5.230 . 0 0 "[ . 1 . 2]" 1 594 1 31 TRP HE1 1 79 LYS HB2 . . 4.850 4.591 4.246 4.848 . 0 0 "[ . 1 . 2]" 1 595 1 31 TRP HE1 1 79 LYS HB3 . . 4.250 3.307 2.974 3.532 . 0 0 "[ . 1 . 2]" 1 596 1 31 TRP HE1 1 79 LYS QD . . 5.330 4.838 3.399 5.341 0.011 19 0 "[ . 1 . 2]" 1 597 1 31 TRP HE1 1 79 LYS QE . . 5.340 5.119 4.193 5.345 0.005 20 0 "[ . 1 . 2]" 1 598 1 31 TRP HE3 1 32 VAL H . . 4.420 3.749 3.472 4.220 . 0 0 "[ . 1 . 2]" 1 599 1 31 TRP HE3 1 38 GLU H . . 5.500 5.044 4.859 5.121 . 0 0 "[ . 1 . 2]" 1 600 1 31 TRP HE3 1 38 GLU HA . . 5.500 3.774 3.604 4.038 . 0 0 "[ . 1 . 2]" 1 601 1 31 TRP HE3 1 38 GLU QB . . 3.620 2.447 2.245 2.644 . 0 0 "[ . 1 . 2]" 1 602 1 31 TRP HE3 1 38 GLU HG2 . . 4.640 4.120 3.080 4.618 . 0 0 "[ . 1 . 2]" 1 603 1 31 TRP HE3 1 38 GLU HG3 . . 4.640 3.740 2.918 4.643 0.003 7 0 "[ . 1 . 2]" 1 604 1 31 TRP HE3 1 39 ARG H . . 4.440 2.973 2.715 3.251 . 0 0 "[ . 1 . 2]" 1 605 1 31 TRP HE3 1 40 LEU H . . 4.650 3.494 3.277 3.789 . 0 0 "[ . 1 . 2]" 1 606 1 31 TRP HE3 1 40 LEU HA . . 4.950 3.568 3.498 3.828 . 0 0 "[ . 1 . 2]" 1 607 1 31 TRP HE3 1 40 LEU HB2 . . 5.500 4.339 4.164 4.391 . 0 0 "[ . 1 . 2]" 1 608 1 31 TRP HE3 1 40 LEU HB3 . . 5.500 5.494 5.354 5.506 0.006 5 0 "[ . 1 . 2]" 1 609 1 31 TRP HE3 1 40 LEU QD . . 5.100 4.455 4.328 4.684 . 0 0 "[ . 1 . 2]" 1 610 1 31 TRP HE3 1 79 LYS QE . . 5.260 3.943 3.086 4.864 . 0 0 "[ . 1 . 2]" 1 611 1 31 TRP HH2 1 39 ARG HA . . 4.770 4.420 4.189 4.755 . 0 0 "[ . 1 . 2]" 1 612 1 31 TRP HH2 1 40 LEU QB . . 5.300 3.294 3.105 3.655 . 0 0 "[ . 1 . 2]" 1 613 1 31 TRP HH2 1 40 LEU MD1 . . 5.500 3.917 3.694 4.271 . 0 0 "[ . 1 . 2]" 1 614 1 31 TRP HH2 1 40 LEU MD2 . . 5.500 4.978 4.841 5.309 . 0 0 "[ . 1 . 2]" 1 615 1 31 TRP HZ2 1 40 LEU QB . . 5.340 3.289 3.137 3.685 . 0 0 "[ . 1 . 2]" 1 616 1 31 TRP HZ2 1 40 LEU MD1 . . 5.220 2.530 2.301 2.914 . 0 0 "[ . 1 . 2]" 1 617 1 31 TRP HZ2 1 40 LEU QD . . 4.480 2.512 2.291 2.881 . 0 0 "[ . 1 . 2]" 1 618 1 31 TRP HZ2 1 40 LEU MD2 . . 5.220 4.285 4.112 4.741 . 0 0 "[ . 1 . 2]" 1 619 1 31 TRP HZ3 1 38 GLU H . . 5.500 5.070 4.893 5.404 . 0 0 "[ . 1 . 2]" 1 620 1 31 TRP HZ3 1 39 ARG HA . . 3.800 2.321 2.067 2.616 . 0 0 "[ . 1 . 2]" 1 621 1 31 TRP HZ3 1 40 LEU HB2 . . 5.500 3.881 3.789 4.213 . 0 0 "[ . 1 . 2]" 1 622 1 31 TRP HZ3 1 40 LEU HB3 . . 5.500 5.026 4.925 5.292 . 0 0 "[ . 1 . 2]" 1 623 1 32 VAL H 1 32 VAL HB . . 3.440 2.666 2.591 2.749 . 0 0 "[ . 1 . 2]" 1 624 1 32 VAL H 1 32 VAL MG1 . . 4.120 3.865 3.832 3.898 . 0 0 "[ . 1 . 2]" 1 625 1 32 VAL H 1 32 VAL MG2 . . 3.730 2.592 2.469 2.739 . 0 0 "[ . 1 . 2]" 1 626 1 32 VAL H 1 38 GLU HA . . 5.020 4.430 4.257 4.557 . 0 0 "[ . 1 . 2]" 1 627 1 32 VAL H 1 39 ARG H . . 3.480 3.000 2.833 3.154 . 0 0 "[ . 1 . 2]" 1 628 1 32 VAL H 1 40 LEU HA . . 4.200 3.781 3.526 3.936 . 0 0 "[ . 1 . 2]" 1 629 1 32 VAL HA 1 32 VAL MG1 . . 2.740 2.301 2.237 2.393 . 0 0 "[ . 1 . 2]" 1 630 1 32 VAL HA 1 32 VAL MG2 . . 2.620 2.436 2.378 2.476 . 0 0 "[ . 1 . 2]" 1 631 1 32 VAL HA 1 33 GLN H . . 2.570 2.226 2.174 2.252 . 0 0 "[ . 1 . 2]" 1 632 1 32 VAL HA 1 33 GLN QB . . 4.880 4.044 3.996 4.078 . 0 0 "[ . 1 . 2]" 1 633 1 32 VAL HA 1 74 ARG HB3 . . 5.500 5.276 5.102 5.385 . 0 0 "[ . 1 . 2]" 1 634 1 32 VAL HA 1 75 ILE H . . 5.500 5.466 5.396 5.513 0.013 7 0 "[ . 1 . 2]" 1 635 1 32 VAL HA 1 75 ILE HA . . 3.210 3.041 2.775 3.127 . 0 0 "[ . 1 . 2]" 1 636 1 32 VAL HA 1 75 ILE HG12 . . 5.190 5.132 4.728 5.200 0.010 3 0 "[ . 1 . 2]" 1 637 1 32 VAL HA 1 75 ILE MG . . 4.570 4.214 3.819 4.329 . 0 0 "[ . 1 . 2]" 1 638 1 32 VAL HB 1 34 LYS QG . . 5.310 4.286 3.138 5.320 0.010 17 0 "[ . 1 . 2]" 1 639 1 32 VAL HB 1 41 ALA MB . . 3.870 2.805 2.672 2.986 . 0 0 "[ . 1 . 2]" 1 640 1 32 VAL HB 1 57 VAL MG2 . . 4.340 4.179 3.907 4.348 0.008 20 0 "[ . 1 . 2]" 1 641 1 32 VAL HB 1 59 TYR QD . . 4.610 4.589 4.489 4.620 0.010 5 0 "[ . 1 . 2]" 1 642 1 32 VAL HB 1 59 TYR QE . . 3.360 3.067 2.723 3.253 . 0 0 "[ . 1 . 2]" 1 643 1 32 VAL HB 1 75 ILE HA . . 5.500 5.501 5.451 5.519 0.019 3 0 "[ . 1 . 2]" 1 644 1 32 VAL MG1 1 33 GLN H . . 3.670 2.041 1.921 2.312 . 0 0 "[ . 1 . 2]" 1 645 1 32 VAL MG1 1 33 GLN HA . . 4.940 3.972 3.858 4.055 . 0 0 "[ . 1 . 2]" 1 646 1 32 VAL MG1 1 33 GLN QB . . 4.790 3.541 3.441 3.675 . 0 0 "[ . 1 . 2]" 1 647 1 32 VAL MG1 1 34 LYS HA . . 5.500 4.443 4.361 4.600 . 0 0 "[ . 1 . 2]" 1 648 1 32 VAL MG1 1 34 LYS QB . . 4.580 3.718 3.327 4.097 . 0 0 "[ . 1 . 2]" 1 649 1 32 VAL MG1 1 34 LYS QD . . 4.450 3.297 2.555 4.379 . 0 0 "[ . 1 . 2]" 1 650 1 32 VAL MG1 1 39 ARG H . . 4.850 4.763 4.694 4.854 0.004 14 0 "[ . 1 . 2]" 1 651 1 32 VAL MG1 1 39 ARG HB2 . . 5.180 4.992 4.664 5.183 0.003 10 0 "[ . 1 . 2]" 1 652 1 32 VAL MG1 1 41 ALA MB . . 3.880 3.700 3.586 3.887 0.007 7 0 "[ . 1 . 2]" 1 653 1 32 VAL MG1 1 57 VAL MG1 . . 4.250 3.895 3.526 4.251 0.001 20 0 "[ . 1 . 2]" 1 654 1 32 VAL MG1 1 57 VAL MG2 . . 4.070 3.018 2.599 3.267 . 0 0 "[ . 1 . 2]" 1 655 1 32 VAL MG1 1 59 TYR QD . . 5.430 5.183 5.119 5.275 . 0 0 "[ . 1 . 2]" 1 656 1 32 VAL MG1 1 59 TYR QE . . 3.800 3.547 3.368 3.737 . 0 0 "[ . 1 . 2]" 1 657 1 32 VAL MG1 1 70 ILE MD . . 3.400 2.246 2.017 2.435 . 0 0 "[ . 1 . 2]" 1 658 1 32 VAL MG1 1 74 ARG HA . . 5.500 3.965 3.784 4.227 . 0 0 "[ . 1 . 2]" 1 659 1 32 VAL MG1 1 74 ARG HB2 . . 5.340 4.074 3.882 4.143 . 0 0 "[ . 1 . 2]" 1 660 1 32 VAL MG1 1 74 ARG HB3 . . 3.880 2.955 2.829 3.054 . 0 0 "[ . 1 . 2]" 1 661 1 32 VAL MG1 1 74 ARG HG2 . . 5.500 4.818 4.684 5.043 . 0 0 "[ . 1 . 2]" 1 662 1 32 VAL MG1 1 75 ILE H . . 5.090 4.856 4.747 4.956 . 0 0 "[ . 1 . 2]" 1 663 1 32 VAL MG1 1 75 ILE HA . . 4.200 3.483 3.219 3.649 . 0 0 "[ . 1 . 2]" 1 664 1 32 VAL MG1 1 75 ILE HG12 . . 4.890 4.616 4.218 4.886 . 0 0 "[ . 1 . 2]" 1 665 1 32 VAL MG2 1 33 GLN H . . 4.140 3.941 3.873 4.086 . 0 0 "[ . 1 . 2]" 1 666 1 32 VAL MG2 1 39 ARG H . . 4.970 4.924 4.820 4.974 0.004 3 0 "[ . 1 . 2]" 1 667 1 32 VAL MG2 1 43 ILE MD . . 4.590 4.231 3.913 4.491 . 0 0 "[ . 1 . 2]" 1 668 1 32 VAL MG2 1 57 VAL HB . . 4.490 2.926 2.494 3.209 . 0 0 "[ . 1 . 2]" 1 669 1 32 VAL MG2 1 57 VAL MG1 . . 3.870 2.405 2.057 2.727 . 0 0 "[ . 1 . 2]" 1 670 1 32 VAL MG2 1 57 VAL MG2 . . 4.230 2.359 2.142 2.525 . 0 0 "[ . 1 . 2]" 1 671 1 32 VAL MG2 1 59 TYR QD . . 5.080 4.889 4.678 5.002 . 0 0 "[ . 1 . 2]" 1 672 1 32 VAL MG2 1 59 TYR QE . . 4.260 4.117 3.894 4.263 0.003 14 0 "[ . 1 . 2]" 1 673 1 32 VAL MG2 1 75 ILE HA . . 4.310 3.141 2.990 3.437 . 0 0 "[ . 1 . 2]" 1 674 1 32 VAL MG2 1 75 ILE HG12 . . 4.370 3.620 3.528 3.820 . 0 0 "[ . 1 . 2]" 1 675 1 33 GLN H 1 33 GLN QB . . 2.690 2.256 2.112 2.303 . 0 0 "[ . 1 . 2]" 1 676 1 33 GLN H 1 33 GLN QG . . 4.170 3.945 3.699 4.081 . 0 0 "[ . 1 . 2]" 1 677 1 33 GLN H 1 74 ARG HA . . 4.470 4.291 4.035 4.386 . 0 0 "[ . 1 . 2]" 1 678 1 33 GLN HA 1 33 GLN QE . . 4.500 4.281 4.008 4.471 . 0 0 "[ . 1 . 2]" 1 679 1 33 GLN HA 1 33 GLN QG . . 3.830 2.393 2.031 2.667 . 0 0 "[ . 1 . 2]" 1 680 1 33 GLN HA 1 34 LYS H . . 2.400 2.139 2.138 2.140 . 0 0 "[ . 1 . 2]" 1 681 1 33 GLN HA 1 34 LYS QB . . 5.070 4.160 4.051 4.409 . 0 0 "[ . 1 . 2]" 1 682 1 33 GLN HA 1 38 GLU HA . . 2.720 2.579 2.401 2.713 . 0 0 "[ . 1 . 2]" 1 683 1 33 GLN HA 1 38 GLU QB . . 5.140 3.895 3.494 4.516 . 0 0 "[ . 1 . 2]" 1 684 1 33 GLN HA 1 38 GLU QG . . 5.340 4.590 2.903 5.369 0.029 17 0 "[ . 1 . 2]" 1 685 1 33 GLN QB 1 38 GLU HA . . 5.340 4.474 4.215 4.711 . 0 0 "[ . 1 . 2]" 1 686 1 33 GLN QB 1 74 ARG HA . . 4.320 3.877 3.030 4.184 . 0 0 "[ . 1 . 2]" 1 687 1 33 GLN HB2 1 33 GLN HE22 . . 5.500 4.153 3.568 4.753 . 0 0 "[ . 1 . 2]" 1 688 1 33 GLN HB3 1 33 GLN HE22 . . 5.500 4.376 3.411 5.355 . 0 0 "[ . 1 . 2]" 1 689 1 33 GLN QG 1 34 LYS QB . . 5.490 4.882 4.606 5.362 . 0 0 "[ . 1 . 2]" 1 690 1 33 GLN QG 1 38 GLU HA . . 5.160 4.084 3.366 4.556 . 0 0 "[ . 1 . 2]" 1 691 1 34 LYS H 1 34 LYS QB . . 3.530 2.659 2.606 2.735 . 0 0 "[ . 1 . 2]" 1 692 1 34 LYS H 1 34 LYS QG . . 4.920 3.862 3.150 4.368 . 0 0 "[ . 1 . 2]" 1 693 1 34 LYS H 1 35 ASN H . . 4.740 4.277 4.211 4.295 . 0 0 "[ . 1 . 2]" 1 694 1 34 LYS H 1 37 GLU H . . 3.930 2.927 2.824 3.063 . 0 0 "[ . 1 . 2]" 1 695 1 34 LYS H 1 37 GLU QB . . 4.020 3.834 3.784 3.873 . 0 0 "[ . 1 . 2]" 1 696 1 34 LYS H 1 38 GLU HA . . 3.610 3.134 3.068 3.257 . 0 0 "[ . 1 . 2]" 1 697 1 34 LYS H 1 39 ARG H . . 4.470 3.950 3.816 4.084 . 0 0 "[ . 1 . 2]" 1 698 1 34 LYS HA 1 34 LYS HD2 . . 3.530 2.284 1.997 3.528 . 0 0 "[ . 1 . 2]" 1 699 1 34 LYS HA 1 34 LYS QD . . 2.880 2.031 1.971 2.210 . 0 0 "[ . 1 . 2]" 1 700 1 34 LYS HA 1 34 LYS HD3 . . 3.530 2.875 2.000 3.520 . 0 0 "[ . 1 . 2]" 1 701 1 34 LYS HA 1 34 LYS QG . . 3.460 2.613 2.507 2.849 . 0 0 "[ . 1 . 2]" 1 702 1 34 LYS HA 1 59 TYR QE . . 5.500 5.456 5.260 5.555 0.055 14 0 "[ . 1 . 2]" 1 703 1 34 LYS QB 1 34 LYS QD . . 2.610 2.375 2.243 2.556 . 0 0 "[ . 1 . 2]" 1 704 1 34 LYS QB 1 34 LYS QE . . 4.100 3.112 2.095 3.741 . 0 0 "[ . 1 . 2]" 1 705 1 34 LYS QB 1 35 ASN H . . 3.780 3.275 3.001 3.485 . 0 0 "[ . 1 . 2]" 1 706 1 34 LYS QB 1 37 GLU H . . 4.700 4.367 4.270 4.503 . 0 0 "[ . 1 . 2]" 1 707 1 34 LYS QB 1 38 GLU HA . . 5.500 4.616 4.454 4.778 . 0 0 "[ . 1 . 2]" 1 708 1 34 LYS QB 1 39 ARG H . . 4.330 4.178 3.904 4.331 0.001 13 0 "[ . 1 . 2]" 1 709 1 34 LYS QB 1 39 ARG QD . . 4.380 2.974 1.961 3.588 . 0 0 "[ . 1 . 2]" 1 710 1 34 LYS QB 1 59 TYR QD . . 5.160 4.692 4.518 4.842 . 0 0 "[ . 1 . 2]" 1 711 1 34 LYS QB 1 59 TYR QE . . 4.080 3.026 2.630 3.263 . 0 0 "[ . 1 . 2]" 1 712 1 34 LYS QE 1 34 LYS QG . . 3.200 2.123 2.001 2.310 . 0 0 "[ . 1 . 2]" 1 713 1 34 LYS QE 1 59 TYR QE . . 4.060 3.362 2.790 4.010 . 0 0 "[ . 1 . 2]" 1 714 1 34 LYS QE 1 66 LEU QD . . 5.030 4.396 3.234 4.958 . 0 0 "[ . 1 . 2]" 1 715 1 34 LYS HE2 1 34 LYS HG2 . . 4.080 3.143 2.086 4.082 0.002 6 0 "[ . 1 . 2]" 1 716 1 34 LYS HE2 1 34 LYS HG3 . . 4.080 2.867 2.072 3.938 . 0 0 "[ . 1 . 2]" 1 717 1 34 LYS HE3 1 34 LYS HG2 . . 4.080 3.372 2.159 3.992 . 0 0 "[ . 1 . 2]" 1 718 1 34 LYS HE3 1 34 LYS HG3 . . 4.080 2.996 2.083 3.654 . 0 0 "[ . 1 . 2]" 1 719 1 34 LYS QG 1 39 ARG QD . . 4.500 4.094 3.174 4.504 0.004 9 0 "[ . 1 . 2]" 1 720 1 34 LYS QG 1 59 TYR QE . . 4.280 2.698 1.993 3.409 . 0 0 "[ . 1 . 2]" 1 721 1 35 ASN H 1 36 ASP H . . 5.500 2.878 2.809 2.909 . 0 0 "[ . 1 . 2]" 1 722 1 35 ASN HA 1 35 ASN QB . . 2.520 2.404 2.280 2.483 . 0 0 "[ . 1 . 2]" 1 723 1 36 ASP H 1 37 GLU H . . 3.100 2.750 2.737 2.758 . 0 0 "[ . 1 . 2]" 1 724 1 36 ASP H 1 37 GLU QB . . 4.890 4.787 4.696 4.868 . 0 0 "[ . 1 . 2]" 1 725 1 36 ASP HA 1 36 ASP QB . . 2.550 2.410 2.294 2.479 . 0 0 "[ . 1 . 2]" 1 726 1 37 GLU H 1 37 GLU QB . . 2.850 2.632 2.581 2.675 . 0 0 "[ . 1 . 2]" 1 727 1 37 GLU H 1 37 GLU QG . . 3.720 3.399 3.227 3.582 . 0 0 "[ . 1 . 2]" 1 728 1 37 GLU H 1 38 GLU H . . 4.850 4.400 4.392 4.415 . 0 0 "[ . 1 . 2]" 1 729 1 37 GLU HA 1 37 GLU HG2 . . 3.970 2.561 2.291 2.799 . 0 0 "[ . 1 . 2]" 1 730 1 37 GLU HA 1 37 GLU QG . . 3.480 2.428 2.227 2.639 . 0 0 "[ . 1 . 2]" 1 731 1 37 GLU HA 1 37 GLU HG3 . . 3.970 3.214 2.468 3.741 . 0 0 "[ . 1 . 2]" 1 732 1 37 GLU HA 1 38 GLU H . . 2.700 2.574 2.521 2.597 . 0 0 "[ . 1 . 2]" 1 733 1 37 GLU QB 1 38 GLU H . . 2.400 2.058 2.007 2.153 . 0 0 "[ . 1 . 2]" 1 734 1 38 GLU H 1 38 GLU QB . . 3.250 2.854 2.384 3.127 . 0 0 "[ . 1 . 2]" 1 735 1 38 GLU H 1 38 GLU QG . . 4.160 2.613 1.946 4.161 0.001 2 0 "[ . 1 . 2]" 1 736 1 38 GLU H 1 39 ARG H . . 4.590 4.316 4.266 4.392 . 0 0 "[ . 1 . 2]" 1 737 1 38 GLU H 1 39 ARG HA . . 5.130 4.904 4.845 4.983 . 0 0 "[ . 1 . 2]" 1 738 1 38 GLU HA 1 38 GLU QB . . 2.520 2.269 2.172 2.530 0.010 2 0 "[ . 1 . 2]" 1 739 1 38 GLU HA 1 38 GLU HG2 . . 4.130 3.528 2.764 3.644 . 0 0 "[ . 1 . 2]" 1 740 1 38 GLU HA 1 38 GLU HG3 . . 4.130 3.485 2.180 4.231 0.101 17 0 "[ . 1 . 2]" 1 741 1 38 GLU HA 1 39 ARG H . . 2.440 2.148 2.141 2.162 . 0 0 "[ . 1 . 2]" 1 742 1 38 GLU HA 1 39 ARG QG . . 5.340 4.056 3.606 5.038 . 0 0 "[ . 1 . 2]" 1 743 1 38 GLU QB 1 39 ARG H . . 3.490 3.238 3.142 3.493 0.003 2 0 "[ . 1 . 2]" 1 744 1 38 GLU QB 1 39 ARG HA . . 5.340 4.281 4.080 4.450 . 0 0 "[ . 1 . 2]" 1 745 1 38 GLU QB 1 76 ASN QD . . 4.620 2.954 2.017 4.362 . 0 0 "[ . 1 . 2]" 1 746 1 38 GLU QG 1 39 ARG H . . 4.640 4.111 2.862 4.340 . 0 0 "[ . 1 . 2]" 1 747 1 38 GLU QG 1 76 ASN QD . . 4.770 3.418 1.804 4.733 . 0 0 "[ . 1 . 2]" 1 748 1 39 ARG H 1 39 ARG HB2 . . 3.880 2.656 2.506 2.799 . 0 0 "[ . 1 . 2]" 1 749 1 39 ARG H 1 40 LEU H . . 5.220 4.415 4.332 4.495 . 0 0 "[ . 1 . 2]" 1 750 1 39 ARG HA 1 39 ARG QD . . 4.520 3.749 3.331 4.159 . 0 0 "[ . 1 . 2]" 1 751 1 39 ARG HA 1 39 ARG HG2 . . 3.790 2.805 2.435 3.515 . 0 0 "[ . 1 . 2]" 1 752 1 39 ARG HA 1 39 ARG QG . . 3.300 2.394 2.061 2.575 . 0 0 "[ . 1 . 2]" 1 753 1 39 ARG HA 1 39 ARG HG3 . . 3.790 3.037 2.083 3.769 . 0 0 "[ . 1 . 2]" 1 754 1 39 ARG HA 1 40 LEU H . . 3.490 2.223 2.167 2.366 . 0 0 "[ . 1 . 2]" 1 755 1 39 ARG HA 1 59 TYR QD . . 5.500 5.078 4.589 5.508 0.008 6 0 "[ . 1 . 2]" 1 756 1 39 ARG HB2 1 40 LEU H . . 4.560 4.001 3.492 4.374 . 0 0 "[ . 1 . 2]" 1 757 1 39 ARG HB2 1 59 TYR QD . . 3.620 2.791 2.046 3.410 . 0 0 "[ . 1 . 2]" 1 758 1 39 ARG HB2 1 59 TYR QE . . 4.230 2.635 1.988 3.204 . 0 0 "[ . 1 . 2]" 1 759 1 39 ARG HB3 1 59 TYR QD . . 3.770 2.767 2.455 3.372 . 0 0 "[ . 1 . 2]" 1 760 1 39 ARG HB3 1 59 TYR QE . . 4.530 3.843 3.337 4.494 . 0 0 "[ . 1 . 2]" 1 761 1 39 ARG QD 1 59 TYR QD . . 4.080 3.418 2.611 4.078 . 0 0 "[ . 1 . 2]" 1 762 1 39 ARG QD 1 62 TYR QE . . 4.280 2.906 2.009 4.263 . 0 0 "[ . 1 . 2]" 1 763 1 39 ARG HD2 1 59 TYR QE . . 5.500 4.317 3.012 5.143 . 0 0 "[ . 1 . 2]" 1 764 1 39 ARG HD3 1 59 TYR QE . . 5.500 3.993 3.080 5.093 . 0 0 "[ . 1 . 2]" 1 765 1 39 ARG QG 1 40 LEU H . . 4.820 4.035 3.533 4.431 . 0 0 "[ . 1 . 2]" 1 766 1 39 ARG QG 1 59 TYR QD . . 4.730 3.919 3.464 4.448 . 0 0 "[ . 1 . 2]" 1 767 1 39 ARG HG2 1 59 TYR QD . . 5.500 4.532 3.634 5.397 . 0 0 "[ . 1 . 2]" 1 768 1 39 ARG HG2 1 62 TYR QE . . 5.500 4.374 2.808 5.504 0.004 19 0 "[ . 1 . 2]" 1 769 1 39 ARG HG3 1 59 TYR QD . . 5.500 4.569 3.601 5.252 . 0 0 "[ . 1 . 2]" 1 770 1 39 ARG HG3 1 62 TYR QE . . 5.500 4.741 4.062 5.501 0.001 16 0 "[ . 1 . 2]" 1 771 1 40 LEU H 1 40 LEU HB2 . . 3.800 2.437 2.355 2.581 . 0 0 "[ . 1 . 2]" 1 772 1 40 LEU H 1 40 LEU QB . . 3.290 2.233 2.208 2.288 . 0 0 "[ . 1 . 2]" 1 773 1 40 LEU H 1 40 LEU HB3 . . 3.800 2.599 2.551 2.669 . 0 0 "[ . 1 . 2]" 1 774 1 40 LEU H 1 40 LEU QD . . 4.530 3.683 3.640 3.743 . 0 0 "[ . 1 . 2]" 1 775 1 40 LEU H 1 41 ALA H . . 5.500 4.434 4.348 4.586 . 0 0 "[ . 1 . 2]" 1 776 1 40 LEU H 1 60 VAL QG . . 5.440 5.394 5.053 5.451 0.011 7 0 "[ . 1 . 2]" 1 777 1 40 LEU HA 1 40 LEU QD . . 2.530 2.494 2.424 2.540 0.010 4 0 "[ . 1 . 2]" 1 778 1 40 LEU HA 1 40 LEU HG . . 4.000 2.688 2.623 2.753 . 0 0 "[ . 1 . 2]" 1 779 1 40 LEU HA 1 41 ALA H . . 2.650 2.151 2.139 2.179 . 0 0 "[ . 1 . 2]" 1 780 1 40 LEU QB 1 40 LEU QD . . 2.850 1.785 1.770 1.816 . 0 0 "[ . 1 . 2]" 1 781 1 40 LEU QB 1 60 VAL HB . . 4.750 3.710 3.627 3.765 . 0 0 "[ . 1 . 2]" 1 782 1 40 LEU QB 1 60 VAL QG . . 3.930 3.622 3.320 3.790 . 0 0 "[ . 1 . 2]" 1 783 1 40 LEU HB2 1 41 ALA H . . 5.040 4.400 4.245 4.476 . 0 0 "[ . 1 . 2]" 1 784 1 40 LEU HB2 1 60 VAL HB . . 5.500 5.489 5.410 5.512 0.012 19 0 "[ . 1 . 2]" 1 785 1 40 LEU HB3 1 41 ALA H . . 5.040 4.234 3.959 4.344 . 0 0 "[ . 1 . 2]" 1 786 1 40 LEU HB3 1 60 VAL HB . . 5.500 3.773 3.685 3.834 . 0 0 "[ . 1 . 2]" 1 787 1 40 LEU QD 1 41 ALA H . . 3.580 3.512 3.248 3.596 0.016 20 0 "[ . 1 . 2]" 1 788 1 40 LEU QD 1 41 ALA MB . . 5.440 4.672 4.542 4.730 . 0 0 "[ . 1 . 2]" 1 789 1 40 LEU QD 1 60 VAL HB . . 4.490 3.060 2.736 3.389 . 0 0 "[ . 1 . 2]" 1 790 1 40 LEU QD 1 60 VAL QG . . 3.350 2.656 2.385 2.972 . 0 0 "[ . 1 . 2]" 1 791 1 40 LEU QD 1 82 LEU QD . . 4.230 3.218 2.640 3.671 . 0 0 "[ . 1 . 2]" 1 792 1 40 LEU MD1 1 41 ALA H . . 4.960 3.666 3.415 3.747 . 0 0 "[ . 1 . 2]" 1 793 1 40 LEU MD2 1 41 ALA H . . 4.960 4.508 4.063 4.731 . 0 0 "[ . 1 . 2]" 1 794 1 41 ALA H 1 41 ALA MB . . 2.910 2.451 2.346 2.640 . 0 0 "[ . 1 . 2]" 1 795 1 41 ALA HA 1 42 GLU H . . 2.900 2.179 2.161 2.200 . 0 0 "[ . 1 . 2]" 1 796 1 41 ALA HA 1 57 VAL MG2 . . 5.500 5.232 4.962 5.485 . 0 0 "[ . 1 . 2]" 1 797 1 41 ALA HA 1 59 TYR HA . . 3.060 2.620 2.234 2.890 . 0 0 "[ . 1 . 2]" 1 798 1 41 ALA HA 1 59 TYR QD . . 4.420 4.309 3.998 4.429 0.009 20 0 "[ . 1 . 2]" 1 799 1 41 ALA HA 1 59 TYR QE . . 5.500 5.466 5.199 5.518 0.018 14 0 "[ . 1 . 2]" 1 800 1 41 ALA HA 1 60 VAL QG . . 4.000 3.272 2.830 3.527 . 0 0 "[ . 1 . 2]" 1 801 1 41 ALA MB 1 42 GLU H . . 3.440 3.014 2.918 3.102 . 0 0 "[ . 1 . 2]" 1 802 1 41 ALA MB 1 43 ILE MD . . 4.220 3.983 3.795 4.076 . 0 0 "[ . 1 . 2]" 1 803 1 41 ALA MB 1 57 VAL HA . . 4.510 3.892 3.708 4.095 . 0 0 "[ . 1 . 2]" 1 804 1 41 ALA MB 1 57 VAL HB . . 2.590 2.102 1.892 2.236 . 0 0 "[ . 1 . 2]" 1 805 1 41 ALA MB 1 57 VAL MG1 . . 3.570 2.626 2.429 2.805 . 0 0 "[ . 1 . 2]" 1 806 1 41 ALA MB 1 57 VAL MG2 . . 3.500 3.046 2.845 3.207 . 0 0 "[ . 1 . 2]" 1 807 1 41 ALA MB 1 58 HIS H . . 3.870 3.045 2.803 3.304 . 0 0 "[ . 1 . 2]" 1 808 1 41 ALA MB 1 59 TYR HA . . 4.090 3.257 2.914 3.568 . 0 0 "[ . 1 . 2]" 1 809 1 41 ALA MB 1 59 TYR QD . . 3.990 3.657 3.390 3.971 . 0 0 "[ . 1 . 2]" 1 810 1 41 ALA MB 1 59 TYR QE . . 4.290 3.764 3.393 4.040 . 0 0 "[ . 1 . 2]" 1 811 1 42 GLU H 1 42 GLU HB3 . . 2.400 2.402 2.397 2.404 0.004 1 0 "[ . 1 . 2]" 1 812 1 42 GLU H 1 43 ILE H . . 5.500 4.476 4.425 4.539 . 0 0 "[ . 1 . 2]" 1 813 1 42 GLU H 1 58 HIS H . . 3.770 2.782 2.570 2.903 . 0 0 "[ . 1 . 2]" 1 814 1 42 GLU H 1 60 VAL QG . . 3.730 2.874 2.509 3.192 . 0 0 "[ . 1 . 2]" 1 815 1 42 GLU HA 1 42 GLU HB2 . . 2.820 2.389 2.386 2.390 . 0 0 "[ . 1 . 2]" 1 816 1 42 GLU HA 1 43 ILE H . . 2.400 2.167 2.143 2.226 . 0 0 "[ . 1 . 2]" 1 817 1 42 GLU HB2 1 43 ILE H . . 4.270 4.091 3.942 4.180 . 0 0 "[ . 1 . 2]" 1 818 1 42 GLU HB2 1 58 HIS HB3 . . 5.500 5.121 4.863 5.367 . 0 0 "[ . 1 . 2]" 1 819 1 42 GLU HB3 1 44 LEU QD . . 5.440 4.029 3.236 4.178 . 0 0 "[ . 1 . 2]" 1 820 1 42 GLU HB3 1 58 HIS HB2 . . 5.360 5.133 4.865 5.370 0.010 11 0 "[ . 1 . 2]" 1 821 1 42 GLU HB3 1 58 HIS HB3 . . 4.280 3.387 3.132 3.638 . 0 0 "[ . 1 . 2]" 1 822 1 42 GLU HB3 1 58 HIS HD2 . . 4.440 3.689 3.219 3.958 . 0 0 "[ . 1 . 2]" 1 823 1 42 GLU HB3 1 60 VAL QG . . 4.180 2.674 2.246 3.023 . 0 0 "[ . 1 . 2]" 1 824 1 42 GLU HG2 1 44 LEU MD1 . . 5.500 4.958 2.619 5.264 . 0 0 "[ . 1 . 2]" 1 825 1 42 GLU HG2 1 44 LEU QD . . 4.230 3.022 2.497 3.221 . 0 0 "[ . 1 . 2]" 1 826 1 42 GLU HG2 1 44 LEU MD2 . . 5.500 3.078 2.854 3.259 . 0 0 "[ . 1 . 2]" 1 827 1 42 GLU HG2 1 58 HIS H . . 4.950 4.861 4.704 4.955 0.005 10 0 "[ . 1 . 2]" 1 828 1 42 GLU HG3 1 43 ILE H . . 3.310 2.710 2.309 2.913 . 0 0 "[ . 1 . 2]" 1 829 1 42 GLU HG3 1 44 LEU QD . . 5.130 4.448 3.812 4.652 . 0 0 "[ . 1 . 2]" 1 830 1 43 ILE H 1 43 ILE MD . . 4.180 3.246 3.068 3.426 . 0 0 "[ . 1 . 2]" 1 831 1 43 ILE H 1 43 ILE HG12 . . 3.440 2.018 1.945 2.192 . 0 0 "[ . 1 . 2]" 1 832 1 43 ILE H 1 43 ILE HG13 . . 3.790 3.507 3.479 3.615 . 0 0 "[ . 1 . 2]" 1 833 1 43 ILE H 1 43 ILE MG . . 3.880 3.767 3.764 3.782 . 0 0 "[ . 1 . 2]" 1 834 1 43 ILE HA 1 43 ILE MD . . 2.430 2.020 1.973 2.143 . 0 0 "[ . 1 . 2]" 1 835 1 43 ILE HA 1 43 ILE HG12 . . 4.050 3.051 3.010 3.151 . 0 0 "[ . 1 . 2]" 1 836 1 43 ILE HA 1 43 ILE MG . . 2.810 2.284 2.256 2.330 . 0 0 "[ . 1 . 2]" 1 837 1 43 ILE HA 1 44 LEU H . . 3.470 2.215 2.214 2.217 . 0 0 "[ . 1 . 2]" 1 838 1 43 ILE HA 1 44 LEU QD . . 5.440 4.361 2.812 4.511 . 0 0 "[ . 1 . 2]" 1 839 1 43 ILE HA 1 45 SER H . . 4.250 3.963 3.851 4.254 0.004 20 0 "[ . 1 . 2]" 1 840 1 43 ILE HA 1 57 VAL HA . . 3.900 2.513 2.429 2.646 . 0 0 "[ . 1 . 2]" 1 841 1 43 ILE HA 1 57 VAL HB . . 5.210 4.476 4.329 4.678 . 0 0 "[ . 1 . 2]" 1 842 1 43 ILE HA 1 57 VAL MG1 . . 2.940 2.782 2.569 2.945 0.005 11 0 "[ . 1 . 2]" 1 843 1 43 ILE HA 1 57 VAL MG2 . . 5.220 5.029 4.918 5.158 . 0 0 "[ . 1 . 2]" 1 844 1 43 ILE HA 1 58 HIS H . . 4.850 3.925 3.740 4.089 . 0 0 "[ . 1 . 2]" 1 845 1 43 ILE MD 1 43 ILE MG . . 2.400 2.057 1.928 2.102 . 0 0 "[ . 1 . 2]" 1 846 1 43 ILE MD 1 44 LEU H . . 4.530 3.480 3.352 3.779 . 0 0 "[ . 1 . 2]" 1 847 1 43 ILE MD 1 55 PHE HA . . 5.330 4.988 4.826 5.264 . 0 0 "[ . 1 . 2]" 1 848 1 43 ILE MD 1 55 PHE HB2 . . 4.020 3.742 3.588 4.020 . 0 0 "[ . 1 . 2]" 1 849 1 43 ILE MD 1 55 PHE HB3 . . 3.850 3.020 2.867 3.296 . 0 0 "[ . 1 . 2]" 1 850 1 43 ILE MD 1 55 PHE QD . . 4.130 3.693 3.509 3.875 . 0 0 "[ . 1 . 2]" 1 851 1 43 ILE MD 1 55 PHE QE . . 5.300 5.126 4.973 5.273 . 0 0 "[ . 1 . 2]" 1 852 1 43 ILE MD 1 57 VAL HA . . 4.850 3.201 3.057 3.421 . 0 0 "[ . 1 . 2]" 1 853 1 43 ILE MD 1 57 VAL MG1 . . 2.400 1.945 1.859 2.060 . 0 0 "[ . 1 . 2]" 1 854 1 43 ILE HG12 1 43 ILE MG . . 3.540 3.194 3.186 3.202 . 0 0 "[ . 1 . 2]" 1 855 1 43 ILE HG13 1 43 ILE MG . . 2.570 2.343 2.309 2.400 . 0 0 "[ . 1 . 2]" 1 856 1 43 ILE HG13 1 44 LEU H . . 5.500 5.214 5.178 5.254 . 0 0 "[ . 1 . 2]" 1 857 1 43 ILE HG13 1 55 PHE QD . . 5.500 5.145 4.920 5.393 . 0 0 "[ . 1 . 2]" 1 858 1 43 ILE MG 1 44 LEU H . . 3.540 2.153 1.994 2.315 . 0 0 "[ . 1 . 2]" 1 859 1 43 ILE MG 1 44 LEU HB2 . . 5.140 4.224 4.135 4.348 . 0 0 "[ . 1 . 2]" 1 860 1 43 ILE MG 1 45 SER H . . 3.540 2.549 2.359 2.815 . 0 0 "[ . 1 . 2]" 1 861 1 43 ILE MG 1 45 SER HA . . 5.500 3.598 3.487 3.722 . 0 0 "[ . 1 . 2]" 1 862 1 43 ILE MG 1 46 ILE HG13 . . 3.660 3.106 2.761 3.400 . 0 0 "[ . 1 . 2]" 1 863 1 43 ILE MG 1 55 PHE HA . . 4.690 4.643 4.387 4.701 0.011 20 0 "[ . 1 . 2]" 1 864 1 43 ILE MG 1 55 PHE HB2 . . 4.780 4.683 4.594 4.768 . 0 0 "[ . 1 . 2]" 1 865 1 43 ILE MG 1 55 PHE HB3 . . 4.080 3.335 3.190 3.416 . 0 0 "[ . 1 . 2]" 1 866 1 43 ILE MG 1 55 PHE QD . . 3.530 3.440 3.249 3.530 . 2 0 "[ . 1 . 2]" 1 867 1 43 ILE MG 1 55 PHE QE . . 5.070 4.989 4.805 5.072 0.002 4 0 "[ . 1 . 2]" 1 868 1 43 ILE MG 1 57 VAL HA . . 4.760 4.015 3.933 4.166 . 0 0 "[ . 1 . 2]" 1 869 1 43 ILE MG 1 57 VAL MG2 . . 5.500 5.490 5.425 5.511 0.011 2 0 "[ . 1 . 2]" 1 870 1 44 LEU H 1 44 LEU HB2 . . 3.570 2.471 2.437 2.521 . 0 0 "[ . 1 . 2]" 1 871 1 44 LEU H 1 44 LEU HB3 . . 4.110 3.667 3.647 3.704 . 0 0 "[ . 1 . 2]" 1 872 1 44 LEU H 1 44 LEU HG . . 4.480 3.349 3.209 4.359 . 0 0 "[ . 1 . 2]" 1 873 1 44 LEU H 1 45 SER H . . 2.900 1.955 1.891 2.171 . 0 0 "[ . 1 . 2]" 1 874 1 44 LEU H 1 56 TYR QD . . 5.400 4.144 4.087 4.293 . 0 0 "[ . 1 . 2]" 1 875 1 44 LEU H 1 57 VAL HA . . 4.010 3.281 3.218 3.417 . 0 0 "[ . 1 . 2]" 1 876 1 44 LEU H 1 58 HIS H . . 5.220 4.832 4.672 4.995 . 0 0 "[ . 1 . 2]" 1 877 1 44 LEU HA 1 44 LEU HB3 . . 2.700 2.563 2.507 2.589 . 0 0 "[ . 1 . 2]" 1 878 1 44 LEU HA 1 44 LEU QD . . 2.400 2.066 1.939 2.115 . 0 0 "[ . 1 . 2]" 1 879 1 44 LEU HB2 1 44 LEU MD1 . . 3.590 2.433 2.366 3.176 . 0 0 "[ . 1 . 2]" 1 880 1 44 LEU HB2 1 44 LEU QD . . 3.040 2.317 2.113 2.348 . 0 0 "[ . 1 . 2]" 1 881 1 44 LEU HB2 1 44 LEU MD2 . . 3.590 3.132 2.146 3.193 . 0 0 "[ . 1 . 2]" 1 882 1 44 LEU HB2 1 45 SER H . . 3.560 2.770 2.404 2.907 . 0 0 "[ . 1 . 2]" 1 883 1 44 LEU HB2 1 56 TYR H . . 5.010 4.865 4.597 5.011 0.001 7 0 "[ . 1 . 2]" 1 884 1 44 LEU HB2 1 56 TYR QB . . 5.230 2.376 2.059 2.525 . 0 0 "[ . 1 . 2]" 1 885 1 44 LEU HB2 1 56 TYR QD . . 3.140 1.999 1.988 2.080 . 0 0 "[ . 1 . 2]" 1 886 1 44 LEU HB2 1 57 VAL H . . 5.260 4.849 4.704 5.056 . 0 0 "[ . 1 . 2]" 1 887 1 44 LEU HB2 1 57 VAL HA . . 5.220 4.156 3.926 4.374 . 0 0 "[ . 1 . 2]" 1 888 1 44 LEU HB2 1 58 HIS HB3 . . 5.500 4.675 4.466 5.279 . 0 0 "[ . 1 . 2]" 1 889 1 44 LEU HB3 1 45 SER H . . 3.700 3.558 3.347 3.687 . 0 0 "[ . 1 . 2]" 1 890 1 44 LEU HB3 1 56 TYR QD . . 3.370 2.429 2.264 2.625 . 0 0 "[ . 1 . 2]" 1 891 1 44 LEU QD 1 56 TYR QB . . 5.280 3.713 3.126 3.862 . 0 0 "[ . 1 . 2]" 1 892 1 44 LEU QD 1 56 TYR QD . . 3.510 2.564 2.368 3.157 . 0 0 "[ . 1 . 2]" 1 893 1 44 LEU QD 1 56 TYR QE . . 3.990 2.535 2.303 3.935 . 0 0 "[ . 1 . 2]" 1 894 1 44 LEU QD 1 57 VAL HA . . 4.460 4.036 2.188 4.261 . 0 0 "[ . 1 . 2]" 1 895 1 44 LEU QD 1 58 HIS H . . 4.430 3.853 2.490 4.022 . 0 0 "[ . 1 . 2]" 1 896 1 44 LEU QD 1 58 HIS HA . . 4.550 3.631 3.279 3.733 . 0 0 "[ . 1 . 2]" 1 897 1 44 LEU QD 1 58 HIS HB2 . . 3.340 1.942 1.899 2.086 . 0 0 "[ . 1 . 2]" 1 898 1 44 LEU QD 1 58 HIS HB3 . . 3.800 2.544 2.026 2.693 . 0 0 "[ . 1 . 2]" 1 899 1 44 LEU QD 1 58 HIS HD2 . . 4.430 3.052 2.752 3.369 . 0 0 "[ . 1 . 2]" 1 900 1 44 LEU QD 1 67 ASP QB . . 4.780 2.484 2.276 3.003 . 0 0 "[ . 1 . 2]" 1 901 1 44 LEU QD 1 68 GLU H . . 5.440 4.418 4.261 4.563 . 0 0 "[ . 1 . 2]" 1 902 1 44 LEU MD1 1 56 TYR QD . . 4.450 2.636 2.383 4.170 . 0 0 "[ . 1 . 2]" 1 903 1 44 LEU MD1 1 57 VAL HA . . 5.210 4.346 4.143 4.539 . 0 0 "[ . 1 . 2]" 1 904 1 44 LEU MD1 1 58 HIS HB2 . . 4.160 2.023 1.906 3.559 . 0 0 "[ . 1 . 2]" 1 905 1 44 LEU MD2 1 56 TYR QD . . 4.450 4.119 3.268 4.349 . 0 0 "[ . 1 . 2]" 1 906 1 44 LEU MD2 1 57 VAL HA . . 5.210 5.064 2.193 5.222 0.012 11 0 "[ . 1 . 2]" 1 907 1 44 LEU MD2 1 58 HIS HB2 . . 4.160 3.549 2.101 3.752 . 0 0 "[ . 1 . 2]" 1 908 1 44 LEU HG 1 56 TYR QD . . 5.020 3.998 2.947 4.129 . 0 0 "[ . 1 . 2]" 1 909 1 44 LEU HG 1 57 VAL HA . . 4.980 3.944 3.845 4.946 . 0 0 "[ . 1 . 2]" 1 910 1 44 LEU HG 1 58 HIS HB3 . . 5.110 2.536 2.324 3.701 . 0 0 "[ . 1 . 2]" 1 911 1 45 SER H 1 45 SER HB3 . . 3.820 3.443 3.200 3.526 . 0 0 "[ . 1 . 2]" 1 912 1 45 SER H 1 56 TYR H . . 3.640 3.134 3.084 3.200 . 0 0 "[ . 1 . 2]" 1 913 1 45 SER H 1 56 TYR HB2 . . 4.290 3.461 3.207 3.685 . 0 0 "[ . 1 . 2]" 1 914 1 45 SER H 1 56 TYR QB . . 3.570 2.161 1.973 2.330 . 0 0 "[ . 1 . 2]" 1 915 1 45 SER H 1 56 TYR HB3 . . 4.290 2.183 1.990 2.358 . 0 0 "[ . 1 . 2]" 1 916 1 45 SER H 1 56 TYR QD . . 5.440 3.703 3.529 3.866 . 0 0 "[ . 1 . 2]" 1 917 1 45 SER HA 1 46 ILE H . . 2.550 2.455 2.293 2.538 . 0 0 "[ . 1 . 2]" 1 918 1 45 SER HB2 1 56 TYR HB2 . . 4.160 3.625 3.362 3.793 . 0 0 "[ . 1 . 2]" 1 919 1 45 SER HB2 1 56 TYR QB . . 3.640 2.985 2.852 3.180 . 0 0 "[ . 1 . 2]" 1 920 1 45 SER HB2 1 56 TYR HB3 . . 4.160 3.179 3.060 3.424 . 0 0 "[ . 1 . 2]" 1 921 1 45 SER HB2 1 56 TYR QD . . 4.400 3.364 3.152 3.648 . 0 0 "[ . 1 . 2]" 1 922 1 45 SER HB2 1 69 TRP HH2 . . 4.830 4.297 3.905 4.574 . 0 0 "[ . 1 . 2]" 1 923 1 45 SER HB2 1 69 TRP HZ2 . . 5.500 5.280 4.617 5.504 0.004 7 0 "[ . 1 . 2]" 1 924 1 45 SER HB3 1 46 ILE H . . 3.720 2.845 2.689 3.497 . 0 0 "[ . 1 . 2]" 1 925 1 45 SER HB3 1 56 TYR H . . 4.540 4.119 3.975 4.315 . 0 0 "[ . 1 . 2]" 1 926 1 45 SER HB3 1 56 TYR HB2 . . 4.010 3.094 2.514 3.365 . 0 0 "[ . 1 . 2]" 1 927 1 45 SER HB3 1 56 TYR HB3 . . 4.010 3.429 2.933 3.770 . 0 0 "[ . 1 . 2]" 1 928 1 45 SER HB3 1 56 TYR QD . . 4.540 4.274 3.662 4.553 0.013 20 0 "[ . 1 . 2]" 1 929 1 45 SER HB3 1 69 TRP HH2 . . 4.100 3.054 2.423 3.298 . 0 0 "[ . 1 . 2]" 1 930 1 45 SER HB3 1 69 TRP HZ2 . . 5.150 4.715 3.845 5.008 . 0 0 "[ . 1 . 2]" 1 931 1 45 SER HB3 1 69 TRP HZ3 . . 5.500 3.675 3.479 4.188 . 0 0 "[ . 1 . 2]" 1 932 1 46 ILE H 1 46 ILE HB . . 3.270 2.728 2.611 2.831 . 0 0 "[ . 1 . 2]" 1 933 1 46 ILE H 1 46 ILE HG12 . . 4.500 4.130 3.895 4.484 . 0 0 "[ . 1 . 2]" 1 934 1 46 ILE H 1 46 ILE HG13 . . 3.400 2.917 2.720 3.263 . 0 0 "[ . 1 . 2]" 1 935 1 46 ILE H 1 46 ILE MG . . 3.950 3.887 3.838 3.930 . 0 0 "[ . 1 . 2]" 1 936 1 46 ILE HA 1 46 ILE MD . . 4.400 3.835 3.699 3.884 . 0 0 "[ . 1 . 2]" 1 937 1 46 ILE HA 1 46 ILE HG12 . . 3.790 2.788 2.593 3.234 . 0 0 "[ . 1 . 2]" 1 938 1 46 ILE HA 1 46 ILE HG13 . . 4.020 2.834 2.400 3.077 . 0 0 "[ . 1 . 2]" 1 939 1 46 ILE HA 1 46 ILE MG . . 2.650 2.297 2.237 2.358 . 0 0 "[ . 1 . 2]" 1 940 1 46 ILE HA 1 47 ASN H . . 2.420 2.203 2.153 2.241 . 0 0 "[ . 1 . 2]" 1 941 1 46 ILE HA 1 47 ASN HB3 . . 5.500 4.501 4.368 4.636 . 0 0 "[ . 1 . 2]" 1 942 1 46 ILE HA 1 55 PHE HA . . 2.810 2.505 2.367 2.640 . 0 0 "[ . 1 . 2]" 1 943 1 46 ILE HA 1 55 PHE HB3 . . 5.500 3.747 3.615 3.949 . 0 0 "[ . 1 . 2]" 1 944 1 46 ILE HA 1 55 PHE QD . . 4.410 3.059 2.904 3.324 . 0 0 "[ . 1 . 2]" 1 945 1 46 ILE HA 1 56 TYR H . . 4.270 3.190 3.069 3.329 . 0 0 "[ . 1 . 2]" 1 946 1 46 ILE HA 1 69 TRP HZ3 . . 4.610 3.719 2.989 3.971 . 0 0 "[ . 1 . 2]" 1 947 1 46 ILE HB 1 46 ILE MD . . 2.530 2.235 2.103 2.327 . 0 0 "[ . 1 . 2]" 1 948 1 46 ILE HB 1 48 THR H . . 5.270 5.067 4.964 5.188 . 0 0 "[ . 1 . 2]" 1 949 1 46 ILE MD 1 46 ILE MG . . 2.980 2.310 2.009 2.870 . 0 0 "[ . 1 . 2]" 1 950 1 46 ILE MD 1 47 ASN H . . 5.170 5.020 4.876 5.178 0.008 4 0 "[ . 1 . 2]" 1 951 1 46 ILE MD 1 55 PHE HA . . 5.500 5.457 5.269 5.507 0.007 20 0 "[ . 1 . 2]" 1 952 1 46 ILE MD 1 55 PHE QD . . 4.370 3.421 3.178 3.739 . 0 0 "[ . 1 . 2]" 1 953 1 46 ILE MD 1 55 PHE QE . . 3.950 3.101 2.499 3.953 0.003 3 0 "[ . 1 . 2]" 1 954 1 46 ILE HG12 1 46 ILE MG . . 3.600 2.272 1.974 2.401 . 0 0 "[ . 1 . 2]" 1 955 1 46 ILE HG12 1 55 PHE HA . . 4.760 4.349 3.988 4.767 0.007 2 0 "[ . 1 . 2]" 1 956 1 46 ILE HG12 1 55 PHE QE . . 3.900 2.948 2.408 3.409 . 0 0 "[ . 1 . 2]" 1 957 1 46 ILE HG12 1 56 TYR H . . 5.500 4.779 4.274 5.394 . 0 0 "[ . 1 . 2]" 1 958 1 46 ILE HG13 1 46 ILE MG . . 3.500 3.133 2.952 3.201 . 0 0 "[ . 1 . 2]" 1 959 1 46 ILE HG13 1 55 PHE HA . . 5.400 4.845 4.110 5.291 . 0 0 "[ . 1 . 2]" 1 960 1 46 ILE HG13 1 55 PHE QD . . 4.340 3.384 2.496 4.008 . 0 0 "[ . 1 . 2]" 1 961 1 46 ILE HG13 1 55 PHE QE . . 5.280 4.537 3.976 4.999 . 0 0 "[ . 1 . 2]" 1 962 1 46 ILE MG 1 47 ASN H . . 3.870 2.252 1.950 2.422 . 0 0 "[ . 1 . 2]" 1 963 1 46 ILE MG 1 47 ASN HA . . 4.860 3.572 3.455 3.798 . 0 0 "[ . 1 . 2]" 1 964 1 46 ILE MG 1 48 THR H . . 4.880 3.373 3.195 3.617 . 0 0 "[ . 1 . 2]" 1 965 1 46 ILE MG 1 48 THR HA . . 4.470 4.167 4.099 4.303 . 0 0 "[ . 1 . 2]" 1 966 1 46 ILE MG 1 48 THR HB . . 5.500 4.763 4.697 4.834 . 0 0 "[ . 1 . 2]" 1 967 1 46 ILE MG 1 48 THR MG . . 2.940 2.298 2.191 2.462 . 0 0 "[ . 1 . 2]" 1 968 1 46 ILE MG 1 53 PRO HB2 . . 4.170 3.854 3.728 3.904 . 0 0 "[ . 1 . 2]" 1 969 1 46 ILE MG 1 53 PRO HB3 . . 4.800 4.802 4.646 4.831 0.031 17 0 "[ . 1 . 2]" 1 970 1 46 ILE MG 1 54 LYS H . . 4.700 4.524 4.420 4.675 . 0 0 "[ . 1 . 2]" 1 971 1 46 ILE MG 1 55 PHE H . . 5.460 5.380 5.225 5.464 0.004 10 0 "[ . 1 . 2]" 1 972 1 46 ILE MG 1 55 PHE HA . . 4.400 3.479 3.292 3.582 . 0 0 "[ . 1 . 2]" 1 973 1 46 ILE MG 1 55 PHE QD . . 3.420 2.609 2.474 2.826 . 0 0 "[ . 1 . 2]" 1 974 1 46 ILE MG 1 55 PHE QE . . 3.890 2.216 2.044 2.431 . 0 0 "[ . 1 . 2]" 1 975 1 46 ILE MG 1 56 TYR H . . 5.160 4.798 4.627 4.897 . 0 0 "[ . 1 . 2]" 1 976 1 47 ASN H 1 48 THR H . . 4.270 3.909 3.781 4.033 . 0 0 "[ . 1 . 2]" 1 977 1 47 ASN H 1 48 THR MG . . 5.290 3.882 3.567 4.067 . 0 0 "[ . 1 . 2]" 1 978 1 47 ASN H 1 53 PRO HB2 . . 4.490 4.409 4.274 4.501 0.011 7 0 "[ . 1 . 2]" 1 979 1 47 ASN H 1 54 LYS H . . 3.970 3.877 3.741 3.979 0.009 18 0 "[ . 1 . 2]" 1 980 1 47 ASN H 1 55 PHE QD . . 4.760 4.086 3.977 4.343 . 0 0 "[ . 1 . 2]" 1 981 1 47 ASN H 1 56 TYR H . . 4.980 4.446 4.283 4.638 . 0 0 "[ . 1 . 2]" 1 982 1 47 ASN H 1 69 TRP HZ3 . . 3.980 3.280 2.249 3.627 . 0 0 "[ . 1 . 2]" 1 983 1 47 ASN HA 1 47 ASN HB2 . . 2.510 2.444 2.393 2.520 0.010 12 0 "[ . 1 . 2]" 1 984 1 47 ASN HA 1 48 THR H . . 2.580 2.185 2.171 2.204 . 0 0 "[ . 1 . 2]" 1 985 1 47 ASN HA 1 48 THR MG . . 4.960 4.136 4.076 4.318 . 0 0 "[ . 1 . 2]" 1 986 1 47 ASN HA 1 49 ARG H . . 4.460 4.260 3.807 4.380 . 0 0 "[ . 1 . 2]" 1 987 1 47 ASN HA 1 69 TRP HH2 . . 5.500 5.102 4.083 5.439 . 0 0 "[ . 1 . 2]" 1 988 1 47 ASN HA 1 69 TRP HZ3 . . 5.160 4.092 3.971 4.221 . 0 0 "[ . 1 . 2]" 1 989 1 47 ASN HB2 1 48 THR H . . 4.770 4.471 4.433 4.547 . 0 0 "[ . 1 . 2]" 1 990 1 47 ASN HB2 1 54 LYS HB2 . . 4.510 4.381 4.161 4.513 0.003 15 0 "[ . 1 . 2]" 1 991 1 47 ASN HB2 1 54 LYS HB3 . . 5.220 4.968 4.700 5.223 0.003 15 0 "[ . 1 . 2]" 1 992 1 47 ASN HB2 1 69 TRP HH2 . . 4.320 3.146 2.392 3.419 . 0 0 "[ . 1 . 2]" 1 993 1 47 ASN HB2 1 69 TRP HZ2 . . 5.350 5.108 3.972 5.351 0.001 2 0 "[ . 1 . 2]" 1 994 1 47 ASN HB2 1 69 TRP HZ3 . . 4.180 2.132 1.997 2.737 . 0 0 "[ . 1 . 2]" 1 995 1 47 ASN HB3 1 54 LYS HA . . 5.500 4.894 4.726 5.099 . 0 0 "[ . 1 . 2]" 1 996 1 47 ASN HB3 1 54 LYS HB2 . . 4.170 2.700 2.475 2.853 . 0 0 "[ . 1 . 2]" 1 997 1 47 ASN HB3 1 54 LYS HB3 . . 4.500 3.450 3.230 3.777 . 0 0 "[ . 1 . 2]" 1 998 1 47 ASN HB3 1 69 TRP HE3 . . 4.510 3.247 3.003 3.533 . 0 0 "[ . 1 . 2]" 1 999 1 47 ASN HB3 1 69 TRP HH2 . . 4.940 4.454 3.504 4.839 . 0 0 "[ . 1 . 2]" 1 1000 1 47 ASN HB3 1 69 TRP HZ3 . . 4.070 2.591 2.241 2.833 . 0 0 "[ . 1 . 2]" 1 1001 1 47 ASN QD 1 54 LYS HB2 . . 4.480 2.687 1.991 4.238 . 0 0 "[ . 1 . 2]" 1 1002 1 47 ASN QD 1 54 LYS QD . . 5.340 3.278 2.643 4.368 . 0 0 "[ . 1 . 2]" 1 1003 1 47 ASN HD21 1 54 LYS HB2 . . 5.140 2.756 2.005 4.513 . 0 0 "[ . 1 . 2]" 1 1004 1 47 ASN HD22 1 54 LYS HB2 . . 5.140 3.988 3.412 5.143 0.003 10 0 "[ . 1 . 2]" 1 1005 1 48 THR H 1 48 THR MG . . 3.410 2.788 2.733 2.950 . 0 0 "[ . 1 . 2]" 1 1006 1 48 THR H 1 49 ARG H . . 3.530 3.472 3.121 3.552 0.022 16 0 "[ . 1 . 2]" 1 1007 1 48 THR H 1 49 ARG QB . . 5.340 4.593 4.196 4.868 . 0 0 "[ . 1 . 2]" 1 1008 1 48 THR H 1 50 LYS H . . 5.490 5.260 5.011 5.314 . 0 0 "[ . 1 . 2]" 1 1009 1 48 THR HA 1 48 THR HB . . 2.550 2.492 2.475 2.552 0.002 13 0 "[ . 1 . 2]" 1 1010 1 48 THR HA 1 48 THR MG . . 2.400 2.226 2.145 2.340 . 0 0 "[ . 1 . 2]" 1 1011 1 48 THR HA 1 53 PRO HA . . 4.030 3.056 2.684 3.203 . 0 0 "[ . 1 . 2]" 1 1012 1 48 THR HA 1 53 PRO HB2 . . 3.250 2.514 2.467 2.582 . 0 0 "[ . 1 . 2]" 1 1013 1 48 THR HB 1 49 ARG HA . . 5.500 4.723 4.679 4.834 . 0 0 "[ . 1 . 2]" 1 1014 1 48 THR HB 1 50 LYS H . . 5.060 4.529 4.381 4.752 . 0 0 "[ . 1 . 2]" 1 1015 1 48 THR HB 1 53 PRO HA . . 5.020 4.891 4.358 5.036 0.016 7 0 "[ . 1 . 2]" 1 1016 1 48 THR HB 1 53 PRO HB2 . . 4.560 4.185 3.825 4.342 . 0 0 "[ . 1 . 2]" 1 1017 1 48 THR MG 1 49 ARG H . . 4.490 4.315 4.304 4.347 . 0 0 "[ . 1 . 2]" 1 1018 1 48 THR MG 1 53 PRO HA . . 4.460 4.306 3.834 4.467 0.007 7 0 "[ . 1 . 2]" 1 1019 1 48 THR MG 1 53 PRO HB2 . . 3.000 2.458 2.063 2.622 . 0 0 "[ . 1 . 2]" 1 1020 1 48 THR MG 1 53 PRO HB3 . . 4.170 2.573 2.141 2.731 . 0 0 "[ . 1 . 2]" 1 1021 1 48 THR MG 1 53 PRO HD3 . . 4.720 4.564 4.118 4.723 0.003 5 0 "[ . 1 . 2]" 1 1022 1 48 THR MG 1 53 PRO HG2 . . 4.770 3.738 3.388 3.867 . 0 0 "[ . 1 . 2]" 1 1023 1 48 THR MG 1 53 PRO HG3 . . 4.160 2.987 2.483 3.142 . 0 0 "[ . 1 . 2]" 1 1024 1 48 THR MG 1 54 LYS H . . 4.000 3.962 3.743 4.013 0.013 16 0 "[ . 1 . 2]" 1 1025 1 48 THR MG 1 55 PHE HZ . . 4.880 3.803 3.621 3.955 . 0 0 "[ . 1 . 2]" 1 1026 1 49 ARG H 1 49 ARG QB . . 2.530 2.485 2.394 2.603 0.073 12 0 "[ . 1 . 2]" 1 1027 1 49 ARG H 1 49 ARG QD . . 5.160 4.323 3.423 4.882 . 0 0 "[ . 1 . 2]" 1 1028 1 49 ARG H 1 49 ARG QG . . 3.360 2.936 2.287 3.362 0.002 2 0 "[ . 1 . 2]" 1 1029 1 49 ARG H 1 50 LYS H . . 2.680 2.192 2.135 2.449 . 0 0 "[ . 1 . 2]" 1 1030 1 49 ARG HA 1 49 ARG QB . . 2.520 2.365 2.172 2.481 . 0 0 "[ . 1 . 2]" 1 1031 1 49 ARG HA 1 49 ARG QD . . 4.300 3.499 2.252 4.319 0.019 12 0 "[ . 1 . 2]" 1 1032 1 49 ARG HA 1 49 ARG HG2 . . 4.110 2.872 2.216 3.800 . 0 0 "[ . 1 . 2]" 1 1033 1 49 ARG HA 1 49 ARG HG3 . . 4.110 3.490 2.698 3.813 . 0 0 "[ . 1 . 2]" 1 1034 1 49 ARG QB 1 49 ARG QD . . 3.150 2.135 1.997 2.321 . 0 0 "[ . 1 . 2]" 1 1035 1 49 ARG QB 1 50 LYS H . . 4.100 3.623 3.522 3.942 . 0 0 "[ . 1 . 2]" 1 1036 1 50 LYS H 1 50 LYS HB2 . . 3.840 2.788 2.565 2.926 . 0 0 "[ . 1 . 2]" 1 1037 1 50 LYS H 1 50 LYS QB . . 3.240 2.618 2.459 2.674 . 0 0 "[ . 1 . 2]" 1 1038 1 50 LYS H 1 50 LYS HB3 . . 3.840 3.225 3.062 3.498 . 0 0 "[ . 1 . 2]" 1 1039 1 50 LYS H 1 50 LYS QG . . 4.420 4.181 3.908 4.335 . 0 0 "[ . 1 . 2]" 1 1040 1 50 LYS H 1 51 ALA H . . 4.520 4.406 4.398 4.409 . 0 0 "[ . 1 . 2]" 1 1041 1 50 LYS HA 1 50 LYS QB . . 2.610 2.514 2.488 2.540 . 0 0 "[ . 1 . 2]" 1 1042 1 50 LYS HA 1 50 LYS HD2 . . 4.840 3.614 2.114 4.521 . 0 0 "[ . 1 . 2]" 1 1043 1 50 LYS HA 1 50 LYS QD . . 4.050 3.276 2.080 3.944 . 0 0 "[ . 1 . 2]" 1 1044 1 50 LYS HA 1 50 LYS HD3 . . 4.840 3.977 2.332 4.643 . 0 0 "[ . 1 . 2]" 1 1045 1 50 LYS HA 1 50 LYS QG . . 2.820 2.182 2.066 2.467 . 0 0 "[ . 1 . 2]" 1 1046 1 50 LYS HA 1 51 ALA H . . 2.700 2.567 2.543 2.640 . 0 0 "[ . 1 . 2]" 1 1047 1 50 LYS HB2 1 51 ALA H . . 3.820 3.795 3.718 3.827 0.007 13 0 "[ . 1 . 2]" 1 1048 1 50 LYS HB3 1 51 ALA H . . 3.820 2.641 2.285 2.884 . 0 0 "[ . 1 . 2]" 1 1049 1 50 LYS QG 1 51 ALA H . . 2.980 2.185 1.936 2.814 . 0 0 "[ . 1 . 2]" 1 1050 1 50 LYS QG 1 53 PRO HA . . 5.500 4.758 4.471 5.297 . 0 0 "[ . 1 . 2]" 1 1051 1 51 ALA H 1 51 ALA MB . . 3.130 2.553 2.543 2.557 . 0 0 "[ . 1 . 2]" 1 1052 1 51 ALA HA 1 52 PRO HA . . 2.400 1.888 1.881 1.912 . 0 0 "[ . 1 . 2]" 1 1053 1 51 ALA HA 1 52 PRO HB2 . . 5.030 4.291 4.262 4.305 . 0 0 "[ . 1 . 2]" 1 1054 1 51 ALA HA 1 52 PRO QB . . 4.250 3.735 3.732 3.737 . 0 0 "[ . 1 . 2]" 1 1055 1 51 ALA HA 1 52 PRO HB3 . . 5.030 4.107 4.101 4.125 . 0 0 "[ . 1 . 2]" 1 1056 1 51 ALA HA 1 52 PRO QG . . 4.890 4.547 4.518 4.559 . 0 0 "[ . 1 . 2]" 1 1057 1 51 ALA HA 1 53 PRO HD2 . . 4.200 3.944 3.926 3.967 . 0 0 "[ . 1 . 2]" 1 1058 1 51 ALA HA 1 53 PRO HD3 . . 4.030 3.035 3.003 3.084 . 0 0 "[ . 1 . 2]" 1 1059 1 51 ALA MB 1 52 PRO HA . . 3.290 3.232 3.111 3.279 . 0 0 "[ . 1 . 2]" 1 1060 1 51 ALA MB 1 52 PRO QB . . 4.820 4.478 4.374 4.519 . 0 0 "[ . 1 . 2]" 1 1061 1 51 ALA MB 1 52 PRO HD2 . . 5.420 4.577 4.561 4.583 . 0 0 "[ . 1 . 2]" 1 1062 1 51 ALA MB 1 52 PRO QD . . 4.710 3.890 3.845 3.907 . 0 0 "[ . 1 . 2]" 1 1063 1 51 ALA MB 1 52 PRO HD3 . . 5.420 4.209 4.140 4.236 . 0 0 "[ . 1 . 2]" 1 1064 1 51 ALA MB 1 53 PRO HA . . 5.500 5.104 5.096 5.111 . 0 0 "[ . 1 . 2]" 1 1065 1 51 ALA MB 1 53 PRO HB3 . . 5.500 5.564 5.539 5.582 0.082 7 0 "[ . 1 . 2]" 1 1066 1 51 ALA MB 1 53 PRO HD2 . . 5.390 5.131 5.040 5.173 . 0 0 "[ . 1 . 2]" 1 1067 1 51 ALA MB 1 53 PRO HD3 . . 4.510 4.175 4.090 4.219 . 0 0 "[ . 1 . 2]" 1 1068 1 52 PRO HA 1 53 PRO HD2 . . 2.770 2.503 2.487 2.528 . 0 0 "[ . 1 . 2]" 1 1069 1 52 PRO HA 1 53 PRO HD3 . . 2.400 2.351 2.343 2.364 . 0 0 "[ . 1 . 2]" 1 1070 1 52 PRO QB 1 53 PRO HD2 . . 3.340 2.077 2.029 2.106 . 0 0 "[ . 1 . 2]" 1 1071 1 52 PRO QB 1 53 PRO HD3 . . 3.590 3.279 3.242 3.302 . 0 0 "[ . 1 . 2]" 1 1072 1 52 PRO QB 1 72 THR HB . . 4.400 4.310 4.175 4.405 0.005 19 0 "[ . 1 . 2]" 1 1073 1 52 PRO QB 1 72 THR MG . . 3.730 2.048 1.911 2.221 . 0 0 "[ . 1 . 2]" 1 1074 1 52 PRO HB2 1 53 PRO HD2 . . 3.810 2.148 2.092 2.182 . 0 0 "[ . 1 . 2]" 1 1075 1 52 PRO HB2 1 53 PRO HD3 . . 4.220 3.575 3.528 3.604 . 0 0 "[ . 1 . 2]" 1 1076 1 52 PRO HB2 1 72 THR HB . . 5.280 4.684 4.586 4.744 . 0 0 "[ . 1 . 2]" 1 1077 1 52 PRO HB2 1 72 THR MG . . 4.300 2.089 1.956 2.264 . 0 0 "[ . 1 . 2]" 1 1078 1 52 PRO HB3 1 53 PRO HD2 . . 3.810 2.758 2.731 2.775 . 0 0 "[ . 1 . 2]" 1 1079 1 52 PRO HB3 1 53 PRO HD3 . . 4.220 3.813 3.781 3.833 . 0 0 "[ . 1 . 2]" 1 1080 1 52 PRO HB3 1 72 THR HB . . 5.280 5.039 4.803 5.237 . 0 0 "[ . 1 . 2]" 1 1081 1 52 PRO HB3 1 72 THR MG . . 4.300 2.949 2.684 3.223 . 0 0 "[ . 1 . 2]" 1 1082 1 52 PRO QG 1 72 THR HB . . 4.700 4.688 4.528 4.708 0.008 8 0 "[ . 1 . 2]" 1 1083 1 52 PRO QG 1 72 THR MG . . 4.390 3.043 2.852 3.247 . 0 0 "[ . 1 . 2]" 1 1084 1 52 PRO QG 1 73 ASP H . . 4.560 3.959 3.750 4.100 . 0 0 "[ . 1 . 2]" 1 1085 1 53 PRO HA 1 54 LYS H . . 2.550 2.496 2.340 2.570 0.020 20 0 "[ . 1 . 2]" 1 1086 1 53 PRO HA 1 72 THR MG . . 5.500 5.298 5.227 5.377 . 0 0 "[ . 1 . 2]" 1 1087 1 53 PRO HB2 1 54 LYS H . . 3.610 2.387 2.215 2.770 . 0 0 "[ . 1 . 2]" 1 1088 1 53 PRO HB3 1 55 PHE QE . . 4.730 4.738 4.733 4.744 0.014 17 0 "[ . 1 . 2]" 1 1089 1 53 PRO HB3 1 55 PHE HZ . . 5.200 4.936 4.784 5.200 . 0 0 "[ . 1 . 2]" 1 1090 1 53 PRO HB3 1 72 THR MG . . 5.500 5.441 5.319 5.502 0.002 11 0 "[ . 1 . 2]" 1 1091 1 53 PRO HD2 1 72 THR MG . . 4.210 2.813 2.710 2.911 . 0 0 "[ . 1 . 2]" 1 1092 1 53 PRO HD3 1 72 THR MG . . 4.950 4.273 4.170 4.375 . 0 0 "[ . 1 . 2]" 1 1093 1 53 PRO HG2 1 55 PHE QE . . 4.440 2.268 2.129 2.441 . 0 0 "[ . 1 . 2]" 1 1094 1 53 PRO HG2 1 55 PHE HZ . . 5.290 2.880 2.746 3.087 . 0 0 "[ . 1 . 2]" 1 1095 1 53 PRO HG2 1 72 THR H . . 5.500 5.218 4.939 5.380 . 0 0 "[ . 1 . 2]" 1 1096 1 53 PRO HG2 1 72 THR MG . . 5.070 3.207 3.054 3.292 . 0 0 "[ . 1 . 2]" 1 1097 1 53 PRO HG3 1 55 PHE QE . . 4.610 3.850 3.732 3.997 . 0 0 "[ . 1 . 2]" 1 1098 1 53 PRO HG3 1 55 PHE HZ . . 5.100 3.546 3.408 3.747 . 0 0 "[ . 1 . 2]" 1 1099 1 54 LYS H 1 54 LYS HB2 . . 3.210 2.496 2.416 2.555 . 0 0 "[ . 1 . 2]" 1 1100 1 54 LYS H 1 54 LYS HG3 . . 3.710 3.353 2.917 3.671 . 0 0 "[ . 1 . 2]" 1 1101 1 54 LYS HA 1 54 LYS HB3 . . 2.870 2.598 2.496 2.663 . 0 0 "[ . 1 . 2]" 1 1102 1 54 LYS HA 1 54 LYS QD . . 4.210 3.958 3.809 4.047 . 0 0 "[ . 1 . 2]" 1 1103 1 54 LYS HA 1 54 LYS QE . . 5.340 4.413 4.195 4.687 . 0 0 "[ . 1 . 2]" 1 1104 1 54 LYS HA 1 54 LYS HG2 . . 2.600 2.409 2.229 2.580 . 0 0 "[ . 1 . 2]" 1 1105 1 54 LYS HA 1 54 LYS HG3 . . 3.060 2.937 2.766 3.064 0.004 14 0 "[ . 1 . 2]" 1 1106 1 54 LYS HA 1 55 PHE H . . 2.850 2.343 2.270 2.377 . 0 0 "[ . 1 . 2]" 1 1107 1 54 LYS HA 1 55 PHE QD . . 4.560 2.903 2.845 2.975 . 0 0 "[ . 1 . 2]" 1 1108 1 54 LYS HA 1 69 TRP HE3 . . 5.210 4.793 4.167 5.052 . 0 0 "[ . 1 . 2]" 1 1109 1 54 LYS HA 1 71 THR HA . . 3.770 2.759 2.552 2.904 . 0 0 "[ . 1 . 2]" 1 1110 1 54 LYS HA 1 71 THR HB . . 5.500 4.936 4.555 5.149 . 0 0 "[ . 1 . 2]" 1 1111 1 54 LYS HA 1 71 THR MG . . 4.460 2.943 2.453 3.185 . 0 0 "[ . 1 . 2]" 1 1112 1 54 LYS HB2 1 55 PHE H . . 4.400 3.903 3.720 4.069 . 0 0 "[ . 1 . 2]" 1 1113 1 54 LYS HB2 1 55 PHE HA . . 5.160 4.876 4.648 5.007 . 0 0 "[ . 1 . 2]" 1 1114 1 54 LYS HB2 1 69 TRP HE3 . . 4.130 3.688 3.457 3.863 . 0 0 "[ . 1 . 2]" 1 1115 1 54 LYS HB2 1 69 TRP HZ3 . . 4.920 4.656 4.176 4.922 0.002 20 0 "[ . 1 . 2]" 1 1116 1 54 LYS HB3 1 54 LYS HE2 . . 5.080 4.206 3.806 4.635 . 0 0 "[ . 1 . 2]" 1 1117 1 54 LYS HB3 1 54 LYS HE3 . . 5.080 4.445 3.828 4.832 . 0 0 "[ . 1 . 2]" 1 1118 1 54 LYS HB3 1 55 PHE H . . 3.970 2.608 2.503 2.826 . 0 0 "[ . 1 . 2]" 1 1119 1 54 LYS HB3 1 55 PHE HA . . 5.260 4.207 4.124 4.348 . 0 0 "[ . 1 . 2]" 1 1120 1 54 LYS HB3 1 69 TRP HB2 . . 5.500 4.413 4.282 4.659 . 0 0 "[ . 1 . 2]" 1 1121 1 54 LYS HB3 1 69 TRP QB . . 4.650 2.794 2.716 2.961 . 0 0 "[ . 1 . 2]" 1 1122 1 54 LYS HB3 1 69 TRP HB3 . . 5.500 2.825 2.747 2.995 . 0 0 "[ . 1 . 2]" 1 1123 1 54 LYS HB3 1 69 TRP HE3 . . 3.680 2.678 2.151 2.952 . 0 0 "[ . 1 . 2]" 1 1124 1 54 LYS HB3 1 69 TRP HZ3 . . 4.960 4.465 3.647 4.869 . 0 0 "[ . 1 . 2]" 1 1125 1 54 LYS HB3 1 71 THR HA . . 5.130 4.682 4.320 4.990 . 0 0 "[ . 1 . 2]" 1 1126 1 54 LYS QD 1 54 LYS HG2 . . 2.620 2.430 2.339 2.479 . 0 0 "[ . 1 . 2]" 1 1127 1 54 LYS QD 1 54 LYS HG3 . . 2.400 2.265 2.213 2.358 . 0 0 "[ . 1 . 2]" 1 1128 1 54 LYS QD 1 69 TRP HA . . 5.500 5.029 4.463 5.447 . 0 0 "[ . 1 . 2]" 1 1129 1 54 LYS QD 1 69 TRP HB2 . . 5.010 3.494 2.993 3.950 . 0 0 "[ . 1 . 2]" 1 1130 1 54 LYS QD 1 69 TRP QB . . 4.330 2.658 2.161 3.035 . 0 0 "[ . 1 . 2]" 1 1131 1 54 LYS QD 1 69 TRP HB3 . . 5.010 2.761 2.198 3.171 . 0 0 "[ . 1 . 2]" 1 1132 1 54 LYS QD 1 69 TRP HE3 . . 4.530 3.853 3.330 4.150 . 0 0 "[ . 1 . 2]" 1 1133 1 54 LYS QE 1 54 LYS HG2 . . 3.560 2.251 2.082 2.516 . 0 0 "[ . 1 . 2]" 1 1134 1 54 LYS QE 1 71 THR HA . . 5.340 4.786 4.169 5.205 . 0 0 "[ . 1 . 2]" 1 1135 1 54 LYS QE 1 71 THR MG . . 3.640 2.530 2.123 2.800 . 0 0 "[ . 1 . 2]" 1 1136 1 54 LYS HE2 1 71 THR MG . . 4.290 3.071 2.322 4.162 . 0 0 "[ . 1 . 2]" 1 1137 1 54 LYS HE3 1 71 THR MG . . 4.290 3.157 2.136 4.163 . 0 0 "[ . 1 . 2]" 1 1138 1 54 LYS HG2 1 55 PHE H . . 4.610 3.686 3.437 4.016 . 0 0 "[ . 1 . 2]" 1 1139 1 54 LYS HG2 1 71 THR H . . 5.500 4.891 4.527 5.214 . 0 0 "[ . 1 . 2]" 1 1140 1 54 LYS HG2 1 71 THR HA . . 4.220 3.411 3.101 3.642 . 0 0 "[ . 1 . 2]" 1 1141 1 55 PHE H 1 55 PHE HB2 . . 3.480 2.803 2.736 2.825 . 0 0 "[ . 1 . 2]" 1 1142 1 55 PHE H 1 55 PHE QD . . 3.890 2.744 2.642 2.771 . 0 0 "[ . 1 . 2]" 1 1143 1 55 PHE H 1 57 VAL MG2 . . 5.500 5.483 5.392 5.506 0.006 12 0 "[ . 1 . 2]" 1 1144 1 55 PHE H 1 69 TRP HA . . 4.340 4.135 4.096 4.235 . 0 0 "[ . 1 . 2]" 1 1145 1 55 PHE H 1 69 TRP HE3 . . 4.210 3.468 2.692 3.725 . 0 0 "[ . 1 . 2]" 1 1146 1 55 PHE H 1 70 ILE H . . 3.920 3.248 2.632 3.525 . 0 0 "[ . 1 . 2]" 1 1147 1 55 PHE H 1 71 THR MG . . 4.610 4.243 3.959 4.486 . 0 0 "[ . 1 . 2]" 1 1148 1 55 PHE H 1 75 ILE MD . . 5.500 4.750 4.597 4.902 . 0 0 "[ . 1 . 2]" 1 1149 1 55 PHE HA 1 55 PHE QD . . 4.180 3.107 3.099 3.121 . 0 0 "[ . 1 . 2]" 1 1150 1 55 PHE HA 1 55 PHE QE . . 5.420 4.738 4.711 4.749 . 0 0 "[ . 1 . 2]" 1 1151 1 55 PHE HA 1 56 TYR H . . 2.600 2.275 2.253 2.293 . 0 0 "[ . 1 . 2]" 1 1152 1 55 PHE HA 1 56 TYR QB . . 4.920 3.980 3.973 3.985 . 0 0 "[ . 1 . 2]" 1 1153 1 55 PHE HA 1 57 VAL MG1 . . 5.290 5.204 5.091 5.253 . 0 0 "[ . 1 . 2]" 1 1154 1 55 PHE HA 1 69 TRP HE3 . . 4.760 3.423 3.050 3.656 . 0 0 "[ . 1 . 2]" 1 1155 1 55 PHE HA 1 69 TRP HZ3 . . 4.250 3.504 2.343 3.958 . 0 0 "[ . 1 . 2]" 1 1156 1 55 PHE HB2 1 56 TYR H . . 3.960 3.835 3.796 3.892 . 0 0 "[ . 1 . 2]" 1 1157 1 55 PHE HB2 1 57 VAL MG1 . . 3.940 3.475 3.391 3.571 . 0 0 "[ . 1 . 2]" 1 1158 1 55 PHE HB2 1 70 ILE H . . 4.430 4.021 3.825 4.146 . 0 0 "[ . 1 . 2]" 1 1159 1 55 PHE HB2 1 70 ILE MD . . 4.320 3.692 3.532 3.797 . 0 0 "[ . 1 . 2]" 1 1160 1 55 PHE HB2 1 70 ILE HG13 . . 3.990 2.903 2.752 2.947 . 0 0 "[ . 1 . 2]" 1 1161 1 55 PHE HB3 1 57 VAL MG1 . . 3.800 3.703 3.599 3.795 . 0 0 "[ . 1 . 2]" 1 1162 1 55 PHE HB3 1 70 ILE HG13 . . 4.490 4.446 4.189 4.494 0.004 17 0 "[ . 1 . 2]" 1 1163 1 55 PHE HB3 1 75 ILE MD . . 4.520 4.342 4.093 4.469 . 0 0 "[ . 1 . 2]" 1 1164 1 55 PHE QD 1 56 TYR H . . 4.600 4.063 4.011 4.098 . 0 0 "[ . 1 . 2]" 1 1165 1 55 PHE QD 1 70 ILE MD . . 4.870 4.781 4.623 4.867 . 0 0 "[ . 1 . 2]" 1 1166 1 55 PHE QD 1 70 ILE HG12 . . 5.500 5.347 5.062 5.494 . 0 0 "[ . 1 . 2]" 1 1167 1 55 PHE QD 1 70 ILE HG13 . . 5.480 4.031 3.820 4.178 . 0 0 "[ . 1 . 2]" 1 1168 1 55 PHE QD 1 72 THR HA . . 4.590 4.487 4.414 4.594 0.004 10 0 "[ . 1 . 2]" 1 1169 1 55 PHE QD 1 72 THR MG . . 5.170 3.751 3.576 3.983 . 0 0 "[ . 1 . 2]" 1 1170 1 55 PHE QD 1 75 ILE MD . . 4.090 2.932 2.782 3.142 . 0 0 "[ . 1 . 2]" 1 1171 1 55 PHE QE 1 72 THR HA . . 4.400 4.385 4.330 4.408 0.008 20 0 "[ . 1 . 2]" 1 1172 1 55 PHE QE 1 72 THR MG . . 4.250 2.561 2.462 2.742 . 0 0 "[ . 1 . 2]" 1 1173 1 55 PHE QE 1 75 ILE MD . . 4.260 3.572 3.406 3.690 . 0 0 "[ . 1 . 2]" 1 1174 1 55 PHE HZ 1 72 THR MG . . 4.320 4.059 3.877 4.174 . 0 0 "[ . 1 . 2]" 1 1175 1 56 TYR H 1 56 TYR HB2 . . 3.730 2.547 2.506 2.579 . 0 0 "[ . 1 . 2]" 1 1176 1 56 TYR H 1 56 TYR QB . . 3.270 2.366 2.354 2.375 . 0 0 "[ . 1 . 2]" 1 1177 1 56 TYR H 1 56 TYR HB3 . . 3.730 2.810 2.777 2.857 . 0 0 "[ . 1 . 2]" 1 1178 1 56 TYR H 1 56 TYR QD . . 4.840 4.196 4.162 4.217 . 0 0 "[ . 1 . 2]" 1 1179 1 56 TYR H 1 69 TRP HZ3 . . 4.660 3.788 3.059 4.098 . 0 0 "[ . 1 . 2]" 1 1180 1 56 TYR HA 1 56 TYR QB . . 2.520 2.467 2.457 2.480 . 0 0 "[ . 1 . 2]" 1 1181 1 56 TYR HA 1 56 TYR QD . . 3.320 2.063 2.006 2.093 . 0 0 "[ . 1 . 2]" 1 1182 1 56 TYR HA 1 57 VAL H . . 2.830 2.140 2.138 2.146 . 0 0 "[ . 1 . 2]" 1 1183 1 56 TYR HA 1 69 TRP HA . . 2.400 2.292 2.240 2.409 0.009 16 0 "[ . 1 . 2]" 1 1184 1 56 TYR HA 1 69 TRP HE3 . . 4.630 3.737 3.482 3.844 . 0 0 "[ . 1 . 2]" 1 1185 1 56 TYR HA 1 70 ILE H . . 4.300 3.374 3.273 3.622 . 0 0 "[ . 1 . 2]" 1 1186 1 56 TYR QB 1 57 VAL H . . 4.440 3.804 3.743 3.848 . 0 0 "[ . 1 . 2]" 1 1187 1 56 TYR QB 1 69 TRP HA . . 4.560 4.087 3.998 4.228 . 0 0 "[ . 1 . 2]" 1 1188 1 56 TYR QB 1 69 TRP HE3 . . 4.770 3.519 3.357 3.867 . 0 0 "[ . 1 . 2]" 1 1189 1 56 TYR QB 1 69 TRP HZ3 . . 5.050 3.199 3.029 3.399 . 0 0 "[ . 1 . 2]" 1 1190 1 56 TYR HB2 1 57 VAL H . . 5.200 4.486 4.445 4.537 . 0 0 "[ . 1 . 2]" 1 1191 1 56 TYR HB2 1 69 TRP HA . . 5.360 4.283 4.175 4.443 . 0 0 "[ . 1 . 2]" 1 1192 1 56 TYR HB2 1 69 TRP HE3 . . 5.430 3.581 3.408 3.959 . 0 0 "[ . 1 . 2]" 1 1193 1 56 TYR HB3 1 57 VAL H . . 5.200 4.110 4.028 4.159 . 0 0 "[ . 1 . 2]" 1 1194 1 56 TYR HB3 1 69 TRP HA . . 5.360 5.167 5.111 5.303 . 0 0 "[ . 1 . 2]" 1 1195 1 56 TYR HB3 1 69 TRP HE3 . . 5.430 5.181 5.040 5.418 . 0 0 "[ . 1 . 2]" 1 1196 1 56 TYR QD 1 57 VAL H . . 4.230 3.452 3.368 3.572 . 0 0 "[ . 1 . 2]" 1 1197 1 56 TYR QD 1 58 HIS HB2 . . 5.500 5.047 4.944 5.222 . 0 0 "[ . 1 . 2]" 1 1198 1 56 TYR QD 1 68 GLU H . . 4.810 4.089 3.976 4.438 . 0 0 "[ . 1 . 2]" 1 1199 1 56 TYR QD 1 68 GLU HA . . 5.180 3.639 3.584 4.130 . 0 0 "[ . 1 . 2]" 1 1200 1 56 TYR QD 1 69 TRP H . . 4.660 3.576 3.503 3.907 . 0 0 "[ . 1 . 2]" 1 1201 1 56 TYR QD 1 69 TRP HA . . 3.840 2.402 2.362 2.548 . 0 0 "[ . 1 . 2]" 1 1202 1 56 TYR QD 1 69 TRP HD1 . . 3.870 3.505 3.384 3.595 . 0 0 "[ . 1 . 2]" 1 1203 1 56 TYR QD 1 69 TRP HE1 . . 4.350 3.751 3.468 3.843 . 0 0 "[ . 1 . 2]" 1 1204 1 56 TYR QE 1 67 ASP HA . . 5.500 5.210 4.758 5.394 . 0 0 "[ . 1 . 2]" 1 1205 1 56 TYR QE 1 67 ASP QB . . 4.220 3.483 2.671 4.242 0.022 11 0 "[ . 1 . 2]" 1 1206 1 56 TYR QE 1 68 GLU HA . . 3.840 2.042 1.991 2.824 . 0 0 "[ . 1 . 2]" 1 1207 1 56 TYR QE 1 68 GLU QB . . 4.890 3.809 3.616 4.545 . 0 0 "[ . 1 . 2]" 1 1208 1 56 TYR QE 1 69 TRP H . . 4.970 3.316 3.192 3.721 . 0 0 "[ . 1 . 2]" 1 1209 1 56 TYR QE 1 69 TRP HD1 . . 4.190 2.755 2.634 2.953 . 0 0 "[ . 1 . 2]" 1 1210 1 56 TYR QE 1 69 TRP HE1 . . 5.040 3.034 2.824 3.436 . 0 0 "[ . 1 . 2]" 1 1211 1 57 VAL H 1 57 VAL MG1 . . 3.830 2.978 2.935 3.063 . 0 0 "[ . 1 . 2]" 1 1212 1 57 VAL H 1 57 VAL MG2 . . 3.410 1.923 1.906 1.997 . 0 0 "[ . 1 . 2]" 1 1213 1 57 VAL H 1 58 HIS HA . . 5.480 5.026 4.929 5.095 . 0 0 "[ . 1 . 2]" 1 1214 1 57 VAL H 1 68 GLU H . . 3.690 3.102 3.029 3.415 . 0 0 "[ . 1 . 2]" 1 1215 1 57 VAL H 1 68 GLU HA . . 5.500 4.856 4.793 4.916 . 0 0 "[ . 1 . 2]" 1 1216 1 57 VAL H 1 69 TRP HA . . 3.880 3.301 3.088 3.390 . 0 0 "[ . 1 . 2]" 1 1217 1 57 VAL H 1 70 ILE MG . . 4.890 3.787 3.668 4.085 . 0 0 "[ . 1 . 2]" 1 1218 1 57 VAL HA 1 57 VAL HB . . 2.550 2.522 2.498 2.538 . 0 0 "[ . 1 . 2]" 1 1219 1 57 VAL HA 1 57 VAL MG1 . . 2.400 2.184 2.145 2.256 . 0 0 "[ . 1 . 2]" 1 1220 1 57 VAL HA 1 58 HIS H . . 2.610 2.317 2.281 2.339 . 0 0 "[ . 1 . 2]" 1 1221 1 57 VAL HA 1 70 ILE HG12 . . 5.090 4.821 4.750 4.968 . 0 0 "[ . 1 . 2]" 1 1222 1 57 VAL HB 1 58 HIS H . . 3.520 2.599 2.538 2.702 . 0 0 "[ . 1 . 2]" 1 1223 1 57 VAL HB 1 68 GLU QG . . 5.500 5.181 4.482 5.508 0.008 11 0 "[ . 1 . 2]" 1 1224 1 57 VAL MG1 1 58 HIS H . . 3.810 3.574 3.506 3.626 . 0 0 "[ . 1 . 2]" 1 1225 1 57 VAL MG1 1 70 ILE HB . . 4.640 4.435 4.347 4.587 . 0 0 "[ . 1 . 2]" 1 1226 1 57 VAL MG1 1 70 ILE MD . . 3.320 1.843 1.800 1.950 . 0 0 "[ . 1 . 2]" 1 1227 1 57 VAL MG1 1 70 ILE HG12 . . 4.080 2.124 1.999 2.313 . 0 0 "[ . 1 . 2]" 1 1228 1 57 VAL MG1 1 70 ILE HG13 . . 3.820 2.987 2.872 3.212 . 0 0 "[ . 1 . 2]" 1 1229 1 57 VAL MG1 1 70 ILE MG . . 3.750 3.385 3.322 3.548 . 0 0 "[ . 1 . 2]" 1 1230 1 57 VAL MG2 1 58 HIS H . . 4.250 3.725 3.636 3.781 . 0 0 "[ . 1 . 2]" 1 1231 1 57 VAL MG2 1 58 HIS HA . . 5.140 3.911 3.822 3.974 . 0 0 "[ . 1 . 2]" 1 1232 1 57 VAL MG2 1 59 TYR QD . . 5.060 4.538 4.299 4.708 . 0 0 "[ . 1 . 2]" 1 1233 1 57 VAL MG2 1 59 TYR QE . . 4.220 3.821 3.613 4.141 . 0 0 "[ . 1 . 2]" 1 1234 1 57 VAL MG2 1 67 ASP HA . . 5.180 3.750 3.604 4.121 . 0 0 "[ . 1 . 2]" 1 1235 1 57 VAL MG2 1 68 GLU H . . 3.710 2.975 2.887 3.062 . 0 0 "[ . 1 . 2]" 1 1236 1 57 VAL MG2 1 68 GLU QB . . 4.710 4.364 3.934 4.608 . 0 0 "[ . 1 . 2]" 1 1237 1 57 VAL MG2 1 68 GLU QG . . 4.330 2.768 2.214 3.050 . 0 0 "[ . 1 . 2]" 1 1238 1 57 VAL MG2 1 70 ILE H . . 5.170 3.029 2.780 3.635 . 0 0 "[ . 1 . 2]" 1 1239 1 57 VAL MG2 1 70 ILE MD . . 3.890 1.968 1.918 2.085 . 0 0 "[ . 1 . 2]" 1 1240 1 57 VAL MG2 1 70 ILE HG12 . . 4.870 1.927 1.903 2.114 . 0 0 "[ . 1 . 2]" 1 1241 1 57 VAL MG2 1 70 ILE HG13 . . 4.460 3.418 3.363 3.631 . 0 0 "[ . 1 . 2]" 1 1242 1 57 VAL MG2 1 70 ILE MG . . 2.400 1.921 1.852 2.118 . 0 0 "[ . 1 . 2]" 1 1243 1 58 HIS H 1 58 HIS HB2 . . 4.190 3.462 3.407 3.496 . 0 0 "[ . 1 . 2]" 1 1244 1 58 HIS H 1 58 HIS HB3 . . 3.820 2.640 2.540 2.679 . 0 0 "[ . 1 . 2]" 1 1245 1 58 HIS H 1 59 TYR H . . 4.360 4.179 4.018 4.299 . 0 0 "[ . 1 . 2]" 1 1246 1 58 HIS HA 1 58 HIS HB2 . . 2.710 2.334 2.322 2.344 . 0 0 "[ . 1 . 2]" 1 1247 1 58 HIS HA 1 59 TYR H . . 3.030 2.146 2.139 2.152 . 0 0 "[ . 1 . 2]" 1 1248 1 58 HIS HA 1 66 LEU H . . 5.500 5.529 5.452 5.571 0.071 11 0 "[ . 1 . 2]" 1 1249 1 58 HIS HA 1 67 ASP H . . 4.200 3.850 3.773 4.240 0.040 16 0 "[ . 1 . 2]" 1 1250 1 58 HIS HA 1 67 ASP HA . . 4.380 2.172 2.097 2.279 . 0 0 "[ . 1 . 2]" 1 1251 1 58 HIS HB2 1 59 TYR H . . 4.460 4.113 4.025 4.245 . 0 0 "[ . 1 . 2]" 1 1252 1 58 HIS HB3 1 58 HIS HD2 . . 3.860 2.720 2.705 2.731 . 0 0 "[ . 1 . 2]" 1 1253 1 58 HIS HD2 1 60 VAL HA . . 4.290 4.301 4.294 4.306 0.016 16 0 "[ . 1 . 2]" 1 1254 1 58 HIS HD2 1 60 VAL MG1 . . 5.500 5.089 4.899 5.242 . 0 0 "[ . 1 . 2]" 1 1255 1 58 HIS HD2 1 60 VAL QG . . 4.250 3.745 3.654 3.838 . 0 0 "[ . 1 . 2]" 1 1256 1 58 HIS HD2 1 60 VAL MG2 . . 5.500 3.857 3.734 3.991 . 0 0 "[ . 1 . 2]" 1 1257 1 59 TYR H 1 59 TYR QD . . 4.360 2.246 1.941 2.756 . 0 0 "[ . 1 . 2]" 1 1258 1 59 TYR H 1 59 TYR QE . . 5.110 4.168 3.972 4.552 . 0 0 "[ . 1 . 2]" 1 1259 1 59 TYR H 1 62 TYR QB . . 4.860 4.235 4.048 4.377 . 0 0 "[ . 1 . 2]" 1 1260 1 59 TYR HA 1 59 TYR QD . . 3.510 2.911 2.571 3.073 . 0 0 "[ . 1 . 2]" 1 1261 1 59 TYR HA 1 59 TYR QE . . 5.040 4.660 4.472 4.744 . 0 0 "[ . 1 . 2]" 1 1262 1 59 TYR HA 1 60 VAL QG . . 4.800 3.707 3.591 3.809 . 0 0 "[ . 1 . 2]" 1 1263 1 59 TYR QB 1 62 TYR HA . . 5.220 4.456 4.287 4.685 . 0 0 "[ . 1 . 2]" 1 1264 1 59 TYR QB 1 62 TYR QD . . 3.520 2.096 1.912 2.601 . 0 0 "[ . 1 . 2]" 1 1265 1 59 TYR QD 1 62 TYR H . . 5.500 4.712 4.506 4.881 . 0 0 "[ . 1 . 2]" 1 1266 1 59 TYR QD 1 66 LEU HB2 . . 4.000 3.433 2.934 3.737 . 0 0 "[ . 1 . 2]" 1 1267 1 59 TYR QD 1 66 LEU HB3 . . 4.000 2.004 1.994 2.078 . 0 0 "[ . 1 . 2]" 1 1268 1 59 TYR QD 1 66 LEU MD1 . . 5.190 3.541 2.223 4.779 . 0 0 "[ . 1 . 2]" 1 1269 1 59 TYR QD 1 66 LEU QD . . 3.790 3.109 2.217 3.584 . 0 0 "[ . 1 . 2]" 1 1270 1 59 TYR QD 1 66 LEU MD2 . . 5.190 4.249 2.376 4.765 . 0 0 "[ . 1 . 2]" 1 1271 1 59 TYR QD 1 67 ASP HA . . 5.390 3.229 2.886 3.816 . 0 0 "[ . 1 . 2]" 1 1272 1 59 TYR QE 1 66 LEU HA . . 5.500 4.927 4.598 5.308 . 0 0 "[ . 1 . 2]" 1 1273 1 59 TYR QE 1 66 LEU QB . . 4.040 3.600 3.024 4.037 . 0 0 "[ . 1 . 2]" 1 1274 1 59 TYR QE 1 66 LEU QD . . 3.990 3.481 2.258 3.891 . 0 0 "[ . 1 . 2]" 1 1275 1 59 TYR QE 1 67 ASP HA . . 5.500 3.893 3.271 4.753 . 0 0 "[ . 1 . 2]" 1 1276 1 59 TYR QE 1 68 GLU QB . . 5.500 4.526 3.185 5.452 . 0 0 "[ . 1 . 2]" 1 1277 1 59 TYR QE 1 68 GLU QG . . 3.710 2.907 2.536 3.715 0.005 11 0 "[ . 1 . 2]" 1 1278 1 59 TYR QE 1 70 ILE MD . . 5.500 5.448 5.300 5.505 0.005 13 0 "[ . 1 . 2]" 1 1279 1 59 TYR QE 1 70 ILE MG . . 4.980 4.445 4.221 4.699 . 0 0 "[ . 1 . 2]" 1 1280 1 60 VAL HA 1 60 VAL MG1 . . 2.550 2.294 2.202 2.385 . 0 0 "[ . 1 . 2]" 1 1281 1 60 VAL HA 1 60 VAL QG . . 2.200 2.064 2.035 2.117 . 0 0 "[ . 1 . 2]" 1 1282 1 60 VAL HA 1 60 VAL MG2 . . 2.550 2.346 2.274 2.441 . 0 0 "[ . 1 . 2]" 1 1283 1 60 VAL HA 1 62 TYR H . . 4.640 3.889 3.773 3.976 . 0 0 "[ . 1 . 2]" 1 1284 1 60 VAL HB 1 61 ASN H . . 5.130 2.777 2.432 2.935 . 0 0 "[ . 1 . 2]" 1 1285 1 60 VAL QG 1 61 ASN H . . 3.850 3.335 3.171 3.425 . 0 0 "[ . 1 . 2]" 1 1286 1 60 VAL QG 1 61 ASN QD . . 4.230 3.897 3.173 4.234 0.004 4 0 "[ . 1 . 2]" 1 1287 1 60 VAL QG 1 62 TYR H . . 5.440 4.384 4.269 4.454 . 0 0 "[ . 1 . 2]" 1 1288 1 61 ASN H 1 61 ASN QD . . 5.340 3.014 1.931 3.960 . 0 0 "[ . 1 . 2]" 1 1289 1 61 ASN H 1 62 TYR H . . 4.010 2.543 2.448 2.660 . 0 0 "[ . 1 . 2]" 1 1290 1 61 ASN H 1 62 TYR HA . . 5.500 5.203 5.127 5.293 . 0 0 "[ . 1 . 2]" 1 1291 1 62 TYR H 1 62 TYR QD . . 4.450 3.178 2.356 3.727 . 0 0 "[ . 1 . 2]" 1 1292 1 62 TYR H 1 62 TYR QE . . 5.500 4.999 4.560 5.512 0.012 11 0 "[ . 1 . 2]" 1 1293 1 62 TYR HA 1 62 TYR QD . . 4.000 2.540 2.045 3.143 . 0 0 "[ . 1 . 2]" 1 1294 1 62 TYR HA 1 63 ASN H . . 3.410 2.652 2.606 2.690 . 0 0 "[ . 1 . 2]" 1 1295 1 62 TYR HA 1 63 ASN QB . . 5.200 4.674 4.493 4.948 . 0 0 "[ . 1 . 2]" 1 1296 1 62 TYR HA 1 63 ASN QD . . 4.890 3.780 3.105 4.657 . 0 0 "[ . 1 . 2]" 1 1297 1 62 TYR HA 1 66 LEU QD . . 4.750 4.148 3.867 4.647 . 0 0 "[ . 1 . 2]" 1 1298 1 62 TYR QB 1 63 ASN H . . 3.540 1.935 1.925 2.015 . 0 0 "[ . 1 . 2]" 1 1299 1 62 TYR QB 1 63 ASN QD . . 4.550 3.944 3.460 4.553 0.003 11 0 "[ . 1 . 2]" 1 1300 1 62 TYR QB 1 66 LEU H . . 5.500 4.190 4.080 4.332 . 0 0 "[ . 1 . 2]" 1 1301 1 62 TYR QB 1 66 LEU MD1 . . 4.760 3.228 1.816 3.534 . 0 0 "[ . 1 . 2]" 1 1302 1 62 TYR QB 1 66 LEU QD . . 3.500 2.210 1.813 2.751 . 0 0 "[ . 1 . 2]" 1 1303 1 62 TYR QB 1 66 LEU MD2 . . 4.760 2.366 1.907 4.084 . 0 0 "[ . 1 . 2]" 1 1304 1 62 TYR QD 1 63 ASN H . . 4.940 3.540 2.968 3.860 . 0 0 "[ . 1 . 2]" 1 1305 1 62 TYR QD 1 66 LEU MD1 . . 4.960 3.597 2.397 3.920 . 0 0 "[ . 1 . 2]" 1 1306 1 62 TYR QD 1 66 LEU QD . . 3.610 2.864 2.198 3.369 . 0 0 "[ . 1 . 2]" 1 1307 1 62 TYR QD 1 66 LEU MD2 . . 4.960 3.177 2.221 4.045 . 0 0 "[ . 1 . 2]" 1 1308 1 62 TYR QE 1 66 LEU QD . . 5.440 3.749 3.206 4.176 . 0 0 "[ . 1 . 2]" 1 1309 1 63 ASN H 1 63 ASN QB . . 3.530 2.331 2.180 2.674 . 0 0 "[ . 1 . 2]" 1 1310 1 63 ASN H 1 66 LEU QD . . 4.590 2.808 2.233 3.610 . 0 0 "[ . 1 . 2]" 1 1311 1 63 ASN HA 1 63 ASN QB . . 2.510 2.415 2.262 2.489 . 0 0 "[ . 1 . 2]" 1 1312 1 63 ASN HA 1 63 ASN QD . . 4.250 3.215 2.026 3.863 . 0 0 "[ . 1 . 2]" 1 1313 1 63 ASN QB 1 66 LEU H . . 5.340 3.785 3.682 3.898 . 0 0 "[ . 1 . 2]" 1 1314 1 63 ASN QB 1 66 LEU QD . . 4.180 3.121 2.550 4.187 0.007 11 0 "[ . 1 . 2]" 1 1315 1 63 ASN HB2 1 65 ARG H . . 4.750 2.846 2.296 3.149 . 0 0 "[ . 1 . 2]" 1 1316 1 63 ASN HB2 1 65 ARG QG . . 4.100 2.130 1.896 2.416 . 0 0 "[ . 1 . 2]" 1 1317 1 63 ASN HB3 1 65 ARG H . . 4.750 2.509 2.224 3.072 . 0 0 "[ . 1 . 2]" 1 1318 1 63 ASN HB3 1 65 ARG QG . . 4.100 2.837 2.177 3.626 . 0 0 "[ . 1 . 2]" 1 1319 1 63 ASN QD 1 65 ARG QG . . 4.860 3.954 3.074 4.850 . 0 0 "[ . 1 . 2]" 1 1320 1 64 LYS H 1 64 LYS QB . . 3.680 2.404 2.224 2.627 . 0 0 "[ . 1 . 2]" 1 1321 1 64 LYS H 1 64 LYS HG2 . . 5.210 3.446 2.199 4.618 . 0 0 "[ . 1 . 2]" 1 1322 1 64 LYS H 1 64 LYS QG . . 4.440 2.890 2.073 4.054 . 0 0 "[ . 1 . 2]" 1 1323 1 64 LYS H 1 64 LYS HG3 . . 5.210 3.392 2.139 4.531 . 0 0 "[ . 1 . 2]" 1 1324 1 64 LYS H 1 65 ARG H . . 4.420 2.582 2.539 2.627 . 0 0 "[ . 1 . 2]" 1 1325 1 64 LYS HA 1 64 LYS QB . . 2.420 2.322 2.179 2.424 0.004 10 0 "[ . 1 . 2]" 1 1326 1 64 LYS HA 1 64 LYS QD . . 4.030 3.653 2.083 4.031 0.001 6 0 "[ . 1 . 2]" 1 1327 1 64 LYS QB 1 64 LYS QD . . 3.280 2.096 1.962 2.451 . 0 0 "[ . 1 . 2]" 1 1328 1 64 LYS QB 1 64 LYS QE . . 4.400 3.161 2.035 3.657 . 0 0 "[ . 1 . 2]" 1 1329 1 64 LYS HB2 1 64 LYS QD . . 3.920 2.665 2.103 3.262 . 0 0 "[ . 1 . 2]" 1 1330 1 64 LYS HB3 1 64 LYS QD . . 3.920 2.494 1.983 3.415 . 0 0 "[ . 1 . 2]" 1 1331 1 64 LYS QE 1 64 LYS HG2 . . 3.370 2.648 2.100 3.370 . 0 0 "[ . 1 . 2]" 1 1332 1 64 LYS QE 1 64 LYS QG . . 2.940 2.168 2.052 2.386 . 0 0 "[ . 1 . 2]" 1 1333 1 64 LYS QE 1 64 LYS HG3 . . 3.370 2.546 2.126 3.368 . 0 0 "[ . 1 . 2]" 1 1334 1 65 ARG H 1 65 ARG QG . . 2.400 2.118 1.960 2.258 . 0 0 "[ . 1 . 2]" 1 1335 1 65 ARG H 1 66 LEU H . . 3.710 2.536 2.519 2.644 . 0 0 "[ . 1 . 2]" 1 1336 1 65 ARG HA 1 65 ARG QB . . 2.420 2.180 2.177 2.181 . 0 0 "[ . 1 . 2]" 1 1337 1 65 ARG HA 1 65 ARG QD . . 4.730 4.303 3.852 4.518 . 0 0 "[ . 1 . 2]" 1 1338 1 65 ARG HA 1 65 ARG QG . . 3.500 3.346 3.332 3.403 . 0 0 "[ . 1 . 2]" 1 1339 1 65 ARG QB 1 65 ARG QD . . 3.210 2.207 2.045 2.409 . 0 0 "[ . 1 . 2]" 1 1340 1 65 ARG QB 1 67 ASP H . . 5.340 5.161 4.849 5.234 . 0 0 "[ . 1 . 2]" 1 1341 1 65 ARG QG 1 66 LEU H . . 3.070 2.919 2.601 3.080 0.010 16 0 "[ . 1 . 2]" 1 1342 1 65 ARG QG 1 66 LEU HA . . 4.130 3.773 3.606 4.048 . 0 0 "[ . 1 . 2]" 1 1343 1 65 ARG QG 1 66 LEU QD . . 3.760 2.334 1.940 3.377 . 0 0 "[ . 1 . 2]" 1 1344 1 66 LEU H 1 66 LEU QB . . 3.360 2.209 2.184 2.306 . 0 0 "[ . 1 . 2]" 1 1345 1 66 LEU H 1 66 LEU MD1 . . 4.350 4.007 3.205 4.317 . 0 0 "[ . 1 . 2]" 1 1346 1 66 LEU H 1 66 LEU QD . . 3.800 2.981 2.550 3.639 . 0 0 "[ . 1 . 2]" 1 1347 1 66 LEU H 1 66 LEU MD2 . . 4.350 3.278 2.575 4.392 0.042 19 0 "[ . 1 . 2]" 1 1348 1 66 LEU H 1 67 ASP H . . 2.400 2.121 2.069 2.255 . 0 0 "[ . 1 . 2]" 1 1349 1 66 LEU H 1 67 ASP QB . . 4.710 4.144 3.912 4.545 . 0 0 "[ . 1 . 2]" 1 1350 1 66 LEU HA 1 66 LEU QD . . 2.390 2.080 1.908 2.392 0.002 19 0 "[ . 1 . 2]" 1 1351 1 66 LEU HA 1 66 LEU HG . . 3.720 3.340 2.358 3.671 . 0 0 "[ . 1 . 2]" 1 1352 1 66 LEU QB 1 66 LEU HG . . 2.440 2.236 2.167 2.474 0.034 11 0 "[ . 1 . 2]" 1 1353 1 66 LEU QB 1 67 ASP H . . 3.570 3.013 2.936 3.352 . 0 0 "[ . 1 . 2]" 1 1354 1 66 LEU HB2 1 67 ASP H . . 4.130 3.331 3.134 3.736 . 0 0 "[ . 1 . 2]" 1 1355 1 66 LEU HB3 1 67 ASP H . . 4.130 3.489 3.110 3.899 . 0 0 "[ . 1 . 2]" 1 1356 1 67 ASP H 1 67 ASP QB . . 3.600 2.379 2.254 2.557 . 0 0 "[ . 1 . 2]" 1 1357 1 67 ASP HA 1 68 GLU H . . 2.690 2.356 2.147 2.405 . 0 0 "[ . 1 . 2]" 1 1358 1 67 ASP QB 1 68 GLU H . . 4.040 2.588 2.427 3.766 . 0 0 "[ . 1 . 2]" 1 1359 1 68 GLU H 1 68 GLU QB . . 3.520 3.324 3.172 3.388 . 0 0 "[ . 1 . 2]" 1 1360 1 68 GLU H 1 68 GLU QG . . 4.050 2.694 2.539 2.818 . 0 0 "[ . 1 . 2]" 1 1361 1 68 GLU HA 1 68 GLU QB . . 2.400 2.179 2.175 2.180 . 0 0 "[ . 1 . 2]" 1 1362 1 68 GLU HA 1 69 TRP H . . 2.690 2.610 2.400 2.725 0.035 11 0 "[ . 1 . 2]" 1 1363 1 68 GLU QB 1 69 TRP H . . 2.950 2.033 1.934 2.450 . 0 0 "[ . 1 . 2]" 1 1364 1 68 GLU QB 1 70 ILE MG . . 4.470 3.987 3.618 4.328 . 0 0 "[ . 1 . 2]" 1 1365 1 68 GLU QG 1 69 TRP H . . 4.690 3.214 2.669 3.413 . 0 0 "[ . 1 . 2]" 1 1366 1 68 GLU QG 1 70 ILE MG . . 4.090 2.374 2.004 2.657 . 0 0 "[ . 1 . 2]" 1 1367 1 69 TRP H 1 69 TRP QB . . 3.530 2.462 2.307 2.516 . 0 0 "[ . 1 . 2]" 1 1368 1 69 TRP H 1 69 TRP HD1 . . 3.760 2.609 2.393 3.229 . 0 0 "[ . 1 . 2]" 1 1369 1 69 TRP H 1 70 ILE H . . 4.670 4.326 4.209 4.548 . 0 0 "[ . 1 . 2]" 1 1370 1 69 TRP HA 1 69 TRP HD1 . . 4.500 4.085 4.039 4.171 . 0 0 "[ . 1 . 2]" 1 1371 1 69 TRP HA 1 69 TRP HE3 . . 3.780 3.327 3.016 3.460 . 0 0 "[ . 1 . 2]" 1 1372 1 69 TRP HA 1 70 ILE H . . 2.960 2.164 2.141 2.241 . 0 0 "[ . 1 . 2]" 1 1373 1 69 TRP HA 1 70 ILE MG . . 5.040 3.833 3.542 3.965 . 0 0 "[ . 1 . 2]" 1 1374 1 69 TRP QB 1 69 TRP HE1 . . 4.620 4.451 4.423 4.463 . 0 0 "[ . 1 . 2]" 1 1375 1 69 TRP QB 1 69 TRP HE3 . . 3.680 2.498 2.455 2.624 . 0 0 "[ . 1 . 2]" 1 1376 1 69 TRP QB 1 70 ILE H . . 4.200 3.384 2.812 3.617 . 0 0 "[ . 1 . 2]" 1 1377 1 69 TRP HE3 1 70 ILE H . . 4.730 4.389 3.557 4.722 . 0 0 "[ . 1 . 2]" 1 1378 1 70 ILE H 1 70 ILE MD . . 4.390 3.849 3.774 4.059 . 0 0 "[ . 1 . 2]" 1 1379 1 70 ILE H 1 70 ILE HG12 . . 4.100 2.268 2.137 2.635 . 0 0 "[ . 1 . 2]" 1 1380 1 70 ILE H 1 70 ILE HG13 . . 3.680 2.739 2.628 2.899 . 0 0 "[ . 1 . 2]" 1 1381 1 70 ILE H 1 70 ILE MG . . 4.260 2.744 2.576 3.046 . 0 0 "[ . 1 . 2]" 1 1382 1 70 ILE H 1 71 THR H . . 5.260 4.517 4.417 4.557 . 0 0 "[ . 1 . 2]" 1 1383 1 70 ILE H 1 74 ARG HB2 . . 5.500 5.454 5.377 5.526 0.026 11 0 "[ . 1 . 2]" 1 1384 1 70 ILE H 1 74 ARG HD2 . . 5.500 5.275 5.106 5.491 . 0 0 "[ . 1 . 2]" 1 1385 1 70 ILE HA 1 70 ILE HB . . 2.550 2.461 2.456 2.470 . 0 0 "[ . 1 . 2]" 1 1386 1 70 ILE HA 1 70 ILE MD . . 4.410 4.160 4.145 4.168 . 0 0 "[ . 1 . 2]" 1 1387 1 70 ILE HA 1 70 ILE MG . . 2.400 2.333 2.229 2.398 . 0 0 "[ . 1 . 2]" 1 1388 1 70 ILE HA 1 71 THR H . . 2.600 2.353 2.282 2.422 . 0 0 "[ . 1 . 2]" 1 1389 1 70 ILE HA 1 71 THR MG . . 4.840 4.111 3.997 4.396 . 0 0 "[ . 1 . 2]" 1 1390 1 70 ILE HA 1 74 ARG HD2 . . 4.770 2.481 2.296 2.625 . 0 0 "[ . 1 . 2]" 1 1391 1 70 ILE HB 1 70 ILE MD . . 2.400 2.299 2.201 2.361 . 0 0 "[ . 1 . 2]" 1 1392 1 70 ILE HB 1 71 THR H . . 2.900 2.501 2.335 2.687 . 0 0 "[ . 1 . 2]" 1 1393 1 70 ILE HB 1 71 THR HA . . 5.460 4.611 4.554 4.668 . 0 0 "[ . 1 . 2]" 1 1394 1 70 ILE HB 1 74 ARG HB2 . . 2.710 2.003 1.981 2.054 . 0 0 "[ . 1 . 2]" 1 1395 1 70 ILE HB 1 74 ARG HB3 . . 4.050 2.366 2.262 2.452 . 0 0 "[ . 1 . 2]" 1 1396 1 70 ILE HB 1 74 ARG HD2 . . 4.010 2.830 2.610 3.084 . 0 0 "[ . 1 . 2]" 1 1397 1 70 ILE HB 1 74 ARG HD3 . . 3.840 3.582 3.280 3.829 . 0 0 "[ . 1 . 2]" 1 1398 1 70 ILE MD 1 70 ILE MG . . 3.100 2.139 1.967 2.328 . 0 0 "[ . 1 . 2]" 1 1399 1 70 ILE MD 1 74 ARG HA . . 5.310 4.645 4.528 4.741 . 0 0 "[ . 1 . 2]" 1 1400 1 70 ILE MD 1 74 ARG HB2 . . 4.420 3.141 2.930 3.373 . 0 0 "[ . 1 . 2]" 1 1401 1 70 ILE MD 1 74 ARG HB3 . . 4.210 3.209 3.081 3.302 . 0 0 "[ . 1 . 2]" 1 1402 1 70 ILE MD 1 74 ARG HD2 . . 4.970 4.606 4.391 4.853 . 0 0 "[ . 1 . 2]" 1 1403 1 70 ILE MD 1 74 ARG HD3 . . 5.210 4.820 4.605 5.068 . 0 0 "[ . 1 . 2]" 1 1404 1 70 ILE MD 1 74 ARG HG2 . . 5.500 5.371 5.216 5.504 0.004 16 0 "[ . 1 . 2]" 1 1405 1 70 ILE MD 1 74 ARG HG3 . . 5.320 5.130 4.929 5.322 0.002 16 0 "[ . 1 . 2]" 1 1406 1 70 ILE HG12 1 71 THR H . . 5.500 4.851 4.727 4.964 . 0 0 "[ . 1 . 2]" 1 1407 1 70 ILE HG13 1 70 ILE MG . . 3.670 3.184 3.169 3.194 . 0 0 "[ . 1 . 2]" 1 1408 1 70 ILE MG 1 71 THR H . . 3.790 3.681 3.628 3.754 . 0 0 "[ . 1 . 2]" 1 1409 1 70 ILE MG 1 74 ARG H . . 5.500 5.497 5.475 5.510 0.010 5 0 "[ . 1 . 2]" 1 1410 1 70 ILE MG 1 74 ARG HB2 . . 5.500 3.489 3.457 3.520 . 0 0 "[ . 1 . 2]" 1 1411 1 70 ILE MG 1 74 ARG HB3 . . 4.720 2.938 2.788 3.003 . 0 0 "[ . 1 . 2]" 1 1412 1 70 ILE MG 1 74 ARG HD2 . . 4.790 2.674 2.448 2.909 . 0 0 "[ . 1 . 2]" 1 1413 1 70 ILE MG 1 74 ARG HD3 . . 4.940 2.960 2.569 3.308 . 0 0 "[ . 1 . 2]" 1 1414 1 70 ILE MG 1 74 ARG HE . . 4.960 4.697 4.230 4.963 0.003 8 0 "[ . 1 . 2]" 1 1415 1 70 ILE MG 1 74 ARG HG2 . . 5.500 4.672 4.590 4.742 . 0 0 "[ . 1 . 2]" 1 1416 1 70 ILE MG 1 74 ARG HG3 . . 5.010 4.500 4.411 4.561 . 0 0 "[ . 1 . 2]" 1 1417 1 71 THR H 1 71 THR MG . . 4.540 3.188 3.088 3.329 . 0 0 "[ . 1 . 2]" 1 1418 1 71 THR H 1 74 ARG H . . 4.520 3.514 3.426 3.586 . 0 0 "[ . 1 . 2]" 1 1419 1 71 THR H 1 74 ARG HD2 . . 4.070 2.549 2.436 2.622 . 0 0 "[ . 1 . 2]" 1 1420 1 71 THR H 1 75 ILE HG13 . . 4.890 4.628 4.493 4.780 . 0 0 "[ . 1 . 2]" 1 1421 1 71 THR HA 1 71 THR HB . . 2.990 2.665 2.634 2.721 . 0 0 "[ . 1 . 2]" 1 1422 1 71 THR HA 1 71 THR MG . . 2.400 2.187 1.968 2.241 . 0 0 "[ . 1 . 2]" 1 1423 1 71 THR HA 1 72 THR H . . 3.070 2.532 2.518 2.556 . 0 0 "[ . 1 . 2]" 1 1424 1 71 THR HA 1 74 ARG HG3 . . 5.500 4.930 4.878 4.969 . 0 0 "[ . 1 . 2]" 1 1425 1 71 THR HB 1 72 THR H . . 3.500 2.156 2.093 2.221 . 0 0 "[ . 1 . 2]" 1 1426 1 71 THR HB 1 72 THR MG . . 5.040 3.736 3.609 3.974 . 0 0 "[ . 1 . 2]" 1 1427 1 71 THR HB 1 73 ASP H . . 4.040 2.649 2.561 2.731 . 0 0 "[ . 1 . 2]" 1 1428 1 71 THR MG 1 72 THR MG . . 3.910 3.873 3.805 3.912 0.002 16 0 "[ . 1 . 2]" 1 1429 1 72 THR H 1 72 THR HB . . 3.740 3.610 3.604 3.616 . 0 0 "[ . 1 . 2]" 1 1430 1 72 THR H 1 72 THR MG . . 3.880 1.993 1.918 2.123 . 0 0 "[ . 1 . 2]" 1 1431 1 72 THR H 1 73 ASP H . . 3.640 2.798 2.767 2.824 . 0 0 "[ . 1 . 2]" 1 1432 1 72 THR H 1 74 ARG H . . 4.780 3.940 3.912 3.963 . 0 0 "[ . 1 . 2]" 1 1433 1 72 THR H 1 74 ARG HG3 . . 5.500 5.499 5.459 5.510 0.010 11 0 "[ . 1 . 2]" 1 1434 1 72 THR H 1 75 ILE MD . . 5.400 3.698 3.494 3.911 . 0 0 "[ . 1 . 2]" 1 1435 1 72 THR HA 1 72 THR HB . . 2.640 2.417 2.393 2.459 . 0 0 "[ . 1 . 2]" 1 1436 1 72 THR HA 1 72 THR MG . . 2.560 2.381 2.309 2.421 . 0 0 "[ . 1 . 2]" 1 1437 1 72 THR HA 1 74 ARG H . . 5.180 3.705 3.674 3.732 . 0 0 "[ . 1 . 2]" 1 1438 1 72 THR HA 1 75 ILE H . . 4.810 3.663 3.447 3.855 . 0 0 "[ . 1 . 2]" 1 1439 1 72 THR HA 1 75 ILE HB . . 4.760 3.052 2.937 3.131 . 0 0 "[ . 1 . 2]" 1 1440 1 72 THR HA 1 75 ILE MD . . 3.280 1.925 1.900 1.963 . 0 0 "[ . 1 . 2]" 1 1441 1 72 THR HA 1 75 ILE HG12 . . 4.600 4.267 4.159 4.314 . 0 0 "[ . 1 . 2]" 1 1442 1 72 THR HA 1 75 ILE HG13 . . 4.140 3.092 2.887 3.186 . 0 0 "[ . 1 . 2]" 1 1443 1 72 THR HB 1 75 ILE MD . . 4.960 3.606 3.494 3.694 . 0 0 "[ . 1 . 2]" 1 1444 1 72 THR HB 1 75 ILE HG13 . . 5.450 5.367 5.130 5.457 0.007 16 0 "[ . 1 . 2]" 1 1445 1 72 THR MG 1 73 ASP H . . 3.910 3.746 3.674 3.847 . 0 0 "[ . 1 . 2]" 1 1446 1 72 THR MG 1 75 ILE MD . . 4.240 2.960 2.840 3.077 . 0 0 "[ . 1 . 2]" 1 1447 1 72 THR MG 1 75 ILE HG13 . . 5.500 4.829 4.689 4.925 . 0 0 "[ . 1 . 2]" 1 1448 1 73 ASP H 1 73 ASP QB . . 2.850 2.345 2.195 2.660 . 0 0 "[ . 1 . 2]" 1 1449 1 73 ASP H 1 74 ARG H . . 3.640 2.607 2.593 2.629 . 0 0 "[ . 1 . 2]" 1 1450 1 73 ASP H 1 74 ARG HG2 . . 5.500 5.455 5.407 5.502 0.002 15 0 "[ . 1 . 2]" 1 1451 1 73 ASP H 1 74 ARG HG3 . . 5.060 4.465 4.442 4.499 . 0 0 "[ . 1 . 2]" 1 1452 1 73 ASP H 1 75 ILE HB . . 5.500 5.459 5.427 5.508 0.008 11 0 "[ . 1 . 2]" 1 1453 1 73 ASP HA 1 73 ASP QB . . 2.460 2.403 2.278 2.459 . 0 0 "[ . 1 . 2]" 1 1454 1 73 ASP QB 1 74 ARG H . . 4.390 3.143 3.096 3.180 . 0 0 "[ . 1 . 2]" 1 1455 1 74 ARG H 1 74 ARG HB3 . . 3.920 3.639 3.630 3.649 . 0 0 "[ . 1 . 2]" 1 1456 1 74 ARG H 1 74 ARG HD2 . . 5.030 4.788 4.730 4.848 . 0 0 "[ . 1 . 2]" 1 1457 1 74 ARG H 1 74 ARG HG2 . . 3.740 3.601 3.567 3.651 . 0 0 "[ . 1 . 2]" 1 1458 1 74 ARG H 1 74 ARG HG3 . . 3.140 2.952 2.881 3.005 . 0 0 "[ . 1 . 2]" 1 1459 1 74 ARG H 1 75 ILE HG12 . . 5.500 5.166 5.056 5.249 . 0 0 "[ . 1 . 2]" 1 1460 1 74 ARG H 1 75 ILE HG13 . . 4.240 3.434 3.349 3.511 . 0 0 "[ . 1 . 2]" 1 1461 1 74 ARG HA 1 74 ARG HB3 . . 2.890 2.524 2.507 2.538 . 0 0 "[ . 1 . 2]" 1 1462 1 74 ARG HA 1 74 ARG HD2 . . 4.670 4.572 4.480 4.670 . 0 0 "[ . 1 . 2]" 1 1463 1 74 ARG HA 1 74 ARG HD3 . . 4.270 3.922 3.872 3.977 . 0 0 "[ . 1 . 2]" 1 1464 1 74 ARG HA 1 74 ARG HG2 . . 2.710 2.329 2.305 2.360 . 0 0 "[ . 1 . 2]" 1 1465 1 74 ARG HA 1 74 ARG HG3 . . 4.090 3.313 3.280 3.333 . 0 0 "[ . 1 . 2]" 1 1466 1 74 ARG HA 1 75 ILE HG13 . . 5.500 4.806 4.713 4.916 . 0 0 "[ . 1 . 2]" 1 1467 1 74 ARG HB2 1 74 ARG HD2 . . 3.350 2.783 2.672 2.912 . 0 0 "[ . 1 . 2]" 1 1468 1 74 ARG HB2 1 74 ARG HD3 . . 3.520 3.343 3.161 3.489 . 0 0 "[ . 1 . 2]" 1 1469 1 74 ARG HB2 1 74 ARG HG3 . . 2.570 2.293 2.282 2.305 . 0 0 "[ . 1 . 2]" 1 1470 1 74 ARG HB2 1 75 ILE H . . 4.070 3.721 3.551 3.893 . 0 0 "[ . 1 . 2]" 1 1471 1 74 ARG HB2 1 75 ILE HA . . 4.940 4.764 4.691 4.822 . 0 0 "[ . 1 . 2]" 1 1472 1 74 ARG HB2 1 75 ILE HG13 . . 4.940 3.489 3.444 3.585 . 0 0 "[ . 1 . 2]" 1 1473 1 74 ARG HB3 1 74 ARG HD2 . . 4.180 2.741 2.560 2.956 . 0 0 "[ . 1 . 2]" 1 1474 1 74 ARG HB3 1 74 ARG HE . . 4.780 4.463 4.213 4.629 . 0 0 "[ . 1 . 2]" 1 1475 1 74 ARG HB3 1 75 ILE H . . 4.780 4.289 4.203 4.378 . 0 0 "[ . 1 . 2]" 1 1476 1 75 ILE H 1 75 ILE HB . . 2.920 2.566 2.518 2.613 . 0 0 "[ . 1 . 2]" 1 1477 1 75 ILE H 1 75 ILE MD . . 3.880 3.677 3.541 3.849 . 0 0 "[ . 1 . 2]" 1 1478 1 75 ILE H 1 75 ILE HG12 . . 4.150 4.012 3.865 4.116 . 0 0 "[ . 1 . 2]" 1 1479 1 75 ILE H 1 75 ILE HG13 . . 3.090 2.683 2.544 2.809 . 0 0 "[ . 1 . 2]" 1 1480 1 75 ILE H 1 76 ASN H . . 4.610 4.506 4.455 4.543 . 0 0 "[ . 1 . 2]" 1 1481 1 75 ILE HA 1 75 ILE MD . . 4.260 3.878 3.860 3.885 . 0 0 "[ . 1 . 2]" 1 1482 1 75 ILE HA 1 75 ILE HG12 . . 3.920 2.695 2.610 2.736 . 0 0 "[ . 1 . 2]" 1 1483 1 75 ILE HA 1 75 ILE HG13 . . 4.140 2.813 2.768 2.901 . 0 0 "[ . 1 . 2]" 1 1484 1 75 ILE HA 1 75 ILE MG . . 2.400 2.356 2.302 2.401 0.001 16 0 "[ . 1 . 2]" 1 1485 1 75 ILE HA 1 76 ASN H . . 2.500 2.222 2.197 2.238 . 0 0 "[ . 1 . 2]" 1 1486 1 75 ILE HB 1 75 ILE MD . . 2.540 2.190 2.154 2.260 . 0 0 "[ . 1 . 2]" 1 1487 1 75 ILE MD 1 75 ILE MG . . 2.400 2.262 2.122 2.336 . 0 0 "[ . 1 . 2]" 1 1488 1 75 ILE MD 1 77 LEU HG . . 5.500 4.999 4.544 5.510 0.010 20 0 "[ . 1 . 2]" 1 1489 1 75 ILE HG12 1 76 ASN H . . 4.470 4.267 4.225 4.311 . 0 0 "[ . 1 . 2]" 1 1490 1 75 ILE MG 1 76 ASN H . . 3.010 2.169 1.980 2.275 . 0 0 "[ . 1 . 2]" 1 1491 1 75 ILE MG 1 76 ASN HA . . 4.460 3.764 3.695 3.838 . 0 0 "[ . 1 . 2]" 1 1492 1 75 ILE MG 1 77 LEU H . . 4.410 3.754 3.667 3.854 . 0 0 "[ . 1 . 2]" 1 1493 1 75 ILE MG 1 77 LEU HG . . 4.860 3.301 2.375 4.391 . 0 0 "[ . 1 . 2]" 1 1494 1 76 ASN H 1 76 ASN HB2 . . 3.930 2.587 2.467 2.814 . 0 0 "[ . 1 . 2]" 1 1495 1 76 ASN H 1 76 ASN QB . . 3.250 2.393 2.342 2.503 . 0 0 "[ . 1 . 2]" 1 1496 1 76 ASN H 1 76 ASN HB3 . . 3.930 2.975 2.548 3.683 . 0 0 "[ . 1 . 2]" 1 1497 1 76 ASN H 1 77 LEU H . . 4.710 4.223 4.189 4.249 . 0 0 "[ . 1 . 2]" 1 1498 1 76 ASN HA 1 77 LEU H . . 2.440 2.166 2.159 2.176 . 0 0 "[ . 1 . 2]" 1 1499 1 76 ASN HA 1 78 ASP H . . 4.430 3.414 3.313 3.470 . 0 0 "[ . 1 . 2]" 1 1500 1 76 ASN QB 1 77 LEU H . . 4.120 3.827 3.540 3.941 . 0 0 "[ . 1 . 2]" 1 1501 1 76 ASN QB 1 78 ASP H . . 5.340 3.338 2.788 3.656 . 0 0 "[ . 1 . 2]" 1 1502 1 76 ASN QB 1 79 LYS H . . 4.400 3.574 3.130 3.871 . 0 0 "[ . 1 . 2]" 1 1503 1 76 ASN QB 1 79 LYS HB2 . . 5.180 3.419 3.003 3.635 . 0 0 "[ . 1 . 2]" 1 1504 1 76 ASN QB 1 79 LYS QD . . 4.670 3.232 2.627 3.861 . 0 0 "[ . 1 . 2]" 1 1505 1 76 ASN HB2 1 77 LEU H . . 4.680 4.513 4.390 4.595 . 0 0 "[ . 1 . 2]" 1 1506 1 76 ASN HB3 1 77 LEU H . . 4.680 4.147 3.726 4.380 . 0 0 "[ . 1 . 2]" 1 1507 1 76 ASN QD 1 78 ASP QB . . 4.440 3.256 2.141 4.443 0.003 20 0 "[ . 1 . 2]" 1 1508 1 76 ASN QD 1 79 LYS QD . . 3.380 2.637 1.803 3.235 . 0 0 "[ . 1 . 2]" 1 1509 1 76 ASN QD 1 79 LYS QE . . 3.780 3.232 2.463 3.786 0.006 17 0 "[ . 1 . 2]" 1 1510 1 77 LEU H 1 77 LEU QB . . 3.440 2.271 2.202 2.382 . 0 0 "[ . 1 . 2]" 1 1511 1 77 LEU H 1 77 LEU QD . . 4.750 2.918 2.264 3.485 . 0 0 "[ . 1 . 2]" 1 1512 1 77 LEU H 1 78 ASP QB . . 4.900 4.039 3.924 4.184 . 0 0 "[ . 1 . 2]" 1 1513 1 77 LEU H 1 79 LYS H . . 4.680 4.590 4.462 4.666 . 0 0 "[ . 1 . 2]" 1 1514 1 77 LEU HA 1 77 LEU QB . . 2.590 2.439 2.381 2.478 . 0 0 "[ . 1 . 2]" 1 1515 1 77 LEU HA 1 77 LEU QD . . 2.380 2.098 1.956 2.293 . 0 0 "[ . 1 . 2]" 1 1516 1 77 LEU HA 1 77 LEU HG . . 3.920 3.234 2.698 3.703 . 0 0 "[ . 1 . 2]" 1 1517 1 77 LEU QB 1 77 LEU QD . . 2.830 1.942 1.863 2.027 . 0 0 "[ . 1 . 2]" 1 1518 1 77 LEU QB 1 78 ASP H . . 4.130 3.671 3.601 3.710 . 0 0 "[ . 1 . 2]" 1 1519 1 77 LEU QD 1 78 ASP H . . 4.920 4.244 3.949 4.531 . 0 0 "[ . 1 . 2]" 1 1520 1 77 LEU QD 1 81 VAL MG2 . . 3.500 3.276 3.116 3.499 . 0 0 "[ . 1 . 2]" 1 1521 1 78 ASP H 1 78 ASP HB2 . . 3.510 2.514 2.245 2.927 . 0 0 "[ . 1 . 2]" 1 1522 1 78 ASP H 1 78 ASP QB . . 2.870 2.319 2.216 2.386 . 0 0 "[ . 1 . 2]" 1 1523 1 78 ASP H 1 78 ASP HB3 . . 3.510 3.006 2.459 3.511 0.001 20 0 "[ . 1 . 2]" 1 1524 1 78 ASP H 1 79 LYS H . . 2.510 2.107 2.102 2.112 . 0 0 "[ . 1 . 2]" 1 1525 1 78 ASP H 1 79 LYS QD . . 4.800 4.109 3.536 4.807 0.007 12 0 "[ . 1 . 2]" 1 1526 1 78 ASP HA 1 78 ASP QB . . 2.530 2.454 2.329 2.526 . 0 0 "[ . 1 . 2]" 1 1527 1 78 ASP QB 1 79 LYS H . . 3.960 2.992 2.934 3.067 . 0 0 "[ . 1 . 2]" 1 1528 1 79 LYS H 1 79 LYS HB2 . . 3.640 2.267 2.238 2.302 . 0 0 "[ . 1 . 2]" 1 1529 1 79 LYS H 1 79 LYS HB3 . . 3.760 3.483 3.286 3.556 . 0 0 "[ . 1 . 2]" 1 1530 1 79 LYS H 1 79 LYS QD . . 3.700 3.138 2.615 3.686 . 0 0 "[ . 1 . 2]" 1 1531 1 79 LYS H 1 80 GLU H . . 4.770 4.546 4.536 4.559 . 0 0 "[ . 1 . 2]" 1 1532 1 79 LYS HA 1 79 LYS HB3 . . 2.880 2.692 2.631 2.825 . 0 0 "[ . 1 . 2]" 1 1533 1 79 LYS HA 1 79 LYS HD2 . . 4.920 3.609 2.965 4.150 . 0 0 "[ . 1 . 2]" 1 1534 1 79 LYS HA 1 79 LYS QD . . 4.110 3.401 2.880 3.873 . 0 0 "[ . 1 . 2]" 1 1535 1 79 LYS HA 1 79 LYS HD3 . . 4.920 4.190 3.621 4.638 . 0 0 "[ . 1 . 2]" 1 1536 1 79 LYS HA 1 79 LYS HG2 . . 4.000 3.279 2.923 3.550 . 0 0 "[ . 1 . 2]" 1 1537 1 79 LYS HA 1 79 LYS HG3 . . 2.510 2.158 2.029 2.253 . 0 0 "[ . 1 . 2]" 1 1538 1 79 LYS HA 1 80 GLU H . . 2.400 2.244 2.221 2.302 . 0 0 "[ . 1 . 2]" 1 1539 1 79 LYS HA 1 80 GLU QG . . 4.670 3.701 3.584 4.140 . 0 0 "[ . 1 . 2]" 1 1540 1 79 LYS HB2 1 79 LYS QD . . 2.920 2.093 2.033 2.204 . 0 0 "[ . 1 . 2]" 1 1541 1 79 LYS HB2 1 79 LYS QE . . 4.130 3.767 3.008 3.999 . 0 0 "[ . 1 . 2]" 1 1542 1 79 LYS HB3 1 79 LYS QD . . 3.660 3.070 2.803 3.267 . 0 0 "[ . 1 . 2]" 1 1543 1 79 LYS HB3 1 80 GLU H . . 3.000 2.992 2.826 3.008 0.008 7 0 "[ . 1 . 2]" 1 1544 1 79 LYS QD 1 79 LYS QE . . 2.350 2.027 1.987 2.067 . 0 0 "[ . 1 . 2]" 1 1545 1 79 LYS QE 1 79 LYS HG2 . . 3.550 2.310 2.033 3.225 . 0 0 "[ . 1 . 2]" 1 1546 1 79 LYS HE2 1 79 LYS HG2 . . 4.150 3.231 2.171 3.793 . 0 0 "[ . 1 . 2]" 1 1547 1 79 LYS HE3 1 79 LYS HG2 . . 4.150 2.601 2.051 3.835 . 0 0 "[ . 1 . 2]" 1 1548 1 79 LYS HG3 1 80 GLU H . . 3.910 3.718 3.245 3.915 0.005 14 0 "[ . 1 . 2]" 1 1549 1 80 GLU H 1 80 GLU QG . . 2.740 2.033 1.923 2.510 . 0 0 "[ . 1 . 2]" 1 1550 1 80 GLU HA 1 80 GLU HB3 . . 2.570 2.418 2.395 2.453 . 0 0 "[ . 1 . 2]" 1 1551 1 80 GLU HA 1 80 GLU QG . . 2.610 2.482 2.384 2.535 . 0 0 "[ . 1 . 2]" 1 1552 1 80 GLU HA 1 81 VAL H . . 2.570 2.272 2.222 2.364 . 0 0 "[ . 1 . 2]" 1 1553 1 80 GLU HA 1 81 VAL MG2 . . 4.610 3.558 3.385 3.735 . 0 0 "[ . 1 . 2]" 1 1554 1 80 GLU HB2 1 82 LEU QD . . 5.140 3.952 3.719 4.193 . 0 0 "[ . 1 . 2]" 1 1555 1 80 GLU HB3 1 80 GLU QG . . 2.750 2.373 2.135 2.483 . 0 0 "[ . 1 . 2]" 1 1556 1 80 GLU HB3 1 81 VAL H . . 3.450 2.791 2.541 2.942 . 0 0 "[ . 1 . 2]" 1 1557 1 80 GLU HB3 1 82 LEU QD . . 4.830 4.221 3.917 4.380 . 0 0 "[ . 1 . 2]" 1 1558 1 80 GLU QG 1 82 LEU QD . . 5.360 5.254 4.991 5.366 0.006 11 0 "[ . 1 . 2]" 1 1559 1 81 VAL H 1 81 VAL HB . . 3.430 2.545 2.479 2.649 . 0 0 "[ . 1 . 2]" 1 1560 1 81 VAL H 1 81 VAL MG1 . . 4.040 3.806 3.778 3.836 . 0 0 "[ . 1 . 2]" 1 1561 1 81 VAL H 1 81 VAL MG2 . . 3.620 2.617 2.352 2.788 . 0 0 "[ . 1 . 2]" 1 1562 1 81 VAL H 1 83 TYR QE . . 5.030 4.767 4.481 4.998 . 0 0 "[ . 1 . 2]" 1 1563 1 81 VAL HA 1 81 VAL MG1 . . 3.330 2.370 2.284 2.410 . 0 0 "[ . 1 . 2]" 1 1564 1 81 VAL HA 1 81 VAL MG2 . . 2.400 2.300 2.244 2.415 0.015 7 0 "[ . 1 . 2]" 1 1565 1 81 VAL HA 1 82 LEU H . . 2.600 2.223 2.197 2.288 . 0 0 "[ . 1 . 2]" 1 1566 1 81 VAL HA 1 82 LEU QD . . 4.890 3.879 3.492 4.351 . 0 0 "[ . 1 . 2]" 1 1567 1 81 VAL HB 1 82 LEU H . . 5.250 3.962 3.688 4.049 . 0 0 "[ . 1 . 2]" 1 1568 1 81 VAL HB 1 82 LEU QD . . 5.440 5.226 4.938 5.454 0.014 19 0 "[ . 1 . 2]" 1 1569 1 81 VAL HB 1 83 TYR QE . . 3.270 2.555 2.265 2.765 . 0 0 "[ . 1 . 2]" 1 1570 1 81 VAL MG1 1 82 LEU H . . 3.450 2.247 2.058 2.364 . 0 0 "[ . 1 . 2]" 1 1571 1 81 VAL MG1 1 83 TYR HA . . 5.280 4.081 3.944 4.263 . 0 0 "[ . 1 . 2]" 1 1572 1 81 VAL MG1 1 83 TYR QD . . 4.360 3.055 2.824 3.456 . 0 0 "[ . 1 . 2]" 1 1573 1 81 VAL MG1 1 83 TYR QE . . 3.510 2.610 2.370 3.078 . 0 0 "[ . 1 . 2]" 1 1574 1 81 VAL MG2 1 82 LEU H . . 3.930 3.877 3.838 3.956 0.026 11 0 "[ . 1 . 2]" 1 1575 1 81 VAL MG2 1 83 TYR QE . . 4.420 3.692 3.506 3.884 . 0 0 "[ . 1 . 2]" 1 1576 1 82 LEU H 1 82 LEU HB3 . . 3.890 3.397 3.281 3.634 . 0 0 "[ . 1 . 2]" 1 1577 1 82 LEU H 1 83 TYR H . . 4.680 4.454 4.423 4.484 . 0 0 "[ . 1 . 2]" 1 1578 1 82 LEU HA 1 82 LEU MD1 . . 3.870 2.704 2.080 3.822 . 0 0 "[ . 1 . 2]" 1 1579 1 82 LEU HA 1 82 LEU QD . . 3.230 2.142 1.948 2.589 . 0 0 "[ . 1 . 2]" 1 1580 1 82 LEU HA 1 82 LEU MD2 . . 3.870 2.586 2.049 3.739 . 0 0 "[ . 1 . 2]" 1 1581 1 82 LEU HA 1 82 LEU HG . . 4.180 3.179 2.332 3.650 . 0 0 "[ . 1 . 2]" 1 1582 1 82 LEU HA 1 83 TYR H . . 2.490 2.157 2.143 2.178 . 0 0 "[ . 1 . 2]" 1 1583 1 82 LEU HB2 1 82 LEU MD1 . . 3.620 2.704 2.099 3.193 . 0 0 "[ . 1 . 2]" 1 1584 1 82 LEU HB2 1 82 LEU MD2 . . 3.620 2.582 2.269 3.192 . 0 0 "[ . 1 . 2]" 1 1585 1 82 LEU HB3 1 82 LEU QD . . 3.030 2.171 2.085 2.276 . 0 0 "[ . 1 . 2]" 1 1586 1 82 LEU HB3 1 83 TYR H . . 4.000 3.427 3.237 3.597 . 0 0 "[ . 1 . 2]" 1 1587 1 82 LEU QD 1 83 TYR H . . 4.650 3.083 2.353 3.878 . 0 0 "[ . 1 . 2]" 1 1588 1 82 LEU HG 1 83 TYR H . . 5.190 4.591 3.217 5.133 . 0 0 "[ . 1 . 2]" 1 1589 1 83 TYR H 1 83 TYR HB2 . . 3.130 2.490 2.369 2.636 . 0 0 "[ . 1 . 2]" 1 1590 1 83 TYR H 1 83 TYR QD . . 3.520 3.189 2.911 3.489 . 0 0 "[ . 1 . 2]" 1 1591 1 83 TYR H 1 83 TYR QE . . 5.400 5.248 5.063 5.342 . 0 0 "[ . 1 . 2]" 1 1592 1 83 TYR H 1 84 PRO QD . . 5.340 4.363 4.349 4.369 . 0 0 "[ . 1 . 2]" 1 1593 1 83 TYR HA 1 83 TYR QD . . 4.160 2.853 2.507 3.019 . 0 0 "[ . 1 . 2]" 1 1594 1 83 TYR HA 1 84 PRO HD2 . . 3.160 2.468 2.436 2.497 . 0 0 "[ . 1 . 2]" 1 1595 1 83 TYR HA 1 84 PRO QD . . 2.600 2.129 2.110 2.147 . 0 0 "[ . 1 . 2]" 1 1596 1 83 TYR HA 1 84 PRO HD3 . . 3.160 2.327 2.312 2.340 . 0 0 "[ . 1 . 2]" 1 1597 1 83 TYR HA 1 84 PRO QG . . 4.360 4.045 4.024 4.064 . 0 0 "[ . 1 . 2]" 1 1598 1 83 TYR HB2 1 84 PRO QD . . 4.230 3.478 3.470 3.484 . 0 0 "[ . 1 . 2]" 1 1599 1 83 TYR HB3 1 84 PRO HD2 . . 4.330 1.972 1.957 1.988 . 0 0 "[ . 1 . 2]" 1 1600 1 83 TYR HB3 1 84 PRO QD . . 3.610 1.961 1.946 1.976 . 0 0 "[ . 1 . 2]" 1 1601 1 83 TYR HB3 1 84 PRO HD3 . . 4.330 3.427 3.415 3.438 . 0 0 "[ . 1 . 2]" 1 1602 1 83 TYR HB3 1 84 PRO QG . . 5.290 3.546 3.522 3.574 . 0 0 "[ . 1 . 2]" 1 1603 1 83 TYR QD 1 84 PRO HD2 . . 4.800 2.162 1.978 2.407 . 0 0 "[ . 1 . 2]" 1 1604 1 83 TYR QD 1 84 PRO QD . . 3.970 2.128 1.961 2.343 . 0 0 "[ . 1 . 2]" 1 1605 1 83 TYR QD 1 84 PRO HD3 . . 4.800 3.227 3.118 3.449 . 0 0 "[ . 1 . 2]" 1 1606 1 84 PRO HA 1 85 LYS H . . 2.400 2.292 2.175 2.399 . 0 0 "[ . 1 . 2]" 1 1607 1 84 PRO HA 1 85 LYS HA . . 4.440 4.403 4.375 4.445 0.005 13 0 "[ . 1 . 2]" 1 1608 1 84 PRO HA 1 85 LYS QB . . 4.600 4.051 3.952 4.489 . 0 0 "[ . 1 . 2]" 1 1609 1 84 PRO QB 1 85 LYS H . . 3.460 2.811 2.540 3.162 . 0 0 "[ . 1 . 2]" 1 1610 1 84 PRO QB 1 86 LEU QD . . 5.140 2.885 2.311 3.829 . 0 0 "[ . 1 . 2]" 1 1611 1 84 PRO QD 1 86 LEU QD . . 5.280 4.802 4.170 5.281 0.001 9 0 "[ . 1 . 2]" 1 1612 1 84 PRO QG 1 86 LEU QD . . 5.440 3.347 2.633 3.853 . 0 0 "[ . 1 . 2]" 1 1613 1 85 LYS H 1 85 LYS QB . . 2.940 2.496 2.355 2.956 0.016 8 0 "[ . 1 . 2]" 1 1614 1 85 LYS H 1 85 LYS HG2 . . 5.490 4.446 2.233 4.867 . 0 0 "[ . 1 . 2]" 1 1615 1 85 LYS H 1 85 LYS QG . . 4.750 3.881 2.213 4.158 . 0 0 "[ . 1 . 2]" 1 1616 1 85 LYS H 1 85 LYS HG3 . . 5.490 4.376 3.613 4.538 . 0 0 "[ . 1 . 2]" 1 1617 1 85 LYS HA 1 85 LYS QD . . 3.500 2.840 1.985 3.528 0.028 10 0 "[ . 1 . 2]" 1 1618 1 85 LYS HA 1 85 LYS HG2 . . 4.110 3.712 3.529 3.816 . 0 0 "[ . 1 . 2]" 1 1619 1 85 LYS HA 1 85 LYS HG3 . . 4.110 2.780 2.329 4.234 0.124 8 0 "[ . 1 . 2]" 1 1620 1 85 LYS HA 1 86 LEU H . . 2.400 2.157 2.141 2.242 . 0 0 "[ . 1 . 2]" 1 1621 1 85 LYS QB 1 85 LYS QD . . 3.450 2.130 1.970 2.327 . 0 0 "[ . 1 . 2]" 1 1622 1 85 LYS QB 1 86 LEU H . . 3.860 3.710 2.830 3.859 . 0 0 "[ . 1 . 2]" 1 1623 1 85 LYS QG 1 86 LEU H . . 4.470 2.899 2.040 4.242 . 0 0 "[ . 1 . 2]" 1 1624 1 85 LYS HG2 1 86 LEU H . . 5.190 4.348 3.324 4.743 . 0 0 "[ . 1 . 2]" 1 1625 1 85 LYS HG3 1 86 LEU H . . 5.190 3.012 2.058 5.116 . 0 0 "[ . 1 . 2]" 1 1626 1 86 LEU H 1 86 LEU QB . . 2.670 2.428 2.244 2.671 0.001 20 0 "[ . 1 . 2]" 1 1627 1 86 LEU H 1 86 LEU QD . . 4.070 3.031 2.579 3.842 . 0 0 "[ . 1 . 2]" 1 1628 1 86 LEU HA 1 86 LEU QB . . 2.540 2.445 2.334 2.487 . 0 0 "[ . 1 . 2]" 1 1629 1 86 LEU HA 1 86 LEU QD . . 2.390 2.198 1.899 2.394 0.004 11 0 "[ . 1 . 2]" 1 1630 1 86 LEU HA 1 87 LYS H . . 2.400 2.240 2.138 2.386 . 0 0 "[ . 1 . 2]" 1 1631 1 86 LEU QB 1 87 LYS H . . 3.670 3.029 2.504 3.668 . 0 0 "[ . 1 . 2]" 1 1632 1 86 LEU QD 1 87 LYS H . . 3.960 3.416 2.496 3.954 . 0 0 "[ . 1 . 2]" 1 1633 1 87 LYS H 1 87 LYS QB . . 2.820 2.606 2.268 2.854 0.034 9 0 "[ . 1 . 2]" 1 1634 1 87 LYS HA 1 87 LYS QD . . 4.850 3.426 2.076 4.459 . 0 0 "[ . 1 . 2]" 1 1635 1 87 LYS HA 1 88 ALA H . . 2.400 2.269 2.144 2.407 0.007 3 0 "[ . 1 . 2]" 1 1636 1 87 LYS QB 1 87 LYS QD . . 2.720 2.198 1.986 2.548 . 0 0 "[ . 1 . 2]" 1 1637 1 87 LYS QB 1 88 ALA H . . 4.020 3.455 2.464 4.020 0.000 9 0 "[ . 1 . 2]" 1 1638 1 88 ALA H 1 88 ALA MB . . 3.420 2.317 2.115 2.699 . 0 0 "[ . 1 . 2]" 1 1639 1 88 ALA HA 1 89 THR H . . 2.480 2.250 2.140 2.453 . 0 0 "[ . 1 . 2]" 1 1640 1 88 ALA MB 1 89 THR H . . 3.970 3.064 2.410 3.702 . 0 0 "[ . 1 . 2]" 1 1641 1 89 THR H 1 89 THR MG . . 4.460 3.276 1.912 3.973 . 0 0 "[ . 1 . 2]" 1 1642 1 90 ASP HA 1 90 ASP QB . . 2.550 2.344 2.176 2.472 . 0 0 "[ . 1 . 2]" 1 stop_ save_
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