NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
407328 | 1y7n | 6113 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1y7n 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 1686 _Distance_constraint_stats_list.Viol_count 3202 _Distance_constraint_stats_list.Viol_total 3393.183 _Distance_constraint_stats_list.Viol_max 0.263 _Distance_constraint_stats_list.Viol_rms 0.0205 _Distance_constraint_stats_list.Viol_average_all_restraints 0.0050 _Distance_constraint_stats_list.Viol_average_violations_only 0.0530 _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 7 GLU 0.027 0.027 12 0 "[ . 1 . 2]" 1 8 THR 0.027 0.027 12 0 "[ . 1 . 2]" 1 9 MET 0.000 0.000 . 0 "[ . 1 . 2]" 1 10 GLY 0.557 0.109 13 0 "[ . 1 . 2]" 1 11 ASN 1.194 0.147 17 0 "[ . 1 . 2]" 1 12 VAL 8.847 0.195 13 0 "[ . 1 . 2]" 1 13 THR 9.094 0.195 13 0 "[ . 1 . 2]" 1 14 THR 5.861 0.131 2 0 "[ . 1 . 2]" 1 15 VAL 13.933 0.194 15 0 "[ . 1 . 2]" 1 16 LEU 11.249 0.189 15 0 "[ . 1 . 2]" 1 17 ILE 6.362 0.257 8 0 "[ . 1 . 2]" 1 18 ARG 2.161 0.167 11 0 "[ . 1 . 2]" 1 19 ARG 7.510 0.152 8 0 "[ . 1 . 2]" 1 20 PRO 0.007 0.007 13 0 "[ . 1 . 2]" 1 21 ASP 2.617 0.134 19 0 "[ . 1 . 2]" 1 22 LEU 12.528 0.230 7 0 "[ . 1 . 2]" 1 23 ARG 1.995 0.116 12 0 "[ . 1 . 2]" 1 24 TYR 3.559 0.154 18 0 "[ . 1 . 2]" 1 25 GLN 2.302 0.154 18 0 "[ . 1 . 2]" 1 26 LEU 3.781 0.149 4 0 "[ . 1 . 2]" 1 27 GLY 0.032 0.030 5 0 "[ . 1 . 2]" 1 28 PHE 2.520 0.144 8 0 "[ . 1 . 2]" 1 29 SER 1.115 0.103 15 0 "[ . 1 . 2]" 1 30 VAL 2.646 0.144 8 0 "[ . 1 . 2]" 1 31 GLN 0.619 0.082 18 0 "[ . 1 . 2]" 1 32 ASN 0.710 0.082 18 0 "[ . 1 . 2]" 1 33 GLY 0.421 0.060 10 0 "[ . 1 . 2]" 1 34 ILE 4.403 0.116 1 0 "[ . 1 . 2]" 1 35 ILE 4.855 0.103 15 0 "[ . 1 . 2]" 1 36 CYS 0.000 0.000 . 0 "[ . 1 . 2]" 1 37 SER 0.273 0.095 18 0 "[ . 1 . 2]" 1 38 LEU 5.386 0.119 19 0 "[ . 1 . 2]" 1 39 MET 0.107 0.075 15 0 "[ . 1 . 2]" 1 40 ARG 1.864 0.141 12 0 "[ . 1 . 2]" 1 41 GLY 0.526 0.141 12 0 "[ . 1 . 2]" 1 42 GLY 1.725 0.081 18 0 "[ . 1 . 2]" 1 43 ILE 4.486 0.135 13 0 "[ . 1 . 2]" 1 44 ALA 1.286 0.075 7 0 "[ . 1 . 2]" 1 45 GLU 0.134 0.095 18 0 "[ . 1 . 2]" 1 46 ARG 1.667 0.117 12 0 "[ . 1 . 2]" 1 47 GLY 1.568 0.136 5 0 "[ . 1 . 2]" 1 48 GLY 0.758 0.077 16 0 "[ . 1 . 2]" 1 49 VAL 4.958 0.194 15 0 "[ . 1 . 2]" 1 50 ARG 3.781 0.133 7 0 "[ . 1 . 2]" 1 51 VAL 6.670 0.133 7 0 "[ . 1 . 2]" 1 52 GLY 1.237 0.063 6 0 "[ . 1 . 2]" 1 53 HIS 1.119 0.053 19 0 "[ . 1 . 2]" 1 54 ARG 1.143 0.056 10 0 "[ . 1 . 2]" 1 55 ILE 7.549 0.211 12 0 "[ . 1 . 2]" 1 56 ILE 11.036 0.251 20 0 "[ . 1 . 2]" 1 57 GLU 7.356 0.211 12 0 "[ . 1 . 2]" 1 58 ILE 6.639 0.198 6 0 "[ . 1 . 2]" 1 59 ASN 2.684 0.181 12 0 "[ . 1 . 2]" 1 60 GLY 0.281 0.115 10 0 "[ . 1 . 2]" 1 61 GLN 3.287 0.152 14 0 "[ . 1 . 2]" 1 62 SER 0.000 0.000 . 0 "[ . 1 . 2]" 1 63 VAL 12.101 0.198 6 0 "[ . 1 . 2]" 1 64 VAL 6.477 0.129 8 0 "[ . 1 . 2]" 1 65 ALA 1.013 0.087 2 0 "[ . 1 . 2]" 1 66 THR 6.712 0.185 8 0 "[ . 1 . 2]" 1 67 PRO 0.099 0.037 18 0 "[ . 1 . 2]" 1 68 HIS 1.669 0.084 18 0 "[ . 1 . 2]" 1 69 GLU 3.888 0.144 17 0 "[ . 1 . 2]" 1 70 LYS 7.120 0.222 3 0 "[ . 1 . 2]" 1 71 ILE 4.708 0.144 4 0 "[ . 1 . 2]" 1 72 VAL 3.405 0.144 17 0 "[ . 1 . 2]" 1 73 HIS 2.213 0.127 10 0 "[ . 1 . 2]" 1 74 ILE 9.692 0.222 3 0 "[ . 1 . 2]" 1 75 LEU 3.198 0.110 16 0 "[ . 1 . 2]" 1 76 SER 0.940 0.083 3 0 "[ . 1 . 2]" 1 77 ASN 0.092 0.041 4 0 "[ . 1 . 2]" 1 78 ALA 5.786 0.187 16 0 "[ . 1 . 2]" 1 79 VAL 10.148 0.230 7 0 "[ . 1 . 2]" 1 80 GLY 0.130 0.049 3 0 "[ . 1 . 2]" 1 81 GLU 1.554 0.167 11 0 "[ . 1 . 2]" 1 82 ILE 7.563 0.263 11 0 "[ . 1 . 2]" 1 83 HIS 2.611 0.263 11 0 "[ . 1 . 2]" 1 84 MET 9.401 0.175 14 0 "[ . 1 . 2]" 1 85 LYS 14.763 0.251 20 0 "[ . 1 . 2]" 1 86 THR 5.785 0.121 7 0 "[ . 1 . 2]" 1 87 MET 3.176 0.148 19 0 "[ . 1 . 2]" 1 88 PRO 0.552 0.086 9 0 "[ . 1 . 2]" 1 89 ALA 3.462 0.148 19 0 "[ . 1 . 2]" 1 90 ALA 0.319 0.086 9 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 7 GLU HA 1 7 GLU QG 2.795 . 3.790 2.776 2.435 3.564 . 0 0 "[ . 1 . 2]" 1 2 1 7 GLU QB 1 7 GLU QG 2.350 . 2.900 2.021 1.986 2.089 . 0 0 "[ . 1 . 2]" 1 3 1 7 GLU QB 1 8 THR H 3.415 . 5.030 3.006 1.773 3.958 0.027 12 0 "[ . 1 . 2]" 1 4 1 7 GLU QG 1 8 THR H 3.650 . 5.500 3.767 1.835 4.874 . 0 0 "[ . 1 . 2]" 1 5 1 8 THR H 1 8 THR MG 3.250 . 4.700 3.178 2.010 4.077 . 0 0 "[ . 1 . 2]" 1 6 1 8 THR H 1 9 MET H 3.445 . 5.090 3.778 2.147 4.480 . 0 0 "[ . 1 . 2]" 1 7 1 8 THR HA 1 8 THR MG 2.565 . 3.330 2.661 2.245 3.263 . 0 0 "[ . 1 . 2]" 1 8 1 8 THR MG 1 9 MET H 3.570 . 5.340 3.555 2.500 4.302 . 0 0 "[ . 1 . 2]" 1 9 1 9 MET H 1 9 MET QB 2.985 . 4.170 2.573 2.277 2.965 . 0 0 "[ . 1 . 2]" 1 10 1 9 MET H 1 12 VAL MG2 3.650 . 5.500 3.809 2.057 5.066 . 0 0 "[ . 1 . 2]" 1 11 1 10 GLY H 1 12 VAL HB 3.450 . 5.100 4.709 3.601 5.169 0.069 1 0 "[ . 1 . 2]" 1 12 1 10 GLY QA 1 12 VAL H 3.395 . 4.990 4.739 3.871 5.099 0.109 13 0 "[ . 1 . 2]" 1 13 1 10 GLY QA 1 12 VAL MG2 3.085 . 4.370 3.805 3.188 4.383 0.013 6 0 "[ . 1 . 2]" 1 14 1 11 ASN H 1 12 VAL H 3.045 . 4.290 3.795 2.748 4.203 . 0 0 "[ . 1 . 2]" 1 15 1 11 ASN H 1 12 VAL HB 3.570 . 5.340 5.221 4.268 5.456 0.116 15 0 "[ . 1 . 2]" 1 16 1 11 ASN H 1 12 VAL MG2 3.525 . 5.250 3.603 3.295 4.072 . 0 0 "[ . 1 . 2]" 1 17 1 11 ASN HA 1 12 VAL H 2.525 . 3.250 2.098 1.883 2.317 . 0 0 "[ . 1 . 2]" 1 18 1 11 ASN HA 1 12 VAL HB 3.175 . 4.550 4.507 4.142 4.697 0.147 17 0 "[ . 1 . 2]" 1 19 1 11 ASN HA 1 12 VAL MG2 3.240 . 4.680 3.993 3.450 4.236 . 0 0 "[ . 1 . 2]" 1 20 1 11 ASN QB 1 11 ASN QD 2.935 . 4.070 2.162 2.099 2.227 . 0 0 "[ . 1 . 2]" 1 21 1 11 ASN QB 1 12 VAL H 3.070 . 4.340 3.632 3.181 3.950 . 0 0 "[ . 1 . 2]" 1 22 1 11 ASN QB 1 12 VAL MG2 3.265 . 4.730 4.382 3.706 4.765 0.035 13 0 "[ . 1 . 2]" 1 23 1 11 ASN QB 1 88 PRO QD 3.220 . 4.640 2.355 1.969 4.058 . 0 0 "[ . 1 . 2]" 1 24 1 11 ASN QB 1 88 PRO QG 3.135 . 4.470 2.580 2.113 4.231 . 0 0 "[ . 1 . 2]" 1 25 1 11 ASN QD 1 88 PRO QD 3.650 . 5.500 3.906 2.874 5.022 . 0 0 "[ . 1 . 2]" 1 26 1 11 ASN QD 1 88 PRO QG 3.525 . 5.250 3.272 1.782 4.538 0.018 13 0 "[ . 1 . 2]" 1 27 1 12 VAL H 1 12 VAL HB 2.535 . 3.270 2.608 2.387 2.784 . 0 0 "[ . 1 . 2]" 1 28 1 12 VAL H 1 12 VAL MG1 2.800 . 3.800 3.768 3.699 3.814 0.014 19 0 "[ . 1 . 2]" 1 29 1 12 VAL H 1 12 VAL MG2 2.545 . 3.290 3.028 2.614 3.241 . 0 0 "[ . 1 . 2]" 1 30 1 12 VAL H 1 13 THR H 3.305 . 4.810 4.062 3.900 4.203 . 0 0 "[ . 1 . 2]" 1 31 1 12 VAL H 1 13 THR HB 3.650 . 5.500 5.627 5.569 5.695 0.195 13 0 "[ . 1 . 2]" 1 32 1 12 VAL H 1 87 MET QG 3.650 . 5.500 4.637 4.248 4.892 . 0 0 "[ . 1 . 2]" 1 33 1 12 VAL H 1 88 PRO QD 3.650 . 5.500 4.793 4.417 5.196 . 0 0 "[ . 1 . 2]" 1 34 1 12 VAL HA 1 12 VAL MG1 2.410 . 3.020 2.472 2.394 2.557 . 0 0 "[ . 1 . 2]" 1 35 1 12 VAL HA 1 12 VAL MG2 2.355 . 2.910 2.311 2.261 2.335 . 0 0 "[ . 1 . 2]" 1 36 1 12 VAL HA 1 13 THR H 2.365 . 2.930 1.967 1.855 2.047 . 0 0 "[ . 1 . 2]" 1 37 1 12 VAL HA 1 13 THR HB 3.070 . 4.340 3.999 3.856 4.171 . 0 0 "[ . 1 . 2]" 1 38 1 12 VAL HA 1 86 THR H 3.135 . 4.470 4.235 4.055 4.389 . 0 0 "[ . 1 . 2]" 1 39 1 12 VAL HA 1 87 MET HA 2.865 . 3.930 2.707 2.491 3.114 . 0 0 "[ . 1 . 2]" 1 40 1 12 VAL HA 1 87 MET QB 3.030 . 4.260 4.149 3.998 4.283 0.023 9 0 "[ . 1 . 2]" 1 41 1 12 VAL HA 1 87 MET QG 2.960 . 4.120 2.712 2.206 2.946 . 0 0 "[ . 1 . 2]" 1 42 1 12 VAL HA 1 88 PRO QD 3.245 . 4.690 3.868 3.500 4.243 . 0 0 "[ . 1 . 2]" 1 43 1 12 VAL HB 1 13 THR H 2.945 . 4.090 4.108 4.001 4.164 0.074 15 0 "[ . 1 . 2]" 1 44 1 12 VAL HB 1 13 THR HA 3.390 . 4.980 4.935 4.792 5.014 0.034 1 0 "[ . 1 . 2]" 1 45 1 12 VAL HB 1 85 LYS QB 3.210 . 4.620 4.652 4.556 4.731 0.111 4 0 "[ . 1 . 2]" 1 46 1 12 VAL MG1 1 13 THR H 2.435 . 3.070 2.591 2.436 2.765 . 0 0 "[ . 1 . 2]" 1 47 1 12 VAL MG1 1 13 THR HA 3.210 . 4.620 3.504 3.335 3.687 . 0 0 "[ . 1 . 2]" 1 48 1 12 VAL MG1 1 13 THR HB 3.060 . 4.320 4.343 4.151 4.439 0.119 15 0 "[ . 1 . 2]" 1 49 1 12 VAL MG1 1 14 THR H 3.340 . 4.880 3.399 3.048 3.627 . 0 0 "[ . 1 . 2]" 1 50 1 12 VAL MG1 1 85 LYS HA 2.775 . 3.750 3.031 2.836 3.269 . 0 0 "[ . 1 . 2]" 1 51 1 12 VAL MG1 1 85 LYS QB 2.305 . 2.810 2.038 1.958 2.147 . 0 0 "[ . 1 . 2]" 1 52 1 12 VAL MG1 1 85 LYS QD 2.440 . 3.080 1.949 1.794 2.382 0.006 2 0 "[ . 1 . 2]" 1 53 1 12 VAL MG1 1 85 LYS QE 2.800 . 3.800 2.928 1.846 3.331 . 0 0 "[ . 1 . 2]" 1 54 1 12 VAL MG1 1 85 LYS QG 2.675 . 3.550 3.338 3.167 3.566 0.016 14 0 "[ . 1 . 2]" 1 55 1 12 VAL MG1 1 87 MET QG 3.120 . 4.440 3.376 3.161 3.622 . 0 0 "[ . 1 . 2]" 1 56 1 12 VAL MG2 1 13 THR H 2.740 . 3.680 3.715 3.613 3.754 0.074 4 0 "[ . 1 . 2]" 1 57 1 12 VAL MG2 1 85 LYS HA 3.405 . 5.010 5.005 4.796 5.124 0.114 7 0 "[ . 1 . 2]" 1 58 1 12 VAL MG2 1 85 LYS QB 2.695 . 3.590 3.313 3.154 3.445 . 0 0 "[ . 1 . 2]" 1 59 1 12 VAL MG2 1 85 LYS QD 2.960 . 4.120 3.861 3.638 4.221 0.101 10 0 "[ . 1 . 2]" 1 60 1 12 VAL MG2 1 85 LYS QE 3.185 . 4.570 4.202 2.877 4.699 0.129 15 0 "[ . 1 . 2]" 1 61 1 12 VAL MG2 1 87 MET QB 2.845 . 3.890 3.825 3.730 3.928 0.038 13 0 "[ . 1 . 2]" 1 62 1 12 VAL MG2 1 87 MET QG 2.730 . 3.660 1.970 1.876 2.119 . 0 0 "[ . 1 . 2]" 1 63 1 12 VAL MG2 1 88 PRO QD 3.375 . 4.950 4.412 4.059 4.863 . 0 0 "[ . 1 . 2]" 1 64 1 13 THR H 1 13 THR HB 2.510 . 3.220 2.258 2.150 2.345 . 0 0 "[ . 1 . 2]" 1 65 1 13 THR H 1 13 THR MG 2.670 . 3.540 3.621 3.573 3.668 0.128 6 0 "[ . 1 . 2]" 1 66 1 13 THR H 1 14 THR H 3.240 . 4.680 4.042 3.924 4.147 . 0 0 "[ . 1 . 2]" 1 67 1 13 THR H 1 15 VAL MG2 3.650 . 5.500 5.156 4.860 5.282 . 0 0 "[ . 1 . 2]" 1 68 1 13 THR H 1 56 ILE MD 3.650 . 5.500 5.323 4.942 5.585 0.085 11 0 "[ . 1 . 2]" 1 69 1 13 THR H 1 56 ILE QG 3.650 . 5.500 5.422 4.907 5.564 0.064 4 0 "[ . 1 . 2]" 1 70 1 13 THR H 1 85 LYS HA 3.425 . 5.050 4.515 4.278 4.694 . 0 0 "[ . 1 . 2]" 1 71 1 13 THR H 1 85 LYS QB 3.630 . 5.460 4.593 4.361 4.839 . 0 0 "[ . 1 . 2]" 1 72 1 13 THR H 1 85 LYS QD 3.650 . 5.500 4.896 4.583 5.285 . 0 0 "[ . 1 . 2]" 1 73 1 13 THR H 1 87 MET HA 3.270 . 4.740 3.324 3.184 3.550 . 0 0 "[ . 1 . 2]" 1 74 1 13 THR H 1 87 MET QB 3.650 . 5.500 5.146 4.917 5.300 . 0 0 "[ . 1 . 2]" 1 75 1 13 THR H 1 87 MET QG 3.350 . 4.900 4.058 3.509 4.320 . 0 0 "[ . 1 . 2]" 1 76 1 13 THR H 1 88 PRO QD 3.650 . 5.500 4.659 4.418 4.994 . 0 0 "[ . 1 . 2]" 1 77 1 13 THR HA 1 13 THR MG 2.390 . 2.980 2.501 2.398 2.593 . 0 0 "[ . 1 . 2]" 1 78 1 13 THR HA 1 14 THR H 2.325 . 2.850 2.064 1.996 2.125 . 0 0 "[ . 1 . 2]" 1 79 1 13 THR HA 1 14 THR HB 3.100 . 4.400 4.488 4.460 4.517 0.117 9 0 "[ . 1 . 2]" 1 80 1 13 THR HB 1 14 THR H 3.095 . 4.390 4.310 4.256 4.377 . 0 0 "[ . 1 . 2]" 1 81 1 13 THR HB 1 15 VAL MG2 3.150 . 4.500 4.205 3.698 4.504 0.004 3 0 "[ . 1 . 2]" 1 82 1 13 THR HB 1 86 THR H 3.080 . 4.360 3.794 3.521 4.136 . 0 0 "[ . 1 . 2]" 1 83 1 13 THR MG 1 14 THR H 2.515 . 3.230 3.124 2.880 3.261 0.031 16 0 "[ . 1 . 2]" 1 84 1 13 THR MG 1 15 VAL H 3.195 . 4.590 4.541 4.266 4.634 0.044 5 0 "[ . 1 . 2]" 1 85 1 13 THR MG 1 15 VAL HA 3.220 . 4.640 4.175 3.803 4.340 . 0 0 "[ . 1 . 2]" 1 86 1 13 THR MG 1 15 VAL MG2 2.375 . 2.950 2.702 2.395 2.980 0.030 19 0 "[ . 1 . 2]" 1 87 1 13 THR MG 1 86 THR H 3.355 . 4.910 4.099 3.891 4.319 . 0 0 "[ . 1 . 2]" 1 88 1 14 THR H 1 14 THR HB 2.540 . 3.280 2.451 2.384 2.521 . 0 0 "[ . 1 . 2]" 1 89 1 14 THR H 1 14 THR MG 2.780 . 3.760 3.715 3.680 3.753 . 0 0 "[ . 1 . 2]" 1 90 1 14 THR H 1 15 VAL H 3.315 . 4.830 4.421 4.377 4.475 . 0 0 "[ . 1 . 2]" 1 91 1 14 THR H 1 15 VAL MG2 3.210 . 4.620 4.609 4.461 4.689 0.069 19 0 "[ . 1 . 2]" 1 92 1 14 THR H 1 85 LYS HA 3.650 . 5.500 4.588 4.408 4.777 . 0 0 "[ . 1 . 2]" 1 93 1 14 THR H 1 85 LYS QD 3.640 . 5.480 4.242 3.905 4.842 . 0 0 "[ . 1 . 2]" 1 94 1 14 THR HA 1 14 THR MG 2.520 . 3.240 2.295 2.223 2.342 . 0 0 "[ . 1 . 2]" 1 95 1 14 THR HA 1 15 VAL H 2.535 . 3.270 2.113 2.055 2.171 . 0 0 "[ . 1 . 2]" 1 96 1 14 THR HA 1 15 VAL HB 3.275 . 4.750 4.247 4.119 4.350 . 0 0 "[ . 1 . 2]" 1 97 1 14 THR HA 1 84 MET H 3.400 . 5.000 4.501 4.272 4.783 . 0 0 "[ . 1 . 2]" 1 98 1 14 THR HA 1 85 LYS HA 2.825 . 3.850 2.144 2.049 2.243 . 0 0 "[ . 1 . 2]" 1 99 1 14 THR HA 1 85 LYS QD 3.390 . 4.980 2.832 2.395 3.650 . 0 0 "[ . 1 . 2]" 1 100 1 14 THR HA 1 85 LYS QG 3.075 . 4.350 3.875 2.825 4.204 . 0 0 "[ . 1 . 2]" 1 101 1 14 THR HA 1 86 THR H 3.230 . 4.660 2.990 2.878 3.173 . 0 0 "[ . 1 . 2]" 1 102 1 14 THR HB 1 15 VAL H 2.980 . 4.160 3.841 3.787 3.901 . 0 0 "[ . 1 . 2]" 1 103 1 14 THR HB 1 15 VAL MG2 3.390 . 4.980 5.057 5.024 5.089 0.109 20 0 "[ . 1 . 2]" 1 104 1 14 THR MG 1 15 VAL H 2.510 . 3.220 2.416 2.350 2.593 . 0 0 "[ . 1 . 2]" 1 105 1 14 THR MG 1 15 VAL HA 2.870 . 3.940 3.822 3.703 3.955 0.015 18 0 "[ . 1 . 2]" 1 106 1 14 THR MG 1 15 VAL HB 3.380 . 4.960 4.351 4.200 4.529 . 0 0 "[ . 1 . 2]" 1 107 1 14 THR MG 1 16 LEU H 3.650 . 5.500 4.342 4.013 4.602 . 0 0 "[ . 1 . 2]" 1 108 1 14 THR MG 1 83 HIS HA 3.380 . 4.960 3.448 3.203 3.779 . 0 0 "[ . 1 . 2]" 1 109 1 14 THR MG 1 83 HIS QB 3.425 . 5.050 3.160 2.623 4.449 . 0 0 "[ . 1 . 2]" 1 110 1 14 THR MG 1 83 HIS HD1 3.205 . 4.610 3.224 2.659 3.806 . 0 0 "[ . 1 . 2]" 1 111 1 14 THR MG 1 84 MET H 3.410 . 5.020 3.168 2.933 3.422 . 0 0 "[ . 1 . 2]" 1 112 1 14 THR MG 1 85 LYS H 3.170 . 4.540 4.644 4.611 4.671 0.131 2 0 "[ . 1 . 2]" 1 113 1 14 THR MG 1 85 LYS HA 2.915 . 4.030 3.190 3.051 3.279 . 0 0 "[ . 1 . 2]" 1 114 1 14 THR MG 1 85 LYS QD 3.090 . 4.380 2.198 1.927 2.860 . 0 0 "[ . 1 . 2]" 1 115 1 14 THR MG 1 85 LYS QG 2.800 . 3.800 3.021 1.928 3.340 . 0 0 "[ . 1 . 2]" 1 116 1 15 VAL H 1 15 VAL HB 2.555 . 3.310 2.432 2.320 2.523 . 0 0 "[ . 1 . 2]" 1 117 1 15 VAL H 1 15 VAL MG2 2.485 . 3.170 2.846 2.746 2.957 . 0 0 "[ . 1 . 2]" 1 118 1 15 VAL H 1 16 LEU H 3.420 . 5.040 4.286 4.120 4.368 . 0 0 "[ . 1 . 2]" 1 119 1 15 VAL H 1 16 LEU HA 3.300 . 4.800 4.658 4.546 4.733 . 0 0 "[ . 1 . 2]" 1 120 1 15 VAL H 1 16 LEU MD1 3.650 . 5.500 5.518 5.453 5.561 0.061 10 0 "[ . 1 . 2]" 1 121 1 15 VAL H 1 83 HIS HA 3.615 . 5.430 4.392 4.159 4.626 . 0 0 "[ . 1 . 2]" 1 122 1 15 VAL H 1 84 MET HA 3.650 . 5.500 4.608 4.554 4.757 . 0 0 "[ . 1 . 2]" 1 123 1 15 VAL H 1 84 MET QB 3.650 . 5.500 3.133 3.039 3.221 . 0 0 "[ . 1 . 2]" 1 124 1 15 VAL H 1 84 MET QG 3.650 . 5.500 4.744 4.584 5.106 . 0 0 "[ . 1 . 2]" 1 125 1 15 VAL H 1 85 LYS HA 3.060 . 4.320 3.186 2.957 3.283 . 0 0 "[ . 1 . 2]" 1 126 1 15 VAL H 1 85 LYS QD 3.435 . 5.070 4.157 3.814 5.078 0.008 6 0 "[ . 1 . 2]" 1 127 1 15 VAL H 1 85 LYS QG 3.260 . 4.720 4.543 3.534 4.777 0.057 15 0 "[ . 1 . 2]" 1 128 1 15 VAL H 1 86 THR H 3.530 . 5.260 4.053 3.910 4.177 . 0 0 "[ . 1 . 2]" 1 129 1 15 VAL H 1 86 THR MG 3.015 . 4.230 3.798 3.658 3.934 . 0 0 "[ . 1 . 2]" 1 130 1 15 VAL HA 1 15 VAL MG1 2.455 . 3.110 2.472 2.439 2.552 . 0 0 "[ . 1 . 2]" 1 131 1 15 VAL HA 1 15 VAL MG2 2.395 . 2.990 2.197 2.174 2.224 . 0 0 "[ . 1 . 2]" 1 132 1 15 VAL HA 1 16 LEU H 2.320 . 2.840 2.141 2.031 2.201 . 0 0 "[ . 1 . 2]" 1 133 1 15 VAL HA 1 16 LEU QB 3.215 . 4.630 4.050 4.012 4.090 . 0 0 "[ . 1 . 2]" 1 134 1 15 VAL HA 1 48 GLY QA 3.320 . 4.840 3.568 3.125 4.212 . 0 0 "[ . 1 . 2]" 1 135 1 15 VAL HA 1 84 MET H 3.625 . 5.450 4.665 4.583 4.808 . 0 0 "[ . 1 . 2]" 1 136 1 15 VAL HA 1 84 MET ME 3.090 . 4.380 4.459 4.423 4.476 0.096 15 0 "[ . 1 . 2]" 1 137 1 15 VAL HB 1 16 LEU H 2.965 . 4.130 4.138 4.066 4.188 0.058 15 0 "[ . 1 . 2]" 1 138 1 15 VAL HB 1 49 VAL MG2 3.265 . 4.730 3.641 3.510 3.770 . 0 0 "[ . 1 . 2]" 1 139 1 15 VAL HB 1 83 HIS HA 3.445 . 5.090 5.126 5.076 5.177 0.087 14 0 "[ . 1 . 2]" 1 140 1 15 VAL HB 1 84 MET HA 3.510 . 5.220 4.760 4.475 4.971 . 0 0 "[ . 1 . 2]" 1 141 1 15 VAL HB 1 84 MET QB 2.950 . 4.100 2.006 1.894 2.172 . 0 0 "[ . 1 . 2]" 1 142 1 15 VAL HB 1 84 MET QG 3.220 . 4.640 3.704 3.554 4.042 . 0 0 "[ . 1 . 2]" 1 143 1 15 VAL HB 1 85 LYS HA 3.240 . 4.680 4.633 4.171 4.734 0.054 15 0 "[ . 1 . 2]" 1 144 1 15 VAL HB 1 86 THR MG 3.170 . 4.540 2.996 2.893 3.069 . 0 0 "[ . 1 . 2]" 1 145 1 15 VAL MG1 1 16 LEU H 2.515 . 3.230 2.541 2.441 2.695 . 0 0 "[ . 1 . 2]" 1 146 1 15 VAL MG1 1 16 LEU HA 2.945 . 4.090 3.224 3.023 3.329 . 0 0 "[ . 1 . 2]" 1 147 1 15 VAL MG1 1 17 ILE H 2.595 . 3.390 3.165 2.834 3.398 0.008 19 0 "[ . 1 . 2]" 1 148 1 15 VAL MG1 1 47 GLY QA 3.230 . 4.660 2.806 2.423 3.100 . 0 0 "[ . 1 . 2]" 1 149 1 15 VAL MG1 1 48 GLY H 3.135 . 4.470 3.712 3.432 3.981 . 0 0 "[ . 1 . 2]" 1 150 1 15 VAL MG1 1 48 GLY QA 2.885 . 3.970 3.242 2.869 3.628 . 0 0 "[ . 1 . 2]" 1 151 1 15 VAL MG1 1 49 VAL H 2.845 . 3.890 3.113 2.749 3.424 . 0 0 "[ . 1 . 2]" 1 152 1 15 VAL MG1 1 49 VAL HA 2.855 . 3.910 3.166 2.767 3.559 . 0 0 "[ . 1 . 2]" 1 153 1 15 VAL MG1 1 49 VAL HB 3.145 . 4.490 3.963 3.818 4.062 . 0 0 "[ . 1 . 2]" 1 154 1 15 VAL MG1 1 49 VAL MG2 2.370 . 2.940 1.800 1.755 1.903 0.045 18 0 "[ . 1 . 2]" 1 155 1 15 VAL MG1 1 83 HIS HA 3.255 . 4.710 4.754 4.715 4.811 0.101 4 0 "[ . 1 . 2]" 1 156 1 15 VAL MG1 1 84 MET H 2.915 . 4.030 3.795 3.702 3.914 . 0 0 "[ . 1 . 2]" 1 157 1 15 VAL MG1 1 84 MET QB 2.635 . 3.470 3.055 2.638 3.340 . 0 0 "[ . 1 . 2]" 1 158 1 15 VAL MG1 1 84 MET ME 2.130 . 2.460 1.899 1.823 2.027 . 0 0 "[ . 1 . 2]" 1 159 1 15 VAL MG1 1 84 MET QG 2.945 . 4.090 3.639 3.323 4.219 0.129 20 0 "[ . 1 . 2]" 1 160 1 15 VAL MG1 1 86 THR MG 2.735 . 3.670 3.732 3.692 3.779 0.109 11 0 "[ . 1 . 2]" 1 161 1 15 VAL MG2 1 16 LEU H 2.725 . 3.650 3.741 3.710 3.767 0.117 11 0 "[ . 1 . 2]" 1 162 1 15 VAL MG2 1 48 GLY H 3.380 . 4.960 4.509 4.148 4.773 . 0 0 "[ . 1 . 2]" 1 163 1 15 VAL MG2 1 48 GLY QA 2.885 . 3.970 2.924 2.601 3.361 . 0 0 "[ . 1 . 2]" 1 164 1 15 VAL MG2 1 49 VAL H 2.895 . 3.990 3.543 3.341 3.744 . 0 0 "[ . 1 . 2]" 1 165 1 15 VAL MG2 1 49 VAL HA 2.630 . 3.460 2.216 2.073 2.486 . 0 0 "[ . 1 . 2]" 1 166 1 15 VAL MG2 1 49 VAL HB 3.035 . 4.270 4.411 4.340 4.464 0.194 15 0 "[ . 1 . 2]" 1 167 1 15 VAL MG2 1 84 MET QB 2.810 . 3.820 3.425 3.292 3.560 . 0 0 "[ . 1 . 2]" 1 168 1 15 VAL MG2 1 84 MET ME 2.545 . 3.290 2.701 2.545 2.857 . 0 0 "[ . 1 . 2]" 1 169 1 15 VAL MG2 1 85 LYS HA 3.050 . 4.300 4.303 4.024 4.366 0.066 9 0 "[ . 1 . 2]" 1 170 1 15 VAL MG2 1 86 THR H 2.990 . 4.180 3.723 3.477 4.006 . 0 0 "[ . 1 . 2]" 1 171 1 15 VAL MG2 1 86 THR MG 2.360 . 2.920 2.382 2.305 2.497 . 0 0 "[ . 1 . 2]" 1 172 1 16 LEU H 1 16 LEU QB 2.715 . 3.630 2.491 2.415 2.529 . 0 0 "[ . 1 . 2]" 1 173 1 16 LEU H 1 16 LEU MD1 3.210 . 4.620 4.308 4.239 4.390 . 0 0 "[ . 1 . 2]" 1 174 1 16 LEU H 1 16 LEU MD2 3.035 . 4.270 4.382 4.350 4.414 0.144 19 0 "[ . 1 . 2]" 1 175 1 16 LEU H 1 16 LEU HG 3.215 . 4.630 4.368 4.301 4.414 . 0 0 "[ . 1 . 2]" 1 176 1 16 LEU H 1 17 ILE H 3.165 . 4.530 4.017 3.864 4.144 . 0 0 "[ . 1 . 2]" 1 177 1 16 LEU H 1 48 GLY QA 3.490 . 5.180 4.133 3.648 4.776 . 0 0 "[ . 1 . 2]" 1 178 1 16 LEU H 1 83 HIS HA 3.650 . 5.500 5.082 4.741 5.286 . 0 0 "[ . 1 . 2]" 1 179 1 16 LEU HA 1 16 LEU MD1 2.540 . 3.280 2.117 2.013 2.306 . 0 0 "[ . 1 . 2]" 1 180 1 16 LEU HA 1 16 LEU MD2 2.765 . 3.730 3.785 3.760 3.812 0.082 4 0 "[ . 1 . 2]" 1 181 1 16 LEU HA 1 16 LEU HG 2.900 . 4.000 2.781 2.604 2.889 . 0 0 "[ . 1 . 2]" 1 182 1 16 LEU HA 1 17 ILE H 2.615 . 3.430 2.032 1.975 2.091 . 0 0 "[ . 1 . 2]" 1 183 1 16 LEU HA 1 17 ILE HB 3.320 . 4.840 4.105 4.007 4.239 . 0 0 "[ . 1 . 2]" 1 184 1 16 LEU HA 1 82 ILE H 3.510 . 5.220 3.937 3.533 4.165 . 0 0 "[ . 1 . 2]" 1 185 1 16 LEU HA 1 83 HIS H 3.650 . 5.500 4.790 4.618 5.013 . 0 0 "[ . 1 . 2]" 1 186 1 16 LEU HA 1 83 HIS HA 2.810 . 3.820 2.769 2.591 2.917 . 0 0 "[ . 1 . 2]" 1 187 1 16 LEU HA 1 84 MET H 3.190 . 4.580 3.354 3.186 3.505 . 0 0 "[ . 1 . 2]" 1 188 1 16 LEU HA 1 84 MET ME 3.310 . 4.820 4.905 4.847 4.995 0.175 14 0 "[ . 1 . 2]" 1 189 1 16 LEU QB 1 16 LEU MD1 2.350 . 2.900 2.214 2.138 2.249 . 0 0 "[ . 1 . 2]" 1 190 1 16 LEU QB 1 16 LEU MD2 2.360 . 2.920 2.031 1.999 2.045 . 0 0 "[ . 1 . 2]" 1 191 1 16 LEU QB 1 17 ILE H 3.125 . 4.450 3.754 3.669 3.822 . 0 0 "[ . 1 . 2]" 1 192 1 16 LEU QB 1 83 HIS HA 3.285 . 4.770 3.767 3.603 4.011 . 0 0 "[ . 1 . 2]" 1 193 1 16 LEU MD1 1 17 ILE H 3.185 . 4.570 2.977 2.652 3.484 . 0 0 "[ . 1 . 2]" 1 194 1 16 LEU MD1 1 18 ARG QD 2.940 . 4.080 3.781 3.382 4.157 0.077 8 0 "[ . 1 . 2]" 1 195 1 16 LEU MD1 1 81 GLU H 3.650 . 5.500 4.785 4.655 4.949 . 0 0 "[ . 1 . 2]" 1 196 1 16 LEU MD1 1 81 GLU HA 2.635 . 3.470 3.020 2.528 3.507 0.037 14 0 "[ . 1 . 2]" 1 197 1 16 LEU MD1 1 81 GLU QB 2.285 . 2.770 1.932 1.788 2.076 0.012 8 0 "[ . 1 . 2]" 1 198 1 16 LEU MD1 1 81 GLU QG 2.585 . 3.370 3.247 2.581 3.426 0.056 8 0 "[ . 1 . 2]" 1 199 1 16 LEU MD1 1 82 ILE H 3.120 . 4.440 2.758 2.598 3.160 . 0 0 "[ . 1 . 2]" 1 200 1 16 LEU MD1 1 83 HIS H 3.565 . 5.330 3.404 3.178 3.688 . 0 0 "[ . 1 . 2]" 1 201 1 16 LEU MD1 1 83 HIS HA 2.810 . 3.820 2.504 2.354 2.743 . 0 0 "[ . 1 . 2]" 1 202 1 16 LEU MD1 1 84 MET H 3.560 . 5.320 4.027 3.815 4.209 . 0 0 "[ . 1 . 2]" 1 203 1 16 LEU MD2 1 18 ARG H 3.650 . 5.500 5.056 4.520 5.441 . 0 0 "[ . 1 . 2]" 1 204 1 16 LEU MD2 1 18 ARG QB 3.325 . 4.850 4.508 3.925 4.891 0.041 5 0 "[ . 1 . 2]" 1 205 1 16 LEU MD2 1 18 ARG QD 2.825 . 3.850 2.318 1.976 3.173 . 0 0 "[ . 1 . 2]" 1 206 1 16 LEU MD2 1 18 ARG QG 2.930 . 4.060 3.032 2.225 3.837 . 0 0 "[ . 1 . 2]" 1 207 1 16 LEU MD2 1 81 GLU HA 2.785 . 3.770 3.582 3.280 3.724 . 0 0 "[ . 1 . 2]" 1 208 1 16 LEU MD2 1 81 GLU QB 3.000 . 4.200 2.749 1.861 3.486 . 0 0 "[ . 1 . 2]" 1 209 1 16 LEU MD2 1 81 GLU QG 2.620 . 3.440 2.579 2.147 2.954 . 0 0 "[ . 1 . 2]" 1 210 1 16 LEU MD2 1 82 ILE H 2.945 . 4.090 4.235 4.189 4.279 0.189 15 0 "[ . 1 . 2]" 1 211 1 16 LEU MD2 1 83 HIS HD1 3.180 . 4.560 4.204 3.761 4.585 0.025 20 0 "[ . 1 . 2]" 1 212 1 16 LEU HG 1 17 ILE H 3.020 . 4.240 3.028 2.775 3.176 . 0 0 "[ . 1 . 2]" 1 213 1 16 LEU HG 1 18 ARG QD 3.160 . 4.520 3.048 2.209 4.080 . 0 0 "[ . 1 . 2]" 1 214 1 16 LEU HG 1 81 GLU HA 3.325 . 4.850 3.349 3.060 3.676 . 0 0 "[ . 1 . 2]" 1 215 1 16 LEU HG 1 81 GLU QG 3.210 . 4.620 3.816 3.460 4.278 . 0 0 "[ . 1 . 2]" 1 216 1 16 LEU HG 1 82 ILE H 3.650 . 5.500 3.181 2.810 3.364 . 0 0 "[ . 1 . 2]" 1 217 1 17 ILE H 1 17 ILE HB 2.755 . 3.710 2.304 2.178 2.503 . 0 0 "[ . 1 . 2]" 1 218 1 17 ILE H 1 17 ILE QG 2.940 . 4.080 3.619 3.226 4.082 0.002 15 0 "[ . 1 . 2]" 1 219 1 17 ILE H 1 17 ILE MG 2.880 . 3.960 3.043 2.163 3.506 . 0 0 "[ . 1 . 2]" 1 220 1 17 ILE H 1 18 ARG H 3.650 . 5.500 4.387 4.278 4.502 . 0 0 "[ . 1 . 2]" 1 221 1 17 ILE H 1 82 ILE H 3.005 . 4.210 2.880 2.584 3.185 . 0 0 "[ . 1 . 2]" 1 222 1 17 ILE H 1 82 ILE HB 3.070 . 4.340 2.908 2.696 3.023 . 0 0 "[ . 1 . 2]" 1 223 1 17 ILE H 1 82 ILE MD 3.230 . 4.660 4.592 4.455 4.670 0.010 9 0 "[ . 1 . 2]" 1 224 1 17 ILE H 1 82 ILE QG 3.415 . 5.030 4.564 4.421 4.745 . 0 0 "[ . 1 . 2]" 1 225 1 17 ILE H 1 82 ILE MG 2.910 . 4.020 3.872 3.602 4.049 0.029 6 0 "[ . 1 . 2]" 1 226 1 17 ILE H 1 83 HIS H 3.650 . 5.500 4.994 4.858 5.144 . 0 0 "[ . 1 . 2]" 1 227 1 17 ILE H 1 83 HIS HA 3.515 . 5.230 4.019 3.825 4.273 . 0 0 "[ . 1 . 2]" 1 228 1 17 ILE HA 1 17 ILE MD 2.510 . 3.220 2.218 1.889 2.792 . 0 0 "[ . 1 . 2]" 1 229 1 17 ILE HA 1 17 ILE QG 2.855 . 3.910 2.429 2.314 2.567 . 0 0 "[ . 1 . 2]" 1 230 1 17 ILE HA 1 17 ILE MG 2.915 . 4.030 2.957 2.763 3.232 . 0 0 "[ . 1 . 2]" 1 231 1 17 ILE HA 1 18 ARG H 2.605 . 3.410 2.119 2.037 2.199 . 0 0 "[ . 1 . 2]" 1 232 1 17 ILE HA 1 18 ARG QB 3.070 . 4.340 4.256 4.034 4.373 0.033 10 0 "[ . 1 . 2]" 1 233 1 17 ILE HA 1 43 ILE MG 3.275 . 4.750 4.825 4.682 4.885 0.135 13 0 "[ . 1 . 2]" 1 234 1 17 ILE HB 1 18 ARG H 3.500 . 5.200 4.412 4.330 4.533 . 0 0 "[ . 1 . 2]" 1 235 1 17 ILE HB 1 49 VAL MG2 3.370 . 4.940 4.260 3.143 5.009 0.069 11 0 "[ . 1 . 2]" 1 236 1 17 ILE HB 1 82 ILE H 3.130 . 4.460 4.141 3.517 4.717 0.257 8 0 "[ . 1 . 2]" 1 237 1 17 ILE MD 1 18 ARG H 2.655 . 3.510 2.500 2.004 2.907 . 0 0 "[ . 1 . 2]" 1 238 1 17 ILE MD 1 18 ARG QB 3.395 . 4.990 4.273 3.757 4.726 . 0 0 "[ . 1 . 2]" 1 239 1 17 ILE MD 1 19 ARG H 3.150 . 4.500 4.399 3.648 4.639 0.139 1 0 "[ . 1 . 2]" 1 240 1 17 ILE MD 1 19 ARG HA 3.200 . 4.600 4.087 3.453 4.456 . 0 0 "[ . 1 . 2]" 1 241 1 17 ILE MD 1 19 ARG QB 2.790 . 3.780 3.342 2.831 3.779 . 0 0 "[ . 1 . 2]" 1 242 1 17 ILE MD 1 19 ARG QD 3.345 . 4.890 4.458 3.769 4.914 0.024 15 0 "[ . 1 . 2]" 1 243 1 17 ILE MD 1 43 ILE H 3.225 . 4.650 4.342 4.132 4.521 . 0 0 "[ . 1 . 2]" 1 244 1 17 ILE MD 1 43 ILE HA 3.300 . 4.800 3.732 3.552 3.903 . 0 0 "[ . 1 . 2]" 1 245 1 17 ILE MD 1 43 ILE HB 2.690 . 3.580 1.986 1.797 2.138 0.003 15 0 "[ . 1 . 2]" 1 246 1 17 ILE MD 1 43 ILE MD 2.370 . 2.940 2.475 2.229 2.768 . 0 0 "[ . 1 . 2]" 1 247 1 17 ILE MD 1 43 ILE QG 2.310 . 2.820 2.666 2.290 2.857 0.037 18 0 "[ . 1 . 2]" 1 248 1 17 ILE MD 1 43 ILE MG 2.525 . 3.250 3.161 2.901 3.325 0.075 12 0 "[ . 1 . 2]" 1 249 1 17 ILE MD 1 44 ALA H 3.220 . 4.640 2.982 2.762 3.357 . 0 0 "[ . 1 . 2]" 1 250 1 17 ILE MD 1 44 ALA HA 2.580 . 3.360 2.205 1.865 2.962 . 0 0 "[ . 1 . 2]" 1 251 1 17 ILE MD 1 47 GLY H 3.205 . 4.610 3.667 2.768 4.552 . 0 0 "[ . 1 . 2]" 1 252 1 17 ILE MD 1 47 GLY QA 2.780 . 3.760 3.028 2.302 3.807 0.047 14 0 "[ . 1 . 2]" 1 253 1 17 ILE MD 1 49 VAL MG2 2.910 . 4.020 3.651 3.176 4.120 0.100 16 0 "[ . 1 . 2]" 1 254 1 17 ILE QG 1 17 ILE MG 2.310 . 2.820 2.296 2.212 2.330 . 0 0 "[ . 1 . 2]" 1 255 1 17 ILE QG 1 18 ARG H 3.650 . 5.500 3.907 3.378 4.295 . 0 0 "[ . 1 . 2]" 1 256 1 17 ILE QG 1 44 ALA HA 2.840 . 3.880 2.524 1.923 3.066 . 0 0 "[ . 1 . 2]" 1 257 1 17 ILE QG 1 47 GLY H 3.640 . 5.480 4.068 3.214 4.698 . 0 0 "[ . 1 . 2]" 1 258 1 17 ILE QG 1 47 GLY QA 3.405 . 5.010 2.712 2.433 3.002 . 0 0 "[ . 1 . 2]" 1 259 1 17 ILE QG 1 49 VAL MG2 3.110 . 4.420 2.819 2.464 3.096 . 0 0 "[ . 1 . 2]" 1 260 1 17 ILE MG 1 18 ARG H 3.255 . 4.710 3.133 2.781 3.886 . 0 0 "[ . 1 . 2]" 1 261 1 17 ILE MG 1 19 ARG H 3.430 . 5.060 3.156 2.628 4.360 . 0 0 "[ . 1 . 2]" 1 262 1 17 ILE MG 1 19 ARG QB 3.045 . 4.290 2.558 2.152 3.491 . 0 0 "[ . 1 . 2]" 1 263 1 17 ILE MG 1 43 ILE HB 3.225 . 4.650 3.814 3.102 4.711 0.061 8 0 "[ . 1 . 2]" 1 264 1 17 ILE MG 1 47 GLY QA 3.160 . 4.520 4.565 4.246 4.656 0.136 5 0 "[ . 1 . 2]" 1 265 1 17 ILE MG 1 81 GLU HA 3.195 . 4.590 4.318 3.900 4.584 . 0 0 "[ . 1 . 2]" 1 266 1 18 ARG H 1 18 ARG QB 2.680 . 3.560 2.445 2.287 2.531 . 0 0 "[ . 1 . 2]" 1 267 1 18 ARG H 1 18 ARG QD 3.110 . 4.420 3.585 2.476 4.431 0.011 12 0 "[ . 1 . 2]" 1 268 1 18 ARG H 1 18 ARG QG 3.070 . 4.340 3.418 2.802 3.975 . 0 0 "[ . 1 . 2]" 1 269 1 18 ARG H 1 19 ARG H 3.650 . 5.500 3.981 3.823 4.337 . 0 0 "[ . 1 . 2]" 1 270 1 18 ARG H 1 43 ILE HB 3.650 . 5.500 3.648 3.214 4.331 . 0 0 "[ . 1 . 2]" 1 271 1 18 ARG H 1 43 ILE MD 3.260 . 4.720 4.405 4.112 4.686 . 0 0 "[ . 1 . 2]" 1 272 1 18 ARG H 1 43 ILE MG 3.110 . 4.420 3.651 3.409 4.095 . 0 0 "[ . 1 . 2]" 1 273 1 18 ARG H 1 47 GLY H 3.650 . 5.500 5.314 4.752 5.564 0.064 19 0 "[ . 1 . 2]" 1 274 1 18 ARG H 1 82 ILE H 3.650 . 5.500 4.829 4.713 4.998 . 0 0 "[ . 1 . 2]" 1 275 1 18 ARG HA 1 18 ARG QD 3.275 . 4.750 3.210 2.111 4.104 . 0 0 "[ . 1 . 2]" 1 276 1 18 ARG HA 1 18 ARG QG 3.040 . 4.280 2.410 2.232 2.770 . 0 0 "[ . 1 . 2]" 1 277 1 18 ARG HA 1 80 GLY H 3.650 . 5.500 4.468 4.120 4.755 . 0 0 "[ . 1 . 2]" 1 278 1 18 ARG HA 1 81 GLU H 3.650 . 5.500 4.477 4.193 4.774 . 0 0 "[ . 1 . 2]" 1 279 1 18 ARG HA 1 82 ILE H 3.160 . 4.520 3.482 3.112 3.771 . 0 0 "[ . 1 . 2]" 1 280 1 18 ARG QB 1 18 ARG QD 2.515 . 3.230 2.577 2.246 2.923 . 0 0 "[ . 1 . 2]" 1 281 1 18 ARG QB 1 18 ARG QG 2.370 . 2.940 2.033 1.976 2.088 . 0 0 "[ . 1 . 2]" 1 282 1 18 ARG QB 1 19 ARG H 3.105 . 4.410 3.455 3.225 3.615 . 0 0 "[ . 1 . 2]" 1 283 1 18 ARG QB 1 80 GLY QA 3.395 . 4.990 4.698 3.980 5.039 0.049 3 0 "[ . 1 . 2]" 1 284 1 18 ARG QD 1 19 ARG H 3.650 . 5.500 4.893 3.727 5.604 0.104 4 0 "[ . 1 . 2]" 1 285 1 18 ARG QD 1 81 GLU H 3.650 . 5.500 5.154 2.963 5.602 0.102 4 0 "[ . 1 . 2]" 1 286 1 18 ARG QD 1 81 GLU HA 3.210 . 4.620 3.311 2.062 3.973 . 0 0 "[ . 1 . 2]" 1 287 1 18 ARG QD 1 81 GLU QG 3.055 . 4.310 2.482 1.960 3.034 . 0 0 "[ . 1 . 2]" 1 288 1 18 ARG QG 1 19 ARG H 3.470 . 5.140 4.045 3.738 4.533 . 0 0 "[ . 1 . 2]" 1 289 1 18 ARG QG 1 80 GLY QA 3.530 . 5.260 4.633 4.224 5.069 . 0 0 "[ . 1 . 2]" 1 290 1 18 ARG QG 1 81 GLU H 3.305 . 4.810 4.401 3.899 4.977 0.167 11 0 "[ . 1 . 2]" 1 291 1 18 ARG QG 1 81 GLU HA 3.065 . 4.330 2.742 2.012 3.762 . 0 0 "[ . 1 . 2]" 1 292 1 18 ARG QG 1 81 GLU QG 2.955 . 4.110 2.326 1.985 3.532 . 0 0 "[ . 1 . 2]" 1 293 1 18 ARG QG 1 82 ILE H 3.625 . 5.450 4.161 3.332 5.219 . 0 0 "[ . 1 . 2]" 1 294 1 19 ARG H 1 20 PRO QD 3.520 . 5.240 4.001 3.800 4.183 . 0 0 "[ . 1 . 2]" 1 295 1 19 ARG H 1 43 ILE MD 3.240 . 4.680 4.461 4.140 4.704 0.024 8 0 "[ . 1 . 2]" 1 296 1 19 ARG H 1 79 VAL HA 3.385 . 4.970 4.101 3.831 4.285 . 0 0 "[ . 1 . 2]" 1 297 1 19 ARG H 1 79 VAL HB 3.410 . 5.020 4.724 4.461 4.919 . 0 0 "[ . 1 . 2]" 1 298 1 19 ARG H 1 80 GLY H 3.060 . 4.320 2.839 2.688 2.972 . 0 0 "[ . 1 . 2]" 1 299 1 19 ARG H 1 80 GLY QA 3.580 . 5.360 3.406 3.070 3.791 . 0 0 "[ . 1 . 2]" 1 300 1 19 ARG H 1 82 ILE H 3.650 . 5.500 4.304 3.971 4.539 . 0 0 "[ . 1 . 2]" 1 301 1 19 ARG H 1 82 ILE MD 3.085 . 4.370 3.606 3.444 3.823 . 0 0 "[ . 1 . 2]" 1 302 1 19 ARG HA 1 19 ARG HE 3.650 . 5.500 4.776 4.172 5.055 . 0 0 "[ . 1 . 2]" 1 303 1 19 ARG HA 1 19 ARG QG 3.000 . 4.200 2.476 2.399 2.587 . 0 0 "[ . 1 . 2]" 1 304 1 19 ARG HA 1 20 PRO QD 2.675 . 3.550 1.993 1.939 2.061 . 0 0 "[ . 1 . 2]" 1 305 1 19 ARG HA 1 20 PRO QG 3.255 . 4.710 3.889 3.831 3.956 . 0 0 "[ . 1 . 2]" 1 306 1 19 ARG HA 1 43 ILE MD 2.705 . 3.610 2.544 2.348 2.922 . 0 0 "[ . 1 . 2]" 1 307 1 19 ARG HA 1 43 ILE MG 3.340 . 4.880 3.241 2.696 3.942 . 0 0 "[ . 1 . 2]" 1 308 1 19 ARG HA 1 80 GLY H 3.620 . 5.440 4.242 4.062 4.400 . 0 0 "[ . 1 . 2]" 1 309 1 19 ARG HA 1 82 ILE MD 3.260 . 4.720 4.775 4.688 4.827 0.107 6 0 "[ . 1 . 2]" 1 310 1 19 ARG QB 1 19 ARG QD 3.035 . 4.270 2.101 2.056 2.254 . 0 0 "[ . 1 . 2]" 1 311 1 19 ARG QB 1 19 ARG HE 3.355 . 4.910 3.707 2.679 3.851 . 0 0 "[ . 1 . 2]" 1 312 1 19 ARG QB 1 21 ASP H 3.650 . 5.500 4.415 4.106 4.730 . 0 0 "[ . 1 . 2]" 1 313 1 19 ARG QB 1 43 ILE MD 2.845 . 3.890 2.790 2.323 3.192 . 0 0 "[ . 1 . 2]" 1 314 1 19 ARG QB 1 79 VAL HA 2.950 . 4.100 2.001 1.905 2.253 . 0 0 "[ . 1 . 2]" 1 315 1 19 ARG QB 1 80 GLY H 3.165 . 4.530 2.359 2.080 2.616 . 0 0 "[ . 1 . 2]" 1 316 1 19 ARG QB 1 82 ILE MD 2.690 . 3.580 2.469 2.410 2.535 . 0 0 "[ . 1 . 2]" 1 317 1 19 ARG QD 1 22 LEU HA 3.225 . 4.650 3.922 2.347 4.337 . 0 0 "[ . 1 . 2]" 1 318 1 19 ARG QD 1 22 LEU MD2 2.765 . 3.730 3.227 1.856 3.689 . 0 0 "[ . 1 . 2]" 1 319 1 19 ARG QD 1 24 TYR H 3.650 . 5.500 5.117 4.336 5.437 . 0 0 "[ . 1 . 2]" 1 320 1 19 ARG QD 1 26 LEU MD1 3.175 . 4.550 2.579 2.213 4.122 . 0 0 "[ . 1 . 2]" 1 321 1 19 ARG QD 1 78 ALA H 3.650 . 5.500 4.547 4.264 4.955 . 0 0 "[ . 1 . 2]" 1 322 1 19 ARG QD 1 79 VAL HA 2.820 . 3.840 1.961 1.854 2.238 . 0 0 "[ . 1 . 2]" 1 323 1 19 ARG QD 1 79 VAL HB 3.405 . 5.010 2.922 2.582 3.079 . 0 0 "[ . 1 . 2]" 1 324 1 19 ARG QD 1 79 VAL MG1 2.880 . 3.960 2.258 1.910 2.478 . 0 0 "[ . 1 . 2]" 1 325 1 19 ARG QD 1 79 VAL MG2 2.980 . 4.160 4.123 3.822 4.207 0.047 7 0 "[ . 1 . 2]" 1 326 1 19 ARG QD 1 80 GLY H 3.650 . 5.500 4.015 3.780 4.286 . 0 0 "[ . 1 . 2]" 1 327 1 19 ARG QD 1 82 ILE MD 2.755 . 3.710 2.735 2.541 3.041 . 0 0 "[ . 1 . 2]" 1 328 1 19 ARG HE 1 22 LEU HA 3.025 . 4.250 2.760 2.259 3.675 . 0 0 "[ . 1 . 2]" 1 329 1 19 ARG HE 1 22 LEU MD2 2.715 . 3.630 3.343 2.999 3.734 0.104 15 0 "[ . 1 . 2]" 1 330 1 19 ARG HE 1 24 TYR H 3.090 . 4.380 3.373 3.045 4.431 0.051 15 0 "[ . 1 . 2]" 1 331 1 19 ARG HE 1 24 TYR QB 3.130 . 4.460 3.161 2.883 3.714 . 0 0 "[ . 1 . 2]" 1 332 1 19 ARG HE 1 25 GLN HA 3.650 . 5.500 3.403 2.683 4.133 . 0 0 "[ . 1 . 2]" 1 333 1 19 ARG HE 1 43 ILE MD 3.145 . 4.490 4.016 3.328 4.502 0.012 7 0 "[ . 1 . 2]" 1 334 1 19 ARG HE 1 79 VAL HA 3.100 . 4.400 4.494 4.445 4.552 0.152 8 0 "[ . 1 . 2]" 1 335 1 19 ARG QG 1 21 ASP H 2.875 . 3.950 2.620 2.216 2.952 . 0 0 "[ . 1 . 2]" 1 336 1 19 ARG QG 1 22 LEU HA 3.460 . 5.120 3.950 3.516 4.290 . 0 0 "[ . 1 . 2]" 1 337 1 19 ARG QG 1 22 LEU MD2 3.095 . 4.390 3.801 3.464 4.029 . 0 0 "[ . 1 . 2]" 1 338 1 19 ARG QG 1 24 TYR H 3.465 . 5.130 3.879 3.486 4.154 . 0 0 "[ . 1 . 2]" 1 339 1 19 ARG QG 1 24 TYR QB 3.065 . 4.330 2.461 2.162 2.764 . 0 0 "[ . 1 . 2]" 1 340 1 19 ARG QG 1 79 VAL H 3.650 . 5.500 5.165 5.079 5.318 . 0 0 "[ . 1 . 2]" 1 341 1 19 ARG QG 1 79 VAL HA 2.885 . 3.970 2.799 2.696 2.950 . 0 0 "[ . 1 . 2]" 1 342 1 19 ARG QG 1 79 VAL HB 3.115 . 4.430 1.994 1.965 2.034 . 0 0 "[ . 1 . 2]" 1 343 1 19 ARG QG 1 79 VAL MG1 2.465 . 3.130 2.682 2.334 2.956 . 0 0 "[ . 1 . 2]" 1 344 1 19 ARG QG 1 79 VAL MG2 2.620 . 3.440 3.561 3.485 3.588 0.148 12 0 "[ . 1 . 2]" 1 345 1 19 ARG QG 1 80 GLY H 3.455 . 5.110 3.266 3.046 3.473 . 0 0 "[ . 1 . 2]" 1 346 1 20 PRO HA 1 80 GLY H 3.190 . 4.580 4.370 4.144 4.587 0.007 13 0 "[ . 1 . 2]" 1 347 1 20 PRO QB 1 21 ASP H 3.035 . 4.270 2.433 2.187 2.824 . 0 0 "[ . 1 . 2]" 1 348 1 20 PRO QB 1 24 TYR QD 3.395 . 4.990 2.937 2.702 3.293 . 0 0 "[ . 1 . 2]" 1 349 1 20 PRO QB 1 24 TYR QE 3.090 . 4.380 3.091 2.595 3.662 . 0 0 "[ . 1 . 2]" 1 350 1 20 PRO QD 1 21 ASP H 3.340 . 4.880 2.794 2.618 3.031 . 0 0 "[ . 1 . 2]" 1 351 1 20 PRO QD 1 24 TYR QD 3.510 . 5.220 3.084 2.875 3.394 . 0 0 "[ . 1 . 2]" 1 352 1 20 PRO QD 1 43 ILE MD 3.025 . 4.250 2.730 2.303 3.314 . 0 0 "[ . 1 . 2]" 1 353 1 20 PRO QD 1 43 ILE MG 3.370 . 4.940 2.870 2.503 3.585 . 0 0 "[ . 1 . 2]" 1 354 1 20 PRO QG 1 21 ASP H 3.010 . 4.220 3.784 3.668 3.966 . 0 0 "[ . 1 . 2]" 1 355 1 20 PRO QG 1 24 TYR QD 3.345 . 4.890 3.260 3.004 3.592 . 0 0 "[ . 1 . 2]" 1 356 1 21 ASP H 1 22 LEU H 3.620 . 5.440 4.284 4.227 4.352 . 0 0 "[ . 1 . 2]" 1 357 1 21 ASP H 1 23 ARG H 3.495 . 5.190 4.372 4.158 4.582 . 0 0 "[ . 1 . 2]" 1 358 1 21 ASP H 1 24 TYR H 3.550 . 5.300 3.595 3.426 3.722 . 0 0 "[ . 1 . 2]" 1 359 1 21 ASP H 1 24 TYR HA 3.650 . 5.500 5.437 5.071 5.592 0.092 8 0 "[ . 1 . 2]" 1 360 1 21 ASP H 1 24 TYR QB 3.135 . 4.470 2.616 2.115 2.843 . 0 0 "[ . 1 . 2]" 1 361 1 21 ASP H 1 24 TYR QD 2.950 . 4.100 3.018 2.491 3.566 . 0 0 "[ . 1 . 2]" 1 362 1 21 ASP H 1 24 TYR QE 3.515 . 5.230 4.620 3.962 5.235 0.005 4 0 "[ . 1 . 2]" 1 363 1 21 ASP H 1 79 VAL MG1 2.895 . 3.990 3.971 3.685 4.065 0.075 15 0 "[ . 1 . 2]" 1 364 1 21 ASP H 1 79 VAL MG2 2.985 . 4.170 4.221 4.184 4.281 0.111 8 0 "[ . 1 . 2]" 1 365 1 21 ASP H 1 80 GLY H 3.650 . 5.500 4.918 4.682 5.190 . 0 0 "[ . 1 . 2]" 1 366 1 21 ASP HA 1 22 LEU H 2.530 . 3.260 2.668 2.539 2.759 . 0 0 "[ . 1 . 2]" 1 367 1 21 ASP HA 1 22 LEU HA 3.175 . 4.550 4.235 4.168 4.416 . 0 0 "[ . 1 . 2]" 1 368 1 21 ASP HA 1 22 LEU MD2 3.120 . 4.440 3.814 3.640 3.977 . 0 0 "[ . 1 . 2]" 1 369 1 21 ASP HA 1 22 LEU HG 2.865 . 3.930 3.888 3.636 3.991 0.061 13 0 "[ . 1 . 2]" 1 370 1 21 ASP HA 1 23 ARG H 3.400 . 5.000 4.360 4.016 4.528 . 0 0 "[ . 1 . 2]" 1 371 1 21 ASP HA 1 24 TYR H 3.650 . 5.500 4.909 4.657 5.045 . 0 0 "[ . 1 . 2]" 1 372 1 21 ASP HA 1 24 TYR QD 3.650 . 5.500 4.988 4.468 5.506 0.006 4 0 "[ . 1 . 2]" 1 373 1 21 ASP HA 1 79 VAL HB 2.950 . 4.100 2.782 2.311 3.097 . 0 0 "[ . 1 . 2]" 1 374 1 21 ASP HA 1 79 VAL MG1 2.465 . 3.130 2.203 2.006 2.384 . 0 0 "[ . 1 . 2]" 1 375 1 21 ASP HA 1 79 VAL MG2 2.500 . 3.200 2.422 2.123 2.673 . 0 0 "[ . 1 . 2]" 1 376 1 21 ASP QB 1 22 LEU H 2.705 . 3.610 2.261 1.916 3.023 . 0 0 "[ . 1 . 2]" 1 377 1 21 ASP QB 1 22 LEU HG 3.155 . 4.510 4.087 3.642 4.644 0.134 19 0 "[ . 1 . 2]" 1 378 1 21 ASP QB 1 23 ARG H 3.100 . 4.400 3.132 2.188 3.521 . 0 0 "[ . 1 . 2]" 1 379 1 21 ASP QB 1 24 TYR QD 3.450 . 5.100 3.834 2.302 4.483 . 0 0 "[ . 1 . 2]" 1 380 1 21 ASP QB 1 79 VAL MG1 3.120 . 4.440 3.690 3.249 4.193 . 0 0 "[ . 1 . 2]" 1 381 1 22 LEU H 1 22 LEU QB 2.700 . 3.600 2.392 2.315 2.443 . 0 0 "[ . 1 . 2]" 1 382 1 22 LEU H 1 22 LEU MD1 2.755 . 3.710 3.695 3.479 3.755 0.045 1 0 "[ . 1 . 2]" 1 383 1 22 LEU H 1 22 LEU MD2 2.725 . 3.650 3.097 2.962 3.301 . 0 0 "[ . 1 . 2]" 1 384 1 22 LEU H 1 22 LEU HG 2.595 . 3.390 2.309 1.979 2.486 . 0 0 "[ . 1 . 2]" 1 385 1 22 LEU H 1 23 ARG H 2.850 . 3.900 2.569 2.229 2.804 . 0 0 "[ . 1 . 2]" 1 386 1 22 LEU H 1 24 TYR H 3.590 . 5.380 4.133 3.820 4.327 . 0 0 "[ . 1 . 2]" 1 387 1 22 LEU H 1 79 VAL MG1 2.775 . 3.750 2.982 2.767 3.140 . 0 0 "[ . 1 . 2]" 1 388 1 22 LEU HA 1 22 LEU MD1 2.705 . 3.610 3.706 3.677 3.747 0.137 6 0 "[ . 1 . 2]" 1 389 1 22 LEU HA 1 22 LEU MD2 2.230 . 2.660 1.870 1.794 1.986 0.006 15 0 "[ . 1 . 2]" 1 390 1 22 LEU HA 1 22 LEU HG 2.720 . 3.640 3.117 3.035 3.186 . 0 0 "[ . 1 . 2]" 1 391 1 22 LEU HA 1 24 TYR H 3.125 . 4.450 3.451 3.332 3.569 . 0 0 "[ . 1 . 2]" 1 392 1 22 LEU HA 1 79 VAL MG1 2.795 . 3.790 3.005 2.711 3.318 . 0 0 "[ . 1 . 2]" 1 393 1 22 LEU QB 1 22 LEU MD1 2.515 . 3.230 2.056 2.040 2.067 . 0 0 "[ . 1 . 2]" 1 394 1 22 LEU QB 1 22 LEU MD2 2.625 . 3.450 2.336 2.268 2.375 . 0 0 "[ . 1 . 2]" 1 395 1 22 LEU QB 1 23 ARG H 2.680 . 3.560 3.093 2.772 3.311 . 0 0 "[ . 1 . 2]" 1 396 1 22 LEU MD1 1 23 ARG H 3.535 . 5.270 5.016 4.655 5.215 . 0 0 "[ . 1 . 2]" 1 397 1 22 LEU MD1 1 77 ASN QB 3.315 . 4.830 3.977 3.102 4.555 . 0 0 "[ . 1 . 2]" 1 398 1 22 LEU MD1 1 77 ASN QD 3.650 . 5.500 4.502 3.405 5.072 . 0 0 "[ . 1 . 2]" 1 399 1 22 LEU MD2 1 23 ARG H 3.100 . 4.400 4.474 4.388 4.516 0.116 12 0 "[ . 1 . 2]" 1 400 1 22 LEU MD2 1 24 TYR H 3.235 . 4.670 4.765 4.685 4.803 0.133 7 0 "[ . 1 . 2]" 1 401 1 22 LEU MD2 1 77 ASN H 3.400 . 5.000 4.295 3.954 4.494 . 0 0 "[ . 1 . 2]" 1 402 1 22 LEU MD2 1 77 ASN HA 2.665 . 3.530 2.381 2.041 2.803 . 0 0 "[ . 1 . 2]" 1 403 1 22 LEU MD2 1 77 ASN QB 3.180 . 4.560 3.845 3.377 4.296 . 0 0 "[ . 1 . 2]" 1 404 1 22 LEU MD2 1 78 ALA H 2.900 . 4.000 3.838 3.387 4.026 0.026 18 0 "[ . 1 . 2]" 1 405 1 22 LEU MD2 1 78 ALA HA 2.860 . 3.920 4.048 3.984 4.107 0.187 16 0 "[ . 1 . 2]" 1 406 1 22 LEU MD2 1 79 VAL HB 2.680 . 3.560 3.716 3.621 3.790 0.230 7 0 "[ . 1 . 2]" 1 407 1 23 ARG H 1 23 ARG QB 2.660 . 3.520 2.437 2.283 2.565 . 0 0 "[ . 1 . 2]" 1 408 1 23 ARG H 1 23 ARG QD 3.290 . 4.780 3.485 1.834 4.252 . 0 0 "[ . 1 . 2]" 1 409 1 23 ARG H 1 23 ARG QG 2.600 . 3.400 2.630 1.901 3.511 0.111 16 0 "[ . 1 . 2]" 1 410 1 23 ARG H 1 24 TYR H 2.610 . 3.420 2.445 2.238 2.648 . 0 0 "[ . 1 . 2]" 1 411 1 23 ARG H 1 24 TYR HA 3.650 . 5.500 5.087 4.925 5.309 . 0 0 "[ . 1 . 2]" 1 412 1 23 ARG H 1 24 TYR QD 3.205 . 4.610 3.535 3.293 3.747 . 0 0 "[ . 1 . 2]" 1 413 1 23 ARG H 1 24 TYR QE 3.650 . 5.500 5.294 4.896 5.530 0.030 4 0 "[ . 1 . 2]" 1 414 1 23 ARG HA 1 23 ARG QD 2.915 . 4.030 3.167 1.908 4.055 0.025 9 0 "[ . 1 . 2]" 1 415 1 23 ARG HA 1 23 ARG QG 2.500 . 3.200 2.597 2.224 3.063 . 0 0 "[ . 1 . 2]" 1 416 1 23 ARG HA 1 24 TYR QD 3.560 . 5.320 4.867 4.620 5.063 . 0 0 "[ . 1 . 2]" 1 417 1 23 ARG QB 1 23 ARG QD 2.505 . 3.210 2.276 2.064 2.424 . 0 0 "[ . 1 . 2]" 1 418 1 23 ARG QB 1 24 TYR H 3.080 . 4.360 3.140 2.733 3.336 . 0 0 "[ . 1 . 2]" 1 419 1 23 ARG QB 1 24 TYR HA 3.265 . 4.730 4.132 3.869 4.249 . 0 0 "[ . 1 . 2]" 1 420 1 23 ARG QB 1 24 TYR QD 3.475 . 5.150 2.917 2.269 3.442 . 0 0 "[ . 1 . 2]" 1 421 1 23 ARG QD 1 23 ARG QG 2.375 . 2.950 2.064 1.986 2.101 . 0 0 "[ . 1 . 2]" 1 422 1 23 ARG QG 1 24 TYR QD 3.460 . 5.120 4.713 4.082 5.139 0.019 11 0 "[ . 1 . 2]" 1 423 1 24 TYR H 1 24 TYR QB 2.690 . 3.580 2.353 2.276 2.471 . 0 0 "[ . 1 . 2]" 1 424 1 24 TYR H 1 24 TYR QD 2.745 . 3.690 2.580 2.309 2.804 . 0 0 "[ . 1 . 2]" 1 425 1 24 TYR H 1 24 TYR QE 3.505 . 5.210 4.835 4.549 4.995 . 0 0 "[ . 1 . 2]" 1 426 1 24 TYR H 1 25 GLN H 3.440 . 5.080 4.023 2.241 4.385 . 0 0 "[ . 1 . 2]" 1 427 1 24 TYR H 1 25 GLN QG 3.650 . 5.500 4.965 4.166 5.654 0.154 18 0 "[ . 1 . 2]" 1 428 1 24 TYR H 1 43 ILE MD 3.400 . 5.000 4.914 4.429 5.073 0.073 4 0 "[ . 1 . 2]" 1 429 1 24 TYR HA 1 24 TYR QD 3.075 . 4.350 3.125 3.035 3.230 . 0 0 "[ . 1 . 2]" 1 430 1 24 TYR HA 1 25 GLN H 2.600 . 3.400 2.300 2.088 3.370 . 0 0 "[ . 1 . 2]" 1 431 1 24 TYR HA 1 25 GLN QG 3.105 . 4.410 3.976 3.546 4.451 0.041 10 0 "[ . 1 . 2]" 1 432 1 24 TYR HA 1 43 ILE MD 3.140 . 4.480 4.056 3.581 4.476 . 0 0 "[ . 1 . 2]" 1 433 1 24 TYR QB 1 25 GLN H 3.350 . 4.900 3.279 2.574 3.702 . 0 0 "[ . 1 . 2]" 1 434 1 24 TYR QB 1 43 ILE MD 2.695 . 3.590 2.221 1.850 2.552 . 0 0 "[ . 1 . 2]" 1 435 1 24 TYR QB 1 43 ILE MG 3.405 . 5.010 3.768 3.146 4.447 . 0 0 "[ . 1 . 2]" 1 436 1 24 TYR QD 1 25 GLN H 3.650 . 5.500 4.435 3.942 4.885 . 0 0 "[ . 1 . 2]" 1 437 1 24 TYR QD 1 43 ILE MD 2.910 . 4.020 3.103 2.555 3.980 . 0 0 "[ . 1 . 2]" 1 438 1 24 TYR QD 1 43 ILE MG 3.025 . 4.250 3.533 3.001 4.078 . 0 0 "[ . 1 . 2]" 1 439 1 24 TYR QE 1 43 ILE MG 3.225 . 4.650 4.562 4.153 4.704 0.054 1 0 "[ . 1 . 2]" 1 440 1 25 GLN H 1 25 GLN QB 2.810 . 3.820 2.702 2.340 3.235 . 0 0 "[ . 1 . 2]" 1 441 1 25 GLN H 1 25 GLN QG 2.750 . 3.700 2.473 1.801 3.190 . 0 0 "[ . 1 . 2]" 1 442 1 25 GLN H 1 26 LEU MD2 3.650 . 5.500 5.329 4.992 5.517 0.017 19 0 "[ . 1 . 2]" 1 443 1 25 GLN H 1 43 ILE MD 3.650 . 5.500 3.810 3.083 4.218 . 0 0 "[ . 1 . 2]" 1 444 1 25 GLN HA 1 25 GLN QE 3.650 . 5.500 3.967 3.423 4.208 . 0 0 "[ . 1 . 2]" 1 445 1 25 GLN HA 1 25 GLN QG 2.585 . 3.370 2.775 2.165 3.344 . 0 0 "[ . 1 . 2]" 1 446 1 25 GLN HA 1 26 LEU MD1 2.915 . 4.030 3.446 2.749 3.858 . 0 0 "[ . 1 . 2]" 1 447 1 25 GLN HA 1 26 LEU MD2 3.010 . 4.220 3.096 2.870 3.308 . 0 0 "[ . 1 . 2]" 1 448 1 25 GLN QB 1 25 GLN QE 3.650 . 5.500 2.316 1.771 3.405 0.029 7 0 "[ . 1 . 2]" 1 449 1 25 GLN QB 1 25 GLN QG 2.380 . 2.960 2.049 1.977 2.092 . 0 0 "[ . 1 . 2]" 1 450 1 25 GLN QE 1 26 LEU MD1 3.650 . 5.500 5.233 4.386 5.525 0.025 11 0 "[ . 1 . 2]" 1 451 1 25 GLN QE 1 26 LEU MD2 2.655 . 3.510 3.447 2.664 3.619 0.109 6 0 "[ . 1 . 2]" 1 452 1 25 GLN QG 1 26 LEU MD1 3.430 . 5.060 5.038 4.542 5.209 0.149 4 0 "[ . 1 . 2]" 1 453 1 26 LEU H 1 27 GLY QA 3.230 . 4.660 4.465 3.939 4.690 0.030 5 0 "[ . 1 . 2]" 1 454 1 26 LEU HA 1 26 LEU HG 2.920 . 4.040 3.802 3.734 3.853 . 0 0 "[ . 1 . 2]" 1 455 1 26 LEU HA 1 28 PHE QD 3.355 . 4.910 4.281 4.017 4.562 . 0 0 "[ . 1 . 2]" 1 456 1 26 LEU HA 1 43 ILE HB 3.150 . 4.500 4.561 4.504 4.605 0.105 17 0 "[ . 1 . 2]" 1 457 1 26 LEU HA 1 43 ILE MD 2.620 . 3.440 2.900 2.369 3.470 0.030 6 0 "[ . 1 . 2]" 1 458 1 26 LEU QB 1 26 LEU MD1 2.380 . 2.960 2.487 2.427 2.549 . 0 0 "[ . 1 . 2]" 1 459 1 26 LEU QB 1 26 LEU MD2 2.425 . 3.050 2.240 2.199 2.283 . 0 0 "[ . 1 . 2]" 1 460 1 26 LEU QB 1 27 GLY QA 3.340 . 4.880 3.732 3.578 3.869 . 0 0 "[ . 1 . 2]" 1 461 1 26 LEU QB 1 28 PHE H 3.350 . 4.900 2.544 2.083 2.912 . 0 0 "[ . 1 . 2]" 1 462 1 26 LEU QB 1 28 PHE QD 2.815 . 3.830 2.431 2.230 2.635 . 0 0 "[ . 1 . 2]" 1 463 1 26 LEU QB 1 28 PHE QE 2.950 . 4.100 2.217 2.099 2.420 . 0 0 "[ . 1 . 2]" 1 464 1 26 LEU MD1 1 75 LEU QB 2.395 . 2.990 2.553 2.202 2.907 . 0 0 "[ . 1 . 2]" 1 465 1 26 LEU MD1 1 76 SER H 3.210 . 4.620 4.661 4.638 4.703 0.083 3 0 "[ . 1 . 2]" 1 466 1 26 LEU MD1 1 76 SER HA 2.975 . 4.150 3.895 3.587 4.084 . 0 0 "[ . 1 . 2]" 1 467 1 27 GLY QA 1 38 LEU MD1 3.295 . 4.790 3.755 3.654 3.843 . 0 0 "[ . 1 . 2]" 1 468 1 27 GLY QA 1 39 MET QB 3.010 . 4.220 2.550 2.273 3.039 . 0 0 "[ . 1 . 2]" 1 469 1 27 GLY QA 1 39 MET QG 3.255 . 4.710 3.885 3.336 4.452 . 0 0 "[ . 1 . 2]" 1 470 1 27 GLY QA 1 44 ALA H 3.650 . 5.500 3.041 2.404 3.499 . 0 0 "[ . 1 . 2]" 1 471 1 27 GLY QA 1 44 ALA MB 3.170 . 4.540 2.824 2.366 3.096 . 0 0 "[ . 1 . 2]" 1 472 1 27 GLY QA 1 45 GLU H 3.650 . 5.500 4.503 4.188 5.005 . 0 0 "[ . 1 . 2]" 1 473 1 28 PHE H 1 28 PHE QD 3.650 . 5.500 3.023 2.563 3.250 . 0 0 "[ . 1 . 2]" 1 474 1 28 PHE H 1 29 SER H 3.650 . 5.500 4.281 4.206 4.434 . 0 0 "[ . 1 . 2]" 1 475 1 28 PHE H 1 38 LEU MD1 3.650 . 5.500 4.358 4.051 4.543 . 0 0 "[ . 1 . 2]" 1 476 1 28 PHE HA 1 28 PHE QD 3.155 . 4.510 3.778 3.759 3.790 . 0 0 "[ . 1 . 2]" 1 477 1 28 PHE HA 1 29 SER H 2.640 . 3.480 2.309 2.186 2.439 . 0 0 "[ . 1 . 2]" 1 478 1 28 PHE HA 1 37 SER H 3.650 . 5.500 4.763 4.524 5.102 . 0 0 "[ . 1 . 2]" 1 479 1 28 PHE HA 1 38 LEU H 3.565 . 5.330 4.696 4.403 4.830 . 0 0 "[ . 1 . 2]" 1 480 1 28 PHE HA 1 38 LEU HA 2.760 . 3.720 2.300 2.132 2.417 . 0 0 "[ . 1 . 2]" 1 481 1 28 PHE HA 1 38 LEU QB 3.325 . 4.850 4.228 4.044 4.380 . 0 0 "[ . 1 . 2]" 1 482 1 28 PHE HA 1 38 LEU MD1 2.780 . 3.760 3.144 2.978 3.390 . 0 0 "[ . 1 . 2]" 1 483 1 28 PHE HA 1 39 MET H 3.140 . 4.480 2.964 2.545 3.316 . 0 0 "[ . 1 . 2]" 1 484 1 28 PHE HA 1 44 ALA MB 3.460 . 5.120 3.994 3.829 4.156 . 0 0 "[ . 1 . 2]" 1 485 1 28 PHE QB 1 29 SER H 2.850 . 3.900 2.517 2.316 2.684 . 0 0 "[ . 1 . 2]" 1 486 1 28 PHE QB 1 35 ILE MG 2.810 . 3.820 2.306 2.073 2.574 . 0 0 "[ . 1 . 2]" 1 487 1 28 PHE QB 1 37 SER H 3.650 . 5.500 4.067 3.913 4.359 . 0 0 "[ . 1 . 2]" 1 488 1 28 PHE QB 1 38 LEU H 3.650 . 5.500 4.783 4.616 5.004 . 0 0 "[ . 1 . 2]" 1 489 1 28 PHE QB 1 38 LEU HA 3.230 . 4.660 2.601 2.399 2.864 . 0 0 "[ . 1 . 2]" 1 490 1 28 PHE QB 1 38 LEU QB 3.260 . 4.720 3.280 3.159 3.433 . 0 0 "[ . 1 . 2]" 1 491 1 28 PHE QB 1 38 LEU MD1 2.610 . 3.420 2.090 1.956 2.244 . 0 0 "[ . 1 . 2]" 1 492 1 28 PHE QB 1 38 LEU MD2 2.895 . 3.990 4.066 4.031 4.109 0.119 19 0 "[ . 1 . 2]" 1 493 1 28 PHE QB 1 44 ALA MB 2.865 . 3.930 2.370 2.223 2.484 . 0 0 "[ . 1 . 2]" 1 494 1 28 PHE QB 1 49 VAL MG1 2.985 . 4.170 2.318 2.091 2.642 . 0 0 "[ . 1 . 2]" 1 495 1 28 PHE QD 1 29 SER H 3.285 . 4.770 3.265 2.939 3.527 . 0 0 "[ . 1 . 2]" 1 496 1 28 PHE QD 1 35 ILE H 3.650 . 5.500 5.279 5.101 5.541 0.041 8 0 "[ . 1 . 2]" 1 497 1 28 PHE QD 1 35 ILE HA 3.315 . 4.830 3.131 2.949 3.395 . 0 0 "[ . 1 . 2]" 1 498 1 28 PHE QD 1 35 ILE MD 2.775 . 3.750 3.753 3.575 3.787 0.037 20 0 "[ . 1 . 2]" 1 499 1 28 PHE QD 1 35 ILE QG 2.990 . 4.180 2.465 2.344 2.765 . 0 0 "[ . 1 . 2]" 1 500 1 28 PHE QD 1 35 ILE MG 2.570 . 3.340 2.413 2.163 2.707 . 0 0 "[ . 1 . 2]" 1 501 1 28 PHE QD 1 36 CYS H 3.650 . 5.500 4.206 3.890 4.576 . 0 0 "[ . 1 . 2]" 1 502 1 28 PHE QD 1 37 SER H 3.650 . 5.500 4.526 4.258 4.930 . 0 0 "[ . 1 . 2]" 1 503 1 28 PHE QD 1 38 LEU MD1 2.915 . 4.030 3.555 3.408 3.686 . 0 0 "[ . 1 . 2]" 1 504 1 28 PHE QD 1 44 ALA HA 3.355 . 4.910 3.847 3.553 4.190 . 0 0 "[ . 1 . 2]" 1 505 1 28 PHE QD 1 44 ALA MB 2.500 . 3.200 1.877 1.781 1.936 0.019 15 0 "[ . 1 . 2]" 1 506 1 28 PHE QD 1 49 VAL HB 3.560 . 5.320 4.313 3.974 4.785 . 0 0 "[ . 1 . 2]" 1 507 1 28 PHE QD 1 49 VAL MG1 2.890 . 3.980 2.902 2.623 3.272 . 0 0 "[ . 1 . 2]" 1 508 1 28 PHE QD 1 49 VAL MG2 2.835 . 3.870 2.973 2.436 3.637 . 0 0 "[ . 1 . 2]" 1 509 1 28 PHE QE 1 30 VAL HB 3.005 . 4.210 2.286 1.998 2.922 . 0 0 "[ . 1 . 2]" 1 510 1 28 PHE QE 1 30 VAL MG1 2.585 . 3.370 3.386 3.228 3.514 0.144 8 0 "[ . 1 . 2]" 1 511 1 28 PHE QE 1 30 VAL MG2 2.535 . 3.270 2.227 1.847 2.492 . 0 0 "[ . 1 . 2]" 1 512 1 29 SER H 1 29 SER QB 2.955 . 4.110 2.475 2.313 2.594 . 0 0 "[ . 1 . 2]" 1 513 1 29 SER H 1 30 VAL H 3.650 . 5.500 4.366 4.230 4.471 . 0 0 "[ . 1 . 2]" 1 514 1 29 SER H 1 35 ILE HA 3.590 . 5.380 4.620 4.315 4.895 . 0 0 "[ . 1 . 2]" 1 515 1 29 SER H 1 35 ILE MG 2.815 . 3.830 3.357 3.044 3.557 . 0 0 "[ . 1 . 2]" 1 516 1 29 SER H 1 36 CYS H 3.470 . 5.140 4.033 3.811 4.269 . 0 0 "[ . 1 . 2]" 1 517 1 29 SER H 1 37 SER H 3.055 . 4.310 2.881 2.726 3.122 . 0 0 "[ . 1 . 2]" 1 518 1 29 SER H 1 38 LEU H 3.650 . 5.500 4.797 4.588 5.110 . 0 0 "[ . 1 . 2]" 1 519 1 29 SER H 1 44 ALA MB 3.650 . 5.500 5.477 5.305 5.575 0.075 7 0 "[ . 1 . 2]" 1 520 1 29 SER H 1 49 VAL MG1 3.650 . 5.500 4.998 4.676 5.261 . 0 0 "[ . 1 . 2]" 1 521 1 29 SER QB 1 30 VAL H 3.035 . 4.270 3.333 2.906 3.828 . 0 0 "[ . 1 . 2]" 1 522 1 29 SER QB 1 35 ILE HA 3.465 . 5.130 4.932 4.727 5.137 0.007 14 0 "[ . 1 . 2]" 1 523 1 29 SER QB 1 35 ILE MG 3.125 . 4.450 4.485 4.429 4.553 0.103 15 0 "[ . 1 . 2]" 1 524 1 29 SER QB 1 36 CYS H 3.570 . 5.340 3.587 3.270 3.876 . 0 0 "[ . 1 . 2]" 1 525 1 29 SER QB 1 37 SER H 3.395 . 4.990 2.711 2.404 2.960 . 0 0 "[ . 1 . 2]" 1 526 1 30 VAL H 1 30 VAL MG1 2.780 . 3.760 2.794 2.511 3.630 . 0 0 "[ . 1 . 2]" 1 527 1 30 VAL H 1 30 VAL MG2 2.825 . 3.850 3.791 3.368 3.887 0.037 9 0 "[ . 1 . 2]" 1 528 1 30 VAL H 1 31 GLN H 3.650 . 5.500 4.353 4.180 4.453 . 0 0 "[ . 1 . 2]" 1 529 1 30 VAL HA 1 30 VAL MG1 2.665 . 3.530 3.127 2.785 3.212 . 0 0 "[ . 1 . 2]" 1 530 1 30 VAL HA 1 30 VAL MG2 2.685 . 3.570 2.211 2.121 2.256 . 0 0 "[ . 1 . 2]" 1 531 1 30 VAL HA 1 31 GLN H 2.620 . 3.440 2.168 2.033 2.261 . 0 0 "[ . 1 . 2]" 1 532 1 30 VAL HA 1 34 ILE H 3.495 . 5.190 4.394 4.255 4.540 . 0 0 "[ . 1 . 2]" 1 533 1 30 VAL HA 1 35 ILE H 3.650 . 5.500 4.342 4.221 4.492 . 0 0 "[ . 1 . 2]" 1 534 1 30 VAL HA 1 35 ILE HA 2.810 . 3.820 2.269 2.092 2.488 . 0 0 "[ . 1 . 2]" 1 535 1 30 VAL HA 1 35 ILE MG 3.335 . 4.870 4.010 3.763 4.241 . 0 0 "[ . 1 . 2]" 1 536 1 30 VAL HA 1 36 CYS H 2.920 . 4.040 2.631 2.358 2.779 . 0 0 "[ . 1 . 2]" 1 537 1 30 VAL HB 1 31 GLN H 3.105 . 4.410 4.374 4.313 4.442 0.032 8 0 "[ . 1 . 2]" 1 538 1 30 VAL HB 1 33 GLY H 3.480 . 5.160 5.080 4.686 5.220 0.060 10 0 "[ . 1 . 2]" 1 539 1 30 VAL HB 1 35 ILE HA 3.305 . 4.810 3.886 3.703 4.426 . 0 0 "[ . 1 . 2]" 1 540 1 30 VAL HB 1 36 CYS H 3.650 . 5.500 4.973 4.631 5.404 . 0 0 "[ . 1 . 2]" 1 541 1 30 VAL MG1 1 31 GLN HA 2.725 . 3.650 3.414 3.164 3.657 0.007 9 0 "[ . 1 . 2]" 1 542 1 30 VAL MG1 1 33 GLY H 2.515 . 3.230 2.495 2.105 2.714 . 0 0 "[ . 1 . 2]" 1 543 1 30 VAL MG1 1 33 GLY QA 2.770 . 3.740 2.867 2.088 3.230 . 0 0 "[ . 1 . 2]" 1 544 1 30 VAL MG1 1 34 ILE H 2.795 . 3.790 3.756 2.999 3.906 0.116 1 0 "[ . 1 . 2]" 1 545 1 30 VAL MG2 1 31 GLN H 2.845 . 3.890 2.806 2.585 3.393 . 0 0 "[ . 1 . 2]" 1 546 1 30 VAL MG2 1 33 GLY QA 2.680 . 3.560 2.712 2.418 3.593 0.033 8 0 "[ . 1 . 2]" 1 547 1 30 VAL MG2 1 34 ILE H 2.955 . 4.110 2.855 2.512 4.007 . 0 0 "[ . 1 . 2]" 1 548 1 30 VAL MG2 1 35 ILE H 2.600 . 3.400 2.960 2.851 3.172 . 0 0 "[ . 1 . 2]" 1 549 1 30 VAL MG2 1 35 ILE HA 2.545 . 3.290 2.235 2.070 2.368 . 0 0 "[ . 1 . 2]" 1 550 1 30 VAL MG2 1 35 ILE QG 2.870 . 3.940 2.163 2.032 2.287 . 0 0 "[ . 1 . 2]" 1 551 1 31 GLN H 1 31 GLN QG 2.820 . 3.840 2.487 2.059 3.228 . 0 0 "[ . 1 . 2]" 1 552 1 31 GLN H 1 32 ASN H 3.650 . 5.500 4.135 3.959 4.323 . 0 0 "[ . 1 . 2]" 1 553 1 31 GLN H 1 33 GLY QA 3.650 . 5.500 4.764 4.544 4.915 . 0 0 "[ . 1 . 2]" 1 554 1 31 GLN H 1 34 ILE H 2.990 . 4.180 2.961 2.834 3.284 . 0 0 "[ . 1 . 2]" 1 555 1 31 GLN H 1 35 ILE QG 3.650 . 5.500 4.994 4.871 5.196 . 0 0 "[ . 1 . 2]" 1 556 1 31 GLN H 1 36 CYS H 3.330 . 4.860 3.617 3.368 3.889 . 0 0 "[ . 1 . 2]" 1 557 1 31 GLN H 1 36 CYS QB 3.525 . 5.250 3.383 3.054 3.781 . 0 0 "[ . 1 . 2]" 1 558 1 31 GLN QB 1 31 GLN QE 3.135 . 4.470 2.921 1.800 3.702 . 0 0 "[ . 1 . 2]" 1 559 1 31 GLN QB 1 32 ASN QB 3.455 . 5.110 3.911 3.409 4.273 . 0 0 "[ . 1 . 2]" 1 560 1 31 GLN QB 1 32 ASN QD 3.650 . 5.500 4.157 2.586 5.578 0.078 14 0 "[ . 1 . 2]" 1 561 1 31 GLN QB 1 33 GLY H 3.650 . 5.500 4.604 4.329 4.846 . 0 0 "[ . 1 . 2]" 1 562 1 31 GLN QB 1 34 ILE H 3.650 . 5.500 4.498 3.786 4.854 . 0 0 "[ . 1 . 2]" 1 563 1 31 GLN QB 1 36 CYS QB 3.315 . 4.830 3.247 2.550 3.789 . 0 0 "[ . 1 . 2]" 1 564 1 31 GLN QE 1 32 ASN QB 3.650 . 5.500 4.757 3.339 5.582 0.082 18 0 "[ . 1 . 2]" 1 565 1 31 GLN QG 1 32 ASN QB 3.650 . 5.500 4.393 3.271 5.436 . 0 0 "[ . 1 . 2]" 1 566 1 31 GLN QG 1 32 ASN QD 3.650 . 5.500 4.945 3.768 5.578 0.078 13 0 "[ . 1 . 2]" 1 567 1 31 GLN QG 1 36 CYS H 3.650 . 5.500 3.923 3.489 4.557 . 0 0 "[ . 1 . 2]" 1 568 1 31 GLN QG 1 36 CYS QB 3.055 . 4.310 2.228 1.859 3.024 . 0 0 "[ . 1 . 2]" 1 569 1 32 ASN H 1 33 GLY H 3.340 . 4.880 2.723 2.538 2.929 . 0 0 "[ . 1 . 2]" 1 570 1 32 ASN HA 1 32 ASN QD 3.650 . 5.500 3.878 2.653 4.132 . 0 0 "[ . 1 . 2]" 1 571 1 32 ASN HA 1 34 ILE H 3.535 . 5.270 4.465 4.326 4.536 . 0 0 "[ . 1 . 2]" 1 572 1 32 ASN HA 1 34 ILE MD 3.295 . 4.790 4.482 4.105 4.865 0.075 9 0 "[ . 1 . 2]" 1 573 1 32 ASN HA 1 68 HIS QB 3.000 . 4.200 2.829 1.775 3.755 0.025 20 0 "[ . 1 . 2]" 1 574 1 32 ASN QB 1 32 ASN QD 2.925 . 4.050 2.112 2.052 2.196 . 0 0 "[ . 1 . 2]" 1 575 1 32 ASN QB 1 33 GLY H 3.290 . 4.780 3.624 3.425 3.742 . 0 0 "[ . 1 . 2]" 1 576 1 32 ASN QB 1 34 ILE H 3.545 . 5.290 3.449 3.018 3.952 . 0 0 "[ . 1 . 2]" 1 577 1 32 ASN QB 1 34 ILE MD 2.995 . 4.190 2.569 2.018 3.236 . 0 0 "[ . 1 . 2]" 1 578 1 32 ASN QD 1 34 ILE MD 3.650 . 5.500 3.911 2.622 4.762 . 0 0 "[ . 1 . 2]" 1 579 1 33 GLY H 1 34 ILE H 2.660 . 3.520 2.207 2.086 2.432 . 0 0 "[ . 1 . 2]" 1 580 1 33 GLY H 1 34 ILE HB 3.455 . 5.110 4.776 4.590 4.997 . 0 0 "[ . 1 . 2]" 1 581 1 33 GLY H 1 34 ILE MD 2.940 . 4.080 3.717 3.553 3.845 . 0 0 "[ . 1 . 2]" 1 582 1 33 GLY H 1 34 ILE QG 3.650 . 5.500 5.432 5.262 5.521 0.021 1 0 "[ . 1 . 2]" 1 583 1 33 GLY H 1 71 ILE MD 3.030 . 4.260 3.600 3.104 4.256 . 0 0 "[ . 1 . 2]" 1 584 1 33 GLY H 1 71 ILE MG 3.115 . 4.430 4.157 3.486 4.466 0.036 14 0 "[ . 1 . 2]" 1 585 1 33 GLY QA 1 34 ILE MD 3.325 . 4.850 2.918 2.789 3.064 . 0 0 "[ . 1 . 2]" 1 586 1 33 GLY QA 1 55 ILE H 3.560 . 5.320 3.503 3.316 3.779 . 0 0 "[ . 1 . 2]" 1 587 1 33 GLY QA 1 55 ILE HB 3.370 . 4.940 3.364 2.832 3.878 . 0 0 "[ . 1 . 2]" 1 588 1 33 GLY QA 1 55 ILE MD 3.210 . 4.620 3.972 3.610 4.654 0.034 16 0 "[ . 1 . 2]" 1 589 1 33 GLY QA 1 55 ILE QG 3.445 . 5.090 3.902 3.097 4.367 . 0 0 "[ . 1 . 2]" 1 590 1 33 GLY QA 1 71 ILE MD 2.725 . 3.650 2.360 2.079 2.769 . 0 0 "[ . 1 . 2]" 1 591 1 33 GLY QA 1 71 ILE MG 2.880 . 3.960 2.700 2.185 3.224 . 0 0 "[ . 1 . 2]" 1 592 1 34 ILE H 1 34 ILE HB 2.605 . 3.410 2.678 2.566 2.767 . 0 0 "[ . 1 . 2]" 1 593 1 34 ILE H 1 34 ILE MD 2.780 . 3.760 2.387 2.234 2.549 . 0 0 "[ . 1 . 2]" 1 594 1 34 ILE H 1 34 ILE QG 2.840 . 3.880 3.635 3.505 3.747 . 0 0 "[ . 1 . 2]" 1 595 1 34 ILE H 1 34 ILE MG 2.840 . 3.880 3.850 3.798 3.892 0.012 18 0 "[ . 1 . 2]" 1 596 1 34 ILE H 1 35 ILE H 3.585 . 5.370 4.287 4.244 4.375 . 0 0 "[ . 1 . 2]" 1 597 1 34 ILE H 1 54 ARG HA 3.650 . 5.500 4.456 4.336 4.604 . 0 0 "[ . 1 . 2]" 1 598 1 34 ILE H 1 54 ARG QG 3.650 . 5.500 4.585 4.159 5.028 . 0 0 "[ . 1 . 2]" 1 599 1 34 ILE HA 1 34 ILE MD 2.745 . 3.690 3.111 3.002 3.201 . 0 0 "[ . 1 . 2]" 1 600 1 34 ILE HA 1 34 ILE QG 2.875 . 3.950 2.487 2.446 2.513 . 0 0 "[ . 1 . 2]" 1 601 1 34 ILE HA 1 34 ILE MG 2.570 . 3.340 2.394 2.325 2.456 . 0 0 "[ . 1 . 2]" 1 602 1 34 ILE HA 1 35 ILE H 2.625 . 3.450 2.021 1.949 2.073 . 0 0 "[ . 1 . 2]" 1 603 1 34 ILE HA 1 35 ILE HB 3.225 . 4.650 4.429 4.350 4.534 . 0 0 "[ . 1 . 2]" 1 604 1 34 ILE HA 1 52 GLY H 3.650 . 5.500 5.517 5.418 5.560 0.060 9 0 "[ . 1 . 2]" 1 605 1 34 ILE HA 1 53 HIS H 3.650 . 5.500 4.548 4.262 4.991 . 0 0 "[ . 1 . 2]" 1 606 1 34 ILE HA 1 54 ARG H 3.480 . 5.160 4.476 4.354 4.691 . 0 0 "[ . 1 . 2]" 1 607 1 34 ILE HA 1 54 ARG HA 2.905 . 4.010 2.072 1.991 2.206 . 0 0 "[ . 1 . 2]" 1 608 1 34 ILE HA 1 54 ARG QB 3.365 . 4.930 3.726 3.324 3.956 . 0 0 "[ . 1 . 2]" 1 609 1 34 ILE HA 1 55 ILE H 3.230 . 4.660 3.108 2.963 3.234 . 0 0 "[ . 1 . 2]" 1 610 1 34 ILE HA 1 55 ILE MD 3.500 . 5.200 4.975 4.605 5.086 . 0 0 "[ . 1 . 2]" 1 611 1 34 ILE HB 1 34 ILE MD 2.520 . 3.240 2.439 2.399 2.471 . 0 0 "[ . 1 . 2]" 1 612 1 34 ILE HB 1 35 ILE H 3.085 . 4.370 4.182 4.111 4.265 . 0 0 "[ . 1 . 2]" 1 613 1 34 ILE MD 1 54 ARG HA 2.850 . 3.900 3.457 3.147 3.923 0.023 16 0 "[ . 1 . 2]" 1 614 1 34 ILE MD 1 54 ARG QB 2.680 . 3.560 3.122 2.962 3.231 . 0 0 "[ . 1 . 2]" 1 615 1 34 ILE MD 1 54 ARG QD 2.840 . 3.880 3.032 2.066 3.896 0.016 13 0 "[ . 1 . 2]" 1 616 1 34 ILE MD 1 54 ARG QG 2.355 . 2.910 2.520 2.174 2.915 0.005 10 0 "[ . 1 . 2]" 1 617 1 34 ILE MD 1 55 ILE H 3.175 . 4.550 4.295 4.031 4.541 . 0 0 "[ . 1 . 2]" 1 618 1 34 ILE MD 1 89 ALA HA 3.145 . 4.490 4.524 4.470 4.572 0.082 6 0 "[ . 1 . 2]" 1 619 1 34 ILE QG 1 34 ILE MG 2.530 . 3.260 2.053 2.033 2.065 . 0 0 "[ . 1 . 2]" 1 620 1 34 ILE QG 1 35 ILE H 3.295 . 4.790 4.092 3.924 4.183 . 0 0 "[ . 1 . 2]" 1 621 1 34 ILE QG 1 54 ARG HA 3.165 . 4.530 2.430 2.174 2.957 . 0 0 "[ . 1 . 2]" 1 622 1 34 ILE QG 1 54 ARG QG 2.930 . 4.060 2.718 2.486 3.192 . 0 0 "[ . 1 . 2]" 1 623 1 34 ILE QG 1 89 ALA MB 2.810 . 3.820 2.386 2.215 2.661 . 0 0 "[ . 1 . 2]" 1 624 1 34 ILE MG 1 35 ILE H 2.475 . 3.150 2.648 2.500 2.786 . 0 0 "[ . 1 . 2]" 1 625 1 34 ILE MG 1 35 ILE HB 2.960 . 4.120 3.789 3.660 3.958 . 0 0 "[ . 1 . 2]" 1 626 1 34 ILE MG 1 36 CYS QB 3.160 . 4.520 4.112 3.688 4.518 . 0 0 "[ . 1 . 2]" 1 627 1 34 ILE MG 1 52 GLY H 3.165 . 4.530 3.293 3.105 3.531 . 0 0 "[ . 1 . 2]" 1 628 1 34 ILE MG 1 52 GLY QA 2.715 . 3.630 2.864 2.691 3.143 . 0 0 "[ . 1 . 2]" 1 629 1 34 ILE MG 1 53 HIS H 3.105 . 4.410 3.117 2.797 3.538 . 0 0 "[ . 1 . 2]" 1 630 1 34 ILE MG 1 54 ARG HA 2.975 . 4.150 3.219 3.091 3.328 . 0 0 "[ . 1 . 2]" 1 631 1 34 ILE MG 1 55 ILE H 3.255 . 4.710 4.783 4.745 4.825 0.115 1 0 "[ . 1 . 2]" 1 632 1 34 ILE MG 1 89 ALA MB 2.490 . 3.180 2.405 2.080 2.925 . 0 0 "[ . 1 . 2]" 1 633 1 35 ILE H 1 35 ILE HB 2.630 . 3.460 2.460 2.424 2.503 . 0 0 "[ . 1 . 2]" 1 634 1 35 ILE H 1 35 ILE MD 2.805 . 3.810 3.180 3.055 3.313 . 0 0 "[ . 1 . 2]" 1 635 1 35 ILE H 1 35 ILE QG 2.795 . 3.790 1.936 1.862 2.015 . 0 0 "[ . 1 . 2]" 1 636 1 35 ILE H 1 49 VAL MG1 3.650 . 5.500 5.369 5.266 5.502 0.002 17 0 "[ . 1 . 2]" 1 637 1 35 ILE H 1 51 VAL HA 3.650 . 5.500 4.754 4.601 4.909 . 0 0 "[ . 1 . 2]" 1 638 1 35 ILE H 1 53 HIS H 3.360 . 4.920 3.273 3.077 3.718 . 0 0 "[ . 1 . 2]" 1 639 1 35 ILE H 1 53 HIS QB 3.650 . 5.500 3.856 3.688 4.218 . 0 0 "[ . 1 . 2]" 1 640 1 35 ILE H 1 54 ARG H 3.650 . 5.500 4.870 4.806 4.909 . 0 0 "[ . 1 . 2]" 1 641 1 35 ILE H 1 54 ARG HA 3.155 . 4.510 3.365 3.093 3.534 . 0 0 "[ . 1 . 2]" 1 642 1 35 ILE H 1 55 ILE H 3.490 . 5.180 3.994 3.825 4.232 . 0 0 "[ . 1 . 2]" 1 643 1 35 ILE H 1 55 ILE MD 3.155 . 4.510 4.529 4.285 4.590 0.080 12 0 "[ . 1 . 2]" 1 644 1 35 ILE H 1 89 ALA MB 3.650 . 5.500 4.766 4.421 5.256 . 0 0 "[ . 1 . 2]" 1 645 1 35 ILE HA 1 35 ILE MD 2.780 . 3.760 3.815 3.798 3.834 0.074 16 0 "[ . 1 . 2]" 1 646 1 35 ILE HA 1 35 ILE QG 2.955 . 4.110 2.396 2.368 2.439 . 0 0 "[ . 1 . 2]" 1 647 1 35 ILE HA 1 35 ILE MG 2.505 . 3.210 2.397 2.354 2.428 . 0 0 "[ . 1 . 2]" 1 648 1 35 ILE HA 1 36 CYS H 2.580 . 3.360 2.120 2.062 2.171 . 0 0 "[ . 1 . 2]" 1 649 1 35 ILE HA 1 36 CYS QB 3.305 . 4.810 4.009 3.914 4.137 . 0 0 "[ . 1 . 2]" 1 650 1 35 ILE HB 1 35 ILE MD 2.590 . 3.380 2.346 2.300 2.375 . 0 0 "[ . 1 . 2]" 1 651 1 35 ILE HB 1 36 CYS H 3.530 . 5.260 4.289 4.237 4.345 . 0 0 "[ . 1 . 2]" 1 652 1 35 ILE HB 1 37 SER H 3.650 . 5.500 5.155 4.911 5.503 0.003 5 0 "[ . 1 . 2]" 1 653 1 35 ILE HB 1 49 VAL MG1 3.125 . 4.450 3.962 3.873 4.057 . 0 0 "[ . 1 . 2]" 1 654 1 35 ILE HB 1 51 VAL H 3.650 . 5.500 4.896 4.730 5.042 . 0 0 "[ . 1 . 2]" 1 655 1 35 ILE HB 1 51 VAL HA 2.840 . 3.880 2.503 2.335 2.619 . 0 0 "[ . 1 . 2]" 1 656 1 35 ILE HB 1 52 GLY H 3.045 . 4.290 2.874 2.681 3.008 . 0 0 "[ . 1 . 2]" 1 657 1 35 ILE HB 1 53 HIS H 2.850 . 3.900 2.392 2.231 2.547 . 0 0 "[ . 1 . 2]" 1 658 1 35 ILE HB 1 53 HIS QB 3.430 . 5.060 2.983 2.775 3.463 . 0 0 "[ . 1 . 2]" 1 659 1 35 ILE MD 1 35 ILE MG 2.270 . 2.740 2.067 1.990 2.143 . 0 0 "[ . 1 . 2]" 1 660 1 35 ILE MD 1 36 CYS H 3.650 . 5.500 5.290 5.239 5.381 . 0 0 "[ . 1 . 2]" 1 661 1 35 ILE MD 1 49 VAL HA 2.945 . 4.090 3.365 3.172 3.635 . 0 0 "[ . 1 . 2]" 1 662 1 35 ILE MD 1 49 VAL MG1 2.370 . 2.940 1.781 1.761 1.792 0.039 17 0 "[ . 1 . 2]" 1 663 1 35 ILE MD 1 50 ARG H 3.030 . 4.260 2.609 2.219 2.942 . 0 0 "[ . 1 . 2]" 1 664 1 35 ILE MD 1 51 VAL HA 3.300 . 4.800 3.729 3.595 3.850 . 0 0 "[ . 1 . 2]" 1 665 1 35 ILE MD 1 53 HIS H 3.080 . 4.360 3.384 3.153 3.609 . 0 0 "[ . 1 . 2]" 1 666 1 35 ILE MD 1 53 HIS QB 2.765 . 3.730 2.001 1.852 2.204 . 0 0 "[ . 1 . 2]" 1 667 1 35 ILE MD 1 54 ARG H 3.650 . 5.500 4.718 4.319 5.039 . 0 0 "[ . 1 . 2]" 1 668 1 35 ILE MD 1 55 ILE H 3.065 . 4.330 4.299 4.179 4.341 0.011 2 0 "[ . 1 . 2]" 1 669 1 35 ILE MD 1 55 ILE MD 2.705 . 3.610 2.437 1.950 2.671 . 0 0 "[ . 1 . 2]" 1 670 1 35 ILE MD 1 55 ILE QG 2.715 . 3.630 2.589 2.313 3.252 . 0 0 "[ . 1 . 2]" 1 671 1 35 ILE MD 1 86 THR HB 3.195 . 4.590 3.295 3.186 3.512 . 0 0 "[ . 1 . 2]" 1 672 1 35 ILE QG 1 35 ILE MG 2.530 . 3.260 2.257 2.226 2.322 . 0 0 "[ . 1 . 2]" 1 673 1 35 ILE QG 1 36 CYS H 3.600 . 5.400 4.168 4.091 4.275 . 0 0 "[ . 1 . 2]" 1 674 1 35 ILE QG 1 49 VAL MG1 2.745 . 3.690 2.978 2.844 3.354 . 0 0 "[ . 1 . 2]" 1 675 1 35 ILE QG 1 52 GLY H 3.650 . 5.500 4.842 4.705 4.946 . 0 0 "[ . 1 . 2]" 1 676 1 35 ILE QG 1 53 HIS H 3.510 . 5.220 4.028 3.897 4.239 . 0 0 "[ . 1 . 2]" 1 677 1 35 ILE QG 1 53 HIS QB 3.455 . 5.110 3.559 3.467 3.767 . 0 0 "[ . 1 . 2]" 1 678 1 35 ILE MG 1 36 CYS H 2.690 . 3.580 2.944 2.816 3.073 . 0 0 "[ . 1 . 2]" 1 679 1 35 ILE MG 1 36 CYS QB 3.180 . 4.560 4.370 4.260 4.545 . 0 0 "[ . 1 . 2]" 1 680 1 35 ILE MG 1 37 SER H 2.730 . 3.660 2.847 2.633 3.151 . 0 0 "[ . 1 . 2]" 1 681 1 35 ILE MG 1 38 LEU HA 3.155 . 4.510 3.897 3.724 4.103 . 0 0 "[ . 1 . 2]" 1 682 1 35 ILE MG 1 38 LEU QB 2.955 . 4.110 3.086 2.867 3.312 . 0 0 "[ . 1 . 2]" 1 683 1 35 ILE MG 1 49 VAL MG1 2.255 . 2.710 2.257 2.133 2.406 . 0 0 "[ . 1 . 2]" 1 684 1 35 ILE MG 1 50 ARG H 3.205 . 4.610 3.674 3.411 3.883 . 0 0 "[ . 1 . 2]" 1 685 1 35 ILE MG 1 51 VAL HA 2.355 . 2.910 1.999 1.943 2.048 . 0 0 "[ . 1 . 2]" 1 686 1 35 ILE MG 1 51 VAL HB 2.930 . 4.060 4.134 4.102 4.159 0.099 12 0 "[ . 1 . 2]" 1 687 1 35 ILE MG 1 52 GLY H 2.610 . 3.420 3.339 3.183 3.439 0.019 17 0 "[ . 1 . 2]" 1 688 1 35 ILE MG 1 53 HIS H 3.025 . 4.250 3.848 3.706 3.964 . 0 0 "[ . 1 . 2]" 1 689 1 35 ILE MG 1 53 HIS QB 3.270 . 4.740 3.903 3.758 4.277 . 0 0 "[ . 1 . 2]" 1 690 1 36 CYS H 1 36 CYS QB 2.965 . 4.130 2.321 2.223 2.420 . 0 0 "[ . 1 . 2]" 1 691 1 36 CYS H 1 37 SER H 2.735 . 3.670 2.208 2.046 2.440 . 0 0 "[ . 1 . 2]" 1 692 1 36 CYS H 1 51 VAL HA 3.650 . 5.500 4.876 4.694 5.181 . 0 0 "[ . 1 . 2]" 1 693 1 36 CYS HA 1 52 GLY H 3.485 . 5.170 3.753 3.405 4.201 . 0 0 "[ . 1 . 2]" 1 694 1 36 CYS QB 1 37 SER H 3.260 . 4.720 2.803 2.390 3.146 . 0 0 "[ . 1 . 2]" 1 695 1 37 SER H 1 38 LEU H 3.485 . 5.170 4.303 4.240 4.375 . 0 0 "[ . 1 . 2]" 1 696 1 37 SER H 1 38 LEU QB 3.650 . 5.500 4.769 4.538 4.901 . 0 0 "[ . 1 . 2]" 1 697 1 37 SER H 1 51 VAL MG1 3.040 . 4.280 3.901 3.603 4.301 0.021 8 0 "[ . 1 . 2]" 1 698 1 37 SER H 1 51 VAL MG2 3.015 . 4.230 3.282 2.945 3.606 . 0 0 "[ . 1 . 2]" 1 699 1 37 SER HA 1 37 SER QB 2.395 . 2.990 2.267 2.173 2.407 . 0 0 "[ . 1 . 2]" 1 700 1 37 SER HA 1 38 LEU H 2.460 . 3.120 2.312 2.171 2.419 . 0 0 "[ . 1 . 2]" 1 701 1 37 SER HA 1 38 LEU QB 3.365 . 4.930 3.857 3.771 3.952 . 0 0 "[ . 1 . 2]" 1 702 1 37 SER HA 1 51 VAL MG1 2.680 . 3.560 3.093 2.822 3.297 . 0 0 "[ . 1 . 2]" 1 703 1 37 SER HA 1 51 VAL MG2 2.490 . 3.180 2.294 1.986 2.486 . 0 0 "[ . 1 . 2]" 1 704 1 37 SER QB 1 38 LEU H 2.720 . 3.640 2.843 2.449 3.487 . 0 0 "[ . 1 . 2]" 1 705 1 37 SER QB 1 51 VAL MG1 3.160 . 4.520 4.362 3.982 4.615 0.095 18 0 "[ . 1 . 2]" 1 706 1 37 SER QB 1 51 VAL MG2 2.890 . 3.980 3.834 3.510 4.008 0.028 4 0 "[ . 1 . 2]" 1 707 1 38 LEU H 1 38 LEU QB 2.865 . 3.930 2.471 2.366 2.621 . 0 0 "[ . 1 . 2]" 1 708 1 38 LEU H 1 38 LEU MD1 3.075 . 4.350 4.354 4.270 4.377 0.027 18 0 "[ . 1 . 2]" 1 709 1 38 LEU H 1 51 VAL HB 3.650 . 5.500 5.337 5.154 5.531 0.031 20 0 "[ . 1 . 2]" 1 710 1 38 LEU H 1 51 VAL MG2 2.695 . 3.590 2.704 2.553 2.905 . 0 0 "[ . 1 . 2]" 1 711 1 38 LEU HA 1 38 LEU MD1 2.605 . 3.410 2.174 2.117 2.233 . 0 0 "[ . 1 . 2]" 1 712 1 38 LEU HA 1 38 LEU MD2 2.900 . 4.000 3.880 3.835 3.919 . 0 0 "[ . 1 . 2]" 1 713 1 38 LEU HA 1 39 MET QB 3.335 . 4.870 4.098 3.995 4.396 . 0 0 "[ . 1 . 2]" 1 714 1 38 LEU QB 1 38 LEU MD1 2.410 . 3.020 2.309 2.268 2.360 . 0 0 "[ . 1 . 2]" 1 715 1 38 LEU QB 1 38 LEU MD2 2.505 . 3.210 2.077 2.051 2.100 . 0 0 "[ . 1 . 2]" 1 716 1 38 LEU QB 1 39 MET H 3.650 . 5.500 3.663 3.499 3.754 . 0 0 "[ . 1 . 2]" 1 717 1 38 LEU QB 1 51 VAL H 3.650 . 5.500 3.861 3.540 4.219 . 0 0 "[ . 1 . 2]" 1 718 1 38 LEU QB 1 51 VAL MG2 2.565 . 3.330 2.119 1.947 2.322 . 0 0 "[ . 1 . 2]" 1 719 1 38 LEU MD1 1 39 MET H 2.785 . 3.770 2.115 1.854 2.372 . 0 0 "[ . 1 . 2]" 1 720 1 38 LEU MD1 1 39 MET HA 3.345 . 4.890 4.484 4.348 4.604 . 0 0 "[ . 1 . 2]" 1 721 1 38 LEU MD1 1 40 ARG H 3.650 . 5.500 5.158 4.966 5.243 . 0 0 "[ . 1 . 2]" 1 722 1 38 LEU MD1 1 40 ARG HA 3.295 . 4.790 4.664 4.339 4.849 0.059 14 0 "[ . 1 . 2]" 1 723 1 38 LEU MD1 1 41 GLY H 3.650 . 5.500 5.364 4.974 5.524 0.024 3 0 "[ . 1 . 2]" 1 724 1 38 LEU MD1 1 42 GLY H 3.415 . 5.030 4.620 4.455 4.828 . 0 0 "[ . 1 . 2]" 1 725 1 38 LEU MD1 1 44 ALA H 2.815 . 3.830 3.873 3.843 3.902 0.072 13 0 "[ . 1 . 2]" 1 726 1 38 LEU MD1 1 44 ALA MB 2.390 . 2.980 1.916 1.852 1.978 . 0 0 "[ . 1 . 2]" 1 727 1 38 LEU MD1 1 45 GLU H 2.805 . 3.810 2.518 2.325 2.799 . 0 0 "[ . 1 . 2]" 1 728 1 38 LEU MD1 1 45 GLU HA 2.605 . 3.410 2.681 2.396 2.948 . 0 0 "[ . 1 . 2]" 1 729 1 38 LEU MD1 1 45 GLU QB 2.690 . 3.580 2.656 2.310 3.126 . 0 0 "[ . 1 . 2]" 1 730 1 38 LEU MD1 1 49 VAL H 2.925 . 4.050 4.090 4.049 4.133 0.083 14 0 "[ . 1 . 2]" 1 731 1 38 LEU MD1 1 49 VAL HB 2.675 . 3.550 2.481 2.362 2.700 . 0 0 "[ . 1 . 2]" 1 732 1 38 LEU MD1 1 49 VAL MG1 2.440 . 3.080 2.237 2.080 2.533 . 0 0 "[ . 1 . 2]" 1 733 1 38 LEU MD2 1 39 MET H 3.325 . 4.850 4.357 4.037 4.591 . 0 0 "[ . 1 . 2]" 1 734 1 38 LEU MD2 1 45 GLU H 3.135 . 4.470 3.750 3.667 3.937 . 0 0 "[ . 1 . 2]" 1 735 1 38 LEU MD2 1 45 GLU HA 2.620 . 3.440 2.042 1.928 2.190 . 0 0 "[ . 1 . 2]" 1 736 1 38 LEU MD2 1 45 GLU QB 2.645 . 3.490 2.489 2.179 2.980 . 0 0 "[ . 1 . 2]" 1 737 1 38 LEU MD2 1 45 GLU QG 2.785 . 3.770 2.605 2.241 3.694 . 0 0 "[ . 1 . 2]" 1 738 1 38 LEU MD2 1 46 ARG H 3.385 . 4.970 4.992 4.958 5.027 0.057 12 0 "[ . 1 . 2]" 1 739 1 38 LEU MD2 1 48 GLY H 3.305 . 4.810 4.842 4.757 4.887 0.077 16 0 "[ . 1 . 2]" 1 740 1 38 LEU MD2 1 49 VAL H 3.255 . 4.710 4.073 3.755 4.283 . 0 0 "[ . 1 . 2]" 1 741 1 38 LEU MD2 1 49 VAL MG1 2.685 . 3.570 2.896 2.541 3.308 . 0 0 "[ . 1 . 2]" 1 742 1 38 LEU MD2 1 50 ARG H 3.620 . 5.440 4.244 3.998 4.463 . 0 0 "[ . 1 . 2]" 1 743 1 38 LEU MD2 1 50 ARG HA 2.725 . 3.650 2.698 2.283 3.114 . 0 0 "[ . 1 . 2]" 1 744 1 38 LEU MD2 1 50 ARG QD 3.335 . 4.870 3.012 2.353 3.848 . 0 0 "[ . 1 . 2]" 1 745 1 38 LEU MD2 1 50 ARG QG 3.055 . 4.310 4.180 3.638 4.388 0.078 20 0 "[ . 1 . 2]" 1 746 1 38 LEU MD2 1 51 VAL H 2.840 . 3.880 3.646 3.265 3.896 0.016 9 0 "[ . 1 . 2]" 1 747 1 38 LEU HG 1 39 MET H 3.650 . 5.500 3.001 2.545 3.359 . 0 0 "[ . 1 . 2]" 1 748 1 38 LEU HG 1 40 ARG HA 3.430 . 5.060 3.672 3.147 4.131 . 0 0 "[ . 1 . 2]" 1 749 1 38 LEU HG 1 45 GLU HA 3.130 . 4.460 3.924 3.680 4.081 . 0 0 "[ . 1 . 2]" 1 750 1 38 LEU HG 1 45 GLU QB 3.150 . 4.500 2.731 2.375 3.280 . 0 0 "[ . 1 . 2]" 1 751 1 39 MET H 1 39 MET QB 2.835 . 3.870 2.299 2.205 2.436 . 0 0 "[ . 1 . 2]" 1 752 1 39 MET H 1 39 MET QG 3.170 . 4.540 3.926 2.580 4.086 . 0 0 "[ . 1 . 2]" 1 753 1 39 MET H 1 40 ARG H 3.650 . 5.500 4.323 4.213 4.447 . 0 0 "[ . 1 . 2]" 1 754 1 39 MET H 1 42 GLY H 3.650 . 5.500 5.043 4.713 5.311 . 0 0 "[ . 1 . 2]" 1 755 1 39 MET HA 1 39 MET QG 2.815 . 3.830 2.664 2.389 3.052 . 0 0 "[ . 1 . 2]" 1 756 1 39 MET HA 1 40 ARG H 2.695 . 3.590 2.079 2.022 2.161 . 0 0 "[ . 1 . 2]" 1 757 1 39 MET HA 1 40 ARG QB 2.975 . 4.150 3.963 3.859 4.182 0.032 10 0 "[ . 1 . 2]" 1 758 1 39 MET QB 1 40 ARG H 3.395 . 4.990 3.777 3.359 3.903 . 0 0 "[ . 1 . 2]" 1 759 1 39 MET QB 1 42 GLY QA 3.160 . 4.520 2.998 2.580 3.399 . 0 0 "[ . 1 . 2]" 1 760 1 39 MET QG 1 40 ARG H 3.650 . 5.500 3.168 2.890 4.156 . 0 0 "[ . 1 . 2]" 1 761 1 39 MET QG 1 42 GLY H 3.370 . 4.940 3.350 2.597 5.015 0.075 15 0 "[ . 1 . 2]" 1 762 1 40 ARG H 1 40 ARG QB 2.740 . 3.680 2.187 2.081 2.328 . 0 0 "[ . 1 . 2]" 1 763 1 40 ARG H 1 40 ARG QD 3.650 . 5.500 4.272 2.148 4.667 . 0 0 "[ . 1 . 2]" 1 764 1 40 ARG H 1 40 ARG QG 3.415 . 5.030 3.950 3.513 4.087 . 0 0 "[ . 1 . 2]" 1 765 1 40 ARG H 1 41 GLY H 3.650 . 5.500 4.491 4.279 4.583 . 0 0 "[ . 1 . 2]" 1 766 1 40 ARG HA 1 40 ARG QB 2.385 . 2.970 2.384 2.176 2.500 . 0 0 "[ . 1 . 2]" 1 767 1 40 ARG HA 1 40 ARG QD 2.820 . 3.840 2.837 1.988 3.627 . 0 0 "[ . 1 . 2]" 1 768 1 40 ARG HA 1 40 ARG QG 2.755 . 3.710 2.675 2.224 3.491 . 0 0 "[ . 1 . 2]" 1 769 1 40 ARG HA 1 41 GLY H 2.385 . 2.970 2.146 2.031 2.227 . 0 0 "[ . 1 . 2]" 1 770 1 40 ARG HA 1 41 GLY QA 3.065 . 4.330 3.912 3.820 3.967 . 0 0 "[ . 1 . 2]" 1 771 1 40 ARG HA 1 42 GLY H 2.740 . 3.680 3.288 3.116 3.514 . 0 0 "[ . 1 . 2]" 1 772 1 40 ARG HA 1 45 GLU QB 3.040 . 4.280 2.983 2.326 3.519 . 0 0 "[ . 1 . 2]" 1 773 1 40 ARG QB 1 40 ARG QD 2.285 . 2.770 2.542 2.247 2.842 0.072 13 0 "[ . 1 . 2]" 1 774 1 40 ARG QB 1 41 GLY H 2.950 . 4.100 3.675 2.905 3.850 . 0 0 "[ . 1 . 2]" 1 775 1 40 ARG QB 1 42 GLY H 3.210 . 4.620 4.667 4.605 4.701 0.081 18 0 "[ . 1 . 2]" 1 776 1 40 ARG QD 1 41 GLY H 3.095 . 4.390 2.801 2.092 4.466 0.076 10 0 "[ . 1 . 2]" 1 777 1 40 ARG QD 1 42 GLY H 3.650 . 5.500 4.621 4.253 5.138 . 0 0 "[ . 1 . 2]" 1 778 1 40 ARG QG 1 41 GLY H 2.925 . 4.050 3.146 2.571 3.624 . 0 0 "[ . 1 . 2]" 1 779 1 40 ARG QG 1 41 GLY QA 3.085 . 4.370 3.899 3.228 4.511 0.141 12 0 "[ . 1 . 2]" 1 780 1 41 GLY H 1 42 GLY H 2.670 . 3.540 2.487 2.150 2.725 . 0 0 "[ . 1 . 2]" 1 781 1 41 GLY H 1 45 GLU QB 3.140 . 4.480 2.744 2.079 2.990 . 0 0 "[ . 1 . 2]" 1 782 1 41 GLY H 1 45 GLU QG 3.505 . 5.210 3.495 2.010 3.877 . 0 0 "[ . 1 . 2]" 1 783 1 41 GLY H 1 46 ARG H 3.650 . 5.500 5.198 4.611 5.520 0.020 19 0 "[ . 1 . 2]" 1 784 1 41 GLY QA 1 45 GLU QB 3.390 . 4.980 3.820 3.242 4.143 . 0 0 "[ . 1 . 2]" 1 785 1 42 GLY H 1 43 ILE H 3.170 . 4.540 4.546 4.509 4.582 0.042 13 0 "[ . 1 . 2]" 1 786 1 42 GLY H 1 44 ALA MB 3.620 . 5.440 5.022 4.824 5.216 . 0 0 "[ . 1 . 2]" 1 787 1 42 GLY H 1 45 GLU H 3.210 . 4.620 3.855 3.643 4.063 . 0 0 "[ . 1 . 2]" 1 788 1 42 GLY H 1 45 GLU QB 2.815 . 3.830 2.923 2.757 3.106 . 0 0 "[ . 1 . 2]" 1 789 1 42 GLY H 1 46 ARG H 3.315 . 4.830 4.820 4.392 4.907 0.077 19 0 "[ . 1 . 2]" 1 790 1 42 GLY QA 1 43 ILE MG 3.115 . 4.430 4.229 4.060 4.418 . 0 0 "[ . 1 . 2]" 1 791 1 42 GLY QA 1 45 GLU H 3.650 . 5.500 3.635 3.453 3.873 . 0 0 "[ . 1 . 2]" 1 792 1 43 ILE H 1 43 ILE HB 2.870 . 3.940 3.594 3.518 3.654 . 0 0 "[ . 1 . 2]" 1 793 1 43 ILE H 1 43 ILE MD 2.875 . 3.950 3.634 3.540 3.709 . 0 0 "[ . 1 . 2]" 1 794 1 43 ILE H 1 43 ILE QG 2.965 . 4.130 1.890 1.793 1.970 0.007 6 0 "[ . 1 . 2]" 1 795 1 43 ILE H 1 43 ILE MG 2.615 . 3.430 3.017 2.747 3.308 . 0 0 "[ . 1 . 2]" 1 796 1 43 ILE H 1 44 ALA H 3.570 . 5.340 2.760 2.610 2.895 . 0 0 "[ . 1 . 2]" 1 797 1 43 ILE H 1 44 ALA MB 3.415 . 5.030 4.379 4.233 4.516 . 0 0 "[ . 1 . 2]" 1 798 1 43 ILE H 1 45 GLU H 3.650 . 5.500 4.397 4.224 4.546 . 0 0 "[ . 1 . 2]" 1 799 1 43 ILE H 1 46 ARG H 3.650 . 5.500 4.915 4.730 5.162 . 0 0 "[ . 1 . 2]" 1 800 1 43 ILE HA 1 43 ILE MD 3.005 . 4.210 4.167 4.111 4.209 . 0 0 "[ . 1 . 2]" 1 801 1 43 ILE HA 1 43 ILE QG 3.015 . 4.230 3.260 3.171 3.317 . 0 0 "[ . 1 . 2]" 1 802 1 43 ILE HA 1 43 ILE MG 2.495 . 3.190 2.189 2.122 2.227 . 0 0 "[ . 1 . 2]" 1 803 1 43 ILE HA 1 46 ARG H 3.095 . 4.390 3.248 3.008 3.476 . 0 0 "[ . 1 . 2]" 1 804 1 43 ILE HA 1 46 ARG QB 2.785 . 3.770 2.585 2.163 3.887 0.117 12 0 "[ . 1 . 2]" 1 805 1 43 ILE HB 1 43 ILE MD 2.500 . 3.200 2.451 2.388 2.516 . 0 0 "[ . 1 . 2]" 1 806 1 43 ILE HB 1 44 ALA H 3.085 . 4.370 3.477 3.287 3.581 . 0 0 "[ . 1 . 2]" 1 807 1 43 ILE MD 1 43 ILE MG 2.385 . 2.970 1.888 1.864 1.921 . 0 0 "[ . 1 . 2]" 1 808 1 43 ILE MD 1 44 ALA H 3.270 . 4.740 4.218 4.060 4.392 . 0 0 "[ . 1 . 2]" 1 809 1 43 ILE QG 1 43 ILE MG 2.605 . 3.410 2.415 2.370 2.468 . 0 0 "[ . 1 . 2]" 1 810 1 43 ILE QG 1 44 ALA H 3.650 . 5.500 2.568 2.363 2.785 . 0 0 "[ . 1 . 2]" 1 811 1 43 ILE QG 1 44 ALA HA 3.240 . 4.680 4.210 3.881 4.525 . 0 0 "[ . 1 . 2]" 1 812 1 43 ILE QG 1 45 GLU H 3.650 . 5.500 4.922 4.757 5.073 . 0 0 "[ . 1 . 2]" 1 813 1 43 ILE MG 1 44 ALA H 3.080 . 4.360 4.304 4.251 4.361 0.001 6 0 "[ . 1 . 2]" 1 814 1 43 ILE MG 1 46 ARG H 3.650 . 5.500 4.813 4.538 5.086 . 0 0 "[ . 1 . 2]" 1 815 1 43 ILE MG 1 46 ARG QB 3.240 . 4.680 3.419 2.917 4.594 . 0 0 "[ . 1 . 2]" 1 816 1 43 ILE MG 1 46 ARG QD 3.350 . 4.900 3.426 2.132 4.661 . 0 0 "[ . 1 . 2]" 1 817 1 43 ILE MG 1 47 GLY H 3.650 . 5.500 4.920 4.564 5.363 . 0 0 "[ . 1 . 2]" 1 818 1 44 ALA H 1 44 ALA MB 2.635 . 3.470 2.187 2.130 2.222 . 0 0 "[ . 1 . 2]" 1 819 1 44 ALA H 1 45 GLU H 3.650 . 5.500 2.735 2.667 2.872 . 0 0 "[ . 1 . 2]" 1 820 1 44 ALA HA 1 47 GLY H 3.130 . 4.460 3.294 3.098 3.487 . 0 0 "[ . 1 . 2]" 1 821 1 44 ALA HA 1 49 VAL MG1 3.370 . 4.940 4.270 3.957 4.511 . 0 0 "[ . 1 . 2]" 1 822 1 44 ALA HA 1 49 VAL MG2 2.660 . 3.520 2.581 2.426 2.740 . 0 0 "[ . 1 . 2]" 1 823 1 44 ALA MB 1 45 GLU H 2.815 . 3.830 2.535 2.376 2.668 . 0 0 "[ . 1 . 2]" 1 824 1 44 ALA MB 1 46 ARG H 3.470 . 5.140 4.453 4.235 4.599 . 0 0 "[ . 1 . 2]" 1 825 1 44 ALA MB 1 47 GLY H 3.555 . 5.310 4.384 4.259 4.558 . 0 0 "[ . 1 . 2]" 1 826 1 44 ALA MB 1 48 GLY H 3.580 . 5.360 4.918 4.692 5.070 . 0 0 "[ . 1 . 2]" 1 827 1 44 ALA MB 1 49 VAL H 3.025 . 4.250 3.954 3.823 4.068 . 0 0 "[ . 1 . 2]" 1 828 1 44 ALA MB 1 49 VAL MG1 2.665 . 3.530 2.416 2.276 2.599 . 0 0 "[ . 1 . 2]" 1 829 1 44 ALA MB 1 49 VAL MG2 2.340 . 2.880 2.100 1.949 2.320 . 0 0 "[ . 1 . 2]" 1 830 1 45 GLU H 1 45 GLU QB 2.735 . 3.670 2.231 2.192 2.297 . 0 0 "[ . 1 . 2]" 1 831 1 45 GLU H 1 45 GLU QG 3.130 . 4.460 3.959 3.914 4.036 . 0 0 "[ . 1 . 2]" 1 832 1 45 GLU H 1 46 ARG H 2.805 . 3.810 2.527 2.428 2.601 . 0 0 "[ . 1 . 2]" 1 833 1 45 GLU H 1 46 ARG QB 3.605 . 5.410 4.606 4.338 5.012 . 0 0 "[ . 1 . 2]" 1 834 1 45 GLU H 1 47 GLY H 3.650 . 5.500 3.777 3.664 3.962 . 0 0 "[ . 1 . 2]" 1 835 1 45 GLU H 1 48 GLY H 3.650 . 5.500 4.828 4.688 5.061 . 0 0 "[ . 1 . 2]" 1 836 1 45 GLU H 1 49 VAL MG1 3.650 . 5.500 5.142 4.917 5.347 . 0 0 "[ . 1 . 2]" 1 837 1 45 GLU H 1 49 VAL MG2 3.650 . 5.500 4.706 4.561 4.893 . 0 0 "[ . 1 . 2]" 1 838 1 45 GLU HA 1 45 GLU QG 2.770 . 3.740 2.506 2.396 3.070 . 0 0 "[ . 1 . 2]" 1 839 1 45 GLU HA 1 47 GLY H 3.320 . 4.840 4.050 3.695 4.353 . 0 0 "[ . 1 . 2]" 1 840 1 45 GLU HA 1 48 GLY H 3.030 . 4.260 3.487 3.255 3.860 . 0 0 "[ . 1 . 2]" 1 841 1 45 GLU HA 1 49 VAL H 2.935 . 4.070 3.405 2.969 3.822 . 0 0 "[ . 1 . 2]" 1 842 1 45 GLU HA 1 49 VAL HB 3.085 . 4.370 3.409 3.089 3.710 . 0 0 "[ . 1 . 2]" 1 843 1 45 GLU HA 1 49 VAL MG1 3.400 . 5.000 4.572 4.297 4.811 . 0 0 "[ . 1 . 2]" 1 844 1 45 GLU QB 1 46 ARG H 2.655 . 3.510 2.473 2.219 2.713 . 0 0 "[ . 1 . 2]" 1 845 1 45 GLU QB 1 47 GLY H 3.545 . 5.290 4.465 4.246 4.658 . 0 0 "[ . 1 . 2]" 1 846 1 45 GLU QB 1 48 GLY H 3.650 . 5.500 4.958 4.809 5.288 . 0 0 "[ . 1 . 2]" 1 847 1 45 GLU QG 1 46 ARG H 3.230 . 4.660 3.617 3.344 4.165 . 0 0 "[ . 1 . 2]" 1 848 1 45 GLU QG 1 46 ARG HA 3.100 . 4.400 3.760 3.453 4.495 0.095 18 0 "[ . 1 . 2]" 1 849 1 46 ARG H 1 46 ARG QB 2.485 . 3.170 2.490 2.273 2.737 . 0 0 "[ . 1 . 2]" 1 850 1 46 ARG H 1 46 ARG QD 3.300 . 4.800 3.865 2.984 4.404 . 0 0 "[ . 1 . 2]" 1 851 1 46 ARG H 1 46 ARG QG 2.785 . 3.770 2.252 1.850 2.676 . 0 0 "[ . 1 . 2]" 1 852 1 46 ARG H 1 47 GLY H 2.765 . 3.730 2.502 2.393 2.634 . 0 0 "[ . 1 . 2]" 1 853 1 46 ARG H 1 47 GLY QA 3.475 . 5.150 4.389 4.279 4.507 . 0 0 "[ . 1 . 2]" 1 854 1 46 ARG H 1 48 GLY H 3.245 . 4.690 4.021 3.936 4.132 . 0 0 "[ . 1 . 2]" 1 855 1 46 ARG H 1 49 VAL H 3.650 . 5.500 5.125 5.010 5.227 . 0 0 "[ . 1 . 2]" 1 856 1 46 ARG H 1 49 VAL MG2 3.650 . 5.500 5.501 5.393 5.532 0.032 18 0 "[ . 1 . 2]" 1 857 1 46 ARG HA 1 46 ARG QB 2.390 . 2.980 2.354 2.162 2.426 . 0 0 "[ . 1 . 2]" 1 858 1 46 ARG HA 1 46 ARG QD 2.955 . 4.110 3.909 2.611 4.182 0.072 8 0 "[ . 1 . 2]" 1 859 1 46 ARG HA 1 46 ARG QG 2.525 . 3.250 2.538 2.272 3.349 0.099 12 0 "[ . 1 . 2]" 1 860 1 46 ARG HA 1 48 GLY H 3.045 . 4.290 3.932 3.665 4.304 0.014 15 0 "[ . 1 . 2]" 1 861 1 46 ARG QB 1 46 ARG QD 2.530 . 3.260 2.171 2.035 2.368 . 0 0 "[ . 1 . 2]" 1 862 1 46 ARG QB 1 47 GLY H 2.850 . 3.900 2.937 2.455 3.729 . 0 0 "[ . 1 . 2]" 1 863 1 46 ARG QB 1 48 GLY H 3.330 . 4.860 4.688 4.510 4.905 0.045 12 0 "[ . 1 . 2]" 1 864 1 46 ARG QG 1 47 GLY H 3.230 . 4.660 4.019 2.855 4.371 . 0 0 "[ . 1 . 2]" 1 865 1 47 GLY H 1 48 GLY H 2.505 . 3.210 2.451 2.147 2.712 . 0 0 "[ . 1 . 2]" 1 866 1 47 GLY H 1 49 VAL MG2 3.595 . 5.390 4.079 3.891 4.310 . 0 0 "[ . 1 . 2]" 1 867 1 47 GLY QA 1 49 VAL MG2 3.160 . 4.520 3.303 2.985 3.684 . 0 0 "[ . 1 . 2]" 1 868 1 48 GLY H 1 49 VAL HA 3.425 . 5.050 4.770 4.593 4.903 . 0 0 "[ . 1 . 2]" 1 869 1 48 GLY H 1 49 VAL HB 3.095 . 4.390 4.049 3.792 4.252 . 0 0 "[ . 1 . 2]" 1 870 1 48 GLY H 1 49 VAL MG1 3.650 . 5.500 5.327 5.133 5.486 . 0 0 "[ . 1 . 2]" 1 871 1 48 GLY H 1 49 VAL MG2 3.100 . 4.400 3.631 3.387 3.794 . 0 0 "[ . 1 . 2]" 1 872 1 49 VAL H 1 49 VAL HB 2.500 . 3.200 2.289 2.244 2.352 . 0 0 "[ . 1 . 2]" 1 873 1 49 VAL H 1 49 VAL MG1 2.930 . 4.060 3.691 3.662 3.722 . 0 0 "[ . 1 . 2]" 1 874 1 49 VAL H 1 49 VAL MG2 2.410 . 3.020 2.258 2.150 2.396 . 0 0 "[ . 1 . 2]" 1 875 1 49 VAL HA 1 49 VAL MG1 2.510 . 3.220 2.509 2.406 2.562 . 0 0 "[ . 1 . 2]" 1 876 1 49 VAL HA 1 49 VAL MG2 2.475 . 3.150 2.350 2.285 2.438 . 0 0 "[ . 1 . 2]" 1 877 1 49 VAL HA 1 50 ARG HA 3.650 . 5.500 4.483 4.400 4.546 . 0 0 "[ . 1 . 2]" 1 878 1 49 VAL HA 1 50 ARG QB 3.400 . 5.000 4.339 4.139 4.579 . 0 0 "[ . 1 . 2]" 1 879 1 49 VAL HA 1 50 ARG QG 3.100 . 4.400 3.890 3.604 4.146 . 0 0 "[ . 1 . 2]" 1 880 1 49 VAL HA 1 84 MET ME 3.005 . 4.210 3.800 3.429 4.191 . 0 0 "[ . 1 . 2]" 1 881 1 49 VAL MG1 1 50 ARG H 2.615 . 3.430 2.529 2.338 2.908 . 0 0 "[ . 1 . 2]" 1 882 1 49 VAL MG1 1 50 ARG HA 3.070 . 4.340 3.423 3.324 3.607 . 0 0 "[ . 1 . 2]" 1 883 1 49 VAL MG1 1 51 VAL HA 3.220 . 4.640 4.289 4.028 4.499 . 0 0 "[ . 1 . 2]" 1 884 1 49 VAL MG1 1 84 MET ME 2.545 . 3.290 3.168 2.907 3.330 0.040 17 0 "[ . 1 . 2]" 1 885 1 49 VAL MG2 1 50 ARG H 3.500 . 5.200 3.894 3.686 4.113 . 0 0 "[ . 1 . 2]" 1 886 1 49 VAL MG2 1 84 MET ME 2.280 . 2.760 2.045 1.856 2.292 . 0 0 "[ . 1 . 2]" 1 887 1 50 ARG H 1 50 ARG QB 2.930 . 4.060 2.687 2.557 2.770 . 0 0 "[ . 1 . 2]" 1 888 1 50 ARG H 1 50 ARG QD 3.235 . 4.670 4.122 3.582 4.418 . 0 0 "[ . 1 . 2]" 1 889 1 50 ARG H 1 50 ARG QG 2.800 . 3.800 3.189 2.854 3.504 . 0 0 "[ . 1 . 2]" 1 890 1 50 ARG H 1 51 VAL H 3.650 . 5.500 4.232 4.162 4.326 . 0 0 "[ . 1 . 2]" 1 891 1 50 ARG HA 1 50 ARG QD 2.755 . 3.710 2.095 1.949 2.277 . 0 0 "[ . 1 . 2]" 1 892 1 50 ARG HA 1 50 ARG QG 2.565 . 3.330 2.882 2.658 3.101 . 0 0 "[ . 1 . 2]" 1 893 1 50 ARG HA 1 51 VAL H 2.405 . 3.010 2.038 1.958 2.162 . 0 0 "[ . 1 . 2]" 1 894 1 50 ARG HA 1 51 VAL HA 3.270 . 4.740 4.172 4.097 4.248 . 0 0 "[ . 1 . 2]" 1 895 1 50 ARG HA 1 51 VAL HB 2.955 . 4.110 4.193 4.161 4.218 0.108 18 0 "[ . 1 . 2]" 1 896 1 50 ARG QB 1 50 ARG QD 2.915 . 4.030 2.504 2.208 2.866 . 0 0 "[ . 1 . 2]" 1 897 1 50 ARG QB 1 51 VAL H 2.975 . 4.150 2.624 2.364 2.851 . 0 0 "[ . 1 . 2]" 1 898 1 50 ARG QB 1 53 HIS H 3.570 . 5.340 4.783 4.276 5.073 . 0 0 "[ . 1 . 2]" 1 899 1 50 ARG QB 1 53 HIS QB 3.375 . 4.950 3.522 3.033 4.181 . 0 0 "[ . 1 . 2]" 1 900 1 50 ARG QD 1 51 VAL H 3.215 . 4.630 3.364 2.869 3.958 . 0 0 "[ . 1 . 2]" 1 901 1 50 ARG QG 1 51 VAL H 2.975 . 4.150 4.237 4.161 4.283 0.133 7 0 "[ . 1 . 2]" 1 902 1 51 VAL H 1 51 VAL HB 2.485 . 3.170 2.211 2.148 2.246 . 0 0 "[ . 1 . 2]" 1 903 1 51 VAL H 1 51 VAL MG1 2.730 . 3.660 3.686 3.668 3.703 0.043 11 0 "[ . 1 . 2]" 1 904 1 51 VAL H 1 51 VAL MG2 2.620 . 3.440 2.314 2.172 2.469 . 0 0 "[ . 1 . 2]" 1 905 1 51 VAL H 1 52 GLY H 3.580 . 5.360 4.570 4.501 4.612 . 0 0 "[ . 1 . 2]" 1 906 1 51 VAL H 1 53 HIS H 3.535 . 5.270 5.045 4.625 5.272 0.002 15 0 "[ . 1 . 2]" 1 907 1 51 VAL H 1 53 HIS HD1 3.650 . 5.500 4.861 3.967 5.483 . 0 0 "[ . 1 . 2]" 1 908 1 51 VAL HA 1 51 VAL MG1 2.525 . 3.250 2.522 2.467 2.564 . 0 0 "[ . 1 . 2]" 1 909 1 51 VAL HA 1 51 VAL MG2 2.455 . 3.110 2.282 2.262 2.298 . 0 0 "[ . 1 . 2]" 1 910 1 51 VAL HA 1 52 GLY H 2.440 . 3.080 2.226 2.172 2.299 . 0 0 "[ . 1 . 2]" 1 911 1 51 VAL HA 1 52 GLY QA 3.100 . 4.400 3.972 3.942 4.019 . 0 0 "[ . 1 . 2]" 1 912 1 51 VAL HA 1 53 HIS H 3.020 . 4.240 3.164 3.015 3.290 . 0 0 "[ . 1 . 2]" 1 913 1 51 VAL HB 1 52 GLY H 3.050 . 4.300 4.074 4.008 4.170 . 0 0 "[ . 1 . 2]" 1 914 1 51 VAL HB 1 53 HIS H 3.650 . 5.500 5.431 5.166 5.526 0.026 17 0 "[ . 1 . 2]" 1 915 1 51 VAL MG1 1 52 GLY H 2.535 . 3.270 2.408 2.311 2.511 . 0 0 "[ . 1 . 2]" 1 916 1 51 VAL MG1 1 52 GLY QA 2.890 . 3.980 3.038 2.966 3.135 . 0 0 "[ . 1 . 2]" 1 917 1 51 VAL MG1 1 53 HIS H 3.000 . 4.200 4.176 4.117 4.218 0.018 8 0 "[ . 1 . 2]" 1 918 1 51 VAL MG2 1 52 GLY H 2.760 . 3.720 3.755 3.736 3.783 0.063 6 0 "[ . 1 . 2]" 1 919 1 52 GLY H 1 53 HIS H 2.755 . 3.710 2.214 2.119 2.302 . 0 0 "[ . 1 . 2]" 1 920 1 52 GLY H 1 53 HIS QB 3.535 . 5.270 4.249 4.112 4.559 . 0 0 "[ . 1 . 2]" 1 921 1 52 GLY H 1 53 HIS HD1 3.650 . 5.500 4.706 4.316 5.141 . 0 0 "[ . 1 . 2]" 1 922 1 52 GLY H 1 89 ALA MB 3.650 . 5.500 5.006 4.693 5.505 0.005 6 0 "[ . 1 . 2]" 1 923 1 52 GLY QA 1 89 ALA MB 3.110 . 4.420 3.455 3.163 3.980 . 0 0 "[ . 1 . 2]" 1 924 1 53 HIS H 1 53 HIS QB 2.690 . 3.580 2.421 2.285 2.575 . 0 0 "[ . 1 . 2]" 1 925 1 53 HIS H 1 53 HIS HD1 3.030 . 4.260 3.433 3.205 3.596 . 0 0 "[ . 1 . 2]" 1 926 1 53 HIS H 1 54 ARG H 3.385 . 4.970 4.367 4.243 4.458 . 0 0 "[ . 1 . 2]" 1 927 1 53 HIS H 1 88 PRO HA 3.530 . 5.260 5.251 5.079 5.292 0.032 18 0 "[ . 1 . 2]" 1 928 1 53 HIS H 1 89 ALA MB 3.360 . 4.920 4.026 3.545 4.778 . 0 0 "[ . 1 . 2]" 1 929 1 53 HIS HA 1 54 ARG H 2.665 . 3.530 2.122 2.023 2.237 . 0 0 "[ . 1 . 2]" 1 930 1 53 HIS HA 1 88 PRO HA 2.755 . 3.710 2.833 2.725 2.911 . 0 0 "[ . 1 . 2]" 1 931 1 53 HIS HA 1 89 ALA H 2.765 . 3.730 2.956 2.659 3.325 . 0 0 "[ . 1 . 2]" 1 932 1 53 HIS QB 1 54 ARG H 2.950 . 4.100 2.908 2.664 3.132 . 0 0 "[ . 1 . 2]" 1 933 1 53 HIS QB 1 54 ARG QB 3.430 . 5.060 4.583 4.392 4.718 . 0 0 "[ . 1 . 2]" 1 934 1 53 HIS QB 1 86 THR H 3.650 . 5.500 5.349 5.220 5.427 . 0 0 "[ . 1 . 2]" 1 935 1 53 HIS QB 1 86 THR HA 3.285 . 4.770 3.891 3.624 4.021 . 0 0 "[ . 1 . 2]" 1 936 1 53 HIS QB 1 86 THR HB 2.715 . 3.630 1.826 1.777 1.988 0.023 9 0 "[ . 1 . 2]" 1 937 1 53 HIS QB 1 86 THR MG 2.855 . 3.910 3.024 2.887 3.283 . 0 0 "[ . 1 . 2]" 1 938 1 53 HIS QB 1 87 MET H 2.900 . 4.000 3.485 3.209 3.624 . 0 0 "[ . 1 . 2]" 1 939 1 53 HIS QB 1 87 MET HA 3.440 . 5.080 5.003 4.537 5.130 0.050 19 0 "[ . 1 . 2]" 1 940 1 53 HIS QB 1 89 ALA H 3.595 . 5.390 4.473 4.313 4.657 . 0 0 "[ . 1 . 2]" 1 941 1 53 HIS HD1 1 54 ARG H 3.630 . 5.460 4.299 3.822 4.502 . 0 0 "[ . 1 . 2]" 1 942 1 53 HIS HD1 1 88 PRO HA 3.015 . 4.230 3.037 2.682 3.614 . 0 0 "[ . 1 . 2]" 1 943 1 53 HIS HD1 1 88 PRO QB 3.400 . 5.000 4.286 3.902 4.972 . 0 0 "[ . 1 . 2]" 1 944 1 53 HIS HD1 1 89 ALA H 3.280 . 4.760 4.739 4.380 4.813 0.053 19 0 "[ . 1 . 2]" 1 945 1 54 ARG H 1 54 ARG QB 2.700 . 3.600 2.347 2.141 2.464 . 0 0 "[ . 1 . 2]" 1 946 1 54 ARG H 1 54 ARG QD 3.650 . 5.500 4.713 4.237 5.071 . 0 0 "[ . 1 . 2]" 1 947 1 54 ARG H 1 54 ARG QG 3.285 . 4.770 3.985 3.861 4.030 . 0 0 "[ . 1 . 2]" 1 948 1 54 ARG H 1 55 ILE H 3.650 . 5.500 4.307 4.206 4.374 . 0 0 "[ . 1 . 2]" 1 949 1 54 ARG H 1 55 ILE HA 3.650 . 5.500 4.925 4.766 5.104 . 0 0 "[ . 1 . 2]" 1 950 1 54 ARG H 1 56 ILE MG 3.315 . 4.830 4.678 4.356 4.855 0.025 19 0 "[ . 1 . 2]" 1 951 1 54 ARG H 1 86 THR HA 3.650 . 5.500 4.401 4.186 4.573 . 0 0 "[ . 1 . 2]" 1 952 1 54 ARG H 1 86 THR HB 3.110 . 4.420 3.755 3.440 4.080 . 0 0 "[ . 1 . 2]" 1 953 1 54 ARG H 1 86 THR MG 3.420 . 5.040 4.865 4.641 5.050 0.010 15 0 "[ . 1 . 2]" 1 954 1 54 ARG H 1 87 MET H 2.795 . 3.790 2.745 2.532 2.893 . 0 0 "[ . 1 . 2]" 1 955 1 54 ARG H 1 87 MET QB 3.330 . 4.860 3.461 3.148 3.688 . 0 0 "[ . 1 . 2]" 1 956 1 54 ARG H 1 87 MET QG 3.335 . 4.870 4.872 4.740 4.926 0.056 10 0 "[ . 1 . 2]" 1 957 1 54 ARG H 1 88 PRO HA 3.140 . 4.480 4.025 3.885 4.117 . 0 0 "[ . 1 . 2]" 1 958 1 54 ARG H 1 88 PRO QD 3.650 . 5.500 4.990 4.867 5.082 . 0 0 "[ . 1 . 2]" 1 959 1 54 ARG H 1 89 ALA H 3.095 . 4.390 2.315 2.105 2.620 . 0 0 "[ . 1 . 2]" 1 960 1 54 ARG H 1 89 ALA HA 3.500 . 5.200 2.952 2.475 3.352 . 0 0 "[ . 1 . 2]" 1 961 1 54 ARG H 1 89 ALA MB 2.950 . 4.100 2.875 2.625 3.093 . 0 0 "[ . 1 . 2]" 1 962 1 54 ARG HA 1 54 ARG QD 3.385 . 4.970 4.108 3.846 4.299 . 0 0 "[ . 1 . 2]" 1 963 1 54 ARG HA 1 54 ARG QG 3.030 . 4.260 2.511 2.386 2.703 . 0 0 "[ . 1 . 2]" 1 964 1 54 ARG HA 1 55 ILE H 2.695 . 3.590 2.107 2.030 2.193 . 0 0 "[ . 1 . 2]" 1 965 1 54 ARG HA 1 55 ILE HB 3.305 . 4.810 4.672 4.577 4.768 . 0 0 "[ . 1 . 2]" 1 966 1 54 ARG HA 1 55 ILE QG 3.430 . 5.060 3.655 3.460 3.834 . 0 0 "[ . 1 . 2]" 1 967 1 54 ARG QB 1 54 ARG QD 2.810 . 3.820 2.260 2.068 2.416 . 0 0 "[ . 1 . 2]" 1 968 1 54 ARG QB 1 54 ARG HE 3.315 . 4.830 2.863 2.117 3.931 . 0 0 "[ . 1 . 2]" 1 969 1 54 ARG QB 1 87 MET H 2.930 . 4.060 3.233 2.972 3.468 . 0 0 "[ . 1 . 2]" 1 970 1 54 ARG QB 1 87 MET QG 3.125 . 4.450 4.124 3.807 4.408 . 0 0 "[ . 1 . 2]" 1 971 1 54 ARG QB 1 89 ALA H 3.265 . 4.730 2.903 2.613 3.077 . 0 0 "[ . 1 . 2]" 1 972 1 54 ARG QB 1 89 ALA HA 2.870 . 3.940 1.868 1.765 1.987 0.035 18 0 "[ . 1 . 2]" 1 973 1 54 ARG QB 1 89 ALA MB 2.770 . 3.740 2.478 2.157 2.733 . 0 0 "[ . 1 . 2]" 1 974 1 54 ARG QB 1 90 ALA H 3.600 . 5.400 3.898 3.236 4.484 . 0 0 "[ . 1 . 2]" 1 975 1 54 ARG QD 1 54 ARG QG 2.380 . 2.960 2.025 1.977 2.101 . 0 0 "[ . 1 . 2]" 1 976 1 54 ARG QD 1 55 ILE H 3.650 . 5.500 4.815 4.295 5.279 . 0 0 "[ . 1 . 2]" 1 977 1 54 ARG QD 1 56 ILE MG 2.870 . 3.940 3.035 2.094 3.854 . 0 0 "[ . 1 . 2]" 1 978 1 54 ARG QD 1 64 VAL MG2 3.130 . 4.460 2.719 1.879 3.744 . 0 0 "[ . 1 . 2]" 1 979 1 54 ARG QD 1 89 ALA MB 3.300 . 4.800 4.061 3.205 4.847 0.047 5 0 "[ . 1 . 2]" 1 980 1 54 ARG HE 1 56 ILE MG 3.555 . 5.310 3.644 1.906 5.295 . 0 0 "[ . 1 . 2]" 1 981 1 54 ARG HE 1 89 ALA HA 3.650 . 5.500 3.938 2.447 5.542 0.042 6 0 "[ . 1 . 2]" 1 982 1 54 ARG QG 1 55 ILE H 3.070 . 4.340 2.887 2.406 3.337 . 0 0 "[ . 1 . 2]" 1 983 1 54 ARG QG 1 55 ILE HB 3.410 . 5.020 4.384 3.818 4.921 . 0 0 "[ . 1 . 2]" 1 984 1 54 ARG QG 1 56 ILE HA 3.380 . 4.960 3.748 3.433 4.202 . 0 0 "[ . 1 . 2]" 1 985 1 54 ARG QG 1 56 ILE MG 2.715 . 3.630 2.629 2.140 2.967 . 0 0 "[ . 1 . 2]" 1 986 1 54 ARG QG 1 87 MET H 3.470 . 5.140 4.305 3.723 4.509 . 0 0 "[ . 1 . 2]" 1 987 1 54 ARG QG 1 87 MET QG 3.315 . 4.830 4.740 3.773 4.883 0.053 16 0 "[ . 1 . 2]" 1 988 1 55 ILE H 1 55 ILE HB 2.670 . 3.540 2.582 2.504 2.683 . 0 0 "[ . 1 . 2]" 1 989 1 55 ILE H 1 55 ILE MD 2.715 . 3.630 3.599 3.110 3.707 0.077 15 0 "[ . 1 . 2]" 1 990 1 55 ILE H 1 55 ILE QG 2.775 . 3.750 2.154 1.975 2.222 . 0 0 "[ . 1 . 2]" 1 991 1 55 ILE HA 1 55 ILE MD 2.890 . 3.980 3.530 2.329 3.769 . 0 0 "[ . 1 . 2]" 1 992 1 55 ILE HA 1 55 ILE QG 2.940 . 4.080 2.539 2.402 3.079 . 0 0 "[ . 1 . 2]" 1 993 1 55 ILE HA 1 55 ILE MG 2.400 . 3.000 2.329 2.275 2.380 . 0 0 "[ . 1 . 2]" 1 994 1 55 ILE HA 1 56 ILE H 2.490 . 3.180 2.106 2.062 2.209 . 0 0 "[ . 1 . 2]" 1 995 1 55 ILE HA 1 56 ILE QG 3.345 . 4.890 3.924 3.748 4.202 . 0 0 "[ . 1 . 2]" 1 996 1 55 ILE HA 1 56 ILE MG 2.920 . 4.040 3.587 3.458 3.748 . 0 0 "[ . 1 . 2]" 1 997 1 55 ILE HA 1 57 GLU H 3.070 . 4.340 3.523 3.440 3.616 . 0 0 "[ . 1 . 2]" 1 998 1 55 ILE HA 1 63 VAL MG2 3.370 . 4.940 4.652 4.387 4.826 . 0 0 "[ . 1 . 2]" 1 999 1 55 ILE HA 1 85 LYS H 3.650 . 5.500 4.321 4.113 4.511 . 0 0 "[ . 1 . 2]" 1 1000 1 55 ILE HA 1 86 THR H 3.650 . 5.500 4.689 4.591 4.954 . 0 0 "[ . 1 . 2]" 1 1001 1 55 ILE HA 1 86 THR HA 2.755 . 3.710 2.256 2.133 2.587 . 0 0 "[ . 1 . 2]" 1 1002 1 55 ILE HA 1 86 THR HB 3.190 . 4.580 3.543 3.343 3.799 . 0 0 "[ . 1 . 2]" 1 1003 1 55 ILE HA 1 86 THR MG 2.470 . 3.140 2.194 2.115 2.276 . 0 0 "[ . 1 . 2]" 1 1004 1 55 ILE HA 1 87 MET H 3.240 . 4.680 3.742 3.512 4.122 . 0 0 "[ . 1 . 2]" 1 1005 1 55 ILE HB 1 63 VAL MG2 2.905 . 4.010 3.171 2.882 3.460 . 0 0 "[ . 1 . 2]" 1 1006 1 55 ILE MD 1 57 GLU H 3.215 . 4.630 4.783 4.665 4.841 0.211 12 0 "[ . 1 . 2]" 1 1007 1 55 ILE MD 1 84 MET QB 3.310 . 4.820 3.323 2.839 4.139 . 0 0 "[ . 1 . 2]" 1 1008 1 55 ILE MD 1 84 MET ME 2.135 . 2.470 2.465 2.015 2.551 0.081 20 0 "[ . 1 . 2]" 1 1009 1 55 ILE MD 1 84 MET QG 3.185 . 4.570 3.612 2.718 3.992 . 0 0 "[ . 1 . 2]" 1 1010 1 55 ILE QG 1 55 ILE MG 2.560 . 3.320 2.364 2.330 2.397 . 0 0 "[ . 1 . 2]" 1 1011 1 55 ILE QG 1 86 THR MG 2.605 . 3.410 2.113 1.835 3.490 0.080 4 0 "[ . 1 . 2]" 1 1012 1 55 ILE MG 1 56 ILE H 2.520 . 3.240 2.733 2.621 3.022 . 0 0 "[ . 1 . 2]" 1 1013 1 55 ILE MG 1 56 ILE HA 2.950 . 4.100 3.733 3.612 3.926 . 0 0 "[ . 1 . 2]" 1 1014 1 55 ILE MG 1 57 GLU H 2.560 . 3.320 2.090 1.935 2.584 . 0 0 "[ . 1 . 2]" 1 1015 1 55 ILE MG 1 57 GLU HA 3.050 . 4.300 3.793 3.687 3.959 . 0 0 "[ . 1 . 2]" 1 1016 1 55 ILE MG 1 58 ILE H 3.250 . 4.700 4.269 4.162 4.414 . 0 0 "[ . 1 . 2]" 1 1017 1 55 ILE MG 1 63 VAL MG2 2.310 . 2.820 2.353 2.115 2.489 . 0 0 "[ . 1 . 2]" 1 1018 1 55 ILE MG 1 84 MET HA 2.865 . 3.930 3.688 3.533 3.979 0.049 4 0 "[ . 1 . 2]" 1 1019 1 55 ILE MG 1 84 MET QB 2.725 . 3.650 2.486 2.082 3.699 0.049 20 0 "[ . 1 . 2]" 1 1020 1 55 ILE MG 1 84 MET QG 2.555 . 3.310 3.070 1.914 3.350 0.040 15 0 "[ . 1 . 2]" 1 1021 1 55 ILE MG 1 85 LYS H 2.945 . 4.090 2.893 2.641 3.473 . 0 0 "[ . 1 . 2]" 1 1022 1 55 ILE MG 1 86 THR HA 3.000 . 4.200 3.794 3.599 4.198 . 0 0 "[ . 1 . 2]" 1 1023 1 56 ILE H 1 56 ILE MD 2.885 . 3.970 3.732 3.242 3.930 . 0 0 "[ . 1 . 2]" 1 1024 1 56 ILE H 1 56 ILE QG 2.845 . 3.890 2.185 2.098 2.346 . 0 0 "[ . 1 . 2]" 1 1025 1 56 ILE H 1 56 ILE MG 2.620 . 3.440 2.563 2.452 2.736 . 0 0 "[ . 1 . 2]" 1 1026 1 56 ILE H 1 57 GLU H 2.615 . 3.430 2.192 2.128 2.273 . 0 0 "[ . 1 . 2]" 1 1027 1 56 ILE H 1 57 GLU HA 3.650 . 5.500 4.876 4.808 4.928 . 0 0 "[ . 1 . 2]" 1 1028 1 56 ILE H 1 63 VAL MG2 3.040 . 4.280 4.235 4.121 4.307 0.027 15 0 "[ . 1 . 2]" 1 1029 1 56 ILE H 1 64 VAL HB 3.650 . 5.500 4.824 4.741 4.951 . 0 0 "[ . 1 . 2]" 1 1030 1 56 ILE H 1 64 VAL MG2 3.075 . 4.350 4.442 4.420 4.479 0.129 8 0 "[ . 1 . 2]" 1 1031 1 56 ILE H 1 85 LYS H 3.390 . 4.980 3.561 3.464 3.693 . 0 0 "[ . 1 . 2]" 1 1032 1 56 ILE H 1 85 LYS QB 3.255 . 4.710 3.341 3.136 3.673 . 0 0 "[ . 1 . 2]" 1 1033 1 56 ILE H 1 85 LYS QG 3.590 . 5.380 5.058 4.884 5.385 0.005 7 0 "[ . 1 . 2]" 1 1034 1 56 ILE H 1 86 THR H 3.650 . 5.500 4.577 4.427 4.672 . 0 0 "[ . 1 . 2]" 1 1035 1 56 ILE H 1 86 THR HA 2.885 . 3.970 2.700 2.489 2.862 . 0 0 "[ . 1 . 2]" 1 1036 1 56 ILE H 1 86 THR MG 2.675 . 3.550 3.576 3.525 3.610 0.060 15 0 "[ . 1 . 2]" 1 1037 1 56 ILE HA 1 56 ILE MD 2.835 . 3.870 3.989 3.672 4.067 0.197 5 0 "[ . 1 . 2]" 1 1038 1 56 ILE HA 1 56 ILE MG 2.385 . 2.970 2.367 2.328 2.415 . 0 0 "[ . 1 . 2]" 1 1039 1 56 ILE HA 1 63 VAL H 3.175 . 4.550 3.879 3.677 4.101 . 0 0 "[ . 1 . 2]" 1 1040 1 56 ILE HA 1 63 VAL MG2 2.620 . 3.440 3.345 3.192 3.456 0.016 7 0 "[ . 1 . 2]" 1 1041 1 56 ILE HA 1 64 VAL H 3.190 . 4.580 3.490 3.341 3.591 . 0 0 "[ . 1 . 2]" 1 1042 1 56 ILE HA 1 64 VAL HA 2.935 . 4.070 3.033 2.655 3.305 . 0 0 "[ . 1 . 2]" 1 1043 1 56 ILE HA 1 64 VAL HB 2.830 . 3.860 2.077 1.964 2.164 . 0 0 "[ . 1 . 2]" 1 1044 1 56 ILE HA 1 64 VAL MG1 2.780 . 3.760 3.742 3.630 3.794 0.034 13 0 "[ . 1 . 2]" 1 1045 1 56 ILE HA 1 64 VAL MG2 2.510 . 3.220 2.332 2.218 2.488 . 0 0 "[ . 1 . 2]" 1 1046 1 56 ILE HA 1 85 LYS H 3.650 . 5.500 5.695 5.651 5.751 0.251 20 0 "[ . 1 . 2]" 1 1047 1 56 ILE HB 1 56 ILE MD 2.500 . 3.200 2.291 2.250 2.357 . 0 0 "[ . 1 . 2]" 1 1048 1 56 ILE HB 1 64 VAL H 3.450 . 5.100 4.361 4.179 4.696 . 0 0 "[ . 1 . 2]" 1 1049 1 56 ILE HB 1 64 VAL MG1 2.770 . 3.740 3.205 3.049 3.477 . 0 0 "[ . 1 . 2]" 1 1050 1 56 ILE HB 1 64 VAL MG2 2.590 . 3.380 2.774 2.498 3.018 . 0 0 "[ . 1 . 2]" 1 1051 1 56 ILE MD 1 57 GLU H 3.140 . 4.480 4.265 3.167 4.531 0.051 20 0 "[ . 1 . 2]" 1 1052 1 56 ILE MD 1 85 LYS HA 3.370 . 4.940 4.580 4.160 4.757 . 0 0 "[ . 1 . 2]" 1 1053 1 56 ILE MD 1 85 LYS QB 2.675 . 3.550 2.294 1.858 2.476 . 0 0 "[ . 1 . 2]" 1 1054 1 56 ILE MD 1 85 LYS QD 3.180 . 4.560 3.799 3.376 4.399 . 0 0 "[ . 1 . 2]" 1 1055 1 56 ILE MD 1 85 LYS QG 2.910 . 4.020 3.394 2.533 4.033 0.013 17 0 "[ . 1 . 2]" 1 1056 1 56 ILE MD 1 86 THR H 3.320 . 4.840 4.769 4.383 4.870 0.030 8 0 "[ . 1 . 2]" 1 1057 1 56 ILE MD 1 87 MET QG 2.825 . 3.850 2.582 2.079 3.723 . 0 0 "[ . 1 . 2]" 1 1058 1 56 ILE QG 1 56 ILE MG 2.285 . 2.770 2.235 2.019 2.317 . 0 0 "[ . 1 . 2]" 1 1059 1 56 ILE QG 1 57 GLU H 2.980 . 4.160 2.973 2.827 3.507 . 0 0 "[ . 1 . 2]" 1 1060 1 56 ILE QG 1 57 GLU QB 3.155 . 4.510 2.760 2.358 3.864 . 0 0 "[ . 1 . 2]" 1 1061 1 56 ILE QG 1 85 LYS H 3.510 . 5.220 3.724 3.550 4.206 . 0 0 "[ . 1 . 2]" 1 1062 1 56 ILE QG 1 85 LYS QB 3.020 . 4.240 1.976 1.804 2.705 . 0 0 "[ . 1 . 2]" 1 1063 1 56 ILE QG 1 86 THR H 3.505 . 5.210 4.088 3.865 4.180 . 0 0 "[ . 1 . 2]" 1 1064 1 56 ILE QG 1 86 THR HA 3.180 . 4.560 3.290 2.958 3.420 . 0 0 "[ . 1 . 2]" 1 1065 1 56 ILE QG 1 87 MET H 3.585 . 5.370 4.184 3.682 4.564 . 0 0 "[ . 1 . 2]" 1 1066 1 56 ILE QG 1 87 MET QG 3.365 . 4.930 2.839 2.039 3.176 . 0 0 "[ . 1 . 2]" 1 1067 1 56 ILE MG 1 57 GLU H 3.090 . 4.380 4.151 4.066 4.326 . 0 0 "[ . 1 . 2]" 1 1068 1 56 ILE MG 1 64 VAL H 3.425 . 5.050 4.907 4.798 5.067 0.017 13 0 "[ . 1 . 2]" 1 1069 1 56 ILE MG 1 64 VAL HA 2.960 . 4.120 4.025 3.815 4.153 0.033 15 0 "[ . 1 . 2]" 1 1070 1 56 ILE MG 1 64 VAL HB 2.735 . 3.670 3.022 2.791 3.280 . 0 0 "[ . 1 . 2]" 1 1071 1 56 ILE MG 1 64 VAL MG2 2.385 . 2.970 1.862 1.770 1.964 0.030 11 0 "[ . 1 . 2]" 1 1072 1 56 ILE MG 1 86 THR HA 2.960 . 4.120 3.356 3.122 3.611 . 0 0 "[ . 1 . 2]" 1 1073 1 56 ILE MG 1 87 MET H 2.870 . 3.940 3.184 2.892 3.440 . 0 0 "[ . 1 . 2]" 1 1074 1 56 ILE MG 1 87 MET QB 2.820 . 3.840 3.058 2.766 3.341 . 0 0 "[ . 1 . 2]" 1 1075 1 56 ILE MG 1 87 MET QG 2.630 . 3.460 2.148 1.979 2.447 . 0 0 "[ . 1 . 2]" 1 1076 1 57 GLU H 1 57 GLU QB 2.805 . 3.810 2.825 2.757 2.943 . 0 0 "[ . 1 . 2]" 1 1077 1 57 GLU H 1 57 GLU QG 3.380 . 4.960 4.181 4.124 4.258 . 0 0 "[ . 1 . 2]" 1 1078 1 57 GLU H 1 58 ILE H 3.465 . 5.130 4.195 4.148 4.254 . 0 0 "[ . 1 . 2]" 1 1079 1 57 GLU H 1 62 SER HA 3.650 . 5.500 4.539 4.364 4.910 . 0 0 "[ . 1 . 2]" 1 1080 1 57 GLU H 1 63 VAL MG2 2.910 . 4.020 3.055 2.947 3.185 . 0 0 "[ . 1 . 2]" 1 1081 1 57 GLU H 1 84 MET HA 3.345 . 4.890 4.139 3.955 4.351 . 0 0 "[ . 1 . 2]" 1 1082 1 57 GLU H 1 84 MET QB 3.570 . 5.340 4.136 3.802 5.301 . 0 0 "[ . 1 . 2]" 1 1083 1 57 GLU H 1 84 MET QG 3.650 . 5.500 4.876 3.628 5.283 . 0 0 "[ . 1 . 2]" 1 1084 1 57 GLU H 1 85 LYS H 2.880 . 3.960 2.531 2.448 2.668 . 0 0 "[ . 1 . 2]" 1 1085 1 57 GLU H 1 85 LYS QB 3.010 . 4.220 3.088 2.823 3.506 . 0 0 "[ . 1 . 2]" 1 1086 1 57 GLU H 1 85 LYS QG 3.285 . 4.770 4.315 4.029 4.780 0.010 7 0 "[ . 1 . 2]" 1 1087 1 57 GLU H 1 86 THR H 3.650 . 5.500 5.531 5.433 5.582 0.082 13 0 "[ . 1 . 2]" 1 1088 1 57 GLU H 1 86 THR HA 3.280 . 4.760 4.517 4.411 4.625 . 0 0 "[ . 1 . 2]" 1 1089 1 57 GLU H 1 86 THR MG 3.105 . 4.410 4.364 4.232 4.451 0.041 1 0 "[ . 1 . 2]" 1 1090 1 57 GLU HA 1 57 GLU QG 2.555 . 3.310 2.458 2.394 2.518 . 0 0 "[ . 1 . 2]" 1 1091 1 57 GLU HA 1 58 ILE H 2.455 . 3.110 2.134 2.065 2.178 . 0 0 "[ . 1 . 2]" 1 1092 1 57 GLU HA 1 58 ILE HB 3.075 . 4.350 4.385 4.351 4.410 0.060 14 0 "[ . 1 . 2]" 1 1093 1 57 GLU HA 1 58 ILE MD 3.225 . 4.650 4.661 4.590 4.760 0.110 11 0 "[ . 1 . 2]" 1 1094 1 57 GLU HA 1 60 GLY H 3.635 . 5.470 5.006 4.772 5.376 . 0 0 "[ . 1 . 2]" 1 1095 1 57 GLU HA 1 61 GLN H 3.210 . 4.620 4.494 4.368 4.628 0.008 17 0 "[ . 1 . 2]" 1 1096 1 57 GLU HA 1 62 SER H 3.650 . 5.500 4.443 4.345 4.753 . 0 0 "[ . 1 . 2]" 1 1097 1 57 GLU HA 1 62 SER HA 2.500 . 3.200 2.127 1.920 2.452 . 0 0 "[ . 1 . 2]" 1 1098 1 57 GLU HA 1 63 VAL H 2.715 . 3.630 2.139 1.955 2.370 . 0 0 "[ . 1 . 2]" 1 1099 1 57 GLU HA 1 63 VAL MG1 2.750 . 3.700 2.968 2.890 3.058 . 0 0 "[ . 1 . 2]" 1 1100 1 57 GLU HA 1 63 VAL MG2 2.695 . 3.590 2.472 2.294 2.680 . 0 0 "[ . 1 . 2]" 1 1101 1 57 GLU HA 1 64 VAL H 3.325 . 4.850 4.202 3.972 4.519 . 0 0 "[ . 1 . 2]" 1 1102 1 57 GLU HA 1 85 LYS H 3.650 . 5.500 4.381 4.260 4.511 . 0 0 "[ . 1 . 2]" 1 1103 1 57 GLU QB 1 58 ILE H 3.130 . 4.460 3.520 3.479 3.561 . 0 0 "[ . 1 . 2]" 1 1104 1 57 GLU QB 1 61 GLN H 3.345 . 4.890 4.926 4.890 4.967 0.077 16 0 "[ . 1 . 2]" 1 1105 1 57 GLU QB 1 62 SER HA 3.235 . 4.670 2.751 2.351 3.154 . 0 0 "[ . 1 . 2]" 1 1106 1 57 GLU QB 1 63 VAL H 3.125 . 4.450 3.905 3.626 4.214 . 0 0 "[ . 1 . 2]" 1 1107 1 57 GLU QB 1 85 LYS H 3.045 . 4.290 2.652 2.320 3.011 . 0 0 "[ . 1 . 2]" 1 1108 1 57 GLU QB 1 85 LYS QB 2.740 . 3.680 2.165 2.054 2.309 . 0 0 "[ . 1 . 2]" 1 1109 1 57 GLU QB 1 85 LYS QE 3.450 . 5.100 3.803 3.034 4.176 . 0 0 "[ . 1 . 2]" 1 1110 1 57 GLU QB 1 85 LYS QG 2.790 . 3.780 2.165 1.993 2.665 . 0 0 "[ . 1 . 2]" 1 1111 1 57 GLU QG 1 58 ILE H 2.735 . 3.670 2.352 2.092 2.483 . 0 0 "[ . 1 . 2]" 1 1112 1 57 GLU QG 1 59 ASN HA 3.480 . 5.160 5.016 4.549 5.204 0.044 9 0 "[ . 1 . 2]" 1 1113 1 57 GLU QG 1 60 GLY H 2.775 . 3.750 2.447 2.172 2.710 . 0 0 "[ . 1 . 2]" 1 1114 1 57 GLU QG 1 60 GLY QA 3.200 . 4.600 3.118 2.749 3.550 . 0 0 "[ . 1 . 2]" 1 1115 1 57 GLU QG 1 61 GLN H 2.845 . 3.890 2.857 2.813 2.926 . 0 0 "[ . 1 . 2]" 1 1116 1 57 GLU QG 1 62 SER HA 2.905 . 4.010 2.705 2.353 3.298 . 0 0 "[ . 1 . 2]" 1 1117 1 57 GLU QG 1 63 VAL MG1 2.850 . 3.900 3.953 3.909 4.016 0.116 11 0 "[ . 1 . 2]" 1 1118 1 57 GLU QG 1 85 LYS QB 3.135 . 4.470 4.178 4.002 4.295 . 0 0 "[ . 1 . 2]" 1 1119 1 57 GLU QG 1 85 LYS QG 3.050 . 4.300 3.449 3.188 3.616 . 0 0 "[ . 1 . 2]" 1 1120 1 58 ILE H 1 58 ILE HB 2.680 . 3.560 2.711 2.635 2.770 . 0 0 "[ . 1 . 2]" 1 1121 1 58 ILE H 1 58 ILE MD 3.005 . 4.210 4.006 3.904 4.060 . 0 0 "[ . 1 . 2]" 1 1122 1 58 ILE H 1 58 ILE MG 2.900 . 4.000 3.856 3.833 3.875 . 0 0 "[ . 1 . 2]" 1 1123 1 58 ILE H 1 59 ASN H 3.335 . 4.870 4.017 3.907 4.068 . 0 0 "[ . 1 . 2]" 1 1124 1 58 ILE H 1 60 GLY H 3.415 . 5.030 3.482 3.242 3.806 . 0 0 "[ . 1 . 2]" 1 1125 1 58 ILE H 1 60 GLY QA 3.650 . 5.500 4.861 4.642 5.018 . 0 0 "[ . 1 . 2]" 1 1126 1 58 ILE H 1 61 GLN H 2.775 . 3.750 2.939 2.820 3.074 . 0 0 "[ . 1 . 2]" 1 1127 1 58 ILE H 1 61 GLN QG 3.020 . 4.240 3.284 3.092 4.147 . 0 0 "[ . 1 . 2]" 1 1128 1 58 ILE H 1 62 SER HA 3.270 . 4.740 3.650 3.472 3.868 . 0 0 "[ . 1 . 2]" 1 1129 1 58 ILE H 1 63 VAL H 3.360 . 4.920 3.536 3.429 3.662 . 0 0 "[ . 1 . 2]" 1 1130 1 58 ILE H 1 63 VAL HB 3.650 . 5.500 5.291 5.135 5.410 . 0 0 "[ . 1 . 2]" 1 1131 1 58 ILE H 1 63 VAL MG1 2.675 . 3.550 2.521 2.407 2.612 . 0 0 "[ . 1 . 2]" 1 1132 1 58 ILE H 1 63 VAL MG2 2.835 . 3.870 3.138 2.963 3.255 . 0 0 "[ . 1 . 2]" 1 1133 1 58 ILE H 1 84 MET HA 3.650 . 5.500 4.306 4.202 4.453 . 0 0 "[ . 1 . 2]" 1 1134 1 58 ILE H 1 85 LYS H 3.650 . 5.500 4.862 4.760 4.979 . 0 0 "[ . 1 . 2]" 1 1135 1 58 ILE HA 1 58 ILE MD 3.005 . 4.210 3.876 3.852 3.899 . 0 0 "[ . 1 . 2]" 1 1136 1 58 ILE HA 1 58 ILE MG 2.585 . 3.370 2.397 2.331 2.452 . 0 0 "[ . 1 . 2]" 1 1137 1 58 ILE HA 1 59 ASN H 2.630 . 3.460 2.116 2.069 2.155 . 0 0 "[ . 1 . 2]" 1 1138 1 58 ILE HA 1 83 HIS H 3.650 . 5.500 4.917 4.175 5.199 . 0 0 "[ . 1 . 2]" 1 1139 1 58 ILE HA 1 84 MET HA 2.830 . 3.860 2.385 2.254 2.508 . 0 0 "[ . 1 . 2]" 1 1140 1 58 ILE HA 1 84 MET QG 3.115 . 4.430 2.252 2.075 2.531 . 0 0 "[ . 1 . 2]" 1 1141 1 58 ILE HA 1 85 LYS H 3.325 . 4.850 4.093 3.903 4.243 . 0 0 "[ . 1 . 2]" 1 1142 1 58 ILE HB 1 58 ILE MD 2.245 . 2.690 2.300 2.251 2.341 . 0 0 "[ . 1 . 2]" 1 1143 1 58 ILE HB 1 59 ASN H 3.175 . 4.550 4.215 4.147 4.277 . 0 0 "[ . 1 . 2]" 1 1144 1 58 ILE HB 1 60 GLY H 3.650 . 5.500 4.948 4.527 5.292 . 0 0 "[ . 1 . 2]" 1 1145 1 58 ILE HB 1 61 GLN H 3.305 . 4.810 4.312 4.203 4.441 . 0 0 "[ . 1 . 2]" 1 1146 1 58 ILE HB 1 63 VAL H 3.650 . 5.500 4.911 4.780 5.059 . 0 0 "[ . 1 . 2]" 1 1147 1 58 ILE HB 1 63 VAL MG1 2.330 . 2.860 2.176 1.993 2.358 . 0 0 "[ . 1 . 2]" 1 1148 1 58 ILE HB 1 63 VAL MG2 2.505 . 3.210 3.233 3.204 3.267 0.057 6 0 "[ . 1 . 2]" 1 1149 1 58 ILE MD 1 63 VAL H 3.080 . 4.360 4.518 4.465 4.558 0.198 6 0 "[ . 1 . 2]" 1 1150 1 58 ILE MD 1 63 VAL HB 2.840 . 3.880 3.046 2.921 3.222 . 0 0 "[ . 1 . 2]" 1 1151 1 58 ILE MD 1 63 VAL MG2 2.500 . 3.200 1.808 1.787 1.830 0.013 5 0 "[ . 1 . 2]" 1 1152 1 58 ILE MD 1 71 ILE HA 3.010 . 4.220 3.209 3.033 3.521 . 0 0 "[ . 1 . 2]" 1 1153 1 58 ILE MD 1 84 MET QG 3.170 . 4.540 3.766 3.395 4.028 . 0 0 "[ . 1 . 2]" 1 1154 1 58 ILE MG 1 59 ASN H 2.560 . 3.320 2.828 2.729 2.905 . 0 0 "[ . 1 . 2]" 1 1155 1 58 ILE MG 1 59 ASN HA 3.010 . 4.220 3.877 3.680 4.188 . 0 0 "[ . 1 . 2]" 1 1156 1 58 ILE MG 1 59 ASN QB 2.740 . 3.680 2.316 2.075 3.146 . 0 0 "[ . 1 . 2]" 1 1157 1 58 ILE MG 1 59 ASN QD 2.785 . 3.770 3.679 2.873 3.868 0.098 20 0 "[ . 1 . 2]" 1 1158 1 58 ILE MG 1 60 GLY H 3.210 . 4.620 4.438 4.188 4.635 0.015 13 0 "[ . 1 . 2]" 1 1159 1 58 ILE MG 1 78 ALA MB 2.785 . 3.770 3.310 3.015 3.557 . 0 0 "[ . 1 . 2]" 1 1160 1 58 ILE MG 1 82 ILE HA 3.290 . 4.780 4.738 4.303 4.843 0.063 8 0 "[ . 1 . 2]" 1 1161 1 58 ILE MG 1 83 HIS H 3.415 . 5.030 4.756 3.912 5.045 0.015 15 0 "[ . 1 . 2]" 1 1162 1 58 ILE MG 1 84 MET H 3.635 . 5.470 5.481 5.389 5.517 0.047 17 0 "[ . 1 . 2]" 1 1163 1 58 ILE MG 1 84 MET HA 2.985 . 4.170 4.161 4.039 4.228 0.058 18 0 "[ . 1 . 2]" 1 1164 1 58 ILE MG 1 84 MET QG 2.685 . 3.570 2.501 2.311 2.911 . 0 0 "[ . 1 . 2]" 1 1165 1 59 ASN H 1 59 ASN QD 3.650 . 5.500 4.314 4.044 4.770 . 0 0 "[ . 1 . 2]" 1 1166 1 59 ASN H 1 60 GLY H 2.925 . 4.050 2.751 2.494 2.977 . 0 0 "[ . 1 . 2]" 1 1167 1 59 ASN H 1 60 GLY QA 3.650 . 5.500 4.584 4.383 4.802 . 0 0 "[ . 1 . 2]" 1 1168 1 59 ASN H 1 61 GLN H 3.355 . 4.910 4.255 4.100 4.378 . 0 0 "[ . 1 . 2]" 1 1169 1 59 ASN H 1 78 ALA MB 3.650 . 5.500 5.558 5.331 5.681 0.181 12 0 "[ . 1 . 2]" 1 1170 1 59 ASN H 1 82 ILE HA 3.650 . 5.500 4.191 3.830 4.613 . 0 0 "[ . 1 . 2]" 1 1171 1 59 ASN H 1 82 ILE MG 3.425 . 5.050 2.748 2.355 3.415 . 0 0 "[ . 1 . 2]" 1 1172 1 59 ASN H 1 83 HIS H 3.010 . 4.220 3.114 2.615 3.316 . 0 0 "[ . 1 . 2]" 1 1173 1 59 ASN H 1 83 HIS HA 3.590 . 5.380 4.582 4.379 4.701 . 0 0 "[ . 1 . 2]" 1 1174 1 59 ASN H 1 83 HIS QB 2.950 . 4.100 3.419 2.693 3.899 . 0 0 "[ . 1 . 2]" 1 1175 1 59 ASN H 1 84 MET H 3.650 . 5.500 4.616 4.267 4.796 . 0 0 "[ . 1 . 2]" 1 1176 1 59 ASN H 1 84 MET HA 2.985 . 4.170 3.342 2.971 3.540 . 0 0 "[ . 1 . 2]" 1 1177 1 59 ASN H 1 84 MET QB 3.425 . 5.050 4.670 3.793 5.036 . 0 0 "[ . 1 . 2]" 1 1178 1 59 ASN H 1 84 MET QG 3.445 . 5.090 3.392 3.093 3.810 . 0 0 "[ . 1 . 2]" 1 1179 1 59 ASN H 1 85 LYS H 3.650 . 5.500 5.465 5.157 5.575 0.075 11 0 "[ . 1 . 2]" 1 1180 1 59 ASN HA 1 59 ASN QD 3.650 . 5.500 3.133 2.765 3.953 . 0 0 "[ . 1 . 2]" 1 1181 1 59 ASN HA 1 60 GLY H 2.630 . 3.460 3.072 2.812 3.367 . 0 0 "[ . 1 . 2]" 1 1182 1 59 ASN HA 1 60 GLY QA 3.220 . 4.640 4.046 3.873 4.199 . 0 0 "[ . 1 . 2]" 1 1183 1 59 ASN HA 1 83 HIS H 3.100 . 4.400 2.595 2.012 2.991 . 0 0 "[ . 1 . 2]" 1 1184 1 59 ASN HA 1 83 HIS QB 2.765 . 3.730 3.305 2.514 3.733 0.003 7 0 "[ . 1 . 2]" 1 1185 1 59 ASN QB 1 59 ASN QD 2.685 . 3.570 2.148 2.088 2.233 . 0 0 "[ . 1 . 2]" 1 1186 1 59 ASN QB 1 60 GLY H 3.100 . 4.400 3.636 3.106 3.867 . 0 0 "[ . 1 . 2]" 1 1187 1 59 ASN QB 1 61 GLN H 3.470 . 5.140 3.621 3.284 4.134 . 0 0 "[ . 1 . 2]" 1 1188 1 59 ASN QB 1 78 ALA MB 3.495 . 5.190 3.345 2.808 4.093 . 0 0 "[ . 1 . 2]" 1 1189 1 59 ASN QB 1 82 ILE HA 3.350 . 4.900 4.153 3.656 4.635 . 0 0 "[ . 1 . 2]" 1 1190 1 59 ASN QB 1 82 ILE MG 3.230 . 4.660 2.707 2.037 4.035 . 0 0 "[ . 1 . 2]" 1 1191 1 59 ASN QB 1 83 HIS H 3.650 . 5.500 4.309 4.075 4.596 . 0 0 "[ . 1 . 2]" 1 1192 1 59 ASN QD 1 78 ALA MB 2.795 . 3.790 2.485 1.794 3.525 0.006 13 0 "[ . 1 . 2]" 1 1193 1 59 ASN QD 1 82 ILE H 3.650 . 5.500 5.261 4.659 5.564 0.064 15 0 "[ . 1 . 2]" 1 1194 1 59 ASN QD 1 82 ILE HA 2.990 . 4.180 3.007 2.441 3.512 . 0 0 "[ . 1 . 2]" 1 1195 1 59 ASN QD 1 82 ILE MD 3.130 . 4.460 3.509 3.080 4.209 . 0 0 "[ . 1 . 2]" 1 1196 1 59 ASN QD 1 82 ILE MG 2.795 . 3.790 2.502 1.886 3.498 . 0 0 "[ . 1 . 2]" 1 1197 1 59 ASN QD 1 83 HIS H 3.255 . 4.710 4.088 3.604 4.717 0.007 15 0 "[ . 1 . 2]" 1 1198 1 60 GLY H 1 61 GLN H 2.725 . 3.650 2.271 1.792 2.510 0.008 17 0 "[ . 1 . 2]" 1 1199 1 60 GLY H 1 61 GLN QG 3.650 . 5.500 4.242 3.415 5.615 0.115 10 0 "[ . 1 . 2]" 1 1200 1 60 GLY H 1 83 HIS QB 3.060 . 4.320 3.679 2.845 4.331 0.011 17 0 "[ . 1 . 2]" 1 1201 1 60 GLY H 1 84 MET HA 3.650 . 5.500 4.647 4.171 4.969 . 0 0 "[ . 1 . 2]" 1 1202 1 60 GLY H 1 85 LYS QG 3.650 . 5.500 5.292 4.957 5.522 0.022 17 0 "[ . 1 . 2]" 1 1203 1 60 GLY QA 1 61 GLN HA 3.085 . 4.370 3.962 3.928 4.058 . 0 0 "[ . 1 . 2]" 1 1204 1 61 GLN H 1 61 GLN QB 2.540 . 3.280 2.923 2.218 3.101 . 0 0 "[ . 1 . 2]" 1 1205 1 61 GLN H 1 61 GLN QG 2.875 . 3.950 2.438 2.070 3.873 . 0 0 "[ . 1 . 2]" 1 1206 1 61 GLN H 1 62 SER H 3.565 . 5.330 4.343 4.245 4.451 . 0 0 "[ . 1 . 2]" 1 1207 1 61 GLN H 1 63 VAL MG1 3.100 . 4.400 3.979 3.863 4.151 . 0 0 "[ . 1 . 2]" 1 1208 1 61 GLN H 1 63 VAL MG2 3.650 . 5.500 5.490 5.405 5.537 0.037 10 0 "[ . 1 . 2]" 1 1209 1 61 GLN HA 1 61 GLN QG 2.815 . 3.830 3.289 2.499 3.388 . 0 0 "[ . 1 . 2]" 1 1210 1 61 GLN HA 1 62 SER H 2.625 . 3.450 2.074 2.004 2.145 . 0 0 "[ . 1 . 2]" 1 1211 1 61 GLN HA 1 62 SER QB 3.360 . 4.920 4.192 3.906 4.464 . 0 0 "[ . 1 . 2]" 1 1212 1 61 GLN HA 1 63 VAL MG1 3.100 . 4.400 4.510 4.428 4.552 0.152 14 0 "[ . 1 . 2]" 1 1213 1 61 GLN QB 1 61 GLN QE 3.650 . 5.500 2.763 1.845 3.468 . 0 0 "[ . 1 . 2]" 1 1214 1 61 GLN QB 1 62 SER H 3.370 . 4.940 3.099 2.666 3.878 . 0 0 "[ . 1 . 2]" 1 1215 1 61 GLN QB 1 63 VAL MG1 2.870 . 3.940 3.410 2.951 3.622 . 0 0 "[ . 1 . 2]" 1 1216 1 61 GLN QE 1 63 VAL MG1 3.260 . 4.720 2.878 1.944 4.219 . 0 0 "[ . 1 . 2]" 1 1217 1 61 GLN QE 1 74 ILE MD 3.200 . 4.600 2.795 2.003 4.217 . 0 0 "[ . 1 . 2]" 1 1218 1 61 GLN QE 1 74 ILE QG 3.650 . 5.500 3.200 1.887 4.632 . 0 0 "[ . 1 . 2]" 1 1219 1 61 GLN QE 1 74 ILE MG 3.235 . 4.670 3.227 1.886 4.402 . 0 0 "[ . 1 . 2]" 1 1220 1 61 GLN QG 1 62 SER H 3.480 . 5.160 4.002 2.907 4.269 . 0 0 "[ . 1 . 2]" 1 1221 1 61 GLN QG 1 63 VAL MG1 2.920 . 4.040 2.088 1.932 2.324 . 0 0 "[ . 1 . 2]" 1 1222 1 62 SER H 1 62 SER QB 2.855 . 3.910 2.397 2.211 2.779 . 0 0 "[ . 1 . 2]" 1 1223 1 62 SER H 1 63 VAL H 3.650 . 5.500 4.397 4.304 4.463 . 0 0 "[ . 1 . 2]" 1 1224 1 62 SER H 1 63 VAL MG1 3.650 . 5.500 4.278 4.179 4.339 . 0 0 "[ . 1 . 2]" 1 1225 1 62 SER H 1 64 VAL H 3.650 . 5.500 5.285 5.118 5.433 . 0 0 "[ . 1 . 2]" 1 1226 1 62 SER HA 1 63 VAL H 2.505 . 3.210 2.187 2.126 2.244 . 0 0 "[ . 1 . 2]" 1 1227 1 62 SER HA 1 63 VAL MG1 3.005 . 4.210 3.530 3.410 3.668 . 0 0 "[ . 1 . 2]" 1 1228 1 62 SER HA 1 63 VAL MG2 3.085 . 4.370 3.644 3.556 3.771 . 0 0 "[ . 1 . 2]" 1 1229 1 62 SER HA 1 64 VAL H 2.970 . 4.140 3.369 3.219 3.667 . 0 0 "[ . 1 . 2]" 1 1230 1 62 SER QB 1 63 VAL H 3.120 . 4.440 3.695 3.446 3.977 . 0 0 "[ . 1 . 2]" 1 1231 1 62 SER QB 1 64 VAL H 3.500 . 5.200 3.361 2.934 3.890 . 0 0 "[ . 1 . 2]" 1 1232 1 63 VAL H 1 63 VAL MG1 2.695 . 3.590 2.454 2.342 2.552 . 0 0 "[ . 1 . 2]" 1 1233 1 63 VAL H 1 63 VAL MG2 2.435 . 3.070 1.903 1.836 1.950 . 0 0 "[ . 1 . 2]" 1 1234 1 63 VAL H 1 64 VAL H 2.540 . 3.280 2.333 2.213 2.489 . 0 0 "[ . 1 . 2]" 1 1235 1 63 VAL H 1 64 VAL HA 3.360 . 4.920 4.376 4.224 4.492 . 0 0 "[ . 1 . 2]" 1 1236 1 63 VAL H 1 64 VAL HB 3.400 . 5.000 3.793 3.737 3.831 . 0 0 "[ . 1 . 2]" 1 1237 1 63 VAL H 1 64 VAL MG1 3.015 . 4.230 4.174 4.052 4.242 0.012 13 0 "[ . 1 . 2]" 1 1238 1 63 VAL H 1 64 VAL MG2 3.340 . 4.880 4.982 4.955 5.004 0.124 17 0 "[ . 1 . 2]" 1 1239 1 63 VAL H 1 66 THR H 3.650 . 5.500 5.198 5.106 5.356 . 0 0 "[ . 1 . 2]" 1 1240 1 63 VAL H 1 66 THR HB 3.305 . 4.810 4.845 4.824 4.891 0.081 2 0 "[ . 1 . 2]" 1 1241 1 63 VAL H 1 66 THR MG 3.650 . 5.500 5.465 5.353 5.533 0.033 20 0 "[ . 1 . 2]" 1 1242 1 63 VAL HA 1 63 VAL MG1 2.320 . 2.840 2.354 2.318 2.382 . 0 0 "[ . 1 . 2]" 1 1243 1 63 VAL HA 1 63 VAL MG2 2.530 . 3.260 3.188 3.175 3.200 . 0 0 "[ . 1 . 2]" 1 1244 1 63 VAL HA 1 64 VAL MG1 3.275 . 4.750 4.667 4.548 4.769 0.019 20 0 "[ . 1 . 2]" 1 1245 1 63 VAL HA 1 65 ALA MB 3.405 . 5.010 4.661 4.258 5.040 0.030 5 0 "[ . 1 . 2]" 1 1246 1 63 VAL HA 1 66 THR H 3.075 . 4.350 3.153 3.068 3.312 . 0 0 "[ . 1 . 2]" 1 1247 1 63 VAL HA 1 66 THR HB 2.805 . 3.810 2.452 2.337 2.601 . 0 0 "[ . 1 . 2]" 1 1248 1 63 VAL HA 1 66 THR MG 2.920 . 4.040 3.304 3.117 3.422 . 0 0 "[ . 1 . 2]" 1 1249 1 63 VAL HA 1 71 ILE MD 3.100 . 4.400 4.438 4.402 4.474 0.074 17 0 "[ . 1 . 2]" 1 1250 1 63 VAL HB 1 64 VAL H 3.445 . 5.090 4.366 4.334 4.418 . 0 0 "[ . 1 . 2]" 1 1251 1 63 VAL HB 1 66 THR H 3.155 . 4.510 3.993 3.880 4.107 . 0 0 "[ . 1 . 2]" 1 1252 1 63 VAL HB 1 66 THR HB 2.605 . 3.410 2.261 2.079 2.386 . 0 0 "[ . 1 . 2]" 1 1253 1 63 VAL HB 1 66 THR MG 2.810 . 3.820 2.842 2.784 2.887 . 0 0 "[ . 1 . 2]" 1 1254 1 63 VAL HB 1 71 ILE H 3.560 . 5.320 4.969 4.791 5.113 . 0 0 "[ . 1 . 2]" 1 1255 1 63 VAL HB 1 71 ILE MD 2.545 . 3.290 3.152 3.009 3.273 . 0 0 "[ . 1 . 2]" 1 1256 1 63 VAL HB 1 71 ILE QG 2.835 . 3.870 2.072 1.986 2.175 . 0 0 "[ . 1 . 2]" 1 1257 1 63 VAL HB 1 71 ILE MG 2.845 . 3.890 3.198 2.988 3.491 . 0 0 "[ . 1 . 2]" 1 1258 1 63 VAL MG1 1 64 VAL H 3.040 . 4.280 4.103 4.033 4.222 . 0 0 "[ . 1 . 2]" 1 1259 1 63 VAL MG1 1 66 THR H 3.305 . 4.810 4.809 4.737 4.848 0.038 9 0 "[ . 1 . 2]" 1 1260 1 63 VAL MG1 1 66 THR HB 2.755 . 3.710 3.445 3.288 3.604 . 0 0 "[ . 1 . 2]" 1 1261 1 63 VAL MG1 1 66 THR MG 2.590 . 3.380 2.925 2.743 3.127 . 0 0 "[ . 1 . 2]" 1 1262 1 63 VAL MG1 1 71 ILE HA 2.955 . 4.110 3.653 3.464 3.901 . 0 0 "[ . 1 . 2]" 1 1263 1 63 VAL MG1 1 71 ILE QG 2.855 . 3.910 3.460 3.289 3.658 . 0 0 "[ . 1 . 2]" 1 1264 1 63 VAL MG2 1 64 VAL H 2.855 . 3.910 3.213 3.099 3.357 . 0 0 "[ . 1 . 2]" 1 1265 1 63 VAL MG2 1 64 VAL HA 2.810 . 3.820 3.340 3.240 3.465 . 0 0 "[ . 1 . 2]" 1 1266 1 63 VAL MG2 1 64 VAL HB 3.220 . 4.640 4.002 3.884 4.101 . 0 0 "[ . 1 . 2]" 1 1267 1 63 VAL MG2 1 66 THR H 3.650 . 5.500 4.372 4.303 4.509 . 0 0 "[ . 1 . 2]" 1 1268 1 63 VAL MG2 1 66 THR HB 3.085 . 4.370 3.637 3.571 3.764 . 0 0 "[ . 1 . 2]" 1 1269 1 63 VAL MG2 1 66 THR MG 2.950 . 4.100 4.148 4.113 4.192 0.092 11 0 "[ . 1 . 2]" 1 1270 1 63 VAL MG2 1 71 ILE HA 3.330 . 4.860 4.105 3.936 4.365 . 0 0 "[ . 1 . 2]" 1 1271 1 63 VAL MG2 1 71 ILE MD 2.535 . 3.270 2.910 2.741 3.064 . 0 0 "[ . 1 . 2]" 1 1272 1 63 VAL MG2 1 71 ILE QG 2.835 . 3.870 3.038 2.917 3.176 . 0 0 "[ . 1 . 2]" 1 1273 1 64 VAL H 1 64 VAL HB 2.610 . 3.420 2.287 2.214 2.406 . 0 0 "[ . 1 . 2]" 1 1274 1 64 VAL H 1 64 VAL MG1 2.510 . 3.220 2.316 2.187 2.405 . 0 0 "[ . 1 . 2]" 1 1275 1 64 VAL H 1 65 ALA H 3.070 . 4.340 2.505 2.310 2.641 . 0 0 "[ . 1 . 2]" 1 1276 1 64 VAL H 1 65 ALA MB 3.420 . 5.040 4.217 4.018 4.401 . 0 0 "[ . 1 . 2]" 1 1277 1 64 VAL HA 1 64 VAL MG1 2.470 . 3.140 3.196 3.185 3.202 0.062 3 0 "[ . 1 . 2]" 1 1278 1 64 VAL HA 1 64 VAL MG2 2.405 . 3.010 2.203 2.182 2.236 . 0 0 "[ . 1 . 2]" 1 1279 1 64 VAL HA 1 65 ALA MB 3.265 . 4.730 4.779 4.745 4.817 0.087 2 0 "[ . 1 . 2]" 1 1280 1 64 VAL HB 1 65 ALA H 3.650 . 5.500 3.973 3.903 4.084 . 0 0 "[ . 1 . 2]" 1 1281 1 64 VAL HB 1 66 THR H 3.605 . 5.410 5.385 5.322 5.453 0.043 5 0 "[ . 1 . 2]" 1 1282 1 64 VAL MG1 1 65 ALA H 3.130 . 4.460 2.686 2.557 2.834 . 0 0 "[ . 1 . 2]" 1 1283 1 64 VAL MG1 1 65 ALA HA 3.285 . 4.770 3.670 3.544 3.819 . 0 0 "[ . 1 . 2]" 1 1284 1 64 VAL MG2 1 65 ALA H 3.200 . 4.600 4.168 4.088 4.243 . 0 0 "[ . 1 . 2]" 1 1285 1 65 ALA H 1 65 ALA MB 2.855 . 3.910 2.386 2.310 2.500 . 0 0 "[ . 1 . 2]" 1 1286 1 65 ALA H 1 66 THR H 2.830 . 3.860 2.184 2.090 2.284 . 0 0 "[ . 1 . 2]" 1 1287 1 65 ALA MB 1 66 THR H 2.760 . 3.720 3.450 3.278 3.529 . 0 0 "[ . 1 . 2]" 1 1288 1 66 THR H 1 66 THR HB 2.545 . 3.290 2.227 2.108 2.362 . 0 0 "[ . 1 . 2]" 1 1289 1 66 THR H 1 66 THR MG 2.800 . 3.800 3.615 3.549 3.671 . 0 0 "[ . 1 . 2]" 1 1290 1 66 THR H 1 67 PRO QD 3.255 . 4.710 4.304 4.190 4.355 . 0 0 "[ . 1 . 2]" 1 1291 1 66 THR H 1 70 LYS QB 3.650 . 5.500 5.625 5.594 5.685 0.185 8 0 "[ . 1 . 2]" 1 1292 1 66 THR H 1 71 ILE MD 3.065 . 4.330 3.341 3.139 3.482 . 0 0 "[ . 1 . 2]" 1 1293 1 66 THR H 1 71 ILE QG 3.615 . 5.430 3.954 3.783 4.085 . 0 0 "[ . 1 . 2]" 1 1294 1 66 THR HA 1 66 THR MG 2.505 . 3.210 2.481 2.424 2.574 . 0 0 "[ . 1 . 2]" 1 1295 1 66 THR HA 1 67 PRO QB 3.310 . 4.820 4.708 4.609 4.779 . 0 0 "[ . 1 . 2]" 1 1296 1 66 THR HA 1 67 PRO QD 2.370 . 2.940 2.031 1.929 2.101 . 0 0 "[ . 1 . 2]" 1 1297 1 66 THR HA 1 70 LYS QB 3.270 . 4.740 4.083 3.908 4.301 . 0 0 "[ . 1 . 2]" 1 1298 1 66 THR HA 1 71 ILE MD 3.300 . 4.800 4.689 4.523 4.858 0.058 20 0 "[ . 1 . 2]" 1 1299 1 66 THR HB 1 70 LYS QB 3.020 . 4.240 4.162 4.081 4.234 . 0 0 "[ . 1 . 2]" 1 1300 1 66 THR HB 1 71 ILE MD 2.660 . 3.520 2.830 2.606 2.939 . 0 0 "[ . 1 . 2]" 1 1301 1 66 THR HB 1 71 ILE QG 2.930 . 4.060 2.376 2.321 2.461 . 0 0 "[ . 1 . 2]" 1 1302 1 66 THR HB 1 71 ILE MG 3.070 . 4.340 4.392 4.361 4.428 0.088 3 0 "[ . 1 . 2]" 1 1303 1 66 THR MG 1 67 PRO QB 3.150 . 4.500 4.121 3.590 4.423 . 0 0 "[ . 1 . 2]" 1 1304 1 66 THR MG 1 67 PRO QD 2.500 . 3.200 2.183 2.077 2.325 . 0 0 "[ . 1 . 2]" 1 1305 1 66 THR MG 1 67 PRO QG 2.820 . 3.840 3.473 3.139 3.877 0.037 18 0 "[ . 1 . 2]" 1 1306 1 66 THR MG 1 70 LYS HA 3.060 . 4.320 4.093 3.963 4.203 . 0 0 "[ . 1 . 2]" 1 1307 1 66 THR MG 1 70 LYS QB 2.275 . 2.750 1.858 1.778 1.956 0.022 18 0 "[ . 1 . 2]" 1 1308 1 66 THR MG 1 70 LYS QE 3.140 . 4.480 4.016 2.063 4.597 0.117 18 0 "[ . 1 . 2]" 1 1309 1 66 THR MG 1 71 ILE H 2.780 . 3.760 2.564 2.360 2.793 . 0 0 "[ . 1 . 2]" 1 1310 1 66 THR MG 1 71 ILE HA 3.015 . 4.230 3.053 2.912 3.198 . 0 0 "[ . 1 . 2]" 1 1311 1 66 THR MG 1 71 ILE HB 3.290 . 4.780 4.176 4.057 4.378 . 0 0 "[ . 1 . 2]" 1 1312 1 66 THR MG 1 71 ILE MD 2.760 . 3.720 3.364 3.248 3.456 . 0 0 "[ . 1 . 2]" 1 1313 1 66 THR MG 1 71 ILE QG 2.520 . 3.240 2.126 2.013 2.251 . 0 0 "[ . 1 . 2]" 1 1314 1 66 THR MG 1 71 ILE MG 2.895 . 3.990 4.013 3.978 4.055 0.065 5 0 "[ . 1 . 2]" 1 1315 1 66 THR MG 1 72 VAL H 3.650 . 5.500 4.923 4.745 5.105 . 0 0 "[ . 1 . 2]" 1 1316 1 66 THR MG 1 74 ILE MD 2.455 . 3.110 2.489 2.158 2.931 . 0 0 "[ . 1 . 2]" 1 1317 1 67 PRO HA 1 68 HIS H 2.610 . 3.420 2.232 2.120 2.404 . 0 0 "[ . 1 . 2]" 1 1318 1 67 PRO HA 1 68 HIS QB 3.160 . 4.520 4.196 3.972 4.521 0.001 15 0 "[ . 1 . 2]" 1 1319 1 67 PRO HA 1 69 GLU H 3.505 . 5.210 4.520 4.236 4.727 . 0 0 "[ . 1 . 2]" 1 1320 1 67 PRO HA 1 70 LYS H 3.645 . 5.490 4.797 4.469 5.017 . 0 0 "[ . 1 . 2]" 1 1321 1 67 PRO QB 1 68 HIS H 3.120 . 4.440 2.804 2.520 3.104 . 0 0 "[ . 1 . 2]" 1 1322 1 67 PRO QB 1 69 GLU H 3.120 . 4.440 3.009 2.751 3.225 . 0 0 "[ . 1 . 2]" 1 1323 1 67 PRO QB 1 70 LYS H 2.895 . 3.990 2.951 2.280 3.577 . 0 0 "[ . 1 . 2]" 1 1324 1 67 PRO QD 1 70 LYS H 3.650 . 5.500 4.215 3.813 4.532 . 0 0 "[ . 1 . 2]" 1 1325 1 67 PRO QD 1 70 LYS QB 2.710 . 3.620 2.487 2.111 2.861 . 0 0 "[ . 1 . 2]" 1 1326 1 67 PRO QD 1 70 LYS QD 3.010 . 4.220 2.755 1.979 3.770 . 0 0 "[ . 1 . 2]" 1 1327 1 67 PRO QD 1 70 LYS QG 3.260 . 4.720 3.281 2.430 3.863 . 0 0 "[ . 1 . 2]" 1 1328 1 67 PRO QG 1 68 HIS H 3.420 . 5.040 4.412 4.090 4.647 . 0 0 "[ . 1 . 2]" 1 1329 1 67 PRO QG 1 70 LYS H 2.990 . 4.180 3.233 2.460 4.210 0.030 5 0 "[ . 1 . 2]" 1 1330 1 67 PRO QG 1 70 LYS QD 3.015 . 4.230 2.700 1.996 3.170 . 0 0 "[ . 1 . 2]" 1 1331 1 68 HIS H 1 68 HIS QB 2.820 . 3.840 2.274 2.162 2.585 . 0 0 "[ . 1 . 2]" 1 1332 1 68 HIS H 1 68 HIS HD1 3.650 . 5.500 4.139 2.445 4.567 . 0 0 "[ . 1 . 2]" 1 1333 1 68 HIS H 1 69 GLU H 3.140 . 4.480 3.007 2.920 3.129 . 0 0 "[ . 1 . 2]" 1 1334 1 68 HIS H 1 69 GLU HA 3.650 . 5.500 5.515 5.448 5.566 0.066 12 0 "[ . 1 . 2]" 1 1335 1 68 HIS H 1 70 LYS H 3.650 . 5.500 4.359 4.079 4.516 . 0 0 "[ . 1 . 2]" 1 1336 1 68 HIS H 1 71 ILE H 3.650 . 5.500 4.847 4.740 4.919 . 0 0 "[ . 1 . 2]" 1 1337 1 68 HIS HA 1 68 HIS HD1 3.355 . 4.910 3.508 3.106 4.054 . 0 0 "[ . 1 . 2]" 1 1338 1 68 HIS HA 1 71 ILE H 3.235 . 4.670 3.802 3.356 4.082 . 0 0 "[ . 1 . 2]" 1 1339 1 68 HIS HA 1 71 ILE HB 2.855 . 3.910 2.942 2.688 3.158 . 0 0 "[ . 1 . 2]" 1 1340 1 68 HIS HA 1 71 ILE MD 2.775 . 3.750 2.693 2.118 3.039 . 0 0 "[ . 1 . 2]" 1 1341 1 68 HIS HA 1 71 ILE QG 3.330 . 4.860 3.425 2.809 3.866 . 0 0 "[ . 1 . 2]" 1 1342 1 68 HIS HA 1 71 ILE MG 2.995 . 4.190 4.178 3.983 4.274 0.084 18 0 "[ . 1 . 2]" 1 1343 1 68 HIS HA 1 72 VAL H 3.330 . 4.860 4.217 3.964 4.581 . 0 0 "[ . 1 . 2]" 1 1344 1 68 HIS HA 1 72 VAL MG2 3.295 . 4.790 3.753 3.340 4.312 . 0 0 "[ . 1 . 2]" 1 1345 1 68 HIS QB 1 69 GLU H 2.790 . 3.780 2.592 2.185 3.528 . 0 0 "[ . 1 . 2]" 1 1346 1 68 HIS QB 1 69 GLU QB 3.360 . 4.920 3.926 3.566 4.682 . 0 0 "[ . 1 . 2]" 1 1347 1 68 HIS QB 1 70 LYS H 3.650 . 5.500 4.742 4.469 5.196 . 0 0 "[ . 1 . 2]" 1 1348 1 68 HIS HD1 1 69 GLU H 3.215 . 4.630 3.222 2.971 3.615 . 0 0 "[ . 1 . 2]" 1 1349 1 68 HIS HD1 1 69 GLU HA 3.190 . 4.580 2.818 2.310 3.460 . 0 0 "[ . 1 . 2]" 1 1350 1 68 HIS HD1 1 69 GLU QB 3.340 . 4.880 3.363 2.781 3.918 . 0 0 "[ . 1 . 2]" 1 1351 1 68 HIS HD1 1 69 GLU QG 3.055 . 4.310 4.287 3.925 4.383 0.073 16 0 "[ . 1 . 2]" 1 1352 1 69 GLU H 1 69 GLU QB 2.540 . 3.280 2.192 2.080 2.285 . 0 0 "[ . 1 . 2]" 1 1353 1 69 GLU H 1 69 GLU QG 2.890 . 3.980 3.928 3.872 4.003 0.023 2 0 "[ . 1 . 2]" 1 1354 1 69 GLU H 1 70 LYS H 2.805 . 3.810 2.649 2.516 2.807 . 0 0 "[ . 1 . 2]" 1 1355 1 69 GLU H 1 71 ILE H 3.560 . 5.320 4.299 4.111 4.506 . 0 0 "[ . 1 . 2]" 1 1356 1 69 GLU H 1 71 ILE MD 3.650 . 5.500 5.422 5.112 5.528 0.028 18 0 "[ . 1 . 2]" 1 1357 1 69 GLU H 1 72 VAL H 3.650 . 5.500 4.775 4.672 4.915 . 0 0 "[ . 1 . 2]" 1 1358 1 69 GLU H 1 72 VAL MG2 3.650 . 5.500 4.714 4.583 4.813 . 0 0 "[ . 1 . 2]" 1 1359 1 69 GLU HA 1 69 GLU QB 2.425 . 3.050 2.359 2.291 2.438 . 0 0 "[ . 1 . 2]" 1 1360 1 69 GLU HA 1 69 GLU QG 2.715 . 3.630 2.422 2.320 2.693 . 0 0 "[ . 1 . 2]" 1 1361 1 69 GLU HA 1 71 ILE H 3.525 . 5.250 4.672 4.383 4.920 . 0 0 "[ . 1 . 2]" 1 1362 1 69 GLU HA 1 72 VAL H 2.965 . 4.130 3.546 3.164 3.880 . 0 0 "[ . 1 . 2]" 1 1363 1 69 GLU HA 1 72 VAL HB 2.685 . 3.570 2.810 2.525 3.005 . 0 0 "[ . 1 . 2]" 1 1364 1 69 GLU HA 1 72 VAL MG1 2.960 . 4.120 4.135 3.980 4.182 0.062 17 0 "[ . 1 . 2]" 1 1365 1 69 GLU HA 1 72 VAL MG2 2.765 . 3.730 3.377 2.900 3.748 0.018 19 0 "[ . 1 . 2]" 1 1366 1 69 GLU HA 1 73 HIS H 3.570 . 5.340 4.146 4.001 4.465 . 0 0 "[ . 1 . 2]" 1 1367 1 69 GLU QB 1 69 GLU QG 2.310 . 2.820 2.073 1.994 2.090 . 0 0 "[ . 1 . 2]" 1 1368 1 69 GLU QB 1 70 LYS H 2.650 . 3.500 2.491 2.062 2.880 . 0 0 "[ . 1 . 2]" 1 1369 1 69 GLU QB 1 70 LYS HA 3.165 . 4.530 3.995 3.791 4.353 . 0 0 "[ . 1 . 2]" 1 1370 1 69 GLU QB 1 70 LYS QG 3.230 . 4.660 4.408 3.404 4.768 0.108 1 0 "[ . 1 . 2]" 1 1371 1 69 GLU QB 1 71 ILE H 3.555 . 5.310 4.784 4.553 5.036 . 0 0 "[ . 1 . 2]" 1 1372 1 69 GLU QB 1 72 VAL H 3.345 . 4.890 4.971 4.916 5.034 0.144 17 0 "[ . 1 . 2]" 1 1373 1 69 GLU QG 1 70 LYS H 3.040 . 4.280 3.725 3.360 4.085 . 0 0 "[ . 1 . 2]" 1 1374 1 69 GLU QG 1 70 LYS HA 3.455 . 5.110 3.739 3.414 4.248 . 0 0 "[ . 1 . 2]" 1 1375 1 69 GLU QG 1 70 LYS QG 3.365 . 4.930 4.760 3.965 4.981 0.051 12 0 "[ . 1 . 2]" 1 1376 1 69 GLU QG 1 72 VAL MG1 3.400 . 5.000 4.508 3.959 4.877 . 0 0 "[ . 1 . 2]" 1 1377 1 69 GLU QG 1 72 VAL MG2 3.500 . 5.200 4.746 4.066 5.219 0.019 3 0 "[ . 1 . 2]" 1 1378 1 69 GLU QG 1 73 HIS H 3.650 . 5.500 4.180 3.906 4.658 . 0 0 "[ . 1 . 2]" 1 1379 1 70 LYS H 1 70 LYS QB 2.460 . 3.120 2.148 2.008 2.347 . 0 0 "[ . 1 . 2]" 1 1380 1 70 LYS H 1 70 LYS QD 3.140 . 4.480 3.745 2.430 4.463 . 0 0 "[ . 1 . 2]" 1 1381 1 70 LYS H 1 70 LYS QE 3.650 . 5.500 4.777 2.478 5.592 0.092 15 0 "[ . 1 . 2]" 1 1382 1 70 LYS H 1 70 LYS QG 2.955 . 4.110 3.409 2.943 3.814 . 0 0 "[ . 1 . 2]" 1 1383 1 70 LYS H 1 71 ILE H 2.575 . 3.350 2.677 2.544 2.766 . 0 0 "[ . 1 . 2]" 1 1384 1 70 LYS H 1 71 ILE HA 3.565 . 5.330 5.267 5.161 5.338 0.008 18 0 "[ . 1 . 2]" 1 1385 1 70 LYS H 1 71 ILE HB 3.300 . 4.800 4.789 4.702 4.832 0.032 6 0 "[ . 1 . 2]" 1 1386 1 70 LYS H 1 71 ILE MD 3.650 . 5.500 5.260 5.124 5.443 . 0 0 "[ . 1 . 2]" 1 1387 1 70 LYS H 1 71 ILE QG 3.340 . 4.880 4.106 3.955 4.307 . 0 0 "[ . 1 . 2]" 1 1388 1 70 LYS H 1 72 VAL H 3.210 . 4.620 4.058 3.947 4.151 . 0 0 "[ . 1 . 2]" 1 1389 1 70 LYS H 1 73 HIS H 3.650 . 5.500 4.525 4.446 4.630 . 0 0 "[ . 1 . 2]" 1 1390 1 70 LYS H 1 73 HIS QB 3.630 . 5.460 4.516 4.350 4.720 . 0 0 "[ . 1 . 2]" 1 1391 1 70 LYS H 1 74 ILE MD 3.380 . 4.960 4.836 4.608 4.964 0.004 15 0 "[ . 1 . 2]" 1 1392 1 70 LYS HA 1 70 LYS QD 2.820 . 3.840 3.333 2.024 3.939 0.099 17 0 "[ . 1 . 2]" 1 1393 1 70 LYS HA 1 70 LYS QE 3.325 . 4.850 3.842 1.788 4.845 0.012 1 0 "[ . 1 . 2]" 1 1394 1 70 LYS HA 1 70 LYS QG 2.705 . 3.610 2.227 2.054 2.581 . 0 0 "[ . 1 . 2]" 1 1395 1 70 LYS HA 1 73 HIS H 2.840 . 3.880 3.185 2.957 3.331 . 0 0 "[ . 1 . 2]" 1 1396 1 70 LYS HA 1 73 HIS QB 2.565 . 3.330 2.405 2.157 2.666 . 0 0 "[ . 1 . 2]" 1 1397 1 70 LYS HA 1 74 ILE H 3.305 . 4.810 3.773 3.673 3.905 . 0 0 "[ . 1 . 2]" 1 1398 1 70 LYS HA 1 74 ILE MD 3.180 . 4.560 3.323 2.891 3.795 . 0 0 "[ . 1 . 2]" 1 1399 1 70 LYS QB 1 70 LYS QE 2.975 . 4.150 3.378 1.919 3.624 . 0 0 "[ . 1 . 2]" 1 1400 1 70 LYS QB 1 71 ILE H 2.795 . 3.790 2.485 2.406 2.671 . 0 0 "[ . 1 . 2]" 1 1401 1 70 LYS QB 1 73 HIS QB 3.090 . 4.380 4.170 3.734 4.466 0.086 19 0 "[ . 1 . 2]" 1 1402 1 70 LYS QD 1 70 LYS QG 2.345 . 2.890 2.057 1.990 2.084 . 0 0 "[ . 1 . 2]" 1 1403 1 70 LYS QD 1 73 HIS QB 3.355 . 4.910 4.640 3.631 4.989 0.079 7 0 "[ . 1 . 2]" 1 1404 1 70 LYS QD 1 74 ILE MD 3.145 . 4.490 3.223 2.201 4.543 0.053 4 0 "[ . 1 . 2]" 1 1405 1 70 LYS QE 1 70 LYS QG 2.515 . 3.230 2.261 1.985 2.487 . 0 0 "[ . 1 . 2]" 1 1406 1 70 LYS QE 1 74 ILE MD 2.800 . 3.800 3.824 2.317 4.022 0.222 3 0 "[ . 1 . 2]" 1 1407 1 70 LYS QG 1 73 HIS H 3.650 . 5.500 4.998 4.463 5.432 . 0 0 "[ . 1 . 2]" 1 1408 1 70 LYS QG 1 74 ILE H 3.650 . 5.500 4.829 4.114 5.197 . 0 0 "[ . 1 . 2]" 1 1409 1 70 LYS QG 1 74 ILE MD 2.555 . 3.310 2.887 2.320 3.422 0.112 17 0 "[ . 1 . 2]" 1 1410 1 70 LYS QG 1 74 ILE QG 3.465 . 5.130 3.892 2.906 5.171 0.041 5 0 "[ . 1 . 2]" 1 1411 1 71 ILE H 1 71 ILE HB 2.485 . 3.170 2.601 2.512 2.702 . 0 0 "[ . 1 . 2]" 1 1412 1 71 ILE H 1 71 ILE MD 2.790 . 3.780 3.591 3.526 3.659 . 0 0 "[ . 1 . 2]" 1 1413 1 71 ILE H 1 71 ILE QG 2.630 . 3.460 1.989 1.931 2.105 . 0 0 "[ . 1 . 2]" 1 1414 1 71 ILE H 1 71 ILE MG 2.820 . 3.840 3.765 3.727 3.801 . 0 0 "[ . 1 . 2]" 1 1415 1 71 ILE H 1 72 VAL H 2.755 . 3.710 2.816 2.729 2.878 . 0 0 "[ . 1 . 2]" 1 1416 1 71 ILE H 1 73 HIS H 3.650 . 5.500 4.068 3.940 4.226 . 0 0 "[ . 1 . 2]" 1 1417 1 71 ILE H 1 74 ILE H 3.650 . 5.500 4.750 4.662 4.819 . 0 0 "[ . 1 . 2]" 1 1418 1 71 ILE H 1 74 ILE MD 2.695 . 3.590 3.641 3.535 3.734 0.144 4 0 "[ . 1 . 2]" 1 1419 1 71 ILE HA 1 71 ILE MD 2.840 . 3.880 3.830 3.804 3.856 . 0 0 "[ . 1 . 2]" 1 1420 1 71 ILE HA 1 71 ILE QG 2.710 . 3.620 2.402 2.357 2.445 . 0 0 "[ . 1 . 2]" 1 1421 1 71 ILE HA 1 71 ILE MG 2.490 . 3.180 2.431 2.376 2.478 . 0 0 "[ . 1 . 2]" 1 1422 1 71 ILE HA 1 74 ILE H 3.070 . 4.340 3.750 3.596 3.923 . 0 0 "[ . 1 . 2]" 1 1423 1 71 ILE HA 1 74 ILE HB 2.585 . 3.370 2.883 2.730 3.030 . 0 0 "[ . 1 . 2]" 1 1424 1 71 ILE HA 1 74 ILE MD 2.365 . 2.930 2.671 2.349 2.983 0.053 5 0 "[ . 1 . 2]" 1 1425 1 71 ILE HA 1 74 ILE QG 3.325 . 4.850 4.198 3.933 4.605 . 0 0 "[ . 1 . 2]" 1 1426 1 71 ILE HA 1 74 ILE MG 3.010 . 4.220 4.073 3.911 4.234 0.014 13 0 "[ . 1 . 2]" 1 1427 1 71 ILE HA 1 75 LEU H 3.335 . 4.870 4.034 3.861 4.220 . 0 0 "[ . 1 . 2]" 1 1428 1 71 ILE HB 1 71 ILE MD 2.480 . 3.160 2.476 2.447 2.498 . 0 0 "[ . 1 . 2]" 1 1429 1 71 ILE HB 1 72 VAL H 2.755 . 3.710 2.582 2.486 2.680 . 0 0 "[ . 1 . 2]" 1 1430 1 71 ILE HB 1 72 VAL MG2 2.900 . 4.000 3.091 2.968 3.270 . 0 0 "[ . 1 . 2]" 1 1431 1 71 ILE MD 1 71 ILE MG 2.215 . 2.630 1.897 1.870 1.940 . 0 0 "[ . 1 . 2]" 1 1432 1 71 ILE MD 1 72 VAL H 3.220 . 4.640 4.609 4.511 4.671 0.031 17 0 "[ . 1 . 2]" 1 1433 1 71 ILE QG 1 71 ILE MG 2.445 . 3.090 2.301 2.282 2.329 . 0 0 "[ . 1 . 2]" 1 1434 1 71 ILE MG 1 72 VAL H 2.740 . 3.680 3.436 3.321 3.546 . 0 0 "[ . 1 . 2]" 1 1435 1 71 ILE MG 1 75 LEU H 3.085 . 4.370 4.189 4.002 4.338 . 0 0 "[ . 1 . 2]" 1 1436 1 72 VAL H 1 72 VAL HB 2.530 . 3.260 2.453 2.401 2.511 . 0 0 "[ . 1 . 2]" 1 1437 1 72 VAL H 1 72 VAL MG1 2.875 . 3.950 3.764 3.737 3.790 . 0 0 "[ . 1 . 2]" 1 1438 1 72 VAL H 1 72 VAL MG2 2.485 . 3.170 2.238 2.119 2.348 . 0 0 "[ . 1 . 2]" 1 1439 1 72 VAL H 1 73 HIS QB 3.650 . 5.500 4.305 4.195 4.431 . 0 0 "[ . 1 . 2]" 1 1440 1 72 VAL H 1 74 ILE H 3.650 . 5.500 4.152 4.089 4.203 . 0 0 "[ . 1 . 2]" 1 1441 1 72 VAL H 1 75 LEU H 3.650 . 5.500 4.732 4.655 4.805 . 0 0 "[ . 1 . 2]" 1 1442 1 72 VAL HA 1 72 VAL MG1 2.410 . 3.020 2.490 2.436 2.553 . 0 0 "[ . 1 . 2]" 1 1443 1 72 VAL HA 1 72 VAL MG2 2.520 . 3.240 2.321 2.277 2.374 . 0 0 "[ . 1 . 2]" 1 1444 1 72 VAL HA 1 75 LEU H 3.100 . 4.400 3.529 3.468 3.596 . 0 0 "[ . 1 . 2]" 1 1445 1 72 VAL HA 1 75 LEU QB 2.655 . 3.510 2.604 2.486 2.802 . 0 0 "[ . 1 . 2]" 1 1446 1 72 VAL HA 1 75 LEU HG 2.830 . 3.860 3.874 3.739 3.912 0.052 17 0 "[ . 1 . 2]" 1 1447 1 72 VAL HA 1 76 SER H 3.365 . 4.930 3.878 3.762 4.003 . 0 0 "[ . 1 . 2]" 1 1448 1 72 VAL HB 1 73 HIS H 2.770 . 3.740 2.886 2.783 3.003 . 0 0 "[ . 1 . 2]" 1 1449 1 72 VAL HB 1 73 HIS HA 3.270 . 4.740 4.404 4.325 4.495 . 0 0 "[ . 1 . 2]" 1 1450 1 72 VAL HB 1 73 HIS QB 3.045 . 4.290 4.146 4.005 4.267 . 0 0 "[ . 1 . 2]" 1 1451 1 72 VAL MG1 1 73 HIS H 2.765 . 3.730 3.549 3.340 3.680 . 0 0 "[ . 1 . 2]" 1 1452 1 72 VAL MG1 1 73 HIS HA 2.945 . 4.090 3.438 3.285 3.615 . 0 0 "[ . 1 . 2]" 1 1453 1 72 VAL MG1 1 76 SER H 2.925 . 4.050 3.927 3.768 4.064 0.014 20 0 "[ . 1 . 2]" 1 1454 1 72 VAL MG1 1 76 SER QB 2.875 . 3.950 3.241 2.821 3.949 . 0 0 "[ . 1 . 2]" 1 1455 1 72 VAL MG2 1 73 HIS H 3.205 . 4.610 3.969 3.883 4.027 . 0 0 "[ . 1 . 2]" 1 1456 1 72 VAL MG2 1 74 ILE H 3.650 . 5.500 5.489 5.408 5.523 0.023 11 0 "[ . 1 . 2]" 1 1457 1 72 VAL MG2 1 75 LEU H 3.500 . 5.200 5.223 5.178 5.240 0.040 12 0 "[ . 1 . 2]" 1 1458 1 72 VAL MG2 1 76 SER H 3.650 . 5.500 5.445 5.319 5.534 0.034 20 0 "[ . 1 . 2]" 1 1459 1 73 HIS H 1 73 HIS QB 2.600 . 3.400 2.259 2.222 2.309 . 0 0 "[ . 1 . 2]" 1 1460 1 73 HIS H 1 73 HIS HD1 3.650 . 5.500 4.463 4.421 4.503 . 0 0 "[ . 1 . 2]" 1 1461 1 73 HIS H 1 74 ILE H 2.930 . 4.060 2.478 2.353 2.617 . 0 0 "[ . 1 . 2]" 1 1462 1 73 HIS H 1 74 ILE HA 3.650 . 5.500 5.091 4.992 5.197 . 0 0 "[ . 1 . 2]" 1 1463 1 73 HIS H 1 74 ILE HB 3.215 . 4.630 4.414 4.250 4.608 . 0 0 "[ . 1 . 2]" 1 1464 1 73 HIS H 1 74 ILE MD 2.995 . 4.190 4.159 3.758 4.317 0.127 10 0 "[ . 1 . 2]" 1 1465 1 73 HIS H 1 74 ILE QG 3.650 . 5.500 4.469 3.935 5.569 0.069 11 0 "[ . 1 . 2]" 1 1466 1 73 HIS H 1 75 LEU H 3.500 . 5.200 4.035 3.878 4.239 . 0 0 "[ . 1 . 2]" 1 1467 1 73 HIS H 1 76 SER H 3.650 . 5.500 4.571 4.400 4.776 . 0 0 "[ . 1 . 2]" 1 1468 1 73 HIS H 1 76 SER QB 3.650 . 5.500 4.717 4.393 5.113 . 0 0 "[ . 1 . 2]" 1 1469 1 73 HIS HA 1 75 LEU H 3.440 . 5.080 4.645 4.517 4.918 . 0 0 "[ . 1 . 2]" 1 1470 1 73 HIS HA 1 76 SER QB 2.845 . 3.890 2.610 2.308 2.973 . 0 0 "[ . 1 . 2]" 1 1471 1 73 HIS HA 1 77 ASN QD 3.180 . 4.560 3.473 2.997 4.556 . 0 0 "[ . 1 . 2]" 1 1472 1 73 HIS QB 1 74 ILE H 2.890 . 3.980 2.523 2.407 2.617 . 0 0 "[ . 1 . 2]" 1 1473 1 73 HIS QB 1 74 ILE HB 3.465 . 5.130 4.499 4.388 4.676 . 0 0 "[ . 1 . 2]" 1 1474 1 73 HIS QB 1 74 ILE MD 3.200 . 4.600 3.507 2.527 3.978 . 0 0 "[ . 1 . 2]" 1 1475 1 73 HIS QB 1 76 SER H 3.650 . 5.500 5.044 4.863 5.270 . 0 0 "[ . 1 . 2]" 1 1476 1 73 HIS QB 1 77 ASN QD 3.650 . 5.500 4.339 3.908 5.300 . 0 0 "[ . 1 . 2]" 1 1477 1 73 HIS HD1 1 74 ILE H 3.650 . 5.500 3.993 3.593 4.371 . 0 0 "[ . 1 . 2]" 1 1478 1 74 ILE H 1 74 ILE HB 2.630 . 3.460 2.304 2.259 2.363 . 0 0 "[ . 1 . 2]" 1 1479 1 74 ILE H 1 74 ILE MD 2.680 . 3.560 2.796 2.206 3.065 . 0 0 "[ . 1 . 2]" 1 1480 1 74 ILE H 1 74 ILE QG 2.810 . 3.820 2.495 2.063 3.447 . 0 0 "[ . 1 . 2]" 1 1481 1 74 ILE H 1 74 ILE MG 2.690 . 3.580 3.657 3.642 3.686 0.106 4 0 "[ . 1 . 2]" 1 1482 1 74 ILE H 1 75 LEU H 2.655 . 3.510 2.678 2.565 2.780 . 0 0 "[ . 1 . 2]" 1 1483 1 74 ILE H 1 75 LEU HA 3.650 . 5.500 5.268 5.185 5.350 . 0 0 "[ . 1 . 2]" 1 1484 1 74 ILE H 1 77 ASN QB 3.650 . 5.500 5.333 4.989 5.541 0.041 4 0 "[ . 1 . 2]" 1 1485 1 74 ILE HA 1 74 ILE MD 2.725 . 3.650 3.549 2.908 3.772 0.122 10 0 "[ . 1 . 2]" 1 1486 1 74 ILE HA 1 74 ILE QG 2.550 . 3.300 2.324 2.281 2.421 . 0 0 "[ . 1 . 2]" 1 1487 1 74 ILE HA 1 74 ILE MG 2.395 . 2.990 2.518 2.453 2.665 . 0 0 "[ . 1 . 2]" 1 1488 1 74 ILE HA 1 76 SER H 3.650 . 5.500 4.487 4.206 4.728 . 0 0 "[ . 1 . 2]" 1 1489 1 74 ILE HA 1 77 ASN H 3.320 . 4.840 3.575 3.366 3.802 . 0 0 "[ . 1 . 2]" 1 1490 1 74 ILE HA 1 77 ASN QB 3.240 . 4.680 3.283 2.874 3.595 . 0 0 "[ . 1 . 2]" 1 1491 1 74 ILE HA 1 77 ASN QD 3.650 . 5.500 4.061 3.635 4.965 . 0 0 "[ . 1 . 2]" 1 1492 1 74 ILE HA 1 78 ALA H 3.510 . 5.220 4.523 4.164 4.838 . 0 0 "[ . 1 . 2]" 1 1493 1 74 ILE HA 1 78 ALA MB 3.230 . 4.660 4.252 3.889 4.551 . 0 0 "[ . 1 . 2]" 1 1494 1 74 ILE HB 1 75 LEU H 2.710 . 3.620 2.533 2.409 2.700 . 0 0 "[ . 1 . 2]" 1 1495 1 74 ILE HB 1 75 LEU HA 3.375 . 4.950 4.535 4.411 4.655 . 0 0 "[ . 1 . 2]" 1 1496 1 74 ILE MD 1 75 LEU H 2.990 . 4.180 4.221 4.177 4.290 0.110 16 0 "[ . 1 . 2]" 1 1497 1 74 ILE QG 1 75 LEU H 3.450 . 5.100 4.191 3.990 4.550 . 0 0 "[ . 1 . 2]" 1 1498 1 74 ILE MG 1 75 LEU H 2.720 . 3.640 3.077 2.818 3.309 . 0 0 "[ . 1 . 2]" 1 1499 1 74 ILE MG 1 75 LEU HA 2.745 . 3.690 3.309 3.001 3.583 . 0 0 "[ . 1 . 2]" 1 1500 1 74 ILE MG 1 77 ASN H 3.475 . 5.150 4.558 4.383 4.712 . 0 0 "[ . 1 . 2]" 1 1501 1 74 ILE MG 1 77 ASN QB 3.375 . 4.950 4.517 3.937 4.850 . 0 0 "[ . 1 . 2]" 1 1502 1 74 ILE MG 1 78 ALA H 3.150 . 4.500 4.357 4.018 4.559 0.059 9 0 "[ . 1 . 2]" 1 1503 1 74 ILE MG 1 78 ALA MB 2.465 . 3.130 2.996 2.605 3.179 0.049 3 0 "[ . 1 . 2]" 1 1504 1 75 LEU H 1 75 LEU QB 2.420 . 3.040 2.391 2.346 2.438 . 0 0 "[ . 1 . 2]" 1 1505 1 75 LEU H 1 75 LEU QD 2.780 . 3.760 3.213 3.128 3.277 . 0 0 "[ . 1 . 2]" 1 1506 1 75 LEU H 1 75 LEU HG 2.575 . 3.350 2.502 2.346 2.625 . 0 0 "[ . 1 . 2]" 1 1507 1 75 LEU H 1 76 SER H 2.780 . 3.760 2.742 2.650 2.871 . 0 0 "[ . 1 . 2]" 1 1508 1 75 LEU H 1 77 ASN H 3.505 . 5.210 4.157 4.051 4.238 . 0 0 "[ . 1 . 2]" 1 1509 1 75 LEU H 1 78 ALA H 3.650 . 5.500 4.937 4.790 5.105 . 0 0 "[ . 1 . 2]" 1 1510 1 75 LEU H 1 78 ALA MB 3.400 . 5.000 4.745 4.440 4.932 . 0 0 "[ . 1 . 2]" 1 1511 1 75 LEU HA 1 75 LEU QD 2.285 . 2.770 1.975 1.935 2.071 . 0 0 "[ . 1 . 2]" 1 1512 1 75 LEU HA 1 75 LEU HG 2.845 . 3.890 2.961 2.879 3.033 . 0 0 "[ . 1 . 2]" 1 1513 1 75 LEU HA 1 78 ALA H 2.880 . 3.960 3.446 3.340 3.573 . 0 0 "[ . 1 . 2]" 1 1514 1 75 LEU HA 1 78 ALA MB 2.520 . 3.240 2.942 2.593 3.140 . 0 0 "[ . 1 . 2]" 1 1515 1 75 LEU HA 1 82 ILE MG 3.145 . 4.490 4.318 3.738 4.552 0.062 17 0 "[ . 1 . 2]" 1 1516 1 75 LEU QB 1 75 LEU QD 2.430 . 3.060 1.927 1.917 1.938 . 0 0 "[ . 1 . 2]" 1 1517 1 75 LEU QB 1 75 LEU HG 2.280 . 2.760 2.366 2.346 2.395 . 0 0 "[ . 1 . 2]" 1 1518 1 75 LEU QB 1 76 SER H 2.785 . 3.770 2.543 2.382 2.780 . 0 0 "[ . 1 . 2]" 1 1519 1 75 LEU QB 1 77 ASN H 3.650 . 5.500 4.548 4.412 4.696 . 0 0 "[ . 1 . 2]" 1 1520 1 75 LEU QB 1 78 ALA H 3.570 . 5.340 4.809 4.618 5.047 . 0 0 "[ . 1 . 2]" 1 1521 1 75 LEU QD 1 78 ALA MB 2.620 . 3.440 3.491 3.289 3.534 0.094 14 0 "[ . 1 . 2]" 1 1522 1 75 LEU QD 1 82 ILE MG 2.460 . 3.120 2.985 2.516 3.171 0.051 17 0 "[ . 1 . 2]" 1 1523 1 75 LEU HG 1 76 SER H 3.235 . 4.670 4.503 4.431 4.570 . 0 0 "[ . 1 . 2]" 1 1524 1 76 SER H 1 76 SER QB 2.555 . 3.310 2.313 2.204 2.507 . 0 0 "[ . 1 . 2]" 1 1525 1 76 SER H 1 77 ASN H 2.800 . 3.800 2.768 2.643 2.855 . 0 0 "[ . 1 . 2]" 1 1526 1 76 SER H 1 77 ASN QB 3.630 . 5.460 4.828 4.689 4.959 . 0 0 "[ . 1 . 2]" 1 1527 1 76 SER H 1 77 ASN QD 3.650 . 5.500 4.172 3.728 5.303 . 0 0 "[ . 1 . 2]" 1 1528 1 76 SER H 1 78 ALA H 3.340 . 4.880 4.213 4.072 4.346 . 0 0 "[ . 1 . 2]" 1 1529 1 76 SER HA 1 78 ALA H 3.360 . 4.920 4.364 4.125 4.692 . 0 0 "[ . 1 . 2]" 1 1530 1 76 SER QB 1 77 ASN H 2.985 . 4.170 2.990 2.794 3.112 . 0 0 "[ . 1 . 2]" 1 1531 1 76 SER QB 1 77 ASN QD 3.205 . 4.610 2.725 2.256 3.655 . 0 0 "[ . 1 . 2]" 1 1532 1 77 ASN H 1 77 ASN QB 2.755 . 3.710 2.459 2.315 2.625 . 0 0 "[ . 1 . 2]" 1 1533 1 77 ASN H 1 77 ASN QD 3.355 . 4.910 2.742 2.363 3.413 . 0 0 "[ . 1 . 2]" 1 1534 1 77 ASN H 1 78 ALA H 2.495 . 3.190 2.268 2.136 2.376 . 0 0 "[ . 1 . 2]" 1 1535 1 77 ASN H 1 78 ALA HA 3.650 . 5.500 4.813 4.686 4.964 . 0 0 "[ . 1 . 2]" 1 1536 1 77 ASN H 1 78 ALA MB 2.960 . 4.120 3.941 3.836 4.117 . 0 0 "[ . 1 . 2]" 1 1537 1 77 ASN HA 1 77 ASN QD 3.650 . 5.500 3.182 1.883 3.565 . 0 0 "[ . 1 . 2]" 1 1538 1 77 ASN QB 1 77 ASN QD 2.790 . 3.780 2.314 2.142 2.731 . 0 0 "[ . 1 . 2]" 1 1539 1 77 ASN QB 1 78 ALA H 3.035 . 4.270 3.303 2.784 3.596 . 0 0 "[ . 1 . 2]" 1 1540 1 77 ASN QB 1 78 ALA MB 3.360 . 4.920 4.005 3.615 4.318 . 0 0 "[ . 1 . 2]" 1 1541 1 78 ALA H 1 78 ALA MB 2.330 . 2.860 2.351 2.294 2.414 . 0 0 "[ . 1 . 2]" 1 1542 1 78 ALA H 1 79 VAL H 3.140 . 4.480 4.496 4.447 4.520 0.040 3 0 "[ . 1 . 2]" 1 1543 1 78 ALA H 1 82 ILE MD 3.250 . 4.700 4.245 4.001 4.450 . 0 0 "[ . 1 . 2]" 1 1544 1 78 ALA HA 1 79 VAL H 2.275 . 2.750 2.157 2.094 2.247 . 0 0 "[ . 1 . 2]" 1 1545 1 78 ALA HA 1 79 VAL MG1 2.720 . 3.640 3.438 3.275 3.628 . 0 0 "[ . 1 . 2]" 1 1546 1 78 ALA HA 1 82 ILE MD 3.120 . 4.440 4.068 3.868 4.280 . 0 0 "[ . 1 . 2]" 1 1547 1 78 ALA MB 1 79 VAL H 2.535 . 3.270 3.024 2.874 3.282 0.012 15 0 "[ . 1 . 2]" 1 1548 1 78 ALA MB 1 82 ILE MD 2.270 . 2.740 2.461 2.317 2.616 . 0 0 "[ . 1 . 2]" 1 1549 1 79 VAL H 1 79 VAL HB 2.900 . 4.000 3.918 3.854 3.996 . 0 0 "[ . 1 . 2]" 1 1550 1 79 VAL H 1 79 VAL MG1 2.675 . 3.550 2.582 2.403 2.703 . 0 0 "[ . 1 . 2]" 1 1551 1 79 VAL H 1 79 VAL MG2 2.430 . 3.060 2.814 2.691 2.954 . 0 0 "[ . 1 . 2]" 1 1552 1 79 VAL H 1 80 GLY H 3.615 . 5.430 4.404 4.355 4.537 . 0 0 "[ . 1 . 2]" 1 1553 1 79 VAL H 1 82 ILE MD 3.135 . 4.470 3.492 3.216 3.836 . 0 0 "[ . 1 . 2]" 1 1554 1 79 VAL H 1 82 ILE QG 3.405 . 5.010 4.130 3.875 4.583 . 0 0 "[ . 1 . 2]" 1 1555 1 79 VAL HA 1 79 VAL MG1 2.485 . 3.170 2.594 2.502 2.696 . 0 0 "[ . 1 . 2]" 1 1556 1 79 VAL HA 1 79 VAL MG2 2.470 . 3.140 3.182 3.167 3.205 0.065 9 0 "[ . 1 . 2]" 1 1557 1 79 VAL HA 1 80 GLY H 2.480 . 3.160 2.663 2.550 2.764 . 0 0 "[ . 1 . 2]" 1 1558 1 79 VAL HA 1 82 ILE MD 2.565 . 3.330 2.211 2.024 2.486 . 0 0 "[ . 1 . 2]" 1 1559 1 79 VAL HB 1 80 GLY H 2.585 . 3.370 2.520 2.302 2.674 . 0 0 "[ . 1 . 2]" 1 1560 1 79 VAL HB 1 80 GLY QA 3.385 . 4.970 4.236 4.068 4.354 . 0 0 "[ . 1 . 2]" 1 1561 1 79 VAL MG2 1 80 GLY H 2.565 . 3.330 2.282 2.168 2.385 . 0 0 "[ . 1 . 2]" 1 1562 1 79 VAL MG2 1 80 GLY QA 2.850 . 3.900 2.816 2.748 2.893 . 0 0 "[ . 1 . 2]" 1 1563 1 79 VAL MG2 1 81 GLU H 3.505 . 5.210 5.126 4.995 5.214 0.004 7 0 "[ . 1 . 2]" 1 1564 1 80 GLY H 1 81 GLU H 3.200 . 4.600 4.518 4.457 4.579 . 0 0 "[ . 1 . 2]" 1 1565 1 80 GLY H 1 82 ILE MD 3.040 . 4.280 3.799 3.692 3.996 . 0 0 "[ . 1 . 2]" 1 1566 1 80 GLY QA 1 81 GLU H 2.470 . 3.140 2.199 2.151 2.280 . 0 0 "[ . 1 . 2]" 1 1567 1 80 GLY QA 1 81 GLU HA 2.945 . 4.090 3.943 3.911 4.009 . 0 0 "[ . 1 . 2]" 1 1568 1 80 GLY QA 1 81 GLU QG 3.335 . 4.870 3.946 3.588 4.679 . 0 0 "[ . 1 . 2]" 1 1569 1 80 GLY QA 1 82 ILE H 3.650 . 5.500 4.920 4.780 5.158 . 0 0 "[ . 1 . 2]" 1 1570 1 81 GLU H 1 81 GLU QB 2.550 . 3.300 2.355 2.230 2.634 . 0 0 "[ . 1 . 2]" 1 1571 1 81 GLU H 1 81 GLU QG 2.765 . 3.730 2.676 2.288 3.458 . 0 0 "[ . 1 . 2]" 1 1572 1 81 GLU H 1 82 ILE H 3.230 . 4.660 4.328 4.262 4.534 . 0 0 "[ . 1 . 2]" 1 1573 1 81 GLU H 1 82 ILE MD 3.650 . 5.500 5.431 5.292 5.564 0.064 11 0 "[ . 1 . 2]" 1 1574 1 81 GLU H 1 82 ILE QG 3.470 . 5.140 4.145 3.982 4.392 . 0 0 "[ . 1 . 2]" 1 1575 1 81 GLU HA 1 81 GLU QG 2.630 . 3.460 2.455 2.329 2.659 . 0 0 "[ . 1 . 2]" 1 1576 1 81 GLU HA 1 82 ILE H 2.460 . 3.120 2.104 2.026 2.230 . 0 0 "[ . 1 . 2]" 1 1577 1 81 GLU HA 1 82 ILE QG 3.110 . 4.420 3.593 3.417 3.913 . 0 0 "[ . 1 . 2]" 1 1578 1 81 GLU QB 1 82 ILE H 2.925 . 4.050 3.411 3.183 3.515 . 0 0 "[ . 1 . 2]" 1 1579 1 81 GLU QB 1 83 HIS H 3.515 . 5.230 4.852 4.552 5.047 . 0 0 "[ . 1 . 2]" 1 1580 1 81 GLU QB 1 83 HIS HD1 3.255 . 4.710 3.907 3.077 4.700 . 0 0 "[ . 1 . 2]" 1 1581 1 81 GLU QG 1 82 ILE H 3.310 . 4.820 4.212 3.993 4.604 . 0 0 "[ . 1 . 2]" 1 1582 1 82 ILE H 1 82 ILE HB 2.730 . 3.660 2.572 2.384 2.674 . 0 0 "[ . 1 . 2]" 1 1583 1 82 ILE H 1 82 ILE MD 2.790 . 3.780 3.802 3.605 3.851 0.071 12 0 "[ . 1 . 2]" 1 1584 1 82 ILE H 1 82 ILE QG 2.780 . 3.760 2.632 2.488 2.760 . 0 0 "[ . 1 . 2]" 1 1585 1 82 ILE H 1 82 ILE MG 2.840 . 3.880 3.831 3.741 3.880 . 0 0 "[ . 1 . 2]" 1 1586 1 82 ILE H 1 83 HIS H 3.405 . 5.010 4.202 4.114 4.269 . 0 0 "[ . 1 . 2]" 1 1587 1 82 ILE H 1 83 HIS HD1 3.650 . 5.500 5.087 4.471 5.639 0.139 14 0 "[ . 1 . 2]" 1 1588 1 82 ILE HA 1 82 ILE QG 2.740 . 3.680 2.457 2.398 2.516 . 0 0 "[ . 1 . 2]" 1 1589 1 82 ILE HA 1 82 ILE MG 2.385 . 2.970 2.406 2.356 2.462 . 0 0 "[ . 1 . 2]" 1 1590 1 82 ILE HA 1 83 HIS H 2.415 . 3.030 2.061 1.829 2.137 . 0 0 "[ . 1 . 2]" 1 1591 1 82 ILE HA 1 83 HIS QB 3.215 . 4.630 4.312 3.496 4.522 . 0 0 "[ . 1 . 2]" 1 1592 1 82 ILE HA 1 83 HIS HD1 3.440 . 5.080 4.088 3.118 5.343 0.263 11 0 "[ . 1 . 2]" 1 1593 1 82 ILE HB 1 82 ILE MD 2.445 . 3.090 2.397 2.324 2.441 . 0 0 "[ . 1 . 2]" 1 1594 1 82 ILE HB 1 83 HIS H 3.310 . 4.820 4.242 4.133 4.307 . 0 0 "[ . 1 . 2]" 1 1595 1 82 ILE QG 1 82 ILE MG 2.385 . 2.970 2.287 2.263 2.334 . 0 0 "[ . 1 . 2]" 1 1596 1 82 ILE QG 1 83 HIS H 3.275 . 4.750 4.180 3.942 4.315 . 0 0 "[ . 1 . 2]" 1 1597 1 82 ILE MG 1 83 HIS H 2.590 . 3.380 2.916 2.728 3.031 . 0 0 "[ . 1 . 2]" 1 1598 1 82 ILE MG 1 83 HIS HA 3.020 . 4.240 4.044 3.878 4.142 . 0 0 "[ . 1 . 2]" 1 1599 1 82 ILE MG 1 83 HIS QB 3.305 . 4.810 4.320 4.008 4.514 . 0 0 "[ . 1 . 2]" 1 1600 1 82 ILE MG 1 84 MET HA 3.175 . 4.550 4.124 3.717 4.438 . 0 0 "[ . 1 . 2]" 1 1601 1 82 ILE MG 1 84 MET QG 2.580 . 3.360 2.429 2.071 3.386 0.026 20 0 "[ . 1 . 2]" 1 1602 1 83 HIS H 1 83 HIS QB 2.715 . 3.630 2.451 2.116 2.625 . 0 0 "[ . 1 . 2]" 1 1603 1 83 HIS H 1 83 HIS HD1 2.995 . 4.190 2.978 2.421 4.250 0.060 11 0 "[ . 1 . 2]" 1 1604 1 83 HIS H 1 84 MET H 3.230 . 4.660 4.298 4.109 4.451 . 0 0 "[ . 1 . 2]" 1 1605 1 83 HIS H 1 84 MET HA 3.650 . 5.500 5.029 4.704 5.219 . 0 0 "[ . 1 . 2]" 1 1606 1 83 HIS H 1 84 MET QG 3.650 . 5.500 4.584 3.986 5.582 0.082 17 0 "[ . 1 . 2]" 1 1607 1 83 HIS HA 1 83 HIS HD1 3.395 . 4.990 3.176 2.547 3.514 . 0 0 "[ . 1 . 2]" 1 1608 1 83 HIS HA 1 84 MET H 2.445 . 3.090 2.080 1.949 2.137 . 0 0 "[ . 1 . 2]" 1 1609 1 83 HIS HA 1 84 MET QB 3.220 . 4.640 4.290 3.622 4.487 . 0 0 "[ . 1 . 2]" 1 1610 1 83 HIS QB 1 84 MET H 3.070 . 4.340 3.339 3.005 3.787 . 0 0 "[ . 1 . 2]" 1 1611 1 83 HIS HD1 1 84 MET H 3.650 . 5.500 4.688 3.953 5.070 . 0 0 "[ . 1 . 2]" 1 1612 1 84 MET H 1 84 MET QB 2.770 . 3.740 2.503 2.162 2.680 . 0 0 "[ . 1 . 2]" 1 1613 1 84 MET H 1 84 MET ME 2.850 . 3.900 3.884 3.710 3.988 0.088 7 0 "[ . 1 . 2]" 1 1614 1 84 MET H 1 84 MET QG 3.095 . 4.390 3.027 2.662 3.922 . 0 0 "[ . 1 . 2]" 1 1615 1 84 MET H 1 85 LYS H 3.345 . 4.890 4.360 4.271 4.456 . 0 0 "[ . 1 . 2]" 1 1616 1 84 MET H 1 85 LYS HA 3.650 . 5.500 4.663 4.506 4.777 . 0 0 "[ . 1 . 2]" 1 1617 1 84 MET H 1 85 LYS QG 3.565 . 5.330 4.537 3.956 4.898 . 0 0 "[ . 1 . 2]" 1 1618 1 84 MET H 1 86 THR MG 3.550 . 5.300 5.005 4.869 5.211 . 0 0 "[ . 1 . 2]" 1 1619 1 84 MET HA 1 84 MET ME 3.020 . 4.240 4.143 3.923 4.210 . 0 0 "[ . 1 . 2]" 1 1620 1 84 MET HA 1 84 MET QG 2.825 . 3.850 2.475 2.198 2.570 . 0 0 "[ . 1 . 2]" 1 1621 1 84 MET HA 1 85 LYS H 2.470 . 3.140 2.312 2.227 2.406 . 0 0 "[ . 1 . 2]" 1 1622 1 84 MET HA 1 85 LYS QG 3.220 . 4.640 3.604 3.353 3.799 . 0 0 "[ . 1 . 2]" 1 1623 1 84 MET QB 1 84 MET ME 2.565 . 3.330 1.803 1.758 1.848 0.042 14 0 "[ . 1 . 2]" 1 1624 1 84 MET QB 1 85 LYS H 2.805 . 3.810 2.669 2.415 3.478 . 0 0 "[ . 1 . 2]" 1 1625 1 84 MET QB 1 85 LYS HA 3.480 . 5.160 3.972 3.880 4.293 . 0 0 "[ . 1 . 2]" 1 1626 1 84 MET QB 1 86 THR H 3.435 . 5.070 4.589 4.463 5.098 0.028 17 0 "[ . 1 . 2]" 1 1627 1 84 MET QB 1 86 THR MG 2.770 . 3.740 2.794 2.539 3.259 . 0 0 "[ . 1 . 2]" 1 1628 1 84 MET ME 1 84 MET QG 2.545 . 3.290 2.508 2.294 2.612 . 0 0 "[ . 1 . 2]" 1 1629 1 84 MET ME 1 85 LYS H 3.015 . 4.230 4.323 4.305 4.342 0.112 5 0 "[ . 1 . 2]" 1 1630 1 84 MET ME 1 86 THR H 3.390 . 4.980 5.023 4.972 5.050 0.070 4 0 "[ . 1 . 2]" 1 1631 1 84 MET ME 1 86 THR MG 2.515 . 3.230 2.342 2.161 2.542 . 0 0 "[ . 1 . 2]" 1 1632 1 84 MET QG 1 85 LYS H 3.175 . 4.550 3.815 2.593 4.100 . 0 0 "[ . 1 . 2]" 1 1633 1 84 MET QG 1 86 THR MG 3.120 . 4.440 4.198 2.897 4.473 0.033 16 0 "[ . 1 . 2]" 1 1634 1 85 LYS H 1 85 LYS QB 2.820 . 3.840 2.581 2.508 2.679 . 0 0 "[ . 1 . 2]" 1 1635 1 85 LYS H 1 85 LYS QD 3.420 . 5.040 4.257 4.045 4.803 . 0 0 "[ . 1 . 2]" 1 1636 1 85 LYS H 1 85 LYS QG 2.900 . 4.000 2.899 2.781 3.095 . 0 0 "[ . 1 . 2]" 1 1637 1 85 LYS H 1 86 THR H 3.345 . 4.890 4.135 4.065 4.220 . 0 0 "[ . 1 . 2]" 1 1638 1 85 LYS H 1 86 THR MG 2.985 . 4.170 3.654 3.573 3.801 . 0 0 "[ . 1 . 2]" 1 1639 1 85 LYS HA 1 85 LYS QD 2.585 . 3.370 2.556 2.245 3.413 0.043 7 0 "[ . 1 . 2]" 1 1640 1 85 LYS HA 1 85 LYS QE 3.485 . 5.170 4.273 3.869 4.554 . 0 0 "[ . 1 . 2]" 1 1641 1 85 LYS HA 1 85 LYS QG 2.695 . 3.590 2.744 2.264 2.870 . 0 0 "[ . 1 . 2]" 1 1642 1 85 LYS HA 1 86 THR H 2.470 . 3.140 2.071 1.959 2.125 . 0 0 "[ . 1 . 2]" 1 1643 1 85 LYS HA 1 86 THR MG 2.750 . 3.700 3.521 3.254 3.660 . 0 0 "[ . 1 . 2]" 1 1644 1 85 LYS QB 1 85 LYS QE 2.535 . 3.270 3.026 2.123 3.385 0.115 13 0 "[ . 1 . 2]" 1 1645 1 85 LYS QB 1 86 THR H 2.880 . 3.960 3.185 2.895 3.348 . 0 0 "[ . 1 . 2]" 1 1646 1 85 LYS QD 1 85 LYS QE 2.355 . 2.910 2.048 1.994 2.102 . 0 0 "[ . 1 . 2]" 1 1647 1 85 LYS QD 1 85 LYS QG 2.245 . 2.690 2.040 1.985 2.066 . 0 0 "[ . 1 . 2]" 1 1648 1 85 LYS QD 1 86 THR H 2.990 . 4.180 3.953 3.712 4.301 0.121 7 0 "[ . 1 . 2]" 1 1649 1 85 LYS QE 1 85 LYS QG 2.385 . 2.970 2.153 2.009 2.608 . 0 0 "[ . 1 . 2]" 1 1650 1 85 LYS QG 1 86 THR H 3.150 . 4.500 4.492 3.911 4.609 0.109 16 0 "[ . 1 . 2]" 1 1651 1 86 THR H 1 86 THR MG 2.635 . 3.470 2.739 2.675 2.839 . 0 0 "[ . 1 . 2]" 1 1652 1 86 THR H 1 87 MET H 3.345 . 4.890 4.432 4.373 4.500 . 0 0 "[ . 1 . 2]" 1 1653 1 86 THR H 1 87 MET HA 3.650 . 5.500 4.910 4.825 5.018 . 0 0 "[ . 1 . 2]" 1 1654 1 86 THR H 1 87 MET QG 3.650 . 5.500 4.651 4.457 4.808 . 0 0 "[ . 1 . 2]" 1 1655 1 86 THR HA 1 86 THR MG 2.460 . 3.120 2.367 2.281 2.450 . 0 0 "[ . 1 . 2]" 1 1656 1 86 THR HA 1 87 MET H 2.565 . 3.330 2.231 2.145 2.306 . 0 0 "[ . 1 . 2]" 1 1657 1 86 THR HB 1 87 MET H 2.670 . 3.540 2.867 2.635 3.113 . 0 0 "[ . 1 . 2]" 1 1658 1 86 THR MG 1 87 MET H 2.855 . 3.910 3.908 3.838 3.951 0.041 2 0 "[ . 1 . 2]" 1 1659 1 87 MET H 1 87 MET QG 2.865 . 3.930 2.804 2.695 2.893 . 0 0 "[ . 1 . 2]" 1 1660 1 87 MET H 1 88 PRO HA 3.650 . 5.500 5.137 5.008 5.223 . 0 0 "[ . 1 . 2]" 1 1661 1 87 MET H 1 88 PRO QD 3.370 . 4.940 4.448 4.424 4.484 . 0 0 "[ . 1 . 2]" 1 1662 1 87 MET H 1 89 ALA H 3.315 . 4.830 3.612 3.469 3.863 . 0 0 "[ . 1 . 2]" 1 1663 1 87 MET H 1 89 ALA MB 3.430 . 5.060 5.157 5.120 5.208 0.148 19 0 "[ . 1 . 2]" 1 1664 1 87 MET HA 1 88 PRO QD 2.580 . 3.360 2.209 2.063 2.410 . 0 0 "[ . 1 . 2]" 1 1665 1 87 MET HA 1 88 PRO QG 3.345 . 4.890 3.959 3.793 4.314 . 0 0 "[ . 1 . 2]" 1 1666 1 87 MET QB 1 88 PRO QD 2.560 . 3.320 2.077 1.888 2.309 . 0 0 "[ . 1 . 2]" 1 1667 1 87 MET QB 1 89 ALA H 3.535 . 5.270 2.690 2.367 3.056 . 0 0 "[ . 1 . 2]" 1 1668 1 87 MET QG 1 88 PRO QD 3.175 . 4.550 3.431 3.183 3.569 . 0 0 "[ . 1 . 2]" 1 1669 1 87 MET QG 1 89 ALA H 3.650 . 5.500 4.628 4.390 4.851 . 0 0 "[ . 1 . 2]" 1 1670 1 88 PRO HA 1 89 ALA H 2.460 . 3.120 2.929 2.768 3.126 0.006 11 0 "[ . 1 . 2]" 1 1671 1 88 PRO HA 1 89 ALA MB 2.940 . 4.080 3.900 3.843 3.934 . 0 0 "[ . 1 . 2]" 1 1672 1 88 PRO HA 1 90 ALA H 3.385 . 4.970 4.614 4.234 5.056 0.086 9 0 "[ . 1 . 2]" 1 1673 1 88 PRO QB 1 89 ALA H 3.070 . 4.340 3.788 3.680 3.917 . 0 0 "[ . 1 . 2]" 1 1674 1 88 PRO QB 1 89 ALA MB 3.295 . 4.790 4.264 4.200 4.346 . 0 0 "[ . 1 . 2]" 1 1675 1 88 PRO QB 1 90 ALA H 3.175 . 4.550 3.759 3.034 4.501 . 0 0 "[ . 1 . 2]" 1 1676 1 88 PRO QB 1 90 ALA MB 3.405 . 5.010 3.451 2.881 4.447 . 0 0 "[ . 1 . 2]" 1 1677 1 88 PRO QD 1 89 ALA H 3.650 . 5.500 3.388 3.192 3.590 . 0 0 "[ . 1 . 2]" 1 1678 1 88 PRO QG 1 89 ALA H 3.250 . 4.700 4.289 3.504 4.541 . 0 0 "[ . 1 . 2]" 1 1679 1 88 PRO QG 1 90 ALA H 3.650 . 5.500 4.208 2.542 5.286 . 0 0 "[ . 1 . 2]" 1 1680 1 89 ALA H 1 89 ALA MB 2.380 . 2.960 2.841 2.740 2.923 . 0 0 "[ . 1 . 2]" 1 1681 1 89 ALA H 1 90 ALA H 2.870 . 3.940 2.660 2.489 2.857 . 0 0 "[ . 1 . 2]" 1 1682 1 89 ALA H 1 90 ALA HA 3.615 . 5.430 5.217 4.988 5.374 . 0 0 "[ . 1 . 2]" 1 1683 1 89 ALA H 1 90 ALA MB 3.295 . 4.790 4.376 4.173 4.813 0.023 6 0 "[ . 1 . 2]" 1 1684 1 89 ALA HA 1 90 ALA H 2.640 . 3.480 2.787 2.342 3.210 . 0 0 "[ . 1 . 2]" 1 1685 1 89 ALA MB 1 90 ALA H 2.770 . 3.740 3.565 3.310 3.681 . 0 0 "[ . 1 . 2]" 1 1686 1 90 ALA H 1 90 ALA MB 2.560 . 3.320 2.362 2.213 2.900 . 0 0 "[ . 1 . 2]" 1 stop_ save_
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