![]() |
NMR Restraints Grid |
![]() |
Result table
(Save to zip file containing files for each block)
image | mrblock_id | pdb_id | cing | stage | program | type | subtype | subsubtype |
![]() |
452561 |
2vkc ![]() ![]() |
cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2vkc 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 2847 _Distance_constraint_stats_list.Viol_count 4232 _Distance_constraint_stats_list.Viol_total 4948.628 _Distance_constraint_stats_list.Viol_max 0.479 _Distance_constraint_stats_list.Viol_rms 0.0138 _Distance_constraint_stats_list.Viol_average_all_restraints 0.0022 _Distance_constraint_stats_list.Viol_average_violations_only 0.0418 _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 31 MET 0.823 0.196 17 0 "[ . 1 . 2 . ]" 1 32 LYS 1.430 0.203 24 0 "[ . 1 . 2 . ]" 1 33 GLU 1.131 0.203 24 0 "[ . 1 . 2 . ]" 1 34 ALA 0.170 0.063 5 0 "[ . 1 . 2 . ]" 1 35 ASN 0.583 0.145 9 0 "[ . 1 . 2 . ]" 1 36 HIS 1.403 0.104 8 0 "[ . 1 . 2 . ]" 1 37 LEU 0.901 0.104 8 0 "[ . 1 . 2 . ]" 1 38 ALA 0.029 0.014 16 0 "[ . 1 . 2 . ]" 1 39 ALA 1.736 0.096 3 0 "[ . 1 . 2 . ]" 1 40 ILE 2.588 0.126 20 0 "[ . 1 . 2 . ]" 1 41 GLU 2.061 0.108 16 0 "[ . 1 . 2 . ]" 1 42 ILE 2.653 0.119 12 0 "[ . 1 . 2 . ]" 1 43 PHE 4.788 0.151 2 0 "[ . 1 . 2 . ]" 1 44 GLU 0.282 0.046 26 0 "[ . 1 . 2 . ]" 1 45 LYS 3.172 0.168 6 0 "[ . 1 . 2 . ]" 1 46 VAL 5.021 0.168 6 0 "[ . 1 . 2 . ]" 1 47 ASN 1.967 0.148 17 0 "[ . 1 . 2 . ]" 1 48 ALA 0.564 0.082 3 0 "[ . 1 . 2 . ]" 1 49 SER 0.198 0.076 15 0 "[ . 1 . 2 . ]" 1 50 LEU 3.101 0.120 13 0 "[ . 1 . 2 . ]" 1 51 LEU 6.116 0.254 23 0 "[ . 1 . 2 . ]" 1 52 PRO 0.062 0.024 12 0 "[ . 1 . 2 . ]" 1 53 GLN 5.041 0.231 1 0 "[ . 1 . 2 . ]" 1 54 ASN 2.395 0.148 12 0 "[ . 1 . 2 . ]" 1 55 VAL 9.460 0.231 1 0 "[ . 1 . 2 . ]" 1 56 LEU 1.681 0.104 23 0 "[ . 1 . 2 . ]" 1 57 ASP 4.642 0.173 23 0 "[ . 1 . 2 . ]" 1 58 LEU 4.467 0.127 14 0 "[ . 1 . 2 . ]" 1 59 HIS 11.986 0.479 23 0 "[ . 1 . 2 . ]" 1 60 GLY 7.319 0.479 23 0 "[ . 1 . 2 . ]" 1 61 LEU 7.371 0.126 20 0 "[ . 1 . 2 . ]" 1 62 HIS 4.125 0.186 10 0 "[ . 1 . 2 . ]" 1 63 VAL 3.821 0.186 10 0 "[ . 1 . 2 . ]" 1 64 ASP 1.702 0.119 4 0 "[ . 1 . 2 . ]" 1 65 GLU 4.513 0.179 23 0 "[ . 1 . 2 . ]" 1 66 ALA 4.747 0.126 25 0 "[ . 1 . 2 . ]" 1 67 LEU 1.450 0.087 3 0 "[ . 1 . 2 . ]" 1 68 GLU 2.225 0.188 3 0 "[ . 1 . 2 . ]" 1 69 HIS 2.590 0.179 23 0 "[ . 1 . 2 . ]" 1 70 LEU 3.978 0.096 3 0 "[ . 1 . 2 . ]" 1 71 MET 2.415 0.062 4 0 "[ . 1 . 2 . ]" 1 72 ARG 2.074 0.143 22 0 "[ . 1 . 2 . ]" 1 73 VAL 5.408 0.185 10 0 "[ . 1 . 2 . ]" 1 74 LEU 2.758 0.179 22 0 "[ . 1 . 2 . ]" 1 75 GLU 2.468 0.269 20 0 "[ . 1 . 2 . ]" 1 76 LYS 3.741 0.269 20 0 "[ . 1 . 2 . ]" 1 77 LYS 1.839 0.148 12 0 "[ . 1 . 2 . ]" 1 78 THR 0.391 0.056 25 0 "[ . 1 . 2 . ]" 1 79 GLU 1.317 0.083 9 0 "[ . 1 . 2 . ]" 1 80 GLU 2.574 0.143 28 0 "[ . 1 . 2 . ]" 1 81 PHE 2.801 0.096 1 0 "[ . 1 . 2 . ]" 1 82 LYS 1.497 0.096 1 0 "[ . 1 . 2 . ]" 1 83 GLN 3.447 0.157 8 0 "[ . 1 . 2 . ]" 1 84 ASN 1.917 0.157 8 0 "[ . 1 . 2 . ]" 1 85 GLY 0.347 0.040 14 0 "[ . 1 . 2 . ]" 1 86 GLY 0.421 0.078 20 0 "[ . 1 . 2 . ]" 1 87 LYS 3.600 0.114 9 0 "[ . 1 . 2 . ]" 1 88 PRO 2.066 0.114 9 0 "[ . 1 . 2 . ]" 1 89 TYR 2.605 0.080 25 0 "[ . 1 . 2 . ]" 1 90 LEU 2.172 0.105 22 0 "[ . 1 . 2 . ]" 1 91 SER 0.529 0.076 19 0 "[ . 1 . 2 . ]" 1 92 VAL 0.223 0.025 24 0 "[ . 1 . 2 . ]" 1 93 ILE 3.356 0.175 9 0 "[ . 1 . 2 . ]" 1 94 THR 2.445 0.126 12 0 "[ . 1 . 2 . ]" 1 95 GLY 2.481 0.167 6 0 "[ . 1 . 2 . ]" 1 96 ARG 0.979 0.128 5 0 "[ . 1 . 2 . ]" 1 97 GLY 1.314 0.204 12 0 "[ . 1 . 2 . ]" 1 98 ASN 1.680 0.169 5 0 "[ . 1 . 2 . ]" 1 99 HIS 2.846 0.223 16 0 "[ . 1 . 2 . ]" 1 100 SER 0.376 0.104 27 0 "[ . 1 . 2 . ]" 1 101 GLN 0.139 0.051 9 0 "[ . 1 . 2 . ]" 1 102 GLY 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 103 GLY 0.182 0.073 22 0 "[ . 1 . 2 . ]" 1 104 VAL 1.944 0.195 5 0 "[ . 1 . 2 . ]" 1 105 ALA 1.887 0.195 5 0 "[ . 1 . 2 . ]" 1 106 ARG 4.576 0.120 10 0 "[ . 1 . 2 . ]" 1 107 ILE 2.701 0.201 23 0 "[ . 1 . 2 . ]" 1 108 LYS 3.235 0.129 15 0 "[ . 1 . 2 . ]" 1 109 PRO 3.809 0.103 12 0 "[ . 1 . 2 . ]" 1 110 ALA 4.756 0.129 28 0 "[ . 1 . 2 . ]" 1 111 VAL 1.987 0.090 22 0 "[ . 1 . 2 . ]" 1 112 ILE 2.514 0.115 23 0 "[ . 1 . 2 . ]" 1 113 LYS 10.312 0.383 13 0 "[ . 1 . 2 . ]" 1 114 TYR 4.682 0.145 12 0 "[ . 1 . 2 . ]" 1 115 LEU 11.882 0.145 12 0 "[ . 1 . 2 . ]" 1 116 ILE 7.583 0.142 2 0 "[ . 1 . 2 . ]" 1 117 SER 3.986 0.142 2 0 "[ . 1 . 2 . ]" 1 118 HIS 4.299 0.080 28 0 "[ . 1 . 2 . ]" 1 119 SER 1.018 0.069 10 0 "[ . 1 . 2 . ]" 1 120 PHE 5.868 0.199 9 0 "[ . 1 . 2 . ]" 1 121 ARG 4.606 0.199 9 0 "[ . 1 . 2 . ]" 1 122 PHE 8.374 0.114 9 0 "[ . 1 . 2 . ]" 1 123 SER 1.631 0.088 12 0 "[ . 1 . 2 . ]" 1 124 GLU 3.226 0.115 27 0 "[ . 1 . 2 . ]" 1 125 ILE 2.102 0.133 1 0 "[ . 1 . 2 . ]" 1 126 LYS 7.191 0.314 1 0 "[ . 1 . 2 . ]" 1 127 PRO 13.272 0.314 1 0 "[ . 1 . 2 . ]" 1 128 GLY 1.178 0.204 12 0 "[ . 1 . 2 . ]" 1 129 CYS 6.971 0.180 12 0 "[ . 1 . 2 . ]" 1 130 LEU 2.706 0.123 23 0 "[ . 1 . 2 . ]" 1 131 LYS 1.299 0.088 12 0 "[ . 1 . 2 . ]" 1 132 VAL 3.303 0.144 1 0 "[ . 1 . 2 . ]" 1 133 MET 3.546 0.161 25 0 "[ . 1 . 2 . ]" 1 134 LEU 3.584 0.161 25 0 "[ . 1 . 2 . ]" 1 135 LYS 1.645 0.086 6 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 31 MET H 1 31 MET QB 3.530 . 3.530 2.917 2.158 3.400 . 0 0 "[ . 1 . 2 . ]" 1 2 1 31 MET H 1 31 MET HG2 4.350 . 4.350 3.322 2.248 4.401 0.051 9 0 "[ . 1 . 2 . ]" 1 3 1 31 MET H 1 31 MET QG 3.590 . 3.590 2.721 1.992 3.786 0.196 17 0 "[ . 1 . 2 . ]" 1 4 1 31 MET H 1 31 MET HG3 4.350 . 4.350 3.238 2.001 4.368 0.018 27 0 "[ . 1 . 2 . ]" 1 5 1 31 MET HA 1 32 LYS H 3.140 . 3.140 2.302 1.996 3.333 0.193 17 0 "[ . 1 . 2 . ]" 1 6 1 31 MET HA 1 33 GLU H 5.090 . 5.090 3.561 2.628 4.433 . 0 0 "[ . 1 . 2 . ]" 1 7 1 31 MET QB 1 32 LYS H 4.120 . 4.120 3.226 1.726 4.034 . 0 0 "[ . 1 . 2 . ]" 1 8 1 31 MET QB 1 33 GLU H 4.570 . 4.570 3.285 2.156 4.652 0.082 23 0 "[ . 1 . 2 . ]" 1 9 1 31 MET QG 1 32 LYS H 5.340 . 5.340 4.214 3.562 4.869 . 0 0 "[ . 1 . 2 . ]" 1 10 1 31 MET QG 1 33 GLU H 5.340 . 5.340 4.710 3.286 5.436 0.096 6 0 "[ . 1 . 2 . ]" 1 11 1 32 LYS H 1 32 LYS QB 3.910 . 3.910 2.541 2.226 3.079 . 0 0 "[ . 1 . 2 . ]" 1 12 1 32 LYS H 1 32 LYS QD 5.490 . 5.490 3.818 1.654 4.788 . 0 0 "[ . 1 . 2 . ]" 1 13 1 32 LYS H 1 32 LYS QE 5.500 . 5.500 4.249 3.143 5.164 . 0 0 "[ . 1 . 2 . ]" 1 14 1 32 LYS H 1 32 LYS QG 4.720 . 4.720 2.599 1.933 4.078 . 0 0 "[ . 1 . 2 . ]" 1 15 1 32 LYS H 1 33 GLU H 4.180 . 4.180 2.406 1.854 2.824 . 0 0 "[ . 1 . 2 . ]" 1 16 1 32 LYS H 1 33 GLU QG 5.340 . 5.340 4.339 3.380 5.543 0.203 24 0 "[ . 1 . 2 . ]" 1 17 1 32 LYS H 1 34 ALA MB 5.500 . 5.500 4.986 3.829 5.563 0.063 5 0 "[ . 1 . 2 . ]" 1 18 1 32 LYS H 1 35 ASN QB 5.360 . 5.360 4.850 4.133 5.459 0.099 5 0 "[ . 1 . 2 . ]" 1 19 1 32 LYS HA 1 32 LYS QD 4.990 . 4.990 3.657 2.054 4.555 . 0 0 "[ . 1 . 2 . ]" 1 20 1 32 LYS HA 1 33 GLU H 3.520 . 3.520 3.383 3.074 3.504 . 0 0 "[ . 1 . 2 . ]" 1 21 1 32 LYS HA 1 35 ASN H 5.380 . 5.380 3.207 2.770 4.085 . 0 0 "[ . 1 . 2 . ]" 1 22 1 32 LYS HA 1 35 ASN QB 4.280 . 4.280 2.527 2.013 3.559 . 0 0 "[ . 1 . 2 . ]" 1 23 1 32 LYS QB 1 32 LYS QE 3.950 . 3.950 2.861 1.938 3.728 . 0 0 "[ . 1 . 2 . ]" 1 24 1 32 LYS QB 1 33 GLU H 4.590 . 4.590 3.238 2.239 3.917 . 0 0 "[ . 1 . 2 . ]" 1 25 1 32 LYS QB 1 34 ALA H 5.500 . 5.500 4.933 4.256 5.513 0.013 24 0 "[ . 1 . 2 . ]" 1 26 1 32 LYS QB 1 35 ASN H 5.260 . 5.260 4.647 3.852 5.208 . 0 0 "[ . 1 . 2 . ]" 1 27 1 32 LYS QD 1 33 GLU H 5.500 . 5.500 4.556 2.158 5.548 0.048 21 0 "[ . 1 . 2 . ]" 1 28 1 32 LYS QD 1 35 ASN QB 5.500 . 5.500 4.809 3.188 5.645 0.145 9 0 "[ . 1 . 2 . ]" 1 29 1 32 LYS QG 1 35 ASN QB 4.960 . 4.960 4.432 3.097 4.986 0.026 17 0 "[ . 1 . 2 . ]" 1 30 1 33 GLU H 1 33 GLU QB 3.280 . 3.280 2.466 2.073 2.934 . 0 0 "[ . 1 . 2 . ]" 1 31 1 33 GLU H 1 33 GLU HB3 3.790 . 3.790 3.295 2.271 3.627 . 0 0 "[ . 1 . 2 . ]" 1 32 1 33 GLU H 1 33 GLU HG2 4.420 . 4.420 3.255 1.924 4.423 0.003 1 0 "[ . 1 . 2 . ]" 1 33 1 33 GLU H 1 33 GLU QG 3.760 . 3.760 2.658 1.877 3.807 0.047 1 0 "[ . 1 . 2 . ]" 1 34 1 33 GLU H 1 33 GLU HG3 4.420 . 4.420 3.226 1.885 4.305 . 0 0 "[ . 1 . 2 . ]" 1 35 1 33 GLU H 1 35 ASN QB 5.260 . 5.260 4.707 4.163 5.203 . 0 0 "[ . 1 . 2 . ]" 1 36 1 33 GLU HA 1 33 GLU HG2 4.230 . 4.230 3.238 2.501 4.232 0.002 7 0 "[ . 1 . 2 . ]" 1 37 1 33 GLU HA 1 33 GLU QG 3.670 . 3.670 2.777 2.363 3.531 . 0 0 "[ . 1 . 2 . ]" 1 38 1 33 GLU HA 1 33 GLU HG3 4.230 . 4.230 3.264 2.458 4.259 0.029 13 0 "[ . 1 . 2 . ]" 1 39 1 33 GLU HA 1 35 ASN H 5.500 . 5.500 4.262 3.654 4.810 . 0 0 "[ . 1 . 2 . ]" 1 40 1 33 GLU HA 1 36 HIS QB 5.070 . 5.070 2.722 1.853 4.635 . 0 0 "[ . 1 . 2 . ]" 1 41 1 33 GLU QB 1 34 ALA H 3.890 . 3.890 2.782 2.101 3.631 . 0 0 "[ . 1 . 2 . ]" 1 42 1 33 GLU QB 1 34 ALA MB 5.340 . 5.340 3.981 3.428 4.678 . 0 0 "[ . 1 . 2 . ]" 1 43 1 33 GLU HB2 1 34 ALA H 4.320 . 4.320 3.040 2.124 3.992 . 0 0 "[ . 1 . 2 . ]" 1 44 1 33 GLU HB3 1 34 ALA H 4.320 . 4.320 3.638 2.178 4.291 . 0 0 "[ . 1 . 2 . ]" 1 45 1 33 GLU QG 1 34 ALA H 4.650 . 4.650 3.732 2.197 4.585 . 0 0 "[ . 1 . 2 . ]" 1 46 1 34 ALA H 1 34 ALA MB 2.710 . 2.710 2.249 2.213 2.288 . 0 0 "[ . 1 . 2 . ]" 1 47 1 34 ALA H 1 35 ASN H 4.010 . 4.010 2.529 2.256 2.740 . 0 0 "[ . 1 . 2 . ]" 1 48 1 34 ALA H 1 35 ASN QB 4.990 . 4.990 4.337 4.009 4.632 . 0 0 "[ . 1 . 2 . ]" 1 49 1 34 ALA HA 1 37 LEU H 4.850 . 4.850 3.309 3.011 3.755 . 0 0 "[ . 1 . 2 . ]" 1 50 1 34 ALA HA 1 37 LEU HB2 4.720 . 4.720 3.012 2.229 4.156 . 0 0 "[ . 1 . 2 . ]" 1 51 1 34 ALA HA 1 37 LEU MD1 5.260 . 5.260 3.260 2.090 5.313 0.053 19 0 "[ . 1 . 2 . ]" 1 52 1 34 ALA HA 1 37 LEU QD 5.440 . 5.440 2.654 2.080 3.459 . 0 0 "[ . 1 . 2 . ]" 1 53 1 34 ALA HA 1 37 LEU MD2 5.260 . 5.260 4.073 2.082 5.256 . 0 0 "[ . 1 . 2 . ]" 1 54 1 34 ALA MB 1 35 ASN H 3.670 . 3.670 2.581 2.317 3.024 . 0 0 "[ . 1 . 2 . ]" 1 55 1 34 ALA MB 1 35 ASN HA 4.830 . 4.830 3.903 3.797 4.006 . 0 0 "[ . 1 . 2 . ]" 1 56 1 34 ALA MB 1 35 ASN QB 5.250 . 5.250 4.033 3.667 4.479 . 0 0 "[ . 1 . 2 . ]" 1 57 1 35 ASN H 1 35 ASN QB 3.260 . 3.260 2.302 2.204 2.515 . 0 0 "[ . 1 . 2 . ]" 1 58 1 35 ASN HA 1 38 ALA H 4.680 . 4.680 3.405 2.968 3.939 . 0 0 "[ . 1 . 2 . ]" 1 59 1 35 ASN HA 1 38 ALA MB 4.980 . 4.980 2.549 2.113 3.181 . 0 0 "[ . 1 . 2 . ]" 1 60 1 35 ASN QB 1 35 ASN QD 3.070 . 3.070 2.310 2.113 2.783 . 0 0 "[ . 1 . 2 . ]" 1 61 1 35 ASN QB 1 35 ASN HD22 3.540 . 3.540 3.328 3.207 3.544 0.004 9 0 "[ . 1 . 2 . ]" 1 62 1 35 ASN QB 1 37 LEU H 5.420 . 5.420 4.820 4.362 5.057 . 0 0 "[ . 1 . 2 . ]" 1 63 1 35 ASN QB 1 38 ALA MB 5.280 . 5.280 4.155 3.287 4.589 . 0 0 "[ . 1 . 2 . ]" 1 64 1 35 ASN QB 1 39 ALA MB 5.500 . 5.500 4.770 3.805 5.518 0.018 13 0 "[ . 1 . 2 . ]" 1 65 1 36 HIS H 1 37 LEU H 3.420 . 3.420 2.638 2.386 2.930 . 0 0 "[ . 1 . 2 . ]" 1 66 1 36 HIS H 1 37 LEU QD 4.770 . 4.770 4.430 3.218 4.831 0.061 23 0 "[ . 1 . 2 . ]" 1 67 1 36 HIS H 1 39 ALA MB 5.500 . 5.500 4.635 4.099 5.108 . 0 0 "[ . 1 . 2 . ]" 1 68 1 36 HIS HA 1 36 HIS HD2 4.390 . 4.390 3.444 2.600 4.272 . 0 0 "[ . 1 . 2 . ]" 1 69 1 36 HIS HA 1 37 LEU QD 5.440 . 5.440 4.858 4.203 5.295 . 0 0 "[ . 1 . 2 . ]" 1 70 1 36 HIS HA 1 38 ALA H 4.890 . 4.890 4.261 3.792 4.632 . 0 0 "[ . 1 . 2 . ]" 1 71 1 36 HIS HA 1 39 ALA H 3.960 . 3.960 3.284 2.806 3.666 . 0 0 "[ . 1 . 2 . ]" 1 72 1 36 HIS HA 1 39 ALA HA 5.500 . 5.500 5.050 4.527 5.558 0.058 23 0 "[ . 1 . 2 . ]" 1 73 1 36 HIS HA 1 39 ALA MB 3.910 . 3.910 2.553 2.111 3.046 . 0 0 "[ . 1 . 2 . ]" 1 74 1 36 HIS HA 1 40 ILE H 5.430 . 5.430 4.773 4.218 5.451 0.021 6 0 "[ . 1 . 2 . ]" 1 75 1 36 HIS HA 1 40 ILE MD 5.470 . 5.470 4.407 3.833 5.139 . 0 0 "[ . 1 . 2 . ]" 1 76 1 36 HIS QB 1 36 HIS HD2 3.370 . 3.370 3.006 2.823 3.289 . 0 0 "[ . 1 . 2 . ]" 1 77 1 36 HIS QB 1 36 HIS HE1 4.640 . 4.640 4.359 4.298 4.407 . 0 0 "[ . 1 . 2 . ]" 1 78 1 36 HIS QB 1 37 LEU H 3.920 . 3.920 2.650 2.332 3.821 . 0 0 "[ . 1 . 2 . ]" 1 79 1 36 HIS QB 1 39 ALA H 4.870 . 4.870 4.788 4.273 4.939 0.069 23 0 "[ . 1 . 2 . ]" 1 80 1 36 HIS HB2 1 37 LEU H 4.550 . 4.550 3.877 3.637 4.307 . 0 0 "[ . 1 . 2 . ]" 1 81 1 36 HIS HB3 1 37 LEU H 4.550 . 4.550 2.719 2.353 4.271 . 0 0 "[ . 1 . 2 . ]" 1 82 1 36 HIS HD2 1 37 LEU HA 4.960 . 4.960 3.870 3.051 4.995 0.035 8 0 "[ . 1 . 2 . ]" 1 83 1 36 HIS HD2 1 37 LEU QD 5.360 . 5.360 3.626 2.584 4.538 . 0 0 "[ . 1 . 2 . ]" 1 84 1 36 HIS HD2 1 37 LEU MD2 4.500 . 4.500 3.769 2.592 4.604 0.104 8 0 "[ . 1 . 2 . ]" 1 85 1 36 HIS HD2 1 39 ALA MB . . 4.500 3.787 2.975 4.541 0.041 17 0 "[ . 1 . 2 . ]" 1 86 1 36 HIS HD2 1 40 ILE H 5.500 . 5.500 4.849 4.169 5.581 0.081 13 0 "[ . 1 . 2 . ]" 1 87 1 36 HIS HD2 1 40 ILE MD 4.030 . 4.030 2.762 2.197 3.443 . 0 0 "[ . 1 . 2 . ]" 1 88 1 36 HIS HD2 1 40 ILE QG 5.340 . 5.340 4.056 2.385 5.369 0.029 6 0 "[ . 1 . 2 . ]" 1 89 1 36 HIS HD2 1 61 LEU HA . . 4.500 3.705 1.919 4.539 0.039 20 0 "[ . 1 . 2 . ]" 1 90 1 37 LEU H 1 37 LEU HB2 3.740 . 3.740 2.486 2.276 2.577 . 0 0 "[ . 1 . 2 . ]" 1 91 1 37 LEU H 1 37 LEU QB 2.920 . 2.920 2.444 2.251 2.524 . 0 0 "[ . 1 . 2 . ]" 1 92 1 37 LEU H 1 37 LEU HB3 4.100 . 4.100 3.602 3.553 3.629 . 0 0 "[ . 1 . 2 . ]" 1 93 1 37 LEU H 1 37 LEU MD1 4.040 . 4.040 3.663 3.314 3.947 . 0 0 "[ . 1 . 2 . ]" 1 94 1 37 LEU H 1 37 LEU QD 3.470 . 3.470 2.800 1.858 3.229 . 0 0 "[ . 1 . 2 . ]" 1 95 1 37 LEU H 1 37 LEU MD2 4.040 . 4.040 2.955 1.868 3.574 . 0 0 "[ . 1 . 2 . ]" 1 96 1 37 LEU H 1 37 LEU HG 4.200 . 4.200 2.721 2.151 4.060 . 0 0 "[ . 1 . 2 . ]" 1 97 1 37 LEU H 1 38 ALA MB 5.040 . 5.040 4.212 4.047 4.361 . 0 0 "[ . 1 . 2 . ]" 1 98 1 37 LEU H 1 39 ALA MB 5.450 . 5.450 4.655 4.369 4.945 . 0 0 "[ . 1 . 2 . ]" 1 99 1 37 LEU HA 1 37 LEU MD1 4.090 . 4.090 3.412 2.021 3.894 . 0 0 "[ . 1 . 2 . ]" 1 100 1 37 LEU HA 1 37 LEU QD 3.430 . 3.430 2.053 1.926 2.147 . 0 0 "[ . 1 . 2 . ]" 1 101 1 37 LEU HA 1 37 LEU MD2 4.090 . 4.090 2.255 2.018 3.143 . 0 0 "[ . 1 . 2 . ]" 1 102 1 37 LEU HA 1 37 LEU HG 3.930 . 3.930 3.324 3.020 3.779 . 0 0 "[ . 1 . 2 . ]" 1 103 1 37 LEU HA 1 38 ALA H 3.550 . 3.550 3.471 3.406 3.520 . 0 0 "[ . 1 . 2 . ]" 1 104 1 37 LEU HA 1 39 ALA H 4.570 . 4.570 4.023 3.546 4.463 . 0 0 "[ . 1 . 2 . ]" 1 105 1 37 LEU HA 1 40 ILE H 4.600 . 4.600 3.609 3.074 4.311 . 0 0 "[ . 1 . 2 . ]" 1 106 1 37 LEU HA 1 40 ILE HB 5.130 . 5.130 3.707 2.660 5.073 . 0 0 "[ . 1 . 2 . ]" 1 107 1 37 LEU HA 1 40 ILE MD 4.190 . 4.190 3.174 1.964 4.230 0.040 3 0 "[ . 1 . 2 . ]" 1 108 1 37 LEU QB 1 38 ALA H 3.250 . 3.250 2.689 2.460 2.984 . 0 0 "[ . 1 . 2 . ]" 1 109 1 37 LEU HB2 1 37 LEU QD 3.100 . 3.100 2.302 2.261 2.397 . 0 0 "[ . 1 . 2 . ]" 1 110 1 37 LEU HB2 1 38 ALA H 3.920 . 3.920 2.763 2.501 3.110 . 0 0 "[ . 1 . 2 . ]" 1 111 1 37 LEU HB2 1 38 ALA HA 5.310 . 5.310 4.409 4.176 4.878 . 0 0 "[ . 1 . 2 . ]" 1 112 1 37 LEU HB2 1 38 ALA MB 4.710 . 4.710 4.054 3.724 4.508 . 0 0 "[ . 1 . 2 . ]" 1 113 1 37 LEU HB3 1 38 ALA H 4.550 . 4.550 3.726 3.496 3.989 . 0 0 "[ . 1 . 2 . ]" 1 114 1 37 LEU HB3 1 38 ALA HA 5.450 . 5.450 4.506 4.293 4.702 . 0 0 "[ . 1 . 2 . ]" 1 115 1 37 LEU QD 1 38 ALA H 4.360 . 4.360 4.038 3.598 4.269 . 0 0 "[ . 1 . 2 . ]" 1 116 1 37 LEU QD 1 39 ALA H 5.440 . 5.440 5.044 4.678 5.439 . 0 0 "[ . 1 . 2 . ]" 1 117 1 37 LEU MD1 1 38 ALA H 5.040 . 5.040 4.641 4.385 4.893 . 0 0 "[ . 1 . 2 . ]" 1 118 1 37 LEU MD2 1 38 ALA H 5.040 . 5.040 4.475 3.757 4.724 . 0 0 "[ . 1 . 2 . ]" 1 119 1 37 LEU HG 1 38 ALA H 5.400 . 5.400 4.523 4.113 5.389 . 0 0 "[ . 1 . 2 . ]" 1 120 1 38 ALA H 1 38 ALA MB 2.640 . 2.640 2.235 2.204 2.276 . 0 0 "[ . 1 . 2 . ]" 1 121 1 38 ALA H 1 39 ALA H 3.060 . 3.060 2.546 2.196 2.683 . 0 0 "[ . 1 . 2 . ]" 1 122 1 38 ALA H 1 41 GLU HG2 5.470 . 5.470 4.862 4.486 5.471 0.001 6 0 "[ . 1 . 2 . ]" 1 123 1 38 ALA HA 1 39 ALA H 3.520 . 3.520 3.470 3.297 3.534 0.014 16 0 "[ . 1 . 2 . ]" 1 124 1 38 ALA HA 1 40 ILE H 4.480 . 4.480 4.087 3.612 4.465 . 0 0 "[ . 1 . 2 . ]" 1 125 1 38 ALA HA 1 41 GLU H 4.150 . 4.150 3.539 3.244 3.968 . 0 0 "[ . 1 . 2 . ]" 1 126 1 38 ALA HA 1 41 GLU QB 5.500 . 5.500 4.107 3.665 4.657 . 0 0 "[ . 1 . 2 . ]" 1 127 1 38 ALA HA 1 41 GLU HG2 4.220 . 4.220 2.280 1.920 2.852 . 0 0 "[ . 1 . 2 . ]" 1 128 1 38 ALA MB 1 41 GLU HG2 4.660 . 4.660 3.533 3.050 4.170 . 0 0 "[ . 1 . 2 . ]" 1 129 1 38 ALA MB 1 42 ILE H 5.380 . 5.380 4.537 4.206 5.349 . 0 0 "[ . 1 . 2 . ]" 1 130 1 39 ALA H 1 39 ALA MB 2.580 . 2.580 2.246 2.185 2.304 . 0 0 "[ . 1 . 2 . ]" 1 131 1 39 ALA H 1 40 ILE H 3.220 . 3.220 2.652 2.221 2.996 . 0 0 "[ . 1 . 2 . ]" 1 132 1 39 ALA H 1 40 ILE MD 4.880 . 4.880 4.099 3.024 4.924 0.044 11 0 "[ . 1 . 2 . ]" 1 133 1 39 ALA H 1 42 ILE QG 4.770 . 4.770 4.290 3.719 4.691 . 0 0 "[ . 1 . 2 . ]" 1 134 1 39 ALA H 1 42 ILE HG13 5.500 . 5.500 5.189 4.527 5.560 0.060 23 0 "[ . 1 . 2 . ]" 1 135 1 39 ALA HA 1 40 ILE H 3.550 . 3.550 3.484 3.371 3.539 . 0 0 "[ . 1 . 2 . ]" 1 136 1 39 ALA HA 1 42 ILE H 4.170 . 4.170 3.502 3.162 3.756 . 0 0 "[ . 1 . 2 . ]" 1 137 1 39 ALA HA 1 42 ILE HB 3.530 . 3.530 2.637 2.114 3.125 . 0 0 "[ . 1 . 2 . ]" 1 138 1 39 ALA HA 1 42 ILE MD 4.970 . 4.970 4.487 3.860 4.971 0.001 9 0 "[ . 1 . 2 . ]" 1 139 1 39 ALA HA 1 42 ILE HG12 5.500 . 5.500 3.128 2.347 3.802 . 0 0 "[ . 1 . 2 . ]" 1 140 1 39 ALA HA 1 42 ILE HG13 4.680 . 4.680 3.263 2.582 3.880 . 0 0 "[ . 1 . 2 . ]" 1 141 1 39 ALA HA 1 42 ILE MG 4.870 . 4.870 3.934 3.446 4.376 . 0 0 "[ . 1 . 2 . ]" 1 142 1 39 ALA HA 1 43 PHE H 4.280 . 4.280 3.874 3.642 4.306 0.026 21 0 "[ . 1 . 2 . ]" 1 143 1 39 ALA MB 1 40 ILE H 2.960 . 2.960 2.678 2.523 2.915 . 0 0 "[ . 1 . 2 . ]" 1 144 1 39 ALA MB 1 40 ILE HA 3.960 . 3.960 3.824 3.746 3.924 . 0 0 "[ . 1 . 2 . ]" 1 145 1 39 ALA MB 1 42 ILE H 5.500 . 5.500 4.624 4.380 4.764 . 0 0 "[ . 1 . 2 . ]" 1 146 1 39 ALA MB 1 61 LEU HA 4.350 . 4.350 3.278 2.344 3.688 . 0 0 "[ . 1 . 2 . ]" 1 147 1 39 ALA MB 1 61 LEU HB2 5.220 . 5.220 4.769 4.032 5.266 0.046 21 0 "[ . 1 . 2 . ]" 1 148 1 39 ALA MB 1 62 HIS H 5.360 . 5.360 5.272 4.079 5.456 0.096 3 0 "[ . 1 . 2 . ]" 1 149 1 40 ILE H 1 40 ILE HB 2.720 . 2.720 2.519 2.392 2.658 . 0 0 "[ . 1 . 2 . ]" 1 150 1 40 ILE H 1 40 ILE MD 3.820 . 3.820 2.489 1.839 3.242 . 0 0 "[ . 1 . 2 . ]" 1 151 1 40 ILE H 1 40 ILE HG12 4.080 . 4.080 3.265 2.000 4.094 0.014 15 0 "[ . 1 . 2 . ]" 1 152 1 40 ILE H 1 40 ILE QG 3.600 . 3.600 2.902 1.988 3.561 . 0 0 "[ . 1 . 2 . ]" 1 153 1 40 ILE H 1 40 ILE HG13 4.080 . 4.080 3.675 3.498 3.919 . 0 0 "[ . 1 . 2 . ]" 1 154 1 40 ILE H 1 40 ILE MG 3.880 . 3.880 3.793 3.751 3.833 . 0 0 "[ . 1 . 2 . ]" 1 155 1 40 ILE H 1 41 GLU H 3.410 . 3.410 2.730 2.633 2.887 . 0 0 "[ . 1 . 2 . ]" 1 156 1 40 ILE H 1 41 GLU QB 5.320 . 5.320 5.053 4.917 5.217 . 0 0 "[ . 1 . 2 . ]" 1 157 1 40 ILE H 1 41 GLU HG2 4.740 . 4.740 4.168 3.742 4.593 . 0 0 "[ . 1 . 2 . ]" 1 158 1 40 ILE H 1 41 GLU QG 4.240 . 4.240 4.010 3.669 4.253 0.013 15 0 "[ . 1 . 2 . ]" 1 159 1 40 ILE H 1 41 GLU HG3 5.270 . 5.270 5.250 4.907 5.305 0.035 13 0 "[ . 1 . 2 . ]" 1 160 1 40 ILE H 1 61 LEU MD1 4.500 . 4.500 4.124 3.690 4.509 0.009 20 0 "[ . 1 . 2 . ]" 1 161 1 40 ILE H 1 61 LEU QD 4.810 . 4.810 3.910 3.432 4.313 . 0 0 "[ . 1 . 2 . ]" 1 162 1 40 ILE HA 1 40 ILE MD 3.620 . 3.620 2.534 2.049 2.980 . 0 0 "[ . 1 . 2 . ]" 1 163 1 40 ILE HA 1 40 ILE HG12 3.980 . 3.980 3.464 3.025 3.740 . 0 0 "[ . 1 . 2 . ]" 1 164 1 40 ILE HA 1 40 ILE QG 3.650 . 3.650 2.643 2.406 3.013 . 0 0 "[ . 1 . 2 . ]" 1 165 1 40 ILE HA 1 40 ILE HG13 3.980 . 3.980 2.985 2.439 3.805 . 0 0 "[ . 1 . 2 . ]" 1 166 1 40 ILE HA 1 40 ILE MG 3.280 . 3.280 2.521 2.358 2.679 . 0 0 "[ . 1 . 2 . ]" 1 167 1 40 ILE HA 1 43 PHE H 3.770 . 3.770 3.493 3.155 3.777 0.007 2 0 "[ . 1 . 2 . ]" 1 168 1 40 ILE HA 1 43 PHE HB2 4.850 . 4.850 3.719 3.024 4.265 . 0 0 "[ . 1 . 2 . ]" 1 169 1 40 ILE HA 1 43 PHE HB3 3.570 . 3.570 2.501 2.129 2.829 . 0 0 "[ . 1 . 2 . ]" 1 170 1 40 ILE HA 1 43 PHE QD 3.980 . 3.980 3.349 2.438 3.982 0.002 22 0 "[ . 1 . 2 . ]" 1 171 1 40 ILE HA 1 44 GLU H 5.010 . 5.010 4.197 3.861 4.538 . 0 0 "[ . 1 . 2 . ]" 1 172 1 40 ILE HA 1 61 LEU QD 3.960 . 3.960 2.629 2.183 2.960 . 0 0 "[ . 1 . 2 . ]" 1 173 1 40 ILE HA 1 61 LEU MD2 4.500 . 4.500 3.272 2.676 4.085 . 0 0 "[ . 1 . 2 . ]" 1 174 1 40 ILE HB 1 40 ILE MD 3.660 . 3.660 2.761 2.418 3.260 . 0 0 "[ . 1 . 2 . ]" 1 175 1 40 ILE HB 1 41 GLU H 3.200 . 3.200 2.640 2.326 2.964 . 0 0 "[ . 1 . 2 . ]" 1 176 1 40 ILE MD 1 41 GLU H 5.260 . 5.260 4.302 3.928 4.701 . 0 0 "[ . 1 . 2 . ]" 1 177 1 40 ILE MD 1 43 PHE H 5.500 . 5.500 5.191 4.770 5.505 0.005 9 0 "[ . 1 . 2 . ]" 1 178 1 40 ILE MD 1 43 PHE HB3 5.500 . 5.500 4.423 3.467 5.048 . 0 0 "[ . 1 . 2 . ]" 1 179 1 40 ILE MD 1 43 PHE QD 5.500 . 5.500 4.756 3.316 5.520 0.020 6 0 "[ . 1 . 2 . ]" 1 180 1 40 ILE MD 1 61 LEU H 5.500 . 5.500 4.960 4.352 5.534 0.034 12 0 "[ . 1 . 2 . ]" 1 181 1 40 ILE MD 1 61 LEU QD 3.740 . 3.740 2.441 1.866 3.307 . 0 0 "[ . 1 . 2 . ]" 1 182 1 40 ILE MD 1 62 HIS HB2 5.500 . 5.500 5.239 4.610 5.596 0.096 22 0 "[ . 1 . 2 . ]" 1 183 1 40 ILE MD 1 65 GLU HB3 5.500 . 5.500 4.446 2.967 5.517 0.017 15 0 "[ . 1 . 2 . ]" 1 184 1 40 ILE MD 1 65 GLU HG2 5.500 . 5.500 4.694 3.986 5.519 0.019 28 0 "[ . 1 . 2 . ]" 1 185 1 40 ILE MD 1 65 GLU HG3 5.500 . 5.500 4.857 2.540 5.517 0.017 1 0 "[ . 1 . 2 . ]" 1 186 1 40 ILE QG 1 41 GLU H 5.060 . 5.060 4.312 3.816 4.691 . 0 0 "[ . 1 . 2 . ]" 1 187 1 40 ILE QG 1 61 LEU QD 3.540 . 3.540 2.851 1.998 3.666 0.126 20 0 "[ . 1 . 2 . ]" 1 188 1 40 ILE HG12 1 40 ILE MG 3.530 . 3.530 2.630 2.218 3.218 . 0 0 "[ . 1 . 2 . ]" 1 189 1 40 ILE HG13 1 40 ILE MG 3.530 . 3.530 2.418 2.331 2.495 . 0 0 "[ . 1 . 2 . ]" 1 190 1 40 ILE MG 1 41 GLU H 3.450 . 3.450 3.234 2.958 3.456 0.006 23 0 "[ . 1 . 2 . ]" 1 191 1 40 ILE MG 1 41 GLU HA 4.040 . 4.040 3.245 2.992 3.471 . 0 0 "[ . 1 . 2 . ]" 1 192 1 40 ILE MG 1 41 GLU QB 4.780 . 4.780 3.952 3.563 4.340 . 0 0 "[ . 1 . 2 . ]" 1 193 1 40 ILE MG 1 41 GLU HG2 5.500 . 5.500 4.949 4.521 5.444 . 0 0 "[ . 1 . 2 . ]" 1 194 1 40 ILE MG 1 43 PHE QD 3.690 . 3.690 3.247 2.526 3.717 0.027 12 0 "[ . 1 . 2 . ]" 1 195 1 40 ILE MG 1 43 PHE QE 5.450 . 5.450 4.458 3.298 5.134 . 0 0 "[ . 1 . 2 . ]" 1 196 1 40 ILE MG 1 44 GLU H 5.000 . 5.000 4.130 3.672 4.578 . 0 0 "[ . 1 . 2 . ]" 1 197 1 40 ILE MG 1 44 GLU HG2 4.480 . 4.480 3.831 2.913 4.342 . 0 0 "[ . 1 . 2 . ]" 1 198 1 40 ILE MG 1 44 GLU HG3 4.230 . 4.230 2.878 2.253 3.318 . 0 0 "[ . 1 . 2 . ]" 1 199 1 40 ILE MG 1 61 LEU MD1 4.500 . 4.500 4.081 3.043 4.557 0.057 26 0 "[ . 1 . 2 . ]" 1 200 1 40 ILE MG 1 61 LEU QD 3.900 . 3.900 3.408 2.856 3.738 . 0 0 "[ . 1 . 2 . ]" 1 201 1 41 GLU H 1 41 GLU QB 2.870 . 2.870 2.613 2.501 2.646 . 0 0 "[ . 1 . 2 . ]" 1 202 1 41 GLU H 1 41 GLU HG2 3.820 . 3.820 2.177 1.912 2.521 . 0 0 "[ . 1 . 2 . ]" 1 203 1 41 GLU H 1 41 GLU QG 3.410 . 3.410 2.136 1.900 2.374 . 0 0 "[ . 1 . 2 . ]" 1 204 1 41 GLU H 1 41 GLU HG3 3.820 . 3.820 3.159 2.806 3.307 . 0 0 "[ . 1 . 2 . ]" 1 205 1 41 GLU H 1 42 ILE HG12 4.540 . 4.540 4.202 3.905 4.463 . 0 0 "[ . 1 . 2 . ]" 1 206 1 41 GLU H 1 42 ILE QG 5.010 . 5.010 4.110 3.835 4.346 . 0 0 "[ . 1 . 2 . ]" 1 207 1 41 GLU H 1 43 PHE HB3 5.110 . 5.110 4.907 4.711 5.171 0.061 14 0 "[ . 1 . 2 . ]" 1 208 1 41 GLU HA 1 43 PHE H 5.350 . 5.350 4.470 4.333 4.636 . 0 0 "[ . 1 . 2 . ]" 1 209 1 41 GLU HA 1 44 GLU H 3.910 . 3.910 3.353 3.095 3.547 . 0 0 "[ . 1 . 2 . ]" 1 210 1 41 GLU HA 1 44 GLU QB 3.710 . 3.710 2.879 2.441 3.416 . 0 0 "[ . 1 . 2 . ]" 1 211 1 41 GLU HA 1 44 GLU QG 4.480 . 4.480 3.085 2.761 3.551 . 0 0 "[ . 1 . 2 . ]" 1 212 1 41 GLU QB 1 42 ILE H 3.680 . 3.680 3.504 3.459 3.566 . 0 0 "[ . 1 . 2 . ]" 1 213 1 41 GLU QB 1 42 ILE MD 4.550 . 4.550 4.158 3.784 4.451 . 0 0 "[ . 1 . 2 . ]" 1 214 1 41 GLU QB 1 43 PHE H 5.330 . 5.330 5.265 5.137 5.348 0.018 18 0 "[ . 1 . 2 . ]" 1 215 1 41 GLU QB 1 44 GLU H 4.990 . 4.990 4.875 4.651 5.036 0.046 26 0 "[ . 1 . 2 . ]" 1 216 1 41 GLU QG 1 42 ILE H 4.340 . 4.340 2.234 2.007 2.418 . 0 0 "[ . 1 . 2 . ]" 1 217 1 41 GLU QG 1 43 PHE H 5.260 . 5.260 4.526 4.346 4.689 . 0 0 "[ . 1 . 2 . ]" 1 218 1 41 GLU HG2 1 42 ILE H 4.540 . 4.540 2.877 2.638 3.245 . 0 0 "[ . 1 . 2 . ]" 1 219 1 41 GLU HG2 1 42 ILE HB 5.270 . 5.270 5.149 4.813 5.306 0.036 2 0 "[ . 1 . 2 . ]" 1 220 1 41 GLU HG3 1 42 ILE H 4.280 . 4.280 2.343 2.027 2.760 . 0 0 "[ . 1 . 2 . ]" 1 221 1 41 GLU HG3 1 42 ILE HA 4.300 . 4.300 3.491 3.296 3.713 . 0 0 "[ . 1 . 2 . ]" 1 222 1 41 GLU HG3 1 42 ILE MD 4.230 . 4.230 2.715 2.388 2.967 . 0 0 "[ . 1 . 2 . ]" 1 223 1 41 GLU HG3 1 42 ILE MG 4.720 . 4.720 4.763 4.623 4.828 0.108 16 0 "[ . 1 . 2 . ]" 1 224 1 42 ILE H 1 42 ILE HB 2.850 . 2.850 2.577 2.416 2.671 . 0 0 "[ . 1 . 2 . ]" 1 225 1 42 ILE H 1 42 ILE MD 3.850 . 3.850 3.205 2.963 3.385 . 0 0 "[ . 1 . 2 . ]" 1 226 1 42 ILE H 1 42 ILE HG12 3.550 . 3.550 2.216 2.085 2.353 . 0 0 "[ . 1 . 2 . ]" 1 227 1 42 ILE H 1 42 ILE QG 2.870 . 2.870 2.199 2.072 2.329 . 0 0 "[ . 1 . 2 . ]" 1 228 1 42 ILE H 1 42 ILE HG13 3.730 . 3.730 3.688 3.560 3.751 0.021 2 0 "[ . 1 . 2 . ]" 1 229 1 42 ILE H 1 42 ILE MG 3.920 . 3.920 3.786 3.736 3.812 . 0 0 "[ . 1 . 2 . ]" 1 230 1 42 ILE H 1 43 PHE H 2.850 . 2.850 2.628 2.398 2.777 . 0 0 "[ . 1 . 2 . ]" 1 231 1 42 ILE H 1 43 PHE HA 5.390 . 5.390 5.221 5.025 5.359 . 0 0 "[ . 1 . 2 . ]" 1 232 1 42 ILE H 1 43 PHE QB 4.680 . 4.680 4.201 3.968 4.408 . 0 0 "[ . 1 . 2 . ]" 1 233 1 42 ILE H 1 43 PHE HB3 4.710 . 4.710 4.426 4.155 4.662 . 0 0 "[ . 1 . 2 . ]" 1 234 1 42 ILE HA 1 42 ILE MD 4.040 . 4.040 2.142 2.028 2.216 . 0 0 "[ . 1 . 2 . ]" 1 235 1 42 ILE HA 1 42 ILE HG12 4.130 . 4.130 3.151 3.015 3.261 . 0 0 "[ . 1 . 2 . ]" 1 236 1 42 ILE HA 1 42 ILE HG13 4.130 . 4.130 3.793 3.698 3.827 . 0 0 "[ . 1 . 2 . ]" 1 237 1 42 ILE HA 1 42 ILE MG 3.260 . 3.260 2.417 2.340 2.513 . 0 0 "[ . 1 . 2 . ]" 1 238 1 42 ILE HA 1 44 GLU H 4.500 . 4.500 4.427 4.243 4.531 0.031 25 0 "[ . 1 . 2 . ]" 1 239 1 42 ILE HA 1 45 LYS H 3.750 . 3.750 3.626 3.417 3.761 0.011 4 0 "[ . 1 . 2 . ]" 1 240 1 42 ILE HA 1 45 LYS QB 4.360 . 4.360 4.229 3.916 4.437 0.077 20 0 "[ . 1 . 2 . ]" 1 241 1 42 ILE HA 1 45 LYS QD 4.440 . 4.440 3.377 2.073 3.854 . 0 0 "[ . 1 . 2 . ]" 1 242 1 42 ILE HA 1 45 LYS HG2 4.980 . 4.980 2.246 1.903 2.558 . 0 0 "[ . 1 . 2 . ]" 1 243 1 42 ILE HA 1 45 LYS HG3 4.980 . 4.980 3.285 2.701 3.768 . 0 0 "[ . 1 . 2 . ]" 1 244 1 42 ILE HB 1 42 ILE MD 3.330 . 3.330 3.254 3.241 3.265 . 0 0 "[ . 1 . 2 . ]" 1 245 1 42 ILE HB 1 43 PHE H 3.090 . 3.090 2.444 2.242 2.609 . 0 0 "[ . 1 . 2 . ]" 1 246 1 42 ILE HB 1 43 PHE HB2 5.240 . 5.240 4.444 4.054 4.864 . 0 0 "[ . 1 . 2 . ]" 1 247 1 42 ILE HB 1 45 LYS QE 5.500 . 5.500 4.686 4.267 5.619 0.119 12 0 "[ . 1 . 2 . ]" 1 248 1 42 ILE MD 1 43 PHE H 5.500 . 5.500 4.618 4.535 4.710 . 0 0 "[ . 1 . 2 . ]" 1 249 1 42 ILE MD 1 45 LYS H 5.260 . 5.260 5.148 4.790 5.281 0.021 20 0 "[ . 1 . 2 . ]" 1 250 1 42 ILE MD 1 45 LYS QE 4.460 . 4.460 2.046 1.868 2.680 . 0 0 "[ . 1 . 2 . ]" 1 251 1 42 ILE QG 1 43 PHE H 4.210 . 4.210 3.901 3.725 4.113 . 0 0 "[ . 1 . 2 . ]" 1 252 1 42 ILE HG12 1 43 PHE H 5.340 . 5.340 4.127 3.926 4.381 . 0 0 "[ . 1 . 2 . ]" 1 253 1 42 ILE HG13 1 43 PHE H 5.330 . 5.330 4.804 4.604 4.986 . 0 0 "[ . 1 . 2 . ]" 1 254 1 42 ILE MG 1 43 PHE H 3.970 . 3.970 3.343 3.148 3.523 . 0 0 "[ . 1 . 2 . ]" 1 255 1 42 ILE MG 1 43 PHE HA 4.450 . 4.450 3.480 3.226 3.705 . 0 0 "[ . 1 . 2 . ]" 1 256 1 42 ILE MG 1 45 LYS H 5.460 . 5.460 4.795 4.586 4.921 . 0 0 "[ . 1 . 2 . ]" 1 257 1 42 ILE MG 1 45 LYS QB 5.220 . 5.220 5.105 4.863 5.309 0.089 8 0 "[ . 1 . 2 . ]" 1 258 1 42 ILE MG 1 45 LYS QE 4.180 . 4.180 2.979 2.142 4.254 0.074 2 0 "[ . 1 . 2 . ]" 1 259 1 42 ILE MG 1 46 VAL H 4.570 . 4.570 3.934 3.725 4.200 . 0 0 "[ . 1 . 2 . ]" 1 260 1 42 ILE MG 1 46 VAL HB 4.860 . 4.860 3.581 2.329 4.876 0.016 14 0 "[ . 1 . 2 . ]" 1 261 1 43 PHE H 1 43 PHE HB2 3.400 . 3.400 2.734 2.523 3.118 . 0 0 "[ . 1 . 2 . ]" 1 262 1 43 PHE H 1 43 PHE QB 2.770 . 2.770 2.137 2.017 2.198 . 0 0 "[ . 1 . 2 . ]" 1 263 1 43 PHE H 1 43 PHE HB3 2.950 . 2.950 2.244 2.053 2.382 . 0 0 "[ . 1 . 2 . ]" 1 264 1 43 PHE H 1 43 PHE QD 4.040 . 4.040 4.026 3.783 4.103 0.063 25 0 "[ . 1 . 2 . ]" 1 265 1 43 PHE H 1 44 GLU H 3.300 . 3.300 2.837 2.801 2.884 . 0 0 "[ . 1 . 2 . ]" 1 266 1 43 PHE H 1 44 GLU QB 5.500 . 5.500 4.917 4.827 5.039 . 0 0 "[ . 1 . 2 . ]" 1 267 1 43 PHE H 1 44 GLU QG 5.340 . 5.340 4.444 4.263 4.623 . 0 0 "[ . 1 . 2 . ]" 1 268 1 43 PHE H 1 45 LYS QG 5.340 . 5.340 4.602 4.311 4.766 . 0 0 "[ . 1 . 2 . ]" 1 269 1 43 PHE H 1 46 VAL QG 4.950 . 4.950 3.793 3.513 4.432 . 0 0 "[ . 1 . 2 . ]" 1 270 1 43 PHE H 1 61 LEU QD 5.140 . 5.140 3.767 3.498 4.187 . 0 0 "[ . 1 . 2 . ]" 1 271 1 43 PHE HA 1 43 PHE QD 3.370 . 3.370 2.851 2.524 3.278 . 0 0 "[ . 1 . 2 . ]" 1 272 1 43 PHE HA 1 43 PHE QE 5.300 . 5.300 4.872 4.620 5.219 . 0 0 "[ . 1 . 2 . ]" 1 273 1 43 PHE HA 1 46 VAL HB 4.570 . 4.570 4.039 2.570 4.721 0.151 2 0 "[ . 1 . 2 . ]" 1 274 1 43 PHE HA 1 46 VAL MG1 4.710 . 4.710 3.014 1.833 3.976 . 0 0 "[ . 1 . 2 . ]" 1 275 1 43 PHE HA 1 46 VAL QG 3.980 . 3.980 2.046 1.823 3.355 . 0 0 "[ . 1 . 2 . ]" 1 276 1 43 PHE HA 1 46 VAL MG2 4.790 . 4.790 3.128 1.827 4.521 . 0 0 "[ . 1 . 2 . ]" 1 277 1 43 PHE QB 1 44 GLU H 3.520 . 3.520 2.716 2.466 3.081 . 0 0 "[ . 1 . 2 . ]" 1 278 1 43 PHE QB 1 45 LYS H 5.340 . 5.340 5.020 4.865 5.317 . 0 0 "[ . 1 . 2 . ]" 1 279 1 43 PHE HB2 1 44 GLU H 4.360 . 4.360 4.033 3.882 4.199 . 0 0 "[ . 1 . 2 . ]" 1 280 1 43 PHE HB2 1 61 LEU QD 4.480 . 4.480 2.232 1.859 2.691 . 0 0 "[ . 1 . 2 . ]" 1 281 1 43 PHE HB2 1 61 LEU MD2 4.500 . 4.500 3.241 1.866 4.126 . 0 0 "[ . 1 . 2 . ]" 1 282 1 43 PHE HB3 1 44 GLU H 3.590 . 3.590 2.763 2.494 3.170 . 0 0 "[ . 1 . 2 . ]" 1 283 1 43 PHE HB3 1 58 LEU HB3 5.360 . 5.360 5.265 4.684 5.487 0.127 14 0 "[ . 1 . 2 . ]" 1 284 1 43 PHE HB3 1 61 LEU QD 4.310 . 4.310 2.626 2.147 3.158 . 0 0 "[ . 1 . 2 . ]" 1 285 1 43 PHE HB3 1 61 LEU MD2 4.500 . 4.500 3.350 2.629 3.970 . 0 0 "[ . 1 . 2 . ]" 1 286 1 43 PHE QD 1 44 GLU H 3.720 . 3.720 3.135 2.736 3.429 . 0 0 "[ . 1 . 2 . ]" 1 287 1 43 PHE QD 1 44 GLU HA 4.260 . 4.260 3.669 2.844 3.973 . 0 0 "[ . 1 . 2 . ]" 1 288 1 43 PHE QD 1 44 GLU HG2 4.020 . 4.020 3.070 2.469 3.420 . 0 0 "[ . 1 . 2 . ]" 1 289 1 43 PHE QD 1 44 GLU QG 3.420 . 3.420 2.602 2.154 2.919 . 0 0 "[ . 1 . 2 . ]" 1 290 1 43 PHE QD 1 44 GLU HG3 4.020 . 4.020 2.881 2.265 4.028 0.008 20 0 "[ . 1 . 2 . ]" 1 291 1 43 PHE QD 1 46 VAL QG 4.330 . 4.330 3.526 3.027 4.441 0.111 7 0 "[ . 1 . 2 . ]" 1 292 1 43 PHE QD 1 46 VAL MG2 5.450 . 5.450 4.625 3.404 5.577 0.127 3 0 "[ . 1 . 2 . ]" 1 293 1 43 PHE QD 1 56 LEU MD1 5.500 . 5.500 4.528 3.255 5.532 0.032 22 0 "[ . 1 . 2 . ]" 1 294 1 43 PHE QD 1 56 LEU QD 5.440 . 5.440 3.852 3.228 4.369 . 0 0 "[ . 1 . 2 . ]" 1 295 1 43 PHE QD 1 56 LEU MD2 5.500 . 5.500 4.627 3.569 5.587 0.087 13 0 "[ . 1 . 2 . ]" 1 296 1 43 PHE QD 1 58 LEU HA 4.130 . 4.130 2.351 1.963 3.043 . 0 0 "[ . 1 . 2 . ]" 1 297 1 43 PHE QD 1 58 LEU HB3 4.600 . 4.600 2.689 2.013 4.609 0.009 14 0 "[ . 1 . 2 . ]" 1 298 1 43 PHE QD 1 58 LEU QD 4.540 . 4.540 3.876 2.539 4.260 . 0 0 "[ . 1 . 2 . ]" 1 299 1 43 PHE QD 1 58 LEU MD2 4.500 . 4.500 4.097 2.546 4.509 0.009 22 0 "[ . 1 . 2 . ]" 1 300 1 43 PHE QD 1 61 LEU MD1 3.910 . 3.910 3.339 2.968 3.955 0.045 22 0 "[ . 1 . 2 . ]" 1 301 1 43 PHE QD 1 61 LEU QD 3.390 . 3.390 2.834 2.482 3.149 . 0 0 "[ . 1 . 2 . ]" 1 302 1 43 PHE QD 1 61 LEU MD2 3.910 . 3.910 3.115 2.508 3.564 . 0 0 "[ . 1 . 2 . ]" 1 303 1 43 PHE QD 1 61 LEU HG 5.450 . 5.450 4.713 3.406 5.374 . 0 0 "[ . 1 . 2 . ]" 1 304 1 43 PHE QE 1 44 GLU H 5.500 . 5.500 5.024 4.564 5.385 . 0 0 "[ . 1 . 2 . ]" 1 305 1 43 PHE QE 1 44 GLU HG2 4.810 . 4.810 3.632 2.781 4.384 . 0 0 "[ . 1 . 2 . ]" 1 306 1 43 PHE QE 1 44 GLU QG 4.280 . 4.280 3.467 2.676 4.139 . 0 0 "[ . 1 . 2 . ]" 1 307 1 43 PHE QE 1 44 GLU HG3 5.070 . 5.070 4.406 3.484 5.086 0.016 20 0 "[ . 1 . 2 . ]" 1 308 1 43 PHE QE 1 47 ASN HB2 5.500 . 5.500 4.294 2.846 5.505 0.005 9 0 "[ . 1 . 2 . ]" 1 309 1 43 PHE QE 1 47 ASN HB3 5.500 . 5.500 4.366 2.800 5.551 0.051 25 0 "[ . 1 . 2 . ]" 1 310 1 43 PHE QE 1 51 LEU QD 5.410 . 5.410 4.415 3.679 5.113 . 0 0 "[ . 1 . 2 . ]" 1 311 1 43 PHE QE 1 56 LEU MD1 4.580 . 4.580 3.269 1.879 4.240 . 0 0 "[ . 1 . 2 . ]" 1 312 1 43 PHE QE 1 56 LEU QD 3.670 . 3.670 2.440 1.876 3.084 . 0 0 "[ . 1 . 2 . ]" 1 313 1 43 PHE QE 1 56 LEU MD2 . . 4.500 3.066 1.917 4.113 . 0 0 "[ . 1 . 2 . ]" 1 314 1 43 PHE QE 1 58 LEU HA 5.170 . 5.170 3.975 3.489 4.520 . 0 0 "[ . 1 . 2 . ]" 1 315 1 43 PHE QE 1 58 LEU QD 3.730 . 3.730 2.993 2.450 3.324 . 0 0 "[ . 1 . 2 . ]" 1 316 1 43 PHE QE 1 58 LEU MD2 4.500 . 4.500 3.082 2.458 4.575 0.075 22 0 "[ . 1 . 2 . ]" 1 317 1 43 PHE QE 1 58 LEU HG 4.820 . 4.820 3.946 3.322 4.507 . 0 0 "[ . 1 . 2 . ]" 1 318 1 43 PHE QE 1 61 LEU MD1 . . 4.500 4.407 4.079 4.549 0.049 5 0 "[ . 1 . 2 . ]" 1 319 1 43 PHE QE 1 61 LEU QD 4.080 . 4.080 3.554 3.123 3.976 . 0 0 "[ . 1 . 2 . ]" 1 320 1 43 PHE QE 1 61 LEU MD2 . . 4.500 3.772 3.218 4.415 . 0 0 "[ . 1 . 2 . ]" 1 321 1 43 PHE QE 1 69 HIS HD2 4.810 . 4.810 4.336 3.826 4.828 0.018 21 0 "[ . 1 . 2 . ]" 1 322 1 43 PHE QE 1 73 VAL QG 5.440 . 5.440 4.304 3.955 4.707 . 0 0 "[ . 1 . 2 . ]" 1 323 1 43 PHE HZ 1 58 LEU QD 5.100 . 5.100 3.893 3.016 4.891 . 0 0 "[ . 1 . 2 . ]" 1 324 1 44 GLU H 1 44 GLU QB 3.410 . 3.410 2.484 2.399 2.547 . 0 0 "[ . 1 . 2 . ]" 1 325 1 44 GLU H 1 44 GLU HG2 3.900 . 3.900 3.278 2.283 3.474 . 0 0 "[ . 1 . 2 . ]" 1 326 1 44 GLU H 1 44 GLU QG 3.420 . 3.420 2.240 2.093 2.407 . 0 0 "[ . 1 . 2 . ]" 1 327 1 44 GLU H 1 44 GLU HG3 3.900 . 3.900 2.324 2.117 3.579 . 0 0 "[ . 1 . 2 . ]" 1 328 1 44 GLU H 1 45 LYS H 3.240 . 3.240 2.789 2.642 2.910 . 0 0 "[ . 1 . 2 . ]" 1 329 1 44 GLU HA 1 44 GLU HG2 4.240 . 4.240 2.482 2.336 2.856 . 0 0 "[ . 1 . 2 . ]" 1 330 1 44 GLU HA 1 44 GLU QG 3.690 . 3.690 2.397 2.270 2.769 . 0 0 "[ . 1 . 2 . ]" 1 331 1 44 GLU HA 1 44 GLU HG3 4.240 . 4.240 3.172 2.983 3.723 . 0 0 "[ . 1 . 2 . ]" 1 332 1 44 GLU HA 1 47 ASN QB 5.340 . 5.340 3.802 3.059 4.558 . 0 0 "[ . 1 . 2 . ]" 1 333 1 44 GLU QB 1 45 LYS H 3.240 . 3.240 2.550 2.257 2.829 . 0 0 "[ . 1 . 2 . ]" 1 334 1 44 GLU QG 1 45 LYS H 4.400 . 4.400 4.079 3.892 4.214 . 0 0 "[ . 1 . 2 . ]" 1 335 1 44 GLU HG2 1 45 LYS H 5.240 . 5.240 4.937 4.478 5.061 . 0 0 "[ . 1 . 2 . ]" 1 336 1 44 GLU HG3 1 45 LYS H 5.240 . 5.240 4.360 4.106 5.014 . 0 0 "[ . 1 . 2 . ]" 1 337 1 45 LYS H 1 45 LYS QB 2.720 . 2.720 2.642 2.477 2.746 0.026 12 0 "[ . 1 . 2 . ]" 1 338 1 45 LYS H 1 45 LYS QD 4.750 . 4.750 3.951 3.659 4.265 . 0 0 "[ . 1 . 2 . ]" 1 339 1 45 LYS H 1 45 LYS HG2 3.890 . 3.890 2.221 1.872 2.463 . 0 0 "[ . 1 . 2 . ]" 1 340 1 45 LYS H 1 45 LYS QG 3.370 . 3.370 2.191 1.857 2.427 . 0 0 "[ . 1 . 2 . ]" 1 341 1 45 LYS H 1 45 LYS HG3 3.890 . 3.890 3.358 2.893 3.657 . 0 0 "[ . 1 . 2 . ]" 1 342 1 45 LYS H 1 46 VAL H 3.220 . 3.220 2.553 2.398 2.692 . 0 0 "[ . 1 . 2 . ]" 1 343 1 45 LYS H 1 46 VAL MG1 5.500 . 5.500 4.407 3.851 5.588 0.088 21 0 "[ . 1 . 2 . ]" 1 344 1 45 LYS H 1 46 VAL QG 4.390 . 4.390 3.894 3.609 4.297 . 0 0 "[ . 1 . 2 . ]" 1 345 1 45 LYS H 1 46 VAL MG2 5.500 . 5.500 4.712 3.875 5.668 0.168 6 0 "[ . 1 . 2 . ]" 1 346 1 45 LYS HA 1 45 LYS HG2 4.040 . 4.040 3.775 3.636 3.850 . 0 0 "[ . 1 . 2 . ]" 1 347 1 45 LYS HA 1 45 LYS HG3 4.040 . 4.040 3.801 3.719 3.884 . 0 0 "[ . 1 . 2 . ]" 1 348 1 45 LYS QB 1 45 LYS QE 4.500 . 4.500 3.346 1.987 3.657 . 0 0 "[ . 1 . 2 . ]" 1 349 1 45 LYS QB 1 46 VAL H 3.750 . 3.750 3.594 3.337 3.691 . 0 0 "[ . 1 . 2 . ]" 1 350 1 45 LYS QB 1 46 VAL MG1 5.500 . 5.500 4.790 4.016 5.655 0.155 7 0 "[ . 1 . 2 . ]" 1 351 1 45 LYS QB 1 46 VAL QG 5.080 . 5.080 4.278 3.853 4.779 . 0 0 "[ . 1 . 2 . ]" 1 352 1 45 LYS QB 1 46 VAL MG2 5.500 . 5.500 5.021 3.960 5.402 . 0 0 "[ . 1 . 2 . ]" 1 353 1 45 LYS QE 1 46 VAL H 5.500 . 5.500 4.599 4.171 4.910 . 0 0 "[ . 1 . 2 . ]" 1 354 1 45 LYS QE 1 46 VAL QG 4.710 . 4.710 3.965 2.726 4.777 0.067 20 0 "[ . 1 . 2 . ]" 1 355 1 45 LYS QG 1 46 VAL H 4.880 . 4.880 2.529 2.236 2.789 . 0 0 "[ . 1 . 2 . ]" 1 356 1 45 LYS HG2 1 46 VAL H 3.870 . 3.870 2.941 2.638 3.413 . 0 0 "[ . 1 . 2 . ]" 1 357 1 45 LYS HG3 1 46 VAL H 3.730 . 3.730 2.784 2.364 3.037 . 0 0 "[ . 1 . 2 . ]" 1 358 1 46 VAL H 1 46 VAL HB 3.760 . 3.760 2.986 2.255 3.767 0.007 5 0 "[ . 1 . 2 . ]" 1 359 1 46 VAL H 1 46 VAL MG1 3.990 . 3.990 2.575 2.173 3.662 . 0 0 "[ . 1 . 2 . ]" 1 360 1 46 VAL H 1 46 VAL QG 3.220 . 3.220 2.207 1.938 2.572 . 0 0 "[ . 1 . 2 . ]" 1 361 1 46 VAL H 1 46 VAL MG2 3.990 . 3.990 2.812 2.037 3.748 . 0 0 "[ . 1 . 2 . ]" 1 362 1 46 VAL H 1 48 ALA H 4.440 . 4.440 4.005 3.839 4.243 . 0 0 "[ . 1 . 2 . ]" 1 363 1 46 VAL HA 1 46 VAL MG1 3.540 . 3.540 2.736 2.320 3.250 . 0 0 "[ . 1 . 2 . ]" 1 364 1 46 VAL HA 1 46 VAL QG 3.080 . 3.080 2.230 2.098 2.300 . 0 0 "[ . 1 . 2 . ]" 1 365 1 46 VAL HA 1 46 VAL MG2 3.540 . 3.540 2.706 2.211 3.252 . 0 0 "[ . 1 . 2 . ]" 1 366 1 46 VAL HA 1 48 ALA H 4.210 . 4.210 4.021 3.822 4.235 0.025 12 0 "[ . 1 . 2 . ]" 1 367 1 46 VAL QG 1 47 ASN HA 4.160 . 4.160 3.202 2.882 3.466 . 0 0 "[ . 1 . 2 . ]" 1 368 1 46 VAL QG 1 48 ALA H 5.440 . 5.440 4.114 3.958 4.337 . 0 0 "[ . 1 . 2 . ]" 1 369 1 46 VAL QG 1 59 HIS HE1 4.710 . 4.710 3.713 2.958 4.356 . 0 0 "[ . 1 . 2 . ]" 1 370 1 46 VAL MG2 1 59 HIS HE1 . . 4.500 4.138 3.154 4.624 0.124 5 0 "[ . 1 . 2 . ]" 1 371 1 47 ASN HA 1 49 SER H 4.950 . 4.950 3.878 3.377 4.310 . 0 0 "[ . 1 . 2 . ]" 1 372 1 47 ASN HA 1 50 LEU H 4.660 . 4.660 2.861 2.395 3.244 . 0 0 "[ . 1 . 2 . ]" 1 373 1 47 ASN HA 1 50 LEU HB3 4.060 . 4.060 3.550 2.313 4.064 0.004 24 0 "[ . 1 . 2 . ]" 1 374 1 47 ASN HA 1 50 LEU MD1 5.050 . 5.050 3.740 2.755 5.118 0.068 21 0 "[ . 1 . 2 . ]" 1 375 1 47 ASN HA 1 50 LEU QD 3.740 . 3.740 3.282 2.723 3.810 0.070 21 0 "[ . 1 . 2 . ]" 1 376 1 47 ASN HA 1 50 LEU MD2 5.050 . 5.050 4.191 2.913 5.071 0.021 11 0 "[ . 1 . 2 . ]" 1 377 1 47 ASN HA 1 50 LEU HG 4.720 . 4.720 4.100 2.863 4.840 0.120 13 0 "[ . 1 . 2 . ]" 1 378 1 47 ASN HA 1 51 LEU H 4.320 . 4.320 2.897 2.432 3.414 . 0 0 "[ . 1 . 2 . ]" 1 379 1 47 ASN HA 1 51 LEU QD 4.920 . 4.920 3.762 2.243 4.328 . 0 0 "[ . 1 . 2 . ]" 1 380 1 47 ASN HA 1 51 LEU MD2 5.500 . 5.500 4.065 2.246 5.552 0.052 6 0 "[ . 1 . 2 . ]" 1 381 1 47 ASN QB 1 48 ALA H 3.980 . 3.980 3.302 2.835 3.788 . 0 0 "[ . 1 . 2 . ]" 1 382 1 47 ASN QB 1 50 LEU QD 5.280 . 5.280 4.540 3.904 5.178 . 0 0 "[ . 1 . 2 . ]" 1 383 1 47 ASN QB 1 51 LEU H 4.330 . 4.330 3.595 3.153 4.478 0.148 17 0 "[ . 1 . 2 . ]" 1 384 1 47 ASN QB 1 51 LEU QD 3.670 . 3.670 2.537 2.149 3.719 0.049 17 0 "[ . 1 . 2 . ]" 1 385 1 47 ASN QB 1 51 LEU HG 4.560 . 4.560 2.761 1.992 4.135 . 0 0 "[ . 1 . 2 . ]" 1 386 1 47 ASN HB2 1 51 LEU MD2 4.500 . 4.500 3.836 2.556 4.573 0.073 17 0 "[ . 1 . 2 . ]" 1 387 1 47 ASN HB2 1 51 LEU HG 4.500 . 4.500 3.712 2.004 4.562 0.062 2 0 "[ . 1 . 2 . ]" 1 388 1 47 ASN HB3 1 51 LEU MD1 4.500 . 4.500 3.933 2.212 4.548 0.048 17 0 "[ . 1 . 2 . ]" 1 389 1 48 ALA H 1 48 ALA MB 3.080 . 3.080 2.236 2.202 2.279 . 0 0 "[ . 1 . 2 . ]" 1 390 1 48 ALA H 1 50 LEU QD 5.040 . 5.040 4.873 4.328 5.122 0.082 3 0 "[ . 1 . 2 . ]" 1 391 1 48 ALA MB 1 49 SER H 3.580 . 3.580 2.667 2.347 2.936 . 0 0 "[ . 1 . 2 . ]" 1 392 1 48 ALA MB 1 49 SER QB 4.450 . 4.450 3.948 3.394 4.311 . 0 0 "[ . 1 . 2 . ]" 1 393 1 49 SER H 1 50 LEU H 4.220 . 4.220 2.164 2.025 2.388 . 0 0 "[ . 1 . 2 . ]" 1 394 1 49 SER H 1 50 LEU QD 5.440 . 5.440 3.813 3.116 4.336 . 0 0 "[ . 1 . 2 . ]" 1 395 1 49 SER HA 1 51 LEU H 4.960 . 4.960 4.582 4.346 4.868 . 0 0 "[ . 1 . 2 . ]" 1 396 1 49 SER HA 1 52 PRO HD2 4.620 . 4.620 3.514 3.181 3.796 . 0 0 "[ . 1 . 2 . ]" 1 397 1 49 SER HA 1 52 PRO QD 4.160 . 4.160 3.376 3.044 3.634 . 0 0 "[ . 1 . 2 . ]" 1 398 1 49 SER HA 1 52 PRO HD3 4.620 . 4.620 4.367 3.882 4.644 0.024 12 0 "[ . 1 . 2 . ]" 1 399 1 49 SER HA 1 52 PRO HG2 4.220 . 4.220 3.561 3.182 4.217 . 0 0 "[ . 1 . 2 . ]" 1 400 1 49 SER HA 1 52 PRO HG3 4.280 . 4.280 3.420 2.953 3.947 . 0 0 "[ . 1 . 2 . ]" 1 401 1 49 SER QB 1 50 LEU H 4.430 . 4.430 3.341 2.736 3.877 . 0 0 "[ . 1 . 2 . ]" 1 402 1 49 SER QB 1 50 LEU HA 5.070 . 5.070 4.124 3.861 4.475 . 0 0 "[ . 1 . 2 . ]" 1 403 1 49 SER QB 1 50 LEU QD 4.800 . 4.800 3.030 2.173 3.807 . 0 0 "[ . 1 . 2 . ]" 1 404 1 49 SER QB 1 53 GLN QE 5.310 . 5.310 4.314 3.026 5.386 0.076 15 0 "[ . 1 . 2 . ]" 1 405 1 50 LEU H 1 50 LEU QB 3.920 . 3.920 2.403 2.116 2.674 . 0 0 "[ . 1 . 2 . ]" 1 406 1 50 LEU H 1 50 LEU MD1 4.580 . 4.580 3.701 2.620 4.209 . 0 0 "[ . 1 . 2 . ]" 1 407 1 50 LEU H 1 50 LEU QD 3.970 . 3.970 3.077 2.312 3.682 . 0 0 "[ . 1 . 2 . ]" 1 408 1 50 LEU H 1 50 LEU MD2 4.580 . 4.580 3.560 2.330 4.381 . 0 0 "[ . 1 . 2 . ]" 1 409 1 50 LEU H 1 50 LEU HG 4.850 . 4.850 3.475 2.418 4.741 . 0 0 "[ . 1 . 2 . ]" 1 410 1 50 LEU H 1 51 LEU H 3.770 . 3.770 2.278 1.938 2.638 . 0 0 "[ . 1 . 2 . ]" 1 411 1 50 LEU H 1 52 PRO QD 4.080 . 4.080 3.098 2.673 3.565 . 0 0 "[ . 1 . 2 . ]" 1 412 1 50 LEU HA 1 50 LEU QD 2.920 . 2.920 2.094 1.943 2.334 . 0 0 "[ . 1 . 2 . ]" 1 413 1 50 LEU HA 1 50 LEU HG 3.760 . 3.760 3.093 2.485 3.771 0.011 26 0 "[ . 1 . 2 . ]" 1 414 1 50 LEU HA 1 53 GLN HE21 4.320 . 4.320 2.547 1.707 4.299 . 0 0 "[ . 1 . 2 . ]" 1 415 1 50 LEU HA 1 53 GLN HE22 4.320 . 4.320 3.487 2.919 4.157 . 0 0 "[ . 1 . 2 . ]" 1 416 1 50 LEU HA 1 53 GLN HG3 4.070 . 4.070 3.108 2.389 4.101 0.031 22 0 "[ . 1 . 2 . ]" 1 417 1 50 LEU HA 1 55 VAL H 5.380 . 5.380 4.774 4.122 5.250 . 0 0 "[ . 1 . 2 . ]" 1 418 1 50 LEU HA 1 55 VAL HB 5.500 . 5.500 3.924 3.320 5.527 0.027 12 0 "[ . 1 . 2 . ]" 1 419 1 50 LEU HA 1 55 VAL MG1 4.010 . 4.010 3.557 2.511 4.033 0.023 7 0 "[ . 1 . 2 . ]" 1 420 1 50 LEU QB 1 51 LEU H 3.720 . 3.720 2.865 2.661 3.100 . 0 0 "[ . 1 . 2 . ]" 1 421 1 50 LEU QB 1 55 VAL H 4.800 . 4.800 3.996 3.275 4.817 0.017 7 0 "[ . 1 . 2 . ]" 1 422 1 50 LEU HB3 1 50 LEU MD1 3.380 . 3.380 2.574 2.203 3.241 . 0 0 "[ . 1 . 2 . ]" 1 423 1 50 LEU HB3 1 50 LEU QD 2.920 . 2.920 2.185 2.084 2.331 . 0 0 "[ . 1 . 2 . ]" 1 424 1 50 LEU HB3 1 50 LEU MD2 3.380 . 3.380 2.523 2.308 3.231 . 0 0 "[ . 1 . 2 . ]" 1 425 1 50 LEU HB3 1 51 LEU H 4.200 . 4.200 3.676 2.952 4.129 . 0 0 "[ . 1 . 2 . ]" 1 426 1 50 LEU HB3 1 55 VAL H 5.180 . 5.180 4.150 3.374 4.974 . 0 0 "[ . 1 . 2 . ]" 1 427 1 50 LEU HB3 1 55 VAL HB 4.710 . 4.710 3.046 2.151 4.403 . 0 0 "[ . 1 . 2 . ]" 1 428 1 50 LEU HB3 1 55 VAL MG1 2.890 . 2.890 1.890 1.727 2.364 . 0 0 "[ . 1 . 2 . ]" 1 429 1 50 LEU QD 1 51 LEU H 4.310 . 4.310 4.176 3.985 4.307 . 0 0 "[ . 1 . 2 . ]" 1 430 1 50 LEU QD 1 53 GLN QE 3.560 . 3.560 2.188 1.707 3.338 . 0 0 "[ . 1 . 2 . ]" 1 431 1 50 LEU QD 1 53 GLN HG2 4.980 . 4.980 4.651 3.255 5.018 0.038 13 0 "[ . 1 . 2 . ]" 1 432 1 50 LEU QD 1 53 GLN HG3 4.440 . 4.440 3.972 3.529 4.297 . 0 0 "[ . 1 . 2 . ]" 1 433 1 50 LEU QD 1 55 VAL H 5.180 . 5.180 4.918 4.291 5.222 0.042 13 0 "[ . 1 . 2 . ]" 1 434 1 50 LEU QD 1 55 VAL HB 4.390 . 4.390 3.568 2.635 4.121 . 0 0 "[ . 1 . 2 . ]" 1 435 1 50 LEU QD 1 57 ASP HA 5.440 . 5.440 4.814 4.157 5.555 0.115 12 0 "[ . 1 . 2 . ]" 1 436 1 50 LEU QD 1 57 ASP QB 4.740 . 4.740 2.541 1.930 3.416 . 0 0 "[ . 1 . 2 . ]" 1 437 1 50 LEU MD1 1 51 LEU H 5.000 . 5.000 4.715 4.364 5.034 0.034 15 0 "[ . 1 . 2 . ]" 1 438 1 50 LEU MD1 1 53 GLN HE21 4.500 . 4.500 3.890 2.252 4.618 0.118 17 0 "[ . 1 . 2 . ]" 1 439 1 50 LEU MD2 1 51 LEU H 5.000 . 5.000 4.697 4.263 5.007 0.007 16 0 "[ . 1 . 2 . ]" 1 440 1 51 LEU H 1 51 LEU HB2 3.710 . 3.710 2.379 2.152 2.568 . 0 0 "[ . 1 . 2 . ]" 1 441 1 51 LEU H 1 51 LEU QB 3.360 . 3.360 2.302 2.072 2.518 . 0 0 "[ . 1 . 2 . ]" 1 442 1 51 LEU H 1 51 LEU HB3 3.710 . 3.710 3.205 2.579 3.673 . 0 0 "[ . 1 . 2 . ]" 1 443 1 51 LEU H 1 51 LEU MD1 4.390 . 4.390 4.003 3.521 4.347 . 0 0 "[ . 1 . 2 . ]" 1 444 1 51 LEU H 1 51 LEU QD 3.830 . 3.830 3.254 2.329 3.717 . 0 0 "[ . 1 . 2 . ]" 1 445 1 51 LEU H 1 51 LEU MD2 4.390 . 4.390 3.492 2.342 4.226 . 0 0 "[ . 1 . 2 . ]" 1 446 1 51 LEU H 1 51 LEU HG 4.710 . 4.710 3.385 2.408 4.519 . 0 0 "[ . 1 . 2 . ]" 1 447 1 51 LEU H 1 52 PRO HD2 4.000 . 4.000 2.223 2.106 2.426 . 0 0 "[ . 1 . 2 . ]" 1 448 1 51 LEU H 1 52 PRO QD 3.510 . 3.510 2.198 2.086 2.396 . 0 0 "[ . 1 . 2 . ]" 1 449 1 51 LEU H 1 52 PRO HD3 4.000 . 4.000 3.453 3.212 3.766 . 0 0 "[ . 1 . 2 . ]" 1 450 1 51 LEU H 1 52 PRO HG2 4.480 . 4.480 4.348 4.055 4.483 0.003 17 0 "[ . 1 . 2 . ]" 1 451 1 51 LEU HA 1 51 LEU MD1 3.390 . 3.390 3.343 2.358 3.644 0.254 23 0 "[ . 1 . 2 . ]" 1 452 1 51 LEU HA 1 51 LEU QD 3.070 . 3.070 2.058 1.846 3.004 . 0 0 "[ . 1 . 2 . ]" 1 453 1 51 LEU HA 1 51 LEU MD2 3.390 . 3.390 2.102 1.851 3.269 . 0 0 "[ . 1 . 2 . ]" 1 454 1 51 LEU HA 1 51 LEU HG 3.720 . 3.720 3.252 2.455 3.761 0.041 7 0 "[ . 1 . 2 . ]" 1 455 1 51 LEU HA 1 54 ASN H 4.660 . 4.660 3.585 3.071 4.059 . 0 0 "[ . 1 . 2 . ]" 1 456 1 51 LEU HA 1 55 VAL H 3.980 . 3.980 2.718 2.357 3.128 . 0 0 "[ . 1 . 2 . ]" 1 457 1 51 LEU QB 1 51 LEU QD 2.780 . 2.780 1.951 1.835 2.088 . 0 0 "[ . 1 . 2 . ]" 1 458 1 51 LEU QB 1 52 PRO QD 3.260 . 3.260 2.343 2.140 2.623 . 0 0 "[ . 1 . 2 . ]" 1 459 1 51 LEU HB2 1 52 PRO HD2 4.620 . 4.620 3.230 2.560 3.949 . 0 0 "[ . 1 . 2 . ]" 1 460 1 51 LEU HB2 1 52 PRO HD3 4.620 . 4.620 3.211 2.395 4.051 . 0 0 "[ . 1 . 2 . ]" 1 461 1 51 LEU HB3 1 52 PRO HD3 4.620 . 4.620 3.151 2.256 4.033 . 0 0 "[ . 1 . 2 . ]" 1 462 1 51 LEU QD 1 55 VAL H 4.850 . 4.850 3.523 3.033 4.352 . 0 0 "[ . 1 . 2 . ]" 1 463 1 51 LEU QD 1 77 LYS QE 4.050 . 4.050 2.497 1.896 3.608 . 0 0 "[ . 1 . 2 . ]" 1 464 1 51 LEU MD1 1 55 VAL H 5.500 . 5.500 5.214 4.150 5.637 0.137 8 0 "[ . 1 . 2 . ]" 1 465 1 51 LEU MD2 1 55 VAL H . . 4.500 3.618 3.048 4.559 0.059 21 0 "[ . 1 . 2 . ]" 1 466 1 51 LEU MD2 1 77 LYS HE2 4.500 . 4.500 3.501 2.311 4.613 0.113 17 0 "[ . 1 . 2 . ]" 1 467 1 51 LEU MD2 1 77 LYS HE3 4.500 . 4.500 3.409 2.228 4.507 0.007 23 0 "[ . 1 . 2 . ]" 1 468 1 52 PRO HA 1 54 ASN H 4.730 . 4.730 3.563 3.376 3.809 . 0 0 "[ . 1 . 2 . ]" 1 469 1 52 PRO HB2 1 53 GLN HA 4.700 . 4.700 4.241 3.953 4.438 . 0 0 "[ . 1 . 2 . ]" 1 470 1 52 PRO HG2 1 53 GLN H 3.800 . 3.800 3.100 2.385 3.467 . 0 0 "[ . 1 . 2 . ]" 1 471 1 53 GLN H 1 53 GLN HG2 4.950 . 4.950 3.448 2.297 4.033 . 0 0 "[ . 1 . 2 . ]" 1 472 1 53 GLN H 1 53 GLN QG 4.080 . 4.080 2.444 2.042 2.859 . 0 0 "[ . 1 . 2 . ]" 1 473 1 53 GLN H 1 53 GLN HG3 4.950 . 4.950 2.629 2.063 3.436 . 0 0 "[ . 1 . 2 . ]" 1 474 1 53 GLN H 1 54 ASN H 4.540 . 4.540 2.245 2.070 2.390 . 0 0 "[ . 1 . 2 . ]" 1 475 1 53 GLN H 1 55 VAL H 4.390 . 4.390 3.376 3.000 4.288 . 0 0 "[ . 1 . 2 . ]" 1 476 1 53 GLN H 1 55 VAL MG1 4.850 . 4.850 4.788 3.778 5.081 0.231 1 0 "[ . 1 . 2 . ]" 1 477 1 53 GLN HA 1 53 GLN HG2 3.830 . 3.830 2.798 2.498 3.838 0.008 22 0 "[ . 1 . 2 . ]" 1 478 1 53 GLN HA 1 53 GLN QG 3.360 . 3.360 2.631 2.405 3.368 0.008 8 0 "[ . 1 . 2 . ]" 1 479 1 53 GLN HA 1 53 GLN HG3 3.830 . 3.830 3.264 2.979 3.764 . 0 0 "[ . 1 . 2 . ]" 1 480 1 53 GLN QB 1 55 VAL H 5.140 . 5.140 3.565 3.007 4.750 . 0 0 "[ . 1 . 2 . ]" 1 481 1 53 GLN HB2 1 53 GLN HE21 4.740 . 4.740 3.133 1.773 4.436 . 0 0 "[ . 1 . 2 . ]" 1 482 1 53 GLN HB2 1 53 GLN HE22 4.740 . 4.740 4.008 3.402 4.647 . 0 0 "[ . 1 . 2 . ]" 1 483 1 53 GLN HB2 1 54 ASN H 4.870 . 4.870 3.654 3.040 4.510 . 0 0 "[ . 1 . 2 . ]" 1 484 1 53 GLN HB2 1 55 VAL H 5.500 . 5.500 3.715 3.065 5.330 . 0 0 "[ . 1 . 2 . ]" 1 485 1 53 GLN HB2 1 55 VAL MG1 5.500 . 5.500 3.967 2.393 5.552 0.052 22 0 "[ . 1 . 2 . ]" 1 486 1 53 GLN HB2 1 55 VAL MG2 5.500 . 5.500 3.672 2.710 5.528 0.028 9 0 "[ . 1 . 2 . ]" 1 487 1 53 GLN HB3 1 53 GLN HE21 4.590 . 4.590 3.528 2.013 4.423 . 0 0 "[ . 1 . 2 . ]" 1 488 1 53 GLN HB3 1 53 GLN HE22 4.590 . 4.590 4.175 3.630 4.643 0.053 14 0 "[ . 1 . 2 . ]" 1 489 1 53 GLN HB3 1 54 ASN H 4.950 . 4.950 4.287 4.052 4.432 . 0 0 "[ . 1 . 2 . ]" 1 490 1 53 GLN HB3 1 55 VAL H 5.280 . 5.280 4.802 4.298 5.339 0.059 15 0 "[ . 1 . 2 . ]" 1 491 1 53 GLN HB3 1 55 VAL MG1 5.500 . 5.500 4.898 3.474 5.563 0.063 22 0 "[ . 1 . 2 . ]" 1 492 1 53 GLN HE22 1 53 GLN QG 3.570 . 3.570 3.312 3.199 3.496 . 0 0 "[ . 1 . 2 . ]" 1 493 1 53 GLN HG3 1 55 VAL H 5.500 . 5.500 4.965 3.127 5.517 0.017 17 0 "[ . 1 . 2 . ]" 1 494 1 54 ASN H 1 54 ASN HB2 4.100 . 4.100 3.406 3.040 3.606 . 0 0 "[ . 1 . 2 . ]" 1 495 1 54 ASN H 1 55 VAL H 3.770 . 3.770 2.608 2.359 2.974 . 0 0 "[ . 1 . 2 . ]" 1 496 1 54 ASN HA 1 77 LYS QE 5.310 . 5.310 2.991 2.096 5.292 . 0 0 "[ . 1 . 2 . ]" 1 497 1 54 ASN HA 1 90 LEU MD1 5.280 . 5.280 3.551 2.305 4.992 . 0 0 "[ . 1 . 2 . ]" 1 498 1 54 ASN HA 1 90 LEU QD 3.910 . 3.910 2.732 2.126 3.795 . 0 0 "[ . 1 . 2 . ]" 1 499 1 54 ASN HA 1 90 LEU MD2 5.280 . 5.280 3.973 2.129 5.238 . 0 0 "[ . 1 . 2 . ]" 1 500 1 54 ASN HB2 1 55 VAL H 4.930 . 4.930 4.404 4.208 4.549 . 0 0 "[ . 1 . 2 . ]" 1 501 1 54 ASN HB2 1 87 LYS HB2 5.170 . 5.170 2.652 2.145 3.649 . 0 0 "[ . 1 . 2 . ]" 1 502 1 54 ASN HB2 1 87 LYS HB3 4.850 . 4.850 3.553 2.890 4.485 . 0 0 "[ . 1 . 2 . ]" 1 503 1 54 ASN HB2 1 87 LYS QD 5.250 . 5.250 3.396 2.103 4.727 . 0 0 "[ . 1 . 2 . ]" 1 504 1 54 ASN HB2 1 90 LEU QD 5.140 . 5.140 3.994 3.486 4.882 . 0 0 "[ . 1 . 2 . ]" 1 505 1 54 ASN HB3 1 55 VAL H 4.660 . 4.660 4.315 4.192 4.423 . 0 0 "[ . 1 . 2 . ]" 1 506 1 54 ASN HB3 1 87 LYS QD 5.340 . 5.340 4.524 2.393 5.443 0.103 23 0 "[ . 1 . 2 . ]" 1 507 1 54 ASN HB3 1 87 LYS QG 4.450 . 4.450 4.081 2.146 4.519 0.069 3 0 "[ . 1 . 2 . ]" 1 508 1 54 ASN HB3 1 90 LEU HA 4.270 . 4.270 2.448 2.098 3.821 . 0 0 "[ . 1 . 2 . ]" 1 509 1 54 ASN HB3 1 90 LEU QD 4.420 . 4.420 2.786 1.978 4.083 . 0 0 "[ . 1 . 2 . ]" 1 510 1 54 ASN QD 1 73 VAL QG 5.270 . 5.270 5.139 3.998 5.389 0.119 22 0 "[ . 1 . 2 . ]" 1 511 1 54 ASN QD 1 77 LYS QD 4.740 . 4.740 2.639 1.759 3.909 . 0 0 "[ . 1 . 2 . ]" 1 512 1 54 ASN QD 1 77 LYS QE 5.180 . 5.180 3.759 2.431 4.605 . 0 0 "[ . 1 . 2 . ]" 1 513 1 54 ASN QD 1 87 LYS HB2 4.160 . 4.160 2.424 2.030 3.259 . 0 0 "[ . 1 . 2 . ]" 1 514 1 54 ASN QD 1 87 LYS QB 4.270 . 4.270 2.374 2.009 3.153 . 0 0 "[ . 1 . 2 . ]" 1 515 1 54 ASN QD 1 87 LYS QG 5.180 . 5.180 4.047 3.153 4.953 . 0 0 "[ . 1 . 2 . ]" 1 516 1 54 ASN QD 1 89 TYR H 4.300 . 4.300 3.174 2.848 3.604 . 0 0 "[ . 1 . 2 . ]" 1 517 1 54 ASN QD 1 90 LEU HA 4.180 . 4.180 3.303 2.469 3.908 . 0 0 "[ . 1 . 2 . ]" 1 518 1 54 ASN QD 1 90 LEU QD 4.140 . 4.140 2.911 1.632 3.672 . 0 0 "[ . 1 . 2 . ]" 1 519 1 54 ASN QD 1 134 LEU MD1 4.150 . 4.150 2.631 2.256 2.949 . 0 0 "[ . 1 . 2 . ]" 1 520 1 54 ASN HD21 1 77 LYS QD 4.500 . 4.500 3.631 2.857 4.648 0.148 12 0 "[ . 1 . 2 . ]" 1 521 1 54 ASN HD21 1 87 LYS HB2 . . 4.500 2.649 2.040 3.688 . 0 0 "[ . 1 . 2 . ]" 1 522 1 54 ASN HD21 1 89 TYR H . . 4.500 3.291 2.923 3.807 . 0 0 "[ . 1 . 2 . ]" 1 523 1 54 ASN HD21 1 90 LEU MD1 5.420 . 5.420 3.626 2.681 4.287 . 0 0 "[ . 1 . 2 . ]" 1 524 1 54 ASN HD21 1 90 LEU MD2 5.420 . 5.420 4.140 2.047 5.053 . 0 0 "[ . 1 . 2 . ]" 1 525 1 54 ASN HD22 1 77 LYS HG3 4.500 . 4.500 3.516 2.062 4.604 0.104 3 0 "[ . 1 . 2 . ]" 1 526 1 54 ASN HD22 1 87 LYS HB2 4.830 . 4.830 2.949 2.373 3.670 . 0 0 "[ . 1 . 2 . ]" 1 527 1 54 ASN HD22 1 89 TYR H 4.950 . 4.950 4.231 3.633 4.961 0.011 4 0 "[ . 1 . 2 . ]" 1 528 1 54 ASN HD22 1 90 LEU MD1 . . 4.500 4.127 2.724 4.548 0.048 6 0 "[ . 1 . 2 . ]" 1 529 1 54 ASN HD22 1 90 LEU MD2 5.420 . 5.420 4.735 1.643 5.469 0.049 12 0 "[ . 1 . 2 . ]" 1 530 1 55 VAL H 1 55 VAL HB 3.600 . 3.600 2.638 2.367 3.263 . 0 0 "[ . 1 . 2 . ]" 1 531 1 55 VAL H 1 55 VAL MG1 4.010 . 4.010 3.273 2.273 3.637 . 0 0 "[ . 1 . 2 . ]" 1 532 1 55 VAL H 1 55 VAL MG2 4.080 . 4.080 3.473 3.167 3.985 . 0 0 "[ . 1 . 2 . ]" 1 533 1 55 VAL H 1 56 LEU H 4.600 . 4.600 4.184 3.956 4.282 . 0 0 "[ . 1 . 2 . ]" 1 534 1 55 VAL H 1 90 LEU QD 4.010 . 4.010 3.477 3.011 4.073 0.063 5 0 "[ . 1 . 2 . ]" 1 535 1 55 VAL H 1 91 SER QB 5.500 . 5.500 5.094 4.809 5.532 0.032 9 0 "[ . 1 . 2 . ]" 1 536 1 55 VAL HA 1 55 VAL MG1 3.580 . 3.580 2.834 2.585 3.251 . 0 0 "[ . 1 . 2 . ]" 1 537 1 55 VAL HA 1 55 VAL MG2 3.460 . 3.460 2.225 2.140 2.369 . 0 0 "[ . 1 . 2 . ]" 1 538 1 55 VAL HA 1 56 LEU H 3.560 . 3.560 2.104 1.999 2.198 . 0 0 "[ . 1 . 2 . ]" 1 539 1 55 VAL HA 1 90 LEU QD 3.550 . 3.550 3.077 2.221 3.595 0.045 21 0 "[ . 1 . 2 . ]" 1 540 1 55 VAL HA 1 91 SER H 4.400 . 4.400 2.577 2.315 2.960 . 0 0 "[ . 1 . 2 . ]" 1 541 1 55 VAL HA 1 91 SER HB2 4.410 . 4.410 3.220 2.320 4.428 0.018 17 0 "[ . 1 . 2 . ]" 1 542 1 55 VAL HA 1 91 SER QB 3.660 . 3.660 2.700 2.306 3.123 . 0 0 "[ . 1 . 2 . ]" 1 543 1 55 VAL HA 1 91 SER HB3 4.410 . 4.410 3.776 2.513 4.455 0.045 4 0 "[ . 1 . 2 . ]" 1 544 1 55 VAL HA 1 92 VAL QG 5.180 . 5.180 4.777 4.490 4.997 . 0 0 "[ . 1 . 2 . ]" 1 545 1 55 VAL MG1 1 56 LEU H 4.330 . 4.330 2.967 2.464 3.899 . 0 0 "[ . 1 . 2 . ]" 1 546 1 55 VAL MG1 1 57 ASP HA 5.500 . 5.500 4.067 3.518 5.165 . 0 0 "[ . 1 . 2 . ]" 1 547 1 55 VAL MG1 1 57 ASP HB2 3.500 . 3.500 2.774 2.322 3.551 0.051 25 0 "[ . 1 . 2 . ]" 1 548 1 55 VAL MG1 1 57 ASP HB3 3.500 . 3.500 3.516 3.235 3.637 0.137 17 0 "[ . 1 . 2 . ]" 1 549 1 55 VAL MG1 1 91 SER QB 5.250 . 5.250 3.694 3.030 4.581 . 0 0 "[ . 1 . 2 . ]" 1 550 1 55 VAL MG2 1 56 LEU H 4.330 . 4.330 3.263 2.369 3.713 . 0 0 "[ . 1 . 2 . ]" 1 551 1 55 VAL MG2 1 57 ASP HA 5.500 . 5.500 5.296 3.849 5.673 0.173 23 0 "[ . 1 . 2 . ]" 1 552 1 55 VAL MG2 1 57 ASP HB2 5.990 . 5.990 4.246 2.627 4.905 . 0 0 "[ . 1 . 2 . ]" 1 553 1 55 VAL MG2 1 91 SER HB2 4.190 . 4.190 2.435 1.830 3.597 . 0 0 "[ . 1 . 2 . ]" 1 554 1 55 VAL MG2 1 91 SER QB 3.570 . 3.570 1.921 1.814 2.151 . 0 0 "[ . 1 . 2 . ]" 1 555 1 55 VAL MG2 1 91 SER HB3 4.190 . 4.190 2.692 1.857 3.347 . 0 0 "[ . 1 . 2 . ]" 1 556 1 55 VAL MG2 1 92 VAL H 5.500 . 5.500 5.122 4.138 5.468 . 0 0 "[ . 1 . 2 . ]" 1 557 1 56 LEU H 1 56 LEU HB2 4.110 . 4.110 3.013 2.729 3.200 . 0 0 "[ . 1 . 2 . ]" 1 558 1 56 LEU H 1 56 LEU HB3 4.110 . 4.110 2.544 2.385 2.826 . 0 0 "[ . 1 . 2 . ]" 1 559 1 56 LEU H 1 56 LEU MD1 4.880 . 4.880 4.101 3.920 4.447 . 0 0 "[ . 1 . 2 . ]" 1 560 1 56 LEU H 1 56 LEU MD2 5.070 . 5.070 4.318 4.229 4.492 . 0 0 "[ . 1 . 2 . ]" 1 561 1 56 LEU H 1 90 LEU QD 4.280 . 4.280 3.218 2.364 3.964 . 0 0 "[ . 1 . 2 . ]" 1 562 1 56 LEU H 1 92 VAL HA 4.020 . 4.020 2.878 2.697 3.097 . 0 0 "[ . 1 . 2 . ]" 1 563 1 56 LEU H 1 92 VAL QG 4.510 . 4.510 3.603 3.332 3.822 . 0 0 "[ . 1 . 2 . ]" 1 564 1 56 LEU HA 1 56 LEU MD1 4.010 . 4.010 2.985 2.128 3.804 . 0 0 "[ . 1 . 2 . ]" 1 565 1 56 LEU HA 1 56 LEU QD 3.020 . 3.020 2.152 2.047 2.234 . 0 0 "[ . 1 . 2 . ]" 1 566 1 56 LEU HA 1 56 LEU MD2 4.010 . 4.010 2.657 2.081 3.890 . 0 0 "[ . 1 . 2 . ]" 1 567 1 56 LEU HB2 1 58 LEU QD 5.440 . 5.440 4.964 4.497 5.312 . 0 0 "[ . 1 . 2 . ]" 1 568 1 56 LEU HB2 1 90 LEU QD 4.850 . 4.850 2.308 1.971 3.088 . 0 0 "[ . 1 . 2 . ]" 1 569 1 56 LEU HB3 1 58 LEU QD 5.050 . 5.050 4.388 3.809 4.723 . 0 0 "[ . 1 . 2 . ]" 1 570 1 56 LEU HB3 1 70 LEU QD 4.630 . 4.630 3.568 3.084 3.903 . 0 0 "[ . 1 . 2 . ]" 1 571 1 56 LEU HB3 1 90 LEU MD1 5.500 . 5.500 3.700 2.089 5.387 . 0 0 "[ . 1 . 2 . ]" 1 572 1 56 LEU HB3 1 90 LEU QD 4.440 . 4.440 2.937 2.082 3.818 . 0 0 "[ . 1 . 2 . ]" 1 573 1 56 LEU HB3 1 90 LEU MD2 5.500 . 5.500 3.235 2.390 4.220 . 0 0 "[ . 1 . 2 . ]" 1 574 1 56 LEU HB3 1 92 VAL HA 3.820 . 3.820 2.729 2.582 2.964 . 0 0 "[ . 1 . 2 . ]" 1 575 1 56 LEU HB3 1 92 VAL QG 3.970 . 3.970 2.278 2.060 2.528 . 0 0 "[ . 1 . 2 . ]" 1 576 1 56 LEU QD 1 57 ASP H 4.430 . 4.430 2.693 2.288 2.826 . 0 0 "[ . 1 . 2 . ]" 1 577 1 56 LEU QD 1 58 LEU H 4.500 . 4.500 3.800 3.309 4.456 . 0 0 "[ . 1 . 2 . ]" 1 578 1 56 LEU QD 1 58 LEU QD 3.700 . 3.700 1.904 1.795 2.072 . 0 0 "[ . 1 . 2 . ]" 1 579 1 56 LEU QD 1 58 LEU HG 5.440 . 5.440 2.295 1.850 3.484 . 0 0 "[ . 1 . 2 . ]" 1 580 1 56 LEU QD 1 69 HIS HB3 4.310 . 4.310 3.156 2.615 3.634 . 0 0 "[ . 1 . 2 . ]" 1 581 1 56 LEU QD 1 70 LEU H 3.780 . 3.780 3.687 3.400 3.845 0.065 6 0 "[ . 1 . 2 . ]" 1 582 1 56 LEU QD 1 70 LEU HA 3.240 . 3.240 2.257 1.840 2.527 . 0 0 "[ . 1 . 2 . ]" 1 583 1 56 LEU QD 1 70 LEU HB2 4.780 . 4.780 2.885 2.399 3.115 . 0 0 "[ . 1 . 2 . ]" 1 584 1 56 LEU QD 1 73 VAL H 4.530 . 4.530 4.146 3.654 4.426 . 0 0 "[ . 1 . 2 . ]" 1 585 1 56 LEU QD 1 73 VAL HB 3.800 . 3.800 2.659 2.128 3.078 . 0 0 "[ . 1 . 2 . ]" 1 586 1 56 LEU QD 1 73 VAL QG 3.270 . 3.270 1.976 1.799 2.261 . 0 0 "[ . 1 . 2 . ]" 1 587 1 56 LEU QD 1 74 LEU H 4.990 . 4.990 4.457 3.766 4.864 . 0 0 "[ . 1 . 2 . ]" 1 588 1 56 LEU QD 1 90 LEU QD 5.370 . 5.370 3.125 2.351 3.785 . 0 0 "[ . 1 . 2 . ]" 1 589 1 56 LEU MD1 1 57 ASP H 4.460 . 4.460 3.320 2.665 4.561 0.101 8 0 "[ . 1 . 2 . ]" 1 590 1 56 LEU MD1 1 58 LEU H 4.670 . 4.670 3.986 3.385 4.748 0.078 8 0 "[ . 1 . 2 . ]" 1 591 1 56 LEU MD1 1 58 LEU MD1 4.120 . 4.120 3.211 1.857 4.224 0.104 23 0 "[ . 1 . 2 . ]" 1 592 1 56 LEU MD1 1 58 LEU MD2 3.870 . 3.870 2.141 1.921 3.669 . 0 0 "[ . 1 . 2 . ]" 1 593 1 56 LEU MD1 1 69 HIS HB3 4.610 . 4.610 3.900 2.850 4.539 . 0 0 "[ . 1 . 2 . ]" 1 594 1 56 LEU MD1 1 70 LEU H 5.440 . 5.440 4.229 3.642 5.146 . 0 0 "[ . 1 . 2 . ]" 1 595 1 56 LEU MD1 1 70 LEU HA 4.330 . 4.330 2.874 1.857 3.974 . 0 0 "[ . 1 . 2 . ]" 1 596 1 56 LEU MD1 1 70 LEU QD 5.180 . 5.180 2.669 1.941 4.302 . 0 0 "[ . 1 . 2 . ]" 1 597 1 56 LEU MD2 1 58 LEU HG 5.500 . 5.500 3.405 2.157 4.276 . 0 0 "[ . 1 . 2 . ]" 1 598 1 56 LEU MD2 1 70 LEU H 5.280 . 5.280 4.338 3.473 4.990 . 0 0 "[ . 1 . 2 . ]" 1 599 1 56 LEU MD2 1 70 LEU HA 4.230 . 4.230 2.822 1.846 3.647 . 0 0 "[ . 1 . 2 . ]" 1 600 1 56 LEU MD2 1 70 LEU HB2 4.570 . 4.570 4.096 2.812 4.618 0.048 8 0 "[ . 1 . 2 . ]" 1 601 1 56 LEU MD2 1 73 VAL H 5.190 . 5.190 4.387 3.892 5.191 0.001 8 0 "[ . 1 . 2 . ]" 1 602 1 56 LEU MD2 1 73 VAL HB 3.820 . 3.820 2.771 2.140 3.844 0.024 8 0 "[ . 1 . 2 . ]" 1 603 1 56 LEU MD2 1 73 VAL QG 3.250 . 3.250 2.088 1.805 2.635 . 0 0 "[ . 1 . 2 . ]" 1 604 1 56 LEU HG 1 58 LEU QD 4.600 . 4.600 3.480 2.389 4.095 . 0 0 "[ . 1 . 2 . ]" 1 605 1 56 LEU HG 1 70 LEU QD 5.320 . 5.320 3.056 2.269 4.241 . 0 0 "[ . 1 . 2 . ]" 1 606 1 57 ASP HA 1 58 LEU H 3.460 . 3.460 2.202 2.028 2.309 . 0 0 "[ . 1 . 2 . ]" 1 607 1 57 ASP HA 1 58 LEU QD 5.440 . 5.440 3.866 2.693 4.248 . 0 0 "[ . 1 . 2 . ]" 1 608 1 57 ASP HA 1 58 LEU HG 5.500 . 5.500 3.783 3.403 5.620 0.120 22 0 "[ . 1 . 2 . ]" 1 609 1 57 ASP HA 1 59 HIS H 4.850 . 4.850 4.031 3.765 4.856 0.006 8 0 "[ . 1 . 2 . ]" 1 610 1 57 ASP HA 1 92 VAL HA 4.760 . 4.760 3.977 3.733 4.190 . 0 0 "[ . 1 . 2 . ]" 1 611 1 57 ASP HA 1 93 ILE H 4.230 . 4.230 2.377 2.211 2.534 . 0 0 "[ . 1 . 2 . ]" 1 612 1 57 ASP HA 1 93 ILE HA 5.250 . 5.250 4.495 4.312 4.660 . 0 0 "[ . 1 . 2 . ]" 1 613 1 57 ASP HA 1 93 ILE HB 3.200 . 3.200 2.216 1.899 2.476 . 0 0 "[ . 1 . 2 . ]" 1 614 1 57 ASP HA 1 93 ILE MD 4.140 . 4.140 3.099 2.714 3.743 . 0 0 "[ . 1 . 2 . ]" 1 615 1 57 ASP HA 1 93 ILE MG 4.060 . 4.060 3.679 3.469 3.822 . 0 0 "[ . 1 . 2 . ]" 1 616 1 57 ASP QB 1 58 LEU H 4.670 . 4.670 3.811 3.631 3.978 . 0 0 "[ . 1 . 2 . ]" 1 617 1 57 ASP QB 1 58 LEU QD 5.280 . 5.280 4.957 4.110 5.186 . 0 0 "[ . 1 . 2 . ]" 1 618 1 57 ASP QB 1 93 ILE MG 4.830 . 4.830 3.775 3.483 4.082 . 0 0 "[ . 1 . 2 . ]" 1 619 1 57 ASP HB2 1 93 ILE MD 4.250 . 4.250 2.451 2.154 2.796 . 0 0 "[ . 1 . 2 . ]" 1 620 1 57 ASP HB3 1 93 ILE MD 4.290 . 4.290 4.028 3.774 4.299 0.009 25 0 "[ . 1 . 2 . ]" 1 621 1 58 LEU H 1 58 LEU HB2 4.020 . 4.020 3.737 2.863 3.878 . 0 0 "[ . 1 . 2 . ]" 1 622 1 58 LEU H 1 58 LEU QB 3.870 . 3.870 3.252 2.787 3.367 . 0 0 "[ . 1 . 2 . ]" 1 623 1 58 LEU H 1 58 LEU HB3 4.070 . 4.070 3.613 3.510 3.831 . 0 0 "[ . 1 . 2 . ]" 1 624 1 58 LEU H 1 58 LEU MD1 4.280 . 4.280 2.504 2.164 3.885 . 0 0 "[ . 1 . 2 . ]" 1 625 1 58 LEU H 1 58 LEU QD 3.680 . 3.680 2.460 2.030 3.507 . 0 0 "[ . 1 . 2 . ]" 1 626 1 58 LEU H 1 58 LEU MD2 4.280 . 4.280 4.071 2.455 4.264 . 0 0 "[ . 1 . 2 . ]" 1 627 1 58 LEU H 1 58 LEU HG 4.110 . 4.110 2.722 2.446 4.210 0.100 22 0 "[ . 1 . 2 . ]" 1 628 1 58 LEU H 1 59 HIS H 3.870 . 3.870 2.525 2.186 3.609 . 0 0 "[ . 1 . 2 . ]" 1 629 1 58 LEU H 1 59 HIS HA 4.730 . 4.730 4.099 3.799 4.634 . 0 0 "[ . 1 . 2 . ]" 1 630 1 58 LEU H 1 66 ALA MB 5.500 . 5.500 5.484 5.312 5.563 0.063 6 0 "[ . 1 . 2 . ]" 1 631 1 58 LEU H 1 92 VAL QG 5.060 . 5.060 4.049 3.543 4.359 . 0 0 "[ . 1 . 2 . ]" 1 632 1 58 LEU H 1 93 ILE H 4.920 . 4.920 3.669 3.258 4.043 . 0 0 "[ . 1 . 2 . ]" 1 633 1 58 LEU H 1 93 ILE HB 4.790 . 4.790 3.410 3.138 3.780 . 0 0 "[ . 1 . 2 . ]" 1 634 1 58 LEU H 1 93 ILE MD 5.500 . 5.500 4.788 4.461 5.256 . 0 0 "[ . 1 . 2 . ]" 1 635 1 58 LEU H 1 93 ILE MG 4.420 . 4.420 3.775 3.542 4.042 . 0 0 "[ . 1 . 2 . ]" 1 636 1 58 LEU H 1 94 THR HA 4.500 . 4.500 3.774 3.355 4.072 . 0 0 "[ . 1 . 2 . ]" 1 637 1 58 LEU H 1 107 ILE MG 5.240 . 5.240 4.903 4.588 5.108 . 0 0 "[ . 1 . 2 . ]" 1 638 1 58 LEU HA 1 58 LEU MD1 4.600 . 4.600 3.665 3.501 3.958 . 0 0 "[ . 1 . 2 . ]" 1 639 1 58 LEU HA 1 58 LEU QD 3.860 . 3.860 3.323 2.349 3.444 . 0 0 "[ . 1 . 2 . ]" 1 640 1 58 LEU HA 1 58 LEU MD2 4.600 . 4.600 3.942 2.367 4.116 . 0 0 "[ . 1 . 2 . ]" 1 641 1 58 LEU HA 1 58 LEU HG 4.120 . 4.120 3.676 3.153 4.198 0.078 22 0 "[ . 1 . 2 . ]" 1 642 1 58 LEU HA 1 61 LEU H 5.200 . 5.200 4.721 4.462 5.013 . 0 0 "[ . 1 . 2 . ]" 1 643 1 58 LEU HA 1 61 LEU QD 3.880 . 3.880 2.518 2.328 2.730 . 0 0 "[ . 1 . 2 . ]" 1 644 1 58 LEU HA 1 61 LEU HG 5.370 . 5.370 5.135 4.002 5.469 0.099 4 0 "[ . 1 . 2 . ]" 1 645 1 58 LEU HA 1 66 ALA MB 5.500 . 5.500 5.386 4.924 5.588 0.088 20 0 "[ . 1 . 2 . ]" 1 646 1 58 LEU QB 1 59 HIS H 4.070 . 4.070 3.940 3.679 4.024 . 0 0 "[ . 1 . 2 . ]" 1 647 1 58 LEU HB2 1 59 HIS H 4.410 . 4.410 4.304 3.939 4.406 . 0 0 "[ . 1 . 2 . ]" 1 648 1 58 LEU HB2 1 61 LEU QD 4.350 . 4.350 2.206 1.840 3.462 . 0 0 "[ . 1 . 2 . ]" 1 649 1 58 LEU HB2 1 66 ALA HA 4.420 . 4.420 3.391 3.061 4.065 . 0 0 "[ . 1 . 2 . ]" 1 650 1 58 LEU HB2 1 66 ALA MB 4.110 . 4.110 3.330 3.007 3.620 . 0 0 "[ . 1 . 2 . ]" 1 651 1 58 LEU HB2 1 107 ILE MG 4.870 . 4.870 4.225 2.714 4.819 . 0 0 "[ . 1 . 2 . ]" 1 652 1 58 LEU HB3 1 58 LEU MD1 3.480 . 3.480 3.151 2.388 3.244 . 0 0 "[ . 1 . 2 . ]" 1 653 1 58 LEU HB3 1 58 LEU QD 2.870 . 2.870 2.229 2.041 2.324 . 0 0 "[ . 1 . 2 . ]" 1 654 1 58 LEU HB3 1 58 LEU MD2 3.480 . 3.480 2.308 2.143 3.186 . 0 0 "[ . 1 . 2 . ]" 1 655 1 58 LEU HB3 1 59 HIS H 5.000 . 5.000 4.569 4.364 4.660 . 0 0 "[ . 1 . 2 . ]" 1 656 1 58 LEU HB3 1 66 ALA HA 5.300 . 5.300 4.175 3.151 4.503 . 0 0 "[ . 1 . 2 . ]" 1 657 1 58 LEU HB3 1 66 ALA MB 5.010 . 5.010 4.432 3.024 4.827 . 0 0 "[ . 1 . 2 . ]" 1 658 1 58 LEU QD 1 59 HIS H 5.440 . 5.440 3.745 3.359 4.514 . 0 0 "[ . 1 . 2 . ]" 1 659 1 58 LEU QD 1 60 GLY H 5.440 . 5.440 4.658 4.121 5.522 0.082 14 0 "[ . 1 . 2 . ]" 1 660 1 58 LEU QD 1 61 LEU H 5.440 . 5.440 4.228 3.568 4.740 . 0 0 "[ . 1 . 2 . ]" 1 661 1 58 LEU QD 1 61 LEU QD 3.570 . 3.570 2.950 2.289 3.348 . 0 0 "[ . 1 . 2 . ]" 1 662 1 58 LEU QD 1 66 ALA H 4.630 . 4.630 4.045 3.736 4.224 . 0 0 "[ . 1 . 2 . ]" 1 663 1 58 LEU QD 1 66 ALA HA 3.510 . 3.510 1.975 1.789 2.614 . 0 0 "[ . 1 . 2 . ]" 1 664 1 58 LEU QD 1 66 ALA MB 3.130 . 3.130 1.927 1.840 2.016 . 0 0 "[ . 1 . 2 . ]" 1 665 1 58 LEU QD 1 67 LEU HA 5.440 . 5.440 4.214 3.935 4.773 . 0 0 "[ . 1 . 2 . ]" 1 666 1 58 LEU QD 1 69 HIS H 5.100 . 5.100 3.918 3.542 4.836 . 0 0 "[ . 1 . 2 . ]" 1 667 1 58 LEU QD 1 69 HIS HA 5.270 . 5.270 4.534 4.188 5.282 0.012 22 0 "[ . 1 . 2 . ]" 1 668 1 58 LEU QD 1 69 HIS HB2 3.970 . 3.970 2.385 2.041 3.186 . 0 0 "[ . 1 . 2 . ]" 1 669 1 58 LEU QD 1 69 HIS HB3 4.040 . 4.040 2.951 2.519 3.528 . 0 0 "[ . 1 . 2 . ]" 1 670 1 58 LEU QD 1 69 HIS HD2 4.620 . 4.620 3.705 3.077 4.216 . 0 0 "[ . 1 . 2 . ]" 1 671 1 58 LEU QD 1 70 LEU H 3.950 . 3.950 3.094 2.805 3.975 0.025 22 0 "[ . 1 . 2 . ]" 1 672 1 58 LEU QD 1 70 LEU HA 5.440 . 5.440 3.196 2.768 3.879 . 0 0 "[ . 1 . 2 . ]" 1 673 1 58 LEU QD 1 70 LEU HB2 4.170 . 4.170 2.437 1.993 3.240 . 0 0 "[ . 1 . 2 . ]" 1 674 1 58 LEU QD 1 73 VAL QG 5.370 . 5.370 4.227 3.895 4.607 . 0 0 "[ . 1 . 2 . ]" 1 675 1 58 LEU QD 1 94 THR HA 4.470 . 4.470 2.571 2.073 4.160 . 0 0 "[ . 1 . 2 . ]" 1 676 1 58 LEU QD 1 107 ILE HA 5.440 . 5.440 4.954 4.684 5.342 . 0 0 "[ . 1 . 2 . ]" 1 677 1 58 LEU QD 1 107 ILE HG12 5.440 . 5.440 4.199 3.706 4.869 . 0 0 "[ . 1 . 2 . ]" 1 678 1 58 LEU QD 1 107 ILE MG 2.660 . 2.660 2.203 1.927 2.734 0.074 14 0 "[ . 1 . 2 . ]" 1 679 1 58 LEU MD1 1 66 ALA H 5.500 . 5.500 4.790 4.163 5.603 0.103 22 0 "[ . 1 . 2 . ]" 1 680 1 58 LEU MD1 1 66 ALA HA 4.220 . 4.220 3.167 1.932 3.683 . 0 0 "[ . 1 . 2 . ]" 1 681 1 58 LEU MD1 1 66 ALA MB 4.410 . 4.410 2.080 1.909 3.363 . 0 0 "[ . 1 . 2 . ]" 1 682 1 58 LEU MD1 1 69 HIS HB2 5.370 . 5.370 4.570 3.256 5.164 . 0 0 "[ . 1 . 2 . ]" 1 683 1 58 LEU MD1 1 70 LEU H 5.370 . 5.370 4.912 3.297 5.396 0.026 19 0 "[ . 1 . 2 . ]" 1 684 1 58 LEU MD2 1 66 ALA H 5.500 . 5.500 4.396 4.049 4.914 . 0 0 "[ . 1 . 2 . ]" 1 685 1 58 LEU MD2 1 66 ALA HA 4.220 . 4.220 2.037 1.825 2.709 . 0 0 "[ . 1 . 2 . ]" 1 686 1 58 LEU MD2 1 66 ALA MB 4.410 . 4.410 2.525 1.848 3.498 . 0 0 "[ . 1 . 2 . ]" 1 687 1 58 LEU MD2 1 69 HIS HB2 5.370 . 5.370 2.440 2.044 4.464 . 0 0 "[ . 1 . 2 . ]" 1 688 1 58 LEU MD2 1 69 HIS HD2 4.500 . 4.500 3.785 3.116 4.605 0.105 22 0 "[ . 1 . 2 . ]" 1 689 1 58 LEU MD2 1 70 LEU H 5.370 . 5.370 3.206 2.831 5.180 . 0 0 "[ . 1 . 2 . ]" 1 690 1 58 LEU HG 1 66 ALA HA 5.030 . 5.030 4.719 2.002 5.078 0.048 15 0 "[ . 1 . 2 . ]" 1 691 1 58 LEU HG 1 66 ALA MB 4.360 . 4.360 4.267 2.811 4.424 0.064 8 0 "[ . 1 . 2 . ]" 1 692 1 59 HIS H 1 59 HIS HB2 3.800 . 3.800 3.608 2.272 3.808 0.008 8 0 "[ . 1 . 2 . ]" 1 693 1 59 HIS H 1 59 HIS QB 3.190 . 3.190 2.636 2.242 2.951 . 0 0 "[ . 1 . 2 . ]" 1 694 1 59 HIS H 1 59 HIS HB3 3.580 . 3.580 2.748 2.612 3.436 . 0 0 "[ . 1 . 2 . ]" 1 695 1 59 HIS H 1 59 HIS HD2 4.410 . 4.410 4.464 4.409 4.589 0.179 23 0 "[ . 1 . 2 . ]" 1 696 1 59 HIS H 1 60 GLY H 4.590 . 4.590 4.454 4.283 4.559 . 0 0 "[ . 1 . 2 . ]" 1 697 1 59 HIS H 1 61 LEU H 4.740 . 4.740 4.758 4.482 4.817 0.077 4 0 "[ . 1 . 2 . ]" 1 698 1 59 HIS H 1 93 ILE HB 5.500 . 5.500 4.362 4.021 5.318 . 0 0 "[ . 1 . 2 . ]" 1 699 1 59 HIS H 1 93 ILE MG 4.350 . 4.350 3.644 3.384 4.377 0.027 26 0 "[ . 1 . 2 . ]" 1 700 1 59 HIS H 1 107 ILE MD 5.020 . 5.020 4.630 4.355 4.974 . 0 0 "[ . 1 . 2 . ]" 1 701 1 59 HIS HA 1 59 HIS HD2 4.530 . 4.530 4.404 2.897 4.523 . 0 0 "[ . 1 . 2 . ]" 1 702 1 59 HIS HA 1 60 GLY H 2.950 . 2.950 2.056 1.927 2.151 . 0 0 "[ . 1 . 2 . ]" 1 703 1 59 HIS HA 1 60 GLY QA 4.640 . 4.640 3.856 3.709 3.917 . 0 0 "[ . 1 . 2 . ]" 1 704 1 59 HIS HA 1 61 LEU H 4.020 . 4.020 3.448 3.144 3.865 . 0 0 "[ . 1 . 2 . ]" 1 705 1 59 HIS HA 1 107 ILE MD 3.960 . 3.960 2.561 2.266 3.057 . 0 0 "[ . 1 . 2 . ]" 1 706 1 59 HIS HA 1 107 ILE HG12 5.500 . 5.500 5.373 5.050 5.701 0.201 23 0 "[ . 1 . 2 . ]" 1 707 1 59 HIS HA 1 107 ILE MG 4.700 . 4.700 3.928 3.637 4.656 . 0 0 "[ . 1 . 2 . ]" 1 708 1 59 HIS QB 1 60 GLY H 3.830 . 3.830 3.066 2.943 3.267 . 0 0 "[ . 1 . 2 . ]" 1 709 1 59 HIS HB2 1 59 HIS HD2 3.400 . 3.400 2.808 2.660 3.495 0.095 23 0 "[ . 1 . 2 . ]" 1 710 1 59 HIS HB2 1 60 GLY H 4.100 . 4.100 3.206 3.028 4.182 0.082 23 0 "[ . 1 . 2 . ]" 1 711 1 59 HIS HB2 1 93 ILE MG 4.790 . 4.790 3.733 3.300 4.227 . 0 0 "[ . 1 . 2 . ]" 1 712 1 59 HIS HB2 1 95 GLY QA 4.580 . 4.580 2.209 1.811 4.612 0.032 23 0 "[ . 1 . 2 . ]" 1 713 1 59 HIS HB3 1 59 HIS HE1 4.950 . 4.950 4.679 4.614 5.021 0.071 23 0 "[ . 1 . 2 . ]" 1 714 1 59 HIS HB3 1 60 GLY H 4.140 . 4.140 4.052 3.127 4.171 0.031 24 0 "[ . 1 . 2 . ]" 1 715 1 59 HIS HB3 1 93 ILE MG 4.400 . 4.400 2.377 1.891 4.529 0.129 23 0 "[ . 1 . 2 . ]" 1 716 1 59 HIS HD2 1 60 GLY H . . 4.500 4.518 3.651 4.607 0.107 14 0 "[ . 1 . 2 . ]" 1 717 1 59 HIS HD2 1 60 GLY HA2 5.060 . 5.060 3.876 3.563 4.673 . 0 0 "[ . 1 . 2 . ]" 1 718 1 59 HIS HD2 1 60 GLY QA 4.290 . 4.290 3.690 3.448 4.284 . 0 0 "[ . 1 . 2 . ]" 1 719 1 59 HIS HD2 1 60 GLY HA3 . . 4.500 4.645 4.496 4.979 0.479 23 0 "[ . 1 . 2 . ]" 1 720 1 59 HIS HD2 1 93 ILE MG 5.500 . 5.500 5.029 3.757 5.423 . 0 0 "[ . 1 . 2 . ]" 1 721 1 59 HIS HE1 1 93 ILE HB 5.500 . 5.500 5.182 4.565 5.412 . 0 0 "[ . 1 . 2 . ]" 1 722 1 59 HIS HE1 1 93 ILE MG . . 3.500 3.564 2.455 3.675 0.175 9 0 "[ . 1 . 2 . ]" 1 723 1 60 GLY H 1 61 LEU H 3.580 . 3.580 2.494 2.305 2.878 . 0 0 "[ . 1 . 2 . ]" 1 724 1 60 GLY H 1 61 LEU HB2 5.120 . 5.120 4.576 4.256 5.023 . 0 0 "[ . 1 . 2 . ]" 1 725 1 60 GLY H 1 61 LEU QD 5.440 . 5.440 3.935 3.589 4.134 . 0 0 "[ . 1 . 2 . ]" 1 726 1 60 GLY H 1 94 THR HA 5.500 . 5.500 4.937 4.501 5.147 . 0 0 "[ . 1 . 2 . ]" 1 727 1 60 GLY H 1 94 THR HB 5.500 . 5.500 5.539 5.327 5.626 0.126 12 0 "[ . 1 . 2 . ]" 1 728 1 60 GLY H 1 107 ILE HB 5.500 . 5.500 4.801 4.177 5.337 . 0 0 "[ . 1 . 2 . ]" 1 729 1 60 GLY H 1 107 ILE MD 4.020 . 4.020 2.058 1.787 2.248 . 0 0 "[ . 1 . 2 . ]" 1 730 1 60 GLY H 1 107 ILE HG13 5.440 . 5.440 4.314 3.830 4.679 . 0 0 "[ . 1 . 2 . ]" 1 731 1 60 GLY HA2 1 107 ILE MD 4.280 . 4.280 4.143 3.791 4.346 0.066 8 0 "[ . 1 . 2 . ]" 1 732 1 60 GLY HA3 1 107 ILE MD 4.280 . 4.280 3.403 2.791 3.796 . 0 0 "[ . 1 . 2 . ]" 1 733 1 61 LEU H 1 61 LEU HB2 3.170 . 3.170 2.397 2.220 2.507 . 0 0 "[ . 1 . 2 . ]" 1 734 1 61 LEU H 1 61 LEU QB 3.080 . 3.080 2.365 2.197 2.468 . 0 0 "[ . 1 . 2 . ]" 1 735 1 61 LEU H 1 61 LEU HB3 3.700 . 3.700 3.618 3.508 3.695 . 0 0 "[ . 1 . 2 . ]" 1 736 1 61 LEU H 1 61 LEU MD1 4.380 . 4.380 2.643 2.010 3.956 . 0 0 "[ . 1 . 2 . ]" 1 737 1 61 LEU H 1 61 LEU QD 3.570 . 3.570 2.186 2.005 2.382 . 0 0 "[ . 1 . 2 . ]" 1 738 1 61 LEU H 1 61 LEU MD2 4.380 . 4.380 3.569 2.133 4.199 . 0 0 "[ . 1 . 2 . ]" 1 739 1 61 LEU H 1 61 LEU HG 3.980 . 3.980 3.833 3.604 4.012 0.032 12 0 "[ . 1 . 2 . ]" 1 740 1 61 LEU H 1 62 HIS H 4.860 . 4.860 4.593 4.513 4.659 . 0 0 "[ . 1 . 2 . ]" 1 741 1 61 LEU H 1 66 ALA MB 5.050 . 5.050 4.187 3.970 4.434 . 0 0 "[ . 1 . 2 . ]" 1 742 1 61 LEU H 1 107 ILE MD 3.760 . 3.760 2.455 2.037 2.894 . 0 0 "[ . 1 . 2 . ]" 1 743 1 61 LEU H 1 107 ILE MG 5.500 . 5.500 4.596 4.389 4.859 . 0 0 "[ . 1 . 2 . ]" 1 744 1 61 LEU HA 1 61 LEU QD 3.320 . 3.320 2.606 2.001 2.954 . 0 0 "[ . 1 . 2 . ]" 1 745 1 61 LEU HA 1 61 LEU HG 3.850 . 3.850 2.874 2.451 3.800 . 0 0 "[ . 1 . 2 . ]" 1 746 1 61 LEU HA 1 62 HIS H 3.000 . 3.000 2.454 2.262 2.563 . 0 0 "[ . 1 . 2 . ]" 1 747 1 61 LEU HA 1 62 HIS HB2 5.290 . 5.290 4.805 4.570 5.004 . 0 0 "[ . 1 . 2 . ]" 1 748 1 61 LEU HA 1 66 ALA H 5.500 . 5.500 5.387 4.994 5.555 0.055 4 0 "[ . 1 . 2 . ]" 1 749 1 61 LEU QB 1 62 HIS H 3.300 . 3.300 2.189 1.982 2.679 . 0 0 "[ . 1 . 2 . ]" 1 750 1 61 LEU QB 1 65 GLU H 4.920 . 4.920 4.303 4.055 4.608 . 0 0 "[ . 1 . 2 . ]" 1 751 1 61 LEU QB 1 66 ALA H 3.920 . 3.920 2.894 2.611 3.127 . 0 0 "[ . 1 . 2 . ]" 1 752 1 61 LEU HB2 1 62 HIS H 4.180 . 4.180 3.574 3.399 3.900 . 0 0 "[ . 1 . 2 . ]" 1 753 1 61 LEU HB2 1 66 ALA H 4.630 . 4.630 3.678 3.565 3.892 . 0 0 "[ . 1 . 2 . ]" 1 754 1 61 LEU HB2 1 66 ALA HA 4.620 . 4.620 3.591 3.382 3.805 . 0 0 "[ . 1 . 2 . ]" 1 755 1 61 LEU HB2 1 66 ALA MB 3.940 . 3.940 2.582 2.113 2.979 . 0 0 "[ . 1 . 2 . ]" 1 756 1 61 LEU HB2 1 107 ILE MD 4.050 . 4.050 3.057 2.468 3.576 . 0 0 "[ . 1 . 2 . ]" 1 757 1 61 LEU HB2 1 107 ILE MG 5.350 . 5.350 4.222 3.852 4.496 . 0 0 "[ . 1 . 2 . ]" 1 758 1 61 LEU HB3 1 62 HIS H 3.370 . 3.370 2.209 1.995 2.729 . 0 0 "[ . 1 . 2 . ]" 1 759 1 61 LEU HB3 1 65 GLU H 5.150 . 5.150 4.449 4.158 4.826 . 0 0 "[ . 1 . 2 . ]" 1 760 1 61 LEU HB3 1 65 GLU HB3 4.530 . 4.530 3.289 2.649 4.581 0.051 25 0 "[ . 1 . 2 . ]" 1 761 1 61 LEU HB3 1 65 GLU QG 5.340 . 5.340 3.642 1.869 4.536 . 0 0 "[ . 1 . 2 . ]" 1 762 1 61 LEU HB3 1 66 ALA H 4.000 . 4.000 3.046 2.665 3.366 . 0 0 "[ . 1 . 2 . ]" 1 763 1 61 LEU HB3 1 66 ALA HA 5.420 . 5.420 3.898 3.333 4.305 . 0 0 "[ . 1 . 2 . ]" 1 764 1 61 LEU HB3 1 66 ALA MB 4.950 . 4.950 3.178 2.504 3.731 . 0 0 "[ . 1 . 2 . ]" 1 765 1 61 LEU QD 1 62 HIS H 3.550 . 3.550 3.416 2.731 3.643 0.093 5 0 "[ . 1 . 2 . ]" 1 766 1 61 LEU QD 1 65 GLU H 5.270 . 5.270 4.803 4.450 5.284 0.014 12 0 "[ . 1 . 2 . ]" 1 767 1 61 LEU QD 1 65 GLU HA 5.440 . 5.440 4.290 3.759 5.449 0.009 12 0 "[ . 1 . 2 . ]" 1 768 1 61 LEU QD 1 65 GLU HB2 4.400 . 4.400 2.850 2.138 3.843 . 0 0 "[ . 1 . 2 . ]" 1 769 1 61 LEU QD 1 65 GLU QG 4.450 . 4.450 3.299 1.927 3.862 . 0 0 "[ . 1 . 2 . ]" 1 770 1 61 LEU QD 1 66 ALA H 4.790 . 4.790 3.715 3.202 4.291 . 0 0 "[ . 1 . 2 . ]" 1 771 1 61 LEU QD 1 66 ALA HA 3.970 . 3.970 3.203 2.478 3.993 0.023 18 0 "[ . 1 . 2 . ]" 1 772 1 61 LEU QD 1 66 ALA MB 4.130 . 4.130 3.398 2.960 3.866 . 0 0 "[ . 1 . 2 . ]" 1 773 1 61 LEU QD 1 69 HIS HD2 4.020 . 4.020 2.435 1.958 3.622 . 0 0 "[ . 1 . 2 . ]" 1 774 1 61 LEU MD1 1 62 HIS H 4.980 . 4.980 4.086 2.765 4.614 . 0 0 "[ . 1 . 2 . ]" 1 775 1 61 LEU MD1 1 66 ALA H 5.110 . 5.110 4.893 3.825 5.226 0.116 20 0 "[ . 1 . 2 . ]" 1 776 1 61 LEU MD1 1 66 ALA HA 5.210 . 5.210 4.382 4.030 4.661 . 0 0 "[ . 1 . 2 . ]" 1 777 1 61 LEU MD1 1 66 ALA MB 4.540 . 4.540 4.084 3.679 4.451 . 0 0 "[ . 1 . 2 . ]" 1 778 1 61 LEU MD1 1 69 HIS HD2 . . 4.500 4.075 2.516 4.570 0.070 17 0 "[ . 1 . 2 . ]" 1 779 1 61 LEU MD2 1 62 HIS H 4.980 . 4.980 3.972 3.715 4.673 . 0 0 "[ . 1 . 2 . ]" 1 780 1 61 LEU MD2 1 66 ALA H 5.110 . 5.110 4.103 3.233 5.230 0.120 12 0 "[ . 1 . 2 . ]" 1 781 1 61 LEU MD2 1 66 ALA HA 5.210 . 5.210 3.379 2.493 4.683 . 0 0 "[ . 1 . 2 . ]" 1 782 1 61 LEU MD2 1 69 HIS HD2 4.660 . 4.660 2.804 1.960 4.706 0.046 1 0 "[ . 1 . 2 . ]" 1 783 1 61 LEU HG 1 62 HIS H 4.910 . 4.910 4.002 3.464 4.877 . 0 0 "[ . 1 . 2 . ]" 1 784 1 62 HIS H 1 62 HIS HB2 3.830 . 3.830 2.395 2.221 2.549 . 0 0 "[ . 1 . 2 . ]" 1 785 1 62 HIS H 1 62 HIS QB 3.290 . 3.290 2.363 2.199 2.506 . 0 0 "[ . 1 . 2 . ]" 1 786 1 62 HIS H 1 62 HIS HB3 3.830 . 3.830 3.619 3.543 3.703 . 0 0 "[ . 1 . 2 . ]" 1 787 1 62 HIS H 1 62 HIS HD2 4.990 . 4.990 4.685 3.859 4.994 0.004 27 0 "[ . 1 . 2 . ]" 1 788 1 62 HIS H 1 62 HIS HE1 5.380 . 5.380 5.214 4.671 5.440 0.060 19 0 "[ . 1 . 2 . ]" 1 789 1 62 HIS H 1 63 VAL H 4.790 . 4.790 4.561 4.498 4.613 . 0 0 "[ . 1 . 2 . ]" 1 790 1 62 HIS H 1 65 GLU H 4.280 . 4.280 3.979 3.726 4.288 0.008 15 0 "[ . 1 . 2 . ]" 1 791 1 62 HIS H 1 65 GLU HB2 5.330 . 5.330 2.876 2.212 4.797 . 0 0 "[ . 1 . 2 . ]" 1 792 1 62 HIS H 1 65 GLU QB 3.860 . 3.860 2.711 2.191 3.939 0.079 13 0 "[ . 1 . 2 . ]" 1 793 1 62 HIS H 1 65 GLU HB3 4.950 . 4.950 3.890 3.546 4.412 . 0 0 "[ . 1 . 2 . ]" 1 794 1 62 HIS H 1 65 GLU HG2 4.720 . 4.720 3.995 2.173 4.778 0.058 22 0 "[ . 1 . 2 . ]" 1 795 1 62 HIS H 1 65 GLU QG 3.900 . 3.900 3.171 2.104 3.741 . 0 0 "[ . 1 . 2 . ]" 1 796 1 62 HIS H 1 65 GLU HG3 4.020 . 4.020 3.449 2.742 3.908 . 0 0 "[ . 1 . 2 . ]" 1 797 1 62 HIS H 1 66 ALA MB 5.500 . 5.500 4.378 3.987 4.604 . 0 0 "[ . 1 . 2 . ]" 1 798 1 62 HIS HA 1 62 HIS HD2 3.920 . 3.920 2.881 2.344 3.378 . 0 0 "[ . 1 . 2 . ]" 1 799 1 62 HIS HA 1 63 VAL H 2.940 . 2.940 2.323 2.159 2.411 . 0 0 "[ . 1 . 2 . ]" 1 800 1 62 HIS HA 1 63 VAL HB 5.230 . 5.230 4.871 4.661 5.416 0.186 10 0 "[ . 1 . 2 . ]" 1 801 1 62 HIS HA 1 64 ASP H 4.390 . 4.390 4.381 4.118 4.467 0.077 15 0 "[ . 1 . 2 . ]" 1 802 1 62 HIS HA 1 65 GLU H 5.470 . 5.470 4.718 4.491 4.850 . 0 0 "[ . 1 . 2 . ]" 1 803 1 62 HIS HA 1 66 ALA MB 5.120 . 5.120 4.738 4.551 4.975 . 0 0 "[ . 1 . 2 . ]" 1 804 1 62 HIS QB 1 63 VAL H 3.420 . 3.420 2.391 2.171 2.614 . 0 0 "[ . 1 . 2 . ]" 1 805 1 62 HIS QB 1 64 ASP H 3.370 . 3.370 2.683 2.312 2.915 . 0 0 "[ . 1 . 2 . ]" 1 806 1 62 HIS QB 1 65 GLU H 3.180 . 3.180 2.584 2.225 2.961 . 0 0 "[ . 1 . 2 . ]" 1 807 1 62 HIS HB2 1 63 VAL H 4.620 . 4.620 3.686 3.568 3.849 . 0 0 "[ . 1 . 2 . ]" 1 808 1 62 HIS HB2 1 64 ASP H 3.990 . 3.990 3.601 3.385 3.913 . 0 0 "[ . 1 . 2 . ]" 1 809 1 62 HIS HB2 1 65 GLU H 4.930 . 4.930 2.689 2.318 3.091 . 0 0 "[ . 1 . 2 . ]" 1 810 1 62 HIS HB2 1 65 GLU HG2 5.090 . 5.090 3.568 2.150 4.291 . 0 0 "[ . 1 . 2 . ]" 1 811 1 62 HIS HB2 1 65 GLU QG 4.030 . 4.030 2.295 1.955 2.709 . 0 0 "[ . 1 . 2 . ]" 1 812 1 62 HIS HB2 1 65 GLU HG3 5.500 . 5.500 2.638 1.963 4.092 . 0 0 "[ . 1 . 2 . ]" 1 813 1 62 HIS HB3 1 62 HIS HD2 3.850 . 3.850 3.008 2.762 3.379 . 0 0 "[ . 1 . 2 . ]" 1 814 1 62 HIS HB3 1 63 VAL H 4.620 . 4.620 2.422 2.189 2.663 . 0 0 "[ . 1 . 2 . ]" 1 815 1 62 HIS HB3 1 64 ASP H 3.930 . 3.930 2.777 2.347 3.074 . 0 0 "[ . 1 . 2 . ]" 1 816 1 62 HIS HB3 1 65 GLU H 4.930 . 4.930 3.371 2.870 3.862 . 0 0 "[ . 1 . 2 . ]" 1 817 1 62 HIS HB3 1 65 GLU QG 4.750 . 4.750 3.684 3.385 4.170 . 0 0 "[ . 1 . 2 . ]" 1 818 1 62 HIS HD2 1 63 VAL H . . 4.500 3.899 3.460 4.381 . 0 0 "[ . 1 . 2 . ]" 1 819 1 63 VAL H 1 63 VAL HB 3.640 . 3.640 2.595 2.385 3.610 . 0 0 "[ . 1 . 2 . ]" 1 820 1 63 VAL H 1 63 VAL MG1 3.800 . 3.800 3.546 1.952 3.769 . 0 0 "[ . 1 . 2 . ]" 1 821 1 63 VAL H 1 63 VAL QG 2.770 . 2.770 2.089 1.877 2.227 . 0 0 "[ . 1 . 2 . ]" 1 822 1 63 VAL H 1 63 VAL MG2 3.800 . 3.800 2.159 1.931 2.488 . 0 0 "[ . 1 . 2 . ]" 1 823 1 63 VAL H 1 107 ILE MD 5.400 . 5.400 5.230 4.911 5.448 0.048 23 0 "[ . 1 . 2 . ]" 1 824 1 63 VAL HA 1 63 VAL MG1 3.280 . 3.280 2.480 2.440 2.536 . 0 0 "[ . 1 . 2 . ]" 1 825 1 63 VAL HA 1 63 VAL QG 2.800 . 2.800 2.165 2.117 2.387 . 0 0 "[ . 1 . 2 . ]" 1 826 1 63 VAL HA 1 63 VAL MG2 3.280 . 3.280 2.432 2.274 3.239 . 0 0 "[ . 1 . 2 . ]" 1 827 1 63 VAL HA 1 65 GLU H 5.010 . 5.010 4.621 4.299 4.811 . 0 0 "[ . 1 . 2 . ]" 1 828 1 63 VAL HA 1 66 ALA H 4.170 . 4.170 3.846 3.261 4.183 0.013 15 0 "[ . 1 . 2 . ]" 1 829 1 63 VAL HA 1 66 ALA MB 3.250 . 3.250 2.804 2.233 3.143 . 0 0 "[ . 1 . 2 . ]" 1 830 1 63 VAL HA 1 67 LEU H 4.480 . 4.480 4.071 3.884 4.353 . 0 0 "[ . 1 . 2 . ]" 1 831 1 63 VAL HA 1 67 LEU MD1 5.500 . 5.500 4.525 4.262 5.229 . 0 0 "[ . 1 . 2 . ]" 1 832 1 63 VAL HA 1 67 LEU MD2 5.500 . 5.500 4.730 4.501 4.981 . 0 0 "[ . 1 . 2 . ]" 1 833 1 63 VAL HA 1 67 LEU HG 4.590 . 4.590 3.784 3.563 4.211 . 0 0 "[ . 1 . 2 . ]" 1 834 1 63 VAL HA 1 107 ILE MD 5.120 . 5.120 4.625 4.033 5.155 0.035 23 0 "[ . 1 . 2 . ]" 1 835 1 63 VAL HA 1 107 ILE HG12 4.940 . 4.940 3.242 2.712 3.907 . 0 0 "[ . 1 . 2 . ]" 1 836 1 63 VAL HA 1 107 ILE HG13 4.940 . 4.940 4.521 4.001 4.949 0.009 8 0 "[ . 1 . 2 . ]" 1 837 1 63 VAL HA 1 107 ILE MG 4.380 . 4.380 3.594 3.056 3.947 . 0 0 "[ . 1 . 2 . ]" 1 838 1 63 VAL HA 1 110 ALA MB 4.300 . 4.300 3.353 3.063 3.604 . 0 0 "[ . 1 . 2 . ]" 1 839 1 63 VAL HB 1 64 ASP H 4.360 . 4.360 2.666 2.347 4.128 . 0 0 "[ . 1 . 2 . ]" 1 840 1 63 VAL HB 1 110 ALA MB 4.010 . 4.010 3.870 1.906 4.139 0.129 28 0 "[ . 1 . 2 . ]" 1 841 1 63 VAL QG 1 64 ASP H 3.380 . 3.380 2.971 2.328 3.140 . 0 0 "[ . 1 . 2 . ]" 1 842 1 63 VAL QG 1 64 ASP HA 4.080 . 4.080 3.234 3.010 3.421 . 0 0 "[ . 1 . 2 . ]" 1 843 1 63 VAL QG 1 67 LEU H 4.840 . 4.840 4.196 3.928 4.749 . 0 0 "[ . 1 . 2 . ]" 1 844 1 63 VAL QG 1 67 LEU HG 4.030 . 4.030 2.959 2.588 3.998 . 0 0 "[ . 1 . 2 . ]" 1 845 1 63 VAL QG 1 106 ARG HA 4.390 . 4.390 3.939 3.552 4.407 0.017 1 0 "[ . 1 . 2 . ]" 1 846 1 63 VAL QG 1 106 ARG HB2 4.510 . 4.510 2.876 2.293 3.254 . 0 0 "[ . 1 . 2 . ]" 1 847 1 63 VAL QG 1 106 ARG HB3 4.160 . 4.160 2.374 1.973 3.048 . 0 0 "[ . 1 . 2 . ]" 1 848 1 63 VAL QG 1 106 ARG QD 4.590 . 4.590 3.672 2.652 4.114 . 0 0 "[ . 1 . 2 . ]" 1 849 1 63 VAL QG 1 107 ILE H 4.350 . 4.350 3.707 2.880 4.047 . 0 0 "[ . 1 . 2 . ]" 1 850 1 63 VAL QG 1 107 ILE HA 3.360 . 3.360 2.665 1.976 3.120 . 0 0 "[ . 1 . 2 . ]" 1 851 1 63 VAL QG 1 110 ALA H 3.900 . 3.900 3.798 3.665 3.914 0.014 19 0 "[ . 1 . 2 . ]" 1 852 1 63 VAL QG 1 110 ALA HA 4.110 . 4.110 3.684 3.488 4.148 0.038 10 0 "[ . 1 . 2 . ]" 1 853 1 63 VAL MG1 1 64 ASP H 4.210 . 4.210 3.257 2.994 3.928 . 0 0 "[ . 1 . 2 . ]" 1 854 1 63 VAL MG1 1 106 ARG HB2 5.500 . 5.500 4.978 2.303 5.545 0.045 16 0 "[ . 1 . 2 . ]" 1 855 1 63 VAL MG1 1 106 ARG QD 5.420 . 5.420 5.082 3.821 5.525 0.105 2 0 "[ . 1 . 2 . ]" 1 856 1 63 VAL MG1 1 110 ALA H 4.890 . 4.890 4.256 3.960 4.435 . 0 0 "[ . 1 . 2 . ]" 1 857 1 63 VAL MG1 1 110 ALA HA 4.990 . 4.990 3.878 3.605 4.976 . 0 0 "[ . 1 . 2 . ]" 1 858 1 63 VAL MG1 1 110 ALA MB 3.060 . 3.060 1.864 1.735 2.639 . 0 0 "[ . 1 . 2 . ]" 1 859 1 63 VAL MG2 1 64 ASP H 4.300 . 4.300 3.672 2.349 3.939 . 0 0 "[ . 1 . 2 . ]" 1 860 1 63 VAL MG2 1 106 ARG HB2 5.270 . 5.270 3.105 2.329 5.078 . 0 0 "[ . 1 . 2 . ]" 1 861 1 63 VAL MG2 1 106 ARG QD 5.150 . 5.150 3.874 2.677 5.185 0.035 19 0 "[ . 1 . 2 . ]" 1 862 1 63 VAL MG2 1 110 ALA H 4.890 . 4.890 4.315 3.908 4.923 0.033 10 0 "[ . 1 . 2 . ]" 1 863 1 63 VAL MG2 1 110 ALA HA 4.990 . 4.990 4.801 4.367 5.012 0.022 2 0 "[ . 1 . 2 . ]" 1 864 1 63 VAL MG2 1 110 ALA MB 3.060 . 3.060 2.572 2.279 2.763 . 0 0 "[ . 1 . 2 . ]" 1 865 1 64 ASP H 1 64 ASP HB2 3.620 . 3.620 2.666 2.420 3.638 0.018 6 0 "[ . 1 . 2 . ]" 1 866 1 64 ASP H 1 64 ASP QB 2.830 . 2.830 2.424 2.183 2.654 . 0 0 "[ . 1 . 2 . ]" 1 867 1 64 ASP H 1 64 ASP HB3 3.620 . 3.620 3.149 2.315 3.633 0.013 9 0 "[ . 1 . 2 . ]" 1 868 1 64 ASP H 1 65 GLU H 2.880 . 2.880 2.691 2.523 2.858 . 0 0 "[ . 1 . 2 . ]" 1 869 1 64 ASP H 1 65 GLU HA 5.500 . 5.500 5.309 5.129 5.451 . 0 0 "[ . 1 . 2 . ]" 1 870 1 64 ASP H 1 65 GLU QG 4.780 . 4.780 4.246 3.911 4.444 . 0 0 "[ . 1 . 2 . ]" 1 871 1 64 ASP H 1 66 ALA MB 4.980 . 4.980 4.803 4.468 4.991 0.011 3 0 "[ . 1 . 2 . ]" 1 872 1 64 ASP H 1 67 LEU H 4.870 . 4.870 4.748 4.580 4.879 0.009 21 0 "[ . 1 . 2 . ]" 1 873 1 64 ASP H 1 110 ALA MB 5.500 . 5.500 5.348 4.896 5.544 0.044 6 0 "[ . 1 . 2 . ]" 1 874 1 64 ASP HA 1 64 ASP QB 2.600 . 2.600 2.335 2.163 2.424 . 0 0 "[ . 1 . 2 . ]" 1 875 1 64 ASP HA 1 65 GLU H 3.570 . 3.570 3.511 3.453 3.550 . 0 0 "[ . 1 . 2 . ]" 1 876 1 64 ASP HA 1 66 ALA H 5.180 . 5.180 4.827 4.605 5.014 . 0 0 "[ . 1 . 2 . ]" 1 877 1 64 ASP HA 1 67 LEU H 4.250 . 4.250 3.760 3.456 4.174 . 0 0 "[ . 1 . 2 . ]" 1 878 1 64 ASP HA 1 67 LEU HB2 4.290 . 4.290 3.106 2.671 3.538 . 0 0 "[ . 1 . 2 . ]" 1 879 1 64 ASP HA 1 67 LEU HB3 5.200 . 5.200 4.751 4.319 5.177 . 0 0 "[ . 1 . 2 . ]" 1 880 1 64 ASP HA 1 67 LEU MD1 5.500 . 5.500 3.125 2.553 3.656 . 0 0 "[ . 1 . 2 . ]" 1 881 1 64 ASP HA 1 67 LEU QD 4.040 . 4.040 3.100 2.543 3.610 . 0 0 "[ . 1 . 2 . ]" 1 882 1 64 ASP HA 1 68 GLU H 4.600 . 4.600 4.300 3.959 4.625 0.025 21 0 "[ . 1 . 2 . ]" 1 883 1 64 ASP QB 1 65 GLU H 3.170 . 3.170 2.467 2.064 3.268 0.098 6 0 "[ . 1 . 2 . ]" 1 884 1 64 ASP QB 1 65 GLU QG 4.890 . 4.890 3.354 2.633 4.500 . 0 0 "[ . 1 . 2 . ]" 1 885 1 64 ASP QB 1 66 ALA H 5.120 . 5.120 4.809 4.540 5.197 0.077 6 0 "[ . 1 . 2 . ]" 1 886 1 64 ASP QB 1 67 LEU H 5.160 . 5.160 5.007 4.828 5.173 0.013 22 0 "[ . 1 . 2 . ]" 1 887 1 64 ASP QB 1 68 GLU H 5.400 . 5.400 5.037 4.613 5.519 0.119 4 0 "[ . 1 . 2 . ]" 1 888 1 64 ASP HB2 1 65 GLU H 3.930 . 3.930 2.963 2.081 3.940 0.010 4 0 "[ . 1 . 2 . ]" 1 889 1 64 ASP HB3 1 65 GLU H 3.930 . 3.930 3.172 2.264 3.813 . 0 0 "[ . 1 . 2 . ]" 1 890 1 65 GLU H 1 65 GLU HB2 3.810 . 3.810 2.693 2.388 3.642 . 0 0 "[ . 1 . 2 . ]" 1 891 1 65 GLU H 1 65 GLU QB 3.310 . 3.310 2.440 2.350 2.707 . 0 0 "[ . 1 . 2 . ]" 1 892 1 65 GLU H 1 65 GLU HB3 3.810 . 3.810 3.371 2.408 3.628 . 0 0 "[ . 1 . 2 . ]" 1 893 1 65 GLU H 1 65 GLU HG2 3.450 . 3.450 3.180 1.854 3.485 0.035 5 0 "[ . 1 . 2 . ]" 1 894 1 65 GLU H 1 65 GLU QG 2.800 . 2.800 2.147 1.848 2.395 . 0 0 "[ . 1 . 2 . ]" 1 895 1 65 GLU H 1 65 GLU HG3 4.230 . 4.230 2.464 1.979 3.740 . 0 0 "[ . 1 . 2 . ]" 1 896 1 65 GLU H 1 66 ALA H 3.060 . 3.060 2.723 2.546 2.863 . 0 0 "[ . 1 . 2 . ]" 1 897 1 65 GLU H 1 66 ALA HA 5.500 . 5.500 5.260 5.113 5.371 . 0 0 "[ . 1 . 2 . ]" 1 898 1 65 GLU H 1 66 ALA MB 4.500 . 4.500 4.292 4.041 4.459 . 0 0 "[ . 1 . 2 . ]" 1 899 1 65 GLU H 1 67 LEU H 4.240 . 4.240 4.086 3.793 4.245 0.005 17 0 "[ . 1 . 2 . ]" 1 900 1 65 GLU H 1 67 LEU QB 5.280 . 5.280 5.138 4.885 5.291 0.011 23 0 "[ . 1 . 2 . ]" 1 901 1 65 GLU HA 1 65 GLU HG2 4.200 . 4.200 2.798 2.388 3.801 . 0 0 "[ . 1 . 2 . ]" 1 902 1 65 GLU HA 1 65 GLU QG 3.590 . 3.590 2.609 2.274 3.401 . 0 0 "[ . 1 . 2 . ]" 1 903 1 65 GLU HA 1 66 ALA MB 5.500 . 5.500 4.999 4.903 5.050 . 0 0 "[ . 1 . 2 . ]" 1 904 1 65 GLU HA 1 67 LEU H 4.500 . 4.500 4.381 4.021 4.528 0.028 5 0 "[ . 1 . 2 . ]" 1 905 1 65 GLU HA 1 68 GLU H 3.640 . 3.640 3.482 3.108 3.668 0.028 3 0 "[ . 1 . 2 . ]" 1 906 1 65 GLU HA 1 68 GLU HB2 4.820 . 4.820 3.747 2.306 4.905 0.085 24 0 "[ . 1 . 2 . ]" 1 907 1 65 GLU HA 1 68 GLU HB3 4.820 . 4.820 4.090 2.568 4.822 0.002 27 0 "[ . 1 . 2 . ]" 1 908 1 65 GLU HA 1 68 GLU QG 4.740 . 4.740 2.781 1.907 3.939 . 0 0 "[ . 1 . 2 . ]" 1 909 1 65 GLU HA 1 69 HIS H 4.840 . 4.840 4.051 3.800 4.441 . 0 0 "[ . 1 . 2 . ]" 1 910 1 65 GLU HA 1 69 HIS HD2 4.820 . 4.820 3.691 3.079 4.867 0.047 4 0 "[ . 1 . 2 . ]" 1 911 1 65 GLU QB 1 66 ALA H 3.530 . 3.530 2.437 2.115 3.399 . 0 0 "[ . 1 . 2 . ]" 1 912 1 65 GLU QB 1 67 LEU H 5.500 . 5.500 4.625 4.466 4.941 . 0 0 "[ . 1 . 2 . ]" 1 913 1 65 GLU HB2 1 66 ALA H 4.290 . 4.290 2.543 2.132 3.875 . 0 0 "[ . 1 . 2 . ]" 1 914 1 65 GLU HB2 1 67 LEU H 5.500 . 5.500 4.986 4.713 5.564 0.064 12 0 "[ . 1 . 2 . ]" 1 915 1 65 GLU HB2 1 69 HIS HD2 4.500 . 4.500 3.730 2.796 4.154 . 0 0 "[ . 1 . 2 . ]" 1 916 1 65 GLU HB3 1 66 ALA H 4.160 . 4.160 3.440 3.267 3.802 . 0 0 "[ . 1 . 2 . ]" 1 917 1 65 GLU HB3 1 66 ALA MB 5.100 . 5.100 4.735 4.490 5.226 0.126 25 0 "[ . 1 . 2 . ]" 1 918 1 65 GLU HB3 1 67 LEU H 5.500 . 5.500 5.510 5.426 5.544 0.044 25 0 "[ . 1 . 2 . ]" 1 919 1 65 GLU QG 1 66 ALA H 4.240 . 4.240 3.563 2.033 4.037 . 0 0 "[ . 1 . 2 . ]" 1 920 1 65 GLU QG 1 69 HIS HD2 4.880 . 4.880 4.075 2.805 4.365 . 0 0 "[ . 1 . 2 . ]" 1 921 1 65 GLU HG2 1 66 ALA H 4.900 . 4.900 4.282 2.122 4.906 0.006 26 0 "[ . 1 . 2 . ]" 1 922 1 65 GLU HG2 1 69 HIS HD2 4.500 . 4.500 4.549 4.418 4.679 0.179 23 0 "[ . 1 . 2 . ]" 1 923 1 66 ALA H 1 66 ALA MB 2.570 . 2.570 2.195 2.094 2.248 . 0 0 "[ . 1 . 2 . ]" 1 924 1 66 ALA H 1 67 LEU H 3.020 . 3.020 2.831 2.713 2.901 . 0 0 "[ . 1 . 2 . ]" 1 925 1 66 ALA H 1 67 LEU QB 4.980 . 4.980 4.900 4.799 4.991 0.011 19 0 "[ . 1 . 2 . ]" 1 926 1 66 ALA H 1 67 LEU HG 5.500 . 5.500 4.852 4.676 4.991 . 0 0 "[ . 1 . 2 . ]" 1 927 1 66 ALA H 1 68 GLU H 4.830 . 4.830 4.321 4.204 4.462 . 0 0 "[ . 1 . 2 . ]" 1 928 1 66 ALA H 1 107 ILE MD 5.190 . 5.190 4.844 4.145 5.160 . 0 0 "[ . 1 . 2 . ]" 1 929 1 66 ALA H 1 107 ILE HG12 5.260 . 5.260 4.764 4.152 5.273 0.013 19 0 "[ . 1 . 2 . ]" 1 930 1 66 ALA H 1 107 ILE MG 5.500 . 5.500 4.492 4.267 4.836 . 0 0 "[ . 1 . 2 . ]" 1 931 1 66 ALA HA 1 69 HIS H 4.340 . 4.340 3.669 3.466 3.872 . 0 0 "[ . 1 . 2 . ]" 1 932 1 66 ALA HA 1 69 HIS HB2 4.330 . 4.330 2.946 2.537 3.277 . 0 0 "[ . 1 . 2 . ]" 1 933 1 66 ALA HA 1 69 HIS HB3 4.990 . 4.990 4.608 4.116 4.947 . 0 0 "[ . 1 . 2 . ]" 1 934 1 66 ALA HA 1 69 HIS HD2 4.440 . 4.440 3.120 2.167 3.659 . 0 0 "[ . 1 . 2 . ]" 1 935 1 66 ALA HA 1 70 LEU H 4.650 . 4.650 3.991 3.818 4.121 . 0 0 "[ . 1 . 2 . ]" 1 936 1 66 ALA HA 1 107 ILE MD 5.000 . 5.000 4.839 4.157 5.052 0.052 19 0 "[ . 1 . 2 . ]" 1 937 1 66 ALA MB 1 67 LEU H 3.000 . 3.000 2.546 2.399 2.693 . 0 0 "[ . 1 . 2 . ]" 1 938 1 66 ALA MB 1 67 LEU HA 4.090 . 4.090 3.818 3.751 3.883 . 0 0 "[ . 1 . 2 . ]" 1 939 1 66 ALA MB 1 67 LEU MD1 4.980 . 4.980 4.651 4.479 4.855 . 0 0 "[ . 1 . 2 . ]" 1 940 1 66 ALA MB 1 67 LEU QD 4.120 . 4.120 3.499 3.226 3.730 . 0 0 "[ . 1 . 2 . ]" 1 941 1 66 ALA MB 1 67 LEU MD2 4.980 . 4.980 3.620 3.287 3.876 . 0 0 "[ . 1 . 2 . ]" 1 942 1 66 ALA MB 1 67 LEU HG 4.270 . 4.270 3.443 3.259 3.706 . 0 0 "[ . 1 . 2 . ]" 1 943 1 66 ALA MB 1 68 GLU H 4.950 . 4.950 4.581 4.470 4.685 . 0 0 "[ . 1 . 2 . ]" 1 944 1 66 ALA MB 1 70 LEU H 5.080 . 5.080 4.550 4.410 4.641 . 0 0 "[ . 1 . 2 . ]" 1 945 1 66 ALA MB 1 94 THR HB 5.500 . 5.500 5.072 4.602 5.542 0.042 9 0 "[ . 1 . 2 . ]" 1 946 1 66 ALA MB 1 107 ILE HB 5.010 . 5.010 4.366 4.081 4.705 . 0 0 "[ . 1 . 2 . ]" 1 947 1 66 ALA MB 1 107 ILE MD 4.260 . 4.260 2.821 2.144 3.141 . 0 0 "[ . 1 . 2 . ]" 1 948 1 66 ALA MB 1 107 ILE MG 3.070 . 3.070 2.024 1.883 2.328 . 0 0 "[ . 1 . 2 . ]" 1 949 1 67 LEU H 1 67 LEU HB2 2.780 . 2.780 2.477 2.420 2.508 . 0 0 "[ . 1 . 2 . ]" 1 950 1 67 LEU H 1 67 LEU QB 2.770 . 2.770 2.438 2.386 2.466 . 0 0 "[ . 1 . 2 . ]" 1 951 1 67 LEU H 1 67 LEU HB3 3.710 . 3.710 3.635 3.607 3.673 . 0 0 "[ . 1 . 2 . ]" 1 952 1 67 LEU H 1 67 LEU MD1 4.230 . 4.230 3.779 3.695 3.883 . 0 0 "[ . 1 . 2 . ]" 1 953 1 67 LEU H 1 67 LEU MD2 4.230 . 4.230 3.430 3.184 3.605 . 0 0 "[ . 1 . 2 . ]" 1 954 1 67 LEU H 1 67 LEU HG 3.380 . 3.380 2.520 2.393 2.654 . 0 0 "[ . 1 . 2 . ]" 1 955 1 67 LEU H 1 68 GLU H 2.960 . 2.960 2.672 2.532 2.779 . 0 0 "[ . 1 . 2 . ]" 1 956 1 67 LEU H 1 68 GLU QB 4.950 . 4.950 4.692 3.854 4.979 0.029 26 0 "[ . 1 . 2 . ]" 1 957 1 67 LEU H 1 68 GLU QG 5.340 . 5.340 4.426 3.942 5.427 0.087 3 0 "[ . 1 . 2 . ]" 1 958 1 67 LEU H 1 69 HIS H 4.340 . 4.340 4.184 3.989 4.322 . 0 0 "[ . 1 . 2 . ]" 1 959 1 67 LEU H 1 69 HIS QB 5.500 . 5.500 5.203 4.931 5.391 . 0 0 "[ . 1 . 2 . ]" 1 960 1 67 LEU H 1 70 LEU H 5.110 . 5.110 4.599 4.520 4.671 . 0 0 "[ . 1 . 2 . ]" 1 961 1 67 LEU H 1 71 MET ME 5.500 . 5.500 4.980 4.794 5.195 . 0 0 "[ . 1 . 2 . ]" 1 962 1 67 LEU H 1 110 ALA MB 5.240 . 5.240 4.899 4.615 5.216 . 0 0 "[ . 1 . 2 . ]" 1 963 1 67 LEU HA 1 67 LEU MD1 4.020 . 4.020 3.836 3.760 3.860 . 0 0 "[ . 1 . 2 . ]" 1 964 1 67 LEU HA 1 67 LEU QD 2.850 . 2.850 2.010 1.986 2.036 . 0 0 "[ . 1 . 2 . ]" 1 965 1 67 LEU HA 1 67 LEU MD2 4.020 . 4.020 2.017 1.993 2.044 . 0 0 "[ . 1 . 2 . ]" 1 966 1 67 LEU HA 1 69 HIS H 4.790 . 4.790 4.442 4.293 4.569 . 0 0 "[ . 1 . 2 . ]" 1 967 1 67 LEU HA 1 70 LEU H 3.890 . 3.890 3.373 3.180 3.531 . 0 0 "[ . 1 . 2 . ]" 1 968 1 67 LEU HA 1 70 LEU HB3 3.690 . 3.690 2.355 2.156 2.593 . 0 0 "[ . 1 . 2 . ]" 1 969 1 67 LEU HA 1 70 LEU QD 3.790 . 3.790 3.052 2.743 3.575 . 0 0 "[ . 1 . 2 . ]" 1 970 1 67 LEU HA 1 71 MET H 4.260 . 4.260 3.763 3.614 3.948 . 0 0 "[ . 1 . 2 . ]" 1 971 1 67 LEU HA 1 71 MET ME 4.580 . 4.580 3.871 3.703 4.092 . 0 0 "[ . 1 . 2 . ]" 1 972 1 67 LEU HA 1 111 VAL HA 5.160 . 5.160 4.778 4.529 4.968 . 0 0 "[ . 1 . 2 . ]" 1 973 1 67 LEU HA 1 111 VAL MG2 4.150 . 4.150 3.515 3.280 3.747 . 0 0 "[ . 1 . 2 . ]" 1 974 1 67 LEU HA 1 114 TYR QD 5.500 . 5.500 4.789 4.447 5.258 . 0 0 "[ . 1 . 2 . ]" 1 975 1 67 LEU QB 1 68 GLU H 3.090 . 3.090 2.674 2.567 2.776 . 0 0 "[ . 1 . 2 . ]" 1 976 1 67 LEU QB 1 69 HIS H 5.100 . 5.100 4.765 4.606 4.886 . 0 0 "[ . 1 . 2 . ]" 1 977 1 67 LEU QB 1 71 MET H 4.860 . 4.860 4.489 4.306 4.678 . 0 0 "[ . 1 . 2 . ]" 1 978 1 67 LEU HB2 1 68 GLU H 3.280 . 3.280 2.751 2.629 2.869 . 0 0 "[ . 1 . 2 . ]" 1 979 1 67 LEU HB3 1 67 LEU MD1 3.410 . 3.410 2.351 2.283 2.377 . 0 0 "[ . 1 . 2 . ]" 1 980 1 67 LEU HB3 1 67 LEU MD2 3.410 . 3.410 2.403 2.364 2.483 . 0 0 "[ . 1 . 2 . ]" 1 981 1 67 LEU HB3 1 68 GLU H 3.700 . 3.700 3.646 3.533 3.719 0.019 14 0 "[ . 1 . 2 . ]" 1 982 1 67 LEU HB3 1 71 MET ME 3.820 . 3.820 2.647 2.363 2.886 . 0 0 "[ . 1 . 2 . ]" 1 983 1 67 LEU HB3 1 114 TYR QD 4.950 . 4.950 3.741 3.198 4.101 . 0 0 "[ . 1 . 2 . ]" 1 984 1 67 LEU QD 1 110 ALA HA 5.440 . 5.440 3.489 3.186 3.715 . 0 0 "[ . 1 . 2 . ]" 1 985 1 67 LEU QD 1 111 VAL H 5.150 . 5.150 3.359 3.237 3.506 . 0 0 "[ . 1 . 2 . ]" 1 986 1 67 LEU QD 1 111 VAL HA 2.980 . 2.980 2.264 1.956 2.388 . 0 0 "[ . 1 . 2 . ]" 1 987 1 67 LEU QD 1 111 VAL HB 4.760 . 4.760 4.228 4.100 4.342 . 0 0 "[ . 1 . 2 . ]" 1 988 1 67 LEU QD 1 114 TYR H 3.960 . 3.960 3.660 3.277 3.873 . 0 0 "[ . 1 . 2 . ]" 1 989 1 67 LEU QD 1 114 TYR HA 4.790 . 4.790 4.037 3.637 4.372 . 0 0 "[ . 1 . 2 . ]" 1 990 1 67 LEU QD 1 114 TYR HB2 3.460 . 3.460 2.217 1.998 2.559 . 0 0 "[ . 1 . 2 . ]" 1 991 1 67 LEU QD 1 114 TYR HB3 3.760 . 3.760 2.950 2.556 3.164 . 0 0 "[ . 1 . 2 . ]" 1 992 1 67 LEU QD 1 114 TYR QD 3.150 . 3.150 2.861 2.441 3.133 . 0 0 "[ . 1 . 2 . ]" 1 993 1 67 LEU QD 1 114 TYR QE 4.610 . 4.610 4.266 3.887 4.470 . 0 0 "[ . 1 . 2 . ]" 1 994 1 67 LEU QD 1 115 LEU MD2 4.540 . 4.540 4.285 3.941 4.478 . 0 0 "[ . 1 . 2 . ]" 1 995 1 67 LEU MD1 1 68 GLU H 5.020 . 5.020 4.672 4.555 4.766 . 0 0 "[ . 1 . 2 . ]" 1 996 1 67 LEU MD1 1 71 MET ME 4.270 . 4.270 3.794 3.486 4.032 . 0 0 "[ . 1 . 2 . ]" 1 997 1 67 LEU MD1 1 110 ALA HA 4.740 . 4.740 3.880 3.486 4.176 . 0 0 "[ . 1 . 2 . ]" 1 998 1 67 LEU MD1 1 110 ALA MB 3.860 . 3.860 2.350 2.097 2.751 . 0 0 "[ . 1 . 2 . ]" 1 999 1 67 LEU MD1 1 111 VAL H 5.500 . 5.500 4.895 4.683 5.074 . 0 0 "[ . 1 . 2 . ]" 1 1000 1 67 LEU MD1 1 111 VAL HA 4.390 . 4.390 4.320 3.885 4.418 0.028 23 0 "[ . 1 . 2 . ]" 1 1001 1 67 LEU MD1 1 114 TYR HB2 4.450 . 4.450 3.476 2.550 3.684 . 0 0 "[ . 1 . 2 . ]" 1 1002 1 67 LEU MD1 1 114 TYR HB3 5.150 . 5.150 4.715 3.906 4.951 . 0 0 "[ . 1 . 2 . ]" 1 1003 1 67 LEU MD1 1 114 TYR QD 4.620 . 4.620 3.702 3.043 3.956 . 0 0 "[ . 1 . 2 . ]" 1 1004 1 67 LEU MD1 1 114 TYR QE 5.500 . 5.500 5.322 4.926 5.536 0.036 15 0 "[ . 1 . 2 . ]" 1 1005 1 67 LEU MD2 1 68 GLU H 5.020 . 5.020 4.713 4.621 4.778 . 0 0 "[ . 1 . 2 . ]" 1 1006 1 67 LEU MD2 1 71 MET ME 4.240 . 4.240 3.920 3.565 4.187 . 0 0 "[ . 1 . 2 . ]" 1 1007 1 67 LEU MD2 1 110 ALA HA 4.740 . 4.740 3.962 3.687 4.165 . 0 0 "[ . 1 . 2 . ]" 1 1008 1 67 LEU MD2 1 110 ALA MB 3.860 . 3.860 2.583 2.399 2.899 . 0 0 "[ . 1 . 2 . ]" 1 1009 1 67 LEU MD2 1 111 VAL H 5.220 . 5.220 3.421 3.291 3.574 . 0 0 "[ . 1 . 2 . ]" 1 1010 1 67 LEU MD2 1 111 VAL HA 4.390 . 4.390 2.272 1.961 2.398 . 0 0 "[ . 1 . 2 . ]" 1 1011 1 67 LEU MD2 1 114 TYR H 4.800 . 4.800 3.784 3.480 4.005 . 0 0 "[ . 1 . 2 . ]" 1 1012 1 67 LEU MD2 1 114 TYR HB2 4.450 . 4.450 2.245 2.083 2.617 . 0 0 "[ . 1 . 2 . ]" 1 1013 1 67 LEU MD2 1 114 TYR HB3 5.150 . 5.150 2.981 2.591 3.204 . 0 0 "[ . 1 . 2 . ]" 1 1014 1 67 LEU MD2 1 114 TYR QD 4.620 . 4.620 2.985 2.494 3.289 . 0 0 "[ . 1 . 2 . ]" 1 1015 1 67 LEU MD2 1 114 TYR QE 5.500 . 5.500 4.493 4.055 4.744 . 0 0 "[ . 1 . 2 . ]" 1 1016 1 67 LEU HG 1 68 GLU H 4.880 . 4.880 4.538 4.411 4.667 . 0 0 "[ . 1 . 2 . ]" 1 1017 1 67 LEU HG 1 107 ILE MG 5.300 . 5.300 4.707 4.375 5.074 . 0 0 "[ . 1 . 2 . ]" 1 1018 1 67 LEU HG 1 111 VAL H 5.500 . 5.500 5.169 4.929 5.323 . 0 0 "[ . 1 . 2 . ]" 1 1019 1 68 GLU H 1 68 GLU HB2 3.590 . 3.590 2.984 2.399 3.637 0.047 28 0 "[ . 1 . 2 . ]" 1 1020 1 68 GLU H 1 68 GLU QB 2.670 . 2.670 2.416 1.842 2.595 . 0 0 "[ . 1 . 2 . ]" 1 1021 1 68 GLU H 1 68 GLU HB3 3.610 . 3.610 3.044 1.877 3.624 0.014 5 0 "[ . 1 . 2 . ]" 1 1022 1 68 GLU H 1 68 GLU HG2 4.200 . 4.200 3.174 2.081 4.103 . 0 0 "[ . 1 . 2 . ]" 1 1023 1 68 GLU H 1 68 GLU QG 3.300 . 3.300 2.421 2.052 3.488 0.188 3 0 "[ . 1 . 2 . ]" 1 1024 1 68 GLU H 1 68 GLU HG3 4.200 . 4.200 2.800 2.076 3.774 . 0 0 "[ . 1 . 2 . ]" 1 1025 1 68 GLU H 1 69 HIS H 3.150 . 3.150 2.635 2.482 2.811 . 0 0 "[ . 1 . 2 . ]" 1 1026 1 68 GLU H 1 69 HIS HB2 4.960 . 4.960 4.839 4.651 4.976 0.016 20 0 "[ . 1 . 2 . ]" 1 1027 1 68 GLU H 1 70 LEU H 4.340 . 4.340 3.963 3.826 4.135 . 0 0 "[ . 1 . 2 . ]" 1 1028 1 68 GLU HA 1 68 GLU HG2 4.170 . 4.170 3.345 2.402 4.264 0.094 18 0 "[ . 1 . 2 . ]" 1 1029 1 68 GLU HA 1 68 GLU QG 3.560 . 3.560 2.967 2.314 3.523 . 0 0 "[ . 1 . 2 . ]" 1 1030 1 68 GLU HA 1 68 GLU HG3 4.170 . 4.170 3.473 2.950 3.778 . 0 0 "[ . 1 . 2 . ]" 1 1031 1 68 GLU HA 1 70 LEU H 5.210 . 5.210 4.341 4.151 4.579 . 0 0 "[ . 1 . 2 . ]" 1 1032 1 68 GLU HA 1 71 MET H 4.110 . 4.110 3.694 3.371 4.094 . 0 0 "[ . 1 . 2 . ]" 1 1033 1 68 GLU HA 1 71 MET ME 3.090 . 3.090 2.251 2.009 2.584 . 0 0 "[ . 1 . 2 . ]" 1 1034 1 68 GLU HA 1 71 MET HG2 4.710 . 4.710 2.225 1.983 2.613 . 0 0 "[ . 1 . 2 . ]" 1 1035 1 68 GLU HA 1 71 MET HG3 4.710 . 4.710 3.633 3.432 3.948 . 0 0 "[ . 1 . 2 . ]" 1 1036 1 68 GLU HA 1 72 ARG H 4.630 . 4.630 4.368 4.125 4.666 0.036 16 0 "[ . 1 . 2 . ]" 1 1037 1 68 GLU HA 1 72 ARG QG 5.340 . 5.340 4.975 4.421 5.350 0.010 16 0 "[ . 1 . 2 . ]" 1 1038 1 68 GLU QB 1 69 HIS H 3.620 . 3.620 2.886 2.255 3.627 0.007 24 0 "[ . 1 . 2 . ]" 1 1039 1 68 GLU HB2 1 69 HIS H 4.180 . 4.180 3.191 2.286 4.130 . 0 0 "[ . 1 . 2 . ]" 1 1040 1 68 GLU HB3 1 69 HIS H 4.180 . 4.180 3.620 2.552 4.082 . 0 0 "[ . 1 . 2 . ]" 1 1041 1 68 GLU QG 1 69 HIS H 4.630 . 4.630 3.165 1.973 4.245 . 0 0 "[ . 1 . 2 . ]" 1 1042 1 69 HIS H 1 69 HIS HB2 3.400 . 3.400 2.479 2.405 2.544 . 0 0 "[ . 1 . 2 . ]" 1 1043 1 69 HIS H 1 69 HIS QB 3.210 . 3.210 2.439 2.372 2.496 . 0 0 "[ . 1 . 2 . ]" 1 1044 1 69 HIS H 1 69 HIS HB3 3.780 . 3.780 3.629 3.600 3.667 . 0 0 "[ . 1 . 2 . ]" 1 1045 1 69 HIS H 1 69 HIS HD2 4.090 . 4.090 3.332 2.844 4.099 0.009 8 0 "[ . 1 . 2 . ]" 1 1046 1 69 HIS H 1 70 LEU H 3.240 . 3.240 2.531 2.433 2.634 . 0 0 "[ . 1 . 2 . ]" 1 1047 1 69 HIS H 1 70 LEU QB 4.390 . 4.390 4.202 4.074 4.319 . 0 0 "[ . 1 . 2 . ]" 1 1048 1 69 HIS H 1 70 LEU HB3 5.500 . 5.500 4.577 4.377 4.749 . 0 0 "[ . 1 . 2 . ]" 1 1049 1 69 HIS H 1 72 ARG H 5.220 . 5.220 5.128 4.935 5.252 0.032 24 0 "[ . 1 . 2 . ]" 1 1050 1 69 HIS H 1 72 ARG QG 5.340 . 5.340 4.630 4.190 4.883 . 0 0 "[ . 1 . 2 . ]" 1 1051 1 69 HIS HA 1 69 HIS HD2 4.930 . 4.930 4.591 4.354 4.880 . 0 0 "[ . 1 . 2 . ]" 1 1052 1 69 HIS HA 1 71 MET H 5.150 . 5.150 4.625 4.535 4.777 . 0 0 "[ . 1 . 2 . ]" 1 1053 1 69 HIS HA 1 72 ARG H 4.130 . 4.130 3.891 3.638 4.137 0.007 24 0 "[ . 1 . 2 . ]" 1 1054 1 69 HIS HA 1 72 ARG HB3 5.000 . 5.000 4.429 4.004 5.023 0.023 22 0 "[ . 1 . 2 . ]" 1 1055 1 69 HIS HA 1 72 ARG QD 4.770 . 4.770 2.842 2.157 3.795 . 0 0 "[ . 1 . 2 . ]" 1 1056 1 69 HIS HA 1 72 ARG HG2 4.070 . 4.070 2.456 2.043 2.785 . 0 0 "[ . 1 . 2 . ]" 1 1057 1 69 HIS HA 1 72 ARG QG 3.190 . 3.190 2.420 2.013 2.743 . 0 0 "[ . 1 . 2 . ]" 1 1058 1 69 HIS HA 1 72 ARG HG3 4.440 . 4.440 3.698 3.032 4.126 . 0 0 "[ . 1 . 2 . ]" 1 1059 1 69 HIS HA 1 73 VAL H 4.930 . 4.930 4.500 4.025 4.938 0.008 24 0 "[ . 1 . 2 . ]" 1 1060 1 69 HIS HA 1 73 VAL QG 4.620 . 4.620 3.856 3.480 4.127 . 0 0 "[ . 1 . 2 . ]" 1 1061 1 69 HIS QB 1 70 LEU H 3.520 . 3.520 2.745 2.530 2.951 . 0 0 "[ . 1 . 2 . ]" 1 1062 1 69 HIS HB2 1 70 LEU H 3.540 . 3.540 2.824 2.591 3.046 . 0 0 "[ . 1 . 2 . ]" 1 1063 1 69 HIS HB3 1 70 LEU H 4.220 . 4.220 3.742 3.540 3.956 . 0 0 "[ . 1 . 2 . ]" 1 1064 1 69 HIS HB3 1 73 VAL QG 5.300 . 5.300 3.803 3.313 4.334 . 0 0 "[ . 1 . 2 . ]" 1 1065 1 70 LEU H 1 70 LEU HB2 3.210 . 3.210 2.568 2.392 2.728 . 0 0 "[ . 1 . 2 . ]" 1 1066 1 70 LEU H 1 70 LEU QB 2.890 . 2.890 2.180 2.142 2.216 . 0 0 "[ . 1 . 2 . ]" 1 1067 1 70 LEU H 1 70 LEU HB3 2.990 . 2.990 2.364 2.266 2.471 . 0 0 "[ . 1 . 2 . ]" 1 1068 1 70 LEU H 1 70 LEU MD1 4.460 . 4.460 4.137 3.962 4.295 . 0 0 "[ . 1 . 2 . ]" 1 1069 1 70 LEU H 1 70 LEU QD 3.830 . 3.830 3.704 3.632 3.785 . 0 0 "[ . 1 . 2 . ]" 1 1070 1 70 LEU H 1 70 LEU MD2 4.460 . 4.460 4.183 4.084 4.233 . 0 0 "[ . 1 . 2 . ]" 1 1071 1 70 LEU H 1 70 LEU HG 4.740 . 4.740 4.440 4.334 4.593 . 0 0 "[ . 1 . 2 . ]" 1 1072 1 70 LEU H 1 71 MET H 3.140 . 3.140 2.685 2.601 2.802 . 0 0 "[ . 1 . 2 . ]" 1 1073 1 70 LEU H 1 71 MET HB3 5.500 . 5.500 5.068 4.924 5.212 . 0 0 "[ . 1 . 2 . ]" 1 1074 1 70 LEU H 1 71 MET ME 4.790 . 4.790 4.818 4.753 4.840 0.050 21 0 "[ . 1 . 2 . ]" 1 1075 1 70 LEU H 1 72 ARG H 4.300 . 4.300 4.277 4.153 4.351 0.051 11 0 "[ . 1 . 2 . ]" 1 1076 1 70 LEU HA 1 70 LEU MD1 4.250 . 4.250 2.613 2.165 3.482 . 0 0 "[ . 1 . 2 . ]" 1 1077 1 70 LEU HA 1 70 LEU QD 3.020 . 3.020 2.246 2.155 2.327 . 0 0 "[ . 1 . 2 . ]" 1 1078 1 70 LEU HA 1 70 LEU MD2 4.250 . 4.250 3.403 2.200 3.959 . 0 0 "[ . 1 . 2 . ]" 1 1079 1 70 LEU HA 1 70 LEU HG 4.120 . 4.120 3.355 3.001 3.910 . 0 0 "[ . 1 . 2 . ]" 1 1080 1 70 LEU HA 1 73 VAL H 4.220 . 4.220 3.782 3.593 3.969 . 0 0 "[ . 1 . 2 . ]" 1 1081 1 70 LEU HA 1 73 VAL HB 4.760 . 4.760 3.194 2.856 3.464 . 0 0 "[ . 1 . 2 . ]" 1 1082 1 70 LEU HA 1 73 VAL QG 4.330 . 4.330 3.628 3.407 3.803 . 0 0 "[ . 1 . 2 . ]" 1 1083 1 70 LEU HA 1 74 LEU H 4.740 . 4.740 4.037 3.819 4.253 . 0 0 "[ . 1 . 2 . ]" 1 1084 1 70 LEU QB 1 71 MET H 3.070 . 3.070 2.377 2.205 2.565 . 0 0 "[ . 1 . 2 . ]" 1 1085 1 70 LEU QB 1 72 ARG H 5.150 . 5.150 4.726 4.606 4.911 . 0 0 "[ . 1 . 2 . ]" 1 1086 1 70 LEU HB2 1 70 LEU MD1 3.390 . 3.390 2.595 2.266 3.199 . 0 0 "[ . 1 . 2 . ]" 1 1087 1 70 LEU HB2 1 70 LEU MD2 3.390 . 3.390 2.482 2.415 2.538 . 0 0 "[ . 1 . 2 . ]" 1 1088 1 70 LEU HB2 1 71 MET H 4.210 . 4.210 3.784 3.659 3.931 . 0 0 "[ . 1 . 2 . ]" 1 1089 1 70 LEU HB3 1 70 LEU QD 3.070 . 3.070 2.225 2.179 2.278 . 0 0 "[ . 1 . 2 . ]" 1 1090 1 70 LEU HB3 1 71 MET H 3.110 . 3.110 2.402 2.223 2.600 . 0 0 "[ . 1 . 2 . ]" 1 1091 1 70 LEU HB3 1 71 MET HA 5.060 . 5.060 4.197 3.993 4.430 . 0 0 "[ . 1 . 2 . ]" 1 1092 1 70 LEU QD 1 71 MET H 3.870 . 3.870 3.342 2.756 3.681 . 0 0 "[ . 1 . 2 . ]" 1 1093 1 70 LEU QD 1 71 MET HA 4.390 . 4.390 3.381 2.251 3.966 . 0 0 "[ . 1 . 2 . ]" 1 1094 1 70 LEU QD 1 73 VAL H 5.440 . 5.440 4.569 4.048 4.955 . 0 0 "[ . 1 . 2 . ]" 1 1095 1 70 LEU QD 1 73 VAL QG 5.130 . 5.130 3.883 3.673 4.131 . 0 0 "[ . 1 . 2 . ]" 1 1096 1 70 LEU QD 1 74 LEU H 4.350 . 4.350 3.701 3.179 4.119 . 0 0 "[ . 1 . 2 . ]" 1 1097 1 70 LEU QD 1 74 LEU HA 5.390 . 5.390 4.489 3.987 4.984 . 0 0 "[ . 1 . 2 . ]" 1 1098 1 70 LEU QD 1 74 LEU QD 2.900 . 2.900 2.024 1.777 2.299 . 0 0 "[ . 1 . 2 . ]" 1 1099 1 70 LEU QD 1 74 LEU HG 4.380 . 4.380 2.724 2.199 4.430 0.050 4 0 "[ . 1 . 2 . ]" 1 1100 1 70 LEU QD 1 92 VAL HA 5.440 . 5.440 4.366 4.089 4.639 . 0 0 "[ . 1 . 2 . ]" 1 1101 1 70 LEU QD 1 111 VAL HA 4.820 . 4.820 3.284 2.703 4.173 . 0 0 "[ . 1 . 2 . ]" 1 1102 1 70 LEU QD 1 114 TYR H 5.440 . 5.440 4.834 4.356 5.414 . 0 0 "[ . 1 . 2 . ]" 1 1103 1 70 LEU QD 1 114 TYR HB2 5.020 . 5.020 3.621 3.126 4.101 . 0 0 "[ . 1 . 2 . ]" 1 1104 1 70 LEU QD 1 114 TYR HB3 4.290 . 4.290 3.027 2.584 3.563 . 0 0 "[ . 1 . 2 . ]" 1 1105 1 70 LEU QD 1 114 TYR QD 3.170 . 3.170 2.621 2.474 2.759 . 0 0 "[ . 1 . 2 . ]" 1 1106 1 70 LEU QD 1 114 TYR QE 3.550 . 3.550 2.982 2.587 3.315 . 0 0 "[ . 1 . 2 . ]" 1 1107 1 70 LEU QD 1 115 LEU H 4.900 . 4.900 4.339 4.027 4.785 . 0 0 "[ . 1 . 2 . ]" 1 1108 1 70 LEU QD 1 115 LEU MD2 4.680 . 4.680 2.496 2.186 3.071 . 0 0 "[ . 1 . 2 . ]" 1 1109 1 70 LEU QD 1 115 LEU HG 5.440 . 5.440 4.494 4.229 4.945 . 0 0 "[ . 1 . 2 . ]" 1 1110 1 70 LEU QD 1 118 HIS HE1 5.440 . 5.440 5.479 5.404 5.514 0.074 19 0 "[ . 1 . 2 . ]" 1 1111 1 70 LEU QD 1 120 PHE QE 5.440 . 5.440 5.070 4.652 5.382 . 0 0 "[ . 1 . 2 . ]" 1 1112 1 70 LEU MD1 1 71 MET H 4.800 . 4.800 3.913 2.799 4.456 . 0 0 "[ . 1 . 2 . ]" 1 1113 1 70 LEU MD1 1 74 LEU H 5.500 . 5.500 3.933 3.489 4.253 . 0 0 "[ . 1 . 2 . ]" 1 1114 1 70 LEU MD1 1 114 TYR QE 4.730 . 4.730 3.713 2.607 4.441 . 0 0 "[ . 1 . 2 . ]" 1 1115 1 70 LEU MD2 1 71 MET H 4.800 . 4.800 3.926 3.621 4.391 . 0 0 "[ . 1 . 2 . ]" 1 1116 1 70 LEU MD2 1 74 LEU H 5.500 . 5.500 4.915 3.407 5.556 0.056 17 0 "[ . 1 . 2 . ]" 1 1117 1 70 LEU MD2 1 114 TYR QE 4.730 . 4.730 3.609 2.938 4.631 . 0 0 "[ . 1 . 2 . ]" 1 1118 1 70 LEU HG 1 71 MET H 4.680 . 4.680 3.820 3.172 4.712 0.032 26 0 "[ . 1 . 2 . ]" 1 1119 1 70 LEU HG 1 71 MET HA 5.490 . 5.490 3.914 2.959 5.497 0.007 13 0 "[ . 1 . 2 . ]" 1 1120 1 70 LEU HG 1 74 LEU QD 3.990 . 3.990 2.736 2.013 4.015 0.025 13 0 "[ . 1 . 2 . ]" 1 1121 1 70 LEU HG 1 114 TYR QD 5.050 . 5.050 4.296 3.799 4.672 . 0 0 "[ . 1 . 2 . ]" 1 1122 1 70 LEU HG 1 114 TYR QE 5.060 . 5.060 4.080 3.373 5.156 0.096 3 0 "[ . 1 . 2 . ]" 1 1123 1 71 MET H 1 71 MET HB2 4.080 . 4.080 3.640 3.621 3.658 . 0 0 "[ . 1 . 2 . ]" 1 1124 1 71 MET H 1 71 MET QB 2.860 . 2.860 2.482 2.432 2.527 . 0 0 "[ . 1 . 2 . ]" 1 1125 1 71 MET H 1 71 MET HB3 2.890 . 2.890 2.527 2.471 2.576 . 0 0 "[ . 1 . 2 . ]" 1 1126 1 71 MET H 1 71 MET ME 4.060 . 4.060 3.423 3.329 3.514 . 0 0 "[ . 1 . 2 . ]" 1 1127 1 71 MET H 1 71 MET HG2 3.510 . 3.510 2.322 2.263 2.396 . 0 0 "[ . 1 . 2 . ]" 1 1128 1 71 MET H 1 71 MET QG 2.940 . 2.940 2.292 2.235 2.361 . 0 0 "[ . 1 . 2 . ]" 1 1129 1 71 MET H 1 71 MET HG3 3.730 . 3.730 3.517 3.454 3.572 . 0 0 "[ . 1 . 2 . ]" 1 1130 1 71 MET H 1 72 ARG H 3.090 . 3.090 2.772 2.706 2.843 . 0 0 "[ . 1 . 2 . ]" 1 1131 1 71 MET H 1 73 VAL H 4.240 . 4.240 4.230 4.132 4.302 0.062 4 0 "[ . 1 . 2 . ]" 1 1132 1 71 MET H 1 74 LEU QD 5.130 . 5.130 4.649 4.194 5.058 . 0 0 "[ . 1 . 2 . ]" 1 1133 1 71 MET HA 1 71 MET ME 5.140 . 5.140 4.190 4.125 4.252 . 0 0 "[ . 1 . 2 . ]" 1 1134 1 71 MET HA 1 71 MET HG2 3.860 . 3.860 3.780 3.763 3.806 . 0 0 "[ . 1 . 2 . ]" 1 1135 1 71 MET HA 1 71 MET HG3 3.880 . 3.880 3.775 3.742 3.807 . 0 0 "[ . 1 . 2 . ]" 1 1136 1 71 MET HA 1 73 VAL H 5.370 . 5.370 4.330 4.174 4.474 . 0 0 "[ . 1 . 2 . ]" 1 1137 1 71 MET HA 1 74 LEU H 3.970 . 3.970 3.559 3.430 3.714 . 0 0 "[ . 1 . 2 . ]" 1 1138 1 71 MET HA 1 74 LEU HB2 4.170 . 4.170 2.866 2.512 3.744 . 0 0 "[ . 1 . 2 . ]" 1 1139 1 71 MET HA 1 74 LEU HB3 4.430 . 4.430 4.083 2.438 4.451 0.021 20 0 "[ . 1 . 2 . ]" 1 1140 1 71 MET HA 1 74 LEU QD 3.470 . 3.470 3.147 2.409 3.513 0.043 22 0 "[ . 1 . 2 . ]" 1 1141 1 71 MET HA 1 75 GLU H 4.850 . 4.850 4.061 3.801 4.361 . 0 0 "[ . 1 . 2 . ]" 1 1142 1 71 MET HA 1 114 TYR QD 5.500 . 5.500 4.916 4.563 5.306 . 0 0 "[ . 1 . 2 . ]" 1 1143 1 71 MET HA 1 114 TYR QE 3.590 . 3.590 3.378 3.048 3.649 0.059 9 0 "[ . 1 . 2 . ]" 1 1144 1 71 MET QB 1 72 ARG H 3.550 . 3.550 3.475 3.427 3.535 . 0 0 "[ . 1 . 2 . ]" 1 1145 1 71 MET HB2 1 72 ARG H 4.200 . 4.200 3.847 3.767 3.957 . 0 0 "[ . 1 . 2 . ]" 1 1146 1 71 MET HB2 1 75 GLU H 5.500 . 5.500 5.159 4.877 5.509 0.009 22 0 "[ . 1 . 2 . ]" 1 1147 1 71 MET HB2 1 114 TYR QE 4.100 . 4.100 2.887 2.568 3.335 . 0 0 "[ . 1 . 2 . ]" 1 1148 1 71 MET HB3 1 72 ARG H 3.950 . 3.950 3.962 3.915 3.984 0.034 13 0 "[ . 1 . 2 . ]" 1 1149 1 71 MET HB3 1 114 TYR QE 4.220 . 4.220 2.365 2.043 2.605 . 0 0 "[ . 1 . 2 . ]" 1 1150 1 71 MET ME 1 71 MET HG2 3.560 . 3.560 2.500 2.448 2.552 . 0 0 "[ . 1 . 2 . ]" 1 1151 1 71 MET ME 1 72 ARG H 4.720 . 4.720 4.676 4.631 4.727 0.007 9 0 "[ . 1 . 2 . ]" 1 1152 1 71 MET ME 1 114 TYR QD 4.150 . 4.150 3.225 2.949 3.600 . 0 0 "[ . 1 . 2 . ]" 1 1153 1 71 MET ME 1 114 TYR QE 3.970 . 3.970 2.435 1.966 2.925 . 0 0 "[ . 1 . 2 . ]" 1 1154 1 71 MET HG2 1 72 ARG H 4.010 . 4.010 2.632 2.577 2.696 . 0 0 "[ . 1 . 2 . ]" 1 1155 1 71 MET HG2 1 72 ARG HA 4.710 . 4.710 4.707 4.609 4.731 0.021 24 0 "[ . 1 . 2 . ]" 1 1156 1 71 MET HG2 1 114 TYR QE 4.720 . 4.720 4.621 4.366 4.745 0.025 26 0 "[ . 1 . 2 . ]" 1 1157 1 71 MET HG3 1 72 ARG H 4.010 . 4.010 2.493 2.330 2.638 . 0 0 "[ . 1 . 2 . ]" 1 1158 1 71 MET HG3 1 72 ARG HA 4.760 . 4.760 3.394 3.285 3.514 . 0 0 "[ . 1 . 2 . ]" 1 1159 1 71 MET HG3 1 114 TYR QE 4.980 . 4.980 4.884 4.675 5.021 0.041 28 0 "[ . 1 . 2 . ]" 1 1160 1 72 ARG H 1 72 ARG HB2 3.710 . 3.710 3.642 3.575 3.684 . 0 0 "[ . 1 . 2 . ]" 1 1161 1 72 ARG H 1 72 ARG QB 2.820 . 2.820 2.571 2.455 2.759 . 0 0 "[ . 1 . 2 . ]" 1 1162 1 72 ARG H 1 72 ARG HB3 2.920 . 2.920 2.630 2.497 2.852 . 0 0 "[ . 1 . 2 . ]" 1 1163 1 72 ARG H 1 72 ARG QD 4.480 . 4.480 3.829 3.613 4.022 . 0 0 "[ . 1 . 2 . ]" 1 1164 1 72 ARG H 1 72 ARG HG2 4.010 . 4.010 2.223 1.962 2.421 . 0 0 "[ . 1 . 2 . ]" 1 1165 1 72 ARG H 1 72 ARG QG 3.160 . 3.160 2.191 1.933 2.384 . 0 0 "[ . 1 . 2 . ]" 1 1166 1 72 ARG H 1 72 ARG HG3 4.010 . 4.010 3.344 2.766 3.605 . 0 0 "[ . 1 . 2 . ]" 1 1167 1 72 ARG H 1 73 VAL H 3.120 . 3.120 2.570 2.457 2.653 . 0 0 "[ . 1 . 2 . ]" 1 1168 1 72 ARG H 1 73 VAL HA 5.430 . 5.430 5.163 5.013 5.270 . 0 0 "[ . 1 . 2 . ]" 1 1169 1 72 ARG H 1 73 VAL QG 4.680 . 4.680 4.071 3.948 4.250 . 0 0 "[ . 1 . 2 . ]" 1 1170 1 72 ARG H 1 74 LEU H 4.560 . 4.560 4.148 3.985 4.312 . 0 0 "[ . 1 . 2 . ]" 1 1171 1 72 ARG H 1 74 LEU QB 5.500 . 5.500 4.985 4.511 5.177 . 0 0 "[ . 1 . 2 . ]" 1 1172 1 72 ARG HA 1 72 ARG QD 4.480 . 4.480 4.295 4.181 4.507 0.027 13 0 "[ . 1 . 2 . ]" 1 1173 1 72 ARG HA 1 72 ARG QG 3.600 . 3.600 3.356 3.327 3.381 . 0 0 "[ . 1 . 2 . ]" 1 1174 1 72 ARG HA 1 74 LEU H 5.320 . 5.320 4.584 4.369 4.771 . 0 0 "[ . 1 . 2 . ]" 1 1175 1 72 ARG HA 1 75 GLU H 4.190 . 4.190 3.772 3.539 4.015 . 0 0 "[ . 1 . 2 . ]" 1 1176 1 72 ARG HA 1 75 GLU HG2 3.660 . 3.660 2.263 2.051 2.523 . 0 0 "[ . 1 . 2 . ]" 1 1177 1 72 ARG QB 1 73 VAL H 3.590 . 3.590 3.514 3.372 3.592 0.002 20 0 "[ . 1 . 2 . ]" 1 1178 1 72 ARG HB2 1 73 VAL H 4.360 . 4.360 3.890 3.606 4.069 . 0 0 "[ . 1 . 2 . ]" 1 1179 1 72 ARG HB3 1 73 VAL H 4.200 . 4.200 4.014 3.925 4.073 . 0 0 "[ . 1 . 2 . ]" 1 1180 1 72 ARG HE 1 73 VAL H 5.350 . 5.350 4.421 4.007 4.650 . 0 0 "[ . 1 . 2 . ]" 1 1181 1 72 ARG HE 1 73 VAL HB 5.500 . 5.500 5.418 4.809 5.643 0.143 22 0 "[ . 1 . 2 . ]" 1 1182 1 72 ARG QG 1 73 VAL H 3.920 . 3.920 2.308 2.038 2.480 . 0 0 "[ . 1 . 2 . ]" 1 1183 1 72 ARG QG 1 73 VAL HA 5.340 . 5.340 3.424 3.237 3.723 . 0 0 "[ . 1 . 2 . ]" 1 1184 1 72 ARG QG 1 73 VAL QG 4.150 . 4.150 2.180 1.989 2.343 . 0 0 "[ . 1 . 2 . ]" 1 1185 1 72 ARG QG 1 74 LEU H 5.140 . 5.140 4.516 4.317 4.656 . 0 0 "[ . 1 . 2 . ]" 1 1186 1 72 ARG HG2 1 73 VAL H 4.090 . 4.090 2.737 2.418 3.246 . 0 0 "[ . 1 . 2 . ]" 1 1187 1 72 ARG HG3 1 73 VAL H 4.090 . 4.090 2.552 2.059 2.853 . 0 0 "[ . 1 . 2 . ]" 1 1188 1 73 VAL H 1 73 VAL HB 3.620 . 3.620 2.464 2.254 2.572 . 0 0 "[ . 1 . 2 . ]" 1 1189 1 73 VAL H 1 73 VAL MG1 3.830 . 3.830 3.782 3.699 3.814 . 0 0 "[ . 1 . 2 . ]" 1 1190 1 73 VAL H 1 73 VAL QG 2.920 . 2.920 2.321 2.202 2.480 . 0 0 "[ . 1 . 2 . ]" 1 1191 1 73 VAL H 1 73 VAL MG2 3.830 . 3.830 2.343 2.216 2.517 . 0 0 "[ . 1 . 2 . ]" 1 1192 1 73 VAL H 1 74 LEU H 3.230 . 3.230 2.541 2.467 2.631 . 0 0 "[ . 1 . 2 . ]" 1 1193 1 73 VAL H 1 74 LEU HB2 4.820 . 4.820 4.520 4.193 4.617 . 0 0 "[ . 1 . 2 . ]" 1 1194 1 73 VAL H 1 74 LEU QB 4.430 . 4.430 4.350 3.975 4.465 0.035 20 0 "[ . 1 . 2 . ]" 1 1195 1 73 VAL H 1 75 GLU H 4.440 . 4.440 4.171 4.040 4.244 . 0 0 "[ . 1 . 2 . ]" 1 1196 1 73 VAL H 1 76 LYS H 5.020 . 5.020 4.868 4.760 5.000 . 0 0 "[ . 1 . 2 . ]" 1 1197 1 73 VAL H 1 90 LEU QD 5.440 . 5.440 4.998 4.633 5.448 0.008 21 0 "[ . 1 . 2 . ]" 1 1198 1 73 VAL HA 1 73 VAL MG1 3.380 . 3.380 2.486 2.419 2.608 . 0 0 "[ . 1 . 2 . ]" 1 1199 1 73 VAL HA 1 73 VAL QG 2.930 . 2.930 2.123 2.075 2.152 . 0 0 "[ . 1 . 2 . ]" 1 1200 1 73 VAL HA 1 73 VAL MG2 3.380 . 3.380 2.308 2.178 2.383 . 0 0 "[ . 1 . 2 . ]" 1 1201 1 73 VAL HA 1 75 GLU H 4.690 . 4.690 4.397 4.131 4.534 . 0 0 "[ . 1 . 2 . ]" 1 1202 1 73 VAL HA 1 75 GLU HG2 4.740 . 4.740 4.696 4.451 4.792 0.052 22 0 "[ . 1 . 2 . ]" 1 1203 1 73 VAL HA 1 76 LYS H 3.800 . 3.800 3.507 3.420 3.621 . 0 0 "[ . 1 . 2 . ]" 1 1204 1 73 VAL HA 1 76 LYS QB 3.670 . 3.670 3.657 2.343 3.855 0.185 10 0 "[ . 1 . 2 . ]" 1 1205 1 73 VAL HA 1 76 LYS QD 5.500 . 5.500 2.867 2.205 5.373 . 0 0 "[ . 1 . 2 . ]" 1 1206 1 73 VAL HA 1 76 LYS QG 4.340 . 4.340 2.123 1.802 4.265 . 0 0 "[ . 1 . 2 . ]" 1 1207 1 73 VAL HA 1 77 LYS H 4.090 . 4.090 3.857 3.650 3.979 . 0 0 "[ . 1 . 2 . ]" 1 1208 1 73 VAL HB 1 74 LEU H 4.020 . 4.020 2.777 2.599 3.069 . 0 0 "[ . 1 . 2 . ]" 1 1209 1 73 VAL HB 1 74 LEU HA 4.780 . 4.780 4.446 4.243 4.785 0.005 13 0 "[ . 1 . 2 . ]" 1 1210 1 73 VAL HB 1 90 LEU QD 5.080 . 5.080 3.430 2.890 4.172 . 0 0 "[ . 1 . 2 . ]" 1 1211 1 73 VAL QG 1 74 LEU H 3.570 . 3.570 3.227 3.115 3.296 . 0 0 "[ . 1 . 2 . ]" 1 1212 1 73 VAL QG 1 74 LEU HA 4.090 . 4.090 3.382 3.207 3.526 . 0 0 "[ . 1 . 2 . ]" 1 1213 1 73 VAL QG 1 75 GLU H 5.090 . 5.090 4.677 4.571 4.731 . 0 0 "[ . 1 . 2 . ]" 1 1214 1 73 VAL QG 1 76 LYS H 4.820 . 4.820 4.393 4.323 4.475 . 0 0 "[ . 1 . 2 . ]" 1 1215 1 73 VAL QG 1 77 LYS H 4.390 . 4.390 3.715 3.502 3.830 . 0 0 "[ . 1 . 2 . ]" 1 1216 1 73 VAL QG 1 77 LYS QD 5.050 . 5.050 3.496 1.976 4.614 . 0 0 "[ . 1 . 2 . ]" 1 1217 1 73 VAL QG 1 77 LYS QE 4.110 . 4.110 2.915 2.390 3.593 . 0 0 "[ . 1 . 2 . ]" 1 1218 1 73 VAL QG 1 78 THR H 5.440 . 5.440 5.323 5.061 5.485 0.045 3 0 "[ . 1 . 2 . ]" 1 1219 1 73 VAL QG 1 90 LEU QD 3.130 . 3.130 2.087 1.846 2.727 . 0 0 "[ . 1 . 2 . ]" 1 1220 1 73 VAL MG1 1 74 LEU H 4.180 . 4.180 3.423 3.262 3.559 . 0 0 "[ . 1 . 2 . ]" 1 1221 1 73 VAL MG1 1 74 LEU HA 5.500 . 5.500 3.416 3.232 3.572 . 0 0 "[ . 1 . 2 . ]" 1 1222 1 73 VAL MG1 1 75 GLU H 5.500 . 5.500 5.053 4.914 5.146 . 0 0 "[ . 1 . 2 . ]" 1 1223 1 73 VAL MG1 1 77 LYS H 5.480 . 5.480 3.789 3.565 3.912 . 0 0 "[ . 1 . 2 . ]" 1 1224 1 73 VAL MG1 1 90 LEU MD1 5.500 . 5.500 2.511 1.871 3.338 . 0 0 "[ . 1 . 2 . ]" 1 1225 1 73 VAL MG1 1 90 LEU MD2 5.500 . 5.500 2.449 1.954 3.223 . 0 0 "[ . 1 . 2 . ]" 1 1226 1 73 VAL MG2 1 74 LEU H 4.180 . 4.180 3.959 3.853 4.188 0.008 22 0 "[ . 1 . 2 . ]" 1 1227 1 73 VAL MG2 1 74 LEU HA 5.500 . 5.500 5.435 5.372 5.543 0.043 22 0 "[ . 1 . 2 . ]" 1 1228 1 73 VAL MG2 1 75 GLU H 5.500 . 5.500 5.520 5.436 5.553 0.053 23 0 "[ . 1 . 2 . ]" 1 1229 1 73 VAL MG2 1 77 LYS H 5.480 . 5.480 5.366 5.063 5.485 0.005 24 0 "[ . 1 . 2 . ]" 1 1230 1 73 VAL MG2 1 90 LEU MD1 5.500 . 5.500 4.611 4.248 5.583 0.083 20 0 "[ . 1 . 2 . ]" 1 1231 1 73 VAL MG2 1 90 LEU MD2 5.500 . 5.500 4.452 3.914 5.309 . 0 0 "[ . 1 . 2 . ]" 1 1232 1 74 LEU H 1 74 LEU HB2 3.470 . 3.470 2.281 1.857 2.485 . 0 0 "[ . 1 . 2 . ]" 1 1233 1 74 LEU H 1 74 LEU QB 3.040 . 3.040 2.233 1.840 2.443 . 0 0 "[ . 1 . 2 . ]" 1 1234 1 74 LEU H 1 74 LEU HB3 3.670 . 3.670 3.406 2.201 3.614 . 0 0 "[ . 1 . 2 . ]" 1 1235 1 74 LEU H 1 74 LEU MD1 4.340 . 4.340 3.792 3.604 4.138 . 0 0 "[ . 1 . 2 . ]" 1 1236 1 74 LEU H 1 74 LEU QD 3.760 . 3.760 3.379 2.977 3.718 . 0 0 "[ . 1 . 2 . ]" 1 1237 1 74 LEU H 1 74 LEU MD2 4.340 . 4.340 3.826 3.066 4.264 . 0 0 "[ . 1 . 2 . ]" 1 1238 1 74 LEU H 1 74 LEU HG 3.960 . 3.960 3.067 2.317 4.139 0.179 22 0 "[ . 1 . 2 . ]" 1 1239 1 74 LEU H 1 75 GLU H 3.120 . 3.120 2.810 2.705 2.861 . 0 0 "[ . 1 . 2 . ]" 1 1240 1 74 LEU H 1 75 GLU HG2 5.500 . 5.500 4.248 3.996 4.492 . 0 0 "[ . 1 . 2 . ]" 1 1241 1 74 LEU H 1 75 GLU QG 4.940 . 4.940 4.110 3.884 4.331 . 0 0 "[ . 1 . 2 . ]" 1 1242 1 74 LEU H 1 76 LYS H 4.440 . 4.440 4.285 3.997 4.423 . 0 0 "[ . 1 . 2 . ]" 1 1243 1 74 LEU H 1 77 LYS H 5.060 . 5.060 4.716 4.603 4.840 . 0 0 "[ . 1 . 2 . ]" 1 1244 1 74 LEU H 1 90 LEU QD 4.810 . 4.810 3.685 3.467 4.053 . 0 0 "[ . 1 . 2 . ]" 1 1245 1 74 LEU HA 1 74 LEU MD1 4.210 . 4.210 3.600 2.003 3.831 . 0 0 "[ . 1 . 2 . ]" 1 1246 1 74 LEU HA 1 74 LEU QD 2.900 . 2.900 2.019 1.888 2.178 . 0 0 "[ . 1 . 2 . ]" 1 1247 1 74 LEU HA 1 74 LEU MD2 4.210 . 4.210 2.163 1.924 3.816 . 0 0 "[ . 1 . 2 . ]" 1 1248 1 74 LEU HA 1 74 LEU HG 3.880 . 3.880 2.834 2.504 3.566 . 0 0 "[ . 1 . 2 . ]" 1 1249 1 74 LEU HA 1 76 LYS H 5.500 . 5.500 4.483 4.031 4.870 . 0 0 "[ . 1 . 2 . ]" 1 1250 1 74 LEU HA 1 77 LYS H 4.400 . 4.400 3.584 3.362 4.070 . 0 0 "[ . 1 . 2 . ]" 1 1251 1 74 LEU HA 1 77 LYS HB3 4.920 . 4.920 4.045 2.964 4.882 . 0 0 "[ . 1 . 2 . ]" 1 1252 1 74 LEU HA 1 78 THR H 4.320 . 4.320 3.873 3.519 4.109 . 0 0 "[ . 1 . 2 . ]" 1 1253 1 74 LEU HA 1 90 LEU QB 4.990 . 4.990 4.278 4.011 4.757 . 0 0 "[ . 1 . 2 . ]" 1 1254 1 74 LEU HA 1 90 LEU QD 3.700 . 3.700 2.404 2.056 2.815 . 0 0 "[ . 1 . 2 . ]" 1 1255 1 74 LEU HA 1 120 PHE QE 5.500 . 5.500 5.323 4.841 5.602 0.102 22 0 "[ . 1 . 2 . ]" 1 1256 1 74 LEU HA 1 120 PHE HZ 5.500 . 5.500 5.244 4.861 5.567 0.067 4 0 "[ . 1 . 2 . ]" 1 1257 1 74 LEU HA 1 134 LEU QD 4.360 . 4.360 3.419 3.129 3.740 . 0 0 "[ . 1 . 2 . ]" 1 1258 1 74 LEU HA 1 134 LEU MD2 4.150 . 4.150 3.507 3.186 3.843 . 0 0 "[ . 1 . 2 . ]" 1 1259 1 74 LEU QB 1 75 GLU H 3.150 . 3.150 2.648 2.291 2.975 . 0 0 "[ . 1 . 2 . ]" 1 1260 1 74 LEU HB2 1 75 GLU H 4.020 . 4.020 2.966 2.398 3.955 . 0 0 "[ . 1 . 2 . ]" 1 1261 1 74 LEU HB2 1 114 TYR QE 4.990 . 4.990 3.780 3.204 4.466 . 0 0 "[ . 1 . 2 . ]" 1 1262 1 74 LEU HB2 1 120 PHE QE 5.500 . 5.500 4.856 4.502 5.498 . 0 0 "[ . 1 . 2 . ]" 1 1263 1 74 LEU HB2 1 120 PHE HZ 5.500 . 5.500 4.536 3.953 5.513 0.013 22 0 "[ . 1 . 2 . ]" 1 1264 1 74 LEU HB3 1 75 GLU H 4.020 . 4.020 3.204 2.375 3.723 . 0 0 "[ . 1 . 2 . ]" 1 1265 1 74 LEU HB3 1 114 TYR QE 4.990 . 4.990 3.903 3.265 4.579 . 0 0 "[ . 1 . 2 . ]" 1 1266 1 74 LEU HB3 1 120 PHE QE 5.500 . 5.500 3.859 3.389 5.015 . 0 0 "[ . 1 . 2 . ]" 1 1267 1 74 LEU HB3 1 120 PHE HZ 5.500 . 5.500 3.175 2.714 4.945 . 0 0 "[ . 1 . 2 . ]" 1 1268 1 74 LEU QD 1 75 GLU H 4.260 . 4.260 4.080 3.764 4.299 0.039 20 0 "[ . 1 . 2 . ]" 1 1269 1 74 LEU QD 1 77 LYS HB2 5.440 . 5.440 3.876 3.210 4.937 . 0 0 "[ . 1 . 2 . ]" 1 1270 1 74 LEU QD 1 77 LYS HB3 5.440 . 5.440 4.278 3.335 5.078 . 0 0 "[ . 1 . 2 . ]" 1 1271 1 74 LEU QD 1 90 LEU QB 3.600 . 3.600 2.677 2.248 3.331 . 0 0 "[ . 1 . 2 . ]" 1 1272 1 74 LEU QD 1 90 LEU QD 3.310 . 3.310 1.924 1.765 2.201 . 0 0 "[ . 1 . 2 . ]" 1 1273 1 74 LEU QD 1 114 TYR QD 3.920 . 3.920 3.133 2.839 3.396 . 0 0 "[ . 1 . 2 . ]" 1 1274 1 74 LEU QD 1 114 TYR QE 2.830 . 2.830 1.868 1.760 2.325 . 0 0 "[ . 1 . 2 . ]" 1 1275 1 74 LEU QD 1 115 LEU HG 4.780 . 4.780 4.114 3.840 4.610 . 0 0 "[ . 1 . 2 . ]" 1 1276 1 74 LEU QD 1 120 PHE QD 3.800 . 3.800 3.376 3.033 3.651 . 0 0 "[ . 1 . 2 . ]" 1 1277 1 74 LEU QD 1 120 PHE QE 3.320 . 3.320 2.671 2.260 2.977 . 0 0 "[ . 1 . 2 . ]" 1 1278 1 74 LEU QD 1 120 PHE HZ 3.740 . 3.740 2.826 2.148 3.117 . 0 0 "[ . 1 . 2 . ]" 1 1279 1 74 LEU QD 1 132 VAL HB 4.870 . 4.870 3.231 2.753 4.318 . 0 0 "[ . 1 . 2 . ]" 1 1280 1 74 LEU QD 1 132 VAL QG 3.050 . 3.050 2.304 2.069 2.717 . 0 0 "[ . 1 . 2 . ]" 1 1281 1 74 LEU QD 1 134 LEU HA 4.870 . 4.870 4.109 3.756 4.690 . 0 0 "[ . 1 . 2 . ]" 1 1282 1 74 LEU QD 1 134 LEU QD 3.010 . 3.010 2.254 2.040 2.664 . 0 0 "[ . 1 . 2 . ]" 1 1283 1 74 LEU QD 1 134 LEU MD2 2.850 . 2.850 2.268 2.049 2.686 . 0 0 "[ . 1 . 2 . ]" 1 1284 1 74 LEU MD1 1 75 GLU H 4.920 . 4.920 4.594 4.032 4.928 0.008 14 0 "[ . 1 . 2 . ]" 1 1285 1 74 LEU MD1 1 114 TYR QE 4.300 . 4.300 2.074 1.813 4.112 . 0 0 "[ . 1 . 2 . ]" 1 1286 1 74 LEU MD1 1 115 LEU MD1 3.470 . 3.470 2.181 1.832 3.163 . 0 0 "[ . 1 . 2 . ]" 1 1287 1 74 LEU MD1 1 115 LEU HG 5.500 . 5.500 4.402 4.022 5.495 . 0 0 "[ . 1 . 2 . ]" 1 1288 1 74 LEU MD1 1 120 PHE QD 4.630 . 4.630 3.741 3.472 4.015 . 0 0 "[ . 1 . 2 . ]" 1 1289 1 74 LEU MD1 1 120 PHE QE 4.030 . 4.030 3.069 2.692 3.460 . 0 0 "[ . 1 . 2 . ]" 1 1290 1 74 LEU MD1 1 120 PHE HZ 4.440 . 4.440 3.206 2.153 3.730 . 0 0 "[ . 1 . 2 . ]" 1 1291 1 74 LEU MD2 1 75 GLU H 4.920 . 4.920 4.585 4.025 4.754 . 0 0 "[ . 1 . 2 . ]" 1 1292 1 74 LEU MD2 1 114 TYR QE 4.300 . 4.300 3.848 1.762 4.321 0.021 20 0 "[ . 1 . 2 . ]" 1 1293 1 74 LEU MD2 1 115 LEU MD1 3.470 . 3.470 2.958 2.287 3.295 . 0 0 "[ . 1 . 2 . ]" 1 1294 1 74 LEU MD2 1 115 LEU HG 5.500 . 5.500 5.100 4.586 5.534 0.034 1 0 "[ . 1 . 2 . ]" 1 1295 1 74 LEU MD2 1 120 PHE QD 4.630 . 4.630 3.888 3.239 4.577 . 0 0 "[ . 1 . 2 . ]" 1 1296 1 74 LEU MD2 1 120 PHE QE 4.030 . 4.030 3.032 2.369 4.006 . 0 0 "[ . 1 . 2 . ]" 1 1297 1 74 LEU MD2 1 120 PHE HZ 4.440 . 4.440 3.367 2.362 4.476 0.036 22 0 "[ . 1 . 2 . ]" 1 1298 1 74 LEU HG 1 75 GLU H 5.500 . 5.500 4.727 3.553 5.092 . 0 0 "[ . 1 . 2 . ]" 1 1299 1 74 LEU HG 1 90 LEU QD 4.620 . 4.620 2.771 1.931 4.260 . 0 0 "[ . 1 . 2 . ]" 1 1300 1 74 LEU HG 1 120 PHE QE 5.500 . 5.500 5.175 3.101 5.552 0.052 20 0 "[ . 1 . 2 . ]" 1 1301 1 74 LEU HG 1 120 PHE HZ 5.500 . 5.500 5.212 2.594 5.539 0.039 14 0 "[ . 1 . 2 . ]" 1 1302 1 75 GLU H 1 75 GLU HB2 3.680 . 3.680 3.639 3.604 3.686 0.006 13 0 "[ . 1 . 2 . ]" 1 1303 1 75 GLU H 1 75 GLU QB 2.830 . 2.830 2.611 2.541 2.712 . 0 0 "[ . 1 . 2 . ]" 1 1304 1 75 GLU H 1 75 GLU HB3 2.760 . 2.760 2.676 2.595 2.798 0.038 14 0 "[ . 1 . 2 . ]" 1 1305 1 75 GLU H 1 75 GLU HG2 4.000 . 4.000 2.137 1.970 2.380 . 0 0 "[ . 1 . 2 . ]" 1 1306 1 75 GLU H 1 75 GLU QG 3.130 . 3.130 2.106 1.943 2.330 . 0 0 "[ . 1 . 2 . ]" 1 1307 1 75 GLU H 1 75 GLU HG3 4.000 . 4.000 3.211 2.968 3.417 . 0 0 "[ . 1 . 2 . ]" 1 1308 1 75 GLU H 1 76 LYS H 2.950 . 2.950 2.633 2.069 2.739 . 0 0 "[ . 1 . 2 . ]" 1 1309 1 75 GLU H 1 76 LYS HA 5.500 . 5.500 5.224 4.754 5.326 . 0 0 "[ . 1 . 2 . ]" 1 1310 1 75 GLU H 1 76 LYS QB 4.910 . 4.910 4.730 3.615 4.934 0.024 10 0 "[ . 1 . 2 . ]" 1 1311 1 75 GLU H 1 76 LYS QG 5.190 . 5.190 4.445 4.061 5.459 0.269 20 0 "[ . 1 . 2 . ]" 1 1312 1 75 GLU H 1 77 LYS H 4.560 . 4.560 4.088 3.810 4.253 . 0 0 "[ . 1 . 2 . ]" 1 1313 1 75 GLU H 1 78 THR HB 5.500 . 5.500 5.419 5.135 5.522 0.022 10 0 "[ . 1 . 2 . ]" 1 1314 1 75 GLU HA 1 75 GLU HB3 2.960 . 2.960 2.411 2.372 2.464 . 0 0 "[ . 1 . 2 . ]" 1 1315 1 75 GLU HA 1 75 GLU HG3 4.080 . 4.080 3.767 3.704 3.839 . 0 0 "[ . 1 . 2 . ]" 1 1316 1 75 GLU HA 1 77 LYS H 5.500 . 5.500 4.431 4.265 4.626 . 0 0 "[ . 1 . 2 . ]" 1 1317 1 75 GLU HA 1 78 THR H 4.200 . 4.200 3.599 3.379 3.940 . 0 0 "[ . 1 . 2 . ]" 1 1318 1 75 GLU HA 1 78 THR HB 3.520 . 3.520 2.995 2.729 3.269 . 0 0 "[ . 1 . 2 . ]" 1 1319 1 75 GLU HA 1 78 THR MG 4.760 . 4.760 4.278 4.041 4.596 . 0 0 "[ . 1 . 2 . ]" 1 1320 1 75 GLU QB 1 76 LYS H 3.430 . 3.430 3.430 3.351 3.472 0.042 5 0 "[ . 1 . 2 . ]" 1 1321 1 75 GLU HB2 1 76 LYS H 4.150 . 4.150 3.738 3.596 3.828 . 0 0 "[ . 1 . 2 . ]" 1 1322 1 75 GLU HB3 1 76 LYS H 3.990 . 3.990 3.995 3.904 4.036 0.046 15 0 "[ . 1 . 2 . ]" 1 1323 1 75 GLU QG 1 76 LYS H 3.800 . 3.800 2.179 1.983 2.409 . 0 0 "[ . 1 . 2 . ]" 1 1324 1 75 GLU HG2 1 76 LYS H 3.130 . 3.130 2.770 2.625 2.954 . 0 0 "[ . 1 . 2 . ]" 1 1325 1 75 GLU HG2 1 76 LYS QG 5.500 . 5.500 4.560 4.059 5.525 0.025 14 0 "[ . 1 . 2 . ]" 1 1326 1 75 GLU HG3 1 76 LYS H 4.100 . 4.100 2.293 2.022 2.592 . 0 0 "[ . 1 . 2 . ]" 1 1327 1 75 GLU HG3 1 76 LYS QB 3.900 . 3.900 3.025 2.738 3.451 . 0 0 "[ . 1 . 2 . ]" 1 1328 1 76 LYS H 1 76 LYS QB 2.590 . 2.590 2.426 2.058 2.560 . 0 0 "[ . 1 . 2 . ]" 1 1329 1 76 LYS H 1 76 LYS QE 5.130 . 5.130 4.417 3.570 5.132 0.002 11 0 "[ . 1 . 2 . ]" 1 1330 1 76 LYS H 1 76 LYS QG 4.090 . 4.090 2.531 2.210 3.755 . 0 0 "[ . 1 . 2 . ]" 1 1331 1 76 LYS H 1 77 LYS H 3.170 . 3.170 2.558 2.457 2.746 . 0 0 "[ . 1 . 2 . ]" 1 1332 1 76 LYS H 1 78 THR H 4.500 . 4.500 4.063 3.902 4.239 . 0 0 "[ . 1 . 2 . ]" 1 1333 1 76 LYS HA 1 76 LYS QD 4.610 . 4.610 4.340 2.101 4.600 . 0 0 "[ . 1 . 2 . ]" 1 1334 1 76 LYS HA 1 76 LYS QG 3.540 . 3.540 3.301 2.148 3.404 . 0 0 "[ . 1 . 2 . ]" 1 1335 1 76 LYS HA 1 79 GLU H 3.920 . 3.920 3.356 3.107 3.660 . 0 0 "[ . 1 . 2 . ]" 1 1336 1 76 LYS HA 1 79 GLU QB 3.600 . 3.600 2.596 2.208 3.135 . 0 0 "[ . 1 . 2 . ]" 1 1337 1 76 LYS HA 1 79 GLU QG 4.750 . 4.750 3.646 2.506 4.616 . 0 0 "[ . 1 . 2 . ]" 1 1338 1 76 LYS HA 1 80 GLU H 4.800 . 4.800 4.023 3.762 4.421 . 0 0 "[ . 1 . 2 . ]" 1 1339 1 76 LYS HA 1 80 GLU QG 4.990 . 4.990 4.282 3.786 5.034 0.044 10 0 "[ . 1 . 2 . ]" 1 1340 1 76 LYS QB 1 77 LYS H 3.550 . 3.550 3.447 2.264 3.562 0.012 17 0 "[ . 1 . 2 . ]" 1 1341 1 76 LYS QB 1 79 GLU H 5.270 . 5.270 4.854 4.699 5.077 . 0 0 "[ . 1 . 2 . ]" 1 1342 1 76 LYS QG 1 77 LYS H 4.100 . 4.100 2.444 2.133 3.686 . 0 0 "[ . 1 . 2 . ]" 1 1343 1 76 LYS QG 1 77 LYS HA 4.240 . 4.240 3.336 3.086 4.033 . 0 0 "[ . 1 . 2 . ]" 1 1344 1 76 LYS QG 1 78 THR H 5.500 . 5.500 4.610 4.312 5.504 0.004 20 0 "[ . 1 . 2 . ]" 1 1345 1 76 LYS QG 1 79 GLU H 5.230 . 5.230 5.088 4.907 5.230 . 0 0 "[ . 1 . 2 . ]" 1 1346 1 76 LYS QG 1 79 GLU QB 5.340 . 5.340 4.749 3.861 5.098 . 0 0 "[ . 1 . 2 . ]" 1 1347 1 76 LYS QG 1 80 GLU H 5.000 . 5.000 4.773 4.361 5.065 0.065 19 0 "[ . 1 . 2 . ]" 1 1348 1 76 LYS QG 1 80 GLU QB 4.980 . 4.980 4.691 4.278 5.028 0.048 19 0 "[ . 1 . 2 . ]" 1 1349 1 77 LYS H 1 77 LYS HB2 3.940 . 3.940 2.352 2.129 2.500 . 0 0 "[ . 1 . 2 . ]" 1 1350 1 77 LYS H 1 77 LYS QB 3.290 . 3.290 2.289 2.102 2.401 . 0 0 "[ . 1 . 2 . ]" 1 1351 1 77 LYS H 1 77 LYS HB3 3.940 . 3.940 3.356 2.526 3.647 . 0 0 "[ . 1 . 2 . ]" 1 1352 1 77 LYS H 1 77 LYS QD 4.310 . 4.310 3.800 2.598 4.366 0.056 6 0 "[ . 1 . 2 . ]" 1 1353 1 77 LYS H 1 77 LYS HG2 4.640 . 4.640 3.495 2.523 4.651 0.011 17 0 "[ . 1 . 2 . ]" 1 1354 1 77 LYS H 1 77 LYS QG 4.140 . 4.140 3.173 2.489 4.079 . 0 0 "[ . 1 . 2 . ]" 1 1355 1 77 LYS H 1 77 LYS HG3 4.630 . 4.630 4.027 2.739 4.548 . 0 0 "[ . 1 . 2 . ]" 1 1356 1 77 LYS H 1 78 THR H 3.290 . 3.290 2.574 2.455 2.685 . 0 0 "[ . 1 . 2 . ]" 1 1357 1 77 LYS H 1 78 THR HB 5.070 . 5.070 4.840 4.568 5.031 . 0 0 "[ . 1 . 2 . ]" 1 1358 1 77 LYS H 1 79 GLU H 4.430 . 4.430 3.948 3.772 4.142 . 0 0 "[ . 1 . 2 . ]" 1 1359 1 77 LYS H 1 79 GLU QB 5.340 . 5.340 4.734 4.408 5.073 . 0 0 "[ . 1 . 2 . ]" 1 1360 1 77 LYS H 1 80 GLU QB 5.500 . 5.500 4.942 4.698 5.343 . 0 0 "[ . 1 . 2 . ]" 1 1361 1 77 LYS H 1 90 LEU QD 4.810 . 4.810 4.025 3.615 4.323 . 0 0 "[ . 1 . 2 . ]" 1 1362 1 77 LYS HA 1 77 LYS QD 3.950 . 3.950 2.170 1.856 3.932 . 0 0 "[ . 1 . 2 . ]" 1 1363 1 77 LYS HA 1 77 LYS HG2 4.190 . 4.190 3.137 2.311 3.760 . 0 0 "[ . 1 . 2 . ]" 1 1364 1 77 LYS HA 1 77 LYS HG3 4.230 . 4.230 3.238 2.301 3.723 . 0 0 "[ . 1 . 2 . ]" 1 1365 1 77 LYS HA 1 80 GLU H 3.640 . 3.640 3.062 2.556 3.474 . 0 0 "[ . 1 . 2 . ]" 1 1366 1 77 LYS HA 1 80 GLU QB 3.350 . 3.350 2.412 2.033 3.493 0.143 28 0 "[ . 1 . 2 . ]" 1 1367 1 77 LYS HA 1 80 GLU QG 5.190 . 5.190 2.895 1.795 3.779 . 0 0 "[ . 1 . 2 . ]" 1 1368 1 77 LYS HA 1 81 PHE H 4.260 . 4.260 3.709 3.485 3.993 . 0 0 "[ . 1 . 2 . ]" 1 1369 1 77 LYS HA 1 90 LEU QD 5.440 . 5.440 4.491 4.040 4.948 . 0 0 "[ . 1 . 2 . ]" 1 1370 1 77 LYS HA 1 134 LEU MD1 5.490 . 5.490 4.140 3.609 4.799 . 0 0 "[ . 1 . 2 . ]" 1 1371 1 77 LYS HA 1 134 LEU QD 5.440 . 5.440 3.997 3.466 4.626 . 0 0 "[ . 1 . 2 . ]" 1 1372 1 77 LYS QB 1 78 THR H 3.830 . 3.830 2.793 2.512 3.142 . 0 0 "[ . 1 . 2 . ]" 1 1373 1 77 LYS HB2 1 78 THR H 3.840 . 3.840 3.187 2.748 3.896 0.056 25 0 "[ . 1 . 2 . ]" 1 1374 1 77 LYS HB2 1 79 GLU H 5.500 . 5.500 5.266 5.018 5.558 0.058 16 0 "[ . 1 . 2 . ]" 1 1375 1 77 LYS HB2 1 90 LEU QD 3.850 . 3.850 2.480 1.866 3.131 . 0 0 "[ . 1 . 2 . ]" 1 1376 1 77 LYS HB3 1 78 THR HA 4.860 . 4.860 4.260 3.869 4.578 . 0 0 "[ . 1 . 2 . ]" 1 1377 1 77 LYS HB3 1 79 GLU H 5.500 . 5.500 5.281 4.767 5.515 0.015 3 0 "[ . 1 . 2 . ]" 1 1378 1 77 LYS HB3 1 81 PHE HB3 5.490 . 5.490 5.163 4.613 5.553 0.063 14 0 "[ . 1 . 2 . ]" 1 1379 1 77 LYS HB3 1 90 LEU QD 4.240 . 4.240 2.765 2.001 3.374 . 0 0 "[ . 1 . 2 . ]" 1 1380 1 77 LYS HB3 1 134 LEU MD1 5.240 . 5.240 2.574 2.033 3.406 . 0 0 "[ . 1 . 2 . ]" 1 1381 1 77 LYS HB3 1 134 LEU MD2 5.240 . 5.240 3.377 2.641 4.180 . 0 0 "[ . 1 . 2 . ]" 1 1382 1 77 LYS QD 1 90 LEU MD1 5.370 . 5.370 3.471 2.098 4.488 . 0 0 "[ . 1 . 2 . ]" 1 1383 1 77 LYS QD 1 90 LEU QD 4.260 . 4.260 3.082 1.868 3.994 . 0 0 "[ . 1 . 2 . ]" 1 1384 1 77 LYS QD 1 90 LEU MD2 5.370 . 5.370 3.870 1.893 5.399 0.029 27 0 "[ . 1 . 2 . ]" 1 1385 1 77 LYS QE 1 77 LYS HG2 3.620 . 3.620 2.497 2.343 3.325 . 0 0 "[ . 1 . 2 . ]" 1 1386 1 77 LYS QE 1 77 LYS HG3 3.620 . 3.620 2.675 2.333 3.350 . 0 0 "[ . 1 . 2 . ]" 1 1387 1 77 LYS QE 1 90 LEU QD 4.060 . 4.060 3.047 2.317 4.069 0.009 13 0 "[ . 1 . 2 . ]" 1 1388 1 77 LYS HE2 1 77 LYS HG2 4.150 . 4.150 2.854 2.425 3.742 . 0 0 "[ . 1 . 2 . ]" 1 1389 1 77 LYS HE2 1 77 LYS HG3 4.150 . 4.150 3.201 2.470 3.802 . 0 0 "[ . 1 . 2 . ]" 1 1390 1 77 LYS HE3 1 77 LYS HG2 4.150 . 4.150 3.014 2.464 3.775 . 0 0 "[ . 1 . 2 . ]" 1 1391 1 77 LYS HE3 1 77 LYS HG3 4.150 . 4.150 2.990 2.423 3.777 . 0 0 "[ . 1 . 2 . ]" 1 1392 1 77 LYS QG 1 78 THR H 4.940 . 4.940 4.314 3.711 4.592 . 0 0 "[ . 1 . 2 . ]" 1 1393 1 77 LYS HG2 1 78 THR H 5.500 . 5.500 4.870 4.517 5.247 . 0 0 "[ . 1 . 2 . ]" 1 1394 1 77 LYS HG2 1 90 LEU QD 5.300 . 5.300 2.796 1.834 4.270 . 0 0 "[ . 1 . 2 . ]" 1 1395 1 77 LYS HG3 1 78 THR H 5.500 . 5.500 4.933 3.869 5.457 . 0 0 "[ . 1 . 2 . ]" 1 1396 1 77 LYS HG3 1 90 LEU QD 4.520 . 4.520 2.659 1.830 3.731 . 0 0 "[ . 1 . 2 . ]" 1 1397 1 78 THR H 1 78 THR HB 3.240 . 3.240 2.579 2.355 2.719 . 0 0 "[ . 1 . 2 . ]" 1 1398 1 78 THR H 1 78 THR MG 3.850 . 3.850 3.767 3.705 3.808 . 0 0 "[ . 1 . 2 . ]" 1 1399 1 78 THR H 1 79 GLU H 3.050 . 3.050 2.603 2.477 2.733 . 0 0 "[ . 1 . 2 . ]" 1 1400 1 78 THR H 1 79 GLU QB 4.750 . 4.750 4.404 4.108 4.710 . 0 0 "[ . 1 . 2 . ]" 1 1401 1 78 THR H 1 80 GLU H 4.780 . 4.780 4.252 4.058 4.472 . 0 0 "[ . 1 . 2 . ]" 1 1402 1 78 THR H 1 134 LEU MD1 5.300 . 5.300 3.538 3.174 3.881 . 0 0 "[ . 1 . 2 . ]" 1 1403 1 78 THR H 1 134 LEU QD 4.240 . 4.240 3.160 2.837 3.458 . 0 0 "[ . 1 . 2 . ]" 1 1404 1 78 THR H 1 134 LEU MD2 5.300 . 5.300 3.583 2.994 4.039 . 0 0 "[ . 1 . 2 . ]" 1 1405 1 78 THR HA 1 78 THR MG 2.810 . 2.810 2.395 2.335 2.523 . 0 0 "[ . 1 . 2 . ]" 1 1406 1 78 THR HA 1 80 GLU H 5.350 . 5.350 4.718 4.604 4.914 . 0 0 "[ . 1 . 2 . ]" 1 1407 1 78 THR HA 1 81 PHE H 3.980 . 3.980 3.508 3.227 3.817 . 0 0 "[ . 1 . 2 . ]" 1 1408 1 78 THR HA 1 81 PHE HB2 4.290 . 4.290 3.376 2.952 3.757 . 0 0 "[ . 1 . 2 . ]" 1 1409 1 78 THR HA 1 81 PHE HB3 4.400 . 4.400 2.361 1.952 2.685 . 0 0 "[ . 1 . 2 . ]" 1 1410 1 78 THR HA 1 81 PHE QD 3.430 . 3.430 3.004 2.364 3.412 . 0 0 "[ . 1 . 2 . ]" 1 1411 1 78 THR HA 1 82 LYS H 4.950 . 4.950 4.285 3.925 4.773 . 0 0 "[ . 1 . 2 . ]" 1 1412 1 78 THR HA 1 134 LEU HB2 5.130 . 5.130 4.185 3.595 4.542 . 0 0 "[ . 1 . 2 . ]" 1 1413 1 78 THR HA 1 134 LEU HB3 4.460 . 4.460 2.964 2.311 3.391 . 0 0 "[ . 1 . 2 . ]" 1 1414 1 78 THR HA 1 134 LEU MD1 3.970 . 3.970 2.144 1.948 2.744 . 0 0 "[ . 1 . 2 . ]" 1 1415 1 78 THR HA 1 134 LEU QD 3.400 . 3.400 2.103 1.910 2.603 . 0 0 "[ . 1 . 2 . ]" 1 1416 1 78 THR HA 1 134 LEU MD2 3.970 . 3.970 3.165 2.758 3.850 . 0 0 "[ . 1 . 2 . ]" 1 1417 1 78 THR HB 1 79 GLU H 3.170 . 3.170 2.724 2.573 2.926 . 0 0 "[ . 1 . 2 . ]" 1 1418 1 78 THR HB 1 81 PHE QD 5.500 . 5.500 5.140 4.549 5.548 0.048 15 0 "[ . 1 . 2 . ]" 1 1419 1 78 THR MG 1 79 GLU H 3.800 . 3.800 3.634 3.312 3.801 0.001 14 0 "[ . 1 . 2 . ]" 1 1420 1 78 THR MG 1 79 GLU HA 4.910 . 4.910 3.758 3.320 3.996 . 0 0 "[ . 1 . 2 . ]" 1 1421 1 78 THR MG 1 81 PHE H 5.160 . 5.160 4.823 4.613 5.024 . 0 0 "[ . 1 . 2 . ]" 1 1422 1 78 THR MG 1 81 PHE QD 3.560 . 3.560 2.773 2.247 3.293 . 0 0 "[ . 1 . 2 . ]" 1 1423 1 78 THR MG 1 81 PHE QE 4.690 . 4.690 3.886 3.033 4.489 . 0 0 "[ . 1 . 2 . ]" 1 1424 1 78 THR MG 1 82 LYS H 4.960 . 4.960 4.258 3.825 4.761 . 0 0 "[ . 1 . 2 . ]" 1 1425 1 78 THR MG 1 82 LYS QE 4.100 . 4.100 2.580 1.864 4.133 0.033 11 0 "[ . 1 . 2 . ]" 1 1426 1 78 THR MG 1 120 PHE QE 5.380 . 5.380 3.881 3.141 5.260 . 0 0 "[ . 1 . 2 . ]" 1 1427 1 78 THR MG 1 120 PHE HZ 5.500 . 5.500 4.432 3.532 5.505 0.005 9 0 "[ . 1 . 2 . ]" 1 1428 1 78 THR MG 1 134 LEU MD1 4.610 . 4.610 3.595 3.032 4.332 . 0 0 "[ . 1 . 2 . ]" 1 1429 1 78 THR MG 1 134 LEU MD2 4.610 . 4.610 3.456 3.039 4.423 . 0 0 "[ . 1 . 2 . ]" 1 1430 1 78 THR MG 1 135 LYS H 4.210 . 4.210 2.631 2.070 3.649 . 0 0 "[ . 1 . 2 . ]" 1 1431 1 79 GLU H 1 79 GLU HA 2.880 . 2.880 2.805 2.766 2.857 . 0 0 "[ . 1 . 2 . ]" 1 1432 1 79 GLU H 1 79 GLU QB 2.530 . 2.530 2.271 2.084 2.493 . 0 0 "[ . 1 . 2 . ]" 1 1433 1 79 GLU H 1 79 GLU QG 3.860 . 3.860 3.228 2.086 3.943 0.083 9 0 "[ . 1 . 2 . ]" 1 1434 1 79 GLU H 1 80 GLU H 2.990 . 2.990 2.720 2.561 2.833 . 0 0 "[ . 1 . 2 . ]" 1 1435 1 79 GLU H 1 80 GLU QG 5.080 . 5.080 4.467 4.194 4.858 . 0 0 "[ . 1 . 2 . ]" 1 1436 1 79 GLU H 1 81 PHE H 4.110 . 4.110 3.969 3.810 4.108 . 0 0 "[ . 1 . 2 . ]" 1 1437 1 79 GLU H 1 81 PHE QB 4.790 . 4.790 4.416 4.270 4.616 . 0 0 "[ . 1 . 2 . ]" 1 1438 1 79 GLU H 1 82 LYS QD 5.500 . 5.500 5.277 4.060 5.561 0.061 16 0 "[ . 1 . 2 . ]" 1 1439 1 79 GLU H 1 134 LEU MD1 5.500 . 5.500 4.887 4.632 5.197 . 0 0 "[ . 1 . 2 . ]" 1 1440 1 79 GLU H 1 134 LEU QD 5.440 . 5.440 4.568 4.348 4.877 . 0 0 "[ . 1 . 2 . ]" 1 1441 1 79 GLU HA 1 79 GLU QG 3.590 . 3.590 2.607 2.287 2.988 . 0 0 "[ . 1 . 2 . ]" 1 1442 1 79 GLU HA 1 82 LYS H 4.980 . 4.980 3.585 3.310 3.785 . 0 0 "[ . 1 . 2 . ]" 1 1443 1 79 GLU HA 1 82 LYS QD 4.810 . 4.810 3.411 2.272 4.115 . 0 0 "[ . 1 . 2 . ]" 1 1444 1 79 GLU HA 1 82 LYS HG2 4.520 . 4.520 2.536 2.084 2.852 . 0 0 "[ . 1 . 2 . ]" 1 1445 1 79 GLU HA 1 83 GLN H 5.010 . 5.010 3.932 3.718 4.336 . 0 0 "[ . 1 . 2 . ]" 1 1446 1 79 GLU QB 1 80 GLU H 3.120 . 3.120 2.334 2.137 2.710 . 0 0 "[ . 1 . 2 . ]" 1 1447 1 79 GLU QB 1 81 PHE H 5.140 . 5.140 4.527 4.349 4.709 . 0 0 "[ . 1 . 2 . ]" 1 1448 1 79 GLU QB 1 83 GLN QE 4.610 . 4.610 3.136 1.649 4.616 0.006 23 0 "[ . 1 . 2 . ]" 1 1449 1 79 GLU QG 1 80 GLU H 4.730 . 4.730 3.730 3.064 4.581 . 0 0 "[ . 1 . 2 . ]" 1 1450 1 79 GLU QG 1 83 GLN HE21 4.630 . 4.630 2.849 1.668 4.525 . 0 0 "[ . 1 . 2 . ]" 1 1451 1 79 GLU QG 1 83 GLN QE 3.970 . 3.970 2.601 1.648 3.743 . 0 0 "[ . 1 . 2 . ]" 1 1452 1 79 GLU QG 1 83 GLN HE22 4.630 . 4.630 3.092 2.359 4.046 . 0 0 "[ . 1 . 2 . ]" 1 1453 1 80 GLU H 1 80 GLU HA 2.910 . 2.910 2.783 2.759 2.822 . 0 0 "[ . 1 . 2 . ]" 1 1454 1 80 GLU H 1 80 GLU QB 2.760 . 2.760 2.468 2.256 2.583 . 0 0 "[ . 1 . 2 . ]" 1 1455 1 80 GLU H 1 80 GLU QG 2.930 . 2.930 2.279 2.114 2.507 . 0 0 "[ . 1 . 2 . ]" 1 1456 1 80 GLU H 1 81 PHE H 3.020 . 3.020 2.739 2.568 2.823 . 0 0 "[ . 1 . 2 . ]" 1 1457 1 80 GLU H 1 81 PHE QB 4.390 . 4.390 4.312 4.184 4.404 0.014 25 0 "[ . 1 . 2 . ]" 1 1458 1 80 GLU H 1 81 PHE HB3 4.750 . 4.750 4.553 4.402 4.691 . 0 0 "[ . 1 . 2 . ]" 1 1459 1 80 GLU H 1 83 GLN HB2 4.580 . 4.580 4.635 4.572 4.672 0.092 1 0 "[ . 1 . 2 . ]" 1 1460 1 80 GLU H 1 83 GLN QB 5.340 . 5.340 4.515 4.248 4.560 . 0 0 "[ . 1 . 2 . ]" 1 1461 1 80 GLU HA 1 80 GLU HG2 3.930 . 3.930 2.668 2.486 3.797 . 0 0 "[ . 1 . 2 . ]" 1 1462 1 80 GLU HA 1 80 GLU QG 3.360 . 3.360 2.527 2.377 3.334 . 0 0 "[ . 1 . 2 . ]" 1 1463 1 80 GLU HA 1 80 GLU HG3 3.930 . 3.930 3.174 2.925 3.759 . 0 0 "[ . 1 . 2 . ]" 1 1464 1 80 GLU HA 1 83 GLN H 3.690 . 3.690 3.559 3.273 3.746 0.056 19 0 "[ . 1 . 2 . ]" 1 1465 1 80 GLU HA 1 83 GLN HB2 4.810 . 4.810 2.931 2.331 3.508 . 0 0 "[ . 1 . 2 . ]" 1 1466 1 80 GLU HA 1 83 GLN QB 4.000 . 4.000 2.863 2.314 3.213 . 0 0 "[ . 1 . 2 . ]" 1 1467 1 80 GLU HA 1 83 GLN HB3 4.810 . 4.810 4.322 2.860 4.758 . 0 0 "[ . 1 . 2 . ]" 1 1468 1 80 GLU HA 1 83 GLN QG 4.850 . 4.850 4.544 3.773 4.890 0.040 11 0 "[ . 1 . 2 . ]" 1 1469 1 80 GLU HA 1 84 ASN H 3.410 . 3.410 2.719 2.418 3.083 . 0 0 "[ . 1 . 2 . ]" 1 1470 1 80 GLU HA 1 84 ASN HB2 3.740 . 3.740 3.014 2.298 3.629 . 0 0 "[ . 1 . 2 . ]" 1 1471 1 80 GLU HA 1 84 ASN HB3 5.340 . 5.340 4.650 3.963 5.373 0.033 20 0 "[ . 1 . 2 . ]" 1 1472 1 80 GLU HA 1 84 ASN HD21 4.310 . 4.310 2.893 1.776 4.076 . 0 0 "[ . 1 . 2 . ]" 1 1473 1 80 GLU HA 1 84 ASN QD 3.820 . 3.820 2.762 1.768 3.724 . 0 0 "[ . 1 . 2 . ]" 1 1474 1 80 GLU HA 1 84 ASN HD22 4.970 . 4.970 3.734 2.972 4.843 . 0 0 "[ . 1 . 2 . ]" 1 1475 1 80 GLU HA 1 85 GLY H 4.790 . 4.790 4.247 3.744 4.732 . 0 0 "[ . 1 . 2 . ]" 1 1476 1 80 GLU QB 1 81 PHE H 3.480 . 3.480 2.628 2.357 3.505 0.025 28 0 "[ . 1 . 2 . ]" 1 1477 1 80 GLU QB 1 82 LYS H 5.410 . 5.410 4.951 4.777 5.429 0.019 10 0 "[ . 1 . 2 . ]" 1 1478 1 80 GLU QB 1 84 ASN H 4.280 . 4.280 4.055 3.776 4.294 0.014 5 0 "[ . 1 . 2 . ]" 1 1479 1 80 GLU QB 1 84 ASN HD21 4.480 . 4.480 3.167 2.007 4.325 . 0 0 "[ . 1 . 2 . ]" 1 1480 1 80 GLU QB 1 84 ASN QD 4.190 . 4.190 3.099 1.988 4.207 0.017 5 0 "[ . 1 . 2 . ]" 1 1481 1 80 GLU QB 1 85 GLY H 5.400 . 5.400 4.541 3.808 5.037 . 0 0 "[ . 1 . 2 . ]" 1 1482 1 80 GLU QB 1 86 GLY H 5.330 . 5.330 3.828 3.293 4.764 . 0 0 "[ . 1 . 2 . ]" 1 1483 1 80 GLU QB 1 86 GLY QA 5.500 . 5.500 3.327 2.691 4.490 . 0 0 "[ . 1 . 2 . ]" 1 1484 1 80 GLU QG 1 81 PHE H 4.590 . 4.590 3.966 2.359 4.231 . 0 0 "[ . 1 . 2 . ]" 1 1485 1 80 GLU QG 1 84 ASN HD21 4.730 . 4.730 2.949 1.768 4.243 . 0 0 "[ . 1 . 2 . ]" 1 1486 1 80 GLU QG 1 84 ASN QD 4.060 . 4.060 2.804 1.757 4.073 0.013 20 0 "[ . 1 . 2 . ]" 1 1487 1 80 GLU QG 1 84 ASN HD22 5.500 . 5.500 3.616 2.475 5.409 . 0 0 "[ . 1 . 2 . ]" 1 1488 1 81 PHE H 1 81 PHE HB2 3.210 . 3.210 2.736 2.644 2.827 . 0 0 "[ . 1 . 2 . ]" 1 1489 1 81 PHE H 1 81 PHE QB 2.940 . 2.940 2.114 2.014 2.177 . 0 0 "[ . 1 . 2 . ]" 1 1490 1 81 PHE H 1 81 PHE HB3 3.150 . 3.150 2.202 2.069 2.301 . 0 0 "[ . 1 . 2 . ]" 1 1491 1 81 PHE H 1 81 PHE QD 4.130 . 4.130 4.057 3.942 4.122 . 0 0 "[ . 1 . 2 . ]" 1 1492 1 81 PHE H 1 82 LYS HA 5.500 . 5.500 5.390 5.272 5.488 . 0 0 "[ . 1 . 2 . ]" 1 1493 1 81 PHE H 1 82 LYS QG 4.950 . 4.950 4.166 3.777 4.318 . 0 0 "[ . 1 . 2 . ]" 1 1494 1 81 PHE H 1 83 GLN HB2 5.170 . 5.170 5.183 4.942 5.228 0.058 8 0 "[ . 1 . 2 . ]" 1 1495 1 81 PHE H 1 83 GLN QB 5.290 . 5.290 5.029 4.758 5.076 . 0 0 "[ . 1 . 2 . ]" 1 1496 1 81 PHE H 1 84 ASN HB2 5.500 . 5.500 5.305 5.000 5.550 0.050 5 0 "[ . 1 . 2 . ]" 1 1497 1 81 PHE H 1 86 GLY QA 5.500 . 5.500 4.370 3.799 5.127 . 0 0 "[ . 1 . 2 . ]" 1 1498 1 81 PHE H 1 134 LEU MD1 4.450 . 4.450 3.745 3.421 4.097 . 0 0 "[ . 1 . 2 . ]" 1 1499 1 81 PHE H 1 134 LEU QD 4.740 . 4.740 3.695 3.382 4.040 . 0 0 "[ . 1 . 2 . ]" 1 1500 1 81 PHE HA 1 81 PHE QD 3.030 . 3.030 2.684 2.506 2.863 . 0 0 "[ . 1 . 2 . ]" 1 1501 1 81 PHE HA 1 81 PHE QE 5.120 . 5.120 4.840 4.692 5.019 . 0 0 "[ . 1 . 2 . ]" 1 1502 1 81 PHE HA 1 85 GLY H 4.460 . 4.460 3.518 2.688 3.992 . 0 0 "[ . 1 . 2 . ]" 1 1503 1 81 PHE HA 1 85 GLY QA 3.910 . 3.910 3.566 2.479 3.950 0.040 14 0 "[ . 1 . 2 . ]" 1 1504 1 81 PHE HA 1 86 GLY H 3.210 . 3.210 2.036 1.722 2.474 . 0 0 "[ . 1 . 2 . ]" 1 1505 1 81 PHE HA 1 86 GLY QA 4.380 . 4.380 2.980 2.191 3.796 . 0 0 "[ . 1 . 2 . ]" 1 1506 1 81 PHE QB 1 82 LYS H 3.370 . 3.370 2.565 2.353 2.766 . 0 0 "[ . 1 . 2 . ]" 1 1507 1 81 PHE QB 1 83 GLN H 5.080 . 5.080 4.564 4.395 4.728 . 0 0 "[ . 1 . 2 . ]" 1 1508 1 81 PHE HB2 1 82 LYS H 4.280 . 4.280 3.943 3.799 4.081 . 0 0 "[ . 1 . 2 . ]" 1 1509 1 81 PHE HB2 1 86 GLY H 5.080 . 5.080 4.234 3.665 4.757 . 0 0 "[ . 1 . 2 . ]" 1 1510 1 81 PHE HB2 1 87 LYS H 5.500 . 5.500 4.585 3.766 5.196 . 0 0 "[ . 1 . 2 . ]" 1 1511 1 81 PHE HB2 1 134 LEU MD1 3.980 . 3.980 2.233 1.963 2.556 . 0 0 "[ . 1 . 2 . ]" 1 1512 1 81 PHE HB2 1 134 LEU QD 3.930 . 3.930 2.229 1.960 2.550 . 0 0 "[ . 1 . 2 . ]" 1 1513 1 81 PHE HB3 1 82 LYS H 3.750 . 3.750 2.600 2.375 2.814 . 0 0 "[ . 1 . 2 . ]" 1 1514 1 81 PHE HB3 1 82 LYS QD 5.500 . 5.500 5.063 4.369 5.551 0.051 17 0 "[ . 1 . 2 . ]" 1 1515 1 81 PHE HB3 1 134 LEU MD1 5.080 . 5.080 2.787 2.529 3.167 . 0 0 "[ . 1 . 2 . ]" 1 1516 1 81 PHE HB3 1 134 LEU QD 3.820 . 3.820 2.768 2.514 3.137 . 0 0 "[ . 1 . 2 . ]" 1 1517 1 81 PHE HB3 1 134 LEU MD2 5.080 . 5.080 4.722 4.402 5.085 0.005 9 0 "[ . 1 . 2 . ]" 1 1518 1 81 PHE QD 1 82 LYS H 3.490 . 3.490 3.212 2.932 3.421 . 0 0 "[ . 1 . 2 . ]" 1 1519 1 81 PHE QD 1 82 LYS QD 5.500 . 5.500 4.064 3.288 4.903 . 0 0 "[ . 1 . 2 . ]" 1 1520 1 81 PHE QD 1 82 LYS QE 4.730 . 4.730 3.781 2.462 4.826 0.096 1 0 "[ . 1 . 2 . ]" 1 1521 1 81 PHE QD 1 82 LYS HG2 4.190 . 4.190 3.789 3.357 4.094 . 0 0 "[ . 1 . 2 . ]" 1 1522 1 81 PHE QD 1 82 LYS HG3 5.470 . 5.470 5.247 4.960 5.456 . 0 0 "[ . 1 . 2 . ]" 1 1523 1 81 PHE QD 1 83 GLN H 5.500 . 5.500 5.318 5.146 5.502 0.002 6 0 "[ . 1 . 2 . ]" 1 1524 1 81 PHE QD 1 85 GLY H 5.500 . 5.500 5.311 4.773 5.532 0.032 15 0 "[ . 1 . 2 . ]" 1 1525 1 81 PHE QD 1 86 GLY H 4.400 . 4.400 4.008 3.236 4.411 0.011 4 0 "[ . 1 . 2 . ]" 1 1526 1 81 PHE QD 1 86 GLY QA 5.330 . 5.330 4.416 3.644 5.128 . 0 0 "[ . 1 . 2 . ]" 1 1527 1 81 PHE QD 1 87 LYS H 5.500 . 5.500 4.754 4.096 5.391 . 0 0 "[ . 1 . 2 . ]" 1 1528 1 81 PHE QD 1 88 PRO HA 4.020 . 4.020 2.651 2.242 3.166 . 0 0 "[ . 1 . 2 . ]" 1 1529 1 81 PHE QD 1 88 PRO HB3 5.090 . 5.090 3.552 3.129 4.057 . 0 0 "[ . 1 . 2 . ]" 1 1530 1 81 PHE QD 1 88 PRO HD3 4.560 . 4.560 3.973 3.605 4.335 . 0 0 "[ . 1 . 2 . ]" 1 1531 1 81 PHE QD 1 89 TYR H 5.490 . 5.490 4.883 4.624 5.103 . 0 0 "[ . 1 . 2 . ]" 1 1532 1 81 PHE QD 1 134 LEU HB2 4.240 . 4.240 3.561 3.122 3.872 . 0 0 "[ . 1 . 2 . ]" 1 1533 1 81 PHE QD 1 134 LEU HB3 4.060 . 4.060 3.257 2.844 3.956 . 0 0 "[ . 1 . 2 . ]" 1 1534 1 81 PHE QD 1 134 LEU MD1 3.440 . 3.440 3.220 2.975 3.399 . 0 0 "[ . 1 . 2 . ]" 1 1535 1 81 PHE QD 1 134 LEU QD 3.380 . 3.380 3.167 2.939 3.352 . 0 0 "[ . 1 . 2 . ]" 1 1536 1 81 PHE QD 1 134 LEU MD2 5.270 . 5.270 4.707 4.517 5.119 . 0 0 "[ . 1 . 2 . ]" 1 1537 1 81 PHE QE 1 82 LYS H 5.260 . 5.260 4.940 4.756 5.106 . 0 0 "[ . 1 . 2 . ]" 1 1538 1 81 PHE QE 1 82 LYS QD 5.500 . 5.500 4.735 3.921 5.538 0.038 17 0 "[ . 1 . 2 . ]" 1 1539 1 81 PHE QE 1 82 LYS QE 5.460 . 5.460 4.463 2.871 5.539 0.079 20 0 "[ . 1 . 2 . ]" 1 1540 1 81 PHE QE 1 88 PRO HA 3.620 . 3.620 2.826 2.236 3.239 . 0 0 "[ . 1 . 2 . ]" 1 1541 1 81 PHE QE 1 88 PRO HB2 4.260 . 4.260 3.631 3.344 3.968 . 0 0 "[ . 1 . 2 . ]" 1 1542 1 81 PHE QE 1 88 PRO HB3 3.780 . 3.780 2.196 2.042 2.461 . 0 0 "[ . 1 . 2 . ]" 1 1543 1 81 PHE QE 1 88 PRO HD3 4.590 . 4.590 4.036 3.277 4.597 0.007 9 0 "[ . 1 . 2 . ]" 1 1544 1 81 PHE QE 1 88 PRO HG3 5.030 . 5.030 4.244 3.759 4.758 . 0 0 "[ . 1 . 2 . ]" 1 1545 1 81 PHE QE 1 134 LEU HB2 4.570 . 4.570 3.817 3.520 4.088 . 0 0 "[ . 1 . 2 . ]" 1 1546 1 81 PHE QE 1 134 LEU HB3 4.970 . 4.970 4.032 3.623 4.416 . 0 0 "[ . 1 . 2 . ]" 1 1547 1 81 PHE QE 1 134 LEU MD1 4.510 . 4.510 4.391 4.038 4.549 0.039 19 0 "[ . 1 . 2 . ]" 1 1548 1 81 PHE QE 1 134 LEU QD 4.450 . 4.450 4.237 3.916 4.387 . 0 0 "[ . 1 . 2 . ]" 1 1549 1 81 PHE QE 1 135 LYS HA 4.620 . 4.620 3.968 2.937 4.577 . 0 0 "[ . 1 . 2 . ]" 1 1550 1 81 PHE QE 1 135 LYS QG 5.500 . 5.500 5.379 4.761 5.557 0.057 10 0 "[ . 1 . 2 . ]" 1 1551 1 81 PHE HZ 1 82 LYS HB3 5.500 . 5.500 5.237 4.837 5.526 0.026 18 0 "[ . 1 . 2 . ]" 1 1552 1 81 PHE HZ 1 88 PRO HA 4.640 . 4.640 4.068 3.488 4.447 . 0 0 "[ . 1 . 2 . ]" 1 1553 1 81 PHE HZ 1 88 PRO HB3 4.750 . 4.750 3.754 2.937 4.629 . 0 0 "[ . 1 . 2 . ]" 1 1554 1 81 PHE HZ 1 135 LYS HA 5.500 . 5.500 5.235 4.010 5.586 0.086 6 0 "[ . 1 . 2 . ]" 1 1555 1 82 LYS H 1 82 LYS HB2 3.690 . 3.690 3.649 3.594 3.682 . 0 0 "[ . 1 . 2 . ]" 1 1556 1 82 LYS H 1 82 LYS QB 3.150 . 3.150 2.736 2.566 2.863 . 0 0 "[ . 1 . 2 . ]" 1 1557 1 82 LYS H 1 82 LYS HB3 3.690 . 3.690 2.828 2.625 2.985 . 0 0 "[ . 1 . 2 . ]" 1 1558 1 82 LYS H 1 82 LYS QD 4.470 . 4.470 3.809 3.409 4.122 . 0 0 "[ . 1 . 2 . ]" 1 1559 1 82 LYS H 1 82 LYS QE 4.770 . 4.770 3.881 3.044 4.642 . 0 0 "[ . 1 . 2 . ]" 1 1560 1 82 LYS H 1 82 LYS HG2 4.040 . 4.040 1.943 1.775 2.045 . 0 0 "[ . 1 . 2 . ]" 1 1561 1 82 LYS H 1 82 LYS QG 3.090 . 3.090 1.927 1.766 2.030 . 0 0 "[ . 1 . 2 . ]" 1 1562 1 82 LYS H 1 82 LYS HG3 4.000 . 4.000 3.225 2.918 3.431 . 0 0 "[ . 1 . 2 . ]" 1 1563 1 82 LYS H 1 83 GLN H 2.970 . 2.970 2.420 2.325 2.503 . 0 0 "[ . 1 . 2 . ]" 1 1564 1 82 LYS H 1 83 GLN HB2 4.730 . 4.730 4.527 4.220 4.639 . 0 0 "[ . 1 . 2 . ]" 1 1565 1 82 LYS H 1 83 GLN QB 4.620 . 4.620 4.395 4.004 4.499 . 0 0 "[ . 1 . 2 . ]" 1 1566 1 82 LYS H 1 134 LEU MD1 5.460 . 5.460 4.983 4.685 5.427 . 0 0 "[ . 1 . 2 . ]" 1 1567 1 82 LYS H 1 134 LEU QD 5.440 . 5.440 4.858 4.563 5.278 . 0 0 "[ . 1 . 2 . ]" 1 1568 1 82 LYS HA 1 82 LYS HG2 3.980 . 3.980 3.682 3.628 3.742 . 0 0 "[ . 1 . 2 . ]" 1 1569 1 82 LYS HA 1 82 LYS HG3 3.980 . 3.980 3.863 3.763 3.950 . 0 0 "[ . 1 . 2 . ]" 1 1570 1 82 LYS QB 1 83 GLN H 3.730 . 3.730 3.667 3.549 3.764 0.034 20 0 "[ . 1 . 2 . ]" 1 1571 1 82 LYS HB2 1 82 LYS QE 4.840 . 4.840 3.369 2.030 4.281 . 0 0 "[ . 1 . 2 . ]" 1 1572 1 82 LYS HB2 1 83 GLN H 4.350 . 4.350 4.013 3.817 4.144 . 0 0 "[ . 1 . 2 . ]" 1 1573 1 82 LYS HB3 1 82 LYS QE 4.410 . 4.410 2.841 1.915 3.953 . 0 0 "[ . 1 . 2 . ]" 1 1574 1 82 LYS HB3 1 83 GLN H 4.350 . 4.350 4.244 4.064 4.357 0.007 20 0 "[ . 1 . 2 . ]" 1 1575 1 82 LYS QE 1 83 GLN H 5.360 . 5.360 5.077 4.471 5.416 0.056 18 0 "[ . 1 . 2 . ]" 1 1576 1 82 LYS QG 1 83 GLN H 4.300 . 4.300 2.695 2.382 3.050 . 0 0 "[ . 1 . 2 . ]" 1 1577 1 82 LYS HG3 1 83 GLN H 5.130 . 5.130 3.074 2.612 3.514 . 0 0 "[ . 1 . 2 . ]" 1 1578 1 83 GLN H 1 83 GLN HB2 3.670 . 3.670 2.363 2.196 2.447 . 0 0 "[ . 1 . 2 . ]" 1 1579 1 83 GLN H 1 83 GLN QB 2.970 . 2.970 2.331 2.135 2.413 . 0 0 "[ . 1 . 2 . ]" 1 1580 1 83 GLN H 1 83 GLN HB3 3.670 . 3.670 3.591 2.773 3.673 0.003 16 0 "[ . 1 . 2 . ]" 1 1581 1 83 GLN H 1 83 GLN HG2 4.480 . 4.480 3.815 3.599 4.449 . 0 0 "[ . 1 . 2 . ]" 1 1582 1 83 GLN H 1 83 GLN QG 3.740 . 3.740 2.762 2.529 3.819 0.079 8 0 "[ . 1 . 2 . ]" 1 1583 1 83 GLN H 1 83 GLN HG3 4.480 . 4.480 2.850 2.567 4.192 . 0 0 "[ . 1 . 2 . ]" 1 1584 1 83 GLN H 1 84 ASN HB2 5.230 . 5.230 4.847 4.707 5.073 . 0 0 "[ . 1 . 2 . ]" 1 1585 1 83 GLN H 1 84 ASN QB 5.090 . 5.090 4.681 4.553 4.886 . 0 0 "[ . 1 . 2 . ]" 1 1586 1 83 GLN H 1 85 GLY H 4.970 . 4.970 3.557 3.319 3.967 . 0 0 "[ . 1 . 2 . ]" 1 1587 1 83 GLN HA 1 83 GLN HG2 4.080 . 4.080 2.487 2.312 3.599 . 0 0 "[ . 1 . 2 . ]" 1 1588 1 83 GLN HA 1 83 GLN QG 3.510 . 3.510 2.343 2.219 2.477 . 0 0 "[ . 1 . 2 . ]" 1 1589 1 83 GLN HA 1 83 GLN HG3 4.080 . 4.080 3.014 2.382 3.210 . 0 0 "[ . 1 . 2 . ]" 1 1590 1 83 GLN QB 1 84 ASN H 3.250 . 3.250 2.385 2.142 2.568 . 0 0 "[ . 1 . 2 . ]" 1 1591 1 83 GLN QB 1 84 ASN HD21 4.650 . 4.650 4.092 2.517 4.807 0.157 8 0 "[ . 1 . 2 . ]" 1 1592 1 83 GLN QB 1 84 ASN QD 4.770 . 4.770 3.556 2.414 4.048 . 0 0 "[ . 1 . 2 . ]" 1 1593 1 83 GLN QB 1 84 ASN HD22 4.730 . 4.730 3.963 3.101 4.437 . 0 0 "[ . 1 . 2 . ]" 1 1594 1 83 GLN HB2 1 84 ASN H 3.940 . 3.940 2.490 2.301 3.221 . 0 0 "[ . 1 . 2 . ]" 1 1595 1 83 GLN HB3 1 84 ASN H 4.040 . 4.040 3.249 2.174 3.470 . 0 0 "[ . 1 . 2 . ]" 1 1596 1 83 GLN QG 1 84 ASN H 4.250 . 4.250 4.103 3.834 4.329 0.079 17 0 "[ . 1 . 2 . ]" 1 1597 1 83 GLN HG2 1 84 ASN H 4.910 . 4.910 4.879 4.051 4.936 0.026 22 0 "[ . 1 . 2 . ]" 1 1598 1 83 GLN HG3 1 84 ASN H 4.910 . 4.910 4.429 4.269 4.876 . 0 0 "[ . 1 . 2 . ]" 1 1599 1 84 ASN H 1 84 ASN HB2 3.780 . 3.780 2.492 2.373 2.574 . 0 0 "[ . 1 . 2 . ]" 1 1600 1 84 ASN H 1 84 ASN QB 3.010 . 3.010 2.454 2.343 2.527 . 0 0 "[ . 1 . 2 . ]" 1 1601 1 84 ASN H 1 84 ASN HB3 4.010 . 4.010 3.675 3.623 3.714 . 0 0 "[ . 1 . 2 . ]" 1 1602 1 84 ASN H 1 84 ASN HD21 4.900 . 4.900 3.693 2.677 4.676 . 0 0 "[ . 1 . 2 . ]" 1 1603 1 84 ASN H 1 84 ASN QD 4.220 . 4.220 3.494 2.639 4.222 0.002 8 0 "[ . 1 . 2 . ]" 1 1604 1 84 ASN H 1 84 ASN HD22 4.900 . 4.900 4.421 3.965 4.809 . 0 0 "[ . 1 . 2 . ]" 1 1605 1 84 ASN H 1 85 GLY H 2.900 . 2.900 2.196 2.020 2.394 . 0 0 "[ . 1 . 2 . ]" 1 1606 1 84 ASN H 1 85 GLY QA 4.530 . 4.530 4.148 3.936 4.325 . 0 0 "[ . 1 . 2 . ]" 1 1607 1 84 ASN H 1 86 GLY H 4.840 . 4.840 3.893 3.534 4.169 . 0 0 "[ . 1 . 2 . ]" 1 1608 1 84 ASN HA 1 84 ASN HD21 4.360 . 4.360 4.278 3.827 4.430 0.070 16 0 "[ . 1 . 2 . ]" 1 1609 1 84 ASN HA 1 84 ASN HD22 5.140 . 5.140 4.572 4.209 4.794 . 0 0 "[ . 1 . 2 . ]" 1 1610 1 84 ASN HA 1 86 GLY H 5.500 . 5.500 5.314 4.764 5.578 0.078 20 0 "[ . 1 . 2 . ]" 1 1611 1 84 ASN QB 1 84 ASN QD 2.990 . 2.990 2.126 2.047 2.211 . 0 0 "[ . 1 . 2 . ]" 1 1612 1 84 ASN QB 1 84 ASN HD22 3.430 . 3.430 3.220 3.187 3.301 . 0 0 "[ . 1 . 2 . ]" 1 1613 1 84 ASN QB 1 85 GLY H 3.520 . 3.520 2.953 2.606 3.374 . 0 0 "[ . 1 . 2 . ]" 1 1614 1 84 ASN HB2 1 84 ASN HD22 3.780 . 3.780 3.477 3.442 3.722 . 0 0 "[ . 1 . 2 . ]" 1 1615 1 84 ASN HB2 1 85 GLY H 4.260 . 4.260 3.060 2.655 3.569 . 0 0 "[ . 1 . 2 . ]" 1 1616 1 84 ASN HB2 1 86 GLY H 5.390 . 5.390 3.724 3.045 4.349 . 0 0 "[ . 1 . 2 . ]" 1 1617 1 84 ASN HB3 1 85 GLY H 4.260 . 4.260 3.914 3.522 4.190 . 0 0 "[ . 1 . 2 . ]" 1 1618 1 85 GLY H 1 85 GLY QA 2.730 . 2.730 2.250 2.205 2.341 . 0 0 "[ . 1 . 2 . ]" 1 1619 1 85 GLY H 1 86 GLY QA 5.160 . 5.160 4.143 3.902 4.327 . 0 0 "[ . 1 . 2 . ]" 1 1620 1 85 GLY QA 1 86 GLY H 3.020 . 3.020 2.579 2.335 2.749 . 0 0 "[ . 1 . 2 . ]" 1 1621 1 85 GLY HA2 1 86 GLY H 3.520 . 3.520 3.520 3.466 3.545 0.025 10 0 "[ . 1 . 2 . ]" 1 1622 1 86 GLY H 1 86 GLY QA 2.710 . 2.710 2.239 2.208 2.300 . 0 0 "[ . 1 . 2 . ]" 1 1623 1 86 GLY QA 1 87 LYS H 2.750 . 2.750 2.235 2.109 2.326 . 0 0 "[ . 1 . 2 . ]" 1 1624 1 86 GLY QA 1 87 LYS HA 4.780 . 4.780 3.919 3.867 3.964 . 0 0 "[ . 1 . 2 . ]" 1 1625 1 87 LYS H 1 87 LYS HB2 3.010 . 3.010 2.445 2.288 2.677 . 0 0 "[ . 1 . 2 . ]" 1 1626 1 87 LYS H 1 87 LYS QB 3.010 . 3.010 2.408 2.261 2.624 . 0 0 "[ . 1 . 2 . ]" 1 1627 1 87 LYS H 1 87 LYS HB3 3.770 . 3.770 3.630 3.540 3.773 0.003 4 0 "[ . 1 . 2 . ]" 1 1628 1 87 LYS H 1 87 LYS QD 3.690 . 3.690 2.594 2.022 3.765 0.075 27 0 "[ . 1 . 2 . ]" 1 1629 1 87 LYS H 1 87 LYS QE 5.500 . 5.500 4.186 2.581 5.084 . 0 0 "[ . 1 . 2 . ]" 1 1630 1 87 LYS H 1 87 LYS HG2 5.500 . 5.500 3.877 2.268 4.629 . 0 0 "[ . 1 . 2 . ]" 1 1631 1 87 LYS H 1 87 LYS QG 4.470 . 4.470 3.349 2.247 4.042 . 0 0 "[ . 1 . 2 . ]" 1 1632 1 87 LYS H 1 87 LYS HG3 5.220 . 5.220 3.840 2.435 4.456 . 0 0 "[ . 1 . 2 . ]" 1 1633 1 87 LYS H 1 88 PRO HD2 4.830 . 4.830 4.808 4.749 4.863 0.033 10 0 "[ . 1 . 2 . ]" 1 1634 1 87 LYS H 1 88 PRO QD 4.300 . 4.300 4.302 4.213 4.352 0.052 8 0 "[ . 1 . 2 . ]" 1 1635 1 87 LYS H 1 89 TYR H 5.280 . 5.280 4.665 4.413 4.886 . 0 0 "[ . 1 . 2 . ]" 1 1636 1 87 LYS HA 1 87 LYS HG2 4.250 . 4.250 3.556 2.447 3.793 . 0 0 "[ . 1 . 2 . ]" 1 1637 1 87 LYS HA 1 87 LYS QG 3.660 . 3.660 2.549 2.243 3.112 . 0 0 "[ . 1 . 2 . ]" 1 1638 1 87 LYS HA 1 87 LYS HG3 4.220 . 4.220 2.742 2.268 3.819 . 0 0 "[ . 1 . 2 . ]" 1 1639 1 87 LYS HA 1 88 PRO HD2 3.200 . 3.200 2.240 2.073 2.353 . 0 0 "[ . 1 . 2 . ]" 1 1640 1 87 LYS HA 1 88 PRO HD3 3.340 . 3.340 2.208 2.119 2.287 . 0 0 "[ . 1 . 2 . ]" 1 1641 1 87 LYS HA 1 89 TYR H 4.260 . 4.260 3.910 3.715 4.110 . 0 0 "[ . 1 . 2 . ]" 1 1642 1 87 LYS HA 1 89 TYR QE 5.110 . 5.110 4.240 3.572 4.691 . 0 0 "[ . 1 . 2 . ]" 1 1643 1 87 LYS QB 1 89 TYR H 3.360 . 3.360 2.456 2.156 2.701 . 0 0 "[ . 1 . 2 . ]" 1 1644 1 87 LYS HB2 1 88 PRO HD2 4.850 . 4.850 3.919 3.661 4.205 . 0 0 "[ . 1 . 2 . ]" 1 1645 1 87 LYS HB2 1 88 PRO HD3 5.500 . 5.500 4.833 4.712 4.970 . 0 0 "[ . 1 . 2 . ]" 1 1646 1 87 LYS HB2 1 89 TYR H 4.610 . 4.610 3.241 2.855 3.627 . 0 0 "[ . 1 . 2 . ]" 1 1647 1 87 LYS HB2 1 89 TYR QE 5.500 . 5.500 4.114 3.687 4.563 . 0 0 "[ . 1 . 2 . ]" 1 1648 1 87 LYS HB3 1 87 LYS QE 4.960 . 4.960 4.234 3.489 4.552 . 0 0 "[ . 1 . 2 . ]" 1 1649 1 87 LYS HB3 1 88 PRO HD2 4.240 . 4.240 2.456 2.101 2.887 . 0 0 "[ . 1 . 2 . ]" 1 1650 1 87 LYS HB3 1 88 PRO HD3 5.010 . 5.010 3.798 3.541 4.114 . 0 0 "[ . 1 . 2 . ]" 1 1651 1 87 LYS HB3 1 89 TYR H 3.700 . 3.700 2.556 2.186 2.833 . 0 0 "[ . 1 . 2 . ]" 1 1652 1 87 LYS HB3 1 89 TYR QD 5.260 . 5.260 2.756 2.232 3.286 . 0 0 "[ . 1 . 2 . ]" 1 1653 1 87 LYS HB3 1 89 TYR QE 5.070 . 5.070 2.814 2.372 3.327 . 0 0 "[ . 1 . 2 . ]" 1 1654 1 87 LYS QD 1 88 PRO HD2 4.580 . 4.580 4.133 2.905 4.583 0.003 14 0 "[ . 1 . 2 . ]" 1 1655 1 87 LYS QD 1 88 PRO HD3 5.340 . 5.340 4.619 3.474 5.291 . 0 0 "[ . 1 . 2 . ]" 1 1656 1 87 LYS QD 1 89 TYR QE 4.350 . 4.350 3.955 2.027 4.430 0.080 25 0 "[ . 1 . 2 . ]" 1 1657 1 87 LYS HD2 1 88 PRO HD2 5.210 . 5.210 4.527 3.162 5.246 0.036 27 0 "[ . 1 . 2 . ]" 1 1658 1 87 LYS HD3 1 88 PRO HD2 5.210 . 5.210 4.860 3.240 5.324 0.114 9 0 "[ . 1 . 2 . ]" 1 1659 1 87 LYS QE 1 89 TYR QE 4.760 . 4.760 4.362 3.260 4.769 0.009 20 0 "[ . 1 . 2 . ]" 1 1660 1 87 LYS QG 1 88 PRO HD2 4.270 . 4.270 3.166 2.668 4.289 0.019 5 0 "[ . 1 . 2 . ]" 1 1661 1 87 LYS QG 1 89 TYR H 4.580 . 4.580 4.363 4.010 4.588 0.008 6 0 "[ . 1 . 2 . ]" 1 1662 1 87 LYS QG 1 89 TYR QD 4.670 . 4.670 3.898 3.492 4.643 . 0 0 "[ . 1 . 2 . ]" 1 1663 1 87 LYS QG 1 89 TYR QE 3.690 . 3.690 2.731 2.322 3.765 0.075 12 0 "[ . 1 . 2 . ]" 1 1664 1 87 LYS HG2 1 88 PRO HD2 5.170 . 5.170 4.098 3.174 4.958 . 0 0 "[ . 1 . 2 . ]" 1 1665 1 87 LYS HG2 1 89 TYR H 5.190 . 5.190 4.887 4.429 5.244 0.054 12 0 "[ . 1 . 2 . ]" 1 1666 1 87 LYS HG2 1 89 TYR QE 5.040 . 5.040 3.147 2.492 4.994 . 0 0 "[ . 1 . 2 . ]" 1 1667 1 87 LYS HG3 1 88 PRO HD2 5.040 . 5.040 3.369 2.711 4.894 . 0 0 "[ . 1 . 2 . ]" 1 1668 1 87 LYS HG3 1 89 TYR H 5.500 . 5.500 4.927 4.582 5.235 . 0 0 "[ . 1 . 2 . ]" 1 1669 1 87 LYS HG3 1 89 TYR QE 4.310 . 4.310 3.155 2.523 4.339 0.029 27 0 "[ . 1 . 2 . ]" 1 1670 1 88 PRO HA 1 89 TYR H 3.460 . 3.460 3.158 3.036 3.250 . 0 0 "[ . 1 . 2 . ]" 1 1671 1 88 PRO HA 1 134 LEU H 5.180 . 5.180 3.953 3.666 4.295 . 0 0 "[ . 1 . 2 . ]" 1 1672 1 88 PRO HA 1 134 LEU HB2 4.540 . 4.540 2.876 2.657 3.302 . 0 0 "[ . 1 . 2 . ]" 1 1673 1 88 PRO HA 1 134 LEU MD1 3.740 . 3.740 2.901 2.603 3.249 . 0 0 "[ . 1 . 2 . ]" 1 1674 1 88 PRO HA 1 134 LEU QD 3.530 . 3.530 2.885 2.594 3.220 . 0 0 "[ . 1 . 2 . ]" 1 1675 1 88 PRO QB 1 89 TYR H 4.060 . 4.060 3.886 3.797 3.956 . 0 0 "[ . 1 . 2 . ]" 1 1676 1 88 PRO HB2 1 89 TYR HB3 4.320 . 4.320 4.130 3.847 4.307 . 0 0 "[ . 1 . 2 . ]" 1 1677 1 88 PRO HB2 1 89 TYR QD 4.350 . 4.350 4.157 3.859 4.370 0.020 15 0 "[ . 1 . 2 . ]" 1 1678 1 88 PRO HB2 1 134 LEU H 5.500 . 5.500 4.010 3.687 4.350 . 0 0 "[ . 1 . 2 . ]" 1 1679 1 88 PRO HB3 1 89 TYR QD 5.370 . 5.370 4.877 4.588 5.170 . 0 0 "[ . 1 . 2 . ]" 1 1680 1 88 PRO QD 1 89 TYR H 3.890 . 3.890 3.219 2.968 3.475 . 0 0 "[ . 1 . 2 . ]" 1 1681 1 88 PRO HD2 1 89 TYR H 4.240 . 4.240 3.334 3.051 3.635 . 0 0 "[ . 1 . 2 . ]" 1 1682 1 88 PRO HD2 1 89 TYR QD 3.460 . 3.460 2.433 2.141 2.940 . 0 0 "[ . 1 . 2 . ]" 1 1683 1 88 PRO HD2 1 89 TYR QE 3.640 . 3.640 2.968 2.496 3.451 . 0 0 "[ . 1 . 2 . ]" 1 1684 1 88 PRO HD3 1 89 TYR H 4.720 . 4.720 4.251 4.068 4.430 . 0 0 "[ . 1 . 2 . ]" 1 1685 1 88 PRO HD3 1 89 TYR QD 4.790 . 4.790 4.012 3.764 4.449 . 0 0 "[ . 1 . 2 . ]" 1 1686 1 88 PRO HD3 1 89 TYR QE 5.330 . 5.330 4.622 4.160 5.177 . 0 0 "[ . 1 . 2 . ]" 1 1687 1 88 PRO QG 1 89 TYR H 4.620 . 4.620 3.589 3.350 3.841 . 0 0 "[ . 1 . 2 . ]" 1 1688 1 88 PRO HG2 1 89 TYR H 4.670 . 4.670 3.689 3.430 3.968 . 0 0 "[ . 1 . 2 . ]" 1 1689 1 88 PRO HG2 1 89 TYR QD 3.190 . 3.190 2.301 2.094 2.580 . 0 0 "[ . 1 . 2 . ]" 1 1690 1 88 PRO HG2 1 89 TYR QE 4.420 . 4.420 4.056 3.685 4.435 0.015 15 0 "[ . 1 . 2 . ]" 1 1691 1 88 PRO HG3 1 89 TYR H 5.500 . 5.500 4.913 4.687 5.124 . 0 0 "[ . 1 . 2 . ]" 1 1692 1 88 PRO HG3 1 89 TYR HB3 5.500 . 5.500 5.137 4.844 5.388 . 0 0 "[ . 1 . 2 . ]" 1 1693 1 88 PRO HG3 1 89 TYR QD 4.410 . 4.410 3.846 3.665 4.135 . 0 0 "[ . 1 . 2 . ]" 1 1694 1 89 TYR H 1 89 TYR QB 3.560 . 3.560 3.164 3.083 3.229 . 0 0 "[ . 1 . 2 . ]" 1 1695 1 89 TYR H 1 89 TYR HB3 4.020 . 4.020 3.332 3.222 3.433 . 0 0 "[ . 1 . 2 . ]" 1 1696 1 89 TYR H 1 89 TYR QD 3.480 . 3.480 2.809 2.318 3.350 . 0 0 "[ . 1 . 2 . ]" 1 1697 1 89 TYR H 1 89 TYR QE 4.870 . 4.870 4.402 4.174 4.649 . 0 0 "[ . 1 . 2 . ]" 1 1698 1 89 TYR H 1 90 LEU H 4.460 . 4.460 4.287 4.190 4.341 . 0 0 "[ . 1 . 2 . ]" 1 1699 1 89 TYR H 1 90 LEU QD 5.440 . 5.440 5.091 3.759 5.488 0.048 13 0 "[ . 1 . 2 . ]" 1 1700 1 89 TYR H 1 134 LEU QB 5.370 . 5.370 4.211 3.834 4.457 . 0 0 "[ . 1 . 2 . ]" 1 1701 1 89 TYR H 1 134 LEU MD1 4.750 . 4.750 3.044 2.876 3.313 . 0 0 "[ . 1 . 2 . ]" 1 1702 1 89 TYR H 1 134 LEU QD 3.600 . 3.600 3.009 2.846 3.260 . 0 0 "[ . 1 . 2 . ]" 1 1703 1 89 TYR H 1 134 LEU MD2 5.310 . 5.310 4.728 4.451 5.134 . 0 0 "[ . 1 . 2 . ]" 1 1704 1 89 TYR H 1 134 LEU HG 4.960 . 4.960 3.413 3.109 3.847 . 0 0 "[ . 1 . 2 . ]" 1 1705 1 89 TYR HA 1 89 TYR QD 3.770 . 3.770 3.753 3.708 3.772 0.002 2 0 "[ . 1 . 2 . ]" 1 1706 1 89 TYR HA 1 90 LEU H 3.260 . 3.260 2.336 2.245 2.414 . 0 0 "[ . 1 . 2 . ]" 1 1707 1 89 TYR HA 1 90 LEU HA 4.970 . 4.970 4.488 4.430 4.553 . 0 0 "[ . 1 . 2 . ]" 1 1708 1 89 TYR HA 1 133 MET HA 3.480 . 3.480 2.232 1.940 2.471 . 0 0 "[ . 1 . 2 . ]" 1 1709 1 89 TYR HA 1 133 MET QB 5.170 . 5.170 4.196 3.802 4.434 . 0 0 "[ . 1 . 2 . ]" 1 1710 1 89 TYR HA 1 133 MET ME 4.410 . 4.410 3.530 2.984 4.426 0.016 20 0 "[ . 1 . 2 . ]" 1 1711 1 89 TYR HA 1 134 LEU H 3.360 . 3.360 2.468 2.094 2.738 . 0 0 "[ . 1 . 2 . ]" 1 1712 1 89 TYR HA 1 134 LEU HB2 4.850 . 4.850 3.968 3.689 4.272 . 0 0 "[ . 1 . 2 . ]" 1 1713 1 89 TYR HA 1 134 LEU MD1 4.230 . 4.230 3.667 3.428 3.968 . 0 0 "[ . 1 . 2 . ]" 1 1714 1 89 TYR HA 1 134 LEU MD2 4.230 . 4.230 3.646 3.357 3.944 . 0 0 "[ . 1 . 2 . ]" 1 1715 1 89 TYR HA 1 134 LEU HG 4.320 . 4.320 2.355 2.151 2.680 . 0 0 "[ . 1 . 2 . ]" 1 1716 1 89 TYR QB 1 90 LEU H 3.440 . 3.440 2.387 2.230 2.713 . 0 0 "[ . 1 . 2 . ]" 1 1717 1 89 TYR QB 1 133 MET H 5.330 . 5.330 4.708 4.505 4.874 . 0 0 "[ . 1 . 2 . ]" 1 1718 1 89 TYR QB 1 134 LEU H 4.020 . 4.020 3.781 3.528 3.941 . 0 0 "[ . 1 . 2 . ]" 1 1719 1 89 TYR HB2 1 90 LEU H 3.590 . 3.590 2.414 2.251 2.760 . 0 0 "[ . 1 . 2 . ]" 1 1720 1 89 TYR HB2 1 90 LEU HA 5.170 . 5.170 4.332 4.167 4.575 . 0 0 "[ . 1 . 2 . ]" 1 1721 1 89 TYR HB2 1 91 SER H 5.500 . 5.500 4.998 4.663 5.390 . 0 0 "[ . 1 . 2 . ]" 1 1722 1 89 TYR HB2 1 131 LYS QE 5.340 . 5.340 3.257 2.743 4.473 . 0 0 "[ . 1 . 2 . ]" 1 1723 1 89 TYR HB2 1 131 LYS QG 4.080 . 4.080 2.935 2.390 3.609 . 0 0 "[ . 1 . 2 . ]" 1 1724 1 89 TYR HB2 1 132 VAL H 5.500 . 5.500 4.166 3.757 4.437 . 0 0 "[ . 1 . 2 . ]" 1 1725 1 89 TYR HB2 1 133 MET HA 4.080 . 4.080 3.189 2.802 3.456 . 0 0 "[ . 1 . 2 . ]" 1 1726 1 89 TYR HB2 1 133 MET ME 3.330 . 3.330 2.757 2.059 3.292 . 0 0 "[ . 1 . 2 . ]" 1 1727 1 89 TYR HB2 1 134 LEU H 4.780 . 4.780 4.559 4.179 4.773 . 0 0 "[ . 1 . 2 . ]" 1 1728 1 89 TYR HB3 1 90 LEU H 4.250 . 4.250 3.756 3.642 3.992 . 0 0 "[ . 1 . 2 . ]" 1 1729 1 89 TYR HB3 1 131 LYS QE 5.340 . 5.340 3.711 2.884 5.354 0.014 8 0 "[ . 1 . 2 . ]" 1 1730 1 89 TYR HB3 1 133 MET HA 4.040 . 4.040 3.057 2.886 3.288 . 0 0 "[ . 1 . 2 . ]" 1 1731 1 89 TYR HB3 1 133 MET ME 3.590 . 3.590 2.253 1.858 2.804 . 0 0 "[ . 1 . 2 . ]" 1 1732 1 89 TYR HB3 1 134 LEU H 4.380 . 4.380 4.040 3.802 4.212 . 0 0 "[ . 1 . 2 . ]" 1 1733 1 89 TYR QD 1 90 LEU H 4.100 . 4.100 3.271 3.051 3.588 . 0 0 "[ . 1 . 2 . ]" 1 1734 1 89 TYR QD 1 90 LEU HA 4.290 . 4.290 3.432 2.840 4.116 . 0 0 "[ . 1 . 2 . ]" 1 1735 1 89 TYR QD 1 91 SER H 4.320 . 4.320 3.369 3.011 3.994 . 0 0 "[ . 1 . 2 . ]" 1 1736 1 89 TYR QD 1 91 SER HA 4.740 . 4.740 4.042 3.593 4.414 . 0 0 "[ . 1 . 2 . ]" 1 1737 1 89 TYR QD 1 91 SER QB 5.340 . 5.340 3.666 2.525 4.393 . 0 0 "[ . 1 . 2 . ]" 1 1738 1 89 TYR QD 1 131 LYS QE 4.880 . 4.880 2.743 2.239 3.441 . 0 0 "[ . 1 . 2 . ]" 1 1739 1 89 TYR QD 1 131 LYS QG 3.850 . 3.850 2.805 2.100 3.863 0.013 12 0 "[ . 1 . 2 . ]" 1 1740 1 89 TYR QD 1 133 MET HA 4.840 . 4.840 4.826 4.644 4.895 0.055 12 0 "[ . 1 . 2 . ]" 1 1741 1 89 TYR QD 1 133 MET ME 3.670 . 3.670 3.381 2.943 3.689 0.019 9 0 "[ . 1 . 2 . ]" 1 1742 1 89 TYR QE 1 90 LEU HA 5.500 . 5.500 4.578 4.185 5.041 . 0 0 "[ . 1 . 2 . ]" 1 1743 1 89 TYR QE 1 91 SER H 4.930 . 4.930 4.005 3.448 4.493 . 0 0 "[ . 1 . 2 . ]" 1 1744 1 89 TYR QE 1 91 SER QB 5.020 . 5.020 3.581 2.351 4.429 . 0 0 "[ . 1 . 2 . ]" 1 1745 1 89 TYR QE 1 131 LYS HE2 4.530 . 4.530 4.135 2.630 4.593 0.063 7 0 "[ . 1 . 2 . ]" 1 1746 1 89 TYR QE 1 131 LYS QE 5.330 . 5.330 3.213 2.594 3.808 . 0 0 "[ . 1 . 2 . ]" 1 1747 1 89 TYR QE 1 131 LYS HE3 4.530 . 4.530 3.600 2.638 4.569 0.039 1 0 "[ . 1 . 2 . ]" 1 1748 1 89 TYR QE 1 131 LYS QG 5.280 . 5.280 4.176 3.465 5.272 . 0 0 "[ . 1 . 2 . ]" 1 1749 1 89 TYR QE 1 133 MET ME 4.960 . 4.960 4.849 4.450 5.039 0.079 5 0 "[ . 1 . 2 . ]" 1 1750 1 90 LEU H 1 90 LEU HB2 3.950 . 3.950 3.007 2.644 3.315 . 0 0 "[ . 1 . 2 . ]" 1 1751 1 90 LEU H 1 90 LEU QB 3.490 . 3.490 2.641 2.497 2.739 . 0 0 "[ . 1 . 2 . ]" 1 1752 1 90 LEU H 1 90 LEU HB3 3.950 . 3.950 3.115 2.730 3.749 . 0 0 "[ . 1 . 2 . ]" 1 1753 1 90 LEU H 1 90 LEU MD1 5.130 . 5.130 4.371 3.266 4.748 . 0 0 "[ . 1 . 2 . ]" 1 1754 1 90 LEU H 1 90 LEU QD 4.200 . 4.200 3.918 3.212 4.047 . 0 0 "[ . 1 . 2 . ]" 1 1755 1 90 LEU H 1 90 LEU MD2 5.130 . 5.130 4.482 4.134 4.755 . 0 0 "[ . 1 . 2 . ]" 1 1756 1 90 LEU H 1 90 LEU HG 5.120 . 5.120 4.373 3.470 4.827 . 0 0 "[ . 1 . 2 . ]" 1 1757 1 90 LEU H 1 91 SER H 4.470 . 4.470 4.021 3.810 4.271 . 0 0 "[ . 1 . 2 . ]" 1 1758 1 90 LEU H 1 132 VAL H 4.200 . 4.200 3.154 2.816 3.395 . 0 0 "[ . 1 . 2 . ]" 1 1759 1 90 LEU H 1 132 VAL HB 4.760 . 4.760 3.237 2.973 4.844 0.084 28 0 "[ . 1 . 2 . ]" 1 1760 1 90 LEU H 1 132 VAL MG1 5.500 . 5.500 4.040 3.851 4.465 . 0 0 "[ . 1 . 2 . ]" 1 1761 1 90 LEU H 1 132 VAL QG 4.250 . 4.250 3.641 2.434 3.845 . 0 0 "[ . 1 . 2 . ]" 1 1762 1 90 LEU H 1 132 VAL MG2 5.500 . 5.500 4.272 2.453 4.598 . 0 0 "[ . 1 . 2 . ]" 1 1763 1 90 LEU H 1 133 MET HA 4.210 . 4.210 3.600 3.235 3.832 . 0 0 "[ . 1 . 2 . ]" 1 1764 1 90 LEU H 1 134 LEU H 4.680 . 4.680 4.452 4.187 4.692 0.012 22 0 "[ . 1 . 2 . ]" 1 1765 1 90 LEU H 1 134 LEU QB 5.480 . 5.480 5.443 5.268 5.530 0.050 18 0 "[ . 1 . 2 . ]" 1 1766 1 90 LEU H 1 134 LEU MD1 5.210 . 5.210 4.455 4.237 4.642 . 0 0 "[ . 1 . 2 . ]" 1 1767 1 90 LEU H 1 134 LEU QD 3.820 . 3.820 3.585 3.283 3.828 0.008 1 0 "[ . 1 . 2 . ]" 1 1768 1 90 LEU H 1 134 LEU MD2 4.940 . 4.940 3.783 3.419 4.107 . 0 0 "[ . 1 . 2 . ]" 1 1769 1 90 LEU H 1 134 LEU HG 5.150 . 5.150 3.589 3.385 3.735 . 0 0 "[ . 1 . 2 . ]" 1 1770 1 90 LEU HA 1 90 LEU MD1 4.250 . 4.250 2.886 1.977 3.849 . 0 0 "[ . 1 . 2 . ]" 1 1771 1 90 LEU HA 1 90 LEU QD 3.280 . 3.280 2.189 1.968 2.917 . 0 0 "[ . 1 . 2 . ]" 1 1772 1 90 LEU HA 1 90 LEU MD2 4.250 . 4.250 3.128 1.974 3.913 . 0 0 "[ . 1 . 2 . ]" 1 1773 1 90 LEU HA 1 91 SER H 3.490 . 3.490 2.146 2.085 2.281 . 0 0 "[ . 1 . 2 . ]" 1 1774 1 90 LEU HA 1 134 LEU QD 4.680 . 4.680 4.054 3.738 4.376 . 0 0 "[ . 1 . 2 . ]" 1 1775 1 90 LEU HA 1 134 LEU MD2 4.830 . 4.830 4.568 4.244 4.857 0.027 20 0 "[ . 1 . 2 . ]" 1 1776 1 90 LEU QB 1 90 LEU QD 2.700 . 2.700 1.936 1.860 2.043 . 0 0 "[ . 1 . 2 . ]" 1 1777 1 90 LEU QB 1 132 VAL H 4.970 . 4.970 3.877 3.270 4.344 . 0 0 "[ . 1 . 2 . ]" 1 1778 1 90 LEU QB 1 132 VAL HB 4.640 . 4.640 2.807 2.028 4.697 0.057 28 0 "[ . 1 . 2 . ]" 1 1779 1 90 LEU HB2 1 132 VAL HB 5.430 . 5.430 3.851 2.440 5.535 0.105 22 0 "[ . 1 . 2 . ]" 1 1780 1 90 LEU HB3 1 132 VAL HB 5.430 . 5.430 3.193 2.044 5.114 . 0 0 "[ . 1 . 2 . ]" 1 1781 1 90 LEU QD 1 91 SER H 3.670 . 3.670 2.805 2.224 3.669 . 0 0 "[ . 1 . 2 . ]" 1 1782 1 90 LEU QD 1 91 SER QB 4.970 . 4.970 4.325 3.743 5.027 0.057 20 0 "[ . 1 . 2 . ]" 1 1783 1 90 LEU QD 1 92 VAL HA 5.440 . 5.440 4.371 3.197 5.188 . 0 0 "[ . 1 . 2 . ]" 1 1784 1 90 LEU QD 1 134 LEU MD2 2.930 . 2.930 2.602 1.854 2.975 0.045 11 0 "[ . 1 . 2 . ]" 1 1785 1 90 LEU HG 1 91 SER H 5.270 . 5.270 3.911 3.227 4.992 . 0 0 "[ . 1 . 2 . ]" 1 1786 1 91 SER H 1 92 VAL H 4.730 . 4.730 4.363 4.199 4.535 . 0 0 "[ . 1 . 2 . ]" 1 1787 1 91 SER H 1 131 LYS QE 5.500 . 5.500 5.364 4.567 5.576 0.076 19 0 "[ . 1 . 2 . ]" 1 1788 1 91 SER HA 1 92 VAL H 3.110 . 3.110 2.162 2.098 2.248 . 0 0 "[ . 1 . 2 . ]" 1 1789 1 91 SER HA 1 92 VAL HA 4.480 . 4.480 4.389 4.347 4.429 . 0 0 "[ . 1 . 2 . ]" 1 1790 1 91 SER HA 1 92 VAL HB 5.500 . 5.500 4.633 4.488 4.759 . 0 0 "[ . 1 . 2 . ]" 1 1791 1 91 SER HA 1 92 VAL QG 4.590 . 4.590 3.511 3.296 3.701 . 0 0 "[ . 1 . 2 . ]" 1 1792 1 91 SER HA 1 93 ILE MD 5.250 . 5.250 4.381 4.122 4.842 . 0 0 "[ . 1 . 2 . ]" 1 1793 1 91 SER HA 1 131 LYS HA 3.490 . 3.490 2.082 1.862 2.441 . 0 0 "[ . 1 . 2 . ]" 1 1794 1 91 SER HA 1 131 LYS QG 4.440 . 4.440 3.097 2.699 4.277 . 0 0 "[ . 1 . 2 . ]" 1 1795 1 91 SER HA 1 132 VAL H 4.110 . 4.110 2.895 2.317 3.373 . 0 0 "[ . 1 . 2 . ]" 1 1796 1 91 SER HA 1 132 VAL QG 5.070 . 5.070 3.944 3.392 4.233 . 0 0 "[ . 1 . 2 . ]" 1 1797 1 91 SER QB 1 92 VAL H 4.280 . 4.280 3.572 3.294 3.927 . 0 0 "[ . 1 . 2 . ]" 1 1798 1 91 SER HB2 1 92 VAL H 4.770 . 4.770 4.313 4.181 4.435 . 0 0 "[ . 1 . 2 . ]" 1 1799 1 91 SER HB3 1 92 VAL H 4.770 . 4.770 3.834 3.438 4.382 . 0 0 "[ . 1 . 2 . ]" 1 1800 1 92 VAL H 1 92 VAL HB 3.760 . 3.760 2.547 2.474 2.694 . 0 0 "[ . 1 . 2 . ]" 1 1801 1 92 VAL H 1 92 VAL QG 3.740 . 3.740 2.410 2.325 2.585 . 0 0 "[ . 1 . 2 . ]" 1 1802 1 92 VAL H 1 93 ILE H 4.690 . 4.690 4.291 4.155 4.440 . 0 0 "[ . 1 . 2 . ]" 1 1803 1 92 VAL H 1 93 ILE MD 4.690 . 4.690 3.871 3.665 4.095 . 0 0 "[ . 1 . 2 . ]" 1 1804 1 92 VAL H 1 129 CYS HA 5.500 . 5.500 4.833 4.475 5.229 . 0 0 "[ . 1 . 2 . ]" 1 1805 1 92 VAL H 1 130 LEU H 4.260 . 4.260 3.641 3.262 4.048 . 0 0 "[ . 1 . 2 . ]" 1 1806 1 92 VAL H 1 130 LEU HB2 5.360 . 5.360 3.637 3.408 3.917 . 0 0 "[ . 1 . 2 . ]" 1 1807 1 92 VAL H 1 130 LEU QB 5.290 . 5.290 3.528 3.322 3.772 . 0 0 "[ . 1 . 2 . ]" 1 1808 1 92 VAL H 1 130 LEU QD 5.440 . 5.440 4.880 4.717 5.111 . 0 0 "[ . 1 . 2 . ]" 1 1809 1 92 VAL H 1 131 LYS HA 4.240 . 4.240 2.944 2.660 3.118 . 0 0 "[ . 1 . 2 . ]" 1 1810 1 92 VAL H 1 132 VAL H 5.500 . 5.500 3.590 3.385 3.865 . 0 0 "[ . 1 . 2 . ]" 1 1811 1 92 VAL H 1 132 VAL QG 4.570 . 4.570 3.389 3.102 3.514 . 0 0 "[ . 1 . 2 . ]" 1 1812 1 92 VAL HA 1 92 VAL MG1 3.480 . 3.480 2.396 2.372 2.433 . 0 0 "[ . 1 . 2 . ]" 1 1813 1 92 VAL HA 1 92 VAL QG 3.000 . 3.000 2.155 2.143 2.176 . 0 0 "[ . 1 . 2 . ]" 1 1814 1 92 VAL HA 1 92 VAL MG2 3.480 . 3.480 2.446 2.394 2.518 . 0 0 "[ . 1 . 2 . ]" 1 1815 1 92 VAL HA 1 93 ILE H 3.570 . 3.570 2.125 2.080 2.189 . 0 0 "[ . 1 . 2 . ]" 1 1816 1 92 VAL HA 1 93 ILE MD 4.820 . 4.820 3.153 2.940 3.380 . 0 0 "[ . 1 . 2 . ]" 1 1817 1 92 VAL HA 1 130 LEU H 5.500 . 5.500 4.992 4.790 5.325 . 0 0 "[ . 1 . 2 . ]" 1 1818 1 92 VAL HB 1 94 THR MG 5.500 . 5.500 3.635 3.282 4.066 . 0 0 "[ . 1 . 2 . ]" 1 1819 1 92 VAL HB 1 130 LEU H 4.130 . 4.130 3.230 2.896 3.582 . 0 0 "[ . 1 . 2 . ]" 1 1820 1 92 VAL HB 1 130 LEU HB2 4.260 . 4.260 2.350 2.206 2.689 . 0 0 "[ . 1 . 2 . ]" 1 1821 1 92 VAL HB 1 130 LEU HB3 5.240 . 5.240 3.964 3.755 4.313 . 0 0 "[ . 1 . 2 . ]" 1 1822 1 92 VAL HB 1 130 LEU QD 3.880 . 3.880 3.421 3.212 3.641 . 0 0 "[ . 1 . 2 . ]" 1 1823 1 92 VAL HB 1 132 VAL QG 4.580 . 4.580 3.321 2.970 3.524 . 0 0 "[ . 1 . 2 . ]" 1 1824 1 92 VAL QG 1 93 ILE H 4.230 . 4.230 2.856 2.505 3.002 . 0 0 "[ . 1 . 2 . ]" 1 1825 1 92 VAL QG 1 94 THR H 5.220 . 5.220 3.600 3.256 3.901 . 0 0 "[ . 1 . 2 . ]" 1 1826 1 92 VAL QG 1 94 THR MG 3.100 . 3.100 2.309 2.038 2.830 . 0 0 "[ . 1 . 2 . ]" 1 1827 1 92 VAL QG 1 115 LEU HG 4.720 . 4.720 4.640 4.424 4.745 0.025 24 0 "[ . 1 . 2 . ]" 1 1828 1 92 VAL QG 1 122 PHE HB2 5.440 . 5.440 5.253 5.110 5.441 0.001 28 0 "[ . 1 . 2 . ]" 1 1829 1 92 VAL QG 1 122 PHE HB3 5.440 . 5.440 5.331 5.194 5.458 0.018 27 0 "[ . 1 . 2 . ]" 1 1830 1 92 VAL QG 1 130 LEU H 4.490 . 4.490 3.706 3.449 3.974 . 0 0 "[ . 1 . 2 . ]" 1 1831 1 92 VAL QG 1 130 LEU HB2 4.530 . 4.530 3.174 2.999 3.434 . 0 0 "[ . 1 . 2 . ]" 1 1832 1 92 VAL QG 1 132 VAL H 4.470 . 4.470 3.536 3.332 3.696 . 0 0 "[ . 1 . 2 . ]" 1 1833 1 93 ILE H 1 93 ILE MD 4.500 . 4.500 2.321 2.108 2.622 . 0 0 "[ . 1 . 2 . ]" 1 1834 1 93 ILE H 1 93 ILE QG 4.210 . 4.210 3.598 3.453 3.825 . 0 0 "[ . 1 . 2 . ]" 1 1835 1 93 ILE H 1 94 THR MG 4.850 . 4.850 4.504 4.323 4.863 0.013 8 0 "[ . 1 . 2 . ]" 1 1836 1 93 ILE HA 1 93 ILE MD 4.370 . 4.370 3.023 2.771 3.119 . 0 0 "[ . 1 . 2 . ]" 1 1837 1 93 ILE HA 1 93 ILE MG 3.320 . 3.320 2.571 2.514 2.676 . 0 0 "[ . 1 . 2 . ]" 1 1838 1 93 ILE HA 1 94 THR H 3.160 . 3.160 2.139 2.054 2.221 . 0 0 "[ . 1 . 2 . ]" 1 1839 1 93 ILE HA 1 94 THR MG 4.240 . 4.240 3.769 3.635 3.879 . 0 0 "[ . 1 . 2 . ]" 1 1840 1 93 ILE HA 1 95 GLY H 3.880 . 3.880 3.339 3.067 3.750 . 0 0 "[ . 1 . 2 . ]" 1 1841 1 93 ILE HA 1 129 CYS HA 3.640 . 3.640 2.389 2.105 3.058 . 0 0 "[ . 1 . 2 . ]" 1 1842 1 93 ILE HA 1 130 LEU H 4.150 . 4.150 3.596 3.324 3.985 . 0 0 "[ . 1 . 2 . ]" 1 1843 1 93 ILE HA 1 130 LEU QD 5.440 . 5.440 5.330 4.795 5.488 0.048 20 0 "[ . 1 . 2 . ]" 1 1844 1 93 ILE HB 1 94 THR H 4.740 . 4.740 4.435 4.368 4.510 . 0 0 "[ . 1 . 2 . ]" 1 1845 1 93 ILE MD 1 94 THR H 5.030 . 5.030 4.795 4.568 4.874 . 0 0 "[ . 1 . 2 . ]" 1 1846 1 93 ILE MD 1 129 CYS HA 5.140 . 5.140 4.311 3.685 5.035 . 0 0 "[ . 1 . 2 . ]" 1 1847 1 93 ILE MD 1 129 CYS QB 5.210 . 5.210 3.659 2.531 4.306 . 0 0 "[ . 1 . 2 . ]" 1 1848 1 93 ILE MD 1 130 LEU H 5.500 . 5.500 4.835 4.417 5.215 . 0 0 "[ . 1 . 2 . ]" 1 1849 1 93 ILE QG 1 93 ILE MG 3.210 . 3.210 2.111 2.088 2.134 . 0 0 "[ . 1 . 2 . ]" 1 1850 1 93 ILE QG 1 95 GLY H 4.860 . 4.860 4.603 4.140 4.942 0.082 6 0 "[ . 1 . 2 . ]" 1 1851 1 93 ILE QG 1 129 CYS HA 5.340 . 5.340 3.708 3.291 4.579 . 0 0 "[ . 1 . 2 . ]" 1 1852 1 93 ILE QG 1 129 CYS QB 5.180 . 5.180 2.537 1.928 3.112 . 0 0 "[ . 1 . 2 . ]" 1 1853 1 93 ILE HG12 1 93 ILE MG 3.690 . 3.690 2.275 2.228 2.320 . 0 0 "[ . 1 . 2 . ]" 1 1854 1 93 ILE HG13 1 93 ILE MG 3.690 . 3.690 2.502 2.406 2.559 . 0 0 "[ . 1 . 2 . ]" 1 1855 1 93 ILE MG 1 94 THR H 3.790 . 3.790 3.172 2.999 3.278 . 0 0 "[ . 1 . 2 . ]" 1 1856 1 93 ILE MG 1 95 GLY H 3.030 . 3.030 2.484 2.056 2.772 . 0 0 "[ . 1 . 2 . ]" 1 1857 1 93 ILE MG 1 95 GLY QA 4.110 . 4.110 2.751 2.172 3.756 . 0 0 "[ . 1 . 2 . ]" 1 1858 1 93 ILE MG 1 129 CYS HA 5.030 . 5.030 4.031 3.710 4.494 . 0 0 "[ . 1 . 2 . ]" 1 1859 1 93 ILE MG 1 129 CYS QB 5.340 . 5.340 3.201 2.753 3.574 . 0 0 "[ . 1 . 2 . ]" 1 1860 1 94 THR H 1 94 THR HB 4.130 . 4.130 3.655 3.517 3.720 . 0 0 "[ . 1 . 2 . ]" 1 1861 1 94 THR H 1 94 THR MG 3.730 . 3.730 2.352 2.210 2.551 . 0 0 "[ . 1 . 2 . ]" 1 1862 1 94 THR H 1 95 GLY H 3.350 . 3.350 2.203 2.073 2.390 . 0 0 "[ . 1 . 2 . ]" 1 1863 1 94 THR H 1 95 GLY QA 4.570 . 4.570 4.177 3.996 4.351 . 0 0 "[ . 1 . 2 . ]" 1 1864 1 94 THR H 1 129 CYS HA 4.330 . 4.330 2.813 2.570 3.055 . 0 0 "[ . 1 . 2 . ]" 1 1865 1 94 THR H 1 130 LEU H 4.870 . 4.870 3.752 3.346 4.098 . 0 0 "[ . 1 . 2 . ]" 1 1866 1 94 THR HA 1 94 THR MG 2.990 . 2.990 2.391 2.320 2.469 . 0 0 "[ . 1 . 2 . ]" 1 1867 1 94 THR HA 1 107 ILE HB 4.110 . 4.110 3.717 3.383 4.016 . 0 0 "[ . 1 . 2 . ]" 1 1868 1 94 THR HA 1 107 ILE MD 4.250 . 4.250 3.394 2.848 3.916 . 0 0 "[ . 1 . 2 . ]" 1 1869 1 94 THR HA 1 107 ILE MG 3.660 . 3.660 2.731 2.277 3.161 . 0 0 "[ . 1 . 2 . ]" 1 1870 1 94 THR HB 1 95 GLY H 4.450 . 4.450 4.036 3.596 4.240 . 0 0 "[ . 1 . 2 . ]" 1 1871 1 94 THR HB 1 105 ALA MB 5.500 . 5.500 4.297 2.937 5.598 0.098 13 0 "[ . 1 . 2 . ]" 1 1872 1 94 THR HB 1 107 ILE H 4.760 . 4.760 4.352 4.059 4.674 . 0 0 "[ . 1 . 2 . ]" 1 1873 1 94 THR HB 1 107 ILE MD 3.980 . 3.980 3.385 3.075 3.814 . 0 0 "[ . 1 . 2 . ]" 1 1874 1 94 THR HB 1 107 ILE MG 3.600 . 3.600 2.389 1.992 3.062 . 0 0 "[ . 1 . 2 . ]" 1 1875 1 94 THR HB 1 108 LYS H 4.220 . 4.220 3.237 2.843 3.837 . 0 0 "[ . 1 . 2 . ]" 1 1876 1 94 THR HB 1 108 LYS HB2 4.780 . 4.780 3.415 3.051 3.802 . 0 0 "[ . 1 . 2 . ]" 1 1877 1 94 THR HB 1 111 VAL MG2 5.220 . 5.220 4.101 3.493 5.138 . 0 0 "[ . 1 . 2 . ]" 1 1878 1 94 THR HB 1 130 LEU QD 5.440 . 5.440 4.771 4.262 5.258 . 0 0 "[ . 1 . 2 . ]" 1 1879 1 94 THR MG 1 95 GLY H 4.230 . 4.230 3.937 3.725 4.163 . 0 0 "[ . 1 . 2 . ]" 1 1880 1 94 THR MG 1 107 ILE MG 3.340 . 3.340 2.142 1.932 2.501 . 0 0 "[ . 1 . 2 . ]" 1 1881 1 94 THR MG 1 108 LYS H 3.990 . 3.990 3.713 2.999 4.035 0.045 10 0 "[ . 1 . 2 . ]" 1 1882 1 94 THR MG 1 108 LYS HA 3.540 . 3.540 2.064 1.923 2.210 . 0 0 "[ . 1 . 2 . ]" 1 1883 1 94 THR MG 1 108 LYS HB2 3.620 . 3.620 3.158 2.314 3.654 0.034 27 0 "[ . 1 . 2 . ]" 1 1884 1 94 THR MG 1 111 VAL H 5.470 . 5.470 4.167 3.785 4.696 . 0 0 "[ . 1 . 2 . ]" 1 1885 1 94 THR MG 1 111 VAL HB 4.140 . 4.140 2.690 2.195 3.423 . 0 0 "[ . 1 . 2 . ]" 1 1886 1 94 THR MG 1 129 CYS H 5.500 . 5.500 5.475 5.082 5.590 0.090 10 0 "[ . 1 . 2 . ]" 1 1887 1 94 THR MG 1 129 CYS HA 5.200 . 5.200 3.795 2.983 4.071 . 0 0 "[ . 1 . 2 . ]" 1 1888 1 94 THR MG 1 130 LEU H 4.390 . 4.390 3.474 3.096 3.761 . 0 0 "[ . 1 . 2 . ]" 1 1889 1 94 THR MG 1 130 LEU QD 3.610 . 3.610 2.616 2.180 2.991 . 0 0 "[ . 1 . 2 . ]" 1 1890 1 94 THR MG 1 130 LEU HG 4.510 . 4.510 3.031 2.585 4.540 0.030 23 0 "[ . 1 . 2 . ]" 1 1891 1 95 GLY H 1 128 GLY HA2 4.950 . 4.950 3.473 2.645 4.560 . 0 0 "[ . 1 . 2 . ]" 1 1892 1 95 GLY H 1 129 CYS HA 5.500 . 5.500 4.157 3.818 4.678 . 0 0 "[ . 1 . 2 . ]" 1 1893 1 95 GLY H 1 129 CYS QB 4.290 . 4.290 4.361 4.173 4.457 0.167 6 0 "[ . 1 . 2 . ]" 1 1894 1 95 GLY QA 1 128 GLY HA2 5.340 . 5.340 4.246 2.892 5.403 0.063 8 0 "[ . 1 . 2 . ]" 1 1895 1 96 ARG H 1 96 ARG QG 4.760 . 4.760 3.173 1.893 4.601 . 0 0 "[ . 1 . 2 . ]" 1 1896 1 96 ARG HA 1 96 ARG QD 4.580 . 4.580 3.779 2.025 4.529 . 0 0 "[ . 1 . 2 . ]" 1 1897 1 96 ARG HA 1 96 ARG HG2 4.180 . 4.180 3.085 2.342 3.788 . 0 0 "[ . 1 . 2 . ]" 1 1898 1 96 ARG HA 1 96 ARG QG 3.560 . 3.560 2.686 2.275 3.381 . 0 0 "[ . 1 . 2 . ]" 1 1899 1 96 ARG HA 1 96 ARG HG3 4.180 . 4.180 3.152 2.460 3.886 . 0 0 "[ . 1 . 2 . ]" 1 1900 1 96 ARG HA 1 97 GLY QA 5.430 . 5.430 3.998 3.703 4.458 . 0 0 "[ . 1 . 2 . ]" 1 1901 1 96 ARG HA 1 98 ASN H 5.500 . 5.500 4.131 2.751 5.499 . 0 0 "[ . 1 . 2 . ]" 1 1902 1 96 ARG QB 1 97 GLY QA 4.640 . 4.640 4.104 3.428 4.548 . 0 0 "[ . 1 . 2 . ]" 1 1903 1 96 ARG QB 1 98 ASN H 5.340 . 5.340 4.572 2.802 5.468 0.128 5 0 "[ . 1 . 2 . ]" 1 1904 1 96 ARG QG 1 98 ASN H 5.340 . 5.340 5.061 2.627 5.440 0.100 27 0 "[ . 1 . 2 . ]" 1 1905 1 97 GLY H 1 98 ASN H 4.190 . 4.190 2.818 1.566 4.275 0.085 20 0 "[ . 1 . 2 . ]" 1 1906 1 97 GLY QA 1 98 ASN H 2.890 . 2.890 2.441 1.954 2.825 . 0 0 "[ . 1 . 2 . ]" 1 1907 1 97 GLY QA 1 105 ALA MB 5.040 . 5.040 3.072 1.751 5.200 0.160 7 0 "[ . 1 . 2 . ]" 1 1908 1 97 GLY QA 1 128 GLY H 5.500 . 5.500 4.862 3.007 5.704 0.204 12 0 "[ . 1 . 2 . ]" 1 1909 1 98 ASN H 1 98 ASN HB2 3.970 . 3.970 2.850 2.350 4.016 0.046 1 0 "[ . 1 . 2 . ]" 1 1910 1 98 ASN H 1 98 ASN QB 3.160 . 3.160 2.545 2.164 3.212 0.052 16 0 "[ . 1 . 2 . ]" 1 1911 1 98 ASN H 1 98 ASN HB3 3.970 . 3.970 3.073 2.446 3.860 . 0 0 "[ . 1 . 2 . ]" 1 1912 1 98 ASN H 1 105 ALA MB 4.680 . 4.680 4.193 2.197 4.849 0.169 5 0 "[ . 1 . 2 . ]" 1 1913 1 98 ASN QB 1 99 HIS H 4.090 . 4.090 3.492 2.288 3.957 . 0 0 "[ . 1 . 2 . ]" 1 1914 1 98 ASN HB2 1 99 HIS H 4.670 . 4.670 4.129 2.311 4.543 . 0 0 "[ . 1 . 2 . ]" 1 1915 1 98 ASN HB3 1 99 HIS H 4.670 . 4.670 3.866 2.667 4.407 . 0 0 "[ . 1 . 2 . ]" 1 1916 1 99 HIS H 1 99 HIS HD2 5.500 . 5.500 4.593 1.787 5.568 0.068 16 0 "[ . 1 . 2 . ]" 1 1917 1 99 HIS HA 1 99 HIS HD2 4.370 . 4.370 3.699 2.329 4.452 0.082 20 0 "[ . 1 . 2 . ]" 1 1918 1 99 HIS HA 1 127 PRO HA 3.840 . 3.840 3.363 2.055 4.046 0.206 28 0 "[ . 1 . 2 . ]" 1 1919 1 99 HIS HA 1 127 PRO HB2 5.500 . 5.500 5.342 3.795 5.723 0.223 16 0 "[ . 1 . 2 . ]" 1 1920 1 99 HIS HA 1 127 PRO HB3 4.690 . 4.690 4.060 2.345 4.749 0.059 12 0 "[ . 1 . 2 . ]" 1 1921 1 99 HIS QB 1 99 HIS HD2 3.490 . 3.490 2.862 2.473 3.297 . 0 0 "[ . 1 . 2 . ]" 1 1922 1 99 HIS HD2 1 100 SER QB 5.500 . 5.500 4.300 2.053 5.604 0.104 27 0 "[ . 1 . 2 . ]" 1 1923 1 100 SER HA 1 101 GLN QB 5.340 . 5.340 4.832 4.033 5.391 0.051 9 0 "[ . 1 . 2 . ]" 1 1924 1 100 SER QB 1 101 GLN H 4.370 . 4.370 2.939 1.950 3.935 . 0 0 "[ . 1 . 2 . ]" 1 1925 1 101 GLN H 1 101 GLN HB2 4.160 . 4.160 3.021 2.368 3.794 . 0 0 "[ . 1 . 2 . ]" 1 1926 1 101 GLN H 1 101 GLN QB 3.580 . 3.580 2.523 2.184 2.975 . 0 0 "[ . 1 . 2 . ]" 1 1927 1 101 GLN H 1 101 GLN HB3 4.160 . 4.160 2.945 2.364 3.837 . 0 0 "[ . 1 . 2 . ]" 1 1928 1 101 GLN H 1 101 GLN QG 4.300 . 4.300 3.292 1.935 4.335 0.035 21 0 "[ . 1 . 2 . ]" 1 1929 1 101 GLN HA 1 101 GLN QG 3.880 . 3.880 2.829 2.415 3.571 . 0 0 "[ . 1 . 2 . ]" 1 1930 1 101 GLN QB 1 102 GLY H 4.100 . 4.100 2.969 1.834 3.950 . 0 0 "[ . 1 . 2 . ]" 1 1931 1 101 GLN HB2 1 102 GLY H 4.740 . 4.740 3.676 1.877 4.466 . 0 0 "[ . 1 . 2 . ]" 1 1932 1 101 GLN HB3 1 102 GLY H 4.740 . 4.740 3.381 1.850 4.452 . 0 0 "[ . 1 . 2 . ]" 1 1933 1 101 GLN QG 1 102 GLY H 4.700 . 4.700 3.440 1.954 4.578 . 0 0 "[ . 1 . 2 . ]" 1 1934 1 102 GLY QA 1 103 GLY H 3.430 . 3.430 2.339 2.086 2.913 . 0 0 "[ . 1 . 2 . ]" 1 1935 1 103 GLY H 1 104 VAL H 4.700 . 4.700 3.825 2.078 4.467 . 0 0 "[ . 1 . 2 . ]" 1 1936 1 103 GLY H 1 104 VAL QG 5.440 . 5.440 4.562 3.082 5.513 0.073 22 0 "[ . 1 . 2 . ]" 1 1937 1 103 GLY QA 1 104 VAL H 2.870 . 2.870 2.248 2.055 2.883 0.013 12 0 "[ . 1 . 2 . ]" 1 1938 1 103 GLY QA 1 104 VAL QG 4.020 . 4.020 3.490 3.040 3.880 . 0 0 "[ . 1 . 2 . ]" 1 1939 1 103 GLY QA 1 105 ALA H 5.500 . 5.500 4.241 3.128 5.064 . 0 0 "[ . 1 . 2 . ]" 1 1940 1 103 GLY QA 1 105 ALA MB 4.840 . 4.840 4.273 3.469 4.899 0.059 13 0 "[ . 1 . 2 . ]" 1 1941 1 103 GLY HA2 1 104 VAL H 3.550 . 3.550 2.857 2.079 3.555 0.005 20 0 "[ . 1 . 2 . ]" 1 1942 1 103 GLY HA3 1 104 VAL H 3.550 . 3.550 2.602 2.136 3.511 . 0 0 "[ . 1 . 2 . ]" 1 1943 1 104 VAL H 1 104 VAL HB 3.370 . 3.370 2.778 2.469 3.497 0.127 13 0 "[ . 1 . 2 . ]" 1 1944 1 104 VAL H 1 104 VAL MG1 3.980 . 3.980 3.291 1.908 4.026 0.046 13 0 "[ . 1 . 2 . ]" 1 1945 1 104 VAL H 1 104 VAL QG 3.040 . 3.040 2.294 1.903 2.833 . 0 0 "[ . 1 . 2 . ]" 1 1946 1 104 VAL H 1 104 VAL MG2 3.980 . 3.980 2.876 2.070 3.959 . 0 0 "[ . 1 . 2 . ]" 1 1947 1 104 VAL H 1 105 ALA H 4.210 . 4.210 3.373 2.020 4.287 0.077 21 0 "[ . 1 . 2 . ]" 1 1948 1 104 VAL H 1 105 ALA HA 5.450 . 5.450 4.957 4.137 5.645 0.195 5 0 "[ . 1 . 2 . ]" 1 1949 1 104 VAL H 1 105 ALA MB 5.060 . 5.060 4.401 3.775 4.932 . 0 0 "[ . 1 . 2 . ]" 1 1950 1 104 VAL HA 1 104 VAL MG1 3.400 . 3.400 2.681 2.383 3.263 . 0 0 "[ . 1 . 2 . ]" 1 1951 1 104 VAL HA 1 104 VAL QG 2.950 . 2.950 2.213 2.125 2.387 . 0 0 "[ . 1 . 2 . ]" 1 1952 1 104 VAL HA 1 104 VAL MG2 3.400 . 3.400 2.413 2.323 2.492 . 0 0 "[ . 1 . 2 . ]" 1 1953 1 104 VAL HA 1 105 ALA H 3.570 . 3.570 2.684 1.996 3.570 . 0 0 "[ . 1 . 2 . ]" 1 1954 1 104 VAL HA 1 105 ALA MB 4.890 . 4.890 4.269 3.970 4.868 . 0 0 "[ . 1 . 2 . ]" 1 1955 1 104 VAL HA 1 106 ARG H 5.500 . 5.500 4.534 2.639 5.556 0.056 28 0 "[ . 1 . 2 . ]" 1 1956 1 104 VAL HB 1 105 ALA H 4.740 . 4.740 3.732 1.840 4.507 . 0 0 "[ . 1 . 2 . ]" 1 1957 1 104 VAL HB 1 106 ARG H 5.500 . 5.500 4.853 3.369 5.605 0.105 3 0 "[ . 1 . 2 . ]" 1 1958 1 104 VAL QG 1 105 ALA H 3.950 . 3.950 2.986 1.898 3.523 . 0 0 "[ . 1 . 2 . ]" 1 1959 1 104 VAL QG 1 105 ALA MB 4.420 . 4.420 4.092 3.676 4.444 0.024 12 0 "[ . 1 . 2 . ]" 1 1960 1 104 VAL QG 1 106 ARG H 4.570 . 4.570 2.874 1.786 3.419 . 0 0 "[ . 1 . 2 . ]" 1 1961 1 104 VAL QG 1 106 ARG HA 4.940 . 4.940 4.157 2.979 5.056 0.116 25 0 "[ . 1 . 2 . ]" 1 1962 1 104 VAL QG 1 106 ARG HB2 5.100 . 5.100 3.654 2.360 4.521 . 0 0 "[ . 1 . 2 . ]" 1 1963 1 104 VAL QG 1 106 ARG QD 4.480 . 4.480 3.699 2.971 4.486 0.006 17 0 "[ . 1 . 2 . ]" 1 1964 1 104 VAL QG 1 106 ARG HG3 3.740 . 3.740 3.277 2.166 3.788 0.048 20 0 "[ . 1 . 2 . ]" 1 1965 1 104 VAL MG1 1 105 ALA H 4.910 . 4.910 3.208 1.908 4.304 . 0 0 "[ . 1 . 2 . ]" 1 1966 1 104 VAL MG1 1 106 ARG H 5.500 . 5.500 3.178 1.787 5.110 . 0 0 "[ . 1 . 2 . ]" 1 1967 1 104 VAL MG2 1 105 ALA H 4.910 . 4.910 3.855 3.405 4.326 . 0 0 "[ . 1 . 2 . ]" 1 1968 1 104 VAL MG2 1 106 ARG H 5.500 . 5.500 4.620 2.410 5.590 0.090 11 0 "[ . 1 . 2 . ]" 1 1969 1 105 ALA H 1 105 ALA MB 3.110 . 3.110 2.529 2.252 2.855 . 0 0 "[ . 1 . 2 . ]" 1 1970 1 105 ALA HA 1 106 ARG H 3.260 . 3.260 2.445 2.078 3.338 0.078 6 0 "[ . 1 . 2 . ]" 1 1971 1 105 ALA HA 1 106 ARG HB2 5.470 . 5.470 4.681 4.121 5.505 0.035 1 0 "[ . 1 . 2 . ]" 1 1972 1 105 ALA HA 1 107 ILE MD 5.420 . 5.420 4.538 3.631 5.452 0.032 9 0 "[ . 1 . 2 . ]" 1 1973 1 105 ALA HA 1 108 LYS H 5.090 . 5.090 4.312 3.314 5.104 0.014 20 0 "[ . 1 . 2 . ]" 1 1974 1 105 ALA HA 1 109 PRO QD 5.430 . 5.430 4.801 3.164 5.407 . 0 0 "[ . 1 . 2 . ]" 1 1975 1 105 ALA MB 1 106 ARG H 4.210 . 4.210 3.541 2.881 3.749 . 0 0 "[ . 1 . 2 . ]" 1 1976 1 105 ALA MB 1 107 ILE H 5.120 . 5.120 3.629 2.941 4.732 . 0 0 "[ . 1 . 2 . ]" 1 1977 1 105 ALA MB 1 109 PRO QD 4.640 . 4.640 3.634 2.110 4.397 . 0 0 "[ . 1 . 2 . ]" 1 1978 1 105 ALA MB 1 128 GLY HA2 5.500 . 5.500 4.469 3.428 5.372 . 0 0 "[ . 1 . 2 . ]" 1 1979 1 105 ALA MB 1 128 GLY HA3 5.500 . 5.500 5.066 4.049 5.566 0.066 5 0 "[ . 1 . 2 . ]" 1 1980 1 106 ARG H 1 106 ARG HB2 4.180 . 4.180 2.493 2.188 3.623 . 0 0 "[ . 1 . 2 . ]" 1 1981 1 106 ARG H 1 106 ARG QB 3.650 . 3.650 2.447 2.166 3.408 . 0 0 "[ . 1 . 2 . ]" 1 1982 1 106 ARG H 1 106 ARG HB3 4.180 . 4.180 3.655 3.484 4.148 . 0 0 "[ . 1 . 2 . ]" 1 1983 1 106 ARG H 1 106 ARG QD 4.800 . 4.800 3.940 3.501 4.360 . 0 0 "[ . 1 . 2 . ]" 1 1984 1 106 ARG H 1 106 ARG HG2 4.540 . 4.540 2.779 2.258 3.622 . 0 0 "[ . 1 . 2 . ]" 1 1985 1 106 ARG H 1 106 ARG QG 3.980 . 3.980 2.621 2.168 3.254 . 0 0 "[ . 1 . 2 . ]" 1 1986 1 106 ARG H 1 107 ILE H 3.870 . 3.870 2.574 1.907 3.318 . 0 0 "[ . 1 . 2 . ]" 1 1987 1 106 ARG H 1 107 ILE MD 5.500 . 5.500 4.934 4.508 5.612 0.112 6 0 "[ . 1 . 2 . ]" 1 1988 1 106 ARG HA 1 106 ARG QD 4.230 . 4.230 2.212 1.890 3.854 . 0 0 "[ . 1 . 2 . ]" 1 1989 1 106 ARG HA 1 106 ARG HG2 3.960 . 3.960 2.682 2.345 2.941 . 0 0 "[ . 1 . 2 . ]" 1 1990 1 106 ARG HA 1 106 ARG HG3 3.960 . 3.960 3.628 3.139 3.782 . 0 0 "[ . 1 . 2 . ]" 1 1991 1 106 ARG HA 1 107 ILE H 3.560 . 3.560 3.309 3.154 3.506 . 0 0 "[ . 1 . 2 . ]" 1 1992 1 106 ARG HA 1 108 LYS H 4.740 . 4.740 3.906 3.498 4.403 . 0 0 "[ . 1 . 2 . ]" 1 1993 1 106 ARG HA 1 109 PRO QD 4.130 . 4.130 2.561 2.161 2.978 . 0 0 "[ . 1 . 2 . ]" 1 1994 1 106 ARG HA 1 109 PRO HG2 3.670 . 3.670 2.480 2.191 2.896 . 0 0 "[ . 1 . 2 . ]" 1 1995 1 106 ARG HA 1 109 PRO HG3 3.670 . 3.670 2.795 2.472 3.085 . 0 0 "[ . 1 . 2 . ]" 1 1996 1 106 ARG HA 1 110 ALA H 4.670 . 4.670 4.359 4.136 4.627 . 0 0 "[ . 1 . 2 . ]" 1 1997 1 106 ARG HA 1 110 ALA MB 4.650 . 4.650 4.640 4.430 4.717 0.067 28 0 "[ . 1 . 2 . ]" 1 1998 1 106 ARG QB 1 107 ILE H 3.770 . 3.770 3.110 2.567 3.384 . 0 0 "[ . 1 . 2 . ]" 1 1999 1 106 ARG HB2 1 106 ARG QD 3.840 . 3.840 3.268 2.372 3.516 . 0 0 "[ . 1 . 2 . ]" 1 2000 1 106 ARG HB2 1 107 ILE H 3.930 . 3.930 3.269 2.633 3.584 . 0 0 "[ . 1 . 2 . ]" 1 2001 1 106 ARG HB2 1 107 ILE MD 5.500 . 5.500 5.320 4.306 5.543 0.043 19 0 "[ . 1 . 2 . ]" 1 2002 1 106 ARG HB3 1 106 ARG QD 3.650 . 3.650 2.424 2.226 2.836 . 0 0 "[ . 1 . 2 . ]" 1 2003 1 106 ARG HB3 1 107 ILE H 4.440 . 4.440 3.921 3.477 4.155 . 0 0 "[ . 1 . 2 . ]" 1 2004 1 106 ARG HB3 1 110 ALA MB 4.550 . 4.550 4.104 3.779 4.564 0.014 20 0 "[ . 1 . 2 . ]" 1 2005 1 106 ARG QD 1 107 ILE H 5.300 . 5.300 4.955 4.737 5.420 0.120 10 0 "[ . 1 . 2 . ]" 1 2006 1 106 ARG QD 1 109 PRO HG2 4.250 . 4.250 3.166 2.499 4.353 0.103 12 0 "[ . 1 . 2 . ]" 1 2007 1 106 ARG HG2 1 109 PRO HG2 4.950 . 4.950 4.787 3.571 4.997 0.047 6 0 "[ . 1 . 2 . ]" 1 2008 1 106 ARG HG2 1 109 PRO HG3 4.750 . 4.750 4.694 3.673 4.834 0.084 6 0 "[ . 1 . 2 . ]" 1 2009 1 107 ILE H 1 107 ILE HB 2.990 . 2.990 2.551 2.431 2.649 . 0 0 "[ . 1 . 2 . ]" 1 2010 1 107 ILE H 1 107 ILE MD 3.670 . 3.670 3.512 3.186 3.695 0.025 13 0 "[ . 1 . 2 . ]" 1 2011 1 107 ILE H 1 107 ILE HG12 4.000 . 4.000 3.327 3.192 3.536 . 0 0 "[ . 1 . 2 . ]" 1 2012 1 107 ILE H 1 107 ILE QG 3.060 . 3.060 2.025 1.880 2.238 . 0 0 "[ . 1 . 2 . ]" 1 2013 1 107 ILE H 1 107 ILE HG13 3.620 . 3.620 2.043 1.893 2.263 . 0 0 "[ . 1 . 2 . ]" 1 2014 1 107 ILE H 1 107 ILE MG 3.820 . 3.820 3.756 3.696 3.809 . 0 0 "[ . 1 . 2 . ]" 1 2015 1 107 ILE H 1 108 LYS H 3.370 . 3.370 2.587 2.353 2.772 . 0 0 "[ . 1 . 2 . ]" 1 2016 1 107 ILE H 1 108 LYS QB 4.680 . 4.680 4.361 4.046 4.623 . 0 0 "[ . 1 . 2 . ]" 1 2017 1 107 ILE H 1 109 PRO QD 3.820 . 3.820 3.528 3.313 3.703 . 0 0 "[ . 1 . 2 . ]" 1 2018 1 107 ILE H 1 110 ALA MB 5.300 . 5.300 4.651 4.434 4.824 . 0 0 "[ . 1 . 2 . ]" 1 2019 1 107 ILE HA 1 107 ILE MD 4.570 . 4.570 3.872 3.827 3.932 . 0 0 "[ . 1 . 2 . ]" 1 2020 1 107 ILE HA 1 107 ILE HG12 3.860 . 3.860 2.622 2.535 2.877 . 0 0 "[ . 1 . 2 . ]" 1 2021 1 107 ILE HA 1 107 ILE HG13 3.860 . 3.860 3.062 2.823 3.160 . 0 0 "[ . 1 . 2 . ]" 1 2022 1 107 ILE HA 1 107 ILE MG 3.150 . 3.150 2.384 2.340 2.441 . 0 0 "[ . 1 . 2 . ]" 1 2023 1 107 ILE HA 1 110 ALA H 3.750 . 3.750 3.767 3.650 3.842 0.092 23 0 "[ . 1 . 2 . ]" 1 2024 1 107 ILE HA 1 110 ALA MB 3.510 . 3.510 2.635 2.414 2.873 . 0 0 "[ . 1 . 2 . ]" 1 2025 1 107 ILE HA 1 111 VAL H 4.360 . 4.360 3.907 3.789 4.105 . 0 0 "[ . 1 . 2 . ]" 1 2026 1 107 ILE HA 1 111 VAL MG2 5.110 . 5.110 3.440 3.272 3.694 . 0 0 "[ . 1 . 2 . ]" 1 2027 1 107 ILE HB 1 107 ILE MD 3.590 . 3.590 2.403 2.305 2.453 . 0 0 "[ . 1 . 2 . ]" 1 2028 1 107 ILE HB 1 108 LYS H 3.510 . 3.510 2.663 2.477 2.903 . 0 0 "[ . 1 . 2 . ]" 1 2029 1 107 ILE MD 1 108 LYS H 5.310 . 5.310 4.554 4.276 4.798 . 0 0 "[ . 1 . 2 . ]" 1 2030 1 107 ILE QG 1 108 LYS H 4.550 . 4.550 3.948 3.811 4.066 . 0 0 "[ . 1 . 2 . ]" 1 2031 1 107 ILE HG12 1 107 ILE MG 3.460 . 3.460 2.350 2.232 2.397 . 0 0 "[ . 1 . 2 . ]" 1 2032 1 107 ILE HG13 1 107 ILE MG 3.490 . 3.490 3.199 3.183 3.214 . 0 0 "[ . 1 . 2 . ]" 1 2033 1 107 ILE HG13 1 108 LYS H 4.790 . 4.790 4.142 3.985 4.277 . 0 0 "[ . 1 . 2 . ]" 1 2034 1 107 ILE MG 1 108 LYS H 4.020 . 4.020 3.581 3.336 3.743 . 0 0 "[ . 1 . 2 . ]" 1 2035 1 107 ILE MG 1 108 LYS HA 4.300 . 4.300 3.492 3.260 3.682 . 0 0 "[ . 1 . 2 . ]" 1 2036 1 107 ILE MG 1 108 LYS HB2 5.180 . 5.180 4.653 4.364 4.889 . 0 0 "[ . 1 . 2 . ]" 1 2037 1 107 ILE MG 1 110 ALA H 5.080 . 5.080 4.761 4.619 4.859 . 0 0 "[ . 1 . 2 . ]" 1 2038 1 107 ILE MG 1 111 VAL H 4.450 . 4.450 3.766 3.563 3.866 . 0 0 "[ . 1 . 2 . ]" 1 2039 1 108 LYS H 1 108 LYS HB2 3.650 . 3.650 2.672 2.576 2.771 . 0 0 "[ . 1 . 2 . ]" 1 2040 1 108 LYS H 1 108 LYS HB3 3.680 . 3.680 2.438 2.334 2.577 . 0 0 "[ . 1 . 2 . ]" 1 2041 1 108 LYS H 1 108 LYS HD2 5.500 . 5.500 5.071 4.915 5.211 . 0 0 "[ . 1 . 2 . ]" 1 2042 1 108 LYS H 1 108 LYS HD3 5.500 . 5.500 4.793 4.612 5.011 . 0 0 "[ . 1 . 2 . ]" 1 2043 1 108 LYS H 1 108 LYS QG 4.680 . 4.680 3.964 3.930 4.012 . 0 0 "[ . 1 . 2 . ]" 1 2044 1 108 LYS H 1 109 PRO HA 5.500 . 5.500 5.554 5.523 5.586 0.086 6 0 "[ . 1 . 2 . ]" 1 2045 1 108 LYS H 1 109 PRO QD 3.240 . 3.240 2.224 2.148 2.328 . 0 0 "[ . 1 . 2 . ]" 1 2046 1 108 LYS H 1 109 PRO QG 4.780 . 4.780 4.047 3.899 4.209 . 0 0 "[ . 1 . 2 . ]" 1 2047 1 108 LYS H 1 110 ALA H 4.430 . 4.430 4.048 3.904 4.191 . 0 0 "[ . 1 . 2 . ]" 1 2048 1 108 LYS HA 1 108 LYS HD2 4.580 . 4.580 4.432 4.365 4.498 . 0 0 "[ . 1 . 2 . ]" 1 2049 1 108 LYS HA 1 108 LYS QG 3.400 . 3.400 2.563 2.448 2.651 . 0 0 "[ . 1 . 2 . ]" 1 2050 1 108 LYS HA 1 110 ALA H 4.550 . 4.550 4.218 4.053 4.416 . 0 0 "[ . 1 . 2 . ]" 1 2051 1 108 LYS HA 1 110 ALA MB 5.460 . 5.460 4.852 4.740 4.978 . 0 0 "[ . 1 . 2 . ]" 1 2052 1 108 LYS HA 1 111 VAL H 4.140 . 4.140 3.561 3.376 3.673 . 0 0 "[ . 1 . 2 . ]" 1 2053 1 108 LYS HA 1 111 VAL HB 3.880 . 3.880 2.811 2.605 3.199 . 0 0 "[ . 1 . 2 . ]" 1 2054 1 108 LYS HA 1 111 VAL MG1 5.280 . 5.280 4.150 3.926 4.551 . 0 0 "[ . 1 . 2 . ]" 1 2055 1 108 LYS HA 1 111 VAL MG2 5.000 . 5.000 3.682 3.414 3.973 . 0 0 "[ . 1 . 2 . ]" 1 2056 1 108 LYS HA 1 112 ILE H 4.590 . 4.590 3.833 3.664 4.005 . 0 0 "[ . 1 . 2 . ]" 1 2057 1 108 LYS HA 1 112 ILE HG13 4.800 . 4.800 3.664 3.532 3.809 . 0 0 "[ . 1 . 2 . ]" 1 2058 1 108 LYS HA 1 130 LEU MD1 4.790 . 4.790 3.040 2.727 4.758 . 0 0 "[ . 1 . 2 . ]" 1 2059 1 108 LYS HA 1 130 LEU QD 4.220 . 4.220 2.923 2.701 3.275 . 0 0 "[ . 1 . 2 . ]" 1 2060 1 108 LYS HA 1 130 LEU MD2 5.350 . 5.350 4.301 2.877 4.637 . 0 0 "[ . 1 . 2 . ]" 1 2061 1 108 LYS HB2 1 108 LYS QE 4.750 . 4.750 4.033 3.912 4.230 . 0 0 "[ . 1 . 2 . ]" 1 2062 1 108 LYS HB3 1 109 PRO QD 3.020 . 3.020 2.097 2.057 2.140 . 0 0 "[ . 1 . 2 . ]" 1 2063 1 108 LYS HD2 1 109 PRO QD 4.500 . 4.500 4.521 4.334 4.590 0.090 11 0 "[ . 1 . 2 . ]" 1 2064 1 108 LYS HD2 1 112 ILE MD 4.510 . 4.510 4.096 3.916 4.395 . 0 0 "[ . 1 . 2 . ]" 1 2065 1 108 LYS HD2 1 128 GLY HA2 5.280 . 5.280 3.416 2.294 4.565 . 0 0 "[ . 1 . 2 . ]" 1 2066 1 108 LYS HD2 1 128 GLY HA3 4.520 . 4.520 2.315 1.916 2.884 . 0 0 "[ . 1 . 2 . ]" 1 2067 1 108 LYS HD2 1 129 CYS H 5.130 . 5.130 5.069 4.645 5.259 0.129 15 0 "[ . 1 . 2 . ]" 1 2068 1 108 LYS HD2 1 130 LEU QD 5.440 . 5.440 3.645 3.163 4.667 . 0 0 "[ . 1 . 2 . ]" 1 2069 1 108 LYS HD3 1 109 PRO QD 4.600 . 4.600 3.338 3.092 3.539 . 0 0 "[ . 1 . 2 . ]" 1 2070 1 108 LYS QE 1 108 LYS QG 3.250 . 3.250 2.144 2.065 2.311 . 0 0 "[ . 1 . 2 . ]" 1 2071 1 108 LYS QE 1 112 ILE MD 3.190 . 3.190 2.155 1.832 2.594 . 0 0 "[ . 1 . 2 . ]" 1 2072 1 108 LYS QE 1 112 ILE HG13 5.340 . 5.340 4.020 3.582 4.636 . 0 0 "[ . 1 . 2 . ]" 1 2073 1 108 LYS QE 1 130 LEU QD 3.750 . 3.750 2.644 2.045 3.815 0.065 22 0 "[ . 1 . 2 . ]" 1 2074 1 108 LYS HE2 1 108 LYS QG 3.730 . 3.730 2.525 2.289 3.331 . 0 0 "[ . 1 . 2 . ]" 1 2075 1 108 LYS HE2 1 112 ILE MD 3.830 . 3.830 2.516 1.873 3.852 0.022 22 0 "[ . 1 . 2 . ]" 1 2076 1 108 LYS HE3 1 108 LYS QG 3.730 . 3.730 2.382 2.308 2.452 . 0 0 "[ . 1 . 2 . ]" 1 2077 1 108 LYS HE3 1 112 ILE MD 3.830 . 3.830 2.562 2.188 3.156 . 0 0 "[ . 1 . 2 . ]" 1 2078 1 108 LYS QG 1 109 PRO HA 4.440 . 4.440 3.408 3.276 3.659 . 0 0 "[ . 1 . 2 . ]" 1 2079 1 108 LYS QG 1 109 PRO QD 3.870 . 3.870 2.938 2.731 3.216 . 0 0 "[ . 1 . 2 . ]" 1 2080 1 108 LYS QG 1 110 ALA H 5.220 . 5.220 4.887 4.755 5.055 . 0 0 "[ . 1 . 2 . ]" 1 2081 1 108 LYS QG 1 111 VAL H 5.500 . 5.500 5.025 4.858 5.219 . 0 0 "[ . 1 . 2 . ]" 1 2082 1 108 LYS QG 1 112 ILE H 5.320 . 5.320 4.098 3.868 4.394 . 0 0 "[ . 1 . 2 . ]" 1 2083 1 108 LYS QG 1 112 ILE MD 3.200 . 3.200 2.181 2.070 2.295 . 0 0 "[ . 1 . 2 . ]" 1 2084 1 108 LYS QG 1 130 LEU MD1 4.470 . 4.470 2.641 2.233 3.521 . 0 0 "[ . 1 . 2 . ]" 1 2085 1 108 LYS QG 1 130 LEU QD 3.780 . 3.780 2.251 1.959 2.895 . 0 0 "[ . 1 . 2 . ]" 1 2086 1 108 LYS QG 1 130 LEU MD2 4.470 . 4.470 2.476 2.147 3.080 . 0 0 "[ . 1 . 2 . ]" 1 2087 1 109 PRO HA 1 111 VAL H 4.920 . 4.920 4.686 4.532 4.838 . 0 0 "[ . 1 . 2 . ]" 1 2088 1 109 PRO HA 1 112 ILE H 4.140 . 4.140 3.659 3.427 3.917 . 0 0 "[ . 1 . 2 . ]" 1 2089 1 109 PRO HA 1 112 ILE HB 3.410 . 3.410 2.716 2.372 2.982 . 0 0 "[ . 1 . 2 . ]" 1 2090 1 109 PRO HA 1 112 ILE MD 3.640 . 3.640 2.528 2.202 2.872 . 0 0 "[ . 1 . 2 . ]" 1 2091 1 109 PRO HA 1 112 ILE MG 4.340 . 4.340 3.992 3.692 4.164 . 0 0 "[ . 1 . 2 . ]" 1 2092 1 109 PRO HA 1 113 LYS H 4.830 . 4.830 4.219 3.943 4.560 . 0 0 "[ . 1 . 2 . ]" 1 2093 1 109 PRO QB 1 110 ALA H 3.490 . 3.490 3.175 3.002 3.332 . 0 0 "[ . 1 . 2 . ]" 1 2094 1 109 PRO HB2 1 110 ALA H 3.740 . 3.740 3.285 3.087 3.474 . 0 0 "[ . 1 . 2 . ]" 1 2095 1 109 PRO HB2 1 110 ALA MB 5.240 . 5.240 4.252 4.069 4.491 . 0 0 "[ . 1 . 2 . ]" 1 2096 1 109 PRO HB2 1 112 ILE MD 5.460 . 5.460 4.979 4.610 5.318 . 0 0 "[ . 1 . 2 . ]" 1 2097 1 109 PRO HB3 1 110 ALA H 4.400 . 4.400 4.209 4.104 4.291 . 0 0 "[ . 1 . 2 . ]" 1 2098 1 109 PRO QD 1 110 ALA H 3.140 . 3.140 3.002 2.811 3.148 0.008 11 0 "[ . 1 . 2 . ]" 1 2099 1 109 PRO QD 1 110 ALA MB 4.450 . 4.450 4.205 3.988 4.377 . 0 0 "[ . 1 . 2 . ]" 1 2100 1 109 PRO QD 1 112 ILE MD 4.860 . 4.860 3.978 3.771 4.207 . 0 0 "[ . 1 . 2 . ]" 1 2101 1 109 PRO QG 1 110 ALA H 3.160 . 3.160 2.593 2.485 2.861 . 0 0 "[ . 1 . 2 . ]" 1 2102 1 109 PRO HG2 1 110 ALA H 3.370 . 3.370 2.621 2.508 2.908 . 0 0 "[ . 1 . 2 . ]" 1 2103 1 109 PRO HG2 1 110 ALA MB 4.030 . 4.030 3.628 3.485 3.894 . 0 0 "[ . 1 . 2 . ]" 1 2104 1 109 PRO HG3 1 110 ALA H 4.240 . 4.240 4.124 4.034 4.252 0.012 1 0 "[ . 1 . 2 . ]" 1 2105 1 110 ALA H 1 110 ALA HA 2.900 . 2.900 2.850 2.816 2.876 . 0 0 "[ . 1 . 2 . ]" 1 2106 1 110 ALA H 1 110 ALA MB 2.400 . 2.400 2.226 2.190 2.274 . 0 0 "[ . 1 . 2 . ]" 1 2107 1 110 ALA H 1 111 VAL H 2.780 . 2.780 2.517 2.420 2.640 . 0 0 "[ . 1 . 2 . ]" 1 2108 1 110 ALA H 1 111 VAL HA 5.320 . 5.320 5.114 5.027 5.223 . 0 0 "[ . 1 . 2 . ]" 1 2109 1 110 ALA H 1 111 VAL HB 5.050 . 5.050 4.597 4.426 4.717 . 0 0 "[ . 1 . 2 . ]" 1 2110 1 110 ALA H 1 111 VAL MG2 5.310 . 5.310 4.229 4.099 4.415 . 0 0 "[ . 1 . 2 . ]" 1 2111 1 110 ALA H 1 112 ILE H 4.260 . 4.260 3.948 3.872 4.094 . 0 0 "[ . 1 . 2 . ]" 1 2112 1 110 ALA H 1 112 ILE MD 5.500 . 5.500 5.219 5.063 5.330 . 0 0 "[ . 1 . 2 . ]" 1 2113 1 110 ALA H 1 112 ILE HG13 5.500 . 5.500 5.142 5.057 5.287 . 0 0 "[ . 1 . 2 . ]" 1 2114 1 110 ALA H 1 113 LYS H 5.280 . 5.280 4.812 4.701 4.952 . 0 0 "[ . 1 . 2 . ]" 1 2115 1 110 ALA H 1 130 LEU QD 5.440 . 5.440 5.452 5.354 5.509 0.069 9 0 "[ . 1 . 2 . ]" 1 2116 1 110 ALA HA 1 112 ILE H 4.890 . 4.890 4.602 4.483 4.736 . 0 0 "[ . 1 . 2 . ]" 1 2117 1 110 ALA HA 1 112 ILE HB 5.500 . 5.500 5.295 5.053 5.519 0.019 28 0 "[ . 1 . 2 . ]" 1 2118 1 110 ALA HA 1 113 LYS H 4.090 . 4.090 3.721 3.439 3.980 . 0 0 "[ . 1 . 2 . ]" 1 2119 1 110 ALA HA 1 113 LYS HB3 3.970 . 3.970 3.017 2.626 3.459 . 0 0 "[ . 1 . 2 . ]" 1 2120 1 110 ALA HA 1 113 LYS QD 4.470 . 4.470 3.389 2.440 4.412 . 0 0 "[ . 1 . 2 . ]" 1 2121 1 110 ALA MB 1 111 VAL H 2.900 . 2.900 2.339 2.257 2.434 . 0 0 "[ . 1 . 2 . ]" 1 2122 1 110 ALA MB 1 111 VAL HA 4.400 . 4.400 3.759 3.697 3.813 . 0 0 "[ . 1 . 2 . ]" 1 2123 1 110 ALA MB 1 112 ILE H 4.950 . 4.950 4.486 4.436 4.543 . 0 0 "[ . 1 . 2 . ]" 1 2124 1 110 ALA MB 1 113 LYS H 5.080 . 5.080 4.754 4.559 4.941 . 0 0 "[ . 1 . 2 . ]" 1 2125 1 111 VAL H 1 111 VAL HB 2.840 . 2.840 2.420 2.352 2.493 . 0 0 "[ . 1 . 2 . ]" 1 2126 1 111 VAL H 1 111 VAL MG1 3.960 . 3.960 3.746 3.713 3.781 . 0 0 "[ . 1 . 2 . ]" 1 2127 1 111 VAL H 1 111 VAL MG2 3.960 . 3.960 2.299 2.247 2.393 . 0 0 "[ . 1 . 2 . ]" 1 2128 1 111 VAL H 1 112 ILE H 3.060 . 3.060 2.710 2.654 2.781 . 0 0 "[ . 1 . 2 . ]" 1 2129 1 111 VAL H 1 112 ILE HA 5.450 . 5.450 5.302 5.267 5.357 . 0 0 "[ . 1 . 2 . ]" 1 2130 1 111 VAL H 1 112 ILE HB 4.980 . 4.980 4.863 4.728 4.983 0.003 28 0 "[ . 1 . 2 . ]" 1 2131 1 111 VAL H 1 112 ILE MD 5.500 . 5.500 5.404 5.262 5.505 0.005 18 0 "[ . 1 . 2 . ]" 1 2132 1 111 VAL H 1 112 ILE QG 5.500 . 5.500 4.358 4.247 4.463 . 0 0 "[ . 1 . 2 . ]" 1 2133 1 111 VAL H 1 112 ILE HG13 5.310 . 5.310 4.475 4.353 4.589 . 0 0 "[ . 1 . 2 . ]" 1 2134 1 111 VAL H 1 113 LYS H 4.450 . 4.450 4.300 4.151 4.448 . 0 0 "[ . 1 . 2 . ]" 1 2135 1 111 VAL H 1 113 LYS HB3 5.500 . 5.500 5.042 4.682 5.405 . 0 0 "[ . 1 . 2 . ]" 1 2136 1 111 VAL H 1 114 TYR H 5.210 . 5.210 4.768 4.658 4.875 . 0 0 "[ . 1 . 2 . ]" 1 2137 1 111 VAL HA 1 111 VAL MG1 3.390 . 3.390 2.526 2.482 2.565 . 0 0 "[ . 1 . 2 . ]" 1 2138 1 111 VAL HA 1 111 VAL MG2 3.390 . 3.390 2.256 2.215 2.318 . 0 0 "[ . 1 . 2 . ]" 1 2139 1 111 VAL HA 1 113 LYS H 4.790 . 4.790 4.362 4.123 4.567 . 0 0 "[ . 1 . 2 . ]" 1 2140 1 111 VAL HA 1 114 TYR H 3.550 . 3.550 3.205 2.995 3.328 . 0 0 "[ . 1 . 2 . ]" 1 2141 1 111 VAL HA 1 114 TYR HB2 4.010 . 4.010 3.261 2.981 3.459 . 0 0 "[ . 1 . 2 . ]" 1 2142 1 111 VAL HA 1 114 TYR HB3 4.140 . 4.140 2.556 2.345 2.745 . 0 0 "[ . 1 . 2 . ]" 1 2143 1 111 VAL HA 1 114 TYR QD 4.620 . 4.620 4.357 4.114 4.557 . 0 0 "[ . 1 . 2 . ]" 1 2144 1 111 VAL HA 1 115 LEU H 4.630 . 4.630 4.240 4.154 4.353 . 0 0 "[ . 1 . 2 . ]" 1 2145 1 111 VAL HB 1 112 ILE H 3.930 . 3.930 2.806 2.725 2.933 . 0 0 "[ . 1 . 2 . ]" 1 2146 1 111 VAL HB 1 130 LEU QD 4.450 . 4.450 2.654 2.468 2.833 . 0 0 "[ . 1 . 2 . ]" 1 2147 1 111 VAL MG1 1 112 ILE H 3.990 . 3.990 3.331 3.196 3.502 . 0 0 "[ . 1 . 2 . ]" 1 2148 1 111 VAL MG1 1 112 ILE HA 4.380 . 4.380 3.431 3.257 3.590 . 0 0 "[ . 1 . 2 . ]" 1 2149 1 111 VAL MG1 1 112 ILE HG13 4.470 . 4.470 4.106 3.749 4.391 . 0 0 "[ . 1 . 2 . ]" 1 2150 1 111 VAL MG1 1 113 LYS H 5.500 . 5.500 5.046 4.875 5.156 . 0 0 "[ . 1 . 2 . ]" 1 2151 1 111 VAL MG1 1 114 TYR H 4.560 . 4.560 4.358 4.193 4.504 . 0 0 "[ . 1 . 2 . ]" 1 2152 1 111 VAL MG1 1 114 TYR HB3 4.750 . 4.750 3.334 3.041 3.558 . 0 0 "[ . 1 . 2 . ]" 1 2153 1 111 VAL MG1 1 115 LEU H 5.500 . 5.500 3.899 3.776 3.998 . 0 0 "[ . 1 . 2 . ]" 1 2154 1 111 VAL MG1 1 115 LEU MD2 3.590 . 3.590 1.915 1.862 1.955 . 0 0 "[ . 1 . 2 . ]" 1 2155 1 111 VAL MG1 1 115 LEU HG 3.960 . 3.960 3.926 3.731 4.011 0.051 27 0 "[ . 1 . 2 . ]" 1 2156 1 111 VAL MG1 1 130 LEU HB2 4.850 . 4.850 3.555 3.072 3.823 . 0 0 "[ . 1 . 2 . ]" 1 2157 1 111 VAL MG2 1 112 ILE H 4.280 . 4.280 4.014 3.953 4.102 . 0 0 "[ . 1 . 2 . ]" 1 2158 1 111 VAL MG2 1 114 TYR HB3 4.770 . 4.770 4.064 3.854 4.186 . 0 0 "[ . 1 . 2 . ]" 1 2159 1 111 VAL MG2 1 114 TYR QD 5.440 . 5.440 4.923 4.700 5.129 . 0 0 "[ . 1 . 2 . ]" 1 2160 1 111 VAL MG2 1 115 LEU H 5.500 . 5.500 5.554 5.493 5.590 0.090 22 0 "[ . 1 . 2 . ]" 1 2161 1 112 ILE H 1 112 ILE HB 2.880 . 2.880 2.540 2.447 2.624 . 0 0 "[ . 1 . 2 . ]" 1 2162 1 112 ILE H 1 112 ILE MD 3.670 . 3.670 3.647 3.595 3.684 0.014 12 0 "[ . 1 . 2 . ]" 1 2163 1 112 ILE H 1 112 ILE HG12 4.290 . 4.290 3.449 3.384 3.530 . 0 0 "[ . 1 . 2 . ]" 1 2164 1 112 ILE H 1 112 ILE QG 3.080 . 3.080 2.185 2.108 2.284 . 0 0 "[ . 1 . 2 . ]" 1 2165 1 112 ILE H 1 112 ILE HG13 3.080 . 3.080 2.209 2.130 2.313 . 0 0 "[ . 1 . 2 . ]" 1 2166 1 112 ILE H 1 112 ILE MG 3.770 . 3.770 3.782 3.764 3.795 0.025 24 0 "[ . 1 . 2 . ]" 1 2167 1 112 ILE H 1 113 LYS H 3.080 . 3.080 2.897 2.781 2.964 . 0 0 "[ . 1 . 2 . ]" 1 2168 1 112 ILE H 1 113 LYS HB3 4.970 . 4.970 4.655 4.270 5.005 0.035 23 0 "[ . 1 . 2 . ]" 1 2169 1 112 ILE H 1 114 TYR H 4.490 . 4.490 4.054 3.943 4.155 . 0 0 "[ . 1 . 2 . ]" 1 2170 1 112 ILE H 1 115 LEU H 5.250 . 5.250 4.892 4.786 4.969 . 0 0 "[ . 1 . 2 . ]" 1 2171 1 112 ILE H 1 130 LEU MD1 5.170 . 5.170 3.182 2.941 4.884 . 0 0 "[ . 1 . 2 . ]" 1 2172 1 112 ILE H 1 130 LEU QD 4.270 . 4.270 3.094 2.913 3.423 . 0 0 "[ . 1 . 2 . ]" 1 2173 1 112 ILE H 1 130 LEU MD2 5.440 . 5.440 4.764 3.495 4.960 . 0 0 "[ . 1 . 2 . ]" 1 2174 1 112 ILE HA 1 112 ILE MD 3.880 . 3.880 3.827 3.760 3.865 . 0 0 "[ . 1 . 2 . ]" 1 2175 1 112 ILE HA 1 112 ILE HG12 3.180 . 3.180 2.498 2.409 2.564 . 0 0 "[ . 1 . 2 . ]" 1 2176 1 112 ILE HA 1 112 ILE HG13 3.710 . 3.710 2.964 2.906 3.023 . 0 0 "[ . 1 . 2 . ]" 1 2177 1 112 ILE HA 1 112 ILE MG 3.120 . 3.120 2.469 2.381 2.541 . 0 0 "[ . 1 . 2 . ]" 1 2178 1 112 ILE HA 1 115 LEU H 3.780 . 3.780 3.533 3.429 3.636 . 0 0 "[ . 1 . 2 . ]" 1 2179 1 112 ILE HA 1 115 LEU HB2 4.320 . 4.320 3.012 2.840 3.166 . 0 0 "[ . 1 . 2 . ]" 1 2180 1 112 ILE HA 1 115 LEU HB3 5.180 . 5.180 4.647 4.464 4.794 . 0 0 "[ . 1 . 2 . ]" 1 2181 1 112 ILE HA 1 115 LEU MD1 5.500 . 5.500 5.200 5.029 5.419 . 0 0 "[ . 1 . 2 . ]" 1 2182 1 112 ILE HA 1 115 LEU MD2 4.340 . 4.340 2.734 2.473 3.042 . 0 0 "[ . 1 . 2 . ]" 1 2183 1 112 ILE HA 1 115 LEU HG 4.590 . 4.590 4.417 4.225 4.538 . 0 0 "[ . 1 . 2 . ]" 1 2184 1 112 ILE HA 1 116 ILE H 4.380 . 4.380 4.144 4.025 4.263 . 0 0 "[ . 1 . 2 . ]" 1 2185 1 112 ILE HA 1 122 PHE QD 4.710 . 4.710 4.493 4.235 4.633 . 0 0 "[ . 1 . 2 . ]" 1 2186 1 112 ILE HA 1 122 PHE QE 3.950 . 3.950 3.560 3.075 3.707 . 0 0 "[ . 1 . 2 . ]" 1 2187 1 112 ILE HA 1 122 PHE HZ 4.220 . 4.220 3.559 2.981 3.684 . 0 0 "[ . 1 . 2 . ]" 1 2188 1 112 ILE HA 1 130 LEU MD1 4.990 . 4.990 2.991 2.679 4.283 . 0 0 "[ . 1 . 2 . ]" 1 2189 1 112 ILE HA 1 130 LEU QD 4.110 . 4.110 2.920 2.651 3.595 . 0 0 "[ . 1 . 2 . ]" 1 2190 1 112 ILE HA 1 130 LEU MD2 4.990 . 4.990 4.295 3.862 4.596 . 0 0 "[ . 1 . 2 . ]" 1 2191 1 112 ILE HB 1 112 ILE MD 3.300 . 3.300 2.442 2.402 2.464 . 0 0 "[ . 1 . 2 . ]" 1 2192 1 112 ILE HB 1 113 LYS H 2.980 . 2.980 2.652 2.352 2.829 . 0 0 "[ . 1 . 2 . ]" 1 2193 1 112 ILE HB 1 114 TYR H 5.110 . 5.110 4.898 4.742 5.017 . 0 0 "[ . 1 . 2 . ]" 1 2194 1 112 ILE HB 1 116 ILE MG 5.400 . 5.400 5.040 4.877 5.301 . 0 0 "[ . 1 . 2 . ]" 1 2195 1 112 ILE HB 1 122 PHE QE 4.880 . 4.880 4.788 4.502 4.911 0.031 22 0 "[ . 1 . 2 . ]" 1 2196 1 112 ILE HB 1 122 PHE HZ 4.990 . 4.990 4.801 4.460 4.884 . 0 0 "[ . 1 . 2 . ]" 1 2197 1 112 ILE MD 1 112 ILE MG 3.130 . 3.130 1.927 1.844 2.017 . 0 0 "[ . 1 . 2 . ]" 1 2198 1 112 ILE MD 1 113 LYS H 4.780 . 4.780 4.666 4.371 4.798 0.018 7 0 "[ . 1 . 2 . ]" 1 2199 1 112 ILE MD 1 122 PHE QE 4.040 . 4.040 3.183 2.870 3.430 . 0 0 "[ . 1 . 2 . ]" 1 2200 1 112 ILE MD 1 130 LEU QD 3.840 . 3.840 2.503 2.212 2.665 . 0 0 "[ . 1 . 2 . ]" 1 2201 1 112 ILE HG12 1 112 ILE MG 2.970 . 2.970 2.351 2.266 2.411 . 0 0 "[ . 1 . 2 . ]" 1 2202 1 112 ILE HG12 1 122 PHE QD 4.510 . 4.510 3.941 3.676 4.234 . 0 0 "[ . 1 . 2 . ]" 1 2203 1 112 ILE HG12 1 122 PHE QE 3.100 . 3.100 2.583 2.076 2.762 . 0 0 "[ . 1 . 2 . ]" 1 2204 1 112 ILE HG12 1 122 PHE HZ 4.120 . 4.120 3.871 3.537 4.050 . 0 0 "[ . 1 . 2 . ]" 1 2205 1 112 ILE HG12 1 130 LEU QD 3.870 . 3.870 2.281 2.071 2.534 . 0 0 "[ . 1 . 2 . ]" 1 2206 1 112 ILE HG13 1 112 ILE MG 3.300 . 3.300 3.185 3.160 3.201 . 0 0 "[ . 1 . 2 . ]" 1 2207 1 112 ILE HG13 1 122 PHE QE 4.440 . 4.440 4.293 3.802 4.467 0.027 22 0 "[ . 1 . 2 . ]" 1 2208 1 112 ILE HG13 1 130 LEU HB3 5.500 . 5.500 5.471 5.354 5.518 0.018 23 0 "[ . 1 . 2 . ]" 1 2209 1 112 ILE HG13 1 130 LEU QD 3.690 . 3.690 2.226 2.129 2.394 . 0 0 "[ . 1 . 2 . ]" 1 2210 1 112 ILE MG 1 113 LYS H 3.560 . 3.560 3.290 3.024 3.439 . 0 0 "[ . 1 . 2 . ]" 1 2211 1 112 ILE MG 1 114 TYR H 5.290 . 5.290 4.763 4.676 4.844 . 0 0 "[ . 1 . 2 . ]" 1 2212 1 112 ILE MG 1 115 LEU H 5.150 . 5.150 4.687 4.593 4.778 . 0 0 "[ . 1 . 2 . ]" 1 2213 1 112 ILE MG 1 115 LEU HB2 4.220 . 4.220 4.064 3.980 4.171 . 0 0 "[ . 1 . 2 . ]" 1 2214 1 112 ILE MG 1 115 LEU HG 5.500 . 5.500 5.557 5.519 5.615 0.115 23 0 "[ . 1 . 2 . ]" 1 2215 1 112 ILE MG 1 116 ILE H 4.260 . 4.260 3.920 3.815 4.116 . 0 0 "[ . 1 . 2 . ]" 1 2216 1 112 ILE MG 1 122 PHE QD 4.940 . 4.940 4.201 4.076 4.379 . 0 0 "[ . 1 . 2 . ]" 1 2217 1 112 ILE MG 1 122 PHE QE 3.410 . 3.410 2.394 2.170 2.651 . 0 0 "[ . 1 . 2 . ]" 1 2218 1 112 ILE MG 1 122 PHE HZ 2.880 . 2.880 1.869 1.773 1.926 . 0 0 "[ . 1 . 2 . ]" 1 2219 1 113 LYS H 1 113 LYS HA 2.890 . 2.890 2.703 2.645 2.769 . 0 0 "[ . 1 . 2 . ]" 1 2220 1 113 LYS H 1 113 LYS HB2 2.900 . 2.900 2.341 1.826 2.991 0.091 2 0 "[ . 1 . 2 . ]" 1 2221 1 113 LYS H 1 113 LYS QB 2.660 . 2.660 1.857 1.785 1.961 . 0 0 "[ . 1 . 2 . ]" 1 2222 1 113 LYS H 1 113 LYS HB3 2.730 . 2.730 2.165 1.805 2.717 . 0 0 "[ . 1 . 2 . ]" 1 2223 1 113 LYS H 1 113 LYS QD 4.520 . 4.520 4.240 3.732 4.567 0.047 28 0 "[ . 1 . 2 . ]" 1 2224 1 113 LYS H 1 113 LYS QE 5.120 . 5.120 4.204 3.452 5.302 0.182 1 0 "[ . 1 . 2 . ]" 1 2225 1 113 LYS H 1 113 LYS HG2 4.520 . 4.520 3.861 3.403 4.237 . 0 0 "[ . 1 . 2 . ]" 1 2226 1 113 LYS H 1 113 LYS QG 3.170 . 3.170 3.443 3.274 3.553 0.383 13 0 "[ . 1 . 2 . ]" 1 2227 1 113 LYS H 1 114 TYR HA 5.500 . 5.500 5.167 5.009 5.341 . 0 0 "[ . 1 . 2 . ]" 1 2228 1 113 LYS H 1 114 TYR HB2 5.500 . 5.500 5.153 4.936 5.357 . 0 0 "[ . 1 . 2 . ]" 1 2229 1 113 LYS H 1 114 TYR QB 4.660 . 4.660 4.386 4.192 4.548 . 0 0 "[ . 1 . 2 . ]" 1 2230 1 113 LYS H 1 115 LEU H 4.570 . 4.570 4.311 4.124 4.443 . 0 0 "[ . 1 . 2 . ]" 1 2231 1 113 LYS H 1 115 LEU QB 5.300 . 5.300 5.289 5.187 5.338 0.038 28 0 "[ . 1 . 2 . ]" 1 2232 1 113 LYS H 1 116 ILE HG12 5.500 . 5.500 4.489 4.337 4.662 . 0 0 "[ . 1 . 2 . ]" 1 2233 1 113 LYS H 1 116 ILE QG 5.070 . 5.070 4.016 3.868 4.147 . 0 0 "[ . 1 . 2 . ]" 1 2234 1 113 LYS HA 1 113 LYS QD 4.920 . 4.920 4.147 3.925 4.486 . 0 0 "[ . 1 . 2 . ]" 1 2235 1 113 LYS HA 1 113 LYS QE 5.250 . 5.250 4.306 3.769 5.167 . 0 0 "[ . 1 . 2 . ]" 1 2236 1 113 LYS HA 1 113 LYS HG2 3.890 . 3.890 3.055 2.528 3.612 . 0 0 "[ . 1 . 2 . ]" 1 2237 1 113 LYS HA 1 113 LYS HG3 3.900 . 3.900 2.618 2.271 3.233 . 0 0 "[ . 1 . 2 . ]" 1 2238 1 113 LYS HA 1 115 LEU H 4.910 . 4.910 4.578 4.396 4.695 . 0 0 "[ . 1 . 2 . ]" 1 2239 1 113 LYS HA 1 116 ILE H 4.170 . 4.170 3.814 3.625 3.949 . 0 0 "[ . 1 . 2 . ]" 1 2240 1 113 LYS HA 1 116 ILE HB 4.830 . 4.830 4.856 4.719 4.909 0.079 10 0 "[ . 1 . 2 . ]" 1 2241 1 113 LYS HA 1 116 ILE MD 3.170 . 3.170 2.422 2.218 2.584 . 0 0 "[ . 1 . 2 . ]" 1 2242 1 113 LYS HA 1 116 ILE HG12 4.450 . 4.450 2.390 2.228 2.596 . 0 0 "[ . 1 . 2 . ]" 1 2243 1 113 LYS HA 1 116 ILE HG13 4.450 . 4.450 2.406 2.190 2.515 . 0 0 "[ . 1 . 2 . ]" 1 2244 1 113 LYS HA 1 116 ILE MG 4.420 . 4.420 3.995 3.851 4.217 . 0 0 "[ . 1 . 2 . ]" 1 2245 1 113 LYS HA 1 117 SER H 4.310 . 4.310 4.106 3.971 4.228 . 0 0 "[ . 1 . 2 . ]" 1 2246 1 113 LYS QB 1 114 TYR H 3.670 . 3.670 2.715 2.384 3.123 . 0 0 "[ . 1 . 2 . ]" 1 2247 1 113 LYS QB 1 115 LEU H 5.320 . 5.320 4.853 4.615 5.145 . 0 0 "[ . 1 . 2 . ]" 1 2248 1 113 LYS QB 1 117 SER H 5.500 . 5.500 5.366 5.200 5.512 0.012 26 0 "[ . 1 . 2 . ]" 1 2249 1 113 LYS HB3 1 113 LYS QE 3.930 . 3.930 2.917 1.953 3.858 . 0 0 "[ . 1 . 2 . ]" 1 2250 1 113 LYS HB3 1 114 TYR H 4.380 . 4.380 2.773 2.413 3.215 . 0 0 "[ . 1 . 2 . ]" 1 2251 1 113 LYS QD 1 114 TYR H 4.990 . 4.990 4.630 4.273 5.000 0.010 28 0 "[ . 1 . 2 . ]" 1 2252 1 113 LYS QD 1 114 TYR HA 5.340 . 5.340 5.139 4.768 5.420 0.080 17 0 "[ . 1 . 2 . ]" 1 2253 1 113 LYS QE 1 113 LYS HG2 3.580 . 3.580 3.035 2.306 3.568 . 0 0 "[ . 1 . 2 . ]" 1 2254 1 113 LYS QG 1 114 TYR H 5.050 . 5.050 3.409 2.653 4.123 . 0 0 "[ . 1 . 2 . ]" 1 2255 1 113 LYS HG2 1 114 TYR H 4.760 . 4.760 3.548 2.692 4.434 . 0 0 "[ . 1 . 2 . ]" 1 2256 1 113 LYS HG2 1 117 SER H 5.440 . 5.440 4.998 4.483 5.466 0.026 3 0 "[ . 1 . 2 . ]" 1 2257 1 113 LYS HG3 1 114 TYR H 5.020 . 5.020 4.510 3.861 4.904 . 0 0 "[ . 1 . 2 . ]" 1 2258 1 114 TYR H 1 114 TYR HB2 3.020 . 3.020 2.744 2.666 2.813 . 0 0 "[ . 1 . 2 . ]" 1 2259 1 114 TYR H 1 114 TYR QB 2.720 . 2.720 2.241 2.204 2.283 . 0 0 "[ . 1 . 2 . ]" 1 2260 1 114 TYR H 1 114 TYR HB3 2.830 . 2.830 2.377 2.333 2.426 . 0 0 "[ . 1 . 2 . ]" 1 2261 1 114 TYR H 1 114 TYR QD 4.170 . 4.170 4.136 4.099 4.172 0.002 25 0 "[ . 1 . 2 . ]" 1 2262 1 114 TYR H 1 115 LEU H 2.980 . 2.980 2.583 2.525 2.644 . 0 0 "[ . 1 . 2 . ]" 1 2263 1 114 TYR H 1 115 LEU HB2 4.600 . 4.600 4.626 4.613 4.642 0.042 25 0 "[ . 1 . 2 . ]" 1 2264 1 114 TYR H 1 115 LEU QB 4.590 . 4.590 4.495 4.483 4.512 . 0 0 "[ . 1 . 2 . ]" 1 2265 1 114 TYR H 1 115 LEU MD2 4.730 . 4.730 3.733 3.641 3.802 . 0 0 "[ . 1 . 2 . ]" 1 2266 1 114 TYR H 1 116 ILE H 4.590 . 4.590 4.244 4.166 4.326 . 0 0 "[ . 1 . 2 . ]" 1 2267 1 114 TYR H 1 116 ILE MD 5.500 . 5.500 5.027 4.886 5.174 . 0 0 "[ . 1 . 2 . ]" 1 2268 1 114 TYR H 1 116 ILE HG12 5.200 . 5.200 5.200 5.109 5.249 0.049 9 0 "[ . 1 . 2 . ]" 1 2269 1 114 TYR H 1 116 ILE HG13 4.970 . 4.970 4.313 4.217 4.419 . 0 0 "[ . 1 . 2 . ]" 1 2270 1 114 TYR HA 1 114 TYR QD 3.280 . 3.280 3.173 3.094 3.254 . 0 0 "[ . 1 . 2 . ]" 1 2271 1 114 TYR HA 1 114 TYR QE 5.170 . 5.170 4.866 4.815 4.904 . 0 0 "[ . 1 . 2 . ]" 1 2272 1 114 TYR HA 1 115 LEU MD2 5.470 . 5.470 4.704 4.582 4.874 . 0 0 "[ . 1 . 2 . ]" 1 2273 1 114 TYR HA 1 116 ILE H 5.080 . 5.080 4.754 4.671 4.827 . 0 0 "[ . 1 . 2 . ]" 1 2274 1 114 TYR HA 1 117 SER H 4.110 . 4.110 3.773 3.566 3.896 . 0 0 "[ . 1 . 2 . ]" 1 2275 1 114 TYR QB 1 115 LEU H 3.200 . 3.200 2.533 2.451 2.642 . 0 0 "[ . 1 . 2 . ]" 1 2276 1 114 TYR HB2 1 115 LEU H 4.110 . 4.110 3.913 3.851 4.002 . 0 0 "[ . 1 . 2 . ]" 1 2277 1 114 TYR HB3 1 115 LEU H 3.190 . 3.190 2.566 2.479 2.680 . 0 0 "[ . 1 . 2 . ]" 1 2278 1 114 TYR HB3 1 115 LEU HA 4.770 . 4.770 4.386 4.312 4.467 . 0 0 "[ . 1 . 2 . ]" 1 2279 1 114 TYR HB3 1 115 LEU MD1 5.370 . 5.370 4.239 4.042 4.464 . 0 0 "[ . 1 . 2 . ]" 1 2280 1 114 TYR HB3 1 115 LEU MD2 4.760 . 4.760 2.655 2.493 2.860 . 0 0 "[ . 1 . 2 . ]" 1 2281 1 114 TYR QD 1 115 LEU H 3.440 . 3.440 2.886 2.748 3.006 . 0 0 "[ . 1 . 2 . ]" 1 2282 1 114 TYR QD 1 115 LEU HA 3.220 . 3.220 2.725 2.554 2.894 . 0 0 "[ . 1 . 2 . ]" 1 2283 1 114 TYR QD 1 115 LEU HB2 5.480 . 5.480 4.226 4.125 4.334 . 0 0 "[ . 1 . 2 . ]" 1 2284 1 114 TYR QD 1 115 LEU HB3 4.960 . 4.960 4.675 4.587 4.793 . 0 0 "[ . 1 . 2 . ]" 1 2285 1 114 TYR QD 1 115 LEU MD1 3.660 . 3.660 2.277 2.049 2.555 . 0 0 "[ . 1 . 2 . ]" 1 2286 1 114 TYR QD 1 115 LEU MD2 3.380 . 3.380 2.109 1.939 2.452 . 0 0 "[ . 1 . 2 . ]" 1 2287 1 114 TYR QD 1 115 LEU HG 4.810 . 4.810 4.469 4.403 4.527 . 0 0 "[ . 1 . 2 . ]" 1 2288 1 114 TYR QD 1 117 SER QB 5.500 . 5.500 4.779 4.382 5.065 . 0 0 "[ . 1 . 2 . ]" 1 2289 1 114 TYR QD 1 118 HIS HB2 4.940 . 4.940 4.673 4.410 4.943 0.003 11 0 "[ . 1 . 2 . ]" 1 2290 1 114 TYR QD 1 118 HIS HE1 . . 3.500 3.009 2.674 3.548 0.048 27 0 "[ . 1 . 2 . ]" 1 2291 1 114 TYR QD 1 120 PHE HB2 5.500 . 5.500 5.063 4.900 5.283 . 0 0 "[ . 1 . 2 . ]" 1 2292 1 114 TYR QD 1 120 PHE QD 4.270 . 4.270 4.116 3.948 4.288 0.018 24 0 "[ . 1 . 2 . ]" 1 2293 1 114 TYR QD 1 120 PHE QE 4.680 . 4.680 4.498 4.257 4.687 0.007 2 0 "[ . 1 . 2 . ]" 1 2294 1 114 TYR QE 1 115 LEU H 5.420 . 5.420 5.040 4.924 5.148 . 0 0 "[ . 1 . 2 . ]" 1 2295 1 114 TYR QE 1 115 LEU HA 4.270 . 4.270 3.767 3.626 3.936 . 0 0 "[ . 1 . 2 . ]" 1 2296 1 114 TYR QE 1 115 LEU MD1 4.010 . 4.010 2.646 2.560 2.823 . 0 0 "[ . 1 . 2 . ]" 1 2297 1 114 TYR QE 1 115 LEU MD2 4.220 . 4.220 3.804 3.590 4.091 . 0 0 "[ . 1 . 2 . ]" 1 2298 1 114 TYR QE 1 115 LEU HG 5.500 . 5.500 5.579 5.535 5.645 0.145 12 0 "[ . 1 . 2 . ]" 1 2299 1 114 TYR QE 1 118 HIS HB2 4.750 . 4.750 4.336 4.065 4.661 . 0 0 "[ . 1 . 2 . ]" 1 2300 1 114 TYR QE 1 118 HIS HE1 3.360 . 3.360 2.811 2.209 3.078 . 0 0 "[ . 1 . 2 . ]" 1 2301 1 114 TYR QE 1 120 PHE QD 4.030 . 4.030 3.806 3.526 4.037 0.007 14 0 "[ . 1 . 2 . ]" 1 2302 1 114 TYR QE 1 120 PHE QE 3.150 . 3.150 2.996 2.577 3.189 0.039 2 0 "[ . 1 . 2 . ]" 1 2303 1 114 TYR QE 1 132 VAL QG 5.440 . 5.440 4.629 4.433 4.967 . 0 0 "[ . 1 . 2 . ]" 1 2304 1 115 LEU H 1 115 LEU HB2 3.550 . 3.550 2.336 2.296 2.390 . 0 0 "[ . 1 . 2 . ]" 1 2305 1 115 LEU H 1 115 LEU QB 3.130 . 3.130 2.309 2.270 2.360 . 0 0 "[ . 1 . 2 . ]" 1 2306 1 115 LEU H 1 115 LEU HB3 3.650 . 3.650 3.615 3.582 3.644 . 0 0 "[ . 1 . 2 . ]" 1 2307 1 115 LEU H 1 115 LEU MD1 4.140 . 4.140 3.508 3.362 3.628 . 0 0 "[ . 1 . 2 . ]" 1 2308 1 115 LEU H 1 115 LEU MD2 2.920 . 2.920 2.138 2.090 2.178 . 0 0 "[ . 1 . 2 . ]" 1 2309 1 115 LEU H 1 115 LEU HG 4.100 . 4.100 4.078 4.027 4.133 0.033 9 0 "[ . 1 . 2 . ]" 1 2310 1 115 LEU H 1 116 ILE H 3.250 . 3.250 2.755 2.696 2.831 . 0 0 "[ . 1 . 2 . ]" 1 2311 1 115 LEU H 1 116 ILE HG12 5.100 . 5.100 5.121 5.048 5.145 0.045 22 0 "[ . 1 . 2 . ]" 1 2312 1 115 LEU H 1 116 ILE HG13 4.220 . 4.220 4.014 3.906 4.122 . 0 0 "[ . 1 . 2 . ]" 1 2313 1 115 LEU H 1 116 ILE MG 5.500 . 5.500 4.515 4.431 4.589 . 0 0 "[ . 1 . 2 . ]" 1 2314 1 115 LEU H 1 117 SER H 4.100 . 4.100 4.104 3.964 4.153 0.053 10 0 "[ . 1 . 2 . ]" 1 2315 1 115 LEU H 1 120 PHE QD 5.010 . 5.010 5.015 4.899 5.054 0.044 23 0 "[ . 1 . 2 . ]" 1 2316 1 115 LEU H 1 122 PHE QE 5.120 . 5.120 4.802 4.603 4.939 . 0 0 "[ . 1 . 2 . ]" 1 2317 1 115 LEU HA 1 115 LEU MD1 3.050 . 3.050 2.013 1.978 2.064 . 0 0 "[ . 1 . 2 . ]" 1 2318 1 115 LEU HA 1 115 LEU MD2 3.800 . 3.800 2.988 2.845 3.190 . 0 0 "[ . 1 . 2 . ]" 1 2319 1 115 LEU HA 1 115 LEU HG 4.080 . 4.080 3.683 3.628 3.721 . 0 0 "[ . 1 . 2 . ]" 1 2320 1 115 LEU HA 1 116 ILE H 3.570 . 3.570 3.526 3.503 3.544 . 0 0 "[ . 1 . 2 . ]" 1 2321 1 115 LEU HA 1 118 HIS H 3.790 . 3.790 3.600 3.506 3.658 . 0 0 "[ . 1 . 2 . ]" 1 2322 1 115 LEU HA 1 118 HIS HB2 4.350 . 4.350 3.312 3.076 3.479 . 0 0 "[ . 1 . 2 . ]" 1 2323 1 115 LEU HA 1 120 PHE H 4.420 . 4.420 3.749 3.652 3.950 . 0 0 "[ . 1 . 2 . ]" 1 2324 1 115 LEU HA 1 120 PHE HB2 3.930 . 3.930 2.664 2.506 2.809 . 0 0 "[ . 1 . 2 . ]" 1 2325 1 115 LEU HA 1 120 PHE HB3 4.290 . 4.290 4.137 3.942 4.297 0.007 11 0 "[ . 1 . 2 . ]" 1 2326 1 115 LEU HA 1 120 PHE QD 2.920 . 2.920 2.264 2.127 2.322 . 0 0 "[ . 1 . 2 . ]" 1 2327 1 115 LEU HA 1 120 PHE QE 4.230 . 4.230 4.070 3.904 4.229 . 0 0 "[ . 1 . 2 . ]" 1 2328 1 115 LEU HA 1 122 PHE QE 5.260 . 5.260 4.886 4.763 5.046 . 0 0 "[ . 1 . 2 . ]" 1 2329 1 115 LEU HA 1 132 VAL MG1 5.500 . 5.500 4.694 4.507 5.008 . 0 0 "[ . 1 . 2 . ]" 1 2330 1 115 LEU HA 1 132 VAL QG 4.830 . 4.830 4.363 4.216 4.657 . 0 0 "[ . 1 . 2 . ]" 1 2331 1 115 LEU HA 1 132 VAL MG2 5.500 . 5.500 5.187 4.981 5.539 0.039 28 0 "[ . 1 . 2 . ]" 1 2332 1 115 LEU QB 1 116 ILE H 3.320 . 3.320 2.511 2.475 2.572 . 0 0 "[ . 1 . 2 . ]" 1 2333 1 115 LEU HB2 1 115 LEU MD1 3.630 . 3.630 3.198 3.187 3.207 . 0 0 "[ . 1 . 2 . ]" 1 2334 1 115 LEU HB2 1 116 ILE H 3.650 . 3.650 2.603 2.556 2.680 . 0 0 "[ . 1 . 2 . ]" 1 2335 1 115 LEU HB2 1 116 ILE HG12 5.260 . 5.260 5.144 5.028 5.279 0.019 28 0 "[ . 1 . 2 . ]" 1 2336 1 115 LEU HB2 1 116 ILE MG 3.920 . 3.920 3.511 3.403 3.643 . 0 0 "[ . 1 . 2 . ]" 1 2337 1 115 LEU HB2 1 120 PHE H 5.500 . 5.500 5.119 5.006 5.212 . 0 0 "[ . 1 . 2 . ]" 1 2338 1 115 LEU HB2 1 120 PHE HB2 4.420 . 4.420 3.861 3.704 3.987 . 0 0 "[ . 1 . 2 . ]" 1 2339 1 115 LEU HB2 1 120 PHE QD 5.500 . 5.500 4.860 4.704 4.942 . 0 0 "[ . 1 . 2 . ]" 1 2340 1 115 LEU HB2 1 122 PHE QD 3.960 . 3.960 3.316 3.130 3.477 . 0 0 "[ . 1 . 2 . ]" 1 2341 1 115 LEU HB2 1 122 PHE QE 3.860 . 3.860 2.942 2.696 3.146 . 0 0 "[ . 1 . 2 . ]" 1 2342 1 115 LEU HB2 1 132 VAL MG1 5.500 . 5.500 4.807 4.056 5.092 . 0 0 "[ . 1 . 2 . ]" 1 2343 1 115 LEU HB2 1 132 VAL MG2 5.500 . 5.500 4.570 4.290 5.632 0.132 28 0 "[ . 1 . 2 . ]" 1 2344 1 115 LEU HB3 1 116 ILE H 3.350 . 3.350 3.299 3.245 3.349 . 0 0 "[ . 1 . 2 . ]" 1 2345 1 115 LEU HB3 1 120 PHE H 4.120 . 4.120 3.755 3.617 3.867 . 0 0 "[ . 1 . 2 . ]" 1 2346 1 115 LEU HB3 1 120 PHE HA 5.500 . 5.500 5.005 4.827 5.139 . 0 0 "[ . 1 . 2 . ]" 1 2347 1 115 LEU HB3 1 120 PHE HB3 5.440 . 5.440 3.159 3.004 3.345 . 0 0 "[ . 1 . 2 . ]" 1 2348 1 115 LEU HB3 1 120 PHE QD 4.280 . 4.280 3.838 3.685 3.943 . 0 0 "[ . 1 . 2 . ]" 1 2349 1 115 LEU HB3 1 122 PHE H 4.720 . 4.720 4.785 4.755 4.824 0.104 14 0 "[ . 1 . 2 . ]" 1 2350 1 115 LEU HB3 1 122 PHE HB3 4.350 . 4.350 3.736 3.502 3.925 . 0 0 "[ . 1 . 2 . ]" 1 2351 1 115 LEU HB3 1 122 PHE QD 3.690 . 3.690 2.271 2.180 2.431 . 0 0 "[ . 1 . 2 . ]" 1 2352 1 115 LEU HB3 1 122 PHE QE 3.300 . 3.300 2.758 2.586 2.954 . 0 0 "[ . 1 . 2 . ]" 1 2353 1 115 LEU HB3 1 122 PHE HZ 5.020 . 5.020 4.637 4.405 4.721 . 0 0 "[ . 1 . 2 . ]" 1 2354 1 115 LEU MD1 1 116 ILE H 4.670 . 4.670 4.662 4.613 4.696 0.026 28 0 "[ . 1 . 2 . ]" 1 2355 1 115 LEU MD1 1 116 ILE MG 5.450 . 5.450 5.366 5.276 5.423 . 0 0 "[ . 1 . 2 . ]" 1 2356 1 115 LEU MD1 1 120 PHE H 4.510 . 4.510 4.165 4.049 4.244 . 0 0 "[ . 1 . 2 . ]" 1 2357 1 115 LEU MD1 1 120 PHE HB2 3.700 . 3.700 2.241 2.128 2.327 . 0 0 "[ . 1 . 2 . ]" 1 2358 1 115 LEU MD1 1 120 PHE HB3 3.800 . 3.800 2.301 2.159 2.460 . 0 0 "[ . 1 . 2 . ]" 1 2359 1 115 LEU MD1 1 120 PHE QD 3.180 . 3.180 2.574 2.392 2.705 . 0 0 "[ . 1 . 2 . ]" 1 2360 1 115 LEU MD1 1 120 PHE QE 3.770 . 3.770 3.456 3.341 3.608 . 0 0 "[ . 1 . 2 . ]" 1 2361 1 115 LEU MD1 1 122 PHE HB3 4.240 . 4.240 3.619 3.365 3.930 . 0 0 "[ . 1 . 2 . ]" 1 2362 1 115 LEU MD1 1 122 PHE QD 4.080 . 4.080 3.688 3.452 3.901 . 0 0 "[ . 1 . 2 . ]" 1 2363 1 115 LEU MD1 1 132 VAL MG1 3.530 . 3.530 2.065 1.962 2.240 . 0 0 "[ . 1 . 2 . ]" 1 2364 1 115 LEU MD1 1 132 VAL QG 3.070 . 3.070 1.911 1.821 2.052 . 0 0 "[ . 1 . 2 . ]" 1 2365 1 115 LEU MD1 1 132 VAL MG2 3.530 . 3.530 2.263 2.114 2.428 . 0 0 "[ . 1 . 2 . ]" 1 2366 1 115 LEU MD2 1 116 ILE H 4.340 . 4.340 4.067 3.997 4.125 . 0 0 "[ . 1 . 2 . ]" 1 2367 1 115 LEU MD2 1 120 PHE HB2 4.960 . 4.960 4.380 4.305 4.449 . 0 0 "[ . 1 . 2 . ]" 1 2368 1 115 LEU HG 1 116 ILE H 4.960 . 4.960 4.982 4.964 5.004 0.044 18 0 "[ . 1 . 2 . ]" 1 2369 1 115 LEU HG 1 116 ILE MG 5.500 . 5.500 5.335 5.230 5.411 . 0 0 "[ . 1 . 2 . ]" 1 2370 1 115 LEU HG 1 120 PHE HB2 4.800 . 4.800 3.705 3.416 3.853 . 0 0 "[ . 1 . 2 . ]" 1 2371 1 115 LEU HG 1 120 PHE HB3 5.010 . 5.010 3.776 3.448 3.954 . 0 0 "[ . 1 . 2 . ]" 1 2372 1 115 LEU HG 1 120 PHE QD 4.990 . 4.990 4.703 4.478 4.810 . 0 0 "[ . 1 . 2 . ]" 1 2373 1 115 LEU HG 1 122 PHE H 5.500 . 5.500 5.259 5.083 5.510 0.010 28 0 "[ . 1 . 2 . ]" 1 2374 1 115 LEU HG 1 122 PHE HA 5.500 . 5.500 5.186 4.903 5.467 . 0 0 "[ . 1 . 2 . ]" 1 2375 1 115 LEU HG 1 122 PHE HB2 4.280 . 4.280 3.791 3.398 4.109 . 0 0 "[ . 1 . 2 . ]" 1 2376 1 115 LEU HG 1 122 PHE HB3 3.990 . 3.990 2.749 2.424 3.039 . 0 0 "[ . 1 . 2 . ]" 1 2377 1 115 LEU HG 1 122 PHE QD 3.600 . 3.600 3.048 2.717 3.280 . 0 0 "[ . 1 . 2 . ]" 1 2378 1 115 LEU HG 1 122 PHE QE 4.500 . 4.500 4.216 4.046 4.337 . 0 0 "[ . 1 . 2 . ]" 1 2379 1 115 LEU HG 1 122 PHE HZ 5.500 . 5.500 5.491 5.128 5.553 0.053 9 0 "[ . 1 . 2 . ]" 1 2380 1 115 LEU HG 1 130 LEU QD 5.270 . 5.270 4.042 3.690 4.798 . 0 0 "[ . 1 . 2 . ]" 1 2381 1 115 LEU HG 1 132 VAL HA 5.280 . 5.280 4.586 4.265 4.839 . 0 0 "[ . 1 . 2 . ]" 1 2382 1 115 LEU HG 1 132 VAL QG 3.470 . 3.470 2.300 2.086 2.515 . 0 0 "[ . 1 . 2 . ]" 1 2383 1 116 ILE H 1 116 ILE HB 3.640 . 3.640 3.647 3.628 3.663 0.023 28 0 "[ . 1 . 2 . ]" 1 2384 1 116 ILE H 1 116 ILE MD 4.310 . 4.310 3.661 3.570 3.752 . 0 0 "[ . 1 . 2 . ]" 1 2385 1 116 ILE H 1 116 ILE HG12 3.210 . 3.210 3.068 3.006 3.132 . 0 0 "[ . 1 . 2 . ]" 1 2386 1 116 ILE H 1 116 ILE QG 2.920 . 2.920 2.001 1.918 2.101 . 0 0 "[ . 1 . 2 . ]" 1 2387 1 116 ILE H 1 116 ILE HG13 3.210 . 3.210 2.028 1.937 2.138 . 0 0 "[ . 1 . 2 . ]" 1 2388 1 116 ILE H 1 116 ILE MG 2.870 . 2.870 2.373 2.289 2.445 . 0 0 "[ . 1 . 2 . ]" 1 2389 1 116 ILE H 1 117 SER H 3.070 . 3.070 2.685 2.638 2.728 . 0 0 "[ . 1 . 2 . ]" 1 2390 1 116 ILE H 1 118 HIS H 4.230 . 4.230 4.115 4.057 4.181 . 0 0 "[ . 1 . 2 . ]" 1 2391 1 116 ILE H 1 120 PHE H 4.780 . 4.780 4.735 4.652 4.792 0.012 20 0 "[ . 1 . 2 . ]" 1 2392 1 116 ILE H 1 122 PHE QE 3.940 . 3.940 3.154 2.940 3.337 . 0 0 "[ . 1 . 2 . ]" 1 2393 1 116 ILE H 1 122 PHE HZ 4.580 . 4.580 4.104 3.901 4.252 . 0 0 "[ . 1 . 2 . ]" 1 2394 1 116 ILE HA 1 116 ILE HG12 4.250 . 4.250 4.170 4.142 4.195 . 0 0 "[ . 1 . 2 . ]" 1 2395 1 116 ILE HA 1 116 ILE HG13 3.610 . 3.610 3.522 3.503 3.541 . 0 0 "[ . 1 . 2 . ]" 1 2396 1 116 ILE HA 1 116 ILE MG 2.830 . 2.830 2.255 2.190 2.292 . 0 0 "[ . 1 . 2 . ]" 1 2397 1 116 ILE HA 1 118 HIS H 3.940 . 3.940 3.844 3.742 3.952 0.012 20 0 "[ . 1 . 2 . ]" 1 2398 1 116 ILE HA 1 119 SER H 3.500 . 3.500 3.325 3.169 3.423 . 0 0 "[ . 1 . 2 . ]" 1 2399 1 116 ILE HA 1 120 PHE H 3.610 . 3.610 3.312 3.162 3.418 . 0 0 "[ . 1 . 2 . ]" 1 2400 1 116 ILE HA 1 122 PHE QD 5.160 . 5.160 4.772 4.605 4.954 . 0 0 "[ . 1 . 2 . ]" 1 2401 1 116 ILE HA 1 122 PHE QE 3.600 . 3.600 3.191 3.006 3.357 . 0 0 "[ . 1 . 2 . ]" 1 2402 1 116 ILE HA 1 122 PHE HZ 5.500 . 5.500 4.938 4.740 5.124 . 0 0 "[ . 1 . 2 . ]" 1 2403 1 116 ILE HB 1 116 ILE MD 2.920 . 2.920 2.243 2.224 2.264 . 0 0 "[ . 1 . 2 . ]" 1 2404 1 116 ILE HB 1 117 SER H 3.740 . 3.740 3.752 3.698 3.788 0.048 22 0 "[ . 1 . 2 . ]" 1 2405 1 116 ILE HB 1 117 SER QB 5.500 . 5.500 5.253 5.034 5.431 . 0 0 "[ . 1 . 2 . ]" 1 2406 1 116 ILE HB 1 118 HIS H 5.500 . 5.500 5.268 5.165 5.370 . 0 0 "[ . 1 . 2 . ]" 1 2407 1 116 ILE HB 1 122 PHE QE 4.680 . 4.680 4.445 4.341 4.587 . 0 0 "[ . 1 . 2 . ]" 1 2408 1 116 ILE MD 1 117 SER H 3.050 . 3.050 2.612 2.428 2.724 . 0 0 "[ . 1 . 2 . ]" 1 2409 1 116 ILE MD 1 117 SER HA 3.480 . 3.480 2.775 2.664 2.868 . 0 0 "[ . 1 . 2 . ]" 1 2410 1 116 ILE MD 1 118 HIS H 5.010 . 5.010 4.605 4.472 4.679 . 0 0 "[ . 1 . 2 . ]" 1 2411 1 116 ILE MD 1 119 SER H 5.470 . 5.470 4.982 4.901 5.081 . 0 0 "[ . 1 . 2 . ]" 1 2412 1 116 ILE QG 1 117 SER H 3.660 . 3.660 2.218 2.082 2.381 . 0 0 "[ . 1 . 2 . ]" 1 2413 1 116 ILE QG 1 119 SER H 5.490 . 5.490 5.309 5.175 5.459 . 0 0 "[ . 1 . 2 . ]" 1 2414 1 116 ILE HG12 1 116 ILE MG 3.070 . 3.070 2.176 2.118 2.218 . 0 0 "[ . 1 . 2 . ]" 1 2415 1 116 ILE HG12 1 117 SER H 4.040 . 4.040 3.907 3.800 4.037 . 0 0 "[ . 1 . 2 . ]" 1 2416 1 116 ILE HG12 1 117 SER QB 5.280 . 5.280 5.241 5.002 5.422 0.142 2 0 "[ . 1 . 2 . ]" 1 2417 1 116 ILE HG12 1 122 PHE QE 4.500 . 4.500 4.500 4.402 4.533 0.033 16 0 "[ . 1 . 2 . ]" 1 2418 1 116 ILE HG12 1 122 PHE HZ 4.110 . 4.110 4.132 4.032 4.158 0.048 1 0 "[ . 1 . 2 . ]" 1 2419 1 116 ILE HG13 1 116 ILE MG 3.070 . 3.070 2.785 2.736 2.862 . 0 0 "[ . 1 . 2 . ]" 1 2420 1 116 ILE HG13 1 117 SER H 3.870 . 3.870 2.230 2.092 2.398 . 0 0 "[ . 1 . 2 . ]" 1 2421 1 116 ILE HG13 1 118 HIS H 4.730 . 4.730 4.643 4.521 4.749 0.019 23 0 "[ . 1 . 2 . ]" 1 2422 1 116 ILE HG13 1 122 PHE QE 4.670 . 4.670 4.569 4.458 4.689 0.019 4 0 "[ . 1 . 2 . ]" 1 2423 1 116 ILE HG13 1 122 PHE HZ 4.980 . 4.980 4.905 4.728 5.000 0.020 1 0 "[ . 1 . 2 . ]" 1 2424 1 116 ILE MG 1 117 SER H 4.230 . 4.230 4.067 4.012 4.121 . 0 0 "[ . 1 . 2 . ]" 1 2425 1 116 ILE MG 1 119 SER H 5.050 . 5.050 5.055 4.941 5.100 0.050 3 0 "[ . 1 . 2 . ]" 1 2426 1 116 ILE MG 1 119 SER HA 4.880 . 4.880 4.839 4.626 4.949 0.069 10 0 "[ . 1 . 2 . ]" 1 2427 1 116 ILE MG 1 120 PHE H 4.760 . 4.760 4.763 4.596 4.807 0.047 20 0 "[ . 1 . 2 . ]" 1 2428 1 116 ILE MG 1 122 PHE H 5.500 . 5.500 5.148 4.858 5.320 . 0 0 "[ . 1 . 2 . ]" 1 2429 1 116 ILE MG 1 122 PHE QD 4.540 . 4.540 3.939 3.844 4.014 . 0 0 "[ . 1 . 2 . ]" 1 2430 1 116 ILE MG 1 122 PHE QE 2.790 . 2.790 1.971 1.904 2.022 . 0 0 "[ . 1 . 2 . ]" 1 2431 1 116 ILE MG 1 122 PHE HZ 3.930 . 3.930 2.173 2.065 2.306 . 0 0 "[ . 1 . 2 . ]" 1 2432 1 117 SER H 1 117 SER QB 2.790 . 2.790 2.248 2.184 2.306 . 0 0 "[ . 1 . 2 . ]" 1 2433 1 117 SER H 1 118 HIS H 3.010 . 3.010 2.619 2.546 2.702 . 0 0 "[ . 1 . 2 . ]" 1 2434 1 117 SER H 1 118 HIS HB2 5.500 . 5.500 4.877 4.732 5.033 . 0 0 "[ . 1 . 2 . ]" 1 2435 1 117 SER H 1 119 SER H 4.230 . 4.230 3.978 3.891 4.074 . 0 0 "[ . 1 . 2 . ]" 1 2436 1 117 SER HA 1 117 SER QB 2.680 . 2.680 2.402 2.383 2.437 . 0 0 "[ . 1 . 2 . ]" 1 2437 1 117 SER HA 1 118 HIS H 3.460 . 3.460 3.446 3.398 3.483 0.023 7 0 "[ . 1 . 2 . ]" 1 2438 1 117 SER HA 1 119 SER H 4.010 . 4.010 3.821 3.647 3.997 . 0 0 "[ . 1 . 2 . ]" 1 2439 1 117 SER QB 1 118 HIS H 3.310 . 3.310 2.927 2.686 3.104 . 0 0 "[ . 1 . 2 . ]" 1 2440 1 117 SER QB 1 118 HIS HA 5.070 . 5.070 4.215 4.039 4.350 . 0 0 "[ . 1 . 2 . ]" 1 2441 1 117 SER QB 1 118 HIS HD2 4.980 . 4.980 4.978 3.836 5.060 0.080 28 0 "[ . 1 . 2 . ]" 1 2442 1 117 SER QB 1 118 HIS HE1 4.910 . 4.910 3.988 3.451 4.924 0.014 27 0 "[ . 1 . 2 . ]" 1 2443 1 117 SER QB 1 119 SER H 4.970 . 4.970 4.554 4.438 4.663 . 0 0 "[ . 1 . 2 . ]" 1 2444 1 118 HIS H 1 118 HIS HB2 3.080 . 3.080 2.523 2.408 2.620 . 0 0 "[ . 1 . 2 . ]" 1 2445 1 118 HIS H 1 118 HIS QB 2.970 . 2.970 2.483 2.375 2.574 . 0 0 "[ . 1 . 2 . ]" 1 2446 1 118 HIS H 1 118 HIS HB3 3.780 . 3.780 3.700 3.628 3.768 . 0 0 "[ . 1 . 2 . ]" 1 2447 1 118 HIS H 1 118 HIS HD2 4.930 . 4.930 4.926 3.984 4.995 0.065 3 0 "[ . 1 . 2 . ]" 1 2448 1 118 HIS H 1 119 SER H 2.760 . 2.760 2.282 2.159 2.424 . 0 0 "[ . 1 . 2 . ]" 1 2449 1 118 HIS H 1 119 SER HA 4.600 . 4.600 4.361 4.177 4.538 . 0 0 "[ . 1 . 2 . ]" 1 2450 1 118 HIS H 1 119 SER QB 5.110 . 5.110 5.006 4.712 5.137 0.027 23 0 "[ . 1 . 2 . ]" 1 2451 1 118 HIS H 1 120 PHE H 3.800 . 3.800 3.468 3.286 3.644 . 0 0 "[ . 1 . 2 . ]" 1 2452 1 118 HIS H 1 120 PHE QB 4.540 . 4.540 4.477 4.341 4.568 0.028 19 0 "[ . 1 . 2 . ]" 1 2453 1 118 HIS H 1 120 PHE QD 3.850 . 3.850 3.574 3.394 3.694 . 0 0 "[ . 1 . 2 . ]" 1 2454 1 118 HIS HA 1 118 HIS HD2 3.530 . 3.530 2.941 2.311 3.078 . 0 0 "[ . 1 . 2 . ]" 1 2455 1 118 HIS HA 1 119 SER H 3.520 . 3.520 3.125 3.042 3.182 . 0 0 "[ . 1 . 2 . ]" 1 2456 1 118 HIS HA 1 119 SER QB 5.320 . 5.320 4.109 3.780 4.431 . 0 0 "[ . 1 . 2 . ]" 1 2457 1 118 HIS HA 1 120 PHE H 5.200 . 5.200 4.864 4.665 5.228 0.028 8 0 "[ . 1 . 2 . ]" 1 2458 1 118 HIS HA 1 120 PHE QD 5.030 . 5.030 4.766 4.638 4.867 . 0 0 "[ . 1 . 2 . ]" 1 2459 1 118 HIS HA 1 120 PHE QE 5.500 . 5.500 5.157 4.967 5.313 . 0 0 "[ . 1 . 2 . ]" 1 2460 1 118 HIS QB 1 119 SER H 3.990 . 3.990 3.550 3.470 3.655 . 0 0 "[ . 1 . 2 . ]" 1 2461 1 118 HIS HB2 1 118 HIS HD2 3.970 . 3.970 3.921 3.877 3.945 . 0 0 "[ . 1 . 2 . ]" 1 2462 1 118 HIS HB2 1 119 SER H 4.020 . 4.020 3.768 3.664 3.918 . 0 0 "[ . 1 . 2 . ]" 1 2463 1 118 HIS HB2 1 120 PHE H 4.160 . 4.160 3.667 3.444 3.976 . 0 0 "[ . 1 . 2 . ]" 1 2464 1 118 HIS HB2 1 120 PHE HA 5.230 . 5.230 5.253 5.167 5.289 0.059 13 0 "[ . 1 . 2 . ]" 1 2465 1 118 HIS HB2 1 120 PHE QD 3.020 . 3.020 2.010 1.943 2.098 . 0 0 "[ . 1 . 2 . ]" 1 2466 1 118 HIS HB2 1 120 PHE QE 3.080 . 3.080 2.617 2.435 2.841 . 0 0 "[ . 1 . 2 . ]" 1 2467 1 118 HIS HB3 1 118 HIS HD2 3.960 . 3.960 2.913 2.829 3.442 . 0 0 "[ . 1 . 2 . ]" 1 2468 1 118 HIS HB3 1 119 SER H 4.510 . 4.510 4.335 4.289 4.392 . 0 0 "[ . 1 . 2 . ]" 1 2469 1 118 HIS HB3 1 120 PHE H 5.080 . 5.080 4.600 4.268 5.031 . 0 0 "[ . 1 . 2 . ]" 1 2470 1 118 HIS HB3 1 120 PHE QD 3.510 . 3.510 3.285 3.022 3.511 0.001 8 0 "[ . 1 . 2 . ]" 1 2471 1 118 HIS HB3 1 120 PHE QE 3.400 . 3.400 2.884 2.669 3.030 . 0 0 "[ . 1 . 2 . ]" 1 2472 1 119 SER H 1 119 SER HA 2.570 . 2.570 2.222 2.183 2.248 . 0 0 "[ . 1 . 2 . ]" 1 2473 1 119 SER H 1 119 SER HB2 4.080 . 4.080 3.459 3.026 4.022 . 0 0 "[ . 1 . 2 . ]" 1 2474 1 119 SER H 1 119 SER QB 3.510 . 3.510 3.219 2.881 3.369 . 0 0 "[ . 1 . 2 . ]" 1 2475 1 119 SER H 1 120 PHE H 3.150 . 3.150 2.746 2.674 2.836 . 0 0 "[ . 1 . 2 . ]" 1 2476 1 119 SER H 1 120 PHE QB 4.650 . 4.650 4.641 4.583 4.671 0.021 18 0 "[ . 1 . 2 . ]" 1 2477 1 119 SER H 1 120 PHE QD 4.950 . 4.950 4.427 4.230 4.666 . 0 0 "[ . 1 . 2 . ]" 1 2478 1 119 SER HA 1 120 PHE H 3.070 . 3.070 2.795 2.422 2.986 . 0 0 "[ . 1 . 2 . ]" 1 2479 1 119 SER QB 1 120 PHE H 4.230 . 4.230 3.899 3.820 4.057 . 0 0 "[ . 1 . 2 . ]" 1 2480 1 119 SER QB 1 120 PHE HA 4.670 . 4.670 4.442 4.316 4.724 0.054 24 0 "[ . 1 . 2 . ]" 1 2481 1 119 SER HB2 1 120 PHE H 5.040 . 5.040 4.358 4.159 4.669 . 0 0 "[ . 1 . 2 . ]" 1 2482 1 119 SER HB3 1 120 PHE H 5.040 . 5.040 4.430 4.136 4.671 . 0 0 "[ . 1 . 2 . ]" 1 2483 1 120 PHE H 1 120 PHE HA 2.920 . 2.920 2.884 2.852 2.922 0.002 9 0 "[ . 1 . 2 . ]" 1 2484 1 120 PHE H 1 120 PHE HB2 2.910 . 2.910 2.273 2.228 2.349 . 0 0 "[ . 1 . 2 . ]" 1 2485 1 120 PHE H 1 120 PHE QB 2.800 . 2.800 2.248 2.205 2.319 . 0 0 "[ . 1 . 2 . ]" 1 2486 1 120 PHE H 1 120 PHE HB3 3.600 . 3.600 3.546 3.518 3.576 . 0 0 "[ . 1 . 2 . ]" 1 2487 1 120 PHE H 1 120 PHE QD 3.530 . 3.530 2.942 2.759 3.130 . 0 0 "[ . 1 . 2 . ]" 1 2488 1 120 PHE H 1 120 PHE QE 5.350 . 5.350 5.007 4.869 5.205 . 0 0 "[ . 1 . 2 . ]" 1 2489 1 120 PHE H 1 121 ARG H 4.690 . 4.690 4.540 4.430 4.617 . 0 0 "[ . 1 . 2 . ]" 1 2490 1 120 PHE H 1 122 PHE QD 4.790 . 4.790 4.682 4.465 4.851 0.061 2 0 "[ . 1 . 2 . ]" 1 2491 1 120 PHE HA 1 120 PHE QD 3.950 . 3.950 2.761 2.574 2.898 . 0 0 "[ . 1 . 2 . ]" 1 2492 1 120 PHE HA 1 120 PHE QE 4.460 . 4.460 4.479 4.413 4.531 0.071 9 0 "[ . 1 . 2 . ]" 1 2493 1 120 PHE HA 1 121 ARG H 2.830 . 2.830 2.465 2.288 2.616 . 0 0 "[ . 1 . 2 . ]" 1 2494 1 120 PHE HA 1 121 ARG QB 4.910 . 4.910 4.532 4.264 4.743 . 0 0 "[ . 1 . 2 . ]" 1 2495 1 120 PHE HA 1 121 ARG QD 3.560 . 3.560 2.824 2.397 3.759 0.199 9 0 "[ . 1 . 2 . ]" 1 2496 1 120 PHE HA 1 121 ARG QG 4.290 . 4.290 4.089 3.431 4.373 0.083 5 0 "[ . 1 . 2 . ]" 1 2497 1 120 PHE HA 1 132 VAL QG 5.300 . 5.300 4.313 4.032 5.313 0.013 28 0 "[ . 1 . 2 . ]" 1 2498 1 120 PHE HA 1 135 LYS QD 4.870 . 4.870 3.027 2.217 4.483 . 0 0 "[ . 1 . 2 . ]" 1 2499 1 120 PHE HA 1 135 LYS HE2 5.500 . 5.500 4.465 2.585 5.520 0.020 13 0 "[ . 1 . 2 . ]" 1 2500 1 120 PHE HA 1 135 LYS QE 4.640 . 4.640 3.970 2.443 4.667 0.027 17 0 "[ . 1 . 2 . ]" 1 2501 1 120 PHE HA 1 135 LYS HE3 5.500 . 5.500 4.611 3.004 5.546 0.046 25 0 "[ . 1 . 2 . ]" 1 2502 1 120 PHE QB 1 121 ARG H 3.570 . 3.570 2.218 1.915 2.593 . 0 0 "[ . 1 . 2 . ]" 1 2503 1 120 PHE QB 1 133 MET H 4.620 . 4.620 4.358 3.828 4.628 0.008 13 0 "[ . 1 . 2 . ]" 1 2504 1 120 PHE HB2 1 121 ARG H 4.340 . 4.340 3.657 3.403 3.940 . 0 0 "[ . 1 . 2 . ]" 1 2505 1 120 PHE HB2 1 122 PHE QD 4.130 . 4.130 3.443 3.309 3.612 . 0 0 "[ . 1 . 2 . ]" 1 2506 1 120 PHE HB2 1 132 VAL QG 4.190 . 4.190 3.521 3.246 4.237 0.047 28 0 "[ . 1 . 2 . ]" 1 2507 1 120 PHE HB3 1 121 ARG H 3.710 . 3.710 2.238 1.926 2.629 . 0 0 "[ . 1 . 2 . ]" 1 2508 1 120 PHE HB3 1 121 ARG HA 4.750 . 4.750 4.162 4.003 4.327 . 0 0 "[ . 1 . 2 . ]" 1 2509 1 120 PHE HB3 1 122 PHE QD 4.080 . 4.080 3.332 3.154 3.564 . 0 0 "[ . 1 . 2 . ]" 1 2510 1 120 PHE HB3 1 132 VAL HA 5.180 . 5.180 4.725 4.387 5.133 . 0 0 "[ . 1 . 2 . ]" 1 2511 1 120 PHE HB3 1 132 VAL QG 3.600 . 3.600 2.455 2.116 3.579 . 0 0 "[ . 1 . 2 . ]" 1 2512 1 120 PHE HB3 1 133 MET H 4.880 . 4.880 4.458 3.896 4.746 . 0 0 "[ . 1 . 2 . ]" 1 2513 1 120 PHE QD 1 121 ARG H 3.910 . 3.910 2.924 2.780 3.030 . 0 0 "[ . 1 . 2 . ]" 1 2514 1 120 PHE QD 1 122 PHE QD 5.230 . 5.230 5.037 4.907 5.184 . 0 0 "[ . 1 . 2 . ]" 1 2515 1 120 PHE QD 1 132 VAL QG 3.530 . 3.530 2.721 2.410 3.541 0.011 28 0 "[ . 1 . 2 . ]" 1 2516 1 120 PHE QD 1 134 LEU HA 4.050 . 4.050 3.195 2.679 3.854 . 0 0 "[ . 1 . 2 . ]" 1 2517 1 120 PHE QD 1 134 LEU QD 4.760 . 4.760 3.654 3.371 4.066 . 0 0 "[ . 1 . 2 . ]" 1 2518 1 120 PHE QD 1 134 LEU MD2 4.560 . 4.560 3.683 3.391 4.106 . 0 0 "[ . 1 . 2 . ]" 1 2519 1 120 PHE QD 1 135 LYS QD 4.990 . 4.990 3.448 2.991 4.435 . 0 0 "[ . 1 . 2 . ]" 1 2520 1 120 PHE QD 1 135 LYS QG 4.750 . 4.750 3.113 2.281 4.060 . 0 0 "[ . 1 . 2 . ]" 1 2521 1 120 PHE QE 1 121 ARG H 5.160 . 5.160 5.191 5.081 5.245 0.085 23 0 "[ . 1 . 2 . ]" 1 2522 1 120 PHE QE 1 132 VAL QG 4.210 . 4.210 3.623 3.339 4.156 . 0 0 "[ . 1 . 2 . ]" 1 2523 1 120 PHE QE 1 134 LEU HA 3.660 . 3.660 2.985 2.349 3.680 0.020 13 0 "[ . 1 . 2 . ]" 1 2524 1 120 PHE QE 1 134 LEU HB3 5.500 . 5.500 4.254 3.570 5.075 . 0 0 "[ . 1 . 2 . ]" 1 2525 1 120 PHE QE 1 134 LEU QD 3.660 . 3.660 2.824 2.364 3.416 . 0 0 "[ . 1 . 2 . ]" 1 2526 1 120 PHE QE 1 134 LEU MD2 3.770 . 3.770 2.839 2.370 3.443 . 0 0 "[ . 1 . 2 . ]" 1 2527 1 120 PHE QE 1 135 LYS H 4.840 . 4.840 3.307 2.561 4.035 . 0 0 "[ . 1 . 2 . ]" 1 2528 1 120 PHE QE 1 135 LYS QB 5.500 . 5.500 4.342 3.730 5.176 . 0 0 "[ . 1 . 2 . ]" 1 2529 1 120 PHE QE 1 135 LYS QD 4.700 . 4.700 3.528 2.751 4.245 . 0 0 "[ . 1 . 2 . ]" 1 2530 1 120 PHE QE 1 135 LYS QG 4.220 . 4.220 2.651 2.354 3.360 . 0 0 "[ . 1 . 2 . ]" 1 2531 1 121 ARG H 1 121 ARG QB 3.260 . 3.260 2.834 2.529 3.206 . 0 0 "[ . 1 . 2 . ]" 1 2532 1 121 ARG H 1 121 ARG QD 3.880 . 3.880 2.184 1.856 3.619 . 0 0 "[ . 1 . 2 . ]" 1 2533 1 121 ARG H 1 121 ARG HG2 4.350 . 4.350 3.710 2.394 4.378 0.028 21 0 "[ . 1 . 2 . ]" 1 2534 1 121 ARG H 1 121 ARG QG 3.320 . 3.320 3.000 2.372 3.353 0.033 4 0 "[ . 1 . 2 . ]" 1 2535 1 121 ARG H 1 121 ARG HG3 4.350 . 4.350 3.548 2.951 4.023 . 0 0 "[ . 1 . 2 . ]" 1 2536 1 121 ARG H 1 122 PHE H 4.080 . 4.080 4.097 3.960 4.149 0.069 26 0 "[ . 1 . 2 . ]" 1 2537 1 121 ARG H 1 122 PHE HB3 4.930 . 4.930 4.481 4.304 4.681 . 0 0 "[ . 1 . 2 . ]" 1 2538 1 121 ARG H 1 132 VAL QG 4.120 . 4.120 3.205 2.874 4.184 0.064 22 0 "[ . 1 . 2 . ]" 1 2539 1 121 ARG H 1 133 MET H 5.180 . 5.180 3.572 3.093 3.871 . 0 0 "[ . 1 . 2 . ]" 1 2540 1 121 ARG H 1 133 MET QB 4.600 . 4.600 3.792 3.384 4.346 . 0 0 "[ . 1 . 2 . ]" 1 2541 1 121 ARG HA 1 121 ARG QD 4.020 . 4.020 3.683 3.464 4.115 0.095 9 0 "[ . 1 . 2 . ]" 1 2542 1 121 ARG HA 1 121 ARG HG2 4.220 . 4.220 3.695 3.245 3.844 . 0 0 "[ . 1 . 2 . ]" 1 2543 1 121 ARG HA 1 121 ARG QG 3.530 . 3.530 2.899 2.409 3.576 0.046 2 0 "[ . 1 . 2 . ]" 1 2544 1 121 ARG HA 1 121 ARG HG3 4.220 . 4.220 3.196 2.470 4.284 0.064 16 0 "[ . 1 . 2 . ]" 1 2545 1 121 ARG HA 1 122 PHE H 2.470 . 2.470 2.127 2.020 2.189 . 0 0 "[ . 1 . 2 . ]" 1 2546 1 121 ARG HA 1 122 PHE HA 4.700 . 4.700 4.374 4.314 4.415 . 0 0 "[ . 1 . 2 . ]" 1 2547 1 121 ARG HA 1 122 PHE QD 4.360 . 4.360 3.369 3.114 3.702 . 0 0 "[ . 1 . 2 . ]" 1 2548 1 121 ARG HA 1 133 MET H 5.060 . 5.060 4.820 4.693 4.947 . 0 0 "[ . 1 . 2 . ]" 1 2549 1 121 ARG QB 1 122 PHE H 3.920 . 3.920 3.341 3.220 3.400 . 0 0 "[ . 1 . 2 . ]" 1 2550 1 121 ARG QB 1 133 MET H 4.350 . 4.350 3.532 2.888 4.385 0.035 2 0 "[ . 1 . 2 . ]" 1 2551 1 121 ARG QB 1 133 MET HG3 4.380 . 4.380 3.550 2.631 4.410 0.030 5 0 "[ . 1 . 2 . ]" 1 2552 1 121 ARG QD 1 122 PHE H 5.500 . 5.500 5.256 4.995 5.614 0.114 9 0 "[ . 1 . 2 . ]" 1 2553 1 121 ARG QD 1 133 MET H 4.580 . 4.580 4.379 3.994 4.681 0.101 9 0 "[ . 1 . 2 . ]" 1 2554 1 121 ARG QD 1 133 MET QB 4.650 . 4.650 3.024 2.245 3.832 . 0 0 "[ . 1 . 2 . ]" 1 2555 1 121 ARG QD 1 134 LEU H 5.500 . 5.500 5.151 4.688 5.627 0.127 22 0 "[ . 1 . 2 . ]" 1 2556 1 121 ARG QD 1 135 LYS QD 4.430 . 4.430 3.895 2.579 4.476 0.046 10 0 "[ . 1 . 2 . ]" 1 2557 1 121 ARG QG 1 122 PHE H 4.880 . 4.880 4.469 4.186 4.664 . 0 0 "[ . 1 . 2 . ]" 1 2558 1 122 PHE H 1 122 PHE HB2 3.860 . 3.860 3.835 3.760 3.881 0.021 10 0 "[ . 1 . 2 . ]" 1 2559 1 122 PHE H 1 122 PHE QB 3.220 . 3.220 3.064 3.039 3.096 . 0 0 "[ . 1 . 2 . ]" 1 2560 1 122 PHE H 1 122 PHE HB3 3.680 . 3.680 3.222 3.182 3.263 . 0 0 "[ . 1 . 2 . ]" 1 2561 1 122 PHE H 1 122 PHE QD 3.090 . 3.090 2.528 2.339 2.639 . 0 0 "[ . 1 . 2 . ]" 1 2562 1 122 PHE H 1 122 PHE QE 4.310 . 4.310 4.011 3.899 4.130 . 0 0 "[ . 1 . 2 . ]" 1 2563 1 122 PHE H 1 123 SER H 4.750 . 4.750 4.368 4.320 4.422 . 0 0 "[ . 1 . 2 . ]" 1 2564 1 122 PHE H 1 123 SER HB2 5.480 . 5.480 4.933 4.695 5.252 . 0 0 "[ . 1 . 2 . ]" 1 2565 1 122 PHE H 1 132 VAL HA 4.430 . 4.430 4.476 4.345 4.531 0.101 20 0 "[ . 1 . 2 . ]" 1 2566 1 122 PHE H 1 132 VAL MG1 5.500 . 5.500 4.524 4.335 4.956 . 0 0 "[ . 1 . 2 . ]" 1 2567 1 122 PHE H 1 132 VAL QG 4.740 . 4.740 4.230 4.090 4.737 . 0 0 "[ . 1 . 2 . ]" 1 2568 1 122 PHE H 1 133 MET H 5.000 . 5.000 4.594 4.410 4.774 . 0 0 "[ . 1 . 2 . ]" 1 2569 1 122 PHE HA 1 122 PHE QD 3.740 . 3.740 3.709 3.666 3.732 . 0 0 "[ . 1 . 2 . ]" 1 2570 1 122 PHE HA 1 123 SER H 2.910 . 2.910 2.329 2.240 2.446 . 0 0 "[ . 1 . 2 . ]" 1 2571 1 122 PHE HA 1 123 SER HA 5.200 . 5.200 4.484 4.403 4.539 . 0 0 "[ . 1 . 2 . ]" 1 2572 1 122 PHE HA 1 123 SER HB3 5.310 . 5.310 4.402 4.236 4.571 . 0 0 "[ . 1 . 2 . ]" 1 2573 1 122 PHE HA 1 131 LYS H 5.270 . 5.270 4.811 4.498 5.093 . 0 0 "[ . 1 . 2 . ]" 1 2574 1 122 PHE HA 1 131 LYS HB3 4.920 . 4.920 4.822 4.450 4.967 0.047 18 0 "[ . 1 . 2 . ]" 1 2575 1 122 PHE HA 1 132 VAL H 5.480 . 5.480 4.570 4.473 4.714 . 0 0 "[ . 1 . 2 . ]" 1 2576 1 122 PHE HA 1 132 VAL HA 3.290 . 3.290 2.068 1.950 2.310 . 0 0 "[ . 1 . 2 . ]" 1 2577 1 122 PHE HA 1 132 VAL MG1 4.700 . 4.700 3.608 3.483 3.873 . 0 0 "[ . 1 . 2 . ]" 1 2578 1 122 PHE HA 1 132 VAL QG 4.000 . 4.000 3.244 3.138 3.598 . 0 0 "[ . 1 . 2 . ]" 1 2579 1 122 PHE HA 1 132 VAL MG2 4.700 . 4.700 3.710 3.497 4.711 0.011 22 0 "[ . 1 . 2 . ]" 1 2580 1 122 PHE HA 1 133 MET H 3.640 . 3.640 2.859 2.449 3.206 . 0 0 "[ . 1 . 2 . ]" 1 2581 1 122 PHE HA 1 133 MET QB 5.500 . 5.500 4.448 3.761 4.967 . 0 0 "[ . 1 . 2 . ]" 1 2582 1 122 PHE HA 1 133 MET HG2 4.490 . 4.490 3.648 3.122 4.312 . 0 0 "[ . 1 . 2 . ]" 1 2583 1 122 PHE QB 1 123 SER H 3.110 . 3.110 2.440 2.249 2.585 . 0 0 "[ . 1 . 2 . ]" 1 2584 1 122 PHE QB 1 133 MET H 4.840 . 4.840 3.662 3.287 3.918 . 0 0 "[ . 1 . 2 . ]" 1 2585 1 122 PHE HB2 1 123 SER H 3.320 . 3.320 2.471 2.271 2.625 . 0 0 "[ . 1 . 2 . ]" 1 2586 1 122 PHE HB2 1 123 SER HB2 5.500 . 5.500 5.332 5.240 5.419 . 0 0 "[ . 1 . 2 . ]" 1 2587 1 122 PHE HB2 1 130 LEU HB3 4.640 . 4.640 2.879 2.444 3.157 . 0 0 "[ . 1 . 2 . ]" 1 2588 1 122 PHE HB2 1 130 LEU QD 5.440 . 5.440 3.606 3.247 3.906 . 0 0 "[ . 1 . 2 . ]" 1 2589 1 122 PHE HB2 1 131 LYS H 5.500 . 5.500 3.956 3.681 4.135 . 0 0 "[ . 1 . 2 . ]" 1 2590 1 122 PHE HB2 1 132 VAL H 5.500 . 5.500 4.487 4.215 4.776 . 0 0 "[ . 1 . 2 . ]" 1 2591 1 122 PHE HB2 1 132 VAL HA 3.930 . 3.930 2.895 2.542 3.217 . 0 0 "[ . 1 . 2 . ]" 1 2592 1 122 PHE HB2 1 132 VAL QG 3.640 . 3.640 2.489 2.186 2.640 . 0 0 "[ . 1 . 2 . ]" 1 2593 1 122 PHE HB2 1 133 MET H 5.480 . 5.480 4.706 4.223 5.112 . 0 0 "[ . 1 . 2 . ]" 1 2594 1 122 PHE HB3 1 123 SER H 3.970 . 3.970 3.766 3.612 3.878 . 0 0 "[ . 1 . 2 . ]" 1 2595 1 122 PHE HB3 1 130 LEU HB3 5.500 . 5.500 4.169 3.707 4.487 . 0 0 "[ . 1 . 2 . ]" 1 2596 1 122 PHE HB3 1 130 LEU QD 5.440 . 5.440 4.471 4.125 4.986 . 0 0 "[ . 1 . 2 . ]" 1 2597 1 122 PHE HB3 1 132 VAL HA 3.820 . 3.820 2.432 2.126 2.687 . 0 0 "[ . 1 . 2 . ]" 1 2598 1 122 PHE HB3 1 132 VAL MG1 4.070 . 4.070 2.462 1.956 2.654 . 0 0 "[ . 1 . 2 . ]" 1 2599 1 122 PHE HB3 1 132 VAL QG 3.560 . 3.560 1.998 1.901 2.098 . 0 0 "[ . 1 . 2 . ]" 1 2600 1 122 PHE HB3 1 132 VAL MG2 4.070 . 4.070 2.233 1.970 3.878 . 0 0 "[ . 1 . 2 . ]" 1 2601 1 122 PHE HB3 1 133 MET H 4.480 . 4.480 3.820 3.427 4.080 . 0 0 "[ . 1 . 2 . ]" 1 2602 1 122 PHE QD 1 123 SER H 3.570 . 3.570 3.447 3.290 3.573 0.003 22 0 "[ . 1 . 2 . ]" 1 2603 1 122 PHE QD 1 123 SER HA 4.150 . 4.150 3.432 3.266 3.689 . 0 0 "[ . 1 . 2 . ]" 1 2604 1 122 PHE QD 1 123 SER HB3 5.500 . 5.500 5.538 5.458 5.572 0.072 21 0 "[ . 1 . 2 . ]" 1 2605 1 122 PHE QD 1 124 GLU H 4.560 . 4.560 3.942 3.537 4.278 . 0 0 "[ . 1 . 2 . ]" 1 2606 1 122 PHE QD 1 124 GLU HA 5.220 . 5.220 4.704 4.338 4.976 . 0 0 "[ . 1 . 2 . ]" 1 2607 1 122 PHE QD 1 124 GLU HB3 5.500 . 5.500 5.235 3.962 5.566 0.066 17 0 "[ . 1 . 2 . ]" 1 2608 1 122 PHE QD 1 130 LEU HA 4.700 . 4.700 4.003 3.556 4.315 . 0 0 "[ . 1 . 2 . ]" 1 2609 1 122 PHE QD 1 130 LEU HB3 4.210 . 4.210 2.970 2.198 3.398 . 0 0 "[ . 1 . 2 . ]" 1 2610 1 122 PHE QD 1 130 LEU MD1 4.470 . 4.470 3.420 2.215 3.884 . 0 0 "[ . 1 . 2 . ]" 1 2611 1 122 PHE QD 1 130 LEU QD 3.420 . 3.420 2.419 2.127 2.842 . 0 0 "[ . 1 . 2 . ]" 1 2612 1 122 PHE QD 1 130 LEU MD2 4.470 . 4.470 2.543 2.151 4.106 . 0 0 "[ . 1 . 2 . ]" 1 2613 1 122 PHE QD 1 130 LEU HG 5.500 . 5.500 5.045 2.613 5.529 0.029 2 0 "[ . 1 . 2 . ]" 1 2614 1 122 PHE QD 1 131 LYS H 4.950 . 4.950 4.652 4.203 4.951 0.001 3 0 "[ . 1 . 2 . ]" 1 2615 1 122 PHE QD 1 132 VAL HA 4.550 . 4.550 4.344 4.116 4.543 . 0 0 "[ . 1 . 2 . ]" 1 2616 1 122 PHE QD 1 132 VAL MG1 5.060 . 5.060 3.613 3.207 3.942 . 0 0 "[ . 1 . 2 . ]" 1 2617 1 122 PHE QD 1 132 VAL QG 4.410 . 4.410 3.254 2.988 3.443 . 0 0 "[ . 1 . 2 . ]" 1 2618 1 122 PHE QD 1 132 VAL MG2 5.060 . 5.060 3.758 3.497 4.960 . 0 0 "[ . 1 . 2 . ]" 1 2619 1 122 PHE QE 1 123 SER HA 4.920 . 4.920 4.732 4.465 4.988 0.068 22 0 "[ . 1 . 2 . ]" 1 2620 1 122 PHE QE 1 124 GLU H 5.080 . 5.080 4.966 4.712 5.111 0.031 7 0 "[ . 1 . 2 . ]" 1 2621 1 122 PHE QE 1 130 LEU MD1 4.770 . 4.770 3.709 2.600 4.116 . 0 0 "[ . 1 . 2 . ]" 1 2622 1 122 PHE QE 1 130 LEU QD 3.550 . 3.550 2.937 2.533 3.250 . 0 0 "[ . 1 . 2 . ]" 1 2623 1 122 PHE QE 1 130 LEU MD2 4.770 . 4.770 3.128 2.615 4.002 . 0 0 "[ . 1 . 2 . ]" 1 2624 1 122 PHE HZ 1 130 LEU MD1 5.500 . 5.500 5.007 4.656 5.364 . 0 0 "[ . 1 . 2 . ]" 1 2625 1 122 PHE HZ 1 130 LEU QD 5.080 . 5.080 4.497 4.248 4.790 . 0 0 "[ . 1 . 2 . ]" 1 2626 1 122 PHE HZ 1 130 LEU MD2 5.500 . 5.500 5.116 4.680 5.596 0.096 23 0 "[ . 1 . 2 . ]" 1 2627 1 123 SER H 1 123 SER HB2 3.830 . 3.830 3.272 3.099 3.370 . 0 0 "[ . 1 . 2 . ]" 1 2628 1 123 SER H 1 123 SER QB 3.250 . 3.250 2.660 2.503 2.743 . 0 0 "[ . 1 . 2 . ]" 1 2629 1 123 SER H 1 123 SER HB3 3.740 . 3.740 2.817 2.619 2.931 . 0 0 "[ . 1 . 2 . ]" 1 2630 1 123 SER H 1 130 LEU HA 4.620 . 4.620 4.121 3.673 4.430 . 0 0 "[ . 1 . 2 . ]" 1 2631 1 123 SER H 1 130 LEU HB3 5.050 . 5.050 4.258 3.876 4.635 . 0 0 "[ . 1 . 2 . ]" 1 2632 1 123 SER H 1 130 LEU QD 4.840 . 4.840 4.416 4.087 4.812 . 0 0 "[ . 1 . 2 . ]" 1 2633 1 123 SER H 1 131 LYS H 3.880 . 3.880 2.956 2.701 3.186 . 0 0 "[ . 1 . 2 . ]" 1 2634 1 123 SER H 1 131 LYS HA 4.680 . 4.680 4.633 4.488 4.711 0.031 28 0 "[ . 1 . 2 . ]" 1 2635 1 123 SER H 1 131 LYS HB2 5.040 . 5.040 4.791 4.323 5.013 . 0 0 "[ . 1 . 2 . ]" 1 2636 1 123 SER H 1 131 LYS QB 4.010 . 4.010 3.351 2.882 3.518 . 0 0 "[ . 1 . 2 . ]" 1 2637 1 123 SER H 1 131 LYS HB3 3.870 . 3.870 3.422 2.927 3.603 . 0 0 "[ . 1 . 2 . ]" 1 2638 1 123 SER H 1 131 LYS QG 5.090 . 5.090 4.576 4.225 5.026 . 0 0 "[ . 1 . 2 . ]" 1 2639 1 123 SER H 1 132 VAL HA 4.110 . 4.110 3.563 3.307 3.795 . 0 0 "[ . 1 . 2 . ]" 1 2640 1 123 SER H 1 132 VAL QG 4.840 . 4.840 4.065 3.986 4.193 . 0 0 "[ . 1 . 2 . ]" 1 2641 1 123 SER H 1 133 MET H 5.460 . 5.460 4.909 4.458 5.294 . 0 0 "[ . 1 . 2 . ]" 1 2642 1 123 SER QB 1 124 GLU H 3.950 . 3.950 3.751 3.636 3.880 . 0 0 "[ . 1 . 2 . ]" 1 2643 1 123 SER HB2 1 124 GLU H 4.600 . 4.600 4.310 4.185 4.425 . 0 0 "[ . 1 . 2 . ]" 1 2644 1 123 SER HB3 1 124 GLU H 4.370 . 4.370 4.126 3.924 4.297 . 0 0 "[ . 1 . 2 . ]" 1 2645 1 123 SER HB3 1 131 LYS HB3 4.310 . 4.310 3.517 2.530 3.841 . 0 0 "[ . 1 . 2 . ]" 1 2646 1 123 SER HB3 1 131 LYS QD 5.280 . 5.280 4.613 4.077 5.368 0.088 12 0 "[ . 1 . 2 . ]" 1 2647 1 123 SER HB3 1 131 LYS QG 5.190 . 5.190 4.928 3.809 5.240 0.050 7 0 "[ . 1 . 2 . ]" 1 2648 1 124 GLU H 1 124 GLU HB2 4.090 . 4.090 2.937 2.675 3.713 . 0 0 "[ . 1 . 2 . ]" 1 2649 1 124 GLU H 1 124 GLU HB3 4.050 . 4.050 2.441 2.342 2.624 . 0 0 "[ . 1 . 2 . ]" 1 2650 1 124 GLU H 1 130 LEU QD 4.350 . 4.350 3.501 3.089 3.754 . 0 0 "[ . 1 . 2 . ]" 1 2651 1 124 GLU H 1 131 LYS H 5.180 . 5.180 4.487 4.342 4.680 . 0 0 "[ . 1 . 2 . ]" 1 2652 1 124 GLU HA 1 124 GLU HG2 4.180 . 4.180 3.269 2.991 3.907 . 0 0 "[ . 1 . 2 . ]" 1 2653 1 124 GLU HA 1 124 GLU QG 3.590 . 3.590 2.682 2.372 3.419 . 0 0 "[ . 1 . 2 . ]" 1 2654 1 124 GLU HA 1 124 GLU HG3 4.180 . 4.180 2.869 2.445 4.205 0.025 27 0 "[ . 1 . 2 . ]" 1 2655 1 124 GLU HA 1 125 ILE H 3.100 . 3.100 2.111 2.040 2.199 . 0 0 "[ . 1 . 2 . ]" 1 2656 1 124 GLU HA 1 125 ILE QG 5.280 . 5.280 3.694 3.445 3.852 . 0 0 "[ . 1 . 2 . ]" 1 2657 1 124 GLU HA 1 130 LEU HA 3.370 . 3.370 2.029 1.873 2.324 . 0 0 "[ . 1 . 2 . ]" 1 2658 1 124 GLU HA 1 130 LEU HB3 5.500 . 5.500 4.242 3.965 4.647 . 0 0 "[ . 1 . 2 . ]" 1 2659 1 124 GLU HA 1 130 LEU QD 3.630 . 3.630 2.714 2.401 3.120 . 0 0 "[ . 1 . 2 . ]" 1 2660 1 124 GLU HA 1 130 LEU HG 5.000 . 5.000 4.690 4.267 5.052 0.052 23 0 "[ . 1 . 2 . ]" 1 2661 1 124 GLU HA 1 131 LYS H 4.050 . 4.050 2.727 2.325 3.127 . 0 0 "[ . 1 . 2 . ]" 1 2662 1 124 GLU QB 1 125 ILE H 4.280 . 4.280 3.480 2.739 3.738 . 0 0 "[ . 1 . 2 . ]" 1 2663 1 124 GLU HB2 1 125 ILE H 4.360 . 4.360 3.819 2.791 4.172 . 0 0 "[ . 1 . 2 . ]" 1 2664 1 124 GLU HB2 1 130 LEU H 5.110 . 5.110 5.056 4.454 5.198 0.088 12 0 "[ . 1 . 2 . ]" 1 2665 1 124 GLU HB2 1 130 LEU HA 4.860 . 4.860 3.224 2.882 3.563 . 0 0 "[ . 1 . 2 . ]" 1 2666 1 124 GLU HB2 1 130 LEU MD1 4.640 . 4.640 4.508 2.638 4.755 0.115 27 0 "[ . 1 . 2 . ]" 1 2667 1 124 GLU HB2 1 130 LEU QD 3.280 . 3.280 1.945 1.830 2.618 . 0 0 "[ . 1 . 2 . ]" 1 2668 1 124 GLU HB2 1 130 LEU MD2 4.640 . 4.640 2.010 1.831 4.379 . 0 0 "[ . 1 . 2 . ]" 1 2669 1 124 GLU HB3 1 125 ILE H 4.620 . 4.620 4.105 3.961 4.239 . 0 0 "[ . 1 . 2 . ]" 1 2670 1 124 GLU HB3 1 129 CYS H 5.500 . 5.500 5.487 4.639 5.589 0.089 25 0 "[ . 1 . 2 . ]" 1 2671 1 124 GLU HB3 1 130 LEU HA 5.080 . 5.080 4.368 3.294 4.818 . 0 0 "[ . 1 . 2 . ]" 1 2672 1 124 GLU HB3 1 130 LEU QD 4.140 . 4.140 3.125 1.897 3.445 . 0 0 "[ . 1 . 2 . ]" 1 2673 1 124 GLU QG 1 125 ILE H 4.340 . 4.340 2.718 2.313 3.599 . 0 0 "[ . 1 . 2 . ]" 1 2674 1 124 GLU QG 1 125 ILE MD 5.340 . 5.340 5.072 4.778 5.383 0.043 23 0 "[ . 1 . 2 . ]" 1 2675 1 124 GLU QG 1 125 ILE MG 5.250 . 5.250 4.594 4.399 5.056 . 0 0 "[ . 1 . 2 . ]" 1 2676 1 124 GLU QG 1 126 LYS H 3.780 . 3.780 2.834 2.350 3.664 . 0 0 "[ . 1 . 2 . ]" 1 2677 1 124 GLU QG 1 126 LYS HA 4.200 . 4.200 2.805 2.188 3.353 . 0 0 "[ . 1 . 2 . ]" 1 2678 1 124 GLU QG 1 128 GLY H 5.340 . 5.340 3.647 3.005 4.947 . 0 0 "[ . 1 . 2 . ]" 1 2679 1 124 GLU QG 1 129 CYS H 4.450 . 4.450 2.875 2.420 4.511 0.061 26 0 "[ . 1 . 2 . ]" 1 2680 1 124 GLU QG 1 130 LEU QD 4.100 . 4.100 2.897 2.378 3.677 . 0 0 "[ . 1 . 2 . ]" 1 2681 1 124 GLU HG2 1 126 LYS HA 5.500 . 5.500 3.078 2.218 4.891 . 0 0 "[ . 1 . 2 . ]" 1 2682 1 124 GLU HG3 1 126 LYS HA 5.410 . 5.410 3.909 2.438 4.853 . 0 0 "[ . 1 . 2 . ]" 1 2683 1 125 ILE H 1 125 ILE HB 3.690 . 3.690 2.450 2.364 2.538 . 0 0 "[ . 1 . 2 . ]" 1 2684 1 125 ILE H 1 125 ILE MD 4.050 . 4.050 3.495 3.177 3.846 . 0 0 "[ . 1 . 2 . ]" 1 2685 1 125 ILE H 1 125 ILE HG12 4.030 . 4.030 2.940 2.170 3.758 . 0 0 "[ . 1 . 2 . ]" 1 2686 1 125 ILE H 1 125 ILE QG 3.360 . 3.360 2.293 2.127 2.564 . 0 0 "[ . 1 . 2 . ]" 1 2687 1 125 ILE H 1 125 ILE HG13 4.030 . 4.030 3.025 2.148 3.873 . 0 0 "[ . 1 . 2 . ]" 1 2688 1 125 ILE H 1 125 ILE MG 3.900 . 3.900 3.765 3.735 3.792 . 0 0 "[ . 1 . 2 . ]" 1 2689 1 125 ILE H 1 126 LYS H 3.120 . 3.120 2.728 2.425 2.999 . 0 0 "[ . 1 . 2 . ]" 1 2690 1 125 ILE H 1 126 LYS QB 5.500 . 5.500 5.210 4.835 5.475 . 0 0 "[ . 1 . 2 . ]" 1 2691 1 125 ILE H 1 130 LEU HA 4.140 . 4.140 3.508 3.215 3.963 . 0 0 "[ . 1 . 2 . ]" 1 2692 1 125 ILE H 1 130 LEU QD 5.270 . 5.270 4.189 3.942 4.657 . 0 0 "[ . 1 . 2 . ]" 1 2693 1 125 ILE H 1 131 LYS H 5.340 . 5.340 3.604 3.293 3.904 . 0 0 "[ . 1 . 2 . ]" 1 2694 1 125 ILE H 1 131 LYS QB 5.500 . 5.500 4.039 3.672 4.428 . 0 0 "[ . 1 . 2 . ]" 1 2695 1 125 ILE HA 1 125 ILE MD 4.030 . 4.030 2.968 1.986 3.893 . 0 0 "[ . 1 . 2 . ]" 1 2696 1 125 ILE HA 1 125 ILE MG 3.470 . 3.470 2.488 2.411 2.571 . 0 0 "[ . 1 . 2 . ]" 1 2697 1 125 ILE HB 1 126 LYS H 3.240 . 3.240 2.020 1.799 2.204 . 0 0 "[ . 1 . 2 . ]" 1 2698 1 125 ILE HB 1 129 CYS H 5.500 . 5.500 4.297 4.016 4.874 . 0 0 "[ . 1 . 2 . ]" 1 2699 1 125 ILE MD 1 131 LYS H 5.500 . 5.500 4.298 3.775 4.935 . 0 0 "[ . 1 . 2 . ]" 1 2700 1 125 ILE QG 1 125 ILE MG 3.230 . 3.230 2.332 2.262 2.423 . 0 0 "[ . 1 . 2 . ]" 1 2701 1 125 ILE QG 1 126 LYS H 4.150 . 4.150 3.801 3.564 3.977 . 0 0 "[ . 1 . 2 . ]" 1 2702 1 125 ILE QG 1 129 CYS QB 5.180 . 5.180 3.791 2.933 4.722 . 0 0 "[ . 1 . 2 . ]" 1 2703 1 125 ILE QG 1 131 LYS H 5.500 . 5.500 3.487 3.022 4.056 . 0 0 "[ . 1 . 2 . ]" 1 2704 1 125 ILE HG12 1 126 LYS H 4.850 . 4.850 4.380 3.793 4.869 0.019 28 0 "[ . 1 . 2 . ]" 1 2705 1 125 ILE HG13 1 126 LYS H 4.850 . 4.850 4.271 3.872 4.639 . 0 0 "[ . 1 . 2 . ]" 1 2706 1 125 ILE MG 1 126 LYS H 3.560 . 3.560 2.798 2.539 3.110 . 0 0 "[ . 1 . 2 . ]" 1 2707 1 125 ILE MG 1 126 LYS HA 4.590 . 4.590 4.135 3.782 4.444 . 0 0 "[ . 1 . 2 . ]" 1 2708 1 125 ILE MG 1 126 LYS HB2 4.650 . 4.650 2.671 2.221 3.405 . 0 0 "[ . 1 . 2 . ]" 1 2709 1 125 ILE MG 1 126 LYS HB3 4.940 . 4.940 3.758 2.832 4.312 . 0 0 "[ . 1 . 2 . ]" 1 2710 1 125 ILE MG 1 126 LYS QE 5.200 . 5.200 4.176 2.995 5.033 . 0 0 "[ . 1 . 2 . ]" 1 2711 1 125 ILE MG 1 127 PRO QD 3.970 . 3.970 4.040 3.976 4.103 0.133 1 0 "[ . 1 . 2 . ]" 1 2712 1 126 LYS H 1 126 LYS HB2 3.410 . 3.410 3.165 2.841 3.477 0.067 3 0 "[ . 1 . 2 . ]" 1 2713 1 126 LYS H 1 126 LYS QB 3.690 . 3.690 2.962 2.750 3.215 . 0 0 "[ . 1 . 2 . ]" 1 2714 1 126 LYS H 1 126 LYS HG2 4.920 . 4.920 4.510 3.604 5.043 0.123 25 0 "[ . 1 . 2 . ]" 1 2715 1 126 LYS H 1 126 LYS QG 4.310 . 4.310 3.811 3.381 4.300 . 0 0 "[ . 1 . 2 . ]" 1 2716 1 126 LYS H 1 126 LYS HG3 4.920 . 4.920 4.203 3.515 4.979 0.059 8 0 "[ . 1 . 2 . ]" 1 2717 1 126 LYS H 1 127 PRO HB2 5.390 . 5.390 5.515 5.153 5.704 0.314 1 0 "[ . 1 . 2 . ]" 1 2718 1 126 LYS H 1 129 CYS H 4.180 . 4.180 3.256 3.071 3.552 . 0 0 "[ . 1 . 2 . ]" 1 2719 1 126 LYS H 1 129 CYS QB 5.200 . 5.200 3.390 2.158 4.676 . 0 0 "[ . 1 . 2 . ]" 1 2720 1 126 LYS HA 1 126 LYS QE 4.750 . 4.750 4.215 2.842 4.789 0.039 18 0 "[ . 1 . 2 . ]" 1 2721 1 126 LYS HA 1 127 PRO QD 3.510 . 3.510 3.505 3.303 3.608 0.098 19 0 "[ . 1 . 2 . ]" 1 2722 1 126 LYS HB2 1 126 LYS QE 4.200 . 4.200 3.035 2.023 4.222 0.022 26 0 "[ . 1 . 2 . ]" 1 2723 1 126 LYS HB2 1 127 PRO HD2 4.170 . 4.170 2.566 1.959 3.446 . 0 0 "[ . 1 . 2 . ]" 1 2724 1 126 LYS HB2 1 127 PRO QD 3.520 . 3.520 2.511 1.951 3.303 . 0 0 "[ . 1 . 2 . ]" 1 2725 1 126 LYS HB2 1 127 PRO HD3 4.170 . 4.170 3.841 3.482 4.313 0.143 25 0 "[ . 1 . 2 . ]" 1 2726 1 126 LYS HB3 1 126 LYS QE 4.200 . 4.200 3.029 1.888 4.117 . 0 0 "[ . 1 . 2 . ]" 1 2727 1 126 LYS HB3 1 127 PRO HA 4.610 . 4.610 4.570 4.240 4.793 0.183 25 0 "[ . 1 . 2 . ]" 1 2728 1 126 LYS HB3 1 127 PRO HD2 4.170 . 4.170 1.783 1.681 1.881 . 0 0 "[ . 1 . 2 . ]" 1 2729 1 126 LYS HB3 1 127 PRO QD 3.410 . 3.410 1.743 1.669 1.805 . 0 0 "[ . 1 . 2 . ]" 1 2730 1 126 LYS HB3 1 127 PRO HD3 4.170 . 4.170 2.534 2.225 2.981 . 0 0 "[ . 1 . 2 . ]" 1 2731 1 126 LYS QG 1 127 PRO QD 4.330 . 4.330 3.047 1.801 3.615 . 0 0 "[ . 1 . 2 . ]" 1 2732 1 127 PRO HA 1 128 GLY H 3.520 . 3.520 2.583 2.140 3.164 . 0 0 "[ . 1 . 2 . ]" 1 2733 1 127 PRO HA 1 128 GLY HA2 4.900 . 4.900 4.318 4.096 4.491 . 0 0 "[ . 1 . 2 . ]" 1 2734 1 127 PRO HA 1 129 CYS H 5.500 . 5.500 4.411 4.233 4.641 . 0 0 "[ . 1 . 2 . ]" 1 2735 1 127 PRO HB2 1 128 GLY HA2 5.130 . 5.130 4.567 3.944 5.033 . 0 0 "[ . 1 . 2 . ]" 1 2736 1 127 PRO HB2 1 129 CYS H 5.500 . 5.500 4.348 3.711 4.732 . 0 0 "[ . 1 . 2 . ]" 1 2737 1 127 PRO HG2 1 129 CYS H 4.720 . 4.720 4.807 4.767 4.900 0.180 12 0 "[ . 1 . 2 . ]" 1 2738 1 128 GLY H 1 129 CYS H 4.370 . 4.370 2.739 2.100 3.175 . 0 0 "[ . 1 . 2 . ]" 1 2739 1 129 CYS H 1 129 CYS HB2 4.110 . 4.110 3.171 2.616 3.831 . 0 0 "[ . 1 . 2 . ]" 1 2740 1 129 CYS H 1 129 CYS QB 3.420 . 3.420 2.597 2.264 3.168 . 0 0 "[ . 1 . 2 . ]" 1 2741 1 129 CYS H 1 129 CYS HB3 4.110 . 4.110 2.789 2.405 3.717 . 0 0 "[ . 1 . 2 . ]" 1 2742 1 129 CYS H 1 130 LEU H 4.470 . 4.470 4.166 4.011 4.390 . 0 0 "[ . 1 . 2 . ]" 1 2743 1 129 CYS H 1 130 LEU QD 5.380 . 5.380 4.230 3.869 4.612 . 0 0 "[ . 1 . 2 . ]" 1 2744 1 129 CYS HA 1 130 LEU H 3.160 . 3.160 2.022 1.954 2.077 . 0 0 "[ . 1 . 2 . ]" 1 2745 1 129 CYS HA 1 130 LEU HB2 5.500 . 5.500 4.473 4.355 4.554 . 0 0 "[ . 1 . 2 . ]" 1 2746 1 129 CYS HA 1 130 LEU HG 5.500 . 5.500 3.804 3.466 5.623 0.123 23 0 "[ . 1 . 2 . ]" 1 2747 1 129 CYS HB2 1 130 LEU H 4.890 . 4.890 4.032 3.311 4.365 . 0 0 "[ . 1 . 2 . ]" 1 2748 1 129 CYS HB3 1 130 LEU H 4.890 . 4.890 4.247 3.386 4.407 . 0 0 "[ . 1 . 2 . ]" 1 2749 1 130 LEU H 1 130 LEU HB2 3.590 . 3.590 2.487 2.418 2.559 . 0 0 "[ . 1 . 2 . ]" 1 2750 1 130 LEU H 1 130 LEU QB 3.450 . 3.450 2.445 2.383 2.509 . 0 0 "[ . 1 . 2 . ]" 1 2751 1 130 LEU H 1 130 LEU HB3 3.990 . 3.990 3.602 3.566 3.642 . 0 0 "[ . 1 . 2 . ]" 1 2752 1 130 LEU H 1 130 LEU MD1 4.730 . 4.730 3.678 3.144 3.792 . 0 0 "[ . 1 . 2 . ]" 1 2753 1 130 LEU H 1 130 LEU QD 3.850 . 3.850 3.104 2.091 3.361 . 0 0 "[ . 1 . 2 . ]" 1 2754 1 130 LEU H 1 130 LEU MD2 4.730 . 4.730 3.359 2.123 3.793 . 0 0 "[ . 1 . 2 . ]" 1 2755 1 130 LEU H 1 130 LEU HG 4.160 . 4.160 2.508 2.347 4.081 . 0 0 "[ . 1 . 2 . ]" 1 2756 1 130 LEU H 1 131 LYS HA 5.200 . 5.200 4.966 4.791 5.119 . 0 0 "[ . 1 . 2 . ]" 1 2757 1 130 LEU HA 1 130 LEU MD1 4.370 . 4.370 3.846 2.184 3.944 . 0 0 "[ . 1 . 2 . ]" 1 2758 1 130 LEU HA 1 130 LEU QD 3.440 . 3.440 2.160 2.073 2.280 . 0 0 "[ . 1 . 2 . ]" 1 2759 1 130 LEU HA 1 130 LEU MD2 4.370 . 4.370 2.217 2.081 3.478 . 0 0 "[ . 1 . 2 . ]" 1 2760 1 130 LEU HA 1 130 LEU HG 4.150 . 4.150 3.251 3.036 3.658 . 0 0 "[ . 1 . 2 . ]" 1 2761 1 130 LEU HA 1 131 LYS H 3.210 . 3.210 2.185 2.135 2.222 . 0 0 "[ . 1 . 2 . ]" 1 2762 1 130 LEU HA 1 131 LYS HB2 5.010 . 5.010 4.604 4.403 4.824 . 0 0 "[ . 1 . 2 . ]" 1 2763 1 130 LEU HA 1 131 LYS HB3 4.990 . 4.990 4.689 4.564 4.891 . 0 0 "[ . 1 . 2 . ]" 1 2764 1 130 LEU QB 1 131 LYS H 4.460 . 4.460 3.411 3.198 3.543 . 0 0 "[ . 1 . 2 . ]" 1 2765 1 130 LEU HB2 1 131 LYS H 4.670 . 4.670 4.261 4.167 4.369 . 0 0 "[ . 1 . 2 . ]" 1 2766 1 130 LEU HB3 1 130 LEU MD1 3.610 . 3.610 2.397 2.362 2.601 . 0 0 "[ . 1 . 2 . ]" 1 2767 1 130 LEU HB3 1 130 LEU QD 3.060 . 3.060 2.131 2.095 2.488 . 0 0 "[ . 1 . 2 . ]" 1 2768 1 130 LEU HB3 1 130 LEU MD2 3.610 . 3.610 2.395 2.296 3.166 . 0 0 "[ . 1 . 2 . ]" 1 2769 1 130 LEU HB3 1 131 LYS H 4.760 . 4.760 3.591 3.319 3.765 . 0 0 "[ . 1 . 2 . ]" 1 2770 1 130 LEU QD 1 131 LYS H 5.140 . 5.140 3.848 3.668 3.985 . 0 0 "[ . 1 . 2 . ]" 1 2771 1 131 LYS H 1 131 LYS HB2 3.940 . 3.940 2.728 2.455 2.910 . 0 0 "[ . 1 . 2 . ]" 1 2772 1 131 LYS H 1 131 LYS QB 3.690 . 3.690 2.320 2.259 2.381 . 0 0 "[ . 1 . 2 . ]" 1 2773 1 131 LYS H 1 131 LYS HB3 3.820 . 3.820 2.522 2.441 2.717 . 0 0 "[ . 1 . 2 . ]" 1 2774 1 131 LYS H 1 131 LYS QG 4.360 . 4.360 3.999 3.946 4.031 . 0 0 "[ . 1 . 2 . ]" 1 2775 1 131 LYS H 1 132 VAL QG 5.440 . 5.440 4.258 4.079 4.344 . 0 0 "[ . 1 . 2 . ]" 1 2776 1 131 LYS HA 1 131 LYS QE 5.340 . 5.340 4.585 3.726 4.867 . 0 0 "[ . 1 . 2 . ]" 1 2777 1 131 LYS HA 1 131 LYS QG 3.850 . 3.850 2.452 2.322 2.819 . 0 0 "[ . 1 . 2 . ]" 1 2778 1 131 LYS HA 1 132 VAL H 3.310 . 3.310 2.115 2.058 2.255 . 0 0 "[ . 1 . 2 . ]" 1 2779 1 131 LYS HA 1 132 VAL HB 5.500 . 5.500 4.648 4.473 5.559 0.059 28 0 "[ . 1 . 2 . ]" 1 2780 1 131 LYS HA 1 132 VAL QG 4.450 . 4.450 3.435 3.279 3.644 . 0 0 "[ . 1 . 2 . ]" 1 2781 1 131 LYS HB2 1 131 LYS QD 3.720 . 3.720 2.365 2.235 2.964 . 0 0 "[ . 1 . 2 . ]" 1 2782 1 131 LYS HB3 1 131 LYS HD2 4.180 . 4.180 3.050 2.449 3.726 . 0 0 "[ . 1 . 2 . ]" 1 2783 1 131 LYS HB3 1 131 LYS QD 3.450 . 3.450 2.449 2.348 3.242 . 0 0 "[ . 1 . 2 . ]" 1 2784 1 131 LYS HB3 1 131 LYS HD3 4.180 . 4.180 2.652 2.449 3.740 . 0 0 "[ . 1 . 2 . ]" 1 2785 1 131 LYS HE2 1 131 LYS QG 3.740 . 3.740 2.468 2.304 3.301 . 0 0 "[ . 1 . 2 . ]" 1 2786 1 131 LYS HE3 1 131 LYS QG 3.740 . 3.740 2.626 2.346 3.321 . 0 0 "[ . 1 . 2 . ]" 1 2787 1 131 LYS QG 1 132 VAL H 4.240 . 4.240 3.175 2.826 3.458 . 0 0 "[ . 1 . 2 . ]" 1 2788 1 131 LYS QG 1 133 MET ME 4.160 . 4.160 2.986 2.021 3.987 . 0 0 "[ . 1 . 2 . ]" 1 2789 1 132 VAL H 1 132 VAL HB 3.650 . 3.650 2.596 2.460 3.675 0.025 28 0 "[ . 1 . 2 . ]" 1 2790 1 132 VAL H 1 132 VAL QG 3.420 . 3.420 2.287 2.058 2.487 . 0 0 "[ . 1 . 2 . ]" 1 2791 1 132 VAL H 1 133 MET ME 5.500 . 5.500 5.071 3.793 5.644 0.144 1 0 "[ . 1 . 2 . ]" 1 2792 1 132 VAL HA 1 132 VAL MG1 3.590 . 3.590 2.403 2.365 2.647 . 0 0 "[ . 1 . 2 . ]" 1 2793 1 132 VAL HA 1 132 VAL QG 2.990 . 2.990 2.191 2.152 2.519 . 0 0 "[ . 1 . 2 . ]" 1 2794 1 132 VAL HA 1 132 VAL MG2 3.590 . 3.590 2.533 2.451 3.200 . 0 0 "[ . 1 . 2 . ]" 1 2795 1 132 VAL HA 1 133 MET H 2.790 . 2.790 2.159 2.110 2.249 . 0 0 "[ . 1 . 2 . ]" 1 2796 1 132 VAL HA 1 133 MET QB 4.780 . 4.780 4.413 4.224 4.615 . 0 0 "[ . 1 . 2 . ]" 1 2797 1 132 VAL HB 1 133 MET H 4.050 . 4.050 3.917 2.661 4.068 0.018 2 0 "[ . 1 . 2 . ]" 1 2798 1 132 VAL QG 1 133 MET H 2.940 . 2.940 2.567 2.426 2.996 0.056 22 0 "[ . 1 . 2 . ]" 1 2799 1 132 VAL QG 1 133 MET HA 4.360 . 4.360 3.761 3.560 3.883 . 0 0 "[ . 1 . 2 . ]" 1 2800 1 132 VAL QG 1 133 MET QB 4.400 . 4.400 3.987 3.841 4.318 . 0 0 "[ . 1 . 2 . ]" 1 2801 1 132 VAL QG 1 134 LEU H 5.180 . 5.180 4.206 4.002 4.469 . 0 0 "[ . 1 . 2 . ]" 1 2802 1 133 MET H 1 133 MET QB 2.990 . 2.990 2.475 2.312 2.661 . 0 0 "[ . 1 . 2 . ]" 1 2803 1 133 MET H 1 133 MET ME 4.790 . 4.790 4.114 3.067 4.797 0.007 28 0 "[ . 1 . 2 . ]" 1 2804 1 133 MET H 1 133 MET HG2 3.460 . 3.460 2.636 2.330 2.998 . 0 0 "[ . 1 . 2 . ]" 1 2805 1 133 MET H 1 133 MET QG 3.100 . 3.100 2.585 2.311 2.925 . 0 0 "[ . 1 . 2 . ]" 1 2806 1 133 MET H 1 133 MET HG3 4.060 . 4.060 3.833 3.271 4.088 0.028 10 0 "[ . 1 . 2 . ]" 1 2807 1 133 MET H 1 134 LEU H 4.580 . 4.580 4.381 4.230 4.480 . 0 0 "[ . 1 . 2 . ]" 1 2808 1 133 MET HA 1 133 MET ME 3.670 . 3.670 2.679 1.956 3.691 0.021 21 0 "[ . 1 . 2 . ]" 1 2809 1 133 MET HA 1 133 MET HG2 4.220 . 4.220 3.082 2.672 3.439 . 0 0 "[ . 1 . 2 . ]" 1 2810 1 133 MET HA 1 134 LEU H 2.880 . 2.880 2.153 2.021 2.258 . 0 0 "[ . 1 . 2 . ]" 1 2811 1 133 MET HA 1 134 LEU HB2 5.340 . 5.340 4.580 4.460 4.665 . 0 0 "[ . 1 . 2 . ]" 1 2812 1 133 MET HA 1 134 LEU MD1 5.500 . 5.500 5.064 4.866 5.256 . 0 0 "[ . 1 . 2 . ]" 1 2813 1 133 MET HA 1 134 LEU HG 5.220 . 5.220 3.738 3.465 4.007 . 0 0 "[ . 1 . 2 . ]" 1 2814 1 133 MET QB 1 134 LEU H 3.720 . 3.720 2.963 2.687 3.221 . 0 0 "[ . 1 . 2 . ]" 1 2815 1 133 MET ME 1 133 MET HG2 3.920 . 3.920 2.657 2.318 3.404 . 0 0 "[ . 1 . 2 . ]" 1 2816 1 133 MET ME 1 133 MET HG3 3.920 . 3.920 2.925 2.544 3.431 . 0 0 "[ . 1 . 2 . ]" 1 2817 1 133 MET ME 1 134 LEU H 4.880 . 4.880 4.015 2.923 5.041 0.161 25 0 "[ . 1 . 2 . ]" 1 2818 1 133 MET QG 1 134 LEU H 4.900 . 4.900 4.541 4.246 4.763 . 0 0 "[ . 1 . 2 . ]" 1 2819 1 133 MET HG2 1 134 LEU H 5.160 . 5.160 4.970 4.648 5.205 0.045 7 0 "[ . 1 . 2 . ]" 1 2820 1 134 LEU H 1 134 LEU HB2 3.330 . 3.330 2.481 2.399 2.573 . 0 0 "[ . 1 . 2 . ]" 1 2821 1 134 LEU H 1 134 LEU QB 3.200 . 3.200 2.442 2.366 2.525 . 0 0 "[ . 1 . 2 . ]" 1 2822 1 134 LEU H 1 134 LEU HB3 3.910 . 3.910 3.634 3.580 3.691 . 0 0 "[ . 1 . 2 . ]" 1 2823 1 134 LEU H 1 134 LEU MD1 3.910 . 3.910 3.761 3.595 3.920 0.010 25 0 "[ . 1 . 2 . ]" 1 2824 1 134 LEU H 1 134 LEU QD 3.230 . 3.230 3.180 3.039 3.288 0.058 9 0 "[ . 1 . 2 . ]" 1 2825 1 134 LEU H 1 134 LEU MD2 3.870 . 3.870 3.433 3.201 3.545 . 0 0 "[ . 1 . 2 . ]" 1 2826 1 134 LEU H 1 134 LEU HG 3.860 . 3.860 2.508 2.323 2.725 . 0 0 "[ . 1 . 2 . ]" 1 2827 1 134 LEU H 1 135 LYS H 4.800 . 4.800 4.552 4.452 4.624 . 0 0 "[ . 1 . 2 . ]" 1 2828 1 134 LEU HA 1 134 LEU MD1 4.240 . 4.240 3.840 3.815 3.870 . 0 0 "[ . 1 . 2 . ]" 1 2829 1 134 LEU HA 1 134 LEU QD 2.920 . 2.920 2.024 1.959 2.094 . 0 0 "[ . 1 . 2 . ]" 1 2830 1 134 LEU HA 1 134 LEU MD2 4.240 . 4.240 2.031 1.965 2.103 . 0 0 "[ . 1 . 2 . ]" 1 2831 1 134 LEU HA 1 134 LEU HG 4.200 . 4.200 3.125 3.052 3.213 . 0 0 "[ . 1 . 2 . ]" 1 2832 1 134 LEU HA 1 135 LYS H 2.860 . 2.860 2.408 2.154 2.714 . 0 0 "[ . 1 . 2 . ]" 1 2833 1 134 LEU HA 1 135 LYS QB 4.910 . 4.910 4.304 4.066 4.774 . 0 0 "[ . 1 . 2 . ]" 1 2834 1 134 LEU HA 1 135 LYS QG 4.480 . 4.480 3.398 2.982 3.845 . 0 0 "[ . 1 . 2 . ]" 1 2835 1 134 LEU QB 1 135 LYS H 3.320 . 3.320 2.318 1.869 2.693 . 0 0 "[ . 1 . 2 . ]" 1 2836 1 134 LEU HB2 1 134 LEU MD1 3.300 . 3.300 2.348 2.297 2.378 . 0 0 "[ . 1 . 2 . ]" 1 2837 1 134 LEU HB2 1 135 LYS H 3.770 . 3.770 3.535 3.107 3.797 0.027 23 0 "[ . 1 . 2 . ]" 1 2838 1 134 LEU HB3 1 135 LYS H 3.440 . 3.440 2.352 1.883 2.755 . 0 0 "[ . 1 . 2 . ]" 1 2839 1 134 LEU QD 1 135 LYS H 3.800 . 3.800 3.253 3.080 3.459 . 0 0 "[ . 1 . 2 . ]" 1 2840 1 134 LEU MD1 1 135 LYS H 4.870 . 4.870 4.307 3.889 4.716 . 0 0 "[ . 1 . 2 . ]" 1 2841 1 134 LEU MD2 1 135 LYS H 4.870 . 4.870 3.373 3.176 3.558 . 0 0 "[ . 1 . 2 . ]" 1 2842 1 134 LEU MD2 1 135 LYS QD 5.460 . 5.460 5.324 4.469 5.537 0.077 19 0 "[ . 1 . 2 . ]" 1 2843 1 135 LYS H 1 135 LYS QB 3.440 . 3.440 2.836 2.325 3.249 . 0 0 "[ . 1 . 2 . ]" 1 2844 1 135 LYS H 1 135 LYS QD 4.120 . 4.120 3.921 2.381 4.179 0.059 9 0 "[ . 1 . 2 . ]" 1 2845 1 135 LYS H 1 135 LYS QG 3.070 . 3.070 2.265 1.897 2.736 . 0 0 "[ . 1 . 2 . ]" 1 2846 1 135 LYS HA 1 135 LYS QG 3.620 . 3.620 3.118 2.391 3.380 . 0 0 "[ . 1 . 2 . ]" 1 2847 1 135 LYS QB 1 135 LYS QD 3.340 . 3.340 2.258 2.057 2.713 . 0 0 "[ . 1 . 2 . ]" 1 stop_ save_
Contact the webmaster for help, if required. Sunday, July 7, 2024 3:37:37 PM GMT (wattos1)