NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
521391 | 2rs4 | 11451 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2rs4 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 2008 _Distance_constraint_stats_list.Viol_count 5658 _Distance_constraint_stats_list.Viol_total 2693.467 _Distance_constraint_stats_list.Viol_max 0.402 _Distance_constraint_stats_list.Viol_rms 0.0125 _Distance_constraint_stats_list.Viol_average_all_restraints 0.0034 _Distance_constraint_stats_list.Viol_average_violations_only 0.0238 _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 1 MET 0.563 0.055 15 0 "[ . 1 . 2]" 1 2 VAL 0.558 0.020 4 0 "[ . 1 . 2]" 1 3 THR 1.014 0.059 15 0 "[ . 1 . 2]" 1 4 PHE 0.475 0.020 4 0 "[ . 1 . 2]" 1 5 HIS 1.296 0.052 6 0 "[ . 1 . 2]" 1 6 THR 1.716 0.091 6 0 "[ . 1 . 2]" 1 7 ASN 3.478 0.112 6 0 "[ . 1 . 2]" 1 8 HIS 0.729 0.038 14 0 "[ . 1 . 2]" 1 9 GLY 1.686 0.102 14 0 "[ . 1 . 2]" 1 10 ASP 2.520 0.102 14 0 "[ . 1 . 2]" 1 11 ILE 0.934 0.047 8 0 "[ . 1 . 2]" 1 12 VAL 0.429 0.032 20 0 "[ . 1 . 2]" 1 13 ILE 3.450 0.059 19 0 "[ . 1 . 2]" 1 14 LYS 2.889 0.073 11 0 "[ . 1 . 2]" 1 15 THR 1.206 0.078 20 0 "[ . 1 . 2]" 1 16 PHE 6.717 0.309 5 0 "[ . 1 . 2]" 1 17 ASP 3.043 0.078 10 0 "[ . 1 . 2]" 1 18 ASP 1.300 0.054 14 0 "[ . 1 . 2]" 1 19 LYS 2.543 0.107 12 0 "[ . 1 . 2]" 1 20 ALA 3.079 0.078 10 0 "[ . 1 . 2]" 1 21 PRO 0.782 0.020 12 0 "[ . 1 . 2]" 1 22 GLU 1.095 0.039 17 0 "[ . 1 . 2]" 1 23 THR 0.936 0.039 17 0 "[ . 1 . 2]" 1 24 VAL 0.040 0.017 18 0 "[ . 1 . 2]" 1 25 LYS 0.699 0.027 11 0 "[ . 1 . 2]" 1 26 ASN 3.061 0.402 12 0 "[ . 1 . 2]" 1 27 PHE 1.297 0.036 12 0 "[ . 1 . 2]" 1 28 LEU 2.057 0.052 3 0 "[ . 1 . 2]" 1 29 ASP 2.621 0.052 3 0 "[ . 1 . 2]" 1 30 TYR 4.206 0.402 12 0 "[ . 1 . 2]" 1 31 CYS 3.782 0.084 6 0 "[ . 1 . 2]" 1 32 ARG 2.775 0.115 17 0 "[ . 1 . 2]" 1 33 GLU 1.190 0.050 20 0 "[ . 1 . 2]" 1 34 GLY 1.575 0.044 8 0 "[ . 1 . 2]" 1 35 PHE 2.934 0.053 3 0 "[ . 1 . 2]" 1 36 TYR 2.993 0.079 6 0 "[ . 1 . 2]" 1 37 ASN 1.732 0.079 6 0 "[ . 1 . 2]" 1 38 ASN 1.607 0.078 15 0 "[ . 1 . 2]" 1 39 THR 1.718 0.078 15 0 "[ . 1 . 2]" 1 40 ILE 0.364 0.040 6 0 "[ . 1 . 2]" 1 41 PHE 0.828 0.045 19 0 "[ . 1 . 2]" 1 42 HIS 0.123 0.014 4 0 "[ . 1 . 2]" 1 43 ARG 2.427 0.101 9 0 "[ . 1 . 2]" 1 44 VAL 1.118 0.084 11 0 "[ . 1 . 2]" 1 45 ILE 1.634 0.051 16 0 "[ . 1 . 2]" 1 46 ASN 1.982 0.050 9 0 "[ . 1 . 2]" 1 47 GLY 0.169 0.048 7 0 "[ . 1 . 2]" 1 48 PHE 3.861 0.344 7 0 "[ . 1 . 2]" 1 49 MET 3.556 0.077 11 0 "[ . 1 . 2]" 1 50 ILE 1.289 0.048 2 0 "[ . 1 . 2]" 1 51 GLN 0.989 0.060 8 0 "[ . 1 . 2]" 1 52 GLY 0.312 0.034 1 0 "[ . 1 . 2]" 1 53 GLY 0.318 0.025 7 0 "[ . 1 . 2]" 1 54 GLY 0.000 0.000 . 0 "[ . 1 . 2]" 1 55 PHE 2.243 0.060 9 0 "[ . 1 . 2]" 1 56 GLU 0.756 0.056 10 0 "[ . 1 . 2]" 1 57 PRO 1.648 0.060 1 0 "[ . 1 . 2]" 1 58 GLY 2.392 0.060 1 0 "[ . 1 . 2]" 1 59 MET 1.249 0.042 18 0 "[ . 1 . 2]" 1 60 LYS 1.401 0.045 16 0 "[ . 1 . 2]" 1 61 GLN 3.350 0.203 9 0 "[ . 1 . 2]" 1 62 LYS 6.089 0.203 9 0 "[ . 1 . 2]" 1 63 ALA 1.731 0.158 9 0 "[ . 1 . 2]" 1 64 THR 0.422 0.039 14 0 "[ . 1 . 2]" 1 65 LYS 3.324 0.111 11 0 "[ . 1 . 2]" 1 66 GLU 1.159 0.053 10 0 "[ . 1 . 2]" 1 67 PRO 0.973 0.053 10 0 "[ . 1 . 2]" 1 68 ILE 2.260 0.058 9 0 "[ . 1 . 2]" 1 69 LYS 3.533 0.108 4 0 "[ . 1 . 2]" 1 70 ASN 0.617 0.042 2 0 "[ . 1 . 2]" 1 71 GLU 0.349 0.060 8 0 "[ . 1 . 2]" 1 72 ALA 0.165 0.044 9 0 "[ . 1 . 2]" 1 73 ASN 0.973 0.057 2 0 "[ . 1 . 2]" 1 74 ASN 1.342 0.051 18 0 "[ . 1 . 2]" 1 75 GLY 0.741 0.037 9 0 "[ . 1 . 2]" 1 76 LEU 2.302 0.309 5 0 "[ . 1 . 2]" 1 77 LYS 2.388 0.073 7 0 "[ . 1 . 2]" 1 78 ASN 2.186 0.073 7 0 "[ . 1 . 2]" 1 79 THR 1.225 0.057 15 0 "[ . 1 . 2]" 1 80 ARG 1.489 0.091 15 0 "[ . 1 . 2]" 1 81 GLY 1.365 0.091 15 0 "[ . 1 . 2]" 1 82 THR 1.757 0.104 20 0 "[ . 1 . 2]" 1 83 LEU 3.666 0.069 1 0 "[ . 1 . 2]" 1 84 ALA 1.488 0.049 15 0 "[ . 1 . 2]" 1 85 MET 1.262 0.071 17 0 "[ . 1 . 2]" 1 86 ALA 1.391 0.074 19 0 "[ . 1 . 2]" 1 87 ARG 0.162 0.026 3 0 "[ . 1 . 2]" 1 88 THR 0.892 0.042 9 0 "[ . 1 . 2]" 1 89 GLN 0.780 0.089 10 0 "[ . 1 . 2]" 1 90 ALA 0.715 0.042 9 0 "[ . 1 . 2]" 1 91 PRO 0.203 0.017 7 0 "[ . 1 . 2]" 1 92 HIS 0.227 0.017 1 0 "[ . 1 . 2]" 1 93 SER 0.034 0.021 14 0 "[ . 1 . 2]" 1 94 ALA 1.344 0.185 20 0 "[ . 1 . 2]" 1 95 THR 1.224 0.185 20 0 "[ . 1 . 2]" 1 96 ALA 1.088 0.061 20 0 "[ . 1 . 2]" 1 97 GLN 1.971 0.074 19 0 "[ . 1 . 2]" 1 98 PHE 3.213 0.071 17 0 "[ . 1 . 2]" 1 99 PHE 3.277 0.069 1 0 "[ . 1 . 2]" 1 100 ILE 0.578 0.030 2 0 "[ . 1 . 2]" 1 101 ASN 1.627 0.077 11 0 "[ . 1 . 2]" 1 102 VAL 0.658 0.062 1 0 "[ . 1 . 2]" 1 103 VAL 1.706 0.062 1 0 "[ . 1 . 2]" 1 104 ASP 0.762 0.061 18 0 "[ . 1 . 2]" 1 105 ASN 5.032 0.344 7 0 "[ . 1 . 2]" 1 106 ASP 1.514 0.095 4 0 "[ . 1 . 2]" 1 107 PHE 1.675 0.095 4 0 "[ . 1 . 2]" 1 108 LEU 0.931 0.037 13 0 "[ . 1 . 2]" 1 109 ASN 1.381 0.053 2 0 "[ . 1 . 2]" 1 110 PHE 0.842 0.043 2 0 "[ . 1 . 2]" 1 111 SER 0.455 0.025 4 0 "[ . 1 . 2]" 1 112 GLY 0.388 0.025 20 0 "[ . 1 . 2]" 1 113 GLU 2.379 0.073 13 0 "[ . 1 . 2]" 1 114 SER 2.186 0.058 16 0 "[ . 1 . 2]" 1 115 LEU 0.613 0.049 20 0 "[ . 1 . 2]" 1 116 GLN 0.969 0.059 14 0 "[ . 1 . 2]" 1 117 GLY 0.468 0.059 14 0 "[ . 1 . 2]" 1 118 TRP 2.152 0.073 13 0 "[ . 1 . 2]" 1 119 GLY 0.000 0.000 . 0 "[ . 1 . 2]" 1 120 TYR 1.345 0.081 1 0 "[ . 1 . 2]" 1 121 CYS 1.394 0.081 1 0 "[ . 1 . 2]" 1 122 VAL 1.114 0.047 10 0 "[ . 1 . 2]" 1 123 PHE 1.480 0.059 19 0 "[ . 1 . 2]" 1 124 ALA 2.461 0.049 15 0 "[ . 1 . 2]" 1 125 GLU 3.186 0.078 20 0 "[ . 1 . 2]" 1 126 VAL 3.075 0.104 20 0 "[ . 1 . 2]" 1 127 VAL 0.943 0.036 5 0 "[ . 1 . 2]" 1 128 ASP 0.958 0.032 9 0 "[ . 1 . 2]" 1 129 GLY 1.384 0.048 11 0 "[ . 1 . 2]" 1 130 MET 2.680 0.048 11 0 "[ . 1 . 2]" 1 131 ASP 1.005 0.030 12 0 "[ . 1 . 2]" 1 132 VAL 0.746 0.036 5 0 "[ . 1 . 2]" 1 133 VAL 0.892 0.031 3 0 "[ . 1 . 2]" 1 134 ASP 1.280 0.061 12 0 "[ . 1 . 2]" 1 135 LYS 2.805 0.061 12 0 "[ . 1 . 2]" 1 136 ILE 1.050 0.042 10 0 "[ . 1 . 2]" 1 137 LYS 2.399 0.065 5 0 "[ . 1 . 2]" 1 138 GLY 1.022 0.060 9 0 "[ . 1 . 2]" 1 139 VAL 1.889 0.136 2 0 "[ . 1 . 2]" 1 140 ALA 1.179 0.136 2 0 "[ . 1 . 2]" 1 141 THR 0.998 0.043 11 0 "[ . 1 . 2]" 1 142 GLY 1.929 0.072 7 0 "[ . 1 . 2]" 1 143 ARG 1.683 0.072 7 0 "[ . 1 . 2]" 1 144 SER 0.321 0.028 17 0 "[ . 1 . 2]" 1 145 GLY 0.000 0.000 . 0 "[ . 1 . 2]" 1 146 MET 0.000 0.000 . 0 "[ . 1 . 2]" 1 147 HIS 1.046 0.104 20 0 "[ . 1 . 2]" 1 148 GLN 1.522 0.104 20 0 "[ . 1 . 2]" 1 149 ASP 0.365 0.061 6 0 "[ . 1 . 2]" 1 150 VAL 0.268 0.028 17 0 "[ . 1 . 2]" 1 151 PRO 0.189 0.026 5 0 "[ . 1 . 2]" 1 152 LYS 2.074 0.061 7 0 "[ . 1 . 2]" 1 153 GLU 1.259 0.063 12 0 "[ . 1 . 2]" 1 154 ASP 1.264 0.075 20 0 "[ . 1 . 2]" 1 155 VAL 2.849 0.075 20 0 "[ . 1 . 2]" 1 156 ILE 3.443 0.091 19 0 "[ . 1 . 2]" 1 157 ILE 2.579 0.091 19 0 "[ . 1 . 2]" 1 158 GLU 0.005 0.003 14 0 "[ . 1 . 2]" 1 159 SER 2.245 0.112 6 0 "[ . 1 . 2]" 1 160 VAL 0.515 0.027 14 0 "[ . 1 . 2]" 1 161 THR 0.407 0.027 14 0 "[ . 1 . 2]" 1 162 VAL 0.008 0.007 15 0 "[ . 1 . 2]" 1 163 SER 1.147 0.059 15 0 "[ . 1 . 2]" 1 164 GLU 0.346 0.027 7 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 1 MET HA 1 1 MET QG . . 3.210 2.419 2.331 2.541 . 0 0 "[ . 1 . 2]" 1 2 1 1 MET HA 1 2 VAL H . . 3.090 2.359 2.326 2.388 . 0 0 "[ . 1 . 2]" 1 3 1 1 MET HA 1 2 VAL MG2 . . 4.080 3.695 3.608 3.756 . 0 0 "[ . 1 . 2]" 1 4 1 1 MET HA 1 14 LYS HB3 . . 5.500 5.520 5.498 5.555 0.055 15 0 "[ . 1 . 2]" 1 5 1 1 MET HA 1 15 THR H . . 3.950 3.001 2.639 3.227 . 0 0 "[ . 1 . 2]" 1 6 1 1 MET HA 1 163 SER HB3 . . 5.050 5.036 4.820 5.066 0.016 10 0 "[ . 1 . 2]" 1 7 1 1 MET QB 1 2 VAL H . . 3.950 2.890 2.501 3.710 . 0 0 "[ . 1 . 2]" 1 8 1 1 MET QB 1 2 VAL HA . . 5.240 4.132 3.927 4.618 . 0 0 "[ . 1 . 2]" 1 9 1 1 MET QB 1 14 LYS HA . . 5.340 3.783 3.353 4.170 . 0 0 "[ . 1 . 2]" 1 10 1 1 MET QB 1 163 SER H . . 4.020 3.511 3.395 3.656 . 0 0 "[ . 1 . 2]" 1 11 1 1 MET QB 1 163 SER HB3 . . 3.730 2.437 2.309 2.611 . 0 0 "[ . 1 . 2]" 1 12 1 1 MET QB 1 164 GLU H . . 4.730 4.596 4.127 4.740 0.010 20 0 "[ . 1 . 2]" 1 13 1 1 MET QG 1 2 VAL H . . 3.790 3.358 2.420 3.790 . 0 0 "[ . 1 . 2]" 1 14 1 1 MET QG 1 14 LYS HA . . 3.660 2.394 2.180 2.870 . 0 0 "[ . 1 . 2]" 1 15 1 1 MET QG 1 15 THR H . . 4.680 3.981 3.498 4.477 . 0 0 "[ . 1 . 2]" 1 16 1 1 MET QG 1 127 VAL MG2 . . 4.070 2.962 2.458 3.431 . 0 0 "[ . 1 . 2]" 1 17 1 1 MET QG 1 163 SER HB3 . . 4.860 4.111 2.698 4.613 . 0 0 "[ . 1 . 2]" 1 18 1 2 VAL H 1 2 VAL HB . . 3.300 2.843 2.792 2.904 . 0 0 "[ . 1 . 2]" 1 19 1 2 VAL H 1 2 VAL MG2 . . 3.840 2.976 2.922 3.068 . 0 0 "[ . 1 . 2]" 1 20 1 2 VAL H 1 13 ILE H . . 3.770 2.944 2.861 3.063 . 0 0 "[ . 1 . 2]" 1 21 1 2 VAL H 1 13 ILE HB . . 3.950 3.010 2.896 3.108 . 0 0 "[ . 1 . 2]" 1 22 1 2 VAL H 1 13 ILE QG . . 5.070 4.887 4.742 5.088 0.018 9 0 "[ . 1 . 2]" 1 23 1 2 VAL H 1 14 LYS H . . 5.110 4.887 4.831 4.920 . 0 0 "[ . 1 . 2]" 1 24 1 2 VAL H 1 15 THR H . . 4.700 4.674 4.583 4.716 0.016 20 0 "[ . 1 . 2]" 1 25 1 2 VAL HA 1 3 THR H . . 3.080 2.098 2.078 2.123 . 0 0 "[ . 1 . 2]" 1 26 1 2 VAL HA 1 162 VAL HA . . 3.530 2.458 2.365 2.568 . 0 0 "[ . 1 . 2]" 1 27 1 2 VAL HA 1 163 SER H . . 3.500 2.856 2.757 2.938 . 0 0 "[ . 1 . 2]" 1 28 1 2 VAL HB 1 3 THR H . . 4.450 4.190 4.149 4.243 . 0 0 "[ . 1 . 2]" 1 29 1 2 VAL HB 1 4 PHE QE . . 4.720 4.731 4.723 4.740 0.020 4 0 "[ . 1 . 2]" 1 30 1 2 VAL HB 1 13 ILE H . . 4.090 3.980 3.874 4.082 . 0 0 "[ . 1 . 2]" 1 31 1 2 VAL HB 1 13 ILE HB . . 3.740 2.584 2.504 2.686 . 0 0 "[ . 1 . 2]" 1 32 1 2 VAL HB 1 13 ILE MD . . 4.410 3.078 2.893 3.348 . 0 0 "[ . 1 . 2]" 1 33 1 2 VAL HB 1 13 ILE QG . . 4.370 4.381 4.334 4.389 0.019 3 0 "[ . 1 . 2]" 1 34 1 2 VAL HB 1 13 ILE MG . . 4.040 3.617 3.475 3.732 . 0 0 "[ . 1 . 2]" 1 35 1 2 VAL HB 1 27 PHE HZ . . 4.580 3.913 3.248 4.588 0.008 11 0 "[ . 1 . 2]" 1 36 1 2 VAL MG2 1 3 THR H . . 4.340 3.975 3.905 4.057 . 0 0 "[ . 1 . 2]" 1 37 1 2 VAL MG2 1 13 ILE HB . . 4.300 3.935 3.839 4.042 . 0 0 "[ . 1 . 2]" 1 38 1 2 VAL MG2 1 27 PHE HZ . . 4.500 3.939 3.307 4.373 . 0 0 "[ . 1 . 2]" 1 39 1 2 VAL MG2 1 162 VAL HA . . 4.530 2.817 2.632 2.999 . 0 0 "[ . 1 . 2]" 1 40 1 2 VAL MG2 1 163 SER H . . 4.250 3.772 3.565 3.893 . 0 0 "[ . 1 . 2]" 1 41 1 3 THR H 1 3 THR HB . . 3.460 2.529 2.500 2.604 . 0 0 "[ . 1 . 2]" 1 42 1 3 THR H 1 3 THR MG . . 4.420 3.847 3.829 3.886 . 0 0 "[ . 1 . 2]" 1 43 1 3 THR H 1 4 PHE H . . 4.520 4.425 4.393 4.448 . 0 0 "[ . 1 . 2]" 1 44 1 3 THR H 1 161 THR H . . 3.580 3.239 3.168 3.317 . 0 0 "[ . 1 . 2]" 1 45 1 3 THR H 1 161 THR HB . . 4.210 3.562 3.407 3.701 . 0 0 "[ . 1 . 2]" 1 46 1 3 THR H 1 161 THR MG . . 4.660 4.312 4.202 4.430 . 0 0 "[ . 1 . 2]" 1 47 1 3 THR H 1 162 VAL H . . 4.950 4.920 4.893 4.957 0.007 15 0 "[ . 1 . 2]" 1 48 1 3 THR H 1 162 VAL HA . . 3.670 3.425 3.292 3.525 . 0 0 "[ . 1 . 2]" 1 49 1 3 THR H 1 163 SER H . . 3.770 3.805 3.788 3.829 0.059 15 0 "[ . 1 . 2]" 1 50 1 3 THR HA 1 4 PHE H . . 2.920 2.117 2.100 2.129 . 0 0 "[ . 1 . 2]" 1 51 1 3 THR HA 1 11 ILE H . . 4.600 4.613 4.568 4.640 0.040 8 0 "[ . 1 . 2]" 1 52 1 3 THR HA 1 12 VAL MG2 . . 4.540 3.028 2.863 3.202 . 0 0 "[ . 1 . 2]" 1 53 1 3 THR HA 1 13 ILE H . . 3.940 3.469 3.338 3.626 . 0 0 "[ . 1 . 2]" 1 54 1 3 THR HB 1 4 PHE H . . 4.420 4.260 4.232 4.295 . 0 0 "[ . 1 . 2]" 1 55 1 3 THR HB 1 161 THR H . . 3.870 3.318 3.182 3.434 . 0 0 "[ . 1 . 2]" 1 56 1 3 THR HB 1 161 THR HB . . 4.120 2.241 2.141 2.512 . 0 0 "[ . 1 . 2]" 1 57 1 3 THR MG 1 4 PHE H . . 3.480 2.821 2.766 2.890 . 0 0 "[ . 1 . 2]" 1 58 1 3 THR MG 1 4 PHE HA . . 4.810 3.844 3.786 3.921 . 0 0 "[ . 1 . 2]" 1 59 1 3 THR MG 1 5 HIS H . . 4.820 4.086 3.806 4.299 . 0 0 "[ . 1 . 2]" 1 60 1 3 THR MG 1 5 HIS HA . . 4.620 4.055 3.696 4.217 . 0 0 "[ . 1 . 2]" 1 61 1 3 THR MG 1 5 HIS HE1 . . 4.170 3.268 2.668 3.625 . 0 0 "[ . 1 . 2]" 1 62 1 3 THR MG 1 10 ASP HA . . 4.930 4.233 4.170 4.513 . 0 0 "[ . 1 . 2]" 1 63 1 3 THR MG 1 11 ILE H . . 4.200 3.481 3.405 3.563 . 0 0 "[ . 1 . 2]" 1 64 1 3 THR MG 1 12 VAL MG2 . . 4.040 2.359 2.308 2.460 . 0 0 "[ . 1 . 2]" 1 65 1 3 THR MG 1 161 THR HB . . 4.500 3.506 3.378 3.845 . 0 0 "[ . 1 . 2]" 1 66 1 4 PHE H 1 4 PHE QD . . 4.130 3.719 3.652 3.770 . 0 0 "[ . 1 . 2]" 1 67 1 4 PHE H 1 5 HIS H . . 4.410 4.363 4.265 4.421 0.011 16 0 "[ . 1 . 2]" 1 68 1 4 PHE H 1 5 HIS HA . . 5.290 5.128 5.023 5.232 . 0 0 "[ . 1 . 2]" 1 69 1 4 PHE H 1 10 ASP HA . . 5.310 4.965 4.904 5.154 . 0 0 "[ . 1 . 2]" 1 70 1 4 PHE H 1 11 ILE H . . 3.690 3.191 3.155 3.217 . 0 0 "[ . 1 . 2]" 1 71 1 4 PHE H 1 11 ILE HB . . 4.100 3.522 3.425 3.593 . 0 0 "[ . 1 . 2]" 1 72 1 4 PHE H 1 11 ILE MD . . 5.330 5.306 5.216 5.342 0.012 6 0 "[ . 1 . 2]" 1 73 1 4 PHE H 1 12 VAL MG2 . . 4.800 4.065 3.955 4.268 . 0 0 "[ . 1 . 2]" 1 74 1 4 PHE HA 1 4 PHE QD . . 3.350 2.011 1.978 2.038 . 0 0 "[ . 1 . 2]" 1 75 1 4 PHE HA 1 5 HIS H . . 3.140 2.013 1.976 2.044 . 0 0 "[ . 1 . 2]" 1 76 1 4 PHE HA 1 159 SER H . . 5.500 4.991 4.821 5.073 . 0 0 "[ . 1 . 2]" 1 77 1 4 PHE HA 1 160 VAL HA . . 3.760 2.696 2.644 2.766 . 0 0 "[ . 1 . 2]" 1 78 1 4 PHE HA 1 160 VAL MG2 . . 4.110 3.087 2.858 3.321 . 0 0 "[ . 1 . 2]" 1 79 1 4 PHE HA 1 161 THR H . . 3.840 3.828 3.740 3.855 0.015 19 0 "[ . 1 . 2]" 1 80 1 4 PHE HB3 1 5 HIS H . . 4.070 3.219 3.034 3.426 . 0 0 "[ . 1 . 2]" 1 81 1 4 PHE HB3 1 6 THR MG . . 3.710 2.386 2.247 2.574 . 0 0 "[ . 1 . 2]" 1 82 1 4 PHE HB3 1 13 ILE MD . . 4.920 4.685 4.306 4.923 0.003 20 0 "[ . 1 . 2]" 1 83 1 4 PHE HB3 1 41 PHE QE . . 5.130 4.579 4.265 4.967 . 0 0 "[ . 1 . 2]" 1 84 1 4 PHE HB3 1 157 ILE MD . . 5.210 3.373 3.042 3.674 . 0 0 "[ . 1 . 2]" 1 85 1 4 PHE HB3 1 157 ILE QG . . 4.710 3.278 2.757 3.663 . 0 0 "[ . 1 . 2]" 1 86 1 4 PHE HB3 1 157 ILE MG . . 3.710 2.536 2.412 2.765 . 0 0 "[ . 1 . 2]" 1 87 1 4 PHE QD 1 5 HIS H . . 3.770 3.650 3.635 3.672 . 0 0 "[ . 1 . 2]" 1 88 1 4 PHE QD 1 11 ILE HB . . 3.910 3.281 2.988 3.562 . 0 0 "[ . 1 . 2]" 1 89 1 4 PHE QD 1 11 ILE MG . . 3.930 3.244 2.841 3.565 . 0 0 "[ . 1 . 2]" 1 90 1 4 PHE QD 1 157 ILE MD . . 4.030 3.166 2.964 3.389 . 0 0 "[ . 1 . 2]" 1 91 1 4 PHE QD 1 157 ILE MG . . 3.780 2.918 2.784 3.082 . 0 0 "[ . 1 . 2]" 1 92 1 4 PHE QD 1 160 VAL HA . . 4.180 2.867 2.692 3.023 . 0 0 "[ . 1 . 2]" 1 93 1 4 PHE QD 1 160 VAL MG2 . . 3.700 2.090 2.041 2.133 . 0 0 "[ . 1 . 2]" 1 94 1 4 PHE QE 1 13 ILE MD . . 3.900 2.541 2.321 2.948 . 0 0 "[ . 1 . 2]" 1 95 1 4 PHE QE 1 36 TYR HB3 . . 4.300 3.504 3.172 3.724 . 0 0 "[ . 1 . 2]" 1 96 1 4 PHE QE 1 98 PHE QE . . 3.270 2.824 2.542 3.012 . 0 0 "[ . 1 . 2]" 1 97 1 4 PHE QE 1 157 ILE MD . . 4.270 3.205 3.060 3.308 . 0 0 "[ . 1 . 2]" 1 98 1 4 PHE QE 1 157 ILE MG . . 4.100 3.696 3.576 3.826 . 0 0 "[ . 1 . 2]" 1 99 1 4 PHE QE 1 160 VAL HB . . 4.920 4.474 4.399 4.620 . 0 0 "[ . 1 . 2]" 1 100 1 4 PHE QE 1 160 VAL MG2 . . 3.800 2.478 2.374 2.648 . 0 0 "[ . 1 . 2]" 1 101 1 4 PHE HZ 1 27 PHE HZ . . 3.500 2.380 2.188 2.597 . 0 0 "[ . 1 . 2]" 1 102 1 4 PHE HZ 1 157 ILE MD . . 3.680 3.646 3.502 3.696 0.016 6 0 "[ . 1 . 2]" 1 103 1 4 PHE HZ 1 157 ILE MG . . 4.990 4.830 4.667 4.995 0.005 16 0 "[ . 1 . 2]" 1 104 1 5 HIS H 1 5 HIS HB3 . . 3.840 3.754 3.699 3.778 . 0 0 "[ . 1 . 2]" 1 105 1 5 HIS H 1 5 HIS HD2 . . 3.860 2.722 2.500 3.174 . 0 0 "[ . 1 . 2]" 1 106 1 5 HIS H 1 6 THR H . . 4.320 4.187 4.114 4.354 0.034 6 0 "[ . 1 . 2]" 1 107 1 5 HIS H 1 6 THR MG . . 4.980 3.828 3.628 3.966 . 0 0 "[ . 1 . 2]" 1 108 1 5 HIS H 1 11 ILE H . . 5.220 5.048 4.946 5.086 . 0 0 "[ . 1 . 2]" 1 109 1 5 HIS H 1 157 ILE MG . . 4.100 3.047 2.909 3.206 . 0 0 "[ . 1 . 2]" 1 110 1 5 HIS H 1 158 GLU HB2 . . 5.500 5.367 5.262 5.503 0.003 14 0 "[ . 1 . 2]" 1 111 1 5 HIS H 1 159 SER H . . 3.880 3.336 3.257 3.419 . 0 0 "[ . 1 . 2]" 1 112 1 5 HIS H 1 160 VAL HA . . 3.690 3.168 2.923 3.288 . 0 0 "[ . 1 . 2]" 1 113 1 5 HIS H 1 160 VAL MG2 . . 4.330 3.647 3.396 3.979 . 0 0 "[ . 1 . 2]" 1 114 1 5 HIS HA 1 6 THR H . . 3.160 2.197 2.076 2.260 . 0 0 "[ . 1 . 2]" 1 115 1 5 HIS HA 1 6 THR HA . . 4.540 4.455 4.389 4.481 . 0 0 "[ . 1 . 2]" 1 116 1 5 HIS HA 1 6 THR HG1 . . 4.640 4.668 4.659 4.692 0.052 6 0 "[ . 1 . 2]" 1 117 1 5 HIS HA 1 6 THR MG . . 4.230 3.700 3.321 3.898 . 0 0 "[ . 1 . 2]" 1 118 1 5 HIS HA 1 10 ASP H . . 4.840 4.851 4.746 4.872 0.032 8 0 "[ . 1 . 2]" 1 119 1 5 HIS HA 1 10 ASP HA . . 3.780 2.701 2.568 2.856 . 0 0 "[ . 1 . 2]" 1 120 1 5 HIS HA 1 11 ILE H . . 3.900 3.854 3.749 3.914 0.014 19 0 "[ . 1 . 2]" 1 121 1 5 HIS HB3 1 6 THR H . . 3.980 3.826 3.363 3.990 0.010 1 0 "[ . 1 . 2]" 1 122 1 5 HIS HB3 1 10 ASP HA . . 4.950 4.897 4.742 4.988 0.038 6 0 "[ . 1 . 2]" 1 123 1 5 HIS HB3 1 158 GLU HB2 . . 4.270 3.954 3.619 4.271 0.001 6 0 "[ . 1 . 2]" 1 124 1 5 HIS HB3 1 159 SER H . . 4.130 4.012 3.792 4.144 0.014 8 0 "[ . 1 . 2]" 1 125 1 5 HIS HB3 1 159 SER HB3 . . 4.950 3.828 3.439 4.975 0.025 1 0 "[ . 1 . 2]" 1 126 1 5 HIS HD2 1 159 SER H . . 5.250 4.322 4.238 4.439 . 0 0 "[ . 1 . 2]" 1 127 1 5 HIS HD2 1 160 VAL H . . 4.440 3.623 3.404 3.747 . 0 0 "[ . 1 . 2]" 1 128 1 5 HIS HD2 1 160 VAL HA . . 4.040 2.813 2.619 3.040 . 0 0 "[ . 1 . 2]" 1 129 1 5 HIS HD2 1 161 THR H . . 4.110 3.556 3.408 3.749 . 0 0 "[ . 1 . 2]" 1 130 1 6 THR H 1 6 THR HG1 . . 3.410 2.641 2.463 3.097 . 0 0 "[ . 1 . 2]" 1 131 1 6 THR H 1 6 THR MG . . 3.790 2.495 2.434 2.608 . 0 0 "[ . 1 . 2]" 1 132 1 6 THR H 1 7 ASN H . . 4.830 4.574 4.544 4.635 . 0 0 "[ . 1 . 2]" 1 133 1 6 THR H 1 8 HIS H . . 4.880 4.586 4.429 4.731 . 0 0 "[ . 1 . 2]" 1 134 1 6 THR H 1 9 GLY H . . 3.900 3.610 3.471 3.931 0.031 6 0 "[ . 1 . 2]" 1 135 1 6 THR H 1 10 ASP H . . 4.660 4.302 3.886 4.437 . 0 0 "[ . 1 . 2]" 1 136 1 6 THR H 1 10 ASP HA . . 3.620 2.842 2.439 2.959 . 0 0 "[ . 1 . 2]" 1 137 1 6 THR H 1 10 ASP HB2 . . 4.420 4.445 4.391 4.511 0.091 6 0 "[ . 1 . 2]" 1 138 1 6 THR H 1 11 ILE H . . 4.260 4.195 3.955 4.307 0.047 8 0 "[ . 1 . 2]" 1 139 1 6 THR HA 1 7 ASN H . . 3.430 2.251 2.200 2.328 . 0 0 "[ . 1 . 2]" 1 140 1 6 THR HA 1 8 HIS H . . 4.130 3.954 3.860 4.022 . 0 0 "[ . 1 . 2]" 1 141 1 6 THR HA 1 9 GLY H . . 4.930 4.517 4.424 4.700 . 0 0 "[ . 1 . 2]" 1 142 1 6 THR HA 1 157 ILE HA . . 4.030 2.319 2.265 2.385 . 0 0 "[ . 1 . 2]" 1 143 1 6 THR HA 1 157 ILE HB . . 5.360 5.337 5.275 5.372 0.012 18 0 "[ . 1 . 2]" 1 144 1 6 THR HA 1 157 ILE QG . . 4.580 4.128 3.997 4.327 . 0 0 "[ . 1 . 2]" 1 145 1 6 THR HA 1 158 GLU H . . 3.720 2.103 1.826 2.248 . 0 0 "[ . 1 . 2]" 1 146 1 6 THR HA 1 159 SER H . . 4.040 3.937 3.695 4.056 0.016 9 0 "[ . 1 . 2]" 1 147 1 6 THR HB 1 7 ASN H . . 3.350 2.682 2.514 2.831 . 0 0 "[ . 1 . 2]" 1 148 1 6 THR HB 1 8 HIS H . . 3.580 2.908 2.584 3.042 . 0 0 "[ . 1 . 2]" 1 149 1 6 THR HB 1 8 HIS HD2 . . 4.390 3.834 2.979 4.396 0.006 1 0 "[ . 1 . 2]" 1 150 1 6 THR HB 1 9 GLY H . . 4.040 3.875 3.462 4.051 0.011 17 0 "[ . 1 . 2]" 1 151 1 6 THR HG1 1 7 ASN H . . 4.600 4.483 4.405 4.623 0.023 6 0 "[ . 1 . 2]" 1 152 1 6 THR HG1 1 8 HIS H . . 3.500 3.155 3.041 3.267 . 0 0 "[ . 1 . 2]" 1 153 1 6 THR HG1 1 9 GLY H . . 3.170 2.257 2.102 2.352 . 0 0 "[ . 1 . 2]" 1 154 1 6 THR HG1 1 9 GLY HA2 . . 4.300 4.075 3.995 4.142 . 0 0 "[ . 1 . 2]" 1 155 1 6 THR HG1 1 10 ASP H . . 4.720 4.513 3.897 4.647 . 0 0 "[ . 1 . 2]" 1 156 1 6 THR MG 1 7 ASN H . . 4.180 4.036 3.930 4.126 . 0 0 "[ . 1 . 2]" 1 157 1 6 THR MG 1 8 HIS H . . 4.500 4.094 3.978 4.219 . 0 0 "[ . 1 . 2]" 1 158 1 6 THR MG 1 9 GLY H . . 4.720 3.960 3.717 4.157 . 0 0 "[ . 1 . 2]" 1 159 1 6 THR MG 1 10 ASP HA . . 4.600 3.658 2.440 3.908 . 0 0 "[ . 1 . 2]" 1 160 1 6 THR MG 1 11 ILE MD . . 4.350 2.540 2.371 2.959 . 0 0 "[ . 1 . 2]" 1 161 1 6 THR MG 1 41 PHE QE . . 3.690 2.748 2.397 3.213 . 0 0 "[ . 1 . 2]" 1 162 1 6 THR MG 1 157 ILE HA . . 4.210 2.382 2.234 2.539 . 0 0 "[ . 1 . 2]" 1 163 1 6 THR MG 1 157 ILE QG . . 4.090 2.278 2.210 2.374 . 0 0 "[ . 1 . 2]" 1 164 1 6 THR MG 1 157 ILE MG . . 4.290 2.727 2.433 3.008 . 0 0 "[ . 1 . 2]" 1 165 1 6 THR MG 1 158 GLU H . . 4.670 3.742 3.449 3.918 . 0 0 "[ . 1 . 2]" 1 166 1 6 THR MG 1 160 VAL MG2 . . 4.950 4.905 4.719 4.970 0.020 14 0 "[ . 1 . 2]" 1 167 1 7 ASN H 1 7 ASN HB2 . . 4.120 3.627 3.578 3.656 . 0 0 "[ . 1 . 2]" 1 168 1 7 ASN H 1 7 ASN HD21 . . 4.790 4.409 3.516 4.561 . 0 0 "[ . 1 . 2]" 1 169 1 7 ASN H 1 7 ASN QD . . 3.980 3.978 3.413 4.075 0.095 6 0 "[ . 1 . 2]" 1 170 1 7 ASN H 1 7 ASN HD22 . . 4.790 4.551 4.486 4.622 . 0 0 "[ . 1 . 2]" 1 171 1 7 ASN H 1 8 HIS H . . 3.730 2.891 2.721 2.988 . 0 0 "[ . 1 . 2]" 1 172 1 7 ASN H 1 8 HIS HD2 . . 4.410 4.107 3.617 4.424 0.014 17 0 "[ . 1 . 2]" 1 173 1 7 ASN H 1 9 GLY H . . 4.410 4.349 4.269 4.430 0.020 6 0 "[ . 1 . 2]" 1 174 1 7 ASN H 1 156 ILE H . . 4.250 3.484 3.255 3.727 . 0 0 "[ . 1 . 2]" 1 175 1 7 ASN H 1 156 ILE HB . . 5.500 4.990 3.633 5.377 . 0 0 "[ . 1 . 2]" 1 176 1 7 ASN H 1 157 ILE HA . . 4.120 3.776 3.682 3.849 . 0 0 "[ . 1 . 2]" 1 177 1 7 ASN H 1 158 GLU H . . 4.140 3.334 3.282 3.402 . 0 0 "[ . 1 . 2]" 1 178 1 7 ASN H 1 158 GLU HB2 . . 4.490 4.320 3.936 4.443 . 0 0 "[ . 1 . 2]" 1 179 1 7 ASN H 1 159 SER H . . 5.500 5.587 5.572 5.612 0.112 6 0 "[ . 1 . 2]" 1 180 1 7 ASN HB2 1 7 ASN QD . . 3.450 2.519 2.320 3.136 . 0 0 "[ . 1 . 2]" 1 181 1 7 ASN QD 1 8 HIS H . . 5.120 4.861 4.294 5.010 . 0 0 "[ . 1 . 2]" 1 182 1 7 ASN QD 1 155 VAL HA . . 4.330 2.941 2.449 3.442 . 0 0 "[ . 1 . 2]" 1 183 1 7 ASN QD 1 156 ILE H . . 3.820 2.439 2.291 2.664 . 0 0 "[ . 1 . 2]" 1 184 1 7 ASN QD 1 156 ILE HA . . 4.980 4.621 4.411 5.003 0.023 1 0 "[ . 1 . 2]" 1 185 1 7 ASN QD 1 156 ILE HB . . 4.280 4.259 3.731 4.359 0.079 16 0 "[ . 1 . 2]" 1 186 1 7 ASN HD21 1 155 VAL HA . . 5.090 4.594 3.639 5.097 0.007 20 0 "[ . 1 . 2]" 1 187 1 7 ASN HD22 1 155 VAL HA . . 5.090 2.978 2.467 3.500 . 0 0 "[ . 1 . 2]" 1 188 1 8 HIS H 1 8 HIS HB3 . . 4.090 3.455 3.032 3.729 . 0 0 "[ . 1 . 2]" 1 189 1 8 HIS H 1 8 HIS HD2 . . 3.960 2.950 2.663 3.155 . 0 0 "[ . 1 . 2]" 1 190 1 8 HIS H 1 9 GLY H . . 3.160 2.204 2.071 2.354 . 0 0 "[ . 1 . 2]" 1 191 1 8 HIS H 1 9 GLY HA2 . . 4.810 4.712 4.578 4.831 0.021 15 0 "[ . 1 . 2]" 1 192 1 8 HIS HA 1 8 HIS HB3 . . 2.970 2.472 2.333 2.591 . 0 0 "[ . 1 . 2]" 1 193 1 8 HIS HA 1 9 GLY HA2 . . 4.960 4.718 4.655 4.882 . 0 0 "[ . 1 . 2]" 1 194 1 8 HIS HB3 1 8 HIS HD2 . . 3.920 3.323 2.602 3.886 . 0 0 "[ . 1 . 2]" 1 195 1 8 HIS HB3 1 9 GLY H . . 4.240 4.232 4.100 4.256 0.016 19 0 "[ . 1 . 2]" 1 196 1 8 HIS HB3 1 136 ILE MD . . 4.770 4.063 3.536 4.495 . 0 0 "[ . 1 . 2]" 1 197 1 8 HIS HB3 1 155 VAL MG2 . . 4.440 4.184 3.527 4.478 0.038 14 0 "[ . 1 . 2]" 1 198 1 8 HIS HD2 1 9 GLY H . . 5.120 4.883 4.417 5.138 0.018 14 0 "[ . 1 . 2]" 1 199 1 8 HIS HD2 1 136 ILE MD . . 4.410 4.151 4.002 4.418 0.008 15 0 "[ . 1 . 2]" 1 200 1 8 HIS HD2 1 155 VAL HA . . 4.670 2.302 2.104 2.625 . 0 0 "[ . 1 . 2]" 1 201 1 8 HIS HD2 1 155 VAL MG2 . . 4.340 3.218 2.572 4.090 . 0 0 "[ . 1 . 2]" 1 202 1 8 HIS HD2 1 156 ILE H . . 4.280 2.834 2.166 3.316 . 0 0 "[ . 1 . 2]" 1 203 1 9 GLY H 1 10 ASP H . . 4.100 4.137 3.658 4.202 0.102 14 0 "[ . 1 . 2]" 1 204 1 9 GLY HA2 1 10 ASP H . . 3.150 2.248 2.144 2.305 . 0 0 "[ . 1 . 2]" 1 205 1 9 GLY HA2 1 10 ASP HA . . 4.560 4.426 4.373 4.463 . 0 0 "[ . 1 . 2]" 1 206 1 9 GLY HA2 1 10 ASP HB2 . . 4.640 4.503 4.389 4.663 0.023 6 0 "[ . 1 . 2]" 1 207 1 9 GLY HA2 1 132 VAL MG2 . . 4.450 3.550 3.449 3.693 . 0 0 "[ . 1 . 2]" 1 208 1 10 ASP H 1 10 ASP HB2 . . 2.880 2.565 2.463 2.643 . 0 0 "[ . 1 . 2]" 1 209 1 10 ASP H 1 11 ILE H . . 4.770 4.629 4.595 4.690 . 0 0 "[ . 1 . 2]" 1 210 1 10 ASP H 1 132 VAL MG2 . . 4.760 3.556 3.157 4.384 . 0 0 "[ . 1 . 2]" 1 211 1 10 ASP HA 1 11 ILE H . . 3.040 2.170 2.128 2.291 . 0 0 "[ . 1 . 2]" 1 212 1 10 ASP HA 1 11 ILE HB . . 4.620 4.481 4.331 4.610 . 0 0 "[ . 1 . 2]" 1 213 1 10 ASP HB2 1 11 ILE H . . 4.050 4.053 3.839 4.082 0.032 5 0 "[ . 1 . 2]" 1 214 1 11 ILE H 1 11 ILE HB . . 3.350 2.743 2.624 2.826 . 0 0 "[ . 1 . 2]" 1 215 1 11 ILE H 1 11 ILE MD . . 4.410 4.228 4.166 4.279 . 0 0 "[ . 1 . 2]" 1 216 1 11 ILE H 1 12 VAL MG2 . . 4.410 4.098 4.002 4.375 . 0 0 "[ . 1 . 2]" 1 217 1 11 ILE HA 1 11 ILE MD . . 4.460 3.916 3.851 3.966 . 0 0 "[ . 1 . 2]" 1 218 1 11 ILE HA 1 11 ILE MG . . 3.610 2.491 2.425 2.615 . 0 0 "[ . 1 . 2]" 1 219 1 11 ILE HA 1 12 VAL H . . 3.220 2.248 2.221 2.276 . 0 0 "[ . 1 . 2]" 1 220 1 11 ILE HA 1 12 VAL MG2 . . 3.700 3.557 3.474 3.648 . 0 0 "[ . 1 . 2]" 1 221 1 11 ILE MD 1 41 PHE HZ . . 5.000 3.381 2.718 3.925 . 0 0 "[ . 1 . 2]" 1 222 1 11 ILE MD 1 132 VAL HB . . 4.200 2.870 2.645 3.682 . 0 0 "[ . 1 . 2]" 1 223 1 11 ILE MD 1 133 VAL MG2 . . 3.590 2.442 2.205 2.868 . 0 0 "[ . 1 . 2]" 1 224 1 11 ILE MD 1 136 ILE MD . . 4.390 2.694 2.322 3.374 . 0 0 "[ . 1 . 2]" 1 225 1 11 ILE QG 1 132 VAL HB . . 4.300 2.627 2.253 3.461 . 0 0 "[ . 1 . 2]" 1 226 1 11 ILE MG 1 12 VAL H . . 3.930 2.425 2.400 2.462 . 0 0 "[ . 1 . 2]" 1 227 1 12 VAL H 1 12 VAL HB . . 3.480 2.784 2.735 2.844 . 0 0 "[ . 1 . 2]" 1 228 1 12 VAL H 1 12 VAL MG2 . . 3.580 2.842 2.764 2.910 . 0 0 "[ . 1 . 2]" 1 229 1 12 VAL H 1 13 ILE H . . 4.590 4.379 4.347 4.402 . 0 0 "[ . 1 . 2]" 1 230 1 12 VAL H 1 127 VAL H . . 4.250 3.896 3.824 3.982 . 0 0 "[ . 1 . 2]" 1 231 1 12 VAL H 1 127 VAL HB . . 4.600 4.464 4.398 4.602 0.002 15 0 "[ . 1 . 2]" 1 232 1 12 VAL H 1 128 ASP H . . 3.670 2.747 2.673 2.845 . 0 0 "[ . 1 . 2]" 1 233 1 12 VAL H 1 128 ASP HA . . 4.970 4.600 4.536 4.672 . 0 0 "[ . 1 . 2]" 1 234 1 12 VAL H 1 128 ASP HB2 . . 4.160 3.133 3.003 3.319 . 0 0 "[ . 1 . 2]" 1 235 1 12 VAL HA 1 13 ILE QG . . 4.430 3.733 3.423 4.391 . 0 0 "[ . 1 . 2]" 1 236 1 12 VAL HB 1 13 ILE H . . 4.530 4.063 4.009 4.129 . 0 0 "[ . 1 . 2]" 1 237 1 12 VAL HB 1 126 VAL HA . . 5.500 5.520 5.510 5.532 0.032 20 0 "[ . 1 . 2]" 1 238 1 12 VAL HB 1 127 VAL H . . 4.330 3.702 3.634 3.739 . 0 0 "[ . 1 . 2]" 1 239 1 12 VAL HB 1 127 VAL MG2 . . 3.990 3.855 3.799 3.932 . 0 0 "[ . 1 . 2]" 1 240 1 12 VAL HB 1 128 ASP H . . 3.500 2.545 2.482 2.621 . 0 0 "[ . 1 . 2]" 1 241 1 12 VAL HB 1 128 ASP HB2 . . 3.520 2.323 2.244 2.393 . 0 0 "[ . 1 . 2]" 1 242 1 12 VAL MG2 1 13 ILE H . . 4.230 4.044 4.006 4.095 . 0 0 "[ . 1 . 2]" 1 243 1 12 VAL MG2 1 128 ASP H . . 3.990 3.926 3.873 3.990 . 0 0 "[ . 1 . 2]" 1 244 1 12 VAL MG2 1 128 ASP HB2 . . 3.810 2.346 2.255 2.421 . 0 0 "[ . 1 . 2]" 1 245 1 12 VAL MG2 1 129 GLY H . . 5.470 5.326 5.127 5.482 0.012 18 0 "[ . 1 . 2]" 1 246 1 13 ILE H 1 13 ILE HB . . 3.570 2.531 2.473 2.595 . 0 0 "[ . 1 . 2]" 1 247 1 13 ILE H 1 13 ILE QG . . 3.850 2.962 2.705 3.455 . 0 0 "[ . 1 . 2]" 1 248 1 13 ILE H 1 13 ILE MG . . 4.570 3.802 3.778 3.824 . 0 0 "[ . 1 . 2]" 1 249 1 13 ILE H 1 14 LYS H . . 4.540 4.478 4.445 4.499 . 0 0 "[ . 1 . 2]" 1 250 1 13 ILE H 1 83 LEU MD1 . . 5.500 5.539 5.531 5.550 0.050 10 0 "[ . 1 . 2]" 1 251 1 13 ILE H 1 127 VAL H . . 4.970 4.581 4.523 4.647 . 0 0 "[ . 1 . 2]" 1 252 1 13 ILE HA 1 13 ILE MD . . 4.610 3.824 3.430 3.994 . 0 0 "[ . 1 . 2]" 1 253 1 13 ILE HA 1 13 ILE QG . . 3.680 2.524 2.429 2.587 . 0 0 "[ . 1 . 2]" 1 254 1 13 ILE HA 1 14 LYS H . . 3.300 2.239 2.219 2.261 . 0 0 "[ . 1 . 2]" 1 255 1 13 ILE HA 1 126 VAL HA . . 3.830 2.409 2.326 2.467 . 0 0 "[ . 1 . 2]" 1 256 1 13 ILE HA 1 127 VAL H . . 4.160 2.834 2.788 2.902 . 0 0 "[ . 1 . 2]" 1 257 1 13 ILE HA 1 128 ASP H . . 4.510 4.529 4.512 4.542 0.032 9 0 "[ . 1 . 2]" 1 258 1 13 ILE HB 1 14 LYS H . . 4.190 4.116 4.077 4.164 . 0 0 "[ . 1 . 2]" 1 259 1 13 ILE HB 1 123 PHE HZ . . 5.470 5.517 5.495 5.529 0.059 19 0 "[ . 1 . 2]" 1 260 1 13 ILE HB 1 124 ALA MB . . 4.370 4.200 4.152 4.242 . 0 0 "[ . 1 . 2]" 1 261 1 13 ILE HB 1 126 VAL HA . . 5.090 5.092 5.020 5.129 0.039 18 0 "[ . 1 . 2]" 1 262 1 13 ILE HB 1 127 VAL MG2 . . 4.830 4.840 4.837 4.844 0.014 16 0 "[ . 1 . 2]" 1 263 1 13 ILE MD 1 27 PHE HZ . . 3.880 3.210 2.409 3.891 0.011 2 0 "[ . 1 . 2]" 1 264 1 13 ILE MD 1 83 LEU MD1 . . 4.750 3.293 3.061 3.668 . 0 0 "[ . 1 . 2]" 1 265 1 13 ILE MD 1 126 VAL MG2 . . 4.490 3.844 3.409 4.224 . 0 0 "[ . 1 . 2]" 1 266 1 13 ILE MD 1 160 VAL MG2 . . 5.500 5.433 5.272 5.520 0.020 8 0 "[ . 1 . 2]" 1 267 1 13 ILE QG 1 14 LYS H . . 5.040 4.206 4.145 4.282 . 0 0 "[ . 1 . 2]" 1 268 1 13 ILE QG 1 83 LEU MD1 . . 3.660 2.280 2.190 2.406 . 0 0 "[ . 1 . 2]" 1 269 1 13 ILE QG 1 126 VAL HA . . 4.120 3.016 2.854 3.147 . 0 0 "[ . 1 . 2]" 1 270 1 13 ILE QG 1 126 VAL MG2 . . 3.990 2.756 2.529 3.034 . 0 0 "[ . 1 . 2]" 1 271 1 13 ILE QG 1 127 VAL H . . 4.520 4.009 3.917 4.108 . 0 0 "[ . 1 . 2]" 1 272 1 13 ILE MG 1 14 LYS H . . 3.950 2.519 2.464 2.587 . 0 0 "[ . 1 . 2]" 1 273 1 13 ILE MG 1 27 PHE HZ . . 5.130 3.992 3.593 4.494 . 0 0 "[ . 1 . 2]" 1 274 1 13 ILE MG 1 123 PHE HZ . . 4.540 3.356 3.254 3.442 . 0 0 "[ . 1 . 2]" 1 275 1 13 ILE MG 1 126 VAL HA . . 4.460 3.402 3.332 3.468 . 0 0 "[ . 1 . 2]" 1 276 1 13 ILE MG 1 127 VAL H . . 4.620 4.646 4.632 4.656 0.036 5 0 "[ . 1 . 2]" 1 277 1 14 LYS H 1 14 LYS HB3 . . 3.260 2.390 2.298 2.471 . 0 0 "[ . 1 . 2]" 1 278 1 14 LYS H 1 14 LYS HG3 . . 4.560 4.461 4.108 4.580 0.020 11 0 "[ . 1 . 2]" 1 279 1 14 LYS H 1 15 THR H . . 4.430 4.404 4.361 4.438 0.008 15 0 "[ . 1 . 2]" 1 280 1 14 LYS H 1 124 ALA HA . . 4.850 4.877 4.869 4.886 0.036 15 0 "[ . 1 . 2]" 1 281 1 14 LYS H 1 124 ALA MB . . 4.200 3.528 3.414 3.642 . 0 0 "[ . 1 . 2]" 1 282 1 14 LYS H 1 125 GLU H . . 3.540 2.801 2.769 2.823 . 0 0 "[ . 1 . 2]" 1 283 1 14 LYS H 1 125 GLU HG2 . . 4.350 3.434 3.349 3.543 . 0 0 "[ . 1 . 2]" 1 284 1 14 LYS H 1 126 VAL HA . . 4.190 3.659 3.570 3.742 . 0 0 "[ . 1 . 2]" 1 285 1 14 LYS H 1 127 VAL H . . 4.730 4.095 4.011 4.175 . 0 0 "[ . 1 . 2]" 1 286 1 14 LYS H 1 127 VAL MG2 . . 4.180 2.360 2.310 2.420 . 0 0 "[ . 1 . 2]" 1 287 1 14 LYS HA 1 14 LYS HD3 . . 4.370 4.161 3.389 4.443 0.073 11 0 "[ . 1 . 2]" 1 288 1 14 LYS HA 1 14 LYS HG3 . . 3.560 2.854 2.609 3.459 . 0 0 "[ . 1 . 2]" 1 289 1 14 LYS HA 1 15 THR H . . 3.010 2.163 2.099 2.195 . 0 0 "[ . 1 . 2]" 1 290 1 14 LYS HA 1 124 ALA MB . . 4.740 4.657 4.543 4.741 0.001 2 0 "[ . 1 . 2]" 1 291 1 14 LYS HB3 1 15 THR H . . 4.600 4.368 4.308 4.411 . 0 0 "[ . 1 . 2]" 1 292 1 14 LYS HB3 1 16 PHE QE . . 4.060 4.082 4.070 4.095 0.035 4 0 "[ . 1 . 2]" 1 293 1 14 LYS HB3 1 125 GLU H . . 3.710 3.477 3.375 3.596 . 0 0 "[ . 1 . 2]" 1 294 1 14 LYS HB3 1 125 GLU HG2 . . 3.630 2.283 2.237 2.381 . 0 0 "[ . 1 . 2]" 1 295 1 14 LYS HB3 1 127 VAL MG2 . . 3.820 2.400 2.334 2.473 . 0 0 "[ . 1 . 2]" 1 296 1 14 LYS HD3 1 16 PHE QE . . 4.800 4.189 3.589 4.827 0.027 2 0 "[ . 1 . 2]" 1 297 1 14 LYS QE 1 16 PHE QE . . 4.050 2.558 2.093 3.050 . 0 0 "[ . 1 . 2]" 1 298 1 14 LYS HG3 1 15 THR H . . 3.870 2.977 2.722 3.614 . 0 0 "[ . 1 . 2]" 1 299 1 14 LYS HG3 1 15 THR HA . . 4.770 4.648 4.250 4.790 0.020 11 0 "[ . 1 . 2]" 1 300 1 14 LYS HG3 1 16 PHE QE . . 3.950 3.599 2.445 3.974 0.024 20 0 "[ . 1 . 2]" 1 301 1 14 LYS HG3 1 125 GLU H . . 5.320 4.839 3.850 5.197 . 0 0 "[ . 1 . 2]" 1 302 1 15 THR H 1 15 THR MG . . 3.730 2.705 2.635 2.842 . 0 0 "[ . 1 . 2]" 1 303 1 15 THR H 1 125 GLU HG2 . . 5.500 5.545 5.520 5.578 0.078 20 0 "[ . 1 . 2]" 1 304 1 15 THR H 1 127 VAL MG2 . . 5.500 5.071 5.012 5.140 . 0 0 "[ . 1 . 2]" 1 305 1 15 THR HA 1 15 THR MG . . 3.750 2.315 2.302 2.332 . 0 0 "[ . 1 . 2]" 1 306 1 15 THR HA 1 16 PHE H . . 3.050 2.214 2.196 2.224 . 0 0 "[ . 1 . 2]" 1 307 1 15 THR HA 1 16 PHE HA . . 4.600 4.406 4.376 4.421 . 0 0 "[ . 1 . 2]" 1 308 1 15 THR HA 1 24 VAL MG2 . . 4.940 3.350 3.231 3.456 . 0 0 "[ . 1 . 2]" 1 309 1 15 THR HA 1 124 ALA H . . 5.070 4.963 4.892 5.030 . 0 0 "[ . 1 . 2]" 1 310 1 15 THR HA 1 124 ALA HA . . 3.610 2.598 2.529 2.660 . 0 0 "[ . 1 . 2]" 1 311 1 15 THR HA 1 124 ALA MB . . 3.720 2.208 2.161 2.262 . 0 0 "[ . 1 . 2]" 1 312 1 15 THR HA 1 125 GLU H . . 4.040 3.874 3.815 3.925 . 0 0 "[ . 1 . 2]" 1 313 1 15 THR HB 1 16 PHE H . . 3.290 2.810 2.728 2.875 . 0 0 "[ . 1 . 2]" 1 314 1 15 THR HB 1 16 PHE HA . . 4.530 4.539 4.535 4.544 0.014 15 0 "[ . 1 . 2]" 1 315 1 15 THR HB 1 124 ALA HA . . 4.980 4.856 4.754 4.925 . 0 0 "[ . 1 . 2]" 1 316 1 15 THR HB 1 124 ALA MB . . 4.140 3.893 3.780 4.027 . 0 0 "[ . 1 . 2]" 1 317 1 15 THR MG 1 16 PHE H . . 3.830 3.662 3.639 3.690 . 0 0 "[ . 1 . 2]" 1 318 1 15 THR MG 1 124 ALA MB . . 4.140 2.580 2.465 2.726 . 0 0 "[ . 1 . 2]" 1 319 1 16 PHE H 1 16 PHE HB3 . . 3.980 3.718 3.712 3.729 . 0 0 "[ . 1 . 2]" 1 320 1 16 PHE H 1 16 PHE QD . . 4.050 3.506 3.486 3.526 . 0 0 "[ . 1 . 2]" 1 321 1 16 PHE H 1 17 ASP H . . 4.060 3.629 3.599 3.648 . 0 0 "[ . 1 . 2]" 1 322 1 16 PHE H 1 24 VAL MG2 . . 3.780 2.590 2.469 2.749 . 0 0 "[ . 1 . 2]" 1 323 1 16 PHE H 1 124 ALA HA . . 3.680 2.875 2.827 2.934 . 0 0 "[ . 1 . 2]" 1 324 1 16 PHE H 1 124 ALA MB . . 3.800 3.239 3.211 3.262 . 0 0 "[ . 1 . 2]" 1 325 1 16 PHE HA 1 16 PHE HB3 . . 3.010 2.395 2.374 2.410 . 0 0 "[ . 1 . 2]" 1 326 1 16 PHE HA 1 16 PHE QD . . 3.200 2.024 2.019 2.034 . 0 0 "[ . 1 . 2]" 1 327 1 16 PHE HA 1 17 ASP H . . 3.140 2.192 2.177 2.201 . 0 0 "[ . 1 . 2]" 1 328 1 16 PHE HA 1 17 ASP HA . . 4.510 4.510 4.505 4.513 0.003 14 0 "[ . 1 . 2]" 1 329 1 16 PHE HA 1 17 ASP HB2 . . 4.840 4.465 4.417 4.502 . 0 0 "[ . 1 . 2]" 1 330 1 16 PHE HA 1 18 ASP H . . 3.910 3.305 3.236 3.371 . 0 0 "[ . 1 . 2]" 1 331 1 16 PHE HA 1 19 LYS H . . 4.200 3.757 3.678 3.819 . 0 0 "[ . 1 . 2]" 1 332 1 16 PHE HA 1 19 LYS HG3 . . 5.160 5.035 4.753 5.164 0.004 6 0 "[ . 1 . 2]" 1 333 1 16 PHE HA 1 76 LEU QD . . 5.440 4.913 4.569 5.450 0.010 2 0 "[ . 1 . 2]" 1 334 1 16 PHE HA 1 124 ALA MB . . 5.500 5.540 5.533 5.547 0.047 11 0 "[ . 1 . 2]" 1 335 1 16 PHE HB3 1 17 ASP H . . 4.040 4.089 4.083 4.096 0.056 7 0 "[ . 1 . 2]" 1 336 1 16 PHE HB3 1 18 ASP H . . 4.030 4.023 3.971 4.040 0.010 19 0 "[ . 1 . 2]" 1 337 1 16 PHE HB3 1 19 LYS H . . 3.620 2.887 2.807 2.997 . 0 0 "[ . 1 . 2]" 1 338 1 16 PHE HB3 1 19 LYS HA . . 4.640 4.734 4.721 4.747 0.107 12 0 "[ . 1 . 2]" 1 339 1 16 PHE HB3 1 19 LYS HB3 . . 4.020 3.784 3.720 3.873 . 0 0 "[ . 1 . 2]" 1 340 1 16 PHE HB3 1 19 LYS HG3 . . 3.580 3.000 2.665 3.201 . 0 0 "[ . 1 . 2]" 1 341 1 16 PHE HB3 1 20 ALA H . . 4.180 3.842 3.731 3.931 . 0 0 "[ . 1 . 2]" 1 342 1 16 PHE HB3 1 76 LEU QD . . 4.030 3.131 2.803 3.723 . 0 0 "[ . 1 . 2]" 1 343 1 16 PHE QD 1 17 ASP H . . 4.130 3.991 3.977 4.005 . 0 0 "[ . 1 . 2]" 1 344 1 16 PHE QD 1 76 LEU MD1 . . 3.730 2.654 2.182 4.039 0.309 5 0 "[ . 1 . 2]" 1 345 1 16 PHE QD 1 123 PHE H . . 4.910 4.706 4.690 4.724 . 0 0 "[ . 1 . 2]" 1 346 1 16 PHE QD 1 123 PHE HA . . 3.840 3.661 3.603 3.683 . 0 0 "[ . 1 . 2]" 1 347 1 16 PHE QD 1 124 ALA H . . 3.960 3.302 3.218 3.383 . 0 0 "[ . 1 . 2]" 1 348 1 16 PHE QD 1 124 ALA HA . . 4.130 3.198 3.149 3.258 . 0 0 "[ . 1 . 2]" 1 349 1 16 PHE QE 1 76 LEU QD . . 3.870 3.218 2.830 3.880 0.010 2 0 "[ . 1 . 2]" 1 350 1 16 PHE QE 1 82 THR HB . . 5.020 4.174 4.013 4.327 . 0 0 "[ . 1 . 2]" 1 351 1 16 PHE QE 1 82 THR MG . . 4.340 4.020 3.846 4.228 . 0 0 "[ . 1 . 2]" 1 352 1 16 PHE QE 1 122 VAL HB . . 4.300 4.314 4.305 4.325 0.025 16 0 "[ . 1 . 2]" 1 353 1 16 PHE QE 1 124 ALA H . . 4.170 3.963 3.931 4.061 . 0 0 "[ . 1 . 2]" 1 354 1 16 PHE QE 1 124 ALA HA . . 4.110 3.609 3.508 3.727 . 0 0 "[ . 1 . 2]" 1 355 1 16 PHE QE 1 125 GLU H . . 4.160 3.997 3.916 4.092 . 0 0 "[ . 1 . 2]" 1 356 1 16 PHE QE 1 125 GLU HB2 . . 4.130 4.175 4.160 4.196 0.066 16 0 "[ . 1 . 2]" 1 357 1 16 PHE QE 1 125 GLU HG2 . . 3.300 2.993 2.865 3.086 . 0 0 "[ . 1 . 2]" 1 358 1 16 PHE HZ 1 125 GLU H . . 4.340 4.170 3.997 4.340 . 2 0 "[ . 1 . 2]" 1 359 1 16 PHE HZ 1 125 GLU HB2 . . 3.510 3.521 3.513 3.529 0.019 20 0 "[ . 1 . 2]" 1 360 1 16 PHE HZ 1 125 GLU HG2 . . 3.110 2.725 2.539 2.812 . 0 0 "[ . 1 . 2]" 1 361 1 17 ASP H 1 17 ASP HB2 . . 3.220 2.441 2.403 2.474 . 0 0 "[ . 1 . 2]" 1 362 1 17 ASP H 1 18 ASP H . . 3.530 2.645 2.608 2.686 . 0 0 "[ . 1 . 2]" 1 363 1 17 ASP H 1 19 LYS H . . 4.370 4.039 4.009 4.067 . 0 0 "[ . 1 . 2]" 1 364 1 17 ASP H 1 20 ALA H . . 4.800 4.614 4.585 4.650 . 0 0 "[ . 1 . 2]" 1 365 1 17 ASP H 1 24 VAL MG2 . . 4.300 3.411 3.331 3.469 . 0 0 "[ . 1 . 2]" 1 366 1 17 ASP HA 1 19 LYS H . . 4.240 4.073 3.943 4.182 . 0 0 "[ . 1 . 2]" 1 367 1 17 ASP HA 1 20 ALA H . . 4.470 3.320 3.271 3.353 . 0 0 "[ . 1 . 2]" 1 368 1 17 ASP HA 1 20 ALA HA . . 5.290 5.354 5.331 5.368 0.078 10 0 "[ . 1 . 2]" 1 369 1 17 ASP HA 1 21 PRO HA . . 3.700 2.707 2.599 2.866 . 0 0 "[ . 1 . 2]" 1 370 1 17 ASP HA 1 24 VAL H . . 4.960 4.617 4.514 4.691 . 0 0 "[ . 1 . 2]" 1 371 1 17 ASP HA 1 24 VAL HB . . 3.760 3.017 2.918 3.079 . 0 0 "[ . 1 . 2]" 1 372 1 17 ASP HA 1 24 VAL MG2 . . 4.300 2.691 2.615 2.769 . 0 0 "[ . 1 . 2]" 1 373 1 17 ASP HB2 1 18 ASP H . . 3.070 2.872 2.835 2.900 . 0 0 "[ . 1 . 2]" 1 374 1 17 ASP HB2 1 20 ALA H . . 5.500 5.538 5.532 5.544 0.044 11 0 "[ . 1 . 2]" 1 375 1 18 ASP H 1 18 ASP HB2 . . 3.480 2.429 2.415 2.443 . 0 0 "[ . 1 . 2]" 1 376 1 18 ASP H 1 19 LYS H . . 3.020 2.401 2.366 2.447 . 0 0 "[ . 1 . 2]" 1 377 1 18 ASP H 1 20 ALA H . . 3.830 3.875 3.868 3.884 0.054 14 0 "[ . 1 . 2]" 1 378 1 18 ASP HB2 1 19 LYS H . . 3.500 2.885 2.780 3.015 . 0 0 "[ . 1 . 2]" 1 379 1 18 ASP HB2 1 19 LYS HB3 . . 5.500 5.516 5.511 5.520 0.020 14 0 "[ . 1 . 2]" 1 380 1 18 ASP HB2 1 19 LYS HD3 . . 4.190 3.856 3.709 4.090 . 0 0 "[ . 1 . 2]" 1 381 1 18 ASP HB2 1 19 LYS HG3 . . 4.570 4.528 4.426 4.578 0.008 2 0 "[ . 1 . 2]" 1 382 1 19 LYS H 1 19 LYS HB3 . . 3.890 3.712 3.686 3.752 . 0 0 "[ . 1 . 2]" 1 383 1 19 LYS H 1 19 LYS HD3 . . 4.070 3.781 3.679 3.895 . 0 0 "[ . 1 . 2]" 1 384 1 19 LYS H 1 19 LYS HG3 . . 4.030 3.845 3.763 3.940 . 0 0 "[ . 1 . 2]" 1 385 1 19 LYS H 1 20 ALA H . . 2.930 2.246 2.167 2.303 . 0 0 "[ . 1 . 2]" 1 386 1 19 LYS HA 1 19 LYS HB3 . . 2.920 2.369 2.336 2.405 . 0 0 "[ . 1 . 2]" 1 387 1 19 LYS HA 1 19 LYS HD3 . . 2.910 2.275 2.259 2.301 . 0 0 "[ . 1 . 2]" 1 388 1 19 LYS HA 1 19 LYS HE2 . . 4.510 4.498 4.435 4.519 0.009 18 0 "[ . 1 . 2]" 1 389 1 19 LYS HA 1 20 ALA MB . . 4.860 4.437 4.399 4.484 . 0 0 "[ . 1 . 2]" 1 390 1 19 LYS HB3 1 20 ALA H . . 4.460 4.124 3.998 4.237 . 0 0 "[ . 1 . 2]" 1 391 1 19 LYS HB3 1 74 ASN HB2 . . 3.750 2.652 2.342 3.136 . 0 0 "[ . 1 . 2]" 1 392 1 19 LYS HB3 1 74 ASN HD21 . . 4.300 3.160 2.576 3.902 . 0 0 "[ . 1 . 2]" 1 393 1 19 LYS HB3 1 74 ASN QD . . 3.770 3.003 2.492 3.631 . 0 0 "[ . 1 . 2]" 1 394 1 19 LYS HB3 1 74 ASN HD22 . . 4.300 3.787 3.186 4.325 0.025 15 0 "[ . 1 . 2]" 1 395 1 19 LYS HB3 1 76 LEU QD . . 4.050 2.346 2.065 2.539 . 0 0 "[ . 1 . 2]" 1 396 1 19 LYS HB3 1 76 LEU HG . . 3.970 3.298 2.998 3.743 . 0 0 "[ . 1 . 2]" 1 397 1 19 LYS HD3 1 74 ASN HB2 . . 4.240 3.965 3.506 4.251 0.011 5 0 "[ . 1 . 2]" 1 398 1 19 LYS HD3 1 76 LEU QD . . 4.220 4.097 3.741 4.231 0.011 17 0 "[ . 1 . 2]" 1 399 1 19 LYS HE2 1 19 LYS HG3 . . 3.490 3.052 3.024 3.087 . 0 0 "[ . 1 . 2]" 1 400 1 19 LYS HG3 1 74 ASN HB2 . . 5.200 4.503 4.123 4.938 . 0 0 "[ . 1 . 2]" 1 401 1 19 LYS HG3 1 76 LEU QD . . 4.170 2.127 2.065 2.302 . 0 0 "[ . 1 . 2]" 1 402 1 20 ALA H 1 21 PRO QD . . 3.870 2.790 2.645 2.879 . 0 0 "[ . 1 . 2]" 1 403 1 20 ALA HA 1 21 PRO QD . . 2.870 2.231 2.180 2.340 . 0 0 "[ . 1 . 2]" 1 404 1 20 ALA HA 1 23 THR H . . 4.430 3.892 3.824 3.947 . 0 0 "[ . 1 . 2]" 1 405 1 20 ALA MB 1 21 PRO HA . . 5.300 4.572 4.504 4.603 . 0 0 "[ . 1 . 2]" 1 406 1 20 ALA MB 1 21 PRO QD . . 3.790 3.630 3.609 3.668 . 0 0 "[ . 1 . 2]" 1 407 1 20 ALA MB 1 22 GLU H . . 4.590 4.533 4.472 4.588 . 0 0 "[ . 1 . 2]" 1 408 1 20 ALA MB 1 23 THR H . . 4.140 3.436 3.373 3.516 . 0 0 "[ . 1 . 2]" 1 409 1 20 ALA MB 1 23 THR HB . . 3.920 2.135 2.087 2.200 . 0 0 "[ . 1 . 2]" 1 410 1 20 ALA MB 1 23 THR HG1 . . 4.390 2.752 2.597 3.176 . 0 0 "[ . 1 . 2]" 1 411 1 20 ALA MB 1 23 THR MG . . 4.180 3.244 3.072 3.385 . 0 0 "[ . 1 . 2]" 1 412 1 20 ALA MB 1 74 ASN HD21 . . 4.810 3.500 2.483 4.546 . 0 0 "[ . 1 . 2]" 1 413 1 20 ALA MB 1 74 ASN QD . . 4.130 3.244 2.360 4.141 0.011 5 0 "[ . 1 . 2]" 1 414 1 20 ALA MB 1 74 ASN HD22 . . 4.810 3.845 2.821 4.833 0.023 2 0 "[ . 1 . 2]" 1 415 1 20 ALA MB 1 123 PHE HA . . 3.640 2.292 2.166 2.478 . 0 0 "[ . 1 . 2]" 1 416 1 20 ALA MB 1 123 PHE HB3 . . 4.010 3.418 3.164 3.577 . 0 0 "[ . 1 . 2]" 1 417 1 21 PRO HA 1 24 VAL H . . 4.490 3.789 3.708 3.871 . 0 0 "[ . 1 . 2]" 1 418 1 21 PRO HA 1 24 VAL HB . . 4.390 2.978 2.865 3.116 . 0 0 "[ . 1 . 2]" 1 419 1 21 PRO HB2 1 22 GLU H . . 3.230 3.212 3.169 3.238 0.008 15 0 "[ . 1 . 2]" 1 420 1 21 PRO HB2 1 22 GLU HA . . 4.080 4.088 4.079 4.095 0.015 5 0 "[ . 1 . 2]" 1 421 1 21 PRO QD 1 22 GLU H . . 3.460 2.858 2.842 2.889 . 0 0 "[ . 1 . 2]" 1 422 1 21 PRO QD 1 22 GLU HB2 . . 4.640 4.653 4.649 4.660 0.020 12 0 "[ . 1 . 2]" 1 423 1 21 PRO QD 1 23 THR H . . 4.270 4.272 4.235 4.286 0.016 14 0 "[ . 1 . 2]" 1 424 1 21 PRO QG 1 22 GLU H . . 3.000 2.196 2.169 2.267 . 0 0 "[ . 1 . 2]" 1 425 1 21 PRO QG 1 22 GLU HA . . 4.480 4.317 4.286 4.363 . 0 0 "[ . 1 . 2]" 1 426 1 21 PRO QG 1 23 THR H . . 4.560 4.569 4.565 4.573 0.013 14 0 "[ . 1 . 2]" 1 427 1 22 GLU H 1 22 GLU HB2 . . 2.950 2.512 2.487 2.528 . 0 0 "[ . 1 . 2]" 1 428 1 22 GLU H 1 22 GLU HG2 . . 3.270 2.212 2.169 2.239 . 0 0 "[ . 1 . 2]" 1 429 1 22 GLU H 1 23 THR H . . 3.190 2.574 2.508 2.611 . 0 0 "[ . 1 . 2]" 1 430 1 22 GLU H 1 23 THR HG1 . . 4.120 4.106 4.017 4.159 0.039 17 0 "[ . 1 . 2]" 1 431 1 22 GLU H 1 24 VAL H . . 4.460 4.246 4.209 4.309 . 0 0 "[ . 1 . 2]" 1 432 1 22 GLU H 1 25 LYS H . . 5.090 4.695 4.627 4.743 . 0 0 "[ . 1 . 2]" 1 433 1 22 GLU HA 1 22 GLU HG2 . . 3.300 3.213 3.193 3.233 . 0 0 "[ . 1 . 2]" 1 434 1 22 GLU HA 1 25 LYS H . . 3.690 3.610 3.480 3.702 0.012 8 0 "[ . 1 . 2]" 1 435 1 22 GLU HA 1 25 LYS HB3 . . 3.320 2.760 2.572 2.929 . 0 0 "[ . 1 . 2]" 1 436 1 22 GLU HB2 1 23 THR H . . 3.810 2.562 2.530 2.708 . 0 0 "[ . 1 . 2]" 1 437 1 22 GLU HG2 1 23 THR H . . 4.170 4.193 4.187 4.201 0.031 17 0 "[ . 1 . 2]" 1 438 1 23 THR H 1 23 THR HB . . 3.380 2.668 2.571 2.736 . 0 0 "[ . 1 . 2]" 1 439 1 23 THR H 1 23 THR HG1 . . 3.420 2.005 1.948 2.204 . 0 0 "[ . 1 . 2]" 1 440 1 23 THR H 1 23 THR MG . . 4.280 3.803 3.784 3.848 . 0 0 "[ . 1 . 2]" 1 441 1 23 THR H 1 25 LYS HB3 . . 5.500 5.227 5.083 5.355 . 0 0 "[ . 1 . 2]" 1 442 1 23 THR HA 1 26 ASN H . . 4.490 3.811 3.702 4.028 . 0 0 "[ . 1 . 2]" 1 443 1 23 THR HA 1 68 ILE MD . . 3.900 2.055 1.953 2.175 . 0 0 "[ . 1 . 2]" 1 444 1 23 THR HB 1 24 VAL H . . 3.690 2.486 2.345 2.587 . 0 0 "[ . 1 . 2]" 1 445 1 23 THR HB 1 24 VAL HB . . 4.900 4.722 4.618 4.805 . 0 0 "[ . 1 . 2]" 1 446 1 23 THR HB 1 68 ILE MD . . 4.750 4.312 4.020 4.533 . 0 0 "[ . 1 . 2]" 1 447 1 23 THR HB 1 68 ILE MG . . 4.610 4.284 4.081 4.621 0.011 18 0 "[ . 1 . 2]" 1 448 1 23 THR HB 1 123 PHE HB3 . . 4.250 3.388 3.100 3.863 . 0 0 "[ . 1 . 2]" 1 449 1 23 THR HG1 1 24 VAL H . . 4.130 3.929 3.882 4.040 . 0 0 "[ . 1 . 2]" 1 450 1 23 THR HG1 1 68 ILE MD . . 4.940 4.194 3.594 4.649 . 0 0 "[ . 1 . 2]" 1 451 1 23 THR MG 1 24 VAL H . . 4.690 3.533 3.279 3.652 . 0 0 "[ . 1 . 2]" 1 452 1 23 THR MG 1 85 MET HG2 . . 4.020 2.903 2.030 3.698 . 0 0 "[ . 1 . 2]" 1 453 1 23 THR MG 1 123 PHE HA . . 4.510 3.920 3.813 4.066 . 0 0 "[ . 1 . 2]" 1 454 1 23 THR MG 1 123 PHE HB3 . . 3.490 2.154 2.111 2.215 . 0 0 "[ . 1 . 2]" 1 455 1 24 VAL H 1 24 VAL HB . . 3.380 2.436 2.389 2.504 . 0 0 "[ . 1 . 2]" 1 456 1 24 VAL H 1 24 VAL MG2 . . 3.920 2.306 2.259 2.340 . 0 0 "[ . 1 . 2]" 1 457 1 24 VAL H 1 25 LYS H . . 3.360 2.815 2.775 2.860 . 0 0 "[ . 1 . 2]" 1 458 1 24 VAL H 1 25 LYS HB3 . . 5.150 4.997 4.908 5.092 . 0 0 "[ . 1 . 2]" 1 459 1 24 VAL H 1 26 ASN H . . 4.710 4.447 4.353 4.554 . 0 0 "[ . 1 . 2]" 1 460 1 24 VAL HA 1 26 ASN H . . 4.600 4.509 4.369 4.605 0.005 2 0 "[ . 1 . 2]" 1 461 1 24 VAL HA 1 27 PHE HB3 . . 3.530 2.460 2.331 2.576 . 0 0 "[ . 1 . 2]" 1 462 1 24 VAL HA 1 28 LEU H . . 3.930 3.875 3.754 3.947 0.017 18 0 "[ . 1 . 2]" 1 463 1 24 VAL HA 1 28 LEU HG . . 4.420 3.826 3.592 3.967 . 0 0 "[ . 1 . 2]" 1 464 1 24 VAL HB 1 25 LYS H . . 4.000 2.792 2.731 2.859 . 0 0 "[ . 1 . 2]" 1 465 1 24 VAL MG2 1 25 LYS H . . 4.490 4.099 4.067 4.125 . 0 0 "[ . 1 . 2]" 1 466 1 25 LYS H 1 25 LYS HB3 . . 2.970 2.560 2.515 2.608 . 0 0 "[ . 1 . 2]" 1 467 1 25 LYS H 1 25 LYS HD3 . . 4.670 4.644 4.550 4.693 0.023 12 0 "[ . 1 . 2]" 1 468 1 25 LYS H 1 25 LYS HG3 . . 4.630 4.531 4.491 4.567 . 0 0 "[ . 1 . 2]" 1 469 1 25 LYS H 1 26 ASN H . . 3.440 2.934 2.864 3.010 . 0 0 "[ . 1 . 2]" 1 470 1 25 LYS HA 1 25 LYS HD3 . . 3.600 2.711 2.206 3.074 . 0 0 "[ . 1 . 2]" 1 471 1 25 LYS HA 1 25 LYS HG3 . . 3.270 3.232 3.117 3.292 0.022 4 0 "[ . 1 . 2]" 1 472 1 25 LYS HA 1 28 LEU H . . 4.100 3.684 3.574 3.772 . 0 0 "[ . 1 . 2]" 1 473 1 25 LYS HA 1 28 LEU MD1 . . 3.850 3.140 2.856 3.500 . 0 0 "[ . 1 . 2]" 1 474 1 25 LYS HA 1 29 ASP H . . 4.360 3.892 3.813 3.972 . 0 0 "[ . 1 . 2]" 1 475 1 25 LYS HB3 1 26 ASN H . . 3.290 2.558 2.458 2.650 . 0 0 "[ . 1 . 2]" 1 476 1 25 LYS HB3 1 26 ASN HA . . 4.340 4.360 4.346 4.367 0.027 11 0 "[ . 1 . 2]" 1 477 1 25 LYS HG3 1 26 ASN H . . 4.560 3.721 3.549 3.854 . 0 0 "[ . 1 . 2]" 1 478 1 25 LYS HG3 1 26 ASN HA . . 4.310 3.741 3.573 3.935 . 0 0 "[ . 1 . 2]" 1 479 1 25 LYS HG3 1 29 ASP HB2 . . 4.460 4.268 4.111 4.444 . 0 0 "[ . 1 . 2]" 1 480 1 26 ASN H 1 26 ASN HB2 . . 3.200 2.403 2.192 2.709 . 0 0 "[ . 1 . 2]" 1 481 1 26 ASN H 1 26 ASN QD . . 4.860 4.649 4.363 4.830 . 0 0 "[ . 1 . 2]" 1 482 1 26 ASN H 1 27 PHE H . . 3.570 2.679 2.622 2.729 . 0 0 "[ . 1 . 2]" 1 483 1 26 ASN H 1 27 PHE HB3 . . 4.680 4.701 4.685 4.713 0.033 18 0 "[ . 1 . 2]" 1 484 1 26 ASN H 1 28 LEU H . . 4.390 4.264 4.201 4.340 . 0 0 "[ . 1 . 2]" 1 485 1 26 ASN H 1 29 ASP H . . 4.630 4.659 4.646 4.675 0.045 5 0 "[ . 1 . 2]" 1 486 1 26 ASN H 1 29 ASP HB2 . . 4.690 4.708 4.671 4.725 0.035 15 0 "[ . 1 . 2]" 1 487 1 26 ASN H 1 68 ILE MG . . 5.190 4.575 4.164 4.975 . 0 0 "[ . 1 . 2]" 1 488 1 26 ASN HA 1 26 ASN QD . . 4.460 3.922 3.500 4.091 . 0 0 "[ . 1 . 2]" 1 489 1 26 ASN HA 1 28 LEU H . . 4.670 4.559 4.478 4.682 0.012 12 0 "[ . 1 . 2]" 1 490 1 26 ASN HA 1 29 ASP H . . 3.690 3.494 3.408 3.696 0.006 12 0 "[ . 1 . 2]" 1 491 1 26 ASN HA 1 29 ASP HB2 . . 3.620 2.324 2.223 2.528 . 0 0 "[ . 1 . 2]" 1 492 1 26 ASN HB2 1 27 PHE H . . 3.890 3.848 3.636 3.913 0.023 14 0 "[ . 1 . 2]" 1 493 1 26 ASN HB2 1 68 ILE MG . . 4.290 3.784 3.367 4.239 . 0 0 "[ . 1 . 2]" 1 494 1 26 ASN QD 1 27 PHE H . . 4.780 4.295 3.453 4.810 0.030 12 0 "[ . 1 . 2]" 1 495 1 26 ASN QD 1 30 TYR QE . . 3.120 2.505 2.102 2.778 . 0 0 "[ . 1 . 2]" 1 496 1 26 ASN QD 1 68 ILE H . . 5.340 4.551 4.097 4.881 . 0 0 "[ . 1 . 2]" 1 497 1 26 ASN QD 1 68 ILE MD . . 3.950 2.002 1.739 2.998 . 0 0 "[ . 1 . 2]" 1 498 1 26 ASN QD 1 68 ILE MG . . 4.430 4.303 4.032 4.442 0.012 12 0 "[ . 1 . 2]" 1 499 1 26 ASN QD 1 95 THR HA . . 4.420 3.348 3.023 3.663 . 0 0 "[ . 1 . 2]" 1 500 1 26 ASN QD 1 95 THR HB . . 4.950 4.478 3.716 4.801 . 0 0 "[ . 1 . 2]" 1 501 1 26 ASN HD21 1 30 TYR QD . . 4.220 4.087 3.616 4.622 0.402 12 0 "[ . 1 . 2]" 1 502 1 26 ASN HD21 1 30 TYR QE . . 3.980 3.311 2.732 3.990 0.010 12 0 "[ . 1 . 2]" 1 503 1 26 ASN HD21 1 68 ILE MD . . 4.740 2.040 1.745 3.513 . 0 0 "[ . 1 . 2]" 1 504 1 26 ASN HD22 1 30 TYR QD . . 5.000 4.122 3.283 4.780 . 0 0 "[ . 1 . 2]" 1 505 1 26 ASN HD22 1 30 TYR QE . . 3.980 2.651 2.117 3.026 . 0 0 "[ . 1 . 2]" 1 506 1 26 ASN HD22 1 68 ILE MD . . 4.740 3.393 2.974 3.862 . 0 0 "[ . 1 . 2]" 1 507 1 27 PHE H 1 27 PHE HB3 . . 3.250 2.422 2.342 2.478 . 0 0 "[ . 1 . 2]" 1 508 1 27 PHE H 1 28 LEU H . . 3.340 2.797 2.742 2.898 . 0 0 "[ . 1 . 2]" 1 509 1 27 PHE H 1 28 LEU HG . . 4.880 4.711 4.614 4.822 . 0 0 "[ . 1 . 2]" 1 510 1 27 PHE H 1 29 ASP H . . 4.140 4.152 4.144 4.176 0.036 12 0 "[ . 1 . 2]" 1 511 1 27 PHE H 1 30 TYR H . . 5.000 4.881 4.775 4.971 . 0 0 "[ . 1 . 2]" 1 512 1 27 PHE H 1 68 ILE MD . . 4.410 3.904 3.654 4.220 . 0 0 "[ . 1 . 2]" 1 513 1 27 PHE HA 1 30 TYR H . . 3.970 3.716 3.639 3.855 . 0 0 "[ . 1 . 2]" 1 514 1 27 PHE HA 1 31 CYS H . . 4.580 4.397 4.314 4.508 . 0 0 "[ . 1 . 2]" 1 515 1 27 PHE HB3 1 28 LEU H . . 3.310 2.446 2.386 2.506 . 0 0 "[ . 1 . 2]" 1 516 1 27 PHE HB3 1 28 LEU HA . . 4.510 4.413 4.310 4.468 . 0 0 "[ . 1 . 2]" 1 517 1 27 PHE HB3 1 28 LEU MD1 . . 4.520 4.544 4.537 4.553 0.033 18 0 "[ . 1 . 2]" 1 518 1 27 PHE HB3 1 28 LEU HG . . 3.840 3.202 3.106 3.312 . 0 0 "[ . 1 . 2]" 1 519 1 27 PHE HB3 1 29 ASP H . . 4.980 4.886 4.823 4.934 . 0 0 "[ . 1 . 2]" 1 520 1 28 LEU H 1 28 LEU HB3 . . 3.820 3.589 3.578 3.599 . 0 0 "[ . 1 . 2]" 1 521 1 28 LEU H 1 28 LEU MD1 . . 3.910 3.555 3.480 3.645 . 0 0 "[ . 1 . 2]" 1 522 1 28 LEU H 1 28 LEU HG . . 3.020 2.396 2.348 2.434 . 0 0 "[ . 1 . 2]" 1 523 1 28 LEU H 1 29 ASP H . . 3.280 2.609 2.538 2.649 . 0 0 "[ . 1 . 2]" 1 524 1 28 LEU H 1 29 ASP HB2 . . 4.430 4.461 4.451 4.473 0.043 16 0 "[ . 1 . 2]" 1 525 1 28 LEU H 1 30 TYR H . . 4.300 4.127 4.045 4.168 . 0 0 "[ . 1 . 2]" 1 526 1 28 LEU H 1 31 CYS H . . 5.010 4.768 4.692 4.833 . 0 0 "[ . 1 . 2]" 1 527 1 28 LEU H 1 31 CYS HB2 . . 5.330 5.207 5.151 5.289 . 0 0 "[ . 1 . 2]" 1 528 1 28 LEU HA 1 28 LEU MD1 . . 4.260 3.865 3.839 3.884 . 0 0 "[ . 1 . 2]" 1 529 1 28 LEU HA 1 28 LEU HG . . 4.100 3.005 2.934 3.095 . 0 0 "[ . 1 . 2]" 1 530 1 28 LEU HA 1 30 TYR H . . 4.140 4.117 4.042 4.151 0.011 4 0 "[ . 1 . 2]" 1 531 1 28 LEU HA 1 31 CYS H . . 3.390 3.152 3.052 3.237 . 0 0 "[ . 1 . 2]" 1 532 1 28 LEU HA 1 31 CYS HB2 . . 3.740 2.421 2.353 2.537 . 0 0 "[ . 1 . 2]" 1 533 1 28 LEU HA 1 31 CYS HG . . 4.160 2.799 2.656 2.937 . 0 0 "[ . 1 . 2]" 1 534 1 28 LEU HA 1 32 ARG H . . 3.970 3.803 3.669 3.897 . 0 0 "[ . 1 . 2]" 1 535 1 28 LEU HA 1 32 ARG HB3 . . 5.440 5.200 5.036 5.444 0.004 20 0 "[ . 1 . 2]" 1 536 1 28 LEU HB3 1 28 LEU MD1 . . 3.650 2.427 2.385 2.459 . 0 0 "[ . 1 . 2]" 1 537 1 28 LEU HB3 1 29 ASP H . . 3.890 3.646 3.586 3.732 . 0 0 "[ . 1 . 2]" 1 538 1 28 LEU HB3 1 30 TYR H . . 5.500 5.512 5.480 5.536 0.036 3 0 "[ . 1 . 2]" 1 539 1 28 LEU HB3 1 31 CYS H . . 5.400 5.222 5.096 5.321 . 0 0 "[ . 1 . 2]" 1 540 1 28 LEU HB3 1 31 CYS HB2 . . 4.520 4.171 4.023 4.311 . 0 0 "[ . 1 . 2]" 1 541 1 28 LEU MD1 1 29 ASP H . . 4.710 4.564 4.487 4.666 . 0 0 "[ . 1 . 2]" 1 542 1 28 LEU HG 1 29 ASP H . . 4.440 4.470 4.461 4.492 0.052 3 0 "[ . 1 . 2]" 1 543 1 29 ASP H 1 29 ASP HB2 . . 3.060 2.232 2.159 2.266 . 0 0 "[ . 1 . 2]" 1 544 1 29 ASP H 1 30 TYR H . . 3.070 2.842 2.758 2.886 . 0 0 "[ . 1 . 2]" 1 545 1 29 ASP H 1 32 ARG HB3 . . 5.240 4.860 4.711 5.186 . 0 0 "[ . 1 . 2]" 1 546 1 29 ASP HA 1 31 CYS H . . 5.140 4.698 4.538 4.875 . 0 0 "[ . 1 . 2]" 1 547 1 29 ASP HA 1 32 ARG H . . 4.050 3.643 3.429 3.872 . 0 0 "[ . 1 . 2]" 1 548 1 29 ASP HA 1 32 ARG HD2 . . 3.950 3.576 2.395 3.978 0.028 3 0 "[ . 1 . 2]" 1 549 1 29 ASP HB2 1 30 TYR H . . 3.170 2.954 2.817 3.078 . 0 0 "[ . 1 . 2]" 1 550 1 29 ASP HB2 1 30 TYR HA . . 4.950 4.914 4.799 4.978 0.028 3 0 "[ . 1 . 2]" 1 551 1 29 ASP HB2 1 31 CYS H . . 5.500 5.320 5.199 5.387 . 0 0 "[ . 1 . 2]" 1 552 1 30 TYR H 1 30 TYR HB3 . . 3.520 3.513 3.455 3.532 0.012 19 0 "[ . 1 . 2]" 1 553 1 30 TYR H 1 30 TYR QD . . 3.950 3.424 3.318 3.677 . 0 0 "[ . 1 . 2]" 1 554 1 30 TYR H 1 31 CYS H . . 3.250 2.584 2.547 2.634 . 0 0 "[ . 1 . 2]" 1 555 1 30 TYR H 1 31 CYS HB2 . . 4.710 4.726 4.720 4.737 0.027 3 0 "[ . 1 . 2]" 1 556 1 30 TYR H 1 32 ARG H . . 4.280 4.017 3.967 4.089 . 0 0 "[ . 1 . 2]" 1 557 1 30 TYR H 1 32 ARG HB3 . . 5.170 4.786 4.625 5.121 . 0 0 "[ . 1 . 2]" 1 558 1 30 TYR HA 1 30 TYR QD . . 3.300 2.214 2.096 2.296 . 0 0 "[ . 1 . 2]" 1 559 1 30 TYR HA 1 33 GLU H . . 3.590 3.296 3.137 3.485 . 0 0 "[ . 1 . 2]" 1 560 1 30 TYR HA 1 33 GLU HB2 . . 3.600 2.763 2.578 3.088 . 0 0 "[ . 1 . 2]" 1 561 1 30 TYR HA 1 34 GLY H . . 4.620 4.511 4.250 4.622 0.002 5 0 "[ . 1 . 2]" 1 562 1 30 TYR HA 1 35 PHE H . . 4.080 3.754 3.404 3.928 . 0 0 "[ . 1 . 2]" 1 563 1 30 TYR HA 1 35 PHE HB3 . . 3.750 3.106 2.646 3.409 . 0 0 "[ . 1 . 2]" 1 564 1 30 TYR HA 1 35 PHE QD . . 4.780 4.336 4.175 4.562 . 0 0 "[ . 1 . 2]" 1 565 1 30 TYR HB3 1 31 CYS H . . 3.720 3.262 3.193 3.298 . 0 0 "[ . 1 . 2]" 1 566 1 30 TYR HB3 1 31 CYS HA . . 4.060 4.125 4.110 4.144 0.084 6 0 "[ . 1 . 2]" 1 567 1 30 TYR HB3 1 33 GLU H . . 5.390 5.147 5.035 5.299 . 0 0 "[ . 1 . 2]" 1 568 1 30 TYR HB3 1 34 GLY H . . 5.380 5.295 5.172 5.385 0.005 17 0 "[ . 1 . 2]" 1 569 1 30 TYR HB3 1 35 PHE H . . 4.030 3.870 3.778 3.922 . 0 0 "[ . 1 . 2]" 1 570 1 30 TYR HB3 1 35 PHE HA . . 5.050 5.089 5.067 5.103 0.053 3 0 "[ . 1 . 2]" 1 571 1 30 TYR HB3 1 35 PHE HB3 . . 3.190 2.116 2.097 2.140 . 0 0 "[ . 1 . 2]" 1 572 1 30 TYR HB3 1 35 PHE QD . . 4.300 2.501 2.381 2.659 . 0 0 "[ . 1 . 2]" 1 573 1 30 TYR HB3 1 36 TYR H . . 4.230 3.914 3.330 4.155 . 0 0 "[ . 1 . 2]" 1 574 1 30 TYR HB3 1 36 TYR QE . . 3.950 2.778 2.556 3.178 . 0 0 "[ . 1 . 2]" 1 575 1 30 TYR QD 1 35 PHE HB3 . . 3.850 2.682 2.428 2.939 . 0 0 "[ . 1 . 2]" 1 576 1 30 TYR QD 1 35 PHE QD . . 3.950 3.039 2.837 3.236 . 0 0 "[ . 1 . 2]" 1 577 1 30 TYR QD 1 96 ALA HA . . 4.320 3.534 3.040 3.873 . 0 0 "[ . 1 . 2]" 1 578 1 30 TYR QE 1 35 PHE QE . . 4.030 3.628 3.266 4.044 0.014 9 0 "[ . 1 . 2]" 1 579 1 30 TYR QE 1 35 PHE HZ . . 5.460 4.517 4.003 5.140 . 0 0 "[ . 1 . 2]" 1 580 1 30 TYR QE 1 65 LYS H . . 3.910 3.563 3.331 3.809 . 0 0 "[ . 1 . 2]" 1 581 1 30 TYR QE 1 65 LYS HE2 . . 4.970 4.326 3.293 4.983 0.013 6 0 "[ . 1 . 2]" 1 582 1 30 TYR QE 1 65 LYS HG3 . . 4.530 4.532 4.435 4.552 0.022 8 0 "[ . 1 . 2]" 1 583 1 30 TYR QE 1 96 ALA HA . . 4.170 3.306 2.134 3.828 . 0 0 "[ . 1 . 2]" 1 584 1 30 TYR QE 1 96 ALA MB . . 4.110 2.578 2.364 3.090 . 0 0 "[ . 1 . 2]" 1 585 1 30 TYR HH 1 65 LYS H . . 3.630 2.304 2.106 2.514 . 0 0 "[ . 1 . 2]" 1 586 1 31 CYS H 1 31 CYS HB2 . . 3.250 2.551 2.511 2.606 . 0 0 "[ . 1 . 2]" 1 587 1 31 CYS H 1 31 CYS HG . . 3.720 1.925 1.878 1.976 . 0 0 "[ . 1 . 2]" 1 588 1 31 CYS H 1 32 ARG H . . 3.420 2.732 2.681 2.847 . 0 0 "[ . 1 . 2]" 1 589 1 31 CYS H 1 32 ARG HB3 . . 4.940 4.610 4.511 4.784 . 0 0 "[ . 1 . 2]" 1 590 1 31 CYS H 1 33 GLU H . . 4.440 4.228 4.165 4.388 . 0 0 "[ . 1 . 2]" 1 591 1 31 CYS H 1 34 GLY H . . 4.790 4.809 4.790 4.826 0.036 20 0 "[ . 1 . 2]" 1 592 1 31 CYS H 1 35 PHE HB3 . . 4.670 4.675 4.549 4.707 0.037 5 0 "[ . 1 . 2]" 1 593 1 31 CYS H 1 36 TYR H . . 5.100 5.086 4.942 5.147 0.047 20 0 "[ . 1 . 2]" 1 594 1 31 CYS H 1 36 TYR QD . . 4.420 3.324 3.261 3.406 . 0 0 "[ . 1 . 2]" 1 595 1 31 CYS H 1 162 VAL MG2 . . 5.450 4.811 4.390 5.078 . 0 0 "[ . 1 . 2]" 1 596 1 31 CYS HA 1 34 GLY HA2 . . 4.160 3.736 3.619 4.058 . 0 0 "[ . 1 . 2]" 1 597 1 31 CYS HA 1 35 PHE H . . 4.330 3.682 3.507 3.984 . 0 0 "[ . 1 . 2]" 1 598 1 31 CYS HA 1 36 TYR H . . 3.900 3.216 2.992 3.543 . 0 0 "[ . 1 . 2]" 1 599 1 31 CYS HA 1 36 TYR QD . . 3.770 2.823 2.476 3.085 . 0 0 "[ . 1 . 2]" 1 600 1 31 CYS HA 1 37 ASN H . . 5.280 4.888 4.514 5.255 . 0 0 "[ . 1 . 2]" 1 601 1 31 CYS HA 1 160 VAL MG2 . . 4.690 4.032 3.549 4.329 . 0 0 "[ . 1 . 2]" 1 602 1 31 CYS HB2 1 32 ARG H . . 3.630 2.597 2.531 2.684 . 0 0 "[ . 1 . 2]" 1 603 1 31 CYS HB2 1 32 ARG HB3 . . 5.100 4.659 4.524 4.859 . 0 0 "[ . 1 . 2]" 1 604 1 31 CYS HB2 1 162 VAL MG2 . . 4.320 2.766 2.365 3.065 . 0 0 "[ . 1 . 2]" 1 605 1 31 CYS HG 1 32 ARG H . . 4.100 4.158 4.144 4.174 0.074 12 0 "[ . 1 . 2]" 1 606 1 31 CYS HG 1 36 TYR QD . . 5.000 3.007 2.802 3.165 . 0 0 "[ . 1 . 2]" 1 607 1 31 CYS HG 1 36 TYR QE . . 3.820 3.049 2.451 3.462 . 0 0 "[ . 1 . 2]" 1 608 1 32 ARG H 1 32 ARG HB3 . . 3.140 2.267 2.214 2.378 . 0 0 "[ . 1 . 2]" 1 609 1 32 ARG H 1 32 ARG HD2 . . 4.200 4.236 4.219 4.260 0.060 5 0 "[ . 1 . 2]" 1 610 1 32 ARG H 1 33 GLU H . . 3.300 2.770 2.704 2.869 . 0 0 "[ . 1 . 2]" 1 611 1 32 ARG H 1 33 GLU HB2 . . 5.080 4.902 4.775 5.085 0.005 20 0 "[ . 1 . 2]" 1 612 1 32 ARG H 1 34 GLY H . . 4.510 3.918 3.855 4.016 . 0 0 "[ . 1 . 2]" 1 613 1 32 ARG HA 1 32 ARG HD2 . . 4.230 4.084 3.846 4.345 0.115 17 0 "[ . 1 . 2]" 1 614 1 32 ARG HA 1 33 GLU HA . . 4.790 4.739 4.698 4.790 . 0 0 "[ . 1 . 2]" 1 615 1 32 ARG HA 1 33 GLU HG2 . . 5.370 5.370 5.103 5.406 0.036 3 0 "[ . 1 . 2]" 1 616 1 32 ARG HA 1 34 GLY H . . 4.280 3.999 3.876 4.283 0.003 20 0 "[ . 1 . 2]" 1 617 1 32 ARG HB3 1 32 ARG HD2 . . 3.070 2.366 2.189 2.546 . 0 0 "[ . 1 . 2]" 1 618 1 32 ARG HB3 1 33 GLU H . . 3.390 2.878 2.360 3.088 . 0 0 "[ . 1 . 2]" 1 619 1 32 ARG HB3 1 34 GLY H . . 5.320 4.940 4.600 5.105 . 0 0 "[ . 1 . 2]" 1 620 1 32 ARG HD2 1 33 GLU H . . 4.730 3.471 2.878 4.749 0.019 20 0 "[ . 1 . 2]" 1 621 1 33 GLU H 1 33 GLU HB2 . . 2.850 2.365 2.299 2.423 . 0 0 "[ . 1 . 2]" 1 622 1 33 GLU H 1 33 GLU HG2 . . 3.210 2.549 2.343 2.678 . 0 0 "[ . 1 . 2]" 1 623 1 33 GLU H 1 34 GLY H . . 3.190 2.506 2.482 2.538 . 0 0 "[ . 1 . 2]" 1 624 1 33 GLU H 1 34 GLY HA2 . . 4.850 4.821 4.785 4.870 0.020 18 0 "[ . 1 . 2]" 1 625 1 33 GLU H 1 35 PHE H . . 3.740 3.735 3.684 3.772 0.032 3 0 "[ . 1 . 2]" 1 626 1 33 GLU HA 1 33 GLU HG2 . . 3.000 2.978 2.834 3.050 0.050 20 0 "[ . 1 . 2]" 1 627 1 33 GLU HA 1 34 GLY H . . 3.500 3.452 3.427 3.493 . 0 0 "[ . 1 . 2]" 1 628 1 33 GLU HB2 1 34 GLY H . . 3.720 3.259 3.196 3.312 . 0 0 "[ . 1 . 2]" 1 629 1 33 GLU HB2 1 34 GLY HA2 . . 5.190 5.219 5.208 5.234 0.044 8 0 "[ . 1 . 2]" 1 630 1 33 GLU HB2 1 35 PHE H . . 3.490 3.008 2.950 3.069 . 0 0 "[ . 1 . 2]" 1 631 1 33 GLU HB2 1 35 PHE HA . . 5.500 4.883 4.745 4.977 . 0 0 "[ . 1 . 2]" 1 632 1 33 GLU HG2 1 34 GLY H . . 5.120 4.692 4.533 4.769 . 0 0 "[ . 1 . 2]" 1 633 1 34 GLY H 1 35 PHE H . . 3.190 2.385 2.282 2.466 . 0 0 "[ . 1 . 2]" 1 634 1 34 GLY H 1 35 PHE HB3 . . 4.840 4.492 4.274 4.642 . 0 0 "[ . 1 . 2]" 1 635 1 34 GLY H 1 36 TYR H . . 4.220 4.240 4.221 4.259 0.039 3 0 "[ . 1 . 2]" 1 636 1 34 GLY HA2 1 37 ASN QD . . 3.370 3.316 2.776 3.402 0.032 17 0 "[ . 1 . 2]" 1 637 1 35 PHE H 1 35 PHE HB3 . . 2.920 2.374 2.248 2.453 . 0 0 "[ . 1 . 2]" 1 638 1 35 PHE H 1 35 PHE QD . . 5.020 4.136 4.104 4.176 . 0 0 "[ . 1 . 2]" 1 639 1 35 PHE H 1 36 TYR H . . 3.380 2.788 2.705 2.842 . 0 0 "[ . 1 . 2]" 1 640 1 35 PHE H 1 37 ASN H . . 4.120 4.090 3.857 4.138 0.018 19 0 "[ . 1 . 2]" 1 641 1 35 PHE HA 1 35 PHE QD . . 4.460 2.641 2.254 3.154 . 0 0 "[ . 1 . 2]" 1 642 1 35 PHE HA 1 35 PHE QE . . 4.930 4.654 4.519 4.942 0.012 20 0 "[ . 1 . 2]" 1 643 1 35 PHE HA 1 36 TYR H . . 3.550 3.517 3.474 3.569 0.019 18 0 "[ . 1 . 2]" 1 644 1 35 PHE HA 1 37 ASN H . . 4.150 3.910 3.754 4.163 0.013 3 0 "[ . 1 . 2]" 1 645 1 35 PHE HA 1 62 LYS HE2 . . 5.500 4.673 4.382 5.388 . 0 0 "[ . 1 . 2]" 1 646 1 35 PHE HB3 1 36 TYR H . . 3.430 2.966 2.733 3.123 . 0 0 "[ . 1 . 2]" 1 647 1 35 PHE HB3 1 37 ASN H . . 4.970 4.975 4.781 5.022 0.052 16 0 "[ . 1 . 2]" 1 648 1 35 PHE QD 1 36 TYR HA . . 4.910 4.188 3.062 4.720 . 0 0 "[ . 1 . 2]" 1 649 1 35 PHE QD 1 36 TYR QD . . 4.040 3.627 3.113 3.883 . 0 0 "[ . 1 . 2]" 1 650 1 35 PHE QD 1 62 LYS HE2 . . 4.520 3.606 3.248 3.799 . 0 0 "[ . 1 . 2]" 1 651 1 35 PHE QE 1 62 LYS HA . . 4.200 4.128 3.813 4.232 0.032 9 0 "[ . 1 . 2]" 1 652 1 35 PHE QE 1 62 LYS HB3 . . 3.680 3.242 2.260 3.709 0.029 15 0 "[ . 1 . 2]" 1 653 1 35 PHE QE 1 62 LYS HD3 . . 4.170 2.915 2.575 3.430 . 0 0 "[ . 1 . 2]" 1 654 1 35 PHE QE 1 62 LYS HE2 . . 3.700 3.067 2.877 3.205 . 0 0 "[ . 1 . 2]" 1 655 1 35 PHE QE 1 63 ALA H . . 4.270 2.390 2.056 2.585 . 0 0 "[ . 1 . 2]" 1 656 1 35 PHE QE 1 63 ALA HA . . 4.870 4.581 4.010 4.886 0.016 2 0 "[ . 1 . 2]" 1 657 1 35 PHE QE 1 64 THR MG . . 3.790 3.181 2.417 3.796 0.006 20 0 "[ . 1 . 2]" 1 658 1 35 PHE QE 1 96 ALA MB . . 3.530 2.191 2.027 2.432 . 0 0 "[ . 1 . 2]" 1 659 1 35 PHE HZ 1 62 LYS H . . 5.500 5.429 5.123 5.528 0.028 11 0 "[ . 1 . 2]" 1 660 1 35 PHE HZ 1 62 LYS HB3 . . 4.040 3.523 2.500 4.072 0.032 11 0 "[ . 1 . 2]" 1 661 1 35 PHE HZ 1 62 LYS HD3 . . 4.350 2.705 2.276 3.398 . 0 0 "[ . 1 . 2]" 1 662 1 35 PHE HZ 1 62 LYS HE2 . . 4.270 3.594 3.218 4.282 0.012 6 0 "[ . 1 . 2]" 1 663 1 35 PHE HZ 1 64 THR H . . 4.980 4.070 3.580 4.847 . 0 0 "[ . 1 . 2]" 1 664 1 35 PHE HZ 1 64 THR HA . . 4.320 3.223 2.681 4.042 . 0 0 "[ . 1 . 2]" 1 665 1 35 PHE HZ 1 64 THR MG . . 3.380 2.850 2.311 3.383 0.003 7 0 "[ . 1 . 2]" 1 666 1 35 PHE HZ 1 96 ALA MB . . 3.830 3.389 2.434 3.845 0.015 11 0 "[ . 1 . 2]" 1 667 1 36 TYR H 1 36 TYR HB3 . . 3.740 3.639 3.611 3.668 . 0 0 "[ . 1 . 2]" 1 668 1 36 TYR H 1 36 TYR QD . . 4.320 2.894 2.720 3.275 . 0 0 "[ . 1 . 2]" 1 669 1 36 TYR H 1 37 ASN H . . 3.080 2.437 2.298 2.569 . 0 0 "[ . 1 . 2]" 1 670 1 36 TYR H 1 37 ASN HA . . 4.930 4.928 4.779 5.009 0.079 6 0 "[ . 1 . 2]" 1 671 1 36 TYR HA 1 36 TYR QD . . 3.580 2.698 2.358 2.887 . 0 0 "[ . 1 . 2]" 1 672 1 36 TYR HA 1 39 THR H . . 4.900 4.298 3.531 4.540 . 0 0 "[ . 1 . 2]" 1 673 1 36 TYR HA 1 39 THR HA . . 5.070 5.084 4.870 5.140 0.070 14 0 "[ . 1 . 2]" 1 674 1 36 TYR HA 1 39 THR HB . . 4.860 4.086 3.964 4.273 . 0 0 "[ . 1 . 2]" 1 675 1 36 TYR HA 1 39 THR HG1 . . 3.460 2.638 2.497 2.750 . 0 0 "[ . 1 . 2]" 1 676 1 36 TYR HA 1 39 THR MG . . 3.720 2.074 2.016 2.189 . 0 0 "[ . 1 . 2]" 1 677 1 36 TYR HB3 1 37 ASN H . . 4.370 4.211 4.034 4.310 . 0 0 "[ . 1 . 2]" 1 678 1 36 TYR HB3 1 37 ASN HA . . 4.830 4.646 4.396 4.789 . 0 0 "[ . 1 . 2]" 1 679 1 36 TYR HB3 1 39 THR H . . 5.100 4.950 4.466 5.113 0.013 16 0 "[ . 1 . 2]" 1 680 1 36 TYR HB3 1 39 THR HG1 . . 3.710 3.089 2.930 3.239 . 0 0 "[ . 1 . 2]" 1 681 1 36 TYR HB3 1 39 THR MG . . 4.030 3.858 3.670 4.032 0.002 4 0 "[ . 1 . 2]" 1 682 1 36 TYR HB3 1 157 ILE HB . . 4.860 4.352 4.034 4.639 . 0 0 "[ . 1 . 2]" 1 683 1 36 TYR HB3 1 157 ILE MD . . 4.230 3.070 2.730 3.325 . 0 0 "[ . 1 . 2]" 1 684 1 36 TYR HB3 1 157 ILE MG . . 4.340 3.221 2.748 3.633 . 0 0 "[ . 1 . 2]" 1 685 1 36 TYR HB3 1 160 VAL MG2 . . 4.120 2.592 2.310 3.007 . 0 0 "[ . 1 . 2]" 1 686 1 36 TYR QD 1 53 GLY HA2 . . 3.890 2.750 2.516 2.947 . 0 0 "[ . 1 . 2]" 1 687 1 36 TYR QE 1 53 GLY HA2 . . 3.890 3.690 3.400 3.897 0.007 11 0 "[ . 1 . 2]" 1 688 1 36 TYR QE 1 96 ALA HA . . 4.090 4.110 4.029 4.138 0.048 3 0 "[ . 1 . 2]" 1 689 1 36 TYR QE 1 96 ALA MB . . 4.110 3.462 3.023 3.730 . 0 0 "[ . 1 . 2]" 1 690 1 36 TYR QE 1 98 PHE H . . 4.400 4.306 3.907 4.439 0.039 3 0 "[ . 1 . 2]" 1 691 1 36 TYR QE 1 98 PHE QE . . 3.600 2.977 2.703 3.384 . 0 0 "[ . 1 . 2]" 1 692 1 36 TYR HH 1 96 ALA HA . . 4.080 2.815 2.581 3.122 . 0 0 "[ . 1 . 2]" 1 693 1 36 TYR HH 1 96 ALA MB . . 3.940 3.203 2.715 3.758 . 0 0 "[ . 1 . 2]" 1 694 1 36 TYR HH 1 98 PHE QD . . 3.000 2.996 2.823 3.032 0.032 11 0 "[ . 1 . 2]" 1 695 1 37 ASN H 1 37 ASN HB2 . . 3.240 2.502 2.332 2.601 . 0 0 "[ . 1 . 2]" 1 696 1 37 ASN H 1 37 ASN QD . . 4.510 4.135 2.666 4.459 . 0 0 "[ . 1 . 2]" 1 697 1 37 ASN H 1 38 ASN H . . 4.530 4.145 2.895 4.563 0.033 1 0 "[ . 1 . 2]" 1 698 1 37 ASN HA 1 38 ASN H . . 3.510 2.428 2.128 3.254 . 0 0 "[ . 1 . 2]" 1 699 1 37 ASN HA 1 38 ASN HA . . 4.590 4.300 4.227 4.399 . 0 0 "[ . 1 . 2]" 1 700 1 37 ASN HA 1 38 ASN HB2 . . 5.160 4.811 4.628 5.119 . 0 0 "[ . 1 . 2]" 1 701 1 37 ASN HA 1 39 THR H . . 4.260 3.802 3.476 4.225 . 0 0 "[ . 1 . 2]" 1 702 1 37 ASN HA 1 159 SER HA . . 3.980 2.994 2.450 3.691 . 0 0 "[ . 1 . 2]" 1 703 1 37 ASN HA 1 160 VAL MG2 . . 4.200 2.613 2.224 3.100 . 0 0 "[ . 1 . 2]" 1 704 1 37 ASN HB2 1 37 ASN QD . . 3.470 2.636 2.286 3.065 . 0 0 "[ . 1 . 2]" 1 705 1 37 ASN HB2 1 38 ASN H . . 4.550 4.083 3.659 4.434 . 0 0 "[ . 1 . 2]" 1 706 1 37 ASN QD 1 159 SER HB3 . . 5.160 4.917 4.092 5.180 0.020 7 0 "[ . 1 . 2]" 1 707 1 37 ASN QD 1 160 VAL H . . 4.090 2.963 2.087 3.551 . 0 0 "[ . 1 . 2]" 1 708 1 38 ASN H 1 38 ASN HB2 . . 3.770 3.113 2.994 3.348 . 0 0 "[ . 1 . 2]" 1 709 1 38 ASN H 1 39 THR H . . 3.460 2.721 2.004 2.854 . 0 0 "[ . 1 . 2]" 1 710 1 38 ASN H 1 39 THR HG1 . . 4.740 4.113 3.278 4.416 . 0 0 "[ . 1 . 2]" 1 711 1 38 ASN H 1 157 ILE HB . . 4.500 3.969 3.614 4.502 0.002 4 0 "[ . 1 . 2]" 1 712 1 38 ASN H 1 157 ILE MG . . 4.560 3.809 3.358 4.566 0.006 16 0 "[ . 1 . 2]" 1 713 1 38 ASN H 1 159 SER HA . . 5.280 4.323 3.701 5.325 0.045 4 0 "[ . 1 . 2]" 1 714 1 38 ASN HA 1 39 THR H . . 3.370 2.701 2.561 3.015 . 0 0 "[ . 1 . 2]" 1 715 1 38 ASN HA 1 39 THR HG1 . . 4.810 4.835 4.714 4.888 0.078 15 0 "[ . 1 . 2]" 1 716 1 38 ASN HA 1 156 ILE HB . . 4.940 4.047 3.477 4.657 . 0 0 "[ . 1 . 2]" 1 717 1 38 ASN HA 1 157 ILE H . . 4.690 4.192 3.886 4.646 . 0 0 "[ . 1 . 2]" 1 718 1 38 ASN HA 1 157 ILE HB . . 4.330 4.319 4.092 4.381 0.051 20 0 "[ . 1 . 2]" 1 719 1 38 ASN HA 1 157 ILE MG . . 5.120 4.772 4.658 4.962 . 0 0 "[ . 1 . 2]" 1 720 1 38 ASN HB2 1 38 ASN QD . . 3.440 2.918 2.472 3.358 . 0 0 "[ . 1 . 2]" 1 721 1 38 ASN HB2 1 39 THR H . . 4.700 4.663 4.585 4.705 0.005 11 0 "[ . 1 . 2]" 1 722 1 38 ASN QD 1 57 PRO HB2 . . 4.460 4.406 4.039 4.487 0.027 19 0 "[ . 1 . 2]" 1 723 1 38 ASN QD 1 57 PRO QD . . 3.500 2.642 2.155 3.333 . 0 0 "[ . 1 . 2]" 1 724 1 38 ASN QD 1 57 PRO QG . . 3.500 2.868 2.117 3.505 0.005 11 0 "[ . 1 . 2]" 1 725 1 39 THR H 1 39 THR HG1 . . 3.420 2.194 1.879 2.351 . 0 0 "[ . 1 . 2]" 1 726 1 39 THR H 1 39 THR MG . . 3.640 2.920 2.724 3.026 . 0 0 "[ . 1 . 2]" 1 727 1 39 THR H 1 40 ILE H . . 4.650 4.579 4.517 4.654 0.004 3 0 "[ . 1 . 2]" 1 728 1 39 THR H 1 57 PRO QD . . 5.350 4.899 4.400 5.362 0.012 6 0 "[ . 1 . 2]" 1 729 1 39 THR H 1 157 ILE H . . 4.200 3.389 3.079 3.852 . 0 0 "[ . 1 . 2]" 1 730 1 39 THR H 1 157 ILE HA . . 5.500 5.076 4.829 5.451 . 0 0 "[ . 1 . 2]" 1 731 1 39 THR H 1 157 ILE HB . . 3.830 2.520 2.354 2.756 . 0 0 "[ . 1 . 2]" 1 732 1 39 THR H 1 157 ILE MG . . 4.200 3.755 3.640 3.953 . 0 0 "[ . 1 . 2]" 1 733 1 39 THR HA 1 40 ILE H . . 3.450 2.389 2.178 2.498 . 0 0 "[ . 1 . 2]" 1 734 1 39 THR HA 1 40 ILE QG . . 4.100 4.007 3.754 4.111 0.011 18 0 "[ . 1 . 2]" 1 735 1 39 THR HA 1 53 GLY HA2 . . 4.570 4.585 4.574 4.595 0.025 7 0 "[ . 1 . 2]" 1 736 1 39 THR HB 1 40 ILE H . . 3.530 2.389 2.210 2.776 . 0 0 "[ . 1 . 2]" 1 737 1 39 THR HB 1 40 ILE QG . . 4.880 4.269 4.153 4.412 . 0 0 "[ . 1 . 2]" 1 738 1 39 THR HB 1 55 PHE H . . 5.430 3.554 3.317 3.781 . 0 0 "[ . 1 . 2]" 1 739 1 39 THR HG1 1 157 ILE HB . . 4.140 2.647 2.439 2.882 . 0 0 "[ . 1 . 2]" 1 740 1 39 THR MG 1 40 ILE H . . 3.620 3.587 3.454 3.639 0.019 14 0 "[ . 1 . 2]" 1 741 1 39 THR MG 1 53 GLY HA2 . . 4.450 2.953 2.473 3.329 . 0 0 "[ . 1 . 2]" 1 742 1 39 THR MG 1 56 GLU HA . . 4.200 3.786 3.385 4.202 0.002 9 0 "[ . 1 . 2]" 1 743 1 39 THR MG 1 56 GLU HG2 . . 4.910 3.404 2.589 4.361 . 0 0 "[ . 1 . 2]" 1 744 1 39 THR MG 1 62 LYS HB3 . . 4.930 4.237 3.521 4.576 . 0 0 "[ . 1 . 2]" 1 745 1 39 THR MG 1 62 LYS HE2 . . 4.380 3.520 2.799 4.194 . 0 0 "[ . 1 . 2]" 1 746 1 39 THR MG 1 157 ILE HB . . 4.780 4.412 4.193 4.586 . 0 0 "[ . 1 . 2]" 1 747 1 40 ILE H 1 40 ILE QG . . 3.370 2.258 2.125 2.380 . 0 0 "[ . 1 . 2]" 1 748 1 40 ILE H 1 40 ILE MG . . 4.060 2.704 2.494 2.897 . 0 0 "[ . 1 . 2]" 1 749 1 40 ILE H 1 41 PHE H . . 4.710 4.569 4.522 4.628 . 0 0 "[ . 1 . 2]" 1 750 1 40 ILE H 1 55 PHE H . . 4.610 3.170 2.927 3.455 . 0 0 "[ . 1 . 2]" 1 751 1 40 ILE H 1 157 ILE H . . 4.860 4.827 4.708 4.900 0.040 6 0 "[ . 1 . 2]" 1 752 1 40 ILE H 1 157 ILE HB . . 5.500 5.464 5.274 5.527 0.027 6 0 "[ . 1 . 2]" 1 753 1 40 ILE HA 1 41 PHE H . . 3.430 2.284 2.174 2.348 . 0 0 "[ . 1 . 2]" 1 754 1 40 ILE HA 1 155 VAL HB . . 5.380 4.918 4.710 5.128 . 0 0 "[ . 1 . 2]" 1 755 1 40 ILE HA 1 156 ILE HA . . 3.650 2.190 2.123 2.254 . 0 0 "[ . 1 . 2]" 1 756 1 40 ILE HA 1 156 ILE QG . . 5.340 4.902 3.897 5.209 . 0 0 "[ . 1 . 2]" 1 757 1 40 ILE HA 1 157 ILE H . . 3.600 3.169 2.858 3.425 . 0 0 "[ . 1 . 2]" 1 758 1 40 ILE HB 1 41 PHE H . . 3.210 2.418 2.299 2.608 . 0 0 "[ . 1 . 2]" 1 759 1 40 ILE MD 1 55 PHE HB3 . . 4.320 3.183 2.781 3.635 . 0 0 "[ . 1 . 2]" 1 760 1 40 ILE MD 1 59 MET H . . 4.340 3.430 2.607 3.757 . 0 0 "[ . 1 . 2]" 1 761 1 40 ILE QG 1 55 PHE HB3 . . 4.840 3.539 3.271 3.729 . 0 0 "[ . 1 . 2]" 1 762 1 40 ILE MG 1 41 PHE H . . 3.830 3.691 3.279 3.835 0.005 20 0 "[ . 1 . 2]" 1 763 1 40 ILE MG 1 57 PRO HA . . 4.180 2.146 2.038 2.336 . 0 0 "[ . 1 . 2]" 1 764 1 40 ILE MG 1 57 PRO QG . . 4.520 2.345 2.133 3.627 . 0 0 "[ . 1 . 2]" 1 765 1 40 ILE MG 1 155 VAL H . . 5.360 4.245 3.340 4.602 . 0 0 "[ . 1 . 2]" 1 766 1 40 ILE MG 1 156 ILE HA . . 4.240 2.745 2.392 3.366 . 0 0 "[ . 1 . 2]" 1 767 1 41 PHE H 1 41 PHE QD . . 3.940 2.753 2.605 2.975 . 0 0 "[ . 1 . 2]" 1 768 1 41 PHE H 1 155 VAL H . . 4.480 4.239 4.107 4.403 . 0 0 "[ . 1 . 2]" 1 769 1 41 PHE H 1 155 VAL HB . . 3.860 3.142 2.995 3.350 . 0 0 "[ . 1 . 2]" 1 770 1 41 PHE H 1 156 ILE HA . . 4.080 3.545 3.232 3.669 . 0 0 "[ . 1 . 2]" 1 771 1 41 PHE H 1 157 ILE H . . 5.500 4.942 4.719 5.146 . 0 0 "[ . 1 . 2]" 1 772 1 41 PHE HA 1 41 PHE QD . . 3.890 2.955 2.859 3.042 . 0 0 "[ . 1 . 2]" 1 773 1 41 PHE HA 1 42 HIS H . . 3.310 2.219 2.103 2.375 . 0 0 "[ . 1 . 2]" 1 774 1 41 PHE HB3 1 42 HIS H . . 4.340 3.988 3.301 4.301 . 0 0 "[ . 1 . 2]" 1 775 1 41 PHE HB3 1 43 ARG H . . 4.830 3.959 3.772 4.708 . 0 0 "[ . 1 . 2]" 1 776 1 41 PHE HB3 1 50 ILE HB . . 5.080 3.561 3.207 4.002 . 0 0 "[ . 1 . 2]" 1 777 1 41 PHE HB3 1 50 ILE MD . . 4.370 3.518 2.873 4.174 . 0 0 "[ . 1 . 2]" 1 778 1 41 PHE HB3 1 136 ILE MG . . 4.530 3.132 2.594 3.685 . 0 0 "[ . 1 . 2]" 1 779 1 41 PHE HB3 1 155 VAL HB . . 3.790 3.811 3.793 3.825 0.035 6 0 "[ . 1 . 2]" 1 780 1 41 PHE HB3 1 155 VAL MG2 . . 4.570 4.489 4.369 4.579 0.009 19 0 "[ . 1 . 2]" 1 781 1 41 PHE QD 1 50 ILE HB . . 3.980 2.975 2.739 3.292 . 0 0 "[ . 1 . 2]" 1 782 1 41 PHE QD 1 51 GLN H . . 4.340 4.067 3.843 4.157 . 0 0 "[ . 1 . 2]" 1 783 1 41 PHE QD 1 51 GLN HA . . 4.780 4.218 3.982 4.394 . 0 0 "[ . 1 . 2]" 1 784 1 41 PHE QD 1 52 GLY H . . 4.960 4.383 4.167 4.701 . 0 0 "[ . 1 . 2]" 1 785 1 41 PHE QD 1 136 ILE MD . . 4.220 3.514 3.138 3.853 . 0 0 "[ . 1 . 2]" 1 786 1 41 PHE QD 1 157 ILE HG12 . . 4.340 4.001 3.586 4.385 0.045 19 0 "[ . 1 . 2]" 1 787 1 41 PHE QE 1 50 ILE HB . . 4.870 4.643 4.247 4.884 0.014 6 0 "[ . 1 . 2]" 1 788 1 41 PHE QE 1 50 ILE MD . . 3.900 3.205 2.944 3.468 . 0 0 "[ . 1 . 2]" 1 789 1 41 PHE QE 1 98 PHE QE . . 3.270 2.861 2.528 3.271 0.001 19 0 "[ . 1 . 2]" 1 790 1 41 PHE QE 1 100 ILE MD . . 3.860 2.520 2.324 2.717 . 0 0 "[ . 1 . 2]" 1 791 1 41 PHE QE 1 157 ILE MD . . 3.450 2.662 2.473 2.910 . 0 0 "[ . 1 . 2]" 1 792 1 41 PHE QE 1 157 ILE QG . . 3.400 2.251 2.183 2.323 . 0 0 "[ . 1 . 2]" 1 793 1 41 PHE HZ 1 98 PHE HZ . . 5.000 2.930 2.546 3.682 . 0 0 "[ . 1 . 2]" 1 794 1 41 PHE HZ 1 100 ILE MD . . 5.000 2.509 2.373 2.652 . 0 0 "[ . 1 . 2]" 1 795 1 41 PHE HZ 1 157 ILE MD . . 4.320 3.224 2.949 3.454 . 0 0 "[ . 1 . 2]" 1 796 1 41 PHE HZ 1 157 ILE MG . . 5.500 5.516 5.507 5.521 0.021 12 0 "[ . 1 . 2]" 1 797 1 42 HIS H 1 42 HIS HB3 . . 3.920 2.653 2.333 3.169 . 0 0 "[ . 1 . 2]" 1 798 1 42 HIS H 1 43 ARG H . . 4.290 2.811 2.201 3.084 . 0 0 "[ . 1 . 2]" 1 799 1 42 HIS HE1 1 55 PHE QE . . 4.750 4.447 2.896 4.764 0.014 4 0 "[ . 1 . 2]" 1 800 1 43 ARG H 1 43 ARG HB3 . . 3.880 3.311 2.515 3.921 0.041 18 0 "[ . 1 . 2]" 1 801 1 43 ARG H 1 43 ARG HD2 . . 5.120 4.830 3.918 5.202 0.082 1 0 "[ . 1 . 2]" 1 802 1 43 ARG H 1 43 ARG HG3 . . 5.070 4.369 3.064 4.754 . 0 0 "[ . 1 . 2]" 1 803 1 43 ARG H 1 44 VAL H . . 4.240 4.288 4.253 4.324 0.084 11 0 "[ . 1 . 2]" 1 804 1 43 ARG H 1 50 ILE MG . . 5.260 5.153 4.908 5.278 0.018 7 0 "[ . 1 . 2]" 1 805 1 43 ARG H 1 51 GLN H . . 4.910 3.089 2.800 3.307 . 0 0 "[ . 1 . 2]" 1 806 1 43 ARG HB3 1 43 ARG HD2 . . 3.620 3.260 2.359 3.721 0.101 9 0 "[ . 1 . 2]" 1 807 1 43 ARG HB3 1 51 GLN H . . 4.040 3.289 1.916 4.061 0.021 12 0 "[ . 1 . 2]" 1 808 1 43 ARG HG3 1 51 GLN H . . 4.350 4.348 3.961 4.410 0.060 8 0 "[ . 1 . 2]" 1 809 1 44 VAL H 1 44 VAL HB . . 3.400 3.358 3.184 3.428 0.028 12 0 "[ . 1 . 2]" 1 810 1 44 VAL H 1 44 VAL MG2 . . 4.200 4.005 3.953 4.065 . 0 0 "[ . 1 . 2]" 1 811 1 44 VAL H 1 45 ILE H . . 4.570 4.339 4.250 4.428 . 0 0 "[ . 1 . 2]" 1 812 1 44 VAL H 1 150 VAL HA . . 4.180 3.376 2.899 4.186 0.006 12 0 "[ . 1 . 2]" 1 813 1 44 VAL H 1 151 PRO QD . . 4.700 3.422 2.846 3.885 . 0 0 "[ . 1 . 2]" 1 814 1 44 VAL HA 1 45 ILE H . . 3.310 2.208 2.133 2.298 . 0 0 "[ . 1 . 2]" 1 815 1 44 VAL HA 1 50 ILE HA . . 4.390 2.876 2.531 3.459 . 0 0 "[ . 1 . 2]" 1 816 1 44 VAL HA 1 50 ILE HB . . 5.290 4.108 3.809 4.458 . 0 0 "[ . 1 . 2]" 1 817 1 44 VAL HA 1 50 ILE MG . . 4.030 2.337 2.099 2.807 . 0 0 "[ . 1 . 2]" 1 818 1 44 VAL HA 1 51 GLN H . . 5.260 4.150 3.681 4.685 . 0 0 "[ . 1 . 2]" 1 819 1 44 VAL MG2 1 45 ILE H . . 3.870 2.487 2.254 2.608 . 0 0 "[ . 1 . 2]" 1 820 1 44 VAL MG2 1 45 ILE MG . . 5.030 4.961 4.767 5.040 0.010 8 0 "[ . 1 . 2]" 1 821 1 44 VAL MG2 1 50 ILE HA . . 5.500 4.154 3.537 4.717 . 0 0 "[ . 1 . 2]" 1 822 1 45 ILE H 1 45 ILE HB . . 3.790 2.688 2.630 2.763 . 0 0 "[ . 1 . 2]" 1 823 1 45 ILE H 1 45 ILE MG . . 4.260 3.843 3.803 3.899 . 0 0 "[ . 1 . 2]" 1 824 1 45 ILE H 1 46 ASN H . . 4.190 4.230 4.214 4.240 0.050 9 0 "[ . 1 . 2]" 1 825 1 45 ILE H 1 48 PHE HB3 . . 4.360 4.102 3.785 4.365 0.005 10 0 "[ . 1 . 2]" 1 826 1 45 ILE H 1 50 ILE HA . . 4.680 4.221 3.976 4.540 . 0 0 "[ . 1 . 2]" 1 827 1 45 ILE HA 1 45 ILE MD . . 4.290 3.782 3.495 3.894 . 0 0 "[ . 1 . 2]" 1 828 1 45 ILE HA 1 45 ILE QG . . 3.440 2.377 2.304 2.484 . 0 0 "[ . 1 . 2]" 1 829 1 45 ILE HA 1 45 ILE MG . . 3.540 2.539 2.424 2.638 . 0 0 "[ . 1 . 2]" 1 830 1 45 ILE HA 1 46 ASN H . . 2.880 2.168 2.138 2.206 . 0 0 "[ . 1 . 2]" 1 831 1 45 ILE HA 1 48 PHE HB3 . . 4.700 4.630 4.516 4.703 0.003 8 0 "[ . 1 . 2]" 1 832 1 45 ILE HB 1 46 ASN H . . 4.580 4.308 4.241 4.355 . 0 0 "[ . 1 . 2]" 1 833 1 45 ILE HB 1 48 PHE H . . 4.530 4.266 3.888 4.475 . 0 0 "[ . 1 . 2]" 1 834 1 45 ILE HB 1 48 PHE HA . . 5.210 5.074 4.774 5.185 . 0 0 "[ . 1 . 2]" 1 835 1 45 ILE HB 1 48 PHE HB3 . . 3.580 2.242 2.126 2.322 . 0 0 "[ . 1 . 2]" 1 836 1 45 ILE HB 1 48 PHE QD . . 3.730 2.477 2.254 2.677 . 0 0 "[ . 1 . 2]" 1 837 1 45 ILE HB 1 49 MET H . . 4.800 4.100 3.761 4.252 . 0 0 "[ . 1 . 2]" 1 838 1 45 ILE MD 1 45 ILE MG . . 3.560 2.352 2.079 3.131 . 0 0 "[ . 1 . 2]" 1 839 1 45 ILE MD 1 48 PHE HB3 . . 4.190 3.713 3.590 3.858 . 0 0 "[ . 1 . 2]" 1 840 1 45 ILE MD 1 48 PHE QD . . 3.750 2.312 2.196 2.609 . 0 0 "[ . 1 . 2]" 1 841 1 45 ILE MD 1 48 PHE QE . . 3.380 3.105 2.868 3.386 0.006 3 0 "[ . 1 . 2]" 1 842 1 45 ILE QG 1 46 ASN H . . 4.570 4.074 3.931 4.311 . 0 0 "[ . 1 . 2]" 1 843 1 45 ILE QG 1 48 PHE HB3 . . 4.710 4.226 3.849 4.354 . 0 0 "[ . 1 . 2]" 1 844 1 45 ILE MG 1 46 ASN H . . 3.960 2.763 2.684 2.836 . 0 0 "[ . 1 . 2]" 1 845 1 45 ILE MG 1 46 ASN HA . . 4.330 4.157 4.082 4.216 . 0 0 "[ . 1 . 2]" 1 846 1 45 ILE MG 1 46 ASN QD . . 4.920 3.839 3.171 4.442 . 0 0 "[ . 1 . 2]" 1 847 1 45 ILE MG 1 48 PHE H . . 3.940 3.398 3.316 3.537 . 0 0 "[ . 1 . 2]" 1 848 1 45 ILE MG 1 48 PHE HA . . 4.430 4.469 4.459 4.481 0.051 16 0 "[ . 1 . 2]" 1 849 1 45 ILE MG 1 48 PHE HB3 . . 3.560 2.141 2.087 2.183 . 0 0 "[ . 1 . 2]" 1 850 1 45 ILE MG 1 48 PHE QD . . 3.770 2.396 2.290 2.560 . 0 0 "[ . 1 . 2]" 1 851 1 45 ILE MG 1 49 MET H . . 4.860 4.604 4.516 4.670 . 0 0 "[ . 1 . 2]" 1 852 1 46 ASN H 1 46 ASN HB2 . . 3.600 3.522 2.622 3.632 0.032 6 0 "[ . 1 . 2]" 1 853 1 46 ASN H 1 46 ASN QD . . 3.650 2.887 2.211 3.672 0.022 16 0 "[ . 1 . 2]" 1 854 1 46 ASN H 1 47 GLY H . . 4.730 4.662 4.635 4.679 . 0 0 "[ . 1 . 2]" 1 855 1 46 ASN H 1 48 PHE H . . 5.200 4.666 4.615 4.735 . 0 0 "[ . 1 . 2]" 1 856 1 46 ASN HA 1 46 ASN QD . . 3.890 3.918 3.812 3.934 0.044 17 0 "[ . 1 . 2]" 1 857 1 46 ASN HA 1 47 GLY H . . 3.450 2.205 2.165 2.245 . 0 0 "[ . 1 . 2]" 1 858 1 46 ASN HA 1 47 GLY HA2 . . 4.630 4.431 4.408 4.464 . 0 0 "[ . 1 . 2]" 1 859 1 46 ASN HA 1 48 PHE H . . 3.590 3.352 3.276 3.464 . 0 0 "[ . 1 . 2]" 1 860 1 46 ASN HB2 1 47 GLY H . . 3.990 3.216 3.015 3.993 0.003 7 0 "[ . 1 . 2]" 1 861 1 46 ASN HB2 1 47 GLY HA2 . . 5.480 4.996 4.856 5.528 0.048 7 0 "[ . 1 . 2]" 1 862 1 47 GLY H 1 48 PHE H . . 3.530 2.730 2.676 2.775 . 0 0 "[ . 1 . 2]" 1 863 1 47 GLY H 1 103 VAL MG2 . . 5.500 5.395 4.943 5.510 0.010 6 0 "[ . 1 . 2]" 1 864 1 47 GLY HA2 1 103 VAL MG2 . . 4.360 4.230 3.820 4.366 0.006 4 0 "[ . 1 . 2]" 1 865 1 48 PHE H 1 48 PHE HB3 . . 3.240 2.875 2.825 2.910 . 0 0 "[ . 1 . 2]" 1 866 1 48 PHE H 1 103 VAL MG2 . . 4.090 3.981 3.811 4.095 0.005 7 0 "[ . 1 . 2]" 1 867 1 48 PHE HA 1 48 PHE QD . . 3.220 2.194 2.158 2.306 . 0 0 "[ . 1 . 2]" 1 868 1 48 PHE HA 1 103 VAL MG2 . . 3.540 2.277 2.089 2.527 . 0 0 "[ . 1 . 2]" 1 869 1 48 PHE HA 1 105 ASN QD . . 3.800 3.690 3.365 3.825 0.025 18 0 "[ . 1 . 2]" 1 870 1 48 PHE HB3 1 49 MET H . . 3.410 2.963 2.888 3.099 . 0 0 "[ . 1 . 2]" 1 871 1 48 PHE QD 1 49 MET H . . 4.030 2.679 2.596 2.765 . 0 0 "[ . 1 . 2]" 1 872 1 48 PHE QD 1 105 ASN HD21 . . 3.580 2.879 2.275 3.924 0.344 7 0 "[ . 1 . 2]" 1 873 1 48 PHE QD 1 105 ASN HD22 . . 4.070 3.520 2.676 3.950 . 0 0 "[ . 1 . 2]" 1 874 1 48 PHE QE 1 49 MET ME . . 4.080 4.103 4.098 4.109 0.029 11 0 "[ . 1 . 2]" 1 875 1 48 PHE QE 1 49 MET HG2 . . 4.130 3.857 3.745 4.024 . 0 0 "[ . 1 . 2]" 1 876 1 48 PHE QE 1 105 ASN HB2 . . 4.640 3.217 2.435 3.982 . 0 0 "[ . 1 . 2]" 1 877 1 48 PHE QE 1 105 ASN QD . . 4.240 2.479 2.100 3.228 . 0 0 "[ . 1 . 2]" 1 878 1 48 PHE QE 1 107 PHE QE . . 3.010 2.923 2.746 3.030 0.020 3 0 "[ . 1 . 2]" 1 879 1 48 PHE QE 1 108 LEU MD1 . . 3.650 2.430 2.289 2.674 . 0 0 "[ . 1 . 2]" 1 880 1 48 PHE QE 1 108 LEU HG . . 3.650 3.430 3.203 3.670 0.020 8 0 "[ . 1 . 2]" 1 881 1 48 PHE HZ 1 49 MET HG2 . . 5.000 4.400 4.197 4.641 . 0 0 "[ . 1 . 2]" 1 882 1 48 PHE HZ 1 107 PHE HZ . . 4.060 3.683 2.779 4.061 0.001 20 0 "[ . 1 . 2]" 1 883 1 48 PHE HZ 1 108 LEU MD1 . . 4.530 2.955 2.525 3.371 . 0 0 "[ . 1 . 2]" 1 884 1 49 MET H 1 49 MET ME . . 3.910 3.887 3.800 3.927 0.017 3 0 "[ . 1 . 2]" 1 885 1 49 MET H 1 49 MET HG2 . . 4.150 3.509 3.474 3.555 . 0 0 "[ . 1 . 2]" 1 886 1 49 MET H 1 50 ILE H . . 4.830 4.554 4.521 4.593 . 0 0 "[ . 1 . 2]" 1 887 1 49 MET H 1 103 VAL MG2 . . 4.530 3.636 3.466 3.865 . 0 0 "[ . 1 . 2]" 1 888 1 49 MET HA 1 50 ILE H . . 3.430 2.574 2.520 2.622 . 0 0 "[ . 1 . 2]" 1 889 1 49 MET HA 1 50 ILE MG . . 3.780 3.424 3.296 3.513 . 0 0 "[ . 1 . 2]" 1 890 1 49 MET HA 1 101 ASN HA . . 4.300 3.873 3.443 4.139 . 0 0 "[ . 1 . 2]" 1 891 1 49 MET HA 1 102 VAL H . . 3.950 2.698 2.536 2.978 . 0 0 "[ . 1 . 2]" 1 892 1 49 MET HA 1 103 VAL H . . 4.250 4.161 3.991 4.276 0.026 17 0 "[ . 1 . 2]" 1 893 1 49 MET HB2 1 49 MET ME . . 4.250 2.182 2.133 2.213 . 0 0 "[ . 1 . 2]" 1 894 1 49 MET HB2 1 50 ILE H . . 3.350 2.083 2.011 2.170 . 0 0 "[ . 1 . 2]" 1 895 1 49 MET HB2 1 50 ILE HA . . 4.460 4.493 4.477 4.508 0.048 2 0 "[ . 1 . 2]" 1 896 1 49 MET HB2 1 99 PHE QD . . 3.930 3.747 3.689 3.774 . 0 0 "[ . 1 . 2]" 1 897 1 49 MET HB2 1 100 ILE H . . 4.070 3.790 3.658 3.878 . 0 0 "[ . 1 . 2]" 1 898 1 49 MET HB2 1 101 ASN HA . . 4.500 2.576 2.374 2.801 . 0 0 "[ . 1 . 2]" 1 899 1 49 MET HB2 1 103 VAL MG2 . . 4.890 4.816 4.666 4.901 0.011 7 0 "[ . 1 . 2]" 1 900 1 49 MET ME 1 50 ILE QG . . 4.010 4.030 4.019 4.053 0.043 6 0 "[ . 1 . 2]" 1 901 1 49 MET ME 1 50 ILE MG . . 4.950 4.470 4.298 4.581 . 0 0 "[ . 1 . 2]" 1 902 1 49 MET ME 1 101 ASN HA . . 4.040 4.108 4.097 4.117 0.077 11 0 "[ . 1 . 2]" 1 903 1 49 MET HG2 1 50 ILE H . . 4.790 4.316 4.233 4.471 . 0 0 "[ . 1 . 2]" 1 904 1 49 MET HG2 1 99 PHE QD . . 4.220 3.486 3.328 3.616 . 0 0 "[ . 1 . 2]" 1 905 1 49 MET HG2 1 100 ILE H . . 5.220 5.242 5.230 5.250 0.030 2 0 "[ . 1 . 2]" 1 906 1 49 MET HG2 1 101 ASN H . . 5.280 5.245 5.103 5.294 0.014 16 0 "[ . 1 . 2]" 1 907 1 50 ILE H 1 50 ILE MD . . 4.360 3.961 3.892 4.085 . 0 0 "[ . 1 . 2]" 1 908 1 50 ILE H 1 50 ILE QG . . 3.460 2.236 2.151 2.382 . 0 0 "[ . 1 . 2]" 1 909 1 50 ILE H 1 50 ILE MG . . 3.990 2.936 2.843 3.008 . 0 0 "[ . 1 . 2]" 1 910 1 50 ILE H 1 100 ILE H . . 4.080 3.310 3.217 3.366 . 0 0 "[ . 1 . 2]" 1 911 1 50 ILE H 1 100 ILE HB . . 4.510 4.009 3.895 4.142 . 0 0 "[ . 1 . 2]" 1 912 1 50 ILE H 1 101 ASN HA . . 4.570 4.114 3.807 4.513 . 0 0 "[ . 1 . 2]" 1 913 1 50 ILE HA 1 50 ILE MG . . 3.650 2.276 2.238 2.323 . 0 0 "[ . 1 . 2]" 1 914 1 50 ILE HA 1 51 GLN H . . 3.260 2.218 2.188 2.252 . 0 0 "[ . 1 . 2]" 1 915 1 50 ILE HB 1 51 GLN H . . 3.610 2.978 2.789 3.123 . 0 0 "[ . 1 . 2]" 1 916 1 50 ILE MD 1 50 ILE MG . . 3.980 2.139 2.119 2.165 . 0 0 "[ . 1 . 2]" 1 917 1 50 ILE MD 1 100 ILE HB . . 4.610 2.897 2.483 3.437 . 0 0 "[ . 1 . 2]" 1 918 1 50 ILE MD 1 136 ILE MG . . 3.570 2.141 1.996 2.359 . 0 0 "[ . 1 . 2]" 1 919 1 50 ILE MD 1 137 LYS H . . 5.090 4.166 3.623 4.658 . 0 0 "[ . 1 . 2]" 1 920 1 50 ILE QG 1 51 GLN H . . 4.480 4.057 3.911 4.244 . 0 0 "[ . 1 . 2]" 1 921 1 50 ILE QG 1 100 ILE H . . 3.990 2.785 2.569 3.009 . 0 0 "[ . 1 . 2]" 1 922 1 50 ILE QG 1 100 ILE HB . . 3.680 2.494 2.300 2.840 . 0 0 "[ . 1 . 2]" 1 923 1 50 ILE QG 1 100 ILE MG . . 4.220 3.791 3.573 4.119 . 0 0 "[ . 1 . 2]" 1 924 1 50 ILE MG 1 51 GLN H . . 3.870 3.822 3.746 3.891 0.021 8 0 "[ . 1 . 2]" 1 925 1 50 ILE MG 1 136 ILE MG . . 4.080 2.479 2.173 2.939 . 0 0 "[ . 1 . 2]" 1 926 1 50 ILE MG 1 137 LYS H . . 4.660 4.067 3.536 4.382 . 0 0 "[ . 1 . 2]" 1 927 1 50 ILE MG 1 137 LYS HA . . 3.970 3.532 2.642 3.999 0.029 8 0 "[ . 1 . 2]" 1 928 1 50 ILE MG 1 137 LYS HB3 . . 4.000 2.622 2.219 3.061 . 0 0 "[ . 1 . 2]" 1 929 1 51 GLN H 1 51 GLN HB2 . . 3.820 2.909 2.745 3.103 . 0 0 "[ . 1 . 2]" 1 930 1 51 GLN H 1 52 GLY H . . 4.580 4.557 4.518 4.588 0.008 2 0 "[ . 1 . 2]" 1 931 1 51 GLN H 1 99 PHE HA . . 5.500 4.915 4.830 5.011 . 0 0 "[ . 1 . 2]" 1 932 1 51 GLN HA 1 99 PHE HA . . 3.850 2.256 2.155 2.359 . 0 0 "[ . 1 . 2]" 1 933 1 51 GLN HA 1 99 PHE HB3 . . 3.780 2.326 2.217 2.412 . 0 0 "[ . 1 . 2]" 1 934 1 51 GLN HA 1 100 ILE H . . 3.900 3.623 3.517 3.749 . 0 0 "[ . 1 . 2]" 1 935 1 51 GLN HB2 1 52 GLY H . . 4.100 4.101 3.990 4.134 0.034 1 0 "[ . 1 . 2]" 1 936 1 51 GLN HB2 1 99 PHE HA . . 4.950 4.391 3.974 4.649 . 0 0 "[ . 1 . 2]" 1 937 1 51 GLN HB2 1 99 PHE HB3 . . 3.630 2.859 2.382 3.144 . 0 0 "[ . 1 . 2]" 1 938 1 51 GLN HB2 1 100 ILE H . . 5.500 5.312 4.850 5.510 0.010 4 0 "[ . 1 . 2]" 1 939 1 51 GLN HG2 1 52 GLY H . . 3.990 2.505 2.323 2.817 . 0 0 "[ . 1 . 2]" 1 940 1 51 GLN HG2 1 98 PHE H . . 4.450 4.080 3.640 4.463 0.013 16 0 "[ . 1 . 2]" 1 941 1 51 GLN HG2 1 99 PHE HB3 . . 4.480 3.820 3.029 4.113 . 0 0 "[ . 1 . 2]" 1 942 1 52 GLY H 1 53 GLY H . . 4.590 4.424 4.396 4.443 . 0 0 "[ . 1 . 2]" 1 943 1 52 GLY H 1 98 PHE H . . 4.240 3.356 3.214 3.559 . 0 0 "[ . 1 . 2]" 1 944 1 52 GLY H 1 99 PHE HA . . 4.020 3.121 2.930 3.315 . 0 0 "[ . 1 . 2]" 1 945 1 52 GLY H 1 99 PHE HB3 . . 3.990 3.760 3.536 3.931 . 0 0 "[ . 1 . 2]" 1 946 1 52 GLY H 1 100 ILE H . . 5.500 5.146 4.970 5.348 . 0 0 "[ . 1 . 2]" 1 947 1 53 GLY H 1 54 GLY H . . 4.590 2.799 2.702 2.935 . 0 0 "[ . 1 . 2]" 1 948 1 53 GLY H 1 54 GLY HA2 . . 5.500 5.400 5.343 5.458 . 0 0 "[ . 1 . 2]" 1 949 1 53 GLY H 1 55 PHE H . . 4.560 4.033 3.855 4.196 . 0 0 "[ . 1 . 2]" 1 950 1 53 GLY HA2 1 98 PHE QE . . 4.330 3.420 3.160 3.665 . 0 0 "[ . 1 . 2]" 1 951 1 54 GLY H 1 55 PHE H . . 3.410 2.641 2.478 2.812 . 0 0 "[ . 1 . 2]" 1 952 1 54 GLY H 1 55 PHE QD . . 4.540 4.085 3.741 4.337 . 0 0 "[ . 1 . 2]" 1 953 1 55 PHE H 1 55 PHE QD . . 4.140 3.273 3.021 3.506 . 0 0 "[ . 1 . 2]" 1 954 1 55 PHE HA 1 55 PHE QD . . 3.920 2.828 2.652 2.952 . 0 0 "[ . 1 . 2]" 1 955 1 55 PHE HA 1 55 PHE QE . . 4.510 4.484 4.362 4.528 0.018 10 0 "[ . 1 . 2]" 1 956 1 55 PHE HA 1 56 GLU H . . 3.260 2.306 2.205 2.382 . 0 0 "[ . 1 . 2]" 1 957 1 55 PHE HA 1 60 LYS H . . 5.390 4.871 4.553 5.247 . 0 0 "[ . 1 . 2]" 1 958 1 55 PHE HA 1 61 GLN HA . . 3.750 3.372 3.000 3.661 . 0 0 "[ . 1 . 2]" 1 959 1 55 PHE HA 1 62 LYS H . . 3.390 3.143 2.994 3.273 . 0 0 "[ . 1 . 2]" 1 960 1 55 PHE HA 1 62 LYS HG3 . . 4.460 3.636 2.516 4.471 0.011 4 0 "[ . 1 . 2]" 1 961 1 55 PHE HB3 1 56 GLU H . . 3.490 2.346 2.231 2.560 . 0 0 "[ . 1 . 2]" 1 962 1 55 PHE HB3 1 56 GLU HB2 . . 4.470 4.480 4.390 4.526 0.056 10 0 "[ . 1 . 2]" 1 963 1 55 PHE HB3 1 58 GLY H . . 5.500 5.508 5.446 5.545 0.045 13 0 "[ . 1 . 2]" 1 964 1 55 PHE HB3 1 59 MET H . . 4.630 3.945 3.682 4.150 . 0 0 "[ . 1 . 2]" 1 965 1 55 PHE HB3 1 59 MET HA . . 3.890 2.749 2.402 3.086 . 0 0 "[ . 1 . 2]" 1 966 1 55 PHE HB3 1 59 MET ME . . 4.330 3.200 2.506 3.977 . 0 0 "[ . 1 . 2]" 1 967 1 55 PHE HB3 1 60 LYS H . . 3.930 3.535 3.256 3.838 . 0 0 "[ . 1 . 2]" 1 968 1 55 PHE HB3 1 61 GLN HA . . 4.710 4.440 4.300 4.558 . 0 0 "[ . 1 . 2]" 1 969 1 55 PHE HB3 1 62 LYS H . . 5.120 5.140 5.054 5.156 0.036 5 0 "[ . 1 . 2]" 1 970 1 55 PHE QD 1 56 GLU H . . 4.240 3.425 3.224 3.622 . 0 0 "[ . 1 . 2]" 1 971 1 55 PHE QD 1 59 MET HA . . 3.730 3.552 3.372 3.571 . 0 0 "[ . 1 . 2]" 1 972 1 55 PHE QD 1 60 LYS H . . 4.100 3.898 3.828 3.917 . 0 0 "[ . 1 . 2]" 1 973 1 55 PHE QD 1 61 GLN H . . 4.390 3.642 3.425 3.810 . 0 0 "[ . 1 . 2]" 1 974 1 55 PHE QD 1 61 GLN HA . . 3.910 2.445 2.250 2.679 . 0 0 "[ . 1 . 2]" 1 975 1 55 PHE QD 1 61 GLN HB2 . . 3.920 3.652 3.421 3.745 . 0 0 "[ . 1 . 2]" 1 976 1 55 PHE QE 1 61 GLN H . . 4.090 3.988 3.804 4.097 0.007 13 0 "[ . 1 . 2]" 1 977 1 55 PHE QE 1 61 GLN HA . . 3.830 2.733 2.563 2.973 . 0 0 "[ . 1 . 2]" 1 978 1 55 PHE QE 1 61 GLN HB2 . . 3.090 2.376 2.248 2.660 . 0 0 "[ . 1 . 2]" 1 979 1 55 PHE QE 1 61 GLN HG2 . . 4.280 4.084 3.593 4.278 . 0 0 "[ . 1 . 2]" 1 980 1 55 PHE QE 1 62 LYS H . . 4.320 4.364 4.350 4.380 0.060 9 0 "[ . 1 . 2]" 1 981 1 55 PHE QE 1 147 HIS HE1 . . 3.480 3.330 2.580 3.496 0.016 10 0 "[ . 1 . 2]" 1 982 1 55 PHE HZ 1 61 GLN HB2 . . 5.000 4.570 4.301 4.940 . 0 0 "[ . 1 . 2]" 1 983 1 55 PHE HZ 1 147 HIS HE1 . . 3.830 3.150 2.660 3.835 0.005 5 0 "[ . 1 . 2]" 1 984 1 56 GLU H 1 56 GLU HB2 . . 3.270 2.410 2.303 2.475 . 0 0 "[ . 1 . 2]" 1 985 1 56 GLU H 1 56 GLU HG2 . . 4.430 3.594 2.711 4.100 . 0 0 "[ . 1 . 2]" 1 986 1 56 GLU H 1 59 MET H . . 4.520 4.350 4.220 4.553 0.033 13 0 "[ . 1 . 2]" 1 987 1 56 GLU H 1 59 MET HA . . 4.560 4.127 3.982 4.277 . 0 0 "[ . 1 . 2]" 1 988 1 56 GLU H 1 59 MET ME . . 4.770 4.763 4.661 4.789 0.019 3 0 "[ . 1 . 2]" 1 989 1 56 GLU H 1 60 LYS H . . 3.720 3.082 2.869 3.293 . 0 0 "[ . 1 . 2]" 1 990 1 56 GLU H 1 60 LYS HA . . 5.150 4.920 4.735 5.117 . 0 0 "[ . 1 . 2]" 1 991 1 56 GLU H 1 60 LYS HB3 . . 5.020 4.803 4.393 4.983 . 0 0 "[ . 1 . 2]" 1 992 1 56 GLU H 1 61 GLN HA . . 4.560 4.359 4.150 4.582 0.022 11 0 "[ . 1 . 2]" 1 993 1 56 GLU H 1 62 LYS H . . 4.480 4.464 4.327 4.515 0.035 10 0 "[ . 1 . 2]" 1 994 1 56 GLU HA 1 56 GLU HG2 . . 3.580 2.548 2.345 2.976 . 0 0 "[ . 1 . 2]" 1 995 1 56 GLU HA 1 57 PRO QD . . 3.350 2.106 2.051 2.324 . 0 0 "[ . 1 . 2]" 1 996 1 56 GLU HA 1 59 MET H . . 5.500 5.225 5.087 5.519 0.019 13 0 "[ . 1 . 2]" 1 997 1 56 GLU HA 1 60 LYS H . . 5.500 5.032 4.901 5.155 . 0 0 "[ . 1 . 2]" 1 998 1 57 PRO HA 1 58 GLY H . . 3.360 3.321 2.016 3.399 0.039 10 0 "[ . 1 . 2]" 1 999 1 57 PRO HA 1 58 GLY HA2 . . 4.540 4.575 4.348 4.600 0.060 1 0 "[ . 1 . 2]" 1 1000 1 57 PRO HA 1 59 MET H . . 4.060 3.427 3.195 3.556 . 0 0 "[ . 1 . 2]" 1 1001 1 57 PRO HB2 1 58 GLY HA2 . . 4.890 4.532 4.430 4.894 0.004 13 0 "[ . 1 . 2]" 1 1002 1 57 PRO QD 1 60 LYS H . . 5.350 5.239 5.133 5.341 . 0 0 "[ . 1 . 2]" 1 1003 1 57 PRO QG 1 58 GLY H . . 4.560 4.289 3.091 4.599 0.039 13 0 "[ . 1 . 2]" 1 1004 1 57 PRO QG 1 156 ILE MD . . 4.890 2.528 2.131 3.289 . 0 0 "[ . 1 . 2]" 1 1005 1 58 GLY H 1 59 MET H . . 3.320 2.636 2.182 2.723 . 0 0 "[ . 1 . 2]" 1 1006 1 58 GLY H 1 59 MET HA . . 4.680 4.653 4.348 4.697 0.017 5 0 "[ . 1 . 2]" 1 1007 1 58 GLY H 1 60 LYS H . . 4.130 3.378 3.139 4.150 0.020 13 0 "[ . 1 . 2]" 1 1008 1 58 GLY HA2 1 59 MET HA . . 5.030 5.021 4.942 5.057 0.027 16 0 "[ . 1 . 2]" 1 1009 1 58 GLY HA2 1 59 MET HB2 . . 4.740 4.618 4.327 4.747 0.007 5 0 "[ . 1 . 2]" 1 1010 1 58 GLY HA2 1 59 MET HG2 . . 3.730 3.746 3.685 3.772 0.042 18 0 "[ . 1 . 2]" 1 1011 1 59 MET H 1 59 MET HB2 . . 3.760 3.702 3.601 3.758 . 0 0 "[ . 1 . 2]" 1 1012 1 59 MET H 1 59 MET HG2 . . 3.690 2.938 2.607 3.220 . 0 0 "[ . 1 . 2]" 1 1013 1 59 MET H 1 60 LYS H . . 3.280 2.619 2.490 2.653 . 0 0 "[ . 1 . 2]" 1 1014 1 59 MET H 1 60 LYS HA . . 5.290 5.295 5.166 5.321 0.031 6 0 "[ . 1 . 2]" 1 1015 1 59 MET H 1 60 LYS HG3 . . 5.120 4.374 4.167 4.528 . 0 0 "[ . 1 . 2]" 1 1016 1 59 MET HA 1 59 MET HG2 . . 3.480 3.158 2.761 3.342 . 0 0 "[ . 1 . 2]" 1 1017 1 59 MET HA 1 60 LYS H . . 3.300 2.765 2.609 2.896 . 0 0 "[ . 1 . 2]" 1 1018 1 59 MET HA 1 60 LYS HG3 . . 5.410 5.024 4.856 5.110 . 0 0 "[ . 1 . 2]" 1 1019 1 59 MET HB2 1 60 LYS H . . 4.390 4.279 4.204 4.354 . 0 0 "[ . 1 . 2]" 1 1020 1 59 MET ME 1 60 LYS H . . 4.350 4.259 4.085 4.376 0.026 12 0 "[ . 1 . 2]" 1 1021 1 60 LYS H 1 60 LYS HB3 . . 3.670 3.657 3.622 3.684 0.014 3 0 "[ . 1 . 2]" 1 1022 1 60 LYS H 1 60 LYS HG3 . . 3.770 2.741 2.583 2.964 . 0 0 "[ . 1 . 2]" 1 1023 1 60 LYS H 1 61 GLN H . . 4.410 4.444 4.431 4.455 0.045 16 0 "[ . 1 . 2]" 1 1024 1 60 LYS HA 1 60 LYS HG3 . . 4.010 2.957 2.892 2.999 . 0 0 "[ . 1 . 2]" 1 1025 1 60 LYS HA 1 61 GLN H . . 3.020 2.083 2.058 2.112 . 0 0 "[ . 1 . 2]" 1 1026 1 60 LYS HA 1 61 GLN HB2 . . 4.790 4.342 4.269 4.519 . 0 0 "[ . 1 . 2]" 1 1027 1 60 LYS HB3 1 61 GLN H . . 3.910 3.280 3.153 3.536 . 0 0 "[ . 1 . 2]" 1 1028 1 60 LYS HB3 1 61 GLN HA . . 5.110 5.040 4.954 5.118 0.008 13 0 "[ . 1 . 2]" 1 1029 1 60 LYS HE2 1 60 LYS HG3 . . 3.990 3.212 2.492 3.866 . 0 0 "[ . 1 . 2]" 1 1030 1 60 LYS HG3 1 61 GLN H . . 4.930 4.944 4.932 4.959 0.029 10 0 "[ . 1 . 2]" 1 1031 1 61 GLN H 1 61 GLN HB2 . . 3.890 2.510 2.433 2.573 . 0 0 "[ . 1 . 2]" 1 1032 1 61 GLN H 1 61 GLN HG2 . . 4.480 4.493 4.485 4.505 0.025 9 0 "[ . 1 . 2]" 1 1033 1 61 GLN H 1 62 LYS H . . 4.510 4.441 4.300 4.528 0.018 4 0 "[ . 1 . 2]" 1 1034 1 61 GLN HA 1 61 GLN QE . . 4.580 4.438 4.148 4.619 0.039 6 0 "[ . 1 . 2]" 1 1035 1 61 GLN HA 1 61 GLN HG2 . . 3.630 2.897 2.445 3.073 . 0 0 "[ . 1 . 2]" 1 1036 1 61 GLN HA 1 62 LYS H . . 2.900 1.970 1.771 2.123 . 0 0 "[ . 1 . 2]" 1 1037 1 61 GLN HA 1 62 LYS HB3 . . 4.880 4.958 4.865 5.083 0.203 9 0 "[ . 1 . 2]" 1 1038 1 61 GLN HA 1 62 LYS HG3 . . 4.270 4.194 4.035 4.324 0.054 20 0 "[ . 1 . 2]" 1 1039 1 61 GLN HG2 1 62 LYS H . . 3.360 3.061 2.571 3.363 0.003 12 0 "[ . 1 . 2]" 1 1040 1 61 GLN HG2 1 62 LYS HA . . 4.830 4.614 4.475 4.717 . 0 0 "[ . 1 . 2]" 1 1041 1 62 LYS H 1 62 LYS HB3 . . 3.760 3.104 2.897 3.306 . 0 0 "[ . 1 . 2]" 1 1042 1 62 LYS H 1 62 LYS HD3 . . 4.820 4.616 4.454 4.853 0.033 18 0 "[ . 1 . 2]" 1 1043 1 62 LYS H 1 62 LYS HE2 . . 4.930 4.936 4.834 4.965 0.035 6 0 "[ . 1 . 2]" 1 1044 1 62 LYS H 1 62 LYS HG3 . . 3.120 2.555 2.263 3.049 . 0 0 "[ . 1 . 2]" 1 1045 1 62 LYS H 1 63 ALA H . . 4.870 4.539 4.345 4.665 . 0 0 "[ . 1 . 2]" 1 1046 1 62 LYS HA 1 62 LYS HE2 . . 4.630 3.905 2.746 4.601 . 0 0 "[ . 1 . 2]" 1 1047 1 62 LYS HA 1 62 LYS HG3 . . 3.840 3.674 3.535 3.745 . 0 0 "[ . 1 . 2]" 1 1048 1 62 LYS HA 1 63 ALA H . . 2.820 2.350 2.291 2.410 . 0 0 "[ . 1 . 2]" 1 1049 1 62 LYS HA 1 63 ALA MB . . 4.320 3.874 3.751 3.991 . 0 0 "[ . 1 . 2]" 1 1050 1 62 LYS HA 1 64 THR H . . 5.290 4.897 4.603 5.150 . 0 0 "[ . 1 . 2]" 1 1051 1 62 LYS HB3 1 62 LYS HD3 . . 3.880 3.177 2.532 3.555 . 0 0 "[ . 1 . 2]" 1 1052 1 62 LYS HB3 1 62 LYS HE2 . . 3.190 2.498 2.365 2.618 . 0 0 "[ . 1 . 2]" 1 1053 1 62 LYS HB3 1 63 ALA H . . 3.930 2.946 2.049 3.568 . 0 0 "[ . 1 . 2]" 1 1054 1 62 LYS HD3 1 63 ALA H . . 4.490 4.300 3.804 4.530 0.040 17 0 "[ . 1 . 2]" 1 1055 1 62 LYS HE2 1 62 LYS HG3 . . 3.780 3.763 3.732 3.796 0.016 20 0 "[ . 1 . 2]" 1 1056 1 62 LYS HE2 1 63 ALA H . . 4.870 3.684 2.089 4.692 . 0 0 "[ . 1 . 2]" 1 1057 1 62 LYS HG3 1 63 ALA H . . 4.280 4.326 4.225 4.438 0.158 9 0 "[ . 1 . 2]" 1 1058 1 63 ALA H 1 63 ALA MB . . 3.100 2.272 2.226 2.337 . 0 0 "[ . 1 . 2]" 1 1059 1 63 ALA H 1 64 THR H . . 3.990 3.746 3.437 3.955 . 0 0 "[ . 1 . 2]" 1 1060 1 63 ALA HA 1 64 THR H . . 2.710 2.455 2.371 2.656 . 0 0 "[ . 1 . 2]" 1 1061 1 63 ALA MB 1 64 THR H . . 3.750 3.752 3.732 3.772 0.022 19 0 "[ . 1 . 2]" 1 1062 1 64 THR H 1 64 THR MG . . 3.700 2.445 2.308 2.602 . 0 0 "[ . 1 . 2]" 1 1063 1 64 THR H 1 65 LYS H . . 4.540 4.482 4.209 4.579 0.039 14 0 "[ . 1 . 2]" 1 1064 1 64 THR HA 1 65 LYS H . . 3.000 2.105 2.071 2.154 . 0 0 "[ . 1 . 2]" 1 1065 1 64 THR MG 1 65 LYS H . . 3.960 3.861 3.700 3.984 0.024 7 0 "[ . 1 . 2]" 1 1066 1 64 THR MG 1 96 ALA MB . . 3.990 2.285 2.077 2.478 . 0 0 "[ . 1 . 2]" 1 1067 1 65 LYS H 1 65 LYS HG3 . . 3.650 3.149 2.825 3.304 . 0 0 "[ . 1 . 2]" 1 1068 1 65 LYS H 1 95 THR HB . . 3.900 3.185 2.504 3.824 . 0 0 "[ . 1 . 2]" 1 1069 1 65 LYS H 1 96 ALA MB . . 4.830 3.691 3.328 4.219 . 0 0 "[ . 1 . 2]" 1 1070 1 65 LYS HA 1 65 LYS HB3 . . 2.940 2.463 2.399 2.523 . 0 0 "[ . 1 . 2]" 1 1071 1 65 LYS HA 1 65 LYS HD3 . . 4.420 4.436 4.246 4.508 0.088 5 0 "[ . 1 . 2]" 1 1072 1 65 LYS HA 1 65 LYS HG3 . . 3.580 3.217 2.995 3.355 . 0 0 "[ . 1 . 2]" 1 1073 1 65 LYS HA 1 66 GLU H . . 3.410 2.423 2.357 2.521 . 0 0 "[ . 1 . 2]" 1 1074 1 65 LYS HA 1 66 GLU HB2 . . 4.780 4.804 4.787 4.817 0.037 19 0 "[ . 1 . 2]" 1 1075 1 65 LYS HA 1 95 THR MG . . 3.930 3.680 3.374 3.935 0.005 4 0 "[ . 1 . 2]" 1 1076 1 65 LYS HB3 1 65 LYS HD3 . . 3.490 3.287 2.474 3.534 0.044 5 0 "[ . 1 . 2]" 1 1077 1 65 LYS HB3 1 65 LYS HE2 . . 4.200 3.967 3.240 4.311 0.111 11 0 "[ . 1 . 2]" 1 1078 1 65 LYS HB3 1 66 GLU H . . 2.880 2.219 2.090 2.338 . 0 0 "[ . 1 . 2]" 1 1079 1 65 LYS HB3 1 66 GLU HA . . 4.490 4.236 4.167 4.331 . 0 0 "[ . 1 . 2]" 1 1080 1 65 LYS HB3 1 67 PRO HD3 . . 5.010 5.019 4.909 5.036 0.026 5 0 "[ . 1 . 2]" 1 1081 1 65 LYS HE2 1 65 LYS HG3 . . 3.390 2.442 2.156 2.952 . 0 0 "[ . 1 . 2]" 1 1082 1 66 GLU H 1 66 GLU HB2 . . 3.340 3.307 3.195 3.345 0.005 17 0 "[ . 1 . 2]" 1 1083 1 66 GLU H 1 66 GLU HG2 . . 3.610 2.939 2.322 3.229 . 0 0 "[ . 1 . 2]" 1 1084 1 66 GLU H 1 67 PRO HD2 . . 3.410 3.082 2.840 3.434 0.024 9 0 "[ . 1 . 2]" 1 1085 1 66 GLU HA 1 66 GLU HG2 . . 3.250 2.354 2.226 2.529 . 0 0 "[ . 1 . 2]" 1 1086 1 66 GLU HA 1 67 PRO HD2 . . 2.750 2.116 2.059 2.238 . 0 0 "[ . 1 . 2]" 1 1087 1 66 GLU HG2 1 67 PRO HD2 . . 4.190 4.222 4.205 4.243 0.053 10 0 "[ . 1 . 2]" 1 1088 1 67 PRO HA 1 68 ILE H . . 3.190 2.165 2.128 2.226 . 0 0 "[ . 1 . 2]" 1 1089 1 67 PRO HA 1 68 ILE HA . . 4.600 4.443 4.384 4.494 . 0 0 "[ . 1 . 2]" 1 1090 1 67 PRO HA 1 68 ILE QG . . 3.800 3.240 3.044 3.429 . 0 0 "[ . 1 . 2]" 1 1091 1 67 PRO HA 1 95 THR MG . . 3.620 2.333 2.153 2.431 . 0 0 "[ . 1 . 2]" 1 1092 1 67 PRO HB2 1 68 ILE H . . 3.610 3.359 3.056 3.635 0.025 9 0 "[ . 1 . 2]" 1 1093 1 67 PRO HB2 1 94 ALA H . . 5.500 4.224 3.804 4.895 . 0 0 "[ . 1 . 2]" 1 1094 1 67 PRO HG2 1 95 THR MG . . 4.910 4.362 3.776 4.629 . 0 0 "[ . 1 . 2]" 1 1095 1 68 ILE H 1 68 ILE HB . . 3.820 2.848 2.727 3.084 . 0 0 "[ . 1 . 2]" 1 1096 1 68 ILE H 1 68 ILE MD . . 5.090 3.470 3.259 3.928 . 0 0 "[ . 1 . 2]" 1 1097 1 68 ILE H 1 68 ILE QG . . 3.110 2.246 2.094 2.361 . 0 0 "[ . 1 . 2]" 1 1098 1 68 ILE H 1 68 ILE MG . . 3.940 3.888 3.842 3.948 0.008 4 0 "[ . 1 . 2]" 1 1099 1 68 ILE H 1 69 LYS H . . 4.590 4.517 4.448 4.579 . 0 0 "[ . 1 . 2]" 1 1100 1 68 ILE H 1 69 LYS HA . . 5.090 5.114 4.925 5.146 0.056 11 0 "[ . 1 . 2]" 1 1101 1 68 ILE H 1 94 ALA H . . 4.380 3.150 2.720 3.410 . 0 0 "[ . 1 . 2]" 1 1102 1 68 ILE H 1 94 ALA MB . . 4.410 3.352 3.063 3.772 . 0 0 "[ . 1 . 2]" 1 1103 1 68 ILE H 1 95 THR H . . 4.670 4.548 4.042 4.710 0.040 12 0 "[ . 1 . 2]" 1 1104 1 68 ILE H 1 95 THR MG . . 4.090 3.980 3.678 4.096 0.006 15 0 "[ . 1 . 2]" 1 1105 1 68 ILE HA 1 68 ILE MD . . 4.220 4.102 4.071 4.130 . 0 0 "[ . 1 . 2]" 1 1106 1 68 ILE HA 1 68 ILE QG . . 3.600 2.884 2.834 2.978 . 0 0 "[ . 1 . 2]" 1 1107 1 68 ILE HA 1 68 ILE MG . . 3.470 2.255 2.214 2.335 . 0 0 "[ . 1 . 2]" 1 1108 1 68 ILE HA 1 69 LYS H . . 2.790 2.286 2.172 2.361 . 0 0 "[ . 1 . 2]" 1 1109 1 68 ILE HA 1 69 LYS HA . . 4.510 4.414 4.356 4.459 . 0 0 "[ . 1 . 2]" 1 1110 1 68 ILE HA 1 69 LYS HB3 . . 4.810 4.747 4.620 4.847 0.037 19 0 "[ . 1 . 2]" 1 1111 1 68 ILE HA 1 69 LYS HG3 . . 4.140 3.930 3.639 4.061 . 0 0 "[ . 1 . 2]" 1 1112 1 68 ILE HB 1 69 LYS H . . 3.390 3.429 3.398 3.448 0.058 9 0 "[ . 1 . 2]" 1 1113 1 68 ILE HB 1 69 LYS HA . . 4.550 4.561 4.480 4.593 0.043 13 0 "[ . 1 . 2]" 1 1114 1 68 ILE MD 1 94 ALA MB . . 4.480 2.865 2.447 3.666 . 0 0 "[ . 1 . 2]" 1 1115 1 68 ILE MD 1 123 PHE HB3 . . 5.500 5.448 5.218 5.536 0.036 19 0 "[ . 1 . 2]" 1 1116 1 68 ILE QG 1 94 ALA MB . . 4.280 3.730 2.863 4.075 . 0 0 "[ . 1 . 2]" 1 1117 1 68 ILE MG 1 69 LYS H . . 3.550 2.083 2.006 2.169 . 0 0 "[ . 1 . 2]" 1 1118 1 68 ILE MG 1 69 LYS HA . . 4.550 4.204 4.107 4.362 . 0 0 "[ . 1 . 2]" 1 1119 1 68 ILE MG 1 69 LYS HB3 . . 4.860 4.703 4.616 4.847 . 0 0 "[ . 1 . 2]" 1 1120 1 69 LYS H 1 69 LYS HB3 . . 3.450 3.037 2.911 3.191 . 0 0 "[ . 1 . 2]" 1 1121 1 69 LYS H 1 69 LYS HD3 . . 3.220 3.206 2.759 3.328 0.108 4 0 "[ . 1 . 2]" 1 1122 1 69 LYS H 1 69 LYS HG3 . . 3.540 2.071 1.811 2.302 . 0 0 "[ . 1 . 2]" 1 1123 1 69 LYS H 1 70 ASN H . . 4.550 4.568 4.528 4.586 0.036 18 0 "[ . 1 . 2]" 1 1124 1 69 LYS HA 1 69 LYS HG3 . . 3.810 3.747 3.616 3.790 . 0 0 "[ . 1 . 2]" 1 1125 1 69 LYS HA 1 70 ASN H . . 3.360 2.304 2.211 2.369 . 0 0 "[ . 1 . 2]" 1 1126 1 69 LYS HA 1 70 ASN HB2 . . 4.640 4.181 3.907 4.355 . 0 0 "[ . 1 . 2]" 1 1127 1 69 LYS HA 1 92 HIS HA . . 3.730 2.421 2.207 2.881 . 0 0 "[ . 1 . 2]" 1 1128 1 69 LYS HA 1 92 HIS HB3 . . 3.380 2.365 2.239 2.494 . 0 0 "[ . 1 . 2]" 1 1129 1 69 LYS HA 1 92 HIS HD2 . . 5.410 5.353 5.213 5.427 0.017 1 0 "[ . 1 . 2]" 1 1130 1 69 LYS HA 1 92 HIS HE1 . . 5.470 4.612 4.471 4.797 . 0 0 "[ . 1 . 2]" 1 1131 1 69 LYS HA 1 94 ALA H . . 4.780 4.775 4.606 4.821 0.041 11 0 "[ . 1 . 2]" 1 1132 1 69 LYS HB3 1 70 ASN H . . 3.780 3.655 3.467 3.788 0.008 9 0 "[ . 1 . 2]" 1 1133 1 69 LYS HB3 1 92 HIS HB3 . . 3.820 2.920 2.571 3.157 . 0 0 "[ . 1 . 2]" 1 1134 1 69 LYS HD3 1 70 ASN H . . 4.500 4.078 3.841 4.503 0.003 5 0 "[ . 1 . 2]" 1 1135 1 69 LYS HD3 1 71 GLU HB2 . . 5.380 5.125 4.450 5.410 0.030 4 0 "[ . 1 . 2]" 1 1136 1 69 LYS HD3 1 71 GLU HG2 . . 4.040 2.626 2.396 2.978 . 0 0 "[ . 1 . 2]" 1 1137 1 69 LYS HG3 1 70 ASN H . . 4.980 4.931 4.814 5.022 0.042 2 0 "[ . 1 . 2]" 1 1138 1 69 LYS HG3 1 71 GLU HG2 . . 5.360 5.106 4.651 5.382 0.022 4 0 "[ . 1 . 2]" 1 1139 1 70 ASN H 1 70 ASN HB2 . . 3.780 2.417 2.137 2.566 . 0 0 "[ . 1 . 2]" 1 1140 1 70 ASN H 1 71 GLU H . . 4.800 4.344 3.099 4.643 . 0 0 "[ . 1 . 2]" 1 1141 1 70 ASN H 1 92 HIS HA . . 4.060 3.101 2.943 3.591 . 0 0 "[ . 1 . 2]" 1 1142 1 70 ASN H 1 92 HIS HB3 . . 4.450 3.809 3.634 3.930 . 0 0 "[ . 1 . 2]" 1 1143 1 70 ASN H 1 92 HIS HE1 . . 4.080 2.864 2.777 2.951 . 0 0 "[ . 1 . 2]" 1 1144 1 71 GLU H 1 71 GLU HB2 . . 3.970 2.819 2.464 3.864 . 0 0 "[ . 1 . 2]" 1 1145 1 71 GLU H 1 71 GLU HG2 . . 4.290 3.498 2.777 3.867 . 0 0 "[ . 1 . 2]" 1 1146 1 71 GLU H 1 72 ALA H . . 3.590 2.694 2.410 3.174 . 0 0 "[ . 1 . 2]" 1 1147 1 71 GLU H 1 121 CYS HB2 . . 4.580 2.673 1.935 4.640 0.060 8 0 "[ . 1 . 2]" 1 1148 1 71 GLU HA 1 71 GLU HG2 . . 2.940 2.549 2.324 2.882 . 0 0 "[ . 1 . 2]" 1 1149 1 71 GLU HA 1 73 ASN H . . 3.720 3.362 3.100 3.763 0.043 9 0 "[ . 1 . 2]" 1 1150 1 71 GLU HB2 1 72 ALA H . . 4.290 3.948 2.102 4.218 . 0 0 "[ . 1 . 2]" 1 1151 1 71 GLU HB2 1 121 CYS HG . . 4.470 2.581 1.774 4.030 . 0 0 "[ . 1 . 2]" 1 1152 1 72 ALA H 1 72 ALA MB . . 3.200 2.244 2.166 2.736 . 0 0 "[ . 1 . 2]" 1 1153 1 72 ALA H 1 73 ASN H . . 3.470 2.840 2.672 3.402 . 0 0 "[ . 1 . 2]" 1 1154 1 72 ALA H 1 74 ASN H . . 5.070 4.716 4.482 5.073 0.003 6 0 "[ . 1 . 2]" 1 1155 1 72 ALA H 1 121 CYS HA . . 4.330 3.752 3.060 4.255 . 0 0 "[ . 1 . 2]" 1 1156 1 72 ALA H 1 121 CYS HB2 . . 3.340 2.656 2.437 2.924 . 0 0 "[ . 1 . 2]" 1 1157 1 72 ALA H 1 121 CYS HG . . 4.040 3.364 2.926 4.053 0.013 8 0 "[ . 1 . 2]" 1 1158 1 72 ALA HA 1 74 ASN H . . 3.550 3.266 3.046 3.508 . 0 0 "[ . 1 . 2]" 1 1159 1 72 ALA HA 1 121 CYS HG . . 3.560 3.038 2.275 3.604 0.044 9 0 "[ . 1 . 2]" 1 1160 1 72 ALA MB 1 73 ASN H . . 3.900 3.109 2.932 3.227 . 0 0 "[ . 1 . 2]" 1 1161 1 72 ALA MB 1 110 PHE HA . . 4.140 3.566 3.248 3.763 . 0 0 "[ . 1 . 2]" 1 1162 1 72 ALA MB 1 110 PHE HB3 . . 4.100 3.739 3.548 3.973 . 0 0 "[ . 1 . 2]" 1 1163 1 72 ALA MB 1 121 CYS H . . 4.670 3.639 3.049 4.434 . 0 0 "[ . 1 . 2]" 1 1164 1 72 ALA MB 1 121 CYS HA . . 3.620 2.218 2.044 2.407 . 0 0 "[ . 1 . 2]" 1 1165 1 72 ALA MB 1 121 CYS HB2 . . 3.830 2.763 2.229 3.587 . 0 0 "[ . 1 . 2]" 1 1166 1 73 ASN H 1 73 ASN HB2 . . 3.830 3.232 2.339 3.598 . 0 0 "[ . 1 . 2]" 1 1167 1 73 ASN H 1 73 ASN QD . . 4.550 4.167 3.941 4.556 0.006 6 0 "[ . 1 . 2]" 1 1168 1 73 ASN H 1 74 ASN H . . 3.190 2.987 2.868 3.219 0.029 11 0 "[ . 1 . 2]" 1 1169 1 73 ASN H 1 121 CYS HB2 . . 5.500 5.325 4.802 5.557 0.057 2 0 "[ . 1 . 2]" 1 1170 1 73 ASN HA 1 73 ASN QD . . 4.400 3.924 2.416 4.403 0.003 13 0 "[ . 1 . 2]" 1 1171 1 73 ASN HA 1 74 ASN H . . 3.250 3.173 2.738 3.281 0.031 5 0 "[ . 1 . 2]" 1 1172 1 73 ASN HA 1 74 ASN HA . . 4.670 4.685 4.610 4.717 0.047 18 0 "[ . 1 . 2]" 1 1173 1 73 ASN HA 1 75 GLY H . . 4.030 3.239 2.989 3.616 . 0 0 "[ . 1 . 2]" 1 1174 1 73 ASN HA 1 75 GLY HA2 . . 5.420 4.640 4.439 5.294 . 0 0 "[ . 1 . 2]" 1 1175 1 73 ASN HA 1 110 PHE HB3 . . 4.090 3.969 3.743 4.117 0.027 13 0 "[ . 1 . 2]" 1 1176 1 73 ASN HA 1 110 PHE HZ . . 4.490 3.947 3.498 4.502 0.012 17 0 "[ . 1 . 2]" 1 1177 1 73 ASN HB2 1 110 PHE HZ . . 3.830 3.480 3.208 3.829 . 0 0 "[ . 1 . 2]" 1 1178 1 74 ASN H 1 75 GLY H . . 3.040 2.469 2.178 2.599 . 0 0 "[ . 1 . 2]" 1 1179 1 74 ASN H 1 75 GLY HA2 . . 4.830 4.777 4.508 4.850 0.020 5 0 "[ . 1 . 2]" 1 1180 1 74 ASN H 1 76 LEU H . . 3.870 3.759 3.360 3.921 0.051 18 0 "[ . 1 . 2]" 1 1181 1 74 ASN HB2 1 74 ASN HD22 . . 4.030 3.648 3.503 3.790 . 0 0 "[ . 1 . 2]" 1 1182 1 74 ASN HB2 1 76 LEU QD . . 4.580 3.402 2.628 3.915 . 0 0 "[ . 1 . 2]" 1 1183 1 74 ASN HB2 1 76 LEU HG . . 4.520 3.170 2.338 3.866 . 0 0 "[ . 1 . 2]" 1 1184 1 74 ASN QD 1 76 LEU QD . . 4.070 2.956 2.219 4.081 0.011 4 0 "[ . 1 . 2]" 1 1185 1 75 GLY H 1 76 LEU H . . 3.290 2.495 2.360 2.599 . 0 0 "[ . 1 . 2]" 1 1186 1 75 GLY H 1 76 LEU HG . . 4.590 4.429 3.607 4.625 0.035 6 0 "[ . 1 . 2]" 1 1187 1 75 GLY H 1 110 PHE HB3 . . 5.370 3.907 3.198 4.601 . 0 0 "[ . 1 . 2]" 1 1188 1 75 GLY HA2 1 76 LEU HA . . 4.680 4.700 4.691 4.717 0.037 9 0 "[ . 1 . 2]" 1 1189 1 76 LEU H 1 76 LEU HB3 . . 4.130 3.636 3.540 3.670 . 0 0 "[ . 1 . 2]" 1 1190 1 76 LEU H 1 76 LEU HG . . 4.180 2.591 2.337 2.856 . 0 0 "[ . 1 . 2]" 1 1191 1 76 LEU H 1 77 LYS H . . 4.670 4.632 4.590 4.665 . 0 0 "[ . 1 . 2]" 1 1192 1 76 LEU HA 1 76 LEU HG . . 3.600 3.047 2.797 3.162 . 0 0 "[ . 1 . 2]" 1 1193 1 76 LEU HA 1 77 LYS H . . 3.030 2.276 2.205 2.342 . 0 0 "[ . 1 . 2]" 1 1194 1 76 LEU HA 1 77 LYS HG3 . . 4.360 3.473 3.132 4.359 . 0 0 "[ . 1 . 2]" 1 1195 1 76 LEU HB3 1 77 LYS H . . 3.100 2.567 2.445 3.085 . 0 0 "[ . 1 . 2]" 1 1196 1 76 LEU HB3 1 122 VAL H . . 4.560 4.178 2.703 4.574 0.014 6 0 "[ . 1 . 2]" 1 1197 1 76 LEU HB3 1 122 VAL HB . . 3.680 2.351 2.169 2.451 . 0 0 "[ . 1 . 2]" 1 1198 1 76 LEU QD 1 77 LYS H . . 4.170 3.198 3.036 3.310 . 0 0 "[ . 1 . 2]" 1 1199 1 76 LEU QD 1 122 VAL HB . . 4.200 2.487 2.171 2.792 . 0 0 "[ . 1 . 2]" 1 1200 1 76 LEU HG 1 77 LYS H . . 4.790 4.814 4.707 4.845 0.055 17 0 "[ . 1 . 2]" 1 1201 1 77 LYS H 1 77 LYS HB3 . . 4.010 3.871 3.839 3.917 . 0 0 "[ . 1 . 2]" 1 1202 1 77 LYS H 1 77 LYS HG3 . . 3.720 3.116 2.915 3.735 0.015 10 0 "[ . 1 . 2]" 1 1203 1 77 LYS H 1 78 ASN H . . 4.940 4.458 4.415 4.521 . 0 0 "[ . 1 . 2]" 1 1204 1 77 LYS H 1 122 VAL MG2 . . 4.510 3.345 3.125 3.641 . 0 0 "[ . 1 . 2]" 1 1205 1 77 LYS HA 1 78 ASN H . . 3.390 2.163 2.070 2.271 . 0 0 "[ . 1 . 2]" 1 1206 1 77 LYS HB3 1 78 ASN H . . 3.610 2.424 2.329 2.538 . 0 0 "[ . 1 . 2]" 1 1207 1 77 LYS HB3 1 78 ASN HB2 . . 5.120 4.613 4.472 4.817 . 0 0 "[ . 1 . 2]" 1 1208 1 77 LYS HB3 1 78 ASN QD . . 4.310 4.348 4.337 4.369 0.059 19 0 "[ . 1 . 2]" 1 1209 1 77 LYS HB3 1 79 THR MG . . 3.900 3.066 2.708 3.408 . 0 0 "[ . 1 . 2]" 1 1210 1 77 LYS HB3 1 109 ASN HB2 . . 5.110 5.091 4.861 5.127 0.017 2 0 "[ . 1 . 2]" 1 1211 1 77 LYS HB3 1 109 ASN HD21 . . 4.310 3.432 3.253 3.516 . 0 0 "[ . 1 . 2]" 1 1212 1 77 LYS HB3 1 109 ASN HD22 . . 4.310 2.328 2.206 2.651 . 0 0 "[ . 1 . 2]" 1 1213 1 77 LYS HG3 1 78 ASN H . . 4.690 4.685 4.085 4.763 0.073 7 0 "[ . 1 . 2]" 1 1214 1 77 LYS HG3 1 109 ASN QD . . 5.340 3.993 2.949 4.310 . 0 0 "[ . 1 . 2]" 1 1215 1 78 ASN H 1 78 ASN HB2 . . 3.600 2.375 2.244 2.481 . 0 0 "[ . 1 . 2]" 1 1216 1 78 ASN H 1 78 ASN HD21 . . 4.340 2.332 2.149 2.467 . 0 0 "[ . 1 . 2]" 1 1217 1 78 ASN H 1 78 ASN QD . . 3.600 2.315 2.135 2.447 . 0 0 "[ . 1 . 2]" 1 1218 1 78 ASN H 1 78 ASN HD22 . . 4.340 3.893 3.693 4.043 . 0 0 "[ . 1 . 2]" 1 1219 1 78 ASN H 1 79 THR H . . 4.590 4.103 3.701 4.382 . 0 0 "[ . 1 . 2]" 1 1220 1 78 ASN H 1 106 ASP HA . . 4.750 3.686 3.140 4.447 . 0 0 "[ . 1 . 2]" 1 1221 1 78 ASN H 1 109 ASN H . . 4.830 4.581 4.408 4.815 . 0 0 "[ . 1 . 2]" 1 1222 1 78 ASN H 1 109 ASN HA . . 4.570 4.097 3.924 4.232 . 0 0 "[ . 1 . 2]" 1 1223 1 78 ASN H 1 109 ASN HB2 . . 4.840 4.863 4.821 4.888 0.048 9 0 "[ . 1 . 2]" 1 1224 1 78 ASN H 1 109 ASN HD21 . . 4.280 4.140 4.029 4.265 . 0 0 "[ . 1 . 2]" 1 1225 1 78 ASN H 1 109 ASN QD . . 3.730 2.767 2.560 2.991 . 0 0 "[ . 1 . 2]" 1 1226 1 78 ASN H 1 109 ASN HD22 . . 4.280 2.811 2.589 3.056 . 0 0 "[ . 1 . 2]" 1 1227 1 78 ASN H 1 122 VAL MG2 . . 4.640 3.672 3.311 4.144 . 0 0 "[ . 1 . 2]" 1 1228 1 78 ASN HA 1 79 THR H . . 3.390 2.236 2.130 2.459 . 0 0 "[ . 1 . 2]" 1 1229 1 78 ASN HB2 1 79 THR MG . . 4.780 4.750 4.686 4.798 0.018 10 0 "[ . 1 . 2]" 1 1230 1 78 ASN QD 1 109 ASN H . . 5.300 3.402 3.182 3.795 . 0 0 "[ . 1 . 2]" 1 1231 1 78 ASN QD 1 109 ASN HA . . 3.510 2.386 2.215 2.689 . 0 0 "[ . 1 . 2]" 1 1232 1 78 ASN QD 1 110 PHE H . . 4.730 4.416 4.223 4.734 0.004 17 0 "[ . 1 . 2]" 1 1233 1 78 ASN HD21 1 109 ASN HA . . 4.090 2.500 2.333 2.790 . 0 0 "[ . 1 . 2]" 1 1234 1 78 ASN HD22 1 109 ASN HA . . 4.090 3.021 2.760 3.519 . 0 0 "[ . 1 . 2]" 1 1235 1 79 THR H 1 79 THR MG . . 3.760 2.847 2.497 3.159 . 0 0 "[ . 1 . 2]" 1 1236 1 79 THR H 1 80 ARG H . . 4.880 4.517 4.443 4.632 . 0 0 "[ . 1 . 2]" 1 1237 1 79 THR H 1 82 THR H . . 4.980 4.607 4.233 4.984 0.004 15 0 "[ . 1 . 2]" 1 1238 1 79 THR H 1 82 THR HG1 . . 3.600 2.241 1.942 2.572 . 0 0 "[ . 1 . 2]" 1 1239 1 79 THR H 1 82 THR MG . . 3.810 2.569 2.462 2.725 . 0 0 "[ . 1 . 2]" 1 1240 1 79 THR H 1 101 ASN HB2 . . 4.490 4.123 3.708 4.508 0.018 20 0 "[ . 1 . 2]" 1 1241 1 79 THR H 1 101 ASN HD21 . . 4.640 3.441 3.118 3.839 . 0 0 "[ . 1 . 2]" 1 1242 1 79 THR H 1 101 ASN QD . . 4.030 3.333 3.039 3.670 . 0 0 "[ . 1 . 2]" 1 1243 1 79 THR H 1 101 ASN HD22 . . 4.640 4.483 4.207 4.667 0.027 9 0 "[ . 1 . 2]" 1 1244 1 79 THR H 1 122 VAL MG2 . . 4.990 4.308 3.707 4.990 0.000 2 0 "[ . 1 . 2]" 1 1245 1 79 THR HA 1 79 THR MG . . 3.440 2.403 2.346 2.482 . 0 0 "[ . 1 . 2]" 1 1246 1 79 THR HB 1 80 ARG H . . 3.420 2.328 2.257 2.470 . 0 0 "[ . 1 . 2]" 1 1247 1 79 THR HB 1 104 ASP HB2 . . 5.390 5.176 4.436 5.427 0.037 12 0 "[ . 1 . 2]" 1 1248 1 79 THR HB 1 105 ASN H . . 5.150 5.186 5.168 5.207 0.057 15 0 "[ . 1 . 2]" 1 1249 1 79 THR MG 1 80 ARG H . . 3.970 3.738 3.634 3.869 . 0 0 "[ . 1 . 2]" 1 1250 1 80 ARG H 1 80 ARG HB3 . . 3.740 2.614 2.175 3.630 . 0 0 "[ . 1 . 2]" 1 1251 1 80 ARG H 1 81 GLY H . . 4.390 4.456 4.413 4.481 0.091 15 0 "[ . 1 . 2]" 1 1252 1 80 ARG H 1 104 ASP H . . 4.970 4.106 3.998 4.484 . 0 0 "[ . 1 . 2]" 1 1253 1 80 ARG H 1 104 ASP HA . . 4.010 2.872 2.605 3.110 . 0 0 "[ . 1 . 2]" 1 1254 1 80 ARG H 1 104 ASP HB2 . . 4.780 4.310 3.282 4.699 . 0 0 "[ . 1 . 2]" 1 1255 1 80 ARG H 1 105 ASN H . . 4.750 4.698 4.388 4.782 0.032 13 0 "[ . 1 . 2]" 1 1256 1 80 ARG HA 1 81 GLY H . . 3.310 2.033 2.001 2.080 . 0 0 "[ . 1 . 2]" 1 1257 1 80 ARG HA 1 81 GLY HA2 . . 4.370 4.328 4.313 4.350 . 0 0 "[ . 1 . 2]" 1 1258 1 80 ARG HA 1 82 THR H . . 4.420 3.764 3.560 3.982 . 0 0 "[ . 1 . 2]" 1 1259 1 80 ARG HA 1 101 ASN HB2 . . 4.270 3.964 3.709 4.234 . 0 0 "[ . 1 . 2]" 1 1260 1 80 ARG HA 1 103 VAL H . . 4.040 3.711 3.435 4.054 0.014 18 0 "[ . 1 . 2]" 1 1261 1 80 ARG HA 1 103 VAL HA . . 4.310 3.772 3.539 3.997 . 0 0 "[ . 1 . 2]" 1 1262 1 80 ARG HB3 1 81 GLY H . . 4.610 4.117 3.403 4.464 . 0 0 "[ . 1 . 2]" 1 1263 1 81 GLY H 1 82 THR H . . 3.700 2.509 2.410 2.574 . 0 0 "[ . 1 . 2]" 1 1264 1 81 GLY H 1 82 THR HG1 . . 4.590 4.227 4.045 4.386 . 0 0 "[ . 1 . 2]" 1 1265 1 81 GLY H 1 100 ILE MG . . 4.760 4.023 3.774 4.281 . 0 0 "[ . 1 . 2]" 1 1266 1 81 GLY H 1 101 ASN HB2 . . 4.340 3.640 3.523 3.757 . 0 0 "[ . 1 . 2]" 1 1267 1 81 GLY H 1 103 VAL H . . 5.450 4.722 4.564 4.916 . 0 0 "[ . 1 . 2]" 1 1268 1 81 GLY H 1 130 MET ME . . 4.210 3.230 2.849 4.141 . 0 0 "[ . 1 . 2]" 1 1269 1 81 GLY HA2 1 100 ILE MG . . 4.210 3.452 3.195 3.811 . 0 0 "[ . 1 . 2]" 1 1270 1 81 GLY HA2 1 126 VAL H . . 4.990 4.143 4.023 4.276 . 0 0 "[ . 1 . 2]" 1 1271 1 81 GLY HA2 1 126 VAL HB . . 4.180 3.496 2.960 4.200 0.020 19 0 "[ . 1 . 2]" 1 1272 1 81 GLY HA2 1 130 MET ME . . 3.880 2.844 2.280 3.449 . 0 0 "[ . 1 . 2]" 1 1273 1 81 GLY HA2 1 130 MET HG2 . . 5.160 4.516 3.955 5.133 . 0 0 "[ . 1 . 2]" 1 1274 1 82 THR H 1 82 THR HB . . 4.040 3.876 3.802 3.946 . 0 0 "[ . 1 . 2]" 1 1275 1 82 THR H 1 82 THR HG1 . . 3.390 2.441 2.339 2.627 . 0 0 "[ . 1 . 2]" 1 1276 1 82 THR H 1 82 THR MG . . 3.710 2.991 2.786 3.238 . 0 0 "[ . 1 . 2]" 1 1277 1 82 THR H 1 83 LEU H . . 4.600 4.591 4.519 4.616 0.016 20 0 "[ . 1 . 2]" 1 1278 1 82 THR H 1 83 LEU MD1 . . 4.580 4.324 4.178 4.567 . 0 0 "[ . 1 . 2]" 1 1279 1 82 THR H 1 101 ASN HB2 . . 3.960 2.346 2.275 2.412 . 0 0 "[ . 1 . 2]" 1 1280 1 82 THR H 1 101 ASN QD . . 4.080 3.724 3.587 3.875 . 0 0 "[ . 1 . 2]" 1 1281 1 82 THR HB 1 83 LEU H . . 3.460 2.374 2.283 2.457 . 0 0 "[ . 1 . 2]" 1 1282 1 82 THR HB 1 83 LEU MD1 . . 5.170 4.766 4.688 4.806 . 0 0 "[ . 1 . 2]" 1 1283 1 82 THR HB 1 125 GLU HB2 . . 4.500 4.081 3.962 4.189 . 0 0 "[ . 1 . 2]" 1 1284 1 82 THR HB 1 126 VAL H . . 4.560 4.644 4.631 4.664 0.104 20 0 "[ . 1 . 2]" 1 1285 1 82 THR MG 1 83 LEU H . . 3.930 3.733 3.693 3.772 . 0 0 "[ . 1 . 2]" 1 1286 1 82 THR MG 1 101 ASN QD . . 4.160 3.825 3.773 3.869 . 0 0 "[ . 1 . 2]" 1 1287 1 82 THR MG 1 125 GLU HA . . 3.990 3.438 3.347 3.515 . 0 0 "[ . 1 . 2]" 1 1288 1 82 THR MG 1 125 GLU HB2 . . 3.860 2.709 2.571 2.902 . 0 0 "[ . 1 . 2]" 1 1289 1 83 LEU H 1 83 LEU MD1 . . 4.260 3.174 3.101 3.241 . 0 0 "[ . 1 . 2]" 1 1290 1 83 LEU H 1 125 GLU HA . . 3.810 2.180 2.135 2.217 . 0 0 "[ . 1 . 2]" 1 1291 1 83 LEU H 1 125 GLU HB2 . . 4.150 4.192 4.179 4.203 0.053 1 0 "[ . 1 . 2]" 1 1292 1 83 LEU H 1 126 VAL H . . 4.300 3.904 3.787 4.016 . 0 0 "[ . 1 . 2]" 1 1293 1 83 LEU HA 1 83 LEU MD1 . . 4.280 3.045 2.986 3.086 . 0 0 "[ . 1 . 2]" 1 1294 1 83 LEU HA 1 83 LEU HG . . 3.770 2.325 2.271 2.368 . 0 0 "[ . 1 . 2]" 1 1295 1 83 LEU HA 1 84 ALA H . . 3.210 2.127 2.092 2.184 . 0 0 "[ . 1 . 2]" 1 1296 1 83 LEU HA 1 84 ALA MB . . 4.270 3.947 3.898 3.995 . 0 0 "[ . 1 . 2]" 1 1297 1 83 LEU HA 1 99 PHE H . . 4.440 4.210 4.143 4.303 . 0 0 "[ . 1 . 2]" 1 1298 1 83 LEU HA 1 99 PHE QE . . 4.400 4.433 4.419 4.445 0.045 15 0 "[ . 1 . 2]" 1 1299 1 83 LEU HA 1 100 ILE HA . . 3.780 2.746 2.638 2.895 . 0 0 "[ . 1 . 2]" 1 1300 1 83 LEU HA 1 100 ILE QG . . 4.220 4.090 3.988 4.186 . 0 0 "[ . 1 . 2]" 1 1301 1 83 LEU HA 1 100 ILE MG . . 4.730 4.002 3.859 4.211 . 0 0 "[ . 1 . 2]" 1 1302 1 83 LEU HA 1 101 ASN H . . 4.320 3.256 3.076 3.372 . 0 0 "[ . 1 . 2]" 1 1303 1 83 LEU HB3 1 84 ALA H . . 3.520 3.100 3.001 3.169 . 0 0 "[ . 1 . 2]" 1 1304 1 83 LEU HB3 1 99 PHE H . . 4.430 4.219 4.145 4.291 . 0 0 "[ . 1 . 2]" 1 1305 1 83 LEU HB3 1 100 ILE HA . . 4.880 4.654 4.583 4.708 . 0 0 "[ . 1 . 2]" 1 1306 1 83 LEU HB3 1 100 ILE QG . . 4.530 4.533 4.528 4.540 0.010 3 0 "[ . 1 . 2]" 1 1307 1 83 LEU HB3 1 123 PHE HZ . . 3.740 3.315 3.172 3.420 . 0 0 "[ . 1 . 2]" 1 1308 1 83 LEU MD1 1 99 PHE H . . 5.500 5.562 5.553 5.569 0.069 1 0 "[ . 1 . 2]" 1 1309 1 83 LEU MD1 1 100 ILE QG . . 3.860 2.361 2.309 2.427 . 0 0 "[ . 1 . 2]" 1 1310 1 83 LEU MD1 1 125 GLU HA . . 3.850 3.118 3.001 3.229 . 0 0 "[ . 1 . 2]" 1 1311 1 83 LEU MD1 1 125 GLU HB2 . . 5.020 4.728 4.609 4.816 . 0 0 "[ . 1 . 2]" 1 1312 1 83 LEU MD1 1 126 VAL H . . 4.290 2.913 2.729 3.034 . 0 0 "[ . 1 . 2]" 1 1313 1 83 LEU MD1 1 126 VAL MG2 . . 3.600 2.706 2.426 3.097 . 0 0 "[ . 1 . 2]" 1 1314 1 83 LEU HG 1 84 ALA H . . 4.120 3.704 3.633 3.775 . 0 0 "[ . 1 . 2]" 1 1315 1 83 LEU HG 1 98 PHE QD . . 4.520 3.250 3.161 3.351 . 0 0 "[ . 1 . 2]" 1 1316 1 83 LEU HG 1 99 PHE HA . . 5.300 4.880 4.812 4.955 . 0 0 "[ . 1 . 2]" 1 1317 1 83 LEU HG 1 100 ILE HA . . 4.080 2.475 2.383 2.565 . 0 0 "[ . 1 . 2]" 1 1318 1 83 LEU HG 1 100 ILE MD . . 4.140 3.899 3.825 3.960 . 0 0 "[ . 1 . 2]" 1 1319 1 83 LEU HG 1 100 ILE QG . . 3.470 2.211 2.170 2.247 . 0 0 "[ . 1 . 2]" 1 1320 1 83 LEU HG 1 101 ASN H . . 4.430 4.194 4.072 4.310 . 0 0 "[ . 1 . 2]" 1 1321 1 83 LEU HG 1 123 PHE HZ . . 5.500 4.959 4.818 5.115 . 0 0 "[ . 1 . 2]" 1 1322 1 84 ALA H 1 84 ALA MB . . 3.640 2.617 2.565 2.667 . 0 0 "[ . 1 . 2]" 1 1323 1 84 ALA H 1 98 PHE QD . . 4.740 4.549 4.541 4.560 . 0 0 "[ . 1 . 2]" 1 1324 1 84 ALA H 1 99 PHE H . . 3.430 2.936 2.848 2.998 . 0 0 "[ . 1 . 2]" 1 1325 1 84 ALA H 1 99 PHE QD . . 4.350 3.274 3.151 3.344 . 0 0 "[ . 1 . 2]" 1 1326 1 84 ALA H 1 99 PHE QE . . 3.450 3.486 3.474 3.498 0.048 7 0 "[ . 1 . 2]" 1 1327 1 84 ALA H 1 100 ILE H . . 5.500 5.307 5.197 5.448 . 0 0 "[ . 1 . 2]" 1 1328 1 84 ALA H 1 100 ILE HA . . 4.420 4.102 3.961 4.281 . 0 0 "[ . 1 . 2]" 1 1329 1 84 ALA HA 1 85 MET H . . 3.350 2.338 2.311 2.363 . 0 0 "[ . 1 . 2]" 1 1330 1 84 ALA HA 1 85 MET HG2 . . 4.870 4.254 3.762 4.886 0.016 9 0 "[ . 1 . 2]" 1 1331 1 84 ALA HA 1 122 VAL HA . . 3.930 2.385 2.289 2.483 . 0 0 "[ . 1 . 2]" 1 1332 1 84 ALA HA 1 123 PHE H . . 3.940 2.260 2.153 2.317 . 0 0 "[ . 1 . 2]" 1 1333 1 84 ALA HA 1 124 ALA H . . 4.270 3.730 3.676 3.827 . 0 0 "[ . 1 . 2]" 1 1334 1 84 ALA MB 1 85 MET H . . 3.450 2.508 2.399 2.578 . 0 0 "[ . 1 . 2]" 1 1335 1 84 ALA MB 1 85 MET HA . . 5.290 4.407 4.351 4.453 . 0 0 "[ . 1 . 2]" 1 1336 1 84 ALA MB 1 99 PHE H . . 4.670 4.410 4.324 4.481 . 0 0 "[ . 1 . 2]" 1 1337 1 84 ALA MB 1 99 PHE QE . . 3.500 2.332 2.214 2.438 . 0 0 "[ . 1 . 2]" 1 1338 1 84 ALA MB 1 99 PHE HZ . . 3.710 2.420 2.359 2.495 . 0 0 "[ . 1 . 2]" 1 1339 1 84 ALA MB 1 120 TYR HB3 . . 4.090 2.795 2.703 3.082 . 0 0 "[ . 1 . 2]" 1 1340 1 84 ALA MB 1 121 CYS H . . 4.840 3.670 3.445 3.958 . 0 0 "[ . 1 . 2]" 1 1341 1 84 ALA MB 1 122 VAL HB . . 4.670 4.239 4.145 4.317 . 0 0 "[ . 1 . 2]" 1 1342 1 84 ALA MB 1 123 PHE H . . 4.280 3.397 3.349 3.444 . 0 0 "[ . 1 . 2]" 1 1343 1 84 ALA MB 1 124 ALA H . . 4.460 4.498 4.487 4.509 0.049 15 0 "[ . 1 . 2]" 1 1344 1 85 MET H 1 85 MET HB2 . . 3.750 2.979 2.449 3.744 . 0 0 "[ . 1 . 2]" 1 1345 1 85 MET H 1 85 MET HG2 . . 3.610 2.715 2.127 3.621 0.011 1 0 "[ . 1 . 2]" 1 1346 1 85 MET H 1 86 ALA H . . 4.760 4.631 4.581 4.665 . 0 0 "[ . 1 . 2]" 1 1347 1 85 MET H 1 120 TYR HB3 . . 4.850 3.990 3.783 4.348 . 0 0 "[ . 1 . 2]" 1 1348 1 85 MET H 1 121 CYS H . . 4.450 3.807 3.474 4.246 . 0 0 "[ . 1 . 2]" 1 1349 1 85 MET H 1 121 CYS HA . . 5.500 5.127 4.910 5.504 0.004 10 0 "[ . 1 . 2]" 1 1350 1 85 MET H 1 122 VAL HA . . 4.050 4.058 3.907 4.097 0.047 10 0 "[ . 1 . 2]" 1 1351 1 85 MET H 1 123 PHE H . . 4.300 3.425 3.288 3.611 . 0 0 "[ . 1 . 2]" 1 1352 1 85 MET HA 1 85 MET HG2 . . 4.160 3.234 2.167 4.167 0.007 9 0 "[ . 1 . 2]" 1 1353 1 85 MET HA 1 86 ALA H . . 3.330 2.191 2.142 2.226 . 0 0 "[ . 1 . 2]" 1 1354 1 85 MET HA 1 98 PHE H . . 4.610 4.651 4.627 4.681 0.071 17 0 "[ . 1 . 2]" 1 1355 1 85 MET HA 1 98 PHE HA . . 3.810 2.063 2.014 2.183 . 0 0 "[ . 1 . 2]" 1 1356 1 85 MET HA 1 98 PHE HB3 . . 3.670 3.319 3.159 3.417 . 0 0 "[ . 1 . 2]" 1 1357 1 85 MET HA 1 99 PHE H . . 4.940 3.773 3.655 3.948 . 0 0 "[ . 1 . 2]" 1 1358 1 86 ALA H 1 86 ALA MB . . 3.600 2.311 2.178 2.420 . 0 0 "[ . 1 . 2]" 1 1359 1 86 ALA H 1 97 GLN HA . . 4.490 4.530 4.494 4.564 0.074 19 0 "[ . 1 . 2]" 1 1360 1 86 ALA H 1 97 GLN HB2 . . 4.200 3.357 3.047 3.832 . 0 0 "[ . 1 . 2]" 1 1361 1 86 ALA H 1 98 PHE HA . . 3.510 2.432 2.353 2.500 . 0 0 "[ . 1 . 2]" 1 1362 1 86 ALA H 1 98 PHE HB3 . . 4.300 4.300 4.249 4.325 0.025 17 0 "[ . 1 . 2]" 1 1363 1 86 ALA H 1 99 PHE H . . 4.590 4.566 4.445 4.622 0.032 9 0 "[ . 1 . 2]" 1 1364 1 86 ALA H 1 99 PHE QD . . 4.950 4.062 3.812 4.245 . 0 0 "[ . 1 . 2]" 1 1365 1 86 ALA HA 1 99 PHE QD . . 4.190 3.423 3.104 3.729 . 0 0 "[ . 1 . 2]" 1 1366 1 86 ALA HA 1 99 PHE QE . . 3.060 2.989 2.696 3.070 0.010 9 0 "[ . 1 . 2]" 1 1367 1 86 ALA MB 1 97 GLN HB2 . . 4.220 2.318 2.196 2.448 . 0 0 "[ . 1 . 2]" 1 1368 1 86 ALA MB 1 98 PHE H . . 4.620 3.667 3.455 3.874 . 0 0 "[ . 1 . 2]" 1 1369 1 86 ALA MB 1 98 PHE HB3 . . 5.210 5.216 5.162 5.238 0.028 18 0 "[ . 1 . 2]" 1 1370 1 86 ALA MB 1 99 PHE QD . . 4.100 2.174 2.088 2.299 . 0 0 "[ . 1 . 2]" 1 1371 1 86 ALA MB 1 99 PHE QE . . 4.630 3.426 2.851 3.721 . 0 0 "[ . 1 . 2]" 1 1372 1 87 ARG H 1 120 TYR QE . . 3.700 2.619 2.060 3.442 . 0 0 "[ . 1 . 2]" 1 1373 1 87 ARG HA 1 88 THR H . . 3.180 2.316 2.235 2.387 . 0 0 "[ . 1 . 2]" 1 1374 1 87 ARG HA 1 93 SER H . . 5.100 4.536 4.017 4.883 . 0 0 "[ . 1 . 2]" 1 1375 1 87 ARG HA 1 94 ALA H . . 4.600 4.135 3.653 4.411 . 0 0 "[ . 1 . 2]" 1 1376 1 87 ARG HB3 1 88 THR H . . 3.940 3.715 2.537 3.956 0.016 17 0 "[ . 1 . 2]" 1 1377 1 87 ARG HB3 1 93 SER H . . 4.590 3.914 3.251 4.400 . 0 0 "[ . 1 . 2]" 1 1378 1 87 ARG HB3 1 94 ALA H . . 5.500 4.384 3.632 5.150 . 0 0 "[ . 1 . 2]" 1 1379 1 87 ARG HG3 1 88 THR H . . 4.810 3.842 3.074 4.836 0.026 3 0 "[ . 1 . 2]" 1 1380 1 87 ARG HG3 1 93 SER H . . 5.500 4.822 4.397 5.508 0.008 16 0 "[ . 1 . 2]" 1 1381 1 87 ARG HG3 1 120 TYR QE . . 3.980 3.532 2.690 3.994 0.014 2 0 "[ . 1 . 2]" 1 1382 1 88 THR H 1 88 THR HB . . 3.620 2.565 2.495 2.721 . 0 0 "[ . 1 . 2]" 1 1383 1 88 THR H 1 88 THR MG . . 3.850 3.810 3.785 3.847 . 0 0 "[ . 1 . 2]" 1 1384 1 88 THR H 1 93 SER H . . 4.350 4.161 3.911 4.371 0.021 14 0 "[ . 1 . 2]" 1 1385 1 88 THR H 1 93 SER HA . . 5.260 4.299 4.262 4.429 . 0 0 "[ . 1 . 2]" 1 1386 1 88 THR H 1 93 SER HB3 . . 5.220 4.055 3.960 4.248 . 0 0 "[ . 1 . 2]" 1 1387 1 88 THR H 1 93 SER HG . . 3.830 2.903 2.627 3.248 . 0 0 "[ . 1 . 2]" 1 1388 1 88 THR H 1 94 ALA H . . 4.950 4.541 4.327 4.793 . 0 0 "[ . 1 . 2]" 1 1389 1 88 THR H 1 94 ALA HA . . 4.170 3.614 3.421 3.889 . 0 0 "[ . 1 . 2]" 1 1390 1 88 THR H 1 95 THR H . . 5.190 4.413 3.699 5.208 0.018 20 0 "[ . 1 . 2]" 1 1391 1 88 THR HB 1 90 ALA H . . 3.670 3.690 3.670 3.712 0.042 9 0 "[ . 1 . 2]" 1 1392 1 88 THR MG 1 89 GLN H . . 4.470 3.369 3.188 4.013 . 0 0 "[ . 1 . 2]" 1 1393 1 88 THR MG 1 89 GLN HG2 . . 5.500 4.300 2.445 5.519 0.019 18 0 "[ . 1 . 2]" 1 1394 1 88 THR MG 1 90 ALA H . . 4.360 4.365 4.176 4.389 0.029 19 0 "[ . 1 . 2]" 1 1395 1 89 GLN H 1 89 GLN HB2 . . 3.930 3.604 2.982 3.990 0.060 5 0 "[ . 1 . 2]" 1 1396 1 89 GLN H 1 89 GLN HG2 . . 4.810 3.980 2.615 4.899 0.089 10 0 "[ . 1 . 2]" 1 1397 1 89 GLN H 1 90 ALA H . . 3.700 2.283 1.965 3.651 . 0 0 "[ . 1 . 2]" 1 1398 1 89 GLN HA 1 89 GLN HG2 . . 3.720 3.394 3.115 3.767 0.047 17 0 "[ . 1 . 2]" 1 1399 1 89 GLN HB2 1 90 ALA H . . 4.010 3.630 2.274 4.014 0.004 17 0 "[ . 1 . 2]" 1 1400 1 89 GLN HG2 1 90 ALA H . . 4.320 3.331 2.646 4.311 . 0 0 "[ . 1 . 2]" 1 1401 1 89 GLN HG2 1 90 ALA MB . . 5.500 4.073 3.801 5.510 0.010 13 0 "[ . 1 . 2]" 1 1402 1 90 ALA H 1 90 ALA MB . . 2.940 2.207 2.168 2.283 . 0 0 "[ . 1 . 2]" 1 1403 1 90 ALA H 1 91 PRO QD . . 4.700 4.540 4.518 4.572 . 0 0 "[ . 1 . 2]" 1 1404 1 90 ALA H 1 93 SER HB3 . . 4.150 3.030 2.654 3.936 . 0 0 "[ . 1 . 2]" 1 1405 1 90 ALA H 1 93 SER HG . . 4.220 2.675 2.340 2.935 . 0 0 "[ . 1 . 2]" 1 1406 1 90 ALA HA 1 91 PRO QD . . 2.830 2.284 2.244 2.314 . 0 0 "[ . 1 . 2]" 1 1407 1 90 ALA HA 1 91 PRO HG2 . . 4.690 4.658 4.575 4.707 0.017 7 0 "[ . 1 . 2]" 1 1408 1 90 ALA HA 1 92 HIS H . . 4.720 4.312 4.217 4.516 . 0 0 "[ . 1 . 2]" 1 1409 1 90 ALA MB 1 91 PRO QD . . 3.340 2.138 2.053 2.262 . 0 0 "[ . 1 . 2]" 1 1410 1 90 ALA MB 1 92 HIS H . . 4.060 2.855 2.685 3.204 . 0 0 "[ . 1 . 2]" 1 1411 1 90 ALA MB 1 93 SER H . . 4.570 3.865 3.712 4.121 . 0 0 "[ . 1 . 2]" 1 1412 1 90 ALA MB 1 93 SER HB3 . . 3.810 2.318 2.124 2.510 . 0 0 "[ . 1 . 2]" 1 1413 1 91 PRO HA 1 93 SER H . . 4.480 4.012 3.767 4.229 . 0 0 "[ . 1 . 2]" 1 1414 1 91 PRO HB2 1 92 HIS H . . 3.780 3.550 3.315 3.754 . 0 0 "[ . 1 . 2]" 1 1415 1 91 PRO HB2 1 92 HIS HD2 . . 4.360 4.222 3.337 4.374 0.014 3 0 "[ . 1 . 2]" 1 1416 1 91 PRO QD 1 92 HIS H . . 3.200 3.040 2.938 3.128 . 0 0 "[ . 1 . 2]" 1 1417 1 91 PRO QD 1 92 HIS HD2 . . 4.160 4.159 4.102 4.175 0.015 7 0 "[ . 1 . 2]" 1 1418 1 91 PRO HG2 1 92 HIS H . . 3.250 2.715 2.520 2.944 . 0 0 "[ . 1 . 2]" 1 1419 1 91 PRO HG2 1 92 HIS HD2 . . 3.930 2.706 2.403 2.812 . 0 0 "[ . 1 . 2]" 1 1420 1 92 HIS H 1 92 HIS HB3 . . 3.870 3.711 3.648 3.793 . 0 0 "[ . 1 . 2]" 1 1421 1 92 HIS H 1 92 HIS HD2 . . 3.620 3.291 3.136 3.506 . 0 0 "[ . 1 . 2]" 1 1422 1 92 HIS H 1 93 SER H . . 3.540 3.005 2.896 3.241 . 0 0 "[ . 1 . 2]" 1 1423 1 92 HIS H 1 93 SER HB3 . . 5.260 4.113 3.813 4.293 . 0 0 "[ . 1 . 2]" 1 1424 1 92 HIS HA 1 94 ALA H . . 4.280 3.592 3.402 3.759 . 0 0 "[ . 1 . 2]" 1 1425 1 92 HIS HB3 1 93 SER H . . 4.650 4.532 4.474 4.561 . 0 0 "[ . 1 . 2]" 1 1426 1 92 HIS HE1 1 118 TRP HH2 . . 4.160 2.692 2.240 3.208 . 0 0 "[ . 1 . 2]" 1 1427 1 93 SER H 1 93 SER HB3 . . 3.760 3.064 2.992 3.167 . 0 0 "[ . 1 . 2]" 1 1428 1 93 SER H 1 93 SER HG . . 3.880 2.363 2.271 2.505 . 0 0 "[ . 1 . 2]" 1 1429 1 93 SER H 1 94 ALA H . . 3.440 2.707 2.572 2.881 . 0 0 "[ . 1 . 2]" 1 1430 1 93 SER H 1 94 ALA MB . . 4.520 3.789 3.541 4.045 . 0 0 "[ . 1 . 2]" 1 1431 1 94 ALA H 1 94 ALA MB . . 3.580 2.251 2.187 2.324 . 0 0 "[ . 1 . 2]" 1 1432 1 94 ALA H 1 95 THR H . . 4.100 4.075 3.698 4.285 0.185 20 0 "[ . 1 . 2]" 1 1433 1 94 ALA H 1 95 THR MG . . 4.550 4.506 4.424 4.551 0.001 9 0 "[ . 1 . 2]" 1 1434 1 94 ALA HA 1 95 THR H . . 2.960 2.256 2.100 2.594 . 0 0 "[ . 1 . 2]" 1 1435 1 94 ALA MB 1 95 THR H . . 3.820 3.551 2.738 3.793 . 0 0 "[ . 1 . 2]" 1 1436 1 95 THR H 1 95 THR MG . . 4.060 2.606 2.204 3.229 . 0 0 "[ . 1 . 2]" 1 1437 1 95 THR H 1 96 ALA H . . 3.620 2.822 2.362 3.398 . 0 0 "[ . 1 . 2]" 1 1438 1 95 THR HB 1 96 ALA H . . 3.500 3.102 2.782 3.500 . 0 0 "[ . 1 . 2]" 1 1439 1 96 ALA H 1 96 ALA MB . . 3.460 2.607 2.450 2.774 . 0 0 "[ . 1 . 2]" 1 1440 1 96 ALA H 1 97 GLN HB2 . . 4.000 4.029 4.007 4.061 0.061 20 0 "[ . 1 . 2]" 1 1441 1 96 ALA MB 1 97 GLN H . . 4.200 3.383 2.794 3.781 . 0 0 "[ . 1 . 2]" 1 1442 1 97 GLN H 1 97 GLN HB2 . . 3.400 2.529 2.296 2.795 . 0 0 "[ . 1 . 2]" 1 1443 1 97 GLN H 1 98 PHE H . . 4.530 4.532 4.459 4.579 0.049 18 0 "[ . 1 . 2]" 1 1444 1 97 GLN HB2 1 98 PHE H . . 4.040 4.002 3.777 4.073 0.033 13 0 "[ . 1 . 2]" 1 1445 1 98 PHE H 1 98 PHE HB3 . . 3.870 3.229 3.188 3.272 . 0 0 "[ . 1 . 2]" 1 1446 1 98 PHE H 1 98 PHE QD . . 4.020 2.875 2.795 2.961 . 0 0 "[ . 1 . 2]" 1 1447 1 98 PHE H 1 99 PHE H . . 4.400 4.422 4.402 4.437 0.037 13 0 "[ . 1 . 2]" 1 1448 1 98 PHE HA 1 98 PHE QD . . 4.200 3.730 3.719 3.746 . 0 0 "[ . 1 . 2]" 1 1449 1 98 PHE HA 1 99 PHE H . . 3.160 2.451 2.425 2.491 . 0 0 "[ . 1 . 2]" 1 1450 1 98 PHE HA 1 99 PHE QD . . 4.280 3.968 3.686 4.093 . 0 0 "[ . 1 . 2]" 1 1451 1 98 PHE HB3 1 99 PHE H . . 3.910 3.819 3.793 3.844 . 0 0 "[ . 1 . 2]" 1 1452 1 98 PHE HB3 1 123 PHE HZ . . 3.880 3.899 3.882 3.914 0.034 13 0 "[ . 1 . 2]" 1 1453 1 98 PHE QD 1 99 PHE H . . 4.520 2.730 2.660 2.803 . 0 0 "[ . 1 . 2]" 1 1454 1 98 PHE QD 1 100 ILE MD . . 4.620 4.271 4.135 4.402 . 0 0 "[ . 1 . 2]" 1 1455 1 98 PHE QD 1 100 ILE HG12 . . 4.780 3.538 3.344 3.684 . 0 0 "[ . 1 . 2]" 1 1456 1 98 PHE QE 1 100 ILE MD . . 4.000 2.712 2.464 2.939 . 0 0 "[ . 1 . 2]" 1 1457 1 98 PHE HZ 1 157 ILE MG . . 5.000 4.938 4.654 5.009 0.009 17 0 "[ . 1 . 2]" 1 1458 1 99 PHE H 1 99 PHE HB3 . . 4.050 3.461 3.398 3.525 . 0 0 "[ . 1 . 2]" 1 1459 1 99 PHE H 1 99 PHE QD . . 4.330 3.475 3.385 3.525 . 0 0 "[ . 1 . 2]" 1 1460 1 99 PHE H 1 99 PHE QE . . 4.820 4.706 4.575 4.805 . 0 0 "[ . 1 . 2]" 1 1461 1 99 PHE H 1 100 ILE H . . 4.400 4.398 4.384 4.408 0.008 9 0 "[ . 1 . 2]" 1 1462 1 99 PHE HA 1 100 ILE HA . . 4.640 4.455 4.439 4.480 . 0 0 "[ . 1 . 2]" 1 1463 1 99 PHE HB3 1 100 ILE H . . 3.930 3.729 3.644 3.789 . 0 0 "[ . 1 . 2]" 1 1464 1 99 PHE QD 1 100 ILE H . . 4.590 3.369 3.188 3.612 . 0 0 "[ . 1 . 2]" 1 1465 1 99 PHE QD 1 101 ASN HA . . 4.830 3.809 3.621 4.034 . 0 0 "[ . 1 . 2]" 1 1466 1 99 PHE QE 1 101 ASN QD . . 4.260 2.106 1.998 2.222 . 0 0 "[ . 1 . 2]" 1 1467 1 99 PHE QE 1 108 LEU MD1 . . 3.960 2.978 2.741 3.146 . 0 0 "[ . 1 . 2]" 1 1468 1 99 PHE QE 1 120 TYR HB3 . . 3.790 3.055 2.799 3.545 . 0 0 "[ . 1 . 2]" 1 1469 1 99 PHE HZ 1 108 LEU HB3 . . 4.910 3.577 3.265 3.891 . 0 0 "[ . 1 . 2]" 1 1470 1 99 PHE HZ 1 108 LEU MD1 . . 3.910 2.625 2.498 2.738 . 0 0 "[ . 1 . 2]" 1 1471 1 99 PHE HZ 1 120 TYR HB3 . . 3.510 3.109 2.626 3.525 0.015 1 0 "[ . 1 . 2]" 1 1472 1 100 ILE H 1 100 ILE HB . . 3.850 2.805 2.764 2.842 . 0 0 "[ . 1 . 2]" 1 1473 1 100 ILE H 1 100 ILE QG . . 4.080 2.689 2.620 2.735 . 0 0 "[ . 1 . 2]" 1 1474 1 100 ILE H 1 100 ILE MG . . 4.540 3.948 3.933 3.963 . 0 0 "[ . 1 . 2]" 1 1475 1 100 ILE HA 1 100 ILE QG . . 3.640 2.559 2.519 2.599 . 0 0 "[ . 1 . 2]" 1 1476 1 100 ILE QG 1 101 ASN H . . 5.340 4.407 4.356 4.437 . 0 0 "[ . 1 . 2]" 1 1477 1 100 ILE MG 1 101 ASN H . . 4.170 2.873 2.801 2.936 . 0 0 "[ . 1 . 2]" 1 1478 1 100 ILE MG 1 130 MET ME . . 5.170 3.910 2.826 4.855 . 0 0 "[ . 1 . 2]" 1 1479 1 101 ASN H 1 101 ASN HB2 . . 3.930 2.316 2.292 2.338 . 0 0 "[ . 1 . 2]" 1 1480 1 101 ASN H 1 101 ASN HD21 . . 4.310 3.427 3.300 3.524 . 0 0 "[ . 1 . 2]" 1 1481 1 101 ASN H 1 101 ASN QD . . 3.770 3.300 3.197 3.375 . 0 0 "[ . 1 . 2]" 1 1482 1 101 ASN H 1 101 ASN HD22 . . 4.310 4.308 4.270 4.322 0.012 12 0 "[ . 1 . 2]" 1 1483 1 101 ASN H 1 102 VAL H . . 4.690 4.305 4.174 4.521 . 0 0 "[ . 1 . 2]" 1 1484 1 101 ASN HA 1 103 VAL H . . 3.760 3.448 3.357 3.554 . 0 0 "[ . 1 . 2]" 1 1485 1 101 ASN HB2 1 103 VAL H . . 5.250 4.810 4.618 4.992 . 0 0 "[ . 1 . 2]" 1 1486 1 102 VAL H 1 102 VAL MG2 . . 3.970 2.931 2.102 3.845 . 0 0 "[ . 1 . 2]" 1 1487 1 102 VAL H 1 103 VAL MG2 . . 4.440 3.720 3.484 3.903 . 0 0 "[ . 1 . 2]" 1 1488 1 102 VAL H 1 105 ASN HD21 . . 5.500 5.174 4.551 5.509 0.009 4 0 "[ . 1 . 2]" 1 1489 1 102 VAL H 1 105 ASN QD . . 4.690 4.263 3.798 4.551 . 0 0 "[ . 1 . 2]" 1 1490 1 102 VAL H 1 105 ASN HD22 . . 5.500 4.539 4.068 4.853 . 0 0 "[ . 1 . 2]" 1 1491 1 102 VAL HA 1 103 VAL H . . 3.530 3.394 3.305 3.469 . 0 0 "[ . 1 . 2]" 1 1492 1 102 VAL HB 1 103 VAL H . . 4.230 4.214 4.087 4.292 0.062 1 0 "[ . 1 . 2]" 1 1493 1 102 VAL HB 1 137 LYS HD3 . . 4.580 3.924 2.467 4.582 0.002 13 0 "[ . 1 . 2]" 1 1494 1 102 VAL HB 1 137 LYS HE2 . . 4.650 4.081 3.313 4.661 0.011 2 0 "[ . 1 . 2]" 1 1495 1 102 VAL MG2 1 103 VAL HA . . 4.280 4.180 3.984 4.324 0.044 8 0 "[ . 1 . 2]" 1 1496 1 103 VAL H 1 103 VAL HB . . 3.870 3.798 3.754 3.853 . 0 0 "[ . 1 . 2]" 1 1497 1 103 VAL H 1 103 VAL MG2 . . 3.260 2.285 2.172 2.388 . 0 0 "[ . 1 . 2]" 1 1498 1 103 VAL H 1 104 ASP H . . 4.520 4.483 4.425 4.526 0.006 5 0 "[ . 1 . 2]" 1 1499 1 103 VAL H 1 105 ASN HD21 . . 4.610 4.413 4.035 4.621 0.011 14 0 "[ . 1 . 2]" 1 1500 1 103 VAL H 1 105 ASN HD22 . . 4.610 3.946 3.204 4.384 . 0 0 "[ . 1 . 2]" 1 1501 1 103 VAL HA 1 104 ASP H . . 3.140 2.425 2.358 2.478 . 0 0 "[ . 1 . 2]" 1 1502 1 103 VAL HB 1 104 ASP H . . 2.900 2.297 2.153 2.383 . 0 0 "[ . 1 . 2]" 1 1503 1 103 VAL HB 1 104 ASP HB2 . . 4.360 4.381 4.336 4.421 0.061 18 0 "[ . 1 . 2]" 1 1504 1 103 VAL HB 1 105 ASN H . . 5.370 5.393 5.371 5.419 0.049 15 0 "[ . 1 . 2]" 1 1505 1 103 VAL MG2 1 104 ASP H . . 3.740 3.605 3.454 3.741 0.001 15 0 "[ . 1 . 2]" 1 1506 1 103 VAL MG2 1 105 ASN QD . . 4.450 2.501 2.077 2.839 . 0 0 "[ . 1 . 2]" 1 1507 1 104 ASP H 1 104 ASP HB2 . . 3.190 2.408 2.144 2.547 . 0 0 "[ . 1 . 2]" 1 1508 1 104 ASP H 1 105 ASN H . . 4.610 4.471 4.429 4.514 . 0 0 "[ . 1 . 2]" 1 1509 1 104 ASP HB2 1 105 ASN H . . 4.630 4.390 4.235 4.588 . 0 0 "[ . 1 . 2]" 1 1510 1 105 ASN H 1 105 ASN HB2 . . 3.770 3.366 2.523 3.807 0.037 12 0 "[ . 1 . 2]" 1 1511 1 105 ASN H 1 105 ASN QD . . 4.720 4.080 3.766 4.203 . 0 0 "[ . 1 . 2]" 1 1512 1 105 ASN H 1 106 ASP H . . 4.180 3.280 3.094 3.466 . 0 0 "[ . 1 . 2]" 1 1513 1 105 ASN H 1 107 PHE H . . 5.500 5.420 5.237 5.526 0.026 10 0 "[ . 1 . 2]" 1 1514 1 105 ASN H 1 108 LEU H . . 5.500 5.513 5.466 5.537 0.037 13 0 "[ . 1 . 2]" 1 1515 1 105 ASN HA 1 106 ASP H . . 3.430 2.388 2.215 2.563 . 0 0 "[ . 1 . 2]" 1 1516 1 105 ASN HA 1 106 ASP HB2 . . 4.550 4.523 4.376 4.600 0.050 9 0 "[ . 1 . 2]" 1 1517 1 105 ASN HA 1 107 PHE QD . . 4.390 3.449 3.008 3.699 . 0 0 "[ . 1 . 2]" 1 1518 1 105 ASN HA 1 107 PHE QE . . 3.610 2.973 2.726 3.183 . 0 0 "[ . 1 . 2]" 1 1519 1 105 ASN HA 1 107 PHE HZ . . 5.420 4.557 3.766 5.418 . 0 0 "[ . 1 . 2]" 1 1520 1 105 ASN HB2 1 108 LEU MD1 . . 4.320 2.840 2.365 3.195 . 0 0 "[ . 1 . 2]" 1 1521 1 106 ASP H 1 106 ASP HB2 . . 2.940 2.215 2.019 2.318 . 0 0 "[ . 1 . 2]" 1 1522 1 106 ASP H 1 107 PHE H . . 3.280 2.888 2.815 2.939 . 0 0 "[ . 1 . 2]" 1 1523 1 106 ASP H 1 107 PHE QD . . 4.290 3.933 3.619 4.091 . 0 0 "[ . 1 . 2]" 1 1524 1 106 ASP H 1 107 PHE QE . . 4.790 4.743 4.510 4.828 0.038 3 0 "[ . 1 . 2]" 1 1525 1 106 ASP H 1 108 LEU H . . 4.500 4.473 4.385 4.524 0.024 19 0 "[ . 1 . 2]" 1 1526 1 106 ASP HA 1 108 LEU H . . 4.110 3.601 3.322 3.863 . 0 0 "[ . 1 . 2]" 1 1527 1 106 ASP HA 1 109 ASN H . . 3.880 3.703 3.405 3.899 0.019 10 0 "[ . 1 . 2]" 1 1528 1 106 ASP HB2 1 107 PHE H . . 3.610 3.551 3.324 3.705 0.095 4 0 "[ . 1 . 2]" 1 1529 1 106 ASP HB2 1 109 ASN QD . . 4.550 3.809 3.689 3.987 . 0 0 "[ . 1 . 2]" 1 1530 1 107 PHE H 1 107 PHE HB3 . . 3.220 2.578 2.436 2.757 . 0 0 "[ . 1 . 2]" 1 1531 1 107 PHE H 1 108 LEU H . . 3.570 2.839 2.656 3.014 . 0 0 "[ . 1 . 2]" 1 1532 1 107 PHE HA 1 107 PHE HB3 . . 2.880 2.390 2.336 2.466 . 0 0 "[ . 1 . 2]" 1 1533 1 107 PHE HA 1 107 PHE QD . . 3.790 3.687 3.682 3.691 . 0 0 "[ . 1 . 2]" 1 1534 1 107 PHE HB3 1 107 PHE QD . . 3.320 2.387 2.349 2.473 . 0 0 "[ . 1 . 2]" 1 1535 1 107 PHE HB3 1 108 LEU H . . 4.460 4.387 4.324 4.439 . 0 0 "[ . 1 . 2]" 1 1536 1 107 PHE QD 1 108 LEU HG . . 4.440 3.383 3.075 3.789 . 0 0 "[ . 1 . 2]" 1 1537 1 107 PHE QE 1 108 LEU HA . . 4.720 4.740 4.728 4.752 0.032 10 0 "[ . 1 . 2]" 1 1538 1 107 PHE QE 1 108 LEU MD1 . . 3.950 3.657 3.350 3.949 . 0 0 "[ . 1 . 2]" 1 1539 1 107 PHE QE 1 108 LEU HG . . 3.950 3.103 2.732 3.515 . 0 0 "[ . 1 . 2]" 1 1540 1 107 PHE HZ 1 108 LEU MD1 . . 4.200 4.112 3.756 4.209 0.009 16 0 "[ . 1 . 2]" 1 1541 1 107 PHE HZ 1 108 LEU HG . . 4.370 4.004 3.743 4.108 . 0 0 "[ . 1 . 2]" 1 1542 1 108 LEU H 1 108 LEU HB3 . . 3.970 3.621 3.594 3.644 . 0 0 "[ . 1 . 2]" 1 1543 1 108 LEU H 1 108 LEU MD1 . . 4.280 3.742 3.673 3.816 . 0 0 "[ . 1 . 2]" 1 1544 1 108 LEU H 1 108 LEU HG . . 3.330 2.497 2.424 2.611 . 0 0 "[ . 1 . 2]" 1 1545 1 108 LEU H 1 109 ASN H . . 3.100 2.588 2.531 2.651 . 0 0 "[ . 1 . 2]" 1 1546 1 108 LEU H 1 109 ASN HB2 . . 4.870 4.804 4.676 4.878 0.008 2 0 "[ . 1 . 2]" 1 1547 1 108 LEU HA 1 108 LEU MD1 . . 4.260 3.875 3.848 3.903 . 0 0 "[ . 1 . 2]" 1 1548 1 108 LEU HA 1 120 TYR QD . . 3.870 3.040 2.729 3.707 . 0 0 "[ . 1 . 2]" 1 1549 1 108 LEU HB3 1 109 ASN H . . 4.610 4.217 4.121 4.279 . 0 0 "[ . 1 . 2]" 1 1550 1 108 LEU HB3 1 120 TYR QD . . 3.760 2.653 2.362 3.211 . 0 0 "[ . 1 . 2]" 1 1551 1 108 LEU HG 1 109 ASN H . . 4.910 4.775 4.673 4.831 . 0 0 "[ . 1 . 2]" 1 1552 1 109 ASN H 1 109 ASN HB2 . . 3.180 2.433 2.388 2.477 . 0 0 "[ . 1 . 2]" 1 1553 1 109 ASN H 1 109 ASN HD21 . . 4.110 3.934 3.719 4.110 . 0 0 "[ . 1 . 2]" 1 1554 1 109 ASN H 1 109 ASN HD22 . . 4.110 4.146 4.121 4.163 0.053 2 0 "[ . 1 . 2]" 1 1555 1 109 ASN H 1 110 PHE H . . 4.870 4.590 4.523 4.688 . 0 0 "[ . 1 . 2]" 1 1556 1 109 ASN HA 1 110 PHE H . . 3.390 2.503 2.373 2.669 . 0 0 "[ . 1 . 2]" 1 1557 1 109 ASN HB2 1 109 ASN QD . . 3.470 2.363 2.312 2.439 . 0 0 "[ . 1 . 2]" 1 1558 1 109 ASN HB2 1 109 ASN HD22 . . 4.020 3.545 3.489 3.589 . 0 0 "[ . 1 . 2]" 1 1559 1 109 ASN HB2 1 110 PHE H . . 4.520 3.367 3.143 3.686 . 0 0 "[ . 1 . 2]" 1 1560 1 110 PHE H 1 110 PHE HB3 . . 3.310 2.403 2.270 2.559 . 0 0 "[ . 1 . 2]" 1 1561 1 110 PHE H 1 111 SER H . . 4.640 4.644 4.622 4.654 0.014 5 0 "[ . 1 . 2]" 1 1562 1 110 PHE H 1 118 TRP HB2 . . 5.260 4.931 4.820 5.178 . 0 0 "[ . 1 . 2]" 1 1563 1 110 PHE HA 1 111 SER H . . 3.150 2.269 2.205 2.357 . 0 0 "[ . 1 . 2]" 1 1564 1 110 PHE HA 1 112 GLY H . . 4.570 4.512 3.957 4.583 0.013 8 0 "[ . 1 . 2]" 1 1565 1 110 PHE HB3 1 111 SER H . . 4.390 4.048 3.766 4.242 . 0 0 "[ . 1 . 2]" 1 1566 1 110 PHE QD 1 118 TRP HA . . 4.520 4.270 4.082 4.314 . 0 0 "[ . 1 . 2]" 1 1567 1 110 PHE QD 1 118 TRP HE3 . . 4.330 2.385 2.270 2.582 . 0 0 "[ . 1 . 2]" 1 1568 1 110 PHE HZ 1 112 GLY HA2 . . 3.680 2.620 2.409 2.807 . 0 0 "[ . 1 . 2]" 1 1569 1 110 PHE HZ 1 113 GLU H . . 3.840 2.254 2.186 2.368 . 0 0 "[ . 1 . 2]" 1 1570 1 110 PHE HZ 1 113 GLU HA . . 4.230 3.804 3.678 3.946 . 0 0 "[ . 1 . 2]" 1 1571 1 110 PHE HZ 1 113 GLU HG2 . . 4.180 3.250 3.110 3.473 . 0 0 "[ . 1 . 2]" 1 1572 1 110 PHE HZ 1 114 SER H . . 5.110 5.139 5.129 5.153 0.043 2 0 "[ . 1 . 2]" 1 1573 1 111 SER H 1 111 SER HB3 . . 3.830 3.042 2.899 3.801 . 0 0 "[ . 1 . 2]" 1 1574 1 111 SER H 1 112 GLY H . . 3.210 2.398 2.152 2.512 . 0 0 "[ . 1 . 2]" 1 1575 1 111 SER H 1 112 GLY HA2 . . 4.960 4.569 4.239 4.785 . 0 0 "[ . 1 . 2]" 1 1576 1 111 SER H 1 117 GLY QA . . 4.250 4.197 3.171 4.275 0.025 4 0 "[ . 1 . 2]" 1 1577 1 111 SER H 1 118 TRP H . . 4.440 3.713 3.191 4.302 . 0 0 "[ . 1 . 2]" 1 1578 1 111 SER H 1 118 TRP HB2 . . 5.210 3.439 3.058 4.336 . 0 0 "[ . 1 . 2]" 1 1579 1 111 SER HB3 1 112 GLY H . . 4.330 3.573 2.431 4.139 . 0 0 "[ . 1 . 2]" 1 1580 1 111 SER HB3 1 118 TRP H . . 4.570 4.194 3.090 4.586 0.016 10 0 "[ . 1 . 2]" 1 1581 1 112 GLY H 1 113 GLU H . . 3.940 2.604 2.351 2.832 . 0 0 "[ . 1 . 2]" 1 1582 1 112 GLY H 1 117 GLY QA . . 4.500 4.249 3.377 4.520 0.020 2 0 "[ . 1 . 2]" 1 1583 1 112 GLY HA2 1 113 GLU H . . 2.950 2.581 2.483 2.691 . 0 0 "[ . 1 . 2]" 1 1584 1 112 GLY HA2 1 113 GLU HA . . 4.650 4.632 4.572 4.668 0.018 9 0 "[ . 1 . 2]" 1 1585 1 112 GLY HA2 1 113 GLU HB2 . . 4.280 4.178 4.050 4.281 0.001 8 0 "[ . 1 . 2]" 1 1586 1 112 GLY HA2 1 113 GLU HG2 . . 5.420 4.966 4.864 5.189 . 0 0 "[ . 1 . 2]" 1 1587 1 112 GLY HA2 1 114 SER H . . 4.450 4.460 4.447 4.475 0.025 20 0 "[ . 1 . 2]" 1 1588 1 113 GLU H 1 113 GLU HB2 . . 3.340 3.384 3.367 3.399 0.059 17 0 "[ . 1 . 2]" 1 1589 1 113 GLU H 1 113 GLU HG2 . . 3.660 3.193 3.045 3.295 . 0 0 "[ . 1 . 2]" 1 1590 1 113 GLU H 1 114 SER H . . 3.920 2.897 2.826 2.958 . 0 0 "[ . 1 . 2]" 1 1591 1 113 GLU H 1 118 TRP HE1 . . 4.060 4.101 4.083 4.133 0.073 13 0 "[ . 1 . 2]" 1 1592 1 113 GLU HA 1 113 GLU HG2 . . 3.420 2.305 2.239 2.334 . 0 0 "[ . 1 . 2]" 1 1593 1 113 GLU HA 1 114 SER H . . 3.030 2.923 2.876 2.979 . 0 0 "[ . 1 . 2]" 1 1594 1 113 GLU HA 1 114 SER HA . . 4.670 4.558 4.471 4.598 . 0 0 "[ . 1 . 2]" 1 1595 1 113 GLU HA 1 118 TRP H . . 5.490 5.295 4.952 5.481 . 0 0 "[ . 1 . 2]" 1 1596 1 113 GLU HA 1 118 TRP HD1 . . 4.650 3.481 3.201 3.909 . 0 0 "[ . 1 . 2]" 1 1597 1 113 GLU HA 1 118 TRP HE1 . . 3.750 2.337 2.292 2.397 . 0 0 "[ . 1 . 2]" 1 1598 1 113 GLU HB2 1 114 SER H . . 4.410 4.187 4.127 4.254 . 0 0 "[ . 1 . 2]" 1 1599 1 113 GLU HB2 1 118 TRP HE1 . . 5.050 5.042 4.988 5.060 0.010 10 0 "[ . 1 . 2]" 1 1600 1 113 GLU HG2 1 114 SER H . . 5.050 5.061 4.941 5.075 0.025 3 0 "[ . 1 . 2]" 1 1601 1 113 GLU HG2 1 118 TRP HE1 . . 4.230 4.198 3.955 4.248 0.018 10 0 "[ . 1 . 2]" 1 1602 1 113 GLU HG2 1 118 TRP HH2 . . 4.870 4.625 3.795 4.884 0.014 20 0 "[ . 1 . 2]" 1 1603 1 114 SER H 1 117 GLY QA . . 4.270 4.170 3.740 4.284 0.014 1 0 "[ . 1 . 2]" 1 1604 1 114 SER H 1 118 TRP H . . 3.590 3.575 3.371 3.640 0.050 20 0 "[ . 1 . 2]" 1 1605 1 114 SER H 1 118 TRP HD1 . . 3.990 2.470 2.196 3.075 . 0 0 "[ . 1 . 2]" 1 1606 1 114 SER H 1 118 TRP HE1 . . 3.860 3.387 3.231 3.548 . 0 0 "[ . 1 . 2]" 1 1607 1 114 SER HA 1 118 TRP H . . 5.470 5.287 5.196 5.445 . 0 0 "[ . 1 . 2]" 1 1608 1 114 SER HA 1 118 TRP HD1 . . 4.170 4.205 4.182 4.228 0.058 16 0 "[ . 1 . 2]" 1 1609 1 115 LEU HA 1 115 LEU MD1 . . 3.840 2.947 2.140 3.856 0.016 4 0 "[ . 1 . 2]" 1 1610 1 115 LEU HA 1 115 LEU HG . . 4.050 3.146 2.469 3.744 . 0 0 "[ . 1 . 2]" 1 1611 1 115 LEU HA 1 117 GLY H . . 4.110 3.827 3.692 4.031 . 0 0 "[ . 1 . 2]" 1 1612 1 115 LEU HA 1 118 TRP HD1 . . 4.630 3.727 3.070 4.211 . 0 0 "[ . 1 . 2]" 1 1613 1 115 LEU HA 1 118 TRP HE1 . . 4.350 3.847 3.117 4.359 0.009 18 0 "[ . 1 . 2]" 1 1614 1 115 LEU HB3 1 116 GLN H . . 4.270 3.210 2.453 3.724 . 0 0 "[ . 1 . 2]" 1 1615 1 115 LEU HB3 1 116 GLN HA . . 4.350 4.372 4.267 4.399 0.049 20 0 "[ . 1 . 2]" 1 1616 1 116 GLN H 1 116 GLN HB2 . . 3.740 3.072 2.462 3.695 . 0 0 "[ . 1 . 2]" 1 1617 1 116 GLN H 1 116 GLN HG2 . . 3.580 2.454 2.038 3.495 . 0 0 "[ . 1 . 2]" 1 1618 1 116 GLN H 1 117 GLY H . . 3.940 2.577 2.501 2.716 . 0 0 "[ . 1 . 2]" 1 1619 1 116 GLN H 1 118 TRP H . . 5.500 5.077 4.800 5.503 0.003 16 0 "[ . 1 . 2]" 1 1620 1 116 GLN HA 1 116 GLN HB2 . . 3.020 2.715 2.326 3.037 0.017 14 0 "[ . 1 . 2]" 1 1621 1 116 GLN HA 1 116 GLN HG2 . . 3.730 3.421 2.405 3.764 0.034 1 0 "[ . 1 . 2]" 1 1622 1 116 GLN HB2 1 117 GLY H . . 4.680 3.874 3.234 4.370 . 0 0 "[ . 1 . 2]" 1 1623 1 116 GLN HG2 1 117 GLY H . . 4.770 3.990 3.080 4.829 0.059 14 0 "[ . 1 . 2]" 1 1624 1 118 TRP H 1 118 TRP HB2 . . 3.900 3.707 3.610 3.772 . 0 0 "[ . 1 . 2]" 1 1625 1 118 TRP H 1 118 TRP HD1 . . 4.030 2.023 1.869 2.210 . 0 0 "[ . 1 . 2]" 1 1626 1 118 TRP H 1 119 GLY H . . 4.680 4.574 4.529 4.625 . 0 0 "[ . 1 . 2]" 1 1627 1 118 TRP HB2 1 119 GLY H . . 3.820 3.072 2.898 3.213 . 0 0 "[ . 1 . 2]" 1 1628 1 119 GLY H 1 120 TYR H . . 3.850 3.123 2.421 3.567 . 0 0 "[ . 1 . 2]" 1 1629 1 119 GLY HA2 1 120 TYR QD . . 4.150 3.796 3.539 3.983 . 0 0 "[ . 1 . 2]" 1 1630 1 119 GLY HA2 1 120 TYR QE . . 4.220 3.941 3.623 4.163 . 0 0 "[ . 1 . 2]" 1 1631 1 120 TYR H 1 120 TYR HB3 . . 4.180 3.798 3.744 3.848 . 0 0 "[ . 1 . 2]" 1 1632 1 120 TYR H 1 120 TYR QD . . 3.820 2.639 2.505 2.839 . 0 0 "[ . 1 . 2]" 1 1633 1 120 TYR H 1 120 TYR QE . . 4.630 4.652 4.635 4.676 0.046 7 0 "[ . 1 . 2]" 1 1634 1 120 TYR H 1 121 CYS H . . 4.610 4.466 4.352 4.510 . 0 0 "[ . 1 . 2]" 1 1635 1 120 TYR H 1 121 CYS HA . . 4.820 4.861 4.836 4.901 0.081 1 0 "[ . 1 . 2]" 1 1636 1 120 TYR HA 1 120 TYR QD . . 4.270 3.040 2.804 3.188 . 0 0 "[ . 1 . 2]" 1 1637 1 120 TYR HA 1 121 CYS H . . 3.360 2.249 2.131 2.405 . 0 0 "[ . 1 . 2]" 1 1638 1 120 TYR HA 1 121 CYS HB2 . . 4.680 4.457 4.338 4.609 . 0 0 "[ . 1 . 2]" 1 1639 1 120 TYR HB3 1 121 CYS H . . 3.580 3.000 2.714 3.406 . 0 0 "[ . 1 . 2]" 1 1640 1 121 CYS HA 1 122 VAL H . . 3.310 2.123 2.089 2.164 . 0 0 "[ . 1 . 2]" 1 1641 1 121 CYS HB2 1 122 VAL H . . 4.310 4.261 4.107 4.324 0.014 9 0 "[ . 1 . 2]" 1 1642 1 122 VAL H 1 122 VAL HB . . 3.580 2.572 2.428 2.752 . 0 0 "[ . 1 . 2]" 1 1643 1 122 VAL H 1 122 VAL MG2 . . 4.290 2.212 2.087 2.376 . 0 0 "[ . 1 . 2]" 1 1644 1 122 VAL H 1 123 PHE H . . 4.620 4.065 3.933 4.210 . 0 0 "[ . 1 . 2]" 1 1645 1 122 VAL H 1 124 ALA H . . 5.500 5.518 5.496 5.535 0.035 9 0 "[ . 1 . 2]" 1 1646 1 122 VAL HA 1 124 ALA H . . 3.500 3.186 3.127 3.247 . 0 0 "[ . 1 . 2]" 1 1647 1 122 VAL HB 1 124 ALA H . . 4.830 4.611 4.554 4.659 . 0 0 "[ . 1 . 2]" 1 1648 1 122 VAL MG2 1 123 PHE H . . 4.360 4.311 4.177 4.369 0.009 13 0 "[ . 1 . 2]" 1 1649 1 123 PHE H 1 124 ALA H . . 3.090 2.529 2.406 2.644 . 0 0 "[ . 1 . 2]" 1 1650 1 123 PHE HB3 1 124 ALA H . . 4.200 4.176 4.141 4.201 0.001 19 0 "[ . 1 . 2]" 1 1651 1 124 ALA HA 1 125 GLU H . . 3.200 2.472 2.455 2.488 . 0 0 "[ . 1 . 2]" 1 1652 1 124 ALA HA 1 125 GLU HA . . 4.710 4.549 4.537 4.562 . 0 0 "[ . 1 . 2]" 1 1653 1 124 ALA HA 1 125 GLU HG2 . . 4.340 4.119 4.073 4.214 . 0 0 "[ . 1 . 2]" 1 1654 1 124 ALA MB 1 125 GLU H . . 3.300 2.209 2.180 2.246 . 0 0 "[ . 1 . 2]" 1 1655 1 124 ALA MB 1 125 GLU HA . . 5.010 3.882 3.851 3.923 . 0 0 "[ . 1 . 2]" 1 1656 1 125 GLU H 1 125 GLU HG2 . . 3.310 2.532 2.470 2.609 . 0 0 "[ . 1 . 2]" 1 1657 1 125 GLU H 1 126 VAL H . . 4.460 4.467 4.462 4.473 0.013 4 0 "[ . 1 . 2]" 1 1658 1 125 GLU H 1 127 VAL MG2 . . 4.570 4.444 4.394 4.495 . 0 0 "[ . 1 . 2]" 1 1659 1 125 GLU HA 1 125 GLU HG2 . . 3.940 3.810 3.782 3.876 . 0 0 "[ . 1 . 2]" 1 1660 1 125 GLU HA 1 126 VAL H . . 3.460 2.327 2.289 2.357 . 0 0 "[ . 1 . 2]" 1 1661 1 125 GLU HA 1 126 VAL HB . . 4.620 4.439 4.384 4.545 . 0 0 "[ . 1 . 2]" 1 1662 1 125 GLU HB2 1 126 VAL H . . 3.340 2.701 2.631 2.843 . 0 0 "[ . 1 . 2]" 1 1663 1 125 GLU HB2 1 126 VAL HA . . 5.500 4.974 4.918 5.047 . 0 0 "[ . 1 . 2]" 1 1664 1 125 GLU HB2 1 127 VAL MG2 . . 4.890 4.895 4.861 4.907 0.017 5 0 "[ . 1 . 2]" 1 1665 1 125 GLU HG2 1 126 VAL H . . 5.000 4.736 4.683 4.792 . 0 0 "[ . 1 . 2]" 1 1666 1 125 GLU HG2 1 127 VAL MG2 . . 4.440 3.758 3.671 3.840 . 0 0 "[ . 1 . 2]" 1 1667 1 126 VAL H 1 126 VAL HB . . 3.480 2.518 2.407 2.726 . 0 0 "[ . 1 . 2]" 1 1668 1 126 VAL H 1 126 VAL MG2 . . 3.920 3.829 3.765 3.927 0.007 15 0 "[ . 1 . 2]" 1 1669 1 126 VAL H 1 127 VAL H . . 4.770 4.573 4.559 4.586 . 0 0 "[ . 1 . 2]" 1 1670 1 126 VAL HA 1 126 VAL MG2 . . 3.730 2.208 2.155 2.289 . 0 0 "[ . 1 . 2]" 1 1671 1 126 VAL HA 1 127 VAL H . . 3.550 2.119 2.103 2.145 . 0 0 "[ . 1 . 2]" 1 1672 1 126 VAL HA 1 127 VAL HA . . 4.570 4.449 4.418 4.480 . 0 0 "[ . 1 . 2]" 1 1673 1 126 VAL HA 1 127 VAL HB . . 4.720 4.626 4.563 4.689 . 0 0 "[ . 1 . 2]" 1 1674 1 126 VAL HA 1 127 VAL MG2 . . 4.210 3.290 3.189 3.410 . 0 0 "[ . 1 . 2]" 1 1675 1 126 VAL HA 1 128 ASP H . . 4.140 3.970 3.928 4.039 . 0 0 "[ . 1 . 2]" 1 1676 1 126 VAL MG2 1 127 VAL H . . 3.880 2.512 2.459 2.587 . 0 0 "[ . 1 . 2]" 1 1677 1 126 VAL MG2 1 128 ASP H . . 3.530 2.763 2.589 2.883 . 0 0 "[ . 1 . 2]" 1 1678 1 126 VAL MG2 1 130 MET HA . . 3.820 3.848 3.833 3.861 0.041 10 0 "[ . 1 . 2]" 1 1679 1 126 VAL MG2 1 130 MET HG2 . . 4.440 3.435 2.989 3.778 . 0 0 "[ . 1 . 2]" 1 1680 1 126 VAL MG2 1 133 VAL MG2 . . 4.090 2.710 2.424 3.146 . 0 0 "[ . 1 . 2]" 1 1681 1 127 VAL H 1 127 VAL HB . . 3.810 2.659 2.609 2.704 . 0 0 "[ . 1 . 2]" 1 1682 1 127 VAL H 1 127 VAL MG2 . . 3.810 2.415 2.323 2.532 . 0 0 "[ . 1 . 2]" 1 1683 1 127 VAL H 1 128 ASP H . . 3.250 2.107 2.067 2.147 . 0 0 "[ . 1 . 2]" 1 1684 1 127 VAL H 1 128 ASP HA . . 4.760 4.739 4.680 4.772 0.012 15 0 "[ . 1 . 2]" 1 1685 1 127 VAL H 1 128 ASP HB2 . . 5.190 4.860 4.800 4.934 . 0 0 "[ . 1 . 2]" 1 1686 1 127 VAL HA 1 127 VAL MG2 . . 3.710 2.518 2.467 2.556 . 0 0 "[ . 1 . 2]" 1 1687 1 127 VAL HB 1 128 ASP H . . 3.810 2.619 2.567 2.728 . 0 0 "[ . 1 . 2]" 1 1688 1 127 VAL HB 1 128 ASP HB2 . . 4.230 3.957 3.863 4.072 . 0 0 "[ . 1 . 2]" 1 1689 1 128 ASP H 1 128 ASP HB2 . . 3.570 2.865 2.842 2.899 . 0 0 "[ . 1 . 2]" 1 1690 1 128 ASP H 1 129 GLY H . . 4.340 4.355 4.332 4.369 0.029 12 0 "[ . 1 . 2]" 1 1691 1 128 ASP HA 1 129 GLY H . . 3.250 2.271 2.227 2.312 . 0 0 "[ . 1 . 2]" 1 1692 1 128 ASP HA 1 129 GLY HA2 . . 4.530 4.531 4.499 4.548 0.018 7 0 "[ . 1 . 2]" 1 1693 1 128 ASP HA 1 130 MET H . . 3.770 3.509 3.271 3.684 . 0 0 "[ . 1 . 2]" 1 1694 1 128 ASP HB2 1 129 GLY H . . 4.060 3.884 3.764 4.027 . 0 0 "[ . 1 . 2]" 1 1695 1 128 ASP HB2 1 129 GLY HA2 . . 5.100 5.096 5.052 5.112 0.012 20 0 "[ . 1 . 2]" 1 1696 1 129 GLY H 1 130 MET H . . 3.420 2.303 2.185 2.411 . 0 0 "[ . 1 . 2]" 1 1697 1 129 GLY H 1 130 MET HB2 . . 4.560 4.255 4.050 4.566 0.006 20 0 "[ . 1 . 2]" 1 1698 1 129 GLY H 1 130 MET HG2 . . 4.280 4.310 4.285 4.328 0.048 11 0 "[ . 1 . 2]" 1 1699 1 129 GLY H 1 131 ASP H . . 4.000 3.997 3.869 4.029 0.029 20 0 "[ . 1 . 2]" 1 1700 1 129 GLY H 1 132 VAL H . . 5.130 4.996 4.909 5.100 . 0 0 "[ . 1 . 2]" 1 1701 1 129 GLY HA2 1 131 ASP H . . 3.940 3.709 3.531 3.948 0.008 6 0 "[ . 1 . 2]" 1 1702 1 129 GLY HA2 1 131 ASP HB2 . . 4.430 4.206 4.037 4.431 0.001 6 0 "[ . 1 . 2]" 1 1703 1 129 GLY HA2 1 132 VAL H . . 3.670 3.291 3.135 3.512 . 0 0 "[ . 1 . 2]" 1 1704 1 129 GLY HA2 1 132 VAL HB . . 4.330 3.706 3.529 3.846 . 0 0 "[ . 1 . 2]" 1 1705 1 129 GLY HA2 1 132 VAL MG2 . . 3.870 2.703 2.537 2.872 . 0 0 "[ . 1 . 2]" 1 1706 1 129 GLY HA2 1 133 VAL H . . 4.910 4.643 4.547 4.790 . 0 0 "[ . 1 . 2]" 1 1707 1 130 MET H 1 130 MET HB2 . . 3.100 2.350 2.240 2.692 . 0 0 "[ . 1 . 2]" 1 1708 1 130 MET H 1 130 MET ME . . 4.700 4.449 4.046 4.732 0.032 6 0 "[ . 1 . 2]" 1 1709 1 130 MET H 1 130 MET HG2 . . 3.320 2.429 2.334 2.607 . 0 0 "[ . 1 . 2]" 1 1710 1 130 MET H 1 131 ASP HA . . 5.430 5.447 5.432 5.459 0.029 6 0 "[ . 1 . 2]" 1 1711 1 130 MET H 1 131 ASP HB2 . . 4.800 4.803 4.765 4.817 0.017 10 0 "[ . 1 . 2]" 1 1712 1 130 MET H 1 132 VAL H . . 4.320 4.204 4.142 4.278 . 0 0 "[ . 1 . 2]" 1 1713 1 130 MET H 1 132 VAL HB . . 5.500 5.509 5.472 5.531 0.031 18 0 "[ . 1 . 2]" 1 1714 1 130 MET H 1 133 VAL MG2 . . 4.480 4.290 4.138 4.365 . 0 0 "[ . 1 . 2]" 1 1715 1 130 MET HA 1 130 MET HG2 . . 3.770 2.699 2.557 2.936 . 0 0 "[ . 1 . 2]" 1 1716 1 130 MET HA 1 132 VAL H . . 4.230 4.101 4.052 4.181 . 0 0 "[ . 1 . 2]" 1 1717 1 130 MET HA 1 133 VAL H . . 3.900 3.214 3.121 3.271 . 0 0 "[ . 1 . 2]" 1 1718 1 130 MET HA 1 133 VAL HB . . 3.510 2.450 2.316 2.766 . 0 0 "[ . 1 . 2]" 1 1719 1 130 MET HA 1 133 VAL MG2 . . 3.760 2.730 2.522 2.839 . 0 0 "[ . 1 . 2]" 1 1720 1 130 MET HA 1 134 ASP H . . 4.300 3.995 3.879 4.147 . 0 0 "[ . 1 . 2]" 1 1721 1 130 MET HB2 1 131 ASP H . . 3.660 2.680 2.591 2.763 . 0 0 "[ . 1 . 2]" 1 1722 1 130 MET HB2 1 131 ASP HB2 . . 4.850 4.866 4.851 4.880 0.030 12 0 "[ . 1 . 2]" 1 1723 1 130 MET HB2 1 133 VAL H . . 5.500 5.511 5.469 5.529 0.029 10 0 "[ . 1 . 2]" 1 1724 1 130 MET HB2 1 133 VAL MG2 . . 5.280 5.221 5.036 5.287 0.007 20 0 "[ . 1 . 2]" 1 1725 1 130 MET ME 1 130 MET HG2 . . 4.010 3.062 2.545 3.455 . 0 0 "[ . 1 . 2]" 1 1726 1 131 ASP H 1 131 ASP HB2 . . 3.170 2.325 2.275 2.374 . 0 0 "[ . 1 . 2]" 1 1727 1 131 ASP H 1 132 VAL H . . 3.190 2.722 2.679 2.751 . 0 0 "[ . 1 . 2]" 1 1728 1 131 ASP H 1 132 VAL HA . . 5.500 5.416 5.374 5.441 . 0 0 "[ . 1 . 2]" 1 1729 1 131 ASP H 1 132 VAL HB . . 5.500 5.101 5.049 5.142 . 0 0 "[ . 1 . 2]" 1 1730 1 131 ASP H 1 132 VAL MG2 . . 4.250 4.039 3.891 4.136 . 0 0 "[ . 1 . 2]" 1 1731 1 131 ASP H 1 133 VAL H . . 4.540 4.215 4.149 4.267 . 0 0 "[ . 1 . 2]" 1 1732 1 131 ASP H 1 134 ASP H . . 5.140 4.744 4.665 4.810 . 0 0 "[ . 1 . 2]" 1 1733 1 131 ASP HA 1 133 VAL H . . 4.840 4.614 4.547 4.697 . 0 0 "[ . 1 . 2]" 1 1734 1 131 ASP HB2 1 132 VAL H . . 3.690 2.943 2.840 2.990 . 0 0 "[ . 1 . 2]" 1 1735 1 131 ASP HB2 1 132 VAL HA . . 4.840 4.760 4.678 4.839 . 0 0 "[ . 1 . 2]" 1 1736 1 132 VAL H 1 132 VAL HB . . 3.110 2.603 2.563 2.662 . 0 0 "[ . 1 . 2]" 1 1737 1 132 VAL H 1 132 VAL MG2 . . 3.290 2.194 2.132 2.243 . 0 0 "[ . 1 . 2]" 1 1738 1 132 VAL H 1 133 VAL H . . 3.300 2.456 2.424 2.486 . 0 0 "[ . 1 . 2]" 1 1739 1 132 VAL H 1 133 VAL HA . . 5.160 5.156 5.126 5.171 0.011 11 0 "[ . 1 . 2]" 1 1740 1 132 VAL H 1 133 VAL HB . . 4.880 4.574 4.433 4.774 . 0 0 "[ . 1 . 2]" 1 1741 1 132 VAL H 1 133 VAL MG2 . . 4.080 3.943 3.816 4.022 . 0 0 "[ . 1 . 2]" 1 1742 1 132 VAL H 1 134 ASP H . . 4.430 3.912 3.845 3.968 . 0 0 "[ . 1 . 2]" 1 1743 1 132 VAL H 1 135 LYS H . . 4.630 4.544 4.433 4.646 0.016 19 0 "[ . 1 . 2]" 1 1744 1 132 VAL H 1 135 LYS HB3 . . 5.040 5.063 5.048 5.076 0.036 5 0 "[ . 1 . 2]" 1 1745 1 132 VAL HA 1 132 VAL MG2 . . 3.530 2.508 2.471 2.560 . 0 0 "[ . 1 . 2]" 1 1746 1 132 VAL HA 1 134 ASP H . . 4.840 4.361 4.259 4.428 . 0 0 "[ . 1 . 2]" 1 1747 1 132 VAL HA 1 135 LYS H . . 3.730 3.184 3.033 3.313 . 0 0 "[ . 1 . 2]" 1 1748 1 132 VAL HA 1 135 LYS HB3 . . 3.550 2.366 2.317 2.410 . 0 0 "[ . 1 . 2]" 1 1749 1 132 VAL HA 1 136 ILE H . . 4.510 3.925 3.777 4.042 . 0 0 "[ . 1 . 2]" 1 1750 1 132 VAL HB 1 133 VAL H . . 3.780 2.622 2.560 2.701 . 0 0 "[ . 1 . 2]" 1 1751 1 132 VAL HB 1 134 ASP H . . 5.240 5.090 5.037 5.149 . 0 0 "[ . 1 . 2]" 1 1752 1 132 VAL HB 1 136 ILE MD . . 4.590 3.987 3.808 4.315 . 0 0 "[ . 1 . 2]" 1 1753 1 132 VAL MG2 1 135 LYS H . . 5.500 5.097 4.965 5.218 . 0 0 "[ . 1 . 2]" 1 1754 1 133 VAL H 1 133 VAL HB . . 3.570 2.523 2.434 2.667 . 0 0 "[ . 1 . 2]" 1 1755 1 133 VAL H 1 133 VAL MG2 . . 3.420 2.089 1.996 2.146 . 0 0 "[ . 1 . 2]" 1 1756 1 133 VAL H 1 134 ASP H . . 3.630 2.772 2.755 2.793 . 0 0 "[ . 1 . 2]" 1 1757 1 133 VAL H 1 136 ILE HB . . 5.500 5.252 4.983 5.529 0.029 20 0 "[ . 1 . 2]" 1 1758 1 133 VAL HA 1 133 VAL MG2 . . 3.520 2.416 2.365 2.514 . 0 0 "[ . 1 . 2]" 1 1759 1 133 VAL HA 1 135 LYS H . . 4.190 4.103 3.928 4.199 0.009 12 0 "[ . 1 . 2]" 1 1760 1 133 VAL HA 1 136 ILE H . . 3.800 3.588 3.402 3.703 . 0 0 "[ . 1 . 2]" 1 1761 1 133 VAL HA 1 136 ILE HB . . 3.880 2.830 2.572 3.115 . 0 0 "[ . 1 . 2]" 1 1762 1 133 VAL HA 1 136 ILE MD . . 3.820 2.646 2.194 3.155 . 0 0 "[ . 1 . 2]" 1 1763 1 133 VAL HA 1 136 ILE MG . . 4.710 4.064 3.749 4.336 . 0 0 "[ . 1 . 2]" 1 1764 1 133 VAL HB 1 134 ASP H . . 3.290 2.689 2.652 2.733 . 0 0 "[ . 1 . 2]" 1 1765 1 133 VAL HB 1 135 LYS H . . 4.920 4.912 4.828 4.940 0.020 7 0 "[ . 1 . 2]" 1 1766 1 133 VAL MG2 1 134 ASP H . . 3.920 3.929 3.859 3.951 0.031 3 0 "[ . 1 . 2]" 1 1767 1 133 VAL MG2 1 136 ILE MD . . 4.240 3.475 3.211 3.824 . 0 0 "[ . 1 . 2]" 1 1768 1 134 ASP H 1 134 ASP HB2 . . 3.710 2.520 2.441 2.784 . 0 0 "[ . 1 . 2]" 1 1769 1 134 ASP H 1 135 LYS H . . 3.510 2.579 2.556 2.601 . 0 0 "[ . 1 . 2]" 1 1770 1 134 ASP H 1 135 LYS HA . . 5.200 5.244 5.232 5.261 0.061 12 0 "[ . 1 . 2]" 1 1771 1 134 ASP H 1 135 LYS HB3 . . 5.060 4.825 4.750 4.881 . 0 0 "[ . 1 . 2]" 1 1772 1 134 ASP H 1 136 ILE H . . 4.590 4.324 4.229 4.401 . 0 0 "[ . 1 . 2]" 1 1773 1 134 ASP HA 1 137 LYS HB3 . . 4.860 4.626 4.351 4.862 0.002 20 0 "[ . 1 . 2]" 1 1774 1 134 ASP HA 1 137 LYS HE2 . . 3.540 2.466 2.126 3.537 . 0 0 "[ . 1 . 2]" 1 1775 1 134 ASP HB2 1 137 LYS HE2 . . 4.010 3.854 3.532 4.056 0.046 6 0 "[ . 1 . 2]" 1 1776 1 135 LYS H 1 135 LYS HB3 . . 3.140 2.490 2.437 2.554 . 0 0 "[ . 1 . 2]" 1 1777 1 135 LYS H 1 135 LYS HG3 . . 4.630 4.499 4.430 4.539 . 0 0 "[ . 1 . 2]" 1 1778 1 135 LYS H 1 136 ILE H . . 3.250 2.461 2.299 2.596 . 0 0 "[ . 1 . 2]" 1 1779 1 135 LYS H 1 136 ILE HB . . 4.860 4.351 4.179 4.724 . 0 0 "[ . 1 . 2]" 1 1780 1 135 LYS H 1 136 ILE QG . . 4.310 4.219 4.026 4.323 0.013 15 0 "[ . 1 . 2]" 1 1781 1 135 LYS H 1 137 LYS H . . 3.980 4.015 3.982 4.040 0.060 19 0 "[ . 1 . 2]" 1 1782 1 135 LYS H 1 137 LYS HG3 . . 5.500 5.383 4.634 5.516 0.016 6 0 "[ . 1 . 2]" 1 1783 1 135 LYS H 1 138 GLY H . . 4.950 4.864 4.741 4.991 0.041 9 0 "[ . 1 . 2]" 1 1784 1 135 LYS HA 1 135 LYS HD3 . . 4.150 2.889 2.278 4.178 0.028 10 0 "[ . 1 . 2]" 1 1785 1 135 LYS HA 1 135 LYS HG3 . . 3.640 3.079 2.419 3.301 . 0 0 "[ . 1 . 2]" 1 1786 1 135 LYS HA 1 137 LYS H . . 4.410 4.117 4.018 4.281 . 0 0 "[ . 1 . 2]" 1 1787 1 135 LYS HA 1 138 GLY H . . 3.980 3.319 3.153 3.452 . 0 0 "[ . 1 . 2]" 1 1788 1 135 LYS HB3 1 136 ILE H . . 3.250 2.594 2.423 2.732 . 0 0 "[ . 1 . 2]" 1 1789 1 135 LYS HB3 1 136 ILE HA . . 4.370 4.388 4.373 4.404 0.034 8 0 "[ . 1 . 2]" 1 1790 1 136 ILE H 1 136 ILE HB . . 3.100 2.340 2.213 2.446 . 0 0 "[ . 1 . 2]" 1 1791 1 136 ILE H 1 136 ILE MD . . 4.120 3.488 3.306 3.575 . 0 0 "[ . 1 . 2]" 1 1792 1 136 ILE H 1 136 ILE QG . . 3.430 2.248 2.176 2.349 . 0 0 "[ . 1 . 2]" 1 1793 1 136 ILE H 1 136 ILE MG . . 3.870 3.756 3.692 3.803 . 0 0 "[ . 1 . 2]" 1 1794 1 136 ILE H 1 138 GLY H . . 4.130 4.132 4.022 4.159 0.029 10 0 "[ . 1 . 2]" 1 1795 1 136 ILE HA 1 136 ILE MD . . 3.850 3.823 3.790 3.851 0.001 6 0 "[ . 1 . 2]" 1 1796 1 136 ILE HA 1 136 ILE QG . . 3.180 2.284 2.219 2.354 . 0 0 "[ . 1 . 2]" 1 1797 1 136 ILE HA 1 136 ILE MG . . 3.650 2.607 2.453 2.713 . 0 0 "[ . 1 . 2]" 1 1798 1 136 ILE HA 1 138 GLY H . . 4.270 4.091 3.894 4.272 0.002 6 0 "[ . 1 . 2]" 1 1799 1 136 ILE HA 1 139 VAL H . . 4.330 3.900 3.510 4.163 . 0 0 "[ . 1 . 2]" 1 1800 1 136 ILE HA 1 139 VAL MG2 . . 4.400 2.760 2.282 4.187 . 0 0 "[ . 1 . 2]" 1 1801 1 136 ILE HA 1 155 VAL MG2 . . 4.420 3.218 2.717 3.845 . 0 0 "[ . 1 . 2]" 1 1802 1 136 ILE MD 1 136 ILE MG . . 3.630 2.100 2.062 2.147 . 0 0 "[ . 1 . 2]" 1 1803 1 136 ILE MD 1 155 VAL HA . . 4.790 4.803 4.773 4.832 0.042 10 0 "[ . 1 . 2]" 1 1804 1 136 ILE MD 1 155 VAL MG2 . . 4.700 3.698 3.575 3.929 . 0 0 "[ . 1 . 2]" 1 1805 1 136 ILE QG 1 137 LYS H . . 5.240 4.344 4.246 4.411 . 0 0 "[ . 1 . 2]" 1 1806 1 136 ILE QG 1 155 VAL MG2 . . 4.250 2.747 2.433 3.376 . 0 0 "[ . 1 . 2]" 1 1807 1 136 ILE MG 1 137 LYS H . . 4.170 3.445 3.214 3.791 . 0 0 "[ . 1 . 2]" 1 1808 1 136 ILE MG 1 155 VAL MG2 . . 4.420 2.342 2.193 2.550 . 0 0 "[ . 1 . 2]" 1 1809 1 137 LYS H 1 137 LYS HB3 . . 2.950 2.843 2.677 2.919 . 0 0 "[ . 1 . 2]" 1 1810 1 137 LYS H 1 137 LYS HG3 . . 3.880 2.895 2.297 3.071 . 0 0 "[ . 1 . 2]" 1 1811 1 137 LYS H 1 138 GLY H . . 3.480 2.401 2.322 2.568 . 0 0 "[ . 1 . 2]" 1 1812 1 137 LYS H 1 139 VAL H . . 4.110 4.161 4.147 4.175 0.065 5 0 "[ . 1 . 2]" 1 1813 1 137 LYS HA 1 137 LYS HG3 . . 4.200 3.689 3.638 3.724 . 0 0 "[ . 1 . 2]" 1 1814 1 137 LYS HA 1 139 VAL H . . 4.370 4.340 4.042 4.406 0.036 9 0 "[ . 1 . 2]" 1 1815 1 137 LYS HB3 1 137 LYS HE2 . . 4.860 4.505 4.370 4.871 0.011 6 0 "[ . 1 . 2]" 1 1816 1 137 LYS HB3 1 138 GLY H . . 4.570 4.341 4.250 4.411 . 0 0 "[ . 1 . 2]" 1 1817 1 137 LYS HE2 1 137 LYS HG3 . . 3.940 3.147 2.762 3.818 . 0 0 "[ . 1 . 2]" 1 1818 1 137 LYS HG3 1 138 GLY H . . 3.620 2.925 2.717 3.148 . 0 0 "[ . 1 . 2]" 1 1819 1 137 LYS HG3 1 138 GLY HA2 . . 4.000 3.795 3.561 4.032 0.032 1 0 "[ . 1 . 2]" 1 1820 1 138 GLY H 1 139 VAL H . . 2.950 2.267 2.123 2.514 . 0 0 "[ . 1 . 2]" 1 1821 1 138 GLY H 1 139 VAL HA . . 4.970 4.836 4.597 4.980 0.010 6 0 "[ . 1 . 2]" 1 1822 1 138 GLY H 1 139 VAL MG2 . . 4.380 3.565 3.353 3.822 . 0 0 "[ . 1 . 2]" 1 1823 1 138 GLY H 1 140 ALA H . . 4.740 4.771 4.756 4.800 0.060 9 0 "[ . 1 . 2]" 1 1824 1 139 VAL H 1 139 VAL HB . . 3.730 3.511 2.479 3.725 . 0 0 "[ . 1 . 2]" 1 1825 1 139 VAL H 1 139 VAL MG2 . . 3.070 2.079 1.990 2.443 . 0 0 "[ . 1 . 2]" 1 1826 1 139 VAL H 1 140 ALA H . . 3.470 2.982 2.840 3.071 . 0 0 "[ . 1 . 2]" 1 1827 1 139 VAL HA 1 139 VAL MG2 . . 3.720 3.124 2.299 3.278 . 0 0 "[ . 1 . 2]" 1 1828 1 139 VAL HA 1 140 ALA MB . . 4.310 4.221 4.074 4.320 0.010 14 0 "[ . 1 . 2]" 1 1829 1 139 VAL HB 1 140 ALA H . . 3.540 3.180 2.335 3.568 0.028 2 0 "[ . 1 . 2]" 1 1830 1 139 VAL HB 1 140 ALA MB . . 3.880 3.612 3.273 4.016 0.136 2 0 "[ . 1 . 2]" 1 1831 1 139 VAL MG2 1 140 ALA H . . 3.860 2.337 1.895 3.891 0.031 5 0 "[ . 1 . 2]" 1 1832 1 139 VAL MG2 1 140 ALA MB . . 4.830 3.633 3.002 4.582 . 0 0 "[ . 1 . 2]" 1 1833 1 140 ALA H 1 140 ALA MB . . 3.100 2.928 2.775 3.076 . 0 0 "[ . 1 . 2]" 1 1834 1 140 ALA HA 1 141 THR H . . 2.760 2.316 2.249 2.418 . 0 0 "[ . 1 . 2]" 1 1835 1 140 ALA HA 1 141 THR MG . . 4.220 3.881 3.570 4.073 . 0 0 "[ . 1 . 2]" 1 1836 1 140 ALA MB 1 141 THR H . . 3.370 2.637 2.360 2.881 . 0 0 "[ . 1 . 2]" 1 1837 1 141 THR H 1 141 THR MG . . 3.940 3.158 2.863 3.356 . 0 0 "[ . 1 . 2]" 1 1838 1 141 THR H 1 142 GLY H . . 4.460 4.460 4.402 4.503 0.043 11 0 "[ . 1 . 2]" 1 1839 1 141 THR H 1 152 LYS HG3 . . 4.500 3.835 3.458 4.466 . 0 0 "[ . 1 . 2]" 1 1840 1 141 THR HA 1 142 GLY H . . 3.420 2.215 2.098 2.298 . 0 0 "[ . 1 . 2]" 1 1841 1 141 THR HA 1 151 PRO HA . . 3.560 2.247 2.051 2.661 . 0 0 "[ . 1 . 2]" 1 1842 1 141 THR HA 1 152 LYS H . . 3.460 2.333 2.212 2.429 . 0 0 "[ . 1 . 2]" 1 1843 1 141 THR HA 1 152 LYS HA . . 5.280 4.793 4.358 5.090 . 0 0 "[ . 1 . 2]" 1 1844 1 141 THR HA 1 152 LYS HG3 . . 4.110 3.571 3.419 3.724 . 0 0 "[ . 1 . 2]" 1 1845 1 141 THR HB 1 142 GLY H . . 3.310 2.701 2.576 2.870 . 0 0 "[ . 1 . 2]" 1 1846 1 141 THR HB 1 142 GLY HA2 . . 4.030 3.842 3.795 3.891 . 0 0 "[ . 1 . 2]" 1 1847 1 141 THR HB 1 143 ARG H . . 5.470 5.280 4.652 5.511 0.041 11 0 "[ . 1 . 2]" 1 1848 1 141 THR HB 1 151 PRO HA . . 4.540 4.051 3.930 4.187 . 0 0 "[ . 1 . 2]" 1 1849 1 141 THR HB 1 152 LYS H . . 4.690 4.702 4.689 4.720 0.030 2 0 "[ . 1 . 2]" 1 1850 1 141 THR MG 1 142 GLY H . . 4.040 3.610 3.461 3.766 . 0 0 "[ . 1 . 2]" 1 1851 1 141 THR MG 1 142 GLY HA2 . . 5.170 5.192 5.173 5.207 0.037 5 0 "[ . 1 . 2]" 1 1852 1 141 THR MG 1 151 PRO HA . . 3.970 2.709 2.343 3.206 . 0 0 "[ . 1 . 2]" 1 1853 1 141 THR MG 1 152 LYS H . . 4.100 3.971 3.681 4.103 0.003 20 0 "[ . 1 . 2]" 1 1854 1 142 GLY H 1 143 ARG H . . 4.160 4.029 3.808 4.201 0.041 7 0 "[ . 1 . 2]" 1 1855 1 142 GLY H 1 151 PRO HA . . 3.930 3.344 3.090 3.687 . 0 0 "[ . 1 . 2]" 1 1856 1 142 GLY H 1 152 LYS H . . 3.810 3.127 3.001 3.379 . 0 0 "[ . 1 . 2]" 1 1857 1 142 GLY H 1 152 LYS HG3 . . 4.370 4.388 4.316 4.431 0.061 7 0 "[ . 1 . 2]" 1 1858 1 142 GLY HA2 1 143 ARG H . . 3.450 2.117 1.958 2.176 . 0 0 "[ . 1 . 2]" 1 1859 1 142 GLY HA2 1 143 ARG HB3 . . 4.820 4.609 4.441 4.876 0.056 7 0 "[ . 1 . 2]" 1 1860 1 142 GLY HA2 1 143 ARG HG3 . . 5.160 5.188 5.164 5.232 0.072 7 0 "[ . 1 . 2]" 1 1861 1 143 ARG H 1 143 ARG HB3 . . 3.350 2.693 2.563 2.910 . 0 0 "[ . 1 . 2]" 1 1862 1 143 ARG H 1 143 ARG HG3 . . 4.050 3.291 3.090 3.863 . 0 0 "[ . 1 . 2]" 1 1863 1 143 ARG H 1 144 SER H . . 4.770 4.668 4.622 4.688 . 0 0 "[ . 1 . 2]" 1 1864 1 143 ARG HA 1 143 ARG HG3 . . 3.910 3.532 2.408 3.860 . 0 0 "[ . 1 . 2]" 1 1865 1 143 ARG HA 1 144 SER H . . 3.130 2.230 2.148 2.336 . 0 0 "[ . 1 . 2]" 1 1866 1 143 ARG HA 1 144 SER HB3 . . 4.250 4.211 4.043 4.272 0.022 6 0 "[ . 1 . 2]" 1 1867 1 143 ARG HA 1 148 GLN HG2 . . 4.880 4.471 4.107 4.691 . 0 0 "[ . 1 . 2]" 1 1868 1 143 ARG HA 1 149 ASP H . . 4.220 3.202 2.792 4.115 . 0 0 "[ . 1 . 2]" 1 1869 1 143 ARG HB3 1 144 SER H . . 4.170 3.790 3.484 3.908 . 0 0 "[ . 1 . 2]" 1 1870 1 143 ARG QD 1 148 GLN HG2 . . 4.190 2.610 2.309 4.072 . 0 0 "[ . 1 . 2]" 1 1871 1 143 ARG HG3 1 144 SER H . . 4.290 4.040 3.461 4.296 0.006 5 0 "[ . 1 . 2]" 1 1872 1 143 ARG HG3 1 148 GLN HG2 . . 4.030 3.812 2.466 4.080 0.050 5 0 "[ . 1 . 2]" 1 1873 1 143 ARG HG3 1 149 ASP H . . 5.060 4.677 2.831 5.121 0.061 6 0 "[ . 1 . 2]" 1 1874 1 144 SER H 1 144 SER HB3 . . 3.750 2.731 2.291 2.961 . 0 0 "[ . 1 . 2]" 1 1875 1 144 SER H 1 147 HIS H . . 4.680 3.709 3.242 3.954 . 0 0 "[ . 1 . 2]" 1 1876 1 144 SER H 1 147 HIS HB2 . . 5.500 4.506 3.753 4.989 . 0 0 "[ . 1 . 2]" 1 1877 1 144 SER H 1 147 HIS HB3 . . 5.500 5.151 4.651 5.470 . 0 0 "[ . 1 . 2]" 1 1878 1 144 SER H 1 148 GLN HG2 . . 4.500 3.992 3.436 4.418 . 0 0 "[ . 1 . 2]" 1 1879 1 144 SER H 1 150 VAL MG2 . . 4.270 2.666 2.435 3.330 . 0 0 "[ . 1 . 2]" 1 1880 1 144 SER HB3 1 147 HIS H . . 4.510 3.743 2.458 4.379 . 0 0 "[ . 1 . 2]" 1 1881 1 144 SER HB3 1 150 VAL HB . . 4.960 4.951 4.790 4.988 0.028 17 0 "[ . 1 . 2]" 1 1882 1 144 SER HB3 1 150 VAL MG2 . . 3.970 2.515 2.357 2.709 . 0 0 "[ . 1 . 2]" 1 1883 1 145 GLY HA2 1 147 HIS H . . 5.140 4.763 3.788 4.977 . 0 0 "[ . 1 . 2]" 1 1884 1 146 MET H 1 147 HIS H . . 3.700 2.319 1.977 3.024 . 0 0 "[ . 1 . 2]" 1 1885 1 147 HIS H 1 147 HIS HB2 . . 3.880 2.716 2.473 2.839 . 0 0 "[ . 1 . 2]" 1 1886 1 147 HIS H 1 147 HIS HD2 . . 3.580 3.490 2.793 3.610 0.030 20 0 "[ . 1 . 2]" 1 1887 1 147 HIS H 1 148 GLN H . . 4.200 4.236 4.077 4.304 0.104 20 0 "[ . 1 . 2]" 1 1888 1 147 HIS HA 1 148 GLN H . . 3.100 2.140 2.078 2.192 . 0 0 "[ . 1 . 2]" 1 1889 1 147 HIS HB2 1 150 VAL MG2 . . 4.130 3.368 2.590 3.853 . 0 0 "[ . 1 . 2]" 1 1890 1 147 HIS HB3 1 148 GLN H . . 3.690 3.258 2.405 3.675 . 0 0 "[ . 1 . 2]" 1 1891 1 147 HIS HB3 1 150 VAL MG2 . . 4.400 3.867 3.089 4.399 . 0 0 "[ . 1 . 2]" 1 1892 1 148 GLN H 1 148 GLN HB2 . . 3.190 2.528 2.407 2.781 . 0 0 "[ . 1 . 2]" 1 1893 1 148 GLN H 1 148 GLN HG2 . . 4.170 3.775 3.605 4.026 . 0 0 "[ . 1 . 2]" 1 1894 1 148 GLN HA 1 148 GLN HG2 . . 3.440 2.458 2.363 2.562 . 0 0 "[ . 1 . 2]" 1 1895 1 148 GLN HB2 1 149 ASP H . . 3.830 3.741 3.541 3.836 0.006 9 0 "[ . 1 . 2]" 1 1896 1 148 GLN QE 1 148 GLN HG2 . . 3.400 3.098 2.500 3.391 . 0 0 "[ . 1 . 2]" 1 1897 1 148 GLN HE22 1 148 GLN HG2 . . 4.050 3.941 3.646 4.089 0.039 20 0 "[ . 1 . 2]" 1 1898 1 148 GLN HG2 1 149 ASP H . . 4.380 4.018 3.705 4.292 . 0 0 "[ . 1 . 2]" 1 1899 1 149 ASP H 1 150 VAL H . . 3.620 2.930 2.788 3.274 . 0 0 "[ . 1 . 2]" 1 1900 1 150 VAL H 1 150 VAL HB . . 4.070 3.778 3.631 3.887 . 0 0 "[ . 1 . 2]" 1 1901 1 150 VAL H 1 150 VAL MG2 . . 3.950 2.207 2.008 2.424 . 0 0 "[ . 1 . 2]" 1 1902 1 150 VAL HA 1 151 PRO QD . . 3.160 2.244 2.164 2.337 . 0 0 "[ . 1 . 2]" 1 1903 1 150 VAL HA 1 151 PRO HG2 . . 4.650 4.619 4.542 4.666 0.016 18 0 "[ . 1 . 2]" 1 1904 1 150 VAL HB 1 151 PRO HD2 . . 4.350 2.197 2.090 2.349 . 0 0 "[ . 1 . 2]" 1 1905 1 150 VAL HB 1 151 PRO QD . . 3.790 2.180 2.076 2.328 . 0 0 "[ . 1 . 2]" 1 1906 1 150 VAL HB 1 151 PRO HD3 . . 4.350 3.669 3.562 3.790 . 0 0 "[ . 1 . 2]" 1 1907 1 150 VAL HB 1 151 PRO HG2 . . 4.170 3.836 3.519 4.088 . 0 0 "[ . 1 . 2]" 1 1908 1 151 PRO HA 1 152 LYS H . . 3.220 2.230 2.143 2.289 . 0 0 "[ . 1 . 2]" 1 1909 1 151 PRO HA 1 152 LYS HA . . 4.500 4.448 4.411 4.485 . 0 0 "[ . 1 . 2]" 1 1910 1 151 PRO HA 1 152 LYS HG3 . . 4.510 4.295 4.078 4.413 . 0 0 "[ . 1 . 2]" 1 1911 1 151 PRO HA 1 153 GLU H . . 4.360 3.943 3.693 4.151 . 0 0 "[ . 1 . 2]" 1 1912 1 151 PRO HG2 1 152 LYS H . . 4.880 4.875 4.801 4.906 0.026 5 0 "[ . 1 . 2]" 1 1913 1 152 LYS H 1 152 LYS HB3 . . 3.720 2.664 2.607 2.739 . 0 0 "[ . 1 . 2]" 1 1914 1 152 LYS H 1 152 LYS HD3 . . 4.360 4.191 4.094 4.265 . 0 0 "[ . 1 . 2]" 1 1915 1 152 LYS H 1 152 LYS HE2 . . 5.310 5.304 5.268 5.317 0.007 9 0 "[ . 1 . 2]" 1 1916 1 152 LYS H 1 152 LYS HG3 . . 3.380 2.205 2.047 2.312 . 0 0 "[ . 1 . 2]" 1 1917 1 152 LYS H 1 153 GLU H . . 3.220 2.458 2.265 2.565 . 0 0 "[ . 1 . 2]" 1 1918 1 152 LYS HA 1 152 LYS HB3 . . 2.880 2.415 2.383 2.447 . 0 0 "[ . 1 . 2]" 1 1919 1 152 LYS HA 1 152 LYS HD3 . . 4.050 4.054 4.019 4.064 0.014 5 0 "[ . 1 . 2]" 1 1920 1 152 LYS HA 1 152 LYS HE2 . . 4.910 4.319 4.077 4.527 . 0 0 "[ . 1 . 2]" 1 1921 1 152 LYS HA 1 152 LYS HG3 . . 3.690 3.696 3.664 3.711 0.021 16 0 "[ . 1 . 2]" 1 1922 1 152 LYS HB3 1 152 LYS HE2 . . 3.600 3.534 3.459 3.608 0.008 16 0 "[ . 1 . 2]" 1 1923 1 152 LYS HB3 1 153 GLU H . . 4.070 4.102 4.094 4.108 0.038 2 0 "[ . 1 . 2]" 1 1924 1 152 LYS HD3 1 153 GLU H . . 3.960 3.102 2.957 3.249 . 0 0 "[ . 1 . 2]" 1 1925 1 152 LYS HE2 1 152 LYS HG3 . . 3.790 3.796 3.791 3.800 0.010 10 0 "[ . 1 . 2]" 1 1926 1 152 LYS HG3 1 153 GLU H . . 4.170 2.616 2.512 2.790 . 0 0 "[ . 1 . 2]" 1 1927 1 152 LYS HG3 1 153 GLU HA . . 4.830 4.810 4.718 4.852 0.022 7 0 "[ . 1 . 2]" 1 1928 1 153 GLU H 1 153 GLU HB2 . . 2.970 2.422 2.217 2.592 . 0 0 "[ . 1 . 2]" 1 1929 1 153 GLU H 1 153 GLU HG2 . . 3.560 3.418 3.069 3.584 0.024 15 0 "[ . 1 . 2]" 1 1930 1 153 GLU HA 1 153 GLU HG2 . . 3.770 2.426 2.358 2.498 . 0 0 "[ . 1 . 2]" 1 1931 1 153 GLU HA 1 154 ASP H . . 2.720 2.319 2.197 2.428 . 0 0 "[ . 1 . 2]" 1 1932 1 153 GLU HB2 1 154 ASP H . . 4.390 3.926 3.696 4.233 . 0 0 "[ . 1 . 2]" 1 1933 1 153 GLU HG2 1 154 ASP H . . 4.270 4.223 4.035 4.333 0.063 12 0 "[ . 1 . 2]" 1 1934 1 154 ASP H 1 154 ASP HB2 . . 3.670 3.545 2.592 3.682 0.012 12 0 "[ . 1 . 2]" 1 1935 1 154 ASP H 1 155 VAL H . . 4.420 4.397 4.332 4.458 0.038 11 0 "[ . 1 . 2]" 1 1936 1 154 ASP H 1 155 VAL MG2 . . 4.310 4.338 4.315 4.366 0.056 3 0 "[ . 1 . 2]" 1 1937 1 154 ASP HA 1 155 VAL H . . 3.280 2.113 2.021 2.145 . 0 0 "[ . 1 . 2]" 1 1938 1 154 ASP HA 1 155 VAL MG2 . . 4.370 3.738 3.605 3.900 . 0 0 "[ . 1 . 2]" 1 1939 1 154 ASP HB2 1 155 VAL H . . 3.950 3.656 3.447 4.025 0.075 20 0 "[ . 1 . 2]" 1 1940 1 154 ASP HB2 1 156 ILE MD . . 5.080 3.932 2.239 4.883 . 0 0 "[ . 1 . 2]" 1 1941 1 155 VAL H 1 155 VAL HB . . 3.380 2.616 2.498 2.798 . 0 0 "[ . 1 . 2]" 1 1942 1 155 VAL H 1 155 VAL MG2 . . 4.000 2.673 2.426 2.945 . 0 0 "[ . 1 . 2]" 1 1943 1 155 VAL H 1 156 ILE H . . 4.550 4.103 3.811 4.227 . 0 0 "[ . 1 . 2]" 1 1944 1 155 VAL HA 1 156 ILE H . . 3.200 2.126 2.081 2.175 . 0 0 "[ . 1 . 2]" 1 1945 1 155 VAL HB 1 156 ILE H . . 4.360 4.401 4.370 4.431 0.071 10 0 "[ . 1 . 2]" 1 1946 1 155 VAL MG2 1 156 ILE H . . 4.240 4.214 4.144 4.270 0.030 20 0 "[ . 1 . 2]" 1 1947 1 156 ILE H 1 156 ILE HB . . 3.950 3.768 3.135 3.961 0.011 20 0 "[ . 1 . 2]" 1 1948 1 156 ILE H 1 157 ILE H . . 4.590 4.412 4.338 4.499 . 0 0 "[ . 1 . 2]" 1 1949 1 156 ILE HA 1 156 ILE QG . . 3.500 3.256 2.944 3.412 . 0 0 "[ . 1 . 2]" 1 1950 1 156 ILE HA 1 157 ILE H . . 3.250 2.070 2.019 2.129 . 0 0 "[ . 1 . 2]" 1 1951 1 156 ILE HA 1 157 ILE HA . . 4.560 4.411 4.375 4.460 . 0 0 "[ . 1 . 2]" 1 1952 1 156 ILE HB 1 157 ILE H . . 4.220 2.811 2.643 3.129 . 0 0 "[ . 1 . 2]" 1 1953 1 156 ILE HB 1 157 ILE HB . . 5.120 5.008 4.770 5.181 0.061 6 0 "[ . 1 . 2]" 1 1954 1 156 ILE MD 1 157 ILE H . . 4.490 4.492 4.335 4.581 0.091 19 0 "[ . 1 . 2]" 1 1955 1 156 ILE QG 1 157 ILE H . . 4.330 3.459 3.113 4.418 0.088 1 0 "[ . 1 . 2]" 1 1956 1 156 ILE MG 1 157 ILE H . . 3.900 3.550 1.852 3.968 0.068 7 0 "[ . 1 . 2]" 1 1957 1 157 ILE H 1 157 ILE HB . . 3.440 2.517 2.352 2.632 . 0 0 "[ . 1 . 2]" 1 1958 1 157 ILE H 1 157 ILE MD . . 4.580 3.884 3.783 4.035 . 0 0 "[ . 1 . 2]" 1 1959 1 157 ILE H 1 157 ILE QG . . 4.410 2.449 2.350 2.648 . 0 0 "[ . 1 . 2]" 1 1960 1 157 ILE H 1 157 ILE MG . . 4.280 3.828 3.776 3.865 . 0 0 "[ . 1 . 2]" 1 1961 1 157 ILE H 1 158 GLU H . . 4.600 4.269 4.222 4.384 . 0 0 "[ . 1 . 2]" 1 1962 1 157 ILE HA 1 157 ILE QG . . 3.620 2.462 2.391 2.506 . 0 0 "[ . 1 . 2]" 1 1963 1 157 ILE HA 1 158 GLU H . . 3.480 2.206 2.155 2.277 . 0 0 "[ . 1 . 2]" 1 1964 1 157 ILE HA 1 158 GLU HA . . 4.620 4.523 4.503 4.549 . 0 0 "[ . 1 . 2]" 1 1965 1 157 ILE HA 1 159 SER H . . 4.200 3.697 3.512 3.851 . 0 0 "[ . 1 . 2]" 1 1966 1 157 ILE MD 1 157 ILE MG . . 3.950 2.080 2.054 2.091 . 0 0 "[ . 1 . 2]" 1 1967 1 157 ILE QG 1 158 GLU H . . 4.770 4.414 4.357 4.468 . 0 0 "[ . 1 . 2]" 1 1968 1 157 ILE MG 1 158 GLU H . . 3.880 3.249 3.132 3.384 . 0 0 "[ . 1 . 2]" 1 1969 1 157 ILE MG 1 158 GLU HA . . 5.390 4.434 4.242 4.535 . 0 0 "[ . 1 . 2]" 1 1970 1 157 ILE MG 1 159 SER H . . 3.710 2.834 2.603 3.019 . 0 0 "[ . 1 . 2]" 1 1971 1 157 ILE MG 1 159 SER HA . . 4.410 3.596 3.340 3.821 . 0 0 "[ . 1 . 2]" 1 1972 1 157 ILE MG 1 160 VAL MG2 . . 4.030 2.072 1.968 2.202 . 0 0 "[ . 1 . 2]" 1 1973 1 158 GLU H 1 158 GLU HB2 . . 3.260 2.442 2.284 2.479 . 0 0 "[ . 1 . 2]" 1 1974 1 158 GLU H 1 159 SER H . . 3.010 2.377 2.317 2.441 . 0 0 "[ . 1 . 2]" 1 1975 1 158 GLU HA 1 158 GLU HG2 . . 2.950 2.501 2.426 2.758 . 0 0 "[ . 1 . 2]" 1 1976 1 158 GLU HB2 1 159 SER H . . 3.000 2.751 2.624 2.946 . 0 0 "[ . 1 . 2]" 1 1977 1 158 GLU HB2 1 159 SER HB3 . . 4.890 4.457 4.174 4.706 . 0 0 "[ . 1 . 2]" 1 1978 1 159 SER H 1 159 SER HB3 . . 3.470 3.210 3.082 3.473 0.003 12 0 "[ . 1 . 2]" 1 1979 1 159 SER H 1 160 VAL MG2 . . 4.540 4.156 4.068 4.229 . 0 0 "[ . 1 . 2]" 1 1980 1 159 SER HA 1 160 VAL H . . 2.930 2.411 2.359 2.513 . 0 0 "[ . 1 . 2]" 1 1981 1 159 SER HA 1 160 VAL MG2 . . 3.660 3.334 3.199 3.435 . 0 0 "[ . 1 . 2]" 1 1982 1 159 SER HB3 1 160 VAL H . . 3.990 3.374 3.167 3.814 . 0 0 "[ . 1 . 2]" 1 1983 1 160 VAL H 1 160 VAL HB . . 3.160 2.863 2.737 2.963 . 0 0 "[ . 1 . 2]" 1 1984 1 160 VAL H 1 160 VAL MG2 . . 3.660 2.950 2.844 3.021 . 0 0 "[ . 1 . 2]" 1 1985 1 160 VAL H 1 161 THR H . . 4.400 4.358 4.294 4.406 0.006 1 0 "[ . 1 . 2]" 1 1986 1 160 VAL HA 1 161 THR H . . 3.080 2.176 2.160 2.188 . 0 0 "[ . 1 . 2]" 1 1987 1 160 VAL HA 1 161 THR HB . . 4.620 4.627 4.622 4.630 0.010 1 0 "[ . 1 . 2]" 1 1988 1 160 VAL HB 1 161 THR H . . 3.980 3.987 3.927 4.007 0.027 14 0 "[ . 1 . 2]" 1 1989 1 160 VAL MG2 1 161 THR H . . 4.200 4.021 3.960 4.074 . 0 0 "[ . 1 . 2]" 1 1990 1 161 THR H 1 161 THR HB . . 3.420 2.792 2.741 2.830 . 0 0 "[ . 1 . 2]" 1 1991 1 161 THR H 1 161 THR MG . . 4.330 3.982 3.957 4.000 . 0 0 "[ . 1 . 2]" 1 1992 1 161 THR H 1 162 VAL H . . 4.440 4.343 4.296 4.395 . 0 0 "[ . 1 . 2]" 1 1993 1 161 THR H 1 162 VAL HA . . 4.910 4.834 4.803 4.879 . 0 0 "[ . 1 . 2]" 1 1994 1 161 THR HA 1 162 VAL H . . 2.980 2.211 2.182 2.241 . 0 0 "[ . 1 . 2]" 1 1995 1 161 THR HB 1 162 VAL H . . 4.430 4.181 4.109 4.252 . 0 0 "[ . 1 . 2]" 1 1996 1 161 THR MG 1 162 VAL H . . 3.860 2.784 2.658 2.902 . 0 0 "[ . 1 . 2]" 1 1997 1 162 VAL H 1 162 VAL HB . . 3.270 2.573 2.519 2.593 . 0 0 "[ . 1 . 2]" 1 1998 1 162 VAL H 1 162 VAL MG2 . . 3.890 2.482 2.438 2.529 . 0 0 "[ . 1 . 2]" 1 1999 1 162 VAL H 1 163 SER H . . 4.510 4.474 4.430 4.511 0.001 4 0 "[ . 1 . 2]" 1 2000 1 162 VAL HA 1 163 SER H . . 2.900 2.132 2.106 2.153 . 0 0 "[ . 1 . 2]" 1 2001 1 162 VAL MG2 1 163 SER H . . 4.390 4.075 3.996 4.135 . 0 0 "[ . 1 . 2]" 1 2002 1 163 SER H 1 163 SER HB3 . . 3.320 2.684 2.626 2.719 . 0 0 "[ . 1 . 2]" 1 2003 1 163 SER H 1 164 GLU H . . 4.710 4.537 4.495 4.563 . 0 0 "[ . 1 . 2]" 1 2004 1 163 SER HA 1 164 GLU HG2 . . 4.240 4.199 3.792 4.267 0.027 7 0 "[ . 1 . 2]" 1 2005 1 163 SER HB3 1 164 GLU H . . 3.980 3.779 3.718 3.986 0.006 5 0 "[ . 1 . 2]" 1 2006 1 164 GLU H 1 164 GLU HB2 . . 3.030 2.644 2.453 2.827 . 0 0 "[ . 1 . 2]" 1 2007 1 164 GLU H 1 164 GLU HG2 . . 3.920 3.333 2.312 3.772 . 0 0 "[ . 1 . 2]" 1 2008 1 164 GLU HA 1 164 GLU HG2 . . 3.960 2.674 2.494 3.093 . 0 0 "[ . 1 . 2]" 1 stop_ save_
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