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NMR Restraints Grid |
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Result table
(Save to zip file containing files for each block)
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
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399194 |
1tvi ![]() ![]() |
6256 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1tvi 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 1484 _Distance_constraint_stats_list.Viol_count 765 _Distance_constraint_stats_list.Viol_total 637.170 _Distance_constraint_stats_list.Viol_max 0.518 _Distance_constraint_stats_list.Viol_rms 0.0095 _Distance_constraint_stats_list.Viol_average_all_restraints 0.0011 _Distance_constraint_stats_list.Viol_average_violations_only 0.0416 _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 23 MET 0.231 0.082 12 0 "[ . 1 . 2]" 1 24 ILE 0.223 0.079 9 0 "[ . 1 . 2]" 1 25 ARG 0.023 0.015 10 0 "[ . 1 . 2]" 1 26 ILE 0.126 0.053 20 0 "[ . 1 . 2]" 1 27 LEU 0.137 0.125 4 0 "[ . 1 . 2]" 1 28 GLY 0.068 0.038 7 0 "[ . 1 . 2]" 1 29 GLU 0.869 0.134 11 0 "[ . 1 . 2]" 1 30 GLY 0.800 0.134 11 0 "[ . 1 . 2]" 1 31 LYS 0.146 0.062 18 0 "[ . 1 . 2]" 1 32 GLY 0.146 0.062 18 0 "[ . 1 . 2]" 1 33 SER 0.000 0.000 . 0 "[ . 1 . 2]" 1 34 LYS 2.316 0.284 8 0 "[ . 1 . 2]" 1 35 LEU 1.332 0.284 8 0 "[ . 1 . 2]" 1 36 LEU 0.000 0.000 . 0 "[ . 1 . 2]" 1 37 GLU 0.631 0.031 7 0 "[ . 1 . 2]" 1 38 ASN 1.637 0.127 18 0 "[ . 1 . 2]" 1 39 LEU 0.073 0.030 15 0 "[ . 1 . 2]" 1 40 LYS 0.435 0.114 17 0 "[ . 1 . 2]" 1 41 GLU 0.000 0.000 . 0 "[ . 1 . 2]" 1 42 LYS 0.283 0.091 7 0 "[ . 1 . 2]" 1 43 LEU 0.000 0.000 . 0 "[ . 1 . 2]" 1 44 GLU 0.919 0.115 17 0 "[ . 1 . 2]" 1 45 GLU 0.780 0.111 15 0 "[ . 1 . 2]" 1 46 ILE 0.466 0.111 15 0 "[ . 1 . 2]" 1 47 VAL 0.000 0.000 . 0 "[ . 1 . 2]" 1 48 LYS 0.170 0.080 17 0 "[ . 1 . 2]" 1 49 LYS 0.048 0.041 14 0 "[ . 1 . 2]" 1 50 GLU 0.161 0.051 19 0 "[ . 1 . 2]" 1 51 ILE 0.786 0.167 16 0 "[ . 1 . 2]" 1 52 GLY 0.335 0.166 16 0 "[ . 1 . 2]" 1 53 ASP 0.085 0.033 16 0 "[ . 1 . 2]" 1 54 VAL 0.300 0.082 12 0 "[ . 1 . 2]" 1 55 HIS 0.292 0.079 9 0 "[ . 1 . 2]" 1 56 VAL 0.000 0.000 . 0 "[ . 1 . 2]" 1 57 ASN 0.007 0.007 16 0 "[ . 1 . 2]" 1 58 VAL 0.584 0.108 11 0 "[ . 1 . 2]" 1 59 ILE 0.012 0.012 4 0 "[ . 1 . 2]" 1 60 LEU 0.000 0.000 . 0 "[ . 1 . 2]" 1 61 VAL 0.061 0.037 16 0 "[ . 1 . 2]" 1 62 SER 0.000 0.000 . 0 "[ . 1 . 2]" 1 63 GLU 0.000 0.000 . 0 "[ . 1 . 2]" 1 64 ASP 0.063 0.054 11 0 "[ . 1 . 2]" 1 65 GLU 0.070 0.037 16 0 "[ . 1 . 2]" 1 66 ILE 0.744 0.093 6 0 "[ . 1 . 2]" 1 67 LYS 0.054 0.054 11 0 "[ . 1 . 2]" 1 68 GLU 0.786 0.093 6 0 "[ . 1 . 2]" 1 69 LEU 0.000 0.000 . 0 "[ . 1 . 2]" 1 70 ASN 0.718 0.201 20 0 "[ . 1 . 2]" 1 71 GLN 0.191 0.036 16 0 "[ . 1 . 2]" 1 72 GLN 1.127 0.102 9 0 "[ . 1 . 2]" 1 73 PHE 0.167 0.070 20 0 "[ . 1 . 2]" 1 74 ARG 0.664 0.102 9 0 "[ . 1 . 2]" 1 75 GLY 0.000 0.000 . 0 "[ . 1 . 2]" 1 76 GLN 1.298 0.123 9 0 "[ . 1 . 2]" 1 77 ASP 0.003 0.002 2 0 "[ . 1 . 2]" 1 78 ARG 0.468 0.077 15 0 "[ . 1 . 2]" 1 79 PRO 0.881 0.125 14 0 "[ . 1 . 2]" 1 80 THR 0.605 0.125 14 0 "[ . 1 . 2]" 1 81 ASP 0.710 0.190 13 0 "[ . 1 . 2]" 1 82 VAL 0.634 0.190 13 0 "[ . 1 . 2]" 1 83 LEU 0.000 0.000 . 0 "[ . 1 . 2]" 1 84 THR 0.000 0.000 . 0 "[ . 1 . 2]" 1 85 PHE 0.223 0.159 14 0 "[ . 1 . 2]" 1 86 PRO 0.000 0.000 . 0 "[ . 1 . 2]" 1 87 LEU 0.978 0.207 14 0 "[ . 1 . 2]" 1 88 MET 0.550 0.518 19 1 "[ . 1 . +2]" 1 89 GLU 0.331 0.055 19 0 "[ . 1 . 2]" 1 90 GLU 0.306 0.055 19 0 "[ . 1 . 2]" 1 91 ASP 0.469 0.098 7 0 "[ . 1 . 2]" 1 92 VAL 0.678 0.098 7 0 "[ . 1 . 2]" 1 93 TYR 0.000 0.000 . 0 "[ . 1 . 2]" 1 94 GLY 0.204 0.084 14 0 "[ . 1 . 2]" 1 95 GLU 0.223 0.159 14 0 "[ . 1 . 2]" 1 96 ILE 0.000 0.000 . 0 "[ . 1 . 2]" 1 97 TYR 0.000 0.000 . 0 "[ . 1 . 2]" 1 98 VAL 0.000 0.000 . 0 "[ . 1 . 2]" 1 99 CYS 0.000 0.000 . 0 "[ . 1 . 2]" 1 100 PRO 0.000 0.000 . 0 "[ . 1 . 2]" 1 101 LEU 0.115 0.058 12 0 "[ . 1 . 2]" 1 102 ILE 1.018 0.111 12 0 "[ . 1 . 2]" 1 103 VAL 0.000 0.000 . 0 "[ . 1 . 2]" 1 104 GLU 0.662 0.111 12 0 "[ . 1 . 2]" 1 105 GLU 0.433 0.080 8 0 "[ . 1 . 2]" 1 106 ASN 0.188 0.075 4 0 "[ . 1 . 2]" 1 107 ALA 0.397 0.067 5 0 "[ . 1 . 2]" 1 108 ARG 0.909 0.144 4 0 "[ . 1 . 2]" 1 109 GLU 0.593 0.102 11 0 "[ . 1 . 2]" 1 110 PHE 0.246 0.075 4 0 "[ . 1 . 2]" 1 111 ASN 2.167 0.198 12 0 "[ . 1 . 2]" 1 112 ASN 1.793 0.131 15 0 "[ . 1 . 2]" 1 113 THR 0.058 0.058 10 0 "[ . 1 . 2]" 1 114 PHE 0.000 0.000 . 0 "[ . 1 . 2]" 1 115 GLU 0.000 0.000 . 0 "[ . 1 . 2]" 1 116 LYS 0.011 0.011 17 0 "[ . 1 . 2]" 1 117 GLU 1.746 0.131 15 0 "[ . 1 . 2]" 1 118 LEU 0.000 0.000 . 0 "[ . 1 . 2]" 1 119 LEU 0.347 0.081 14 0 "[ . 1 . 2]" 1 120 GLU 0.000 0.000 . 0 "[ . 1 . 2]" 1 121 VAL 0.078 0.042 8 0 "[ . 1 . 2]" 1 122 VAL 0.000 0.000 . 0 "[ . 1 . 2]" 1 123 ILE 0.059 0.059 3 0 "[ . 1 . 2]" 1 124 HIS 0.073 0.073 3 0 "[ . 1 . 2]" 1 125 GLY 0.000 0.000 . 0 "[ . 1 . 2]" 1 126 ILE 0.000 0.000 . 0 "[ . 1 . 2]" 1 127 LEU 0.494 0.101 3 0 "[ . 1 . 2]" 1 128 HIS 0.792 0.134 7 0 "[ . 1 . 2]" 1 129 LEU 0.408 0.134 7 0 "[ . 1 . 2]" 1 130 ALA 0.043 0.043 16 0 "[ . 1 . 2]" 1 131 GLY 0.124 0.075 1 0 "[ . 1 . 2]" 1 132 TYR 0.000 0.000 . 0 "[ . 1 . 2]" 1 133 ASP 0.000 0.000 . 0 "[ . 1 . 2]" 1 134 HIS 0.000 0.000 . 0 "[ . 1 . 2]" 1 135 GLU 0.472 0.246 13 0 "[ . 1 . 2]" 1 136 PHE 0.518 0.246 13 0 "[ . 1 . 2]" 1 137 GLU 0.016 0.012 12 0 "[ . 1 . 2]" 1 139 LYS 0.805 0.304 6 0 "[ . 1 . 2]" 1 140 ASN 0.899 0.304 6 0 "[ . 1 . 2]" 1 141 SER 0.000 0.000 . 0 "[ . 1 . 2]" 1 143 GLU 0.000 0.000 . 0 "[ . 1 . 2]" 1 144 MET 0.000 0.000 . 0 "[ . 1 . 2]" 1 145 PHE 0.036 0.036 16 0 "[ . 1 . 2]" 1 146 GLU 0.000 0.000 . 0 "[ . 1 . 2]" 1 147 LYS 0.991 0.098 11 0 "[ . 1 . 2]" 1 148 GLN 0.357 0.062 19 0 "[ . 1 . 2]" 1 149 LYS 0.719 0.074 11 0 "[ . 1 . 2]" 1 150 LYS 0.010 0.010 3 0 "[ . 1 . 2]" 1 151 TYR 0.573 0.098 11 0 "[ . 1 . 2]" 1 152 VAL 0.000 0.000 . 0 "[ . 1 . 2]" 1 153 GLU 0.000 0.000 . 0 "[ . 1 . 2]" 1 154 GLU 0.015 0.009 15 0 "[ . 1 . 2]" 1 155 VAL 0.000 0.000 . 0 "[ . 1 . 2]" 1 156 TRP 0.004 0.004 17 0 "[ . 1 . 2]" 1 157 GLY 0.025 0.025 14 0 "[ . 1 . 2]" 1 158 GLU 0.215 0.086 18 0 "[ . 1 . 2]" 1 159 TRP 0.030 0.025 14 0 "[ . 1 . 2]" 1 160 ARG 0.000 0.000 . 0 "[ . 1 . 2]" 1 161 SER 0.301 0.086 18 0 "[ . 1 . 2]" 1 162 ASN 0.086 0.030 10 0 "[ . 1 . 2]" 1 163 PRO 0.000 0.000 . 0 "[ . 1 . 2]" 1 164 SER 1.151 0.101 15 0 "[ . 1 . 2]" 1 165 GLU 0.992 0.192 10 0 "[ . 1 . 2]" 1 166 ASP 1.308 0.192 10 0 "[ . 1 . 2]" 1 167 SER 0.408 0.165 3 0 "[ . 1 . 2]" 1 168 ASP 0.053 0.012 11 0 "[ . 1 . 2]" 1 169 PRO 0.000 0.000 . 0 "[ . 1 . 2]" 1 170 GLY 0.002 0.002 10 0 "[ . 1 . 2]" 1 171 LYS 0.000 0.000 . 0 "[ . 1 . 2]" 1 172 ARG 0.000 0.000 . 0 "[ . 1 . 2]" stop_ loop_ _Distance_constraint_stats.Restraint_ID _Distance_constraint_stats.Atom_1_entity_assembly_ID _Distance_constraint_stats.Atom_1_comp_index_ID _Distance_constraint_stats.Atom_1_comp_ID _Distance_constraint_stats.Atom_1_ID _Distance_constraint_stats.Atom_2_entity_assembly_ID _Distance_constraint_stats.Atom_2_comp_index_ID _Distance_constraint_stats.Atom_2_comp_ID _Distance_constraint_stats.Atom_2_ID _Distance_constraint_stats.Node_1_distance_val _Distance_constraint_stats.Node_1_distance_lower_bound_val _Distance_constraint_stats.Node_1_distance_upper_bound_val _Distance_constraint_stats.Distance_average _Distance_constraint_stats.Distance_minimum _Distance_constraint_stats.Distance_maximum _Distance_constraint_stats.Max_violation _Distance_constraint_stats.Max_violation_model_number _Distance_constraint_stats.Over_cutoff_violation_count _Distance_constraint_stats.Over_cutoff_viol_per_model _Distance_constraint_stats.Distance_constraint_stats_ID 1 1 23 MET H 1 23 MET HG2 . . 5.500 3.829 1.999 5.042 . 0 0 "[ . 1 . 2]" 1 2 1 23 MET H 1 23 MET HG3 . . 5.500 3.944 1.836 5.192 . 0 0 "[ . 1 . 2]" 1 3 1 23 MET ME 1 47 VAL MG1 . . 5.940 2.468 1.739 3.926 . 0 0 "[ . 1 . 2]" 1 4 1 23 MET ME 1 48 LYS H . . 5.260 4.162 3.828 4.491 . 0 0 "[ . 1 . 2]" 1 5 1 23 MET ME 1 53 ASP HA . . 6.530 2.634 1.833 3.821 . 0 0 "[ . 1 . 2]" 1 6 1 23 MET ME 1 54 VAL H . . 3.890 2.595 1.882 3.118 . 0 0 "[ . 1 . 2]" 1 7 1 23 MET QG 1 54 VAL H . . 4.790 3.746 2.362 4.340 . 0 0 "[ . 1 . 2]" 1 8 1 23 MET HG2 1 54 VAL H . . 4.940 4.255 2.380 5.022 0.082 12 0 "[ . 1 . 2]" 1 9 1 23 MET HG3 1 54 VAL H . . 4.940 4.554 3.164 4.984 0.044 8 0 "[ . 1 . 2]" 1 10 1 24 ILE HA 1 25 ARG H . . 3.490 2.332 2.193 2.404 . 0 0 "[ . 1 . 2]" 1 11 1 24 ILE HA 1 55 HIS HA . . 4.570 4.251 3.409 4.649 0.079 9 0 "[ . 1 . 2]" 1 12 1 24 ILE HA 1 56 VAL H . . 3.980 3.146 2.414 3.663 . 0 0 "[ . 1 . 2]" 1 13 1 24 ILE HA 1 56 VAL MG1 . . 5.570 4.148 2.593 4.467 . 0 0 "[ . 1 . 2]" 1 14 1 24 ILE HB 1 36 LEU QB . . 6.380 5.479 5.016 5.621 . 0 0 "[ . 1 . 2]" 1 15 1 24 ILE MD 1 40 LYS QG . . 6.570 2.638 2.033 4.052 . 0 0 "[ . 1 . 2]" 1 16 1 24 ILE MD 1 43 LEU QB . . 4.800 2.393 1.930 3.068 . 0 0 "[ . 1 . 2]" 1 17 1 24 ILE MD 1 44 GLU H . . 4.760 3.188 2.795 3.700 . 0 0 "[ . 1 . 2]" 1 18 1 24 ILE MD 1 44 GLU HA . . 4.360 3.037 2.699 3.325 . 0 0 "[ . 1 . 2]" 1 19 1 24 ILE MD 1 44 GLU HB2 . . 4.950 4.155 3.933 4.231 . 0 0 "[ . 1 . 2]" 1 20 1 24 ILE MD 1 44 GLU QG . . 5.760 1.923 1.799 2.135 . 0 0 "[ . 1 . 2]" 1 21 1 24 ILE MD 1 47 VAL MG2 . . 6.470 3.783 2.915 4.253 . 0 0 "[ . 1 . 2]" 1 22 1 24 ILE QG 1 25 ARG H . . 5.330 4.033 3.778 4.320 . 0 0 "[ . 1 . 2]" 1 23 1 24 ILE HG12 1 25 ARG H . . 5.500 4.855 4.495 5.195 . 0 0 "[ . 1 . 2]" 1 24 1 24 ILE HG13 1 25 ARG H . . 5.500 4.317 4.029 4.626 . 0 0 "[ . 1 . 2]" 1 25 1 24 ILE MG 1 25 ARG H . . 3.950 2.098 1.917 2.472 . 0 0 "[ . 1 . 2]" 1 26 1 24 ILE MG 1 26 ILE H . . 6.090 4.370 3.929 4.695 . 0 0 "[ . 1 . 2]" 1 27 1 24 ILE MG 1 57 ASN HA . . 6.190 4.132 3.709 4.798 . 0 0 "[ . 1 . 2]" 1 28 1 24 ILE MG 1 58 VAL H . . 6.160 3.905 3.430 4.471 . 0 0 "[ . 1 . 2]" 1 29 1 25 ARG H 1 25 ARG HG2 . . 5.500 4.724 4.475 5.095 . 0 0 "[ . 1 . 2]" 1 30 1 25 ARG H 1 25 ARG QG . . 5.100 3.867 3.353 4.326 . 0 0 "[ . 1 . 2]" 1 31 1 25 ARG H 1 25 ARG HG3 . . 5.500 4.113 3.463 4.677 . 0 0 "[ . 1 . 2]" 1 32 1 25 ARG H 1 26 ILE H . . 4.540 4.410 4.186 4.511 . 0 0 "[ . 1 . 2]" 1 33 1 25 ARG H 1 57 ASN HA . . 3.860 3.329 2.503 3.867 0.007 16 0 "[ . 1 . 2]" 1 34 1 25 ARG H 1 58 VAL H . . 4.510 4.165 3.655 4.525 0.015 10 0 "[ . 1 . 2]" 1 35 1 25 ARG HA 1 25 ARG QG . . 4.020 2.073 1.961 2.456 . 0 0 "[ . 1 . 2]" 1 36 1 25 ARG HA 1 26 ILE H . . 2.930 2.257 2.226 2.368 . 0 0 "[ . 1 . 2]" 1 37 1 25 ARG HA 1 26 ILE MG . . 6.500 5.112 4.186 5.467 . 0 0 "[ . 1 . 2]" 1 38 1 25 ARG HB2 1 26 ILE H . . 5.220 4.519 4.281 4.663 . 0 0 "[ . 1 . 2]" 1 39 1 25 ARG HB3 1 26 ILE H . . 4.140 3.676 3.252 3.993 . 0 0 "[ . 1 . 2]" 1 40 1 25 ARG QG 1 26 ILE H . . 4.190 3.215 2.261 3.803 . 0 0 "[ . 1 . 2]" 1 41 1 25 ARG HG2 1 26 ILE H . . 4.720 4.054 2.656 4.713 . 0 0 "[ . 1 . 2]" 1 42 1 25 ARG HG3 1 26 ILE H . . 4.720 3.508 2.276 4.359 . 0 0 "[ . 1 . 2]" 1 43 1 26 ILE H 1 26 ILE HB . . 3.610 2.987 2.588 3.534 . 0 0 "[ . 1 . 2]" 1 44 1 26 ILE H 1 26 ILE MD . . 4.850 3.470 2.201 3.921 . 0 0 "[ . 1 . 2]" 1 45 1 26 ILE H 1 26 ILE HG12 . . 3.420 2.874 1.910 3.378 . 0 0 "[ . 1 . 2]" 1 46 1 26 ILE H 1 26 ILE QG . . 3.240 2.021 1.902 2.237 . 0 0 "[ . 1 . 2]" 1 47 1 26 ILE H 1 26 ILE HG13 . . 3.420 2.301 1.938 3.473 0.053 20 0 "[ . 1 . 2]" 1 48 1 26 ILE H 1 26 ILE MG . . 4.420 3.740 3.347 3.866 . 0 0 "[ . 1 . 2]" 1 49 1 26 ILE H 1 27 LEU H . . 5.500 4.332 4.150 4.516 . 0 0 "[ . 1 . 2]" 1 50 1 26 ILE HA 1 26 ILE MD . . 4.760 3.822 3.168 4.061 . 0 0 "[ . 1 . 2]" 1 51 1 26 ILE HA 1 58 VAL H . . 4.320 2.990 2.448 3.563 . 0 0 "[ . 1 . 2]" 1 52 1 26 ILE HB 1 27 LEU H . . 5.500 3.915 2.742 4.438 . 0 0 "[ . 1 . 2]" 1 53 1 26 ILE MD 1 33 SER QB . . 7.160 3.762 3.002 4.622 . 0 0 "[ . 1 . 2]" 1 54 1 26 ILE MD 1 37 GLU HA . . 5.750 3.894 3.361 4.714 . 0 0 "[ . 1 . 2]" 1 55 1 26 ILE MD 1 37 GLU QG . . 7.400 2.390 1.833 3.018 . 0 0 "[ . 1 . 2]" 1 56 1 26 ILE QG 1 27 LEU H . . 6.380 4.523 4.223 4.683 . 0 0 "[ . 1 . 2]" 1 57 1 26 ILE MG 1 27 LEU H . . 4.140 3.055 2.381 3.349 . 0 0 "[ . 1 . 2]" 1 58 1 26 ILE MG 1 34 LYS H . . 6.530 5.019 4.508 5.359 . 0 0 "[ . 1 . 2]" 1 59 1 26 ILE MG 1 37 GLU H . . 5.910 4.664 4.339 4.841 . 0 0 "[ . 1 . 2]" 1 60 1 26 ILE MG 1 37 GLU QG . . 7.400 3.931 3.562 4.253 . 0 0 "[ . 1 . 2]" 1 61 1 27 LEU H 1 27 LEU MD2 . . 5.540 2.564 1.901 3.990 . 0 0 "[ . 1 . 2]" 1 62 1 27 LEU H 1 27 LEU HG . . 4.410 2.864 2.230 4.535 0.125 4 0 "[ . 1 . 2]" 1 63 1 27 LEU H 1 28 GLY H . . 4.850 4.457 4.384 4.597 . 0 0 "[ . 1 . 2]" 1 64 1 27 LEU H 1 58 VAL H . . 5.470 3.466 2.736 4.139 . 0 0 "[ . 1 . 2]" 1 65 1 27 LEU H 1 59 ILE HA . . 3.760 3.367 2.839 3.772 0.012 4 0 "[ . 1 . 2]" 1 66 1 27 LEU H 1 60 LEU H . . 5.130 3.925 3.008 4.330 . 0 0 "[ . 1 . 2]" 1 67 1 27 LEU H 1 60 LEU MD1 . . 6.530 4.122 3.407 4.714 . 0 0 "[ . 1 . 2]" 1 68 1 27 LEU HA 1 28 GLY H . . 2.650 2.437 2.251 2.498 . 0 0 "[ . 1 . 2]" 1 69 1 27 LEU HA 1 59 ILE MG . . 6.530 5.128 4.545 5.329 . 0 0 "[ . 1 . 2]" 1 70 1 27 LEU QB 1 28 GLY H . . 4.050 2.582 2.410 3.573 . 0 0 "[ . 1 . 2]" 1 71 1 27 LEU HB2 1 28 GLY H . . 4.380 2.849 2.441 4.362 . 0 0 "[ . 1 . 2]" 1 72 1 27 LEU HB3 1 28 GLY H . . 4.380 3.639 2.517 4.006 . 0 0 "[ . 1 . 2]" 1 73 1 27 LEU MD1 1 28 GLY H . . 5.040 3.780 2.421 4.166 . 0 0 "[ . 1 . 2]" 1 74 1 27 LEU MD1 1 59 ILE H . . 6.340 4.600 4.211 5.107 . 0 0 "[ . 1 . 2]" 1 75 1 27 LEU MD1 1 85 PHE QD . . 8.650 6.422 6.029 6.547 . 0 0 "[ . 1 . 2]" 1 76 1 27 LEU MD1 1 97 TYR QD . . 8.670 5.117 4.588 5.548 . 0 0 "[ . 1 . 2]" 1 77 1 27 LEU MD2 1 28 GLY H . . 5.660 4.403 2.390 4.836 . 0 0 "[ . 1 . 2]" 1 78 1 27 LEU MD2 1 57 ASN HA . . 6.500 2.943 2.068 5.385 . 0 0 "[ . 1 . 2]" 1 79 1 27 LEU MD2 1 57 ASN HB2 . . 5.570 3.299 2.297 4.507 . 0 0 "[ . 1 . 2]" 1 80 1 27 LEU MD2 1 57 ASN QB . . 5.150 2.064 1.751 3.475 . 0 0 "[ . 1 . 2]" 1 81 1 27 LEU MD2 1 57 ASN HB3 . . 5.570 2.097 1.760 3.633 . 0 0 "[ . 1 . 2]" 1 82 1 27 LEU MD2 1 59 ILE HA . . 5.780 3.794 3.191 4.856 . 0 0 "[ . 1 . 2]" 1 83 1 27 LEU MD2 1 59 ILE MD . . 6.810 3.355 1.800 4.776 . 0 0 "[ . 1 . 2]" 1 84 1 27 LEU HG 1 57 ASN QB . . 6.380 3.617 2.033 4.385 . 0 0 "[ . 1 . 2]" 1 85 1 27 LEU HG 1 59 ILE MG . . 5.910 3.501 2.422 4.880 . 0 0 "[ . 1 . 2]" 1 86 1 28 GLY H 1 29 GLU H . . 4.630 4.463 3.136 4.668 0.038 7 0 "[ . 1 . 2]" 1 87 1 28 GLY QA 1 59 ILE MG . . 7.400 2.524 1.966 3.333 . 0 0 "[ . 1 . 2]" 1 88 1 29 GLU H 1 29 GLU HB2 . . 4.010 3.516 3.001 3.936 . 0 0 "[ . 1 . 2]" 1 89 1 29 GLU H 1 29 GLU QB . . 3.640 3.201 2.907 3.436 . 0 0 "[ . 1 . 2]" 1 90 1 29 GLU H 1 29 GLU HB3 . . 4.010 3.819 3.606 3.959 . 0 0 "[ . 1 . 2]" 1 91 1 29 GLU H 1 29 GLU QG . . 3.280 2.465 2.144 2.783 . 0 0 "[ . 1 . 2]" 1 92 1 29 GLU H 1 30 GLY H . . 4.380 4.311 4.179 4.403 0.023 16 0 "[ . 1 . 2]" 1 93 1 29 GLU H 1 60 LEU H . . 4.410 3.583 2.959 3.978 . 0 0 "[ . 1 . 2]" 1 94 1 29 GLU H 1 60 LEU MD1 . . 5.320 4.143 3.278 4.331 . 0 0 "[ . 1 . 2]" 1 95 1 29 GLU HA 1 30 GLY H . . 2.770 2.337 2.243 2.555 . 0 0 "[ . 1 . 2]" 1 96 1 29 GLU QB 1 30 GLY H . . 3.500 2.854 2.310 3.159 . 0 0 "[ . 1 . 2]" 1 97 1 29 GLU HB2 1 30 GLY H . . 3.700 3.312 2.337 3.770 0.070 17 0 "[ . 1 . 2]" 1 98 1 29 GLU HB3 1 30 GLY H . . 3.700 3.399 2.877 3.834 0.134 11 0 "[ . 1 . 2]" 1 99 1 29 GLU QG 1 30 GLY H . . 5.510 4.365 3.719 4.591 . 0 0 "[ . 1 . 2]" 1 100 1 29 GLU QG 1 30 GLY QA . . 7.260 4.810 3.846 5.276 . 0 0 "[ . 1 . 2]" 1 101 1 30 GLY H 1 31 LYS H . . 4.970 4.023 3.830 4.284 . 0 0 "[ . 1 . 2]" 1 102 1 30 GLY H 1 60 LEU MD1 . . 4.050 3.127 2.916 3.266 . 0 0 "[ . 1 . 2]" 1 103 1 30 GLY QA 1 31 LYS H . . 3.110 2.214 2.174 2.299 . 0 0 "[ . 1 . 2]" 1 104 1 30 GLY QA 1 62 SER H . . 5.200 4.583 4.480 4.667 . 0 0 "[ . 1 . 2]" 1 105 1 30 GLY HA2 1 31 LYS H . . 3.300 2.275 2.209 2.434 . 0 0 "[ . 1 . 2]" 1 106 1 30 GLY HA3 1 31 LYS H . . 3.300 3.079 2.825 3.232 . 0 0 "[ . 1 . 2]" 1 107 1 31 LYS H 1 31 LYS HB2 . . 3.550 2.057 2.020 2.078 . 0 0 "[ . 1 . 2]" 1 108 1 31 LYS H 1 31 LYS HB3 . . 3.550 3.061 3.013 3.152 . 0 0 "[ . 1 . 2]" 1 109 1 31 LYS H 1 31 LYS QG . . 4.610 3.605 3.469 3.706 . 0 0 "[ . 1 . 2]" 1 110 1 31 LYS H 1 32 GLY H . . 4.790 4.390 4.352 4.557 . 0 0 "[ . 1 . 2]" 1 111 1 31 LYS HA 1 31 LYS QG . . 3.560 2.134 2.002 2.204 . 0 0 "[ . 1 . 2]" 1 112 1 31 LYS HA 1 32 GLY H . . 2.770 2.192 2.176 2.200 . 0 0 "[ . 1 . 2]" 1 113 1 31 LYS HA 1 33 SER H . . 4.450 3.731 3.556 4.002 . 0 0 "[ . 1 . 2]" 1 114 1 31 LYS QB 1 32 GLY H . . 4.620 3.925 3.686 3.968 . 0 0 "[ . 1 . 2]" 1 115 1 31 LYS HB2 1 32 GLY H . . 4.880 4.656 4.558 4.696 . 0 0 "[ . 1 . 2]" 1 116 1 31 LYS HB3 1 32 GLY H . . 4.880 4.228 3.893 4.296 . 0 0 "[ . 1 . 2]" 1 117 1 31 LYS QE 1 159 TRP HH2 . . 6.380 5.141 4.294 5.756 . 0 0 "[ . 1 . 2]" 1 118 1 31 LYS QG 1 32 GLY H . . 3.880 3.282 2.950 3.498 . 0 0 "[ . 1 . 2]" 1 119 1 31 LYS HG2 1 32 GLY H . . 4.410 3.533 2.996 4.084 . 0 0 "[ . 1 . 2]" 1 120 1 31 LYS HG3 1 32 GLY H . . 4.410 4.122 3.642 4.472 0.062 18 0 "[ . 1 . 2]" 1 121 1 32 GLY H 1 33 SER H . . 3.240 2.049 1.899 2.268 . 0 0 "[ . 1 . 2]" 1 122 1 32 GLY H 1 33 SER HA . . 4.660 4.452 4.354 4.616 . 0 0 "[ . 1 . 2]" 1 123 1 32 GLY H 1 34 LYS H . . 4.760 2.996 2.792 3.081 . 0 0 "[ . 1 . 2]" 1 124 1 32 GLY H 1 60 LEU MD2 . . 6.310 4.199 3.656 4.986 . 0 0 "[ . 1 . 2]" 1 125 1 32 GLY QA 1 35 LEU H . . 5.230 3.206 2.969 3.448 . 0 0 "[ . 1 . 2]" 1 126 1 33 SER H 1 34 LYS H . . 3.390 2.829 2.621 2.884 . 0 0 "[ . 1 . 2]" 1 127 1 33 SER H 1 60 LEU MD1 . . 4.050 2.069 1.867 2.395 . 0 0 "[ . 1 . 2]" 1 128 1 33 SER HA 1 60 LEU MD1 . . 3.580 2.179 1.899 2.578 . 0 0 "[ . 1 . 2]" 1 129 1 33 SER HA 1 60 LEU MD2 . . 5.850 3.530 3.160 3.881 . 0 0 "[ . 1 . 2]" 1 130 1 33 SER QB 1 60 LEU MD1 . . 5.420 1.954 1.834 2.336 . 0 0 "[ . 1 . 2]" 1 131 1 33 SER QB 1 60 LEU MD2 . . 7.400 3.975 3.556 4.431 . 0 0 "[ . 1 . 2]" 1 132 1 34 LYS H 1 34 LYS HB2 . . 3.450 3.174 2.091 3.543 0.093 8 0 "[ . 1 . 2]" 1 133 1 34 LYS H 1 34 LYS HB3 . . 3.670 3.133 2.809 3.549 . 0 0 "[ . 1 . 2]" 1 134 1 34 LYS H 1 34 LYS QD . . 5.040 3.096 1.881 4.464 . 0 0 "[ . 1 . 2]" 1 135 1 34 LYS H 1 34 LYS HG2 . . 3.420 2.566 1.924 3.474 0.054 10 0 "[ . 1 . 2]" 1 136 1 34 LYS H 1 34 LYS QG . . 3.160 1.949 1.783 2.945 . 0 0 "[ . 1 . 2]" 1 137 1 34 LYS H 1 34 LYS HG3 . . 3.420 2.191 1.946 3.453 0.033 1 0 "[ . 1 . 2]" 1 138 1 34 LYS H 1 35 LEU H . . 3.110 2.539 2.404 2.721 . 0 0 "[ . 1 . 2]" 1 139 1 34 LYS HA 1 34 LYS QD . . 4.640 4.045 2.864 4.274 . 0 0 "[ . 1 . 2]" 1 140 1 34 LYS HA 1 34 LYS HG2 . . 3.980 3.550 2.064 3.779 . 0 0 "[ . 1 . 2]" 1 141 1 34 LYS HA 1 34 LYS QG . . 3.590 2.980 2.047 3.395 . 0 0 "[ . 1 . 2]" 1 142 1 34 LYS HA 1 34 LYS HG3 . . 3.980 3.305 2.659 4.207 0.227 8 0 "[ . 1 . 2]" 1 143 1 34 LYS HA 1 37 GLU H . . 3.920 3.088 2.899 3.455 . 0 0 "[ . 1 . 2]" 1 144 1 34 LYS HB2 1 35 LEU H . . 3.450 3.352 2.862 3.734 0.284 8 0 "[ . 1 . 2]" 1 145 1 34 LYS HB3 1 35 LEU H . . 4.290 4.141 3.436 4.291 0.001 10 0 "[ . 1 . 2]" 1 146 1 34 LYS QD 1 35 LEU H . . 6.380 3.655 3.328 5.041 . 0 0 "[ . 1 . 2]" 1 147 1 34 LYS QD 1 35 LEU HA . . 5.880 4.819 4.207 5.459 . 0 0 "[ . 1 . 2]" 1 148 1 34 LYS QG 1 35 LEU H . . 6.160 2.790 1.832 4.519 . 0 0 "[ . 1 . 2]" 1 149 1 35 LEU H 1 35 LEU HB2 . . 3.730 3.087 2.644 3.339 . 0 0 "[ . 1 . 2]" 1 150 1 35 LEU H 1 35 LEU QB . . 3.290 1.996 1.958 2.129 . 0 0 "[ . 1 . 2]" 1 151 1 35 LEU H 1 35 LEU HB3 . . 3.730 2.027 1.977 2.245 . 0 0 "[ . 1 . 2]" 1 152 1 35 LEU H 1 35 LEU MD1 . . 5.290 4.209 4.076 4.354 . 0 0 "[ . 1 . 2]" 1 153 1 35 LEU H 1 35 LEU MD2 . . 5.010 3.907 3.598 4.076 . 0 0 "[ . 1 . 2]" 1 154 1 35 LEU H 1 35 LEU HG . . 4.880 3.715 3.271 4.290 . 0 0 "[ . 1 . 2]" 1 155 1 35 LEU H 1 36 LEU H . . 3.330 2.682 2.454 2.810 . 0 0 "[ . 1 . 2]" 1 156 1 35 LEU H 1 37 GLU H . . 4.720 4.334 4.096 4.471 . 0 0 "[ . 1 . 2]" 1 157 1 35 LEU HA 1 35 LEU MD1 . . 4.200 2.658 2.425 2.906 . 0 0 "[ . 1 . 2]" 1 158 1 35 LEU HA 1 38 ASN H . . 4.760 3.619 3.532 3.696 . 0 0 "[ . 1 . 2]" 1 159 1 35 LEU HA 1 38 ASN HB2 . . 4.910 3.130 2.833 3.904 . 0 0 "[ . 1 . 2]" 1 160 1 35 LEU HA 1 38 ASN QB . . 4.330 3.070 2.794 3.760 . 0 0 "[ . 1 . 2]" 1 161 1 35 LEU HA 1 38 ASN HB3 . . 4.910 4.464 4.267 4.908 . 0 0 "[ . 1 . 2]" 1 162 1 35 LEU HA 1 38 ASN HD21 . . 4.940 2.517 1.926 3.227 . 0 0 "[ . 1 . 2]" 1 163 1 35 LEU HA 1 38 ASN HD22 . . 5.500 2.983 2.001 3.986 . 0 0 "[ . 1 . 2]" 1 164 1 35 LEU QB 1 36 LEU H . . 5.360 3.248 2.906 3.404 . 0 0 "[ . 1 . 2]" 1 165 1 35 LEU MD1 1 36 LEU H . . 5.880 3.888 3.438 4.738 . 0 0 "[ . 1 . 2]" 1 166 1 35 LEU MD1 1 38 ASN HD22 . . 6.090 4.561 2.594 4.905 . 0 0 "[ . 1 . 2]" 1 167 1 35 LEU MD1 1 39 LEU MD1 . . 7.560 2.493 1.909 4.210 . 0 0 "[ . 1 . 2]" 1 168 1 35 LEU MD1 1 39 LEU MD2 . . 7.060 2.750 1.931 4.321 . 0 0 "[ . 1 . 2]" 1 169 1 35 LEU MD1 1 118 LEU MD2 . . 7.560 4.063 2.856 5.205 . 0 0 "[ . 1 . 2]" 1 170 1 35 LEU MD1 1 119 LEU MD2 . . 7.560 4.691 4.452 5.030 . 0 0 "[ . 1 . 2]" 1 171 1 35 LEU MD1 1 159 TRP HD1 . . 5.910 4.608 3.649 4.990 . 0 0 "[ . 1 . 2]" 1 172 1 35 LEU MD1 1 159 TRP HE1 . . 4.510 3.047 1.894 3.508 . 0 0 "[ . 1 . 2]" 1 173 1 35 LEU MD1 1 159 TRP HZ2 . . 5.850 2.035 1.888 2.232 . 0 0 "[ . 1 . 2]" 1 174 1 35 LEU MD2 1 100 PRO QB . . 7.410 3.823 3.551 4.110 . 0 0 "[ . 1 . 2]" 1 175 1 35 LEU MD2 1 100 PRO HG2 . . 6.030 5.005 4.919 5.058 . 0 0 "[ . 1 . 2]" 1 176 1 35 LEU MD2 1 100 PRO QG . . 5.430 3.893 3.790 3.984 . 0 0 "[ . 1 . 2]" 1 177 1 35 LEU MD2 1 100 PRO HG3 . . 6.030 4.060 3.937 4.178 . 0 0 "[ . 1 . 2]" 1 178 1 35 LEU MD2 1 115 GLU HA . . 4.450 3.493 3.351 3.663 . 0 0 "[ . 1 . 2]" 1 179 1 35 LEU MD2 1 118 LEU QB . . 5.830 2.815 2.386 3.250 . 0 0 "[ . 1 . 2]" 1 180 1 35 LEU MD2 1 118 LEU MD2 . . 7.030 2.708 1.733 3.222 . 0 0 "[ . 1 . 2]" 1 181 1 35 LEU MD2 1 119 LEU H . . 6.160 4.904 4.358 5.071 . 0 0 "[ . 1 . 2]" 1 182 1 35 LEU HG 1 39 LEU MD1 . . 4.730 3.568 3.021 3.787 . 0 0 "[ . 1 . 2]" 1 183 1 36 LEU H 1 36 LEU QB . . 3.670 2.148 2.051 2.188 . 0 0 "[ . 1 . 2]" 1 184 1 36 LEU H 1 36 LEU MD1 . . 5.040 4.080 4.057 4.119 . 0 0 "[ . 1 . 2]" 1 185 1 36 LEU H 1 36 LEU MD2 . . 4.790 3.804 3.331 3.927 . 0 0 "[ . 1 . 2]" 1 186 1 36 LEU H 1 36 LEU HG . . 4.880 4.593 4.543 4.619 . 0 0 "[ . 1 . 2]" 1 187 1 36 LEU H 1 37 GLU H . . 3.610 2.550 2.463 2.625 . 0 0 "[ . 1 . 2]" 1 188 1 36 LEU HA 1 36 LEU MD1 . . 3.740 2.083 1.931 2.500 . 0 0 "[ . 1 . 2]" 1 189 1 36 LEU HA 1 36 LEU MD2 . . 4.390 2.618 2.182 2.774 . 0 0 "[ . 1 . 2]" 1 190 1 36 LEU HA 1 39 LEU H . . 4.570 3.190 3.124 3.335 . 0 0 "[ . 1 . 2]" 1 191 1 36 LEU HB2 1 37 GLU H . . 4.350 3.608 3.396 3.824 . 0 0 "[ . 1 . 2]" 1 192 1 36 LEU HB3 1 37 GLU H . . 4.350 2.556 2.461 2.804 . 0 0 "[ . 1 . 2]" 1 193 1 36 LEU MD1 1 39 LEU MD2 . . 6.410 4.236 4.170 4.292 . 0 0 "[ . 1 . 2]" 1 194 1 36 LEU MD1 1 40 LYS H . . 4.420 3.610 3.539 3.662 . 0 0 "[ . 1 . 2]" 1 195 1 36 LEU MD2 1 37 GLU H . . 5.810 4.875 4.804 4.920 . 0 0 "[ . 1 . 2]" 1 196 1 36 LEU MD2 1 37 GLU QG . . 7.400 5.524 5.455 5.606 . 0 0 "[ . 1 . 2]" 1 197 1 36 LEU MD2 1 122 VAL H . . 5.940 4.845 4.254 4.999 . 0 0 "[ . 1 . 2]" 1 198 1 36 LEU MD2 1 122 VAL MG2 . . 6.130 1.781 1.633 2.036 . 0 0 "[ . 1 . 2]" 1 199 1 36 LEU HG 1 37 GLU H . . 5.500 4.682 4.528 5.064 . 0 0 "[ . 1 . 2]" 1 200 1 37 GLU H 1 37 GLU HB2 . . 3.520 2.511 2.418 2.601 . 0 0 "[ . 1 . 2]" 1 201 1 37 GLU H 1 37 GLU QB . . 3.270 2.461 2.379 2.539 . 0 0 "[ . 1 . 2]" 1 202 1 37 GLU H 1 37 GLU HB3 . . 3.520 3.548 3.543 3.551 0.031 7 0 "[ . 1 . 2]" 1 203 1 37 GLU H 1 37 GLU QG . . 3.960 2.175 2.078 2.310 . 0 0 "[ . 1 . 2]" 1 204 1 37 GLU H 1 38 ASN H . . 3.270 2.773 2.759 2.781 . 0 0 "[ . 1 . 2]" 1 205 1 37 GLU H 1 39 LEU H . . 4.600 4.540 4.356 4.630 0.030 15 0 "[ . 1 . 2]" 1 206 1 37 GLU H 1 40 LYS QG . . 5.670 3.722 3.424 3.996 . 0 0 "[ . 1 . 2]" 1 207 1 37 GLU HA 1 40 LYS H . . 4.410 3.458 3.225 3.585 . 0 0 "[ . 1 . 2]" 1 208 1 37 GLU QB 1 39 LEU H . . 6.380 5.076 4.901 5.186 . 0 0 "[ . 1 . 2]" 1 209 1 37 GLU HB2 1 38 ASN H . . 4.230 3.179 3.019 3.246 . 0 0 "[ . 1 . 2]" 1 210 1 37 GLU HB3 1 38 ASN H . . 4.230 4.088 3.972 4.173 . 0 0 "[ . 1 . 2]" 1 211 1 37 GLU QG 1 38 ASN H . . 6.380 4.223 4.106 4.331 . 0 0 "[ . 1 . 2]" 1 212 1 38 ASN H 1 38 ASN HB2 . . 3.490 2.308 2.034 2.481 . 0 0 "[ . 1 . 2]" 1 213 1 38 ASN H 1 38 ASN QB . . 3.200 2.277 2.016 2.436 . 0 0 "[ . 1 . 2]" 1 214 1 38 ASN H 1 38 ASN HB3 . . 3.490 3.511 3.297 3.557 0.067 14 0 "[ . 1 . 2]" 1 215 1 38 ASN H 1 38 ASN HD21 . . 4.690 4.004 3.477 4.388 . 0 0 "[ . 1 . 2]" 1 216 1 38 ASN H 1 38 ASN HD22 . . 4.690 4.495 4.048 4.719 0.029 10 0 "[ . 1 . 2]" 1 217 1 38 ASN H 1 39 LEU H . . 3.300 2.564 2.470 2.745 . 0 0 "[ . 1 . 2]" 1 218 1 38 ASN H 1 40 LYS H . . 5.220 3.992 3.831 4.256 . 0 0 "[ . 1 . 2]" 1 219 1 38 ASN H 1 40 LYS QB . . 5.670 4.298 4.132 4.536 . 0 0 "[ . 1 . 2]" 1 220 1 38 ASN HA 1 38 ASN HD21 . . 4.350 4.374 3.954 4.477 0.127 18 0 "[ . 1 . 2]" 1 221 1 38 ASN HA 1 39 LEU H . . 3.640 3.631 3.596 3.643 0.003 4 0 "[ . 1 . 2]" 1 222 1 38 ASN QB 1 38 ASN HD22 . . 3.640 3.233 3.231 3.243 . 0 0 "[ . 1 . 2]" 1 223 1 38 ASN QB 1 39 LEU H . . 3.560 2.446 2.326 2.657 . 0 0 "[ . 1 . 2]" 1 224 1 38 ASN HB2 1 38 ASN HD21 . . 3.550 2.379 2.106 2.641 . 0 0 "[ . 1 . 2]" 1 225 1 38 ASN HB2 1 38 ASN HD22 . . 3.950 3.563 3.447 3.679 . 0 0 "[ . 1 . 2]" 1 226 1 38 ASN HB2 1 39 LEU H . . 4.070 2.523 2.369 2.880 . 0 0 "[ . 1 . 2]" 1 227 1 38 ASN HB3 1 38 ASN HD21 . . 3.550 2.728 2.429 3.185 . 0 0 "[ . 1 . 2]" 1 228 1 38 ASN HB3 1 38 ASN HD22 . . 3.950 3.723 3.582 3.950 . 10 0 "[ . 1 . 2]" 1 229 1 38 ASN HB3 1 39 LEU H . . 4.070 3.393 2.782 3.705 . 0 0 "[ . 1 . 2]" 1 230 1 39 LEU H 1 39 LEU MD1 . . 4.730 1.995 1.839 2.687 . 0 0 "[ . 1 . 2]" 1 231 1 39 LEU H 1 39 LEU MD2 . . 4.790 3.746 3.619 3.937 . 0 0 "[ . 1 . 2]" 1 232 1 39 LEU H 1 39 LEU HG . . 3.240 2.133 1.943 2.452 . 0 0 "[ . 1 . 2]" 1 233 1 39 LEU H 1 40 LYS H . . 3.020 2.833 2.612 2.988 . 0 0 "[ . 1 . 2]" 1 234 1 39 LEU H 1 43 LEU MD1 . . 6.530 4.499 4.024 5.283 . 0 0 "[ . 1 . 2]" 1 235 1 39 LEU HA 1 41 GLU H . . 5.500 4.012 3.616 4.195 . 0 0 "[ . 1 . 2]" 1 236 1 39 LEU QB 1 40 LYS H . . 5.290 4.076 4.060 4.093 . 0 0 "[ . 1 . 2]" 1 237 1 39 LEU MD1 1 159 TRP QB . . 7.400 5.383 4.703 5.482 . 0 0 "[ . 1 . 2]" 1 238 1 39 LEU MD2 1 155 VAL MG2 . . 7.560 4.383 3.925 4.676 . 0 0 "[ . 1 . 2]" 1 239 1 39 LEU MD2 1 159 TRP HA . . 5.880 4.540 3.892 4.740 . 0 0 "[ . 1 . 2]" 1 240 1 39 LEU MD2 1 159 TRP QB . . 7.400 2.988 2.029 3.149 . 0 0 "[ . 1 . 2]" 1 241 1 39 LEU HG 1 119 LEU MD2 . . 6.310 4.922 4.451 5.111 . 0 0 "[ . 1 . 2]" 1 242 1 40 LYS H 1 40 LYS HB2 . . 3.080 2.059 2.026 2.089 . 0 0 "[ . 1 . 2]" 1 243 1 40 LYS H 1 40 LYS HB3 . . 3.080 3.094 3.017 3.194 0.114 17 0 "[ . 1 . 2]" 1 244 1 40 LYS H 1 40 LYS QE . . 6.380 5.236 4.399 5.701 . 0 0 "[ . 1 . 2]" 1 245 1 40 LYS H 1 40 LYS HG2 . . 4.510 4.108 3.635 4.261 . 0 0 "[ . 1 . 2]" 1 246 1 40 LYS H 1 40 LYS QG . . 3.920 3.549 3.434 3.634 . 0 0 "[ . 1 . 2]" 1 247 1 40 LYS H 1 40 LYS HG3 . . 4.510 3.910 3.708 4.220 . 0 0 "[ . 1 . 2]" 1 248 1 40 LYS H 1 41 GLU H . . 3.520 2.654 2.424 2.763 . 0 0 "[ . 1 . 2]" 1 249 1 40 LYS H 1 41 GLU QG . . 6.220 4.465 3.627 5.408 . 0 0 "[ . 1 . 2]" 1 250 1 40 LYS HA 1 41 GLU QB . . 6.380 5.447 5.335 5.547 . 0 0 "[ . 1 . 2]" 1 251 1 40 LYS HA 1 43 LEU H . . 4.260 3.515 3.281 3.650 . 0 0 "[ . 1 . 2]" 1 252 1 40 LYS HA 1 43 LEU MD1 . . 4.360 2.318 2.092 2.967 . 0 0 "[ . 1 . 2]" 1 253 1 40 LYS HA 1 43 LEU HG . . 5.500 4.083 3.584 4.528 . 0 0 "[ . 1 . 2]" 1 254 1 40 LYS QB 1 41 GLU H . . 3.640 2.525 2.407 2.832 . 0 0 "[ . 1 . 2]" 1 255 1 40 LYS QB 1 43 LEU H . . 5.640 4.887 4.708 5.060 . 0 0 "[ . 1 . 2]" 1 256 1 40 LYS HB2 1 41 GLU H . . 3.950 3.202 3.022 3.365 . 0 0 "[ . 1 . 2]" 1 257 1 40 LYS HB3 1 41 GLU H . . 3.950 2.647 2.481 3.047 . 0 0 "[ . 1 . 2]" 1 258 1 40 LYS QG 1 41 GLU H . . 5.110 4.384 4.299 4.534 . 0 0 "[ . 1 . 2]" 1 259 1 40 LYS HG2 1 41 GLU H . . 5.500 4.774 4.651 4.942 . 0 0 "[ . 1 . 2]" 1 260 1 40 LYS HG3 1 41 GLU H . . 5.500 5.109 5.020 5.293 . 0 0 "[ . 1 . 2]" 1 261 1 41 GLU H 1 41 GLU QG . . 3.900 2.495 1.969 3.045 . 0 0 "[ . 1 . 2]" 1 262 1 41 GLU H 1 42 LYS H . . 3.140 2.675 2.429 2.828 . 0 0 "[ . 1 . 2]" 1 263 1 41 GLU H 1 43 LEU H . . 4.760 4.275 4.027 4.521 . 0 0 "[ . 1 . 2]" 1 264 1 41 GLU HA 1 44 GLU H . . 4.290 2.870 2.793 2.986 . 0 0 "[ . 1 . 2]" 1 265 1 41 GLU QG 1 42 LYS H . . 6.130 3.404 1.972 4.615 . 0 0 "[ . 1 . 2]" 1 266 1 42 LYS H 1 42 LYS HB3 . . 3.140 3.079 2.093 3.231 0.091 7 0 "[ . 1 . 2]" 1 267 1 42 LYS H 1 42 LYS QD . . 5.730 3.400 2.886 4.451 . 0 0 "[ . 1 . 2]" 1 268 1 42 LYS H 1 42 LYS QG . . 4.330 3.764 3.371 3.930 . 0 0 "[ . 1 . 2]" 1 269 1 42 LYS H 1 43 LEU H . . 3.170 2.689 2.570 2.777 . 0 0 "[ . 1 . 2]" 1 270 1 42 LYS HA 1 42 LYS QD . . 3.560 2.251 1.981 2.862 . 0 0 "[ . 1 . 2]" 1 271 1 42 LYS HA 1 45 GLU H . . 3.890 3.735 3.623 3.881 . 0 0 "[ . 1 . 2]" 1 272 1 42 LYS HA 1 45 GLU HG2 . . 3.610 3.458 3.282 3.624 0.014 10 0 "[ . 1 . 2]" 1 273 1 42 LYS HB2 1 43 LEU H . . 4.850 3.475 3.302 4.362 . 0 0 "[ . 1 . 2]" 1 274 1 42 LYS HB3 1 43 LEU H . . 3.490 3.077 2.923 3.240 . 0 0 "[ . 1 . 2]" 1 275 1 43 LEU H 1 43 LEU MD1 . . 5.010 3.054 2.629 3.421 . 0 0 "[ . 1 . 2]" 1 276 1 43 LEU H 1 43 LEU MD2 . . 4.670 3.792 3.434 3.968 . 0 0 "[ . 1 . 2]" 1 277 1 43 LEU H 1 43 LEU HG . . 3.800 2.383 1.968 2.705 . 0 0 "[ . 1 . 2]" 1 278 1 43 LEU H 1 44 GLU H . . 3.360 2.362 2.328 2.412 . 0 0 "[ . 1 . 2]" 1 279 1 43 LEU HA 1 43 LEU MD2 . . 4.140 2.472 2.190 2.876 . 0 0 "[ . 1 . 2]" 1 280 1 43 LEU HA 1 43 LEU HG . . 3.610 2.807 2.647 3.079 . 0 0 "[ . 1 . 2]" 1 281 1 43 LEU HA 1 46 ILE H . . 4.850 3.226 3.092 3.296 . 0 0 "[ . 1 . 2]" 1 282 1 43 LEU HA 1 46 ILE MD . . 4.730 2.557 2.249 2.967 . 0 0 "[ . 1 . 2]" 1 283 1 43 LEU QB 1 44 GLU H . . 5.640 2.903 2.675 2.994 . 0 0 "[ . 1 . 2]" 1 284 1 43 LEU MD2 1 46 ILE H . . 6.530 5.012 4.694 5.336 . 0 0 "[ . 1 . 2]" 1 285 1 43 LEU HG 1 44 GLU H . . 5.440 4.423 4.135 4.598 . 0 0 "[ . 1 . 2]" 1 286 1 44 GLU H 1 44 GLU HB2 . . 3.270 2.397 2.245 2.576 . 0 0 "[ . 1 . 2]" 1 287 1 44 GLU H 1 44 GLU HG2 . . 2.990 3.010 2.887 3.105 0.115 17 0 "[ . 1 . 2]" 1 288 1 44 GLU H 1 44 GLU HG3 . . 2.990 2.486 1.912 3.017 0.027 5 0 "[ . 1 . 2]" 1 289 1 44 GLU H 1 45 GLU H . . 3.550 2.655 2.580 2.758 . 0 0 "[ . 1 . 2]" 1 290 1 44 GLU HA 1 47 VAL MG2 . . 5.290 3.131 1.774 4.261 . 0 0 "[ . 1 . 2]" 1 291 1 44 GLU HB2 1 44 GLU QG . . 2.720 2.262 2.190 2.389 . 0 0 "[ . 1 . 2]" 1 292 1 44 GLU HB2 1 45 GLU H . . 4.230 3.230 3.153 3.307 . 0 0 "[ . 1 . 2]" 1 293 1 44 GLU HB2 1 45 GLU HG2 . . 3.450 3.444 3.345 3.530 0.080 15 0 "[ . 1 . 2]" 1 294 1 45 GLU H 1 45 GLU HB2 . . 2.990 2.771 2.747 2.813 . 0 0 "[ . 1 . 2]" 1 295 1 45 GLU H 1 45 GLU HB3 . . 3.860 3.551 3.534 3.568 . 0 0 "[ . 1 . 2]" 1 296 1 45 GLU H 1 45 GLU HG2 . . 2.930 2.267 2.118 2.376 . 0 0 "[ . 1 . 2]" 1 297 1 45 GLU H 1 45 GLU HG3 . . 3.210 2.180 2.097 2.309 . 0 0 "[ . 1 . 2]" 1 298 1 45 GLU H 1 46 ILE H . . 3.640 2.589 2.541 2.686 . 0 0 "[ . 1 . 2]" 1 299 1 45 GLU HA 1 45 GLU HB3 . . 2.680 2.362 2.345 2.379 . 0 0 "[ . 1 . 2]" 1 300 1 45 GLU HA 1 45 GLU HG2 . . 3.330 2.652 2.610 2.707 . 0 0 "[ . 1 . 2]" 1 301 1 45 GLU HB2 1 46 ILE H . . 3.950 2.437 2.367 2.563 . 0 0 "[ . 1 . 2]" 1 302 1 45 GLU HB3 1 45 GLU HG2 . . 2.900 2.738 2.706 2.778 . 0 0 "[ . 1 . 2]" 1 303 1 45 GLU HB3 1 46 ILE H . . 4.040 3.812 3.761 3.906 . 0 0 "[ . 1 . 2]" 1 304 1 45 GLU HG2 1 46 ILE H . . 5.500 4.305 4.179 4.370 . 0 0 "[ . 1 . 2]" 1 305 1 45 GLU HG3 1 46 ILE H . . 3.670 3.684 3.611 3.781 0.111 15 0 "[ . 1 . 2]" 1 306 1 46 ILE H 1 46 ILE HB . . 3.610 3.525 3.513 3.556 . 0 0 "[ . 1 . 2]" 1 307 1 46 ILE H 1 46 ILE MD . . 4.790 3.572 3.486 3.640 . 0 0 "[ . 1 . 2]" 1 308 1 46 ILE H 1 46 ILE HG12 . . 3.520 1.891 1.827 1.949 . 0 0 "[ . 1 . 2]" 1 309 1 46 ILE H 1 46 ILE QG . . 3.220 1.862 1.807 1.910 . 0 0 "[ . 1 . 2]" 1 310 1 46 ILE H 1 46 ILE HG13 . . 3.520 2.828 2.470 3.000 . 0 0 "[ . 1 . 2]" 1 311 1 46 ILE H 1 46 ILE MG . . 4.700 2.398 2.240 2.554 . 0 0 "[ . 1 . 2]" 1 312 1 46 ILE H 1 47 VAL H . . 4.170 2.711 2.380 2.882 . 0 0 "[ . 1 . 2]" 1 313 1 46 ILE HA 1 49 LYS H . . 4.320 3.399 3.141 3.786 . 0 0 "[ . 1 . 2]" 1 314 1 46 ILE HB 1 47 VAL H . . 4.970 3.647 3.424 4.031 . 0 0 "[ . 1 . 2]" 1 315 1 46 ILE HB 1 126 ILE MD . . 5.070 3.961 3.851 4.016 . 0 0 "[ . 1 . 2]" 1 316 1 46 ILE HB 1 126 ILE MG . . 5.850 2.584 2.106 2.741 . 0 0 "[ . 1 . 2]" 1 317 1 46 ILE MD 1 47 VAL MG2 . . 7.560 4.373 3.989 4.935 . 0 0 "[ . 1 . 2]" 1 318 1 46 ILE MD 1 123 ILE MD . . 5.910 3.951 3.728 4.034 . 0 0 "[ . 1 . 2]" 1 319 1 46 ILE MD 1 123 ILE MG . . 6.350 2.261 1.901 2.536 . 0 0 "[ . 1 . 2]" 1 320 1 46 ILE MD 1 126 ILE H . . 6.530 4.270 4.001 4.516 . 0 0 "[ . 1 . 2]" 1 321 1 46 ILE MD 1 126 ILE MD . . 5.660 1.815 1.720 1.987 . 0 0 "[ . 1 . 2]" 1 322 1 46 ILE MD 1 126 ILE MG . . 5.420 1.920 1.699 2.111 . 0 0 "[ . 1 . 2]" 1 323 1 46 ILE MD 1 127 LEU H . . 6.530 4.010 3.765 4.544 . 0 0 "[ . 1 . 2]" 1 324 1 46 ILE MD 1 127 LEU HA . . 5.880 4.662 4.477 4.838 . 0 0 "[ . 1 . 2]" 1 325 1 46 ILE MD 1 151 TYR HB2 . . 4.260 3.481 3.400 3.553 . 0 0 "[ . 1 . 2]" 1 326 1 46 ILE MD 1 155 VAL MG2 . . 5.660 2.444 2.081 3.212 . 0 0 "[ . 1 . 2]" 1 327 1 46 ILE QG 1 47 VAL H . . 3.280 1.936 1.732 2.389 . 0 0 "[ . 1 . 2]" 1 328 1 46 ILE MG 1 47 VAL H . . 5.160 4.077 4.005 4.220 . 0 0 "[ . 1 . 2]" 1 329 1 46 ILE MG 1 123 ILE MD . . 7.560 4.773 4.396 5.008 . 0 0 "[ . 1 . 2]" 1 330 1 46 ILE MG 1 123 ILE MG . . 7.460 3.727 3.269 3.976 . 0 0 "[ . 1 . 2]" 1 331 1 46 ILE MG 1 126 ILE MD . . 7.460 4.196 4.083 4.401 . 0 0 "[ . 1 . 2]" 1 332 1 46 ILE MG 1 126 ILE MG . . 5.450 3.681 3.507 3.801 . 0 0 "[ . 1 . 2]" 1 333 1 46 ILE MG 1 130 ALA MB . . 7.560 5.083 4.920 5.204 . 0 0 "[ . 1 . 2]" 1 334 1 46 ILE MG 1 151 TYR QD . . 8.670 2.041 1.765 2.392 . 0 0 "[ . 1 . 2]" 1 335 1 47 VAL H 1 47 VAL HB . . 3.670 2.662 2.023 3.535 . 0 0 "[ . 1 . 2]" 1 336 1 47 VAL H 1 47 VAL MG1 . . 3.490 2.540 1.985 2.832 . 0 0 "[ . 1 . 2]" 1 337 1 47 VAL H 1 47 VAL MG2 . . 4.420 2.856 1.758 3.714 . 0 0 "[ . 1 . 2]" 1 338 1 47 VAL H 1 48 LYS H . . 3.080 2.650 2.498 2.882 . 0 0 "[ . 1 . 2]" 1 339 1 47 VAL H 1 126 ILE MG . . 5.320 3.167 2.765 3.775 . 0 0 "[ . 1 . 2]" 1 340 1 47 VAL HA 1 126 ILE MG . . 5.440 2.679 2.087 3.050 . 0 0 "[ . 1 . 2]" 1 341 1 47 VAL HB 1 48 LYS H . . 4.200 3.552 3.209 3.887 . 0 0 "[ . 1 . 2]" 1 342 1 47 VAL MG1 1 48 LYS H . . 5.100 2.821 1.891 4.180 . 0 0 "[ . 1 . 2]" 1 343 1 47 VAL MG1 1 52 GLY H . . 5.380 4.215 3.401 4.494 . 0 0 "[ . 1 . 2]" 1 344 1 47 VAL MG1 1 54 VAL H . . 5.750 4.040 3.038 4.576 . 0 0 "[ . 1 . 2]" 1 345 1 47 VAL MG1 1 54 VAL QG . . 7.220 2.764 1.687 4.155 . 0 0 "[ . 1 . 2]" 1 346 1 47 VAL MG2 1 48 LYS H . . 5.940 3.217 1.821 4.235 . 0 0 "[ . 1 . 2]" 1 347 1 47 VAL MG2 1 126 ILE MG . . 5.510 3.150 1.924 3.774 . 0 0 "[ . 1 . 2]" 1 348 1 48 LYS H 1 48 LYS HB2 . . 3.860 2.452 2.065 2.914 . 0 0 "[ . 1 . 2]" 1 349 1 48 LYS H 1 48 LYS QB . . 3.690 2.159 2.028 2.205 . 0 0 "[ . 1 . 2]" 1 350 1 48 LYS H 1 48 LYS HB3 . . 3.860 2.513 2.117 2.969 . 0 0 "[ . 1 . 2]" 1 351 1 48 LYS H 1 48 LYS QG . . 5.010 3.908 3.722 3.958 . 0 0 "[ . 1 . 2]" 1 352 1 48 LYS H 1 49 LYS H . . 3.640 2.663 2.524 2.884 . 0 0 "[ . 1 . 2]" 1 353 1 48 LYS HA 1 52 GLY H . . 3.580 3.220 2.355 3.660 0.080 17 0 "[ . 1 . 2]" 1 354 1 48 LYS QB 1 49 LYS H . . 4.620 2.687 2.453 3.203 . 0 0 "[ . 1 . 2]" 1 355 1 48 LYS HB2 1 49 LYS H . . 4.940 3.907 3.463 4.393 . 0 0 "[ . 1 . 2]" 1 356 1 48 LYS HB3 1 49 LYS H . . 4.940 2.741 2.485 3.291 . 0 0 "[ . 1 . 2]" 1 357 1 48 LYS QG 1 49 LYS H . . 5.420 3.783 2.953 4.292 . 0 0 "[ . 1 . 2]" 1 358 1 48 LYS QG 1 49 LYS HA . . 5.230 3.925 3.196 4.664 . 0 0 "[ . 1 . 2]" 1 359 1 49 LYS H 1 49 LYS HB2 . . 3.270 2.469 2.211 2.661 . 0 0 "[ . 1 . 2]" 1 360 1 49 LYS H 1 49 LYS HB3 . . 3.270 2.466 2.321 2.748 . 0 0 "[ . 1 . 2]" 1 361 1 49 LYS H 1 49 LYS HG2 . . 4.600 4.428 4.287 4.598 . 0 0 "[ . 1 . 2]" 1 362 1 49 LYS H 1 49 LYS QG . . 4.320 3.919 3.903 3.936 . 0 0 "[ . 1 . 2]" 1 363 1 49 LYS H 1 49 LYS HG3 . . 4.600 4.379 4.223 4.511 . 0 0 "[ . 1 . 2]" 1 364 1 49 LYS H 1 50 GLU H . . 3.390 2.802 2.553 3.146 . 0 0 "[ . 1 . 2]" 1 365 1 49 LYS H 1 51 ILE H . . 5.470 4.435 3.653 4.707 . 0 0 "[ . 1 . 2]" 1 366 1 49 LYS HA 1 49 LYS HG2 . . 3.890 3.270 3.048 3.570 . 0 0 "[ . 1 . 2]" 1 367 1 49 LYS HA 1 49 LYS QG . . 3.510 2.361 2.087 2.512 . 0 0 "[ . 1 . 2]" 1 368 1 49 LYS HA 1 49 LYS HG3 . . 3.890 2.431 2.111 2.663 . 0 0 "[ . 1 . 2]" 1 369 1 49 LYS QB 1 50 GLU H . . 3.770 2.534 2.146 2.827 . 0 0 "[ . 1 . 2]" 1 370 1 49 LYS HB2 1 50 GLU H . . 4.040 3.896 3.488 4.081 0.041 14 0 "[ . 1 . 2]" 1 371 1 49 LYS HB3 1 50 GLU H . . 4.040 2.568 2.166 2.882 . 0 0 "[ . 1 . 2]" 1 372 1 49 LYS QG 1 50 GLU H . . 4.210 3.518 3.165 3.789 . 0 0 "[ . 1 . 2]" 1 373 1 50 GLU H 1 50 GLU HB2 . . 3.110 2.331 2.071 2.630 . 0 0 "[ . 1 . 2]" 1 374 1 50 GLU H 1 50 GLU HB3 . . 3.110 2.708 2.371 3.122 0.012 16 0 "[ . 1 . 2]" 1 375 1 50 GLU H 1 51 ILE H . . 3.140 2.884 2.545 3.161 0.021 19 0 "[ . 1 . 2]" 1 376 1 50 GLU H 1 51 ILE MG . . 6.160 4.526 4.183 4.949 . 0 0 "[ . 1 . 2]" 1 377 1 50 GLU H 1 126 ILE MG . . 6.000 4.767 3.973 5.041 . 0 0 "[ . 1 . 2]" 1 378 1 50 GLU HA 1 51 ILE HB . . 5.030 4.781 4.320 5.081 0.051 19 0 "[ . 1 . 2]" 1 379 1 51 ILE H 1 51 ILE HB . . 3.390 3.364 2.883 3.557 0.167 16 0 "[ . 1 . 2]" 1 380 1 51 ILE H 1 51 ILE MD . . 5.780 4.546 3.611 4.869 . 0 0 "[ . 1 . 2]" 1 381 1 51 ILE H 1 52 GLY H . . 3.670 2.431 1.936 3.836 0.166 16 0 "[ . 1 . 2]" 1 382 1 51 ILE H 1 52 GLY QA . . 5.600 3.757 3.467 4.670 . 0 0 "[ . 1 . 2]" 1 383 1 51 ILE HB 1 51 ILE MD . . 3.430 2.278 2.089 2.646 . 0 0 "[ . 1 . 2]" 1 384 1 51 ILE HB 1 52 GLY H . . 4.880 4.063 3.830 4.689 . 0 0 "[ . 1 . 2]" 1 385 1 51 ILE MD 1 52 GLY H . . 5.290 4.254 3.728 4.457 . 0 0 "[ . 1 . 2]" 1 386 1 51 ILE MG 1 52 GLY H . . 4.950 2.419 1.792 4.128 . 0 0 "[ . 1 . 2]" 1 387 1 53 ASP H 1 53 ASP HB2 . . 3.360 3.051 2.206 3.363 0.003 12 0 "[ . 1 . 2]" 1 388 1 53 ASP H 1 53 ASP QB . . 3.090 2.687 2.167 2.998 . 0 0 "[ . 1 . 2]" 1 389 1 53 ASP H 1 53 ASP HB3 . . 3.360 3.081 2.312 3.393 0.033 16 0 "[ . 1 . 2]" 1 390 1 53 ASP H 1 54 VAL H . . 4.480 3.441 2.477 4.382 . 0 0 "[ . 1 . 2]" 1 391 1 53 ASP H 1 54 VAL MG1 . . 6.530 4.018 2.230 5.458 . 0 0 "[ . 1 . 2]" 1 392 1 53 ASP H 1 54 VAL QG . . 5.880 3.473 2.224 4.527 . 0 0 "[ . 1 . 2]" 1 393 1 53 ASP H 1 54 VAL MG2 . . 6.530 4.505 2.698 5.496 . 0 0 "[ . 1 . 2]" 1 394 1 53 ASP HA 1 54 VAL H . . 3.550 2.465 2.254 2.861 . 0 0 "[ . 1 . 2]" 1 395 1 53 ASP HB2 1 54 VAL H . . 5.000 4.569 3.971 4.718 . 0 0 "[ . 1 . 2]" 1 396 1 53 ASP HB3 1 54 VAL H . . 5.000 4.328 4.034 4.626 . 0 0 "[ . 1 . 2]" 1 397 1 54 VAL H 1 54 VAL HB . . 4.070 3.278 2.494 3.924 . 0 0 "[ . 1 . 2]" 1 398 1 54 VAL H 1 54 VAL MG1 . . 4.760 2.798 2.231 3.932 . 0 0 "[ . 1 . 2]" 1 399 1 54 VAL H 1 54 VAL QG . . 3.960 2.357 1.901 2.915 . 0 0 "[ . 1 . 2]" 1 400 1 54 VAL H 1 54 VAL MG2 . . 4.760 3.073 1.939 4.024 . 0 0 "[ . 1 . 2]" 1 401 1 54 VAL H 1 55 HIS H . . 5.500 4.368 4.211 4.474 . 0 0 "[ . 1 . 2]" 1 402 1 54 VAL HA 1 55 HIS H . . 3.300 2.674 2.424 2.930 . 0 0 "[ . 1 . 2]" 1 403 1 54 VAL HA 1 55 HIS HD2 . . 5.470 3.075 2.124 4.646 . 0 0 "[ . 1 . 2]" 1 404 1 54 VAL HB 1 55 HIS H . . 3.890 3.053 1.934 3.923 0.033 11 0 "[ . 1 . 2]" 1 405 1 54 VAL QG 1 55 HIS H . . 5.060 2.137 1.797 2.839 . 0 0 "[ . 1 . 2]" 1 406 1 54 VAL QG 1 55 HIS HD2 . . 5.800 4.038 3.375 4.378 . 0 0 "[ . 1 . 2]" 1 407 1 54 VAL QG 1 56 VAL MG2 . . 6.300 2.583 1.969 3.444 . 0 0 "[ . 1 . 2]" 1 408 1 54 VAL MG1 1 55 HIS H . . 5.540 3.053 1.872 3.845 . 0 0 "[ . 1 . 2]" 1 409 1 54 VAL MG1 1 55 HIS HD2 . . 6.530 4.615 3.456 5.206 . 0 0 "[ . 1 . 2]" 1 410 1 54 VAL MG1 1 56 VAL MG2 . . 7.000 3.577 2.395 4.749 . 0 0 "[ . 1 . 2]" 1 411 1 54 VAL MG2 1 55 HIS H . . 5.540 2.472 1.818 4.009 . 0 0 "[ . 1 . 2]" 1 412 1 54 VAL MG2 1 55 HIS HD2 . . 6.530 4.588 3.840 5.174 . 0 0 "[ . 1 . 2]" 1 413 1 54 VAL MG2 1 56 VAL MG2 . . 7.000 3.063 1.991 4.636 . 0 0 "[ . 1 . 2]" 1 414 1 55 HIS H 1 56 VAL H . . 4.910 3.920 3.713 4.217 . 0 0 "[ . 1 . 2]" 1 415 1 55 HIS H 1 93 TYR QB . . 5.790 3.694 2.120 5.028 . 0 0 "[ . 1 . 2]" 1 416 1 55 HIS HA 1 56 VAL H . . 3.360 2.209 2.186 2.237 . 0 0 "[ . 1 . 2]" 1 417 1 55 HIS HA 1 56 VAL MG2 . . 6.530 4.350 3.846 4.584 . 0 0 "[ . 1 . 2]" 1 418 1 55 HIS QB 1 55 HIS HD2 . . 3.560 2.925 2.756 3.140 . 0 0 "[ . 1 . 2]" 1 419 1 55 HIS QB 1 56 VAL H . . 5.290 3.607 3.074 3.783 . 0 0 "[ . 1 . 2]" 1 420 1 56 VAL H 1 56 VAL HB . . 3.860 2.367 2.234 2.550 . 0 0 "[ . 1 . 2]" 1 421 1 56 VAL H 1 57 ASN H . . 5.220 4.168 3.959 4.486 . 0 0 "[ . 1 . 2]" 1 422 1 56 VAL MG1 1 57 ASN H . . 4.260 3.219 2.798 3.338 . 0 0 "[ . 1 . 2]" 1 423 1 56 VAL MG1 1 95 GLU HA . . 5.880 4.295 3.533 4.712 . 0 0 "[ . 1 . 2]" 1 424 1 56 VAL MG1 1 125 GLY H . . 5.810 3.885 3.123 4.414 . 0 0 "[ . 1 . 2]" 1 425 1 56 VAL MG2 1 57 ASN H . . 4.950 3.870 3.341 4.064 . 0 0 "[ . 1 . 2]" 1 426 1 56 VAL MG2 1 93 TYR QD . . 8.670 5.530 4.569 6.360 . 0 0 "[ . 1 . 2]" 1 427 1 56 VAL MG2 1 125 GLY H . . 5.160 4.035 3.681 4.207 . 0 0 "[ . 1 . 2]" 1 428 1 57 ASN H 1 92 VAL QG . . 7.960 4.889 3.889 5.902 . 0 0 "[ . 1 . 2]" 1 429 1 57 ASN H 1 95 GLU HA . . 4.970 2.543 2.138 2.784 . 0 0 "[ . 1 . 2]" 1 430 1 57 ASN HA 1 58 VAL H . . 3.110 2.274 2.252 2.320 . 0 0 "[ . 1 . 2]" 1 431 1 57 ASN HA 1 58 VAL MG2 . . 5.500 4.344 3.972 4.550 . 0 0 "[ . 1 . 2]" 1 432 1 57 ASN QB 1 59 ILE MD . . 5.920 3.227 2.600 4.171 . 0 0 "[ . 1 . 2]" 1 433 1 58 VAL H 1 58 VAL HB . . 3.550 2.909 2.099 3.658 0.108 11 0 "[ . 1 . 2]" 1 434 1 58 VAL H 1 58 VAL MG2 . . 3.680 2.767 2.233 3.174 . 0 0 "[ . 1 . 2]" 1 435 1 58 VAL HA 1 59 ILE H . . 3.170 2.226 2.195 2.343 . 0 0 "[ . 1 . 2]" 1 436 1 58 VAL HA 1 96 ILE H . . 4.720 2.716 2.043 3.150 . 0 0 "[ . 1 . 2]" 1 437 1 58 VAL MG2 1 59 ILE H . . 4.450 3.563 3.287 3.771 . 0 0 "[ . 1 . 2]" 1 438 1 58 VAL MG2 1 97 TYR HA . . 6.120 4.994 4.890 5.067 . 0 0 "[ . 1 . 2]" 1 439 1 59 ILE H 1 59 ILE HB . . 3.890 2.626 2.458 2.916 . 0 0 "[ . 1 . 2]" 1 440 1 59 ILE H 1 59 ILE MD . . 4.330 2.328 1.849 2.631 . 0 0 "[ . 1 . 2]" 1 441 1 59 ILE H 1 59 ILE HG12 . . 4.630 3.893 2.027 4.234 . 0 0 "[ . 1 . 2]" 1 442 1 59 ILE H 1 59 ILE HG13 . . 3.920 3.131 2.771 3.691 . 0 0 "[ . 1 . 2]" 1 443 1 59 ILE H 1 60 LEU H . . 5.310 4.245 4.160 4.321 . 0 0 "[ . 1 . 2]" 1 444 1 59 ILE H 1 96 ILE H . . 4.450 3.764 2.960 4.253 . 0 0 "[ . 1 . 2]" 1 445 1 59 ILE H 1 97 TYR H . . 4.880 4.377 4.090 4.509 . 0 0 "[ . 1 . 2]" 1 446 1 59 ILE H 1 97 TYR HA . . 3.670 2.275 2.070 2.608 . 0 0 "[ . 1 . 2]" 1 447 1 59 ILE H 1 97 TYR QD . . 7.640 4.430 4.075 4.648 . 0 0 "[ . 1 . 2]" 1 448 1 59 ILE HA 1 60 LEU H . . 3.450 2.186 2.177 2.193 . 0 0 "[ . 1 . 2]" 1 449 1 59 ILE HB 1 97 TYR HA . . 4.010 2.093 1.983 2.341 . 0 0 "[ . 1 . 2]" 1 450 1 59 ILE HB 1 98 VAL H . . 5.380 3.669 3.179 3.950 . 0 0 "[ . 1 . 2]" 1 451 1 59 ILE MD 1 95 GLU HB2 . . 5.630 1.918 1.770 2.521 . 0 0 "[ . 1 . 2]" 1 452 1 59 ILE MD 1 95 GLU HB3 . . 4.080 3.106 2.190 3.325 . 0 0 "[ . 1 . 2]" 1 453 1 59 ILE MD 1 97 TYR QD . . 7.890 2.635 2.162 4.001 . 0 0 "[ . 1 . 2]" 1 454 1 59 ILE MD 1 97 TYR QE . . 7.570 2.696 2.135 4.057 . 0 0 "[ . 1 . 2]" 1 455 1 59 ILE MD 1 98 VAL H . . 5.750 4.360 3.966 4.805 . 0 0 "[ . 1 . 2]" 1 456 1 59 ILE MG 1 60 LEU H . . 4.610 3.059 2.885 3.202 . 0 0 "[ . 1 . 2]" 1 457 1 59 ILE MG 1 69 LEU HG . . 4.480 3.565 3.320 3.666 . 0 0 "[ . 1 . 2]" 1 458 1 59 ILE MG 1 97 TYR QD . . 8.610 2.220 1.961 2.795 . 0 0 "[ . 1 . 2]" 1 459 1 59 ILE MG 1 97 TYR QE . . 8.660 2.186 1.935 2.733 . 0 0 "[ . 1 . 2]" 1 460 1 59 ILE MG 1 98 VAL H . . 5.470 4.448 4.302 4.601 . 0 0 "[ . 1 . 2]" 1 461 1 60 LEU H 1 60 LEU HB2 . . 4.070 2.529 2.478 2.578 . 0 0 "[ . 1 . 2]" 1 462 1 60 LEU H 1 60 LEU QB . . 3.820 2.481 2.435 2.522 . 0 0 "[ . 1 . 2]" 1 463 1 60 LEU H 1 60 LEU HB3 . . 4.070 3.589 3.571 3.615 . 0 0 "[ . 1 . 2]" 1 464 1 60 LEU H 1 60 LEU MD1 . . 4.850 3.348 3.150 3.475 . 0 0 "[ . 1 . 2]" 1 465 1 60 LEU H 1 60 LEU MD2 . . 5.660 3.554 3.303 3.738 . 0 0 "[ . 1 . 2]" 1 466 1 60 LEU H 1 60 LEU HG . . 4.290 2.234 2.092 2.369 . 0 0 "[ . 1 . 2]" 1 467 1 60 LEU H 1 61 VAL H . . 4.720 4.453 4.372 4.529 . 0 0 "[ . 1 . 2]" 1 468 1 60 LEU HA 1 60 LEU MD2 . . 4.230 2.386 2.168 2.547 . 0 0 "[ . 1 . 2]" 1 469 1 60 LEU HA 1 61 VAL H . . 2.930 2.180 2.176 2.187 . 0 0 "[ . 1 . 2]" 1 470 1 60 LEU HA 1 61 VAL MG2 . . 6.470 3.861 3.740 3.968 . 0 0 "[ . 1 . 2]" 1 471 1 60 LEU HA 1 98 VAL HB . . 4.510 3.710 3.302 4.016 . 0 0 "[ . 1 . 2]" 1 472 1 60 LEU HA 1 98 VAL MG2 . . 6.500 4.926 4.460 5.259 . 0 0 "[ . 1 . 2]" 1 473 1 60 LEU QB 1 61 VAL H . . 4.990 3.418 3.294 3.560 . 0 0 "[ . 1 . 2]" 1 474 1 60 LEU HB2 1 61 VAL H . . 5.500 4.324 4.249 4.420 . 0 0 "[ . 1 . 2]" 1 475 1 60 LEU HB3 1 61 VAL H . . 5.500 3.581 3.431 3.754 . 0 0 "[ . 1 . 2]" 1 476 1 60 LEU MD1 1 61 VAL H . . 6.530 5.418 5.330 5.487 . 0 0 "[ . 1 . 2]" 1 477 1 60 LEU MD2 1 61 VAL H . . 4.980 3.971 3.711 4.032 . 0 0 "[ . 1 . 2]" 1 478 1 60 LEU MD2 1 98 VAL H . . 6.220 4.004 3.381 4.330 . 0 0 "[ . 1 . 2]" 1 479 1 60 LEU MD2 1 98 VAL HB . . 4.260 2.965 2.097 3.417 . 0 0 "[ . 1 . 2]" 1 480 1 60 LEU MD2 1 99 CYS HA . . 6.530 4.710 4.428 5.053 . 0 0 "[ . 1 . 2]" 1 481 1 60 LEU MD2 1 100 PRO QD . . 6.910 3.296 3.020 3.643 . 0 0 "[ . 1 . 2]" 1 482 1 60 LEU MD2 1 118 LEU HG . . 5.910 4.818 4.448 5.050 . 0 0 "[ . 1 . 2]" 1 483 1 61 VAL H 1 61 VAL MG1 . . 4.050 3.027 2.954 3.173 . 0 0 "[ . 1 . 2]" 1 484 1 61 VAL H 1 61 VAL MG2 . . 4.360 2.440 2.319 2.592 . 0 0 "[ . 1 . 2]" 1 485 1 61 VAL H 1 98 VAL H . . 4.170 3.749 3.516 3.970 . 0 0 "[ . 1 . 2]" 1 486 1 61 VAL H 1 99 CYS HA . . 5.310 3.050 2.824 3.224 . 0 0 "[ . 1 . 2]" 1 487 1 61 VAL H 1 100 PRO QD . . 5.690 3.471 3.195 3.631 . 0 0 "[ . 1 . 2]" 1 488 1 61 VAL HA 1 62 SER H . . 3.020 2.248 2.213 2.275 . 0 0 "[ . 1 . 2]" 1 489 1 61 VAL HB 1 62 SER H . . 3.490 3.102 2.996 3.256 . 0 0 "[ . 1 . 2]" 1 490 1 61 VAL HB 1 65 GLU H . . 4.880 4.523 4.318 4.767 . 0 0 "[ . 1 . 2]" 1 491 1 61 VAL HB 1 65 GLU HB2 . . 3.610 2.667 1.987 3.647 0.037 16 0 "[ . 1 . 2]" 1 492 1 61 VAL HB 1 65 GLU QB . . 3.170 1.990 1.801 2.102 . 0 0 "[ . 1 . 2]" 1 493 1 61 VAL HB 1 65 GLU HB3 . . 3.610 2.194 1.963 2.524 . 0 0 "[ . 1 . 2]" 1 494 1 61 VAL MG1 1 66 ILE H . . 6.500 4.869 4.778 5.042 . 0 0 "[ . 1 . 2]" 1 495 1 61 VAL MG1 1 66 ILE HB . . 5.070 4.262 4.161 4.337 . 0 0 "[ . 1 . 2]" 1 496 1 61 VAL MG1 1 66 ILE MD . . 6.840 3.895 3.602 4.374 . 0 0 "[ . 1 . 2]" 1 497 1 61 VAL MG1 1 97 TYR HA . . 6.220 4.346 4.100 4.531 . 0 0 "[ . 1 . 2]" 1 498 1 61 VAL MG1 1 98 VAL H . . 6.310 4.318 4.086 4.616 . 0 0 "[ . 1 . 2]" 1 499 1 61 VAL MG1 1 99 CYS HA . . 6.530 5.421 5.307 5.485 . 0 0 "[ . 1 . 2]" 1 500 1 61 VAL MG2 1 62 SER H . . 4.700 3.848 3.694 3.965 . 0 0 "[ . 1 . 2]" 1 501 1 61 VAL MG2 1 65 GLU QB . . 7.070 3.363 3.018 3.546 . 0 0 "[ . 1 . 2]" 1 502 1 61 VAL MG2 1 69 LEU MD1 . . 7.560 3.883 3.296 4.178 . 0 0 "[ . 1 . 2]" 1 503 1 61 VAL MG2 1 69 LEU MD2 . . 7.560 4.501 4.077 4.718 . 0 0 "[ . 1 . 2]" 1 504 1 61 VAL MG2 1 97 TYR QD . . 6.680 2.697 2.143 3.463 . 0 0 "[ . 1 . 2]" 1 505 1 61 VAL MG2 1 97 TYR QE . . 7.950 4.508 3.764 5.179 . 0 0 "[ . 1 . 2]" 1 506 1 62 SER H 1 63 GLU H . . 4.720 4.436 4.407 4.466 . 0 0 "[ . 1 . 2]" 1 507 1 62 SER H 1 65 GLU H . . 4.790 3.496 3.304 3.707 . 0 0 "[ . 1 . 2]" 1 508 1 62 SER H 1 65 GLU HB2 . . 4.200 1.923 1.882 1.992 . 0 0 "[ . 1 . 2]" 1 509 1 62 SER H 1 65 GLU QB . . 3.830 1.881 1.784 1.962 . 0 0 "[ . 1 . 2]" 1 510 1 62 SER H 1 65 GLU HB3 . . 4.200 2.911 2.109 3.367 . 0 0 "[ . 1 . 2]" 1 511 1 62 SER H 1 66 ILE H . . 5.500 4.038 3.755 4.400 . 0 0 "[ . 1 . 2]" 1 512 1 62 SER HA 1 63 GLU H . . 3.170 2.868 2.810 2.897 . 0 0 "[ . 1 . 2]" 1 513 1 63 GLU H 1 63 GLU QG . . 5.110 3.871 3.842 3.926 . 0 0 "[ . 1 . 2]" 1 514 1 63 GLU H 1 64 ASP H . . 3.420 2.605 2.492 2.809 . 0 0 "[ . 1 . 2]" 1 515 1 63 GLU H 1 64 ASP QB . . 5.570 4.284 4.163 4.498 . 0 0 "[ . 1 . 2]" 1 516 1 63 GLU H 1 65 GLU H . . 5.500 3.739 3.552 4.142 . 0 0 "[ . 1 . 2]" 1 517 1 63 GLU HA 1 65 GLU H . . 4.820 4.357 4.102 4.805 . 0 0 "[ . 1 . 2]" 1 518 1 63 GLU HA 1 66 ILE H . . 4.230 3.475 3.349 3.648 . 0 0 "[ . 1 . 2]" 1 519 1 63 GLU HA 1 66 ILE MG . . 4.080 1.930 1.761 2.022 . 0 0 "[ . 1 . 2]" 1 520 1 63 GLU QB 1 64 ASP H . . 4.360 2.609 2.520 2.768 . 0 0 "[ . 1 . 2]" 1 521 1 63 GLU QG 1 64 ASP H . . 4.490 3.188 2.925 3.598 . 0 0 "[ . 1 . 2]" 1 522 1 63 GLU QG 1 66 ILE H . . 5.320 4.819 4.703 4.899 . 0 0 "[ . 1 . 2]" 1 523 1 63 GLU QG 1 67 LYS HA . . 5.350 4.807 4.656 4.932 . 0 0 "[ . 1 . 2]" 1 524 1 64 ASP H 1 64 ASP HB2 . . 3.330 2.171 2.010 2.566 . 0 0 "[ . 1 . 2]" 1 525 1 64 ASP H 1 64 ASP QB . . 3.130 2.073 1.990 2.199 . 0 0 "[ . 1 . 2]" 1 526 1 64 ASP H 1 64 ASP HB3 . . 3.330 2.923 2.372 3.299 . 0 0 "[ . 1 . 2]" 1 527 1 64 ASP H 1 65 GLU H . . 3.020 2.495 2.430 2.656 . 0 0 "[ . 1 . 2]" 1 528 1 64 ASP H 1 66 ILE H . . 5.500 4.031 3.906 4.245 . 0 0 "[ . 1 . 2]" 1 529 1 64 ASP HA 1 67 LYS H . . 3.640 3.235 3.021 3.694 0.054 11 0 "[ . 1 . 2]" 1 530 1 64 ASP HA 1 67 LYS QB . . 4.980 2.239 1.999 3.303 . 0 0 "[ . 1 . 2]" 1 531 1 64 ASP HA 1 67 LYS QD . . 5.540 3.428 2.319 3.835 . 0 0 "[ . 1 . 2]" 1 532 1 64 ASP HA 1 68 GLU H . . 5.500 4.390 4.114 4.613 . 0 0 "[ . 1 . 2]" 1 533 1 64 ASP HB2 1 65 GLU H . . 3.920 3.483 3.001 3.925 0.005 18 0 "[ . 1 . 2]" 1 534 1 64 ASP HB3 1 65 GLU H . . 3.920 2.935 2.338 3.374 . 0 0 "[ . 1 . 2]" 1 535 1 65 GLU H 1 65 GLU QG . . 4.020 2.658 1.875 3.702 . 0 0 "[ . 1 . 2]" 1 536 1 65 GLU H 1 66 ILE H . . 3.300 2.570 2.406 2.814 . 0 0 "[ . 1 . 2]" 1 537 1 65 GLU H 1 67 LYS H . . 4.380 3.797 3.634 3.971 . 0 0 "[ . 1 . 2]" 1 538 1 65 GLU HB2 1 66 ILE H . . 4.260 2.943 2.675 3.448 . 0 0 "[ . 1 . 2]" 1 539 1 65 GLU HB3 1 66 ILE H . . 4.260 3.573 3.031 3.945 . 0 0 "[ . 1 . 2]" 1 540 1 66 ILE H 1 66 ILE HB . . 3.760 2.451 2.358 2.583 . 0 0 "[ . 1 . 2]" 1 541 1 66 ILE H 1 66 ILE MD . . 5.660 4.176 4.083 4.307 . 0 0 "[ . 1 . 2]" 1 542 1 66 ILE H 1 66 ILE MG . . 4.140 2.152 1.892 2.336 . 0 0 "[ . 1 . 2]" 1 543 1 66 ILE H 1 67 LYS H . . 3.550 2.352 2.214 2.567 . 0 0 "[ . 1 . 2]" 1 544 1 66 ILE H 1 68 GLU H . . 4.230 4.262 4.125 4.323 0.093 6 0 "[ . 1 . 2]" 1 545 1 66 ILE HA 1 69 LEU MD1 . . 4.980 3.948 3.684 4.105 . 0 0 "[ . 1 . 2]" 1 546 1 66 ILE MD 1 67 LYS H . . 6.530 5.078 4.866 5.158 . 0 0 "[ . 1 . 2]" 1 547 1 66 ILE MD 1 69 LEU MD1 . . 7.560 4.050 2.659 4.678 . 0 0 "[ . 1 . 2]" 1 548 1 66 ILE MD 1 83 LEU H . . 5.630 2.815 2.533 3.034 . 0 0 "[ . 1 . 2]" 1 549 1 66 ILE MD 1 98 VAL HA . . 5.470 3.773 3.333 4.456 . 0 0 "[ . 1 . 2]" 1 550 1 66 ILE MD 1 99 CYS QB . . 6.010 2.106 1.759 3.917 . 0 0 "[ . 1 . 2]" 1 551 1 66 ILE QG 1 69 LEU MD1 . . 7.030 3.457 2.955 4.033 . 0 0 "[ . 1 . 2]" 1 552 1 66 ILE QG 1 80 THR MG . . 4.950 2.949 2.412 3.485 . 0 0 "[ . 1 . 2]" 1 553 1 66 ILE MG 1 67 LYS H . . 3.860 2.254 1.856 2.432 . 0 0 "[ . 1 . 2]" 1 554 1 66 ILE MG 1 79 PRO HA . . 3.950 2.886 2.522 3.145 . 0 0 "[ . 1 . 2]" 1 555 1 66 ILE MG 1 79 PRO QB . . 5.390 2.818 2.171 3.585 . 0 0 "[ . 1 . 2]" 1 556 1 66 ILE MG 1 80 THR H . . 4.540 3.043 2.563 3.626 . 0 0 "[ . 1 . 2]" 1 557 1 66 ILE MG 1 80 THR MG . . 7.560 3.507 3.146 4.015 . 0 0 "[ . 1 . 2]" 1 558 1 66 ILE MG 1 99 CYS QB . . 6.110 2.778 2.356 3.125 . 0 0 "[ . 1 . 2]" 1 559 1 67 LYS H 1 67 LYS QD . . 4.640 4.090 3.995 4.170 . 0 0 "[ . 1 . 2]" 1 560 1 67 LYS H 1 67 LYS HG2 . . 5.500 4.241 2.505 4.389 . 0 0 "[ . 1 . 2]" 1 561 1 67 LYS H 1 67 LYS HG3 . . 5.500 4.517 3.523 4.590 . 0 0 "[ . 1 . 2]" 1 562 1 67 LYS H 1 68 GLU H . . 3.360 2.870 2.783 2.916 . 0 0 "[ . 1 . 2]" 1 563 1 67 LYS HA 1 67 LYS HG2 . . 4.040 2.608 2.405 3.838 . 0 0 "[ . 1 . 2]" 1 564 1 67 LYS HA 1 67 LYS QG . . 3.760 2.506 2.368 3.307 . 0 0 "[ . 1 . 2]" 1 565 1 67 LYS HA 1 67 LYS HG3 . . 4.040 3.468 3.193 3.610 . 0 0 "[ . 1 . 2]" 1 566 1 67 LYS HA 1 70 ASN H . . 4.600 3.960 3.856 4.027 . 0 0 "[ . 1 . 2]" 1 567 1 67 LYS QB 1 68 GLU H . . 5.420 2.708 2.594 3.425 . 0 0 "[ . 1 . 2]" 1 568 1 67 LYS QD 1 68 GLU H . . 4.240 3.083 2.654 4.049 . 0 0 "[ . 1 . 2]" 1 569 1 67 LYS QG 1 68 GLU H . . 5.290 3.787 1.918 4.155 . 0 0 "[ . 1 . 2]" 1 570 1 68 GLU H 1 68 GLU HG2 . . 2.870 2.810 2.774 2.872 0.002 8 0 "[ . 1 . 2]" 1 571 1 68 GLU H 1 68 GLU HG3 . . 2.800 2.677 2.519 2.792 . 0 0 "[ . 1 . 2]" 1 572 1 68 GLU H 1 69 LEU H . . 3.360 2.496 2.407 2.586 . 0 0 "[ . 1 . 2]" 1 573 1 68 GLU HA 1 68 GLU HG2 . . 2.960 2.351 2.308 2.389 . 0 0 "[ . 1 . 2]" 1 574 1 68 GLU HA 1 68 GLU HG3 . . 3.550 3.543 3.515 3.559 0.009 17 0 "[ . 1 . 2]" 1 575 1 68 GLU HA 1 72 GLN H . . 4.600 4.173 3.946 4.615 0.015 4 0 "[ . 1 . 2]" 1 576 1 68 GLU HG2 1 69 LEU H . . 5.500 4.623 4.594 4.655 . 0 0 "[ . 1 . 2]" 1 577 1 69 LEU H 1 69 LEU HB2 . . 4.110 2.179 2.091 2.323 . 0 0 "[ . 1 . 2]" 1 578 1 69 LEU H 1 69 LEU QB . . 3.860 2.096 2.043 2.156 . 0 0 "[ . 1 . 2]" 1 579 1 69 LEU H 1 69 LEU HB3 . . 4.110 2.738 2.556 2.865 . 0 0 "[ . 1 . 2]" 1 580 1 69 LEU H 1 69 LEU MD1 . . 5.100 4.223 4.099 4.294 . 0 0 "[ . 1 . 2]" 1 581 1 69 LEU H 1 69 LEU MD2 . . 5.040 3.677 3.433 3.950 . 0 0 "[ . 1 . 2]" 1 582 1 69 LEU H 1 69 LEU HG . . 4.570 4.464 4.413 4.522 . 0 0 "[ . 1 . 2]" 1 583 1 69 LEU H 1 70 ASN H . . 3.520 2.853 2.800 2.933 . 0 0 "[ . 1 . 2]" 1 584 1 69 LEU HA 1 69 LEU MD2 . . 4.540 1.992 1.933 2.096 . 0 0 "[ . 1 . 2]" 1 585 1 69 LEU MD1 1 72 GLN HE22 . . 6.530 5.223 4.138 5.479 . 0 0 "[ . 1 . 2]" 1 586 1 69 LEU MD1 1 85 PHE QE . . 8.650 4.514 3.182 5.442 . 0 0 "[ . 1 . 2]" 1 587 1 69 LEU MD1 1 97 TYR QD . . 8.300 2.902 2.613 3.425 . 0 0 "[ . 1 . 2]" 1 588 1 69 LEU MD2 1 72 GLN HE21 . . 6.220 3.167 2.709 3.568 . 0 0 "[ . 1 . 2]" 1 589 1 69 LEU MD2 1 72 GLN HE22 . . 4.730 2.761 2.330 3.213 . 0 0 "[ . 1 . 2]" 1 590 1 69 LEU MD2 1 73 PHE QD . . 7.910 3.847 3.086 5.625 . 0 0 "[ . 1 . 2]" 1 591 1 69 LEU MD2 1 73 PHE QE . . 7.970 2.563 1.907 4.185 . 0 0 "[ . 1 . 2]" 1 592 1 69 LEU MD2 1 73 PHE HZ . . 4.570 3.498 3.066 3.697 . 0 0 "[ . 1 . 2]" 1 593 1 69 LEU MD2 1 97 TYR QD . . 8.670 3.872 3.515 4.331 . 0 0 "[ . 1 . 2]" 1 594 1 70 ASN H 1 70 ASN HB2 . . 3.360 2.164 2.066 2.234 . 0 0 "[ . 1 . 2]" 1 595 1 70 ASN H 1 70 ASN HB3 . . 3.330 2.860 2.749 3.021 . 0 0 "[ . 1 . 2]" 1 596 1 70 ASN H 1 70 ASN HD21 . . 4.970 4.320 4.177 4.595 . 0 0 "[ . 1 . 2]" 1 597 1 70 ASN H 1 70 ASN HD22 . . 5.500 5.521 5.426 5.701 0.201 20 0 "[ . 1 . 2]" 1 598 1 70 ASN H 1 71 GLN H . . 3.670 2.697 2.528 2.844 . 0 0 "[ . 1 . 2]" 1 599 1 70 ASN H 1 72 GLN H . . 5.130 3.742 3.563 4.089 . 0 0 "[ . 1 . 2]" 1 600 1 70 ASN H 1 83 LEU MD1 . . 4.700 3.721 3.520 3.827 . 0 0 "[ . 1 . 2]" 1 601 1 70 ASN H 1 83 LEU MD2 . . 5.540 4.325 4.103 4.494 . 0 0 "[ . 1 . 2]" 1 602 1 70 ASN HB2 1 80 THR MG . . 5.190 4.128 3.912 4.262 . 0 0 "[ . 1 . 2]" 1 603 1 70 ASN HB3 1 70 ASN HD22 . . 4.040 3.851 3.673 4.019 . 0 0 "[ . 1 . 2]" 1 604 1 70 ASN HB3 1 80 THR MG . . 6.530 5.172 5.032 5.314 . 0 0 "[ . 1 . 2]" 1 605 1 70 ASN HD21 1 78 ARG H . . 5.220 3.901 3.426 4.542 . 0 0 "[ . 1 . 2]" 1 606 1 70 ASN HD21 1 80 THR HB . . 5.280 4.055 3.582 4.700 . 0 0 "[ . 1 . 2]" 1 607 1 70 ASN HD21 1 80 THR MG . . 5.690 2.698 2.103 3.275 . 0 0 "[ . 1 . 2]" 1 608 1 70 ASN HD22 1 78 ARG H . . 4.850 4.780 4.496 4.875 0.025 7 0 "[ . 1 . 2]" 1 609 1 70 ASN HD22 1 78 ARG HG2 . . 5.500 4.809 3.665 5.515 0.015 4 0 "[ . 1 . 2]" 1 610 1 70 ASN HD22 1 78 ARG QG . . 5.280 3.529 3.159 4.733 . 0 0 "[ . 1 . 2]" 1 611 1 70 ASN HD22 1 78 ARG HG3 . . 5.500 3.655 3.207 5.153 . 0 0 "[ . 1 . 2]" 1 612 1 70 ASN HD22 1 80 THR HB . . 4.510 3.500 3.038 4.323 . 0 0 "[ . 1 . 2]" 1 613 1 70 ASN HD22 1 80 THR MG . . 5.290 2.585 2.082 3.569 . 0 0 "[ . 1 . 2]" 1 614 1 70 ASN HD22 1 83 LEU MD1 . . 4.480 2.699 2.301 3.172 . 0 0 "[ . 1 . 2]" 1 615 1 70 ASN HD22 1 83 LEU MD2 . . 4.820 3.502 3.150 3.815 . 0 0 "[ . 1 . 2]" 1 616 1 71 GLN H 1 71 GLN HB2 . . 3.520 2.755 2.057 3.556 0.036 16 0 "[ . 1 . 2]" 1 617 1 71 GLN H 1 71 GLN QB . . 3.120 2.260 2.039 2.642 . 0 0 "[ . 1 . 2]" 1 618 1 71 GLN H 1 71 GLN HB3 . . 3.520 2.866 2.137 3.551 0.031 4 0 "[ . 1 . 2]" 1 619 1 71 GLN H 1 71 GLN HG2 . . 4.540 3.308 1.935 4.212 . 0 0 "[ . 1 . 2]" 1 620 1 71 GLN H 1 71 GLN QG . . 4.110 2.874 1.884 3.759 . 0 0 "[ . 1 . 2]" 1 621 1 71 GLN H 1 71 GLN HG3 . . 4.540 3.358 2.592 4.451 . 0 0 "[ . 1 . 2]" 1 622 1 71 GLN H 1 72 GLN H . . 3.240 2.517 2.327 2.803 . 0 0 "[ . 1 . 2]" 1 623 1 71 GLN H 1 75 GLY H . . 5.220 4.403 4.270 4.636 . 0 0 "[ . 1 . 2]" 1 624 1 71 GLN H 1 76 GLN H . . 5.310 4.537 4.008 5.210 . 0 0 "[ . 1 . 2]" 1 625 1 71 GLN HA 1 71 GLN HG2 . . 3.920 3.013 2.025 3.795 . 0 0 "[ . 1 . 2]" 1 626 1 71 GLN HA 1 71 GLN QG . . 3.650 2.597 2.008 3.326 . 0 0 "[ . 1 . 2]" 1 627 1 71 GLN HA 1 71 GLN HG3 . . 3.920 3.128 2.552 3.695 . 0 0 "[ . 1 . 2]" 1 628 1 71 GLN HA 1 75 GLY H . . 4.320 2.010 1.900 2.325 . 0 0 "[ . 1 . 2]" 1 629 1 71 GLN HA 1 76 GLN H . . 3.270 2.219 1.946 2.597 . 0 0 "[ . 1 . 2]" 1 630 1 71 GLN QB 1 71 GLN HE22 . . 4.790 4.052 3.627 4.200 . 0 0 "[ . 1 . 2]" 1 631 1 71 GLN QB 1 72 GLN H . . 4.220 3.228 2.851 3.696 . 0 0 "[ . 1 . 2]" 1 632 1 71 GLN HB2 1 72 GLN H . . 4.910 3.764 2.933 4.371 . 0 0 "[ . 1 . 2]" 1 633 1 71 GLN HB3 1 72 GLN H . . 4.910 3.713 3.197 4.288 . 0 0 "[ . 1 . 2]" 1 634 1 71 GLN HE22 1 71 GLN HG2 . . 4.110 3.603 3.445 3.996 . 0 0 "[ . 1 . 2]" 1 635 1 71 GLN HE22 1 71 GLN QG . . 3.770 3.241 3.231 3.307 . 0 0 "[ . 1 . 2]" 1 636 1 71 GLN HE22 1 71 GLN HG3 . . 4.110 3.734 3.446 4.099 . 0 0 "[ . 1 . 2]" 1 637 1 71 GLN QG 1 72 GLN H . . 5.110 3.629 2.191 4.606 . 0 0 "[ . 1 . 2]" 1 638 1 72 GLN H 1 72 GLN HB2 . . 3.210 2.366 2.282 2.579 . 0 0 "[ . 1 . 2]" 1 639 1 72 GLN H 1 72 GLN HB3 . . 3.760 3.533 3.513 3.550 . 0 0 "[ . 1 . 2]" 1 640 1 72 GLN H 1 72 GLN HE21 . . 5.500 4.549 4.353 4.840 . 0 0 "[ . 1 . 2]" 1 641 1 72 GLN H 1 72 GLN HG2 . . 3.360 3.265 2.920 3.373 0.013 8 0 "[ . 1 . 2]" 1 642 1 72 GLN H 1 72 GLN HG3 . . 3.360 2.390 1.991 2.604 . 0 0 "[ . 1 . 2]" 1 643 1 72 GLN H 1 73 PHE H . . 3.610 2.711 2.595 2.857 . 0 0 "[ . 1 . 2]" 1 644 1 72 GLN H 1 73 PHE QD . . 7.620 4.527 3.446 5.161 . 0 0 "[ . 1 . 2]" 1 645 1 72 GLN H 1 74 ARG H . . 4.260 4.284 4.188 4.362 0.102 9 0 "[ . 1 . 2]" 1 646 1 72 GLN HA 1 72 GLN HB3 . . 2.900 2.594 2.488 2.661 . 0 0 "[ . 1 . 2]" 1 647 1 72 GLN HA 1 72 GLN HG2 . . 3.330 2.269 2.142 2.452 . 0 0 "[ . 1 . 2]" 1 648 1 72 GLN HA 1 72 GLN HG3 . . 3.330 3.109 3.005 3.238 . 0 0 "[ . 1 . 2]" 1 649 1 72 GLN HB2 1 73 PHE H . . 4.070 3.127 2.906 3.258 . 0 0 "[ . 1 . 2]" 1 650 1 72 GLN HB3 1 73 PHE H . . 4.010 3.928 3.681 4.080 0.070 20 0 "[ . 1 . 2]" 1 651 1 72 GLN HE21 1 72 GLN HG2 . . 3.330 2.916 2.521 3.060 . 0 0 "[ . 1 . 2]" 1 652 1 72 GLN HE21 1 72 GLN QG . . 3.070 2.148 2.103 2.255 . 0 0 "[ . 1 . 2]" 1 653 1 72 GLN HE21 1 72 GLN HG3 . . 3.330 2.230 2.143 2.542 . 0 0 "[ . 1 . 2]" 1 654 1 72 GLN HE22 1 72 GLN HG2 . . 3.830 3.813 3.623 3.884 0.054 8 0 "[ . 1 . 2]" 1 655 1 72 GLN HE22 1 72 GLN QG . . 3.660 3.233 3.231 3.235 . 0 0 "[ . 1 . 2]" 1 656 1 72 GLN HE22 1 72 GLN HG3 . . 3.830 3.498 3.461 3.633 . 0 0 "[ . 1 . 2]" 1 657 1 72 GLN HG2 1 73 PHE H . . 5.500 5.074 4.970 5.147 . 0 0 "[ . 1 . 2]" 1 658 1 72 GLN HG3 1 73 PHE H . . 5.500 4.690 4.335 4.900 . 0 0 "[ . 1 . 2]" 1 659 1 73 PHE H 1 73 PHE HB2 . . 3.800 2.567 2.486 2.797 . 0 0 "[ . 1 . 2]" 1 660 1 73 PHE H 1 73 PHE HB3 . . 3.800 3.693 3.662 3.734 . 0 0 "[ . 1 . 2]" 1 661 1 73 PHE H 1 74 ARG H . . 3.640 2.057 1.938 2.144 . 0 0 "[ . 1 . 2]" 1 662 1 73 PHE H 1 75 GLY H . . 4.630 2.787 2.647 3.067 . 0 0 "[ . 1 . 2]" 1 663 1 73 PHE H 1 76 GLN H . . 5.470 4.966 4.726 5.304 . 0 0 "[ . 1 . 2]" 1 664 1 73 PHE HB2 1 74 ARG H . . 5.100 2.265 2.148 2.406 . 0 0 "[ . 1 . 2]" 1 665 1 73 PHE HB3 1 74 ARG H . . 5.100 3.458 3.284 3.820 . 0 0 "[ . 1 . 2]" 1 666 1 74 ARG H 1 74 ARG HB2 . . 4.010 2.245 2.035 2.548 . 0 0 "[ . 1 . 2]" 1 667 1 74 ARG H 1 74 ARG QB . . 3.840 2.208 2.013 2.495 . 0 0 "[ . 1 . 2]" 1 668 1 74 ARG H 1 74 ARG HB3 . . 4.010 3.331 2.826 3.567 . 0 0 "[ . 1 . 2]" 1 669 1 74 ARG H 1 74 ARG HD2 . . 5.500 4.449 3.490 4.987 . 0 0 "[ . 1 . 2]" 1 670 1 74 ARG H 1 74 ARG QD . . 4.810 3.812 2.670 4.352 . 0 0 "[ . 1 . 2]" 1 671 1 74 ARG H 1 74 ARG HD3 . . 5.500 4.203 2.724 5.029 . 0 0 "[ . 1 . 2]" 1 672 1 74 ARG H 1 74 ARG HG2 . . 4.880 3.277 1.968 4.644 . 0 0 "[ . 1 . 2]" 1 673 1 74 ARG H 1 74 ARG QG . . 4.600 3.002 1.955 4.019 . 0 0 "[ . 1 . 2]" 1 674 1 74 ARG H 1 74 ARG HG3 . . 4.880 3.747 2.870 4.452 . 0 0 "[ . 1 . 2]" 1 675 1 74 ARG H 1 75 GLY H . . 3.020 2.521 2.466 2.570 . 0 0 "[ . 1 . 2]" 1 676 1 74 ARG H 1 76 GLN H . . 4.140 3.989 3.883 4.085 . 0 0 "[ . 1 . 2]" 1 677 1 74 ARG HA 1 74 ARG HD2 . . 3.830 2.959 1.987 3.874 0.044 13 0 "[ . 1 . 2]" 1 678 1 74 ARG HA 1 74 ARG QD . . 3.570 2.484 1.963 3.131 . 0 0 "[ . 1 . 2]" 1 679 1 74 ARG HA 1 74 ARG HD3 . . 3.830 2.966 2.302 3.714 . 0 0 "[ . 1 . 2]" 1 680 1 74 ARG QB 1 75 GLY H . . 4.550 3.026 2.889 3.241 . 0 0 "[ . 1 . 2]" 1 681 1 74 ARG QG 1 75 GLY H . . 5.910 4.418 4.035 4.850 . 0 0 "[ . 1 . 2]" 1 682 1 75 GLY H 1 75 GLY HA2 . . 2.830 2.259 2.246 2.281 . 0 0 "[ . 1 . 2]" 1 683 1 75 GLY H 1 76 GLN H . . 3.450 2.682 2.593 2.773 . 0 0 "[ . 1 . 2]" 1 684 1 76 GLN H 1 76 GLN HB2 . . 4.140 2.900 2.241 3.839 . 0 0 "[ . 1 . 2]" 1 685 1 76 GLN H 1 76 GLN HB3 . . 4.140 3.293 2.629 3.571 . 0 0 "[ . 1 . 2]" 1 686 1 76 GLN H 1 76 GLN HG2 . . 3.980 3.283 2.078 4.050 0.070 12 0 "[ . 1 . 2]" 1 687 1 76 GLN H 1 76 GLN QG . . 3.730 2.849 2.058 3.475 . 0 0 "[ . 1 . 2]" 1 688 1 76 GLN H 1 76 GLN HG3 . . 3.980 3.412 2.634 3.791 . 0 0 "[ . 1 . 2]" 1 689 1 76 GLN H 1 77 ASP H . . 4.760 4.516 4.405 4.614 . 0 0 "[ . 1 . 2]" 1 690 1 76 GLN HA 1 76 GLN HE21 . . 5.500 4.393 2.686 5.506 0.006 9 0 "[ . 1 . 2]" 1 691 1 76 GLN HA 1 76 GLN HG2 . . 3.670 2.910 2.082 3.793 0.123 9 0 "[ . 1 . 2]" 1 692 1 76 GLN HA 1 76 GLN HG3 . . 3.670 3.265 2.332 3.770 0.100 15 0 "[ . 1 . 2]" 1 693 1 76 GLN HA 1 77 ASP H . . 2.800 2.324 2.250 2.545 . 0 0 "[ . 1 . 2]" 1 694 1 76 GLN HB2 1 77 ASP H . . 5.250 3.697 2.356 4.354 . 0 0 "[ . 1 . 2]" 1 695 1 76 GLN HB3 1 77 ASP H . . 5.250 3.481 2.932 4.324 . 0 0 "[ . 1 . 2]" 1 696 1 76 GLN HE21 1 76 GLN HG2 . . 3.520 2.727 2.103 3.567 0.047 16 0 "[ . 1 . 2]" 1 697 1 76 GLN HE21 1 76 GLN HG3 . . 3.520 2.877 2.134 3.566 0.046 1 0 "[ . 1 . 2]" 1 698 1 76 GLN QG 1 77 ASP H . . 4.300 3.644 3.346 3.788 . 0 0 "[ . 1 . 2]" 1 699 1 77 ASP H 1 77 ASP HB2 . . 3.240 2.754 2.143 3.168 . 0 0 "[ . 1 . 2]" 1 700 1 77 ASP H 1 77 ASP HB3 . . 3.240 2.468 2.151 3.237 . 0 0 "[ . 1 . 2]" 1 701 1 77 ASP H 1 78 ARG H . . 4.380 4.146 4.065 4.336 . 0 0 "[ . 1 . 2]" 1 702 1 77 ASP HA 1 77 ASP HB2 . . 3.050 2.503 2.329 2.915 . 0 0 "[ . 1 . 2]" 1 703 1 77 ASP HA 1 77 ASP HB3 . . 3.050 3.015 2.861 3.052 0.002 2 0 "[ . 1 . 2]" 1 704 1 77 ASP HA 1 78 ARG H . . 2.960 2.308 2.274 2.321 . 0 0 "[ . 1 . 2]" 1 705 1 77 ASP HB2 1 78 ARG H . . 5.100 4.572 4.389 4.715 . 0 0 "[ . 1 . 2]" 1 706 1 77 ASP HB3 1 78 ARG H . . 5.100 4.477 4.106 4.646 . 0 0 "[ . 1 . 2]" 1 707 1 78 ARG H 1 78 ARG HB2 . . 4.170 3.913 2.813 4.066 . 0 0 "[ . 1 . 2]" 1 708 1 78 ARG H 1 78 ARG HB3 . . 4.170 3.606 3.495 3.883 . 0 0 "[ . 1 . 2]" 1 709 1 78 ARG H 1 78 ARG QG . . 3.590 2.578 2.440 2.996 . 0 0 "[ . 1 . 2]" 1 710 1 78 ARG H 1 79 PRO QD . . 4.830 3.823 3.616 3.973 . 0 0 "[ . 1 . 2]" 1 711 1 78 ARG HA 1 79 PRO HG2 . . 4.450 4.457 4.385 4.527 0.077 15 0 "[ . 1 . 2]" 1 712 1 78 ARG HA 1 79 PRO HG3 . . 5.100 4.232 4.218 4.324 . 0 0 "[ . 1 . 2]" 1 713 1 78 ARG QB 1 79 PRO QD . . 4.580 2.775 2.478 3.349 . 0 0 "[ . 1 . 2]" 1 714 1 78 ARG HB2 1 79 PRO QD . . 4.830 2.947 2.530 4.287 . 0 0 "[ . 1 . 2]" 1 715 1 78 ARG HB3 1 79 PRO QD . . 4.830 3.637 3.491 3.774 . 0 0 "[ . 1 . 2]" 1 716 1 78 ARG HG2 1 79 PRO QD . . 6.380 4.951 4.378 5.200 . 0 0 "[ . 1 . 2]" 1 717 1 78 ARG HG3 1 79 PRO QD . . 6.380 4.527 4.089 5.170 . 0 0 "[ . 1 . 2]" 1 718 1 79 PRO HA 1 80 THR H . . 3.140 2.453 2.391 2.530 . 0 0 "[ . 1 . 2]" 1 719 1 79 PRO QB 1 80 THR H . . 4.030 2.573 2.418 2.703 . 0 0 "[ . 1 . 2]" 1 720 1 79 PRO HB2 1 80 THR H . . 4.260 2.668 2.488 2.824 . 0 0 "[ . 1 . 2]" 1 721 1 79 PRO HB3 1 80 THR H . . 4.260 3.378 3.293 3.455 . 0 0 "[ . 1 . 2]" 1 722 1 79 PRO HG2 1 80 THR H . . 4.690 4.690 4.537 4.815 0.125 14 0 "[ . 1 . 2]" 1 723 1 79 PRO HG3 1 80 THR H . . 5.500 5.188 5.070 5.286 . 0 0 "[ . 1 . 2]" 1 724 1 80 THR H 1 80 THR HB . . 4.170 3.508 3.452 3.582 . 0 0 "[ . 1 . 2]" 1 725 1 80 THR H 1 80 THR MG . . 3.710 2.330 1.934 2.631 . 0 0 "[ . 1 . 2]" 1 726 1 80 THR H 1 81 ASP H . . 4.760 3.738 1.802 4.391 . 0 0 "[ . 1 . 2]" 1 727 1 80 THR H 1 83 LEU MD1 . . 4.880 3.772 3.432 4.043 . 0 0 "[ . 1 . 2]" 1 728 1 80 THR H 1 102 ILE MD . . 4.260 2.951 2.023 3.455 . 0 0 "[ . 1 . 2]" 1 729 1 80 THR HA 1 81 ASP H . . 3.170 2.694 2.439 3.213 0.043 18 0 "[ . 1 . 2]" 1 730 1 80 THR HB 1 81 ASP H . . 4.660 3.961 3.642 4.672 0.012 14 0 "[ . 1 . 2]" 1 731 1 80 THR MG 1 81 ASP H . . 4.200 3.411 3.229 3.522 . 0 0 "[ . 1 . 2]" 1 732 1 80 THR MG 1 81 ASP QB . . 6.660 4.474 4.227 4.905 . 0 0 "[ . 1 . 2]" 1 733 1 80 THR MG 1 82 VAL H . . 4.670 3.189 2.707 3.534 . 0 0 "[ . 1 . 2]" 1 734 1 80 THR MG 1 102 ILE MD . . 7.180 4.155 3.541 4.631 . 0 0 "[ . 1 . 2]" 1 735 1 81 ASP H 1 82 VAL H . . 3.360 2.950 2.523 3.550 0.190 13 0 "[ . 1 . 2]" 1 736 1 81 ASP H 1 102 ILE MG . . 4.980 3.814 2.758 4.045 . 0 0 "[ . 1 . 2]" 1 737 1 81 ASP HA 1 102 ILE MG . . 4.050 2.738 2.111 3.306 . 0 0 "[ . 1 . 2]" 1 738 1 81 ASP QB 1 82 VAL HA . . 6.380 4.254 4.058 4.594 . 0 0 "[ . 1 . 2]" 1 739 1 81 ASP QB 1 102 ILE MG . . 7.400 3.880 3.049 4.478 . 0 0 "[ . 1 . 2]" 1 740 1 82 VAL H 1 82 VAL MG1 . . 3.800 2.248 2.020 2.422 . 0 0 "[ . 1 . 2]" 1 741 1 82 VAL H 1 83 LEU H . . 5.500 4.239 4.140 4.378 . 0 0 "[ . 1 . 2]" 1 742 1 82 VAL HA 1 83 LEU H . . 3.140 2.226 2.189 2.257 . 0 0 "[ . 1 . 2]" 1 743 1 82 VAL HA 1 98 VAL HA . . 3.700 2.657 2.101 3.111 . 0 0 "[ . 1 . 2]" 1 744 1 82 VAL HA 1 99 CYS H . . 4.690 3.227 3.009 3.460 . 0 0 "[ . 1 . 2]" 1 745 1 82 VAL HA 1 121 VAL MG1 . . 5.750 4.324 3.997 4.534 . 0 0 "[ . 1 . 2]" 1 746 1 82 VAL HB 1 83 LEU H . . 5.500 4.148 4.010 4.315 . 0 0 "[ . 1 . 2]" 1 747 1 82 VAL MG1 1 83 LEU H . . 6.470 4.093 3.916 4.209 . 0 0 "[ . 1 . 2]" 1 748 1 82 VAL MG1 1 121 VAL HB . . 4.950 3.678 3.298 4.003 . 0 0 "[ . 1 . 2]" 1 749 1 82 VAL MG2 1 83 LEU H . . 4.050 2.518 2.268 2.839 . 0 0 "[ . 1 . 2]" 1 750 1 82 VAL MG2 1 97 TYR H . . 4.850 3.959 3.776 4.049 . 0 0 "[ . 1 . 2]" 1 751 1 82 VAL MG2 1 121 VAL H . . 6.220 4.971 4.858 5.093 . 0 0 "[ . 1 . 2]" 1 752 1 83 LEU H 1 83 LEU MD1 . . 4.230 3.306 3.212 3.412 . 0 0 "[ . 1 . 2]" 1 753 1 83 LEU H 1 83 LEU MD2 . . 5.630 4.527 4.513 4.546 . 0 0 "[ . 1 . 2]" 1 754 1 83 LEU H 1 84 THR H . . 5.500 4.510 4.459 4.563 . 0 0 "[ . 1 . 2]" 1 755 1 83 LEU H 1 97 TYR H . . 4.200 3.950 3.573 4.178 . 0 0 "[ . 1 . 2]" 1 756 1 83 LEU H 1 98 VAL HA . . 4.260 3.208 2.870 3.548 . 0 0 "[ . 1 . 2]" 1 757 1 83 LEU HA 1 83 LEU MD1 . . 3.950 3.296 3.218 3.333 . 0 0 "[ . 1 . 2]" 1 758 1 83 LEU HA 1 83 LEU MD2 . . 4.080 3.223 3.162 3.300 . 0 0 "[ . 1 . 2]" 1 759 1 83 LEU HA 1 84 THR H . . 2.770 2.208 2.182 2.258 . 0 0 "[ . 1 . 2]" 1 760 1 83 LEU HB2 1 84 THR H . . 4.720 4.492 4.387 4.570 . 0 0 "[ . 1 . 2]" 1 761 1 83 LEU HB3 1 84 THR H . . 3.830 3.522 3.310 3.695 . 0 0 "[ . 1 . 2]" 1 762 1 83 LEU MD1 1 97 TYR QB . . 5.950 3.424 3.184 3.643 . 0 0 "[ . 1 . 2]" 1 763 1 83 LEU MD1 1 97 TYR QD . . 8.670 4.581 4.288 4.875 . 0 0 "[ . 1 . 2]" 1 764 1 83 LEU MD2 1 84 THR H . . 4.610 3.590 3.333 3.721 . 0 0 "[ . 1 . 2]" 1 765 1 83 LEU MD2 1 97 TYR QB . . 7.410 3.530 3.334 3.793 . 0 0 "[ . 1 . 2]" 1 766 1 84 THR H 1 84 THR HB . . 3.920 2.659 2.314 3.213 . 0 0 "[ . 1 . 2]" 1 767 1 84 THR HA 1 85 PHE H . . 3.450 2.249 2.152 2.309 . 0 0 "[ . 1 . 2]" 1 768 1 84 THR HA 1 97 TYR H . . 4.380 3.342 3.035 3.824 . 0 0 "[ . 1 . 2]" 1 769 1 84 THR MG 1 85 PHE H . . 5.470 2.995 2.021 4.197 . 0 0 "[ . 1 . 2]" 1 770 1 84 THR MG 1 85 PHE HA . . 5.540 4.160 3.823 4.366 . 0 0 "[ . 1 . 2]" 1 771 1 85 PHE H 1 95 GLU H . . 5.280 5.050 4.576 5.439 0.159 14 0 "[ . 1 . 2]" 1 772 1 85 PHE HA 1 86 PRO HD2 . . 3.110 2.559 2.364 2.936 . 0 0 "[ . 1 . 2]" 1 773 1 85 PHE HA 1 86 PRO QD . . 2.840 1.897 1.849 2.093 . 0 0 "[ . 1 . 2]" 1 774 1 85 PHE HA 1 86 PRO HD3 . . 3.110 1.957 1.922 2.143 . 0 0 "[ . 1 . 2]" 1 775 1 85 PHE QD 1 87 LEU MD2 . . 8.650 3.090 1.884 4.768 . 0 0 "[ . 1 . 2]" 1 776 1 85 PHE QE 1 87 LEU MD2 . . 8.650 4.796 2.408 6.010 . 0 0 "[ . 1 . 2]" 1 777 1 85 PHE QE 1 92 VAL QG . . 10.210 6.324 5.346 6.854 . 0 0 "[ . 1 . 2]" 1 778 1 87 LEU H 1 87 LEU MD1 . . 5.600 4.332 2.084 4.625 . 0 0 "[ . 1 . 2]" 1 779 1 87 LEU H 1 87 LEU MD2 . . 4.820 2.714 1.937 3.933 . 0 0 "[ . 1 . 2]" 1 780 1 87 LEU H 1 87 LEU HG . . 3.830 3.562 2.679 4.007 0.177 2 0 "[ . 1 . 2]" 1 781 1 87 LEU H 1 88 MET H . . 4.070 2.670 1.895 4.102 0.032 10 0 "[ . 1 . 2]" 1 782 1 87 LEU HA 1 87 LEU MD2 . . 4.540 3.318 1.946 3.758 . 0 0 "[ . 1 . 2]" 1 783 1 87 LEU HA 1 87 LEU HG . . 4.040 3.609 3.069 4.247 0.207 14 0 "[ . 1 . 2]" 1 784 1 87 LEU MD1 1 92 VAL HB . . 5.540 3.935 1.756 4.544 . 0 0 "[ . 1 . 2]" 1 785 1 87 LEU MD1 1 94 GLY QA . . 5.640 2.281 1.881 3.244 . 0 0 "[ . 1 . 2]" 1 786 1 87 LEU MD1 1 95 GLU H . . 6.220 3.585 2.201 4.305 . 0 0 "[ . 1 . 2]" 1 787 1 87 LEU MD1 1 95 GLU QG . . 7.410 4.793 4.020 5.291 . 0 0 "[ . 1 . 2]" 1 788 1 87 LEU MD2 1 88 MET H . . 5.570 3.953 2.489 4.587 . 0 0 "[ . 1 . 2]" 1 789 1 87 LEU MD2 1 89 GLU H . . 6.190 4.646 2.942 5.218 . 0 0 "[ . 1 . 2]" 1 790 1 87 LEU MD2 1 93 TYR QD . . 8.670 5.801 4.217 6.523 . 0 0 "[ . 1 . 2]" 1 791 1 87 LEU MD2 1 94 GLY QA . . 5.830 3.133 1.901 3.955 . 0 0 "[ . 1 . 2]" 1 792 1 87 LEU HG 1 88 MET H . . 5.500 4.131 1.899 5.336 . 0 0 "[ . 1 . 2]" 1 793 1 87 LEU HG 1 92 VAL QG . . 5.200 3.185 2.194 3.832 . 0 0 "[ . 1 . 2]" 1 794 1 87 LEU HG 1 94 GLY QA . . 5.730 4.478 2.178 4.977 . 0 0 "[ . 1 . 2]" 1 795 1 88 MET H 1 88 MET HB2 . . 3.300 2.409 2.003 3.818 0.518 19 1 "[ . 1 . +2]" 1 796 1 88 MET H 1 88 MET ME . . 6.090 4.818 3.808 5.135 . 0 0 "[ . 1 . 2]" 1 797 1 88 MET H 1 88 MET HG2 . . 5.500 3.946 2.129 4.904 . 0 0 "[ . 1 . 2]" 1 798 1 88 MET H 1 88 MET HG3 . . 5.500 4.093 2.879 4.721 . 0 0 "[ . 1 . 2]" 1 799 1 88 MET HA 1 88 MET HG2 . . 4.110 3.037 2.007 3.935 . 0 0 "[ . 1 . 2]" 1 800 1 88 MET HA 1 88 MET QG . . 3.950 2.413 1.988 3.344 . 0 0 "[ . 1 . 2]" 1 801 1 88 MET HA 1 88 MET HG3 . . 4.110 2.939 2.085 3.702 . 0 0 "[ . 1 . 2]" 1 802 1 88 MET HA 1 89 GLU HA . . 5.440 4.470 4.290 5.317 . 0 0 "[ . 1 . 2]" 1 803 1 88 MET ME 1 136 PHE H . . 5.600 4.548 4.283 4.707 . 0 0 "[ . 1 . 2]" 1 804 1 89 GLU H 1 89 GLU HB2 . . 3.890 2.662 2.182 3.676 . 0 0 "[ . 1 . 2]" 1 805 1 89 GLU H 1 90 GLU H . . 4.630 4.428 4.311 4.672 0.042 16 0 "[ . 1 . 2]" 1 806 1 89 GLU HA 1 90 GLU H . . 3.080 2.798 2.670 3.070 . 0 0 "[ . 1 . 2]" 1 807 1 89 GLU HB2 1 90 GLU H . . 3.450 3.340 2.464 3.505 0.055 19 0 "[ . 1 . 2]" 1 808 1 89 GLU HB2 1 91 ASP H . . 4.720 3.600 2.996 4.686 . 0 0 "[ . 1 . 2]" 1 809 1 89 GLU HB3 1 90 GLU H . . 3.330 1.967 1.897 2.118 . 0 0 "[ . 1 . 2]" 1 810 1 89 GLU HB3 1 91 ASP H . . 3.800 3.273 2.137 3.825 0.025 19 0 "[ . 1 . 2]" 1 811 1 90 GLU H 1 91 ASP H . . 4.690 3.024 2.301 3.590 . 0 0 "[ . 1 . 2]" 1 812 1 91 ASP H 1 91 ASP HB2 . . 4.110 3.404 2.657 4.059 . 0 0 "[ . 1 . 2]" 1 813 1 91 ASP H 1 91 ASP QB . . 3.920 3.086 2.596 3.522 . 0 0 "[ . 1 . 2]" 1 814 1 91 ASP H 1 91 ASP HB3 . . 4.110 3.692 3.101 3.960 . 0 0 "[ . 1 . 2]" 1 815 1 91 ASP H 1 92 VAL H . . 3.580 3.024 1.878 3.678 0.098 7 0 "[ . 1 . 2]" 1 816 1 91 ASP H 1 92 VAL QG . . 7.680 4.261 3.193 4.978 . 0 0 "[ . 1 . 2]" 1 817 1 91 ASP QB 1 92 VAL H . . 4.360 3.124 1.853 4.015 . 0 0 "[ . 1 . 2]" 1 818 1 91 ASP HB2 1 92 VAL H . . 4.510 3.510 1.932 4.596 0.086 5 0 "[ . 1 . 2]" 1 819 1 91 ASP HB3 1 92 VAL H . . 4.510 3.799 2.047 4.592 0.082 20 0 "[ . 1 . 2]" 1 820 1 92 VAL H 1 92 VAL HB . . 3.670 2.990 2.078 3.699 0.029 8 0 "[ . 1 . 2]" 1 821 1 92 VAL H 1 92 VAL QG . . 4.130 2.394 1.719 3.299 . 0 0 "[ . 1 . 2]" 1 822 1 92 VAL HA 1 94 GLY H . . 4.040 3.946 3.616 4.124 0.084 14 0 "[ . 1 . 2]" 1 823 1 92 VAL HB 1 93 TYR H . . 5.500 3.682 2.501 4.563 . 0 0 "[ . 1 . 2]" 1 824 1 92 VAL QG 1 93 TYR H . . 5.360 2.038 1.624 2.958 . 0 0 "[ . 1 . 2]" 1 825 1 92 VAL QG 1 93 TYR QB . . 7.390 3.718 3.344 3.957 . 0 0 "[ . 1 . 2]" 1 826 1 92 VAL QG 1 94 GLY H . . 6.970 2.177 1.713 3.416 . 0 0 "[ . 1 . 2]" 1 827 1 92 VAL QG 1 126 ILE H . . 7.100 4.956 4.576 5.235 . 0 0 "[ . 1 . 2]" 1 828 1 92 VAL QG 1 126 ILE HA . . 7.620 4.496 3.820 4.818 . 0 0 "[ . 1 . 2]" 1 829 1 93 TYR H 1 94 GLY H . . 4.690 2.893 1.896 3.728 . 0 0 "[ . 1 . 2]" 1 830 1 93 TYR H 1 94 GLY QA . . 6.380 4.569 3.458 4.804 . 0 0 "[ . 1 . 2]" 1 831 1 93 TYR HB2 1 94 GLY H . . 5.130 4.599 4.355 4.692 . 0 0 "[ . 1 . 2]" 1 832 1 93 TYR HB3 1 94 GLY H . . 5.130 4.330 3.955 4.708 . 0 0 "[ . 1 . 2]" 1 833 1 94 GLY HA2 1 95 GLU H . . 3.640 3.103 2.796 3.409 . 0 0 "[ . 1 . 2]" 1 834 1 94 GLY HA3 1 95 GLU H . . 3.640 2.277 2.199 2.458 . 0 0 "[ . 1 . 2]" 1 835 1 95 GLU H 1 96 ILE H . . 5.500 4.326 4.111 4.469 . 0 0 "[ . 1 . 2]" 1 836 1 95 GLU HA 1 96 ILE H . . 3.330 2.306 2.202 2.465 . 0 0 "[ . 1 . 2]" 1 837 1 95 GLU HB2 1 97 TYR QE . . 7.630 4.189 3.404 5.962 . 0 0 "[ . 1 . 2]" 1 838 1 95 GLU HB3 1 97 TYR QE . . 7.630 5.246 4.509 6.689 . 0 0 "[ . 1 . 2]" 1 839 1 96 ILE QG 1 98 VAL MG2 . . 6.070 3.019 2.460 3.979 . 0 0 "[ . 1 . 2]" 1 840 1 96 ILE MG 1 125 GLY QA . . 6.570 3.458 2.806 3.934 . 0 0 "[ . 1 . 2]" 1 841 1 97 TYR H 1 98 VAL H . . 5.500 4.520 4.418 4.606 . 0 0 "[ . 1 . 2]" 1 842 1 97 TYR HA 1 98 VAL H . . 2.740 2.215 2.187 2.265 . 0 0 "[ . 1 . 2]" 1 843 1 97 TYR HB2 1 98 VAL H . . 5.340 4.310 4.076 4.525 . 0 0 "[ . 1 . 2]" 1 844 1 97 TYR HB3 1 98 VAL H . . 5.340 3.391 3.121 3.674 . 0 0 "[ . 1 . 2]" 1 845 1 97 TYR QD 1 98 VAL H . . 7.080 4.405 4.090 4.687 . 0 0 "[ . 1 . 2]" 1 846 1 98 VAL H 1 98 VAL HB . . 3.300 2.575 2.367 2.828 . 0 0 "[ . 1 . 2]" 1 847 1 98 VAL H 1 98 VAL MG2 . . 4.200 2.858 2.245 3.211 . 0 0 "[ . 1 . 2]" 1 848 1 98 VAL H 1 99 CYS H . . 5.500 4.469 4.399 4.548 . 0 0 "[ . 1 . 2]" 1 849 1 98 VAL H 1 121 VAL MG2 . . 6.470 5.183 4.915 5.373 . 0 0 "[ . 1 . 2]" 1 850 1 98 VAL HA 1 99 CYS H . . 3.210 2.346 2.302 2.416 . 0 0 "[ . 1 . 2]" 1 851 1 98 VAL HA 1 103 VAL MG2 . . 6.030 4.750 4.198 5.044 . 0 0 "[ . 1 . 2]" 1 852 1 98 VAL HB 1 99 CYS H . . 5.500 3.939 3.553 4.167 . 0 0 "[ . 1 . 2]" 1 853 1 98 VAL HB 1 121 VAL MG1 . . 5.940 4.897 4.492 4.993 . 0 0 "[ . 1 . 2]" 1 854 1 98 VAL MG1 1 99 CYS H . . 3.460 2.082 1.889 2.328 . 0 0 "[ . 1 . 2]" 1 855 1 98 VAL MG1 1 99 CYS HA . . 6.370 3.404 3.146 3.888 . 0 0 "[ . 1 . 2]" 1 856 1 98 VAL MG1 1 99 CYS QB . . 7.000 4.201 3.962 4.422 . 0 0 "[ . 1 . 2]" 1 857 1 98 VAL MG1 1 121 VAL MG2 . . 6.840 1.767 1.642 1.926 . 0 0 "[ . 1 . 2]" 1 858 1 98 VAL MG2 1 99 CYS H . . 6.530 3.842 3.483 4.167 . 0 0 "[ . 1 . 2]" 1 859 1 99 CYS H 1 103 VAL H . . 5.500 5.020 4.616 5.292 . 0 0 "[ . 1 . 2]" 1 860 1 99 CYS H 1 103 VAL MG2 . . 6.220 3.173 2.674 3.513 . 0 0 "[ . 1 . 2]" 1 861 1 99 CYS HA 1 101 LEU H . . 5.220 3.250 3.177 3.297 . 0 0 "[ . 1 . 2]" 1 862 1 99 CYS QB 1 100 PRO QD . . 6.390 3.503 3.281 3.749 . 0 0 "[ . 1 . 2]" 1 863 1 99 CYS QB 1 101 LEU H . . 6.380 3.210 2.703 3.778 . 0 0 "[ . 1 . 2]" 1 864 1 101 LEU H 1 101 LEU HB2 . . 3.700 2.169 2.030 2.465 . 0 0 "[ . 1 . 2]" 1 865 1 101 LEU H 1 101 LEU HB3 . . 3.700 2.833 2.545 3.075 . 0 0 "[ . 1 . 2]" 1 866 1 101 LEU H 1 101 LEU MD1 . . 5.410 3.905 3.260 4.250 . 0 0 "[ . 1 . 2]" 1 867 1 101 LEU H 1 101 LEU HG . . 4.600 4.417 4.170 4.595 . 0 0 "[ . 1 . 2]" 1 868 1 101 LEU H 1 102 ILE H . . 3.580 2.637 2.426 2.765 . 0 0 "[ . 1 . 2]" 1 869 1 101 LEU H 1 103 VAL H . . 5.070 3.656 3.336 3.783 . 0 0 "[ . 1 . 2]" 1 870 1 101 LEU H 1 104 GLU H . . 4.850 4.449 4.301 4.695 . 0 0 "[ . 1 . 2]" 1 871 1 101 LEU HA 1 101 LEU MD1 . . 3.710 2.654 2.149 3.040 . 0 0 "[ . 1 . 2]" 1 872 1 101 LEU HA 1 101 LEU HG . . 3.860 3.076 2.121 3.751 . 0 0 "[ . 1 . 2]" 1 873 1 101 LEU HA 1 104 GLU H . . 5.500 3.890 3.728 4.085 . 0 0 "[ . 1 . 2]" 1 874 1 101 LEU QB 1 102 ILE H . . 4.160 2.419 2.269 2.540 . 0 0 "[ . 1 . 2]" 1 875 1 101 LEU HB2 1 102 ILE H . . 4.450 3.441 3.168 3.786 . 0 0 "[ . 1 . 2]" 1 876 1 101 LEU HB3 1 102 ILE H . . 4.450 2.477 2.308 2.626 . 0 0 "[ . 1 . 2]" 1 877 1 101 LEU HG 1 102 ILE H . . 4.790 4.738 4.642 4.848 0.058 12 0 "[ . 1 . 2]" 1 878 1 102 ILE H 1 102 ILE HB . . 3.110 2.385 2.358 2.425 . 0 0 "[ . 1 . 2]" 1 879 1 102 ILE H 1 102 ILE MD . . 5.040 2.179 1.897 2.452 . 0 0 "[ . 1 . 2]" 1 880 1 102 ILE H 1 102 ILE HG12 . . 3.830 3.852 3.753 3.903 0.073 20 0 "[ . 1 . 2]" 1 881 1 102 ILE H 1 102 ILE QG . . 3.440 2.682 2.428 2.935 . 0 0 "[ . 1 . 2]" 1 882 1 102 ILE H 1 102 ILE HG13 . . 3.830 2.740 2.459 3.044 . 0 0 "[ . 1 . 2]" 1 883 1 102 ILE H 1 103 VAL H . . 3.170 2.475 2.360 2.566 . 0 0 "[ . 1 . 2]" 1 884 1 102 ILE H 1 103 VAL MG2 . . 4.980 3.801 3.600 4.027 . 0 0 "[ . 1 . 2]" 1 885 1 102 ILE H 1 104 GLU H . . 4.290 4.266 4.059 4.401 0.111 12 0 "[ . 1 . 2]" 1 886 1 102 ILE HA 1 102 ILE MD . . 4.330 3.593 3.370 3.735 . 0 0 "[ . 1 . 2]" 1 887 1 102 ILE HA 1 105 GLU H . . 3.860 3.324 3.154 3.716 . 0 0 "[ . 1 . 2]" 1 888 1 102 ILE HB 1 103 VAL H . . 4.690 2.814 2.688 3.110 . 0 0 "[ . 1 . 2]" 1 889 1 102 ILE HB 1 103 VAL MG2 . . 5.850 3.326 3.211 3.572 . 0 0 "[ . 1 . 2]" 1 890 1 102 ILE MD 1 103 VAL H . . 4.790 3.781 3.577 3.891 . 0 0 "[ . 1 . 2]" 1 891 1 102 ILE MD 1 103 VAL MG2 . . 7.560 4.065 3.925 4.194 . 0 0 "[ . 1 . 2]" 1 892 1 102 ILE QG 1 103 VAL MG2 . . 7.250 5.075 4.993 5.222 . 0 0 "[ . 1 . 2]" 1 893 1 102 ILE MG 1 103 VAL H . . 4.850 3.612 3.469 3.824 . 0 0 "[ . 1 . 2]" 1 894 1 102 ILE MG 1 106 ASN HD21 . . 4.760 2.688 1.892 3.840 . 0 0 "[ . 1 . 2]" 1 895 1 102 ILE MG 1 106 ASN QD . . 4.430 2.186 1.708 2.916 . 0 0 "[ . 1 . 2]" 1 896 1 102 ILE MG 1 106 ASN HD22 . . 4.760 2.514 1.876 3.421 . 0 0 "[ . 1 . 2]" 1 897 1 103 VAL H 1 103 VAL HB . . 3.730 2.419 2.244 2.500 . 0 0 "[ . 1 . 2]" 1 898 1 103 VAL H 1 103 VAL MG2 . . 3.460 2.042 1.895 2.533 . 0 0 "[ . 1 . 2]" 1 899 1 103 VAL H 1 104 GLU H . . 3.580 2.824 2.575 2.927 . 0 0 "[ . 1 . 2]" 1 900 1 103 VAL HB 1 104 GLU H . . 4.600 2.465 2.343 2.686 . 0 0 "[ . 1 . 2]" 1 901 1 103 VAL MG1 1 104 GLU H . . 4.610 3.318 3.057 3.578 . 0 0 "[ . 1 . 2]" 1 902 1 103 VAL MG1 1 114 PHE QD . . 7.840 2.762 2.021 3.952 . 0 0 "[ . 1 . 2]" 1 903 1 103 VAL MG1 1 117 GLU H . . 5.440 4.260 3.947 4.419 . 0 0 "[ . 1 . 2]" 1 904 1 103 VAL MG1 1 118 LEU H . . 4.570 3.610 3.364 3.824 . 0 0 "[ . 1 . 2]" 1 905 1 103 VAL MG1 1 118 LEU HA . . 4.540 3.471 3.144 3.677 . 0 0 "[ . 1 . 2]" 1 906 1 103 VAL MG2 1 104 GLU H . . 5.290 3.840 3.754 3.949 . 0 0 "[ . 1 . 2]" 1 907 1 103 VAL MG2 1 106 ASN H . . 6.530 5.156 4.959 5.309 . 0 0 "[ . 1 . 2]" 1 908 1 103 VAL MG2 1 114 PHE QD . . 8.650 4.866 4.140 5.759 . 0 0 "[ . 1 . 2]" 1 909 1 103 VAL MG2 1 114 PHE QE . . 8.090 4.900 4.010 5.676 . 0 0 "[ . 1 . 2]" 1 910 1 103 VAL MG2 1 118 LEU HA . . 6.280 4.136 3.752 4.459 . 0 0 "[ . 1 . 2]" 1 911 1 104 GLU H 1 104 GLU HB2 . . 3.800 2.568 2.034 3.545 . 0 0 "[ . 1 . 2]" 1 912 1 104 GLU H 1 104 GLU QB . . 3.620 2.188 2.008 2.373 . 0 0 "[ . 1 . 2]" 1 913 1 104 GLU H 1 104 GLU HB3 . . 3.800 2.835 2.267 3.518 . 0 0 "[ . 1 . 2]" 1 914 1 104 GLU H 1 105 GLU H . . 3.610 2.779 2.637 2.933 . 0 0 "[ . 1 . 2]" 1 915 1 104 GLU HA 1 107 ALA MB . . 4.080 2.305 1.961 2.662 . 0 0 "[ . 1 . 2]" 1 916 1 104 GLU HA 1 114 PHE QD . . 6.320 3.200 1.977 4.411 . 0 0 "[ . 1 . 2]" 1 917 1 104 GLU QB 1 105 GLU H . . 3.660 2.769 2.420 3.427 . 0 0 "[ . 1 . 2]" 1 918 1 104 GLU QB 1 107 ALA H . . 5.420 4.695 4.524 4.867 . 0 0 "[ . 1 . 2]" 1 919 1 104 GLU QB 1 108 ARG QG . . 7.250 3.445 2.845 3.980 . 0 0 "[ . 1 . 2]" 1 920 1 104 GLU HB2 1 105 GLU H . . 3.830 3.458 2.655 3.910 0.080 8 0 "[ . 1 . 2]" 1 921 1 104 GLU HB3 1 105 GLU H . . 3.830 3.092 2.447 3.862 0.032 2 0 "[ . 1 . 2]" 1 922 1 105 GLU H 1 105 GLU QB . . 3.880 2.188 2.069 2.507 . 0 0 "[ . 1 . 2]" 1 923 1 105 GLU H 1 105 GLU QG . . 4.550 3.880 1.936 4.024 . 0 0 "[ . 1 . 2]" 1 924 1 105 GLU H 1 106 ASN H . . 3.210 2.746 2.624 2.822 . 0 0 "[ . 1 . 2]" 1 925 1 105 GLU H 1 106 ASN HA . . 5.280 5.248 5.145 5.309 0.029 11 0 "[ . 1 . 2]" 1 926 1 105 GLU HA 1 108 ARG H . . 3.640 3.362 3.090 3.615 . 0 0 "[ . 1 . 2]" 1 927 1 105 GLU QB 1 106 ASN H . . 4.060 2.781 2.489 3.633 . 0 0 "[ . 1 . 2]" 1 928 1 105 GLU HB2 1 106 ASN H . . 4.820 3.915 3.510 4.128 . 0 0 "[ . 1 . 2]" 1 929 1 105 GLU HB3 1 106 ASN H . . 4.820 2.865 2.546 4.182 . 0 0 "[ . 1 . 2]" 1 930 1 105 GLU QG 1 106 ASN H . . 5.350 3.859 2.313 4.274 . 0 0 "[ . 1 . 2]" 1 931 1 105 GLU QG 1 106 ASN HD21 . . 5.940 4.261 3.478 5.057 . 0 0 "[ . 1 . 2]" 1 932 1 105 GLU QG 1 106 ASN QD . . 5.660 3.955 3.200 4.546 . 0 0 "[ . 1 . 2]" 1 933 1 105 GLU QG 1 106 ASN HD22 . . 5.940 4.744 3.740 5.153 . 0 0 "[ . 1 . 2]" 1 934 1 106 ASN H 1 106 ASN HB2 . . 3.920 2.237 2.040 2.650 . 0 0 "[ . 1 . 2]" 1 935 1 106 ASN H 1 106 ASN QB . . 3.680 2.206 2.021 2.580 . 0 0 "[ . 1 . 2]" 1 936 1 106 ASN H 1 106 ASN HB3 . . 3.920 3.426 3.247 3.572 . 0 0 "[ . 1 . 2]" 1 937 1 106 ASN H 1 108 ARG QG . . 6.380 4.811 4.525 5.221 . 0 0 "[ . 1 . 2]" 1 938 1 106 ASN HA 1 109 GLU H . . 4.320 3.426 3.233 3.623 . 0 0 "[ . 1 . 2]" 1 939 1 106 ASN HA 1 110 PHE H . . 5.100 4.520 3.863 5.175 0.075 4 0 "[ . 1 . 2]" 1 940 1 106 ASN QB 1 107 ALA HA . . 4.490 3.765 3.652 3.851 . 0 0 "[ . 1 . 2]" 1 941 1 106 ASN HB2 1 107 ALA H . . 4.070 2.837 2.347 3.223 . 0 0 "[ . 1 . 2]" 1 942 1 106 ASN HB3 1 107 ALA H . . 4.070 3.422 2.945 4.080 0.010 11 0 "[ . 1 . 2]" 1 943 1 107 ALA H 1 107 ALA MB . . 3.430 2.071 1.945 2.200 . 0 0 "[ . 1 . 2]" 1 944 1 107 ALA H 1 108 ARG H . . 3.210 2.504 2.368 2.702 . 0 0 "[ . 1 . 2]" 1 945 1 107 ALA H 1 109 GLU H . . 5.500 4.191 3.702 4.592 . 0 0 "[ . 1 . 2]" 1 946 1 107 ALA H 1 110 PHE H . . 5.280 4.691 4.490 5.295 0.015 4 0 "[ . 1 . 2]" 1 947 1 107 ALA HA 1 108 ARG QG . . 5.950 5.279 5.099 5.392 . 0 0 "[ . 1 . 2]" 1 948 1 107 ALA HA 1 109 GLU QG . . 6.290 4.182 3.903 4.597 . 0 0 "[ . 1 . 2]" 1 949 1 107 ALA HA 1 110 PHE H . . 4.260 3.210 2.935 3.995 . 0 0 "[ . 1 . 2]" 1 950 1 107 ALA HA 1 110 PHE QD . . 7.620 4.776 4.005 6.363 . 0 0 "[ . 1 . 2]" 1 951 1 107 ALA HA 1 111 ASN H . . 4.290 4.181 3.760 4.357 0.067 5 0 "[ . 1 . 2]" 1 952 1 107 ALA HA 1 112 ASN H . . 4.200 2.465 1.966 2.840 . 0 0 "[ . 1 . 2]" 1 953 1 107 ALA HA 1 112 ASN HB2 . . 3.240 2.721 2.315 3.082 . 0 0 "[ . 1 . 2]" 1 954 1 107 ALA HA 1 112 ASN HB3 . . 3.240 2.194 1.949 2.437 . 0 0 "[ . 1 . 2]" 1 955 1 107 ALA MB 1 108 ARG H . . 3.770 2.911 2.836 2.998 . 0 0 "[ . 1 . 2]" 1 956 1 107 ALA MB 1 108 ARG HA . . 5.010 3.828 3.764 3.893 . 0 0 "[ . 1 . 2]" 1 957 1 107 ALA MB 1 110 PHE QB . . 7.250 4.106 3.721 5.278 . 0 0 "[ . 1 . 2]" 1 958 1 107 ALA MB 1 112 ASN H . . 4.700 2.996 2.720 3.252 . 0 0 "[ . 1 . 2]" 1 959 1 107 ALA MB 1 112 ASN HB2 . . 4.950 3.403 3.211 3.663 . 0 0 "[ . 1 . 2]" 1 960 1 107 ALA MB 1 112 ASN HB3 . . 4.140 2.001 1.920 2.314 . 0 0 "[ . 1 . 2]" 1 961 1 107 ALA MB 1 112 ASN HD21 . . 5.880 2.806 2.265 3.364 . 0 0 "[ . 1 . 2]" 1 962 1 107 ALA MB 1 113 THR H . . 5.230 4.162 3.945 4.267 . 0 0 "[ . 1 . 2]" 1 963 1 107 ALA MB 1 113 THR HA . . 6.530 4.001 3.401 4.309 . 0 0 "[ . 1 . 2]" 1 964 1 107 ALA MB 1 114 PHE HA . . 4.670 2.708 2.496 3.032 . 0 0 "[ . 1 . 2]" 1 965 1 108 ARG H 1 108 ARG QD . . 5.320 4.318 4.226 4.443 . 0 0 "[ . 1 . 2]" 1 966 1 108 ARG H 1 108 ARG HG2 . . 3.140 3.058 2.955 3.149 0.009 13 0 "[ . 1 . 2]" 1 967 1 108 ARG H 1 108 ARG QG . . 2.740 2.544 2.457 2.601 . 0 0 "[ . 1 . 2]" 1 968 1 108 ARG H 1 108 ARG HG3 . . 3.140 2.726 2.587 2.886 . 0 0 "[ . 1 . 2]" 1 969 1 108 ARG H 1 109 GLU H . . 3.170 2.604 2.405 2.830 . 0 0 "[ . 1 . 2]" 1 970 1 108 ARG HA 1 108 ARG HG2 . . 3.360 2.207 2.175 2.266 . 0 0 "[ . 1 . 2]" 1 971 1 108 ARG HA 1 108 ARG QG . . 3.170 2.180 2.146 2.234 . 0 0 "[ . 1 . 2]" 1 972 1 108 ARG HA 1 108 ARG HG3 . . 3.360 3.383 3.298 3.441 0.081 3 0 "[ . 1 . 2]" 1 973 1 108 ARG HA 1 111 ASN H . . 4.350 3.629 3.230 4.494 0.144 4 0 "[ . 1 . 2]" 1 974 1 108 ARG HA 1 112 ASN H . . 4.790 4.485 4.117 4.851 0.061 20 0 "[ . 1 . 2]" 1 975 1 108 ARG QB 1 109 GLU H . . 4.420 2.665 2.345 2.916 . 0 0 "[ . 1 . 2]" 1 976 1 108 ARG HG2 1 109 GLU H . . 5.500 4.822 4.744 4.882 . 0 0 "[ . 1 . 2]" 1 977 1 108 ARG HG3 1 109 GLU H . . 5.500 4.626 4.384 4.764 . 0 0 "[ . 1 . 2]" 1 978 1 109 GLU H 1 109 GLU HB2 . . 3.890 3.572 3.480 3.605 . 0 0 "[ . 1 . 2]" 1 979 1 109 GLU H 1 109 GLU HB3 . . 2.960 2.626 2.203 2.775 . 0 0 "[ . 1 . 2]" 1 980 1 109 GLU H 1 109 GLU HG2 . . 3.330 2.280 1.867 3.341 0.011 4 0 "[ . 1 . 2]" 1 981 1 109 GLU H 1 109 GLU HG3 . . 3.330 2.808 2.448 3.432 0.102 11 0 "[ . 1 . 2]" 1 982 1 109 GLU H 1 110 PHE QD . . 7.340 5.557 4.849 6.086 . 0 0 "[ . 1 . 2]" 1 983 1 109 GLU HA 1 109 GLU HG2 . . 4.140 3.883 3.534 4.226 0.086 4 0 "[ . 1 . 2]" 1 984 1 109 GLU HA 1 109 GLU QG . . 3.680 3.338 3.322 3.390 . 0 0 "[ . 1 . 2]" 1 985 1 109 GLU HA 1 109 GLU HG3 . . 4.140 3.683 3.558 4.122 . 0 0 "[ . 1 . 2]" 1 986 1 109 GLU HB2 1 110 PHE H . . 4.230 4.115 3.753 4.299 0.069 12 0 "[ . 1 . 2]" 1 987 1 109 GLU HB2 1 110 PHE QD . . 6.410 4.806 4.172 5.345 . 0 0 "[ . 1 . 2]" 1 988 1 109 GLU HB3 1 110 PHE QD . . 7.620 5.848 5.176 6.562 . 0 0 "[ . 1 . 2]" 1 989 1 109 GLU QG 1 110 PHE H . . 3.510 2.263 1.886 2.686 . 0 0 "[ . 1 . 2]" 1 990 1 109 GLU QG 1 110 PHE QD . . 7.330 3.256 2.470 3.945 . 0 0 "[ . 1 . 2]" 1 991 1 109 GLU HG2 1 110 PHE H . . 4.350 3.190 1.903 3.838 . 0 0 "[ . 1 . 2]" 1 992 1 109 GLU HG2 1 110 PHE QD . . 7.620 4.662 3.826 5.534 . 0 0 "[ . 1 . 2]" 1 993 1 109 GLU HG3 1 110 PHE H . . 4.350 2.487 2.096 3.154 . 0 0 "[ . 1 . 2]" 1 994 1 109 GLU HG3 1 110 PHE QD . . 7.620 3.340 2.501 4.220 . 0 0 "[ . 1 . 2]" 1 995 1 110 PHE H 1 110 PHE HB2 . . 3.330 2.300 2.073 2.479 . 0 0 "[ . 1 . 2]" 1 996 1 110 PHE H 1 110 PHE QB . . 3.060 2.216 2.044 2.404 . 0 0 "[ . 1 . 2]" 1 997 1 110 PHE H 1 110 PHE HB3 . . 3.330 2.937 2.600 3.280 . 0 0 "[ . 1 . 2]" 1 998 1 110 PHE H 1 112 ASN H . . 3.980 3.314 3.089 3.734 . 0 0 "[ . 1 . 2]" 1 999 1 110 PHE HA 1 111 ASN HB3 . . 5.500 4.501 4.215 5.450 . 0 0 "[ . 1 . 2]" 1 1000 1 110 PHE QD 1 111 ASN H . . 7.620 4.841 3.946 5.031 . 0 0 "[ . 1 . 2]" 1 1001 1 111 ASN H 1 111 ASN HA . . 2.590 2.238 2.170 2.699 0.109 4 0 "[ . 1 . 2]" 1 1002 1 111 ASN H 1 111 ASN HB2 . . 3.490 3.009 2.847 3.688 0.198 12 0 "[ . 1 . 2]" 1 1003 1 111 ASN H 1 111 ASN HB3 . . 3.800 3.531 3.287 3.791 . 0 0 "[ . 1 . 2]" 1 1004 1 111 ASN H 1 112 ASN H . . 3.110 2.784 1.850 2.950 . 0 0 "[ . 1 . 2]" 1 1005 1 111 ASN HA 1 111 ASN HB2 . . 2.990 2.556 2.456 2.735 . 0 0 "[ . 1 . 2]" 1 1006 1 111 ASN HA 1 111 ASN HD21 . . 4.040 2.328 1.869 3.208 . 0 0 "[ . 1 . 2]" 1 1007 1 111 ASN HA 1 112 ASN H . . 3.110 2.977 2.833 3.102 . 0 0 "[ . 1 . 2]" 1 1008 1 111 ASN HB2 1 112 ASN H . . 5.190 4.604 4.419 4.717 . 0 0 "[ . 1 . 2]" 1 1009 1 111 ASN HB3 1 111 ASN HD21 . . 3.550 3.149 2.449 3.558 0.008 16 0 "[ . 1 . 2]" 1 1010 1 111 ASN HB3 1 112 ASN H . . 4.480 4.141 3.991 4.311 . 0 0 "[ . 1 . 2]" 1 1011 1 111 ASN HD22 1 164 SER HA . . 4.880 4.938 4.902 4.981 0.101 15 0 "[ . 1 . 2]" 1 1012 1 112 ASN H 1 112 ASN HB2 . . 3.490 2.398 2.272 2.554 . 0 0 "[ . 1 . 2]" 1 1013 1 112 ASN H 1 112 ASN HB3 . . 3.330 2.638 2.549 2.842 . 0 0 "[ . 1 . 2]" 1 1014 1 112 ASN H 1 113 THR H . . 5.340 4.618 4.563 4.643 . 0 0 "[ . 1 . 2]" 1 1015 1 112 ASN HA 1 113 THR H . . 3.050 2.461 2.299 2.620 . 0 0 "[ . 1 . 2]" 1 1016 1 112 ASN HA 1 113 THR MG . . 6.340 4.188 3.256 5.432 . 0 0 "[ . 1 . 2]" 1 1017 1 112 ASN HB2 1 112 ASN HD22 . . 4.070 3.973 3.917 4.024 . 0 0 "[ . 1 . 2]" 1 1018 1 112 ASN HB2 1 113 THR H . . 4.540 4.085 3.858 4.436 . 0 0 "[ . 1 . 2]" 1 1019 1 112 ASN HB3 1 113 THR H . . 3.860 3.573 3.217 3.918 0.058 10 0 "[ . 1 . 2]" 1 1020 1 112 ASN HD21 1 113 THR H . . 4.820 3.606 2.905 4.276 . 0 0 "[ . 1 . 2]" 1 1021 1 112 ASN HD21 1 117 GLU HA . . 4.110 4.163 4.089 4.241 0.131 15 0 "[ . 1 . 2]" 1 1022 1 112 ASN HD22 1 113 THR H . . 4.690 3.549 3.054 4.203 . 0 0 "[ . 1 . 2]" 1 1023 1 112 ASN HD22 1 117 GLU HA . . 3.610 3.638 3.615 3.685 0.075 20 0 "[ . 1 . 2]" 1 1024 1 112 ASN HD22 1 117 GLU HB2 . . 5.500 3.118 2.593 3.518 . 0 0 "[ . 1 . 2]" 1 1025 1 112 ASN HD22 1 117 GLU QB . . 4.790 3.065 2.573 3.426 . 0 0 "[ . 1 . 2]" 1 1026 1 112 ASN HD22 1 117 GLU HB3 . . 5.500 4.561 4.146 4.825 . 0 0 "[ . 1 . 2]" 1 1027 1 113 THR H 1 113 THR MG . . 4.330 2.733 1.781 3.722 . 0 0 "[ . 1 . 2]" 1 1028 1 113 THR H 1 114 PHE H . . 5.500 4.272 4.185 4.375 . 0 0 "[ . 1 . 2]" 1 1029 1 113 THR H 1 116 LYS QB . . 5.730 3.763 3.354 4.294 . 0 0 "[ . 1 . 2]" 1 1030 1 113 THR H 1 116 LYS QG . . 6.380 4.938 3.166 5.722 . 0 0 "[ . 1 . 2]" 1 1031 1 113 THR HA 1 113 THR MG . . 3.640 2.380 2.040 3.217 . 0 0 "[ . 1 . 2]" 1 1032 1 113 THR HA 1 114 PHE H . . 3.080 2.208 2.176 2.216 . 0 0 "[ . 1 . 2]" 1 1033 1 113 THR HA 1 115 GLU H . . 3.980 3.525 3.342 3.815 . 0 0 "[ . 1 . 2]" 1 1034 1 113 THR HA 1 116 LYS H . . 4.720 4.201 3.925 4.596 . 0 0 "[ . 1 . 2]" 1 1035 1 113 THR MG 1 114 PHE H . . 5.230 4.012 3.428 4.412 . 0 0 "[ . 1 . 2]" 1 1036 1 113 THR MG 1 115 GLU H . . 5.470 3.962 2.245 4.687 . 0 0 "[ . 1 . 2]" 1 1037 1 113 THR MG 1 156 TRP HH2 . . 6.430 2.638 1.830 3.648 . 0 0 "[ . 1 . 2]" 1 1038 1 113 THR MG 1 156 TRP HZ2 . . 6.280 2.255 1.807 3.737 . 0 0 "[ . 1 . 2]" 1 1039 1 113 THR MG 1 156 TRP HZ3 . . 5.690 4.252 3.401 4.855 . 0 0 "[ . 1 . 2]" 1 1040 1 114 PHE H 1 114 PHE HB2 . . 3.760 2.687 2.374 3.049 . 0 0 "[ . 1 . 2]" 1 1041 1 114 PHE H 1 114 PHE QB . . 3.600 2.017 1.878 2.102 . 0 0 "[ . 1 . 2]" 1 1042 1 114 PHE H 1 114 PHE HB3 . . 3.760 2.106 1.896 2.345 . 0 0 "[ . 1 . 2]" 1 1043 1 114 PHE H 1 115 GLU H . . 4.540 2.875 2.782 2.986 . 0 0 "[ . 1 . 2]" 1 1044 1 114 PHE HB2 1 115 GLU H . . 5.380 4.129 3.888 4.306 . 0 0 "[ . 1 . 2]" 1 1045 1 114 PHE HB3 1 115 GLU H . . 5.380 2.887 2.460 3.256 . 0 0 "[ . 1 . 2]" 1 1046 1 114 PHE QD 1 115 GLU H . . 7.620 3.460 2.124 4.127 . 0 0 "[ . 1 . 2]" 1 1047 1 114 PHE QD 1 115 GLU QG . . 8.350 4.546 3.584 5.374 . 0 0 "[ . 1 . 2]" 1 1048 1 115 GLU H 1 115 GLU HG2 . . 5.100 2.372 1.900 4.412 . 0 0 "[ . 1 . 2]" 1 1049 1 115 GLU H 1 115 GLU QG . . 4.290 2.124 1.818 3.542 . 0 0 "[ . 1 . 2]" 1 1050 1 115 GLU H 1 115 GLU HG3 . . 5.100 3.256 1.897 3.742 . 0 0 "[ . 1 . 2]" 1 1051 1 115 GLU H 1 116 LYS H . . 3.640 2.706 2.455 2.888 . 0 0 "[ . 1 . 2]" 1 1052 1 115 GLU HA 1 115 GLU QG . . 3.820 3.124 1.983 3.387 . 0 0 "[ . 1 . 2]" 1 1053 1 116 LYS H 1 116 LYS HB2 . . 3.670 2.654 2.285 3.386 . 0 0 "[ . 1 . 2]" 1 1054 1 116 LYS H 1 116 LYS QB . . 3.450 2.139 1.985 2.200 . 0 0 "[ . 1 . 2]" 1 1055 1 116 LYS H 1 116 LYS HB3 . . 3.670 2.352 2.006 2.686 . 0 0 "[ . 1 . 2]" 1 1056 1 116 LYS H 1 116 LYS QE . . 6.010 4.710 4.119 5.432 . 0 0 "[ . 1 . 2]" 1 1057 1 116 LYS H 1 117 GLU H . . 3.270 2.662 2.483 2.840 . 0 0 "[ . 1 . 2]" 1 1058 1 116 LYS HA 1 116 LYS HG2 . . 4.200 3.106 2.138 4.211 0.011 17 0 "[ . 1 . 2]" 1 1059 1 116 LYS HA 1 116 LYS QG . . 3.690 2.593 2.114 3.387 . 0 0 "[ . 1 . 2]" 1 1060 1 116 LYS HA 1 116 LYS HG3 . . 4.200 3.213 2.389 3.570 . 0 0 "[ . 1 . 2]" 1 1061 1 116 LYS HA 1 119 LEU H . . 4.600 3.162 3.027 3.696 . 0 0 "[ . 1 . 2]" 1 1062 1 116 LYS HA 1 119 LEU MD2 . . 4.390 3.165 1.751 3.601 . 0 0 "[ . 1 . 2]" 1 1063 1 116 LYS HA 1 152 VAL MG1 . . 5.880 3.892 3.296 4.480 . 0 0 "[ . 1 . 2]" 1 1064 1 116 LYS QB 1 117 GLU H . . 4.890 2.729 2.447 3.493 . 0 0 "[ . 1 . 2]" 1 1065 1 116 LYS HB2 1 117 GLU H . . 5.500 3.991 3.675 4.344 . 0 0 "[ . 1 . 2]" 1 1066 1 116 LYS HB3 1 117 GLU H . . 5.500 2.784 2.475 3.682 . 0 0 "[ . 1 . 2]" 1 1067 1 116 LYS QD 1 152 VAL HB . . 5.200 4.316 3.750 4.659 . 0 0 "[ . 1 . 2]" 1 1068 1 116 LYS QE 1 116 LYS QG . . 3.370 2.173 1.956 2.380 . 0 0 "[ . 1 . 2]" 1 1069 1 116 LYS QG 1 152 VAL MG1 . . 7.040 2.733 1.859 4.129 . 0 0 "[ . 1 . 2]" 1 1070 1 117 GLU H 1 117 GLU HB2 . . 3.980 2.052 2.017 2.211 . 0 0 "[ . 1 . 2]" 1 1071 1 117 GLU H 1 117 GLU HB3 . . 3.980 3.116 2.777 3.286 . 0 0 "[ . 1 . 2]" 1 1072 1 117 GLU H 1 118 LEU H . . 3.980 2.744 2.455 2.828 . 0 0 "[ . 1 . 2]" 1 1073 1 117 GLU HA 1 121 VAL H . . 5.070 4.898 4.613 5.112 0.042 8 0 "[ . 1 . 2]" 1 1074 1 118 LEU H 1 118 LEU MD1 . . 5.040 3.888 3.549 4.194 . 0 0 "[ . 1 . 2]" 1 1075 1 118 LEU H 1 118 LEU HG . . 5.500 4.514 4.271 4.612 . 0 0 "[ . 1 . 2]" 1 1076 1 118 LEU H 1 119 LEU H . . 3.450 2.454 2.329 2.659 . 0 0 "[ . 1 . 2]" 1 1077 1 118 LEU HA 1 118 LEU MD1 . . 4.200 3.382 2.394 3.766 . 0 0 "[ . 1 . 2]" 1 1078 1 118 LEU HA 1 121 VAL MG1 . . 5.410 2.861 1.948 3.540 . 0 0 "[ . 1 . 2]" 1 1079 1 118 LEU HA 1 121 VAL MG2 . . 4.140 2.241 1.902 2.969 . 0 0 "[ . 1 . 2]" 1 1080 1 118 LEU MD1 1 119 LEU H . . 5.910 3.545 2.683 4.952 . 0 0 "[ . 1 . 2]" 1 1081 1 118 LEU MD1 1 121 VAL MG2 . . 5.170 3.360 2.499 3.788 . 0 0 "[ . 1 . 2]" 1 1082 1 118 LEU MD1 1 159 TRP HH2 . . 6.030 4.504 2.209 4.985 . 0 0 "[ . 1 . 2]" 1 1083 1 118 LEU MD1 1 159 TRP HZ2 . . 6.530 5.172 4.333 5.419 . 0 0 "[ . 1 . 2]" 1 1084 1 118 LEU MD2 1 121 VAL MG2 . . 6.440 2.130 1.652 4.018 . 0 0 "[ . 1 . 2]" 1 1085 1 119 LEU H 1 119 LEU HB2 . . 3.670 2.336 2.002 3.531 . 0 0 "[ . 1 . 2]" 1 1086 1 119 LEU H 1 119 LEU HB3 . . 3.670 3.140 2.277 3.471 . 0 0 "[ . 1 . 2]" 1 1087 1 119 LEU H 1 119 LEU MD1 . . 5.160 3.003 2.293 3.989 . 0 0 "[ . 1 . 2]" 1 1088 1 119 LEU H 1 119 LEU MD2 . . 5.070 3.979 2.533 4.380 . 0 0 "[ . 1 . 2]" 1 1089 1 119 LEU H 1 119 LEU HG . . 3.800 3.509 2.429 3.881 0.081 14 0 "[ . 1 . 2]" 1 1090 1 119 LEU H 1 120 GLU H . . 3.450 2.659 2.521 2.832 . 0 0 "[ . 1 . 2]" 1 1091 1 119 LEU HA 1 119 LEU MD1 . . 4.390 3.166 2.915 3.721 . 0 0 "[ . 1 . 2]" 1 1092 1 119 LEU HA 1 122 VAL H . . 4.600 3.241 2.906 3.439 . 0 0 "[ . 1 . 2]" 1 1093 1 119 LEU QB 1 120 GLU H . . 5.980 3.106 2.746 3.707 . 0 0 "[ . 1 . 2]" 1 1094 1 119 LEU QB 1 152 VAL MG2 . . 7.380 2.684 1.881 4.431 . 0 0 "[ . 1 . 2]" 1 1095 1 119 LEU MD1 1 156 TRP HD1 . . 5.850 4.048 3.570 4.812 . 0 0 "[ . 1 . 2]" 1 1096 1 119 LEU MD1 1 156 TRP HE3 . . 6.400 5.053 4.489 5.224 . 0 0 "[ . 1 . 2]" 1 1097 1 119 LEU MD1 1 159 TRP H . . 6.530 4.706 4.125 5.391 . 0 0 "[ . 1 . 2]" 1 1098 1 119 LEU MD1 1 159 TRP HE3 . . 6.530 3.962 3.495 4.401 . 0 0 "[ . 1 . 2]" 1 1099 1 119 LEU MD2 1 120 GLU H . . 6.160 4.761 3.725 5.133 . 0 0 "[ . 1 . 2]" 1 1100 1 119 LEU MD2 1 120 GLU QG . . 7.400 5.282 5.077 5.578 . 0 0 "[ . 1 . 2]" 1 1101 1 119 LEU MD2 1 156 TRP H . . 4.510 2.760 2.473 3.464 . 0 0 "[ . 1 . 2]" 1 1102 1 119 LEU MD2 1 156 TRP HA . . 5.470 2.270 2.065 2.423 . 0 0 "[ . 1 . 2]" 1 1103 1 119 LEU MD2 1 156 TRP QB . . 6.200 1.960 1.870 2.201 . 0 0 "[ . 1 . 2]" 1 1104 1 119 LEU MD2 1 156 TRP HD1 . . 5.130 3.829 3.000 4.118 . 0 0 "[ . 1 . 2]" 1 1105 1 119 LEU MD2 1 156 TRP HE3 . . 5.570 4.414 4.347 4.528 . 0 0 "[ . 1 . 2]" 1 1106 1 119 LEU MD2 1 157 GLY H . . 5.750 4.373 4.074 4.821 . 0 0 "[ . 1 . 2]" 1 1107 1 119 LEU MD2 1 159 TRP H . . 6.090 4.332 3.792 4.620 . 0 0 "[ . 1 . 2]" 1 1108 1 119 LEU HG 1 155 VAL MG1 . . 4.540 2.951 2.542 3.635 . 0 0 "[ . 1 . 2]" 1 1109 1 120 GLU H 1 121 VAL H . . 3.490 2.781 2.557 2.902 . 0 0 "[ . 1 . 2]" 1 1110 1 120 GLU H 1 121 VAL MG1 . . 6.530 4.086 3.648 4.558 . 0 0 "[ . 1 . 2]" 1 1111 1 120 GLU H 1 121 VAL MG2 . . 5.780 4.062 3.498 4.357 . 0 0 "[ . 1 . 2]" 1 1112 1 120 GLU H 1 123 ILE H . . 5.340 4.770 4.604 5.050 . 0 0 "[ . 1 . 2]" 1 1113 1 120 GLU H 1 152 VAL MG1 . . 6.340 5.179 5.010 5.233 . 0 0 "[ . 1 . 2]" 1 1114 1 120 GLU H 1 152 VAL MG2 . . 5.410 3.390 3.055 3.674 . 0 0 "[ . 1 . 2]" 1 1115 1 120 GLU HA 1 121 VAL MG1 . . 6.530 4.837 4.671 5.097 . 0 0 "[ . 1 . 2]" 1 1116 1 120 GLU HA 1 123 ILE HB . . 5.500 5.027 4.823 5.276 . 0 0 "[ . 1 . 2]" 1 1117 1 120 GLU HA 1 123 ILE MD . . 5.290 2.714 2.057 3.008 . 0 0 "[ . 1 . 2]" 1 1118 1 120 GLU HA 1 152 VAL MG1 . . 6.530 4.839 4.382 5.237 . 0 0 "[ . 1 . 2]" 1 1119 1 120 GLU HA 1 152 VAL MG2 . . 4.080 2.442 1.891 2.773 . 0 0 "[ . 1 . 2]" 1 1120 1 120 GLU QB 1 152 VAL MG1 . . 7.400 5.103 3.493 5.468 . 0 0 "[ . 1 . 2]" 1 1121 1 120 GLU QB 1 152 VAL MG2 . . 5.920 3.454 1.841 3.815 . 0 0 "[ . 1 . 2]" 1 1122 1 120 GLU QG 1 152 VAL MG1 . . 7.400 3.723 3.253 5.394 . 0 0 "[ . 1 . 2]" 1 1123 1 120 GLU QG 1 152 VAL MG2 . . 7.400 2.246 1.772 3.968 . 0 0 "[ . 1 . 2]" 1 1124 1 121 VAL H 1 121 VAL HB . . 3.800 3.518 3.474 3.553 . 0 0 "[ . 1 . 2]" 1 1125 1 121 VAL H 1 121 VAL MG1 . . 3.550 2.044 1.870 2.330 . 0 0 "[ . 1 . 2]" 1 1126 1 121 VAL H 1 121 VAL MG2 . . 3.430 2.315 1.827 2.660 . 0 0 "[ . 1 . 2]" 1 1127 1 121 VAL H 1 122 VAL H . . 3.270 2.610 2.367 2.696 . 0 0 "[ . 1 . 2]" 1 1128 1 121 VAL H 1 122 VAL MG2 . . 6.530 4.118 3.428 4.584 . 0 0 "[ . 1 . 2]" 1 1129 1 121 VAL HA 1 124 HIS H . . 4.200 3.310 3.125 3.441 . 0 0 "[ . 1 . 2]" 1 1130 1 121 VAL HA 1 124 HIS HA . . 5.160 4.544 4.319 4.693 . 0 0 "[ . 1 . 2]" 1 1131 1 121 VAL HA 1 124 HIS HB2 . . 3.920 2.063 1.892 2.412 . 0 0 "[ . 1 . 2]" 1 1132 1 121 VAL HA 1 124 HIS HB3 . . 3.760 2.658 1.970 3.274 . 0 0 "[ . 1 . 2]" 1 1133 1 121 VAL HB 1 122 VAL H . . 4.350 4.169 4.028 4.265 . 0 0 "[ . 1 . 2]" 1 1134 1 121 VAL MG1 1 122 VAL H . . 5.500 3.930 3.735 4.148 . 0 0 "[ . 1 . 2]" 1 1135 1 121 VAL MG2 1 122 VAL H . . 4.330 2.275 2.068 2.530 . 0 0 "[ . 1 . 2]" 1 1136 1 122 VAL H 1 122 VAL HB . . 3.140 2.243 2.071 2.489 . 0 0 "[ . 1 . 2]" 1 1137 1 122 VAL H 1 122 VAL MG1 . . 4.540 3.629 3.506 3.719 . 0 0 "[ . 1 . 2]" 1 1138 1 122 VAL H 1 122 VAL MG2 . . 3.490 2.418 1.896 2.799 . 0 0 "[ . 1 . 2]" 1 1139 1 122 VAL H 1 123 ILE H . . 3.860 2.663 2.595 2.773 . 0 0 "[ . 1 . 2]" 1 1140 1 122 VAL HB 1 123 ILE H . . 4.630 2.457 2.304 2.678 . 0 0 "[ . 1 . 2]" 1 1141 1 122 VAL MG1 1 123 ILE H . . 5.540 2.918 2.414 3.451 . 0 0 "[ . 1 . 2]" 1 1142 1 122 VAL MG1 1 125 GLY H . . 6.090 4.727 4.567 4.938 . 0 0 "[ . 1 . 2]" 1 1143 1 122 VAL MG1 1 126 ILE H . . 6.090 4.770 4.222 5.005 . 0 0 "[ . 1 . 2]" 1 1144 1 122 VAL MG2 1 123 ILE H . . 6.530 3.902 3.656 4.085 . 0 0 "[ . 1 . 2]" 1 1145 1 123 ILE H 1 123 ILE HB . . 3.760 3.551 3.530 3.571 . 0 0 "[ . 1 . 2]" 1 1146 1 123 ILE H 1 123 ILE MD . . 4.420 3.616 3.245 3.840 . 0 0 "[ . 1 . 2]" 1 1147 1 123 ILE H 1 123 ILE HG12 . . 3.520 2.072 1.946 2.302 . 0 0 "[ . 1 . 2]" 1 1148 1 123 ILE H 1 123 ILE QG . . 3.220 2.038 1.911 2.256 . 0 0 "[ . 1 . 2]" 1 1149 1 123 ILE H 1 123 ILE HG13 . . 3.520 3.096 2.787 3.579 0.059 3 0 "[ . 1 . 2]" 1 1150 1 123 ILE H 1 123 ILE MG . . 3.890 2.298 2.073 2.563 . 0 0 "[ . 1 . 2]" 1 1151 1 123 ILE H 1 124 HIS H . . 4.010 2.514 2.369 2.668 . 0 0 "[ . 1 . 2]" 1 1152 1 123 ILE HA 1 126 ILE MD . . 4.110 2.855 2.576 3.132 . 0 0 "[ . 1 . 2]" 1 1153 1 123 ILE HB 1 124 HIS H . . 4.820 4.242 4.157 4.313 . 0 0 "[ . 1 . 2]" 1 1154 1 123 ILE MD 1 151 TYR H . . 6.120 3.269 3.044 3.624 . 0 0 "[ . 1 . 2]" 1 1155 1 123 ILE MD 1 151 TYR HB3 . . 4.330 3.081 2.631 3.293 . 0 0 "[ . 1 . 2]" 1 1156 1 123 ILE MD 1 151 TYR QD . . 8.670 2.431 2.103 3.290 . 0 0 "[ . 1 . 2]" 1 1157 1 123 ILE MD 1 152 VAL MG1 . . 7.560 3.606 3.416 3.810 . 0 0 "[ . 1 . 2]" 1 1158 1 123 ILE MD 1 155 VAL H . . 5.910 4.729 4.561 4.832 . 0 0 "[ . 1 . 2]" 1 1159 1 123 ILE MD 1 155 VAL HB . . 5.380 4.161 3.945 4.262 . 0 0 "[ . 1 . 2]" 1 1160 1 123 ILE MD 1 155 VAL MG2 . . 6.070 3.782 3.634 3.901 . 0 0 "[ . 1 . 2]" 1 1161 1 123 ILE MG 1 124 HIS H . . 5.380 4.115 4.047 4.202 . 0 0 "[ . 1 . 2]" 1 1162 1 123 ILE MG 1 151 TYR H . . 5.850 4.679 4.611 4.755 . 0 0 "[ . 1 . 2]" 1 1163 1 123 ILE MG 1 151 TYR HB2 . . 4.480 2.528 2.347 2.886 . 0 0 "[ . 1 . 2]" 1 1164 1 123 ILE MG 1 151 TYR HB3 . . 5.660 2.361 2.003 2.650 . 0 0 "[ . 1 . 2]" 1 1165 1 123 ILE MG 1 152 VAL HB . . 6.060 4.670 4.322 5.020 . 0 0 "[ . 1 . 2]" 1 1166 1 124 HIS H 1 124 HIS HB2 . . 3.550 2.263 2.000 2.589 . 0 0 "[ . 1 . 2]" 1 1167 1 124 HIS H 1 124 HIS HB3 . . 4.070 2.739 2.322 3.334 . 0 0 "[ . 1 . 2]" 1 1168 1 124 HIS H 1 125 GLY H . . 4.450 2.782 2.751 2.839 . 0 0 "[ . 1 . 2]" 1 1169 1 124 HIS HA 1 126 ILE H . . 5.500 4.776 4.393 5.040 . 0 0 "[ . 1 . 2]" 1 1170 1 124 HIS HA 1 127 LEU QD . . 6.830 1.903 1.779 2.552 . 0 0 "[ . 1 . 2]" 1 1171 1 124 HIS HA 1 128 HIS H . . 4.450 4.058 3.486 4.523 0.073 3 0 "[ . 1 . 2]" 1 1172 1 124 HIS HB2 1 125 GLY H . . 4.630 3.827 3.003 4.249 . 0 0 "[ . 1 . 2]" 1 1173 1 124 HIS HB3 1 125 GLY H . . 3.800 2.961 2.664 3.519 . 0 0 "[ . 1 . 2]" 1 1174 1 124 HIS HB3 1 125 GLY QA . . 4.990 3.940 3.679 4.224 . 0 0 "[ . 1 . 2]" 1 1175 1 124 HIS HD2 1 127 LEU QD . . 8.040 3.610 2.285 5.366 . 0 0 "[ . 1 . 2]" 1 1176 1 125 GLY H 1 126 ILE H . . 3.700 2.536 2.396 2.850 . 0 0 "[ . 1 . 2]" 1 1177 1 125 GLY H 1 126 ILE HB . . 4.970 4.546 4.337 4.797 . 0 0 "[ . 1 . 2]" 1 1178 1 125 GLY H 1 127 LEU H . . 5.100 4.020 3.715 4.192 . 0 0 "[ . 1 . 2]" 1 1179 1 125 GLY QA 1 127 LEU H . . 5.790 4.345 3.854 4.590 . 0 0 "[ . 1 . 2]" 1 1180 1 126 ILE H 1 126 ILE HB . . 3.700 2.294 2.168 2.378 . 0 0 "[ . 1 . 2]" 1 1181 1 126 ILE H 1 126 ILE MD . . 4.700 3.364 2.829 3.618 . 0 0 "[ . 1 . 2]" 1 1182 1 126 ILE H 1 126 ILE HG12 . . 4.970 3.677 3.346 4.098 . 0 0 "[ . 1 . 2]" 1 1183 1 126 ILE H 1 126 ILE HG13 . . 3.830 2.364 2.080 2.865 . 0 0 "[ . 1 . 2]" 1 1184 1 126 ILE H 1 126 ILE MG . . 4.480 3.669 3.585 3.717 . 0 0 "[ . 1 . 2]" 1 1185 1 126 ILE H 1 127 LEU H . . 3.700 2.662 2.348 2.858 . 0 0 "[ . 1 . 2]" 1 1186 1 126 ILE H 1 127 LEU QD . . 6.610 4.668 4.290 4.896 . 0 0 "[ . 1 . 2]" 1 1187 1 126 ILE HB 1 126 ILE MD . . 3.490 2.259 2.114 2.446 . 0 0 "[ . 1 . 2]" 1 1188 1 126 ILE MG 1 129 LEU H . . 6.530 4.426 4.119 4.765 . 0 0 "[ . 1 . 2]" 1 1189 1 126 ILE MG 1 130 ALA H . . 6.090 3.884 3.537 4.303 . 0 0 "[ . 1 . 2]" 1 1190 1 127 LEU H 1 127 LEU MD1 . . 4.980 3.819 2.789 4.111 . 0 0 "[ . 1 . 2]" 1 1191 1 127 LEU H 1 127 LEU QD . . 4.470 3.225 2.752 3.412 . 0 0 "[ . 1 . 2]" 1 1192 1 127 LEU H 1 127 LEU MD2 . . 4.980 3.617 3.269 4.223 . 0 0 "[ . 1 . 2]" 1 1193 1 127 LEU H 1 127 LEU HG . . 3.020 2.925 2.566 3.121 0.101 3 0 "[ . 1 . 2]" 1 1194 1 127 LEU H 1 128 HIS H . . 3.830 2.827 2.722 2.954 . 0 0 "[ . 1 . 2]" 1 1195 1 127 LEU H 1 130 ALA MB . . 5.260 3.877 3.569 4.248 . 0 0 "[ . 1 . 2]" 1 1196 1 127 LEU HA 1 130 ALA HA . . 4.790 4.534 4.330 4.833 0.043 16 0 "[ . 1 . 2]" 1 1197 1 127 LEU HA 1 130 ALA MB . . 4.330 1.894 1.743 2.182 . 0 0 "[ . 1 . 2]" 1 1198 1 127 LEU QD 1 128 HIS H . . 7.790 2.909 2.123 4.196 . 0 0 "[ . 1 . 2]" 1 1199 1 127 LEU QD 1 128 HIS HD2 . . 6.450 3.640 1.886 4.784 . 0 0 "[ . 1 . 2]" 1 1200 1 127 LEU QD 1 132 TYR QD . . 10.140 3.325 2.425 4.702 . 0 0 "[ . 1 . 2]" 1 1201 1 127 LEU QD 1 132 TYR QE . . 8.310 2.912 1.787 5.592 . 0 0 "[ . 1 . 2]" 1 1202 1 127 LEU MD1 1 151 TYR QD . . 8.670 4.110 2.018 5.208 . 0 0 "[ . 1 . 2]" 1 1203 1 127 LEU MD2 1 151 TYR QD . . 8.670 3.354 2.351 4.984 . 0 0 "[ . 1 . 2]" 1 1204 1 128 HIS H 1 128 HIS HB2 . . 3.450 2.270 2.012 3.419 . 0 0 "[ . 1 . 2]" 1 1205 1 128 HIS H 1 128 HIS QB . . 3.260 2.148 1.993 2.702 . 0 0 "[ . 1 . 2]" 1 1206 1 128 HIS H 1 128 HIS HB3 . . 3.450 3.111 2.109 3.526 0.076 7 0 "[ . 1 . 2]" 1 1207 1 128 HIS H 1 129 LEU H . . 3.890 2.838 2.646 3.035 . 0 0 "[ . 1 . 2]" 1 1208 1 128 HIS H 1 130 ALA H . . 5.500 3.675 3.385 3.960 . 0 0 "[ . 1 . 2]" 1 1209 1 128 HIS H 1 144 MET ME . . 6.530 5.296 5.050 5.456 . 0 0 "[ . 1 . 2]" 1 1210 1 128 HIS HA 1 131 GLY H . . 4.170 3.921 3.417 4.245 0.075 1 0 "[ . 1 . 2]" 1 1211 1 128 HIS QB 1 129 LEU H . . 3.750 2.572 2.107 3.394 . 0 0 "[ . 1 . 2]" 1 1212 1 128 HIS QB 1 129 LEU QD . . 7.580 4.151 3.351 5.088 . 0 0 "[ . 1 . 2]" 1 1213 1 128 HIS QB 1 132 TYR QE . . 6.810 3.417 2.182 4.199 . 0 0 "[ . 1 . 2]" 1 1214 1 128 HIS HB2 1 129 LEU H . . 4.070 3.148 2.272 4.160 0.090 19 0 "[ . 1 . 2]" 1 1215 1 128 HIS HB3 1 129 LEU H . . 4.070 2.942 2.129 4.003 . 0 0 "[ . 1 . 2]" 1 1216 1 128 HIS HD2 1 129 LEU H . . 5.440 5.105 3.959 5.574 0.134 7 0 "[ . 1 . 2]" 1 1217 1 129 LEU H 1 129 LEU HB2 . . 3.800 2.771 2.027 3.586 . 0 0 "[ . 1 . 2]" 1 1218 1 129 LEU H 1 129 LEU HB3 . . 3.800 2.642 2.109 3.554 . 0 0 "[ . 1 . 2]" 1 1219 1 129 LEU H 1 129 LEU MD1 . . 5.780 3.981 3.029 4.354 . 0 0 "[ . 1 . 2]" 1 1220 1 129 LEU H 1 129 LEU QD . . 5.180 3.215 1.922 3.701 . 0 0 "[ . 1 . 2]" 1 1221 1 129 LEU H 1 129 LEU MD2 . . 5.780 3.587 1.925 4.455 . 0 0 "[ . 1 . 2]" 1 1222 1 129 LEU H 1 129 LEU HG . . 5.500 3.571 1.945 4.436 . 0 0 "[ . 1 . 2]" 1 1223 1 129 LEU H 1 130 ALA H . . 3.610 2.488 2.223 2.701 . 0 0 "[ . 1 . 2]" 1 1224 1 129 LEU HA 1 129 LEU HG . . 3.830 3.030 2.112 3.664 . 0 0 "[ . 1 . 2]" 1 1225 1 129 LEU HA 1 132 TYR QE . . 7.170 5.442 3.086 6.521 . 0 0 "[ . 1 . 2]" 1 1226 1 130 ALA H 1 131 GLY H . . 3.580 2.570 2.312 2.690 . 0 0 "[ . 1 . 2]" 1 1227 1 130 ALA HA 1 131 GLY H . . 3.640 3.506 3.372 3.553 . 0 0 "[ . 1 . 2]" 1 1228 1 130 ALA MB 1 131 GLY H . . 4.080 2.973 2.821 3.281 . 0 0 "[ . 1 . 2]" 1 1229 1 130 ALA MB 1 132 TYR QD . . 8.170 4.708 2.522 5.619 . 0 0 "[ . 1 . 2]" 1 1230 1 130 ALA MB 1 132 TYR QE . . 8.660 5.054 2.735 6.467 . 0 0 "[ . 1 . 2]" 1 1231 1 131 GLY H 1 132 TYR QD . . 7.640 3.768 2.676 4.754 . 0 0 "[ . 1 . 2]" 1 1232 1 132 TYR H 1 144 MET ME . . 6.530 4.656 1.760 5.485 . 0 0 "[ . 1 . 2]" 1 1233 1 132 TYR HA 1 144 MET ME . . 6.370 4.155 1.955 5.364 . 0 0 "[ . 1 . 2]" 1 1234 1 132 TYR QB 1 133 ASP HA . . 5.670 4.342 3.512 5.084 . 0 0 "[ . 1 . 2]" 1 1235 1 132 TYR QB 1 144 MET ME . . 4.900 2.787 1.929 3.503 . 0 0 "[ . 1 . 2]" 1 1236 1 132 TYR HB2 1 133 ASP H . . 5.500 3.111 1.993 4.654 . 0 0 "[ . 1 . 2]" 1 1237 1 132 TYR HB2 1 144 MET ME . . 5.410 3.495 1.987 4.537 . 0 0 "[ . 1 . 2]" 1 1238 1 132 TYR HB3 1 133 ASP H . . 5.500 3.429 1.911 4.498 . 0 0 "[ . 1 . 2]" 1 1239 1 132 TYR HB3 1 144 MET ME . . 5.410 3.071 2.154 4.343 . 0 0 "[ . 1 . 2]" 1 1240 1 132 TYR QD 1 133 ASP H . . 7.640 3.460 2.432 4.685 . 0 0 "[ . 1 . 2]" 1 1241 1 133 ASP HA 1 136 PHE QD . . 7.620 5.952 4.518 7.045 . 0 0 "[ . 1 . 2]" 1 1242 1 134 HIS QB 1 135 GLU H . . 5.700 3.277 1.988 4.093 . 0 0 "[ . 1 . 2]" 1 1243 1 135 GLU H 1 135 GLU QB . . 3.700 2.868 2.082 3.372 . 0 0 "[ . 1 . 2]" 1 1244 1 135 GLU H 1 136 PHE H . . 4.200 3.253 1.887 4.446 0.246 13 0 "[ . 1 . 2]" 1 1245 1 135 GLU HA 1 135 GLU HG2 . . 3.490 2.701 2.098 3.455 . 0 0 "[ . 1 . 2]" 1 1246 1 135 GLU HA 1 135 GLU QG . . 3.270 2.222 2.020 2.534 . 0 0 "[ . 1 . 2]" 1 1247 1 135 GLU HA 1 135 GLU HG3 . . 3.490 2.612 2.043 3.288 . 0 0 "[ . 1 . 2]" 1 1248 1 135 GLU HA 1 137 GLU H . . 4.600 4.123 3.273 4.612 0.012 12 0 "[ . 1 . 2]" 1 1249 1 135 GLU QB 1 136 PHE H . . 4.430 3.215 1.931 3.931 . 0 0 "[ . 1 . 2]" 1 1250 1 135 GLU QB 1 136 PHE QD . . 8.500 4.958 3.102 6.194 . 0 0 "[ . 1 . 2]" 1 1251 1 135 GLU QG 1 136 PHE H . . 5.110 3.599 2.299 4.574 . 0 0 "[ . 1 . 2]" 1 1252 1 135 GLU QG 1 136 PHE QD . . 8.500 5.339 4.303 6.737 . 0 0 "[ . 1 . 2]" 1 1253 1 136 PHE H 1 136 PHE HB2 . . 3.920 3.009 2.100 3.711 . 0 0 "[ . 1 . 2]" 1 1254 1 136 PHE H 1 136 PHE QB . . 3.760 2.571 2.043 3.331 . 0 0 "[ . 1 . 2]" 1 1255 1 136 PHE H 1 136 PHE HB3 . . 3.920 3.166 2.059 3.975 0.055 20 0 "[ . 1 . 2]" 1 1256 1 136 PHE H 1 137 GLU H . . 3.830 2.905 1.888 3.833 0.003 10 0 "[ . 1 . 2]" 1 1257 1 136 PHE H 1 144 MET ME . . 6.530 5.231 4.492 5.460 . 0 0 "[ . 1 . 2]" 1 1258 1 136 PHE QB 1 137 GLU H . . 4.540 3.624 1.965 4.104 . 0 0 "[ . 1 . 2]" 1 1259 1 136 PHE HB2 1 137 GLU H . . 4.910 4.183 2.947 4.708 . 0 0 "[ . 1 . 2]" 1 1260 1 136 PHE HB3 1 137 GLU H . . 4.910 4.075 1.984 4.605 . 0 0 "[ . 1 . 2]" 1 1261 1 136 PHE QD 1 137 GLU H . . 7.620 4.083 2.194 4.990 . 0 0 "[ . 1 . 2]" 1 1262 1 136 PHE QD 1 144 MET H . . 7.620 5.498 3.394 6.912 . 0 0 "[ . 1 . 2]" 1 1263 1 139 LYS H 1 139 LYS QD . . 6.220 4.180 3.018 5.405 . 0 0 "[ . 1 . 2]" 1 1264 1 139 LYS H 1 139 LYS QE . . 6.380 4.840 2.793 5.710 . 0 0 "[ . 1 . 2]" 1 1265 1 139 LYS H 1 139 LYS QG . . 4.980 3.811 2.458 4.388 . 0 0 "[ . 1 . 2]" 1 1266 1 139 LYS H 1 140 ASN H . . 4.350 3.641 1.915 4.654 0.304 6 0 "[ . 1 . 2]" 1 1267 1 139 LYS HA 1 140 ASN H . . 3.580 3.186 2.180 3.639 0.059 16 0 "[ . 1 . 2]" 1 1268 1 139 LYS QB 1 140 ASN H . . 6.070 2.688 1.918 4.096 . 0 0 "[ . 1 . 2]" 1 1269 1 139 LYS QD 1 140 ASN H . . 6.380 4.204 2.184 5.679 . 0 0 "[ . 1 . 2]" 1 1270 1 139 LYS QG 1 140 ASN H . . 6.380 3.511 1.942 4.346 . 0 0 "[ . 1 . 2]" 1 1271 1 140 ASN H 1 140 ASN HB2 . . 3.980 3.075 2.085 3.991 0.011 7 0 "[ . 1 . 2]" 1 1272 1 140 ASN H 1 140 ASN QB . . 3.770 2.797 2.048 3.465 . 0 0 "[ . 1 . 2]" 1 1273 1 140 ASN H 1 140 ASN HB3 . . 3.980 3.441 2.732 4.042 0.062 8 0 "[ . 1 . 2]" 1 1274 1 140 ASN H 1 140 ASN HD21 . . 5.500 4.493 2.462 5.483 . 0 0 "[ . 1 . 2]" 1 1275 1 140 ASN H 1 141 SER H . . 4.450 3.532 1.989 4.447 . 0 0 "[ . 1 . 2]" 1 1276 1 140 ASN H 1 141 SER QB . . 6.380 4.671 3.483 5.650 . 0 0 "[ . 1 . 2]" 1 1277 1 140 ASN QB 1 141 SER H . . 3.620 2.527 1.954 3.144 . 0 0 "[ . 1 . 2]" 1 1278 1 140 ASN HB2 1 140 ASN HD21 . . 3.550 2.651 2.103 3.561 0.011 8 0 "[ . 1 . 2]" 1 1279 1 140 ASN HB2 1 141 SER H . . 4.290 3.275 2.395 4.061 . 0 0 "[ . 1 . 2]" 1 1280 1 140 ASN HB3 1 140 ASN HD21 . . 3.550 2.857 2.122 3.529 . 0 0 "[ . 1 . 2]" 1 1281 1 140 ASN HB3 1 141 SER H . . 4.290 2.897 1.971 4.116 . 0 0 "[ . 1 . 2]" 1 1282 1 141 SER H 1 144 MET QB . . 5.540 4.126 1.932 5.070 . 0 0 "[ . 1 . 2]" 1 1283 1 143 GLU H 1 144 MET H . . 3.800 2.681 2.472 2.862 . 0 0 "[ . 1 . 2]" 1 1284 1 143 GLU HA 1 146 GLU H . . 4.940 3.538 3.051 3.877 . 0 0 "[ . 1 . 2]" 1 1285 1 144 MET H 1 145 PHE QB . . 5.230 4.286 4.146 4.467 . 0 0 "[ . 1 . 2]" 1 1286 1 144 MET QB 1 145 PHE H . . 4.030 2.647 2.338 2.928 . 0 0 "[ . 1 . 2]" 1 1287 1 144 MET HB2 1 145 PHE H . . 4.260 3.477 2.405 4.185 . 0 0 "[ . 1 . 2]" 1 1288 1 144 MET HB3 1 145 PHE H . . 4.260 2.907 2.384 3.578 . 0 0 "[ . 1 . 2]" 1 1289 1 144 MET ME 1 145 PHE H . . 6.530 5.148 4.532 5.523 . 0 0 "[ . 1 . 2]" 1 1290 1 144 MET ME 1 147 LYS H . . 6.000 4.864 4.709 4.991 . 0 0 "[ . 1 . 2]" 1 1291 1 145 PHE H 1 145 PHE HB2 . . 3.330 2.191 1.883 2.556 . 0 0 "[ . 1 . 2]" 1 1292 1 145 PHE H 1 145 PHE QB . . 3.120 2.027 1.868 2.095 . 0 0 "[ . 1 . 2]" 1 1293 1 145 PHE H 1 145 PHE HB3 . . 3.330 2.563 2.159 3.136 . 0 0 "[ . 1 . 2]" 1 1294 1 145 PHE HA 1 148 GLN H . . 3.730 3.488 3.282 3.766 0.036 16 0 "[ . 1 . 2]" 1 1295 1 145 PHE QB 1 146 GLU H . . 4.270 2.532 2.096 2.817 . 0 0 "[ . 1 . 2]" 1 1296 1 145 PHE HB2 1 146 GLU H . . 4.510 3.705 3.174 4.136 . 0 0 "[ . 1 . 2]" 1 1297 1 145 PHE HB3 1 146 GLU H . . 4.510 2.588 2.111 2.867 . 0 0 "[ . 1 . 2]" 1 1298 1 145 PHE QD 1 146 GLU H . . 7.620 3.750 2.886 4.548 . 0 0 "[ . 1 . 2]" 1 1299 1 146 GLU H 1 146 GLU HB2 . . 3.830 2.440 2.179 3.553 . 0 0 "[ . 1 . 2]" 1 1300 1 146 GLU H 1 146 GLU HB3 . . 3.830 3.489 2.635 3.564 . 0 0 "[ . 1 . 2]" 1 1301 1 146 GLU H 1 147 LYS H . . 3.980 2.765 2.472 2.940 . 0 0 "[ . 1 . 2]" 1 1302 1 146 GLU HA 1 148 GLN H . . 5.500 4.111 3.824 4.691 . 0 0 "[ . 1 . 2]" 1 1303 1 146 GLU QB 1 147 LYS H . . 4.070 2.459 2.222 3.472 . 0 0 "[ . 1 . 2]" 1 1304 1 146 GLU QB 1 149 LYS H . . 5.050 4.584 4.486 4.653 . 0 0 "[ . 1 . 2]" 1 1305 1 146 GLU HB2 1 147 LYS H . . 4.260 2.534 2.264 3.775 . 0 0 "[ . 1 . 2]" 1 1306 1 146 GLU HB3 1 147 LYS H . . 4.260 3.404 2.936 4.054 . 0 0 "[ . 1 . 2]" 1 1307 1 147 LYS H 1 147 LYS HB2 . . 3.950 2.115 2.005 2.343 . 0 0 "[ . 1 . 2]" 1 1308 1 147 LYS H 1 147 LYS QB . . 3.760 2.088 1.984 2.311 . 0 0 "[ . 1 . 2]" 1 1309 1 147 LYS H 1 147 LYS HB3 . . 3.950 3.283 2.701 3.528 . 0 0 "[ . 1 . 2]" 1 1310 1 147 LYS H 1 147 LYS QE . . 6.380 4.754 3.231 5.681 . 0 0 "[ . 1 . 2]" 1 1311 1 147 LYS H 1 147 LYS HG2 . . 5.500 3.795 2.397 4.606 . 0 0 "[ . 1 . 2]" 1 1312 1 147 LYS H 1 147 LYS QG . . 5.110 3.149 2.358 3.940 . 0 0 "[ . 1 . 2]" 1 1313 1 147 LYS H 1 147 LYS HG3 . . 5.500 3.507 2.654 4.281 . 0 0 "[ . 1 . 2]" 1 1314 1 147 LYS H 1 148 GLN H . . 4.480 2.685 2.558 2.879 . 0 0 "[ . 1 . 2]" 1 1315 1 147 LYS HA 1 147 LYS HG2 . . 3.610 2.561 1.978 3.431 . 0 0 "[ . 1 . 2]" 1 1316 1 147 LYS HA 1 147 LYS HG3 . . 3.610 2.757 1.998 3.640 0.030 12 0 "[ . 1 . 2]" 1 1317 1 147 LYS HA 1 149 LYS H . . 4.290 4.278 4.039 4.364 0.074 11 0 "[ . 1 . 2]" 1 1318 1 147 LYS HA 1 150 LYS H . . 4.480 3.280 3.113 3.431 . 0 0 "[ . 1 . 2]" 1 1319 1 147 LYS HA 1 150 LYS HB2 . . 4.010 2.533 2.088 3.360 . 0 0 "[ . 1 . 2]" 1 1320 1 147 LYS HA 1 150 LYS QB . . 3.730 2.348 2.063 2.849 . 0 0 "[ . 1 . 2]" 1 1321 1 147 LYS HA 1 150 LYS HB3 . . 4.010 3.210 2.224 3.642 . 0 0 "[ . 1 . 2]" 1 1322 1 147 LYS HA 1 151 TYR H . . 4.720 4.646 4.185 4.818 0.098 11 0 "[ . 1 . 2]" 1 1323 1 147 LYS HB2 1 148 GLN H . . 4.720 3.327 2.824 4.004 . 0 0 "[ . 1 . 2]" 1 1324 1 147 LYS HB3 1 148 GLN H . . 4.720 3.437 2.870 3.991 . 0 0 "[ . 1 . 2]" 1 1325 1 148 GLN H 1 148 GLN HG3 . . 4.540 4.413 4.250 4.490 . 0 0 "[ . 1 . 2]" 1 1326 1 148 GLN H 1 149 LYS H . . 4.110 2.504 2.364 2.810 . 0 0 "[ . 1 . 2]" 1 1327 1 148 GLN HE21 1 152 VAL MG2 . . 6.530 4.301 3.118 4.840 . 0 0 "[ . 1 . 2]" 1 1328 1 148 GLN HE22 1 152 VAL MG2 . . 6.530 5.075 4.568 5.284 . 0 0 "[ . 1 . 2]" 1 1329 1 148 GLN HG2 1 149 LYS H . . 5.500 3.558 2.334 4.097 . 0 0 "[ . 1 . 2]" 1 1330 1 148 GLN HG2 1 152 VAL MG2 . . 4.110 3.008 2.790 3.280 . 0 0 "[ . 1 . 2]" 1 1331 1 148 GLN HG3 1 149 LYS H . . 4.380 4.304 3.784 4.442 0.062 19 0 "[ . 1 . 2]" 1 1332 1 148 GLN HG3 1 152 VAL MG2 . . 5.750 2.794 1.959 3.547 . 0 0 "[ . 1 . 2]" 1 1333 1 149 LYS H 1 149 LYS QG . . 3.990 3.250 2.856 3.476 . 0 0 "[ . 1 . 2]" 1 1334 1 149 LYS H 1 150 LYS H . . 4.140 2.448 2.367 2.539 . 0 0 "[ . 1 . 2]" 1 1335 1 149 LYS HA 1 149 LYS QG . . 3.760 2.124 1.908 3.131 . 0 0 "[ . 1 . 2]" 1 1336 1 149 LYS HA 1 152 VAL H . . 5.130 3.213 3.046 3.353 . 0 0 "[ . 1 . 2]" 1 1337 1 149 LYS HA 1 152 VAL MG1 . . 6.370 2.591 2.075 2.965 . 0 0 "[ . 1 . 2]" 1 1338 1 149 LYS QB 1 150 LYS H . . 6.380 3.204 2.932 3.550 . 0 0 "[ . 1 . 2]" 1 1339 1 149 LYS QB 1 153 GLU QG . . 7.250 3.447 2.326 5.202 . 0 0 "[ . 1 . 2]" 1 1340 1 149 LYS QG 1 152 VAL MG1 . . 5.700 2.811 1.903 3.979 . 0 0 "[ . 1 . 2]" 1 1341 1 149 LYS QG 1 153 GLU QG . . 7.260 3.893 2.026 5.556 . 0 0 "[ . 1 . 2]" 1 1342 1 150 LYS H 1 150 LYS HB2 . . 3.490 2.249 2.021 2.856 . 0 0 "[ . 1 . 2]" 1 1343 1 150 LYS H 1 150 LYS QB . . 3.270 2.083 1.997 2.156 . 0 0 "[ . 1 . 2]" 1 1344 1 150 LYS H 1 150 LYS HB3 . . 3.490 2.770 2.181 3.114 . 0 0 "[ . 1 . 2]" 1 1345 1 150 LYS H 1 150 LYS HG2 . . 4.760 4.373 3.874 4.618 . 0 0 "[ . 1 . 2]" 1 1346 1 150 LYS H 1 150 LYS QG . . 4.260 3.792 3.492 3.895 . 0 0 "[ . 1 . 2]" 1 1347 1 150 LYS H 1 150 LYS HG3 . . 4.760 4.181 3.876 4.481 . 0 0 "[ . 1 . 2]" 1 1348 1 150 LYS H 1 151 TYR H . . 3.980 2.805 2.602 2.987 . 0 0 "[ . 1 . 2]" 1 1349 1 150 LYS HA 1 153 GLU H . . 5.100 3.890 3.777 4.033 . 0 0 "[ . 1 . 2]" 1 1350 1 150 LYS QB 1 151 TYR H . . 3.710 2.425 2.249 2.590 . 0 0 "[ . 1 . 2]" 1 1351 1 150 LYS HB2 1 151 TYR H . . 3.980 3.530 3.131 3.990 0.010 3 0 "[ . 1 . 2]" 1 1352 1 150 LYS HB3 1 151 TYR H . . 3.980 2.475 2.275 2.630 . 0 0 "[ . 1 . 2]" 1 1353 1 151 TYR H 1 151 TYR HB2 . . 3.920 2.521 2.275 2.590 . 0 0 "[ . 1 . 2]" 1 1354 1 151 TYR H 1 152 VAL H . . 4.200 2.557 2.509 2.650 . 0 0 "[ . 1 . 2]" 1 1355 1 151 TYR HA 1 154 GLU H . . 5.070 3.208 3.084 3.449 . 0 0 "[ . 1 . 2]" 1 1356 1 151 TYR HB2 1 155 VAL MG2 . . 6.190 3.932 3.584 4.300 . 0 0 "[ . 1 . 2]" 1 1357 1 151 TYR QD 1 152 VAL H . . 7.420 3.900 3.390 4.378 . 0 0 "[ . 1 . 2]" 1 1358 1 151 TYR QD 1 152 VAL MG1 . . 8.670 6.146 5.696 6.464 . 0 0 "[ . 1 . 2]" 1 1359 1 152 VAL H 1 152 VAL HB . . 3.800 1.994 1.955 2.113 . 0 0 "[ . 1 . 2]" 1 1360 1 152 VAL H 1 152 VAL MG1 . . 4.700 3.373 3.114 3.579 . 0 0 "[ . 1 . 2]" 1 1361 1 152 VAL H 1 152 VAL MG2 . . 4.420 3.004 2.700 3.249 . 0 0 "[ . 1 . 2]" 1 1362 1 152 VAL H 1 153 GLU H . . 4.410 2.791 2.668 2.908 . 0 0 "[ . 1 . 2]" 1 1363 1 152 VAL HA 1 155 VAL H . . 4.910 3.536 3.224 3.837 . 0 0 "[ . 1 . 2]" 1 1364 1 152 VAL HB 1 153 GLU H . . 4.350 2.962 2.645 3.275 . 0 0 "[ . 1 . 2]" 1 1365 1 152 VAL MG1 1 153 GLU H . . 5.230 2.339 2.112 2.587 . 0 0 "[ . 1 . 2]" 1 1366 1 152 VAL MG1 1 153 GLU HA . . 5.540 2.868 2.816 2.959 . 0 0 "[ . 1 . 2]" 1 1367 1 152 VAL MG1 1 153 GLU QG . . 6.290 2.687 2.080 4.018 . 0 0 "[ . 1 . 2]" 1 1368 1 152 VAL MG1 1 156 TRP QB . . 6.660 2.677 2.416 2.994 . 0 0 "[ . 1 . 2]" 1 1369 1 152 VAL MG2 1 153 GLU H . . 6.530 4.172 4.068 4.292 . 0 0 "[ . 1 . 2]" 1 1370 1 153 GLU H 1 153 GLU QG . . 3.930 2.602 2.166 3.546 . 0 0 "[ . 1 . 2]" 1 1371 1 153 GLU H 1 154 GLU H . . 4.070 2.654 2.553 2.785 . 0 0 "[ . 1 . 2]" 1 1372 1 153 GLU HA 1 156 TRP H . . 5.130 3.518 3.231 3.927 . 0 0 "[ . 1 . 2]" 1 1373 1 153 GLU HA 1 157 GLY H . . 4.790 4.098 3.823 4.391 . 0 0 "[ . 1 . 2]" 1 1374 1 153 GLU QB 1 154 GLU H . . 4.180 2.880 2.526 3.694 . 0 0 "[ . 1 . 2]" 1 1375 1 153 GLU QG 1 154 GLU H . . 4.700 3.957 2.150 4.370 . 0 0 "[ . 1 . 2]" 1 1376 1 154 GLU H 1 154 GLU HB2 . . 3.300 2.046 2.018 2.096 . 0 0 "[ . 1 . 2]" 1 1377 1 154 GLU H 1 154 GLU QB . . 3.050 2.026 1.998 2.073 . 0 0 "[ . 1 . 2]" 1 1378 1 154 GLU H 1 154 GLU HB3 . . 3.300 3.256 3.199 3.309 0.009 15 0 "[ . 1 . 2]" 1 1379 1 154 GLU H 1 154 GLU QG . . 4.700 3.405 3.172 3.805 . 0 0 "[ . 1 . 2]" 1 1380 1 154 GLU H 1 155 VAL H . . 3.950 2.661 2.436 2.943 . 0 0 "[ . 1 . 2]" 1 1381 1 154 GLU QB 1 155 VAL HA . . 4.460 3.772 3.701 3.845 . 0 0 "[ . 1 . 2]" 1 1382 1 154 GLU QG 1 155 VAL H . . 6.380 4.421 4.252 4.533 . 0 0 "[ . 1 . 2]" 1 1383 1 155 VAL H 1 155 VAL HB . . 3.890 2.341 2.212 2.463 . 0 0 "[ . 1 . 2]" 1 1384 1 155 VAL H 1 155 VAL MG2 . . 3.430 2.236 1.913 2.420 . 0 0 "[ . 1 . 2]" 1 1385 1 155 VAL H 1 156 TRP H . . 3.730 2.543 2.354 2.724 . 0 0 "[ . 1 . 2]" 1 1386 1 155 VAL H 1 157 GLY H . . 5.500 3.610 3.450 3.783 . 0 0 "[ . 1 . 2]" 1 1387 1 155 VAL HA 1 158 GLU H . . 4.410 4.150 4.025 4.244 . 0 0 "[ . 1 . 2]" 1 1388 1 155 VAL HA 1 158 GLU QB . . 5.070 4.391 4.081 4.558 . 0 0 "[ . 1 . 2]" 1 1389 1 155 VAL HB 1 156 TRP H . . 4.010 2.733 2.421 3.028 . 0 0 "[ . 1 . 2]" 1 1390 1 155 VAL MG1 1 156 TRP H . . 5.750 3.489 2.981 3.898 . 0 0 "[ . 1 . 2]" 1 1391 1 155 VAL MG1 1 158 GLU H . . 5.850 4.513 4.335 4.669 . 0 0 "[ . 1 . 2]" 1 1392 1 155 VAL MG1 1 159 TRP H . . 6.160 4.635 4.404 4.794 . 0 0 "[ . 1 . 2]" 1 1393 1 155 VAL MG2 1 156 TRP H . . 5.600 3.939 3.852 4.040 . 0 0 "[ . 1 . 2]" 1 1394 1 156 TRP H 1 156 TRP HB2 . . 3.490 2.524 2.450 2.627 . 0 0 "[ . 1 . 2]" 1 1395 1 156 TRP H 1 156 TRP QB . . 3.280 2.209 2.190 2.232 . 0 0 "[ . 1 . 2]" 1 1396 1 156 TRP H 1 156 TRP HB3 . . 3.490 2.445 2.373 2.526 . 0 0 "[ . 1 . 2]" 1 1397 1 156 TRP H 1 156 TRP HD1 . . 5.500 4.798 4.783 4.822 . 0 0 "[ . 1 . 2]" 1 1398 1 156 TRP H 1 157 GLY H . . 4.140 2.477 2.366 2.615 . 0 0 "[ . 1 . 2]" 1 1399 1 156 TRP H 1 158 GLU H . . 5.500 4.447 4.355 4.548 . 0 0 "[ . 1 . 2]" 1 1400 1 156 TRP HA 1 159 TRP H . . 4.880 3.037 2.903 3.170 . 0 0 "[ . 1 . 2]" 1 1401 1 156 TRP HA 1 160 ARG H . . 4.450 3.744 3.511 3.902 . 0 0 "[ . 1 . 2]" 1 1402 1 156 TRP QB 1 157 GLY H . . 4.120 3.245 3.180 3.266 . 0 0 "[ . 1 . 2]" 1 1403 1 156 TRP HB2 1 157 GLY H . . 4.320 4.262 4.209 4.310 . 0 0 "[ . 1 . 2]" 1 1404 1 156 TRP HB3 1 157 GLY H . . 4.320 3.364 3.285 3.392 . 0 0 "[ . 1 . 2]" 1 1405 1 156 TRP HD1 1 159 TRP H . . 4.320 3.149 2.969 3.568 . 0 0 "[ . 1 . 2]" 1 1406 1 156 TRP HD1 1 159 TRP HA . . 4.260 4.092 3.963 4.264 0.004 17 0 "[ . 1 . 2]" 1 1407 1 156 TRP HD1 1 160 ARG H . . 4.630 2.510 2.385 2.795 . 0 0 "[ . 1 . 2]" 1 1408 1 156 TRP HD1 1 160 ARG QD . . 5.850 4.552 3.316 5.237 . 0 0 "[ . 1 . 2]" 1 1409 1 156 TRP HE1 1 160 ARG QD . . 6.070 4.137 3.176 5.304 . 0 0 "[ . 1 . 2]" 1 1410 1 156 TRP HZ2 1 160 ARG QD . . 6.380 4.326 3.354 5.656 . 0 0 "[ . 1 . 2]" 1 1411 1 157 GLY H 1 158 GLU H . . 3.890 2.809 2.774 2.828 . 0 0 "[ . 1 . 2]" 1 1412 1 157 GLY H 1 158 GLU QB . . 5.850 4.536 4.469 4.626 . 0 0 "[ . 1 . 2]" 1 1413 1 157 GLY H 1 159 TRP H . . 4.820 4.650 4.483 4.845 0.025 14 0 "[ . 1 . 2]" 1 1414 1 157 GLY QA 1 160 ARG QB . . 5.500 2.547 2.230 2.841 . 0 0 "[ . 1 . 2]" 1 1415 1 157 GLY HA2 1 160 ARG HB2 . . 6.570 2.640 2.327 2.943 . 0 0 "[ . 1 . 2]" 1 1416 1 157 GLY HA2 1 160 ARG HB3 . . 6.570 3.812 2.553 4.283 . 0 0 "[ . 1 . 2]" 1 1417 1 157 GLY HA3 1 160 ARG HB2 . . 6.570 4.064 3.851 4.528 . 0 0 "[ . 1 . 2]" 1 1418 1 157 GLY HA3 1 160 ARG HB3 . . 6.570 5.307 4.018 5.753 . 0 0 "[ . 1 . 2]" 1 1419 1 158 GLU H 1 158 GLU QG . . 4.300 3.906 3.829 3.968 . 0 0 "[ . 1 . 2]" 1 1420 1 158 GLU H 1 159 TRP H . . 4.070 2.504 2.423 2.594 . 0 0 "[ . 1 . 2]" 1 1421 1 158 GLU H 1 160 ARG H . . 4.880 3.318 3.252 3.382 . 0 0 "[ . 1 . 2]" 1 1422 1 158 GLU HA 1 161 SER H . . 3.890 3.805 3.586 3.976 0.086 18 0 "[ . 1 . 2]" 1 1423 1 158 GLU QB 1 159 TRP H . . 4.490 2.311 2.122 2.500 . 0 0 "[ . 1 . 2]" 1 1424 1 158 GLU QB 1 162 ASN HD21 . . 6.380 5.564 5.504 5.734 . 0 0 "[ . 1 . 2]" 1 1425 1 158 GLU QB 1 162 ASN HD22 . . 6.380 4.834 4.119 5.586 . 0 0 "[ . 1 . 2]" 1 1426 1 158 GLU QG 1 159 TRP H . . 6.380 3.901 3.287 4.233 . 0 0 "[ . 1 . 2]" 1 1427 1 158 GLU QG 1 162 ASN HD21 . . 5.880 5.112 4.514 5.265 . 0 0 "[ . 1 . 2]" 1 1428 1 158 GLU QG 1 162 ASN HD22 . . 6.380 4.311 3.903 4.642 . 0 0 "[ . 1 . 2]" 1 1429 1 159 TRP H 1 159 TRP HD1 . . 5.470 2.905 2.283 4.791 . 0 0 "[ . 1 . 2]" 1 1430 1 159 TRP H 1 160 ARG H . . 3.640 2.633 2.470 2.678 . 0 0 "[ . 1 . 2]" 1 1431 1 159 TRP HA 1 159 TRP HE1 . . 5.500 4.845 4.547 5.045 . 0 0 "[ . 1 . 2]" 1 1432 1 159 TRP HA 1 162 ASN H . . 5.500 3.421 3.129 3.674 . 0 0 "[ . 1 . 2]" 1 1433 1 159 TRP HA 1 162 ASN HD21 . . 5.500 2.678 1.940 3.450 . 0 0 "[ . 1 . 2]" 1 1434 1 159 TRP QB 1 160 ARG H . . 4.920 3.121 3.082 3.151 . 0 0 "[ . 1 . 2]" 1 1435 1 160 ARG H 1 160 ARG HB2 . . 3.450 2.120 2.028 2.617 . 0 0 "[ . 1 . 2]" 1 1436 1 160 ARG H 1 160 ARG QB . . 3.280 2.069 2.005 2.208 . 0 0 "[ . 1 . 2]" 1 1437 1 160 ARG H 1 160 ARG HB3 . . 3.450 3.237 2.365 3.431 . 0 0 "[ . 1 . 2]" 1 1438 1 160 ARG H 1 160 ARG QG . . 4.140 3.243 2.860 3.947 . 0 0 "[ . 1 . 2]" 1 1439 1 160 ARG H 1 161 SER H . . 3.760 2.795 2.674 2.928 . 0 0 "[ . 1 . 2]" 1 1440 1 160 ARG H 1 161 SER QB . . 6.070 4.710 4.374 5.029 . 0 0 "[ . 1 . 2]" 1 1441 1 160 ARG HA 1 160 ARG QD . . 4.830 2.897 2.003 3.784 . 0 0 "[ . 1 . 2]" 1 1442 1 160 ARG HA 1 163 PRO HA . . 5.130 4.348 4.133 4.698 . 0 0 "[ . 1 . 2]" 1 1443 1 160 ARG QB 1 161 SER H . . 3.880 2.854 2.532 3.162 . 0 0 "[ . 1 . 2]" 1 1444 1 160 ARG HB2 1 161 SER H . . 4.380 3.318 2.990 4.091 . 0 0 "[ . 1 . 2]" 1 1445 1 160 ARG HB3 1 161 SER H . . 4.380 3.199 2.726 3.722 . 0 0 "[ . 1 . 2]" 1 1446 1 160 ARG QG 1 161 SER H . . 6.100 4.448 3.430 4.652 . 0 0 "[ . 1 . 2]" 1 1447 1 161 SER H 1 162 ASN H . . 4.170 2.619 2.446 2.774 . 0 0 "[ . 1 . 2]" 1 1448 1 161 SER H 1 162 ASN QB . . 5.940 4.996 4.814 5.294 . 0 0 "[ . 1 . 2]" 1 1449 1 161 SER HA 1 162 ASN HD22 . . 5.500 5.333 4.989 5.530 0.030 10 0 "[ . 1 . 2]" 1 1450 1 161 SER QB 1 162 ASN HD21 . . 6.380 2.854 2.267 3.383 . 0 0 "[ . 1 . 2]" 1 1451 1 161 SER QB 1 162 ASN HD22 . . 6.380 2.966 2.521 3.291 . 0 0 "[ . 1 . 2]" 1 1452 1 162 ASN H 1 162 ASN HD22 . . 5.500 3.255 2.911 3.601 . 0 0 "[ . 1 . 2]" 1 1453 1 162 ASN QB 1 165 GLU HA . . 6.380 5.178 3.429 5.727 . 0 0 "[ . 1 . 2]" 1 1454 1 165 GLU H 1 165 GLU HB2 . . 4.010 2.842 2.060 3.954 . 0 0 "[ . 1 . 2]" 1 1455 1 165 GLU H 1 165 GLU QB . . 3.520 2.646 2.037 3.153 . 0 0 "[ . 1 . 2]" 1 1456 1 165 GLU H 1 165 GLU HB3 . . 4.010 3.473 2.871 4.047 0.037 1 0 "[ . 1 . 2]" 1 1457 1 165 GLU H 1 165 GLU QG . . 4.980 3.388 1.955 4.100 . 0 0 "[ . 1 . 2]" 1 1458 1 165 GLU H 1 166 ASP H . . 4.660 3.147 1.865 4.653 . 0 0 "[ . 1 . 2]" 1 1459 1 165 GLU HA 1 166 ASP H . . 3.300 2.902 2.258 3.485 0.185 3 0 "[ . 1 . 2]" 1 1460 1 165 GLU HB2 1 166 ASP H . . 4.140 3.982 2.112 4.238 0.098 17 0 "[ . 1 . 2]" 1 1461 1 165 GLU HB3 1 166 ASP H . . 4.140 3.729 2.651 4.332 0.192 10 0 "[ . 1 . 2]" 1 1462 1 165 GLU QG 1 166 ASP H . . 5.570 4.126 1.982 4.985 . 0 0 "[ . 1 . 2]" 1 1463 1 166 ASP H 1 166 ASP HB2 . . 3.980 3.006 2.139 3.951 . 0 0 "[ . 1 . 2]" 1 1464 1 166 ASP H 1 166 ASP QB . . 3.520 2.640 2.091 3.185 . 0 0 "[ . 1 . 2]" 1 1465 1 166 ASP H 1 166 ASP HB3 . . 3.980 3.159 2.241 3.862 . 0 0 "[ . 1 . 2]" 1 1466 1 166 ASP H 1 167 SER H . . 4.720 3.777 2.197 4.640 . 0 0 "[ . 1 . 2]" 1 1467 1 166 ASP HA 1 166 ASP QB . . 2.710 2.397 2.180 2.529 . 0 0 "[ . 1 . 2]" 1 1468 1 166 ASP HA 1 167 SER H . . 3.490 2.577 2.257 3.655 0.165 3 0 "[ . 1 . 2]" 1 1469 1 166 ASP HB2 1 167 SER H . . 5.100 4.058 2.314 4.727 . 0 0 "[ . 1 . 2]" 1 1470 1 166 ASP HB3 1 167 SER H . . 5.100 3.854 2.281 4.612 . 0 0 "[ . 1 . 2]" 1 1471 1 167 SER H 1 168 ASP H . . 5.500 3.457 2.218 4.565 . 0 0 "[ . 1 . 2]" 1 1472 1 167 SER H 1 168 ASP HB2 . . 5.500 4.638 3.291 5.464 . 0 0 "[ . 1 . 2]" 1 1473 1 167 SER H 1 168 ASP QB . . 5.200 4.095 3.243 4.639 . 0 0 "[ . 1 . 2]" 1 1474 1 167 SER H 1 168 ASP HB3 . . 5.500 4.903 3.400 5.505 0.005 14 0 "[ . 1 . 2]" 1 1475 1 167 SER HA 1 168 ASP H . . 3.640 2.636 2.216 3.648 0.008 5 0 "[ . 1 . 2]" 1 1476 1 168 ASP H 1 168 ASP HB2 . . 3.890 3.200 2.261 3.886 . 0 0 "[ . 1 . 2]" 1 1477 1 168 ASP H 1 168 ASP HB3 . . 3.890 3.477 2.506 3.902 0.012 11 0 "[ . 1 . 2]" 1 1478 1 168 ASP HA 1 170 GLY H . . 4.480 4.281 3.862 4.482 0.002 10 0 "[ . 1 . 2]" 1 1479 1 168 ASP QB 1 171 LYS H . . 4.890 4.019 2.618 4.393 . 0 0 "[ . 1 . 2]" 1 1480 1 169 PRO QD 1 170 GLY H . . 5.580 2.672 2.234 4.129 . 0 0 "[ . 1 . 2]" 1 1481 1 170 GLY H 1 171 LYS H . . 3.860 2.755 1.905 3.462 . 0 0 "[ . 1 . 2]" 1 1482 1 170 GLY H 1 172 ARG QG . . 6.380 5.478 3.686 5.736 . 0 0 "[ . 1 . 2]" 1 1483 1 170 GLY QA 1 171 LYS HA . . 5.020 4.160 3.965 4.453 . 0 0 "[ . 1 . 2]" 1 1484 1 171 LYS HA 1 172 ARG H . . 3.270 2.434 2.180 2.978 . 0 0 "[ . 1 . 2]" 1 stop_ save_
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