NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | in_recoord | stage | program | type | subtype | subsubtype |
392556 | 1q27 | 5570 | cing | recoord | 4-filtered-FRED | Wattos | check | violation | distance |
data_1q27 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 1253 _Distance_constraint_stats_list.Viol_count 584 _Distance_constraint_stats_list.Viol_total 167.769 _Distance_constraint_stats_list.Viol_max 0.595 _Distance_constraint_stats_list.Viol_rms 0.0112 _Distance_constraint_stats_list.Viol_average_all_restraints 0.0013 _Distance_constraint_stats_list.Viol_average_violations_only 0.0287 _Distance_constraint_stats_list.Cutoff_violation_report 0.500 _Distance_constraint_stats_list.Details ; Description of the tags in this list: * 1 * Administrative tag * 2 * Administrative tag * 3 * Administrative tag * 4 * ID of the restraint list. * 5 * Number of restraints in list. * 6 * Number of violated restraints (each model violation is used). * 7 * Sum of violations in Angstrom. * 8 * Maximum violation of a restraint without averaging in any way. * 9 * Rms of violations over all restraints. * 10 * Average violation over all restraints. * 11 * Average violation over violated restraints. This violation is averaged over only those models in which the restraint is violated. These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998). * 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table. * 13 * This tag Description of the tags in the per residue table below: * 1 * Chain identifier (can be absent if none defined) * 2 * Residue number * 3 * Residue name * 4 * Maximum violation in ensemble of models (without any averaging) * 5 * Model number with the maximum violation * 6 * Number of models with a violation above cutoff * 7 * List of models (1 character per model) with a violation above cutoff. An '*' marks a violation above the cutoff. A '+' indicates the largest violation above the cutoff and a '-' marks the smallest violation over cutoff. For models 5, 15, 25,... a ' ' is replaced by a '.'. For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1. * 8 * Administrative tag * 9 * Administrative tag Description of the tags in the per restraint table below: * 1 * Restraint ID within restraint list. First node, FIRST member, first atom's: * 2 * Chain identifier (can be absent if none defined) * 3 * Residue number * 4 * Residue name * 5 * Name of (pseudo-)atom First node, SECOND member, first atom's: * 6 * Chain identifier (can be absent if none defined) * 7 * Residue number * 8 * Residue name * 9 * Name of (pseudo-)atom FIRST node's: * 10 * Target distance value (Angstrom) * 11 * Lower bound distance (Angstrom) * 12 * Upper bound distance (Angstrom) * 13 * Average distance in ensemble of models * 14 * Minimum distance in ensemble of models * 15 * Maximum distance in ensemble of models * 16 * Maximum violation (without any averaging) * 17 * Model number with the maximum violation * 18 * Number of models with a violation above cutoff * 19 * List of models with a violation above cutoff. See description above. * 20 * Administrative tag * 21 * Administrative tag ; loop_ _Distance_constraint_stats_per_res.Atom_entity_assembly_ID _Distance_constraint_stats_per_res.Atom_comp_index_ID _Distance_constraint_stats_per_res.Atom_comp_ID _Distance_constraint_stats_per_res.Total_violation _Distance_constraint_stats_per_res.Max_violation _Distance_constraint_stats_per_res.Max_violation_model_number _Distance_constraint_stats_per_res.Over_cutoff_viol_count _Distance_constraint_stats_per_res.Over_cutoff_viol_per_model 1 4 VAL 0.000 0.000 . 0 "[ . 1]" 1 5 SER 0.121 0.051 2 0 "[ . 1]" 1 6 ASP 0.121 0.051 2 0 "[ . 1]" 1 7 GLU 0.000 0.000 . 0 "[ . 1]" 1 8 ARG 0.270 0.108 7 0 "[ . 1]" 1 9 LEU 0.016 0.012 7 0 "[ . 1]" 1 10 ASP 0.007 0.007 10 0 "[ . 1]" 1 11 LEU 0.000 0.000 . 0 "[ . 1]" 1 12 VAL 0.052 0.040 4 0 "[ . 1]" 1 13 ASN 0.381 0.041 10 0 "[ . 1]" 1 14 GLU 0.332 0.050 4 0 "[ . 1]" 1 15 ARG 0.666 0.051 7 0 "[ . 1]" 1 16 ASP 0.296 0.051 7 0 "[ . 1]" 1 17 GLU 0.017 0.008 9 0 "[ . 1]" 1 18 VAL 0.451 0.040 4 0 "[ . 1]" 1 19 VAL 0.204 0.029 7 0 "[ . 1]" 1 20 GLY 0.210 0.029 7 0 "[ . 1]" 1 21 GLN 0.007 0.007 10 0 "[ . 1]" 1 22 ILE 0.091 0.053 5 0 "[ . 1]" 1 23 LEU 0.002 0.002 2 0 "[ . 1]" 1 24 ARG 0.008 0.004 8 0 "[ . 1]" 1 25 THR 0.000 0.000 . 0 "[ . 1]" 1 26 ASP 0.002 0.002 2 0 "[ . 1]" 1 27 PRO 0.010 0.010 2 0 "[ . 1]" 1 28 ALA 0.151 0.046 6 0 "[ . 1]" 1 29 LEU 0.806 0.135 8 0 "[ . 1]" 1 30 ARG 0.484 0.079 10 0 "[ . 1]" 1 31 TRP 0.456 0.071 7 0 "[ . 1]" 1 32 GLU 0.552 0.071 7 0 "[ . 1]" 1 33 ARG 0.224 0.041 5 0 "[ . 1]" 1 34 VAL 0.606 0.135 8 0 "[ . 1]" 1 35 ARG 0.000 0.000 . 0 "[ . 1]" 1 36 VAL 0.013 0.007 9 0 "[ . 1]" 1 37 VAL 0.291 0.094 9 0 "[ . 1]" 1 38 ASN 0.179 0.028 3 0 "[ . 1]" 1 39 ALA 0.080 0.019 7 0 "[ . 1]" 1 40 PHE 1.552 0.595 6 2 "[- .+ 1]" 1 41 LEU 0.083 0.031 9 0 "[ . 1]" 1 42 ARG 0.070 0.054 8 0 "[ . 1]" 1 43 ASN 0.210 0.049 8 0 "[ . 1]" 1 44 SER 0.263 0.119 10 0 "[ . 1]" 1 45 GLN 0.332 0.119 10 0 "[ . 1]" 1 46 GLY 0.014 0.014 10 0 "[ . 1]" 1 47 GLN 0.432 0.069 4 0 "[ . 1]" 1 48 LEU 0.000 0.000 . 0 "[ . 1]" 1 49 TRP 1.463 0.117 2 0 "[ . 1]" 1 50 ILE 2.437 0.595 6 2 "[- .+ 1]" 1 51 PRO 0.022 0.022 9 0 "[ . 1]" 1 54 SER 0.020 0.017 4 0 "[ . 1]" 1 55 PRO 0.000 0.000 . 0 "[ . 1]" 1 56 SER 0.033 0.029 2 0 "[ . 1]" 1 57 LYS 0.033 0.029 2 0 "[ . 1]" 1 62 ASN 0.000 0.000 . 0 "[ . 1]" 1 63 ALA 0.110 0.034 7 0 "[ . 1]" 1 64 LEU 0.260 0.094 6 0 "[ . 1]" 1 65 ASP 0.000 0.000 . 0 "[ . 1]" 1 66 VAL 0.731 0.087 10 0 "[ . 1]" 1 67 SER 0.080 0.031 9 0 "[ . 1]" 1 68 VAL 0.243 0.032 7 0 "[ . 1]" 1 69 GLY 0.067 0.019 7 0 "[ . 1]" 1 70 GLY 0.025 0.023 1 0 "[ . 1]" 1 71 ALA 0.013 0.007 9 0 "[ . 1]" 1 72 VAL 0.000 0.000 . 0 "[ . 1]" 1 73 GLN 0.000 0.000 . 0 "[ . 1]" 1 74 SER 0.153 0.052 1 0 "[ . 1]" 1 75 GLY 0.172 0.052 1 0 "[ . 1]" 1 76 GLU 0.054 0.024 9 0 "[ . 1]" 1 77 THR 0.026 0.019 1 0 "[ . 1]" 1 78 TYR 0.053 0.037 3 0 "[ . 1]" 1 79 GLU 0.053 0.037 3 0 "[ . 1]" 1 80 GLU 0.007 0.007 10 0 "[ . 1]" 1 81 ALA 0.000 0.000 . 0 "[ . 1]" 1 82 PHE 0.000 0.000 . 0 "[ . 1]" 1 83 ARG 0.000 0.000 . 0 "[ . 1]" 1 84 ARG 0.000 0.000 . 0 "[ . 1]" 1 85 GLU 0.103 0.038 3 0 "[ . 1]" 1 86 ALA 0.375 0.106 5 0 "[ . 1]" 1 87 ARG 0.011 0.011 6 0 "[ . 1]" 1 88 GLU 0.000 0.000 . 0 "[ . 1]" 1 89 GLU 0.005 0.005 4 0 "[ . 1]" 1 90 LEU 0.024 0.011 10 0 "[ . 1]" 1 91 ASN 0.038 0.011 10 0 "[ . 1]" 1 92 VAL 0.406 0.089 3 0 "[ . 1]" 1 93 GLU 0.177 0.030 9 0 "[ . 1]" 1 94 ILE 0.189 0.106 5 0 "[ . 1]" 1 95 ASP 0.045 0.028 10 0 "[ . 1]" 1 96 ALA 0.175 0.022 6 0 "[ . 1]" 1 97 LEU 0.458 0.028 10 0 "[ . 1]" 1 98 SER 0.200 0.028 10 0 "[ . 1]" 1 99 TRP 0.316 0.040 10 0 "[ . 1]" 1 100 ARG 0.027 0.010 2 0 "[ . 1]" 1 101 PRO 0.497 0.044 6 0 "[ . 1]" 1 102 LEU 0.046 0.013 1 0 "[ . 1]" 1 103 ALA 0.531 0.044 6 0 "[ . 1]" 1 104 SER 0.000 0.000 . 0 "[ . 1]" 1 105 PHE 0.000 0.000 . 0 "[ . 1]" 1 106 SER 0.000 0.000 . 0 "[ . 1]" 1 107 PRO 0.000 0.000 . 0 "[ . 1]" 1 108 PHE 0.006 0.006 4 0 "[ . 1]" 1 109 GLN 0.009 0.009 6 0 "[ . 1]" 1 110 THR 0.022 0.009 6 0 "[ . 1]" 1 111 THR 0.009 0.008 1 0 "[ . 1]" 1 112 LEU 0.184 0.062 3 0 "[ . 1]" 1 113 SER 0.000 0.000 . 0 "[ . 1]" 1 114 SER 0.074 0.026 4 0 "[ . 1]" 1 115 PHE 0.000 0.000 . 0 "[ . 1]" 1 116 MET 0.110 0.062 3 0 "[ . 1]" 1 117 CYS 0.000 0.000 . 0 "[ . 1]" 1 118 VAL 0.378 0.041 1 0 "[ . 1]" 1 119 TYR 0.000 0.000 . 0 "[ . 1]" 1 120 GLU 0.109 0.029 3 0 "[ . 1]" 1 121 LEU 0.028 0.010 2 0 "[ . 1]" 1 122 ARG 0.165 0.040 10 0 "[ . 1]" 1 123 SER 0.034 0.017 5 0 "[ . 1]" 1 124 ASP 0.022 0.014 4 0 "[ . 1]" 1 125 ALA 0.056 0.017 5 0 "[ . 1]" 1 126 THR 0.000 0.000 . 0 "[ . 1]" 1 127 PRO 0.342 0.055 4 0 "[ . 1]" 1 128 ILE 0.181 0.055 4 0 "[ . 1]" 1 129 PHE 0.384 0.063 7 0 "[ . 1]" 1 130 ASN 0.141 0.042 8 0 "[ . 1]" 1 131 PRO 0.133 0.050 7 0 "[ . 1]" 1 132 ASN 0.493 0.050 7 0 "[ . 1]" 1 133 ASP 0.306 0.040 3 0 "[ . 1]" 1 134 ILE 0.481 0.098 7 0 "[ . 1]" 1 135 SER 0.297 0.098 7 0 "[ . 1]" 1 136 GLY 0.038 0.038 9 0 "[ . 1]" 1 137 GLY 0.022 0.022 9 0 "[ . 1]" 1 138 GLU 0.147 0.026 2 0 "[ . 1]" 1 139 TRP 0.386 0.074 7 0 "[ . 1]" 1 140 LEU 0.951 0.146 3 0 "[ . 1]" 1 141 THR 0.000 0.000 . 0 "[ . 1]" 1 142 PRO 0.219 0.040 5 0 "[ . 1]" 1 143 GLU 0.406 0.040 5 0 "[ . 1]" 1 144 HIS 0.191 0.036 3 0 "[ . 1]" 1 145 LEU 0.000 0.000 . 0 "[ . 1]" 1 146 LEU 0.076 0.026 6 0 "[ . 1]" 1 147 ALA 0.054 0.018 4 0 "[ . 1]" 1 148 ARG 0.000 0.000 . 0 "[ . 1]" 1 149 ILE 0.440 0.094 6 0 "[ . 1]" 1 150 ALA 0.096 0.034 10 0 "[ . 1]" 1 151 ALA 0.094 0.034 10 0 "[ . 1]" 1 152 GLY 0.003 0.003 3 0 "[ . 1]" 1 153 GLU 0.132 0.097 2 0 "[ . 1]" 1 154 ALA 0.248 0.097 2 0 "[ . 1]" 1 155 ALA 0.109 0.046 2 0 "[ . 1]" 1 156 LYS 0.136 0.034 7 0 "[ . 1]" 1 157 GLY 0.000 0.000 . 0 "[ . 1]" 1 158 ASP 0.000 0.000 . 0 "[ . 1]" 1 159 LEU 0.000 0.000 . 0 "[ . 1]" 1 160 ALA 0.098 0.063 9 0 "[ . 1]" 1 161 GLU 0.015 0.015 3 0 "[ . 1]" 1 162 LEU 0.000 0.000 . 0 "[ . 1]" 1 163 VAL 0.249 0.084 5 0 "[ . 1]" 1 164 ARG 0.019 0.011 1 0 "[ . 1]" 1 165 ARG 0.015 0.011 1 0 "[ . 1]" 1 166 CYS 0.196 0.037 4 0 "[ . 1]" 1 167 TYR 0.293 0.056 8 0 "[ . 1]" 1 168 ARG 0.293 0.051 10 0 "[ . 1]" 1 169 GLU 0.283 0.051 10 0 "[ . 1]" 1 170 GLU 0.000 0.000 . 0 "[ . 1]" stop_ loop_ _Distance_constraint_stats.Restraint_ID _Distance_constraint_stats.Atom_1_entity_assembly_ID _Distance_constraint_stats.Atom_1_comp_index_ID _Distance_constraint_stats.Atom_1_comp_ID _Distance_constraint_stats.Atom_1_ID _Distance_constraint_stats.Atom_2_entity_assembly_ID _Distance_constraint_stats.Atom_2_comp_index_ID _Distance_constraint_stats.Atom_2_comp_ID _Distance_constraint_stats.Atom_2_ID _Distance_constraint_stats.Node_1_distance_val _Distance_constraint_stats.Node_1_distance_lower_bound_val _Distance_constraint_stats.Node_1_distance_upper_bound_val _Distance_constraint_stats.Distance_average _Distance_constraint_stats.Distance_minimum _Distance_constraint_stats.Distance_maximum _Distance_constraint_stats.Max_violation _Distance_constraint_stats.Max_violation_model_number _Distance_constraint_stats.Over_cutoff_violation_count _Distance_constraint_stats.Over_cutoff_viol_per_model _Distance_constraint_stats.Distance_constraint_stats_ID 1 1 7 GLU H 1 8 ARG H 1.800 . 5.000 3.868 2.279 4.608 . 0 0 "[ . 1]" 1 2 1 8 ARG H 1 9 LEU H 1.800 . 5.000 4.454 4.209 4.541 . 0 0 "[ . 1]" 1 3 1 9 LEU H 1 24 ARG H 1.800 . 5.000 4.059 3.580 4.448 . 0 0 "[ . 1]" 1 4 1 11 LEU H 1 22 ILE H 1.800 . 5.000 4.014 3.235 4.324 . 0 0 "[ . 1]" 1 5 1 11 LEU H 1 20 GLY H 1.800 . 5.000 3.579 3.383 3.899 . 0 0 "[ . 1]" 1 6 1 13 ASN H 1 17 GLU H 1.800 . 5.000 3.686 2.975 4.273 . 0 0 "[ . 1]" 1 7 1 13 ASN H 1 14 GLU H 1.800 . 5.000 2.850 2.363 3.312 . 0 0 "[ . 1]" 1 8 1 13 ASN H 1 15 ARG H 1.800 . 5.000 4.357 3.488 4.872 . 0 0 "[ . 1]" 1 9 1 14 GLU H 1 15 ARG H 1.800 . 3.500 2.208 1.851 2.580 . 0 0 "[ . 1]" 1 10 1 15 ARG H 1 16 ASP H 1.800 . 4.000 2.533 1.931 3.075 . 0 0 "[ . 1]" 1 11 1 15 ARG H 1 17 GLU H 1.800 . 3.500 2.977 2.266 3.503 0.003 3 0 "[ . 1]" 1 12 1 16 ASP H 1 17 GLU H 1.800 . 3.000 2.286 1.896 2.723 . 0 0 "[ . 1]" 1 13 1 17 GLU H 1 18 VAL H 1.800 . 5.000 3.672 3.206 3.883 . 0 0 "[ . 1]" 1 14 1 18 VAL H 1 19 VAL H 1.800 . 5.000 4.495 4.340 4.619 . 0 0 "[ . 1]" 1 15 1 19 VAL H 1 20 GLY H 1.800 . 3.500 2.304 1.983 2.589 . 0 0 "[ . 1]" 1 16 1 20 GLY H 1 21 GLN H 1.800 . 5.000 4.360 4.222 4.435 . 0 0 "[ . 1]" 1 17 1 22 ILE H 1 23 LEU H 1.800 . 5.000 4.444 4.292 4.559 . 0 0 "[ . 1]" 1 18 1 24 ARG H 1 25 THR H 1.800 . 3.500 2.530 2.346 2.679 . 0 0 "[ . 1]" 1 19 1 25 THR H 1 26 ASP H 1.800 . 3.500 2.809 2.406 3.403 . 0 0 "[ . 1]" 1 20 1 28 ALA H 1 29 LEU H 1.800 . 3.000 2.800 2.474 3.016 0.016 9 0 "[ . 1]" 1 21 1 29 LEU H 1 30 ARG H 1.800 . 5.000 2.964 2.315 4.638 . 0 0 "[ . 1]" 1 22 1 30 ARG H 1 31 TRP H 1.800 . 5.000 3.499 3.023 4.118 . 0 0 "[ . 1]" 1 23 1 31 TRP H 1 32 GLU H 1.800 . 5.000 4.044 2.718 4.429 . 0 0 "[ . 1]" 1 24 1 32 GLU H 1 33 ARG H 1.800 . 3.500 2.204 1.898 3.503 0.003 9 0 "[ . 1]" 1 25 1 33 ARG H 1 34 VAL H 1.800 . 3.500 2.387 1.908 2.933 . 0 0 "[ . 1]" 1 26 1 36 VAL H 1 78 TYR QE 1.800 . 7.000 3.685 2.755 4.212 . 0 0 "[ . 1]" 1 27 1 36 VAL H 1 78 TYR QD 1.800 . 7.000 5.474 4.575 6.109 . 0 0 "[ . 1]" 1 28 1 37 VAL H 1 70 GLY H 1.800 . 5.000 3.138 2.742 3.528 . 0 0 "[ . 1]" 1 29 1 38 ASN H 1 39 ALA H 1.800 . 5.000 4.364 4.319 4.449 . 0 0 "[ . 1]" 1 30 1 38 ASN H 1 119 TYR H 1.800 . 5.000 4.241 4.001 4.613 . 0 0 "[ . 1]" 1 31 1 38 ASN H 1 119 TYR QD 1.800 . 7.000 3.558 2.994 4.769 . 0 0 "[ . 1]" 1 32 1 38 ASN H 1 119 TYR QE 1.800 . 7.000 3.623 2.953 4.593 . 0 0 "[ . 1]" 1 33 1 39 ALA H 1 40 PHE H 1.800 . 5.000 4.354 4.288 4.400 . 0 0 "[ . 1]" 1 34 1 39 ALA H 1 68 VAL H 1.800 . 3.500 3.041 2.835 3.246 . 0 0 "[ . 1]" 1 35 1 40 PHE H 1 121 LEU H 1.800 . 5.000 3.539 3.330 3.920 . 0 0 "[ . 1]" 1 36 1 41 LEU H 1 67 SER H 1.800 . 5.000 4.129 3.769 4.405 . 0 0 "[ . 1]" 1 37 1 40 PHE QD 1 41 LEU H 1.800 . 5.000 3.913 3.011 4.457 . 0 0 "[ . 1]" 1 38 1 42 ARG H 1 121 LEU H 1.800 . 5.000 4.271 3.721 4.588 . 0 0 "[ . 1]" 1 39 1 42 ARG H 1 43 ASN H 1.800 . 5.000 4.384 4.344 4.448 . 0 0 "[ . 1]" 1 40 1 42 ARG H 1 123 SER H 1.800 . 5.000 3.079 2.771 3.588 . 0 0 "[ . 1]" 1 41 1 43 ASN H 1 49 TRP H 1.800 . 6.000 5.155 4.810 5.360 . 0 0 "[ . 1]" 1 42 1 43 ASN H 1 47 GLN H 1.800 . 5.000 2.775 2.399 3.336 . 0 0 "[ . 1]" 1 43 1 44 SER H 1 45 GLN H 1.800 . 3.500 2.840 2.681 3.619 0.119 10 0 "[ . 1]" 1 44 1 43 ASN HD22 1 44 SER H 1.800 . 6.000 4.291 3.297 5.842 . 0 0 "[ . 1]" 1 45 1 45 GLN H 1 46 GLY H 1.800 . 3.500 2.742 2.023 3.101 . 0 0 "[ . 1]" 1 46 1 45 GLN H 1 47 GLN H 1.800 . 5.000 3.857 2.457 4.472 . 0 0 "[ . 1]" 1 47 1 43 ASN HD22 1 45 GLN H 1.800 . 6.000 4.789 2.815 6.024 0.024 5 0 "[ . 1]" 1 48 1 47 GLN H 1 48 LEU H 1.800 . 5.000 4.008 3.786 4.104 . 0 0 "[ . 1]" 1 49 1 43 ASN HD22 1 47 GLN H 1.800 . 6.000 5.509 4.680 5.926 . 0 0 "[ . 1]" 1 50 1 56 SER H 1 57 LYS H 1.800 . 3.500 2.793 2.167 3.529 0.029 2 0 "[ . 1]" 1 51 1 63 ALA H 1 64 LEU H 1.800 . 5.000 3.943 2.283 4.649 . 0 0 "[ . 1]" 1 52 1 64 LEU H 1 65 ASP H 1.800 . 5.000 4.492 4.270 4.598 . 0 0 "[ . 1]" 1 53 1 65 ASP H 1 66 VAL H 1.800 . 5.000 4.434 4.336 4.495 . 0 0 "[ . 1]" 1 54 1 67 SER H 1 68 VAL H 1.800 . 3.500 2.607 2.339 3.024 . 0 0 "[ . 1]" 1 55 1 68 VAL H 1 69 GLY H 1.800 . 5.000 4.326 4.044 4.543 . 0 0 "[ . 1]" 1 56 1 69 GLY H 1 70 GLY H 1.800 . 5.000 4.292 3.988 4.517 . 0 0 "[ . 1]" 1 57 1 71 ALA H 1 72 VAL H 1.800 . 5.000 4.466 4.126 4.559 . 0 0 "[ . 1]" 1 58 1 73 GLN H 1 74 SER H 1.800 . 5.000 4.459 4.275 4.554 . 0 0 "[ . 1]" 1 59 1 75 GLY H 1 76 GLU H 1.800 . 3.500 2.864 2.036 3.524 0.024 9 0 "[ . 1]" 1 60 1 77 THR H 1 78 TYR H 1.800 . 5.000 4.256 3.901 4.591 . 0 0 "[ . 1]" 1 61 1 78 TYR H 1 79 GLU H 1.800 . 3.500 2.671 2.553 2.852 . 0 0 "[ . 1]" 1 62 1 79 GLU H 1 80 GLU H 1.800 . 3.500 2.717 2.602 3.045 . 0 0 "[ . 1]" 1 63 1 79 GLU H 1 81 ALA H 1.800 . 5.000 4.055 3.813 4.726 . 0 0 "[ . 1]" 1 64 1 78 TYR QD 1 79 GLU H 1.800 . 7.000 4.331 3.952 4.669 . 0 0 "[ . 1]" 1 65 1 80 GLU H 1 81 ALA H 1.800 . 3.500 2.688 2.538 2.949 . 0 0 "[ . 1]" 1 66 1 81 ALA H 1 82 PHE H 1.800 . 5.000 2.717 2.484 2.853 . 0 0 "[ . 1]" 1 67 1 82 PHE H 1 83 ARG H 1.800 . 3.500 2.638 2.491 2.735 . 0 0 "[ . 1]" 1 68 1 84 ARG H 1 85 GLU H 1.800 . 3.500 2.677 2.416 2.831 . 0 0 "[ . 1]" 1 69 1 85 GLU H 1 86 ALA H 1.800 . 3.500 2.639 2.482 2.798 . 0 0 "[ . 1]" 1 70 1 86 ALA H 1 87 ARG H 1.800 . 3.500 2.551 2.388 2.709 . 0 0 "[ . 1]" 1 71 1 87 ARG H 1 88 GLU H 1.800 . 3.000 2.616 2.374 2.780 . 0 0 "[ . 1]" 1 72 1 88 GLU H 1 89 GLU H 1.800 . 3.500 2.542 2.405 2.693 . 0 0 "[ . 1]" 1 73 1 89 GLU H 1 90 LEU H 1.800 . 3.000 2.892 2.470 3.005 0.005 4 0 "[ . 1]" 1 74 1 89 GLU H 1 91 ASN H 1.800 . 5.000 3.680 2.978 4.997 . 0 0 "[ . 1]" 1 75 1 88 GLU H 1 90 LEU H 1.800 . 5.500 4.874 4.268 5.046 . 0 0 "[ . 1]" 1 76 1 90 LEU H 1 91 ASN H 1.800 . 3.000 2.308 1.985 2.582 . 0 0 "[ . 1]" 1 77 1 90 LEU H 1 92 VAL H 1.800 . 5.000 3.103 2.570 3.912 . 0 0 "[ . 1]" 1 78 1 91 ASN H 1 92 VAL H 1.800 . 3.000 2.660 1.971 3.008 0.008 7 0 "[ . 1]" 1 79 1 92 VAL H 1 93 GLU H 1.800 . 5.000 2.813 1.994 4.554 . 0 0 "[ . 1]" 1 80 1 93 GLU H 1 94 ILE H 1.800 . 5.000 2.659 2.501 2.832 . 0 0 "[ . 1]" 1 81 1 94 ILE H 1 95 ASP H 1.800 . 5.000 2.915 2.871 2.976 . 0 0 "[ . 1]" 1 82 1 95 ASP H 1 96 ALA H 1.800 . 3.000 1.941 1.832 2.025 . 0 0 "[ . 1]" 1 83 1 96 ALA H 1 97 LEU H 1.800 . 3.500 2.006 1.932 2.240 . 0 0 "[ . 1]" 1 84 1 97 LEU H 1 98 SER H 1.800 . 3.000 2.786 1.934 3.028 0.028 10 0 "[ . 1]" 1 85 1 98 SER H 1 99 TRP H 1.800 . 5.000 3.813 3.595 3.958 . 0 0 "[ . 1]" 1 86 1 99 TRP H 1 99 TRP HD1 1.800 . 3.500 2.395 2.067 3.210 . 0 0 "[ . 1]" 1 87 1 99 TRP H 1 100 ARG H 1.800 . 5.000 4.445 4.386 4.540 . 0 0 "[ . 1]" 1 88 1 102 LEU H 1 103 ALA H 1.800 . 3.000 2.382 1.879 2.701 . 0 0 "[ . 1]" 1 89 1 102 LEU H 1 119 TYR QD 1.800 . 7.000 4.031 3.131 4.629 . 0 0 "[ . 1]" 1 90 1 102 LEU H 1 119 TYR QE 1.800 . 8.000 5.555 5.128 5.801 . 0 0 "[ . 1]" 1 91 1 103 ALA H 1 118 VAL H 1.800 . 3.500 3.513 3.439 3.541 0.041 1 0 "[ . 1]" 1 92 1 103 ALA H 1 104 SER H 1.800 . 5.000 4.356 4.298 4.407 . 0 0 "[ . 1]" 1 93 1 104 SER H 1 105 PHE H 1.800 . 5.000 4.208 3.854 4.518 . 0 0 "[ . 1]" 1 94 1 105 PHE H 1 106 SER H 1.800 . 5.000 4.336 4.121 4.531 . 0 0 "[ . 1]" 1 95 1 105 PHE H 1 116 MET H 1.800 . 5.000 3.961 3.570 4.481 . 0 0 "[ . 1]" 1 96 1 108 PHE H 1 109 GLN H 1.800 . 3.500 2.289 1.982 3.410 . 0 0 "[ . 1]" 1 97 1 108 PHE H 1 110 THR H 1.800 . 3.500 3.052 2.439 3.506 0.006 4 0 "[ . 1]" 1 98 1 109 GLN H 1 110 THR H 1.800 . 3.000 2.427 1.900 3.009 0.009 6 0 "[ . 1]" 1 99 1 110 THR H 1 111 THR H 1.800 . 5.000 4.266 2.289 4.619 . 0 0 "[ . 1]" 1 100 1 111 THR H 1 112 LEU H 1.800 . 3.500 2.480 1.990 3.502 0.002 1 0 "[ . 1]" 1 101 1 112 LEU H 1 113 SER H 1.800 . 5.000 4.496 4.289 4.635 . 0 0 "[ . 1]" 1 102 1 112 LEU H 1 114 SER H 1.800 . 5.000 4.876 4.571 5.026 0.026 4 0 "[ . 1]" 1 103 1 113 SER H 1 114 SER H 1.800 . 3.500 2.467 2.017 2.735 . 0 0 "[ . 1]" 1 104 1 114 SER H 1 115 PHE H 1.800 . 5.000 4.366 4.315 4.455 . 0 0 "[ . 1]" 1 105 1 116 MET HA 1 117 CYS H 1.800 . 3.500 2.401 2.296 2.483 . 0 0 "[ . 1]" 1 106 1 117 CYS H 1 118 VAL H 1.800 . 5.000 4.552 4.519 4.574 . 0 0 "[ . 1]" 1 107 1 118 VAL H 1 119 TYR H 1.800 . 5.000 4.212 3.933 4.357 . 0 0 "[ . 1]" 1 108 1 119 TYR H 1 120 GLU H 1.800 . 5.000 4.468 4.382 4.511 . 0 0 "[ . 1]" 1 109 1 119 TYR QD 1 120 GLU H 1.800 . 5.500 4.040 3.495 4.315 . 0 0 "[ . 1]" 1 110 1 102 LEU H 1 120 GLU H 1.800 . 5.000 3.287 2.750 4.196 . 0 0 "[ . 1]" 1 111 1 122 ARG H 1 123 SER H 1.800 . 5.000 4.339 4.195 4.638 . 0 0 "[ . 1]" 1 112 1 123 SER H 1 124 ASP H 1.800 . 5.000 4.382 4.263 4.560 . 0 0 "[ . 1]" 1 113 1 124 ASP H 1 125 ALA H 1.800 . 3.500 3.060 1.882 3.514 0.014 4 0 "[ . 1]" 1 114 1 125 ALA H 1 126 THR H 1.800 . 5.000 4.401 4.261 4.555 . 0 0 "[ . 1]" 1 115 1 128 ILE H 1 129 PHE H 1.800 . 5.000 4.492 4.383 4.644 . 0 0 "[ . 1]" 1 116 1 129 PHE H 1 130 ASN H 1.800 . 5.000 3.998 2.849 4.628 . 0 0 "[ . 1]" 1 117 1 130 ASN HD22 1 132 ASN H 1.800 . 6.000 4.653 4.128 5.321 . 0 0 "[ . 1]" 1 118 1 130 ASN HD21 1 132 ASN H 1.800 . 6.000 4.287 2.715 5.597 . 0 0 "[ . 1]" 1 119 1 132 ASN H 1 133 ASP H 1.800 . 3.000 2.182 1.951 3.013 0.013 8 0 "[ . 1]" 1 120 1 132 ASN H 1 134 ILE H 1.800 . 3.500 3.454 3.283 3.525 0.025 7 0 "[ . 1]" 1 121 1 132 ASN H 1 135 SER H 1.800 . 5.000 4.712 3.501 5.024 0.024 9 0 "[ . 1]" 1 122 1 133 ASP H 1 134 ILE H 1.800 . 3.000 2.304 1.932 2.478 . 0 0 "[ . 1]" 1 123 1 135 SER H 1 136 GLY H 1.800 . 3.000 2.777 2.574 3.038 0.038 9 0 "[ . 1]" 1 124 1 136 GLY H 1 137 GLY H 1.800 . 5.000 3.737 3.317 4.562 . 0 0 "[ . 1]" 1 125 1 137 GLY H 1 138 GLU H 1.800 . 5.000 4.114 3.740 4.383 . 0 0 "[ . 1]" 1 126 1 138 GLU H 1 139 TRP H 1.800 . 5.000 4.437 4.402 4.489 . 0 0 "[ . 1]" 1 127 1 139 TRP H 1 140 LEU H 1.800 . 5.000 4.161 4.127 4.205 . 0 0 "[ . 1]" 1 128 1 141 THR H 1 144 HIS H 1.800 . 5.000 3.866 3.555 4.093 . 0 0 "[ . 1]" 1 129 1 143 GLU H 1 144 HIS H 1.800 . 3.000 2.559 2.480 2.659 . 0 0 "[ . 1]" 1 130 1 143 GLU H 1 145 LEU H 1.800 . 5.000 4.000 3.823 4.164 . 0 0 "[ . 1]" 1 131 1 144 HIS H 1 145 LEU H 1.800 . 3.000 2.517 2.446 2.601 . 0 0 "[ . 1]" 1 132 1 144 HIS H 1 146 LEU H 1.800 . 5.000 4.355 4.083 4.558 . 0 0 "[ . 1]" 1 133 1 145 LEU H 1 146 LEU H 1.800 . 3.500 2.813 2.755 2.875 . 0 0 "[ . 1]" 1 134 1 146 LEU H 1 147 ALA H 1.800 . 3.000 2.617 2.511 2.674 . 0 0 "[ . 1]" 1 135 1 147 ALA H 1 148 ARG H 1.800 . 3.500 2.571 2.528 2.656 . 0 0 "[ . 1]" 1 136 1 149 ILE H 1 150 ALA H 1.800 . 3.500 2.657 2.502 2.718 . 0 0 "[ . 1]" 1 137 1 150 ALA H 1 151 ALA H 1.800 . 3.500 2.484 2.370 2.609 . 0 0 "[ . 1]" 1 138 1 150 ALA H 1 152 GLY H 1.800 . 5.000 4.465 3.851 5.003 0.003 3 0 "[ . 1]" 1 139 1 151 ALA H 1 152 GLY H 1.800 . 3.500 2.829 2.461 3.120 . 0 0 "[ . 1]" 1 140 1 151 ALA H 1 153 GLU H 1.800 . 5.000 4.560 4.055 4.943 . 0 0 "[ . 1]" 1 141 1 152 GLY H 1 153 GLU H 1.800 . 3.500 2.384 2.046 2.723 . 0 0 "[ . 1]" 1 142 1 153 GLU H 1 154 ALA H 1.800 . 3.500 2.857 2.461 3.290 . 0 0 "[ . 1]" 1 143 1 154 ALA H 1 155 ALA H 1.800 . 3.500 2.788 2.674 3.159 . 0 0 "[ . 1]" 1 144 1 155 ALA H 1 156 LYS H 1.800 . 5.000 2.612 1.812 3.302 . 0 0 "[ . 1]" 1 145 1 159 LEU H 1 160 ALA H 1.800 . 3.500 2.780 2.622 2.926 . 0 0 "[ . 1]" 1 146 1 160 ALA H 1 161 GLU H 1.800 . 3.500 2.760 2.668 2.882 . 0 0 "[ . 1]" 1 147 1 160 ALA H 1 162 LEU H 1.800 . 5.000 4.156 3.998 4.481 . 0 0 "[ . 1]" 1 148 1 161 GLU H 1 162 LEU H 1.800 . 3.500 2.620 2.445 2.848 . 0 0 "[ . 1]" 1 149 1 162 LEU H 1 163 VAL H 1.800 . 3.500 2.674 2.455 2.913 . 0 0 "[ . 1]" 1 150 1 163 VAL H 1 164 ARG H 1.800 . 3.500 2.656 2.451 2.821 . 0 0 "[ . 1]" 1 151 1 165 ARG H 1 166 CYS H 1.800 . 3.500 2.484 2.367 2.811 . 0 0 "[ . 1]" 1 152 1 165 ARG H 1 167 TYR H 1.800 . 5.000 3.933 3.737 4.126 . 0 0 "[ . 1]" 1 153 1 166 CYS H 1 167 TYR H 1.800 . 3.000 2.470 2.372 2.662 . 0 0 "[ . 1]" 1 154 1 166 CYS H 1 168 ARG H 1.800 . 5.000 4.538 4.155 5.005 0.005 7 0 "[ . 1]" 1 155 1 167 TYR H 1 168 ARG H 1.800 . 3.000 2.813 2.614 2.954 . 0 0 "[ . 1]" 1 156 1 167 TYR H 1 167 TYR QD 1.800 . 5.500 2.828 2.036 3.568 . 0 0 "[ . 1]" 1 157 1 167 TYR H 1 167 TYR QE 1.800 . 7.000 4.979 4.393 5.451 . 0 0 "[ . 1]" 1 158 1 168 ARG H 1 169 GLU H 1.800 . 3.000 2.911 2.683 3.007 0.007 2 0 "[ . 1]" 1 159 1 167 TYR QD 1 168 ARG H 1.800 . 7.000 4.273 4.097 4.376 . 0 0 "[ . 1]" 1 160 1 4 VAL HA 1 5 SER H 1.800 . 3.000 2.264 2.141 2.507 . 0 0 "[ . 1]" 1 161 1 5 SER HA 1 6 ASP H 1.800 . 3.500 2.778 2.158 3.551 0.051 2 0 "[ . 1]" 1 162 1 5 SER QB 1 6 ASP H 1.800 . 5.000 3.001 1.939 4.033 . 0 0 "[ . 1]" 1 163 1 6 ASP HA 1 7 GLU H 1.800 . 3.000 2.395 2.140 2.963 . 0 0 "[ . 1]" 1 164 1 7 GLU HA 1 8 ARG H 1.800 . 3.500 2.320 2.141 2.808 . 0 0 "[ . 1]" 1 165 1 8 ARG HA 1 9 LEU H 1.800 . 3.000 2.346 2.242 2.584 . 0 0 "[ . 1]" 1 166 1 8 ARG QD 1 9 LEU H 1.800 . 7.000 4.464 3.845 5.028 . 0 0 "[ . 1]" 1 167 1 8 ARG HB3 1 9 LEU H 1.800 . 4.500 3.258 2.584 3.848 . 0 0 "[ . 1]" 1 168 1 8 ARG HB2 1 9 LEU H 1.800 . 4.500 3.468 2.129 4.260 . 0 0 "[ . 1]" 1 169 1 8 ARG QG 1 9 LEU H 1.800 . 6.000 3.315 2.367 4.274 . 0 0 "[ . 1]" 1 170 1 9 LEU H 1 23 LEU HA 1.800 . 3.500 3.021 2.527 3.492 . 0 0 "[ . 1]" 1 171 1 9 LEU HA 1 10 ASP H 1.800 . 3.000 2.163 2.141 2.186 . 0 0 "[ . 1]" 1 172 1 10 ASP HA 1 11 LEU H 1.800 . 2.500 2.177 2.137 2.277 . 0 0 "[ . 1]" 1 173 1 11 LEU H 1 21 GLN HA 1.800 . 3.500 3.191 3.019 3.396 . 0 0 "[ . 1]" 1 174 1 10 ASP HB3 1 11 LEU H 1.800 . 6.000 3.370 3.043 3.784 . 0 0 "[ . 1]" 1 175 1 10 ASP HB2 1 11 LEU H 1.800 . 6.000 4.316 4.031 4.506 . 0 0 "[ . 1]" 1 176 1 11 LEU HA 1 12 VAL H 1.800 . 2.500 2.148 2.139 2.162 . 0 0 "[ . 1]" 1 177 1 11 LEU QD 1 12 VAL H 1.800 . 5.500 3.698 3.132 4.114 . 0 0 "[ . 1]" 1 178 1 12 VAL HA 1 13 ASN H 1.800 . 2.500 2.265 2.209 2.449 . 0 0 "[ . 1]" 1 179 1 13 ASN H 1 18 VAL HA 1.800 . 3.500 3.524 3.514 3.531 0.031 2 0 "[ . 1]" 1 180 1 13 ASN HB3 1 14 GLU H 1.800 . 4.000 3.323 2.303 4.027 0.027 9 0 "[ . 1]" 1 181 1 13 ASN HB2 1 14 GLU H 1.800 . 4.000 3.044 2.111 4.013 0.013 9 0 "[ . 1]" 1 182 1 12 VAL MG1 1 14 GLU H 1.800 . 5.000 3.769 2.926 4.212 . 0 0 "[ . 1]" 1 183 1 12 VAL MG2 1 14 GLU H 1.800 . 5.000 2.725 1.977 3.614 . 0 0 "[ . 1]" 1 184 1 14 GLU HA 1 15 ARG H 1.800 . 3.500 3.316 2.753 3.550 0.050 4 0 "[ . 1]" 1 185 1 13 ASN HB3 1 15 ARG H 1.800 . 6.000 4.933 3.606 6.024 0.024 10 0 "[ . 1]" 1 186 1 13 ASN HB2 1 15 ARG H 1.800 . 6.000 4.567 3.494 6.041 0.041 10 0 "[ . 1]" 1 187 1 15 ARG QG 1 16 ASP H 1.800 . 6.000 3.494 1.945 4.573 . 0 0 "[ . 1]" 1 188 1 15 ARG HA 1 16 ASP H 1.800 . 3.500 3.458 2.786 3.551 0.051 7 0 "[ . 1]" 1 189 1 16 ASP HA 1 17 GLU H 1.800 . 3.500 2.972 2.818 3.373 . 0 0 "[ . 1]" 1 190 1 12 VAL MG1 1 17 GLU H 1.800 . 5.000 3.687 2.880 4.145 . 0 0 "[ . 1]" 1 191 1 12 VAL MG2 1 17 GLU H 1.800 . 5.000 2.723 1.882 4.124 . 0 0 "[ . 1]" 1 192 1 12 VAL HA 1 17 GLU H 1.800 . 5.000 4.493 4.306 4.886 . 0 0 "[ . 1]" 1 193 1 16 ASP HB3 1 17 GLU H 1.800 . 6.000 4.140 3.440 4.618 . 0 0 "[ . 1]" 1 194 1 17 GLU HA 1 18 VAL H 1.800 . 3.000 2.320 2.254 2.426 . 0 0 "[ . 1]" 1 195 1 17 GLU QG 1 18 VAL H 1.800 . 4.500 4.003 3.729 4.089 . 0 0 "[ . 1]" 1 196 1 18 VAL HA 1 19 VAL H 1.800 . 3.500 2.169 2.128 2.241 . 0 0 "[ . 1]" 1 197 1 12 VAL HA 1 19 VAL H 1.800 . 3.500 2.248 1.996 2.528 . 0 0 "[ . 1]" 1 198 1 19 VAL HA 1 20 GLY H 1.800 . 3.500 3.520 3.509 3.529 0.029 7 0 "[ . 1]" 1 199 1 12 VAL HA 1 20 GLY H 1.800 . 5.000 4.202 4.006 4.269 . 0 0 "[ . 1]" 1 200 1 18 VAL HA 1 20 GLY H 1.800 . 4.000 3.880 3.776 4.006 0.006 2 0 "[ . 1]" 1 201 1 19 VAL MG1 1 20 GLY H 1.800 . 4.500 3.756 3.709 3.781 . 0 0 "[ . 1]" 1 202 1 19 VAL MG2 1 20 GLY H 1.800 . 4.500 1.994 1.913 2.113 . 0 0 "[ . 1]" 1 203 1 20 GLY HA3 1 21 GLN H 1.800 . 3.500 2.889 2.707 3.103 . 0 0 "[ . 1]" 1 204 1 20 GLY HA2 1 21 GLN H 1.800 . 3.500 2.293 2.167 2.424 . 0 0 "[ . 1]" 1 205 1 21 GLN HA 1 22 ILE H 1.800 . 3.000 2.173 2.139 2.234 . 0 0 "[ . 1]" 1 206 1 10 ASP HA 1 22 ILE H 1.800 . 3.500 3.232 2.911 3.469 . 0 0 "[ . 1]" 1 207 1 21 GLN HG3 1 22 ILE H 1.800 . 6.000 3.959 2.828 5.246 . 0 0 "[ . 1]" 1 208 1 21 GLN HG2 1 22 ILE H 1.800 . 6.000 4.385 3.748 4.874 . 0 0 "[ . 1]" 1 209 1 22 ILE HA 1 23 LEU H 1.800 . 3.000 2.213 2.145 2.328 . 0 0 "[ . 1]" 1 210 1 23 LEU H 1 26 ASP HB3 1.800 . 6.000 3.961 2.783 4.846 . 0 0 "[ . 1]" 1 211 1 23 LEU H 1 26 ASP HB2 1.800 . 6.000 3.592 2.292 4.749 . 0 0 "[ . 1]" 1 212 1 22 ILE MG 1 23 LEU H 1.800 . 6.000 2.316 1.940 3.127 . 0 0 "[ . 1]" 1 213 1 22 ILE MD 1 23 LEU H 1.800 . 6.000 3.983 3.434 4.931 . 0 0 "[ . 1]" 1 214 1 23 LEU HA 1 24 ARG H 1.800 . 3.000 2.273 2.142 2.471 . 0 0 "[ . 1]" 1 215 1 24 ARG H 1 24 ARG HA 1.800 . 3.000 2.854 2.810 2.895 . 0 0 "[ . 1]" 1 216 1 8 ARG HA 1 24 ARG H 1.800 . 3.500 3.187 2.934 3.475 . 0 0 "[ . 1]" 1 217 1 24 ARG HA 1 25 THR H 1.800 . 4.000 3.513 3.476 3.571 . 0 0 "[ . 1]" 1 218 1 25 THR MG 1 26 ASP H 1.800 . 6.000 4.099 3.133 4.456 . 0 0 "[ . 1]" 1 219 1 25 THR HA 1 26 ASP H 1.800 . 3.500 3.123 2.636 3.498 . 0 0 "[ . 1]" 1 220 1 26 ASP H 1 26 ASP HA 1.800 . 3.000 2.902 2.824 2.939 . 0 0 "[ . 1]" 1 221 1 26 ASP H 1 27 PRO HD3 1.800 . 6.000 4.611 4.063 4.802 . 0 0 "[ . 1]" 1 222 1 26 ASP H 1 27 PRO HD2 1.800 . 6.000 5.057 4.828 5.387 . 0 0 "[ . 1]" 1 223 1 23 LEU HB3 1 26 ASP H 1.800 . 4.500 3.143 2.278 4.502 0.002 2 0 "[ . 1]" 1 224 1 23 LEU HB2 1 26 ASP H 1.800 . 4.500 3.782 2.700 4.465 . 0 0 "[ . 1]" 1 225 1 27 PRO HA 1 28 ALA H 1.800 . 3.500 3.223 2.875 3.357 . 0 0 "[ . 1]" 1 226 1 26 ASP HA 1 28 ALA H 1.800 . 5.000 3.837 3.577 4.100 . 0 0 "[ . 1]" 1 227 1 28 ALA H 1 28 ALA HA 1.800 . 3.000 2.815 2.725 2.940 . 0 0 "[ . 1]" 1 228 1 27 PRO HB3 1 28 ALA H 1.800 . 6.000 4.557 4.462 4.676 . 0 0 "[ . 1]" 1 229 1 27 PRO HB2 1 28 ALA H 1.800 . 6.000 4.047 3.718 4.363 . 0 0 "[ . 1]" 1 230 1 27 PRO HD3 1 28 ALA H 1.800 . 4.500 4.024 3.761 4.510 0.010 2 0 "[ . 1]" 1 231 1 27 PRO HD2 1 28 ALA H 1.800 . 4.500 2.972 2.731 3.697 . 0 0 "[ . 1]" 1 232 1 28 ALA HA 1 29 LEU H 1.800 . 3.500 3.338 2.818 3.546 0.046 6 0 "[ . 1]" 1 233 1 26 ASP HB3 1 29 LEU H 1.800 . 6.000 4.484 3.947 5.258 . 0 0 "[ . 1]" 1 234 1 26 ASP HB2 1 29 LEU H 1.800 . 6.000 5.546 4.918 5.948 . 0 0 "[ . 1]" 1 235 1 29 LEU HA 1 30 ARG H 1.800 . 3.000 2.923 2.374 3.079 0.079 10 0 "[ . 1]" 1 236 1 29 LEU HG 1 30 ARG H 1.800 . 5.000 4.252 3.676 5.003 0.003 1 0 "[ . 1]" 1 237 1 29 LEU MD1 1 30 ARG H 1.800 . 6.000 3.227 2.507 5.003 . 0 0 "[ . 1]" 1 238 1 29 LEU MD2 1 30 ARG H 1.800 . 6.000 4.731 3.910 5.090 . 0 0 "[ . 1]" 1 239 1 30 ARG HA 1 31 TRP H 1.800 . 3.500 2.371 2.206 2.662 . 0 0 "[ . 1]" 1 240 1 29 LEU MD2 1 31 TRP H 1.800 . 6.000 4.807 4.479 5.005 . 0 0 "[ . 1]" 1 241 1 31 TRP H 1 31 TRP HD1 1.800 . 3.500 3.162 2.912 3.513 0.013 5 0 "[ . 1]" 1 242 1 31 TRP HA 1 32 GLU H 1.800 . 4.000 2.293 2.108 3.066 . 0 0 "[ . 1]" 1 243 1 31 TRP HB3 1 32 GLU H 1.800 . 4.500 3.924 3.644 4.313 . 0 0 "[ . 1]" 1 244 1 31 TRP HB2 1 32 GLU H 1.800 . 4.500 4.480 3.989 4.571 0.071 7 0 "[ . 1]" 1 245 1 32 GLU HA 1 33 ARG H 1.800 . 3.500 3.375 2.316 3.541 0.041 5 0 "[ . 1]" 1 246 1 32 GLU HB3 1 33 ARG H 1.800 . 6.000 3.332 2.521 4.456 . 0 0 "[ . 1]" 1 247 1 32 GLU HB2 1 33 ARG H 1.800 . 6.000 3.350 2.520 4.666 . 0 0 "[ . 1]" 1 248 1 32 GLU QG 1 33 ARG H 1.800 . 6.000 3.933 1.971 4.426 . 0 0 "[ . 1]" 1 249 1 35 ARG H 1 35 ARG HA 2.500 . 5.000 2.929 2.925 2.937 . 0 0 "[ . 1]" 1 250 1 34 VAL HA 1 35 ARG H 1.800 . 3.500 2.500 2.425 2.592 . 0 0 "[ . 1]" 1 251 1 34 VAL HB 1 35 ARG H 1.800 . 3.500 2.542 1.982 3.301 . 0 0 "[ . 1]" 1 252 1 35 ARG HA 1 36 VAL H 1.800 . 3.000 2.171 2.140 2.219 . 0 0 "[ . 1]" 1 253 1 36 VAL H 1 116 MET HA 1.800 . 3.500 2.424 2.246 2.572 . 0 0 "[ . 1]" 1 254 1 36 VAL HA 1 37 VAL H 1.800 . 3.000 2.461 2.326 2.561 . 0 0 "[ . 1]" 1 255 1 36 VAL HB 1 37 VAL H 1.800 . 3.500 3.132 2.855 3.497 . 0 0 "[ . 1]" 1 256 1 37 VAL H 1 71 ALA MB 1.800 . 6.000 4.533 4.108 4.837 . 0 0 "[ . 1]" 1 257 1 36 VAL MG1 1 37 VAL H 1.800 . 6.000 1.929 1.867 1.992 . 0 0 "[ . 1]" 1 258 1 36 VAL MG2 1 37 VAL H 1.800 . 6.000 3.964 3.940 4.008 . 0 0 "[ . 1]" 1 259 1 38 ASN H 1 118 VAL HA 1.800 . 5.000 3.691 3.207 4.032 . 0 0 "[ . 1]" 1 260 1 37 VAL HA 1 38 ASN H 1.800 . 3.000 2.238 2.126 2.322 . 0 0 "[ . 1]" 1 261 1 37 VAL HB 1 38 ASN H 1.800 . 3.500 3.436 3.072 3.528 0.028 3 0 "[ . 1]" 1 262 1 38 ASN HA 1 39 ALA H 1.800 . 3.000 2.348 2.296 2.483 . 0 0 "[ . 1]" 1 263 1 39 ALA H 1 69 GLY HA3 1.800 . 4.500 4.480 4.359 4.519 0.019 7 0 "[ . 1]" 1 264 1 39 ALA H 1 69 GLY HA2 1.800 . 4.500 3.802 3.568 4.021 . 0 0 "[ . 1]" 1 265 1 38 ASN QB 1 39 ALA H 1.800 . 4.500 2.655 2.428 2.943 . 0 0 "[ . 1]" 1 266 1 39 ALA H 1 66 VAL MG1 1.800 . 6.000 3.117 1.815 3.778 . 0 0 "[ . 1]" 1 267 1 39 ALA H 1 66 VAL MG2 1.800 . 5.500 3.443 2.311 3.950 . 0 0 "[ . 1]" 1 268 1 39 ALA H 1 66 VAL HB 1.800 . 3.500 2.917 2.521 3.513 0.013 3 0 "[ . 1]" 1 269 1 39 ALA H 1 68 VAL HB 1.800 . 4.000 3.577 3.321 3.942 . 0 0 "[ . 1]" 1 270 1 39 ALA HA 1 40 PHE H 1.800 . 3.000 2.331 2.240 2.483 . 0 0 "[ . 1]" 1 271 1 40 PHE H 1 120 GLU HA 1.800 . 3.500 2.777 2.433 3.066 . 0 0 "[ . 1]" 1 272 1 39 ALA MB 1 40 PHE H 1.800 . 4.500 2.522 2.141 2.762 . 0 0 "[ . 1]" 1 273 1 40 PHE HA 1 41 LEU H 1.800 . 3.000 2.163 2.147 2.190 . 0 0 "[ . 1]" 1 274 1 41 LEU H 1 67 SER HA 1.800 . 5.000 4.904 4.534 5.031 0.031 9 0 "[ . 1]" 1 275 1 41 LEU H 1 67 SER QB 1.800 . 6.000 2.505 2.157 2.861 . 0 0 "[ . 1]" 1 276 1 40 PHE QB 1 41 LEU H 1.800 . 6.000 3.211 3.109 3.309 . 0 0 "[ . 1]" 1 277 1 39 ALA MB 1 41 LEU H 1.800 . 6.000 4.837 4.721 4.902 . 0 0 "[ . 1]" 1 278 1 41 LEU HA 1 42 ARG H 1.800 . 3.000 2.134 2.109 2.147 . 0 0 "[ . 1]" 1 279 1 42 ARG H 1 48 LEU HA 1.800 . 6.000 5.343 5.108 5.471 . 0 0 "[ . 1]" 1 280 1 42 ARG H 1 122 ARG HA 1.800 . 4.000 3.028 2.607 3.419 . 0 0 "[ . 1]" 1 281 1 41 LEU HB3 1 42 ARG H 1.800 . 6.000 3.852 3.426 4.258 . 0 0 "[ . 1]" 1 282 1 41 LEU HB2 1 42 ARG H 1.800 . 6.000 4.441 4.136 4.577 . 0 0 "[ . 1]" 1 283 1 41 LEU MD1 1 42 ARG H 1.800 . 6.000 3.519 2.527 4.862 . 0 0 "[ . 1]" 1 284 1 41 LEU MD2 1 42 ARG H 1.800 . 7.000 3.727 2.789 4.596 . 0 0 "[ . 1]" 1 285 1 42 ARG H 1 48 LEU MD2 1.800 . 6.500 4.708 4.090 5.280 . 0 0 "[ . 1]" 1 286 1 42 ARG HA 1 43 ASN H 1.800 . 3.000 2.266 2.218 2.357 . 0 0 "[ . 1]" 1 287 1 43 ASN H 1 48 LEU HA 1.800 . 4.500 4.099 3.919 4.356 . 0 0 "[ . 1]" 1 288 1 42 ARG HB3 1 43 ASN H 1.800 . 6.000 3.854 3.582 4.090 . 0 0 "[ . 1]" 1 289 1 42 ARG HB2 1 43 ASN H 1.800 . 6.000 3.919 2.933 4.096 . 0 0 "[ . 1]" 1 290 1 43 ASN H 1 48 LEU MD2 1.800 . 6.000 4.346 3.516 4.869 . 0 0 "[ . 1]" 1 291 1 43 ASN HA 1 44 SER H 1.800 . 3.000 2.312 2.189 2.569 . 0 0 "[ . 1]" 1 292 1 43 ASN HB3 1 44 SER H 1.800 . 4.000 3.696 3.009 3.962 . 0 0 "[ . 1]" 1 293 1 43 ASN HB2 1 44 SER H 1.800 . 4.000 3.514 2.251 4.049 0.049 8 0 "[ . 1]" 1 294 1 43 ASN HA 1 45 GLN H 1.800 . 4.500 3.711 3.052 4.429 . 0 0 "[ . 1]" 1 295 1 44 SER HA 1 45 GLN H 1.800 . 4.500 3.296 2.999 3.562 . 0 0 "[ . 1]" 1 296 1 43 ASN HB3 1 45 GLN H 1.800 . 6.000 4.164 2.647 5.813 . 0 0 "[ . 1]" 1 297 1 43 ASN HB2 1 45 GLN H 1.800 . 6.000 4.607 3.440 5.530 . 0 0 "[ . 1]" 1 298 1 44 SER QB 1 45 GLN H 1.800 . 6.000 3.256 2.274 4.029 . 0 0 "[ . 1]" 1 299 1 45 GLN HA 1 46 GLY H 1.800 . 3.500 3.084 2.543 3.514 0.014 10 0 "[ . 1]" 1 300 1 45 GLN HB3 1 46 GLY H 1.800 . 5.500 3.880 2.726 4.423 . 0 0 "[ . 1]" 1 301 1 45 GLN HB2 1 46 GLY H 1.800 . 5.500 4.261 3.644 4.659 . 0 0 "[ . 1]" 1 302 1 46 GLY HA3 1 47 GLN H 1.800 . 4.500 3.381 2.975 3.572 . 0 0 "[ . 1]" 1 303 1 46 GLY HA2 1 47 GLN H 1.800 . 4.500 3.005 2.662 3.501 . 0 0 "[ . 1]" 1 304 1 47 GLN HA 1 48 LEU H 1.800 . 3.200 2.209 2.159 2.267 . 0 0 "[ . 1]" 1 305 1 48 LEU HA 1 49 TRP H 1.800 . 3.000 2.146 2.125 2.165 . 0 0 "[ . 1]" 1 306 1 48 LEU MD1 1 49 TRP H 1.800 . 6.000 4.050 2.316 5.042 . 0 0 "[ . 1]" 1 307 1 48 LEU MD2 1 49 TRP H 1.800 . 6.000 3.275 2.613 4.139 . 0 0 "[ . 1]" 1 308 1 47 GLN HA 1 49 TRP H 1.800 . 5.500 5.543 5.522 5.569 0.069 4 0 "[ . 1]" 1 309 1 42 ARG HA 1 49 TRP H 1.800 . 4.000 3.433 3.096 3.714 . 0 0 "[ . 1]" 1 310 1 49 TRP QB 1 50 ILE H 1.800 . 6.000 3.821 3.731 3.905 . 0 0 "[ . 1]" 1 311 1 56 SER HA 1 57 LYS H 1.800 . 4.000 3.264 2.213 3.570 . 0 0 "[ . 1]" 1 312 1 62 ASN HA 1 63 ALA H 1.800 . 5.000 2.714 2.167 3.572 . 0 0 "[ . 1]" 1 313 1 64 LEU HA 1 65 ASP H 1.800 . 3.000 2.421 2.233 2.616 . 0 0 "[ . 1]" 1 314 1 65 ASP HA 1 66 VAL H 1.800 . 3.000 2.436 2.147 2.728 . 0 0 "[ . 1]" 1 315 1 65 ASP HB3 1 66 VAL H 1.800 . 5.500 2.969 2.481 3.569 . 0 0 "[ . 1]" 1 316 1 65 ASP HB2 1 66 VAL H 1.800 . 5.500 3.827 1.944 4.491 . 0 0 "[ . 1]" 1 317 1 40 PHE HA 1 67 SER H 1.800 . 5.000 2.920 2.504 3.157 . 0 0 "[ . 1]" 1 318 1 66 VAL HB 1 67 SER H 1.800 . 3.500 2.425 1.962 3.368 . 0 0 "[ . 1]" 1 319 1 66 VAL HA 1 67 SER H 1.800 . 3.000 2.472 2.295 2.679 . 0 0 "[ . 1]" 1 320 1 66 VAL MG1 1 67 SER H 1.800 . 6.500 3.181 1.908 3.625 . 0 0 "[ . 1]" 1 321 1 66 VAL MG2 1 67 SER H 1.800 . 6.500 3.545 2.696 3.952 . 0 0 "[ . 1]" 1 322 1 40 PHE HA 1 68 VAL H 1.800 . 5.000 3.790 3.535 3.983 . 0 0 "[ . 1]" 1 323 1 38 ASN HA 1 68 VAL H 1.800 . 5.000 4.773 4.560 4.979 . 0 0 "[ . 1]" 1 324 1 66 VAL HA 1 68 VAL H 1.800 . 5.000 4.920 4.703 5.032 0.032 7 0 "[ . 1]" 1 325 1 66 VAL HB 1 68 VAL H 1.800 . 4.000 3.552 3.153 4.014 0.014 3 0 "[ . 1]" 1 326 1 39 ALA MB 1 68 VAL H 1.800 . 6.000 3.698 3.419 4.026 . 0 0 "[ . 1]" 1 327 1 67 SER HA 1 68 VAL H 1.800 . 3.700 3.567 3.560 3.571 . 0 0 "[ . 1]" 1 328 1 68 VAL HA 1 69 GLY H 1.800 . 3.500 2.241 2.148 2.368 . 0 0 "[ . 1]" 1 329 1 68 VAL HB 1 69 GLY H 1.800 . 5.000 4.055 3.544 4.403 . 0 0 "[ . 1]" 1 330 1 69 GLY HA3 1 70 GLY H 1.800 . 4.500 3.060 2.834 3.263 . 0 0 "[ . 1]" 1 331 1 69 GLY HA2 1 70 GLY H 1.800 . 4.500 2.208 2.137 2.322 . 0 0 "[ . 1]" 1 332 1 38 ASN HA 1 70 GLY H 1.800 . 5.000 3.735 3.380 3.962 . 0 0 "[ . 1]" 1 333 1 37 VAL HB 1 70 GLY H 1.800 . 3.500 3.055 2.079 3.523 0.023 1 0 "[ . 1]" 1 334 1 70 GLY HA3 1 71 ALA H 1.800 . 4.000 2.725 2.373 2.952 . 0 0 "[ . 1]" 1 335 1 70 GLY HA2 1 71 ALA H 1.800 . 4.000 2.428 2.245 2.786 . 0 0 "[ . 1]" 1 336 1 36 VAL HA 1 72 VAL H 1.800 . 4.000 3.429 3.083 3.820 . 0 0 "[ . 1]" 1 337 1 72 VAL HA 1 73 GLN H 1.800 . 3.000 2.206 2.145 2.369 . 0 0 "[ . 1]" 1 338 1 72 VAL MG1 1 73 GLN H 1.800 . 6.000 2.889 1.886 4.164 . 0 0 "[ . 1]" 1 339 1 72 VAL MG2 1 73 GLN H 1.800 . 6.000 3.922 2.571 4.206 . 0 0 "[ . 1]" 1 340 1 73 GLN H 1 81 ALA MB 1.800 . 6.000 3.498 2.826 3.984 . 0 0 "[ . 1]" 1 341 1 73 GLN HA 1 74 SER H 1.800 . 3.000 2.329 2.140 2.629 . 0 0 "[ . 1]" 1 342 1 73 GLN HG3 1 74 SER H 1.800 . 6.000 4.282 3.549 4.803 . 0 0 "[ . 1]" 1 343 1 73 GLN HG2 1 74 SER H 1.800 . 6.000 4.186 2.575 5.210 . 0 0 "[ . 1]" 1 344 1 73 GLN HB3 1 74 SER H 1.800 . 4.500 3.406 1.976 4.263 . 0 0 "[ . 1]" 1 345 1 73 GLN HB2 1 74 SER H 1.800 . 4.500 3.355 2.079 4.397 . 0 0 "[ . 1]" 1 346 1 74 SER HA 1 75 GLY H 1.800 . 3.500 2.941 2.204 3.552 0.052 1 0 "[ . 1]" 1 347 1 74 SER HB3 1 75 GLY H 1.800 . 6.000 3.801 1.918 4.610 . 0 0 "[ . 1]" 1 348 1 74 SER HB2 1 75 GLY H 1.800 . 6.000 3.549 1.996 4.626 . 0 0 "[ . 1]" 1 349 1 75 GLY HA3 1 76 GLU H 1.800 . 5.000 2.941 2.143 3.569 . 0 0 "[ . 1]" 1 350 1 75 GLY HA2 1 76 GLU H 1.800 . 5.000 3.156 2.211 3.557 . 0 0 "[ . 1]" 1 351 1 76 GLU HA 1 77 THR H 1.800 . 3.500 2.655 2.161 3.519 0.019 1 0 "[ . 1]" 1 352 1 77 THR H 1 77 THR HA 1.800 . 3.000 2.912 2.854 2.946 . 0 0 "[ . 1]" 1 353 1 72 VAL QG 1 77 THR H 1.800 . 7.000 2.987 1.800 4.446 . 0 0 "[ . 1]" 1 354 1 77 THR HA 1 78 TYR H 1.800 . 3.500 2.271 2.136 2.845 . 0 0 "[ . 1]" 1 355 1 78 TYR H 1 78 TYR HA 1.800 . 3.000 2.798 2.733 2.841 . 0 0 "[ . 1]" 1 356 1 77 THR MG 1 78 TYR H 1.800 . 4.500 3.033 1.960 3.680 . 0 0 "[ . 1]" 1 357 1 72 VAL QG 1 78 TYR H 1.800 . 7.000 3.685 3.113 4.122 . 0 0 "[ . 1]" 1 358 1 78 TYR HA 1 79 GLU H 1.800 . 3.500 3.497 3.482 3.537 0.037 3 0 "[ . 1]" 1 359 1 79 GLU H 1 79 GLU HA 1.800 . 3.000 2.822 2.756 2.865 . 0 0 "[ . 1]" 1 360 1 78 TYR HB3 1 79 GLU H 1.800 . 4.500 3.675 3.139 4.023 . 0 0 "[ . 1]" 1 361 1 78 TYR HB2 1 79 GLU H 1.800 . 4.500 2.903 2.600 3.107 . 0 0 "[ . 1]" 1 362 1 77 THR MG 1 79 GLU H 1.800 . 6.000 3.435 2.017 4.079 . 0 0 "[ . 1]" 1 363 1 72 VAL QG 1 79 GLU H 1.800 . 7.000 4.777 4.362 5.042 . 0 0 "[ . 1]" 1 364 1 80 GLU H 1 80 GLU HA 1.800 . 3.000 2.809 2.785 2.846 . 0 0 "[ . 1]" 1 365 1 77 THR HA 1 80 GLU H 1.800 . 5.000 4.556 4.290 5.007 0.007 10 0 "[ . 1]" 1 366 1 80 GLU HA 1 81 ALA H 1.800 . 5.000 3.521 3.484 3.569 . 0 0 "[ . 1]" 1 367 1 82 PHE H 1 82 PHE HA 1.800 . 3.000 2.815 2.782 2.870 . 0 0 "[ . 1]" 1 368 1 81 ALA MB 1 82 PHE H 1.800 . 4.500 2.448 2.149 2.719 . 0 0 "[ . 1]" 1 369 1 82 PHE HA 1 83 ARG H 1.800 . 4.500 3.510 3.477 3.551 . 0 0 "[ . 1]" 1 370 1 82 PHE HB3 1 83 ARG H 1.800 . 5.000 2.875 2.655 3.180 . 0 0 "[ . 1]" 1 371 1 82 PHE HB2 1 83 ARG H 1.800 . 5.000 3.587 2.952 3.894 . 0 0 "[ . 1]" 1 372 1 83 ARG H 1 83 ARG HA 1.800 . 3.000 2.814 2.775 2.851 . 0 0 "[ . 1]" 1 373 1 83 ARG H 1 94 ILE MD 1.800 . 6.000 3.253 2.863 3.768 . 0 0 "[ . 1]" 1 374 1 84 ARG H 1 94 ILE MD 1.800 . 7.000 5.235 4.960 5.584 . 0 0 "[ . 1]" 1 375 1 84 ARG HA 1 85 GLU H 1.800 . 5.000 3.539 3.473 3.571 . 0 0 "[ . 1]" 1 376 1 85 GLU H 1 85 GLU HA 1.800 . 3.000 2.814 2.780 2.859 . 0 0 "[ . 1]" 1 377 1 85 GLU HA 1 86 ALA H 1.800 . 3.500 3.506 3.488 3.538 0.038 3 0 "[ . 1]" 1 378 1 86 ALA H 1 86 ALA HA 1.800 . 3.000 2.859 2.825 2.885 . 0 0 "[ . 1]" 1 379 1 86 ALA H 1 94 ILE MG 1.800 . 6.000 3.747 3.556 4.207 . 0 0 "[ . 1]" 1 380 1 85 GLU HB3 1 86 ALA H 1.800 . 6.000 3.489 2.984 4.048 . 0 0 "[ . 1]" 1 381 1 85 GLU HB2 1 86 ALA H 1.800 . 6.000 3.044 2.509 3.629 . 0 0 "[ . 1]" 1 382 1 86 ALA HA 1 87 ARG H 1.800 . 5.000 3.533 3.450 3.566 . 0 0 "[ . 1]" 1 383 1 87 ARG H 1 87 ARG HA 1.800 . 3.000 2.824 2.769 2.884 . 0 0 "[ . 1]" 1 384 1 86 ALA MB 1 87 ARG H 1.800 . 4.500 2.576 2.296 2.930 . 0 0 "[ . 1]" 1 385 1 88 GLU H 1 88 GLU HA 1.800 . 3.000 2.840 2.787 2.885 . 0 0 "[ . 1]" 1 386 1 86 ALA MB 1 88 GLU H 1.800 . 6.000 4.485 4.309 4.682 . 0 0 "[ . 1]" 1 387 1 89 GLU H 1 89 GLU HA 1.800 . 3.000 2.851 2.814 2.924 . 0 0 "[ . 1]" 1 388 1 88 GLU HA 1 89 GLU H 1.800 . 3.500 3.468 3.426 3.489 . 0 0 "[ . 1]" 1 389 1 86 ALA HA 1 89 GLU H 1.800 . 5.500 3.486 3.372 3.635 . 0 0 "[ . 1]" 1 390 1 85 GLU HA 1 89 GLU H 1.800 . 5.000 4.547 4.296 4.761 . 0 0 "[ . 1]" 1 391 1 88 GLU QB 1 89 GLU H 1.800 . 6.000 3.086 2.814 3.663 . 0 0 "[ . 1]" 1 392 1 90 LEU H 1 90 LEU HA 1.800 . 3.000 2.921 2.899 2.948 . 0 0 "[ . 1]" 1 393 1 86 ALA HA 1 90 LEU H 1.800 . 5.000 4.256 3.424 4.895 . 0 0 "[ . 1]" 1 394 1 87 ARG HA 1 90 LEU H 1.800 . 5.000 4.083 3.702 4.808 . 0 0 "[ . 1]" 1 395 1 89 GLU HG3 1 90 LEU H 1.800 . 6.000 4.244 2.134 4.687 . 0 0 "[ . 1]" 1 396 1 89 GLU HG2 1 90 LEU H 1.800 . 6.000 4.129 2.335 4.670 . 0 0 "[ . 1]" 1 397 1 89 GLU QB 1 90 LEU H 1.800 . 6.000 2.222 1.981 3.351 . 0 0 "[ . 1]" 1 398 1 91 ASN H 1 91 ASN HA 1.800 . 3.000 2.320 2.273 2.726 . 0 0 "[ . 1]" 1 399 1 90 LEU HB3 1 91 ASN H 1.800 . 4.500 3.964 2.125 4.248 . 0 0 "[ . 1]" 1 400 1 90 LEU HB2 1 91 ASN H 1.800 . 4.500 4.101 2.916 4.511 0.011 10 0 "[ . 1]" 1 401 1 87 ARG HA 1 91 ASN H 1.800 . 3.500 3.018 2.760 3.511 0.011 6 0 "[ . 1]" 1 402 1 89 GLU QB 1 91 ASN H 1.800 . 6.000 4.048 3.719 4.936 . 0 0 "[ . 1]" 1 403 1 91 ASN HA 1 92 VAL H 1.800 . 3.500 2.815 2.499 3.019 . 0 0 "[ . 1]" 1 404 1 87 ARG HA 1 92 VAL H 1.800 . 3.000 2.495 2.084 2.960 . 0 0 "[ . 1]" 1 405 1 91 ASN QB 1 92 VAL H 1.800 . 6.000 3.835 3.710 3.909 . 0 0 "[ . 1]" 1 406 1 92 VAL HA 1 93 GLU H 1.800 . 3.500 3.247 2.147 3.530 0.030 9 0 "[ . 1]" 1 407 1 92 VAL MG1 1 93 GLU H 1.800 . 6.500 3.491 1.910 4.114 . 0 0 "[ . 1]" 1 408 1 92 VAL MG2 1 93 GLU H 1.800 . 6.500 3.227 1.924 4.094 . 0 0 "[ . 1]" 1 409 1 86 ALA MB 1 93 GLU H 1.800 . 5.000 2.931 2.203 4.096 . 0 0 "[ . 1]" 1 410 1 94 ILE HA 1 95 ASP H 1.800 . 5.000 2.947 2.904 2.978 . 0 0 "[ . 1]" 1 411 1 92 VAL HA 1 95 ASP H 1.800 . 5.000 4.837 4.558 5.028 0.028 10 0 "[ . 1]" 1 412 1 94 ILE HB 1 95 ASP H 1.800 . 5.000 4.459 4.445 4.495 . 0 0 "[ . 1]" 1 413 1 94 ILE HG13 1 95 ASP H 1.800 . 6.000 3.733 3.691 3.751 . 0 0 "[ . 1]" 1 414 1 94 ILE HG12 1 95 ASP H 1.800 . 6.000 4.510 4.410 4.870 . 0 0 "[ . 1]" 1 415 1 94 ILE MG 1 95 ASP H 1.800 . 6.000 4.302 4.287 4.329 . 0 0 "[ . 1]" 1 416 1 94 ILE MD 1 95 ASP H 1.800 . 6.000 5.055 4.907 5.082 . 0 0 "[ . 1]" 1 417 1 93 GLU QG 1 95 ASP H 1.800 . 6.000 3.702 2.099 4.549 . 0 0 "[ . 1]" 1 418 1 96 ALA H 1 96 ALA HA 1.800 . 3.100 2.945 2.941 2.948 . 0 0 "[ . 1]" 1 419 1 94 ILE HA 1 96 ALA H 1.800 . 5.000 3.768 3.693 3.958 . 0 0 "[ . 1]" 1 420 1 95 ASP HB3 1 96 ALA H 1.800 . 5.000 3.914 3.135 4.282 . 0 0 "[ . 1]" 1 421 1 95 ASP HB2 1 96 ALA H 1.800 . 5.000 4.140 3.961 4.508 . 0 0 "[ . 1]" 1 422 1 93 GLU QG 1 96 ALA H 1.800 . 6.000 4.632 3.206 5.341 . 0 0 "[ . 1]" 1 423 1 93 GLU HB3 1 96 ALA H 1.800 . 6.000 5.708 4.217 6.015 0.015 2 0 "[ . 1]" 1 424 1 93 GLU HB2 1 96 ALA H 1.800 . 6.000 4.856 3.778 5.898 . 0 0 "[ . 1]" 1 425 1 94 ILE HA 1 97 LEU H 1.800 . 5.000 4.169 3.699 4.363 . 0 0 "[ . 1]" 1 426 1 96 ALA HA 1 97 LEU H 1.800 . 3.500 3.430 3.075 3.522 0.022 6 0 "[ . 1]" 1 427 1 96 ALA MB 1 97 LEU H 1.800 . 4.500 2.916 2.601 3.548 . 0 0 "[ . 1]" 1 428 1 97 LEU HA 1 98 SER H 1.800 . 3.500 3.484 3.242 3.526 0.026 7 0 "[ . 1]" 1 429 1 97 LEU HB3 1 98 SER H 1.800 . 4.500 2.634 2.238 4.055 . 0 0 "[ . 1]" 1 430 1 97 LEU HB2 1 98 SER H 1.800 . 4.500 2.360 1.984 3.748 . 0 0 "[ . 1]" 1 431 1 97 LEU MD1 1 98 SER H 1.800 . 6.000 3.973 3.714 4.657 . 0 0 "[ . 1]" 1 432 1 97 LEU MD2 1 98 SER H 1.800 . 6.000 4.136 4.037 4.435 . 0 0 "[ . 1]" 1 433 1 99 TRP H 1 99 TRP HA 1.800 . 3.100 2.933 2.910 2.945 . 0 0 "[ . 1]" 1 434 1 99 TRP H 1 121 LEU HA 1.800 . 5.000 4.844 4.409 5.008 0.008 2 0 "[ . 1]" 1 435 1 98 SER QB 1 99 TRP H 1.800 . 4.500 3.560 3.198 3.812 . 0 0 "[ . 1]" 1 436 1 97 LEU HB3 1 99 TRP H 1.800 . 6.000 6.013 6.003 6.024 0.024 2 0 "[ . 1]" 1 437 1 97 LEU HB2 1 99 TRP H 1.800 . 6.000 5.841 5.629 6.000 . 0 0 "[ . 1]" 1 438 1 99 TRP HA 1 100 ARG H 1.800 . 3.000 2.389 2.278 2.519 . 0 0 "[ . 1]" 1 439 1 100 ARG H 1 120 GLU HA 1.800 . 5.500 4.626 4.461 4.907 . 0 0 "[ . 1]" 1 440 1 100 ARG H 1 121 LEU HA 1.800 . 4.000 3.892 3.697 4.010 0.010 2 0 "[ . 1]" 1 441 1 100 ARG H 1 119 TYR HA 1.800 . 5.500 4.415 4.118 4.517 . 0 0 "[ . 1]" 1 442 1 99 TRP HB3 1 100 ARG H 1.800 . 4.000 3.741 2.369 4.007 0.007 1 0 "[ . 1]" 1 443 1 99 TRP HB2 1 100 ARG H 1.800 . 4.000 2.708 2.295 3.802 . 0 0 "[ . 1]" 1 444 1 99 TRP HE3 1 100 ARG H 1.800 . 4.000 3.396 2.787 3.986 . 0 0 "[ . 1]" 1 445 1 102 LEU H 1 119 TYR HA 1.800 . 3.500 2.084 1.945 2.558 . 0 0 "[ . 1]" 1 446 1 101 PRO HA 1 102 LEU H 1.800 . 3.500 2.185 2.146 2.226 . 0 0 "[ . 1]" 1 447 1 102 LEU H 1 102 LEU HA 2.500 . 3.500 2.865 2.785 2.945 . 0 0 "[ . 1]" 1 448 1 101 PRO HB3 1 102 LEU H 1.800 . 6.000 4.047 3.618 4.287 . 0 0 "[ . 1]" 1 449 1 102 LEU H 1 103 ALA MB 1.800 . 6.000 4.532 3.752 4.899 . 0 0 "[ . 1]" 1 450 1 102 LEU H 1 118 VAL MG1 1.800 . 6.000 3.863 3.222 4.502 . 0 0 "[ . 1]" 1 451 1 103 ALA H 1 119 TYR HA 1.800 . 5.000 3.822 3.603 4.028 . 0 0 "[ . 1]" 1 452 1 101 PRO HA 1 103 ALA H 1.800 . 3.500 3.530 3.508 3.544 0.044 6 0 "[ . 1]" 1 453 1 102 LEU HA 1 103 ALA H 1.800 . 3.500 3.478 3.355 3.513 0.013 1 0 "[ . 1]" 1 454 1 101 PRO HB3 1 103 ALA H 1.800 . 6.000 4.274 3.906 4.697 . 0 0 "[ . 1]" 1 455 1 102 LEU MD1 1 103 ALA H 1.800 . 6.000 4.693 3.960 4.969 . 0 0 "[ . 1]" 1 456 1 102 LEU MD2 1 103 ALA H 1.800 . 6.000 4.456 3.594 4.969 . 0 0 "[ . 1]" 1 457 1 103 ALA H 1 118 VAL MG1 1.800 . 6.000 3.714 2.196 4.459 . 0 0 "[ . 1]" 1 458 1 103 ALA HA 1 104 SER H 1.800 . 3.000 2.683 2.387 2.876 . 0 0 "[ . 1]" 1 459 1 103 ALA MB 1 104 SER H 1.800 . 4.500 2.045 1.929 2.474 . 0 0 "[ . 1]" 1 460 1 104 SER HA 1 105 PHE H 1.800 . 3.500 2.190 2.144 2.302 . 0 0 "[ . 1]" 1 461 1 105 PHE H 1 117 CYS HA 1.800 . 3.500 2.796 2.506 3.166 . 0 0 "[ . 1]" 1 462 1 104 SER HB3 1 105 PHE H 1.800 . 6.000 3.848 2.886 4.333 . 0 0 "[ . 1]" 1 463 1 104 SER HB2 1 105 PHE H 1.800 . 6.000 3.712 3.215 4.379 . 0 0 "[ . 1]" 1 464 1 105 PHE H 1 112 LEU MD1 1.800 . 6.000 4.127 2.612 4.834 . 0 0 "[ . 1]" 1 465 1 105 PHE H 1 112 LEU MD2 1.800 . 6.000 4.463 2.671 4.900 . 0 0 "[ . 1]" 1 466 1 105 PHE HA 1 106 SER H 1.800 . 3.000 2.215 2.127 2.392 . 0 0 "[ . 1]" 1 467 1 105 PHE HB3 1 106 SER H 1.800 . 6.000 3.313 2.460 4.074 . 0 0 "[ . 1]" 1 468 1 105 PHE HB2 1 106 SER H 1.800 . 6.000 4.222 3.416 4.646 . 0 0 "[ . 1]" 1 469 1 107 PRO HA 1 108 PHE H 1.800 . 5.000 3.021 2.161 3.574 . 0 0 "[ . 1]" 1 470 1 107 PRO QB 1 108 PHE H 1.800 . 6.000 3.116 1.839 3.967 . 0 0 "[ . 1]" 1 471 1 108 PHE HA 1 109 GLN H 1.800 . 5.000 3.427 2.323 3.568 . 0 0 "[ . 1]" 1 472 1 108 PHE HA 1 110 THR H 1.800 . 6.000 4.809 3.738 5.523 . 0 0 "[ . 1]" 1 473 1 109 GLN QB 1 110 THR H 1.800 . 4.500 3.388 2.403 4.038 . 0 0 "[ . 1]" 1 474 1 109 GLN QG 1 110 THR H 1.800 . 6.000 4.394 3.938 4.628 . 0 0 "[ . 1]" 1 475 1 110 THR HB 1 111 THR H 1.800 . 3.500 2.835 2.199 3.508 0.008 1 0 "[ . 1]" 1 476 1 111 THR MG 1 112 LEU H 1.800 . 5.000 3.690 2.441 4.200 . 0 0 "[ . 1]" 1 477 1 112 LEU H 1 116 MET ME 1.800 . 6.000 4.812 4.414 4.904 . 0 0 "[ . 1]" 1 478 1 112 LEU HA 1 113 SER H 1.800 . 3.000 2.513 2.164 2.848 . 0 0 "[ . 1]" 1 479 1 112 LEU QB 1 113 SER H 1.800 . 6.000 2.398 1.976 3.041 . 0 0 "[ . 1]" 1 480 1 112 LEU MD2 1 113 SER H 1.800 . 6.000 4.012 3.384 4.878 . 0 0 "[ . 1]" 1 481 1 112 LEU MD1 1 113 SER H 1.800 . 6.000 4.495 4.113 5.004 . 0 0 "[ . 1]" 1 482 1 113 SER H 1 116 MET ME 1.800 . 5.000 2.866 2.421 3.854 . 0 0 "[ . 1]" 1 483 1 113 SER HA 1 114 SER H 1.800 . 3.500 3.324 3.055 3.482 . 0 0 "[ . 1]" 1 484 1 112 LEU HA 1 114 SER H 1.800 . 5.000 4.165 3.672 4.531 . 0 0 "[ . 1]" 1 485 1 112 LEU MD2 1 114 SER H 1.800 . 6.000 4.086 2.229 4.446 . 0 0 "[ . 1]" 1 486 1 112 LEU MD1 1 114 SER H 1.800 . 6.000 4.213 3.686 4.959 . 0 0 "[ . 1]" 1 487 1 114 SER H 1 116 MET ME 1.800 . 4.500 3.332 2.834 3.682 . 0 0 "[ . 1]" 1 488 1 114 SER HA 1 115 PHE H 1.800 . 3.000 2.609 2.324 2.781 . 0 0 "[ . 1]" 1 489 1 34 VAL HA 1 115 PHE H 1.800 . 5.000 4.857 4.684 4.985 . 0 0 "[ . 1]" 1 490 1 114 SER QB 1 115 PHE H 1.800 . 4.500 2.414 1.978 2.892 . 0 0 "[ . 1]" 1 491 1 115 PHE HA 1 116 MET H 1.800 . 3.000 2.209 2.168 2.285 . 0 0 "[ . 1]" 1 492 1 105 PHE HB3 1 116 MET H 1.800 . 6.000 4.458 3.378 5.917 . 0 0 "[ . 1]" 1 493 1 105 PHE HB2 1 116 MET H 1.800 . 6.000 4.122 3.316 4.826 . 0 0 "[ . 1]" 1 494 1 37 VAL HA 1 117 CYS H 1.800 . 3.500 2.435 2.233 2.833 . 0 0 "[ . 1]" 1 495 1 117 CYS HA 1 118 VAL H 1.800 . 3.000 2.387 2.280 2.461 . 0 0 "[ . 1]" 1 496 1 101 PRO HA 1 118 VAL H 1.800 . 5.000 5.006 4.909 5.034 0.034 2 0 "[ . 1]" 1 497 1 117 CYS HB3 1 118 VAL H 1.800 . 4.500 2.671 2.315 3.678 . 0 0 "[ . 1]" 1 498 1 117 CYS HB2 1 118 VAL H 1.800 . 4.500 3.849 3.568 4.094 . 0 0 "[ . 1]" 1 499 1 118 VAL HA 1 119 TYR H 1.800 . 3.000 2.141 2.122 2.171 . 0 0 "[ . 1]" 1 500 1 39 ALA HA 1 119 TYR H 1.800 . 3.500 2.059 1.906 2.196 . 0 0 "[ . 1]" 1 501 1 118 VAL HB 1 119 TYR H 3.500 . 6.500 4.235 4.157 4.368 . 0 0 "[ . 1]" 1 502 1 118 VAL MG1 1 119 TYR H 1.800 . 5.000 2.926 2.514 3.958 . 0 0 "[ . 1]" 1 503 1 118 VAL MG2 1 119 TYR H 1.800 . 6.000 4.041 2.701 4.231 . 0 0 "[ . 1]" 1 504 1 119 TYR HA 1 120 GLU H 1.800 . 3.000 2.342 2.162 2.572 . 0 0 "[ . 1]" 1 505 1 101 PRO HA 1 120 GLU H 1.800 . 3.500 3.457 3.242 3.514 0.014 2 0 "[ . 1]" 1 506 1 119 TYR HB3 1 120 GLU H 1.800 . 6.000 2.650 2.097 3.206 . 0 0 "[ . 1]" 1 507 1 119 TYR HB2 1 120 GLU H 1.800 . 6.000 3.639 3.146 3.949 . 0 0 "[ . 1]" 1 508 1 120 GLU HA 1 121 LEU H 1.800 . 3.000 2.163 2.137 2.187 . 0 0 "[ . 1]" 1 509 1 41 LEU HA 1 121 LEU H 1.800 . 3.500 3.321 2.922 3.504 0.004 9 0 "[ . 1]" 1 510 1 120 GLU HB3 1 121 LEU H 1.800 . 5.000 3.886 3.521 4.543 . 0 0 "[ . 1]" 1 511 1 120 GLU HB2 1 121 LEU H 1.800 . 5.000 4.541 4.262 4.625 . 0 0 "[ . 1]" 1 512 1 121 LEU HA 1 122 ARG H 1.800 . 3.000 2.193 2.131 2.450 . 0 0 "[ . 1]" 1 513 1 99 TRP HA 1 122 ARG H 1.800 . 3.500 3.493 3.367 3.540 0.040 10 0 "[ . 1]" 1 514 1 98 SER QB 1 122 ARG H 1.800 . 6.000 3.899 3.530 4.764 . 0 0 "[ . 1]" 1 515 1 121 LEU QD 1 122 ARG H 1.800 . 6.400 3.220 2.285 4.152 . 0 0 "[ . 1]" 1 516 1 99 TRP HB3 1 122 ARG H 1.800 . 6.000 4.440 4.003 6.010 0.010 2 0 "[ . 1]" 1 517 1 99 TRP HB2 1 122 ARG H 1.800 . 6.000 5.246 4.956 5.968 . 0 0 "[ . 1]" 1 518 1 122 ARG HA 1 123 SER H 1.800 . 3.000 2.183 2.143 2.263 . 0 0 "[ . 1]" 1 519 1 43 ASN HA 1 123 SER H 1.800 . 4.000 3.564 3.218 4.001 0.001 1 0 "[ . 1]" 1 520 1 122 ARG HG3 1 123 SER H 1.800 . 6.000 4.749 2.688 5.567 . 0 0 "[ . 1]" 1 521 1 122 ARG HG2 1 123 SER H 1.800 . 6.000 4.239 3.366 4.852 . 0 0 "[ . 1]" 1 522 1 122 ARG QB 1 123 SER H 1.800 . 6.000 3.553 3.030 3.939 . 0 0 "[ . 1]" 1 523 1 97 LEU MD1 1 123 SER H 1.800 . 6.000 4.423 4.022 4.693 . 0 0 "[ . 1]" 1 524 1 41 LEU MD1 1 123 SER H 1.800 . 6.000 3.353 2.090 4.859 . 0 0 "[ . 1]" 1 525 1 41 LEU MD2 1 123 SER H 1.800 . 6.000 3.871 2.887 4.666 . 0 0 "[ . 1]" 1 526 1 123 SER HA 1 124 ASP H 1.800 . 3.500 2.535 2.232 2.717 . 0 0 "[ . 1]" 1 527 1 123 SER HB3 1 124 ASP H 1.800 . 6.000 3.147 2.408 3.702 . 0 0 "[ . 1]" 1 528 1 123 SER HB2 1 124 ASP H 1.800 . 6.000 3.210 2.150 4.170 . 0 0 "[ . 1]" 1 529 1 123 SER HB3 1 125 ALA H 1.800 . 5.500 4.434 3.252 5.511 0.011 2 0 "[ . 1]" 1 530 1 123 SER HB2 1 125 ALA H 1.800 . 5.500 4.828 3.517 5.517 0.017 5 0 "[ . 1]" 1 531 1 124 ASP HB3 1 125 ALA H 1.800 . 5.500 4.110 2.201 4.635 . 0 0 "[ . 1]" 1 532 1 124 ASP HB2 1 125 ALA H 1.800 . 5.500 4.212 2.942 4.670 . 0 0 "[ . 1]" 1 533 1 125 ALA HA 1 126 THR H 1.800 . 3.000 2.391 2.224 2.796 . 0 0 "[ . 1]" 1 534 1 125 ALA MB 1 126 THR H 1.800 . 6.000 2.553 1.967 2.885 . 0 0 "[ . 1]" 1 535 1 127 PRO HA 1 128 ILE H 1.800 . 3.500 2.790 2.334 3.555 0.055 4 0 "[ . 1]" 1 536 1 128 ILE HA 1 129 PHE H 1.800 . 3.000 2.505 2.217 2.665 . 0 0 "[ . 1]" 1 537 1 128 ILE HB 1 129 PHE H 1.800 . 4.000 2.739 1.943 4.021 0.021 4 0 "[ . 1]" 1 538 1 128 ILE HG13 1 129 PHE H 1.800 . 4.500 3.623 2.000 4.542 0.042 2 0 "[ . 1]" 1 539 1 128 ILE HG12 1 129 PHE H 1.800 . 4.500 4.199 2.293 4.511 0.011 2 0 "[ . 1]" 1 540 1 128 ILE MD 1 129 PHE H 1.800 . 6.000 3.486 2.278 4.889 . 0 0 "[ . 1]" 1 541 1 129 PHE HB3 1 130 ASN H 1.800 . 4.500 3.546 1.987 4.439 . 0 0 "[ . 1]" 1 542 1 129 PHE HB2 1 130 ASN H 1.800 . 4.500 4.023 2.199 4.542 0.042 8 0 "[ . 1]" 1 543 1 131 PRO HA 1 132 ASN H 1.800 . 3.500 3.101 2.736 3.550 0.050 7 0 "[ . 1]" 1 544 1 130 ASN HA 1 132 ASN H 1.800 . 4.000 3.569 3.174 3.890 . 0 0 "[ . 1]" 1 545 1 132 ASN H 1 132 ASN HA 1.800 . 3.000 2.804 2.283 2.944 . 0 0 "[ . 1]" 1 546 1 131 PRO HD3 1 132 ASN H 1.800 . 4.500 4.159 3.841 4.522 0.022 5 0 "[ . 1]" 1 547 1 131 PRO HD2 1 132 ASN H 1.800 . 4.500 3.212 2.658 3.881 . 0 0 "[ . 1]" 1 548 1 131 PRO HB3 1 132 ASN H 1.800 . 6.000 4.533 3.887 4.668 . 0 0 "[ . 1]" 1 549 1 131 PRO HB2 1 132 ASN H 1.800 . 6.000 4.036 2.906 4.310 . 0 0 "[ . 1]" 1 550 1 131 PRO HA 1 133 ASP H 1.800 . 5.000 4.524 3.999 4.763 . 0 0 "[ . 1]" 1 551 1 132 ASN HA 1 133 ASP H 1.800 . 3.500 3.495 3.188 3.540 0.040 3 0 "[ . 1]" 1 552 1 131 PRO HD3 1 133 ASP H 1.800 . 6.000 5.788 5.260 6.026 0.026 9 0 "[ . 1]" 1 553 1 131 PRO HD2 1 133 ASP H 1.800 . 6.000 4.952 4.157 5.407 . 0 0 "[ . 1]" 1 554 1 131 PRO HA 1 134 ILE H 1.800 . 5.500 4.846 4.132 5.384 . 0 0 "[ . 1]" 1 555 1 133 ASP HA 1 134 ILE H 1.800 . 5.000 3.545 3.474 3.569 . 0 0 "[ . 1]" 1 556 1 133 ASP HB3 1 134 ILE H 1.800 . 6.000 2.705 2.268 3.225 . 0 0 "[ . 1]" 1 557 1 133 ASP HB2 1 134 ILE H 1.800 . 6.000 3.178 2.740 3.863 . 0 0 "[ . 1]" 1 558 1 134 ILE HA 1 135 SER H 1.800 . 3.000 2.353 2.133 3.098 0.098 7 0 "[ . 1]" 1 559 1 134 ILE HB 1 135 SER H 1.800 . 5.000 4.160 3.808 4.516 . 0 0 "[ . 1]" 1 560 1 134 ILE MG 1 135 SER H 1.800 . 5.000 3.836 3.272 4.140 . 0 0 "[ . 1]" 1 561 1 134 ILE MD 1 135 SER H 1.800 . 6.000 4.257 3.290 4.785 . 0 0 "[ . 1]" 1 562 1 134 ILE MG 1 136 GLY H 1.800 . 4.500 3.221 2.741 3.578 . 0 0 "[ . 1]" 1 563 1 136 GLY HA3 1 137 GLY H 1.800 . 4.000 3.189 2.618 3.444 . 0 0 "[ . 1]" 1 564 1 136 GLY HA2 1 137 GLY H 1.800 . 4.000 2.223 2.131 2.513 . 0 0 "[ . 1]" 1 565 1 134 ILE MG 1 137 GLY H 1.800 . 6.000 4.461 3.827 4.754 . 0 0 "[ . 1]" 1 566 1 137 GLY HA3 1 138 GLU H 1.800 . 4.000 2.229 2.135 2.491 . 0 0 "[ . 1]" 1 567 1 137 GLY HA2 1 138 GLU H 1.800 . 4.000 3.019 2.621 3.326 . 0 0 "[ . 1]" 1 568 1 138 GLU HA 1 139 TRP H 1.800 . 3.000 2.461 2.305 2.536 . 0 0 "[ . 1]" 1 569 1 138 GLU HB3 1 139 TRP H 1.800 . 4.500 3.076 2.628 3.406 . 0 0 "[ . 1]" 1 570 1 138 GLU HB2 1 139 TRP H 1.800 . 4.500 3.926 3.839 4.148 . 0 0 "[ . 1]" 1 571 1 138 GLU QG 1 139 TRP H 1.800 . 6.000 2.103 1.908 2.550 . 0 0 "[ . 1]" 1 572 1 139 TRP HA 1 140 LEU H 1.800 . 3.500 2.185 2.171 2.192 . 0 0 "[ . 1]" 1 573 1 140 LEU HA 1 141 THR H 1.800 . 3.000 2.527 2.438 2.593 . 0 0 "[ . 1]" 1 574 1 140 LEU HB3 1 141 THR H 1.800 . 6.000 2.596 2.074 3.284 . 0 0 "[ . 1]" 1 575 1 140 LEU HB2 1 141 THR H 1.800 . 6.000 2.916 2.083 3.498 . 0 0 "[ . 1]" 1 576 1 140 LEU MD1 1 141 THR H 1.800 . 6.000 4.179 3.782 4.482 . 0 0 "[ . 1]" 1 577 1 140 LEU MD2 1 141 THR H 1.800 . 6.000 3.830 3.206 4.656 . 0 0 "[ . 1]" 1 578 1 141 THR H 1 144 HIS HB3 1.800 . 4.500 3.439 2.884 4.006 . 0 0 "[ . 1]" 1 579 1 141 THR H 1 144 HIS HB2 1.800 . 4.500 2.841 2.186 3.201 . 0 0 "[ . 1]" 1 580 1 143 GLU H 1 143 GLU HA 1.800 . 3.000 2.842 2.808 2.864 . 0 0 "[ . 1]" 1 581 1 141 THR MG 1 143 GLU H 1.800 . 4.500 3.156 1.988 3.677 . 0 0 "[ . 1]" 1 582 1 142 PRO HD3 1 143 GLU H 1.800 . 4.500 4.000 3.758 4.227 . 0 0 "[ . 1]" 1 583 1 142 PRO HD2 1 143 GLU H 1.800 . 4.500 2.856 2.397 3.158 . 0 0 "[ . 1]" 1 584 1 142 PRO HA 1 143 GLU H 1.800 . 3.500 3.522 3.513 3.540 0.040 5 0 "[ . 1]" 1 585 1 143 GLU HA 1 144 HIS H 1.800 . 3.500 3.519 3.502 3.536 0.036 3 0 "[ . 1]" 1 586 1 143 GLU QB 1 144 HIS H 1.800 . 4.500 2.886 2.532 3.409 . 0 0 "[ . 1]" 1 587 1 143 GLU QG 1 144 HIS H 1.800 . 6.000 3.576 1.971 4.393 . 0 0 "[ . 1]" 1 588 1 144 HIS HA 1 145 LEU H 1.800 . 5.000 3.523 3.488 3.551 . 0 0 "[ . 1]" 1 589 1 142 PRO HA 1 145 LEU H 1.800 . 4.500 3.545 3.321 3.831 . 0 0 "[ . 1]" 1 590 1 145 LEU H 1 145 LEU HA 1.800 . 3.000 2.800 2.777 2.809 . 0 0 "[ . 1]" 1 591 1 144 HIS HB3 1 145 LEU H 1.800 . 4.500 3.063 2.554 3.815 . 0 0 "[ . 1]" 1 592 1 144 HIS HB2 1 145 LEU H 1.800 . 4.500 3.223 2.723 3.651 . 0 0 "[ . 1]" 1 593 1 146 LEU H 1 146 LEU HA 1.800 . 3.000 2.816 2.799 2.845 . 0 0 "[ . 1]" 1 594 1 146 LEU HA 1 147 ALA H 1.800 . 3.500 3.504 3.493 3.518 0.018 4 0 "[ . 1]" 1 595 1 147 ALA H 1 147 ALA HA 1.800 . 3.000 2.835 2.804 2.847 . 0 0 "[ . 1]" 1 596 1 144 HIS HA 1 147 ALA H 1.800 . 3.500 3.445 3.297 3.503 0.003 2 0 "[ . 1]" 1 597 1 146 LEU HB3 1 147 ALA H 1.800 . 6.000 3.243 2.738 3.565 . 0 0 "[ . 1]" 1 598 1 146 LEU HB2 1 147 ALA H 1.800 . 6.000 3.122 2.854 3.631 . 0 0 "[ . 1]" 1 599 1 146 LEU MD1 1 147 ALA H 1.800 . 6.000 4.618 4.366 4.874 . 0 0 "[ . 1]" 1 600 1 146 LEU MD2 1 147 ALA H 1.800 . 6.000 4.484 4.159 4.865 . 0 0 "[ . 1]" 1 601 1 148 ARG H 1 148 ARG HA 1.800 . 3.000 2.857 2.814 2.883 . 0 0 "[ . 1]" 1 602 1 149 ILE H 1 149 ILE HA 1.800 . 3.000 2.803 2.780 2.855 . 0 0 "[ . 1]" 1 603 1 150 ALA H 1 150 ALA HA 1.800 . 3.000 2.860 2.820 2.886 . 0 0 "[ . 1]" 1 604 1 149 ILE HA 1 150 ALA H 1.800 . 5.000 3.482 3.469 3.498 . 0 0 "[ . 1]" 1 605 1 151 ALA H 1 151 ALA HA 1.800 . 3.000 2.816 2.779 2.868 . 0 0 "[ . 1]" 1 606 1 150 ALA HA 1 151 ALA H 1.800 . 3.500 3.505 3.480 3.534 0.034 10 0 "[ . 1]" 1 607 1 148 ARG HA 1 151 ALA H 1.800 . 4.000 3.491 3.313 3.671 . 0 0 "[ . 1]" 1 608 1 151 ALA MB 1 152 GLY H 1.800 . 4.500 2.354 1.953 2.871 . 0 0 "[ . 1]" 1 609 1 153 GLU H 1 153 GLU HA 1.800 . 3.000 2.932 2.921 2.947 . 0 0 "[ . 1]" 1 610 1 152 GLY HA3 1 153 GLU H 1.800 . 6.000 3.561 3.548 3.570 . 0 0 "[ . 1]" 1 611 1 152 GLY HA2 1 153 GLU H 1.800 . 6.000 2.606 2.449 2.772 . 0 0 "[ . 1]" 1 612 1 153 GLU HA 1 154 ALA H 1.800 . 3.000 2.868 2.598 2.994 . 0 0 "[ . 1]" 1 613 1 153 GLU HB3 1 154 ALA H 1.800 . 4.500 4.193 4.074 4.335 . 0 0 "[ . 1]" 1 614 1 153 GLU HB2 1 154 ALA H 1.800 . 4.500 4.363 4.193 4.597 0.097 2 0 "[ . 1]" 1 615 1 153 GLU HG3 1 154 ALA H 1.800 . 6.000 5.371 4.233 5.926 . 0 0 "[ . 1]" 1 616 1 153 GLU HG2 1 154 ALA H 1.800 . 6.000 5.246 4.819 5.983 . 0 0 "[ . 1]" 1 617 1 154 ALA HA 1 155 ALA H 1.800 . 3.000 2.837 2.311 3.020 0.020 7 0 "[ . 1]" 1 618 1 154 ALA MB 1 155 ALA H 1.800 . 4.500 3.618 3.566 3.671 . 0 0 "[ . 1]" 1 619 1 155 ALA HA 1 156 LYS H 1.800 . 3.000 2.929 2.644 3.012 0.012 5 0 "[ . 1]" 1 620 1 154 ALA HA 1 156 LYS H 1.800 . 3.500 3.333 3.151 3.533 0.033 3 0 "[ . 1]" 1 621 1 155 ALA MB 1 156 LYS H 1.800 . 4.500 3.618 3.580 3.709 . 0 0 "[ . 1]" 1 622 1 158 ASP HA 1 159 LEU H 1.800 . 5.000 3.528 3.497 3.557 . 0 0 "[ . 1]" 1 623 1 159 LEU H 1 159 LEU HA 1.800 . 3.000 2.814 2.790 2.856 . 0 0 "[ . 1]" 1 624 1 157 GLY HA3 1 159 LEU H 1.800 . 5.000 4.471 3.458 4.878 . 0 0 "[ . 1]" 1 625 1 157 GLY HA2 1 159 LEU H 1.800 . 5.000 4.476 4.255 4.677 . 0 0 "[ . 1]" 1 626 1 158 ASP HB3 1 159 LEU H 1.800 . 6.000 2.995 2.437 3.961 . 0 0 "[ . 1]" 1 627 1 158 ASP HB2 1 159 LEU H 1.800 . 6.000 3.435 2.818 3.909 . 0 0 "[ . 1]" 1 628 1 159 LEU HA 1 160 ALA H 1.800 . 5.000 3.565 3.554 3.573 . 0 0 "[ . 1]" 1 629 1 160 ALA H 1 160 ALA HA 1.800 . 3.000 2.789 2.754 2.827 . 0 0 "[ . 1]" 1 630 1 161 GLU H 1 161 GLU HA 1.800 . 3.000 2.824 2.782 2.866 . 0 0 "[ . 1]" 1 631 1 160 ALA HA 1 161 GLU H 1.800 . 5.000 3.536 3.489 3.567 . 0 0 "[ . 1]" 1 632 1 158 ASP HA 1 161 GLU H 1.800 . 5.000 3.688 3.516 4.013 . 0 0 "[ . 1]" 1 633 1 160 ALA MB 1 161 GLU H 1.800 . 5.000 2.585 2.288 2.829 . 0 0 "[ . 1]" 1 634 1 162 LEU H 1 162 LEU HA 1.800 . 3.000 2.835 2.787 2.872 . 0 0 "[ . 1]" 1 635 1 161 GLU HA 1 162 LEU H 1.800 . 5.000 3.515 3.482 3.566 . 0 0 "[ . 1]" 1 636 1 161 GLU HB3 1 162 LEU H 1.800 . 6.000 2.992 2.607 3.372 . 0 0 "[ . 1]" 1 637 1 161 GLU HB2 1 162 LEU H 1.800 . 6.000 3.378 2.566 3.928 . 0 0 "[ . 1]" 1 638 1 160 ALA HA 1 163 VAL H 1.800 . 5.000 3.680 3.349 3.994 . 0 0 "[ . 1]" 1 639 1 160 ALA MB 1 163 VAL H 1.800 . 6.000 4.807 4.540 5.030 . 0 0 "[ . 1]" 1 640 1 162 LEU HA 1 163 VAL H 1.800 . 5.000 3.550 3.494 3.574 . 0 0 "[ . 1]" 1 641 1 163 VAL H 1 163 VAL HA 1.800 . 3.000 2.812 2.766 2.872 . 0 0 "[ . 1]" 1 642 1 162 LEU QB 1 163 VAL H 1.800 . 4.500 2.445 2.155 2.740 . 0 0 "[ . 1]" 1 643 1 160 ALA HA 1 164 ARG H 1.800 . 5.000 4.083 3.814 4.361 . 0 0 "[ . 1]" 1 644 1 163 VAL HA 1 164 ARG H 1.800 . 5.000 3.524 3.470 3.554 . 0 0 "[ . 1]" 1 645 1 164 ARG H 1 164 ARG HA 1.800 . 3.000 2.846 2.811 2.878 . 0 0 "[ . 1]" 1 646 1 163 VAL MG1 1 164 ARG H 1.800 . 6.000 3.764 3.617 4.022 . 0 0 "[ . 1]" 1 647 1 163 VAL MG2 1 164 ARG H 1.800 . 6.000 3.219 1.896 3.813 . 0 0 "[ . 1]" 1 648 1 164 ARG HA 1 165 ARG H 1.800 . 3.500 3.483 3.420 3.511 0.011 1 0 "[ . 1]" 1 649 1 165 ARG H 1 165 ARG HA 1.800 . 3.000 2.869 2.826 2.887 . 0 0 "[ . 1]" 1 650 1 165 ARG HA 1 166 CYS H 1.800 . 5.000 3.515 3.481 3.571 . 0 0 "[ . 1]" 1 651 1 166 CYS H 1 166 CYS HA 1.800 . 3.000 2.868 2.815 2.887 . 0 0 "[ . 1]" 1 652 1 163 VAL HA 1 166 CYS H 1.800 . 5.000 3.534 3.271 3.955 . 0 0 "[ . 1]" 1 653 1 167 TYR H 1 167 TYR HA 1.800 . 3.000 2.861 2.838 2.886 . 0 0 "[ . 1]" 1 654 1 166 CYS HA 1 167 TYR H 1.800 . 3.500 3.515 3.472 3.537 0.037 4 0 "[ . 1]" 1 655 1 164 ARG HA 1 167 TYR H 1.800 . 5.000 3.614 3.355 3.827 . 0 0 "[ . 1]" 1 656 1 163 VAL HA 1 167 TYR H 1.800 . 5.000 3.875 3.561 4.322 . 0 0 "[ . 1]" 1 657 1 168 ARG H 1 168 ARG HA 1.800 . 3.000 2.649 2.274 2.843 . 0 0 "[ . 1]" 1 658 1 164 ARG HA 1 168 ARG H 1.800 . 3.500 3.184 2.720 3.504 0.004 7 0 "[ . 1]" 1 659 1 167 TYR HB3 1 168 ARG H 1.800 . 4.500 2.667 2.344 3.048 . 0 0 "[ . 1]" 1 660 1 167 TYR HB2 1 168 ARG H 1.800 . 4.500 2.442 2.105 2.666 . 0 0 "[ . 1]" 1 661 1 168 ARG HA 1 169 GLU H 1.800 . 3.500 3.242 2.396 3.551 0.051 10 0 "[ . 1]" 1 662 1 168 ARG QG 1 169 GLU H 1.800 . 4.500 3.663 1.932 4.072 . 0 0 "[ . 1]" 1 663 1 169 GLU HA 1 170 GLU H 1.800 . 5.000 2.485 2.145 3.565 . 0 0 "[ . 1]" 1 664 1 13 ASN HD21 1 19 VAL MG1 1.800 . 5.500 2.697 1.915 3.454 . 0 0 "[ . 1]" 1 665 1 13 ASN HD21 1 17 GLU HB3 1.800 . 5.500 2.664 1.990 5.051 . 0 0 "[ . 1]" 1 666 1 13 ASN HD21 1 17 GLU HB2 1.800 . 5.500 3.829 2.582 5.448 . 0 0 "[ . 1]" 1 667 1 13 ASN HD22 1 19 VAL MG1 1.800 . 5.500 2.743 1.884 4.557 . 0 0 "[ . 1]" 1 668 1 13 ASN HD22 1 17 GLU HB3 1.800 . 5.500 3.369 1.905 4.585 . 0 0 "[ . 1]" 1 669 1 13 ASN HD22 1 17 GLU HB2 1.800 . 5.500 4.474 2.019 5.508 0.008 9 0 "[ . 1]" 1 670 1 18 VAL MG1 1 21 GLN HE21 1.800 . 5.500 2.540 1.969 3.236 . 0 0 "[ . 1]" 1 671 1 18 VAL MG1 1 21 GLN HE22 1.800 . 5.500 3.053 2.147 3.953 . 0 0 "[ . 1]" 1 672 1 29 LEU MD2 1 31 TRP HE1 1.800 . 4.500 2.369 1.783 2.810 0.017 2 0 "[ . 1]" 1 673 1 29 LEU MD2 1 31 TRP HD1 1.800 . 4.500 3.411 2.797 3.647 . 0 0 "[ . 1]" 1 674 1 31 TRP HE1 1 34 VAL MG1 1.800 . 6.000 4.365 2.635 4.811 . 0 0 "[ . 1]" 1 675 1 31 TRP HE1 1 34 VAL MG2 1.800 . 6.000 4.480 3.667 4.868 . 0 0 "[ . 1]" 1 676 1 94 ILE HG13 1 99 TRP HE1 1.800 . 6.000 3.781 3.308 4.599 . 0 0 "[ . 1]" 1 677 1 94 ILE HG12 1 99 TRP HE1 1.800 . 6.000 5.127 4.795 5.551 . 0 0 "[ . 1]" 1 678 1 94 ILE MG 1 99 TRP HE1 1.800 . 6.000 4.572 2.125 5.042 . 0 0 "[ . 1]" 1 679 1 94 ILE MD 1 99 TRP HE1 1.800 . 5.000 3.175 2.568 4.105 . 0 0 "[ . 1]" 1 680 1 94 ILE HB 1 99 TRP HD1 1.800 . 3.500 3.237 2.901 3.506 0.006 7 0 "[ . 1]" 1 681 1 94 ILE MG 1 99 TRP HD1 1.800 . 6.000 4.447 4.187 4.651 . 0 0 "[ . 1]" 1 682 1 94 ILE MD 1 99 TRP HD1 1.800 . 6.000 4.365 3.776 4.851 . 0 0 "[ . 1]" 1 683 1 4 VAL MG1 1 5 SER HA 1.800 . 6.000 4.150 3.311 5.051 . 0 0 "[ . 1]" 1 684 1 10 ASP HA 1 21 GLN HA 1.800 . 3.500 2.908 2.719 3.223 . 0 0 "[ . 1]" 1 685 1 10 ASP HA 1 21 GLN HG3 1.800 . 6.000 3.781 3.099 5.509 . 0 0 "[ . 1]" 1 686 1 10 ASP HA 1 21 GLN HG2 1.800 . 6.000 4.564 3.763 5.744 . 0 0 "[ . 1]" 1 687 1 10 ASP HA 1 21 GLN HB3 1.800 . 6.000 5.073 4.088 5.524 . 0 0 "[ . 1]" 1 688 1 10 ASP HA 1 21 GLN HB2 1.800 . 6.000 5.502 5.038 6.007 0.007 10 0 "[ . 1]" 1 689 1 10 ASP HA 1 18 VAL MG1 1.800 . 6.000 3.548 3.353 3.819 . 0 0 "[ . 1]" 1 690 1 10 ASP HA 1 18 VAL MG2 1.800 . 6.000 4.765 4.475 4.872 . 0 0 "[ . 1]" 1 691 1 11 LEU HA 1 19 VAL MG1 2.500 2.500 6.700 5.424 5.280 5.480 . 0 0 "[ . 1]" 1 692 1 11 LEU HA 1 19 VAL MG2 2.500 2.500 6.700 3.975 3.862 4.161 . 0 0 "[ . 1]" 1 693 1 11 LEU QD 1 22 ILE MG 1.800 . 7.000 3.693 3.005 4.197 . 0 0 "[ . 1]" 1 694 1 12 VAL HB 1 18 VAL HA 1.800 . 6.000 3.000 2.768 3.410 . 0 0 "[ . 1]" 1 695 1 12 VAL HA 1 18 VAL HA 1.800 . 3.500 1.850 1.800 1.884 0.000 7 0 "[ . 1]" 1 696 1 12 VAL HA 1 18 VAL MG1 1.800 . 6.000 3.431 3.295 3.576 . 0 0 "[ . 1]" 1 697 1 12 VAL HA 1 18 VAL MG2 1.800 . 6.000 3.687 3.509 3.806 . 0 0 "[ . 1]" 1 698 1 13 ASN HA 1 19 VAL MG2 1.800 . 6.000 4.185 3.723 4.490 . 0 0 "[ . 1]" 1 699 1 12 VAL HB 1 16 ASP HA 1.800 . 5.000 4.405 3.825 4.995 . 0 0 "[ . 1]" 1 700 1 12 VAL MG1 1 16 ASP HA 1.800 . 5.000 3.800 3.563 4.039 . 0 0 "[ . 1]" 1 701 1 12 VAL MG2 1 16 ASP HA 1.800 . 6.000 3.329 2.001 4.903 . 0 0 "[ . 1]" 1 702 1 12 VAL MG1 1 18 VAL HA 1.800 . 6.000 3.300 1.903 4.248 . 0 0 "[ . 1]" 1 703 1 12 VAL MG1 1 18 VAL MG1 1.800 . 7.000 3.900 2.596 4.761 . 0 0 "[ . 1]" 1 704 1 12 VAL MG2 1 18 VAL MG2 1.800 . 7.000 3.259 2.594 4.048 . 0 0 "[ . 1]" 1 705 1 12 VAL MG1 1 18 VAL MG2 1.800 . 7.000 3.178 1.760 4.227 0.040 4 0 "[ . 1]" 1 706 1 12 VAL MG2 1 18 VAL MG1 1.800 . 7.000 4.336 4.009 4.743 . 0 0 "[ . 1]" 1 707 1 22 ILE MD 1 28 ALA MB 1.800 . 7.000 3.906 2.558 4.765 . 0 0 "[ . 1]" 1 708 1 22 ILE MD 1 29 LEU MD2 1.800 . 7.000 3.849 3.073 4.527 . 0 0 "[ . 1]" 1 709 1 22 ILE MD 1 29 LEU MD1 1.800 . 7.000 4.536 4.152 4.790 . 0 0 "[ . 1]" 1 710 1 22 ILE MG 1 29 LEU MD2 1.800 . 7.000 2.123 1.782 2.842 0.018 5 0 "[ . 1]" 1 711 1 22 ILE MG 1 29 LEU MD1 1.800 . 7.000 3.344 1.938 4.174 . 0 0 "[ . 1]" 1 712 1 24 ARG HB3 1 25 THR MG 1.800 . 7.000 3.934 2.987 5.232 . 0 0 "[ . 1]" 1 713 1 24 ARG HB2 1 25 THR MG 1.800 . 7.000 4.430 3.865 5.013 . 0 0 "[ . 1]" 1 714 1 24 ARG HG3 1 25 THR MG 1.800 . 7.000 4.268 2.257 5.715 . 0 0 "[ . 1]" 1 715 1 24 ARG HG2 1 25 THR MG 1.800 . 7.000 4.506 3.346 5.644 . 0 0 "[ . 1]" 1 716 1 26 ASP HA 1 27 PRO HD3 1.800 . 6.000 2.101 1.829 2.254 . 0 0 "[ . 1]" 1 717 1 26 ASP HA 1 27 PRO HD2 1.800 . 6.000 2.525 2.201 3.204 . 0 0 "[ . 1]" 1 718 1 26 ASP HA 1 27 PRO QG 1.800 . 6.000 3.884 3.662 3.975 . 0 0 "[ . 1]" 1 719 1 27 PRO HA 1 28 ALA MB 1.800 . 6.000 4.774 4.651 4.911 . 0 0 "[ . 1]" 1 720 1 22 ILE MD 1 29 LEU HA 1.800 . 5.500 3.494 2.075 4.178 . 0 0 "[ . 1]" 1 721 1 29 LEU MD2 1 34 VAL MG1 1.800 . 7.000 3.289 2.290 4.609 . 0 0 "[ . 1]" 1 722 1 29 LEU MD2 1 31 TRP HZ2 1.800 . 5.000 3.288 2.891 3.596 . 0 0 "[ . 1]" 1 723 1 29 LEU MD1 1 31 TRP HZ2 1.800 . 6.000 4.362 3.671 4.902 . 0 0 "[ . 1]" 1 724 1 29 LEU MD1 1 34 VAL MG1 1.800 . 7.000 3.104 1.665 4.554 0.135 8 0 "[ . 1]" 1 725 1 29 LEU MD1 1 34 VAL MG2 1.800 . 7.000 3.340 2.019 4.399 . 0 0 "[ . 1]" 1 726 1 29 LEU MD2 1 31 TRP HA 1.800 . 6.000 4.555 4.194 4.872 . 0 0 "[ . 1]" 1 727 1 31 TRP HA 1 34 VAL MG2 1.800 . 6.000 2.193 1.837 3.183 . 0 0 "[ . 1]" 1 728 1 31 TRP HA 1 31 TRP HE3 1.800 . 5.000 3.498 2.857 4.983 . 0 0 "[ . 1]" 1 729 1 29 LEU MD2 1 31 TRP HH2 1.800 . 6.000 4.738 3.947 4.968 . 0 0 "[ . 1]" 1 730 1 24 ARG HD2 1 31 TRP HH2 1.800 . 6.500 5.705 2.910 6.504 0.004 8 0 "[ . 1]" 1 731 1 31 TRP HH2 1 71 ALA MB 1.800 . 4.500 2.566 2.045 3.150 . 0 0 "[ . 1]" 1 732 1 31 TRP HZ2 1 71 ALA MB 1.800 . 6.000 3.519 3.097 4.348 . 0 0 "[ . 1]" 1 733 1 31 TRP HZ3 1 36 VAL MG1 1.800 . 6.000 3.586 2.806 4.083 . 0 0 "[ . 1]" 1 734 1 31 TRP HH2 1 36 VAL MG1 1.800 . 6.500 3.478 2.214 4.283 . 0 0 "[ . 1]" 1 735 1 31 TRP HE3 1 36 VAL MG1 1.800 . 7.000 5.468 4.756 5.721 . 0 0 "[ . 1]" 1 736 1 31 TRP HZ3 1 34 VAL MG2 1.800 . 6.000 3.253 2.573 3.957 . 0 0 "[ . 1]" 1 737 1 31 TRP HE3 1 34 VAL MG2 1.800 . 6.000 2.519 2.079 3.176 . 0 0 "[ . 1]" 1 738 1 31 TRP HB3 1 34 VAL MG2 1.800 . 6.000 3.372 2.615 3.929 . 0 0 "[ . 1]" 1 739 1 31 TRP HB2 1 34 VAL MG2 1.800 . 6.000 4.184 3.927 4.618 . 0 0 "[ . 1]" 1 740 1 36 VAL HA 1 71 ALA HA 1.800 . 3.000 2.786 2.390 3.007 0.007 9 0 "[ . 1]" 1 741 1 36 VAL HA 1 71 ALA MB 1.800 . 6.000 3.816 3.138 4.247 . 0 0 "[ . 1]" 1 742 1 36 VAL MG1 1 114 SER HB3 1.800 . 7.000 4.869 4.388 5.295 . 0 0 "[ . 1]" 1 743 1 36 VAL MG1 1 114 SER HB2 1.800 . 7.000 5.062 4.267 5.715 . 0 0 "[ . 1]" 1 744 1 36 VAL MG1 1 71 ALA MB 1.800 . 7.000 2.655 1.959 3.507 . 0 0 "[ . 1]" 1 745 1 36 VAL MG1 1 71 ALA HA 1.800 . 6.000 2.116 1.919 2.539 . 0 0 "[ . 1]" 1 746 1 36 VAL MG2 1 114 SER HB3 1.800 . 7.000 2.500 2.087 2.812 . 0 0 "[ . 1]" 1 747 1 36 VAL MG2 1 114 SER HB2 1.800 . 7.000 3.098 2.345 3.656 . 0 0 "[ . 1]" 1 748 1 36 VAL MG2 1 71 ALA MB 1.800 . 7.000 3.415 2.607 3.993 . 0 0 "[ . 1]" 1 749 1 36 VAL MG2 1 71 ALA HA 1.800 . 6.000 3.809 3.335 4.366 . 0 0 "[ . 1]" 1 750 1 37 VAL MG2 1 119 TYR QD 1.800 . 8.400 5.303 5.106 5.560 . 0 0 "[ . 1]" 1 751 1 37 VAL MG2 1 119 TYR QE 1.800 . 7.400 4.137 3.567 5.163 . 0 0 "[ . 1]" 1 752 1 37 VAL MG2 1 78 TYR QD 1.800 . 7.000 2.558 1.934 4.586 . 0 0 "[ . 1]" 1 753 1 37 VAL MG2 1 78 TYR QE 1.800 . 8.000 3.403 2.376 4.897 . 0 0 "[ . 1]" 1 754 1 38 ASN HA 1 69 GLY HA3 1.800 . 3.500 3.081 2.853 3.374 . 0 0 "[ . 1]" 1 755 1 38 ASN HA 1 69 GLY HA2 1.800 . 3.500 2.095 1.883 2.306 . 0 0 "[ . 1]" 1 756 1 38 ASN HA 1 66 VAL MG1 1.800 . 6.000 3.959 3.185 4.366 . 0 0 "[ . 1]" 1 757 1 38 ASN HA 1 66 VAL MG2 1.800 . 6.000 3.471 2.573 4.034 . 0 0 "[ . 1]" 1 758 1 38 ASN HA 1 39 ALA MB 1.800 . 6.000 3.795 3.748 3.865 . 0 0 "[ . 1]" 1 759 1 39 ALA MB 1 68 VAL HB 1.800 . 4.500 2.735 2.035 3.337 . 0 0 "[ . 1]" 1 760 1 39 ALA MB 1 68 VAL MG2 1.800 . 7.000 3.652 3.135 4.047 . 0 0 "[ . 1]" 1 761 1 39 ALA MB 1 119 TYR QD 1.800 . 7.000 2.926 2.255 3.450 . 0 0 "[ . 1]" 1 762 1 39 ALA MB 1 119 TYR QE 1.800 . 7.000 4.802 4.310 5.263 . 0 0 "[ . 1]" 1 763 1 48 LEU MD1 1 167 TYR QE 1.800 . 7.500 3.746 3.009 5.117 . 0 0 "[ . 1]" 1 764 1 48 LEU MD1 1 167 TYR QD 1.800 . 8.000 5.045 4.179 5.634 . 0 0 "[ . 1]" 1 765 1 48 LEU MD2 1 167 TYR QE 1.800 . 8.000 3.755 1.918 5.389 . 0 0 "[ . 1]" 1 766 1 48 LEU MD1 1 50 ILE MD 1.800 . 7.000 2.851 1.887 4.335 . 0 0 "[ . 1]" 1 767 1 54 SER HA 1 55 PRO QD 1.800 . 6.000 2.367 1.924 3.543 . 0 0 "[ . 1]" 1 768 1 38 ASN QB 1 66 VAL MG2 1.800 . 7.000 2.199 1.783 3.035 0.017 6 0 "[ . 1]" 1 769 1 66 VAL MG2 1 69 GLY HA3 1.800 . 6.000 3.344 2.786 4.456 . 0 0 "[ . 1]" 1 770 1 66 VAL MG2 1 69 GLY HA2 1.800 . 6.000 4.086 3.328 4.896 . 0 0 "[ . 1]" 1 771 1 40 PHE HZ 1 66 VAL MG1 1.800 . 6.000 3.313 2.633 3.907 . 0 0 "[ . 1]" 1 772 1 68 VAL MG1 1 85 GLU HA 1.800 . 6.000 4.904 4.673 5.077 . 0 0 "[ . 1]" 1 773 1 68 VAL MG1 1 85 GLU HB3 1.800 . 7.000 3.167 2.802 4.147 . 0 0 "[ . 1]" 1 774 1 68 VAL MG1 1 85 GLU HB2 1.800 . 7.000 3.830 2.836 4.850 . 0 0 "[ . 1]" 1 775 1 66 VAL MG1 1 69 GLY HA2 1.800 . 7.000 5.256 4.169 5.750 . 0 0 "[ . 1]" 1 776 1 72 VAL HA 1 81 ALA MB 1.800 . 6.000 2.152 1.901 2.458 . 0 0 "[ . 1]" 1 777 1 72 VAL MG2 1 78 TYR QE 1.800 . 8.000 3.999 2.068 4.933 . 0 0 "[ . 1]" 1 778 1 72 VAL MG2 1 78 TYR HA 1.800 . 6.000 3.442 2.398 4.643 . 0 0 "[ . 1]" 1 779 1 37 VAL MG2 1 78 TYR HA 1.800 . 6.000 2.982 2.262 4.805 . 0 0 "[ . 1]" 1 780 1 72 VAL MG2 1 78 TYR QD 1.800 . 7.000 3.890 2.038 4.840 . 0 0 "[ . 1]" 1 781 1 35 ARG HA 1 78 TYR QE 1.800 . 7.400 4.511 3.637 5.628 . 0 0 "[ . 1]" 1 782 1 37 VAL MG1 1 81 ALA MB 1.800 . 7.000 3.634 2.575 4.401 . 0 0 "[ . 1]" 1 783 1 37 VAL MG2 1 81 ALA MB 1.800 . 7.000 2.369 1.832 2.844 . 0 0 "[ . 1]" 1 784 1 37 VAL HB 1 81 ALA MB 1.800 . 6.000 4.030 3.511 4.420 . 0 0 "[ . 1]" 1 785 1 78 TYR HA 1 81 ALA MB 1.800 . 6.000 2.643 2.189 3.223 . 0 0 "[ . 1]" 1 786 1 78 TYR QD 1 81 ALA MB 1.800 . 8.000 4.202 3.630 4.914 . 0 0 "[ . 1]" 1 787 1 83 ARG HA 1 86 ALA MB 1.800 . 6.000 2.871 2.407 3.254 . 0 0 "[ . 1]" 1 788 1 83 ARG HA 1 94 ILE MD 1.800 . 6.000 3.019 2.448 3.499 . 0 0 "[ . 1]" 1 789 1 83 ARG HA 1 94 ILE MG 1.800 . 6.500 2.674 2.180 3.292 . 0 0 "[ . 1]" 1 790 1 68 VAL MG1 1 86 ALA HA 1.800 . 6.000 3.669 3.293 4.132 . 0 0 "[ . 1]" 1 791 1 68 VAL MG2 1 86 ALA HA 1.800 . 6.000 4.682 4.455 4.860 . 0 0 "[ . 1]" 1 792 1 86 ALA HA 1 92 VAL MG2 1.800 . 6.000 4.002 3.010 4.907 . 0 0 "[ . 1]" 1 793 1 92 VAL HB 1 97 LEU MD1 1.800 . 6.000 4.462 3.818 5.018 . 0 0 "[ . 1]" 1 794 1 92 VAL MG1 1 94 ILE HA 2.500 2.500 6.700 3.348 2.607 4.825 . 0 0 "[ . 1]" 1 795 1 92 VAL MG1 1 94 ILE MG 1.800 . 7.000 3.588 2.554 4.691 . 0 0 "[ . 1]" 1 796 1 86 ALA MB 1 92 VAL MG1 1.800 . 7.000 3.080 1.711 4.072 0.089 3 0 "[ . 1]" 1 797 1 92 VAL MG2 1 94 ILE HA 2.500 2.500 6.700 4.285 2.582 5.357 . 0 0 "[ . 1]" 1 798 1 92 VAL MG2 1 94 ILE MG 1.800 . 7.000 3.945 2.456 4.730 . 0 0 "[ . 1]" 1 799 1 86 ALA MB 1 92 VAL MG2 1.800 . 7.000 2.972 1.878 3.944 . 0 0 "[ . 1]" 1 800 1 86 ALA MB 1 94 ILE MD 1.800 . 7.000 3.996 3.749 4.218 . 0 0 "[ . 1]" 1 801 1 94 ILE MD 1 99 TRP HZ2 1.800 . 6.000 2.835 2.145 3.648 . 0 0 "[ . 1]" 1 802 1 94 ILE MD 1 99 TRP HE3 1.800 . 6.000 4.504 3.947 4.822 . 0 0 "[ . 1]" 1 803 1 86 ALA MB 1 94 ILE MG 1.800 . 7.000 1.842 1.694 2.008 0.106 5 0 "[ . 1]" 1 804 1 93 GLU HB3 1 96 ALA MB 1.800 . 7.000 5.110 3.514 5.648 . 0 0 "[ . 1]" 1 805 1 93 GLU HB2 1 96 ALA MB 1.800 . 7.000 4.421 3.654 5.661 . 0 0 "[ . 1]" 1 806 1 93 GLU HG3 1 96 ALA MB 1.800 . 7.000 4.136 3.504 5.315 . 0 0 "[ . 1]" 1 807 1 93 GLU HG2 1 96 ALA MB 1.800 . 7.000 4.575 2.778 5.636 . 0 0 "[ . 1]" 1 808 1 96 ALA MB 1 97 LEU MD1 1.800 . 7.000 3.932 3.482 4.409 . 0 0 "[ . 1]" 1 809 1 96 ALA MB 1 97 LEU MD2 1.800 . 7.000 3.674 2.341 4.373 . 0 0 "[ . 1]" 1 810 1 99 TRP HA 1 121 LEU HA 1.800 . 3.000 2.352 1.976 2.520 . 0 0 "[ . 1]" 1 811 1 99 TRP HA 1 121 LEU QD 1.800 . 6.000 3.528 3.043 4.072 . 0 0 "[ . 1]" 1 812 1 99 TRP HE3 1 119 TYR QD 1.800 . 6.000 2.801 2.086 3.537 . 0 0 "[ . 1]" 1 813 1 99 TRP HE3 1 119 TYR QE 1.800 . 6.000 4.405 3.357 5.075 . 0 0 "[ . 1]" 1 814 1 99 TRP HZ3 1 119 TYR QE 1.800 . 6.000 2.971 2.091 3.901 . 0 0 "[ . 1]" 1 815 1 99 TRP HH2 1 119 TYR QE 1.800 . 7.400 4.426 3.871 5.298 . 0 0 "[ . 1]" 1 816 1 99 TRP HH2 1 119 TYR QD 1.800 . 7.400 4.810 3.983 5.224 . 0 0 "[ . 1]" 1 817 1 94 ILE MD 1 99 TRP HZ3 3.000 3.000 6.000 4.437 3.736 4.828 . 0 0 "[ . 1]" 1 818 1 101 PRO HA 1 119 TYR HA 1.800 . 3.000 1.977 1.911 2.024 . 0 0 "[ . 1]" 1 819 1 101 PRO HA 1 119 TYR QD 1.800 . 6.000 2.287 1.921 3.134 . 0 0 "[ . 1]" 1 820 1 104 SER HA 1 117 CYS HA 1.800 . 3.000 2.092 1.980 2.287 . 0 0 "[ . 1]" 1 821 1 105 PHE HA 1 110 THR MG 1.800 . 5.000 3.485 1.996 3.916 . 0 0 "[ . 1]" 1 822 1 110 THR HB 1 112 LEU MD1 1.800 . 6.000 2.915 1.863 4.041 . 0 0 "[ . 1]" 1 823 1 110 THR MG 1 112 LEU MD1 1.800 . 6.000 2.774 1.838 3.489 . 0 0 "[ . 1]" 1 824 1 105 PHE HB3 1 112 LEU MD1 1.800 . 7.000 2.450 1.879 3.810 . 0 0 "[ . 1]" 1 825 1 36 VAL MG2 1 116 MET HA 1.800 . 6.000 3.988 3.515 4.340 . 0 0 "[ . 1]" 1 826 1 78 TYR QE 1 116 MET HA 1.800 . 6.000 3.797 2.963 5.177 . 0 0 "[ . 1]" 1 827 1 78 TYR QD 1 116 MET HA 1.800 . 7.000 5.499 4.606 6.175 . 0 0 "[ . 1]" 1 828 1 114 SER HB3 1 116 MET ME 1.800 . 6.000 4.637 4.168 5.004 . 0 0 "[ . 1]" 1 829 1 114 SER HB2 1 116 MET ME 1.800 . 6.000 4.350 3.143 5.002 . 0 0 "[ . 1]" 1 830 1 112 LEU HA 1 116 MET ME 1.800 . 6.000 3.463 2.511 3.996 . 0 0 "[ . 1]" 1 831 1 112 LEU MD1 1 116 MET ME 1.800 . 6.000 3.404 2.576 3.894 . 0 0 "[ . 1]" 1 832 1 112 LEU MD2 1 116 MET ME 1.800 . 6.000 2.042 1.738 3.451 0.062 3 0 "[ . 1]" 1 833 1 36 VAL MG1 1 116 MET ME 1.800 . 6.000 3.566 2.491 3.964 . 0 0 "[ . 1]" 1 834 1 36 VAL MG2 1 116 MET ME 1.800 . 6.000 3.742 3.391 4.021 . 0 0 "[ . 1]" 1 835 1 104 SER HB3 1 117 CYS HA 1.800 . 7.000 3.504 2.466 4.655 . 0 0 "[ . 1]" 1 836 1 104 SER HB2 1 117 CYS HA 1.800 . 7.000 3.550 2.724 4.634 . 0 0 "[ . 1]" 1 837 1 118 VAL HA 1 119 TYR QD 1.800 . 5.900 3.631 3.058 4.117 . 0 0 "[ . 1]" 1 838 1 101 PRO HB3 1 119 TYR QD 1.800 . 6.900 2.693 2.135 3.357 . 0 0 "[ . 1]" 1 839 1 101 PRO HB2 1 119 TYR QD 1.800 . 6.900 4.014 3.639 4.592 . 0 0 "[ . 1]" 1 840 1 101 PRO HB3 1 119 TYR QE 1.800 . 6.900 2.613 2.218 3.226 . 0 0 "[ . 1]" 1 841 1 101 PRO HB2 1 119 TYR QE 1.800 . 6.900 4.144 3.716 4.724 . 0 0 "[ . 1]" 1 842 1 118 VAL HA 1 119 TYR QE 1.800 . 7.400 4.787 4.248 5.280 . 0 0 "[ . 1]" 1 843 1 37 VAL MG1 1 119 TYR QE 1.800 . 8.400 2.070 1.854 2.574 . 0 0 "[ . 1]" 1 844 1 37 VAL HB 1 119 TYR QE 1.800 . 7.400 4.483 3.079 5.384 . 0 0 "[ . 1]" 1 845 1 79 GLU HA 1 119 TYR QE 1.800 . 7.400 5.629 4.059 6.509 . 0 0 "[ . 1]" 1 846 1 99 TRP HB3 1 121 LEU QD 1.800 . 7.000 2.593 1.832 5.242 . 0 0 "[ . 1]" 1 847 1 99 TRP HB2 1 121 LEU QD 1.800 . 7.000 2.992 1.979 5.178 . 0 0 "[ . 1]" 1 848 1 41 LEU MD1 1 123 SER HA 1.800 . 6.400 3.898 2.814 5.199 . 0 0 "[ . 1]" 1 849 1 97 LEU MD1 1 123 SER HA 1.800 . 6.000 2.874 2.163 3.367 . 0 0 "[ . 1]" 1 850 1 97 LEU MD2 1 123 SER HA 1.800 . 6.000 4.153 1.919 5.045 . 0 0 "[ . 1]" 1 851 1 126 THR HA 1 127 PRO HG3 1.800 . 6.000 4.373 3.936 4.506 . 0 0 "[ . 1]" 1 852 1 126 THR HA 1 127 PRO HD3 1.800 . 6.000 2.200 1.870 2.392 . 0 0 "[ . 1]" 1 853 1 126 THR HA 1 127 PRO HD2 1.800 . 6.000 2.513 2.246 2.939 . 0 0 "[ . 1]" 1 854 1 126 THR HB 1 127 PRO HD3 1.800 . 6.000 4.365 4.040 4.636 . 0 0 "[ . 1]" 1 855 1 126 THR HB 1 127 PRO HD2 1.800 . 6.000 3.450 2.876 3.800 . 0 0 "[ . 1]" 1 856 1 126 THR MG 1 127 PRO HG3 1.800 . 7.000 4.182 3.879 5.380 . 0 0 "[ . 1]" 1 857 1 126 THR MG 1 127 PRO HG2 1.800 . 7.000 3.581 3.146 4.577 . 0 0 "[ . 1]" 1 858 1 130 ASN HA 1 131 PRO HD3 1.800 . 4.500 2.409 1.848 2.754 . 0 0 "[ . 1]" 1 859 1 130 ASN HA 1 131 PRO HD2 1.800 . 4.500 2.447 2.047 2.778 . 0 0 "[ . 1]" 1 860 1 116 MET ME 1 134 ILE MG 1.800 . 8.000 5.412 5.273 5.528 . 0 0 "[ . 1]" 1 861 1 134 ILE MG 1 136 GLY HA3 1.800 . 6.000 4.780 4.619 4.921 . 0 0 "[ . 1]" 1 862 1 134 ILE MG 1 136 GLY HA2 1.800 . 6.000 3.592 3.507 3.710 . 0 0 "[ . 1]" 1 863 1 138 GLU HB3 1 140 LEU MD1 1.800 . 7.000 3.914 3.600 4.146 . 0 0 "[ . 1]" 1 864 1 138 GLU HB2 1 140 LEU MD1 1.800 . 6.500 4.946 4.127 5.330 . 0 0 "[ . 1]" 1 865 1 138 GLU HG2 1 140 LEU MD1 1.800 . 6.500 5.273 4.764 5.394 . 0 0 "[ . 1]" 1 866 1 138 GLU HB3 1 140 LEU MD2 1.800 . 7.000 2.688 1.902 3.342 . 0 0 "[ . 1]" 1 867 1 138 GLU HB2 1 140 LEU MD2 1.800 . 7.000 3.969 3.235 4.625 . 0 0 "[ . 1]" 1 868 1 138 GLU HG3 1 140 LEU MD2 1.800 . 7.000 4.562 3.832 5.178 . 0 0 "[ . 1]" 1 869 1 138 GLU HG2 1 140 LEU MD2 1.800 . 7.000 3.383 2.741 3.945 . 0 0 "[ . 1]" 1 870 1 141 THR HA 1 142 PRO HD3 1.800 . 6.000 2.235 1.990 2.538 . 0 0 "[ . 1]" 1 871 1 141 THR HA 1 142 PRO HD2 1.800 . 6.000 2.640 2.252 3.290 . 0 0 "[ . 1]" 1 872 1 141 THR HB 1 142 PRO HD3 1.800 . 5.000 3.950 2.991 4.513 . 0 0 "[ . 1]" 1 873 1 141 THR HB 1 142 PRO HD2 1.800 . 5.000 3.004 2.159 3.942 . 0 0 "[ . 1]" 1 874 1 141 THR MG 1 142 PRO HD3 1.800 . 7.000 3.138 2.085 4.535 . 0 0 "[ . 1]" 1 875 1 141 THR MG 1 142 PRO HD2 1.800 . 7.000 2.350 1.853 4.042 . 0 0 "[ . 1]" 1 876 1 142 PRO HA 1 145 LEU QD 1.800 . 6.000 3.538 2.897 4.293 . 0 0 "[ . 1]" 1 877 1 140 LEU MD2 1 144 HIS HB3 1.800 . 5.500 3.948 2.997 4.593 . 0 0 "[ . 1]" 1 878 1 140 LEU QB 1 144 HIS HB2 1.800 . 5.500 3.303 2.232 4.157 . 0 0 "[ . 1]" 1 879 1 144 HIS HB3 1 147 ALA MB 1.800 . 6.000 4.524 4.125 4.861 . 0 0 "[ . 1]" 1 880 1 144 HIS HB2 1 147 ALA MB 1.800 . 6.000 4.803 4.716 4.890 . 0 0 "[ . 1]" 1 881 1 144 HIS HA 1 147 ALA MB 1.800 . 5.000 2.349 2.160 2.597 . 0 0 "[ . 1]" 1 882 1 149 ILE MG 1 160 ALA HA 1.800 . 6.000 4.563 3.639 4.856 . 0 0 "[ . 1]" 1 883 1 163 VAL HA 1 167 TYR QD 1.800 . 6.400 3.450 2.799 3.771 . 0 0 "[ . 1]" 1 884 1 163 VAL HA 1 167 TYR QE 1.800 . 7.400 4.386 3.432 5.419 . 0 0 "[ . 1]" 1 885 1 163 VAL MG1 1 167 TYR QD 1.800 . 8.000 2.994 1.883 4.548 . 0 0 "[ . 1]" 1 886 1 163 VAL MG2 1 167 TYR QD 1.800 . 8.000 4.392 3.417 5.029 . 0 0 "[ . 1]" 1 887 1 63 ALA HA 1 154 ALA MB 1.800 . 4.500 2.523 1.953 3.174 . 0 0 "[ . 1]" 1 888 1 63 ALA HA 1 155 ALA HA 2.500 2.500 6.700 3.111 2.677 3.909 . 0 0 "[ . 1]" 1 889 1 63 ALA H 1 154 ALA MB 1.800 . 6.000 2.348 1.819 3.482 . 0 0 "[ . 1]" 1 890 1 63 ALA HA 1 154 ALA H 1.800 . 5.000 4.915 4.708 5.021 0.021 5 0 "[ . 1]" 1 891 1 63 ALA HA 1 155 ALA H 1.800 . 4.500 3.803 3.486 4.446 . 0 0 "[ . 1]" 1 892 1 63 ALA HA 1 156 LYS H 1.800 . 5.000 4.760 3.877 5.034 0.034 7 0 "[ . 1]" 1 893 1 63 ALA MB 1 155 ALA HA 1.800 . 6.000 2.611 1.949 3.414 . 0 0 "[ . 1]" 1 894 1 154 ALA MB 1 155 ALA HA 1.800 . 6.000 4.146 4.086 4.194 . 0 0 "[ . 1]" 1 895 1 63 ALA MB 1 154 ALA HA 1.800 . 6.000 4.577 3.964 4.851 . 0 0 "[ . 1]" 1 896 1 154 ALA HA 1 155 ALA MB 1.800 . 6.000 4.586 4.200 4.703 . 0 0 "[ . 1]" 1 897 1 64 LEU MD2 1 155 ALA MB 1.800 . 7.000 3.560 2.777 4.285 . 0 0 "[ . 1]" 1 898 1 64 LEU MD1 1 155 ALA HA 1.800 . 6.000 3.739 2.723 4.797 . 0 0 "[ . 1]" 1 899 1 64 LEU MD1 1 155 ALA MB 1.800 . 5.500 2.108 1.793 2.544 0.007 9 0 "[ . 1]" 1 900 1 64 LEU H 1 155 ALA MB 1.800 . 6.000 3.537 1.974 4.670 . 0 0 "[ . 1]" 1 901 1 153 GLU HA 1 154 ALA MB 1.800 . 6.000 3.703 3.651 3.779 . 0 0 "[ . 1]" 1 902 1 64 LEU MD1 1 153 GLU HB3 1.800 . 7.000 2.928 2.148 4.129 . 0 0 "[ . 1]" 1 903 1 64 LEU MD1 1 153 GLU HB2 1.800 . 7.000 3.845 2.839 5.530 . 0 0 "[ . 1]" 1 904 1 64 LEU MD1 1 153 GLU HG3 1.800 . 6.500 4.368 3.369 5.392 . 0 0 "[ . 1]" 1 905 1 64 LEU MD1 1 153 GLU HG2 1.800 . 6.500 4.347 2.877 5.222 . 0 0 "[ . 1]" 1 906 1 149 ILE MD 1 160 ALA MB 1.800 . 5.500 1.876 1.737 1.998 0.063 9 0 "[ . 1]" 1 907 1 149 ILE MD 1 160 ALA HA 1.800 . 6.000 2.198 1.808 2.840 . 0 0 "[ . 1]" 1 908 1 149 ILE MG 1 160 ALA MB 1.800 . 6.500 3.946 3.535 4.299 . 0 0 "[ . 1]" 1 909 1 149 ILE MG 1 155 ALA MB 1.800 . 5.500 2.200 1.754 2.981 0.046 2 0 "[ . 1]" 1 910 1 149 ILE HG13 1 155 ALA MB 1.800 . 6.000 4.504 3.859 4.970 . 0 0 "[ . 1]" 1 911 1 149 ILE HG12 1 155 ALA MB 1.800 . 6.000 4.429 4.108 4.902 . 0 0 "[ . 1]" 1 912 1 149 ILE MD 1 155 ALA MB 1.800 . 5.500 3.326 2.793 3.648 . 0 0 "[ . 1]" 1 913 1 149 ILE MD 1 160 ALA H 1.800 . 5.000 4.030 3.842 4.115 . 0 0 "[ . 1]" 1 914 1 149 ILE HA 1 153 GLU HB3 1.800 . 6.000 3.395 2.663 4.365 . 0 0 "[ . 1]" 1 915 1 149 ILE HA 1 153 GLU HB2 1.800 . 6.000 2.871 2.129 4.806 . 0 0 "[ . 1]" 1 916 1 10 ASP H 1 74 SER H 1.800 . 5.000 2.924 1.990 3.861 . 0 0 "[ . 1]" 1 917 1 10 ASP H 1 74 SER HA 1.800 . 3.500 2.767 1.998 3.314 . 0 0 "[ . 1]" 1 918 1 10 ASP H 1 73 GLN HA 1.800 . 5.500 4.587 3.560 5.482 . 0 0 "[ . 1]" 1 919 1 10 ASP H 1 74 SER HB3 1.800 . 6.000 4.239 2.085 5.754 . 0 0 "[ . 1]" 1 920 1 10 ASP H 1 74 SER HB2 1.800 . 6.000 4.398 2.761 5.855 . 0 0 "[ . 1]" 1 921 1 9 LEU HA 1 74 SER H 1.800 . 3.000 2.581 2.061 3.012 0.012 7 0 "[ . 1]" 1 922 1 9 LEU QD 1 74 SER H 1.800 . 6.500 3.452 1.976 4.698 . 0 0 "[ . 1]" 1 923 1 126 THR H 1 139 TRP HZ2 1.800 . 5.000 3.987 3.352 4.691 . 0 0 "[ . 1]" 1 924 1 49 TRP HZ2 1 137 GLY H 1.800 . 5.000 3.403 2.895 4.115 . 0 0 "[ . 1]" 1 925 1 49 TRP HZ2 1 138 GLU H 1.800 . 6.500 6.515 6.505 6.526 0.026 2 0 "[ . 1]" 1 926 1 127 PRO HG3 1 139 TRP HH2 1.800 . 6.000 5.919 5.082 6.023 0.023 2 0 "[ . 1]" 1 927 1 126 THR HA 1 139 TRP HZ2 1.800 . 4.500 2.281 1.932 2.547 . 0 0 "[ . 1]" 1 928 1 126 THR HB 1 139 TRP HZ2 2.500 2.500 5.700 4.004 3.602 4.453 . 0 0 "[ . 1]" 1 929 1 126 THR MG 1 139 TRP HZ2 1.800 . 6.000 2.269 1.819 5.055 . 0 0 "[ . 1]" 1 930 1 127 PRO HG3 1 139 TRP HZ2 1.800 . 6.000 5.558 4.453 5.927 . 0 0 "[ . 1]" 1 931 1 127 PRO HD3 1 139 TRP HZ2 2.500 2.500 6.000 3.600 2.496 4.074 0.004 4 0 "[ . 1]" 1 932 1 127 PRO HD2 1 139 TRP HZ2 2.500 2.500 6.000 3.689 3.395 4.057 . 0 0 "[ . 1]" 1 933 1 49 TRP HH2 1 134 ILE MG 1.800 . 6.000 4.798 4.253 4.951 . 0 0 "[ . 1]" 1 934 1 49 TRP HH2 1 134 ILE MD 1.800 . 6.000 4.761 4.619 4.869 . 0 0 "[ . 1]" 1 935 1 49 TRP HZ2 1 134 ILE MG 1.800 . 6.500 3.996 3.216 4.332 . 0 0 "[ . 1]" 1 936 1 49 TRP HZ2 1 126 THR MG 2.500 2.500 7.200 4.547 3.811 5.016 . 0 0 "[ . 1]" 1 937 1 49 TRP HE1 1 137 GLY HA3 1.800 . 6.000 2.739 1.985 3.411 . 0 0 "[ . 1]" 1 938 1 49 TRP HE1 1 137 GLY HA2 1.800 . 6.000 3.843 3.460 4.147 . 0 0 "[ . 1]" 1 939 1 49 TRP HE1 1 126 THR MG 1.800 . 6.000 4.883 4.789 4.990 . 0 0 "[ . 1]" 1 940 1 49 TRP HE1 1 127 PRO HD3 1.800 . 6.000 4.979 3.703 6.022 0.022 5 0 "[ . 1]" 1 941 1 49 TRP HE1 1 127 PRO HD2 1.800 . 6.000 5.202 4.498 6.048 0.048 4 0 "[ . 1]" 1 942 1 49 TRP HE1 1 50 ILE HA 1.800 . 4.000 4.079 4.036 4.117 0.117 2 0 "[ . 1]" 1 943 1 126 THR MG 1 139 TRP HE1 1.800 . 6.000 3.696 1.996 4.891 . 0 0 "[ . 1]" 1 944 1 127 PRO HD3 1 139 TRP HE1 1.800 . 6.000 5.089 2.781 5.863 . 0 0 "[ . 1]" 1 945 1 127 PRO HD2 1 139 TRP HE1 1.800 . 6.000 5.398 4.224 6.029 0.029 1 0 "[ . 1]" 1 946 1 50 ILE MG 1 140 LEU MD1 1.800 . 7.000 4.220 3.861 4.695 . 0 0 "[ . 1]" 1 947 1 49 TRP HA 1 140 LEU H 1.800 . 5.000 2.967 2.651 3.423 . 0 0 "[ . 1]" 1 948 1 50 ILE H 1 140 LEU MD1 1.800 . 6.000 4.024 3.669 4.677 . 0 0 "[ . 1]" 1 949 1 49 TRP HA 1 50 ILE H 1.800 . 3.500 2.136 2.123 2.163 . 0 0 "[ . 1]" 1 950 1 50 ILE H 1 139 TRP HA 1.800 . 5.000 3.507 3.412 3.613 . 0 0 "[ . 1]" 1 951 1 48 LEU H 1 140 LEU H 1.800 . 5.000 4.133 3.777 4.328 . 0 0 "[ . 1]" 1 952 1 50 ILE H 1 140 LEU H 1.800 . 5.000 3.484 3.067 3.950 . 0 0 "[ . 1]" 1 953 1 40 PHE QD 1 50 ILE MD 2.500 2.500 8.400 2.588 1.905 3.442 0.595 6 2 "[- .+ 1]" 1 954 1 40 PHE HZ 1 50 ILE MD 2.500 2.500 8.400 4.529 3.501 5.355 . 0 0 "[ . 1]" 1 955 1 139 TRP H 1 139 TRP HD1 1.800 . 5.000 4.087 2.177 5.074 0.074 7 0 "[ . 1]" 1 956 1 51 PRO HA 1 137 GLY H 1.800 . 5.000 4.191 3.405 4.821 . 0 0 "[ . 1]" 1 957 1 51 PRO HA 1 138 GLU H 1.800 . 4.500 2.632 2.159 3.204 . 0 0 "[ . 1]" 1 958 1 51 PRO HA 1 137 GLY HA3 1.800 . 4.000 2.211 1.778 3.148 0.022 9 0 "[ . 1]" 1 959 1 51 PRO HA 1 137 GLY HA2 1.800 . 4.000 2.217 1.962 2.928 . 0 0 "[ . 1]" 1 960 1 49 TRP HA 1 139 TRP HA 1.800 . 4.000 2.142 1.992 2.458 . 0 0 "[ . 1]" 1 961 1 50 ILE MD 1 66 VAL HA 1.800 . 6.000 4.223 3.014 4.868 . 0 0 "[ . 1]" 1 962 1 50 ILE MG 1 64 LEU HA 1.800 . 6.000 4.175 3.755 4.710 . 0 0 "[ . 1]" 1 963 1 50 ILE MG 1 64 LEU MD2 1.800 . 5.000 2.202 1.844 2.914 . 0 0 "[ . 1]" 1 964 1 50 ILE MG 1 64 LEU MD1 1.800 . 7.000 3.917 2.939 4.810 . 0 0 "[ . 1]" 1 965 1 140 LEU MD1 1 145 LEU HA 1.800 . 6.000 3.109 2.141 3.828 . 0 0 "[ . 1]" 1 966 1 64 LEU MD1 1 149 ILE MG 1.800 . 5.500 1.834 1.706 2.002 0.094 6 0 "[ . 1]" 1 967 1 64 LEU MD1 1 149 ILE MD 1.800 . 7.000 4.456 3.970 4.730 . 0 0 "[ . 1]" 1 968 1 64 LEU MD2 1 149 ILE MG 1.800 . 5.000 2.496 1.904 3.310 . 0 0 "[ . 1]" 1 969 1 94 ILE MD 1 121 LEU QD 1.800 . 8.000 4.243 3.566 4.527 . 0 0 "[ . 1]" 1 970 1 94 ILE MG 1 121 LEU QD 1.800 . 8.000 2.267 1.880 2.803 . 0 0 "[ . 1]" 1 971 1 22 ILE MG 1 34 VAL MG1 1.800 . 7.000 4.565 4.139 4.753 . 0 0 "[ . 1]" 1 972 1 24 ARG HA 1 29 LEU MD1 1.800 . 5.500 4.191 3.912 4.586 . 0 0 "[ . 1]" 1 973 1 24 ARG HA 1 29 LEU MD2 1.800 . 6.000 2.902 1.915 3.714 . 0 0 "[ . 1]" 1 974 1 42 ARG HA 1 48 LEU MD2 1.800 . 6.000 3.214 2.881 3.544 . 0 0 "[ . 1]" 1 975 1 40 PHE QD 1 167 TYR QE 2.500 2.500 8.500 5.832 4.264 6.794 . 0 0 "[ . 1]" 1 976 1 40 PHE QD 1 48 LEU MD1 1.800 . 8.400 4.590 3.087 5.696 . 0 0 "[ . 1]" 1 977 1 40 PHE QD 1 48 LEU MD2 1.800 . 8.400 4.514 3.032 5.848 . 0 0 "[ . 1]" 1 978 1 7 GLU H 1 7 GLU HG3 1.800 . 5.000 3.673 2.541 4.571 . 0 0 "[ . 1]" 1 979 1 7 GLU H 1 7 GLU HG2 1.800 . 5.000 4.101 2.948 4.976 . 0 0 "[ . 1]" 1 980 1 8 ARG H 1 8 ARG HB3 1.800 . 3.500 3.316 2.954 3.489 . 0 0 "[ . 1]" 1 981 1 8 ARG H 1 8 ARG HB2 1.800 . 3.500 3.030 2.311 3.608 0.108 7 0 "[ . 1]" 1 982 1 8 ARG H 1 8 ARG QG 2.500 . 5.500 3.117 1.851 4.268 . 0 0 "[ . 1]" 1 983 1 12 VAL H 1 12 VAL MG1 1.800 . 5.000 2.444 1.988 2.977 . 0 0 "[ . 1]" 1 984 1 12 VAL H 1 12 VAL MG2 1.800 . 5.000 3.163 1.968 3.900 . 0 0 "[ . 1]" 1 985 1 16 ASP H 1 16 ASP HB3 1.800 . 4.000 3.426 2.974 3.985 . 0 0 "[ . 1]" 1 986 1 16 ASP H 1 16 ASP HB2 1.800 . 4.000 2.871 2.271 3.952 . 0 0 "[ . 1]" 1 987 1 16 ASP HB2 1 17 GLU H 1.800 . 4.500 4.298 3.999 4.448 . 0 0 "[ . 1]" 1 988 1 19 VAL H 1 19 VAL HB 1.800 . 3.800 3.685 3.620 3.779 . 0 0 "[ . 1]" 1 989 1 19 VAL H 1 19 VAL MG1 1.800 . 4.500 2.314 2.129 2.600 . 0 0 "[ . 1]" 1 990 1 19 VAL H 1 19 VAL MG2 1.800 . 4.500 2.126 2.079 2.214 . 0 0 "[ . 1]" 1 991 1 21 GLN H 1 21 GLN HG3 2.500 . 6.500 3.965 2.523 4.453 . 0 0 "[ . 1]" 1 992 1 21 GLN H 1 21 GLN HG2 2.500 . 6.500 4.418 2.976 4.860 . 0 0 "[ . 1]" 1 993 1 22 ILE H 1 22 ILE MG 1.800 . 5.000 3.768 2.855 3.971 . 0 0 "[ . 1]" 1 994 1 22 ILE H 1 22 ILE MD 1.800 . 4.500 3.521 2.346 3.787 . 0 0 "[ . 1]" 1 995 1 23 LEU H 1 23 LEU HB3 2.000 . 4.500 3.496 3.174 3.910 . 0 0 "[ . 1]" 1 996 1 23 LEU H 1 23 LEU HB2 2.000 . 4.500 2.406 2.269 2.909 . 0 0 "[ . 1]" 1 997 1 25 THR H 1 25 THR HB 1.800 . 4.000 3.513 2.854 3.638 . 0 0 "[ . 1]" 1 998 1 25 THR H 1 25 THR MG 1.800 . 4.500 2.568 1.929 3.287 . 0 0 "[ . 1]" 1 999 1 28 ALA H 1 28 ALA MB 1.800 . 4.500 2.178 2.031 2.379 . 0 0 "[ . 1]" 1 1000 1 29 LEU H 1 29 LEU HB3 1.800 . 4.000 3.010 2.348 3.366 . 0 0 "[ . 1]" 1 1001 1 29 LEU H 1 29 LEU HB2 1.800 . 4.000 3.606 3.564 3.765 . 0 0 "[ . 1]" 1 1002 1 29 LEU H 1 29 LEU HG 1.800 . 3.000 2.342 2.008 2.949 . 0 0 "[ . 1]" 1 1003 1 31 TRP H 1 31 TRP HB3 1.800 . 3.500 3.487 3.416 3.539 0.039 2 0 "[ . 1]" 1 1004 1 31 TRP H 1 31 TRP HB2 1.800 . 3.500 2.188 2.106 2.266 . 0 0 "[ . 1]" 1 1005 1 34 VAL H 1 34 VAL HB 1.800 . 3.500 3.264 2.737 3.596 0.096 2 0 "[ . 1]" 1 1006 1 34 VAL H 1 34 VAL MG1 1.800 . 5.000 3.031 2.293 3.791 . 0 0 "[ . 1]" 1 1007 1 34 VAL H 1 34 VAL MG2 1.800 . 5.000 1.988 1.893 2.148 . 0 0 "[ . 1]" 1 1008 1 36 VAL H 1 36 VAL HB 1.800 . 3.500 3.108 2.946 3.244 . 0 0 "[ . 1]" 1 1009 1 36 VAL H 1 36 VAL MG1 2.500 . 5.500 4.002 3.959 4.034 . 0 0 "[ . 1]" 1 1010 1 36 VAL H 1 36 VAL MG2 2.500 . 5.500 2.593 2.331 2.757 . 0 0 "[ . 1]" 1 1011 1 37 VAL H 1 37 VAL HB 1.800 . 3.500 3.097 2.813 3.594 0.094 9 0 "[ . 1]" 1 1012 1 38 ASN H 1 38 ASN QB 2.500 . 6.000 2.930 2.456 3.370 . 0 0 "[ . 1]" 1 1013 1 39 ALA H 1 39 ALA MB 1.800 . 4.500 2.731 2.622 2.794 . 0 0 "[ . 1]" 1 1014 1 40 PHE H 1 40 PHE QB 2.000 . 4.500 2.417 2.299 2.666 . 0 0 "[ . 1]" 1 1015 1 41 LEU H 1 41 LEU HB3 1.800 . 3.500 3.037 2.385 3.479 . 0 0 "[ . 1]" 1 1016 1 41 LEU H 1 41 LEU HB2 1.800 . 3.500 2.393 2.221 2.930 . 0 0 "[ . 1]" 1 1017 1 41 LEU H 1 41 LEU MD1 1.800 . 7.000 4.136 3.539 4.439 . 0 0 "[ . 1]" 1 1018 1 41 LEU H 1 41 LEU MD2 1.800 . 7.000 3.844 3.103 4.456 . 0 0 "[ . 1]" 1 1019 1 42 ARG H 1 42 ARG HB3 1.800 . 3.500 2.886 2.720 3.516 0.016 8 0 "[ . 1]" 1 1020 1 42 ARG H 1 42 ARG HB2 1.800 . 3.500 3.263 3.113 3.554 0.054 8 0 "[ . 1]" 1 1021 1 43 ASN H 1 43 ASN HB3 2.500 . 5.000 3.015 2.567 3.789 . 0 0 "[ . 1]" 1 1022 1 43 ASN H 1 43 ASN HB2 2.500 . 5.000 3.243 2.660 4.043 . 0 0 "[ . 1]" 1 1023 1 45 GLN H 1 45 GLN HB3 1.800 . 3.500 3.246 2.766 3.545 0.045 4 0 "[ . 1]" 1 1024 1 45 GLN H 1 45 GLN HB2 1.800 . 3.500 2.782 2.109 3.556 0.056 5 0 "[ . 1]" 1 1025 1 50 ILE H 1 50 ILE HB 1.800 . 3.500 3.038 2.909 3.364 . 0 0 "[ . 1]" 1 1026 1 50 ILE H 1 50 ILE HG13 2.500 . 5.000 3.649 2.719 4.616 . 0 0 "[ . 1]" 1 1027 1 50 ILE H 1 50 ILE MG 1.800 . 5.000 3.948 3.736 4.056 . 0 0 "[ . 1]" 1 1028 1 50 ILE H 1 50 ILE MD 1.800 . 5.000 4.018 3.384 4.260 . 0 0 "[ . 1]" 1 1029 1 50 ILE H 1 50 ILE HG12 2.500 . 5.000 3.998 3.202 5.090 0.090 6 0 "[ . 1]" 1 1030 1 54 SER H 1 54 SER HB3 1.800 . 4.000 3.572 2.376 4.017 0.017 4 0 "[ . 1]" 1 1031 1 54 SER H 1 54 SER HB2 1.800 . 4.000 3.233 2.282 3.888 . 0 0 "[ . 1]" 1 1032 1 63 ALA H 1 63 ALA MB 2.000 . 5.500 2.757 2.217 2.982 . 0 0 "[ . 1]" 1 1033 1 66 VAL H 1 66 VAL HB 1.800 . 3.500 3.436 2.735 3.587 0.087 10 0 "[ . 1]" 1 1034 1 66 VAL H 1 66 VAL MG1 1.800 . 5.500 2.795 2.169 3.809 . 0 0 "[ . 1]" 1 1035 1 66 VAL H 1 66 VAL MG2 1.800 . 5.500 2.051 1.895 2.252 . 0 0 "[ . 1]" 1 1036 1 67 SER H 1 67 SER QB 2.500 . 6.000 2.640 2.169 3.037 . 0 0 "[ . 1]" 1 1037 1 68 VAL H 1 68 VAL MG1 1.800 . 4.500 3.848 3.839 3.862 . 0 0 "[ . 1]" 1 1038 1 68 VAL H 1 68 VAL MG2 1.800 . 4.500 2.498 2.388 2.653 . 0 0 "[ . 1]" 1 1039 1 68 VAL H 1 68 VAL HB 2.000 . 4.000 2.641 2.607 2.665 . 0 0 "[ . 1]" 1 1040 1 71 ALA H 1 71 ALA MB 1.800 . 4.500 2.321 2.197 2.657 . 0 0 "[ . 1]" 1 1041 1 72 VAL H 1 72 VAL QG 1.800 . 6.500 2.096 1.867 2.422 . 0 0 "[ . 1]" 1 1042 1 73 GLN H 1 73 GLN HG3 1.800 . 5.000 3.487 2.036 4.392 . 0 0 "[ . 1]" 1 1043 1 73 GLN H 1 73 GLN HG2 1.800 . 5.000 3.240 1.995 4.434 . 0 0 "[ . 1]" 1 1044 1 77 THR H 1 77 THR MG 1.800 . 4.500 3.651 3.130 3.802 . 0 0 "[ . 1]" 1 1045 1 81 ALA H 1 81 ALA MB 1.800 . 4.500 2.153 2.030 2.232 . 0 0 "[ . 1]" 1 1046 1 85 GLU H 1 85 GLU HB3 1.800 . 4.000 3.374 2.702 3.588 . 0 0 "[ . 1]" 1 1047 1 85 GLU H 1 85 GLU HB2 1.800 . 4.000 2.389 2.103 3.578 . 0 0 "[ . 1]" 1 1048 1 86 ALA H 1 86 ALA MB 1.800 . 4.500 2.186 2.043 2.247 . 0 0 "[ . 1]" 1 1049 1 88 GLU H 1 88 GLU HG3 2.000 . 4.500 3.339 2.330 4.212 . 0 0 "[ . 1]" 1 1050 1 88 GLU H 1 88 GLU HG2 2.000 . 4.500 3.617 2.099 4.399 . 0 0 "[ . 1]" 1 1051 1 89 GLU H 1 89 GLU QB 2.500 . 5.000 2.225 2.044 2.593 . 0 0 "[ . 1]" 1 1052 1 89 GLU H 1 89 GLU HG3 2.000 . 4.500 3.617 2.691 4.463 . 0 0 "[ . 1]" 1 1053 1 89 GLU H 1 89 GLU HG2 2.000 . 4.500 3.878 2.086 4.444 . 0 0 "[ . 1]" 1 1054 1 90 LEU H 1 90 LEU HB3 2.500 . 5.000 3.361 2.953 3.624 . 0 0 "[ . 1]" 1 1055 1 90 LEU H 1 90 LEU HB2 2.500 . 5.000 2.748 2.404 3.260 . 0 0 "[ . 1]" 1 1056 1 92 VAL H 1 92 VAL HB 1.800 . 3.500 2.849 2.603 3.571 0.071 8 0 "[ . 1]" 1 1057 1 92 VAL H 1 92 VAL MG1 1.800 . 5.500 3.234 1.951 3.875 . 0 0 "[ . 1]" 1 1058 1 92 VAL H 1 92 VAL MG2 1.800 . 5.500 2.448 1.887 3.781 . 0 0 "[ . 1]" 1 1059 1 94 ILE H 1 94 ILE HB 1.800 . 4.000 3.960 3.917 3.973 . 0 0 "[ . 1]" 1 1060 1 94 ILE H 1 94 ILE HG13 2.500 . 5.000 3.986 3.857 4.039 . 0 0 "[ . 1]" 1 1061 1 94 ILE H 1 94 ILE HG12 2.500 . 5.000 3.558 3.480 3.860 . 0 0 "[ . 1]" 1 1062 1 96 ALA H 1 97 LEU HB3 1.800 . 5.500 5.453 5.202 5.518 0.018 9 0 "[ . 1]" 1 1063 1 96 ALA H 1 97 LEU HB2 1.800 . 5.500 4.005 3.610 4.091 . 0 0 "[ . 1]" 1 1064 1 96 ALA H 1 96 ALA MB 1.800 . 4.500 2.389 2.265 2.485 . 0 0 "[ . 1]" 1 1065 1 97 LEU H 1 97 LEU MD1 1.800 . 5.000 3.798 3.067 4.143 . 0 0 "[ . 1]" 1 1066 1 97 LEU H 1 97 LEU MD2 1.800 . 5.000 3.696 2.450 4.242 . 0 0 "[ . 1]" 1 1067 1 100 ARG H 1 100 ARG QG 1.800 . 4.500 3.435 2.546 4.089 . 0 0 "[ . 1]" 1 1068 1 103 ALA H 1 103 ALA MB 1.800 . 4.500 2.904 2.634 3.030 . 0 0 "[ . 1]" 1 1069 1 109 GLN H 1 109 GLN QG 2.500 . 5.200 3.649 2.218 4.218 . 0 0 "[ . 1]" 1 1070 1 110 THR H 1 110 THR MG 1.800 . 4.800 3.155 2.308 3.930 . 0 0 "[ . 1]" 1 1071 1 112 LEU H 1 112 LEU QB 1.800 . 5.300 2.669 2.288 2.931 . 0 0 "[ . 1]" 1 1072 1 115 PHE H 1 115 PHE HB3 1.800 . 4.000 3.089 2.374 3.635 . 0 0 "[ . 1]" 1 1073 1 115 PHE H 1 115 PHE HB2 1.800 . 4.000 2.430 2.096 2.807 . 0 0 "[ . 1]" 1 1074 1 116 MET H 1 116 MET HG3 1.800 . 4.000 3.423 2.538 4.001 0.001 3 0 "[ . 1]" 1 1075 1 116 MET H 1 116 MET HG2 1.800 . 4.000 2.402 1.901 3.124 . 0 0 "[ . 1]" 1 1076 1 118 VAL H 1 118 VAL HB 1.800 . 3.000 2.788 2.671 3.035 0.035 7 0 "[ . 1]" 1 1077 1 118 VAL H 1 118 VAL MG1 1.800 . 5.000 3.725 2.124 3.957 . 0 0 "[ . 1]" 1 1078 1 118 VAL H 1 118 VAL MG2 1.800 . 5.000 2.787 2.485 3.910 . 0 0 "[ . 1]" 1 1079 1 119 TYR H 1 119 TYR HB3 2.500 . 6.000 3.760 3.687 3.838 . 0 0 "[ . 1]" 1 1080 1 119 TYR H 1 119 TYR HB2 2.500 . 6.000 2.687 2.514 2.791 . 0 0 "[ . 1]" 1 1081 1 120 GLU H 1 120 GLU HB3 1.800 . 3.500 3.330 2.409 3.507 0.007 2 0 "[ . 1]" 1 1082 1 120 GLU H 1 120 GLU HB2 1.800 . 3.500 2.450 2.235 3.313 . 0 0 "[ . 1]" 1 1083 1 120 GLU H 1 120 GLU HG3 1.800 . 4.000 3.855 3.612 4.029 0.029 3 0 "[ . 1]" 1 1084 1 121 LEU H 1 121 LEU QD 1.800 . 6.000 3.304 2.128 3.843 . 0 0 "[ . 1]" 1 1085 1 122 ARG H 1 122 ARG HG3 2.000 . 5.000 3.634 2.530 4.683 . 0 0 "[ . 1]" 1 1086 1 122 ARG H 1 122 ARG HG2 2.000 . 5.000 3.868 1.954 4.684 . 0 0 "[ . 1]" 1 1087 1 122 ARG H 1 122 ARG QB 2.000 . 5.000 2.323 2.050 3.004 . 0 0 "[ . 1]" 1 1088 1 124 ASP H 1 124 ASP HB3 1.800 . 4.000 3.190 2.904 3.597 . 0 0 "[ . 1]" 1 1089 1 124 ASP H 1 124 ASP HB2 1.800 . 4.000 3.227 2.544 3.908 . 0 0 "[ . 1]" 1 1090 1 125 ALA H 1 125 ALA MB 1.800 . 4.500 2.542 2.214 2.857 . 0 0 "[ . 1]" 1 1091 1 126 THR H 1 126 THR MG 2.500 . 6.000 3.573 2.273 3.809 . 0 0 "[ . 1]" 1 1092 1 128 ILE H 1 128 ILE HB 2.500 . 4.700 3.286 2.619 3.803 . 0 0 "[ . 1]" 1 1093 1 128 ILE H 1 128 ILE HG13 2.000 . 5.000 2.819 1.965 4.680 . 0 0 "[ . 1]" 1 1094 1 128 ILE H 1 128 ILE HG12 2.000 . 5.000 3.483 2.031 4.685 . 0 0 "[ . 1]" 1 1095 1 129 PHE H 1 129 PHE HB3 1.800 . 3.500 3.222 2.559 3.563 0.063 7 0 "[ . 1]" 1 1096 1 129 PHE H 1 129 PHE HB2 1.800 . 3.500 2.408 2.205 2.947 . 0 0 "[ . 1]" 1 1097 1 130 ASN H 1 130 ASN HB3 1.800 . 3.500 3.294 2.898 3.526 0.026 5 0 "[ . 1]" 1 1098 1 130 ASN H 1 130 ASN HB2 1.800 . 3.500 2.830 2.210 3.103 . 0 0 "[ . 1]" 1 1099 1 132 ASN H 1 132 ASN QB 1.800 . 3.500 2.638 2.330 3.147 . 0 0 "[ . 1]" 1 1100 1 133 ASP H 1 133 ASP HB3 1.800 . 3.500 3.133 2.643 3.482 . 0 0 "[ . 1]" 1 1101 1 133 ASP H 1 133 ASP HB2 1.800 . 3.500 2.390 2.194 2.749 . 0 0 "[ . 1]" 1 1102 1 134 ILE H 1 134 ILE MG 2.500 . 6.000 3.399 2.408 3.962 . 0 0 "[ . 1]" 1 1103 1 135 SER H 1 135 SER HB3 1.800 . 3.500 3.252 2.809 3.503 0.003 10 0 "[ . 1]" 1 1104 1 135 SER H 1 135 SER HB2 1.800 . 3.500 2.630 2.066 3.501 0.001 2 0 "[ . 1]" 1 1105 1 138 GLU H 1 138 GLU HB3 1.800 . 3.500 3.067 2.922 3.389 . 0 0 "[ . 1]" 1 1106 1 138 GLU H 1 138 GLU HB2 1.800 . 3.500 2.880 2.695 3.055 . 0 0 "[ . 1]" 1 1107 1 138 GLU H 1 138 GLU QG 2.500 . 5.500 4.190 4.141 4.266 . 0 0 "[ . 1]" 1 1108 1 139 TRP H 1 139 TRP QB 1.800 . 3.500 2.480 2.321 2.720 . 0 0 "[ . 1]" 1 1109 1 140 LEU H 1 140 LEU HB3 1.800 . 3.500 3.579 3.507 3.646 0.146 3 0 "[ . 1]" 1 1110 1 140 LEU H 1 140 LEU HB2 1.800 . 3.500 2.889 2.420 3.566 0.066 7 0 "[ . 1]" 1 1111 1 140 LEU H 1 140 LEU MD1 1.800 . 4.500 3.713 3.563 3.772 . 0 0 "[ . 1]" 1 1112 1 140 LEU H 1 140 LEU MD2 1.800 . 4.500 3.217 2.368 3.760 . 0 0 "[ . 1]" 1 1113 1 141 THR H 1 141 THR MG 2.500 . 5.500 3.264 1.899 3.881 . 0 0 "[ . 1]" 1 1114 1 143 GLU H 1 143 GLU QB 1.800 . 3.500 2.286 2.066 2.657 . 0 0 "[ . 1]" 1 1115 1 143 GLU H 1 143 GLU QG 2.500 . 5.000 3.159 1.931 4.014 . 0 0 "[ . 1]" 1 1116 1 144 HIS H 1 144 HIS QB 1.800 . 3.500 2.168 2.075 2.477 . 0 0 "[ . 1]" 1 1117 1 146 LEU H 1 146 LEU HB3 1.800 . 3.500 3.348 2.884 3.526 0.026 6 0 "[ . 1]" 1 1118 1 146 LEU H 1 146 LEU HB2 1.800 . 3.500 2.135 2.054 2.253 . 0 0 "[ . 1]" 1 1119 1 146 LEU H 1 146 LEU MD1 1.800 . 5.500 3.467 2.405 4.159 . 0 0 "[ . 1]" 1 1120 1 146 LEU H 1 146 LEU MD2 1.800 . 5.500 3.426 2.204 4.393 . 0 0 "[ . 1]" 1 1121 1 147 ALA H 1 147 ALA MB 1.800 . 4.500 2.181 2.101 2.236 . 0 0 "[ . 1]" 1 1122 1 150 ALA H 1 150 ALA MB 1.800 . 4.500 2.204 2.054 2.279 . 0 0 "[ . 1]" 1 1123 1 151 ALA H 1 151 ALA MB 1.800 . 4.500 2.133 2.055 2.243 . 0 0 "[ . 1]" 1 1124 1 153 GLU H 1 153 GLU HB3 1.800 . 3.500 3.144 2.476 3.508 0.008 3 0 "[ . 1]" 1 1125 1 153 GLU H 1 153 GLU HB2 1.800 . 3.500 2.389 2.204 2.820 . 0 0 "[ . 1]" 1 1126 1 153 GLU H 1 153 GLU HG3 2.500 . 4.500 4.356 4.049 4.502 0.002 8 0 "[ . 1]" 1 1127 1 153 GLU H 1 153 GLU HG2 2.500 . 4.500 4.384 3.992 4.512 0.012 2 0 "[ . 1]" 1 1128 1 154 ALA H 1 154 ALA MB 1.800 . 4.500 2.878 2.822 2.917 . 0 0 "[ . 1]" 1 1129 1 155 ALA H 1 155 ALA MB 1.800 . 4.500 2.407 2.176 2.847 . 0 0 "[ . 1]" 1 1130 1 160 ALA H 1 160 ALA MB 1.800 . 4.500 2.153 2.077 2.224 . 0 0 "[ . 1]" 1 1131 1 161 GLU H 1 161 GLU HB3 1.800 . 3.500 3.093 2.553 3.515 0.015 3 0 "[ . 1]" 1 1132 1 161 GLU H 1 161 GLU HB2 1.800 . 3.500 2.223 2.079 2.493 . 0 0 "[ . 1]" 1 1133 1 162 LEU H 1 162 LEU QB 1.800 . 4.000 2.149 2.030 2.218 . 0 0 "[ . 1]" 1 1134 1 163 VAL H 1 163 VAL HB 1.800 . 3.500 2.921 2.602 3.584 0.084 5 0 "[ . 1]" 1 1135 1 163 VAL H 1 163 VAL MG1 1.800 . 4.500 3.323 2.118 3.783 . 0 0 "[ . 1]" 1 1136 1 163 VAL H 1 163 VAL MG2 1.800 . 4.500 2.042 1.924 2.256 . 0 0 "[ . 1]" 1 1137 1 165 ARG H 1 165 ARG HB3 1.800 . 4.000 3.112 2.671 3.466 . 0 0 "[ . 1]" 1 1138 1 165 ARG H 1 165 ARG HB2 1.800 . 4.000 2.441 2.075 3.627 . 0 0 "[ . 1]" 1 1139 1 166 CYS H 1 166 CYS HB3 1.800 . 4.000 2.970 2.495 3.560 . 0 0 "[ . 1]" 1 1140 1 166 CYS H 1 166 CYS HB2 1.800 . 4.000 2.579 2.127 3.592 . 0 0 "[ . 1]" 1 1141 1 167 TYR H 1 167 TYR HB3 1.800 . 3.500 3.470 3.357 3.556 0.056 8 0 "[ . 1]" 1 1142 1 167 TYR H 1 167 TYR HB2 1.800 . 3.500 2.183 2.099 2.310 . 0 0 "[ . 1]" 1 1143 1 168 ARG H 1 168 ARG HB3 1.800 . 4.000 3.207 2.401 3.731 . 0 0 "[ . 1]" 1 1144 1 168 ARG H 1 168 ARG HB2 1.800 . 4.000 2.785 2.091 3.859 . 0 0 "[ . 1]" 1 1145 1 168 ARG H 1 168 ARG QG 2.200 . 5.200 3.300 2.028 4.206 . 0 0 "[ . 1]" 1 1146 1 169 GLU H 1 169 GLU HB3 1.800 . 4.000 3.449 3.007 3.957 . 0 0 "[ . 1]" 1 1147 1 169 GLU H 1 169 GLU HB2 1.800 . 4.000 2.531 2.089 3.502 . 0 0 "[ . 1]" 1 1148 1 169 GLU H 1 169 GLU QG 2.500 . 5.500 3.607 2.961 4.253 . 0 0 "[ . 1]" 1 1149 1 94 ILE HB 1 99 TRP HE1 3.500 . 5.500 3.266 2.264 3.657 . 0 0 "[ . 1]" 1 1150 1 11 LEU HA 1 11 LEU QD 2.500 . 6.400 2.430 1.898 2.952 . 0 0 "[ . 1]" 1 1151 1 12 VAL HA 1 12 VAL HB 1.800 . 3.000 2.491 2.467 2.534 . 0 0 "[ . 1]" 1 1152 1 12 VAL HA 1 12 VAL MG1 1.800 . 4.500 2.858 2.310 3.208 . 0 0 "[ . 1]" 1 1153 1 12 VAL HA 1 12 VAL MG2 1.800 . 4.500 2.652 2.233 3.199 . 0 0 "[ . 1]" 1 1154 1 13 ASN HB3 1 13 ASN HD21 2.500 . 5.500 2.781 2.116 3.324 . 0 0 "[ . 1]" 1 1155 1 18 VAL HA 1 18 VAL HB 1.800 . 3.000 3.015 3.012 3.020 0.020 9 0 "[ . 1]" 1 1156 1 18 VAL HA 1 18 VAL MG1 1.800 . 6.000 2.319 2.269 2.376 . 0 0 "[ . 1]" 1 1157 1 18 VAL MG1 1 18 VAL MG2 1.800 . 6.000 2.050 1.972 2.088 . 0 0 "[ . 1]" 1 1158 1 19 VAL MG1 1 19 VAL MG2 1.800 . 5.500 2.038 1.992 2.079 . 0 0 "[ . 1]" 1 1159 1 21 GLN HA 1 21 GLN HG3 1.800 . 4.500 2.443 2.042 3.771 . 0 0 "[ . 1]" 1 1160 1 21 GLN HA 1 21 GLN HG2 1.800 . 4.500 3.114 2.696 3.570 . 0 0 "[ . 1]" 1 1161 1 22 ILE MD 1 22 ILE MG 1.800 . 5.500 2.173 1.747 3.235 0.053 5 0 "[ . 1]" 1 1162 1 22 ILE HB 1 22 ILE MD 1.800 . 4.500 2.866 2.225 3.230 . 0 0 "[ . 1]" 1 1163 1 22 ILE HA 1 22 ILE MD 1.800 . 4.500 2.610 1.974 3.841 . 0 0 "[ . 1]" 1 1164 1 22 ILE HG13 1 22 ILE MG 1.800 . 5.500 2.581 2.281 3.200 . 0 0 "[ . 1]" 1 1165 1 22 ILE HG12 1 22 ILE MG 1.800 . 5.500 2.826 1.991 3.202 . 0 0 "[ . 1]" 1 1166 1 22 ILE HA 1 22 ILE MG 1.800 . 4.500 2.385 2.177 3.088 . 0 0 "[ . 1]" 1 1167 1 29 LEU HA 1 29 LEU MD1 2.000 . 5.000 3.546 3.337 4.008 . 0 0 "[ . 1]" 1 1168 1 29 LEU HA 1 29 LEU MD2 2.000 . 5.000 4.034 3.758 4.130 . 0 0 "[ . 1]" 1 1169 1 29 LEU HB3 1 29 LEU MD1 1.800 . 5.000 3.076 2.671 3.197 . 0 0 "[ . 1]" 1 1170 1 29 LEU HB2 1 29 LEU MD1 1.800 . 5.000 2.344 1.963 2.584 . 0 0 "[ . 1]" 1 1171 1 29 LEU HB3 1 29 LEU MD2 1.800 . 5.000 2.296 1.984 2.461 . 0 0 "[ . 1]" 1 1172 1 29 LEU HB2 1 29 LEU MD2 1.800 . 5.000 2.507 2.201 3.103 . 0 0 "[ . 1]" 1 1173 1 29 LEU MD1 1 29 LEU MD2 1.800 . 6.000 2.012 1.883 2.067 . 0 0 "[ . 1]" 1 1174 1 34 VAL HA 1 34 VAL MG1 1.800 . 4.500 2.195 2.053 2.307 . 0 0 "[ . 1]" 1 1175 1 34 VAL HA 1 34 VAL MG2 1.800 . 4.500 2.933 2.497 3.201 . 0 0 "[ . 1]" 1 1176 1 36 VAL HA 1 36 VAL MG1 1.800 . 4.500 2.103 2.002 2.259 . 0 0 "[ . 1]" 1 1177 1 36 VAL HA 1 36 VAL MG2 1.800 . 4.500 2.636 2.474 2.734 . 0 0 "[ . 1]" 1 1178 1 37 VAL HA 1 37 VAL MG1 1.800 . 5.000 2.129 1.968 2.259 . 0 0 "[ . 1]" 1 1179 1 37 VAL HA 1 37 VAL MG2 1.800 . 5.000 2.723 2.478 3.139 . 0 0 "[ . 1]" 1 1180 1 48 LEU MD1 1 48 LEU MD2 1.800 . 5.500 2.023 1.925 2.071 . 0 0 "[ . 1]" 1 1181 1 48 LEU HA 1 48 LEU MD1 2.500 . 6.000 3.081 1.953 3.770 . 0 0 "[ . 1]" 1 1182 1 48 LEU HA 1 48 LEU MD2 1.800 . 5.000 2.080 1.939 2.348 . 0 0 "[ . 1]" 1 1183 1 50 ILE MD 1 50 ILE MG 2.500 . 6.500 2.215 1.878 3.028 . 0 0 "[ . 1]" 1 1184 1 50 ILE HB 1 50 ILE MD 2.200 . 5.200 2.528 1.978 3.219 . 0 0 "[ . 1]" 1 1185 1 50 ILE HA 1 50 ILE MD 1.800 . 5.000 3.238 1.943 4.041 . 0 0 "[ . 1]" 1 1186 1 50 ILE HG13 1 50 ILE MG 1.800 . 5.800 2.893 2.400 3.200 . 0 0 "[ . 1]" 1 1187 1 50 ILE HG12 1 50 ILE MG 1.800 . 5.800 2.554 2.110 3.199 . 0 0 "[ . 1]" 1 1188 1 50 ILE HA 1 50 ILE MG 1.800 . 5.300 2.419 2.083 2.766 . 0 0 "[ . 1]" 1 1189 1 54 SER HB3 1 55 PRO QD 1.800 . 6.000 3.301 1.975 4.216 . 0 0 "[ . 1]" 1 1190 1 64 LEU MD1 1 64 LEU MD2 1.800 . 5.500 2.027 1.974 2.078 . 0 0 "[ . 1]" 1 1191 1 64 LEU HA 1 64 LEU MD1 1.800 . 6.000 2.872 2.372 3.855 . 0 0 "[ . 1]" 1 1192 1 64 LEU HB3 1 64 LEU MD1 1.800 . 4.500 3.017 2.217 3.175 . 0 0 "[ . 1]" 1 1193 1 64 LEU HB2 1 64 LEU MD1 1.800 . 4.500 2.244 1.999 3.171 . 0 0 "[ . 1]" 1 1194 1 64 LEU HA 1 64 LEU MD2 1.800 . 4.500 3.542 2.657 3.738 . 0 0 "[ . 1]" 1 1195 1 66 VAL HA 1 66 VAL MG1 1.800 . 4.500 2.216 1.982 2.373 . 0 0 "[ . 1]" 1 1196 1 66 VAL HA 1 66 VAL MG2 1.800 . 4.500 3.069 2.502 3.205 . 0 0 "[ . 1]" 1 1197 1 38 ASN QB 1 66 VAL MG1 1.800 . 6.000 2.054 1.885 2.291 . 0 0 "[ . 1]" 1 1198 1 66 VAL MG1 1 66 VAL MG2 1.800 . 4.500 1.976 1.919 2.052 . 0 0 "[ . 1]" 1 1199 1 68 VAL HA 1 68 VAL MG1 1.800 . 4.500 2.293 2.239 2.404 . 0 0 "[ . 1]" 1 1200 1 68 VAL HA 1 68 VAL MG2 1.800 . 4.500 2.439 2.343 2.499 . 0 0 "[ . 1]" 1 1201 1 68 VAL HA 1 68 VAL HB 1.800 . 3.000 3.017 3.015 3.021 0.021 6 0 "[ . 1]" 1 1202 1 66 VAL MG1 1 69 GLY HA3 2.500 . 6.500 5.036 4.274 5.340 . 0 0 "[ . 1]" 1 1203 1 72 VAL HA 1 72 VAL QG 1.800 . 5.900 2.149 2.039 2.299 . 0 0 "[ . 1]" 1 1204 1 77 THR HA 1 77 THR MG 2.500 . 5.500 2.157 2.071 2.322 . 0 0 "[ . 1]" 1 1205 1 78 TYR HA 1 78 TYR QD 1.800 . 5.500 2.803 2.106 3.079 . 0 0 "[ . 1]" 1 1206 1 92 VAL HA 1 92 VAL MG1 1.800 . 4.500 2.451 2.111 3.192 . 0 0 "[ . 1]" 1 1207 1 92 VAL HA 1 92 VAL MG2 1.800 . 4.500 2.590 2.368 3.177 . 0 0 "[ . 1]" 1 1208 1 92 VAL MG1 1 92 VAL MG2 1.800 . 4.500 2.036 1.942 2.094 . 0 0 "[ . 1]" 1 1209 1 94 ILE MD 1 94 ILE MG 2.500 . 6.000 2.245 2.066 2.676 . 0 0 "[ . 1]" 1 1210 1 94 ILE HB 1 94 ILE MD 2.200 . 5.200 2.258 2.030 2.345 . 0 0 "[ . 1]" 1 1211 1 94 ILE HA 1 94 ILE MD 1.800 . 5.000 4.118 3.989 4.149 . 0 0 "[ . 1]" 1 1212 1 94 ILE HA 1 94 ILE MG 1.800 . 5.300 2.349 2.250 2.412 . 0 0 "[ . 1]" 1 1213 1 97 LEU HA 1 97 LEU HG 2.200 . 5.000 2.981 2.492 3.695 . 0 0 "[ . 1]" 1 1214 1 97 LEU HA 1 97 LEU MD1 2.500 . 6.500 3.254 1.891 3.853 . 0 0 "[ . 1]" 1 1215 1 97 LEU HA 1 97 LEU MD2 2.500 . 6.500 2.353 1.938 2.904 . 0 0 "[ . 1]" 1 1216 1 110 THR HA 1 110 THR MG 1.800 . 4.500 2.342 1.987 3.201 . 0 0 "[ . 1]" 1 1217 1 112 LEU MD1 1 112 LEU MD2 1.800 . 6.000 2.002 1.909 2.087 . 0 0 "[ . 1]" 1 1218 1 112 LEU HA 1 112 LEU MD2 1.800 . 4.500 3.380 2.100 3.835 . 0 0 "[ . 1]" 1 1219 1 112 LEU HA 1 112 LEU MD1 1.800 . 4.500 3.534 2.481 3.843 . 0 0 "[ . 1]" 1 1220 1 116 MET HA 1 116 MET ME 3.000 . 6.500 5.111 4.883 5.326 . 0 0 "[ . 1]" 1 1221 1 116 MET ME 1 116 MET HG3 1.800 . 4.500 2.096 1.993 2.213 . 0 0 "[ . 1]" 1 1222 1 116 MET ME 1 116 MET HG2 1.800 . 4.500 3.087 2.967 3.250 . 0 0 "[ . 1]" 1 1223 1 118 VAL HA 1 118 VAL MG1 1.800 . 4.500 2.405 2.213 3.208 . 0 0 "[ . 1]" 1 1224 1 118 VAL HA 1 118 VAL MG2 1.800 . 4.500 2.435 2.358 2.531 . 0 0 "[ . 1]" 1 1225 1 120 GLU HA 1 120 GLU HG3 2.500 . 5.000 2.894 2.064 3.451 . 0 0 "[ . 1]" 1 1226 1 120 GLU HA 1 120 GLU HG2 2.500 . 5.000 2.492 2.033 3.914 . 0 0 "[ . 1]" 1 1227 1 121 LEU HA 1 121 LEU QD 2.500 . 7.400 2.755 2.037 3.388 . 0 0 "[ . 1]" 1 1228 1 122 ARG HA 1 122 ARG QD 2.500 . 6.500 3.472 2.654 4.100 . 0 0 "[ . 1]" 1 1229 1 126 THR HA 1 126 THR MG 1.800 . 4.500 2.209 1.991 3.214 . 0 0 "[ . 1]" 1 1230 1 128 ILE HB 1 128 ILE MD 2.200 . 5.200 2.218 1.990 2.383 . 0 0 "[ . 1]" 1 1231 1 128 ILE HA 1 128 ILE MD 1.800 . 5.000 3.669 2.088 4.165 . 0 0 "[ . 1]" 1 1232 1 128 ILE HG13 1 128 ILE MG 1.800 . 5.500 2.901 2.439 3.184 . 0 0 "[ . 1]" 1 1233 1 128 ILE HG12 1 128 ILE MG 1.800 . 5.500 2.112 1.965 2.288 . 0 0 "[ . 1]" 1 1234 1 128 ILE HB 1 128 ILE MG 2.000 . 6.000 2.107 2.088 2.127 . 0 0 "[ . 1]" 1 1235 1 128 ILE HA 1 128 ILE MG 1.800 . 5.300 2.410 1.986 3.195 . 0 0 "[ . 1]" 1 1236 1 134 ILE MD 1 134 ILE MG 2.500 . 6.500 2.608 1.708 3.213 0.092 3 0 "[ . 1]" 1 1237 1 134 ILE HB 1 134 ILE MD 2.200 . 5.200 2.550 2.042 3.196 . 0 0 "[ . 1]" 1 1238 1 134 ILE HA 1 134 ILE MD 1.800 . 5.000 3.528 3.246 3.790 . 0 0 "[ . 1]" 1 1239 1 134 ILE HG13 1 134 ILE MG 1.800 . 5.800 2.716 2.533 3.194 . 0 0 "[ . 1]" 1 1240 1 134 ILE HG12 1 134 ILE MG 1.800 . 5.800 2.451 1.965 3.176 . 0 0 "[ . 1]" 1 1241 1 140 LEU HA 1 140 LEU MD1 2.500 . 6.000 3.989 3.878 4.140 . 0 0 "[ . 1]" 1 1242 1 140 LEU HA 1 140 LEU MD2 1.800 . 4.500 2.489 1.951 3.262 . 0 0 "[ . 1]" 1 1243 1 140 LEU MD1 1 140 LEU MD2 1.800 . 6.000 2.022 1.896 2.077 . 0 0 "[ . 1]" 1 1244 1 144 HIS HA 1 144 HIS HD1 1.800 . 4.500 3.114 2.012 4.499 . 0 0 "[ . 1]" 1 1245 1 149 ILE MD 1 149 ILE QG 1.800 . 5.500 1.822 1.757 1.866 0.043 7 0 "[ . 1]" 1 1246 1 149 ILE MD 1 149 ILE MG 2.500 . 6.500 2.673 2.197 3.045 . 0 0 "[ . 1]" 1 1247 1 149 ILE HB 1 149 ILE MD 2.200 . 5.200 2.134 1.994 2.276 . 0 0 "[ . 1]" 1 1248 1 149 ILE HA 1 149 ILE MD 1.800 . 5.300 3.975 3.728 4.154 . 0 0 "[ . 1]" 1 1249 1 149 ILE QG 1 149 ILE MG 1.800 . 5.500 2.050 1.931 2.195 . 0 0 "[ . 1]" 1 1250 1 149 ILE HB 1 149 ILE MG 2.000 . 5.200 2.107 2.095 2.123 . 0 0 "[ . 1]" 1 1251 1 149 ILE HA 1 149 ILE MG 1.800 . 5.300 2.319 2.221 2.432 . 0 0 "[ . 1]" 1 1252 1 163 VAL HA 1 163 VAL MG1 1.800 . 5.000 2.282 2.178 2.391 . 0 0 "[ . 1]" 1 1253 1 163 VAL HA 1 163 VAL MG2 1.800 . 4.500 2.671 2.386 3.200 . 0 0 "[ . 1]" 1 stop_ save_ save_distance_constraint_statistics_2 _Distance_constraint_stats_list.Sf_category distance_constraint_statistics _Distance_constraint_stats_list.Constraint_list_ID 2 _Distance_constraint_stats_list.Constraint_count 110 _Distance_constraint_stats_list.Viol_count 263 _Distance_constraint_stats_list.Viol_total 31.734 _Distance_constraint_stats_list.Viol_max 0.059 _Distance_constraint_stats_list.Viol_rms 0.0076 _Distance_constraint_stats_list.Viol_average_all_restraints 0.0029 _Distance_constraint_stats_list.Viol_average_violations_only 0.0121 _Distance_constraint_stats_list.Cutoff_violation_report 0.500 _Distance_constraint_stats_list.Details . 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 9 LEU 0.022 0.012 9 0 "[ . 1]" 1 11 LEU 0.129 0.028 8 0 "[ . 1]" 1 13 ASN 0.050 0.033 10 0 "[ . 1]" 1 17 GLU 0.050 0.033 10 0 "[ . 1]" 1 20 GLY 0.129 0.028 8 0 "[ . 1]" 1 22 ILE 0.022 0.012 9 0 "[ . 1]" 1 34 VAL 0.180 0.030 5 0 "[ . 1]" 1 36 VAL 0.401 0.059 5 0 "[ . 1]" 1 37 VAL 0.058 0.020 9 0 "[ . 1]" 1 38 ASN 0.132 0.023 5 0 "[ . 1]" 1 39 ALA 0.046 0.019 7 0 "[ . 1]" 1 40 PHE 0.085 0.029 10 0 "[ . 1]" 1 41 LEU 0.163 0.037 2 0 "[ . 1]" 1 42 ARG 0.094 0.023 5 0 "[ . 1]" 1 43 ASN 0.298 0.049 8 0 "[ . 1]" 1 47 GLN 0.298 0.049 8 0 "[ . 1]" 1 48 LEU 0.121 0.025 9 0 "[ . 1]" 1 49 TRP 0.163 0.037 2 0 "[ . 1]" 1 50 ILE 0.421 0.047 9 0 "[ . 1]" 1 68 VAL 0.046 0.019 7 0 "[ . 1]" 1 70 GLY 0.058 0.020 9 0 "[ . 1]" 1 77 THR 0.030 0.010 1 0 "[ . 1]" 1 78 TYR 0.001 0.001 10 0 "[ . 1]" 1 79 GLU 0.012 0.007 7 0 "[ . 1]" 1 80 GLU 0.017 0.012 3 0 "[ . 1]" 1 81 ALA 0.060 0.010 1 0 "[ . 1]" 1 82 PHE 0.018 0.007 3 0 "[ . 1]" 1 83 ARG 0.015 0.007 7 0 "[ . 1]" 1 84 ARG 0.017 0.012 3 0 "[ . 1]" 1 85 GLU 0.029 0.009 10 0 "[ . 1]" 1 86 ALA 0.016 0.007 3 0 "[ . 1]" 1 87 ARG 0.002 0.002 4 0 "[ . 1]" 1 88 GLU 0.000 0.000 . 0 "[ . 1]" 1 98 SER 0.000 0.000 8 0 "[ . 1]" 1 100 ARG 0.242 0.042 2 0 "[ . 1]" 1 102 LEU 0.053 0.021 1 0 "[ . 1]" 1 103 ALA 0.060 0.018 9 0 "[ . 1]" 1 105 PHE 0.178 0.038 4 0 "[ . 1]" 1 115 PHE 0.213 0.030 5 0 "[ . 1]" 1 116 MET 0.178 0.038 4 0 "[ . 1]" 1 117 CYS 0.479 0.059 5 0 "[ . 1]" 1 118 VAL 0.112 0.021 1 0 "[ . 1]" 1 119 TYR 0.079 0.025 7 0 "[ . 1]" 1 120 GLU 0.242 0.042 2 0 "[ . 1]" 1 121 LEU 0.059 0.029 10 0 "[ . 1]" 1 122 ARG 0.000 0.000 8 0 "[ . 1]" 1 123 SER 0.064 0.023 5 0 "[ . 1]" 1 138 GLU 0.421 0.047 9 0 "[ . 1]" 1 140 LEU 0.121 0.025 9 0 "[ . 1]" 1 141 THR 0.031 0.022 3 0 "[ . 1]" 1 142 PRO 0.051 0.023 3 0 "[ . 1]" 1 143 GLU 0.021 0.006 9 0 "[ . 1]" 1 144 HIS 0.012 0.007 3 0 "[ . 1]" 1 145 LEU 0.031 0.022 3 0 "[ . 1]" 1 146 LEU 0.074 0.023 3 0 "[ . 1]" 1 147 ALA 0.021 0.006 9 0 "[ . 1]" 1 148 ARG 0.012 0.007 3 0 "[ . 1]" 1 149 ILE 0.000 0.000 . 0 "[ . 1]" 1 150 ALA 0.024 0.012 3 0 "[ . 1]" 1 156 LYS 0.080 0.034 7 0 "[ . 1]" 1 157 GLY 0.022 0.010 3 0 "[ . 1]" 1 158 ASP 0.006 0.004 3 0 "[ . 1]" 1 159 LEU 0.000 0.000 . 0 "[ . 1]" 1 160 ALA 0.114 0.034 7 0 "[ . 1]" 1 161 GLU 0.055 0.010 3 0 "[ . 1]" 1 162 LEU 0.013 0.005 1 0 "[ . 1]" 1 163 VAL 0.009 0.005 4 0 "[ . 1]" 1 164 ARG 0.033 0.013 1 0 "[ . 1]" 1 165 ARG 0.034 0.010 3 0 "[ . 1]" 1 166 CYS 0.007 0.005 1 0 "[ . 1]" 1 167 TYR 0.009 0.005 4 0 "[ . 1]" 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 9 LEU O 1 22 ILE H 1.800 . 2.300 2.055 1.840 2.300 . 0 0 "[ . 1]" 2 2 1 9 LEU O 1 22 ILE N 2.800 2.800 3.300 2.907 2.797 3.022 0.003 2 0 "[ . 1]" 2 3 1 9 LEU H 1 22 ILE O 1.800 . 2.300 2.018 1.904 2.304 0.004 1 0 "[ . 1]" 2 4 1 9 LEU N 1 22 ILE O 2.800 2.800 3.300 2.874 2.788 3.097 0.012 9 0 "[ . 1]" 2 5 1 13 ASN H 1 17 GLU O 1.800 . 2.300 2.072 1.822 2.333 0.033 10 0 "[ . 1]" 2 6 1 13 ASN N 1 17 GLU O 2.800 2.800 3.300 3.026 2.792 3.303 0.008 8 0 "[ . 1]" 2 7 1 11 LEU O 1 20 GLY H 1.800 . 2.300 2.301 2.238 2.328 0.028 8 0 "[ . 1]" 2 8 1 11 LEU O 1 20 GLY N 2.800 2.800 3.300 3.257 3.204 3.291 . 0 0 "[ . 1]" 2 9 1 11 LEU H 1 20 GLY O 1.800 . 2.300 2.181 2.002 2.315 0.015 9 0 "[ . 1]" 2 10 1 11 LEU N 1 20 GLY O 2.800 2.800 3.300 3.039 2.904 3.136 . 0 0 "[ . 1]" 2 11 1 39 ALA O 1 68 VAL H 1.800 . 2.300 2.130 1.917 2.304 0.004 10 0 "[ . 1]" 2 12 1 39 ALA O 1 68 VAL N 2.800 2.800 3.300 3.079 2.885 3.253 . 0 0 "[ . 1]" 2 13 1 37 VAL O 1 70 GLY H 1.800 . 2.300 2.100 1.865 2.305 0.005 2 0 "[ . 1]" 2 14 1 37 VAL O 1 70 GLY N 2.800 2.800 3.300 2.926 2.837 3.050 . 0 0 "[ . 1]" 2 15 1 37 VAL H 1 70 GLY O 1.800 . 2.300 2.002 1.852 2.320 0.020 9 0 "[ . 1]" 2 16 1 37 VAL N 1 70 GLY O 2.800 2.800 3.300 2.931 2.787 3.285 0.013 7 0 "[ . 1]" 2 17 1 39 ALA H 1 68 VAL O 1.800 . 2.300 2.149 1.992 2.306 0.006 1 0 "[ . 1]" 2 18 1 39 ALA N 1 68 VAL O 2.800 2.800 3.300 2.881 2.781 2.989 0.019 7 0 "[ . 1]" 2 19 1 36 VAL H 1 115 PHE O 1.800 . 2.300 2.095 1.913 2.258 . 0 0 "[ . 1]" 2 20 1 36 VAL N 1 115 PHE O 2.800 2.800 3.300 2.915 2.786 3.094 0.014 3 0 "[ . 1]" 2 21 1 38 ASN H 1 117 CYS O 1.800 . 2.300 2.286 2.178 2.321 0.021 6 0 "[ . 1]" 2 22 1 38 ASN N 1 117 CYS O 2.800 2.800 3.300 2.935 2.777 3.044 0.023 5 0 "[ . 1]" 2 23 1 40 PHE H 1 119 TYR O 1.800 . 2.300 1.939 1.852 2.179 . 0 0 "[ . 1]" 2 24 1 40 PHE N 1 119 TYR O 2.800 2.800 3.300 2.836 2.775 3.096 0.025 7 0 "[ . 1]" 2 25 1 38 ASN O 1 119 TYR H 1.800 . 2.300 2.086 1.887 2.312 0.012 9 0 "[ . 1]" 2 26 1 38 ASN O 1 119 TYR N 2.800 2.800 3.300 2.962 2.790 3.140 0.010 3 0 "[ . 1]" 2 27 1 40 PHE O 1 121 LEU H 1.800 . 2.300 2.201 1.957 2.329 0.029 10 0 "[ . 1]" 2 28 1 40 PHE O 1 121 LEU N 2.800 2.800 3.300 3.081 2.909 3.220 . 0 0 "[ . 1]" 2 29 1 100 ARG O 1 120 GLU H 1.800 . 2.300 1.940 1.810 2.202 . 0 0 "[ . 1]" 2 30 1 100 ARG O 1 120 GLU N 2.800 2.800 3.300 2.811 2.758 3.037 0.042 2 0 "[ . 1]" 2 31 1 103 ALA O 1 118 VAL H 1.800 . 2.300 1.906 1.843 2.034 . 0 0 "[ . 1]" 2 32 1 103 ALA O 1 118 VAL N 2.800 2.800 3.300 2.824 2.782 2.987 0.018 9 0 "[ . 1]" 2 33 1 105 PHE H 1 116 MET O 1.800 . 2.300 2.108 1.918 2.311 0.011 1 0 "[ . 1]" 2 34 1 105 PHE N 1 116 MET O 2.800 2.800 3.300 2.934 2.782 3.184 0.018 10 0 "[ . 1]" 2 35 1 102 LEU H 1 118 VAL O 1.800 . 2.300 2.213 2.035 2.310 0.010 6 0 "[ . 1]" 2 36 1 102 LEU N 1 118 VAL O 2.800 2.800 3.300 2.902 2.779 3.210 0.021 1 0 "[ . 1]" 2 37 1 103 ALA H 1 118 VAL O 1.800 . 2.300 2.120 2.000 2.292 . 0 0 "[ . 1]" 2 38 1 103 ALA N 1 118 VAL O 2.800 2.800 3.300 3.055 2.885 3.256 . 0 0 "[ . 1]" 2 39 1 100 ARG H 1 120 GLU O 1.800 . 2.300 2.293 2.149 2.324 0.024 10 0 "[ . 1]" 2 40 1 100 ARG N 1 120 GLU O 2.800 2.800 3.300 3.031 2.795 3.162 0.005 2 0 "[ . 1]" 2 41 1 36 VAL O 1 117 CYS H 1.800 . 2.300 2.337 2.316 2.359 0.059 5 0 "[ . 1]" 2 42 1 36 VAL O 1 117 CYS N 2.800 2.800 3.300 3.165 3.068 3.207 . 0 0 "[ . 1]" 2 43 1 34 VAL O 1 115 PHE H 1.800 . 2.300 2.318 2.305 2.330 0.030 5 0 "[ . 1]" 2 44 1 34 VAL O 1 115 PHE N 2.800 2.800 3.300 2.982 2.914 3.072 . 0 0 "[ . 1]" 2 45 1 42 ARG O 1 123 SER H 1.800 . 2.300 2.265 2.003 2.323 0.023 5 0 "[ . 1]" 2 46 1 42 ARG O 1 123 SER N 2.800 2.800 3.300 3.064 2.799 3.154 0.001 3 0 "[ . 1]" 2 47 1 105 PHE O 1 116 MET H 1.800 . 2.300 2.303 2.257 2.338 0.038 4 0 "[ . 1]" 2 48 1 105 PHE O 1 116 MET N 2.800 2.800 3.300 3.103 2.864 3.300 . 0 0 "[ . 1]" 2 49 1 98 SER O 1 122 ARG H 1.800 . 2.300 2.093 1.884 2.300 0.000 8 0 "[ . 1]" 2 50 1 98 SER O 1 122 ARG N 2.800 2.800 3.300 3.045 2.812 3.262 . 0 0 "[ . 1]" 2 51 1 50 ILE H 1 138 GLU O 1.800 . 2.300 1.961 1.840 2.032 . 0 0 "[ . 1]" 2 52 1 50 ILE N 1 138 GLU O 2.800 2.800 3.300 2.793 2.766 2.907 0.034 2 0 "[ . 1]" 2 53 1 48 LEU H 1 140 LEU O 1.800 . 2.300 2.281 2.081 2.318 0.018 2 0 "[ . 1]" 2 54 1 48 LEU N 1 140 LEU O 2.800 2.800 3.300 3.086 2.802 3.179 . 0 0 "[ . 1]" 2 55 1 48 LEU O 1 140 LEU H 1.800 . 2.300 2.041 1.979 2.226 . 0 0 "[ . 1]" 2 56 1 48 LEU O 1 140 LEU N 2.800 2.800 3.300 2.869 2.775 3.094 0.025 9 0 "[ . 1]" 2 57 1 50 ILE O 1 138 GLU H 1.800 . 2.300 2.314 2.224 2.347 0.047 9 0 "[ . 1]" 2 58 1 50 ILE O 1 138 GLU N 2.800 2.800 3.300 3.261 3.153 3.321 0.021 9 0 "[ . 1]" 2 59 1 41 LEU O 1 49 TRP H 1.800 . 2.300 2.299 2.181 2.337 0.037 2 0 "[ . 1]" 2 60 1 41 LEU O 1 49 TRP N 2.800 2.800 3.300 3.267 3.154 3.301 0.001 7 0 "[ . 1]" 2 61 1 42 ARG H 1 121 LEU O 1.800 . 2.300 2.238 2.123 2.313 0.013 9 0 "[ . 1]" 2 62 1 42 ARG N 1 121 LEU O 2.800 2.800 3.300 3.184 3.077 3.278 . 0 0 "[ . 1]" 2 63 1 43 ASN H 1 47 GLN O 1.800 . 2.300 2.205 1.892 2.333 0.033 10 0 "[ . 1]" 2 64 1 43 ASN N 1 47 GLN O 2.800 2.800 3.300 3.053 2.808 3.192 . 0 0 "[ . 1]" 2 65 1 43 ASN O 1 47 GLN H 1.800 . 2.300 2.190 1.830 2.349 0.049 8 0 "[ . 1]" 2 66 1 43 ASN O 1 47 GLN N 2.800 2.800 3.300 3.084 2.794 3.307 0.007 8 0 "[ . 1]" 2 67 1 77 THR O 1 81 ALA H 1.800 . 2.300 2.215 2.023 2.310 0.010 1 0 "[ . 1]" 2 68 1 77 THR O 1 81 ALA N 2.800 2.800 3.300 3.128 2.935 3.266 . 0 0 "[ . 1]" 2 69 1 78 TYR O 1 82 PHE H 1.800 . 2.300 2.029 1.923 2.300 . 7 0 "[ . 1]" 2 70 1 78 TYR O 1 82 PHE N 2.800 2.800 3.300 2.964 2.799 3.271 0.001 10 0 "[ . 1]" 2 71 1 79 GLU O 1 83 ARG H 1.800 . 2.300 2.032 1.856 2.147 . 0 0 "[ . 1]" 2 72 1 79 GLU O 1 83 ARG N 2.800 2.800 3.300 2.905 2.793 3.096 0.007 7 0 "[ . 1]" 2 73 1 80 GLU O 1 84 ARG H 1.800 . 2.300 2.231 2.076 2.312 0.012 3 0 "[ . 1]" 2 74 1 80 GLU O 1 84 ARG N 2.800 2.800 3.300 3.148 2.997 3.283 . 0 0 "[ . 1]" 2 75 1 81 ALA O 1 85 GLU H 1.800 . 2.300 2.120 1.884 2.309 0.009 10 0 "[ . 1]" 2 76 1 81 ALA O 1 85 GLU N 2.800 2.800 3.300 3.058 2.796 3.283 0.004 6 0 "[ . 1]" 2 77 1 82 PHE O 1 86 ALA H 1.800 . 2.300 2.067 1.843 2.303 0.003 9 0 "[ . 1]" 2 78 1 82 PHE O 1 86 ALA N 2.800 2.800 3.300 2.912 2.793 3.148 0.007 3 0 "[ . 1]" 2 79 1 83 ARG O 1 87 ARG H 1.800 . 2.300 2.036 1.825 2.292 . 0 0 "[ . 1]" 2 80 1 83 ARG O 1 87 ARG N 2.800 2.800 3.300 2.937 2.798 3.250 0.002 4 0 "[ . 1]" 2 81 1 84 ARG O 1 88 GLU H 1.800 . 2.300 2.087 1.865 2.299 . 0 0 "[ . 1]" 2 82 1 84 ARG O 1 88 GLU N 2.800 2.800 3.300 2.983 2.825 3.160 . 0 0 "[ . 1]" 2 83 1 141 THR O 1 145 LEU H 1.800 . 2.300 2.011 1.814 2.158 . 0 0 "[ . 1]" 2 84 1 141 THR O 1 145 LEU N 2.800 2.800 3.300 2.929 2.778 3.111 0.022 3 0 "[ . 1]" 2 85 1 142 PRO O 1 146 LEU H 1.800 . 2.300 2.222 1.881 2.323 0.023 3 0 "[ . 1]" 2 86 1 142 PRO O 1 146 LEU N 2.800 2.800 3.300 3.185 2.856 3.297 . 0 0 "[ . 1]" 2 87 1 143 GLU O 1 147 ALA H 1.800 . 2.300 2.290 2.197 2.306 0.006 9 0 "[ . 1]" 2 88 1 143 GLU O 1 147 ALA N 2.800 2.800 3.300 3.116 3.027 3.198 . 0 0 "[ . 1]" 2 89 1 144 HIS O 1 148 ARG H 1.800 . 2.300 2.044 1.895 2.273 . 0 0 "[ . 1]" 2 90 1 144 HIS O 1 148 ARG N 2.800 2.800 3.300 2.858 2.793 3.073 0.007 3 0 "[ . 1]" 2 91 1 145 LEU O 1 149 ILE H 1.800 . 2.300 2.088 1.946 2.298 . 0 0 "[ . 1]" 2 92 1 145 LEU O 1 149 ILE N 2.800 2.800 3.300 3.061 2.919 3.275 . 0 0 "[ . 1]" 2 93 1 146 LEU O 1 150 ALA H 1.800 . 2.300 2.200 1.987 2.312 0.012 3 0 "[ . 1]" 2 94 1 146 LEU O 1 150 ALA N 2.800 2.800 3.300 2.993 2.798 3.119 0.002 10 0 "[ . 1]" 2 95 1 163 VAL O 1 167 TYR H 1.800 . 2.300 2.029 1.840 2.275 . 0 0 "[ . 1]" 2 96 1 163 VAL O 1 167 TYR N 2.800 2.800 3.300 2.925 2.795 3.124 0.005 4 0 "[ . 1]" 2 97 1 162 LEU O 1 166 CYS H 1.800 . 2.300 2.153 1.984 2.305 0.005 1 0 "[ . 1]" 2 98 1 162 LEU O 1 166 CYS N 2.800 2.800 3.300 3.032 2.856 3.194 . 0 0 "[ . 1]" 2 99 1 161 GLU O 1 165 ARG H 1.800 . 2.300 2.264 2.047 2.306 0.006 4 0 "[ . 1]" 2 100 1 161 GLU O 1 165 ARG N 2.800 2.800 3.300 3.032 2.790 3.129 0.010 3 0 "[ . 1]" 2 101 1 160 ALA O 1 164 ARG H 1.800 . 2.300 2.125 1.871 2.303 0.003 4 0 "[ . 1]" 2 102 1 160 ALA O 1 164 ARG N 2.800 2.800 3.300 3.015 2.787 3.252 0.013 1 0 "[ . 1]" 2 103 1 159 LEU O 1 163 VAL H 1.800 . 2.300 2.020 1.833 2.269 . 0 0 "[ . 1]" 2 104 1 159 LEU O 1 163 VAL N 2.800 2.800 3.300 2.965 2.807 3.247 . 0 0 "[ . 1]" 2 105 1 158 ASP O 1 162 LEU H 1.800 . 2.300 2.086 1.873 2.304 0.004 3 0 "[ . 1]" 2 106 1 158 ASP O 1 162 LEU N 2.800 2.800 3.300 2.929 2.798 3.245 0.002 2 0 "[ . 1]" 2 107 1 157 GLY O 1 161 GLU H 1.800 . 2.300 2.083 1.828 2.309 0.009 5 0 "[ . 1]" 2 108 1 157 GLY O 1 161 GLU N 2.800 2.800 3.300 3.000 2.790 3.240 0.010 3 0 "[ . 1]" 2 109 1 156 LYS O 1 160 ALA H 1.800 . 2.300 2.283 2.150 2.334 0.034 7 0 "[ . 1]" 2 110 1 156 LYS O 1 160 ALA N 2.800 2.800 3.300 3.230 3.126 3.303 0.003 7 0 "[ . 1]" 2 stop_ save_
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