NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
501548 | 2lak | 17530 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2lak 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 1493 _Distance_constraint_stats_list.Viol_count 803 _Distance_constraint_stats_list.Viol_total 924.548 _Distance_constraint_stats_list.Viol_max 0.347 _Distance_constraint_stats_list.Viol_rms 0.0131 _Distance_constraint_stats_list.Viol_average_all_restraints 0.0015 _Distance_constraint_stats_list.Viol_average_violations_only 0.0576 _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 2 GLU 0.368 0.135 11 0 "[ . 1 . 2]" 1 3 LYS 0.411 0.135 11 0 "[ . 1 . 2]" 1 4 ALA 0.082 0.043 1 0 "[ . 1 . 2]" 1 5 MET 0.948 0.158 12 0 "[ . 1 . 2]" 1 6 PRO 0.826 0.224 13 0 "[ . 1 . 2]" 1 7 GLU 1.695 0.238 2 0 "[ . 1 . 2]" 1 8 SER 0.547 0.189 14 0 "[ . 1 . 2]" 1 9 PHE 0.673 0.189 14 0 "[ . 1 . 2]" 1 10 VAL 0.471 0.071 3 0 "[ . 1 . 2]" 1 11 VAL 0.818 0.135 17 0 "[ . 1 . 2]" 1 12 ARG 0.000 0.000 . 0 "[ . 1 . 2]" 1 13 ARG 1.077 0.150 12 0 "[ . 1 . 2]" 1 14 GLU 0.376 0.203 7 0 "[ . 1 . 2]" 1 15 ALA 0.299 0.048 12 0 "[ . 1 . 2]" 1 16 HIS 0.089 0.089 7 0 "[ . 1 . 2]" 1 17 LEU 0.236 0.079 9 0 "[ . 1 . 2]" 1 18 ALA 0.254 0.080 14 0 "[ . 1 . 2]" 1 19 ALA 0.818 0.089 15 0 "[ . 1 . 2]" 1 20 PRO 0.546 0.133 13 0 "[ . 1 . 2]" 1 21 PRO 0.393 0.125 13 0 "[ . 1 . 2]" 1 22 ALA 0.479 0.072 7 0 "[ . 1 . 2]" 1 23 ALA 0.237 0.133 13 0 "[ . 1 . 2]" 1 24 VAL 0.532 0.089 15 0 "[ . 1 . 2]" 1 25 PHE 0.560 0.102 3 0 "[ . 1 . 2]" 1 26 ALA 0.169 0.094 3 0 "[ . 1 . 2]" 1 27 LEU 1.078 0.104 18 0 "[ . 1 . 2]" 1 28 MET 1.377 0.102 3 0 "[ . 1 . 2]" 1 29 THR 0.245 0.072 14 0 "[ . 1 . 2]" 1 30 ASP 0.555 0.147 18 0 "[ . 1 . 2]" 1 31 PRO 1.141 0.216 20 0 "[ . 1 . 2]" 1 32 GLU 0.040 0.040 19 0 "[ . 1 . 2]" 1 33 LYS 2.019 0.166 16 0 "[ . 1 . 2]" 1 34 ILE 1.144 0.225 11 0 "[ . 1 . 2]" 1 35 LEU 0.556 0.092 19 0 "[ . 1 . 2]" 1 36 ARG 2.455 0.223 8 0 "[ . 1 . 2]" 1 37 TRP 1.505 0.174 8 0 "[ . 1 . 2]" 1 38 MET 1.233 0.225 11 0 "[ . 1 . 2]" 1 39 GLY 0.287 0.079 17 0 "[ . 1 . 2]" 1 40 THR 0.660 0.302 4 0 "[ . 1 . 2]" 1 41 GLU 2.327 0.330 6 0 "[ . 1 . 2]" 1 42 ALA 1.845 0.347 6 0 "[ . 1 . 2]" 1 43 GLU 0.291 0.216 20 0 "[ . 1 . 2]" 1 44 VAL 1.022 0.215 20 0 "[ . 1 . 2]" 1 45 GLU 0.748 0.141 9 0 "[ . 1 . 2]" 1 46 PRO 0.432 0.107 10 0 "[ . 1 . 2]" 1 47 GLU 0.000 0.000 . 0 "[ . 1 . 2]" 1 48 PRO 0.098 0.056 4 0 "[ . 1 . 2]" 1 49 GLY 0.236 0.146 17 0 "[ . 1 . 2]" 1 50 GLY 0.906 0.146 17 0 "[ . 1 . 2]" 1 51 LEU 0.611 0.093 4 0 "[ . 1 . 2]" 1 52 TYR 0.181 0.088 20 0 "[ . 1 . 2]" 1 53 LEU 0.876 0.289 12 0 "[ . 1 . 2]" 1 54 VAL 1.095 0.347 6 0 "[ . 1 . 2]" 1 55 ASN 1.386 0.330 6 0 "[ . 1 . 2]" 1 56 VAL 0.026 0.011 16 0 "[ . 1 . 2]" 1 57 THR 0.098 0.092 17 0 "[ . 1 . 2]" 1 58 GLY 0.588 0.190 6 0 "[ . 1 . 2]" 1 59 ALA 0.725 0.190 6 0 "[ . 1 . 2]" 1 60 ARG 0.232 0.076 15 0 "[ . 1 . 2]" 1 61 PHE 0.227 0.088 8 0 "[ . 1 . 2]" 1 62 ALA 0.095 0.069 6 0 "[ . 1 . 2]" 1 63 ARG 0.095 0.069 6 0 "[ . 1 . 2]" 1 65 SER 0.111 0.095 17 0 "[ . 1 . 2]" 1 66 PHE 0.977 0.142 8 0 "[ . 1 . 2]" 1 67 ARG 0.442 0.107 8 0 "[ . 1 . 2]" 1 68 GLU 1.456 0.142 8 0 "[ . 1 . 2]" 1 69 VAL 0.672 0.314 19 0 "[ . 1 . 2]" 1 70 VAL 1.400 0.195 19 0 "[ . 1 . 2]" 1 71 PRO 0.168 0.046 20 0 "[ . 1 . 2]" 1 72 VAL 0.816 0.076 14 0 "[ . 1 . 2]" 1 73 HIS 0.370 0.065 20 0 "[ . 1 . 2]" 1 74 ARG 1.707 0.195 19 0 "[ . 1 . 2]" 1 75 LEU 0.954 0.314 19 0 "[ . 1 . 2]" 1 76 ALA 0.861 0.131 19 0 "[ . 1 . 2]" 1 77 TYR 0.338 0.107 8 0 "[ . 1 . 2]" 1 78 SER 0.418 0.224 17 0 "[ . 1 . 2]" 1 79 PHE 0.522 0.175 17 0 "[ . 1 . 2]" 1 80 GLY 0.197 0.136 13 0 "[ . 1 . 2]" 1 81 TRP 0.473 0.234 17 0 "[ . 1 . 2]" 1 82 ASP 0.060 0.043 19 0 "[ . 1 . 2]" 1 83 GLY 0.000 0.000 . 0 "[ . 1 . 2]" 1 84 SER 0.086 0.086 14 0 "[ . 1 . 2]" 1 85 GLU 1.506 0.328 14 0 "[ . 1 . 2]" 1 86 VAL 1.900 0.328 14 0 "[ . 1 . 2]" 1 87 VAL 1.644 0.234 17 0 "[ . 1 . 2]" 1 88 PRO 0.986 0.292 5 0 "[ . 1 . 2]" 1 89 PRO 0.000 0.000 . 0 "[ . 1 . 2]" 1 90 GLY 0.000 0.000 . 0 "[ . 1 . 2]" 1 91 SER 1.696 0.292 5 0 "[ . 1 . 2]" 1 92 SER 0.770 0.150 9 0 "[ . 1 . 2]" 1 93 LEU 1.305 0.224 17 0 "[ . 1 . 2]" 1 94 VAL 0.521 0.185 14 0 "[ . 1 . 2]" 1 95 GLU 0.354 0.211 4 0 "[ . 1 . 2]" 1 96 ILE 0.347 0.096 2 0 "[ . 1 . 2]" 1 97 ASP 0.193 0.100 17 0 "[ . 1 . 2]" 1 98 LEU 0.903 0.081 14 0 "[ . 1 . 2]" 1 99 ILE 1.587 0.246 16 0 "[ . 1 . 2]" 1 100 GLU 0.419 0.097 9 0 "[ . 1 . 2]" 1 101 GLN 0.762 0.143 16 0 "[ . 1 . 2]" 1 102 GLY 0.000 0.000 . 0 "[ . 1 . 2]" 1 103 GLY 0.000 0.000 . 0 "[ . 1 . 2]" 1 104 GLY 0.056 0.043 9 0 "[ . 1 . 2]" 1 105 THR 0.578 0.097 9 0 "[ . 1 . 2]" 1 106 LEU 1.634 0.246 16 0 "[ . 1 . 2]" 1 107 LEU 0.573 0.091 16 0 "[ . 1 . 2]" 1 108 ARG 0.470 0.182 8 0 "[ . 1 . 2]" 1 109 LEU 0.628 0.096 2 0 "[ . 1 . 2]" 1 110 THR 0.418 0.072 3 0 "[ . 1 . 2]" 1 111 HIS 0.160 0.097 13 0 "[ . 1 . 2]" 1 112 SER 0.298 0.071 8 0 "[ . 1 . 2]" 1 113 GLY 0.512 0.150 9 0 "[ . 1 . 2]" 1 114 LEU 1.152 0.221 17 0 "[ . 1 . 2]" 1 115 PRO 0.307 0.090 11 0 "[ . 1 . 2]" 1 116 SER 0.167 0.060 13 0 "[ . 1 . 2]" 1 117 ALA 0.000 0.000 . 0 "[ . 1 . 2]" 1 118 GLU 0.000 0.000 . 0 "[ . 1 . 2]" 1 119 GLN 0.202 0.048 18 0 "[ . 1 . 2]" 1 120 CYS 0.214 0.081 6 0 "[ . 1 . 2]" 1 121 ALA 0.000 0.000 . 0 "[ . 1 . 2]" 1 122 GLY 0.000 0.000 . 0 "[ . 1 . 2]" 1 123 HIS 0.188 0.048 8 0 "[ . 1 . 2]" 1 124 GLU 0.380 0.150 12 0 "[ . 1 . 2]" 1 125 GLU 0.000 0.000 . 0 "[ . 1 . 2]" 1 126 GLY 0.000 0.000 . 0 "[ . 1 . 2]" 1 127 TRP 0.026 0.026 18 0 "[ . 1 . 2]" 1 128 ALA 0.000 0.000 . 0 "[ . 1 . 2]" 1 129 HIS 0.000 0.000 . 0 "[ . 1 . 2]" 1 130 TYR 0.214 0.080 15 0 "[ . 1 . 2]" 1 131 LEU 0.210 0.095 8 0 "[ . 1 . 2]" 1 132 GLY 0.000 0.000 . 0 "[ . 1 . 2]" 1 133 ARG 0.309 0.080 15 0 "[ . 1 . 2]" 1 134 LEU 0.177 0.102 8 0 "[ . 1 . 2]" 1 135 THR 0.100 0.079 9 0 "[ . 1 . 2]" 1 136 GLU 0.032 0.032 14 0 "[ . 1 . 2]" 1 137 VAL 2.080 0.223 8 0 "[ . 1 . 2]" 1 138 ALA 0.182 0.062 17 0 "[ . 1 . 2]" 1 139 ALA 0.132 0.039 14 0 "[ . 1 . 2]" 1 140 GLY 0.746 0.225 3 0 "[ . 1 . 2]" 1 141 ARG 1.460 0.225 3 0 "[ . 1 . 2]" 1 142 ASP 0.472 0.144 9 0 "[ . 1 . 2]" 1 143 PRO 1.002 0.174 8 0 "[ . 1 . 2]" 1 144 GLY 0.336 0.101 8 0 "[ . 1 . 2]" 1 145 PRO 0.827 0.279 9 0 "[ . 1 . 2]" 1 146 ASP 0.518 0.203 14 0 "[ . 1 . 2]" 1 147 PRO 1.110 0.279 9 0 "[ . 1 . 2]" 1 148 PHE 0.658 0.206 14 0 "[ . 1 . 2]" 1 149 TYR 0.658 0.206 14 0 "[ . 1 . 2]" 1 151 ARG 0.032 0.023 9 0 "[ . 1 . 2]" 1 152 ARG 0.009 0.009 17 0 "[ . 1 . 2]" 1 159 HIS 0.000 0.000 . 0 "[ . 1 . 2]" 1 160 HIS 0.000 0.000 . 0 "[ . 1 . 2]" stop_ loop_ _Distance_constraint_stats.Restraint_ID _Distance_constraint_stats.Atom_1_entity_assembly_ID _Distance_constraint_stats.Atom_1_comp_index_ID _Distance_constraint_stats.Atom_1_comp_ID _Distance_constraint_stats.Atom_1_ID _Distance_constraint_stats.Atom_2_entity_assembly_ID _Distance_constraint_stats.Atom_2_comp_index_ID _Distance_constraint_stats.Atom_2_comp_ID _Distance_constraint_stats.Atom_2_ID _Distance_constraint_stats.Node_1_distance_val _Distance_constraint_stats.Node_1_distance_lower_bound_val _Distance_constraint_stats.Node_1_distance_upper_bound_val _Distance_constraint_stats.Distance_average _Distance_constraint_stats.Distance_minimum _Distance_constraint_stats.Distance_maximum _Distance_constraint_stats.Max_violation _Distance_constraint_stats.Max_violation_model_number _Distance_constraint_stats.Over_cutoff_violation_count _Distance_constraint_stats.Over_cutoff_viol_per_model _Distance_constraint_stats.Distance_constraint_stats_ID 1 1 2 GLU HA 1 3 LYS H 1.800 . 3.390 2.650 2.168 3.525 0.135 11 0 "[ . 1 . 2]" 1 2 1 2 GLU QB 1 3 LYS H 1.800 . 4.000 3.169 1.757 4.015 0.043 17 0 "[ . 1 . 2]" 1 3 1 3 LYS HA 1 4 ALA H 1.800 . 3.600 2.684 2.148 3.585 . 0 0 "[ . 1 . 2]" 1 4 1 3 LYS QB 1 3 LYS QD 1.800 . 3.330 2.177 2.126 2.365 . 0 0 "[ . 1 . 2]" 1 5 1 3 LYS QB 1 4 ALA H 1.800 . 4.100 3.109 1.757 3.986 0.043 1 0 "[ . 1 . 2]" 1 6 1 3 LYS QG 1 4 ALA H 1.800 . 6.050 3.431 2.510 4.468 . 0 0 "[ . 1 . 2]" 1 7 1 3 LYS H 1 3 LYS QB 1.800 . 3.890 2.630 2.283 3.388 . 0 0 "[ . 1 . 2]" 1 8 1 3 LYS H 1 3 LYS QD 1.800 . 5.870 4.158 2.793 5.101 . 0 0 "[ . 1 . 2]" 1 9 1 3 LYS H 1 3 LYS QG 1.800 . 4.740 3.039 1.810 4.170 . 0 0 "[ . 1 . 2]" 1 10 1 4 ALA HA 1 5 MET H 1.800 . 3.600 2.524 2.160 3.338 . 0 0 "[ . 1 . 2]" 1 11 1 4 ALA MB 1 5 MET H 1.800 . 4.250 2.951 1.760 3.725 0.040 10 0 "[ . 1 . 2]" 1 12 1 4 ALA H 1 4 ALA MB 1.800 . 3.630 2.496 2.214 2.940 . 0 0 "[ . 1 . 2]" 1 13 1 5 MET HA 1 6 PRO HD3 1.800 . 3.900 2.674 2.139 3.775 . 0 0 "[ . 1 . 2]" 1 14 1 5 MET HA 1 6 PRO HD2 1.800 . 3.900 2.525 2.282 4.058 0.158 16 0 "[ . 1 . 2]" 1 15 1 5 MET H 1 5 MET QB 1.800 . 3.890 2.913 2.175 3.357 . 0 0 "[ . 1 . 2]" 1 16 1 5 MET H 1 5 MET QG 1.800 . 4.200 3.241 1.779 4.358 0.158 12 0 "[ . 1 . 2]" 1 17 1 5 MET H 1 6 PRO QD 1.800 . 4.830 3.045 1.712 4.476 0.088 16 0 "[ . 1 . 2]" 1 18 1 6 PRO HA 1 7 GLU H 1.800 . 3.320 2.466 2.164 3.544 0.224 13 0 "[ . 1 . 2]" 1 19 1 6 PRO HB3 1 7 GLU H 1.800 . 4.300 3.520 2.427 4.005 . 0 0 "[ . 1 . 2]" 1 20 1 6 PRO HB2 1 7 GLU H 1.800 . 4.300 3.199 1.842 3.805 . 0 0 "[ . 1 . 2]" 1 21 1 7 GLU HA 1 8 SER H 1.800 . 3.800 2.798 2.160 3.565 . 0 0 "[ . 1 . 2]" 1 22 1 7 GLU QB 1 8 SER H 1.800 . 4.000 3.122 1.799 4.053 0.053 14 0 "[ . 1 . 2]" 1 23 1 7 GLU HG3 1 8 SER H 1.800 . 5.300 4.037 2.361 5.348 0.048 15 0 "[ . 1 . 2]" 1 24 1 7 GLU HG2 1 8 SER H 1.800 . 5.300 3.883 2.248 5.188 . 0 0 "[ . 1 . 2]" 1 25 1 7 GLU H 1 7 GLU HG3 1.800 . 4.600 3.661 2.284 4.792 0.192 13 0 "[ . 1 . 2]" 1 26 1 7 GLU H 1 7 GLU HG2 1.800 . 4.600 3.674 1.869 4.838 0.238 2 0 "[ . 1 . 2]" 1 27 1 7 GLU H 1 8 SER H 1.800 . 4.650 3.399 1.801 4.669 0.019 1 0 "[ . 1 . 2]" 1 28 1 8 SER HA 1 9 PHE H 1.800 . 3.380 2.647 2.132 3.569 0.189 14 0 "[ . 1 . 2]" 1 29 1 8 SER QB 1 9 PHE H 1.800 . 4.000 2.870 1.888 3.912 . 0 0 "[ . 1 . 2]" 1 30 1 8 SER H 1 8 SER QB 1.800 . 3.410 2.722 2.262 3.445 0.035 19 0 "[ . 1 . 2]" 1 31 1 8 SER H 1 9 PHE H 1.800 . 5.160 4.022 2.401 4.656 . 0 0 "[ . 1 . 2]" 1 32 1 9 PHE HA 1 9 PHE QD 1.800 . 4.510 2.797 2.337 3.633 . 0 0 "[ . 1 . 2]" 1 33 1 9 PHE HA 1 10 VAL H 1.800 . 3.500 2.452 2.164 3.350 . 0 0 "[ . 1 . 2]" 1 34 1 9 PHE QB 1 10 VAL H 1.800 . 4.150 3.379 2.707 3.883 . 0 0 "[ . 1 . 2]" 1 35 1 9 PHE QB 1 114 LEU QB 1.800 . 5.530 3.135 2.215 4.132 . 0 0 "[ . 1 . 2]" 1 36 1 9 PHE HB3 1 114 LEU QB 1.800 . 5.510 3.840 2.326 5.196 . 0 0 "[ . 1 . 2]" 1 37 1 9 PHE HB2 1 114 LEU QB 1.800 . 5.510 3.713 2.322 5.489 . 0 0 "[ . 1 . 2]" 1 38 1 9 PHE QD 1 10 VAL H 1.800 . 5.100 4.159 2.962 4.865 . 0 0 "[ . 1 . 2]" 1 39 1 9 PHE H 1 9 PHE QB 1.800 . 3.620 2.741 2.246 3.462 . 0 0 "[ . 1 . 2]" 1 40 1 9 PHE H 1 9 PHE QD 1.800 . 4.020 2.956 2.158 4.191 0.171 6 0 "[ . 1 . 2]" 1 41 1 9 PHE H 1 10 VAL H 1.800 . 4.800 3.799 2.277 4.648 . 0 0 "[ . 1 . 2]" 1 42 1 10 VAL HA 1 10 VAL MG1 1.800 . 3.540 2.396 2.309 2.420 . 0 0 "[ . 1 . 2]" 1 43 1 10 VAL HA 1 10 VAL MG2 1.800 . 3.360 2.268 2.218 2.333 . 0 0 "[ . 1 . 2]" 1 44 1 10 VAL HA 1 11 VAL H 1.800 . 3.490 2.190 2.147 2.214 . 0 0 "[ . 1 . 2]" 1 45 1 10 VAL HA 1 112 SER HA 1.800 . 3.780 2.650 2.339 2.891 . 0 0 "[ . 1 . 2]" 1 46 1 10 VAL HA 1 112 SER QB 1.800 . 4.150 3.734 2.528 4.149 . 0 0 "[ . 1 . 2]" 1 47 1 10 VAL HA 1 112 SER H 1.800 . 5.860 5.076 4.858 5.305 . 0 0 "[ . 1 . 2]" 1 48 1 10 VAL HA 1 113 GLY H 1.800 . 4.490 4.192 3.636 4.517 0.027 9 0 "[ . 1 . 2]" 1 49 1 10 VAL HB 1 11 VAL H 1.800 . 4.770 4.185 4.135 4.211 . 0 0 "[ . 1 . 2]" 1 50 1 10 VAL HB 1 110 THR MG 1.800 . 5.200 4.983 4.397 5.235 0.035 8 0 "[ . 1 . 2]" 1 51 1 10 VAL HB 1 112 SER HA 1.800 . 5.310 5.186 4.879 5.375 0.065 5 0 "[ . 1 . 2]" 1 52 1 10 VAL MG1 1 11 VAL H 1.800 . 3.960 2.445 2.381 2.562 . 0 0 "[ . 1 . 2]" 1 53 1 10 VAL MG1 1 12 ARG QD 1.800 . 3.950 3.379 2.924 3.877 . 0 0 "[ . 1 . 2]" 1 54 1 10 VAL MG1 1 12 ARG QG 1.800 . 3.560 2.335 2.232 2.492 . 0 0 "[ . 1 . 2]" 1 55 1 10 VAL MG1 1 110 THR HA 1.800 . 5.040 3.970 3.472 4.317 . 0 0 "[ . 1 . 2]" 1 56 1 10 VAL MG1 1 110 THR HB 1.800 . 5.190 4.894 3.078 5.220 0.030 11 0 "[ . 1 . 2]" 1 57 1 10 VAL MG1 1 110 THR MG 1.800 . 3.100 2.467 2.074 2.860 . 0 0 "[ . 1 . 2]" 1 58 1 10 VAL MG1 1 111 HIS H 1.800 . 4.400 3.240 2.657 3.655 . 0 0 "[ . 1 . 2]" 1 59 1 10 VAL MG1 1 112 SER HA 1.800 . 4.260 3.584 3.308 3.982 . 0 0 "[ . 1 . 2]" 1 60 1 10 VAL MG1 1 112 SER QB 1.800 . 4.060 3.254 2.264 4.131 0.071 3 0 "[ . 1 . 2]" 1 61 1 10 VAL MG2 1 11 VAL H 1.800 . 4.680 3.853 3.805 4.032 . 0 0 "[ . 1 . 2]" 1 62 1 10 VAL MG2 1 112 SER HA 1.800 . 3.780 2.699 2.291 3.323 . 0 0 "[ . 1 . 2]" 1 63 1 10 VAL MG2 1 112 SER QB 1.800 . 3.730 2.384 2.042 2.855 . 0 0 "[ . 1 . 2]" 1 64 1 10 VAL MG2 1 112 SER H 1.800 . 5.260 4.789 4.459 5.229 . 0 0 "[ . 1 . 2]" 1 65 1 10 VAL MG2 1 113 GLY H 1.800 . 4.400 3.602 3.261 3.964 . 0 0 "[ . 1 . 2]" 1 66 1 10 VAL H 1 10 VAL HB 1.800 . 3.740 2.584 2.510 2.696 . 0 0 "[ . 1 . 2]" 1 67 1 10 VAL H 1 10 VAL MG1 1.800 . 4.400 3.815 3.789 3.852 . 0 0 "[ . 1 . 2]" 1 68 1 10 VAL H 1 10 VAL MG2 1.800 . 3.780 2.959 2.716 3.105 . 0 0 "[ . 1 . 2]" 1 69 1 11 VAL HA 1 11 VAL MG1 1.800 . 3.940 2.409 2.335 2.434 . 0 0 "[ . 1 . 2]" 1 70 1 11 VAL HA 1 11 VAL MG2 1.800 . 3.750 2.295 2.241 2.466 . 0 0 "[ . 1 . 2]" 1 71 1 11 VAL HA 1 12 ARG H 1.800 . 3.250 2.175 2.138 2.200 . 0 0 "[ . 1 . 2]" 1 72 1 11 VAL HB 1 111 HIS QB 1.800 . 4.150 2.473 2.302 2.780 . 0 0 "[ . 1 . 2]" 1 73 1 11 VAL HB 1 111 HIS H 1.800 . 4.440 3.521 3.025 3.985 . 0 0 "[ . 1 . 2]" 1 74 1 11 VAL HB 1 114 LEU MD1 1.800 . 4.840 3.481 2.660 4.252 . 0 0 "[ . 1 . 2]" 1 75 1 11 VAL MG1 1 12 ARG H 1.800 . 3.780 2.544 2.473 2.683 . 0 0 "[ . 1 . 2]" 1 76 1 11 VAL MG1 1 13 ARG QD 1.800 . 4.190 3.276 2.088 4.243 0.053 9 0 "[ . 1 . 2]" 1 77 1 11 VAL MG1 1 13 ARG QG 1.800 . 4.200 2.930 2.298 4.335 0.135 17 0 "[ . 1 . 2]" 1 78 1 11 VAL MG1 1 109 LEU MD2 1.800 . 3.840 3.574 3.103 3.880 0.040 20 0 "[ . 1 . 2]" 1 79 1 11 VAL MG1 1 111 HIS QB 1.800 . 4.280 3.521 3.259 3.799 . 0 0 "[ . 1 . 2]" 1 80 1 11 VAL MG1 1 111 HIS H 1.800 . 5.130 4.060 3.513 4.432 . 0 0 "[ . 1 . 2]" 1 81 1 11 VAL MG1 1 120 CYS HA 1.800 . 5.630 5.146 4.396 5.655 0.025 6 0 "[ . 1 . 2]" 1 82 1 11 VAL MG1 1 124 GLU HA 1.800 . 3.520 2.953 2.400 3.605 0.085 6 0 "[ . 1 . 2]" 1 83 1 11 VAL MG1 1 124 GLU QB 1.800 . 4.630 3.310 2.453 4.201 . 0 0 "[ . 1 . 2]" 1 84 1 11 VAL MG1 1 124 GLU QG 1.800 . 4.060 2.869 2.095 3.716 . 0 0 "[ . 1 . 2]" 1 85 1 11 VAL MG1 1 124 GLU H 1.800 . 4.940 4.321 3.936 4.948 0.008 14 0 "[ . 1 . 2]" 1 86 1 11 VAL MG1 1 127 TRP HE1 1.800 . 5.840 5.045 3.864 5.809 . 0 0 "[ . 1 . 2]" 1 87 1 11 VAL MG2 1 12 ARG H 1.800 . 4.750 3.873 3.817 4.086 . 0 0 "[ . 1 . 2]" 1 88 1 11 VAL MG2 1 111 HIS HB3 1.800 . 5.470 3.780 3.089 4.180 . 0 0 "[ . 1 . 2]" 1 89 1 11 VAL MG2 1 111 HIS HB2 1.800 . 5.470 5.013 4.387 5.465 . 0 0 "[ . 1 . 2]" 1 90 1 11 VAL MG2 1 111 HIS H 1.800 . 5.200 4.835 4.309 5.188 . 0 0 "[ . 1 . 2]" 1 91 1 11 VAL MG2 1 114 LEU MD1 1.800 . 3.480 2.480 1.906 2.918 . 0 0 "[ . 1 . 2]" 1 92 1 11 VAL MG2 1 114 LEU MD2 1.800 . 4.950 4.222 3.013 4.960 0.010 18 0 "[ . 1 . 2]" 1 93 1 11 VAL MG2 1 120 CYS HA 1.800 . 4.150 3.406 2.812 3.998 . 0 0 "[ . 1 . 2]" 1 94 1 11 VAL MG2 1 120 CYS QB 1.800 . 5.080 3.373 2.039 5.161 0.081 6 0 "[ . 1 . 2]" 1 95 1 11 VAL MG2 1 123 HIS QB 1.800 . 3.920 3.698 2.979 3.945 0.025 10 0 "[ . 1 . 2]" 1 96 1 11 VAL MG2 1 123 HIS HD1 1.800 . 5.600 4.894 2.981 5.643 0.043 20 0 "[ . 1 . 2]" 1 97 1 11 VAL MG2 1 124 GLU QB 1.800 . 4.510 3.357 2.346 4.483 . 0 0 "[ . 1 . 2]" 1 98 1 11 VAL MG2 1 124 GLU QG 1.800 . 4.790 3.791 2.214 4.697 . 0 0 "[ . 1 . 2]" 1 99 1 11 VAL MG2 1 124 GLU H 1.800 . 4.500 4.121 3.711 4.609 0.109 6 0 "[ . 1 . 2]" 1 100 1 11 VAL MG2 1 127 TRP HD1 1.800 . 5.440 4.790 4.294 5.397 . 0 0 "[ . 1 . 2]" 1 101 1 11 VAL H 1 11 VAL HB 1.800 . 3.830 2.478 2.377 2.561 . 0 0 "[ . 1 . 2]" 1 102 1 11 VAL H 1 11 VAL MG1 1.800 . 4.190 3.777 3.744 3.811 . 0 0 "[ . 1 . 2]" 1 103 1 11 VAL H 1 11 VAL MG2 1.800 . 3.940 2.819 2.456 2.913 . 0 0 "[ . 1 . 2]" 1 104 1 11 VAL H 1 111 HIS QB 1.800 . 4.660 3.209 2.837 3.735 . 0 0 "[ . 1 . 2]" 1 105 1 11 VAL H 1 111 HIS H 1.800 . 4.400 3.036 2.706 3.381 . 0 0 "[ . 1 . 2]" 1 106 1 11 VAL H 1 112 SER HA 1.800 . 4.710 3.788 3.444 4.079 . 0 0 "[ . 1 . 2]" 1 107 1 11 VAL H 1 114 LEU MD1 1.800 . 5.160 3.790 2.984 4.723 . 0 0 "[ . 1 . 2]" 1 108 1 12 ARG HA 1 12 ARG QD 1.800 . 5.200 4.026 3.940 4.178 . 0 0 "[ . 1 . 2]" 1 109 1 12 ARG HA 1 13 ARG H 1.800 . 3.490 2.200 2.136 2.239 . 0 0 "[ . 1 . 2]" 1 110 1 12 ARG HA 1 110 THR HA 1.800 . 4.270 2.713 2.337 3.157 . 0 0 "[ . 1 . 2]" 1 111 1 12 ARG HA 1 110 THR MG 1.800 . 4.750 3.828 2.998 4.392 . 0 0 "[ . 1 . 2]" 1 112 1 12 ARG HA 1 111 HIS H 1.800 . 5.070 3.842 3.402 4.298 . 0 0 "[ . 1 . 2]" 1 113 1 12 ARG QB 1 12 ARG QD 1.800 . 3.100 2.229 2.123 2.307 . 0 0 "[ . 1 . 2]" 1 114 1 12 ARG QB 1 13 ARG H 1.800 . 4.570 3.096 2.956 3.343 . 0 0 "[ . 1 . 2]" 1 115 1 12 ARG QB 1 110 THR HA 1.800 . 5.790 4.387 3.892 4.968 . 0 0 "[ . 1 . 2]" 1 116 1 12 ARG QD 1 110 THR MG 1.800 . 4.700 3.842 3.033 4.682 . 0 0 "[ . 1 . 2]" 1 117 1 12 ARG QG 1 110 THR HA 1.800 . 5.270 3.040 2.489 3.720 . 0 0 "[ . 1 . 2]" 1 118 1 12 ARG QG 1 110 THR MG 1.800 . 3.580 2.630 2.164 3.312 . 0 0 "[ . 1 . 2]" 1 119 1 12 ARG H 1 12 ARG QB 1.800 . 3.900 2.532 2.440 2.596 . 0 0 "[ . 1 . 2]" 1 120 1 12 ARG H 1 12 ARG QD 1.800 . 5.210 4.370 4.149 4.714 . 0 0 "[ . 1 . 2]" 1 121 1 12 ARG H 1 12 ARG QG 1.800 . 4.020 2.949 2.751 3.093 . 0 0 "[ . 1 . 2]" 1 122 1 13 ARG HA 1 13 ARG QD 1.800 . 4.200 2.839 2.131 4.172 . 0 0 "[ . 1 . 2]" 1 123 1 13 ARG HA 1 13 ARG QG 1.800 . 3.940 2.485 2.254 2.904 . 0 0 "[ . 1 . 2]" 1 124 1 13 ARG HA 1 14 GLU H 1.800 . 3.310 2.293 2.235 2.345 . 0 0 "[ . 1 . 2]" 1 125 1 13 ARG HA 1 131 LEU MD1 1.800 . 5.360 4.432 4.112 5.213 . 0 0 "[ . 1 . 2]" 1 126 1 13 ARG QB 1 13 ARG HE 1.800 . 5.220 3.450 1.813 4.347 . 0 0 "[ . 1 . 2]" 1 127 1 13 ARG QB 1 109 LEU MD1 1.800 . 5.890 4.037 3.225 4.698 . 0 0 "[ . 1 . 2]" 1 128 1 13 ARG HB3 1 14 GLU H 1.800 . 4.730 2.844 2.621 3.460 . 0 0 "[ . 1 . 2]" 1 129 1 13 ARG HB3 1 109 LEU HB3 1.800 . 5.570 3.768 2.525 4.306 . 0 0 "[ . 1 . 2]" 1 130 1 13 ARG HB3 1 109 LEU HB2 1.800 . 5.570 4.819 3.330 5.648 0.078 10 0 "[ . 1 . 2]" 1 131 1 13 ARG HB3 1 109 LEU MD2 1.800 . 5.320 4.464 3.539 5.075 . 0 0 "[ . 1 . 2]" 1 132 1 13 ARG HB3 1 131 LEU MD1 1.800 . 3.700 2.377 2.078 3.108 . 0 0 "[ . 1 . 2]" 1 133 1 13 ARG HB3 1 131 LEU MD2 1.800 . 4.910 4.155 3.188 4.889 . 0 0 "[ . 1 . 2]" 1 134 1 13 ARG HB2 1 14 GLU H 1.800 . 4.730 3.975 3.725 4.329 . 0 0 "[ . 1 . 2]" 1 135 1 13 ARG HB2 1 109 LEU HB3 1.800 . 5.570 2.601 2.323 3.179 . 0 0 "[ . 1 . 2]" 1 136 1 13 ARG HB2 1 109 LEU HB2 1.800 . 5.570 4.040 3.427 4.824 . 0 0 "[ . 1 . 2]" 1 137 1 13 ARG HB2 1 109 LEU MD2 1.800 . 5.320 3.250 2.926 3.555 . 0 0 "[ . 1 . 2]" 1 138 1 13 ARG HB2 1 131 LEU MD1 1.800 . 3.700 2.824 2.193 3.321 . 0 0 "[ . 1 . 2]" 1 139 1 13 ARG HB2 1 131 LEU MD2 1.800 . 4.910 4.402 3.559 5.005 0.095 8 0 "[ . 1 . 2]" 1 140 1 13 ARG QD 1 14 GLU H 1.800 . 5.200 3.976 3.124 5.238 0.038 1 0 "[ . 1 . 2]" 1 141 1 13 ARG QD 1 124 GLU QG 1.800 . 4.510 3.521 2.340 4.660 0.150 12 0 "[ . 1 . 2]" 1 142 1 13 ARG HD3 1 131 LEU MD1 1.800 . 4.980 3.781 2.273 4.810 . 0 0 "[ . 1 . 2]" 1 143 1 13 ARG HD2 1 131 LEU MD1 1.800 . 4.980 3.696 2.314 4.884 . 0 0 "[ . 1 . 2]" 1 144 1 13 ARG QG 1 14 GLU H 1.800 . 5.320 3.769 2.471 4.465 . 0 0 "[ . 1 . 2]" 1 145 1 13 ARG QG 1 109 LEU MD2 1.800 . 4.510 3.820 3.080 4.552 0.042 8 0 "[ . 1 . 2]" 1 146 1 13 ARG QG 1 124 GLU QG 1.800 . 4.880 4.142 3.038 4.737 . 0 0 "[ . 1 . 2]" 1 147 1 13 ARG H 1 13 ARG HG3 1.800 . 4.960 4.106 2.861 4.741 . 0 0 "[ . 1 . 2]" 1 148 1 13 ARG H 1 13 ARG HG2 1.800 . 4.960 3.926 2.814 5.068 0.108 8 0 "[ . 1 . 2]" 1 149 1 13 ARG H 1 109 LEU HB3 1.800 . 5.830 3.281 2.812 3.882 . 0 0 "[ . 1 . 2]" 1 150 1 13 ARG H 1 109 LEU HB2 1.800 . 5.830 4.737 4.190 5.328 . 0 0 "[ . 1 . 2]" 1 151 1 13 ARG H 1 109 LEU MD2 1.800 . 4.990 3.835 3.477 4.305 . 0 0 "[ . 1 . 2]" 1 152 1 13 ARG H 1 109 LEU H 1.800 . 4.230 2.945 2.677 3.290 . 0 0 "[ . 1 . 2]" 1 153 1 13 ARG H 1 110 THR HA 1.800 . 4.990 3.952 3.536 4.269 . 0 0 "[ . 1 . 2]" 1 154 1 13 ARG H 1 131 LEU MD1 1.800 . 5.350 4.886 4.495 5.365 0.015 6 0 "[ . 1 . 2]" 1 155 1 14 GLU HA 1 15 ALA H 1.800 . 3.360 2.284 2.209 2.373 . 0 0 "[ . 1 . 2]" 1 156 1 14 GLU HA 1 106 LEU MD1 1.800 . 4.840 3.592 3.160 4.406 . 0 0 "[ . 1 . 2]" 1 157 1 14 GLU HA 1 107 LEU MD2 1.800 . 4.730 3.984 3.703 4.304 . 0 0 "[ . 1 . 2]" 1 158 1 14 GLU HA 1 108 ARG HA 1.800 . 4.050 2.757 2.315 3.120 . 0 0 "[ . 1 . 2]" 1 159 1 14 GLU HA 1 108 ARG QG 1.800 . 5.020 3.927 3.149 4.472 . 0 0 "[ . 1 . 2]" 1 160 1 14 GLU HA 1 109 LEU H 1.800 . 4.460 3.676 3.226 3.912 . 0 0 "[ . 1 . 2]" 1 161 1 14 GLU QB 1 15 ALA H 1.800 . 3.580 2.806 2.511 3.456 . 0 0 "[ . 1 . 2]" 1 162 1 14 GLU QB 1 106 LEU MD1 1.800 . 3.580 2.424 2.225 3.783 0.203 7 0 "[ . 1 . 2]" 1 163 1 14 GLU QB 1 106 LEU HG 1.800 . 5.930 4.381 3.871 5.874 . 0 0 "[ . 1 . 2]" 1 164 1 14 GLU QB 1 108 ARG HA 1.800 . 5.440 4.239 3.448 4.530 . 0 0 "[ . 1 . 2]" 1 165 1 14 GLU QG 1 108 ARG QD 1.800 . 4.650 3.937 3.157 4.309 . 0 0 "[ . 1 . 2]" 1 166 1 14 GLU QG 1 108 ARG QG 1.800 . 4.250 2.495 2.282 3.033 . 0 0 "[ . 1 . 2]" 1 167 1 14 GLU HG3 1 15 ALA H 1.800 . 5.200 4.533 2.487 4.922 . 0 0 "[ . 1 . 2]" 1 168 1 14 GLU HG3 1 106 LEU MD1 1.800 . 4.700 4.289 2.544 4.716 0.016 10 0 "[ . 1 . 2]" 1 169 1 14 GLU HG3 1 106 LEU MD2 1.800 . 5.400 4.951 4.129 5.470 0.070 16 0 "[ . 1 . 2]" 1 170 1 14 GLU HG3 1 108 ARG HA 1.800 . 4.680 3.498 2.341 4.113 . 0 0 "[ . 1 . 2]" 1 171 1 14 GLU HG2 1 15 ALA H 1.800 . 5.200 4.184 2.243 4.943 . 0 0 "[ . 1 . 2]" 1 172 1 14 GLU HG2 1 106 LEU MD1 1.800 . 4.700 3.449 2.190 4.180 . 0 0 "[ . 1 . 2]" 1 173 1 14 GLU HG2 1 106 LEU MD2 1.800 . 5.300 3.904 3.422 5.011 . 0 0 "[ . 1 . 2]" 1 174 1 14 GLU HG2 1 108 ARG HA 1.800 . 4.680 3.405 2.307 4.709 0.029 7 0 "[ . 1 . 2]" 1 175 1 14 GLU H 1 14 GLU QB 1.800 . 3.440 2.653 2.613 2.708 . 0 0 "[ . 1 . 2]" 1 176 1 14 GLU H 1 14 GLU HG3 1.800 . 5.240 3.497 3.158 4.735 . 0 0 "[ . 1 . 2]" 1 177 1 14 GLU H 1 14 GLU HG2 1.800 . 5.240 4.346 4.216 4.603 . 0 0 "[ . 1 . 2]" 1 178 1 15 ALA HA 1 16 HIS H 1.800 . 3.310 2.272 2.172 2.340 . 0 0 "[ . 1 . 2]" 1 179 1 15 ALA MB 1 16 HIS H 1.800 . 3.810 2.798 2.609 3.194 . 0 0 "[ . 1 . 2]" 1 180 1 15 ALA MB 1 17 LEU MD1 1.800 . 3.320 2.514 2.166 3.075 . 0 0 "[ . 1 . 2]" 1 181 1 15 ALA MB 1 17 LEU MD2 1.800 . 4.970 3.907 3.684 4.251 . 0 0 "[ . 1 . 2]" 1 182 1 15 ALA MB 1 17 LEU HG 1.800 . 4.540 3.707 3.418 4.207 . 0 0 "[ . 1 . 2]" 1 183 1 15 ALA MB 1 106 LEU MD1 1.800 . 4.290 4.043 3.739 4.295 0.005 7 0 "[ . 1 . 2]" 1 184 1 15 ALA MB 1 107 LEU MD2 1.800 . 3.600 3.393 2.946 3.637 0.037 11 0 "[ . 1 . 2]" 1 185 1 15 ALA MB 1 107 LEU H 1.800 . 4.000 3.834 3.336 4.048 0.048 12 0 "[ . 1 . 2]" 1 186 1 15 ALA MB 1 131 LEU QB 1.800 . 4.320 2.652 2.312 3.204 . 0 0 "[ . 1 . 2]" 1 187 1 15 ALA MB 1 131 LEU MD1 1.800 . 3.370 3.139 2.565 3.390 0.020 9 0 "[ . 1 . 2]" 1 188 1 15 ALA MB 1 131 LEU MD2 1.800 . 3.780 2.672 2.146 3.211 . 0 0 "[ . 1 . 2]" 1 189 1 15 ALA MB 1 134 LEU MD2 1.800 . 5.170 4.580 3.916 4.892 . 0 0 "[ . 1 . 2]" 1 190 1 15 ALA H 1 15 ALA MB 1.800 . 3.340 2.695 2.609 2.772 . 0 0 "[ . 1 . 2]" 1 191 1 15 ALA H 1 16 HIS H 1.800 . 4.730 4.323 4.124 4.398 . 0 0 "[ . 1 . 2]" 1 192 1 15 ALA H 1 107 LEU HB3 1.800 . 6.050 3.563 3.321 3.815 . 0 0 "[ . 1 . 2]" 1 193 1 15 ALA H 1 107 LEU HB2 1.800 . 6.050 4.975 4.593 5.301 . 0 0 "[ . 1 . 2]" 1 194 1 15 ALA H 1 107 LEU MD2 1.800 . 4.250 4.036 3.647 4.283 0.033 2 0 "[ . 1 . 2]" 1 195 1 16 HIS HA 1 17 LEU H 1.800 . 3.120 2.172 2.122 2.196 . 0 0 "[ . 1 . 2]" 1 196 1 16 HIS HA 1 106 LEU HA 1.800 . 4.000 2.893 2.463 3.211 . 0 0 "[ . 1 . 2]" 1 197 1 16 HIS HA 1 106 LEU QB 1.800 . 4.720 4.392 3.839 4.809 0.089 7 0 "[ . 1 . 2]" 1 198 1 16 HIS HA 1 106 LEU MD1 1.800 . 4.400 3.064 2.257 3.454 . 0 0 "[ . 1 . 2]" 1 199 1 16 HIS HA 1 107 LEU H 1.800 . 4.570 3.815 3.389 4.223 . 0 0 "[ . 1 . 2]" 1 200 1 16 HIS QB 1 17 LEU H 1.800 . 4.210 3.462 3.144 3.907 . 0 0 "[ . 1 . 2]" 1 201 1 16 HIS QB 1 106 LEU MD1 1.800 . 4.640 3.838 2.948 4.511 . 0 0 "[ . 1 . 2]" 1 202 1 16 HIS H 1 16 HIS QB 1.800 . 3.370 2.543 2.272 2.970 . 0 0 "[ . 1 . 2]" 1 203 1 16 HIS H 1 17 LEU H 1.800 . 4.890 4.397 4.321 4.506 . 0 0 "[ . 1 . 2]" 1 204 1 17 LEU HA 1 17 LEU MD1 1.800 . 4.190 3.277 2.659 3.707 . 0 0 "[ . 1 . 2]" 1 205 1 17 LEU HA 1 17 LEU HG 1.800 . 3.730 2.332 2.289 2.410 . 0 0 "[ . 1 . 2]" 1 206 1 17 LEU HA 1 18 ALA MB 1.800 . 4.480 3.983 3.941 4.023 . 0 0 "[ . 1 . 2]" 1 207 1 17 LEU HA 1 18 ALA H 1.800 . 3.260 2.167 2.121 2.217 . 0 0 "[ . 1 . 2]" 1 208 1 17 LEU HA 1 135 THR HA 1.800 . 4.790 3.670 3.293 4.420 . 0 0 "[ . 1 . 2]" 1 209 1 17 LEU HA 1 135 THR MG 1.800 . 3.970 2.621 2.306 3.089 . 0 0 "[ . 1 . 2]" 1 210 1 17 LEU HA 1 138 ALA MB 1.800 . 4.540 3.492 3.163 3.936 . 0 0 "[ . 1 . 2]" 1 211 1 17 LEU QB 1 17 LEU MD1 1.800 . 4.000 2.171 2.139 2.217 . 0 0 "[ . 1 . 2]" 1 212 1 17 LEU QB 1 105 THR MG 1.800 . 4.610 3.932 3.424 4.193 . 0 0 "[ . 1 . 2]" 1 213 1 17 LEU QB 1 134 LEU HG 1.800 . 5.820 4.896 4.512 5.435 . 0 0 "[ . 1 . 2]" 1 214 1 17 LEU HB3 1 17 LEU MD2 1.800 . 4.270 2.223 2.173 2.256 . 0 0 "[ . 1 . 2]" 1 215 1 17 LEU HB3 1 18 ALA H 1.800 . 4.710 3.226 3.001 3.363 . 0 0 "[ . 1 . 2]" 1 216 1 17 LEU HB3 1 105 THR HB 1.800 . 5.130 4.266 3.476 4.710 . 0 0 "[ . 1 . 2]" 1 217 1 17 LEU HB2 1 17 LEU MD2 1.800 . 4.270 2.663 2.480 2.993 . 0 0 "[ . 1 . 2]" 1 218 1 17 LEU HB2 1 18 ALA H 1.800 . 4.710 4.173 4.015 4.300 . 0 0 "[ . 1 . 2]" 1 219 1 17 LEU HB2 1 105 THR HB 1.800 . 5.130 2.962 2.530 3.247 . 0 0 "[ . 1 . 2]" 1 220 1 17 LEU MD1 1 105 THR HB 1.800 . 4.190 3.843 3.357 4.191 0.001 11 0 "[ . 1 . 2]" 1 221 1 17 LEU MD1 1 105 THR MG 1.800 . 4.030 3.765 3.334 4.036 0.006 17 0 "[ . 1 . 2]" 1 222 1 17 LEU MD1 1 105 THR H 1.800 . 5.850 4.394 3.941 4.873 . 0 0 "[ . 1 . 2]" 1 223 1 17 LEU MD1 1 106 LEU QB 1.800 . 5.400 5.117 4.738 5.347 . 0 0 "[ . 1 . 2]" 1 224 1 17 LEU MD1 1 107 LEU QB 1.800 . 4.150 2.160 1.907 2.634 . 0 0 "[ . 1 . 2]" 1 225 1 17 LEU MD1 1 107 LEU H 1.800 . 4.080 2.989 2.701 3.151 . 0 0 "[ . 1 . 2]" 1 226 1 17 LEU MD1 1 134 LEU MD2 1.800 . 4.140 3.729 3.333 4.042 . 0 0 "[ . 1 . 2]" 1 227 1 17 LEU MD2 1 18 ALA H 1.800 . 5.850 4.570 4.136 4.802 . 0 0 "[ . 1 . 2]" 1 228 1 17 LEU MD2 1 107 LEU H 1.800 . 6.050 5.282 4.612 5.638 . 0 0 "[ . 1 . 2]" 1 229 1 17 LEU MD2 1 134 LEU MD1 1.800 . 3.640 3.362 3.182 3.574 . 0 0 "[ . 1 . 2]" 1 230 1 17 LEU MD2 1 134 LEU MD2 1.800 . 3.780 2.593 2.307 3.002 . 0 0 "[ . 1 . 2]" 1 231 1 17 LEU MD2 1 135 THR HA 1.800 . 3.440 2.632 2.259 2.992 . 0 0 "[ . 1 . 2]" 1 232 1 17 LEU MD2 1 135 THR HB 1.800 . 6.050 5.007 4.601 5.406 . 0 0 "[ . 1 . 2]" 1 233 1 17 LEU MD2 1 135 THR H 1.800 . 4.380 4.057 3.588 4.459 0.079 9 0 "[ . 1 . 2]" 1 234 1 17 LEU MD2 1 138 ALA MB 1.800 . 3.120 2.135 1.993 2.273 . 0 0 "[ . 1 . 2]" 1 235 1 17 LEU MD2 1 138 ALA H 1.800 . 4.350 3.929 3.558 4.328 . 0 0 "[ . 1 . 2]" 1 236 1 17 LEU MD2 1 139 ALA H 1.800 . 5.100 4.915 4.648 5.139 0.039 14 0 "[ . 1 . 2]" 1 237 1 17 LEU HG 1 18 ALA H 1.800 . 5.510 4.299 3.997 4.520 . 0 0 "[ . 1 . 2]" 1 238 1 17 LEU HG 1 107 LEU H 1.800 . 5.970 5.765 5.027 6.008 0.038 9 0 "[ . 1 . 2]" 1 239 1 17 LEU HG 1 135 THR HB 1.800 . 5.680 4.832 4.400 5.630 . 0 0 "[ . 1 . 2]" 1 240 1 17 LEU HG 1 135 THR MG 1.800 . 3.650 2.821 2.461 3.322 . 0 0 "[ . 1 . 2]" 1 241 1 17 LEU H 1 17 LEU HB3 1.800 . 4.270 3.724 3.625 3.759 . 0 0 "[ . 1 . 2]" 1 242 1 17 LEU H 1 17 LEU HB2 1.800 . 4.270 2.526 2.356 2.595 . 0 0 "[ . 1 . 2]" 1 243 1 17 LEU H 1 17 LEU MD1 1.800 . 3.880 2.255 1.968 2.730 . 0 0 "[ . 1 . 2]" 1 244 1 17 LEU H 1 17 LEU HG 1.800 . 4.950 3.561 3.137 4.019 . 0 0 "[ . 1 . 2]" 1 245 1 17 LEU H 1 105 THR HB 1.800 . 5.370 4.128 3.419 4.580 . 0 0 "[ . 1 . 2]" 1 246 1 17 LEU H 1 105 THR MG 1.800 . 5.470 4.690 4.172 4.989 . 0 0 "[ . 1 . 2]" 1 247 1 17 LEU H 1 105 THR H 1.800 . 4.330 3.096 2.743 3.420 . 0 0 "[ . 1 . 2]" 1 248 1 18 ALA HA 1 19 ALA H 1.800 . 3.510 2.713 2.349 3.308 . 0 0 "[ . 1 . 2]" 1 249 1 18 ALA HA 1 104 GLY QA 1.800 . 3.980 2.458 2.191 3.063 . 0 0 "[ . 1 . 2]" 1 250 1 18 ALA HA 1 105 THR H 1.800 . 5.150 3.774 3.353 4.216 . 0 0 "[ . 1 . 2]" 1 251 1 18 ALA MB 1 19 ALA H 1.800 . 4.000 3.559 3.258 3.723 . 0 0 "[ . 1 . 2]" 1 252 1 18 ALA MB 1 139 ALA H 1.800 . 5.140 4.574 4.100 5.157 0.017 7 0 "[ . 1 . 2]" 1 253 1 18 ALA H 1 18 ALA MB 1.800 . 3.270 2.248 2.188 2.292 . 0 0 "[ . 1 . 2]" 1 254 1 18 ALA H 1 19 ALA H 1.800 . 3.890 3.397 2.450 3.970 0.080 14 0 "[ . 1 . 2]" 1 255 1 18 ALA H 1 139 ALA MB 1.800 . 4.890 3.251 2.229 4.681 . 0 0 "[ . 1 . 2]" 1 256 1 19 ALA MB 1 23 ALA MB 1.800 . 3.300 2.231 1.882 2.636 . 0 0 "[ . 1 . 2]" 1 257 1 19 ALA MB 1 23 ALA H 1.800 . 5.150 4.301 4.095 4.655 . 0 0 "[ . 1 . 2]" 1 258 1 19 ALA MB 1 24 VAL HA 1.800 . 5.220 4.731 4.119 5.048 . 0 0 "[ . 1 . 2]" 1 259 1 19 ALA MB 1 24 VAL MG2 1.800 . 3.270 2.949 2.397 3.277 0.007 12 0 "[ . 1 . 2]" 1 260 1 19 ALA MB 1 24 VAL H 1.800 . 4.510 3.931 3.325 4.147 . 0 0 "[ . 1 . 2]" 1 261 1 19 ALA MB 1 138 ALA HA 1.800 . 3.900 3.387 2.940 3.609 . 0 0 "[ . 1 . 2]" 1 262 1 19 ALA MB 1 139 ALA HA 1.800 . 4.570 4.228 3.601 4.588 0.018 3 0 "[ . 1 . 2]" 1 263 1 19 ALA MB 1 139 ALA H 1.800 . 5.670 4.853 4.475 5.129 . 0 0 "[ . 1 . 2]" 1 264 1 19 ALA H 1 19 ALA MB 1.800 . 3.360 2.678 2.221 2.962 . 0 0 "[ . 1 . 2]" 1 265 1 19 ALA H 1 24 VAL MG2 1.800 . 4.710 4.571 4.080 4.799 0.089 15 0 "[ . 1 . 2]" 1 266 1 19 ALA H 1 104 GLY QA 1.800 . 4.200 3.103 1.966 4.243 0.043 9 0 "[ . 1 . 2]" 1 267 1 19 ALA H 1 105 THR HB 1.800 . 4.660 4.135 3.532 4.684 0.024 11 0 "[ . 1 . 2]" 1 268 1 19 ALA H 1 105 THR HG1 1.800 . 4.950 4.198 3.378 4.837 . 0 0 "[ . 1 . 2]" 1 269 1 19 ALA H 1 105 THR H 1.800 . 4.100 3.393 2.740 4.098 . 0 0 "[ . 1 . 2]" 1 270 1 19 ALA H 1 138 ALA MB 1.800 . 4.420 4.034 3.004 4.474 0.054 19 0 "[ . 1 . 2]" 1 271 1 20 PRO HA 1 21 PRO QD 1.800 . 3.660 2.153 2.107 2.179 . 0 0 "[ . 1 . 2]" 1 272 1 20 PRO HA 1 21 PRO QG 1.800 . 5.160 4.081 4.018 4.107 . 0 0 "[ . 1 . 2]" 1 273 1 20 PRO HA 1 105 THR HB 1.800 . 5.380 4.606 4.159 5.446 0.066 13 0 "[ . 1 . 2]" 1 274 1 20 PRO HA 1 105 THR HG1 1.800 . 4.210 2.689 2.246 3.439 . 0 0 "[ . 1 . 2]" 1 275 1 20 PRO HB3 1 21 PRO HD3 1.800 . 4.320 3.832 3.530 4.035 . 0 0 "[ . 1 . 2]" 1 276 1 20 PRO HB3 1 21 PRO HD2 1.800 . 4.320 2.782 2.279 3.139 . 0 0 "[ . 1 . 2]" 1 277 1 20 PRO HB3 1 22 ALA H 1.800 . 4.870 4.115 3.450 4.377 . 0 0 "[ . 1 . 2]" 1 278 1 20 PRO HB3 1 23 ALA MB 1.800 . 5.140 4.782 4.136 5.147 0.007 14 0 "[ . 1 . 2]" 1 279 1 20 PRO HB2 1 21 PRO HD3 1.800 . 4.320 3.789 3.411 4.445 0.125 13 0 "[ . 1 . 2]" 1 280 1 20 PRO HB2 1 21 PRO HD2 1.800 . 4.320 2.443 2.320 3.253 . 0 0 "[ . 1 . 2]" 1 281 1 20 PRO HB2 1 22 ALA H 1.800 . 4.870 2.553 2.398 3.049 . 0 0 "[ . 1 . 2]" 1 282 1 20 PRO HB2 1 23 ALA MB 1.800 . 5.140 3.951 2.668 4.288 . 0 0 "[ . 1 . 2]" 1 283 1 20 PRO HB2 1 23 ALA H 1.800 . 5.440 3.161 2.334 3.434 . 0 0 "[ . 1 . 2]" 1 284 1 20 PRO QG 1 23 ALA HA 1.800 . 5.210 4.492 4.181 5.343 0.133 13 0 "[ . 1 . 2]" 1 285 1 20 PRO QG 1 23 ALA MB 1.800 . 3.490 2.560 2.308 3.107 . 0 0 "[ . 1 . 2]" 1 286 1 20 PRO QG 1 23 ALA H 1.800 . 4.100 2.745 2.398 4.084 . 0 0 "[ . 1 . 2]" 1 287 1 21 PRO HA 1 23 ALA H 1.800 . 5.020 4.366 4.265 4.481 . 0 0 "[ . 1 . 2]" 1 288 1 21 PRO HA 1 24 VAL HB 1.800 . 3.790 2.835 2.377 3.409 . 0 0 "[ . 1 . 2]" 1 289 1 21 PRO HA 1 24 VAL MG1 1.800 . 5.220 4.198 3.773 4.721 . 0 0 "[ . 1 . 2]" 1 290 1 21 PRO HA 1 24 VAL MG2 1.800 . 4.300 3.169 2.770 3.641 . 0 0 "[ . 1 . 2]" 1 291 1 21 PRO HA 1 24 VAL H 1.800 . 4.260 3.476 3.304 3.774 . 0 0 "[ . 1 . 2]" 1 292 1 21 PRO HA 1 25 PHE H 1.800 . 4.800 4.014 3.594 4.337 . 0 0 "[ . 1 . 2]" 1 293 1 21 PRO HA 1 98 LEU MD1 1.800 . 4.280 3.424 2.832 4.138 . 0 0 "[ . 1 . 2]" 1 294 1 21 PRO HA 1 105 THR HB 1.800 . 6.030 4.136 3.264 5.144 . 0 0 "[ . 1 . 2]" 1 295 1 21 PRO HA 1 105 THR HG1 1.800 . 4.940 2.468 2.036 3.137 . 0 0 "[ . 1 . 2]" 1 296 1 21 PRO HA 1 105 THR MG 1.800 . 3.950 2.534 2.256 3.167 . 0 0 "[ . 1 . 2]" 1 297 1 21 PRO QB 1 22 ALA H 1.800 . 4.030 3.115 2.552 3.356 . 0 0 "[ . 1 . 2]" 1 298 1 21 PRO QB 1 72 VAL MG2 1.800 . 5.000 3.710 2.018 4.798 . 0 0 "[ . 1 . 2]" 1 299 1 21 PRO QB 1 98 LEU QB 1.800 . 5.010 3.060 2.248 3.665 . 0 0 "[ . 1 . 2]" 1 300 1 21 PRO QB 1 98 LEU MD1 1.800 . 4.960 2.938 2.269 3.693 . 0 0 "[ . 1 . 2]" 1 301 1 21 PRO QB 1 105 THR MG 1.800 . 5.120 2.698 2.206 3.894 . 0 0 "[ . 1 . 2]" 1 302 1 21 PRO QD 1 22 ALA H 1.800 . 4.370 2.779 2.671 2.864 . 0 0 "[ . 1 . 2]" 1 303 1 21 PRO QD 1 23 ALA H 1.800 . 5.040 4.504 4.209 4.685 . 0 0 "[ . 1 . 2]" 1 304 1 21 PRO QD 1 100 GLU QG 1.800 . 4.360 3.562 2.813 4.421 0.061 13 0 "[ . 1 . 2]" 1 305 1 21 PRO QD 1 105 THR HG1 1.800 . 5.320 2.537 2.216 2.952 . 0 0 "[ . 1 . 2]" 1 306 1 21 PRO QD 1 105 THR MG 1.800 . 5.180 3.267 2.539 4.135 . 0 0 "[ . 1 . 2]" 1 307 1 21 PRO QG 1 72 VAL MG2 1.800 . 5.000 4.177 2.448 4.986 . 0 0 "[ . 1 . 2]" 1 308 1 21 PRO QG 1 98 LEU QB 1.800 . 5.870 4.414 3.487 5.281 . 0 0 "[ . 1 . 2]" 1 309 1 21 PRO QG 1 100 GLU QG 1.800 . 3.820 3.104 2.100 3.889 0.069 9 0 "[ . 1 . 2]" 1 310 1 21 PRO QG 1 105 THR MG 1.800 . 4.890 3.566 2.701 4.275 . 0 0 "[ . 1 . 2]" 1 311 1 21 PRO HG3 1 22 ALA H 1.800 . 4.800 4.168 3.911 4.615 . 0 0 "[ . 1 . 2]" 1 312 1 21 PRO HG2 1 22 ALA H 1.800 . 4.800 2.873 2.405 4.060 . 0 0 "[ . 1 . 2]" 1 313 1 22 ALA HA 1 25 PHE HB3 1.800 . 4.890 2.803 2.420 3.126 . 0 0 "[ . 1 . 2]" 1 314 1 22 ALA HA 1 25 PHE HB2 1.800 . 4.890 3.741 3.331 4.108 . 0 0 "[ . 1 . 2]" 1 315 1 22 ALA HA 1 25 PHE H 1.800 . 4.390 3.601 3.404 3.706 . 0 0 "[ . 1 . 2]" 1 316 1 22 ALA HA 1 26 ALA MB 1.800 . 4.960 4.540 4.099 4.848 . 0 0 "[ . 1 . 2]" 1 317 1 22 ALA HA 1 26 ALA H 1.800 . 4.930 3.929 3.583 4.216 . 0 0 "[ . 1 . 2]" 1 318 1 22 ALA HA 1 72 VAL HB 1.800 . 4.800 4.117 2.830 4.840 0.040 13 0 "[ . 1 . 2]" 1 319 1 22 ALA HA 1 72 VAL MG1 1.800 . 5.000 2.662 2.049 4.312 . 0 0 "[ . 1 . 2]" 1 320 1 22 ALA HA 1 72 VAL MG2 1.800 . 5.000 3.999 2.250 4.728 . 0 0 "[ . 1 . 2]" 1 321 1 22 ALA MB 1 23 ALA H 1.800 . 3.540 2.497 2.322 2.595 . 0 0 "[ . 1 . 2]" 1 322 1 22 ALA MB 1 72 VAL MG1 1.800 . 4.300 3.103 2.302 4.297 . 0 0 "[ . 1 . 2]" 1 323 1 22 ALA MB 1 72 VAL MG2 1.800 . 4.600 4.053 2.366 4.624 0.024 4 0 "[ . 1 . 2]" 1 324 1 22 ALA H 1 22 ALA MB 1.800 . 3.330 2.231 2.208 2.253 . 0 0 "[ . 1 . 2]" 1 325 1 22 ALA H 1 23 ALA H 1.800 . 3.630 2.660 2.518 2.758 . 0 0 "[ . 1 . 2]" 1 326 1 22 ALA H 1 72 VAL MG1 1.800 . 5.600 3.916 2.899 5.662 0.062 12 0 "[ . 1 . 2]" 1 327 1 22 ALA H 1 72 VAL MG2 1.800 . 5.600 4.957 3.015 5.672 0.072 7 0 "[ . 1 . 2]" 1 328 1 23 ALA HA 1 26 ALA MB 1.800 . 3.700 2.716 2.489 2.898 . 0 0 "[ . 1 . 2]" 1 329 1 23 ALA HA 1 26 ALA H 1.800 . 4.320 3.609 3.464 3.775 . 0 0 "[ . 1 . 2]" 1 330 1 23 ALA MB 1 24 VAL MG2 1.800 . 3.590 3.084 2.928 3.218 . 0 0 "[ . 1 . 2]" 1 331 1 23 ALA MB 1 24 VAL H 1.800 . 3.440 2.464 2.282 2.576 . 0 0 "[ . 1 . 2]" 1 332 1 23 ALA MB 1 138 ALA HA 1.800 . 5.100 4.550 4.147 4.843 . 0 0 "[ . 1 . 2]" 1 333 1 23 ALA H 1 23 ALA MB 1.800 . 3.330 2.227 2.203 2.245 . 0 0 "[ . 1 . 2]" 1 334 1 23 ALA H 1 24 VAL H 1.800 . 3.150 2.681 2.591 2.836 . 0 0 "[ . 1 . 2]" 1 335 1 24 VAL HA 1 24 VAL MG1 1.800 . 3.510 2.367 2.349 2.397 . 0 0 "[ . 1 . 2]" 1 336 1 24 VAL HA 1 24 VAL MG2 1.800 . 3.520 2.311 2.267 2.385 . 0 0 "[ . 1 . 2]" 1 337 1 24 VAL HA 1 27 LEU HB3 1.800 . 4.940 4.524 4.214 4.731 . 0 0 "[ . 1 . 2]" 1 338 1 24 VAL HA 1 27 LEU HB2 1.800 . 4.940 2.948 2.694 3.152 . 0 0 "[ . 1 . 2]" 1 339 1 24 VAL HA 1 27 LEU MD1 1.800 . 3.610 2.418 2.264 2.846 . 0 0 "[ . 1 . 2]" 1 340 1 24 VAL HA 1 27 LEU MD2 1.800 . 5.690 4.933 4.769 5.197 . 0 0 "[ . 1 . 2]" 1 341 1 24 VAL HA 1 27 LEU HG 1.800 . 5.640 3.988 3.609 4.619 . 0 0 "[ . 1 . 2]" 1 342 1 24 VAL HA 1 27 LEU H 1.800 . 4.600 3.597 3.455 3.647 . 0 0 "[ . 1 . 2]" 1 343 1 24 VAL HA 1 134 LEU HG 1.800 . 6.050 5.631 5.187 5.970 . 0 0 "[ . 1 . 2]" 1 344 1 24 VAL HA 1 138 ALA MB 1.800 . 5.350 4.458 3.949 4.855 . 0 0 "[ . 1 . 2]" 1 345 1 24 VAL HB 1 25 PHE H 1.800 . 3.690 2.484 2.427 2.539 . 0 0 "[ . 1 . 2]" 1 346 1 24 VAL HB 1 98 LEU MD1 1.800 . 4.300 3.433 2.682 4.086 . 0 0 "[ . 1 . 2]" 1 347 1 24 VAL HB 1 105 THR MG 1.800 . 4.490 4.010 3.365 4.536 0.046 5 0 "[ . 1 . 2]" 1 348 1 24 VAL MG1 1 25 PHE HA 1.800 . 4.380 3.357 3.308 3.408 . 0 0 "[ . 1 . 2]" 1 349 1 24 VAL MG1 1 25 PHE H 1.800 . 3.730 3.256 3.160 3.311 . 0 0 "[ . 1 . 2]" 1 350 1 24 VAL MG1 1 28 MET ME 1.800 . 4.300 2.735 1.994 4.189 . 0 0 "[ . 1 . 2]" 1 351 1 24 VAL MG1 1 28 MET HG3 1.800 . 4.700 3.129 2.433 3.438 . 0 0 "[ . 1 . 2]" 1 352 1 24 VAL MG1 1 28 MET HG2 1.800 . 4.700 4.128 2.627 4.734 0.034 12 0 "[ . 1 . 2]" 1 353 1 24 VAL MG1 1 28 MET H 1.800 . 4.770 4.149 3.850 4.311 . 0 0 "[ . 1 . 2]" 1 354 1 24 VAL MG1 1 98 LEU MD1 1.800 . 4.130 3.159 2.563 3.895 . 0 0 "[ . 1 . 2]" 1 355 1 24 VAL MG1 1 105 THR HB 1.800 . 5.640 4.965 4.113 5.635 . 0 0 "[ . 1 . 2]" 1 356 1 24 VAL MG1 1 134 LEU MD1 1.800 . 4.460 3.725 3.113 4.388 . 0 0 "[ . 1 . 2]" 1 357 1 24 VAL MG1 1 134 LEU MD2 1.800 . 4.030 2.904 2.259 3.524 . 0 0 "[ . 1 . 2]" 1 358 1 24 VAL MG2 1 25 PHE H 1.800 . 4.590 3.839 3.801 3.868 . 0 0 "[ . 1 . 2]" 1 359 1 24 VAL MG2 1 105 THR HB 1.800 . 3.700 3.204 2.730 3.717 0.017 1 0 "[ . 1 . 2]" 1 360 1 24 VAL MG2 1 105 THR HG1 1.800 . 4.990 3.080 2.539 3.471 . 0 0 "[ . 1 . 2]" 1 361 1 24 VAL MG2 1 138 ALA MB 1.800 . 3.610 3.145 2.646 3.608 . 0 0 "[ . 1 . 2]" 1 362 1 24 VAL H 1 24 VAL HB 1.800 . 3.380 2.453 2.423 2.474 . 0 0 "[ . 1 . 2]" 1 363 1 24 VAL H 1 24 VAL MG1 1.800 . 4.380 3.761 3.752 3.772 . 0 0 "[ . 1 . 2]" 1 364 1 24 VAL H 1 24 VAL MG2 1.800 . 3.370 2.172 2.131 2.232 . 0 0 "[ . 1 . 2]" 1 365 1 24 VAL H 1 25 PHE H 1.800 . 3.530 2.700 2.646 2.754 . 0 0 "[ . 1 . 2]" 1 366 1 25 PHE HA 1 28 MET HB3 1.800 . 5.120 4.390 4.059 4.653 . 0 0 "[ . 1 . 2]" 1 367 1 25 PHE HA 1 28 MET HB2 1.800 . 5.120 2.729 2.459 2.973 . 0 0 "[ . 1 . 2]" 1 368 1 25 PHE HA 1 28 MET ME 1.800 . 4.980 3.998 2.224 5.082 0.102 3 0 "[ . 1 . 2]" 1 369 1 25 PHE HA 1 28 MET H 1.800 . 4.540 3.386 3.176 3.552 . 0 0 "[ . 1 . 2]" 1 370 1 25 PHE HA 1 98 LEU MD1 1.800 . 4.490 3.816 2.759 4.378 . 0 0 "[ . 1 . 2]" 1 371 1 25 PHE QB 1 72 VAL HA 1.800 . 4.530 2.923 2.298 3.674 . 0 0 "[ . 1 . 2]" 1 372 1 25 PHE HB3 1 26 ALA H 1.800 . 4.480 2.509 2.441 2.562 . 0 0 "[ . 1 . 2]" 1 373 1 25 PHE HB3 1 72 VAL HB 1.800 . 6.050 4.922 2.846 6.119 0.069 13 0 "[ . 1 . 2]" 1 374 1 25 PHE HB3 1 72 VAL MG1 1.800 . 5.050 3.263 2.290 5.126 0.076 14 0 "[ . 1 . 2]" 1 375 1 25 PHE HB3 1 72 VAL MG2 1.800 . 6.030 4.658 2.752 5.465 . 0 0 "[ . 1 . 2]" 1 376 1 25 PHE HB3 1 98 LEU MD1 1.800 . 4.750 4.494 3.705 4.803 0.053 7 0 "[ . 1 . 2]" 1 377 1 25 PHE HB2 1 26 ALA H 1.800 . 4.480 3.844 3.764 3.885 . 0 0 "[ . 1 . 2]" 1 378 1 25 PHE HB2 1 72 VAL HB 1.800 . 5.670 4.574 2.824 5.696 0.026 13 0 "[ . 1 . 2]" 1 379 1 25 PHE HB2 1 72 VAL MG1 1.800 . 5.050 3.292 2.159 5.020 . 0 0 "[ . 1 . 2]" 1 380 1 25 PHE HB2 1 72 VAL MG2 1.800 . 6.030 4.429 2.353 5.393 . 0 0 "[ . 1 . 2]" 1 381 1 25 PHE HB2 1 98 LEU MD1 1.800 . 4.750 3.136 2.308 3.580 . 0 0 "[ . 1 . 2]" 1 382 1 25 PHE H 1 25 PHE HB3 1.800 . 3.620 2.540 2.503 2.611 . 0 0 "[ . 1 . 2]" 1 383 1 25 PHE H 1 25 PHE HB2 1.800 . 3.620 2.563 2.485 2.630 . 0 0 "[ . 1 . 2]" 1 384 1 25 PHE H 1 26 ALA H 1.800 . 3.830 2.728 2.684 2.788 . 0 0 "[ . 1 . 2]" 1 385 1 25 PHE H 1 98 LEU MD1 1.800 . 4.160 3.867 3.307 4.173 0.013 15 0 "[ . 1 . 2]" 1 386 1 26 ALA HA 1 29 THR HB 1.800 . 4.710 3.000 2.314 4.702 . 0 0 "[ . 1 . 2]" 1 387 1 26 ALA HA 1 29 THR MG 1.800 . 5.000 3.955 2.146 4.682 . 0 0 "[ . 1 . 2]" 1 388 1 26 ALA HA 1 29 THR H 1.800 . 4.400 3.417 3.192 3.625 . 0 0 "[ . 1 . 2]" 1 389 1 26 ALA HA 1 30 ASP QB 1.800 . 5.280 4.619 3.829 5.159 . 0 0 "[ . 1 . 2]" 1 390 1 26 ALA MB 1 27 LEU H 1.800 . 3.640 2.458 2.304 2.543 . 0 0 "[ . 1 . 2]" 1 391 1 26 ALA MB 1 28 MET H 1.800 . 5.410 4.506 4.391 4.572 . 0 0 "[ . 1 . 2]" 1 392 1 26 ALA MB 1 29 THR H 1.800 . 5.590 4.458 4.256 4.683 . 0 0 "[ . 1 . 2]" 1 393 1 26 ALA MB 1 30 ASP QB 1.800 . 4.760 4.253 3.613 4.854 0.094 3 0 "[ . 1 . 2]" 1 394 1 26 ALA H 1 26 ALA MB 1.800 . 3.220 2.231 2.186 2.246 . 0 0 "[ . 1 . 2]" 1 395 1 26 ALA H 1 27 LEU H 1.800 . 3.660 2.775 2.667 2.852 . 0 0 "[ . 1 . 2]" 1 396 1 27 LEU HA 1 27 LEU MD1 1.800 . 4.520 3.816 3.781 3.847 . 0 0 "[ . 1 . 2]" 1 397 1 27 LEU HA 1 27 LEU MD2 1.800 . 3.330 2.204 2.137 2.281 . 0 0 "[ . 1 . 2]" 1 398 1 27 LEU HA 1 30 ASP HB3 1.800 . 5.200 4.405 2.495 5.244 0.044 6 0 "[ . 1 . 2]" 1 399 1 27 LEU HA 1 30 ASP HB2 1.800 . 5.200 3.689 2.334 5.066 . 0 0 "[ . 1 . 2]" 1 400 1 27 LEU HA 1 30 ASP H 1.800 . 6.050 4.517 3.280 6.098 0.048 19 0 "[ . 1 . 2]" 1 401 1 27 LEU HA 1 33 LYS QB 1.800 . 4.500 2.737 2.206 3.172 . 0 0 "[ . 1 . 2]" 1 402 1 27 LEU HA 1 33 LYS QD 1.800 . 4.990 3.384 2.409 4.889 . 0 0 "[ . 1 . 2]" 1 403 1 27 LEU HA 1 33 LYS QG 1.800 . 4.600 3.774 2.303 4.521 . 0 0 "[ . 1 . 2]" 1 404 1 27 LEU QB 1 33 LYS QB 1.800 . 5.090 3.934 3.495 4.651 . 0 0 "[ . 1 . 2]" 1 405 1 27 LEU QB 1 37 TRP HD1 1.800 . 5.600 5.152 4.196 5.659 0.059 9 0 "[ . 1 . 2]" 1 406 1 27 LEU QB 1 37 TRP HE1 1.800 . 4.690 3.433 2.396 4.541 . 0 0 "[ . 1 . 2]" 1 407 1 27 LEU HB3 1 27 LEU MD1 1.800 . 4.000 2.509 2.424 2.623 . 0 0 "[ . 1 . 2]" 1 408 1 27 LEU HB3 1 27 LEU MD2 1.800 . 4.600 2.233 2.202 2.265 . 0 0 "[ . 1 . 2]" 1 409 1 27 LEU HB3 1 28 MET H 1.800 . 4.520 3.481 3.341 3.637 . 0 0 "[ . 1 . 2]" 1 410 1 27 LEU HB3 1 134 LEU MD1 1.800 . 4.190 3.361 2.931 3.889 . 0 0 "[ . 1 . 2]" 1 411 1 27 LEU HB2 1 27 LEU MD1 1.800 . 4.000 2.270 2.224 2.336 . 0 0 "[ . 1 . 2]" 1 412 1 27 LEU HB2 1 27 LEU MD2 1.800 . 4.600 3.197 3.164 3.218 . 0 0 "[ . 1 . 2]" 1 413 1 27 LEU HB2 1 28 MET H 1.800 . 4.520 2.617 2.544 2.689 . 0 0 "[ . 1 . 2]" 1 414 1 27 LEU HB2 1 134 LEU MD1 1.800 . 4.190 3.618 2.989 4.084 . 0 0 "[ . 1 . 2]" 1 415 1 27 LEU MD1 1 33 LYS QB 1.800 . 5.750 4.713 4.142 5.510 . 0 0 "[ . 1 . 2]" 1 416 1 27 LEU MD1 1 37 TRP HD1 1.800 . 6.050 5.087 4.191 5.853 . 0 0 "[ . 1 . 2]" 1 417 1 27 LEU MD1 1 134 LEU MD1 1.800 . 3.490 2.504 1.903 3.359 . 0 0 "[ . 1 . 2]" 1 418 1 27 LEU MD1 1 134 LEU MD2 1.800 . 5.490 4.040 3.428 4.759 . 0 0 "[ . 1 . 2]" 1 419 1 27 LEU MD1 1 137 VAL MG1 1.800 . 3.470 2.782 2.253 3.344 . 0 0 "[ . 1 . 2]" 1 420 1 27 LEU MD1 1 137 VAL MG2 1.800 . 5.750 4.667 4.005 5.179 . 0 0 "[ . 1 . 2]" 1 421 1 27 LEU MD1 1 138 ALA HA 1.800 . 3.720 3.370 2.596 3.782 0.062 17 0 "[ . 1 . 2]" 1 422 1 27 LEU MD1 1 138 ALA MB 1.800 . 3.980 3.308 2.600 3.847 . 0 0 "[ . 1 . 2]" 1 423 1 27 LEU MD1 1 138 ALA H 1.800 . 5.100 4.318 3.705 4.802 . 0 0 "[ . 1 . 2]" 1 424 1 27 LEU MD2 1 28 MET H 1.800 . 5.670 4.729 4.694 4.768 . 0 0 "[ . 1 . 2]" 1 425 1 27 LEU MD2 1 33 LYS HA 1.800 . 4.890 4.219 3.735 4.681 . 0 0 "[ . 1 . 2]" 1 426 1 27 LEU MD2 1 33 LYS QB 1.800 . 3.600 2.382 1.972 3.201 . 0 0 "[ . 1 . 2]" 1 427 1 27 LEU MD2 1 33 LYS QD 1.800 . 4.190 2.593 2.146 3.863 . 0 0 "[ . 1 . 2]" 1 428 1 27 LEU MD2 1 33 LYS QE 1.800 . 4.230 3.537 2.150 4.131 . 0 0 "[ . 1 . 2]" 1 429 1 27 LEU MD2 1 33 LYS HE3 1.800 . 5.000 4.279 3.526 4.994 . 0 0 "[ . 1 . 2]" 1 430 1 27 LEU MD2 1 33 LYS HE2 1.800 . 5.000 3.959 2.169 4.989 . 0 0 "[ . 1 . 2]" 1 431 1 27 LEU MD2 1 33 LYS QG 1.800 . 4.940 3.036 1.984 3.842 . 0 0 "[ . 1 . 2]" 1 432 1 27 LEU MD2 1 33 LYS H 1.800 . 5.500 5.171 4.571 5.604 0.104 18 0 "[ . 1 . 2]" 1 433 1 27 LEU MD2 1 34 ILE HA 1.800 . 5.540 4.220 3.324 5.239 . 0 0 "[ . 1 . 2]" 1 434 1 27 LEU MD2 1 34 ILE H 1.800 . 5.620 4.723 4.049 5.483 . 0 0 "[ . 1 . 2]" 1 435 1 27 LEU MD2 1 36 ARG HB3 1.800 . 5.470 4.792 4.252 5.571 0.101 1 0 "[ . 1 . 2]" 1 436 1 27 LEU MD2 1 36 ARG HB2 1.800 . 5.470 4.883 3.931 5.528 0.058 11 0 "[ . 1 . 2]" 1 437 1 27 LEU MD2 1 36 ARG QD 1.800 . 4.600 4.070 2.877 4.694 0.094 5 0 "[ . 1 . 2]" 1 438 1 27 LEU MD2 1 37 TRP HD1 1.800 . 4.800 3.812 3.093 4.676 . 0 0 "[ . 1 . 2]" 1 439 1 27 LEU MD2 1 37 TRP HE1 1.800 . 5.100 3.194 1.981 5.129 0.029 3 0 "[ . 1 . 2]" 1 440 1 27 LEU MD2 1 37 TRP H 1.800 . 6.050 5.510 4.788 6.016 . 0 0 "[ . 1 . 2]" 1 441 1 27 LEU MD2 1 134 LEU MD1 1.800 . 4.300 3.710 2.810 4.261 . 0 0 "[ . 1 . 2]" 1 442 1 27 LEU MD2 1 138 ALA HA 1.800 . 5.790 5.066 3.942 5.756 . 0 0 "[ . 1 . 2]" 1 443 1 27 LEU HG 1 28 MET H 1.800 . 5.680 4.458 4.342 4.642 . 0 0 "[ . 1 . 2]" 1 444 1 27 LEU HG 1 137 VAL MG1 1.800 . 5.400 4.877 3.987 5.364 . 0 0 "[ . 1 . 2]" 1 445 1 27 LEU H 1 27 LEU HB3 1.800 . 4.280 3.586 3.556 3.603 . 0 0 "[ . 1 . 2]" 1 446 1 27 LEU H 1 27 LEU HB2 1.800 . 4.280 2.355 2.249 2.419 . 0 0 "[ . 1 . 2]" 1 447 1 27 LEU H 1 27 LEU MD1 1.800 . 4.290 3.361 3.191 3.473 . 0 0 "[ . 1 . 2]" 1 448 1 27 LEU H 1 27 LEU MD2 1.800 . 4.870 3.737 3.542 4.054 . 0 0 "[ . 1 . 2]" 1 449 1 27 LEU H 1 27 LEU HG 1.800 . 3.980 2.422 2.238 2.777 . 0 0 "[ . 1 . 2]" 1 450 1 27 LEU H 1 28 MET H 1.800 . 3.750 2.682 2.625 2.744 . 0 0 "[ . 1 . 2]" 1 451 1 28 MET HA 1 28 MET ME 1.800 . 5.320 4.141 3.142 4.507 . 0 0 "[ . 1 . 2]" 1 452 1 28 MET HA 1 34 ILE MD 1.800 . 4.940 2.868 2.290 4.409 . 0 0 "[ . 1 . 2]" 1 453 1 28 MET HA 1 34 ILE QG 1.800 . 4.720 3.211 2.627 4.128 . 0 0 "[ . 1 . 2]" 1 454 1 28 MET HA 1 37 TRP HZ2 1.800 . 4.830 4.534 3.266 4.917 0.087 9 0 "[ . 1 . 2]" 1 455 1 28 MET QB 1 28 MET ME 1.800 . 4.960 2.726 2.098 3.560 . 0 0 "[ . 1 . 2]" 1 456 1 28 MET HB3 1 29 THR H 1.800 . 5.180 3.938 3.513 4.212 . 0 0 "[ . 1 . 2]" 1 457 1 28 MET HB2 1 29 THR H 1.800 . 5.180 3.108 2.627 3.482 . 0 0 "[ . 1 . 2]" 1 458 1 28 MET ME 1 75 LEU QD 1.800 . 4.750 3.434 2.168 4.495 . 0 0 "[ . 1 . 2]" 1 459 1 28 MET ME 1 96 ILE MD 1.800 . 4.170 2.690 1.923 4.239 0.069 12 0 "[ . 1 . 2]" 1 460 1 28 MET ME 1 96 ILE MG 1.800 . 3.290 2.785 2.205 3.315 0.025 6 0 "[ . 1 . 2]" 1 461 1 28 MET ME 1 98 LEU MD1 1.800 . 4.800 4.063 2.597 4.881 0.081 14 0 "[ . 1 . 2]" 1 462 1 28 MET ME 1 107 LEU MD1 1.800 . 3.340 2.747 1.973 3.378 0.038 16 0 "[ . 1 . 2]" 1 463 1 28 MET ME 1 134 LEU MD1 1.800 . 5.200 4.638 3.323 5.302 0.102 8 0 "[ . 1 . 2]" 1 464 1 28 MET ME 1 134 LEU MD2 1.800 . 4.800 3.482 2.464 4.512 . 0 0 "[ . 1 . 2]" 1 465 1 28 MET ME 1 28 MET QG 1.800 . 4.710 2.193 2.141 2.237 . 0 0 "[ . 1 . 2]" 1 466 1 28 MET HG3 1 37 TRP HZ2 1.800 . 6.050 5.252 3.515 6.142 0.092 20 0 "[ . 1 . 2]" 1 467 1 28 MET HG3 1 134 LEU MD1 1.800 . 5.510 4.547 3.516 5.302 . 0 0 "[ . 1 . 2]" 1 468 1 28 MET HG3 1 134 LEU MD2 1.800 . 4.960 4.081 3.335 4.595 . 0 0 "[ . 1 . 2]" 1 469 1 28 MET HG2 1 37 TRP HZ2 1.800 . 5.900 4.567 2.678 5.708 . 0 0 "[ . 1 . 2]" 1 470 1 28 MET HG2 1 134 LEU MD1 1.800 . 5.510 4.724 3.824 5.394 . 0 0 "[ . 1 . 2]" 1 471 1 28 MET HG2 1 134 LEU MD2 1.800 . 4.960 4.215 3.040 4.857 . 0 0 "[ . 1 . 2]" 1 472 1 28 MET H 1 28 MET QB 1.800 . 3.580 2.360 2.318 2.397 . 0 0 "[ . 1 . 2]" 1 473 1 28 MET H 1 28 MET HG3 1.800 . 4.500 2.640 2.272 3.640 . 0 0 "[ . 1 . 2]" 1 474 1 28 MET H 1 28 MET HG2 1.800 . 4.500 3.352 2.319 3.697 . 0 0 "[ . 1 . 2]" 1 475 1 28 MET H 1 29 THR H 1.800 . 3.300 2.542 2.397 2.707 . 0 0 "[ . 1 . 2]" 1 476 1 29 THR HA 1 29 THR MG 1.800 . 3.860 2.324 2.222 3.210 . 0 0 "[ . 1 . 2]" 1 477 1 29 THR HA 1 34 ILE MD 1.800 . 5.000 4.481 3.418 5.072 0.072 14 0 "[ . 1 . 2]" 1 478 1 29 THR H 1 29 THR MG 1.800 . 3.880 3.574 1.960 3.928 0.048 14 0 "[ . 1 . 2]" 1 479 1 29 THR H 1 30 ASP H 1.800 . 4.100 2.912 2.055 4.105 0.005 19 0 "[ . 1 . 2]" 1 480 1 30 ASP HA 1 31 PRO QD 1.800 . 3.290 2.074 2.025 2.152 . 0 0 "[ . 1 . 2]" 1 481 1 30 ASP HA 1 31 PRO QG 1.800 . 4.890 4.006 3.953 4.088 . 0 0 "[ . 1 . 2]" 1 482 1 30 ASP QB 1 31 PRO QD 1.800 . 4.500 3.377 2.584 3.829 . 0 0 "[ . 1 . 2]" 1 483 1 30 ASP QB 1 33 LYS QB 1.800 . 3.940 2.302 1.980 3.104 . 0 0 "[ . 1 . 2]" 1 484 1 30 ASP QB 1 33 LYS QD 1.800 . 4.300 3.018 2.099 4.382 0.082 20 0 "[ . 1 . 2]" 1 485 1 30 ASP QB 1 33 LYS QG 1.800 . 3.950 2.760 2.038 4.097 0.147 18 0 "[ . 1 . 2]" 1 486 1 30 ASP HB3 1 33 LYS H 1.800 . 4.820 2.805 2.376 4.126 . 0 0 "[ . 1 . 2]" 1 487 1 30 ASP HB2 1 33 LYS H 1.800 . 4.820 3.633 2.386 4.525 . 0 0 "[ . 1 . 2]" 1 488 1 30 ASP H 1 30 ASP QB 1.800 . 3.790 2.762 2.281 3.569 . 0 0 "[ . 1 . 2]" 1 489 1 31 PRO HA 1 34 ILE HB 1.800 . 4.020 3.010 2.692 3.531 . 0 0 "[ . 1 . 2]" 1 490 1 31 PRO HA 1 34 ILE MD 1.800 . 3.740 2.353 2.159 3.112 . 0 0 "[ . 1 . 2]" 1 491 1 31 PRO HA 1 34 ILE QG 1.800 . 4.910 3.621 3.021 4.389 . 0 0 "[ . 1 . 2]" 1 492 1 31 PRO HA 1 34 ILE H 1.800 . 4.740 3.700 3.488 4.007 . 0 0 "[ . 1 . 2]" 1 493 1 31 PRO HA 1 35 LEU H 1.800 . 5.240 4.584 4.038 5.083 . 0 0 "[ . 1 . 2]" 1 494 1 31 PRO HA 1 42 ALA MB 1.800 . 4.310 3.681 2.079 4.397 0.087 9 0 "[ . 1 . 2]" 1 495 1 31 PRO HA 1 44 VAL HB 1.800 . 6.050 5.063 3.073 6.265 0.215 20 0 "[ . 1 . 2]" 1 496 1 31 PRO HA 1 44 VAL MG2 1.800 . 5.400 4.311 2.787 5.468 0.068 8 0 "[ . 1 . 2]" 1 497 1 31 PRO QB 1 32 GLU H 1.800 . 3.810 2.983 2.480 3.530 . 0 0 "[ . 1 . 2]" 1 498 1 31 PRO QB 1 34 ILE HB 1.800 . 5.510 4.555 4.309 5.162 . 0 0 "[ . 1 . 2]" 1 499 1 31 PRO QB 1 34 ILE MD 1.800 . 4.580 3.847 3.426 4.624 0.044 19 0 "[ . 1 . 2]" 1 500 1 31 PRO QB 1 42 ALA MB 1.800 . 3.980 3.255 2.057 4.035 0.055 12 0 "[ . 1 . 2]" 1 501 1 31 PRO QB 1 43 GLU HA 1.800 . 5.400 3.762 2.084 5.616 0.216 20 0 "[ . 1 . 2]" 1 502 1 31 PRO QB 1 44 VAL HB 1.800 . 4.640 3.326 2.332 4.770 0.130 1 0 "[ . 1 . 2]" 1 503 1 31 PRO QB 1 44 VAL MG2 1.800 . 4.160 3.128 2.011 4.091 . 0 0 "[ . 1 . 2]" 1 504 1 31 PRO QB 1 44 VAL H 1.800 . 5.330 3.648 1.739 5.320 0.061 7 0 "[ . 1 . 2]" 1 505 1 31 PRO QD 1 32 GLU H 1.800 . 4.590 2.634 2.377 2.903 . 0 0 "[ . 1 . 2]" 1 506 1 31 PRO QD 1 44 VAL HB 1.800 . 5.080 4.066 2.317 5.039 . 0 0 "[ . 1 . 2]" 1 507 1 31 PRO QG 1 32 GLU H 1.800 . 4.200 2.991 1.760 3.869 0.040 19 0 "[ . 1 . 2]" 1 508 1 32 GLU HA 1 32 GLU QG 1.800 . 3.720 2.498 2.299 3.318 . 0 0 "[ . 1 . 2]" 1 509 1 32 GLU HA 1 34 ILE HB 1.800 . 6.050 5.095 4.843 5.406 . 0 0 "[ . 1 . 2]" 1 510 1 32 GLU HA 1 35 LEU HB3 1.800 . 6.010 4.789 4.269 5.178 . 0 0 "[ . 1 . 2]" 1 511 1 32 GLU HA 1 35 LEU HB2 1.800 . 6.010 3.366 2.725 4.051 . 0 0 "[ . 1 . 2]" 1 512 1 32 GLU HA 1 35 LEU MD1 1.800 . 3.990 2.476 2.142 3.105 . 0 0 "[ . 1 . 2]" 1 513 1 32 GLU HA 1 35 LEU HG 1.800 . 5.390 3.356 2.414 4.133 . 0 0 "[ . 1 . 2]" 1 514 1 32 GLU HA 1 35 LEU H 1.800 . 4.720 3.621 3.514 3.889 . 0 0 "[ . 1 . 2]" 1 515 1 32 GLU QB 1 33 LYS H 1.800 . 3.530 2.546 2.278 3.424 . 0 0 "[ . 1 . 2]" 1 516 1 32 GLU QG 1 35 LEU MD1 1.800 . 5.070 3.584 2.607 4.841 . 0 0 "[ . 1 . 2]" 1 517 1 32 GLU H 1 32 GLU QB 1.800 . 3.350 2.319 2.204 2.536 . 0 0 "[ . 1 . 2]" 1 518 1 32 GLU H 1 32 GLU QG 1.800 . 4.300 3.209 1.944 4.059 . 0 0 "[ . 1 . 2]" 1 519 1 32 GLU H 1 33 LYS H 1.800 . 3.330 2.627 2.405 2.776 . 0 0 "[ . 1 . 2]" 1 520 1 33 LYS HA 1 33 LYS QD 1.800 . 4.210 3.319 2.140 4.148 . 0 0 "[ . 1 . 2]" 1 521 1 33 LYS HA 1 33 LYS QE 1.800 . 5.000 4.258 2.297 4.926 . 0 0 "[ . 1 . 2]" 1 522 1 33 LYS HA 1 33 LYS HG3 1.800 . 4.270 3.036 2.317 3.796 . 0 0 "[ . 1 . 2]" 1 523 1 33 LYS HA 1 33 LYS HG2 1.800 . 4.270 2.775 2.381 3.652 . 0 0 "[ . 1 . 2]" 1 524 1 33 LYS HA 1 36 ARG QB 1.800 . 4.000 3.141 2.273 4.149 0.149 9 0 "[ . 1 . 2]" 1 525 1 33 LYS HA 1 36 ARG QD 1.800 . 4.200 3.520 2.210 4.363 0.163 2 0 "[ . 1 . 2]" 1 526 1 33 LYS HA 1 36 ARG QG 1.800 . 5.010 4.019 2.454 5.052 0.042 14 0 "[ . 1 . 2]" 1 527 1 33 LYS HA 1 36 ARG H 1.800 . 4.170 3.574 3.322 3.825 . 0 0 "[ . 1 . 2]" 1 528 1 33 LYS QB 1 33 LYS QE 1.800 . 4.280 3.541 2.225 3.803 . 0 0 "[ . 1 . 2]" 1 529 1 33 LYS QB 1 34 ILE QG 1.800 . 4.690 3.300 3.073 3.443 . 0 0 "[ . 1 . 2]" 1 530 1 33 LYS QB 1 34 ILE H 1.800 . 4.080 2.654 2.456 2.796 . 0 0 "[ . 1 . 2]" 1 531 1 33 LYS HB3 1 33 LYS QD 1.800 . 4.230 2.507 2.235 3.259 . 0 0 "[ . 1 . 2]" 1 532 1 33 LYS HB2 1 33 LYS QD 1.800 . 4.230 2.606 2.235 3.321 . 0 0 "[ . 1 . 2]" 1 533 1 33 LYS QE 1 33 LYS QG 1.800 . 3.330 2.230 2.118 2.315 . 0 0 "[ . 1 . 2]" 1 534 1 33 LYS QG 1 36 ARG QD 1.800 . 5.320 4.079 2.115 5.389 0.069 15 0 "[ . 1 . 2]" 1 535 1 33 LYS H 1 33 LYS QB 1.800 . 3.630 2.378 2.181 2.526 . 0 0 "[ . 1 . 2]" 1 536 1 33 LYS H 1 33 LYS QD 1.800 . 4.330 3.839 3.176 4.382 0.052 8 0 "[ . 1 . 2]" 1 537 1 33 LYS H 1 33 LYS QG 1.800 . 3.900 2.637 1.979 4.066 0.166 16 0 "[ . 1 . 2]" 1 538 1 33 LYS H 1 34 ILE H 1.800 . 3.410 2.660 2.579 2.766 . 0 0 "[ . 1 . 2]" 1 539 1 34 ILE HA 1 37 TRP HD1 1.800 . 4.720 3.438 2.441 4.393 . 0 0 "[ . 1 . 2]" 1 540 1 34 ILE HA 1 37 TRP HE1 1.800 . 4.030 2.160 1.779 3.124 0.021 3 0 "[ . 1 . 2]" 1 541 1 34 ILE HA 1 37 TRP HZ2 1.800 . 5.070 3.705 2.496 4.851 . 0 0 "[ . 1 . 2]" 1 542 1 34 ILE HB 1 35 LEU HG 1.800 . 4.700 3.412 3.130 3.778 . 0 0 "[ . 1 . 2]" 1 543 1 34 ILE HB 1 35 LEU H 1.800 . 3.480 2.640 2.502 3.014 . 0 0 "[ . 1 . 2]" 1 544 1 34 ILE HB 1 42 ALA MB 1.800 . 4.980 3.777 2.618 4.554 . 0 0 "[ . 1 . 2]" 1 545 1 34 ILE MD 1 42 ALA MB 1.800 . 4.390 3.681 2.219 4.449 0.059 6 0 "[ . 1 . 2]" 1 546 1 34 ILE QG 1 37 TRP HZ2 1.800 . 4.540 2.994 2.371 4.286 . 0 0 "[ . 1 . 2]" 1 547 1 34 ILE HG13 1 37 TRP HE1 1.800 . 5.640 4.042 3.338 4.979 . 0 0 "[ . 1 . 2]" 1 548 1 34 ILE HG12 1 37 TRP HE1 1.800 . 5.640 3.370 2.141 4.210 . 0 0 "[ . 1 . 2]" 1 549 1 34 ILE HG13 1 34 ILE MG 1.800 . 4.580 3.195 3.182 3.205 . 0 0 "[ . 1 . 2]" 1 550 1 34 ILE HG12 1 34 ILE MG 1.800 . 4.580 2.344 2.297 2.376 . 0 0 "[ . 1 . 2]" 1 551 1 34 ILE MG 1 35 LEU HA 1.800 . 5.030 3.346 3.247 3.540 . 0 0 "[ . 1 . 2]" 1 552 1 34 ILE MG 1 35 LEU HG 1.800 . 5.080 3.789 3.256 4.383 . 0 0 "[ . 1 . 2]" 1 553 1 34 ILE MG 1 35 LEU H 1.800 . 4.260 3.308 3.207 3.632 . 0 0 "[ . 1 . 2]" 1 554 1 34 ILE MG 1 37 TRP HD1 1.800 . 6.030 4.748 3.611 5.680 . 0 0 "[ . 1 . 2]" 1 555 1 34 ILE MG 1 37 TRP HE1 1.800 . 5.200 3.513 2.135 4.288 . 0 0 "[ . 1 . 2]" 1 556 1 34 ILE MG 1 37 TRP H 1.800 . 5.440 4.273 3.618 4.635 . 0 0 "[ . 1 . 2]" 1 557 1 34 ILE MG 1 37 TRP HZ2 1.800 . 5.950 3.173 2.331 4.387 . 0 0 "[ . 1 . 2]" 1 558 1 34 ILE MG 1 38 MET QB 1.800 . 5.600 3.043 1.950 5.408 . 0 0 "[ . 1 . 2]" 1 559 1 34 ILE MG 1 38 MET H 1.800 . 4.910 4.386 3.355 5.135 0.225 11 0 "[ . 1 . 2]" 1 560 1 34 ILE MG 1 42 ALA MB 1.800 . 4.400 3.406 2.069 4.471 0.071 20 0 "[ . 1 . 2]" 1 561 1 34 ILE H 1 34 ILE HB 1.800 . 3.710 2.429 2.385 2.464 . 0 0 "[ . 1 . 2]" 1 562 1 34 ILE H 1 34 ILE MD 1.800 . 4.170 3.448 3.336 3.560 . 0 0 "[ . 1 . 2]" 1 563 1 34 ILE H 1 34 ILE HG13 1.800 . 4.360 2.249 2.153 2.311 . 0 0 "[ . 1 . 2]" 1 564 1 34 ILE H 1 34 ILE HG12 1.800 . 4.360 3.611 3.525 3.692 . 0 0 "[ . 1 . 2]" 1 565 1 34 ILE H 1 34 ILE MG 1.800 . 4.910 3.762 3.743 3.775 . 0 0 "[ . 1 . 2]" 1 566 1 34 ILE H 1 35 LEU H 1.800 . 4.090 2.710 2.666 2.792 . 0 0 "[ . 1 . 2]" 1 567 1 35 LEU HA 1 35 LEU MD1 1.800 . 4.440 3.838 3.820 3.858 . 0 0 "[ . 1 . 2]" 1 568 1 35 LEU HA 1 35 LEU MD2 1.800 . 3.430 2.157 2.121 2.204 . 0 0 "[ . 1 . 2]" 1 569 1 35 LEU HA 1 37 TRP H 1.800 . 5.040 4.124 3.504 4.377 . 0 0 "[ . 1 . 2]" 1 570 1 35 LEU HA 1 38 MET H 1.800 . 4.530 3.623 2.874 4.581 0.051 9 0 "[ . 1 . 2]" 1 571 1 35 LEU HB3 1 35 LEU MD1 1.800 . 4.060 2.430 2.339 2.502 . 0 0 "[ . 1 . 2]" 1 572 1 35 LEU HB3 1 35 LEU MD2 1.800 . 4.580 2.260 2.210 2.299 . 0 0 "[ . 1 . 2]" 1 573 1 35 LEU HB3 1 36 ARG H 1.800 . 4.620 4.088 3.894 4.334 . 0 0 "[ . 1 . 2]" 1 574 1 35 LEU HB2 1 35 LEU MD1 1.800 . 4.060 2.311 2.237 2.377 . 0 0 "[ . 1 . 2]" 1 575 1 35 LEU HB2 1 35 LEU MD2 1.800 . 4.580 3.208 3.198 3.218 . 0 0 "[ . 1 . 2]" 1 576 1 35 LEU HB2 1 36 ARG H 1.800 . 4.620 3.173 2.807 3.444 . 0 0 "[ . 1 . 2]" 1 577 1 35 LEU MD1 1 41 GLU HA 1.800 . 3.990 3.446 2.254 4.082 0.092 19 0 "[ . 1 . 2]" 1 578 1 35 LEU MD1 1 41 GLU QG 1.800 . 6.050 4.620 3.223 5.736 . 0 0 "[ . 1 . 2]" 1 579 1 35 LEU MD1 1 41 GLU H 1.800 . 5.400 4.536 2.288 5.435 0.035 8 0 "[ . 1 . 2]" 1 580 1 35 LEU MD1 1 42 ALA H 1.800 . 4.400 3.161 1.779 4.436 0.036 13 0 "[ . 1 . 2]" 1 581 1 35 LEU MD2 1 39 GLY QA 1.800 . 4.330 2.883 2.148 4.197 . 0 0 "[ . 1 . 2]" 1 582 1 35 LEU MD2 1 40 THR HA 1.800 . 4.680 3.575 2.347 4.734 0.054 15 0 "[ . 1 . 2]" 1 583 1 35 LEU MD2 1 40 THR H 1.800 . 4.680 3.257 2.033 4.528 . 0 0 "[ . 1 . 2]" 1 584 1 35 LEU MD2 1 41 GLU HA 1.800 . 4.030 2.759 2.214 3.713 . 0 0 "[ . 1 . 2]" 1 585 1 35 LEU MD2 1 41 GLU H 1.800 . 4.050 2.916 1.861 3.883 . 0 0 "[ . 1 . 2]" 1 586 1 35 LEU MD2 1 42 ALA MB 1.800 . 3.300 2.363 1.952 3.008 . 0 0 "[ . 1 . 2]" 1 587 1 35 LEU MD2 1 42 ALA H 1.800 . 4.320 2.758 2.091 4.117 . 0 0 "[ . 1 . 2]" 1 588 1 35 LEU HG 1 42 ALA MB 1.800 . 4.270 3.191 2.302 4.297 0.027 9 0 "[ . 1 . 2]" 1 589 1 35 LEU H 1 35 LEU QB 1.800 . 3.620 2.480 2.301 2.691 . 0 0 "[ . 1 . 2]" 1 590 1 35 LEU H 1 35 LEU MD1 1.800 . 4.250 3.447 3.333 3.602 . 0 0 "[ . 1 . 2]" 1 591 1 35 LEU H 1 35 LEU MD2 1.800 . 4.140 3.276 2.784 3.780 . 0 0 "[ . 1 . 2]" 1 592 1 35 LEU H 1 35 LEU HG 1.800 . 3.450 2.061 1.774 2.438 0.026 9 0 "[ . 1 . 2]" 1 593 1 35 LEU H 1 36 ARG H 1.800 . 4.030 2.684 2.545 2.834 . 0 0 "[ . 1 . 2]" 1 594 1 35 LEU H 1 42 ALA MB 1.800 . 5.100 4.427 3.383 5.144 0.044 16 0 "[ . 1 . 2]" 1 595 1 36 ARG HA 1 36 ARG QD 1.800 . 4.610 3.962 3.398 4.172 . 0 0 "[ . 1 . 2]" 1 596 1 36 ARG HA 1 36 ARG HG3 1.800 . 3.900 2.653 2.364 3.478 . 0 0 "[ . 1 . 2]" 1 597 1 36 ARG HA 1 36 ARG HG2 1.800 . 3.900 2.780 2.289 3.085 . 0 0 "[ . 1 . 2]" 1 598 1 36 ARG QB 1 36 ARG QD 1.800 . 3.490 2.194 2.119 2.308 . 0 0 "[ . 1 . 2]" 1 599 1 36 ARG QB 1 137 VAL MG1 1.800 . 4.530 3.972 2.759 4.722 0.192 2 0 "[ . 1 . 2]" 1 600 1 36 ARG QB 1 137 VAL MG2 1.800 . 4.810 4.240 2.527 4.939 0.129 14 0 "[ . 1 . 2]" 1 601 1 36 ARG HB3 1 37 TRP HD1 1.800 . 5.390 2.883 2.305 4.301 . 0 0 "[ . 1 . 2]" 1 602 1 36 ARG HB3 1 37 TRP H 1.800 . 4.400 2.951 2.479 3.701 . 0 0 "[ . 1 . 2]" 1 603 1 36 ARG HB2 1 37 TRP HD1 1.800 . 5.390 3.553 2.321 4.283 . 0 0 "[ . 1 . 2]" 1 604 1 36 ARG HB2 1 37 TRP H 1.800 . 4.400 3.433 2.588 4.100 . 0 0 "[ . 1 . 2]" 1 605 1 36 ARG QD 1 137 VAL MG1 1.800 . 4.600 3.744 2.578 4.595 . 0 0 "[ . 1 . 2]" 1 606 1 36 ARG QD 1 137 VAL MG2 1.800 . 5.200 4.524 3.613 5.223 0.023 18 0 "[ . 1 . 2]" 1 607 1 36 ARG QG 1 37 TRP H 1.800 . 5.670 3.896 3.559 4.250 . 0 0 "[ . 1 . 2]" 1 608 1 36 ARG QG 1 137 VAL MG2 1.800 . 5.590 4.716 3.466 5.813 0.223 8 0 "[ . 1 . 2]" 1 609 1 36 ARG H 1 36 ARG HB3 1.800 . 3.700 2.962 2.539 3.620 . 0 0 "[ . 1 . 2]" 1 610 1 36 ARG H 1 36 ARG HB2 1.800 . 3.700 2.473 2.385 2.603 . 0 0 "[ . 1 . 2]" 1 611 1 36 ARG H 1 36 ARG QD 1.800 . 4.940 4.278 3.675 4.729 . 0 0 "[ . 1 . 2]" 1 612 1 36 ARG H 1 36 ARG QG 1.800 . 4.770 3.389 2.201 4.008 . 0 0 "[ . 1 . 2]" 1 613 1 36 ARG H 1 37 TRP HD1 1.800 . 4.590 3.795 3.245 4.362 . 0 0 "[ . 1 . 2]" 1 614 1 36 ARG H 1 37 TRP H 1.800 . 3.690 2.664 2.415 2.793 . 0 0 "[ . 1 . 2]" 1 615 1 37 TRP HA 1 137 VAL MG2 1.800 . 4.410 4.046 3.158 4.393 . 0 0 "[ . 1 . 2]" 1 616 1 37 TRP HA 1 143 PRO HG3 1.800 . 5.900 4.572 3.034 6.074 0.174 8 0 "[ . 1 . 2]" 1 617 1 37 TRP HA 1 143 PRO HG2 1.800 . 5.900 4.170 2.740 5.941 0.041 2 0 "[ . 1 . 2]" 1 618 1 37 TRP QB 1 133 ARG QB 1.800 . 5.810 3.402 2.150 4.712 . 0 0 "[ . 1 . 2]" 1 619 1 37 TRP QB 1 134 LEU HA 1.800 . 5.150 4.171 2.280 5.016 . 0 0 "[ . 1 . 2]" 1 620 1 37 TRP HB3 1 137 VAL MG1 1.800 . 5.250 3.598 2.882 4.064 . 0 0 "[ . 1 . 2]" 1 621 1 37 TRP HB3 1 137 VAL MG2 1.800 . 3.940 2.262 2.097 2.465 . 0 0 "[ . 1 . 2]" 1 622 1 37 TRP HB2 1 137 VAL MG1 1.800 . 5.250 4.742 3.909 5.301 0.051 19 0 "[ . 1 . 2]" 1 623 1 37 TRP HB2 1 137 VAL MG2 1.800 . 3.940 2.957 2.276 3.507 . 0 0 "[ . 1 . 2]" 1 624 1 37 TRP HD1 1 38 MET H 1.800 . 5.400 4.637 3.201 5.483 0.083 14 0 "[ . 1 . 2]" 1 625 1 37 TRP HD1 1 134 LEU MD1 1.800 . 5.400 4.545 3.290 5.324 . 0 0 "[ . 1 . 2]" 1 626 1 37 TRP HD1 1 137 VAL HB 1.800 . 6.050 5.045 4.206 5.903 . 0 0 "[ . 1 . 2]" 1 627 1 37 TRP HD1 1 137 VAL MG1 1.800 . 4.710 3.323 2.629 4.416 . 0 0 "[ . 1 . 2]" 1 628 1 37 TRP HD1 1 137 VAL MG2 1.800 . 4.890 3.487 2.779 4.222 . 0 0 "[ . 1 . 2]" 1 629 1 37 TRP HE1 1 134 LEU MD1 1.800 . 4.880 3.695 3.145 4.598 . 0 0 "[ . 1 . 2]" 1 630 1 37 TRP HE3 1 133 ARG QB 1.800 . 5.210 3.058 2.250 4.593 . 0 0 "[ . 1 . 2]" 1 631 1 37 TRP HE3 1 133 ARG QG 1.800 . 4.940 3.895 2.471 4.992 0.052 3 0 "[ . 1 . 2]" 1 632 1 37 TRP H 1 37 TRP HD1 1.800 . 3.860 2.307 1.790 2.834 0.010 19 0 "[ . 1 . 2]" 1 633 1 37 TRP H 1 38 MET H 1.800 . 3.600 2.648 1.772 3.642 0.042 1 0 "[ . 1 . 2]" 1 634 1 37 TRP H 1 137 VAL MG1 1.800 . 5.600 5.074 4.554 5.596 . 0 0 "[ . 1 . 2]" 1 635 1 37 TRP H 1 137 VAL MG2 1.800 . 5.400 4.586 3.581 5.003 . 0 0 "[ . 1 . 2]" 1 636 1 38 MET HA 1 38 MET QG 1.800 . 3.860 2.518 2.234 3.268 . 0 0 "[ . 1 . 2]" 1 637 1 38 MET HA 1 39 GLY H 1.800 . 3.740 2.706 2.169 3.584 . 0 0 "[ . 1 . 2]" 1 638 1 38 MET QB 1 39 GLY H 1.800 . 4.200 2.939 1.791 4.041 0.009 3 0 "[ . 1 . 2]" 1 639 1 38 MET QG 1 39 GLY H 1.800 . 5.090 2.862 1.768 4.381 0.032 10 0 "[ . 1 . 2]" 1 640 1 38 MET H 1 38 MET QG 1.800 . 5.190 4.030 2.384 4.461 . 0 0 "[ . 1 . 2]" 1 641 1 38 MET H 1 39 GLY H 1.800 . 6.050 3.670 2.204 4.422 . 0 0 "[ . 1 . 2]" 1 642 1 39 GLY QA 1 41 GLU H 1.800 . 4.880 3.859 2.878 4.959 0.079 17 0 "[ . 1 . 2]" 1 643 1 40 THR HA 1 40 THR MG 1.800 . 3.640 2.400 2.221 3.148 . 0 0 "[ . 1 . 2]" 1 644 1 40 THR HB 1 41 GLU H 1.800 . 5.630 3.570 1.807 4.474 . 0 0 "[ . 1 . 2]" 1 645 1 40 THR MG 1 41 GLU H 1.800 . 4.620 3.694 2.524 4.386 . 0 0 "[ . 1 . 2]" 1 646 1 40 THR H 1 40 THR MG 1.800 . 4.100 3.243 1.788 4.037 0.012 6 0 "[ . 1 . 2]" 1 647 1 40 THR H 1 41 GLU H 1.800 . 3.800 2.925 1.966 4.102 0.302 4 0 "[ . 1 . 2]" 1 648 1 41 GLU HA 1 41 GLU QG 1.800 . 3.820 2.454 2.285 3.317 . 0 0 "[ . 1 . 2]" 1 649 1 41 GLU HA 1 42 ALA H 1.800 . 3.600 2.233 2.163 2.347 . 0 0 "[ . 1 . 2]" 1 650 1 41 GLU QB 1 42 ALA H 1.800 . 4.030 3.267 2.643 3.949 . 0 0 "[ . 1 . 2]" 1 651 1 41 GLU QB 1 55 ASN QB 1.800 . 4.820 4.008 2.199 5.150 0.330 6 0 "[ . 1 . 2]" 1 652 1 41 GLU QB 1 55 ASN H 1.800 . 5.080 3.928 2.379 5.047 . 0 0 "[ . 1 . 2]" 1 653 1 41 GLU QG 1 42 ALA H 1.800 . 4.590 3.676 2.153 4.751 0.161 14 0 "[ . 1 . 2]" 1 654 1 41 GLU H 1 41 GLU QG 1.800 . 4.610 3.299 2.551 4.197 . 0 0 "[ . 1 . 2]" 1 655 1 41 GLU H 1 55 ASN QB 1.800 . 5.000 4.626 3.472 5.119 0.119 18 0 "[ . 1 . 2]" 1 656 1 41 GLU H 1 55 ASN H 1.800 . 5.810 5.228 3.067 6.005 0.195 2 0 "[ . 1 . 2]" 1 657 1 42 ALA HA 1 54 VAL HA 1.800 . 5.100 3.696 2.329 5.180 0.080 14 0 "[ . 1 . 2]" 1 658 1 42 ALA HA 1 54 VAL MG1 1.800 . 5.650 3.778 2.382 5.761 0.111 14 0 "[ . 1 . 2]" 1 659 1 42 ALA HA 1 54 VAL MG2 1.800 . 5.650 4.131 2.243 5.672 0.022 3 0 "[ . 1 . 2]" 1 660 1 42 ALA HA 1 55 ASN H 1.800 . 4.880 3.566 1.862 5.007 0.127 6 0 "[ . 1 . 2]" 1 661 1 42 ALA MB 1 43 GLU H 1.800 . 4.440 2.847 2.621 3.354 . 0 0 "[ . 1 . 2]" 1 662 1 42 ALA MB 1 54 VAL HA 1.800 . 5.090 4.277 2.286 5.437 0.347 6 0 "[ . 1 . 2]" 1 663 1 42 ALA MB 1 54 VAL HB 1.800 . 5.600 4.512 3.026 5.734 0.134 9 0 "[ . 1 . 2]" 1 664 1 42 ALA MB 1 54 VAL QG 1.800 . 4.800 3.338 2.044 4.801 0.001 3 0 "[ . 1 . 2]" 1 665 1 42 ALA MB 1 55 ASN H 1.800 . 4.890 3.979 2.109 4.823 . 0 0 "[ . 1 . 2]" 1 666 1 42 ALA H 1 42 ALA MB 1.800 . 3.670 2.759 2.536 2.910 . 0 0 "[ . 1 . 2]" 1 667 1 43 GLU HA 1 43 GLU QG 1.800 . 3.870 2.768 2.287 3.494 . 0 0 "[ . 1 . 2]" 1 668 1 43 GLU QG 1 44 VAL H 1.800 . 5.740 3.404 1.815 4.584 . 0 0 "[ . 1 . 2]" 1 669 1 43 GLU QG 1 51 LEU QD 1.800 . 5.200 4.384 3.155 5.238 0.038 20 0 "[ . 1 . 2]" 1 670 1 44 VAL HA 1 44 VAL MG1 1.800 . 3.930 2.723 2.143 3.208 . 0 0 "[ . 1 . 2]" 1 671 1 44 VAL MG1 1 45 GLU H 1.800 . 5.000 3.380 2.209 4.432 . 0 0 "[ . 1 . 2]" 1 672 1 44 VAL MG1 1 46 PRO QD 1.800 . 4.600 4.114 2.104 4.707 0.107 10 0 "[ . 1 . 2]" 1 673 1 44 VAL MG2 1 45 GLU H 1.800 . 5.720 3.305 2.049 4.203 . 0 0 "[ . 1 . 2]" 1 674 1 44 VAL H 1 44 VAL MG1 1.800 . 4.420 2.947 1.879 3.922 . 0 0 "[ . 1 . 2]" 1 675 1 44 VAL H 1 44 VAL MG2 1.800 . 4.810 3.107 1.912 4.032 . 0 0 "[ . 1 . 2]" 1 676 1 45 GLU HA 1 45 GLU QG 1.800 . 3.870 2.576 2.212 3.449 . 0 0 "[ . 1 . 2]" 1 677 1 45 GLU HA 1 46 PRO QD 1.800 . 3.710 2.144 2.081 2.343 . 0 0 "[ . 1 . 2]" 1 678 1 45 GLU QB 1 50 GLY QA 1.800 . 4.700 3.681 2.199 4.841 0.141 9 0 "[ . 1 . 2]" 1 679 1 45 GLU QB 1 50 GLY H 1.800 . 5.530 4.305 2.859 5.641 0.111 5 0 "[ . 1 . 2]" 1 680 1 45 GLU QB 1 51 LEU H 1.800 . 5.200 4.137 2.126 5.293 0.093 4 0 "[ . 1 . 2]" 1 681 1 45 GLU QG 1 51 LEU H 1.800 . 4.730 4.028 2.071 4.758 0.028 17 0 "[ . 1 . 2]" 1 682 1 45 GLU H 1 45 GLU QG 1.800 . 4.730 3.157 2.036 4.225 . 0 0 "[ . 1 . 2]" 1 683 1 47 GLU QB 1 48 PRO QD 1.800 . 4.400 2.443 1.913 3.837 . 0 0 "[ . 1 . 2]" 1 684 1 47 GLU H 1 47 GLU QG 1.800 . 5.700 3.576 1.838 4.472 . 0 0 "[ . 1 . 2]" 1 685 1 48 PRO HA 1 49 GLY H 1.800 . 3.800 2.413 2.178 3.480 . 0 0 "[ . 1 . 2]" 1 686 1 48 PRO HA 1 50 GLY H 1.800 . 5.130 4.107 3.318 5.186 0.056 4 0 "[ . 1 . 2]" 1 687 1 48 PRO QB 1 49 GLY H 1.800 . 4.310 3.208 2.855 3.769 . 0 0 "[ . 1 . 2]" 1 688 1 49 GLY H 1 50 GLY H 1.800 . 3.820 2.855 1.772 3.966 0.146 17 0 "[ . 1 . 2]" 1 689 1 50 GLY QA 1 51 LEU QB 1.800 . 5.190 4.175 3.841 4.707 . 0 0 "[ . 1 . 2]" 1 690 1 50 GLY H 1 51 LEU H 1.800 . 5.100 3.652 1.742 4.670 0.058 19 0 "[ . 1 . 2]" 1 691 1 51 LEU HA 1 51 LEU QD 1.800 . 4.070 2.224 1.973 3.164 . 0 0 "[ . 1 . 2]" 1 692 1 51 LEU QB 1 51 LEU MD1 1.800 . 3.510 2.159 2.095 2.308 . 0 0 "[ . 1 . 2]" 1 693 1 51 LEU QB 1 51 LEU MD2 1.800 . 3.510 2.197 2.089 2.325 . 0 0 "[ . 1 . 2]" 1 694 1 51 LEU QB 1 52 TYR H 1.800 . 4.300 2.853 1.780 3.916 0.020 4 0 "[ . 1 . 2]" 1 695 1 51 LEU QD 1 52 TYR H 1.800 . 4.390 3.497 1.730 4.478 0.088 20 0 "[ . 1 . 2]" 1 696 1 51 LEU H 1 51 LEU QB 1.800 . 3.760 2.610 2.114 3.383 . 0 0 "[ . 1 . 2]" 1 697 1 51 LEU H 1 51 LEU MD1 1.800 . 4.990 3.703 1.999 4.866 . 0 0 "[ . 1 . 2]" 1 698 1 51 LEU H 1 51 LEU MD2 1.800 . 4.990 3.534 1.744 4.937 0.056 4 0 "[ . 1 . 2]" 1 699 1 51 LEU H 1 51 LEU HG 1.800 . 4.850 3.178 1.792 4.761 0.008 18 0 "[ . 1 . 2]" 1 700 1 53 LEU HA 1 53 LEU MD1 1.800 . 3.850 2.979 2.070 4.139 0.289 12 0 "[ . 1 . 2]" 1 701 1 53 LEU QB 1 53 LEU MD2 1.800 . 4.310 2.185 2.085 2.334 . 0 0 "[ . 1 . 2]" 1 702 1 53 LEU MD1 1 54 VAL H 1.800 . 5.040 3.674 1.870 5.118 0.078 10 0 "[ . 1 . 2]" 1 703 1 53 LEU MD1 1 61 PHE QB 1.800 . 4.750 4.240 2.054 4.838 0.088 8 0 "[ . 1 . 2]" 1 704 1 53 LEU MD1 1 61 PHE QD 1.800 . 5.210 4.172 2.694 5.246 0.036 12 0 "[ . 1 . 2]" 1 705 1 53 LEU MD2 1 54 VAL H 1.800 . 6.040 4.104 3.274 5.054 . 0 0 "[ . 1 . 2]" 1 706 1 53 LEU H 1 53 LEU MD1 1.800 . 5.500 3.918 1.976 4.826 . 0 0 "[ . 1 . 2]" 1 707 1 54 VAL HA 1 54 VAL MG1 1.800 . 4.460 2.433 2.228 3.200 . 0 0 "[ . 1 . 2]" 1 708 1 54 VAL HA 1 54 VAL MG2 1.800 . 4.460 2.872 2.330 3.208 . 0 0 "[ . 1 . 2]" 1 709 1 54 VAL HA 1 55 ASN H 1.800 . 3.870 2.272 2.145 2.495 . 0 0 "[ . 1 . 2]" 1 710 1 54 VAL QG 1 55 ASN H 1.800 . 4.310 2.911 1.858 3.543 . 0 0 "[ . 1 . 2]" 1 711 1 55 ASN QB 1 56 VAL H 1.800 . 4.300 2.761 1.789 4.047 0.011 16 0 "[ . 1 . 2]" 1 712 1 56 VAL HA 1 56 VAL MG1 1.800 . 4.320 2.607 2.270 3.210 . 0 0 "[ . 1 . 2]" 1 713 1 56 VAL HA 1 56 VAL MG2 1.800 . 4.320 2.619 2.280 3.220 . 0 0 "[ . 1 . 2]" 1 714 1 56 VAL QG 1 57 THR H 1.800 . 5.950 2.672 1.795 3.737 0.005 17 0 "[ . 1 . 2]" 1 715 1 57 THR HA 1 57 THR MG 1.800 . 4.210 2.602 2.230 3.210 . 0 0 "[ . 1 . 2]" 1 716 1 57 THR MG 1 58 GLY H 1.800 . 5.380 3.553 2.059 4.295 . 0 0 "[ . 1 . 2]" 1 717 1 57 THR H 1 58 GLY H 1.800 . 5.270 3.734 1.708 4.595 0.092 17 0 "[ . 1 . 2]" 1 718 1 58 GLY QA 1 59 ALA MB 1.800 . 3.950 3.654 3.516 3.859 . 0 0 "[ . 1 . 2]" 1 719 1 58 GLY H 1 59 ALA MB 1.800 . 5.180 4.804 4.132 5.370 0.190 6 0 "[ . 1 . 2]" 1 720 1 59 ALA MB 1 60 ARG H 1.800 . 4.300 2.487 1.728 3.715 0.072 17 0 "[ . 1 . 2]" 1 721 1 59 ALA H 1 60 ARG H 1.800 . 4.920 3.862 1.724 4.687 0.076 15 0 "[ . 1 . 2]" 1 722 1 60 ARG HA 1 60 ARG QD 1.800 . 4.880 3.920 2.243 4.501 . 0 0 "[ . 1 . 2]" 1 723 1 60 ARG QB 1 61 PHE H 1.800 . 4.300 2.918 1.797 3.824 0.003 17 0 "[ . 1 . 2]" 1 724 1 61 PHE H 1 61 PHE QD 1.800 . 4.930 3.170 1.864 4.404 . 0 0 "[ . 1 . 2]" 1 725 1 62 ALA HA 1 63 ARG H 1.800 . 3.840 2.767 2.198 3.549 . 0 0 "[ . 1 . 2]" 1 726 1 62 ALA MB 1 63 ARG H 1.800 . 4.300 2.767 1.731 3.736 0.069 6 0 "[ . 1 . 2]" 1 727 1 65 SER HA 1 66 PHE QD 1.800 . 5.840 4.194 3.061 5.935 0.095 17 0 "[ . 1 . 2]" 1 728 1 65 SER QB 1 66 PHE H 1.800 . 4.360 3.108 1.784 4.051 0.016 3 0 "[ . 1 . 2]" 1 729 1 66 PHE HA 1 66 PHE QD 1.800 . 4.710 2.988 2.297 3.716 . 0 0 "[ . 1 . 2]" 1 730 1 66 PHE HA 1 68 GLU H 1.800 . 4.940 4.425 3.594 5.075 0.135 10 0 "[ . 1 . 2]" 1 731 1 66 PHE QB 1 68 GLU H 1.800 . 5.120 3.994 2.871 5.262 0.142 8 0 "[ . 1 . 2]" 1 732 1 66 PHE QB 1 69 VAL MG2 1.800 . 4.070 2.813 2.004 4.179 0.109 8 0 "[ . 1 . 2]" 1 733 1 66 PHE QD 1 69 VAL MG1 1.800 . 5.430 4.810 3.230 5.417 . 0 0 "[ . 1 . 2]" 1 734 1 66 PHE QD 1 69 VAL MG2 1.800 . 3.930 2.731 2.085 3.387 . 0 0 "[ . 1 . 2]" 1 735 1 66 PHE QD 1 75 LEU QD 1.800 . 5.780 4.807 3.142 5.768 . 0 0 "[ . 1 . 2]" 1 736 1 66 PHE H 1 66 PHE QD 1.800 . 4.400 2.732 1.897 4.527 0.127 17 0 "[ . 1 . 2]" 1 737 1 67 ARG HA 1 67 ARG QG 1.800 . 3.760 2.486 2.271 3.317 . 0 0 "[ . 1 . 2]" 1 738 1 67 ARG QB 1 68 GLU H 1.800 . 3.930 2.261 1.773 3.475 0.027 19 0 "[ . 1 . 2]" 1 739 1 67 ARG QD 1 76 ALA MB 1.800 . 4.640 3.380 2.289 4.645 0.005 20 0 "[ . 1 . 2]" 1 740 1 67 ARG QD 1 93 LEU MD1 1.800 . 4.040 2.488 2.073 2.903 . 0 0 "[ . 1 . 2]" 1 741 1 67 ARG QD 1 93 LEU MD2 1.800 . 4.270 3.401 2.048 4.237 . 0 0 "[ . 1 . 2]" 1 742 1 67 ARG QD 1 93 LEU HG 1.800 . 5.400 4.788 3.980 5.435 0.035 5 0 "[ . 1 . 2]" 1 743 1 67 ARG QG 1 68 GLU H 1.800 . 4.950 3.593 2.083 4.138 . 0 0 "[ . 1 . 2]" 1 744 1 67 ARG QG 1 77 TYR HA 1.800 . 4.800 3.798 2.294 4.907 0.107 8 0 "[ . 1 . 2]" 1 745 1 67 ARG QG 1 78 SER H 1.800 . 5.630 4.238 2.865 5.679 0.049 15 0 "[ . 1 . 2]" 1 746 1 67 ARG QG 1 93 LEU MD1 1.800 . 4.680 3.740 2.112 4.717 0.037 14 0 "[ . 1 . 2]" 1 747 1 67 ARG H 1 67 ARG QG 1.800 . 4.500 3.075 1.894 4.071 . 0 0 "[ . 1 . 2]" 1 748 1 67 ARG H 1 68 GLU H 1.800 . 3.840 2.590 1.788 3.136 0.012 17 0 "[ . 1 . 2]" 1 749 1 67 ARG H 1 77 TYR HA 1.800 . 4.620 2.865 1.767 4.479 0.033 11 0 "[ . 1 . 2]" 1 750 1 68 GLU HA 1 69 VAL H 1.800 . 3.210 2.209 2.160 2.268 . 0 0 "[ . 1 . 2]" 1 751 1 68 GLU HB3 1 69 VAL H 1.800 . 5.010 3.721 2.880 4.165 . 0 0 "[ . 1 . 2]" 1 752 1 68 GLU HB3 1 70 VAL MG2 1.800 . 5.400 3.781 3.081 4.472 . 0 0 "[ . 1 . 2]" 1 753 1 68 GLU HB3 1 76 ALA MB 1.800 . 3.670 2.793 2.146 3.713 0.043 12 0 "[ . 1 . 2]" 1 754 1 68 GLU HB3 1 76 ALA H 1.800 . 5.000 3.938 3.200 5.027 0.027 15 0 "[ . 1 . 2]" 1 755 1 68 GLU HB2 1 69 VAL H 1.800 . 5.010 4.230 4.021 4.469 . 0 0 "[ . 1 . 2]" 1 756 1 68 GLU HB2 1 70 VAL MG2 1.800 . 5.400 4.680 4.080 5.129 . 0 0 "[ . 1 . 2]" 1 757 1 68 GLU HB2 1 76 ALA MB 1.800 . 3.670 3.012 2.167 3.801 0.131 19 0 "[ . 1 . 2]" 1 758 1 68 GLU HB2 1 76 ALA H 1.800 . 5.200 4.710 3.151 5.319 0.119 17 0 "[ . 1 . 2]" 1 759 1 68 GLU QG 1 69 VAL H 1.800 . 4.840 3.104 2.376 4.408 . 0 0 "[ . 1 . 2]" 1 760 1 68 GLU QG 1 76 ALA MB 1.800 . 4.380 3.890 3.492 4.360 . 0 0 "[ . 1 . 2]" 1 761 1 68 GLU H 1 68 GLU QG 1.800 . 5.240 3.877 3.105 4.316 . 0 0 "[ . 1 . 2]" 1 762 1 68 GLU H 1 76 ALA MB 1.800 . 4.150 2.898 1.957 3.664 . 0 0 "[ . 1 . 2]" 1 763 1 68 GLU H 1 76 ALA H 1.800 . 4.230 3.631 2.796 4.061 . 0 0 "[ . 1 . 2]" 1 764 1 68 GLU H 1 77 TYR HA 1.800 . 4.830 3.983 3.006 4.442 . 0 0 "[ . 1 . 2]" 1 765 1 69 VAL HA 1 69 VAL MG1 1.800 . 3.690 2.383 2.303 2.431 . 0 0 "[ . 1 . 2]" 1 766 1 69 VAL HA 1 69 VAL MG2 1.800 . 4.030 2.307 2.248 2.419 . 0 0 "[ . 1 . 2]" 1 767 1 69 VAL HA 1 70 VAL H 1.800 . 3.270 2.164 2.122 2.192 . 0 0 "[ . 1 . 2]" 1 768 1 69 VAL HA 1 75 LEU HA 1.800 . 4.200 2.819 2.319 3.096 . 0 0 "[ . 1 . 2]" 1 769 1 69 VAL HA 1 75 LEU QD 1.800 . 4.000 2.522 2.089 3.626 . 0 0 "[ . 1 . 2]" 1 770 1 69 VAL HA 1 76 ALA H 1.800 . 4.910 3.341 2.986 3.825 . 0 0 "[ . 1 . 2]" 1 771 1 69 VAL HB 1 70 VAL H 1.800 . 5.150 4.268 4.173 4.437 . 0 0 "[ . 1 . 2]" 1 772 1 69 VAL HB 1 75 LEU QD 1.800 . 4.710 4.367 4.038 5.024 0.314 19 0 "[ . 1 . 2]" 1 773 1 69 VAL MG1 1 70 VAL HA 1.800 . 4.580 3.507 3.375 4.011 . 0 0 "[ . 1 . 2]" 1 774 1 69 VAL MG1 1 70 VAL H 1.800 . 4.310 2.662 2.499 3.119 . 0 0 "[ . 1 . 2]" 1 775 1 69 VAL MG1 1 75 LEU HA 1.800 . 5.510 4.144 3.731 4.479 . 0 0 "[ . 1 . 2]" 1 776 1 69 VAL MG1 1 75 LEU QD 1.800 . 4.710 2.449 2.009 3.078 . 0 0 "[ . 1 . 2]" 1 777 1 69 VAL MG2 1 70 VAL H 1.800 . 4.640 3.948 3.819 4.279 . 0 0 "[ . 1 . 2]" 1 778 1 69 VAL MG2 1 75 LEU HA 1.800 . 5.100 4.092 3.736 4.517 . 0 0 "[ . 1 . 2]" 1 779 1 69 VAL MG2 1 75 LEU HB3 1.800 . 6.050 5.108 3.144 6.058 0.008 18 0 "[ . 1 . 2]" 1 780 1 69 VAL MG2 1 75 LEU HB2 1.800 . 6.050 5.167 2.354 6.099 0.049 5 0 "[ . 1 . 2]" 1 781 1 69 VAL MG2 1 75 LEU QD 1.800 . 3.350 2.558 2.032 3.381 0.031 5 0 "[ . 1 . 2]" 1 782 1 69 VAL MG2 1 76 ALA H 1.800 . 4.850 3.757 3.358 4.155 . 0 0 "[ . 1 . 2]" 1 783 1 69 VAL H 1 69 VAL HB 1.800 . 3.810 2.649 2.547 2.911 . 0 0 "[ . 1 . 2]" 1 784 1 69 VAL H 1 69 VAL MG1 1.800 . 5.140 3.847 3.797 3.985 . 0 0 "[ . 1 . 2]" 1 785 1 69 VAL H 1 69 VAL MG2 1.800 . 4.140 2.948 2.761 3.185 . 0 0 "[ . 1 . 2]" 1 786 1 70 VAL HA 1 70 VAL MG1 1.800 . 3.330 2.245 2.198 2.295 . 0 0 "[ . 1 . 2]" 1 787 1 70 VAL HA 1 70 VAL MG2 1.800 . 3.520 2.531 2.424 2.630 . 0 0 "[ . 1 . 2]" 1 788 1 70 VAL HA 1 71 PRO QD 1.800 . 3.500 2.066 2.008 2.111 . 0 0 "[ . 1 . 2]" 1 789 1 70 VAL HA 1 71 PRO QG 1.800 . 4.750 3.993 3.929 4.032 . 0 0 "[ . 1 . 2]" 1 790 1 70 VAL HB 1 73 HIS H 1.800 . 4.880 4.172 3.576 4.523 . 0 0 "[ . 1 . 2]" 1 791 1 70 VAL HB 1 74 ARG QG 1.800 . 4.750 3.862 2.127 4.763 0.013 19 0 "[ . 1 . 2]" 1 792 1 70 VAL HB 1 74 ARG H 1.800 . 4.400 1.855 1.759 2.137 0.041 20 0 "[ . 1 . 2]" 1 793 1 70 VAL MG1 1 71 PRO QD 1.800 . 3.810 2.718 2.065 3.134 . 0 0 "[ . 1 . 2]" 1 794 1 70 VAL MG1 1 71 PRO QG 1.800 . 4.750 4.284 3.386 4.795 0.045 1 0 "[ . 1 . 2]" 1 795 1 70 VAL MG1 1 73 HIS QB 1.800 . 4.890 2.112 2.001 2.279 . 0 0 "[ . 1 . 2]" 1 796 1 70 VAL MG1 1 73 HIS HD1 1.800 . 5.020 2.427 1.848 2.832 . 0 0 "[ . 1 . 2]" 1 797 1 70 VAL MG1 1 73 HIS H 1.800 . 4.710 4.372 4.221 4.643 . 0 0 "[ . 1 . 2]" 1 798 1 70 VAL MG1 1 74 ARG H 1.800 . 4.180 3.084 2.884 3.358 . 0 0 "[ . 1 . 2]" 1 799 1 70 VAL MG2 1 71 PRO QD 1.800 . 4.380 3.864 3.664 3.992 . 0 0 "[ . 1 . 2]" 1 800 1 70 VAL MG2 1 73 HIS QB 1.800 . 5.010 3.723 3.512 3.915 . 0 0 "[ . 1 . 2]" 1 801 1 70 VAL MG2 1 74 ARG HA 1.800 . 5.380 4.813 4.472 5.382 0.002 18 0 "[ . 1 . 2]" 1 802 1 70 VAL MG2 1 74 ARG QB 1.800 . 3.710 2.936 2.191 3.877 0.167 4 0 "[ . 1 . 2]" 1 803 1 70 VAL MG2 1 74 ARG QD 1.800 . 4.800 4.000 2.679 4.995 0.195 19 0 "[ . 1 . 2]" 1 804 1 70 VAL MG2 1 74 ARG QG 1.800 . 4.300 3.645 2.021 4.374 0.074 10 0 "[ . 1 . 2]" 1 805 1 70 VAL MG2 1 74 ARG H 1.800 . 3.980 3.482 3.232 3.744 . 0 0 "[ . 1 . 2]" 1 806 1 70 VAL MG2 1 75 LEU HA 1.800 . 5.680 3.647 3.288 4.249 . 0 0 "[ . 1 . 2]" 1 807 1 70 VAL H 1 70 VAL HB 1.800 . 3.830 2.989 2.803 3.097 . 0 0 "[ . 1 . 2]" 1 808 1 70 VAL H 1 70 VAL MG1 1.800 . 4.200 3.986 3.893 4.026 . 0 0 "[ . 1 . 2]" 1 809 1 70 VAL H 1 70 VAL MG2 1.800 . 3.370 2.563 2.146 2.696 . 0 0 "[ . 1 . 2]" 1 810 1 70 VAL H 1 71 PRO QD 1.800 . 4.870 3.769 3.339 4.313 . 0 0 "[ . 1 . 2]" 1 811 1 70 VAL H 1 74 ARG H 1.800 . 4.530 3.950 3.480 4.124 . 0 0 "[ . 1 . 2]" 1 812 1 70 VAL H 1 75 LEU HA 1.800 . 4.420 2.896 2.609 3.511 . 0 0 "[ . 1 . 2]" 1 813 1 70 VAL H 1 75 LEU QD 1.800 . 5.010 2.661 1.754 3.913 0.046 1 0 "[ . 1 . 2]" 1 814 1 71 PRO HB3 1 72 VAL MG1 1.800 . 4.540 3.735 3.166 4.414 . 0 0 "[ . 1 . 2]" 1 815 1 71 PRO HB2 1 72 VAL MG1 1.800 . 4.540 3.462 2.510 4.586 0.046 20 0 "[ . 1 . 2]" 1 816 1 72 VAL HA 1 72 VAL MG1 1.800 . 3.650 2.512 2.234 3.230 . 0 0 "[ . 1 . 2]" 1 817 1 72 VAL HA 1 72 VAL MG2 1.800 . 4.470 2.989 2.230 3.215 . 0 0 "[ . 1 . 2]" 1 818 1 72 VAL HB 1 98 LEU MD1 1.800 . 4.690 4.372 4.020 4.729 0.039 3 0 "[ . 1 . 2]" 1 819 1 72 VAL MG1 1 73 HIS H 1.800 . 5.530 4.234 3.729 4.366 . 0 0 "[ . 1 . 2]" 1 820 1 72 VAL MG1 1 98 LEU MD1 1.800 . 4.610 3.996 3.286 4.630 0.020 12 0 "[ . 1 . 2]" 1 821 1 72 VAL MG2 1 73 HIS H 1.800 . 4.420 3.848 3.651 4.110 . 0 0 "[ . 1 . 2]" 1 822 1 72 VAL H 1 72 VAL MG1 1.800 . 4.800 2.528 2.210 3.120 . 0 0 "[ . 1 . 2]" 1 823 1 72 VAL H 1 72 VAL MG2 1.800 . 4.300 3.219 2.764 4.028 . 0 0 "[ . 1 . 2]" 1 824 1 72 VAL H 1 73 HIS H 1.800 . 3.810 3.163 3.014 3.486 . 0 0 "[ . 1 . 2]" 1 825 1 73 HIS HA 1 98 LEU QB 1.800 . 3.690 3.170 2.598 3.731 0.041 11 0 "[ . 1 . 2]" 1 826 1 73 HIS HA 1 98 LEU MD1 1.800 . 4.800 3.707 2.716 4.307 . 0 0 "[ . 1 . 2]" 1 827 1 73 HIS HA 1 98 LEU MD2 1.800 . 6.050 5.669 5.101 6.086 0.036 20 0 "[ . 1 . 2]" 1 828 1 73 HIS HA 1 98 LEU HG 1.800 . 5.100 4.757 4.206 5.165 0.065 20 0 "[ . 1 . 2]" 1 829 1 73 HIS HA 1 98 LEU H 1.800 . 5.120 4.249 3.742 4.816 . 0 0 "[ . 1 . 2]" 1 830 1 73 HIS QB 1 74 ARG H 1.800 . 4.250 1.881 1.776 2.346 0.024 18 0 "[ . 1 . 2]" 1 831 1 73 HIS QB 1 98 LEU H 1.800 . 6.050 5.374 4.600 6.042 . 0 0 "[ . 1 . 2]" 1 832 1 73 HIS HD1 1 74 ARG H 1.800 . 5.150 3.444 2.235 4.390 . 0 0 "[ . 1 . 2]" 1 833 1 73 HIS H 1 73 HIS QB 1.800 . 3.750 2.800 2.646 2.903 . 0 0 "[ . 1 . 2]" 1 834 1 73 HIS H 1 74 ARG H 1.800 . 3.270 2.764 2.138 3.325 0.055 19 0 "[ . 1 . 2]" 1 835 1 74 ARG HA 1 74 ARG QD 1.800 . 5.740 4.054 3.888 4.453 . 0 0 "[ . 1 . 2]" 1 836 1 74 ARG HA 1 75 LEU H 1.800 . 3.160 2.279 2.179 2.380 . 0 0 "[ . 1 . 2]" 1 837 1 74 ARG HA 1 96 ILE MG 1.800 . 5.050 4.287 3.685 4.674 . 0 0 "[ . 1 . 2]" 1 838 1 74 ARG HA 1 98 LEU H 1.800 . 5.130 3.147 2.500 3.791 . 0 0 "[ . 1 . 2]" 1 839 1 74 ARG QB 1 74 ARG QD 1.800 . 3.480 2.226 2.114 2.332 . 0 0 "[ . 1 . 2]" 1 840 1 74 ARG QB 1 75 LEU H 1.800 . 4.320 3.033 2.462 3.721 . 0 0 "[ . 1 . 2]" 1 841 1 74 ARG HB3 1 97 ASP HA 1.800 . 5.290 4.085 2.334 5.217 . 0 0 "[ . 1 . 2]" 1 842 1 74 ARG HB2 1 97 ASP HA 1.800 . 5.290 3.996 2.600 5.110 . 0 0 "[ . 1 . 2]" 1 843 1 74 ARG QD 1 75 LEU H 1.800 . 4.920 4.575 4.095 5.043 0.123 7 0 "[ . 1 . 2]" 1 844 1 74 ARG QD 1 97 ASP HA 1.800 . 4.410 4.251 3.795 4.510 0.100 17 0 "[ . 1 . 2]" 1 845 1 74 ARG QD 1 97 ASP QB 1.800 . 5.700 4.236 3.427 4.811 . 0 0 "[ . 1 . 2]" 1 846 1 74 ARG QG 1 75 LEU H 1.800 . 4.100 3.197 2.126 3.863 . 0 0 "[ . 1 . 2]" 1 847 1 74 ARG H 1 74 ARG QG 1.800 . 4.540 3.399 2.296 4.162 . 0 0 "[ . 1 . 2]" 1 848 1 74 ARG H 1 75 LEU H 1.800 . 5.180 4.383 4.220 4.460 . 0 0 "[ . 1 . 2]" 1 849 1 75 LEU HA 1 75 LEU QD 1.800 . 3.750 2.278 1.969 3.345 . 0 0 "[ . 1 . 2]" 1 850 1 75 LEU HA 1 76 ALA H 1.800 . 3.220 2.222 2.175 2.301 . 0 0 "[ . 1 . 2]" 1 851 1 75 LEU QB 1 76 ALA H 1.800 . 4.510 3.403 2.767 3.819 . 0 0 "[ . 1 . 2]" 1 852 1 75 LEU QB 1 96 ILE H 1.800 . 5.140 3.727 2.930 5.142 0.002 19 0 "[ . 1 . 2]" 1 853 1 75 LEU QD 1 76 ALA H 1.800 . 4.370 2.689 1.839 4.011 . 0 0 "[ . 1 . 2]" 1 854 1 75 LEU QD 1 77 TYR QD 1.800 . 5.300 3.712 2.085 5.396 0.096 12 0 "[ . 1 . 2]" 1 855 1 75 LEU H 1 75 LEU QB 1.800 . 3.670 2.687 2.527 3.205 . 0 0 "[ . 1 . 2]" 1 856 1 75 LEU H 1 75 LEU QD 1.800 . 4.710 3.730 2.305 4.045 . 0 0 "[ . 1 . 2]" 1 857 1 75 LEU H 1 76 ALA H 1.800 . 4.690 4.317 4.129 4.447 . 0 0 "[ . 1 . 2]" 1 858 1 75 LEU H 1 96 ILE HB 1.800 . 4.820 3.393 2.856 3.861 . 0 0 "[ . 1 . 2]" 1 859 1 75 LEU H 1 96 ILE MD 1.800 . 5.910 4.973 4.284 5.458 . 0 0 "[ . 1 . 2]" 1 860 1 75 LEU H 1 96 ILE MG 1.800 . 4.940 3.933 3.478 4.373 . 0 0 "[ . 1 . 2]" 1 861 1 75 LEU H 1 96 ILE H 1.800 . 3.940 3.270 2.752 3.895 . 0 0 "[ . 1 . 2]" 1 862 1 75 LEU H 1 97 ASP HA 1.800 . 5.040 3.608 3.075 4.099 . 0 0 "[ . 1 . 2]" 1 863 1 76 ALA HA 1 77 TYR H 1.800 . 3.840 2.181 2.138 2.238 . 0 0 "[ . 1 . 2]" 1 864 1 76 ALA HA 1 95 GLU HA 1.800 . 4.070 2.409 2.297 2.947 . 0 0 "[ . 1 . 2]" 1 865 1 76 ALA HA 1 95 GLU QB 1.800 . 5.640 4.096 3.554 4.989 . 0 0 "[ . 1 . 2]" 1 866 1 76 ALA HA 1 95 GLU QG 1.800 . 5.850 3.108 2.288 4.937 . 0 0 "[ . 1 . 2]" 1 867 1 76 ALA HA 1 96 ILE H 1.800 . 4.290 3.316 2.434 3.910 . 0 0 "[ . 1 . 2]" 1 868 1 76 ALA MB 1 77 TYR H 1.800 . 4.420 3.121 2.772 3.350 . 0 0 "[ . 1 . 2]" 1 869 1 76 ALA MB 1 93 LEU MD1 1.800 . 3.970 3.403 2.670 3.965 . 0 0 "[ . 1 . 2]" 1 870 1 76 ALA MB 1 93 LEU MD2 1.800 . 4.890 4.037 3.230 4.897 0.007 5 0 "[ . 1 . 2]" 1 871 1 76 ALA MB 1 95 GLU HA 1.800 . 4.030 3.129 2.246 3.836 . 0 0 "[ . 1 . 2]" 1 872 1 76 ALA MB 1 95 GLU QB 1.800 . 3.810 3.595 3.090 3.847 0.037 7 0 "[ . 1 . 2]" 1 873 1 76 ALA MB 1 95 GLU QG 1.800 . 3.940 2.361 2.046 3.540 . 0 0 "[ . 1 . 2]" 1 874 1 77 TYR HA 1 77 TYR QD 1.800 . 5.980 2.972 2.287 3.715 . 0 0 "[ . 1 . 2]" 1 875 1 77 TYR QD 1 78 SER H 1.800 . 5.530 3.201 2.490 4.066 . 0 0 "[ . 1 . 2]" 1 876 1 77 TYR H 1 77 TYR QD 1.800 . 5.280 3.624 2.334 4.508 . 0 0 "[ . 1 . 2]" 1 877 1 77 TYR H 1 93 LEU MD1 1.800 . 4.920 3.553 3.026 4.287 . 0 0 "[ . 1 . 2]" 1 878 1 77 TYR H 1 94 VAL HB 1.800 . 5.150 3.446 2.325 4.357 . 0 0 "[ . 1 . 2]" 1 879 1 77 TYR H 1 94 VAL MG1 1.800 . 6.050 3.873 2.596 4.890 . 0 0 "[ . 1 . 2]" 1 880 1 77 TYR H 1 94 VAL H 1.800 . 5.070 3.758 3.252 4.156 . 0 0 "[ . 1 . 2]" 1 881 1 77 TYR H 1 95 GLU HA 1.800 . 5.420 3.554 3.144 4.383 . 0 0 "[ . 1 . 2]" 1 882 1 77 TYR H 1 95 GLU QG 1.800 . 6.050 3.924 3.218 5.457 . 0 0 "[ . 1 . 2]" 1 883 1 78 SER HA 1 93 LEU MD1 1.800 . 4.600 2.919 2.063 4.824 0.224 17 0 "[ . 1 . 2]" 1 884 1 78 SER HA 1 94 VAL H 1.800 . 5.050 3.073 2.393 5.088 0.038 17 0 "[ . 1 . 2]" 1 885 1 78 SER QB 1 93 LEU HA 1.800 . 4.220 3.696 2.519 4.310 0.090 20 0 "[ . 1 . 2]" 1 886 1 79 PHE QB 1 94 VAL MG2 1.800 . 5.280 3.618 2.062 5.455 0.175 17 0 "[ . 1 . 2]" 1 887 1 79 PHE H 1 93 LEU HA 1.800 . 4.800 4.087 3.025 4.921 0.121 13 0 "[ . 1 . 2]" 1 888 1 80 GLY QA 1 87 VAL MG1 1.800 . 4.110 3.024 2.002 4.246 0.136 13 0 "[ . 1 . 2]" 1 889 1 81 TRP HA 1 82 ASP H 1.800 . 3.840 2.528 2.119 3.517 . 0 0 "[ . 1 . 2]" 1 890 1 81 TRP QB 1 82 ASP H 1.800 . 4.300 3.126 1.757 3.950 0.043 19 0 "[ . 1 . 2]" 1 891 1 81 TRP H 1 81 TRP HD1 1.800 . 5.700 4.199 2.088 5.320 . 0 0 "[ . 1 . 2]" 1 892 1 81 TRP H 1 82 ASP H 1.800 . 5.510 4.088 2.375 4.648 . 0 0 "[ . 1 . 2]" 1 893 1 81 TRP H 1 87 VAL HB 1.800 . 5.800 4.780 3.399 6.034 0.234 17 0 "[ . 1 . 2]" 1 894 1 81 TRP H 1 87 VAL MG1 1.800 . 4.800 3.601 2.122 4.835 0.035 8 0 "[ . 1 . 2]" 1 895 1 82 ASP H 1 82 ASP QB 1.800 . 3.830 2.739 2.255 3.282 . 0 0 "[ . 1 . 2]" 1 896 1 83 GLY H 1 84 SER H 1.800 . 5.140 3.470 1.840 4.678 . 0 0 "[ . 1 . 2]" 1 897 1 84 SER HA 1 85 GLU H 1.800 . 3.920 2.706 2.143 3.588 . 0 0 "[ . 1 . 2]" 1 898 1 84 SER QB 1 86 VAL H 1.800 . 5.850 4.537 2.684 5.936 0.086 14 0 "[ . 1 . 2]" 1 899 1 84 SER H 1 84 SER HG 1.800 . 5.060 3.624 1.905 4.718 . 0 0 "[ . 1 . 2]" 1 900 1 85 GLU HA 1 85 GLU QG 1.800 . 3.750 2.463 2.309 2.875 . 0 0 "[ . 1 . 2]" 1 901 1 85 GLU HB3 1 86 VAL H 1.800 . 4.770 3.323 1.800 4.452 0.000 14 0 "[ . 1 . 2]" 1 902 1 85 GLU HB2 1 86 VAL H 1.800 . 4.770 3.350 1.819 4.521 . 0 0 "[ . 1 . 2]" 1 903 1 85 GLU QG 1 86 VAL H 1.800 . 4.880 3.882 2.401 4.615 . 0 0 "[ . 1 . 2]" 1 904 1 85 GLU H 1 85 GLU QB 1.800 . 3.820 2.682 2.267 3.298 . 0 0 "[ . 1 . 2]" 1 905 1 85 GLU H 1 85 GLU QG 1.800 . 4.150 2.946 2.150 4.164 0.014 5 0 "[ . 1 . 2]" 1 906 1 85 GLU H 1 86 VAL H 1.800 . 4.300 3.517 1.898 4.628 0.328 14 0 "[ . 1 . 2]" 1 907 1 86 VAL HA 1 86 VAL MG1 1.800 . 3.670 2.623 2.209 3.217 . 0 0 "[ . 1 . 2]" 1 908 1 86 VAL HA 1 86 VAL MG2 1.800 . 3.670 2.643 2.239 3.204 . 0 0 "[ . 1 . 2]" 1 909 1 86 VAL HB 1 87 VAL H 1.800 . 4.800 3.925 1.818 4.465 . 0 0 "[ . 1 . 2]" 1 910 1 86 VAL QG 1 87 VAL H 1.800 . 4.410 2.783 1.779 3.723 0.021 17 0 "[ . 1 . 2]" 1 911 1 86 VAL MG1 1 87 VAL H 1.800 . 5.060 3.476 1.936 4.255 . 0 0 "[ . 1 . 2]" 1 912 1 86 VAL MG2 1 87 VAL H 1.800 . 5.060 3.414 1.789 4.327 0.011 17 0 "[ . 1 . 2]" 1 913 1 86 VAL H 1 86 VAL QG 1.800 . 3.900 2.106 1.749 2.806 0.051 6 0 "[ . 1 . 2]" 1 914 1 86 VAL H 1 86 VAL MG1 1.800 . 4.640 2.731 1.998 3.977 . 0 0 "[ . 1 . 2]" 1 915 1 86 VAL H 1 86 VAL MG2 1.800 . 4.640 2.768 1.801 4.025 . 0 0 "[ . 1 . 2]" 1 916 1 86 VAL H 1 87 VAL H 1.800 . 4.600 3.715 1.727 4.639 0.073 1 0 "[ . 1 . 2]" 1 917 1 87 VAL HA 1 87 VAL MG1 1.800 . 3.830 2.294 2.216 2.446 . 0 0 "[ . 1 . 2]" 1 918 1 87 VAL HA 1 87 VAL MG2 1.800 . 3.620 2.596 2.228 3.222 . 0 0 "[ . 1 . 2]" 1 919 1 87 VAL HA 1 88 PRO QD 1.800 . 3.390 2.166 2.085 2.328 . 0 0 "[ . 1 . 2]" 1 920 1 87 VAL MG1 1 88 PRO QD 1.800 . 4.910 3.559 3.190 3.865 . 0 0 "[ . 1 . 2]" 1 921 1 87 VAL MG1 1 91 SER HG 1.800 . 4.950 3.367 1.807 5.000 0.050 11 0 "[ . 1 . 2]" 1 922 1 87 VAL MG1 1 114 LEU MD2 1.800 . 5.400 4.985 3.782 5.621 0.221 17 0 "[ . 1 . 2]" 1 923 1 87 VAL MG1 1 115 PRO QD 1.800 . 4.810 4.020 3.080 4.768 . 0 0 "[ . 1 . 2]" 1 924 1 87 VAL MG2 1 88 PRO QD 1.800 . 4.740 3.847 3.663 4.164 . 0 0 "[ . 1 . 2]" 1 925 1 87 VAL MG2 1 114 LEU MD2 1.800 . 5.400 4.645 3.758 5.585 0.185 13 0 "[ . 1 . 2]" 1 926 1 87 VAL MG2 1 115 PRO HD3 1.800 . 4.470 3.797 2.133 4.483 0.013 7 0 "[ . 1 . 2]" 1 927 1 87 VAL MG2 1 115 PRO HD2 1.800 . 4.470 3.868 3.024 4.549 0.079 13 0 "[ . 1 . 2]" 1 928 1 87 VAL MG2 1 115 PRO QG 1.800 . 3.830 3.077 2.095 3.920 0.090 11 0 "[ . 1 . 2]" 1 929 1 87 VAL H 1 87 VAL MG1 1.800 . 4.880 3.623 2.261 4.032 . 0 0 "[ . 1 . 2]" 1 930 1 87 VAL H 1 87 VAL MG2 1.800 . 4.020 2.660 1.835 3.298 . 0 0 "[ . 1 . 2]" 1 931 1 88 PRO HA 1 89 PRO QD 1.800 . 3.600 2.545 2.108 3.565 . 0 0 "[ . 1 . 2]" 1 932 1 88 PRO QB 1 89 PRO QD 1.800 . 3.560 2.091 1.919 2.269 . 0 0 "[ . 1 . 2]" 1 933 1 88 PRO HB3 1 89 PRO HD3 1.800 . 4.620 3.174 2.331 3.980 . 0 0 "[ . 1 . 2]" 1 934 1 88 PRO HB2 1 89 PRO HD3 1.800 . 4.620 3.195 2.113 4.458 . 0 0 "[ . 1 . 2]" 1 935 1 88 PRO HB2 1 89 PRO HD2 1.800 . 4.620 2.787 2.308 3.635 . 0 0 "[ . 1 . 2]" 1 936 1 88 PRO QD 1 91 SER QB 1.800 . 4.640 3.578 2.130 4.932 0.292 5 0 "[ . 1 . 2]" 1 937 1 89 PRO HA 1 90 GLY H 1.800 . 3.830 2.566 2.153 3.539 . 0 0 "[ . 1 . 2]" 1 938 1 90 GLY H 1 91 SER H 1.800 . 4.700 3.074 2.228 4.631 . 0 0 "[ . 1 . 2]" 1 939 1 91 SER HG 1 92 SER H 1.800 . 6.050 3.823 1.833 5.616 . 0 0 "[ . 1 . 2]" 1 940 1 91 SER H 1 91 SER QB 1.800 . 3.670 2.634 2.246 3.495 . 0 0 "[ . 1 . 2]" 1 941 1 91 SER H 1 91 SER HG 1.800 . 4.100 3.541 2.681 4.214 0.114 20 0 "[ . 1 . 2]" 1 942 1 91 SER H 1 92 SER H 1.800 . 4.600 3.354 2.205 4.681 0.081 16 0 "[ . 1 . 2]" 1 943 1 92 SER HA 1 93 LEU H 1.800 . 3.870 2.578 2.192 3.481 . 0 0 "[ . 1 . 2]" 1 944 1 92 SER HA 1 113 GLY QA 1.800 . 4.350 2.931 2.253 4.500 0.150 9 0 "[ . 1 . 2]" 1 945 1 92 SER HA 1 114 LEU MD2 1.800 . 5.510 4.812 3.545 5.574 0.064 4 0 "[ . 1 . 2]" 1 946 1 92 SER QB 1 93 LEU H 1.800 . 3.740 2.588 1.725 3.779 0.075 2 0 "[ . 1 . 2]" 1 947 1 92 SER QB 1 111 HIS HE1 1.800 . 5.330 3.191 2.186 4.677 . 0 0 "[ . 1 . 2]" 1 948 1 92 SER QB 1 114 LEU MD2 1.800 . 4.330 3.360 2.227 4.039 . 0 0 "[ . 1 . 2]" 1 949 1 92 SER HB3 1 111 HIS HD1 1.800 . 5.400 4.343 1.795 5.404 0.005 13 0 "[ . 1 . 2]" 1 950 1 92 SER HB2 1 111 HIS HD1 1.800 . 5.400 4.297 2.602 5.244 . 0 0 "[ . 1 . 2]" 1 951 1 93 LEU HA 1 93 LEU MD1 1.800 . 3.780 2.104 2.062 2.319 . 0 0 "[ . 1 . 2]" 1 952 1 93 LEU HA 1 93 LEU MD2 1.800 . 4.380 3.716 2.133 3.831 . 0 0 "[ . 1 . 2]" 1 953 1 93 LEU HA 1 94 VAL H 1.800 . 3.660 2.167 2.131 2.202 . 0 0 "[ . 1 . 2]" 1 954 1 93 LEU HA 1 112 SER H 1.800 . 6.050 4.999 4.553 5.243 . 0 0 "[ . 1 . 2]" 1 955 1 93 LEU QB 1 112 SER QB 1.800 . 4.620 3.187 2.299 4.469 . 0 0 "[ . 1 . 2]" 1 956 1 93 LEU QB 1 112 SER H 1.800 . 5.280 3.456 2.624 4.384 . 0 0 "[ . 1 . 2]" 1 957 1 93 LEU HB3 1 93 LEU MD1 1.800 . 4.230 3.170 2.348 3.218 . 0 0 "[ . 1 . 2]" 1 958 1 93 LEU HB3 1 93 LEU MD2 1.800 . 3.510 2.421 2.268 3.217 . 0 0 "[ . 1 . 2]" 1 959 1 93 LEU HB2 1 93 LEU MD1 1.800 . 4.230 2.374 2.275 3.204 . 0 0 "[ . 1 . 2]" 1 960 1 93 LEU HB2 1 93 LEU MD2 1.800 . 3.510 2.333 2.252 2.459 . 0 0 "[ . 1 . 2]" 1 961 1 93 LEU MD1 1 94 VAL H 1.800 . 4.130 2.146 1.856 2.637 . 0 0 "[ . 1 . 2]" 1 962 1 93 LEU MD1 1 95 GLU QG 1.800 . 4.370 3.195 2.011 4.382 0.012 4 0 "[ . 1 . 2]" 1 963 1 93 LEU MD2 1 94 VAL H 1.800 . 5.440 4.408 3.144 4.737 . 0 0 "[ . 1 . 2]" 1 964 1 93 LEU MD2 1 95 GLU QG 1.800 . 4.200 3.190 2.819 4.411 0.211 4 0 "[ . 1 . 2]" 1 965 1 93 LEU HG 1 94 VAL H 1.800 . 4.420 3.206 2.781 4.605 0.185 14 0 "[ . 1 . 2]" 1 966 1 93 LEU HG 1 95 GLU QG 1.800 . 4.790 2.607 2.284 4.751 . 0 0 "[ . 1 . 2]" 1 967 1 93 LEU H 1 93 LEU HB3 1.800 . 4.270 2.706 2.462 3.142 . 0 0 "[ . 1 . 2]" 1 968 1 93 LEU H 1 93 LEU HB2 1.800 . 4.270 3.152 2.832 3.528 . 0 0 "[ . 1 . 2]" 1 969 1 93 LEU H 1 93 LEU MD1 1.800 . 5.140 4.279 4.179 4.347 . 0 0 "[ . 1 . 2]" 1 970 1 93 LEU H 1 93 LEU MD2 1.800 . 5.330 4.561 4.164 4.853 . 0 0 "[ . 1 . 2]" 1 971 1 93 LEU H 1 111 HIS HD1 1.800 . 4.400 3.908 2.462 4.455 0.055 16 0 "[ . 1 . 2]" 1 972 1 93 LEU H 1 112 SER H 1.800 . 4.740 3.054 2.212 3.429 . 0 0 "[ . 1 . 2]" 1 973 1 93 LEU H 1 113 GLY QA 1.800 . 5.070 3.559 3.149 4.002 . 0 0 "[ . 1 . 2]" 1 974 1 94 VAL HA 1 95 GLU H 1.800 . 3.710 2.183 2.141 2.213 . 0 0 "[ . 1 . 2]" 1 975 1 94 VAL HA 1 111 HIS HA 1.800 . 4.350 2.834 2.357 3.608 . 0 0 "[ . 1 . 2]" 1 976 1 94 VAL HA 1 111 HIS HD1 1.800 . 4.860 3.814 2.725 4.611 . 0 0 "[ . 1 . 2]" 1 977 1 94 VAL MG1 1 95 GLU H 1.800 . 4.410 2.597 2.485 2.923 . 0 0 "[ . 1 . 2]" 1 978 1 94 VAL MG1 1 96 ILE MD 1.800 . 3.780 3.028 2.145 3.396 . 0 0 "[ . 1 . 2]" 1 979 1 94 VAL MG1 1 96 ILE HG13 1.800 . 4.590 2.787 2.271 3.216 . 0 0 "[ . 1 . 2]" 1 980 1 94 VAL MG1 1 96 ILE HG12 1.800 . 4.590 3.799 3.334 4.102 . 0 0 "[ . 1 . 2]" 1 981 1 94 VAL MG1 1 96 ILE H 1.800 . 5.490 4.328 3.993 4.833 . 0 0 "[ . 1 . 2]" 1 982 1 94 VAL MG1 1 109 LEU MD1 1.800 . 4.290 3.268 2.647 4.193 . 0 0 "[ . 1 . 2]" 1 983 1 94 VAL MG1 1 109 LEU MD2 1.800 . 5.050 3.456 2.448 4.553 . 0 0 "[ . 1 . 2]" 1 984 1 94 VAL MG1 1 127 TRP HZ2 1.800 . 4.690 3.644 2.611 4.716 0.026 18 0 "[ . 1 . 2]" 1 985 1 94 VAL MG2 1 95 GLU H 1.800 . 5.140 3.990 3.819 4.248 . 0 0 "[ . 1 . 2]" 1 986 1 94 VAL MG2 1 111 HIS HA 1.800 . 5.170 3.592 2.745 4.950 . 0 0 "[ . 1 . 2]" 1 987 1 94 VAL MG2 1 111 HIS HD1 1.800 . 5.430 2.515 1.910 3.862 . 0 0 "[ . 1 . 2]" 1 988 1 94 VAL MG2 1 127 TRP HZ2 1.800 . 4.650 3.359 2.518 4.142 . 0 0 "[ . 1 . 2]" 1 989 1 94 VAL H 1 94 VAL MG2 1.800 . 4.630 2.613 2.048 2.911 . 0 0 "[ . 1 . 2]" 1 990 1 95 GLU HA 1 96 ILE H 1.800 . 3.310 2.196 2.136 2.243 . 0 0 "[ . 1 . 2]" 1 991 1 95 GLU QB 1 96 ILE H 1.800 . 4.090 3.102 2.880 3.706 . 0 0 "[ . 1 . 2]" 1 992 1 95 GLU QB 1 110 THR HB 1.800 . 3.870 2.515 2.257 3.701 . 0 0 "[ . 1 . 2]" 1 993 1 95 GLU H 1 95 GLU QG 1.800 . 4.580 3.132 2.787 4.133 . 0 0 "[ . 1 . 2]" 1 994 1 95 GLU H 1 96 ILE H 1.800 . 5.130 4.345 4.110 4.419 . 0 0 "[ . 1 . 2]" 1 995 1 95 GLU H 1 109 LEU MD2 1.800 . 5.580 4.472 3.337 5.620 0.040 3 0 "[ . 1 . 2]" 1 996 1 95 GLU H 1 109 LEU HG 1.800 . 5.930 4.310 3.656 5.050 . 0 0 "[ . 1 . 2]" 1 997 1 95 GLU H 1 110 THR HB 1.800 . 5.250 3.703 3.004 4.864 . 0 0 "[ . 1 . 2]" 1 998 1 95 GLU H 1 110 THR H 1.800 . 4.210 3.335 2.807 3.858 . 0 0 "[ . 1 . 2]" 1 999 1 95 GLU H 1 111 HIS HA 1.800 . 4.880 3.662 2.987 4.321 . 0 0 "[ . 1 . 2]" 1 1000 1 96 ILE HA 1 96 ILE MD 1.800 . 4.480 3.804 3.390 3.834 . 0 0 "[ . 1 . 2]" 1 1001 1 96 ILE HA 1 97 ASP H 1.800 . 3.390 2.183 2.157 2.231 . 0 0 "[ . 1 . 2]" 1 1002 1 96 ILE HB 1 96 ILE MD 1.800 . 3.730 2.304 2.197 2.346 . 0 0 "[ . 1 . 2]" 1 1003 1 96 ILE HB 1 97 ASP H 1.800 . 5.310 4.198 4.060 4.269 . 0 0 "[ . 1 . 2]" 1 1004 1 96 ILE MD 1 97 ASP H 1.800 . 6.050 5.090 4.939 5.169 . 0 0 "[ . 1 . 2]" 1 1005 1 96 ILE MD 1 109 LEU MD1 1.800 . 3.400 2.955 2.351 3.424 0.024 8 0 "[ . 1 . 2]" 1 1006 1 96 ILE QG 1 109 LEU HG 1.800 . 3.520 2.909 2.279 3.616 0.096 2 0 "[ . 1 . 2]" 1 1007 1 96 ILE HG13 1 109 LEU MD1 1.800 . 4.860 3.680 2.197 4.506 . 0 0 "[ . 1 . 2]" 1 1008 1 96 ILE HG12 1 109 LEU MD1 1.800 . 4.860 2.736 2.126 3.357 . 0 0 "[ . 1 . 2]" 1 1009 1 96 ILE QG 1 96 ILE MG 1.800 . 3.440 2.273 2.080 2.295 . 0 0 "[ . 1 . 2]" 1 1010 1 96 ILE MG 1 97 ASP HA 1.800 . 5.570 3.668 3.565 3.782 . 0 0 "[ . 1 . 2]" 1 1011 1 96 ILE MG 1 97 ASP H 1.800 . 3.920 2.576 2.369 2.699 . 0 0 "[ . 1 . 2]" 1 1012 1 96 ILE MG 1 98 LEU MD1 1.800 . 4.810 3.813 3.497 4.113 . 0 0 "[ . 1 . 2]" 1 1013 1 96 ILE MG 1 98 LEU MD2 1.800 . 4.050 2.576 2.307 2.886 . 0 0 "[ . 1 . 2]" 1 1014 1 96 ILE MG 1 98 LEU HG 1.800 . 4.070 3.177 2.825 3.540 . 0 0 "[ . 1 . 2]" 1 1015 1 96 ILE MG 1 107 LEU HG 1.800 . 3.670 2.738 2.463 3.093 . 0 0 "[ . 1 . 2]" 1 1016 1 96 ILE MG 1 108 ARG H 1.800 . 5.210 3.669 3.198 4.307 . 0 0 "[ . 1 . 2]" 1 1017 1 96 ILE MG 1 109 LEU MD1 1.800 . 4.950 3.795 2.966 4.418 . 0 0 "[ . 1 . 2]" 1 1018 1 96 ILE H 1 96 ILE HB 1.800 . 3.900 2.647 2.596 2.707 . 0 0 "[ . 1 . 2]" 1 1019 1 96 ILE H 1 96 ILE MD 1.800 . 5.020 3.882 2.328 4.047 . 0 0 "[ . 1 . 2]" 1 1020 1 96 ILE H 1 96 ILE HG13 1.800 . 5.370 3.002 2.908 3.547 . 0 0 "[ . 1 . 2]" 1 1021 1 96 ILE H 1 96 ILE HG12 1.800 . 5.370 4.173 4.106 4.425 . 0 0 "[ . 1 . 2]" 1 1022 1 96 ILE H 1 97 ASP H 1.800 . 5.530 4.350 4.260 4.399 . 0 0 "[ . 1 . 2]" 1 1023 1 97 ASP HA 1 98 LEU H 1.800 . 3.180 2.195 2.150 2.233 . 0 0 "[ . 1 . 2]" 1 1024 1 97 ASP QB 1 98 LEU H 1.800 . 4.330 3.237 2.940 3.836 . 0 0 "[ . 1 . 2]" 1 1025 1 97 ASP QB 1 99 ILE MD 1.800 . 4.000 3.319 2.297 3.935 . 0 0 "[ . 1 . 2]" 1 1026 1 97 ASP QB 1 99 ILE QG 1.800 . 5.870 3.389 3.043 4.351 . 0 0 "[ . 1 . 2]" 1 1027 1 97 ASP QB 1 108 ARG QB 1.800 . 3.780 2.410 2.294 2.587 . 0 0 "[ . 1 . 2]" 1 1028 1 97 ASP QB 1 108 ARG QD 1.800 . 5.120 3.372 2.634 4.229 . 0 0 "[ . 1 . 2]" 1 1029 1 97 ASP QB 1 108 ARG QG 1.800 . 5.090 3.944 3.667 4.301 . 0 0 "[ . 1 . 2]" 1 1030 1 97 ASP QB 1 108 ARG H 1.800 . 4.470 3.796 3.323 4.208 . 0 0 "[ . 1 . 2]" 1 1031 1 97 ASP HB3 1 108 ARG HB3 1.800 . 5.600 4.105 2.353 5.601 0.001 6 0 "[ . 1 . 2]" 1 1032 1 97 ASP HB3 1 108 ARG HB2 1.800 . 5.600 4.418 2.563 5.397 . 0 0 "[ . 1 . 2]" 1 1033 1 97 ASP HB2 1 108 ARG HB3 1.800 . 5.600 3.321 2.335 5.146 . 0 0 "[ . 1 . 2]" 1 1034 1 97 ASP HB2 1 108 ARG HB2 1.800 . 5.600 3.833 2.342 5.612 0.012 20 0 "[ . 1 . 2]" 1 1035 1 97 ASP H 1 108 ARG QB 1.800 . 4.880 3.065 2.653 3.395 . 0 0 "[ . 1 . 2]" 1 1036 1 97 ASP H 1 108 ARG H 1.800 . 4.230 3.297 2.806 3.621 . 0 0 "[ . 1 . 2]" 1 1037 1 98 LEU HA 1 98 LEU MD1 1.800 . 4.690 3.821 3.808 3.838 . 0 0 "[ . 1 . 2]" 1 1038 1 98 LEU HA 1 98 LEU MD2 1.800 . 3.510 2.113 2.096 2.137 . 0 0 "[ . 1 . 2]" 1 1039 1 98 LEU HA 1 99 ILE MD 1.800 . 5.200 4.560 2.871 4.966 . 0 0 "[ . 1 . 2]" 1 1040 1 98 LEU HA 1 99 ILE H 1.800 . 3.200 2.175 2.146 2.200 . 0 0 "[ . 1 . 2]" 1 1041 1 98 LEU HA 1 105 THR MG 1.800 . 3.960 3.687 3.036 3.999 0.039 13 0 "[ . 1 . 2]" 1 1042 1 98 LEU HA 1 108 ARG H 1.800 . 4.570 3.695 3.422 4.051 . 0 0 "[ . 1 . 2]" 1 1043 1 98 LEU QB 1 98 LEU MD1 1.800 . 3.430 2.102 2.096 2.107 . 0 0 "[ . 1 . 2]" 1 1044 1 98 LEU QB 1 99 ILE H 1.800 . 4.300 3.240 3.162 3.297 . 0 0 "[ . 1 . 2]" 1 1045 1 98 LEU HB3 1 98 LEU MD2 1.800 . 4.490 2.301 2.283 2.329 . 0 0 "[ . 1 . 2]" 1 1046 1 98 LEU HB2 1 98 LEU MD2 1.800 . 4.490 3.209 3.204 3.213 . 0 0 "[ . 1 . 2]" 1 1047 1 98 LEU MD1 1 107 LEU MD1 1.800 . 4.590 4.044 3.647 4.586 . 0 0 "[ . 1 . 2]" 1 1048 1 98 LEU MD2 1 99 ILE H 1.800 . 4.330 3.679 3.631 3.758 . 0 0 "[ . 1 . 2]" 1 1049 1 98 LEU MD2 1 105 THR HB 1.800 . 6.050 4.983 4.298 5.616 . 0 0 "[ . 1 . 2]" 1 1050 1 98 LEU MD2 1 107 LEU HA 1.800 . 3.700 2.820 2.350 3.259 . 0 0 "[ . 1 . 2]" 1 1051 1 98 LEU MD2 1 107 LEU QB 1.800 . 4.290 3.239 3.070 3.450 . 0 0 "[ . 1 . 2]" 1 1052 1 98 LEU MD2 1 107 LEU MD1 1.800 . 4.080 2.353 1.973 3.017 . 0 0 "[ . 1 . 2]" 1 1053 1 98 LEU MD2 1 107 LEU HG 1.800 . 3.490 2.557 2.111 2.984 . 0 0 "[ . 1 . 2]" 1 1054 1 98 LEU MD2 1 108 ARG H 1.800 . 4.060 3.566 3.022 4.052 . 0 0 "[ . 1 . 2]" 1 1055 1 98 LEU H 1 98 LEU QB 1.800 . 3.790 2.524 2.496 2.564 . 0 0 "[ . 1 . 2]" 1 1056 1 98 LEU H 1 98 LEU MD1 1.800 . 4.630 3.797 3.709 3.852 . 0 0 "[ . 1 . 2]" 1 1057 1 98 LEU H 1 98 LEU HG 1.800 . 3.930 2.479 2.339 2.576 . 0 0 "[ . 1 . 2]" 1 1058 1 98 LEU H 1 99 ILE H 1.800 . 4.910 4.446 4.415 4.504 . 0 0 "[ . 1 . 2]" 1 1059 1 99 ILE HA 1 99 ILE MD 1.800 . 4.230 3.680 2.075 3.839 . 0 0 "[ . 1 . 2]" 1 1060 1 99 ILE HA 1 99 ILE HG13 1.800 . 4.220 2.846 2.358 3.727 . 0 0 "[ . 1 . 2]" 1 1061 1 99 ILE HA 1 99 ILE HG12 1.800 . 4.220 2.737 2.523 3.594 . 0 0 "[ . 1 . 2]" 1 1062 1 99 ILE HA 1 99 ILE MG 1.800 . 3.480 2.325 2.230 2.362 . 0 0 "[ . 1 . 2]" 1 1063 1 99 ILE HA 1 100 GLU H 1.800 . 3.380 2.157 2.106 2.178 . 0 0 "[ . 1 . 2]" 1 1064 1 99 ILE HB 1 99 ILE MD 1.800 . 3.410 2.328 2.227 3.202 . 0 0 "[ . 1 . 2]" 1 1065 1 99 ILE HB 1 106 LEU HB3 1.800 . 5.270 2.575 2.250 3.468 . 0 0 "[ . 1 . 2]" 1 1066 1 99 ILE HB 1 106 LEU HB2 1.800 . 5.270 4.043 2.326 4.582 . 0 0 "[ . 1 . 2]" 1 1067 1 99 ILE HB 1 106 LEU MD2 1.800 . 4.370 3.179 2.734 4.355 . 0 0 "[ . 1 . 2]" 1 1068 1 99 ILE HB 1 106 LEU H 1.800 . 4.520 3.991 2.938 4.480 . 0 0 "[ . 1 . 2]" 1 1069 1 99 ILE MD 1 106 LEU MD2 1.800 . 4.180 3.201 2.724 4.342 0.162 8 0 "[ . 1 . 2]" 1 1070 1 99 ILE MD 1 108 ARG HA 1.800 . 5.600 5.457 4.647 5.782 0.182 8 0 "[ . 1 . 2]" 1 1071 1 99 ILE MD 1 108 ARG QD 1.800 . 3.970 3.131 1.960 3.966 . 0 0 "[ . 1 . 2]" 1 1072 1 99 ILE MD 1 108 ARG HE 1.800 . 5.600 3.943 1.792 5.643 0.043 9 0 "[ . 1 . 2]" 1 1073 1 99 ILE QG 1 100 GLU H 1.800 . 5.020 4.150 4.029 4.762 . 0 0 "[ . 1 . 2]" 1 1074 1 99 ILE HG13 1 99 ILE MG 1.800 . 3.550 3.079 2.311 3.195 . 0 0 "[ . 1 . 2]" 1 1075 1 99 ILE HG12 1 99 ILE MG 1.800 . 3.550 2.348 2.157 3.195 . 0 0 "[ . 1 . 2]" 1 1076 1 99 ILE MG 1 100 GLU H 1.800 . 3.400 2.643 2.562 2.833 . 0 0 "[ . 1 . 2]" 1 1077 1 99 ILE MG 1 101 GLN QB 1.800 . 4.260 3.679 2.694 4.242 . 0 0 "[ . 1 . 2]" 1 1078 1 99 ILE MG 1 101 GLN QE 1.800 . 5.200 4.176 2.341 5.283 0.083 19 0 "[ . 1 . 2]" 1 1079 1 99 ILE MG 1 101 GLN H 1.800 . 5.120 4.604 4.024 4.880 . 0 0 "[ . 1 . 2]" 1 1080 1 99 ILE MG 1 106 LEU QB 1.800 . 4.570 3.266 2.929 3.744 . 0 0 "[ . 1 . 2]" 1 1081 1 99 ILE MG 1 106 LEU MD2 1.800 . 4.360 3.434 2.708 4.606 0.246 16 0 "[ . 1 . 2]" 1 1082 1 99 ILE MG 1 106 LEU H 1.800 . 4.720 4.303 3.780 4.710 . 0 0 "[ . 1 . 2]" 1 1083 1 99 ILE H 1 99 ILE HB 1.800 . 3.450 2.651 2.553 2.745 . 0 0 "[ . 1 . 2]" 1 1084 1 99 ILE H 1 99 ILE MD 1.800 . 4.040 3.637 1.858 4.033 . 0 0 "[ . 1 . 2]" 1 1085 1 99 ILE H 1 99 ILE HG13 1.800 . 4.820 3.070 2.835 3.938 . 0 0 "[ . 1 . 2]" 1 1086 1 99 ILE H 1 99 ILE HG12 1.800 . 4.820 4.095 2.484 4.485 . 0 0 "[ . 1 . 2]" 1 1087 1 99 ILE H 1 105 THR MG 1.800 . 3.450 3.216 2.637 3.487 0.037 9 0 "[ . 1 . 2]" 1 1088 1 99 ILE H 1 106 LEU HA 1.800 . 5.730 5.107 4.640 5.311 . 0 0 "[ . 1 . 2]" 1 1089 1 99 ILE H 1 106 LEU HB3 1.800 . 6.050 3.615 3.059 4.235 . 0 0 "[ . 1 . 2]" 1 1090 1 99 ILE H 1 106 LEU HB2 1.800 . 6.050 5.063 3.141 5.734 . 0 0 "[ . 1 . 2]" 1 1091 1 99 ILE H 1 106 LEU HG 1.800 . 5.530 4.511 4.199 5.595 0.065 16 0 "[ . 1 . 2]" 1 1092 1 99 ILE H 1 106 LEU H 1.800 . 4.100 3.718 2.846 4.119 0.019 8 0 "[ . 1 . 2]" 1 1093 1 99 ILE H 1 107 LEU HA 1.800 . 4.110 3.665 2.871 4.201 0.091 16 0 "[ . 1 . 2]" 1 1094 1 99 ILE H 1 107 LEU QB 1.800 . 6.050 5.155 4.448 5.621 . 0 0 "[ . 1 . 2]" 1 1095 1 100 GLU HA 1 100 GLU QG 1.800 . 3.780 2.463 2.289 2.827 . 0 0 "[ . 1 . 2]" 1 1096 1 100 GLU HA 1 101 GLN QB 1.800 . 5.090 4.159 3.979 4.535 . 0 0 "[ . 1 . 2]" 1 1097 1 100 GLU HA 1 101 GLN H 1.800 . 3.330 2.213 2.167 2.262 . 0 0 "[ . 1 . 2]" 1 1098 1 100 GLU HA 1 105 THR HA 1.800 . 4.170 3.083 2.313 3.775 . 0 0 "[ . 1 . 2]" 1 1099 1 100 GLU HA 1 105 THR HB 1.800 . 5.820 5.479 5.162 5.814 . 0 0 "[ . 1 . 2]" 1 1100 1 100 GLU HA 1 105 THR MG 1.800 . 4.470 3.065 2.628 3.581 . 0 0 "[ . 1 . 2]" 1 1101 1 100 GLU HA 1 106 LEU H 1.800 . 5.030 3.615 3.051 4.422 . 0 0 "[ . 1 . 2]" 1 1102 1 100 GLU QB 1 105 THR MG 1.800 . 6.050 4.618 4.245 5.054 . 0 0 "[ . 1 . 2]" 1 1103 1 100 GLU HB3 1 101 GLN H 1.800 . 5.220 3.412 2.882 4.051 . 0 0 "[ . 1 . 2]" 1 1104 1 100 GLU HB2 1 101 GLN H 1.800 . 5.220 4.212 3.997 4.440 . 0 0 "[ . 1 . 2]" 1 1105 1 100 GLU QG 1 101 GLN H 1.800 . 4.550 3.847 2.473 4.625 0.075 19 0 "[ . 1 . 2]" 1 1106 1 100 GLU QG 1 105 THR MG 1.800 . 4.220 3.858 3.173 4.317 0.097 9 0 "[ . 1 . 2]" 1 1107 1 100 GLU H 1 100 GLU HB3 1.800 . 3.970 3.365 2.537 3.626 . 0 0 "[ . 1 . 2]" 1 1108 1 100 GLU H 1 100 GLU HB2 1.800 . 3.970 2.418 2.350 2.598 . 0 0 "[ . 1 . 2]" 1 1109 1 100 GLU H 1 100 GLU QG 1.800 . 4.200 2.794 2.179 4.003 . 0 0 "[ . 1 . 2]" 1 1110 1 100 GLU H 1 101 GLN H 1.800 . 4.940 4.585 4.313 4.662 . 0 0 "[ . 1 . 2]" 1 1111 1 101 GLN HA 1 101 GLN QG 1.800 . 3.590 2.398 2.277 3.318 . 0 0 "[ . 1 . 2]" 1 1112 1 101 GLN HA 1 102 GLY QA 1.800 . 4.430 4.007 3.914 4.247 . 0 0 "[ . 1 . 2]" 1 1113 1 101 GLN QB 1 101 GLN QE 1.800 . 4.530 3.283 1.785 3.587 0.015 7 0 "[ . 1 . 2]" 1 1114 1 101 GLN QB 1 105 THR HA 1.800 . 5.090 3.743 2.388 4.835 . 0 0 "[ . 1 . 2]" 1 1115 1 101 GLN QB 1 106 LEU QB 1.800 . 4.160 2.921 2.242 4.303 0.143 16 0 "[ . 1 . 2]" 1 1116 1 101 GLN QB 1 106 LEU MD2 1.800 . 4.840 3.736 2.833 4.854 0.014 1 0 "[ . 1 . 2]" 1 1117 1 101 GLN QB 1 106 LEU H 1.800 . 4.990 3.340 2.277 4.542 . 0 0 "[ . 1 . 2]" 1 1118 1 101 GLN QE 1 106 LEU QB 1.800 . 4.910 3.461 2.078 4.816 . 0 0 "[ . 1 . 2]" 1 1119 1 101 GLN HE21 1 106 LEU MD1 1.800 . 5.440 5.072 3.910 5.477 0.037 19 0 "[ . 1 . 2]" 1 1120 1 101 GLN HE21 1 106 LEU MD2 1.800 . 4.620 3.379 2.271 4.524 . 0 0 "[ . 1 . 2]" 1 1121 1 101 GLN HE22 1 106 LEU MD1 1.800 . 5.440 4.279 3.355 5.337 . 0 0 "[ . 1 . 2]" 1 1122 1 101 GLN HE22 1 106 LEU MD2 1.800 . 4.620 2.739 1.753 3.921 0.047 3 0 "[ . 1 . 2]" 1 1123 1 101 GLN H 1 101 GLN HB3 1.800 . 4.030 3.243 2.807 3.881 . 0 0 "[ . 1 . 2]" 1 1124 1 101 GLN H 1 101 GLN HB2 1.800 . 4.030 3.141 2.428 3.657 . 0 0 "[ . 1 . 2]" 1 1125 1 101 GLN H 1 101 GLN QG 1.800 . 5.320 3.683 1.859 4.218 . 0 0 "[ . 1 . 2]" 1 1126 1 101 GLN H 1 105 THR HA 1.800 . 3.840 2.947 2.444 3.410 . 0 0 "[ . 1 . 2]" 1 1127 1 101 GLN H 1 106 LEU H 1.800 . 4.460 3.663 3.012 4.266 . 0 0 "[ . 1 . 2]" 1 1128 1 103 GLY H 1 104 GLY H 1.800 . 4.740 3.407 2.420 4.611 . 0 0 "[ . 1 . 2]" 1 1129 1 104 GLY QA 1 105 THR H 1.800 . 3.370 2.248 2.131 2.326 . 0 0 "[ . 1 . 2]" 1 1130 1 104 GLY H 1 105 THR H 1.800 . 4.980 4.395 3.583 4.677 . 0 0 "[ . 1 . 2]" 1 1131 1 105 THR HA 1 105 THR MG 1.800 . 3.610 2.322 2.277 2.347 . 0 0 "[ . 1 . 2]" 1 1132 1 105 THR HA 1 106 LEU H 1.800 . 3.470 2.167 2.114 2.196 . 0 0 "[ . 1 . 2]" 1 1133 1 105 THR MG 1 106 LEU H 1.800 . 3.820 2.640 2.535 2.956 . 0 0 "[ . 1 . 2]" 1 1134 1 105 THR MG 1 107 LEU HA 1.800 . 4.800 3.977 3.876 4.082 . 0 0 "[ . 1 . 2]" 1 1135 1 105 THR MG 1 107 LEU H 1.800 . 4.830 4.372 4.152 4.541 . 0 0 "[ . 1 . 2]" 1 1136 1 105 THR H 1 105 THR HB 1.800 . 3.890 2.696 2.596 2.954 . 0 0 "[ . 1 . 2]" 1 1137 1 105 THR H 1 105 THR HG1 1.800 . 4.490 3.213 2.602 3.717 . 0 0 "[ . 1 . 2]" 1 1138 1 105 THR H 1 105 THR MG 1.800 . 4.550 3.882 3.841 3.980 . 0 0 "[ . 1 . 2]" 1 1139 1 105 THR H 1 106 LEU H 1.800 . 5.280 4.314 3.954 4.412 . 0 0 "[ . 1 . 2]" 1 1140 1 106 LEU HA 1 106 LEU MD1 1.800 . 3.390 2.108 2.065 2.207 . 0 0 "[ . 1 . 2]" 1 1141 1 106 LEU HA 1 106 LEU MD2 1.800 . 5.740 3.642 2.165 3.878 . 0 0 "[ . 1 . 2]" 1 1142 1 106 LEU HA 1 107 LEU H 1.800 . 3.310 2.178 2.137 2.209 . 0 0 "[ . 1 . 2]" 1 1143 1 106 LEU QB 1 107 LEU H 1.800 . 4.300 3.729 3.122 3.829 . 0 0 "[ . 1 . 2]" 1 1144 1 106 LEU HB3 1 106 LEU MD1 1.800 . 3.730 3.118 2.242 3.215 . 0 0 "[ . 1 . 2]" 1 1145 1 106 LEU HB3 1 106 LEU MD2 1.800 . 4.520 2.460 2.308 3.204 . 0 0 "[ . 1 . 2]" 1 1146 1 106 LEU HB2 1 106 LEU MD1 1.800 . 3.730 2.428 2.249 3.216 . 0 0 "[ . 1 . 2]" 1 1147 1 106 LEU HB2 1 106 LEU MD2 1.800 . 4.520 2.327 2.237 2.420 . 0 0 "[ . 1 . 2]" 1 1148 1 106 LEU MD1 1 107 LEU H 1.800 . 3.770 2.068 1.849 2.823 . 0 0 "[ . 1 . 2]" 1 1149 1 106 LEU HG 1 107 LEU H 1.800 . 4.970 3.306 2.916 5.032 0.062 7 0 "[ . 1 . 2]" 1 1150 1 106 LEU H 1 106 LEU HB3 1.800 . 4.050 2.515 2.399 3.511 . 0 0 "[ . 1 . 2]" 1 1151 1 106 LEU H 1 106 LEU HB2 1.800 . 4.050 2.751 2.196 2.945 . 0 0 "[ . 1 . 2]" 1 1152 1 106 LEU H 1 106 LEU MD1 1.800 . 4.980 4.178 4.068 4.279 . 0 0 "[ . 1 . 2]" 1 1153 1 106 LEU H 1 106 LEU MD2 1.800 . 4.710 4.197 2.304 4.381 . 0 0 "[ . 1 . 2]" 1 1154 1 106 LEU H 1 106 LEU HG 1.800 . 5.150 4.376 4.066 4.648 . 0 0 "[ . 1 . 2]" 1 1155 1 106 LEU H 1 107 LEU H 1.800 . 5.310 4.516 4.424 4.560 . 0 0 "[ . 1 . 2]" 1 1156 1 107 LEU HA 1 107 LEU MD1 1.800 . 4.490 3.406 3.286 3.681 . 0 0 "[ . 1 . 2]" 1 1157 1 107 LEU HA 1 107 LEU MD2 1.800 . 4.520 3.346 2.797 3.533 . 0 0 "[ . 1 . 2]" 1 1158 1 107 LEU HA 1 108 ARG H 1.800 . 3.260 2.157 2.120 2.169 . 0 0 "[ . 1 . 2]" 1 1159 1 107 LEU QB 1 134 LEU MD2 1.800 . 5.890 4.294 3.765 4.778 . 0 0 "[ . 1 . 2]" 1 1160 1 107 LEU HB3 1 107 LEU MD1 1.800 . 3.820 2.708 2.419 2.785 . 0 0 "[ . 1 . 2]" 1 1161 1 107 LEU HB3 1 107 LEU MD2 1.800 . 4.630 2.200 2.183 2.237 . 0 0 "[ . 1 . 2]" 1 1162 1 107 LEU HB3 1 108 ARG H 1.800 . 5.280 4.204 4.125 4.287 . 0 0 "[ . 1 . 2]" 1 1163 1 107 LEU HB2 1 107 LEU MD1 1.800 . 3.820 2.213 2.181 2.330 . 0 0 "[ . 1 . 2]" 1 1164 1 107 LEU HB2 1 107 LEU MD2 1.800 . 4.630 3.133 3.103 3.211 . 0 0 "[ . 1 . 2]" 1 1165 1 107 LEU HB2 1 108 ARG H 1.800 . 5.280 4.334 4.216 4.531 . 0 0 "[ . 1 . 2]" 1 1166 1 107 LEU MD1 1 108 ARG H 1.800 . 5.700 4.362 4.129 4.888 . 0 0 "[ . 1 . 2]" 1 1167 1 107 LEU MD1 1 134 LEU MD1 1.800 . 5.440 4.719 4.086 5.258 . 0 0 "[ . 1 . 2]" 1 1168 1 107 LEU MD1 1 134 LEU MD2 1.800 . 3.660 2.798 2.076 3.524 . 0 0 "[ . 1 . 2]" 1 1169 1 107 LEU MD2 1 108 ARG HA 1.800 . 4.260 3.378 3.227 3.507 . 0 0 "[ . 1 . 2]" 1 1170 1 107 LEU MD2 1 108 ARG H 1.800 . 4.190 3.176 2.485 3.469 . 0 0 "[ . 1 . 2]" 1 1171 1 107 LEU MD2 1 109 LEU HA 1.800 . 4.800 3.697 3.384 4.030 . 0 0 "[ . 1 . 2]" 1 1172 1 107 LEU MD2 1 109 LEU HB3 1.800 . 5.180 3.883 3.585 4.261 . 0 0 "[ . 1 . 2]" 1 1173 1 107 LEU MD2 1 109 LEU HB2 1.800 . 5.180 2.610 2.289 2.886 . 0 0 "[ . 1 . 2]" 1 1174 1 107 LEU MD2 1 109 LEU MD1 1.800 . 4.130 3.144 2.593 3.381 . 0 0 "[ . 1 . 2]" 1 1175 1 107 LEU MD2 1 109 LEU H 1.800 . 3.880 3.529 3.275 3.758 . 0 0 "[ . 1 . 2]" 1 1176 1 107 LEU MD2 1 131 LEU MD2 1.800 . 3.350 2.402 1.944 2.899 . 0 0 "[ . 1 . 2]" 1 1177 1 107 LEU MD2 1 134 LEU MD2 1.800 . 4.410 3.705 3.038 4.304 . 0 0 "[ . 1 . 2]" 1 1178 1 107 LEU HG 1 108 ARG H 1.800 . 4.190 2.817 2.510 3.648 . 0 0 "[ . 1 . 2]" 1 1179 1 107 LEU HG 1 109 LEU QB 1.800 . 5.900 4.792 4.257 5.580 . 0 0 "[ . 1 . 2]" 1 1180 1 107 LEU H 1 107 LEU HB3 1.800 . 4.130 2.607 2.508 2.772 . 0 0 "[ . 1 . 2]" 1 1181 1 107 LEU H 1 107 LEU HB2 1.800 . 4.130 2.911 2.753 3.004 . 0 0 "[ . 1 . 2]" 1 1182 1 107 LEU H 1 107 LEU MD1 1.800 . 5.430 4.543 4.453 4.578 . 0 0 "[ . 1 . 2]" 1 1183 1 107 LEU H 1 107 LEU MD2 1.800 . 4.570 4.078 3.936 4.154 . 0 0 "[ . 1 . 2]" 1 1184 1 108 ARG HA 1 108 ARG QD 1.800 . 4.200 4.041 3.861 4.182 . 0 0 "[ . 1 . 2]" 1 1185 1 108 ARG HA 1 109 LEU H 1.800 . 3.280 2.178 2.136 2.218 . 0 0 "[ . 1 . 2]" 1 1186 1 108 ARG QB 1 108 ARG QD 1.800 . 3.340 2.248 2.123 2.315 . 0 0 "[ . 1 . 2]" 1 1187 1 108 ARG HB3 1 109 LEU H 1.800 . 5.180 3.828 3.135 4.237 . 0 0 "[ . 1 . 2]" 1 1188 1 108 ARG HB2 1 109 LEU H 1.800 . 5.180 4.246 4.143 4.367 . 0 0 "[ . 1 . 2]" 1 1189 1 108 ARG QG 1 109 LEU H 1.800 . 4.850 3.166 2.531 4.062 . 0 0 "[ . 1 . 2]" 1 1190 1 108 ARG H 1 108 ARG QB 1.800 . 3.720 2.434 2.384 2.505 . 0 0 "[ . 1 . 2]" 1 1191 1 108 ARG H 1 108 ARG QD 1.800 . 5.380 4.578 3.932 4.994 . 0 0 "[ . 1 . 2]" 1 1192 1 108 ARG H 1 108 ARG QG 1.800 . 5.470 3.570 2.647 4.058 . 0 0 "[ . 1 . 2]" 1 1193 1 108 ARG H 1 109 LEU H 1.800 . 4.690 4.432 4.314 4.514 . 0 0 "[ . 1 . 2]" 1 1194 1 109 LEU HA 1 109 LEU MD1 1.800 . 4.230 3.260 2.274 3.674 . 0 0 "[ . 1 . 2]" 1 1195 1 109 LEU HA 1 109 LEU MD2 1.800 . 4.860 3.378 2.895 3.812 . 0 0 "[ . 1 . 2]" 1 1196 1 109 LEU HA 1 110 THR H 1.800 . 3.420 2.159 2.116 2.187 . 0 0 "[ . 1 . 2]" 1 1197 1 109 LEU QB 1 109 LEU MD2 1.800 . 3.850 2.153 2.114 2.188 . 0 0 "[ . 1 . 2]" 1 1198 1 109 LEU QB 1 110 THR H 1.800 . 4.300 3.790 3.737 3.832 . 0 0 "[ . 1 . 2]" 1 1199 1 109 LEU HB3 1 109 LEU MD1 1.800 . 4.490 2.757 2.441 3.169 . 0 0 "[ . 1 . 2]" 1 1200 1 109 LEU HB2 1 109 LEU MD1 1.800 . 4.490 2.230 2.184 2.315 . 0 0 "[ . 1 . 2]" 1 1201 1 109 LEU MD1 1 111 HIS QB 1.800 . 5.870 4.529 4.308 4.977 . 0 0 "[ . 1 . 2]" 1 1202 1 109 LEU MD1 1 127 TRP QB 1.800 . 5.870 3.625 2.601 5.057 . 0 0 "[ . 1 . 2]" 1 1203 1 109 LEU MD1 1 127 TRP HE3 1.800 . 5.670 2.970 2.409 3.887 . 0 0 "[ . 1 . 2]" 1 1204 1 109 LEU MD1 1 127 TRP HZ2 1.800 . 5.290 4.056 3.319 4.959 . 0 0 "[ . 1 . 2]" 1 1205 1 109 LEU MD1 1 131 LEU MD1 1.800 . 4.410 3.178 2.257 4.383 . 0 0 "[ . 1 . 2]" 1 1206 1 109 LEU MD1 1 131 LEU MD2 1.800 . 4.310 2.942 2.330 3.527 . 0 0 "[ . 1 . 2]" 1 1207 1 109 LEU MD2 1 110 THR HA 1.800 . 5.190 3.428 2.991 4.724 . 0 0 "[ . 1 . 2]" 1 1208 1 109 LEU MD2 1 110 THR H 1.800 . 4.180 3.229 2.474 4.252 0.072 3 0 "[ . 1 . 2]" 1 1209 1 109 LEU MD2 1 111 HIS HB3 1.800 . 4.680 3.890 3.512 4.497 . 0 0 "[ . 1 . 2]" 1 1210 1 109 LEU MD2 1 111 HIS HB2 1.800 . 4.680 2.734 2.300 3.500 . 0 0 "[ . 1 . 2]" 1 1211 1 109 LEU MD2 1 111 HIS H 1.800 . 4.870 3.628 3.222 4.842 . 0 0 "[ . 1 . 2]" 1 1212 1 109 LEU MD2 1 127 TRP QB 1.800 . 4.760 3.317 2.558 4.156 . 0 0 "[ . 1 . 2]" 1 1213 1 109 LEU MD2 1 127 TRP HD1 1.800 . 5.020 4.045 3.579 4.747 . 0 0 "[ . 1 . 2]" 1 1214 1 109 LEU MD2 1 131 LEU MD1 1.800 . 4.970 3.535 2.475 4.317 . 0 0 "[ . 1 . 2]" 1 1215 1 109 LEU HG 1 110 THR H 1.800 . 3.820 2.810 2.584 3.330 . 0 0 "[ . 1 . 2]" 1 1216 1 109 LEU H 1 109 LEU MD1 1.800 . 5.360 4.545 4.224 4.677 . 0 0 "[ . 1 . 2]" 1 1217 1 109 LEU H 1 109 LEU MD2 1.800 . 5.040 4.161 4.047 4.491 . 0 0 "[ . 1 . 2]" 1 1218 1 109 LEU H 1 109 LEU HG 1.800 . 5.490 4.575 4.494 4.650 . 0 0 "[ . 1 . 2]" 1 1219 1 109 LEU H 1 131 LEU MD1 1.800 . 5.730 4.742 4.261 5.170 . 0 0 "[ . 1 . 2]" 1 1220 1 110 THR HA 1 110 THR MG 1.800 . 3.520 2.318 2.265 2.370 . 0 0 "[ . 1 . 2]" 1 1221 1 110 THR HA 1 111 HIS H 1.800 . 3.500 2.169 2.146 2.192 . 0 0 "[ . 1 . 2]" 1 1222 1 110 THR MG 1 111 HIS H 1.800 . 3.930 2.721 2.587 3.653 . 0 0 "[ . 1 . 2]" 1 1223 1 110 THR MG 1 112 SER QB 1.800 . 5.370 3.648 2.923 5.441 0.071 8 0 "[ . 1 . 2]" 1 1224 1 110 THR H 1 110 THR MG 1.800 . 4.770 3.818 3.206 3.874 . 0 0 "[ . 1 . 2]" 1 1225 1 111 HIS HA 1 111 HIS HD1 1.800 . 4.160 2.994 2.185 3.213 . 0 0 "[ . 1 . 2]" 1 1226 1 111 HIS HA 1 112 SER H 1.800 . 3.850 2.196 2.136 2.255 . 0 0 "[ . 1 . 2]" 1 1227 1 111 HIS HD1 1 112 SER H 1.800 . 4.160 2.662 1.914 3.764 . 0 0 "[ . 1 . 2]" 1 1228 1 111 HIS HD1 1 114 LEU MD2 1.800 . 5.030 2.825 2.138 4.268 . 0 0 "[ . 1 . 2]" 1 1229 1 111 HIS HE1 1 114 LEU MD2 1.800 . 4.770 3.368 2.164 4.867 0.097 13 0 "[ . 1 . 2]" 1 1230 1 112 SER HA 1 114 LEU HG 1.800 . 4.910 3.736 2.734 4.698 . 0 0 "[ . 1 . 2]" 1 1231 1 112 SER HA 1 114 LEU H 1.800 . 6.050 4.269 2.983 5.894 . 0 0 "[ . 1 . 2]" 1 1232 1 112 SER QB 1 113 GLY H 1.800 . 4.260 3.038 2.366 3.769 . 0 0 "[ . 1 . 2]" 1 1233 1 113 GLY H 1 114 LEU H 1.800 . 4.250 2.905 2.185 4.327 0.077 1 0 "[ . 1 . 2]" 1 1234 1 114 LEU HA 1 114 LEU MD1 1.800 . 4.250 3.814 3.760 3.882 . 0 0 "[ . 1 . 2]" 1 1235 1 114 LEU HA 1 114 LEU MD2 1.800 . 3.490 2.175 2.095 2.270 . 0 0 "[ . 1 . 2]" 1 1236 1 114 LEU QB 1 114 LEU MD2 1.800 . 4.300 2.243 2.163 2.340 . 0 0 "[ . 1 . 2]" 1 1237 1 114 LEU QB 1 116 SER H 1.800 . 4.280 3.285 2.618 3.943 . 0 0 "[ . 1 . 2]" 1 1238 1 114 LEU HB3 1 114 LEU MD1 1.800 . 3.940 2.432 2.257 2.653 . 0 0 "[ . 1 . 2]" 1 1239 1 114 LEU HB2 1 114 LEU MD1 1.800 . 3.940 2.325 2.208 2.458 . 0 0 "[ . 1 . 2]" 1 1240 1 114 LEU MD1 1 119 GLN QB 1.800 . 5.870 3.903 3.080 5.186 . 0 0 "[ . 1 . 2]" 1 1241 1 114 LEU MD1 1 120 CYS HA 1.800 . 4.300 2.328 2.061 2.749 . 0 0 "[ . 1 . 2]" 1 1242 1 114 LEU MD1 1 120 CYS QB 1.800 . 4.390 2.804 1.929 3.615 . 0 0 "[ . 1 . 2]" 1 1243 1 114 LEU MD1 1 120 CYS H 1.800 . 5.280 3.779 3.048 4.826 . 0 0 "[ . 1 . 2]" 1 1244 1 114 LEU MD1 1 123 HIS QB 1.800 . 4.370 3.366 2.403 4.282 . 0 0 "[ . 1 . 2]" 1 1245 1 114 LEU MD1 1 123 HIS HD1 1.800 . 5.060 3.537 2.684 4.605 . 0 0 "[ . 1 . 2]" 1 1246 1 114 LEU MD1 1 123 HIS H 1.800 . 5.380 4.992 4.037 5.428 0.048 8 0 "[ . 1 . 2]" 1 1247 1 114 LEU MD2 1 115 PRO HD3 1.800 . 4.370 3.621 2.573 4.413 0.043 19 0 "[ . 1 . 2]" 1 1248 1 114 LEU MD2 1 115 PRO HD2 1.800 . 4.370 3.286 2.205 3.996 . 0 0 "[ . 1 . 2]" 1 1249 1 114 LEU MD2 1 116 SER H 1.800 . 5.600 4.532 3.928 5.102 . 0 0 "[ . 1 . 2]" 1 1250 1 114 LEU MD2 1 119 GLN HB3 1.800 . 4.830 3.097 2.315 4.874 0.044 4 0 "[ . 1 . 2]" 1 1251 1 114 LEU MD2 1 119 GLN HB2 1.800 . 4.830 3.788 2.639 4.878 0.048 18 0 "[ . 1 . 2]" 1 1252 1 114 LEU MD2 1 123 HIS HB3 1.800 . 5.760 4.063 3.154 4.798 . 0 0 "[ . 1 . 2]" 1 1253 1 114 LEU MD2 1 123 HIS HB2 1.800 . 5.760 3.815 2.897 4.477 . 0 0 "[ . 1 . 2]" 1 1254 1 114 LEU MD2 1 123 HIS HD1 1.800 . 5.310 2.653 1.792 3.946 0.008 14 0 "[ . 1 . 2]" 1 1255 1 114 LEU H 1 114 LEU HB3 1.800 . 4.190 3.763 3.561 4.037 . 0 0 "[ . 1 . 2]" 1 1256 1 114 LEU H 1 114 LEU HB2 1.800 . 4.190 2.891 2.247 3.755 . 0 0 "[ . 1 . 2]" 1 1257 1 114 LEU H 1 114 LEU MD1 1.800 . 5.080 3.754 3.178 4.349 . 0 0 "[ . 1 . 2]" 1 1258 1 114 LEU H 1 114 LEU MD2 1.800 . 4.480 3.143 1.954 4.175 . 0 0 "[ . 1 . 2]" 1 1259 1 114 LEU H 1 114 LEU HG 1.800 . 4.040 2.553 1.814 3.025 . 0 0 "[ . 1 . 2]" 1 1260 1 115 PRO QB 1 116 SER H 1.800 . 4.150 3.091 2.250 3.862 . 0 0 "[ . 1 . 2]" 1 1261 1 115 PRO QD 1 119 GLN QB 1.800 . 5.390 3.320 2.419 4.451 . 0 0 "[ . 1 . 2]" 1 1262 1 115 PRO QG 1 116 SER H 1.800 . 4.350 3.201 1.782 3.987 0.018 16 0 "[ . 1 . 2]" 1 1263 1 116 SER HA 1 117 ALA H 1.800 . 3.900 2.323 2.135 2.500 . 0 0 "[ . 1 . 2]" 1 1264 1 116 SER HB3 1 117 ALA H 1.800 . 4.570 3.493 2.371 4.171 . 0 0 "[ . 1 . 2]" 1 1265 1 116 SER HB2 1 117 ALA H 1.800 . 4.570 3.567 2.394 4.231 . 0 0 "[ . 1 . 2]" 1 1266 1 116 SER H 1 119 GLN QB 1.800 . 3.960 3.045 2.503 3.513 . 0 0 "[ . 1 . 2]" 1 1267 1 116 SER H 1 119 GLN H 1.800 . 4.680 4.059 3.502 4.721 0.041 19 0 "[ . 1 . 2]" 1 1268 1 116 SER H 1 120 CYS H 1.800 . 4.960 4.593 4.108 5.020 0.060 13 0 "[ . 1 . 2]" 1 1269 1 117 ALA HA 1 120 CYS QB 1.800 . 3.840 2.546 2.102 2.927 . 0 0 "[ . 1 . 2]" 1 1270 1 117 ALA HA 1 120 CYS H 1.800 . 4.870 3.215 3.067 3.460 . 0 0 "[ . 1 . 2]" 1 1271 1 117 ALA HA 1 121 ALA H 1.800 . 5.100 4.212 3.758 4.612 . 0 0 "[ . 1 . 2]" 1 1272 1 117 ALA MB 1 118 GLU HA 1.800 . 4.270 3.837 3.792 3.917 . 0 0 "[ . 1 . 2]" 1 1273 1 117 ALA MB 1 118 GLU H 1.800 . 4.090 2.646 2.559 2.871 . 0 0 "[ . 1 . 2]" 1 1274 1 117 ALA MB 1 120 CYS QB 1.800 . 4.920 3.665 3.264 3.993 . 0 0 "[ . 1 . 2]" 1 1275 1 117 ALA H 1 117 ALA MB 1.800 . 3.550 2.223 2.194 2.246 . 0 0 "[ . 1 . 2]" 1 1276 1 117 ALA H 1 118 GLU H 1.800 . 4.650 2.618 2.573 2.683 . 0 0 "[ . 1 . 2]" 1 1277 1 118 GLU HA 1 118 GLU QG 1.800 . 3.730 2.516 2.309 3.319 . 0 0 "[ . 1 . 2]" 1 1278 1 118 GLU HA 1 121 ALA MB 1.800 . 3.830 3.056 2.499 3.781 . 0 0 "[ . 1 . 2]" 1 1279 1 118 GLU HA 1 121 ALA H 1.800 . 4.460 3.641 3.501 4.059 . 0 0 "[ . 1 . 2]" 1 1280 1 118 GLU HA 1 122 GLY H 1.800 . 4.750 4.273 3.733 4.601 . 0 0 "[ . 1 . 2]" 1 1281 1 118 GLU QB 1 119 GLN H 1.800 . 3.580 2.516 2.197 3.416 . 0 0 "[ . 1 . 2]" 1 1282 1 118 GLU H 1 118 GLU QB 1.800 . 3.890 2.389 2.205 2.483 . 0 0 "[ . 1 . 2]" 1 1283 1 118 GLU H 1 118 GLU QG 1.800 . 4.790 2.635 2.022 4.091 . 0 0 "[ . 1 . 2]" 1 1284 1 118 GLU H 1 119 GLN H 1.800 . 4.800 2.780 2.666 2.993 . 0 0 "[ . 1 . 2]" 1 1285 1 119 GLN HA 1 119 GLN QG 1.800 . 4.000 2.552 2.292 2.891 . 0 0 "[ . 1 . 2]" 1 1286 1 119 GLN QB 1 120 CYS H 1.800 . 4.460 2.666 2.537 2.807 . 0 0 "[ . 1 . 2]" 1 1287 1 119 GLN H 1 119 GLN QG 1.800 . 4.320 2.900 2.076 4.077 . 0 0 "[ . 1 . 2]" 1 1288 1 119 GLN H 1 120 CYS H 1.800 . 4.040 2.599 2.536 2.650 . 0 0 "[ . 1 . 2]" 1 1289 1 120 CYS HA 1 123 HIS QB 1.800 . 4.830 2.703 2.419 4.083 . 0 0 "[ . 1 . 2]" 1 1290 1 120 CYS HA 1 123 HIS H 1.800 . 5.070 3.610 3.324 3.991 . 0 0 "[ . 1 . 2]" 1 1291 1 120 CYS HA 1 124 GLU H 1.800 . 5.250 3.826 3.495 4.199 . 0 0 "[ . 1 . 2]" 1 1292 1 120 CYS QB 1 121 ALA H 1.800 . 3.750 2.587 2.025 3.325 . 0 0 "[ . 1 . 2]" 1 1293 1 120 CYS H 1 120 CYS HB3 1.800 . 4.170 3.004 2.210 3.617 . 0 0 "[ . 1 . 2]" 1 1294 1 120 CYS H 1 120 CYS HB2 1.800 . 4.170 2.598 2.161 3.550 . 0 0 "[ . 1 . 2]" 1 1295 1 121 ALA HA 1 124 GLU QB 1.800 . 3.630 2.789 2.606 3.066 . 0 0 "[ . 1 . 2]" 1 1296 1 121 ALA HA 1 124 GLU H 1.800 . 4.500 3.662 3.462 3.950 . 0 0 "[ . 1 . 2]" 1 1297 1 121 ALA MB 1 122 GLY H 1.800 . 3.760 2.442 2.241 2.730 . 0 0 "[ . 1 . 2]" 1 1298 1 121 ALA MB 1 124 GLU QB 1.800 . 4.520 4.098 3.955 4.337 . 0 0 "[ . 1 . 2]" 1 1299 1 121 ALA H 1 121 ALA MB 1.800 . 3.340 2.224 2.150 2.248 . 0 0 "[ . 1 . 2]" 1 1300 1 121 ALA H 1 122 GLY H 1.800 . 3.980 2.688 2.552 2.851 . 0 0 "[ . 1 . 2]" 1 1301 1 122 GLY QA 1 125 GLU QB 1.800 . 5.260 3.065 2.799 3.530 . 0 0 "[ . 1 . 2]" 1 1302 1 122 GLY H 1 123 HIS H 1.800 . 3.860 2.644 2.605 2.738 . 0 0 "[ . 1 . 2]" 1 1303 1 123 HIS QB 1 124 GLU H 1.800 . 4.360 2.572 2.450 3.280 . 0 0 "[ . 1 . 2]" 1 1304 1 123 HIS H 1 124 GLU H 1.800 . 4.160 2.654 2.616 2.705 . 0 0 "[ . 1 . 2]" 1 1305 1 124 GLU HA 1 124 GLU HG3 1.800 . 4.190 2.612 2.424 3.627 . 0 0 "[ . 1 . 2]" 1 1306 1 124 GLU HA 1 124 GLU HG2 1.800 . 4.190 2.933 2.319 3.082 . 0 0 "[ . 1 . 2]" 1 1307 1 124 GLU HA 1 127 TRP QB 1.800 . 4.650 3.072 2.570 3.638 . 0 0 "[ . 1 . 2]" 1 1308 1 124 GLU HA 1 127 TRP HD1 1.800 . 5.170 3.140 2.350 3.871 . 0 0 "[ . 1 . 2]" 1 1309 1 124 GLU QB 1 125 GLU H 1.800 . 3.970 2.391 2.079 2.588 . 0 0 "[ . 1 . 2]" 1 1310 1 124 GLU QG 1 125 GLU H 1.800 . 4.790 3.632 3.208 4.236 . 0 0 "[ . 1 . 2]" 1 1311 1 124 GLU H 1 124 GLU QB 1.800 . 3.480 2.269 2.226 2.391 . 0 0 "[ . 1 . 2]" 1 1312 1 124 GLU H 1 124 GLU QG 1.800 . 4.710 3.735 2.194 3.980 . 0 0 "[ . 1 . 2]" 1 1313 1 124 GLU H 1 125 GLU H 1.800 . 4.150 2.820 2.675 3.042 . 0 0 "[ . 1 . 2]" 1 1314 1 125 GLU HA 1 125 GLU QG 1.800 . 3.940 2.639 2.272 2.864 . 0 0 "[ . 1 . 2]" 1 1315 1 125 GLU HA 1 128 ALA MB 1.800 . 3.630 2.596 2.291 2.881 . 0 0 "[ . 1 . 2]" 1 1316 1 125 GLU HA 1 128 ALA H 1.800 . 5.130 3.542 3.277 3.698 . 0 0 "[ . 1 . 2]" 1 1317 1 125 GLU QB 1 126 GLY H 1.800 . 4.290 2.601 2.475 2.728 . 0 0 "[ . 1 . 2]" 1 1318 1 125 GLU QB 1 128 ALA MB 1.800 . 5.250 4.187 3.808 4.550 . 0 0 "[ . 1 . 2]" 1 1319 1 125 GLU H 1 125 GLU QB 1.800 . 3.630 2.320 2.254 2.440 . 0 0 "[ . 1 . 2]" 1 1320 1 125 GLU H 1 125 GLU QG 1.800 . 4.320 3.269 2.095 4.068 . 0 0 "[ . 1 . 2]" 1 1321 1 125 GLU H 1 126 GLY H 1.800 . 4.040 2.583 2.532 2.677 . 0 0 "[ . 1 . 2]" 1 1322 1 126 GLY H 1 127 TRP H 1.800 . 4.910 2.756 2.678 2.860 . 0 0 "[ . 1 . 2]" 1 1323 1 127 TRP QB 1 131 LEU MD1 1.800 . 4.370 2.458 2.146 2.866 . 0 0 "[ . 1 . 2]" 1 1324 1 127 TRP HB3 1 128 ALA H 1.800 . 4.870 3.563 3.471 3.658 . 0 0 "[ . 1 . 2]" 1 1325 1 127 TRP HB2 1 128 ALA H 1.800 . 4.870 2.733 2.640 2.860 . 0 0 "[ . 1 . 2]" 1 1326 1 127 TRP HE3 1 131 LEU MD2 1.800 . 4.620 3.784 3.252 4.263 . 0 0 "[ . 1 . 2]" 1 1327 1 127 TRP HE3 1 131 LEU HG 1.800 . 4.410 3.108 2.578 3.610 . 0 0 "[ . 1 . 2]" 1 1328 1 127 TRP H 1 128 ALA H 1.800 . 4.630 2.675 2.581 2.790 . 0 0 "[ . 1 . 2]" 1 1329 1 127 TRP HZ3 1 130 TYR QB 1.800 . 4.680 3.928 3.698 4.458 . 0 0 "[ . 1 . 2]" 1 1330 1 127 TRP HZ3 1 131 LEU MD2 1.800 . 5.400 4.600 3.883 5.247 . 0 0 "[ . 1 . 2]" 1 1331 1 128 ALA HA 1 131 LEU QB 1.800 . 4.400 2.844 2.496 3.472 . 0 0 "[ . 1 . 2]" 1 1332 1 128 ALA HA 1 131 LEU MD1 1.800 . 4.540 2.771 2.417 3.175 . 0 0 "[ . 1 . 2]" 1 1333 1 128 ALA HA 1 131 LEU H 1.800 . 5.320 3.781 3.594 3.991 . 0 0 "[ . 1 . 2]" 1 1334 1 128 ALA MB 1 129 HIS H 1.800 . 3.850 2.386 2.275 2.540 . 0 0 "[ . 1 . 2]" 1 1335 1 128 ALA MB 1 131 LEU QB 1.800 . 5.420 4.270 3.959 4.728 . 0 0 "[ . 1 . 2]" 1 1336 1 128 ALA H 1 128 ALA MB 1.800 . 3.540 2.227 2.205 2.247 . 0 0 "[ . 1 . 2]" 1 1337 1 128 ALA H 1 129 HIS H 1.800 . 4.550 2.787 2.678 2.922 . 0 0 "[ . 1 . 2]" 1 1338 1 129 HIS HB3 1 130 TYR H 1.800 . 4.630 3.225 2.299 3.900 . 0 0 "[ . 1 . 2]" 1 1339 1 129 HIS HB2 1 130 TYR H 1.800 . 4.630 2.922 2.423 3.959 . 0 0 "[ . 1 . 2]" 1 1340 1 129 HIS H 1 129 HIS HB2 1.800 . 4.000 2.488 2.321 3.630 . 0 0 "[ . 1 . 2]" 1 1341 1 129 HIS H 1 130 TYR H 1.800 . 4.550 2.651 2.501 2.734 . 0 0 "[ . 1 . 2]" 1 1342 1 130 TYR HA 1 133 ARG QB 1.800 . 5.330 2.869 2.523 3.360 . 0 0 "[ . 1 . 2]" 1 1343 1 130 TYR HA 1 133 ARG QD 1.800 . 5.020 3.924 2.465 5.100 0.080 15 0 "[ . 1 . 2]" 1 1344 1 130 TYR HA 1 133 ARG QG 1.800 . 5.290 4.219 2.977 4.956 . 0 0 "[ . 1 . 2]" 1 1345 1 130 TYR HA 1 133 ARG H 1.800 . 4.140 3.585 3.347 3.788 . 0 0 "[ . 1 . 2]" 1 1346 1 130 TYR HB3 1 131 LEU H 1.800 . 5.860 3.188 2.347 3.734 . 0 0 "[ . 1 . 2]" 1 1347 1 130 TYR HB3 1 133 ARG H 1.800 . 6.050 5.490 5.194 5.721 . 0 0 "[ . 1 . 2]" 1 1348 1 130 TYR HB2 1 131 LEU H 1.800 . 5.860 2.787 2.513 3.767 . 0 0 "[ . 1 . 2]" 1 1349 1 130 TYR HB2 1 133 ARG H 1.800 . 6.050 5.704 5.503 5.997 . 0 0 "[ . 1 . 2]" 1 1350 1 130 TYR H 1 131 LEU H 1.800 . 4.710 2.733 2.642 2.783 . 0 0 "[ . 1 . 2]" 1 1351 1 131 LEU HA 1 131 LEU MD1 1.800 . 4.680 3.828 3.805 3.843 . 0 0 "[ . 1 . 2]" 1 1352 1 131 LEU HA 1 131 LEU MD2 1.800 . 3.610 2.192 2.156 2.258 . 0 0 "[ . 1 . 2]" 1 1353 1 131 LEU HA 1 134 LEU QB 1.800 . 4.000 2.603 2.297 2.815 . 0 0 "[ . 1 . 2]" 1 1354 1 131 LEU HA 1 134 LEU MD2 1.800 . 4.690 3.494 3.162 3.728 . 0 0 "[ . 1 . 2]" 1 1355 1 131 LEU HA 1 134 LEU H 1.800 . 4.660 3.507 3.332 3.760 . 0 0 "[ . 1 . 2]" 1 1356 1 131 LEU HA 1 135 THR H 1.800 . 4.860 4.039 3.721 4.364 . 0 0 "[ . 1 . 2]" 1 1357 1 131 LEU QB 1 131 LEU MD1 1.800 . 3.310 2.102 2.085 2.117 . 0 0 "[ . 1 . 2]" 1 1358 1 131 LEU QB 1 132 GLY H 1.800 . 4.480 2.543 2.486 2.602 . 0 0 "[ . 1 . 2]" 1 1359 1 131 LEU HB3 1 131 LEU MD2 1.800 . 4.100 2.220 2.200 2.247 . 0 0 "[ . 1 . 2]" 1 1360 1 131 LEU HB2 1 131 LEU MD2 1.800 . 4.100 3.205 3.176 3.216 . 0 0 "[ . 1 . 2]" 1 1361 1 131 LEU MD2 1 134 LEU MD2 1.800 . 3.960 3.082 2.696 3.535 . 0 0 "[ . 1 . 2]" 1 1362 1 131 LEU H 1 131 LEU MD1 1.800 . 5.050 3.381 3.228 3.467 . 0 0 "[ . 1 . 2]" 1 1363 1 131 LEU H 1 131 LEU MD2 1.800 . 4.870 3.673 3.544 3.936 . 0 0 "[ . 1 . 2]" 1 1364 1 131 LEU H 1 131 LEU HG 1.800 . 4.270 2.340 2.247 2.586 . 0 0 "[ . 1 . 2]" 1 1365 1 131 LEU H 1 132 GLY H 1.800 . 4.380 2.677 2.597 2.723 . 0 0 "[ . 1 . 2]" 1 1366 1 132 GLY QA 1 135 THR H 1.800 . 4.630 3.488 3.380 3.659 . 0 0 "[ . 1 . 2]" 1 1367 1 132 GLY QA 1 136 GLU H 1.800 . 4.990 4.180 3.976 4.396 . 0 0 "[ . 1 . 2]" 1 1368 1 132 GLY HA3 1 135 THR HB 1.800 . 5.030 4.559 4.312 4.906 . 0 0 "[ . 1 . 2]" 1 1369 1 132 GLY HA2 1 135 THR HB 1.800 . 5.030 3.050 2.774 3.402 . 0 0 "[ . 1 . 2]" 1 1370 1 132 GLY H 1 133 ARG H 1.800 . 4.130 2.720 2.568 2.830 . 0 0 "[ . 1 . 2]" 1 1371 1 133 ARG HA 1 133 ARG QD 1.800 . 5.420 3.685 2.225 4.187 . 0 0 "[ . 1 . 2]" 1 1372 1 133 ARG HA 1 133 ARG HE 1.800 . 6.050 4.470 2.367 5.585 . 0 0 "[ . 1 . 2]" 1 1373 1 133 ARG HA 1 136 GLU HB3 1.800 . 5.570 4.057 2.904 4.800 . 0 0 "[ . 1 . 2]" 1 1374 1 133 ARG HA 1 136 GLU HB2 1.800 . 5.570 3.293 2.766 4.983 . 0 0 "[ . 1 . 2]" 1 1375 1 133 ARG HA 1 136 GLU H 1.800 . 5.280 3.537 3.272 3.736 . 0 0 "[ . 1 . 2]" 1 1376 1 133 ARG HA 1 137 VAL H 1.800 . 6.050 4.343 3.864 4.592 . 0 0 "[ . 1 . 2]" 1 1377 1 133 ARG QB 1 134 LEU H 1.800 . 4.580 2.549 2.452 2.629 . 0 0 "[ . 1 . 2]" 1 1378 1 133 ARG H 1 133 ARG QG 1.800 . 4.190 3.119 2.154 4.061 . 0 0 "[ . 1 . 2]" 1 1379 1 133 ARG H 1 134 LEU H 1.800 . 4.130 2.643 2.598 2.724 . 0 0 "[ . 1 . 2]" 1 1380 1 134 LEU HA 1 134 LEU MD1 1.800 . 3.660 2.094 2.071 2.135 . 0 0 "[ . 1 . 2]" 1 1381 1 134 LEU HA 1 134 LEU MD2 1.800 . 5.280 3.805 3.789 3.839 . 0 0 "[ . 1 . 2]" 1 1382 1 134 LEU HA 1 137 VAL HB 1.800 . 4.650 2.818 2.355 3.533 . 0 0 "[ . 1 . 2]" 1 1383 1 134 LEU HA 1 137 VAL MG1 1.800 . 5.590 4.163 3.667 4.833 . 0 0 "[ . 1 . 2]" 1 1384 1 134 LEU HA 1 137 VAL MG2 1.800 . 4.470 3.217 2.761 4.018 . 0 0 "[ . 1 . 2]" 1 1385 1 134 LEU HA 1 137 VAL H 1.800 . 4.770 3.496 3.338 3.811 . 0 0 "[ . 1 . 2]" 1 1386 1 134 LEU QB 1 135 THR H 1.800 . 4.210 2.558 2.481 2.647 . 0 0 "[ . 1 . 2]" 1 1387 1 134 LEU HB3 1 134 LEU MD2 1.800 . 4.410 2.375 2.339 2.432 . 0 0 "[ . 1 . 2]" 1 1388 1 134 LEU HB2 1 134 LEU MD2 1.800 . 4.410 2.346 2.264 2.398 . 0 0 "[ . 1 . 2]" 1 1389 1 134 LEU MD1 1 135 THR H 1.800 . 5.630 4.375 4.298 4.445 . 0 0 "[ . 1 . 2]" 1 1390 1 134 LEU MD1 1 137 VAL HB 1.800 . 4.580 2.797 2.506 3.615 . 0 0 "[ . 1 . 2]" 1 1391 1 134 LEU MD1 1 137 VAL MG1 1.800 . 4.720 3.327 2.808 4.112 . 0 0 "[ . 1 . 2]" 1 1392 1 134 LEU MD1 1 137 VAL MG2 1.800 . 5.150 3.681 3.213 4.423 . 0 0 "[ . 1 . 2]" 1 1393 1 134 LEU MD1 1 137 VAL H 1.800 . 6.050 4.288 4.042 4.706 . 0 0 "[ . 1 . 2]" 1 1394 1 134 LEU MD1 1 138 ALA MB 1.800 . 4.370 3.279 2.309 3.975 . 0 0 "[ . 1 . 2]" 1 1395 1 134 LEU MD1 1 138 ALA H 1.800 . 4.920 3.503 3.223 3.948 . 0 0 "[ . 1 . 2]" 1 1396 1 134 LEU MD2 1 135 THR H 1.800 . 5.170 4.363 4.253 4.482 . 0 0 "[ . 1 . 2]" 1 1397 1 134 LEU HG 1 135 THR H 1.800 . 5.070 3.682 3.599 3.766 . 0 0 "[ . 1 . 2]" 1 1398 1 134 LEU H 1 134 LEU QB 1.800 . 3.820 2.271 2.261 2.289 . 0 0 "[ . 1 . 2]" 1 1399 1 134 LEU H 1 134 LEU MD1 1.800 . 5.100 4.057 4.016 4.086 . 0 0 "[ . 1 . 2]" 1 1400 1 134 LEU H 1 134 LEU MD2 1.800 . 4.940 4.301 4.280 4.339 . 0 0 "[ . 1 . 2]" 1 1401 1 134 LEU H 1 134 LEU HG 1.800 . 5.300 4.466 4.448 4.482 . 0 0 "[ . 1 . 2]" 1 1402 1 134 LEU H 1 135 THR H 1.800 . 4.410 2.687 2.584 2.762 . 0 0 "[ . 1 . 2]" 1 1403 1 135 THR HA 1 135 THR HG1 1.800 . 4.440 2.184 2.022 2.303 . 0 0 "[ . 1 . 2]" 1 1404 1 135 THR HA 1 135 THR MG 1.800 . 3.500 2.322 2.279 2.349 . 0 0 "[ . 1 . 2]" 1 1405 1 135 THR HA 1 138 ALA MB 1.800 . 3.880 2.701 2.289 3.047 . 0 0 "[ . 1 . 2]" 1 1406 1 135 THR HA 1 138 ALA H 1.800 . 4.870 3.556 3.369 3.729 . 0 0 "[ . 1 . 2]" 1 1407 1 135 THR HA 1 139 ALA MB 1.800 . 5.420 4.475 3.661 5.257 . 0 0 "[ . 1 . 2]" 1 1408 1 135 THR HA 1 139 ALA H 1.800 . 4.820 4.098 3.521 4.777 . 0 0 "[ . 1 . 2]" 1 1409 1 135 THR HB 1 136 GLU H 1.800 . 3.900 2.510 2.361 2.847 . 0 0 "[ . 1 . 2]" 1 1410 1 135 THR HG1 1 136 GLU H 1.800 . 4.720 3.334 3.201 3.524 . 0 0 "[ . 1 . 2]" 1 1411 1 135 THR MG 1 136 GLU HA 1.800 . 4.750 3.552 3.399 3.823 . 0 0 "[ . 1 . 2]" 1 1412 1 135 THR MG 1 136 GLU H 1.800 . 4.260 3.449 3.272 3.653 . 0 0 "[ . 1 . 2]" 1 1413 1 135 THR H 1 135 THR HB 1.800 . 3.690 2.573 2.486 2.711 . 0 0 "[ . 1 . 2]" 1 1414 1 135 THR H 1 135 THR HG1 1.800 . 3.490 2.725 2.038 3.229 . 0 0 "[ . 1 . 2]" 1 1415 1 135 THR H 1 135 THR MG 1.800 . 4.220 3.759 3.746 3.770 . 0 0 "[ . 1 . 2]" 1 1416 1 135 THR H 1 136 GLU H 1.800 . 3.790 2.742 2.569 2.808 . 0 0 "[ . 1 . 2]" 1 1417 1 136 GLU HA 1 136 GLU HG3 1.800 . 4.350 3.000 2.432 3.746 . 0 0 "[ . 1 . 2]" 1 1418 1 136 GLU HA 1 136 GLU HG2 1.800 . 4.350 2.894 2.448 3.707 . 0 0 "[ . 1 . 2]" 1 1419 1 136 GLU HA 1 138 ALA H 1.800 . 5.890 4.588 4.425 4.719 . 0 0 "[ . 1 . 2]" 1 1420 1 136 GLU HA 1 139 ALA MB 1.800 . 3.930 2.877 2.442 3.417 . 0 0 "[ . 1 . 2]" 1 1421 1 136 GLU HA 1 139 ALA H 1.800 . 4.270 3.550 3.433 3.712 . 0 0 "[ . 1 . 2]" 1 1422 1 136 GLU QB 1 137 VAL MG2 1.800 . 4.260 3.163 2.984 4.090 . 0 0 "[ . 1 . 2]" 1 1423 1 136 GLU HB3 1 137 VAL H 1.800 . 4.220 3.198 2.239 4.032 . 0 0 "[ . 1 . 2]" 1 1424 1 136 GLU HB2 1 137 VAL H 1.800 . 4.220 3.048 2.462 3.881 . 0 0 "[ . 1 . 2]" 1 1425 1 136 GLU QG 1 137 VAL H 1.800 . 5.250 3.793 2.021 4.152 . 0 0 "[ . 1 . 2]" 1 1426 1 136 GLU H 1 136 GLU HB3 1.800 . 4.200 3.208 2.580 3.614 . 0 0 "[ . 1 . 2]" 1 1427 1 136 GLU H 1 136 GLU HB2 1.800 . 4.200 2.523 2.424 3.608 . 0 0 "[ . 1 . 2]" 1 1428 1 136 GLU H 1 136 GLU QG 1.800 . 4.100 2.791 1.768 4.071 0.032 14 0 "[ . 1 . 2]" 1 1429 1 136 GLU H 1 137 VAL H 1.800 . 3.950 2.730 2.617 2.847 . 0 0 "[ . 1 . 2]" 1 1430 1 137 VAL HA 1 137 VAL MG1 1.800 . 3.600 2.391 2.358 2.480 . 0 0 "[ . 1 . 2]" 1 1431 1 137 VAL HA 1 137 VAL MG2 1.800 . 3.490 2.322 2.230 2.385 . 0 0 "[ . 1 . 2]" 1 1432 1 137 VAL HA 1 140 GLY H 1.800 . 4.220 3.500 3.179 4.300 0.080 10 0 "[ . 1 . 2]" 1 1433 1 137 VAL HA 1 141 ARG H 1.800 . 4.330 4.028 2.489 4.393 0.063 11 0 "[ . 1 . 2]" 1 1434 1 137 VAL HB 1 138 ALA H 1.800 . 3.860 2.534 2.467 2.609 . 0 0 "[ . 1 . 2]" 1 1435 1 137 VAL MG1 1 138 ALA HA 1.800 . 4.170 3.328 3.210 3.403 . 0 0 "[ . 1 . 2]" 1 1436 1 137 VAL MG1 1 138 ALA H 1.800 . 4.300 3.247 3.120 3.332 . 0 0 "[ . 1 . 2]" 1 1437 1 137 VAL MG1 1 140 GLY H 1.800 . 5.220 4.304 3.905 4.563 . 0 0 "[ . 1 . 2]" 1 1438 1 137 VAL MG2 1 138 ALA H 1.800 . 4.760 3.882 3.836 3.974 . 0 0 "[ . 1 . 2]" 1 1439 1 137 VAL MG2 1 142 ASP HA 1.800 . 6.050 4.980 3.975 6.124 0.074 15 0 "[ . 1 . 2]" 1 1440 1 137 VAL MG2 1 143 PRO QD 1.800 . 3.430 2.921 2.157 3.572 0.142 15 0 "[ . 1 . 2]" 1 1441 1 137 VAL MG2 1 143 PRO HG2 1.800 . 4.390 3.529 2.176 4.446 0.056 19 0 "[ . 1 . 2]" 1 1442 1 137 VAL H 1 137 VAL HB 1.800 . 3.590 2.427 2.346 2.460 . 0 0 "[ . 1 . 2]" 1 1443 1 137 VAL H 1 137 VAL MG1 1.800 . 4.290 3.758 3.740 3.771 . 0 0 "[ . 1 . 2]" 1 1444 1 137 VAL H 1 137 VAL MG2 1.800 . 3.550 2.224 2.140 2.381 . 0 0 "[ . 1 . 2]" 1 1445 1 137 VAL H 1 138 ALA H 1.800 . 3.840 2.690 2.639 2.744 . 0 0 "[ . 1 . 2]" 1 1446 1 138 ALA HA 1 139 ALA H 1.800 . 3.930 3.526 3.462 3.560 . 0 0 "[ . 1 . 2]" 1 1447 1 138 ALA MB 1 139 ALA H 1.800 . 3.500 2.622 2.450 2.880 . 0 0 "[ . 1 . 2]" 1 1448 1 138 ALA H 1 138 ALA MB 1.800 . 3.180 2.221 2.184 2.259 . 0 0 "[ . 1 . 2]" 1 1449 1 138 ALA H 1 139 ALA H 1.800 . 3.540 2.654 2.482 2.737 . 0 0 "[ . 1 . 2]" 1 1450 1 139 ALA MB 1 140 GLY H 1.800 . 4.000 3.279 3.164 3.558 . 0 0 "[ . 1 . 2]" 1 1451 1 139 ALA H 1 139 ALA MB 1.800 . 3.360 2.286 2.204 2.435 . 0 0 "[ . 1 . 2]" 1 1452 1 139 ALA H 1 140 GLY H 1.800 . 3.390 2.485 2.243 2.799 . 0 0 "[ . 1 . 2]" 1 1453 1 140 GLY H 1 141 ARG H 1.800 . 4.100 3.760 2.343 4.325 0.225 3 0 "[ . 1 . 2]" 1 1454 1 141 ARG HA 1 141 ARG QG 1.800 . 3.780 2.515 2.283 3.324 . 0 0 "[ . 1 . 2]" 1 1455 1 141 ARG HA 1 142 ASP H 1.800 . 3.600 2.656 2.179 3.561 . 0 0 "[ . 1 . 2]" 1 1456 1 141 ARG QB 1 141 ARG QD 1.800 . 3.410 2.249 2.123 2.313 . 0 0 "[ . 1 . 2]" 1 1457 1 141 ARG QB 1 142 ASP H 1.800 . 4.000 2.757 1.770 4.047 0.047 16 0 "[ . 1 . 2]" 1 1458 1 141 ARG QG 1 142 ASP H 1.800 . 4.760 3.356 1.779 4.463 0.021 12 0 "[ . 1 . 2]" 1 1459 1 141 ARG H 1 141 ARG QB 1.800 . 3.540 2.745 2.322 3.380 . 0 0 "[ . 1 . 2]" 1 1460 1 141 ARG H 1 141 ARG QG 1.800 . 4.200 3.031 1.811 4.422 0.222 18 0 "[ . 1 . 2]" 1 1461 1 141 ARG H 1 142 ASP H 1.800 . 5.220 3.880 1.778 4.693 0.022 6 0 "[ . 1 . 2]" 1 1462 1 142 ASP H 1 142 ASP QB 1.800 . 3.390 2.922 2.195 3.534 0.144 9 0 "[ . 1 . 2]" 1 1463 1 142 ASP H 1 143 PRO QD 1.800 . 4.800 2.685 1.751 4.423 0.049 18 0 "[ . 1 . 2]" 1 1464 1 143 PRO QB 1 144 GLY H 1.800 . 4.040 2.992 2.347 3.680 . 0 0 "[ . 1 . 2]" 1 1465 1 143 PRO HG3 1 144 GLY H 1.800 . 5.700 5.074 4.489 5.680 . 0 0 "[ . 1 . 2]" 1 1466 1 143 PRO HG2 1 144 GLY H 1.800 . 5.700 4.856 3.278 5.801 0.101 8 0 "[ . 1 . 2]" 1 1467 1 144 GLY QA 1 145 PRO HA 1.800 . 4.690 4.094 4.034 4.266 . 0 0 "[ . 1 . 2]" 1 1468 1 144 GLY QA 1 145 PRO QD 1.800 . 3.260 2.117 2.012 2.369 . 0 0 "[ . 1 . 2]" 1 1469 1 144 GLY H 1 145 PRO QD 1.800 . 4.300 3.445 1.747 4.340 0.053 5 0 "[ . 1 . 2]" 1 1470 1 145 PRO HA 1 146 ASP QB 1.800 . 5.010 4.341 3.919 4.889 . 0 0 "[ . 1 . 2]" 1 1471 1 145 PRO HA 1 146 ASP H 1.800 . 3.600 2.755 2.176 3.546 . 0 0 "[ . 1 . 2]" 1 1472 1 145 PRO HB3 1 146 ASP H 1.800 . 5.090 3.674 2.403 4.621 . 0 0 "[ . 1 . 2]" 1 1473 1 145 PRO HB2 1 146 ASP H 1.800 . 5.090 2.981 1.828 4.154 . 0 0 "[ . 1 . 2]" 1 1474 1 145 PRO QG 1 147 PRO HD3 1.800 . 5.140 3.673 2.451 5.419 0.279 9 0 "[ . 1 . 2]" 1 1475 1 145 PRO QG 1 147 PRO HD2 1.800 . 5.140 4.370 2.310 5.260 0.120 1 0 "[ . 1 . 2]" 1 1476 1 145 PRO QG 1 147 PRO QG 1.800 . 5.000 4.216 2.804 5.080 0.080 19 0 "[ . 1 . 2]" 1 1477 1 146 ASP HA 1 147 PRO HD3 1.800 . 3.840 3.109 2.355 3.897 0.057 9 0 "[ . 1 . 2]" 1 1478 1 146 ASP HA 1 147 PRO HD2 1.800 . 3.840 2.638 2.267 4.043 0.203 14 0 "[ . 1 . 2]" 1 1479 1 146 ASP H 1 146 ASP HB3 1.800 . 4.190 3.510 2.766 4.052 . 0 0 "[ . 1 . 2]" 1 1480 1 146 ASP H 1 146 ASP HB2 1.800 . 4.190 3.404 2.370 4.094 . 0 0 "[ . 1 . 2]" 1 1481 1 148 PHE H 1 149 TYR H 1.800 . 4.540 3.482 1.594 4.632 0.206 14 0 "[ . 1 . 2]" 1 1482 1 149 TYR HA 1 149 TYR QD 1.800 . 4.350 2.705 2.537 2.913 . 0 0 "[ . 1 . 2]" 1 1483 1 149 TYR H 1 149 TYR HB3 1.800 . 4.140 3.285 2.465 4.082 . 0 0 "[ . 1 . 2]" 1 1484 1 149 TYR H 1 149 TYR HB2 1.800 . 4.140 2.923 2.325 3.607 . 0 0 "[ . 1 . 2]" 1 1485 1 151 ARG HA 1 151 ARG QD 1.800 . 5.320 3.867 2.222 4.521 . 0 0 "[ . 1 . 2]" 1 1486 1 151 ARG HA 1 151 ARG QG 1.800 . 3.920 2.663 2.260 3.331 . 0 0 "[ . 1 . 2]" 1 1487 1 151 ARG QB 1 151 ARG QD 1.800 . 3.200 2.273 2.121 2.701 . 0 0 "[ . 1 . 2]" 1 1488 1 151 ARG QB 1 152 ARG H 1.800 . 4.300 3.187 1.791 3.985 0.009 17 0 "[ . 1 . 2]" 1 1489 1 151 ARG H 1 151 ARG QB 1.800 . 3.900 2.689 2.270 3.333 . 0 0 "[ . 1 . 2]" 1 1490 1 151 ARG H 1 151 ARG HG3 1.800 . 5.280 3.401 2.281 5.106 . 0 0 "[ . 1 . 2]" 1 1491 1 151 ARG H 1 151 ARG HG2 1.800 . 5.280 3.301 1.777 4.863 0.023 9 0 "[ . 1 . 2]" 1 1492 1 159 HIS HA 1 160 HIS H 1.800 . 3.840 2.674 2.159 3.565 . 0 0 "[ . 1 . 2]" 1 1493 1 159 HIS QB 1 160 HIS H 1.800 . 4.350 3.178 1.813 4.022 . 0 0 "[ . 1 . 2]" 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 80 _Distance_constraint_stats_list.Viol_count 266 _Distance_constraint_stats_list.Viol_total 249.878 _Distance_constraint_stats_list.Viol_max 0.248 _Distance_constraint_stats_list.Viol_rms 0.0250 _Distance_constraint_stats_list.Viol_average_all_restraints 0.0078 _Distance_constraint_stats_list.Viol_average_violations_only 0.0470 _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 11 VAL 0.229 0.058 6 0 "[ . 1 . 2]" 1 13 ARG 0.264 0.097 6 0 "[ . 1 . 2]" 1 22 ALA 0.030 0.030 20 0 "[ . 1 . 2]" 1 23 ALA 0.097 0.052 2 0 "[ . 1 . 2]" 1 24 VAL 0.122 0.038 17 0 "[ . 1 . 2]" 1 25 PHE 0.245 0.066 12 0 "[ . 1 . 2]" 1 26 ALA 0.030 0.030 20 0 "[ . 1 . 2]" 1 27 LEU 0.097 0.052 2 0 "[ . 1 . 2]" 1 28 MET 0.122 0.038 17 0 "[ . 1 . 2]" 1 29 THR 0.245 0.066 12 0 "[ . 1 . 2]" 1 33 LYS 0.068 0.051 3 0 "[ . 1 . 2]" 1 34 ILE 1.603 0.248 2 0 "[ . 1 . 2]" 1 36 ARG 0.068 0.051 3 0 "[ . 1 . 2]" 1 37 TRP 1.603 0.248 2 0 "[ . 1 . 2]" 1 68 GLU 2.607 0.232 10 0 "[ . 1 . 2]" 1 70 VAL 0.523 0.113 6 0 "[ . 1 . 2]" 1 74 ARG 0.523 0.113 6 0 "[ . 1 . 2]" 1 75 LEU 0.071 0.050 20 0 "[ . 1 . 2]" 1 76 ALA 2.607 0.232 10 0 "[ . 1 . 2]" 1 77 TYR 1.328 0.198 10 0 "[ . 1 . 2]" 1 93 LEU 1.356 0.212 13 0 "[ . 1 . 2]" 1 94 VAL 1.328 0.198 10 0 "[ . 1 . 2]" 1 95 GLU 0.494 0.090 18 0 "[ . 1 . 2]" 1 96 ILE 0.071 0.050 20 0 "[ . 1 . 2]" 1 97 ASP 0.513 0.083 2 0 "[ . 1 . 2]" 1 99 ILE 0.434 0.100 1 0 "[ . 1 . 2]" 1 106 LEU 0.434 0.100 1 0 "[ . 1 . 2]" 1 108 ARG 0.513 0.083 2 0 "[ . 1 . 2]" 1 109 LEU 0.264 0.097 6 0 "[ . 1 . 2]" 1 110 THR 0.494 0.090 18 0 "[ . 1 . 2]" 1 111 HIS 0.229 0.058 6 0 "[ . 1 . 2]" 1 112 SER 1.356 0.212 13 0 "[ . 1 . 2]" 1 117 ALA 0.229 0.076 12 0 "[ . 1 . 2]" 1 118 GLU 0.374 0.086 18 0 "[ . 1 . 2]" 1 119 GLN 0.163 0.060 4 0 "[ . 1 . 2]" 1 120 CYS 0.120 0.045 7 0 "[ . 1 . 2]" 1 121 ALA 0.702 0.108 18 0 "[ . 1 . 2]" 1 122 GLY 0.395 0.086 18 0 "[ . 1 . 2]" 1 123 HIS 0.401 0.060 4 0 "[ . 1 . 2]" 1 124 GLU 0.227 0.052 13 0 "[ . 1 . 2]" 1 125 GLU 0.829 0.108 18 0 "[ . 1 . 2]" 1 126 GLY 0.050 0.029 15 0 "[ . 1 . 2]" 1 127 TRP 0.372 0.053 6 0 "[ . 1 . 2]" 1 128 ALA 0.166 0.058 17 0 "[ . 1 . 2]" 1 129 HIS 0.429 0.073 3 0 "[ . 1 . 2]" 1 130 TYR 0.164 0.063 9 0 "[ . 1 . 2]" 1 131 LEU 0.133 0.049 18 0 "[ . 1 . 2]" 1 132 GLY 0.058 0.058 17 0 "[ . 1 . 2]" 1 133 ARG 0.073 0.073 3 0 "[ . 1 . 2]" 1 134 LEU 0.135 0.063 9 0 "[ . 1 . 2]" 1 135 THR 0.000 0.000 . 0 "[ . 1 . 2]" stop_ loop_ _Distance_constraint_stats.Restraint_ID _Distance_constraint_stats.Atom_1_entity_assembly_ID _Distance_constraint_stats.Atom_1_comp_index_ID _Distance_constraint_stats.Atom_1_comp_ID _Distance_constraint_stats.Atom_1_ID _Distance_constraint_stats.Atom_2_entity_assembly_ID _Distance_constraint_stats.Atom_2_comp_index_ID _Distance_constraint_stats.Atom_2_comp_ID _Distance_constraint_stats.Atom_2_ID _Distance_constraint_stats.Node_1_distance_val _Distance_constraint_stats.Node_1_distance_lower_bound_val _Distance_constraint_stats.Node_1_distance_upper_bound_val _Distance_constraint_stats.Distance_average _Distance_constraint_stats.Distance_minimum _Distance_constraint_stats.Distance_maximum _Distance_constraint_stats.Max_violation _Distance_constraint_stats.Max_violation_model_number _Distance_constraint_stats.Over_cutoff_violation_count _Distance_constraint_stats.Over_cutoff_viol_per_model _Distance_constraint_stats.Distance_constraint_stats_ID 1 1 11 VAL O 1 111 HIS H 1.700 . 2.300 2.120 1.851 2.358 0.058 6 0 "[ . 1 . 2]" 2 2 1 11 VAL O 1 111 HIS N 2.700 2.700 3.300 3.058 2.807 3.303 0.003 6 0 "[ . 1 . 2]" 2 3 1 11 VAL H 1 111 HIS O 1.700 . 2.300 2.077 1.770 2.349 0.049 1 0 "[ . 1 . 2]" 2 4 1 11 VAL N 1 111 HIS O 2.700 2.700 3.300 3.027 2.747 3.302 0.002 1 0 "[ . 1 . 2]" 2 5 1 13 ARG H 1 109 LEU O 1.700 . 2.300 2.172 1.902 2.397 0.097 6 0 "[ . 1 . 2]" 2 6 1 13 ARG N 1 109 LEU O 2.700 2.700 3.300 3.082 2.876 3.336 0.036 6 0 "[ . 1 . 2]" 2 7 1 13 ARG O 1 109 LEU H 1.700 . 2.300 2.108 1.825 2.355 0.055 6 0 "[ . 1 . 2]" 2 8 1 13 ARG O 1 109 LEU N 2.700 2.700 3.300 3.065 2.790 3.318 0.018 6 0 "[ . 1 . 2]" 2 9 1 93 LEU H 1 112 SER O 1.700 . 2.300 2.124 1.800 2.419 0.119 2 0 "[ . 1 . 2]" 2 10 1 93 LEU N 1 112 SER O 2.700 2.700 3.300 3.026 2.725 3.294 . 0 0 "[ . 1 . 2]" 2 11 1 93 LEU O 1 112 SER H 1.700 . 2.300 2.294 1.901 2.512 0.212 13 0 "[ . 1 . 2]" 2 12 1 93 LEU O 1 112 SER N 2.700 2.700 3.300 3.237 2.826 3.417 0.117 13 0 "[ . 1 . 2]" 2 13 1 95 GLU H 1 110 THR O 1.700 . 2.300 2.168 1.848 2.390 0.090 18 0 "[ . 1 . 2]" 2 14 1 95 GLU N 1 110 THR O 2.700 2.700 3.300 3.080 2.752 3.319 0.019 8 0 "[ . 1 . 2]" 2 15 1 95 GLU O 1 110 THR H 1.700 . 2.300 2.088 1.764 2.346 0.046 1 0 "[ . 1 . 2]" 2 16 1 95 GLU O 1 110 THR N 2.700 2.700 3.300 3.035 2.733 3.319 0.019 1 0 "[ . 1 . 2]" 2 17 1 97 ASP H 1 108 ARG O 1.700 . 2.300 2.212 1.984 2.383 0.083 2 0 "[ . 1 . 2]" 2 18 1 97 ASP N 1 108 ARG O 2.700 2.700 3.300 3.162 2.944 3.360 0.060 2 0 "[ . 1 . 2]" 2 19 1 97 ASP O 1 108 ARG H 1.700 . 2.300 2.231 1.997 2.357 0.057 12 0 "[ . 1 . 2]" 2 20 1 97 ASP O 1 108 ARG N 2.700 2.700 3.300 3.184 2.971 3.303 0.003 7 0 "[ . 1 . 2]" 2 21 1 99 ILE H 1 106 LEU O 1.700 . 2.300 2.164 1.908 2.333 0.033 7 0 "[ . 1 . 2]" 2 22 1 99 ILE N 1 106 LEU O 2.700 2.700 3.300 3.118 2.880 3.283 . 0 0 "[ . 1 . 2]" 2 23 1 99 ILE O 1 106 LEU H 1.700 . 2.300 2.174 1.774 2.400 0.100 1 0 "[ . 1 . 2]" 2 24 1 99 ILE O 1 106 LEU N 2.700 2.700 3.300 3.031 2.708 3.273 . 0 0 "[ . 1 . 2]" 2 25 1 77 TYR H 1 94 VAL O 1.700 . 2.300 2.199 1.873 2.498 0.198 10 0 "[ . 1 . 2]" 2 26 1 77 TYR N 1 94 VAL O 2.700 2.700 3.300 3.099 2.834 3.313 0.013 5 0 "[ . 1 . 2]" 2 27 1 77 TYR O 1 94 VAL H 1.700 . 2.300 2.296 1.823 2.491 0.191 12 0 "[ . 1 . 2]" 2 28 1 77 TYR O 1 94 VAL N 2.700 2.700 3.300 3.163 2.723 3.335 0.035 17 0 "[ . 1 . 2]" 2 29 1 75 LEU H 1 96 ILE O 1.700 . 2.300 2.056 1.717 2.316 0.016 19 0 "[ . 1 . 2]" 2 30 1 75 LEU N 1 96 ILE O 2.700 2.700 3.300 2.991 2.695 3.271 0.005 9 0 "[ . 1 . 2]" 2 31 1 75 LEU O 1 96 ILE H 1.700 . 2.300 1.968 1.742 2.193 . 0 0 "[ . 1 . 2]" 2 32 1 75 LEU O 1 96 ILE N 2.700 2.700 3.300 2.888 2.650 3.172 0.050 20 0 "[ . 1 . 2]" 2 33 1 68 GLU H 1 76 ALA O 1.700 . 2.300 2.360 1.931 2.532 0.232 10 0 "[ . 1 . 2]" 2 34 1 68 GLU N 1 76 ALA O 2.700 2.700 3.300 3.296 2.836 3.424 0.124 7 0 "[ . 1 . 2]" 2 35 1 68 GLU O 1 76 ALA H 1.700 . 2.300 2.121 1.685 2.387 0.087 9 0 "[ . 1 . 2]" 2 36 1 68 GLU O 1 76 ALA N 2.700 2.700 3.300 3.020 2.647 3.257 0.053 19 0 "[ . 1 . 2]" 2 37 1 70 VAL H 1 74 ARG O 1.700 . 2.300 2.279 2.049 2.413 0.113 6 0 "[ . 1 . 2]" 2 38 1 70 VAL N 1 74 ARG O 2.700 2.700 3.300 2.939 2.698 3.080 0.002 16 0 "[ . 1 . 2]" 2 39 1 22 ALA O 1 26 ALA H 1.700 . 2.300 1.979 1.728 2.183 . 0 0 "[ . 1 . 2]" 2 40 1 22 ALA O 1 26 ALA N 2.700 2.700 3.300 2.922 2.670 3.137 0.030 20 0 "[ . 1 . 2]" 2 41 1 23 ALA O 1 27 LEU H 1.700 . 2.300 2.225 1.984 2.352 0.052 2 0 "[ . 1 . 2]" 2 42 1 23 ALA O 1 27 LEU N 2.700 2.700 3.300 3.151 2.870 3.273 . 0 0 "[ . 1 . 2]" 2 43 1 24 VAL O 1 28 MET H 1.700 . 2.300 2.185 1.795 2.338 0.038 17 0 "[ . 1 . 2]" 2 44 1 24 VAL O 1 28 MET N 2.700 2.700 3.300 3.115 2.728 3.265 . 0 0 "[ . 1 . 2]" 2 45 1 25 PHE O 1 29 THR H 1.700 . 2.300 2.083 1.830 2.333 0.033 20 0 "[ . 1 . 2]" 2 46 1 25 PHE O 1 29 THR N 2.700 2.700 3.300 2.781 2.634 2.999 0.066 12 0 "[ . 1 . 2]" 2 47 1 33 LYS O 1 36 ARG H 1.700 . 2.300 2.124 1.702 2.317 0.017 1 0 "[ . 1 . 2]" 2 48 1 33 LYS O 1 36 ARG N 2.700 2.700 3.300 2.977 2.649 3.109 0.051 3 0 "[ . 1 . 2]" 2 49 1 34 ILE O 1 37 TRP H 1.700 . 2.300 2.290 1.757 2.548 0.248 2 0 "[ . 1 . 2]" 2 50 1 34 ILE O 1 37 TRP N 2.700 2.700 3.300 3.091 2.563 3.370 0.137 9 0 "[ . 1 . 2]" 2 51 1 117 ALA O 1 121 ALA H 1.700 . 2.300 2.092 1.716 2.376 0.076 12 0 "[ . 1 . 2]" 2 52 1 117 ALA O 1 121 ALA N 2.700 2.700 3.300 3.035 2.688 3.305 0.012 17 0 "[ . 1 . 2]" 2 53 1 118 GLU O 1 122 GLY H 1.700 . 2.300 2.169 1.806 2.386 0.086 18 0 "[ . 1 . 2]" 2 54 1 118 GLU O 1 122 GLY N 2.700 2.700 3.300 3.114 2.734 3.357 0.057 4 0 "[ . 1 . 2]" 2 55 1 119 GLN O 1 123 HIS H 1.700 . 2.300 1.834 1.721 2.126 . 0 0 "[ . 1 . 2]" 2 56 1 119 GLN O 1 123 HIS N 2.700 2.700 3.300 2.762 2.640 3.051 0.060 4 0 "[ . 1 . 2]" 2 57 1 120 CYS O 1 124 GLU H 1.700 . 2.300 1.917 1.730 2.147 . 0 0 "[ . 1 . 2]" 2 58 1 120 CYS O 1 124 GLU N 2.700 2.700 3.300 2.851 2.655 3.111 0.045 7 0 "[ . 1 . 2]" 2 59 1 121 ALA O 1 125 GLU H 1.700 . 2.300 2.265 2.019 2.408 0.108 18 0 "[ . 1 . 2]" 2 60 1 121 ALA O 1 125 GLU N 2.700 2.700 3.300 3.215 2.932 3.349 0.049 18 0 "[ . 1 . 2]" 2 61 1 122 GLY O 1 126 GLY H 1.700 . 2.300 2.024 1.822 2.321 0.021 18 0 "[ . 1 . 2]" 2 62 1 122 GLY O 1 126 GLY N 2.700 2.700 3.300 2.914 2.703 3.246 . 0 0 "[ . 1 . 2]" 2 63 1 123 HIS O 1 127 TRP H 1.700 . 2.300 1.817 1.676 2.334 0.034 4 0 "[ . 1 . 2]" 2 64 1 123 HIS O 1 127 TRP N 2.700 2.700 3.300 2.785 2.647 3.277 0.053 6 0 "[ . 1 . 2]" 2 65 1 124 GLU O 1 128 ALA H 1.700 . 2.300 2.187 2.016 2.352 0.052 13 0 "[ . 1 . 2]" 2 66 1 124 GLU O 1 128 ALA N 2.700 2.700 3.300 3.086 2.884 3.276 . 0 0 "[ . 1 . 2]" 2 67 1 125 GLU O 1 129 HIS H 1.700 . 2.300 2.249 2.016 2.365 0.065 18 0 "[ . 1 . 2]" 2 68 1 125 GLU O 1 129 HIS N 2.700 2.700 3.300 3.188 2.984 3.312 0.012 12 0 "[ . 1 . 2]" 2 69 1 126 GLY O 1 130 TYR H 1.700 . 2.300 2.046 1.786 2.329 0.029 15 0 "[ . 1 . 2]" 2 70 1 126 GLY O 1 130 TYR N 2.700 2.700 3.300 3.005 2.705 3.289 . 0 0 "[ . 1 . 2]" 2 71 1 127 TRP O 1 131 LEU H 1.700 . 2.300 1.777 1.699 1.899 0.001 18 0 "[ . 1 . 2]" 2 72 1 127 TRP O 1 131 LEU N 2.700 2.700 3.300 2.732 2.651 2.873 0.049 18 0 "[ . 1 . 2]" 2 73 1 128 ALA O 1 132 GLY H 1.700 . 2.300 2.077 1.827 2.358 0.058 17 0 "[ . 1 . 2]" 2 74 1 128 ALA O 1 132 GLY N 2.700 2.700 3.300 2.990 2.743 3.300 0.000 17 0 "[ . 1 . 2]" 2 75 1 129 HIS O 1 133 ARG H 1.700 . 2.300 2.001 1.793 2.373 0.073 3 0 "[ . 1 . 2]" 2 76 1 129 HIS O 1 133 ARG N 2.700 2.700 3.300 2.947 2.730 3.281 . 0 0 "[ . 1 . 2]" 2 77 1 130 TYR O 1 134 LEU H 1.700 . 2.300 1.974 1.720 2.292 . 0 0 "[ . 1 . 2]" 2 78 1 130 TYR O 1 134 LEU N 2.700 2.700 3.300 2.907 2.637 3.243 0.063 9 0 "[ . 1 . 2]" 2 79 1 131 LEU O 1 135 THR H 1.700 . 2.300 2.039 1.800 2.277 . 0 0 "[ . 1 . 2]" 2 80 1 131 LEU O 1 135 THR N 2.700 2.700 3.300 2.965 2.734 3.204 . 0 0 "[ . 1 . 2]" 2 stop_ save_
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