NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
399690 | 1u7q | 6029 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1u7q 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 2151 _Distance_constraint_stats_list.Viol_count 3007 _Distance_constraint_stats_list.Viol_total 3541.365 _Distance_constraint_stats_list.Viol_max 0.239 _Distance_constraint_stats_list.Viol_rms 0.0188 _Distance_constraint_stats_list.Viol_average_all_restraints 0.0041 _Distance_constraint_stats_list.Viol_average_violations_only 0.0589 _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 21 ASN 0.000 0.000 . 0 "[ . 1 . 2]" 1 22 ARG 0.000 0.000 . 0 "[ . 1 . 2]" 1 23 GLN 0.000 0.000 . 0 "[ . 1 . 2]" 1 24 ALA 0.198 0.041 15 0 "[ . 1 . 2]" 1 25 SER 0.000 0.000 . 0 "[ . 1 . 2]" 1 26 GLU 1.940 0.130 9 0 "[ . 1 . 2]" 1 27 PHE 1.212 0.092 7 0 "[ . 1 . 2]" 1 28 ILE 0.405 0.034 19 0 "[ . 1 . 2]" 1 29 PRO 5.265 0.182 19 0 "[ . 1 . 2]" 1 30 ALA 0.730 0.045 5 0 "[ . 1 . 2]" 1 31 GLN 3.388 0.123 13 0 "[ . 1 . 2]" 1 32 GLY 2.335 0.123 13 0 "[ . 1 . 2]" 1 33 VAL 1.268 0.085 13 0 "[ . 1 . 2]" 1 34 ASP 0.320 0.061 13 0 "[ . 1 . 2]" 1 35 GLU 0.356 0.031 2 0 "[ . 1 . 2]" 1 36 LYS 0.034 0.011 5 0 "[ . 1 . 2]" 1 37 THR 0.696 0.061 13 0 "[ . 1 . 2]" 1 38 LEU 2.333 0.073 12 0 "[ . 1 . 2]" 1 39 ALA 1.002 0.045 11 0 "[ . 1 . 2]" 1 40 ASP 3.338 0.093 16 0 "[ . 1 . 2]" 1 41 ALA 4.546 0.155 14 0 "[ . 1 . 2]" 1 42 ALA 2.695 0.137 19 0 "[ . 1 . 2]" 1 43 GLN 8.741 0.150 14 0 "[ . 1 . 2]" 1 44 LEU 6.493 0.155 14 0 "[ . 1 . 2]" 1 45 ALA 3.383 0.129 1 0 "[ . 1 . 2]" 1 46 SER 1.109 0.054 11 0 "[ . 1 . 2]" 1 47 LEU 2.405 0.100 4 0 "[ . 1 . 2]" 1 48 ALA 0.000 0.000 . 0 "[ . 1 . 2]" 1 49 ASP 7.349 0.137 19 0 "[ . 1 . 2]" 1 50 GLU 5.985 0.137 19 0 "[ . 1 . 2]" 1 51 THR 1.414 0.075 10 0 "[ . 1 . 2]" 1 52 PRO 0.000 0.000 . 0 "[ . 1 . 2]" 1 53 GLU 0.000 0.000 . 0 "[ . 1 . 2]" 1 54 GLY 2.673 0.108 10 0 "[ . 1 . 2]" 1 55 ARG 1.960 0.108 10 0 "[ . 1 . 2]" 1 56 SER 0.781 0.046 10 0 "[ . 1 . 2]" 1 57 ILE 1.462 0.046 10 0 "[ . 1 . 2]" 1 58 VAL 4.337 0.150 14 0 "[ . 1 . 2]" 1 59 ILE 0.061 0.014 5 0 "[ . 1 . 2]" 1 60 LEU 0.831 0.053 17 0 "[ . 1 . 2]" 1 61 ALA 2.493 0.095 2 0 "[ . 1 . 2]" 1 62 LYS 7.407 0.170 20 0 "[ . 1 . 2]" 1 63 GLN 1.055 0.077 10 0 "[ . 1 . 2]" 1 64 ARG 2.142 0.095 2 0 "[ . 1 . 2]" 1 65 PHE 5.172 0.172 3 0 "[ . 1 . 2]" 1 66 ASN 1.554 0.172 3 0 "[ . 1 . 2]" 1 67 LEU 2.917 0.149 20 0 "[ . 1 . 2]" 1 68 ARG 1.865 0.125 7 0 "[ . 1 . 2]" 1 69 GLU 2.175 0.157 15 0 "[ . 1 . 2]" 1 70 ARG 4.781 0.157 15 0 "[ . 1 . 2]" 1 71 ASP 4.974 0.161 14 0 "[ . 1 . 2]" 1 72 VAL 3.434 0.161 14 0 "[ . 1 . 2]" 1 73 GLN 1.705 0.104 18 0 "[ . 1 . 2]" 1 74 SER 1.302 0.081 3 0 "[ . 1 . 2]" 1 75 LEU 5.010 0.104 18 0 "[ . 1 . 2]" 1 76 HIS 1.382 0.079 11 0 "[ . 1 . 2]" 1 77 ALA 0.457 0.029 12 0 "[ . 1 . 2]" 1 78 THR 4.310 0.131 11 0 "[ . 1 . 2]" 1 79 PHE 4.709 0.084 3 0 "[ . 1 . 2]" 1 80 VAL 0.503 0.074 4 0 "[ . 1 . 2]" 1 81 PRO 0.028 0.007 3 0 "[ . 1 . 2]" 1 82 PHE 1.461 0.061 3 0 "[ . 1 . 2]" 1 83 THR 0.032 0.007 17 0 "[ . 1 . 2]" 1 84 ALA 0.714 0.057 11 0 "[ . 1 . 2]" 1 85 GLN 0.705 0.054 15 0 "[ . 1 . 2]" 1 86 SER 2.151 0.190 1 0 "[ . 1 . 2]" 1 87 ARG 4.233 0.190 1 0 "[ . 1 . 2]" 1 88 MET 3.074 0.117 5 0 "[ . 1 . 2]" 1 89 SER 0.646 0.053 14 0 "[ . 1 . 2]" 1 90 GLY 3.647 0.129 1 0 "[ . 1 . 2]" 1 91 ILE 5.796 0.104 3 0 "[ . 1 . 2]" 1 92 ASN 3.824 0.131 11 0 "[ . 1 . 2]" 1 93 ILE 6.567 0.161 11 0 "[ . 1 . 2]" 1 94 ASP 6.715 0.130 11 0 "[ . 1 . 2]" 1 95 ASN 3.165 0.106 19 0 "[ . 1 . 2]" 1 96 ARG 6.009 0.161 11 0 "[ . 1 . 2]" 1 97 MET 1.850 0.112 4 0 "[ . 1 . 2]" 1 98 ILE 4.676 0.117 16 0 "[ . 1 . 2]" 1 99 ARG 4.338 0.239 16 0 "[ . 1 . 2]" 1 100 LYS 0.732 0.053 14 0 "[ . 1 . 2]" 1 101 GLY 0.299 0.031 3 0 "[ . 1 . 2]" 1 102 SER 0.184 0.034 3 0 "[ . 1 . 2]" 1 103 VAL 1.865 0.096 11 0 "[ . 1 . 2]" 1 104 ASP 2.575 0.096 11 0 "[ . 1 . 2]" 1 105 ALA 3.695 0.128 18 0 "[ . 1 . 2]" 1 106 ILE 2.531 0.058 17 0 "[ . 1 . 2]" 1 107 ARG 5.181 0.124 8 0 "[ . 1 . 2]" 1 108 ARG 2.285 0.124 8 0 "[ . 1 . 2]" 1 109 HIS 7.503 0.130 16 0 "[ . 1 . 2]" 1 110 VAL 3.153 0.097 8 0 "[ . 1 . 2]" 1 111 GLU 2.289 0.088 14 0 "[ . 1 . 2]" 1 112 ALA 4.723 0.130 16 0 "[ . 1 . 2]" 1 113 ASN 3.279 0.088 14 0 "[ . 1 . 2]" 1 114 GLY 0.000 0.000 . 0 "[ . 1 . 2]" 1 115 GLY 7.830 0.196 20 0 "[ . 1 . 2]" 1 116 HIS 1.885 0.077 14 0 "[ . 1 . 2]" 1 117 PHE 2.550 0.114 18 0 "[ . 1 . 2]" 1 118 PRO 2.002 0.114 18 0 "[ . 1 . 2]" 1 119 THR 7.515 0.171 18 0 "[ . 1 . 2]" 1 120 ASP 0.829 0.062 11 0 "[ . 1 . 2]" 1 121 VAL 3.113 0.166 16 0 "[ . 1 . 2]" 1 122 ASP 1.370 0.101 7 0 "[ . 1 . 2]" 1 123 GLN 6.698 0.171 18 0 "[ . 1 . 2]" 1 124 LYS 1.685 0.062 11 0 "[ . 1 . 2]" 1 125 VAL 0.697 0.043 17 0 "[ . 1 . 2]" 1 126 ASP 2.994 0.101 7 0 "[ . 1 . 2]" 1 127 GLN 2.474 0.083 14 0 "[ . 1 . 2]" 1 128 VAL 0.029 0.019 11 0 "[ . 1 . 2]" 1 129 ALA 1.128 0.069 14 0 "[ . 1 . 2]" 1 130 ARG 2.992 0.104 6 0 "[ . 1 . 2]" 1 131 GLN 3.580 0.130 9 0 "[ . 1 . 2]" 1 132 GLY 2.479 0.130 9 0 "[ . 1 . 2]" 1 133 ALA 1.739 0.104 6 0 "[ . 1 . 2]" 1 134 THR 3.748 0.164 19 0 "[ . 1 . 2]" 1 135 PRO 0.619 0.065 8 0 "[ . 1 . 2]" 1 136 LEU 0.804 0.050 19 0 "[ . 1 . 2]" 1 137 VAL 1.548 0.085 12 0 "[ . 1 . 2]" 1 138 VAL 2.594 0.148 8 0 "[ . 1 . 2]" 1 139 VAL 4.079 0.108 10 0 "[ . 1 . 2]" 1 140 GLU 2.061 0.117 16 0 "[ . 1 . 2]" 1 141 GLY 0.084 0.019 8 0 "[ . 1 . 2]" 1 142 SER 0.367 0.025 19 0 "[ . 1 . 2]" 1 143 ARG 1.028 0.072 12 0 "[ . 1 . 2]" 1 144 VAL 4.818 0.108 10 0 "[ . 1 . 2]" 1 145 LEU 2.522 0.079 9 0 "[ . 1 . 2]" 1 146 GLY 9.131 0.182 19 0 "[ . 1 . 2]" 1 147 VAL 1.948 0.071 3 0 "[ . 1 . 2]" 1 148 ILE 2.150 0.085 12 0 "[ . 1 . 2]" 1 149 ALA 4.313 0.164 19 0 "[ . 1 . 2]" 1 150 LEU 3.510 0.130 9 0 "[ . 1 . 2]" 1 151 LYS 0.387 0.055 1 0 "[ . 1 . 2]" 1 152 ASP 0.000 0.000 . 0 "[ . 1 . 2]" 1 153 ILE 0.708 0.070 7 0 "[ . 1 . 2]" 1 154 VAL 0.077 0.023 20 0 "[ . 1 . 2]" 1 155 LYS 0.000 0.000 . 0 "[ . 1 . 2]" 1 156 GLY 0.000 0.000 . 0 "[ . 1 . 2]" stop_ loop_ _Distance_constraint_stats.Restraint_ID _Distance_constraint_stats.Atom_1_entity_assembly_ID _Distance_constraint_stats.Atom_1_comp_index_ID _Distance_constraint_stats.Atom_1_comp_ID _Distance_constraint_stats.Atom_1_ID _Distance_constraint_stats.Atom_2_entity_assembly_ID _Distance_constraint_stats.Atom_2_comp_index_ID _Distance_constraint_stats.Atom_2_comp_ID _Distance_constraint_stats.Atom_2_ID _Distance_constraint_stats.Node_1_distance_val _Distance_constraint_stats.Node_1_distance_lower_bound_val _Distance_constraint_stats.Node_1_distance_upper_bound_val _Distance_constraint_stats.Distance_average _Distance_constraint_stats.Distance_minimum _Distance_constraint_stats.Distance_maximum _Distance_constraint_stats.Max_violation _Distance_constraint_stats.Max_violation_model_number _Distance_constraint_stats.Over_cutoff_violation_count _Distance_constraint_stats.Over_cutoff_viol_per_model _Distance_constraint_stats.Distance_constraint_stats_ID 1 1 23 GLN H 1 23 GLN HA 2.700 2.700 7.700 3.001 2.986 3.005 . 0 0 "[ . 1 . 2]" 1 2 1 23 GLN H 1 23 GLN QB 0.000 . 3.500 2.517 2.398 3.001 . 0 0 "[ . 1 . 2]" 1 3 1 24 ALA H 1 24 ALA HA 2.700 2.700 7.700 2.845 2.821 2.872 . 0 0 "[ . 1 . 2]" 1 4 1 25 SER H 1 25 SER HB2 0.000 . 3.200 2.367 2.270 2.632 . 0 0 "[ . 1 . 2]" 1 5 1 25 SER H 1 25 SER HB3 0.000 . 4.200 3.579 3.507 3.741 . 0 0 "[ . 1 . 2]" 1 6 1 25 SER H 1 25 SER HA 2.700 2.700 7.700 3.001 2.999 3.003 . 0 0 "[ . 1 . 2]" 1 7 1 26 GLU H 1 26 GLU QG 0.000 . 5.000 3.843 3.453 4.219 . 0 0 "[ . 1 . 2]" 1 8 1 26 GLU H 1 26 GLU HA 2.700 2.700 7.700 2.951 2.923 2.966 . 0 0 "[ . 1 . 2]" 1 9 1 27 PHE H 1 27 PHE HA 2.700 2.700 7.700 2.982 2.976 2.989 . 0 0 "[ . 1 . 2]" 1 10 1 27 PHE H 1 27 PHE HB3 0.000 . 3.200 3.260 3.235 3.292 0.092 7 0 "[ . 1 . 2]" 1 11 1 27 PHE H 1 27 PHE HB2 0.000 . 4.200 3.761 3.727 3.798 . 0 0 "[ . 1 . 2]" 1 12 1 28 ILE H 1 28 ILE QG 0.000 . 4.000 3.292 2.984 3.571 . 0 0 "[ . 1 . 2]" 1 13 1 28 ILE H 1 28 ILE MD 0.000 . 5.000 2.975 2.073 3.578 . 0 0 "[ . 1 . 2]" 1 14 1 28 ILE H 1 28 ILE HA 2.700 2.700 7.700 2.999 2.995 3.003 . 0 0 "[ . 1 . 2]" 1 15 1 28 ILE H 1 28 ILE HB 0.000 . 2.700 2.323 2.260 2.458 . 0 0 "[ . 1 . 2]" 1 16 1 30 ALA H 1 30 ALA MB 0.000 . 3.500 1.952 1.935 1.963 . 0 0 "[ . 1 . 2]" 1 17 1 30 ALA H 1 30 ALA HA 2.700 2.700 7.700 2.926 2.918 2.934 . 0 0 "[ . 1 . 2]" 1 18 1 31 GLN H 1 31 GLN HA 2.700 2.700 7.700 2.804 2.799 2.809 . 0 0 "[ . 1 . 2]" 1 19 1 31 GLN H 1 31 GLN QB 0.000 . 3.500 2.165 2.158 2.171 . 0 0 "[ . 1 . 2]" 1 20 1 31 GLN H 1 31 GLN QG 0.000 . 5.000 4.002 3.998 4.009 . 0 0 "[ . 1 . 2]" 1 21 1 32 GLY H 1 32 GLY HA3 2.700 2.700 7.700 2.981 2.977 2.991 . 0 0 "[ . 1 . 2]" 1 22 1 33 VAL HA 1 33 VAL MG1 0.000 . 3.500 2.367 2.254 2.416 . 0 0 "[ . 1 . 2]" 1 23 1 33 VAL HA 1 33 VAL MG2 0.000 . 3.500 2.304 2.283 2.347 . 0 0 "[ . 1 . 2]" 1 24 1 33 VAL H 1 33 VAL HA 2.700 2.700 7.700 2.991 2.989 2.992 . 0 0 "[ . 1 . 2]" 1 25 1 33 VAL H 1 33 VAL MG2 0.000 . 3.500 2.799 2.463 2.890 . 0 0 "[ . 1 . 2]" 1 26 1 33 VAL H 1 33 VAL HB 0.000 . 2.700 2.662 2.408 2.707 0.007 10 0 "[ . 1 . 2]" 1 27 1 34 ASP H 1 34 ASP QB 0.000 . 3.500 2.275 2.226 2.569 . 0 0 "[ . 1 . 2]" 1 28 1 34 ASP H 1 34 ASP HA 2.700 2.700 7.700 2.918 2.912 2.925 . 0 0 "[ . 1 . 2]" 1 29 1 35 GLU H 1 35 GLU QB 0.000 . 3.500 2.182 2.173 2.190 . 0 0 "[ . 1 . 2]" 1 30 1 35 GLU H 1 35 GLU HA 2.700 2.700 7.700 2.843 2.838 2.847 . 0 0 "[ . 1 . 2]" 1 31 1 35 GLU H 1 35 GLU QG 0.000 . 5.000 3.927 3.921 3.935 . 0 0 "[ . 1 . 2]" 1 32 1 36 LYS H 1 36 LYS QG 0.000 . 5.000 3.914 3.902 3.975 . 0 0 "[ . 1 . 2]" 1 33 1 36 LYS H 1 36 LYS QE 0.000 . 4.000 3.364 2.488 3.631 . 0 0 "[ . 1 . 2]" 1 34 1 36 LYS H 1 36 LYS QB 0.000 . 3.500 2.111 2.017 2.147 . 0 0 "[ . 1 . 2]" 1 35 1 37 THR H 1 37 THR HB 0.000 . 2.700 2.405 2.193 2.437 . 0 0 "[ . 1 . 2]" 1 36 1 37 THR H 1 37 THR HA 2.700 2.700 7.700 2.864 2.857 2.882 . 0 0 "[ . 1 . 2]" 1 37 1 38 LEU H 1 38 LEU QB 0.000 . 3.500 2.070 2.014 2.095 . 0 0 "[ . 1 . 2]" 1 38 1 38 LEU H 1 38 LEU HA 2.700 2.700 7.700 2.861 2.854 2.866 . 0 0 "[ . 1 . 2]" 1 39 1 38 LEU H 1 38 LEU HG 0.000 . 4.200 4.162 4.072 4.210 0.010 16 0 "[ . 1 . 2]" 1 40 1 39 ALA H 1 39 ALA MB 0.000 . 3.500 1.921 1.907 1.940 . 0 0 "[ . 1 . 2]" 1 41 1 39 ALA H 1 39 ALA HA 2.700 2.700 7.700 2.861 2.859 2.864 . 0 0 "[ . 1 . 2]" 1 42 1 40 ASP H 1 40 ASP QB 0.000 . 3.500 2.280 2.162 2.339 . 0 0 "[ . 1 . 2]" 1 43 1 41 ALA H 1 41 ALA MB 0.000 . 3.500 2.150 2.145 2.154 . 0 0 "[ . 1 . 2]" 1 44 1 42 ALA H 1 42 ALA HA 0.000 . 2.700 2.835 2.833 2.837 0.137 19 0 "[ . 1 . 2]" 1 45 1 42 ALA H 1 42 ALA MB 0.000 . 3.500 2.035 2.007 2.055 . 0 0 "[ . 1 . 2]" 1 46 1 43 GLN H 1 43 GLN QB 0.000 . 3.500 2.029 2.015 2.071 . 0 0 "[ . 1 . 2]" 1 47 1 43 GLN HA 1 43 GLN HE21 0.000 . 5.500 4.326 4.234 4.421 . 0 0 "[ . 1 . 2]" 1 48 1 43 GLN H 1 43 GLN HA 2.700 2.700 7.700 2.892 2.890 2.893 . 0 0 "[ . 1 . 2]" 1 49 1 43 GLN H 1 43 GLN QG 0.000 . 4.000 2.761 2.664 2.791 . 0 0 "[ . 1 . 2]" 1 50 1 44 LEU H 1 44 LEU QB 0.000 . 3.500 2.782 2.736 2.808 . 0 0 "[ . 1 . 2]" 1 51 1 44 LEU H 1 44 LEU HA 2.700 2.700 7.700 2.822 2.813 2.831 . 0 0 "[ . 1 . 2]" 1 52 1 44 LEU H 1 44 LEU HG 0.000 . 3.200 1.860 1.844 1.871 . 0 0 "[ . 1 . 2]" 1 53 1 45 ALA H 1 45 ALA MB 0.000 . 3.500 2.098 2.043 2.136 . 0 0 "[ . 1 . 2]" 1 54 1 46 SER H 1 46 SER QB 0.000 . 3.500 2.642 2.586 2.683 . 0 0 "[ . 1 . 2]" 1 55 1 46 SER H 1 46 SER HA 2.700 2.700 7.700 2.984 2.982 2.985 . 0 0 "[ . 1 . 2]" 1 56 1 47 LEU H 1 47 LEU QD 0.000 . 4.200 2.685 2.643 2.703 . 0 0 "[ . 1 . 2]" 1 57 1 47 LEU H 1 47 LEU HB2 0.000 . 2.700 2.511 2.484 2.526 . 0 0 "[ . 1 . 2]" 1 58 1 47 LEU H 1 47 LEU HA 2.700 2.700 7.700 2.873 2.867 2.876 . 0 0 "[ . 1 . 2]" 1 59 1 47 LEU H 1 47 LEU HB3 0.000 . 4.200 3.536 3.528 3.541 . 0 0 "[ . 1 . 2]" 1 60 1 47 LEU H 1 47 LEU HG 0.000 . 2.700 1.821 1.809 1.834 . 0 0 "[ . 1 . 2]" 1 61 1 48 ALA H 1 48 ALA HA 2.700 2.700 7.700 2.953 2.952 2.954 . 0 0 "[ . 1 . 2]" 1 62 1 48 ALA H 1 48 ALA MB 0.000 . 3.500 2.033 1.992 2.082 . 0 0 "[ . 1 . 2]" 1 63 1 49 ASP H 1 49 ASP HB2 0.000 . 4.200 3.540 3.536 3.546 . 0 0 "[ . 1 . 2]" 1 64 1 49 ASP H 1 49 ASP HA 2.700 2.700 7.700 2.889 2.879 2.894 . 0 0 "[ . 1 . 2]" 1 65 1 49 ASP H 1 49 ASP HB3 0.000 . 2.700 2.689 2.676 2.703 0.003 10 0 "[ . 1 . 2]" 1 66 1 50 GLU H 1 50 GLU QG 0.000 . 3.500 2.405 2.396 2.410 . 0 0 "[ . 1 . 2]" 1 67 1 50 GLU H 1 50 GLU HB2 0.000 . 2.700 2.310 2.305 2.319 . 0 0 "[ . 1 . 2]" 1 68 1 50 GLU H 1 50 GLU HB3 0.000 . 4.200 3.557 3.555 3.561 . 0 0 "[ . 1 . 2]" 1 69 1 50 GLU H 1 50 GLU HA 2.700 2.700 7.700 2.971 2.970 2.974 . 0 0 "[ . 1 . 2]" 1 70 1 51 THR H 1 51 THR MG 0.000 . 3.500 1.808 1.806 1.809 . 0 0 "[ . 1 . 2]" 1 71 1 51 THR H 1 51 THR HA 2.700 2.700 7.700 2.910 2.904 2.914 . 0 0 "[ . 1 . 2]" 1 72 1 51 THR H 1 51 THR HB 0.000 . 4.200 3.523 3.521 3.526 . 0 0 "[ . 1 . 2]" 1 73 1 53 GLU H 1 53 GLU HA 2.700 2.700 7.700 2.874 2.873 2.875 . 0 0 "[ . 1 . 2]" 1 74 1 53 GLU H 1 53 GLU HB2 0.000 . 3.200 2.304 2.280 2.326 . 0 0 "[ . 1 . 2]" 1 75 1 53 GLU H 1 53 GLU HB3 0.000 . 4.200 3.512 3.510 3.516 . 0 0 "[ . 1 . 2]" 1 76 1 53 GLU H 1 53 GLU QG 0.000 . 4.000 2.123 2.076 2.178 . 0 0 "[ . 1 . 2]" 1 77 1 55 ARG H 1 55 ARG QG 0.000 . 3.500 2.236 2.167 2.260 . 0 0 "[ . 1 . 2]" 1 78 1 55 ARG H 1 55 ARG QD 0.000 . 5.000 3.818 3.581 3.843 . 0 0 "[ . 1 . 2]" 1 79 1 55 ARG H 1 55 ARG QB 0.000 . 3.500 2.318 2.310 2.344 . 0 0 "[ . 1 . 2]" 1 80 1 55 ARG H 1 55 ARG HA 2.700 2.700 7.700 2.947 2.945 2.949 . 0 0 "[ . 1 . 2]" 1 81 1 56 SER H 1 56 SER HA 2.700 2.700 7.700 2.848 2.845 2.852 . 0 0 "[ . 1 . 2]" 1 82 1 56 SER H 1 56 SER QB 0.000 . 3.500 2.534 2.184 2.616 . 0 0 "[ . 1 . 2]" 1 83 1 57 ILE H 1 57 ILE HA 2.700 2.700 7.700 2.877 2.873 2.881 . 0 0 "[ . 1 . 2]" 1 84 1 57 ILE H 1 57 ILE MD 0.000 . 4.000 3.313 3.255 3.332 . 0 0 "[ . 1 . 2]" 1 85 1 57 ILE H 1 57 ILE HB 0.000 . 2.700 2.406 2.386 2.427 . 0 0 "[ . 1 . 2]" 1 86 1 57 ILE H 1 57 ILE QG 0.000 . 3.500 1.939 1.889 1.980 . 0 0 "[ . 1 . 2]" 1 87 1 58 VAL H 1 58 VAL HB 0.000 . 2.700 2.514 2.502 2.527 . 0 0 "[ . 1 . 2]" 1 88 1 58 VAL H 1 58 VAL HA 2.700 2.700 7.700 2.858 2.850 2.867 . 0 0 "[ . 1 . 2]" 1 89 1 58 VAL H 1 58 VAL MG2 0.000 . 3.500 1.941 1.858 1.987 . 0 0 "[ . 1 . 2]" 1 90 1 59 ILE H 1 59 ILE HA 2.700 2.700 7.700 2.933 2.930 2.935 . 0 0 "[ . 1 . 2]" 1 91 1 59 ILE H 1 59 ILE QG 0.000 . 4.000 2.109 2.095 2.140 . 0 0 "[ . 1 . 2]" 1 92 1 59 ILE H 1 59 ILE HB 0.000 . 3.200 2.389 2.380 2.398 . 0 0 "[ . 1 . 2]" 1 93 1 60 LEU H 1 60 LEU HA 2.700 2.700 7.700 2.847 2.841 2.853 . 0 0 "[ . 1 . 2]" 1 94 1 60 LEU H 1 60 LEU HG 0.000 . 5.500 4.334 4.326 4.342 . 0 0 "[ . 1 . 2]" 1 95 1 60 LEU HA 1 60 LEU HB2 0.000 . 2.700 2.416 2.393 2.439 . 0 0 "[ . 1 . 2]" 1 96 1 60 LEU H 1 60 LEU QB 0.000 . 3.500 2.163 2.147 2.178 . 0 0 "[ . 1 . 2]" 1 97 1 61 ALA H 1 61 ALA HA 2.700 2.700 7.700 2.877 2.875 2.880 . 0 0 "[ . 1 . 2]" 1 98 1 62 LYS H 1 62 LYS QG 0.000 . 4.000 1.852 1.839 1.925 . 0 0 "[ . 1 . 2]" 1 99 1 62 LYS H 1 62 LYS QE 0.000 . 6.300 3.713 3.361 3.904 . 0 0 "[ . 1 . 2]" 1 100 1 62 LYS H 1 62 LYS QD 0.000 . 5.000 3.832 3.735 4.006 . 0 0 "[ . 1 . 2]" 1 101 1 62 LYS H 1 62 LYS HA 2.700 2.700 7.700 2.866 2.848 2.877 . 0 0 "[ . 1 . 2]" 1 102 1 62 LYS H 1 62 LYS QB 0.000 . 3.500 2.469 2.424 2.504 . 0 0 "[ . 1 . 2]" 1 103 1 63 GLN H 1 63 GLN HA 2.700 2.700 7.700 2.862 2.857 2.867 . 0 0 "[ . 1 . 2]" 1 104 1 64 ARG H 1 64 ARG HA 2.700 2.700 7.700 2.868 2.862 2.885 . 0 0 "[ . 1 . 2]" 1 105 1 64 ARG H 1 64 ARG HB3 0.000 . 4.200 3.525 3.502 3.533 . 0 0 "[ . 1 . 2]" 1 106 1 64 ARG H 1 64 ARG QD 0.000 . 5.000 3.391 3.151 3.887 . 0 0 "[ . 1 . 2]" 1 107 1 64 ARG H 1 64 ARG HB2 0.000 . 2.700 2.363 2.212 2.431 . 0 0 "[ . 1 . 2]" 1 108 1 64 ARG H 1 64 ARG QG 0.000 . 4.000 2.054 1.921 2.371 . 0 0 "[ . 1 . 2]" 1 109 1 65 PHE H 1 65 PHE HB2 0.000 . 3.200 2.436 2.360 2.471 . 0 0 "[ . 1 . 2]" 1 110 1 65 PHE H 1 65 PHE HB3 0.000 . 4.200 3.676 3.599 3.704 . 0 0 "[ . 1 . 2]" 1 111 1 65 PHE H 1 65 PHE HA 2.700 2.700 7.700 3.006 3.002 3.007 . 0 0 "[ . 1 . 2]" 1 112 1 66 ASN H 1 66 ASN QB 0.000 . 3.500 2.623 2.603 2.640 . 0 0 "[ . 1 . 2]" 1 113 1 66 ASN HA 1 66 ASN HD22 0.000 . 5.500 4.228 3.567 4.634 . 0 0 "[ . 1 . 2]" 1 114 1 66 ASN H 1 66 ASN HA 2.700 2.700 7.700 2.972 2.968 2.976 . 0 0 "[ . 1 . 2]" 1 115 1 67 LEU H 1 67 LEU HG 0.000 . 3.200 2.013 1.857 3.089 . 0 0 "[ . 1 . 2]" 1 116 1 67 LEU H 1 67 LEU QB 0.000 . 3.500 2.398 2.251 2.526 . 0 0 "[ . 1 . 2]" 1 117 1 67 LEU H 1 67 LEU HA 2.700 2.700 7.700 2.866 2.860 2.878 . 0 0 "[ . 1 . 2]" 1 118 1 68 ARG H 1 68 ARG HA 2.700 2.700 7.700 2.993 2.954 3.001 . 0 0 "[ . 1 . 2]" 1 119 1 68 ARG H 1 68 ARG QD 0.000 . 5.000 4.392 4.055 4.556 . 0 0 "[ . 1 . 2]" 1 120 1 69 GLU H 1 69 GLU QG 0.000 . 4.000 2.618 1.836 2.871 . 0 0 "[ . 1 . 2]" 1 121 1 69 GLU H 1 69 GLU QB 0.000 . 3.500 2.644 2.530 2.944 . 0 0 "[ . 1 . 2]" 1 122 1 69 GLU H 1 69 GLU HA 2.700 2.700 7.700 2.994 2.982 3.001 . 0 0 "[ . 1 . 2]" 1 123 1 70 ARG H 1 70 ARG HE 0.000 . 5.500 4.818 4.248 5.590 0.090 11 0 "[ . 1 . 2]" 1 124 1 70 ARG H 1 70 ARG QG 0.000 . 4.000 2.033 1.837 3.708 . 0 0 "[ . 1 . 2]" 1 125 1 70 ARG HA 1 70 ARG HE 3.200 3.200 8.200 6.047 3.916 6.423 . 0 0 "[ . 1 . 2]" 1 126 1 70 ARG H 1 70 ARG QB 0.000 . 3.500 2.519 2.064 2.581 . 0 0 "[ . 1 . 2]" 1 127 1 71 ASP H 1 71 ASP HA 2.700 2.700 7.700 2.996 2.981 3.001 . 0 0 "[ . 1 . 2]" 1 128 1 72 VAL H 1 72 VAL HB 0.000 . 2.700 2.393 2.302 2.465 . 0 0 "[ . 1 . 2]" 1 129 1 72 VAL H 1 72 VAL HA 2.700 2.700 7.700 2.898 2.894 2.902 . 0 0 "[ . 1 . 2]" 1 130 1 73 GLN H 1 73 GLN QB 0.000 . 3.500 2.326 2.306 2.362 . 0 0 "[ . 1 . 2]" 1 131 1 73 GLN H 1 73 GLN QG 0.000 . 4.000 2.019 1.955 2.068 . 0 0 "[ . 1 . 2]" 1 132 1 73 GLN H 1 73 GLN HA 2.700 2.700 7.700 2.854 2.844 2.861 . 0 0 "[ . 1 . 2]" 1 133 1 74 SER H 1 74 SER QB 0.000 . 3.500 2.008 2.004 2.023 . 0 0 "[ . 1 . 2]" 1 134 1 74 SER H 1 74 SER HA 2.700 2.700 7.700 2.954 2.952 2.957 . 0 0 "[ . 1 . 2]" 1 135 1 75 LEU H 1 75 LEU HA 2.700 2.700 7.700 2.983 2.980 2.990 . 0 0 "[ . 1 . 2]" 1 136 1 75 LEU H 1 75 LEU QB 0.000 . 3.500 2.404 2.332 2.458 . 0 0 "[ . 1 . 2]" 1 137 1 75 LEU H 1 75 LEU MD2 0.000 . 5.000 3.226 3.105 3.920 . 0 0 "[ . 1 . 2]" 1 138 1 75 LEU H 1 75 LEU MD1 0.000 . 5.000 3.761 3.196 3.853 . 0 0 "[ . 1 . 2]" 1 139 1 77 ALA H 1 77 ALA HA 2.700 2.700 7.700 2.964 2.959 2.967 . 0 0 "[ . 1 . 2]" 1 140 1 77 ALA H 1 77 ALA MB 0.000 . 3.500 2.199 2.176 2.216 . 0 0 "[ . 1 . 2]" 1 141 1 78 THR H 1 78 THR HB 0.000 . 3.200 2.371 2.357 2.381 . 0 0 "[ . 1 . 2]" 1 142 1 78 THR H 1 78 THR HA 2.700 2.700 7.700 3.001 2.997 3.005 . 0 0 "[ . 1 . 2]" 1 143 1 79 PHE H 1 79 PHE HB3 0.000 . 4.200 3.595 3.589 3.601 . 0 0 "[ . 1 . 2]" 1 144 1 79 PHE H 1 79 PHE HB2 0.000 . 2.700 2.424 2.401 2.448 . 0 0 "[ . 1 . 2]" 1 145 1 79 PHE H 1 79 PHE HA 2.700 2.700 7.700 2.971 2.969 2.973 . 0 0 "[ . 1 . 2]" 1 146 1 80 VAL H 1 80 VAL MG2 0.000 . 4.000 2.705 2.314 3.060 . 0 0 "[ . 1 . 2]" 1 147 1 80 VAL H 1 80 VAL HA 2.700 2.700 7.700 2.999 2.997 3.002 . 0 0 "[ . 1 . 2]" 1 148 1 80 VAL H 1 80 VAL HB 0.000 . 3.200 2.566 2.412 2.705 . 0 0 "[ . 1 . 2]" 1 149 1 82 PHE H 1 82 PHE QB 0.000 . 3.500 2.170 2.164 2.177 . 0 0 "[ . 1 . 2]" 1 150 1 82 PHE H 1 82 PHE HA 2.700 2.700 7.700 2.872 2.856 2.893 . 0 0 "[ . 1 . 2]" 1 151 1 83 THR H 1 83 THR MG 0.000 . 4.000 2.653 2.356 3.084 . 0 0 "[ . 1 . 2]" 1 152 1 83 THR H 1 83 THR HA 2.700 2.700 7.700 3.000 2.999 3.001 . 0 0 "[ . 1 . 2]" 1 153 1 84 ALA H 1 84 ALA HA 2.700 2.700 7.700 2.914 2.900 2.921 . 0 0 "[ . 1 . 2]" 1 154 1 84 ALA H 1 84 ALA MB 0.000 . 3.500 2.033 1.920 2.169 . 0 0 "[ . 1 . 2]" 1 155 1 85 GLN H 1 85 GLN QB 0.000 . 3.500 2.325 2.148 2.367 . 0 0 "[ . 1 . 2]" 1 156 1 85 GLN H 1 85 GLN QG 0.000 . 5.000 2.256 1.952 3.912 . 0 0 "[ . 1 . 2]" 1 157 1 85 GLN H 1 85 GLN HA 2.700 2.700 7.700 2.836 2.823 2.856 . 0 0 "[ . 1 . 2]" 1 158 1 86 SER H 1 86 SER HA 2.700 2.700 7.700 2.976 2.968 2.980 . 0 0 "[ . 1 . 2]" 1 159 1 87 ARG H 1 87 ARG HA 0.000 . 2.700 2.357 2.345 2.361 . 0 0 "[ . 1 . 2]" 1 160 1 88 MET H 1 88 MET QG 0.000 . 4.000 2.269 2.174 2.373 . 0 0 "[ . 1 . 2]" 1 161 1 88 MET H 1 88 MET HA 2.700 2.700 7.700 2.952 2.930 2.973 . 0 0 "[ . 1 . 2]" 1 162 1 89 SER H 1 89 SER HB2 0.000 . 4.200 3.935 3.929 3.939 . 0 0 "[ . 1 . 2]" 1 163 1 89 SER H 1 89 SER HB3 0.000 . 3.200 3.085 2.995 3.125 . 0 0 "[ . 1 . 2]" 1 164 1 89 SER H 1 89 SER HA 2.700 2.700 7.700 2.961 2.958 2.963 . 0 0 "[ . 1 . 2]" 1 165 1 90 GLY H 1 90 GLY HA2 2.700 2.700 7.700 2.853 2.825 2.870 . 0 0 "[ . 1 . 2]" 1 166 1 91 ILE H 1 91 ILE MG 0.000 . 4.000 2.038 1.841 2.187 . 0 0 "[ . 1 . 2]" 1 167 1 91 ILE H 1 91 ILE QG 0.000 . 5.000 4.042 4.029 4.059 . 0 0 "[ . 1 . 2]" 1 168 1 91 ILE H 1 91 ILE HA 2.700 2.700 7.700 2.993 2.988 2.995 . 0 0 "[ . 1 . 2]" 1 169 1 92 ASN H 1 92 ASN HA 2.700 2.700 7.700 3.007 3.005 3.009 . 0 0 "[ . 1 . 2]" 1 170 1 93 ILE H 1 93 ILE HA 2.700 2.700 7.700 2.956 2.951 2.962 . 0 0 "[ . 1 . 2]" 1 171 1 93 ILE H 1 93 ILE MG 0.000 . 3.500 2.016 1.947 2.128 . 0 0 "[ . 1 . 2]" 1 172 1 93 ILE H 1 93 ILE QG 0.000 . 5.000 3.919 3.891 3.945 . 0 0 "[ . 1 . 2]" 1 173 1 94 ASP H 1 94 ASP HB2 0.000 . 4.200 2.392 2.374 2.409 . 0 0 "[ . 1 . 2]" 1 174 1 94 ASP H 1 94 ASP HA 0.000 . 2.700 2.677 2.659 2.687 . 0 0 "[ . 1 . 2]" 1 175 1 94 ASP H 1 94 ASP HB3 0.000 . 4.200 3.517 3.513 3.524 . 0 0 "[ . 1 . 2]" 1 176 1 95 ASN H 1 95 ASN HA 2.700 2.700 7.700 2.929 2.919 2.943 . 0 0 "[ . 1 . 2]" 1 177 1 95 ASN H 1 95 ASN QB 0.000 . 3.500 2.175 2.163 2.187 . 0 0 "[ . 1 . 2]" 1 178 1 96 ARG HB3 1 96 ARG HE 0.000 . 4.200 2.046 1.867 2.235 . 0 0 "[ . 1 . 2]" 1 179 1 96 ARG H 1 96 ARG HB3 0.000 . 4.200 3.831 3.812 3.900 . 0 0 "[ . 1 . 2]" 1 180 1 96 ARG HB3 1 96 ARG HD2 0.000 . 4.200 3.864 3.777 3.957 . 0 0 "[ . 1 . 2]" 1 181 1 96 ARG H 1 96 ARG HB2 0.000 . 3.200 2.692 2.654 2.898 . 0 0 "[ . 1 . 2]" 1 182 1 96 ARG HD2 1 96 ARG HH11 0.000 . 2.700 1.875 1.848 2.097 . 0 0 "[ . 1 . 2]" 1 183 1 96 ARG HB2 1 96 ARG HD3 0.000 . 3.200 2.318 2.235 2.461 . 0 0 "[ . 1 . 2]" 1 184 1 96 ARG HA 1 96 ARG HE 0.000 . 5.500 4.270 3.999 4.459 . 0 0 "[ . 1 . 2]" 1 185 1 96 ARG H 1 96 ARG QG 0.000 . 3.500 3.070 2.557 3.152 . 0 0 "[ . 1 . 2]" 1 186 1 96 ARG HA 1 96 ARG HD3 0.000 . 5.500 4.550 4.429 4.751 . 0 0 "[ . 1 . 2]" 1 187 1 96 ARG HB3 1 96 ARG HD3 0.000 . 4.200 3.277 3.152 3.552 . 0 0 "[ . 1 . 2]" 1 188 1 96 ARG HD3 1 96 ARG HH11 0.000 . 2.700 2.521 2.258 2.567 . 0 0 "[ . 1 . 2]" 1 189 1 96 ARG H 1 96 ARG QD 0.000 . 5.000 3.941 3.574 4.067 . 0 0 "[ . 1 . 2]" 1 190 1 96 ARG HB2 1 96 ARG HE 0.000 . 4.200 2.745 2.272 2.935 . 0 0 "[ . 1 . 2]" 1 191 1 96 ARG HA 1 96 ARG HD2 0.000 . 5.500 4.839 4.809 5.008 . 0 0 "[ . 1 . 2]" 1 192 1 96 ARG H 1 96 ARG HA 2.700 2.700 7.700 2.993 2.989 2.999 . 0 0 "[ . 1 . 2]" 1 193 1 96 ARG HB2 1 96 ARG HD2 0.000 . 4.200 3.573 3.520 3.659 . 0 0 "[ . 1 . 2]" 1 194 1 97 MET H 1 97 MET ME 0.000 . 6.300 4.015 3.615 5.231 . 0 0 "[ . 1 . 2]" 1 195 1 97 MET H 1 97 MET HB3 0.000 . 4.200 3.786 3.775 3.801 . 0 0 "[ . 1 . 2]" 1 196 1 97 MET H 1 97 MET QG 0.000 . 5.000 3.200 3.153 3.236 . 0 0 "[ . 1 . 2]" 1 197 1 97 MET H 1 97 MET HB2 0.000 . 2.700 2.639 2.629 2.656 . 0 0 "[ . 1 . 2]" 1 198 1 97 MET H 1 97 MET HA 2.700 2.700 7.700 2.983 2.981 2.986 . 0 0 "[ . 1 . 2]" 1 199 1 98 ILE H 1 98 ILE HA 2.700 2.700 7.700 3.006 3.002 3.009 . 0 0 "[ . 1 . 2]" 1 200 1 98 ILE H 1 98 ILE MD 0.000 . 5.000 4.138 4.038 4.192 . 0 0 "[ . 1 . 2]" 1 201 1 98 ILE H 1 98 ILE QG 0.000 . 4.000 2.764 2.618 2.843 . 0 0 "[ . 1 . 2]" 1 202 1 98 ILE H 1 98 ILE HB 0.000 . 3.200 2.464 2.361 2.543 . 0 0 "[ . 1 . 2]" 1 203 1 99 ARG H 1 99 ARG HD2 0.000 . 5.500 4.975 4.775 5.507 0.007 3 0 "[ . 1 . 2]" 1 204 1 99 ARG H 1 99 ARG HA 2.700 2.700 7.700 2.989 2.981 2.999 . 0 0 "[ . 1 . 2]" 1 205 1 99 ARG HA 1 99 ARG HD3 0.000 . 4.200 3.337 2.130 4.154 . 0 0 "[ . 1 . 2]" 1 206 1 99 ARG H 1 99 ARG QG 0.000 . 5.000 2.969 2.760 4.229 . 0 0 "[ . 1 . 2]" 1 207 1 99 ARG H 1 99 ARG HD3 0.000 . 5.500 4.982 4.067 5.543 0.043 5 0 "[ . 1 . 2]" 1 208 1 99 ARG HA 1 99 ARG HD2 0.000 . 4.200 3.774 2.847 4.439 0.239 16 0 "[ . 1 . 2]" 1 209 1 100 LYS H 1 100 LYS HA 2.700 2.700 7.700 2.980 2.977 2.985 . 0 0 "[ . 1 . 2]" 1 210 1 100 LYS H 1 100 LYS QG 0.000 . 4.000 2.158 2.042 2.228 . 0 0 "[ . 1 . 2]" 1 211 1 101 GLY H 1 101 GLY HA2 2.700 2.700 7.700 2.951 2.893 2.963 . 0 0 "[ . 1 . 2]" 1 212 1 101 GLY H 1 101 GLY HA3 2.700 2.700 7.700 2.695 2.672 2.796 0.028 8 0 "[ . 1 . 2]" 1 213 1 102 SER H 1 102 SER QB 0.000 . 3.500 2.379 2.182 2.423 . 0 0 "[ . 1 . 2]" 1 214 1 102 SER H 1 102 SER HA 2.700 2.700 7.700 2.884 2.881 2.889 . 0 0 "[ . 1 . 2]" 1 215 1 103 VAL H 1 103 VAL HA 2.700 2.700 7.700 2.813 2.809 2.819 . 0 0 "[ . 1 . 2]" 1 216 1 103 VAL H 1 103 VAL HB 0.000 . 2.700 2.305 2.233 2.371 . 0 0 "[ . 1 . 2]" 1 217 1 104 ASP H 1 104 ASP HA 2.700 2.700 7.700 2.875 2.872 2.878 . 0 0 "[ . 1 . 2]" 1 218 1 104 ASP H 1 104 ASP QB 0.000 . 3.500 2.202 2.153 2.262 . 0 0 "[ . 1 . 2]" 1 219 1 105 ALA H 1 105 ALA MB 0.000 . 3.500 2.090 1.954 2.158 . 0 0 "[ . 1 . 2]" 1 220 1 105 ALA H 1 105 ALA HA 2.700 2.700 7.700 2.891 2.883 2.896 . 0 0 "[ . 1 . 2]" 1 221 1 106 ILE H 1 106 ILE QG 0.000 . 3.500 1.951 1.913 2.043 . 0 0 "[ . 1 . 2]" 1 222 1 106 ILE H 1 106 ILE HA 2.700 2.700 7.700 2.850 2.844 2.857 . 0 0 "[ . 1 . 2]" 1 223 1 106 ILE H 1 106 ILE HB 0.000 . 2.700 2.412 2.385 2.423 . 0 0 "[ . 1 . 2]" 1 224 1 106 ILE H 1 106 ILE MD 0.000 . 5.000 2.986 2.910 3.076 . 0 0 "[ . 1 . 2]" 1 225 1 107 ARG H 1 107 ARG HB3 0.000 . 2.700 2.242 2.187 2.330 . 0 0 "[ . 1 . 2]" 1 226 1 107 ARG H 1 107 ARG HB2 0.000 . 2.700 2.599 2.526 2.664 . 0 0 "[ . 1 . 2]" 1 227 1 107 ARG H 1 107 ARG QG 0.000 . 5.000 3.859 3.836 3.902 . 0 0 "[ . 1 . 2]" 1 228 1 107 ARG H 1 107 ARG HA 2.700 2.700 7.700 2.839 2.835 2.845 . 0 0 "[ . 1 . 2]" 1 229 1 107 ARG H 1 107 ARG QD 0.000 . 5.000 4.447 4.297 4.514 . 0 0 "[ . 1 . 2]" 1 230 1 108 ARG H 1 108 ARG QG 0.000 . 4.000 2.027 1.955 2.067 . 0 0 "[ . 1 . 2]" 1 231 1 108 ARG H 1 108 ARG HA 2.700 2.700 7.700 2.882 2.877 2.886 . 0 0 "[ . 1 . 2]" 1 232 1 109 HIS H 1 109 HIS HB2 0.000 . 2.700 2.719 2.712 2.727 0.027 14 0 "[ . 1 . 2]" 1 233 1 109 HIS H 1 109 HIS HD1 0.000 . 4.200 4.276 4.269 4.284 0.084 1 0 "[ . 1 . 2]" 1 234 1 109 HIS H 1 109 HIS HA 2.700 2.700 7.700 2.880 2.877 2.882 . 0 0 "[ . 1 . 2]" 1 235 1 109 HIS H 1 109 HIS HB3 0.000 . 2.700 2.121 2.110 2.133 . 0 0 "[ . 1 . 2]" 1 236 1 110 VAL H 1 110 VAL HB 0.000 . 2.700 2.281 2.261 2.303 . 0 0 "[ . 1 . 2]" 1 237 1 110 VAL H 1 110 VAL HA 2.700 2.700 7.700 2.884 2.883 2.885 . 0 0 "[ . 1 . 2]" 1 238 1 110 VAL H 1 110 VAL MG2 0.000 . 3.500 2.212 2.179 2.237 . 0 0 "[ . 1 . 2]" 1 239 1 111 GLU H 1 111 GLU QB 0.000 . 3.500 2.327 2.282 2.340 . 0 0 "[ . 1 . 2]" 1 240 1 111 GLU H 1 111 GLU HA 2.700 2.700 7.700 2.863 2.856 2.868 . 0 0 "[ . 1 . 2]" 1 241 1 111 GLU H 1 111 GLU QG 0.000 . 3.500 2.058 2.037 2.117 . 0 0 "[ . 1 . 2]" 1 242 1 112 ALA H 1 112 ALA MB 0.000 . 3.500 2.098 2.085 2.129 . 0 0 "[ . 1 . 2]" 1 243 1 112 ALA H 1 112 ALA HA 2.700 2.700 7.700 2.888 2.885 2.893 . 0 0 "[ . 1 . 2]" 1 244 1 113 ASN H 1 113 ASN HB2 0.000 . 2.700 2.055 2.036 2.067 . 0 0 "[ . 1 . 2]" 1 245 1 113 ASN HA 1 113 ASN HD22 0.000 . 5.500 3.970 3.857 4.096 . 0 0 "[ . 1 . 2]" 1 246 1 113 ASN H 1 113 ASN HA 2.700 2.700 7.700 2.876 2.873 2.879 . 0 0 "[ . 1 . 2]" 1 247 1 113 ASN H 1 113 ASN HD21 0.000 . 5.500 2.317 2.156 2.481 . 0 0 "[ . 1 . 2]" 1 248 1 113 ASN H 1 113 ASN HD22 0.000 . 5.500 3.824 3.761 3.904 . 0 0 "[ . 1 . 2]" 1 249 1 115 GLY H 1 115 GLY HA3 2.700 2.700 7.700 2.517 2.504 2.532 0.196 20 0 "[ . 1 . 2]" 1 250 1 115 GLY H 1 115 GLY HA2 2.700 2.700 7.700 3.005 3.003 3.008 . 0 0 "[ . 1 . 2]" 1 251 1 116 HIS H 1 116 HIS QB 0.000 . 3.500 2.629 2.586 2.986 . 0 0 "[ . 1 . 2]" 1 252 1 116 HIS H 1 116 HIS HA 2.700 2.700 7.700 2.987 2.984 2.990 . 0 0 "[ . 1 . 2]" 1 253 1 117 PHE H 1 117 PHE QB 0.000 . 3.500 2.948 2.916 2.965 . 0 0 "[ . 1 . 2]" 1 254 1 117 PHE H 1 117 PHE HA 2.700 2.700 7.700 3.003 3.000 3.005 . 0 0 "[ . 1 . 2]" 1 255 1 117 PHE H 1 117 PHE HD2 2.700 2.700 7.700 2.676 2.637 2.731 0.063 3 0 "[ . 1 . 2]" 1 256 1 117 PHE H 1 117 PHE HD1 2.700 2.700 7.700 3.590 3.535 3.638 . 0 0 "[ . 1 . 2]" 1 257 1 119 THR H 1 119 THR HB 0.000 . 3.200 2.645 2.560 2.669 . 0 0 "[ . 1 . 2]" 1 258 1 119 THR H 1 119 THR HA 2.700 2.700 7.700 2.862 2.857 2.867 . 0 0 "[ . 1 . 2]" 1 259 1 119 THR H 1 119 THR MG 0.000 . 3.500 1.809 1.805 1.819 . 0 0 "[ . 1 . 2]" 1 260 1 120 ASP H 1 120 ASP HA 2.700 2.700 7.700 2.863 2.852 2.876 . 0 0 "[ . 1 . 2]" 1 261 1 120 ASP H 1 120 ASP QB 0.000 . 3.500 2.292 2.159 2.313 . 0 0 "[ . 1 . 2]" 1 262 1 121 VAL H 1 121 VAL MG2 0.000 . 3.500 2.552 2.526 2.570 . 0 0 "[ . 1 . 2]" 1 263 1 121 VAL H 1 121 VAL HA 2.700 2.700 7.700 2.942 2.940 2.947 . 0 0 "[ . 1 . 2]" 1 264 1 121 VAL H 1 121 VAL HB 0.000 . 2.700 2.210 2.201 2.221 . 0 0 "[ . 1 . 2]" 1 265 1 122 ASP H 1 122 ASP QB 0.000 . 3.500 2.224 2.179 2.273 . 0 0 "[ . 1 . 2]" 1 266 1 122 ASP H 1 122 ASP HA 2.700 2.700 7.700 2.872 2.870 2.873 . 0 0 "[ . 1 . 2]" 1 267 1 123 GLN H 1 123 GLN HA 2.700 2.700 7.700 2.904 2.898 2.909 . 0 0 "[ . 1 . 2]" 1 268 1 123 GLN H 1 123 GLN QG 0.000 . 3.500 2.506 2.217 3.157 . 0 0 "[ . 1 . 2]" 1 269 1 123 GLN H 1 123 GLN QB 0.000 . 3.500 2.175 1.948 2.275 . 0 0 "[ . 1 . 2]" 1 270 1 124 LYS H 1 124 LYS HA 2.700 2.700 7.700 2.846 2.835 2.852 . 0 0 "[ . 1 . 2]" 1 271 1 124 LYS H 1 124 LYS QD 0.000 . 5.000 3.687 3.557 3.726 . 0 0 "[ . 1 . 2]" 1 272 1 124 LYS H 1 124 LYS QG 0.000 . 3.500 2.165 2.088 2.234 . 0 0 "[ . 1 . 2]" 1 273 1 124 LYS H 1 124 LYS QB 0.000 . 3.500 2.284 2.256 2.321 . 0 0 "[ . 1 . 2]" 1 274 1 124 LYS H 1 124 LYS QE 0.000 . 5.000 4.297 4.187 4.453 . 0 0 "[ . 1 . 2]" 1 275 1 125 VAL H 1 125 VAL HB 0.000 . 2.700 2.075 2.053 2.105 . 0 0 "[ . 1 . 2]" 1 276 1 125 VAL H 1 125 VAL HA 2.700 2.700 7.700 2.880 2.878 2.882 . 0 0 "[ . 1 . 2]" 1 277 1 126 ASP H 1 126 ASP QB 0.000 . 3.500 2.153 2.149 2.157 . 0 0 "[ . 1 . 2]" 1 278 1 126 ASP H 1 126 ASP HA 2.700 2.700 7.700 2.877 2.875 2.879 . 0 0 "[ . 1 . 2]" 1 279 1 127 GLN H 1 127 GLN HA 2.700 2.700 7.700 2.880 2.878 2.884 . 0 0 "[ . 1 . 2]" 1 280 1 127 GLN H 1 127 GLN QG 0.000 . 3.500 1.842 1.835 1.845 . 0 0 "[ . 1 . 2]" 1 281 1 127 GLN H 1 127 GLN QB 0.000 . 3.500 2.360 2.351 2.374 . 0 0 "[ . 1 . 2]" 1 282 1 128 VAL H 1 128 VAL HB 0.000 . 2.700 2.295 2.283 2.303 . 0 0 "[ . 1 . 2]" 1 283 1 128 VAL H 1 128 VAL MG2 0.000 . 3.500 2.150 2.129 2.181 . 0 0 "[ . 1 . 2]" 1 284 1 128 VAL H 1 128 VAL HA 2.700 2.700 7.700 2.879 2.875 2.881 . 0 0 "[ . 1 . 2]" 1 285 1 129 ALA H 1 129 ALA HA 2.700 2.700 7.700 2.890 2.885 2.894 . 0 0 "[ . 1 . 2]" 1 286 1 129 ALA H 1 129 ALA MB 0.000 . 3.500 1.955 1.939 1.965 . 0 0 "[ . 1 . 2]" 1 287 1 130 ARG H 1 130 ARG HA 2.700 2.700 7.700 2.848 2.834 2.862 . 0 0 "[ . 1 . 2]" 1 288 1 130 ARG H 1 130 ARG HD2 0.000 . 5.500 4.807 4.299 4.980 . 0 0 "[ . 1 . 2]" 1 289 1 130 ARG H 1 130 ARG QG 0.000 . 4.000 3.481 1.908 3.756 . 0 0 "[ . 1 . 2]" 1 290 1 130 ARG H 1 130 ARG QB 0.000 . 3.500 2.048 1.925 2.567 . 0 0 "[ . 1 . 2]" 1 291 1 130 ARG H 1 130 ARG HD3 0.000 . 5.500 4.679 3.753 5.584 0.084 15 0 "[ . 1 . 2]" 1 292 1 131 GLN H 1 131 GLN QG 0.000 . 4.000 2.992 1.956 3.632 . 0 0 "[ . 1 . 2]" 1 293 1 131 GLN H 1 131 GLN HA 2.700 2.700 7.700 2.951 2.945 2.964 . 0 0 "[ . 1 . 2]" 1 294 1 132 GLY H 1 132 GLY HA2 0.000 . 2.700 2.397 2.385 2.426 . 0 0 "[ . 1 . 2]" 1 295 1 133 ALA H 1 133 ALA HA 2.700 2.700 5.900 2.998 2.992 3.000 . 0 0 "[ . 1 . 2]" 1 296 1 133 ALA H 1 133 ALA MB 0.000 . 3.500 2.192 2.104 2.261 . 0 0 "[ . 1 . 2]" 1 297 1 134 THR H 1 134 THR HB 0.000 . 3.200 2.548 2.325 2.745 . 0 0 "[ . 1 . 2]" 1 298 1 136 LEU H 1 136 LEU QD 0.000 . 4.700 2.900 2.826 2.989 . 0 0 "[ . 1 . 2]" 1 299 1 136 LEU H 1 136 LEU HG 0.000 . 3.200 2.455 2.395 2.520 . 0 0 "[ . 1 . 2]" 1 300 1 136 LEU H 1 136 LEU HA 2.700 2.700 7.700 2.986 2.984 2.987 . 0 0 "[ . 1 . 2]" 1 301 1 137 VAL H 1 137 VAL HB 0.000 . 3.200 2.410 2.374 2.524 . 0 0 "[ . 1 . 2]" 1 302 1 137 VAL H 1 137 VAL HA 2.700 2.700 7.700 2.983 2.978 2.987 . 0 0 "[ . 1 . 2]" 1 303 1 138 VAL H 1 138 VAL MG2 0.000 . 4.000 2.972 2.914 3.061 . 0 0 "[ . 1 . 2]" 1 304 1 138 VAL H 1 138 VAL HB 0.000 . 2.700 2.408 2.370 2.438 . 0 0 "[ . 1 . 2]" 1 305 1 138 VAL H 1 138 VAL HA 2.700 2.700 7.700 2.989 2.987 2.992 . 0 0 "[ . 1 . 2]" 1 306 1 139 VAL H 1 139 VAL HB 0.000 . 4.200 3.594 3.583 3.612 . 0 0 "[ . 1 . 2]" 1 307 1 139 VAL HA 1 139 VAL HB 0.000 . 2.700 2.601 2.593 2.611 . 0 0 "[ . 1 . 2]" 1 308 1 139 VAL H 1 139 VAL HA 2.700 2.700 7.700 2.989 2.987 2.990 . 0 0 "[ . 1 . 2]" 1 309 1 140 GLU H 1 140 GLU QG 0.000 . 4.000 3.635 3.626 3.641 . 0 0 "[ . 1 . 2]" 1 310 1 140 GLU H 1 140 GLU HA 2.700 2.700 7.700 2.963 2.960 2.965 . 0 0 "[ . 1 . 2]" 1 311 1 142 SER H 1 142 SER HB2 0.000 . 4.200 3.567 3.467 3.636 . 0 0 "[ . 1 . 2]" 1 312 1 142 SER H 1 142 SER HA 2.700 2.700 7.700 2.993 2.987 3.003 . 0 0 "[ . 1 . 2]" 1 313 1 142 SER H 1 142 SER HB3 0.000 . 3.200 2.996 2.789 3.225 0.025 19 0 "[ . 1 . 2]" 1 314 1 143 ARG H 1 143 ARG HB3 0.000 . 3.200 2.824 2.759 2.893 . 0 0 "[ . 1 . 2]" 1 315 1 143 ARG H 1 143 ARG HA 2.700 2.700 7.700 3.001 2.998 3.002 . 0 0 "[ . 1 . 2]" 1 316 1 143 ARG H 1 143 ARG QG 0.000 . 5.000 1.980 1.920 2.018 . 0 0 "[ . 1 . 2]" 1 317 1 143 ARG H 1 143 ARG HB2 0.000 . 4.200 3.739 3.706 3.776 . 0 0 "[ . 1 . 2]" 1 318 1 144 VAL H 1 144 VAL HA 2.700 2.700 7.700 2.961 2.948 2.972 . 0 0 "[ . 1 . 2]" 1 319 1 144 VAL H 1 144 VAL MG2 0.000 . 3.500 2.168 2.057 2.301 . 0 0 "[ . 1 . 2]" 1 320 1 144 VAL H 1 144 VAL HB 0.000 . 3.200 2.430 2.385 2.467 . 0 0 "[ . 1 . 2]" 1 321 1 145 LEU H 1 145 LEU HB3 0.000 . 3.200 3.059 3.013 3.103 . 0 0 "[ . 1 . 2]" 1 322 1 145 LEU H 1 145 LEU HB2 0.000 . 4.200 3.605 3.595 3.614 . 0 0 "[ . 1 . 2]" 1 323 1 145 LEU H 1 145 LEU HG 0.000 . 4.200 1.705 1.692 1.732 . 0 0 "[ . 1 . 2]" 1 324 1 145 LEU H 1 145 LEU HA 2.700 2.700 7.700 2.962 2.959 2.966 . 0 0 "[ . 1 . 2]" 1 325 1 146 GLY H 1 146 GLY HA3 2.700 2.700 7.700 2.936 2.928 2.941 . 0 0 "[ . 1 . 2]" 1 326 1 146 GLY H 1 146 GLY HA2 2.700 2.700 7.700 2.762 2.753 2.773 . 0 0 "[ . 1 . 2]" 1 327 1 147 VAL H 1 147 VAL HB 0.000 . 3.200 2.549 2.536 2.570 . 0 0 "[ . 1 . 2]" 1 328 1 147 VAL H 1 147 VAL HA 2.700 2.700 7.700 3.003 3.001 3.005 . 0 0 "[ . 1 . 2]" 1 329 1 147 VAL H 1 147 VAL MG2 0.000 . 4.000 2.534 2.507 2.569 . 0 0 "[ . 1 . 2]" 1 330 1 148 ILE H 1 148 ILE HA 2.700 2.700 7.700 2.982 2.980 2.984 . 0 0 "[ . 1 . 2]" 1 331 1 148 ILE H 1 148 ILE QG 0.000 . 4.000 2.459 2.429 2.480 . 0 0 "[ . 1 . 2]" 1 332 1 148 ILE H 1 148 ILE HB 0.000 . 3.200 2.396 2.382 2.411 . 0 0 "[ . 1 . 2]" 1 333 1 148 ILE H 1 148 ILE MD 0.000 . 5.000 3.661 3.633 3.690 . 0 0 "[ . 1 . 2]" 1 334 1 149 ALA H 1 149 ALA HA 2.700 2.700 7.700 2.959 2.955 2.974 . 0 0 "[ . 1 . 2]" 1 335 1 149 ALA H 1 149 ALA MB 0.000 . 3.500 2.202 2.174 2.227 . 0 0 "[ . 1 . 2]" 1 336 1 150 LEU H 1 150 LEU HB3 0.000 . 4.200 3.611 3.606 3.631 . 0 0 "[ . 1 . 2]" 1 337 1 150 LEU H 1 150 LEU HA 2.700 2.700 7.700 2.972 2.968 2.984 . 0 0 "[ . 1 . 2]" 1 338 1 150 LEU H 1 150 LEU HB2 0.000 . 3.200 2.640 2.441 2.680 . 0 0 "[ . 1 . 2]" 1 339 1 150 LEU H 1 150 LEU HG 0.000 . 4.200 2.044 1.921 3.013 . 0 0 "[ . 1 . 2]" 1 340 1 151 LYS H 1 151 LYS QE 0.000 . 6.300 4.507 3.723 5.288 . 0 0 "[ . 1 . 2]" 1 341 1 151 LYS H 1 151 LYS QG 0.000 . 5.000 2.488 1.942 2.881 . 0 0 "[ . 1 . 2]" 1 342 1 151 LYS H 1 151 LYS QD 0.000 . 5.000 4.139 3.601 4.524 . 0 0 "[ . 1 . 2]" 1 343 1 151 LYS H 1 151 LYS HA 2.700 2.700 7.700 2.994 2.987 3.002 . 0 0 "[ . 1 . 2]" 1 344 1 152 ASP H 1 152 ASP HB3 0.000 . 2.700 2.506 2.485 2.526 . 0 0 "[ . 1 . 2]" 1 345 1 152 ASP H 1 152 ASP HB2 0.000 . 2.700 2.492 2.372 2.691 . 0 0 "[ . 1 . 2]" 1 346 1 153 ILE H 1 153 ILE MG 0.000 . 4.000 2.140 2.057 2.243 . 0 0 "[ . 1 . 2]" 1 347 1 153 ILE H 1 153 ILE HB 0.000 . 2.700 2.719 2.598 2.770 0.070 7 0 "[ . 1 . 2]" 1 348 1 153 ILE H 1 153 ILE QG 0.000 . 5.000 4.118 4.008 4.156 . 0 0 "[ . 1 . 2]" 1 349 1 153 ILE H 1 153 ILE HA 2.700 2.700 7.700 2.998 2.989 3.001 . 0 0 "[ . 1 . 2]" 1 350 1 153 ILE H 1 153 ILE MD 0.000 . 5.000 4.098 4.011 4.256 . 0 0 "[ . 1 . 2]" 1 351 1 154 VAL H 1 154 VAL HB 0.000 . 2.700 2.478 2.430 2.708 0.008 9 0 "[ . 1 . 2]" 1 352 1 154 VAL H 1 154 VAL HA 2.700 2.700 7.700 2.984 2.981 2.987 . 0 0 "[ . 1 . 2]" 1 353 1 155 LYS H 1 155 LYS HA 2.700 2.700 7.700 2.966 2.963 2.974 . 0 0 "[ . 1 . 2]" 1 354 1 22 ARG QG 1 23 GLN H 0.000 . 5.000 4.045 4.012 4.086 . 0 0 "[ . 1 . 2]" 1 355 1 22 ARG H 1 23 GLN H 3.200 3.200 8.200 4.502 4.467 4.674 . 0 0 "[ . 1 . 2]" 1 356 1 22 ARG HA 1 23 GLN H 0.000 . 2.700 2.287 2.256 2.314 . 0 0 "[ . 1 . 2]" 1 357 1 23 GLN HA 1 24 ALA H 0.000 . 2.700 2.289 2.237 2.365 . 0 0 "[ . 1 . 2]" 1 358 1 23 GLN H 1 24 ALA H 3.200 3.200 8.200 4.454 4.401 4.488 . 0 0 "[ . 1 . 2]" 1 359 1 23 GLN QB 1 24 ALA H 0.000 . 5.000 3.233 2.818 3.812 . 0 0 "[ . 1 . 2]" 1 360 1 24 ALA H 1 25 SER H 3.200 3.200 8.200 4.658 4.648 4.673 . 0 0 "[ . 1 . 2]" 1 361 1 24 ALA HA 1 25 SER H 0.000 . 2.700 2.258 2.245 2.280 . 0 0 "[ . 1 . 2]" 1 362 1 25 SER HA 1 26 GLU QG 0.000 . 6.300 4.825 3.911 5.688 . 0 0 "[ . 1 . 2]" 1 363 1 24 ALA MB 1 25 SER H 0.000 . 4.000 3.070 3.038 3.114 . 0 0 "[ . 1 . 2]" 1 364 1 25 SER H 1 26 GLU H 0.000 . 2.700 2.017 1.950 2.101 . 0 0 "[ . 1 . 2]" 1 365 1 25 SER HA 1 26 GLU H 2.700 2.700 7.700 3.565 3.545 3.581 . 0 0 "[ . 1 . 2]" 1 366 1 25 SER HB2 1 26 GLU H 0.000 . 3.200 2.723 2.458 2.913 . 0 0 "[ . 1 . 2]" 1 367 1 26 GLU H 1 27 PHE H 3.200 3.200 8.200 4.358 4.323 4.403 . 0 0 "[ . 1 . 2]" 1 368 1 25 SER HB3 1 26 GLU H 0.000 . 4.200 3.406 3.137 3.725 . 0 0 "[ . 1 . 2]" 1 369 1 26 GLU QG 1 27 PHE H 0.000 . 4.000 2.977 2.277 3.621 . 0 0 "[ . 1 . 2]" 1 370 1 26 GLU QB 1 27 PHE H 0.000 . 4.000 3.225 2.812 3.572 . 0 0 "[ . 1 . 2]" 1 371 1 27 PHE H 1 28 ILE H 3.200 3.200 8.200 4.431 4.392 4.477 . 0 0 "[ . 1 . 2]" 1 372 1 27 PHE H 1 28 ILE QG 0.000 . 6.300 4.489 4.234 4.764 . 0 0 "[ . 1 . 2]" 1 373 1 27 PHE HA 1 28 ILE QG 0.000 . 5.000 4.161 3.712 4.450 . 0 0 "[ . 1 . 2]" 1 374 1 26 GLU HA 1 27 PHE H 0.000 . 2.700 2.323 2.294 2.348 . 0 0 "[ . 1 . 2]" 1 375 1 27 PHE HA 1 28 ILE MD 0.000 . 6.300 3.507 2.776 4.387 . 0 0 "[ . 1 . 2]" 1 376 1 26 GLU QG 1 27 PHE HA 0.000 . 6.300 4.889 4.120 5.644 . 0 0 "[ . 1 . 2]" 1 377 1 26 GLU QB 1 27 PHE HA 0.000 . 6.300 4.158 3.995 4.314 . 0 0 "[ . 1 . 2]" 1 378 1 27 PHE HA 1 28 ILE H 0.000 . 2.700 2.246 2.207 2.348 . 0 0 "[ . 1 . 2]" 1 379 1 28 ILE H 1 29 PRO HD2 3.200 3.200 8.200 5.216 5.181 5.235 . 0 0 "[ . 1 . 2]" 1 380 1 28 ILE H 1 29 PRO HD3 3.200 3.200 8.200 4.626 4.562 4.650 . 0 0 "[ . 1 . 2]" 1 381 1 28 ILE MG 1 29 PRO QD 0.000 . 4.300 1.846 1.805 1.916 . 0 0 "[ . 1 . 2]" 1 382 1 27 PHE HB2 1 28 ILE H 0.000 . 4.200 3.014 2.719 3.157 . 0 0 "[ . 1 . 2]" 1 383 1 28 ILE HA 1 29 PRO HD3 0.000 . 2.700 1.853 1.842 1.863 . 0 0 "[ . 1 . 2]" 1 384 1 28 ILE HA 1 29 PRO HD2 0.000 . 2.700 2.713 2.663 2.733 0.033 10 0 "[ . 1 . 2]" 1 385 1 29 PRO HA 1 30 ALA H 0.000 . 2.700 2.184 2.172 2.196 . 0 0 "[ . 1 . 2]" 1 386 1 30 ALA H 1 31 GLN H 3.200 3.200 8.200 4.623 4.619 4.633 . 0 0 "[ . 1 . 2]" 1 387 1 30 ALA HA 1 31 GLN QB 0.000 . 5.000 4.147 4.133 4.160 . 0 0 "[ . 1 . 2]" 1 388 1 29 PRO HB3 1 30 ALA H 0.000 . 4.200 3.488 3.446 3.506 . 0 0 "[ . 1 . 2]" 1 389 1 29 PRO HB2 1 30 ALA H 0.000 . 5.500 3.390 3.353 3.411 . 0 0 "[ . 1 . 2]" 1 390 1 30 ALA MB 1 31 GLN H 0.000 . 4.000 2.892 2.870 2.918 . 0 0 "[ . 1 . 2]" 1 391 1 30 ALA HA 1 31 GLN H 0.000 . 2.700 2.342 2.334 2.357 . 0 0 "[ . 1 . 2]" 1 392 1 31 GLN H 1 32 GLY H 3.200 3.200 8.200 4.562 4.556 4.565 . 0 0 "[ . 1 . 2]" 1 393 1 31 GLN HA 1 32 GLY H 0.000 . 2.700 2.154 2.147 2.158 . 0 0 "[ . 1 . 2]" 1 394 1 32 GLY H 1 33 VAL MG2 0.000 . 6.300 4.392 4.314 4.460 . 0 0 "[ . 1 . 2]" 1 395 1 32 GLY QA 1 33 VAL MG2 0.000 . 4.800 3.163 3.102 3.216 . 0 0 "[ . 1 . 2]" 1 396 1 31 GLN HB2 1 32 GLY H 0.000 . 4.200 4.316 4.303 4.323 0.123 13 0 "[ . 1 . 2]" 1 397 1 31 GLN QG 1 32 GLY QA 0.000 . 4.800 3.323 3.283 3.346 . 0 0 "[ . 1 . 2]" 1 398 1 32 GLY H 1 33 VAL H 0.000 . 2.700 2.364 2.315 2.606 . 0 0 "[ . 1 . 2]" 1 399 1 31 GLN QG 1 32 GLY H 0.000 . 4.000 2.756 2.703 2.860 . 0 0 "[ . 1 . 2]" 1 400 1 31 GLN HB3 1 32 GLY H 0.000 . 4.200 4.186 4.166 4.206 0.006 4 0 "[ . 1 . 2]" 1 401 1 33 VAL HA 1 34 ASP QB 0.000 . 5.000 4.352 4.304 4.429 . 0 0 "[ . 1 . 2]" 1 402 1 32 GLY QA 1 33 VAL HA 0.000 . 5.000 4.044 4.018 4.051 . 0 0 "[ . 1 . 2]" 1 403 1 33 VAL MG1 1 34 ASP HA 0.000 . 5.000 4.124 4.010 4.176 . 0 0 "[ . 1 . 2]" 1 404 1 32 GLY QA 1 33 VAL H 0.000 . 3.500 2.956 2.853 2.972 . 0 0 "[ . 1 . 2]" 1 405 1 33 VAL HB 1 34 ASP H 0.000 . 4.200 4.094 4.071 4.121 . 0 0 "[ . 1 . 2]" 1 406 1 33 VAL MG1 1 34 ASP H 0.000 . 4.000 2.373 2.231 2.572 . 0 0 "[ . 1 . 2]" 1 407 1 34 ASP H 1 35 GLU H 3.200 3.200 8.200 4.676 4.663 4.679 . 0 0 "[ . 1 . 2]" 1 408 1 33 VAL HA 1 34 ASP H 0.000 . 2.700 2.238 2.224 2.257 . 0 0 "[ . 1 . 2]" 1 409 1 33 VAL MG2 1 34 ASP H 0.000 . 5.000 4.051 3.999 4.072 . 0 0 "[ . 1 . 2]" 1 410 1 34 ASP HA 1 35 GLU H 0.000 . 2.700 2.338 2.307 2.354 . 0 0 "[ . 1 . 2]" 1 411 1 34 ASP QB 1 35 GLU H 0.000 . 3.500 2.880 2.842 3.020 . 0 0 "[ . 1 . 2]" 1 412 1 35 GLU H 1 36 LYS H 0.000 . 3.200 2.781 2.706 2.810 . 0 0 "[ . 1 . 2]" 1 413 1 35 GLU HB2 1 36 LYS H 0.000 . 4.200 3.836 3.810 3.875 . 0 0 "[ . 1 . 2]" 1 414 1 35 GLU HA 1 36 LYS H 0.000 . 5.500 3.573 3.546 3.585 . 0 0 "[ . 1 . 2]" 1 415 1 36 LYS H 1 37 THR H 0.000 . 2.700 2.689 2.656 2.711 0.011 5 0 "[ . 1 . 2]" 1 416 1 35 GLU QG 1 36 LYS H 0.000 . 6.300 3.738 3.690 3.840 . 0 0 "[ . 1 . 2]" 1 417 1 37 THR H 1 38 LEU QB 0.000 . 6.300 4.251 4.194 4.278 . 0 0 "[ . 1 . 2]" 1 418 1 36 LYS HA 1 37 THR H 3.200 3.200 8.200 3.557 3.540 3.568 . 0 0 "[ . 1 . 2]" 1 419 1 36 LYS QB 1 37 THR H 0.000 . 4.000 2.385 2.321 2.523 . 0 0 "[ . 1 . 2]" 1 420 1 36 LYS QE 1 37 THR H 0.000 . 5.000 4.537 4.490 4.556 . 0 0 "[ . 1 . 2]" 1 421 1 36 LYS QD 1 37 THR H 0.000 . 6.300 4.700 4.411 5.328 . 0 0 "[ . 1 . 2]" 1 422 1 36 LYS QG 1 37 THR H 0.000 . 6.300 3.775 3.619 4.167 . 0 0 "[ . 1 . 2]" 1 423 1 37 THR HB 1 38 LEU H 0.000 . 3.200 2.447 2.403 2.692 . 0 0 "[ . 1 . 2]" 1 424 1 37 THR MG 1 38 LEU H 0.000 . 4.000 3.338 3.114 3.355 . 0 0 "[ . 1 . 2]" 1 425 1 37 THR HA 1 38 LEU H 0.000 . 5.500 3.566 3.557 3.573 . 0 0 "[ . 1 . 2]" 1 426 1 37 THR H 1 38 LEU H 0.000 . 2.700 2.710 2.654 2.733 0.033 9 0 "[ . 1 . 2]" 1 427 1 38 LEU H 1 39 ALA MB 0.000 . 6.300 4.186 4.171 4.213 . 0 0 "[ . 1 . 2]" 1 428 1 38 LEU QB 1 39 ALA H 0.000 . 4.000 2.657 2.617 2.715 . 0 0 "[ . 1 . 2]" 1 429 1 39 ALA H 1 40 ASP H 0.000 . 2.700 2.731 2.718 2.745 0.045 11 0 "[ . 1 . 2]" 1 430 1 38 LEU HA 1 39 ALA H 3.200 3.200 8.200 3.568 3.565 3.571 . 0 0 "[ . 1 . 2]" 1 431 1 38 LEU H 1 39 ALA H 0.000 . 2.700 2.719 2.708 2.733 0.033 16 0 "[ . 1 . 2]" 1 432 1 38 LEU HG 1 39 ALA H 0.000 . 4.200 3.130 2.957 3.220 . 0 0 "[ . 1 . 2]" 1 433 1 39 ALA MB 1 40 ASP HA 0.000 . 5.000 3.708 3.689 3.740 . 0 0 "[ . 1 . 2]" 1 434 1 39 ALA HA 1 40 ASP H 0.000 . 4.200 3.575 3.568 3.582 . 0 0 "[ . 1 . 2]" 1 435 1 39 ALA MB 1 40 ASP H 0.000 . 4.000 2.552 2.471 2.629 . 0 0 "[ . 1 . 2]" 1 436 1 40 ASP H 1 41 ALA H 0.000 . 2.700 2.781 2.771 2.793 0.093 16 0 "[ . 1 . 2]" 1 437 1 40 ASP QB 1 41 ALA H 0.000 . 3.500 2.317 2.254 2.356 . 0 0 "[ . 1 . 2]" 1 438 1 40 ASP HA 1 41 ALA H 0.000 . 4.200 3.590 3.586 3.592 . 0 0 "[ . 1 . 2]" 1 439 1 41 ALA H 1 42 ALA H 0.000 . 2.700 2.536 2.518 2.555 . 0 0 "[ . 1 . 2]" 1 440 1 41 ALA HA 1 42 ALA H 3.200 3.200 8.200 3.523 3.519 3.528 . 0 0 "[ . 1 . 2]" 1 441 1 41 ALA HA 1 42 ALA HA 0.000 . 5.500 4.905 4.895 4.910 . 0 0 "[ . 1 . 2]" 1 442 1 42 ALA H 1 43 GLN H 0.000 . 2.700 2.621 2.616 2.627 . 0 0 "[ . 1 . 2]" 1 443 1 43 GLN H 1 44 LEU QD 0.000 . 7.000 3.550 3.506 3.590 . 0 0 "[ . 1 . 2]" 1 444 1 42 ALA MB 1 43 GLN H 0.000 . 3.500 2.621 2.601 2.642 . 0 0 "[ . 1 . 2]" 1 445 1 42 ALA HA 1 43 GLN H 0.000 . 4.200 3.530 3.527 3.534 . 0 0 "[ . 1 . 2]" 1 446 1 42 ALA HA 1 43 GLN HA 0.000 . 5.500 4.796 4.787 4.806 . 0 0 "[ . 1 . 2]" 1 447 1 43 GLN HA 1 44 LEU H 3.200 3.200 8.200 3.604 3.600 3.607 . 0 0 "[ . 1 . 2]" 1 448 1 43 GLN QG 1 44 LEU H 0.000 . 5.000 4.165 4.135 4.183 . 0 0 "[ . 1 . 2]" 1 449 1 43 GLN H 1 44 LEU H 0.000 . 2.700 2.760 2.752 2.766 0.066 14 0 "[ . 1 . 2]" 1 450 1 43 GLN QB 1 44 LEU H 0.000 . 4.000 2.326 2.299 2.343 . 0 0 "[ . 1 . 2]" 1 451 1 45 ALA H 1 46 SER QB 0.000 . 6.300 4.527 4.477 4.592 . 0 0 "[ . 1 . 2]" 1 452 1 44 LEU HA 1 45 ALA H 0.000 . 5.500 3.515 3.510 3.517 . 0 0 "[ . 1 . 2]" 1 453 1 44 LEU HG 1 45 ALA H 0.000 . 5.500 2.198 2.160 2.224 . 0 0 "[ . 1 . 2]" 1 454 1 44 LEU H 1 45 ALA H 0.000 . 2.700 2.766 2.743 2.788 0.088 11 0 "[ . 1 . 2]" 1 455 1 44 LEU QB 1 45 ALA H 0.000 . 4.000 3.315 3.269 3.383 . 0 0 "[ . 1 . 2]" 1 456 1 45 ALA MB 1 46 SER H 0.000 . 4.000 2.847 2.831 2.877 . 0 0 "[ . 1 . 2]" 1 457 1 45 ALA HA 1 46 SER H 2.700 2.700 7.700 3.495 3.479 3.502 . 0 0 "[ . 1 . 2]" 1 458 1 46 SER H 1 47 LEU QD 0.000 . 5.700 3.550 3.493 3.568 . 0 0 "[ . 1 . 2]" 1 459 1 45 ALA H 1 46 SER H 0.000 . 2.700 2.523 2.513 2.536 . 0 0 "[ . 1 . 2]" 1 460 1 46 SER HA 1 47 LEU H 0.000 . 3.200 3.237 3.224 3.254 0.054 11 0 "[ . 1 . 2]" 1 461 1 46 SER H 1 47 LEU H 0.000 . 2.700 2.487 2.461 2.513 . 0 0 "[ . 1 . 2]" 1 462 1 46 SER QB 1 47 LEU H 0.000 . 5.000 3.922 3.913 3.932 . 0 0 "[ . 1 . 2]" 1 463 1 47 LEU H 1 48 ALA H 0.000 . 2.700 2.607 2.588 2.637 . 0 0 "[ . 1 . 2]" 1 464 1 47 LEU HB3 1 48 ALA HA 0.000 . 5.500 4.430 4.393 4.445 . 0 0 "[ . 1 . 2]" 1 465 1 47 LEU HB3 1 48 ALA H 0.000 . 4.200 3.498 3.474 3.519 . 0 0 "[ . 1 . 2]" 1 466 1 47 LEU MD2 1 48 ALA H 0.000 . 5.000 4.280 4.264 4.306 . 0 0 "[ . 1 . 2]" 1 467 1 47 LEU HB2 1 48 ALA HA 0.000 . 4.200 4.132 4.108 4.166 . 0 0 "[ . 1 . 2]" 1 468 1 47 LEU HA 1 48 ALA H 2.700 2.700 7.700 3.505 3.500 3.514 . 0 0 "[ . 1 . 2]" 1 469 1 48 ALA H 1 49 ASP H 0.000 . 2.700 2.542 2.507 2.566 . 0 0 "[ . 1 . 2]" 1 470 1 47 LEU MD1 1 48 ALA H 0.000 . 5.000 4.240 4.220 4.251 . 0 0 "[ . 1 . 2]" 1 471 1 47 LEU HG 1 48 ALA H 0.000 . 4.200 3.798 3.788 3.816 . 0 0 "[ . 1 . 2]" 1 472 1 47 LEU HB2 1 48 ALA H 0.000 . 4.200 2.238 2.212 2.261 . 0 0 "[ . 1 . 2]" 1 473 1 48 ALA MB 1 49 ASP H 0.000 . 4.000 3.291 3.243 3.328 . 0 0 "[ . 1 . 2]" 1 474 1 48 ALA HA 1 49 ASP H 2.700 2.700 7.700 3.333 3.321 3.347 . 0 0 "[ . 1 . 2]" 1 475 1 48 ALA MB 1 49 ASP HA 0.000 . 5.000 4.077 4.053 4.105 . 0 0 "[ . 1 . 2]" 1 476 1 49 ASP HA 1 50 GLU HB3 0.000 . 5.500 5.594 5.591 5.598 0.098 19 0 "[ . 1 . 2]" 1 477 1 49 ASP HA 1 50 GLU HA 0.000 . 5.500 4.439 4.437 4.444 . 0 0 "[ . 1 . 2]" 1 478 1 49 ASP H 1 50 GLU H 2.700 2.700 7.700 4.562 4.556 4.565 . 0 0 "[ . 1 . 2]" 1 479 1 49 ASP HA 1 50 GLU H 0.000 . 2.700 2.142 2.139 2.144 . 0 0 "[ . 1 . 2]" 1 480 1 49 ASP HB3 1 50 GLU H 0.000 . 4.200 4.139 4.130 4.156 . 0 0 "[ . 1 . 2]" 1 481 1 49 ASP HB2 1 50 GLU H 0.000 . 3.200 3.332 3.325 3.337 0.137 19 0 "[ . 1 . 2]" 1 482 1 50 GLU H 1 51 THR H 0.000 . 2.700 2.381 2.358 2.392 . 0 0 "[ . 1 . 2]" 1 483 1 50 GLU H 1 51 THR MG 0.000 . 5.000 2.889 2.871 2.909 . 0 0 "[ . 1 . 2]" 1 484 1 51 THR H 1 52 PRO QD 3.200 3.200 8.200 4.389 4.385 4.397 . 0 0 "[ . 1 . 2]" 1 485 1 50 GLU HB2 1 51 THR H 0.000 . 4.200 3.525 3.501 3.538 . 0 0 "[ . 1 . 2]" 1 486 1 50 GLU QG 1 51 THR H 0.000 . 5.000 4.245 4.231 4.252 . 0 0 "[ . 1 . 2]" 1 487 1 50 GLU HA 1 51 THR H 2.700 2.700 7.700 3.255 3.246 3.268 . 0 0 "[ . 1 . 2]" 1 488 1 50 GLU HB3 1 51 THR H 0.000 . 4.200 4.271 4.264 4.275 0.075 10 0 "[ . 1 . 2]" 1 489 1 51 THR HA 1 52 PRO QG 0.000 . 5.000 3.915 3.874 3.951 . 0 0 "[ . 1 . 2]" 1 490 1 51 THR HA 1 52 PRO HD3 0.000 . 2.700 2.346 2.041 2.483 . 0 0 "[ . 1 . 2]" 1 491 1 51 THR HA 1 52 PRO HD2 0.000 . 2.700 2.276 2.141 2.555 . 0 0 "[ . 1 . 2]" 1 492 1 53 GLU H 1 54 GLY H 0.000 . 2.700 2.618 2.612 2.626 . 0 0 "[ . 1 . 2]" 1 493 1 53 GLU H 1 54 GLY QA 0.000 . 6.300 4.512 4.505 4.520 . 0 0 "[ . 1 . 2]" 1 494 1 52 PRO HA 1 53 GLU H 2.700 2.700 7.700 3.549 3.542 3.557 . 0 0 "[ . 1 . 2]" 1 495 1 52 PRO HD3 1 53 GLU H 3.200 3.200 5.500 4.010 3.987 4.027 . 0 0 "[ . 1 . 2]" 1 496 1 52 PRO QB 1 53 GLU H 0.000 . 3.500 2.834 2.567 2.978 . 0 0 "[ . 1 . 2]" 1 497 1 52 PRO QG 1 53 GLU H 0.000 . 5.000 2.872 2.508 3.639 . 0 0 "[ . 1 . 2]" 1 498 1 53 GLU HB3 1 54 GLY HA2 0.000 . 5.500 4.418 4.386 4.458 . 0 0 "[ . 1 . 2]" 1 499 1 53 GLU QG 1 54 GLY H 0.000 . 5.000 4.126 4.085 4.167 . 0 0 "[ . 1 . 2]" 1 500 1 53 GLU HA 1 54 GLY H 3.200 3.200 8.200 3.527 3.522 3.533 . 0 0 "[ . 1 . 2]" 1 501 1 54 GLY H 1 55 ARG H 0.000 . 2.700 2.795 2.782 2.808 0.108 10 0 "[ . 1 . 2]" 1 502 1 53 GLU HB3 1 54 GLY HA3 0.000 . 5.500 5.397 5.373 5.426 . 0 0 "[ . 1 . 2]" 1 503 1 53 GLU QB 1 54 GLY H 0.000 . 3.500 2.744 2.709 2.774 . 0 0 "[ . 1 . 2]" 1 504 1 54 GLY QA 1 55 ARG H 2.700 2.700 7.700 2.742 2.722 2.762 . 0 0 "[ . 1 . 2]" 1 505 1 55 ARG QD 1 56 SER H 0.000 . 6.300 4.773 4.750 4.814 . 0 0 "[ . 1 . 2]" 1 506 1 55 ARG QB 1 56 SER H 0.000 . 4.000 2.582 2.554 2.622 . 0 0 "[ . 1 . 2]" 1 507 1 55 ARG HA 1 56 SER H 0.000 . 4.200 3.556 3.550 3.561 . 0 0 "[ . 1 . 2]" 1 508 1 55 ARG QG 1 56 SER H 0.000 . 6.300 4.021 3.976 4.042 . 0 0 "[ . 1 . 2]" 1 509 1 55 ARG H 1 56 SER H 0.000 . 2.700 2.438 2.424 2.457 . 0 0 "[ . 1 . 2]" 1 510 1 56 SER QB 1 57 ILE H 0.000 . 5.000 2.578 2.511 3.381 . 0 0 "[ . 1 . 2]" 1 511 1 56 SER H 1 57 ILE H 0.000 . 2.700 2.739 2.728 2.746 0.046 10 0 "[ . 1 . 2]" 1 512 1 56 SER HA 1 57 ILE H 0.000 . 4.200 3.559 3.556 3.564 . 0 0 "[ . 1 . 2]" 1 513 1 57 ILE H 1 58 VAL H 0.000 . 2.700 2.734 2.719 2.742 0.042 19 0 "[ . 1 . 2]" 1 514 1 57 ILE QG 1 58 VAL H 0.000 . 6.300 3.923 3.892 3.955 . 0 0 "[ . 1 . 2]" 1 515 1 57 ILE HA 1 58 VAL H 2.700 2.700 7.700 3.589 3.585 3.593 . 0 0 "[ . 1 . 2]" 1 516 1 57 ILE HB 1 58 VAL H 0.000 . 3.200 2.334 2.314 2.361 . 0 0 "[ . 1 . 2]" 1 517 1 58 VAL HA 1 59 ILE H 0.000 . 5.500 3.527 3.520 3.534 . 0 0 "[ . 1 . 2]" 1 518 1 58 VAL MG1 1 59 ILE H 0.000 . 6.300 3.720 3.693 3.762 . 0 0 "[ . 1 . 2]" 1 519 1 58 VAL HB 1 59 ILE H 0.000 . 4.200 2.683 2.659 2.706 . 0 0 "[ . 1 . 2]" 1 520 1 58 VAL H 1 59 ILE H 0.000 . 2.700 2.693 2.660 2.714 0.014 5 0 "[ . 1 . 2]" 1 521 1 59 ILE HA 1 60 LEU HA 0.000 . 5.500 4.890 4.881 4.903 . 0 0 "[ . 1 . 2]" 1 522 1 59 ILE H 1 60 LEU H 0.000 . 2.700 2.456 2.445 2.469 . 0 0 "[ . 1 . 2]" 1 523 1 58 VAL MG2 1 59 ILE H 0.000 . 6.300 3.763 3.738 3.780 . 0 0 "[ . 1 . 2]" 1 524 1 59 ILE MG 1 60 LEU H 0.000 . 5.000 3.662 3.624 3.690 . 0 0 "[ . 1 . 2]" 1 525 1 59 ILE HA 1 60 LEU H 3.200 3.200 8.200 3.547 3.540 3.559 . 0 0 "[ . 1 . 2]" 1 526 1 59 ILE MD 1 60 LEU H 0.000 . 6.300 4.352 4.320 4.401 . 0 0 "[ . 1 . 2]" 1 527 1 59 ILE HB 1 60 LEU H 0.000 . 3.200 2.744 2.713 2.787 . 0 0 "[ . 1 . 2]" 1 528 1 59 ILE QG 1 60 LEU H 0.000 . 5.000 4.040 4.022 4.057 . 0 0 "[ . 1 . 2]" 1 529 1 60 LEU QB 1 61 ALA H 0.000 . 5.000 2.515 2.485 2.561 . 0 0 "[ . 1 . 2]" 1 530 1 60 LEU H 1 61 ALA H 0.000 . 2.700 2.742 2.731 2.753 0.053 17 0 "[ . 1 . 2]" 1 531 1 60 LEU QD 1 61 ALA H 0.000 . 7.000 3.288 3.155 3.397 . 0 0 "[ . 1 . 2]" 1 532 1 60 LEU HG 1 61 ALA H 0.000 . 5.500 3.721 3.669 3.788 . 0 0 "[ . 1 . 2]" 1 533 1 60 LEU HA 1 61 ALA H 0.000 . 5.500 3.557 3.554 3.559 . 0 0 "[ . 1 . 2]" 1 534 1 61 ALA H 1 62 LYS H 0.000 . 2.700 2.727 2.710 2.747 0.047 7 0 "[ . 1 . 2]" 1 535 1 62 LYS H 1 63 GLN H 0.000 . 2.700 2.747 2.729 2.777 0.077 10 0 "[ . 1 . 2]" 1 536 1 61 ALA MB 1 62 LYS H 0.000 . 3.500 2.543 2.506 2.597 . 0 0 "[ . 1 . 2]" 1 537 1 61 ALA HA 1 62 LYS H 2.700 2.700 7.700 3.578 3.573 3.584 . 0 0 "[ . 1 . 2]" 1 538 1 62 LYS HA 1 63 GLN H 0.000 . 5.500 3.555 3.550 3.558 . 0 0 "[ . 1 . 2]" 1 539 1 62 LYS QG 1 63 GLN H 0.000 . 6.300 3.745 3.694 3.842 . 0 0 "[ . 1 . 2]" 1 540 1 62 LYS QB 1 63 GLN H 0.000 . 4.000 2.254 2.211 2.298 . 0 0 "[ . 1 . 2]" 1 541 1 63 GLN H 1 64 ARG QG 0.000 . 6.300 4.030 3.888 4.415 . 0 0 "[ . 1 . 2]" 1 542 1 63 GLN H 1 64 ARG H 0.000 . 2.700 2.692 2.674 2.702 0.002 5 0 "[ . 1 . 2]" 1 543 1 63 GLN HA 1 64 ARG H 2.700 2.700 7.700 3.559 3.552 3.569 . 0 0 "[ . 1 . 2]" 1 544 1 63 GLN QB 1 64 ARG H 0.000 . 3.500 3.286 3.277 3.295 . 0 0 "[ . 1 . 2]" 1 545 1 63 GLN QG 1 64 ARG H 0.000 . 5.000 1.761 1.756 1.782 . 0 0 "[ . 1 . 2]" 1 546 1 64 ARG H 1 65 PHE H 0.000 . 2.700 2.741 2.685 2.765 0.065 8 0 "[ . 1 . 2]" 1 547 1 64 ARG QG 1 65 PHE H 0.000 . 5.000 3.990 3.907 4.177 . 0 0 "[ . 1 . 2]" 1 548 1 64 ARG HA 1 65 PHE H 2.700 2.700 7.700 3.594 3.585 3.600 . 0 0 "[ . 1 . 2]" 1 549 1 64 ARG HB3 1 65 PHE H 0.000 . 4.200 3.516 3.363 3.656 . 0 0 "[ . 1 . 2]" 1 550 1 65 PHE H 1 66 ASN H 0.000 . 2.700 2.030 2.002 2.052 . 0 0 "[ . 1 . 2]" 1 551 1 64 ARG HB2 1 65 PHE H 0.000 . 3.200 2.465 2.413 2.617 . 0 0 "[ . 1 . 2]" 1 552 1 65 PHE H 1 66 ASN QB 0.000 . 5.000 4.192 4.141 4.245 . 0 0 "[ . 1 . 2]" 1 553 1 65 PHE HA 1 66 ASN H 2.700 2.700 7.700 3.559 3.551 3.570 . 0 0 "[ . 1 . 2]" 1 554 1 65 PHE HD1 1 66 ASN H 0.000 . 5.500 5.171 4.324 5.672 0.172 3 0 "[ . 1 . 2]" 1 555 1 65 PHE HB2 1 66 ASN H 0.000 . 4.200 2.705 2.631 2.828 . 0 0 "[ . 1 . 2]" 1 556 1 66 ASN H 1 67 LEU H 2.700 2.700 7.700 3.853 3.703 3.923 . 0 0 "[ . 1 . 2]" 1 557 1 65 PHE HB3 1 66 ASN H 0.000 . 4.200 3.534 3.416 3.614 . 0 0 "[ . 1 . 2]" 1 558 1 66 ASN QB 1 67 LEU H 0.000 . 5.000 4.003 3.974 4.035 . 0 0 "[ . 1 . 2]" 1 559 1 67 LEU HA 1 68 ARG QB 0.000 . 5.000 4.286 4.215 4.458 . 0 0 "[ . 1 . 2]" 1 560 1 67 LEU H 1 68 ARG H 3.200 3.200 5.500 4.157 4.127 4.243 . 0 0 "[ . 1 . 2]" 1 561 1 66 ASN HA 1 67 LEU H 0.000 . 3.200 2.270 2.240 2.318 . 0 0 "[ . 1 . 2]" 1 562 1 67 LEU QB 1 68 ARG H 0.000 . 5.000 3.825 3.801 3.857 . 0 0 "[ . 1 . 2]" 1 563 1 68 ARG H 1 69 GLU QG 0.000 . 6.300 4.215 4.005 5.654 . 0 0 "[ . 1 . 2]" 1 564 1 67 LEU HA 1 68 ARG H 0.000 . 2.700 2.345 2.309 2.359 . 0 0 "[ . 1 . 2]" 1 565 1 68 ARG H 1 69 GLU H 3.200 3.200 8.200 4.468 4.386 4.510 . 0 0 "[ . 1 . 2]" 1 566 1 68 ARG QG 1 69 GLU H 0.000 . 4.000 1.964 1.835 2.790 . 0 0 "[ . 1 . 2]" 1 567 1 68 ARG HA 1 69 GLU H 0.000 . 2.700 2.455 2.353 2.624 . 0 0 "[ . 1 . 2]" 1 568 1 68 ARG QB 1 69 GLU H 0.000 . 4.000 3.281 2.296 3.484 . 0 0 "[ . 1 . 2]" 1 569 1 68 ARG QD 1 69 GLU H 0.000 . 5.000 2.765 2.354 4.491 . 0 0 "[ . 1 . 2]" 1 570 1 69 GLU H 1 70 ARG H 3.200 3.200 8.200 4.257 4.199 4.391 . 0 0 "[ . 1 . 2]" 1 571 1 69 GLU QG 1 70 ARG H 0.000 . 5.000 3.772 2.676 3.943 . 0 0 "[ . 1 . 2]" 1 572 1 69 GLU HA 1 70 ARG H 0.000 . 2.700 2.808 2.706 2.857 0.157 15 0 "[ . 1 . 2]" 1 573 1 69 GLU QB 1 70 ARG H 0.000 . 4.000 1.913 1.853 2.117 . 0 0 "[ . 1 . 2]" 1 574 1 70 ARG H 1 71 ASP H 2.700 2.700 7.700 4.606 4.585 4.612 . 0 0 "[ . 1 . 2]" 1 575 1 70 ARG HD2 1 71 ASP H 0.000 . 5.500 4.722 2.107 5.512 0.012 4 0 "[ . 1 . 2]" 1 576 1 70 ARG QB 1 71 ASP H 0.000 . 5.000 2.655 2.567 3.530 . 0 0 "[ . 1 . 2]" 1 577 1 70 ARG HD3 1 71 ASP H 0.000 . 5.500 5.476 3.464 5.602 0.102 20 0 "[ . 1 . 2]" 1 578 1 70 ARG QG 1 71 ASP H 0.000 . 6.300 3.348 2.579 3.506 . 0 0 "[ . 1 . 2]" 1 579 1 70 ARG HA 1 71 ASP H 0.000 . 2.700 2.402 2.353 2.446 . 0 0 "[ . 1 . 2]" 1 580 1 71 ASP H 1 72 VAL H 2.700 2.700 7.700 2.692 2.637 3.242 0.063 8 0 "[ . 1 . 2]" 1 581 1 72 VAL H 1 73 GLN H 0.000 . 2.700 2.636 2.598 2.680 . 0 0 "[ . 1 . 2]" 1 582 1 72 VAL H 1 73 GLN QB 0.000 . 6.300 4.520 4.504 4.548 . 0 0 "[ . 1 . 2]" 1 583 1 71 ASP HA 1 72 VAL H 0.000 . 2.700 2.832 2.775 2.861 0.161 14 0 "[ . 1 . 2]" 1 584 1 72 VAL HB 1 73 GLN H 0.000 . 3.200 2.346 2.252 2.449 . 0 0 "[ . 1 . 2]" 1 585 1 72 VAL QG 1 73 GLN HA 0.000 . 7.000 3.547 3.376 3.697 . 0 0 "[ . 1 . 2]" 1 586 1 73 GLN H 1 74 SER QB 0.000 . 6.300 4.336 4.318 4.360 . 0 0 "[ . 1 . 2]" 1 587 1 73 GLN H 1 74 SER H 0.000 . 2.700 2.688 2.672 2.713 0.013 1 0 "[ . 1 . 2]" 1 588 1 72 VAL HA 1 73 GLN H 2.700 2.700 7.700 3.574 3.563 3.582 . 0 0 "[ . 1 . 2]" 1 589 1 73 GLN QG 1 74 SER H 0.000 . 5.000 4.126 4.083 4.165 . 0 0 "[ . 1 . 2]" 1 590 1 73 GLN HA 1 74 SER H 2.700 2.700 7.700 3.501 3.478 3.517 . 0 0 "[ . 1 . 2]" 1 591 1 74 SER H 1 75 LEU H 0.000 . 2.700 2.296 2.278 2.318 . 0 0 "[ . 1 . 2]" 1 592 1 74 SER HB2 1 75 LEU QD 0.000 . 4.700 3.512 3.500 3.522 . 0 0 "[ . 1 . 2]" 1 593 1 73 GLN QB 1 74 SER H 0.000 . 3.500 2.819 2.758 2.911 . 0 0 "[ . 1 . 2]" 1 594 1 74 SER HB3 1 75 LEU HG 0.000 . 4.200 2.998 2.611 3.125 . 0 0 "[ . 1 . 2]" 1 595 1 74 SER HB3 1 75 LEU QD 0.000 . 4.700 2.464 2.258 3.330 . 0 0 "[ . 1 . 2]" 1 596 1 74 SER H 1 75 LEU QB 0.000 . 6.300 4.366 4.291 4.444 . 0 0 "[ . 1 . 2]" 1 597 1 73 GLN QB 1 74 SER HA 0.000 . 5.000 4.090 4.075 4.108 . 0 0 "[ . 1 . 2]" 1 598 1 74 SER HB2 1 75 LEU HG 0.000 . 4.200 3.292 3.116 3.384 . 0 0 "[ . 1 . 2]" 1 599 1 74 SER HA 1 75 LEU H 2.700 2.700 7.700 3.507 3.500 3.518 . 0 0 "[ . 1 . 2]" 1 600 1 74 SER HB2 1 75 LEU H 0.000 . 3.200 3.039 2.895 3.132 . 0 0 "[ . 1 . 2]" 1 601 1 74 SER HB3 1 75 LEU H 0.000 . 3.200 3.264 3.241 3.281 0.081 3 0 "[ . 1 . 2]" 1 602 1 75 LEU H 1 76 HIS H 0.000 . 3.200 2.258 2.204 2.297 . 0 0 "[ . 1 . 2]" 1 603 1 75 LEU HB2 1 76 HIS H 0.000 . 4.200 3.354 3.323 3.410 . 0 0 "[ . 1 . 2]" 1 604 1 75 LEU MD1 1 76 HIS H 0.000 . 6.300 5.119 4.740 5.212 . 0 0 "[ . 1 . 2]" 1 605 1 75 LEU MD2 1 76 HIS H 0.000 . 6.300 4.429 4.331 4.964 . 0 0 "[ . 1 . 2]" 1 606 1 75 LEU HB3 1 76 HIS H 0.000 . 4.200 4.248 4.225 4.279 0.079 11 0 "[ . 1 . 2]" 1 607 1 76 HIS H 1 77 ALA H 0.000 . 4.000 2.781 2.736 2.829 . 0 0 "[ . 1 . 2]" 1 608 1 75 LEU HA 1 76 HIS H 2.700 2.700 7.700 3.353 3.325 3.367 . 0 0 "[ . 1 . 2]" 1 609 1 76 HIS QB 1 77 ALA H 0.000 . 5.000 3.911 3.904 3.918 . 0 0 "[ . 1 . 2]" 1 610 1 77 ALA H 1 78 THR H 3.200 3.200 8.200 4.579 4.571 4.588 . 0 0 "[ . 1 . 2]" 1 611 1 76 HIS HA 1 77 ALA H 0.000 . 2.700 2.721 2.710 2.729 0.029 12 0 "[ . 1 . 2]" 1 612 1 77 ALA HA 1 78 THR H 0.000 . 2.700 2.534 2.517 2.545 . 0 0 "[ . 1 . 2]" 1 613 1 78 THR H 1 79 PHE H 3.200 3.200 8.200 4.456 4.439 4.467 . 0 0 "[ . 1 . 2]" 1 614 1 77 ALA MB 1 78 THR H 0.000 . 3.500 2.330 2.304 2.383 . 0 0 "[ . 1 . 2]" 1 615 1 78 THR HA 1 79 PHE H 0.000 . 2.700 2.221 2.209 2.232 . 0 0 "[ . 1 . 2]" 1 616 1 79 PHE H 1 80 VAL H 3.200 3.200 8.200 4.597 4.587 4.603 . 0 0 "[ . 1 . 2]" 1 617 1 78 THR MG 1 79 PHE H 0.000 . 4.000 2.381 2.328 2.453 . 0 0 "[ . 1 . 2]" 1 618 1 78 THR HB 1 79 PHE H 0.000 . 4.200 4.243 4.234 4.256 0.056 11 0 "[ . 1 . 2]" 1 619 1 79 PHE HD1 1 80 VAL H 0.000 . 4.200 4.225 4.189 4.274 0.074 4 0 "[ . 1 . 2]" 1 620 1 80 VAL H 1 81 PRO HD3 0.000 . 5.500 4.132 4.067 4.175 . 0 0 "[ . 1 . 2]" 1 621 1 79 PHE HB2 1 80 VAL H 0.000 . 4.200 3.948 3.891 4.029 . 0 0 "[ . 1 . 2]" 1 622 1 80 VAL H 1 81 PRO HD2 0.000 . 5.500 4.496 4.458 4.523 . 0 0 "[ . 1 . 2]" 1 623 1 79 PHE HB3 1 80 VAL H 0.000 . 3.200 3.032 2.983 3.116 . 0 0 "[ . 1 . 2]" 1 624 1 79 PHE HA 1 80 VAL H 0.000 . 2.700 2.295 2.275 2.309 . 0 0 "[ . 1 . 2]" 1 625 1 80 VAL HA 1 81 PRO QG 0.000 . 5.000 3.746 3.742 3.749 . 0 0 "[ . 1 . 2]" 1 626 1 80 VAL HA 1 81 PRO HD2 0.000 . 2.700 1.867 1.863 1.870 . 0 0 "[ . 1 . 2]" 1 627 1 80 VAL HA 1 81 PRO HD3 0.000 . 2.700 2.611 2.588 2.635 . 0 0 "[ . 1 . 2]" 1 628 1 82 PHE H 1 83 THR H 3.200 3.200 8.200 4.604 4.592 4.616 . 0 0 "[ . 1 . 2]" 1 629 1 81 PRO HB3 1 82 PHE H 0.000 . 4.200 3.569 3.511 3.632 . 0 0 "[ . 1 . 2]" 1 630 1 81 PRO QG 1 82 PHE H 0.000 . 6.300 4.608 4.566 4.630 . 0 0 "[ . 1 . 2]" 1 631 1 81 PRO HB2 1 82 PHE H 0.000 . 3.200 3.161 3.084 3.207 0.007 3 0 "[ . 1 . 2]" 1 632 1 81 PRO HA 1 82 PHE H 0.000 . 2.700 2.321 2.308 2.342 . 0 0 "[ . 1 . 2]" 1 633 1 81 PRO QD 1 82 PHE H 4.000 4.000 9.000 5.018 5.013 5.024 . 0 0 "[ . 1 . 2]" 1 634 1 82 PHE HA 1 83 THR H 0.000 . 2.700 2.203 2.196 2.211 . 0 0 "[ . 1 . 2]" 1 635 1 83 THR HA 1 84 ALA H 0.000 . 2.700 2.304 2.260 2.330 . 0 0 "[ . 1 . 2]" 1 636 1 83 THR MG 1 84 ALA H 0.000 . 5.000 3.995 3.766 4.093 . 0 0 "[ . 1 . 2]" 1 637 1 83 THR HB 1 84 ALA H 0.000 . 3.200 3.002 2.926 3.126 . 0 0 "[ . 1 . 2]" 1 638 1 84 ALA H 1 85 GLN H 0.000 . 2.700 2.523 2.505 2.535 . 0 0 "[ . 1 . 2]" 1 639 1 83 THR H 1 84 ALA H 3.200 3.200 8.200 4.488 4.476 4.500 . 0 0 "[ . 1 . 2]" 1 640 1 85 GLN H 1 86 SER H 0.000 . 2.700 2.734 2.723 2.754 0.054 15 0 "[ . 1 . 2]" 1 641 1 84 ALA MB 1 85 GLN H 0.000 . 4.000 3.065 2.774 3.208 . 0 0 "[ . 1 . 2]" 1 642 1 84 ALA MB 1 85 GLN HA 0.000 . 5.000 3.939 3.812 4.036 . 0 0 "[ . 1 . 2]" 1 643 1 84 ALA HA 1 85 GLN H 2.700 2.700 7.700 3.411 3.361 3.511 . 0 0 "[ . 1 . 2]" 1 644 1 85 GLN HA 1 86 SER H 3.200 3.200 8.200 3.542 3.529 3.571 . 0 0 "[ . 1 . 2]" 1 645 1 85 GLN QB 1 86 SER H 0.000 . 4.000 2.548 2.342 2.644 . 0 0 "[ . 1 . 2]" 1 646 1 86 SER H 1 87 ARG QB 0.000 . 6.300 4.779 4.684 4.986 . 0 0 "[ . 1 . 2]" 1 647 1 85 GLN QG 1 86 SER H 0.000 . 5.000 3.976 3.586 4.044 . 0 0 "[ . 1 . 2]" 1 648 1 86 SER H 1 87 ARG H 0.000 . 2.700 1.954 1.854 2.191 . 0 0 "[ . 1 . 2]" 1 649 1 87 ARG H 1 88 MET H 0.000 . 2.700 2.794 2.749 2.817 0.117 5 0 "[ . 1 . 2]" 1 650 1 86 SER QB 1 87 ARG H 0.000 . 6.300 3.479 3.012 3.896 . 0 0 "[ . 1 . 2]" 1 651 1 87 ARG H 1 88 MET QG 0.000 . 5.000 3.461 3.339 3.598 . 0 0 "[ . 1 . 2]" 1 652 1 86 SER HA 1 87 ARG H 0.000 . 3.200 3.274 3.221 3.390 0.190 1 0 "[ . 1 . 2]" 1 653 1 87 ARG HA 1 88 MET H 0.000 . 2.700 2.733 2.714 2.761 0.061 15 0 "[ . 1 . 2]" 1 654 1 88 MET H 1 89 SER H 3.200 3.200 8.200 4.415 4.404 4.430 . 0 0 "[ . 1 . 2]" 1 655 1 88 MET HA 1 89 SER HA 0.000 . 5.500 4.602 4.586 4.615 . 0 0 "[ . 1 . 2]" 1 656 1 88 MET QB 1 89 SER H 0.000 . 3.500 2.406 2.311 2.682 . 0 0 "[ . 1 . 2]" 1 657 1 88 MET HA 1 89 SER H 0.000 . 2.700 2.417 2.367 2.468 . 0 0 "[ . 1 . 2]" 1 658 1 88 MET ME 1 89 SER H 0.000 . 6.300 4.508 4.348 4.591 . 0 0 "[ . 1 . 2]" 1 659 1 88 MET QG 1 89 SER H 0.000 . 5.000 3.950 3.780 4.384 . 0 0 "[ . 1 . 2]" 1 660 1 89 SER H 1 90 GLY H 3.200 3.200 8.200 4.418 4.414 4.422 . 0 0 "[ . 1 . 2]" 1 661 1 89 SER HB3 1 90 GLY H 0.000 . 4.200 4.109 4.084 4.149 . 0 0 "[ . 1 . 2]" 1 662 1 89 SER HB2 1 90 GLY H 0.000 . 3.200 2.801 2.764 2.886 . 0 0 "[ . 1 . 2]" 1 663 1 90 GLY H 1 91 ILE H 3.200 3.200 8.200 4.362 4.349 4.370 . 0 0 "[ . 1 . 2]" 1 664 1 89 SER HA 1 90 GLY HA2 0.000 . 5.500 4.669 4.662 4.683 . 0 0 "[ . 1 . 2]" 1 665 1 89 SER HA 1 90 GLY HA3 0.000 . 5.500 4.405 4.392 4.424 . 0 0 "[ . 1 . 2]" 1 666 1 90 GLY HA3 1 91 ILE MG 0.000 . 5.000 3.972 3.798 4.072 . 0 0 "[ . 1 . 2]" 1 667 1 89 SER HA 1 90 GLY H 0.000 . 2.700 2.495 2.489 2.501 . 0 0 "[ . 1 . 2]" 1 668 1 91 ILE H 1 92 ASN H 3.200 3.200 8.200 4.448 4.426 4.464 . 0 0 "[ . 1 . 2]" 1 669 1 91 ILE HA 1 92 ASN QB 0.000 . 6.300 4.495 4.467 4.534 . 0 0 "[ . 1 . 2]" 1 670 1 90 GLY HA3 1 91 ILE H 0.000 . 2.700 2.402 2.377 2.424 . 0 0 "[ . 1 . 2]" 1 671 1 90 GLY HA2 1 91 ILE H 0.000 . 2.700 2.738 2.727 2.751 0.051 19 0 "[ . 1 . 2]" 1 672 1 91 ILE MG 1 92 ASN H 0.000 . 5.000 3.749 3.661 3.783 . 0 0 "[ . 1 . 2]" 1 673 1 92 ASN HA 1 93 ILE MG 0.000 . 5.000 3.385 3.266 3.607 . 0 0 "[ . 1 . 2]" 1 674 1 92 ASN H 1 93 ILE H 3.200 3.200 8.200 4.380 4.362 4.405 . 0 0 "[ . 1 . 2]" 1 675 1 91 ILE HB 1 92 ASN H 0.000 . 4.200 4.135 4.104 4.177 . 0 0 "[ . 1 . 2]" 1 676 1 92 ASN QB 1 93 ILE HA 0.000 . 6.300 3.990 3.949 4.050 . 0 0 "[ . 1 . 2]" 1 677 1 91 ILE HA 1 92 ASN H 0.000 . 2.700 2.329 2.296 2.343 . 0 0 "[ . 1 . 2]" 1 678 1 92 ASN H 1 93 ILE HA 0.000 . 5.500 4.932 4.895 4.957 . 0 0 "[ . 1 . 2]" 1 679 1 92 ASN HA 1 93 ILE HA 0.000 . 5.500 4.481 4.464 4.498 . 0 0 "[ . 1 . 2]" 1 680 1 91 ILE HG13 1 92 ASN HA 0.000 . 5.500 5.276 5.180 5.316 . 0 0 "[ . 1 . 2]" 1 681 1 91 ILE MD 1 92 ASN H 0.000 . 5.000 4.017 3.953 4.090 . 0 0 "[ . 1 . 2]" 1 682 1 92 ASN H 1 93 ILE HB 0.000 . 5.500 4.999 4.901 5.048 . 0 0 "[ . 1 . 2]" 1 683 1 91 ILE QG 1 92 ASN H 0.000 . 4.000 2.266 2.197 2.355 . 0 0 "[ . 1 . 2]" 1 684 1 92 ASN HA 1 93 ILE H 0.000 . 2.700 2.239 2.222 2.261 . 0 0 "[ . 1 . 2]" 1 685 1 92 ASN QB 1 93 ILE H 0.000 . 4.000 3.190 3.129 3.225 . 0 0 "[ . 1 . 2]" 1 686 1 93 ILE HG13 1 94 ASP HB3 0.000 . 4.200 4.256 4.231 4.289 0.089 1 0 "[ . 1 . 2]" 1 687 1 93 ILE MG 1 94 ASP HB2 0.000 . 5.000 4.242 4.216 4.268 . 0 0 "[ . 1 . 2]" 1 688 1 93 ILE HG13 1 94 ASP HB2 0.000 . 4.200 2.552 2.539 2.589 . 0 0 "[ . 1 . 2]" 1 689 1 93 ILE H 1 94 ASP H 3.200 3.200 8.200 4.346 4.343 4.361 . 0 0 "[ . 1 . 2]" 1 690 1 93 ILE HG12 1 94 ASP HB3 0.000 . 4.200 4.132 3.994 4.228 0.028 17 0 "[ . 1 . 2]" 1 691 1 94 ASP H 1 95 ASN H 0.000 . 3.200 3.294 3.285 3.306 0.106 19 0 "[ . 1 . 2]" 1 692 1 93 ILE HB 1 94 ASP H 0.000 . 4.200 3.798 3.769 3.832 . 0 0 "[ . 1 . 2]" 1 693 1 93 ILE HG12 1 94 ASP HB2 0.000 . 4.200 2.600 2.461 2.696 . 0 0 "[ . 1 . 2]" 1 694 1 93 ILE HA 1 94 ASP H 0.000 . 2.700 2.284 2.276 2.295 . 0 0 "[ . 1 . 2]" 1 695 1 93 ILE QG 1 94 ASP H 0.000 . 5.000 1.922 1.840 2.013 . 0 0 "[ . 1 . 2]" 1 696 1 94 ASP HB3 1 95 ASN H 0.000 . 2.700 2.764 2.756 2.775 0.075 4 0 "[ . 1 . 2]" 1 697 1 95 ASN H 1 96 ARG H 0.000 . 2.700 2.575 2.523 2.602 . 0 0 "[ . 1 . 2]" 1 698 1 94 ASP HA 1 95 ASN H 2.700 2.700 7.700 3.537 3.530 3.544 . 0 0 "[ . 1 . 2]" 1 699 1 94 ASP HB2 1 95 ASN H 0.000 . 3.200 2.004 1.988 2.025 . 0 0 "[ . 1 . 2]" 1 700 1 95 ASN HA 1 96 ARG H 2.700 2.700 7.700 3.420 3.400 3.443 . 0 0 "[ . 1 . 2]" 1 701 1 96 ARG H 1 97 MET H 3.200 3.200 8.200 4.400 4.371 4.432 . 0 0 "[ . 1 . 2]" 1 702 1 95 ASN QB 1 96 ARG H 0.000 . 5.000 3.196 3.147 3.229 . 0 0 "[ . 1 . 2]" 1 703 1 96 ARG QG 1 97 MET H 0.000 . 5.000 4.028 3.975 4.314 . 0 0 "[ . 1 . 2]" 1 704 1 97 MET H 1 98 ILE MD 0.000 . 6.300 4.365 4.179 4.451 . 0 0 "[ . 1 . 2]" 1 705 1 97 MET H 1 98 ILE H 3.200 3.200 8.200 3.916 3.712 4.032 . 0 0 "[ . 1 . 2]" 1 706 1 97 MET H 1 98 ILE QG 0.000 . 6.300 2.978 2.773 3.056 . 0 0 "[ . 1 . 2]" 1 707 1 96 ARG QD 1 97 MET H 0.000 . 6.300 5.570 5.520 5.601 . 0 0 "[ . 1 . 2]" 1 708 1 96 ARG HB3 1 97 MET H 0.000 . 4.200 3.036 2.929 3.093 . 0 0 "[ . 1 . 2]" 1 709 1 96 ARG HA 1 97 MET H 0.000 . 2.700 2.263 2.249 2.291 . 0 0 "[ . 1 . 2]" 1 710 1 96 ARG HB2 1 97 MET H 0.000 . 4.200 4.056 3.784 4.109 . 0 0 "[ . 1 . 2]" 1 711 1 98 ILE H 1 99 ARG H 3.200 3.200 8.200 4.491 4.453 4.540 . 0 0 "[ . 1 . 2]" 1 712 1 97 MET HA 1 98 ILE H 0.000 . 2.700 2.252 2.236 2.288 . 0 0 "[ . 1 . 2]" 1 713 1 98 ILE HA 1 99 ARG HA 0.000 . 5.500 4.506 4.501 4.512 . 0 0 "[ . 1 . 2]" 1 714 1 97 MET QG 1 98 ILE H 0.000 . 5.000 4.232 4.179 4.302 . 0 0 "[ . 1 . 2]" 1 715 1 98 ILE QG 1 99 ARG H 0.000 . 5.000 4.044 4.017 4.073 . 0 0 "[ . 1 . 2]" 1 716 1 98 ILE HB 1 99 ARG H 0.000 . 4.200 4.065 4.036 4.088 . 0 0 "[ . 1 . 2]" 1 717 1 98 ILE HB 1 99 ARG HA 0.000 . 5.500 4.696 4.667 4.724 . 0 0 "[ . 1 . 2]" 1 718 1 99 ARG H 1 100 LYS H 3.200 3.200 8.200 4.453 4.435 4.459 . 0 0 "[ . 1 . 2]" 1 719 1 98 ILE MG 1 99 ARG H 0.000 . 3.500 2.085 2.025 2.123 . 0 0 "[ . 1 . 2]" 1 720 1 98 ILE HA 1 99 ARG H 0.000 . 2.700 2.285 2.276 2.291 . 0 0 "[ . 1 . 2]" 1 721 1 98 ILE MD 1 99 ARG H 0.000 . 6.300 4.686 4.668 4.704 . 0 0 "[ . 1 . 2]" 1 722 1 99 ARG HA 1 100 LYS H 0.000 . 2.700 2.356 2.318 2.378 . 0 0 "[ . 1 . 2]" 1 723 1 99 ARG QB 1 100 LYS H 0.000 . 4.000 2.670 2.580 3.394 . 0 0 "[ . 1 . 2]" 1 724 1 99 ARG QG 1 100 LYS H 0.000 . 5.000 4.032 2.008 4.466 . 0 0 "[ . 1 . 2]" 1 725 1 100 LYS HA 1 101 GLY QA 0.000 . 6.300 3.961 3.948 3.975 . 0 0 "[ . 1 . 2]" 1 726 1 100 LYS H 1 101 GLY QA 0.000 . 6.300 4.334 4.286 4.447 . 0 0 "[ . 1 . 2]" 1 727 1 100 LYS H 1 101 GLY H 3.200 3.200 8.200 4.249 4.196 4.393 . 0 0 "[ . 1 . 2]" 1 728 1 99 ARG HA 1 100 LYS HA 0.000 . 5.500 4.534 4.515 4.540 . 0 0 "[ . 1 . 2]" 1 729 1 99 ARG QD 1 100 LYS H 0.000 . 5.000 4.108 3.206 4.472 . 0 0 "[ . 1 . 2]" 1 730 1 101 GLY HA3 1 102 SER H 0.000 . 2.700 2.663 2.656 2.672 . 0 0 "[ . 1 . 2]" 1 731 1 100 LYS QG 1 101 GLY H 0.000 . 5.000 4.209 3.755 4.267 . 0 0 "[ . 1 . 2]" 1 732 1 101 GLY HA2 1 102 SER H 0.000 . 2.700 2.538 2.530 2.559 . 0 0 "[ . 1 . 2]" 1 733 1 100 LYS QB 1 101 GLY H 0.000 . 4.000 3.339 3.008 3.439 . 0 0 "[ . 1 . 2]" 1 734 1 100 LYS QD 1 101 GLY QA 0.000 . 5.800 3.214 2.807 4.649 . 0 0 "[ . 1 . 2]" 1 735 1 100 LYS HA 1 101 GLY H 0.000 . 2.700 2.222 2.210 2.282 . 0 0 "[ . 1 . 2]" 1 736 1 101 GLY H 1 102 SER H 3.200 3.200 8.200 4.418 4.395 4.428 . 0 0 "[ . 1 . 2]" 1 737 1 102 SER H 1 103 VAL H 3.200 3.200 8.200 4.675 4.668 4.681 . 0 0 "[ . 1 . 2]" 1 738 1 103 VAL MG1 1 104 ASP QB 0.000 . 5.800 4.262 4.169 4.373 . 0 0 "[ . 1 . 2]" 1 739 1 102 SER QB 1 103 VAL H 0.000 . 4.000 2.926 2.858 3.571 . 0 0 "[ . 1 . 2]" 1 740 1 103 VAL H 1 104 ASP H 0.000 . 2.700 2.778 2.758 2.796 0.096 11 0 "[ . 1 . 2]" 1 741 1 102 SER HA 1 103 VAL H 0.000 . 2.700 2.330 2.314 2.346 . 0 0 "[ . 1 . 2]" 1 742 1 104 ASP H 1 105 ALA MB 0.000 . 6.300 4.311 4.244 4.333 . 0 0 "[ . 1 . 2]" 1 743 1 103 VAL HA 1 104 ASP H 3.200 3.200 8.200 3.536 3.530 3.543 . 0 0 "[ . 1 . 2]" 1 744 1 103 VAL MG2 1 104 ASP H 0.000 . 5.000 3.962 3.900 4.014 . 0 0 "[ . 1 . 2]" 1 745 1 104 ASP H 1 105 ALA H 0.000 . 2.700 2.734 2.721 2.744 0.044 1 0 "[ . 1 . 2]" 1 746 1 103 VAL MG1 1 104 ASP H 0.000 . 4.000 3.265 3.115 3.368 . 0 0 "[ . 1 . 2]" 1 747 1 103 VAL HB 1 104 ASP H 0.000 . 2.700 2.674 2.629 2.697 . 0 0 "[ . 1 . 2]" 1 748 1 104 ASP H 1 105 ALA HA 0.000 . 5.500 5.395 5.389 5.401 . 0 0 "[ . 1 . 2]" 1 749 1 105 ALA H 1 106 ILE H 0.000 . 2.700 2.735 2.722 2.746 0.046 12 0 "[ . 1 . 2]" 1 750 1 104 ASP QB 1 105 ALA HA 0.000 . 5.000 4.065 3.976 4.146 . 0 0 "[ . 1 . 2]" 1 751 1 105 ALA MB 1 106 ILE H 0.000 . 3.500 2.243 2.186 2.324 . 0 0 "[ . 1 . 2]" 1 752 1 105 ALA H 1 106 ILE HB 0.000 . 5.500 4.777 4.731 4.806 . 0 0 "[ . 1 . 2]" 1 753 1 104 ASP QB 1 105 ALA H 0.000 . 4.000 2.388 2.325 2.460 . 0 0 "[ . 1 . 2]" 1 754 1 105 ALA MB 1 106 ILE MD 0.000 . 4.800 2.874 2.767 2.963 . 0 0 "[ . 1 . 2]" 1 755 1 105 ALA H 1 106 ILE HA 0.000 . 5.500 5.364 5.353 5.375 . 0 0 "[ . 1 . 2]" 1 756 1 105 ALA H 1 106 ILE QG 0.000 . 6.300 4.098 4.053 4.221 . 0 0 "[ . 1 . 2]" 1 757 1 104 ASP HA 1 105 ALA H 3.200 3.200 8.200 3.588 3.585 3.591 . 0 0 "[ . 1 . 2]" 1 758 1 105 ALA HA 1 106 ILE H 3.200 3.200 8.200 3.576 3.572 3.584 . 0 0 "[ . 1 . 2]" 1 759 1 106 ILE H 1 107 ARG H 0.000 . 2.700 2.752 2.738 2.758 0.058 17 0 "[ . 1 . 2]" 1 760 1 106 ILE H 1 107 ARG QB 0.000 . 6.300 4.326 4.302 4.364 . 0 0 "[ . 1 . 2]" 1 761 1 106 ILE MG 1 107 ARG H 0.000 . 4.000 3.388 3.373 3.399 . 0 0 "[ . 1 . 2]" 1 762 1 106 ILE MD 1 107 ARG H 0.000 . 6.300 4.458 4.433 4.489 . 0 0 "[ . 1 . 2]" 1 763 1 106 ILE HB 1 107 ARG H 0.000 . 3.200 2.444 2.413 2.532 . 0 0 "[ . 1 . 2]" 1 764 1 107 ARG H 1 108 ARG H 0.000 . 2.700 2.760 2.751 2.768 0.068 8 0 "[ . 1 . 2]" 1 765 1 107 ARG H 1 108 ARG HA 0.000 . 5.500 5.426 5.418 5.431 . 0 0 "[ . 1 . 2]" 1 766 1 106 ILE HA 1 107 ARG H 3.200 3.200 8.200 3.559 3.552 3.565 . 0 0 "[ . 1 . 2]" 1 767 1 106 ILE QG 1 107 ARG H 0.000 . 5.000 3.928 3.897 4.012 . 0 0 "[ . 1 . 2]" 1 768 1 107 ARG HB2 1 108 ARG H 0.000 . 4.200 3.909 3.879 3.932 . 0 0 "[ . 1 . 2]" 1 769 1 107 ARG QG 1 108 ARG H 0.000 . 5.000 3.184 2.985 3.378 . 0 0 "[ . 1 . 2]" 1 770 1 107 ARG QD 1 108 ARG H 0.000 . 6.300 4.907 4.464 5.026 . 0 0 "[ . 1 . 2]" 1 771 1 108 ARG H 1 109 HIS QB 0.000 . 6.300 4.171 4.160 4.180 . 0 0 "[ . 1 . 2]" 1 772 1 107 ARG HA 1 108 ARG H 3.200 3.200 8.200 3.564 3.560 3.570 . 0 0 "[ . 1 . 2]" 1 773 1 107 ARG HB3 1 108 ARG H 0.000 . 3.200 2.521 2.488 2.550 . 0 0 "[ . 1 . 2]" 1 774 1 107 ARG HG3 1 108 ARG HA 0.000 . 4.200 4.254 4.221 4.324 0.124 8 0 "[ . 1 . 2]" 1 775 1 107 ARG HG2 1 108 ARG HA 0.000 . 4.200 3.801 3.449 4.184 . 0 0 "[ . 1 . 2]" 1 776 1 108 ARG H 1 109 HIS H 0.000 . 2.700 2.584 2.574 2.592 . 0 0 "[ . 1 . 2]" 1 777 1 109 HIS HB3 1 110 VAL MG2 0.000 . 6.300 3.510 3.470 3.557 . 0 0 "[ . 1 . 2]" 1 778 1 108 ARG QB 1 109 HIS HA 0.000 . 5.000 3.940 3.913 3.953 . 0 0 "[ . 1 . 2]" 1 779 1 108 ARG QD 1 109 HIS H 0.000 . 5.000 4.522 4.509 4.547 . 0 0 "[ . 1 . 2]" 1 780 1 109 HIS H 1 110 VAL H 0.000 . 2.700 2.702 2.685 2.719 0.019 14 0 "[ . 1 . 2]" 1 781 1 108 ARG QB 1 109 HIS H 0.000 . 3.500 2.541 2.505 2.563 . 0 0 "[ . 1 . 2]" 1 782 1 108 ARG QG 1 109 HIS H 0.000 . 5.000 4.003 3.963 4.026 . 0 0 "[ . 1 . 2]" 1 783 1 109 HIS H 1 110 VAL MG2 0.000 . 5.000 4.183 4.171 4.191 . 0 0 "[ . 1 . 2]" 1 784 1 109 HIS H 1 110 VAL HB 0.000 . 5.500 4.702 4.665 4.734 . 0 0 "[ . 1 . 2]" 1 785 1 109 HIS HB2 1 110 VAL MG2 0.000 . 6.300 4.939 4.900 4.987 . 0 0 "[ . 1 . 2]" 1 786 1 108 ARG HA 1 109 HIS H 3.200 3.200 8.200 3.551 3.547 3.556 . 0 0 "[ . 1 . 2]" 1 787 1 109 HIS H 1 110 VAL HA 0.000 . 5.500 5.355 5.340 5.371 . 0 0 "[ . 1 . 2]" 1 788 1 110 VAL H 1 111 GLU H 0.000 . 2.700 2.721 2.717 2.725 0.025 16 0 "[ . 1 . 2]" 1 789 1 109 HIS HB2 1 110 VAL H 0.000 . 4.200 4.096 4.082 4.111 . 0 0 "[ . 1 . 2]" 1 790 1 110 VAL H 1 111 GLU HA 0.000 . 5.500 5.359 5.353 5.362 . 0 0 "[ . 1 . 2]" 1 791 1 110 VAL H 1 111 GLU QB 0.000 . 6.300 4.565 4.519 4.572 . 0 0 "[ . 1 . 2]" 1 792 1 109 HIS HA 1 110 VAL H 3.200 3.200 8.200 3.577 3.570 3.585 . 0 0 "[ . 1 . 2]" 1 793 1 109 HIS HB3 1 110 VAL H 0.000 . 3.200 2.790 2.765 2.815 . 0 0 "[ . 1 . 2]" 1 794 1 109 HIS HD1 1 110 VAL H 0.000 . 4.200 2.759 2.695 2.824 . 0 0 "[ . 1 . 2]" 1 795 1 110 VAL H 1 111 GLU QG 0.000 . 6.300 4.248 4.230 4.344 . 0 0 "[ . 1 . 2]" 1 796 1 110 VAL HB 1 111 GLU H 0.000 . 3.200 2.419 2.368 2.450 . 0 0 "[ . 1 . 2]" 1 797 1 111 GLU H 1 112 ALA HA 0.000 . 5.500 5.342 5.333 5.356 . 0 0 "[ . 1 . 2]" 1 798 1 111 GLU H 1 112 ALA MB 0.000 . 6.300 4.267 4.250 4.279 . 0 0 "[ . 1 . 2]" 1 799 1 110 VAL MG2 1 111 GLU H 0.000 . 5.000 3.855 3.840 3.867 . 0 0 "[ . 1 . 2]" 1 800 1 110 VAL MG1 1 111 GLU H 0.000 . 4.000 3.081 3.041 3.122 . 0 0 "[ . 1 . 2]" 1 801 1 110 VAL HA 1 111 GLU H 3.200 3.200 8.200 3.579 3.578 3.581 . 0 0 "[ . 1 . 2]" 1 802 1 111 GLU H 1 112 ALA H 0.000 . 2.700 2.686 2.674 2.701 0.001 3 0 "[ . 1 . 2]" 1 803 1 110 VAL MG1 1 111 GLU HA 0.000 . 4.000 3.334 3.282 3.361 . 0 0 "[ . 1 . 2]" 1 804 1 111 GLU HA 1 112 ALA H 3.200 3.200 8.200 3.560 3.557 3.563 . 0 0 "[ . 1 . 2]" 1 805 1 112 ALA H 1 113 ASN H 0.000 . 2.700 2.556 2.540 2.565 . 0 0 "[ . 1 . 2]" 1 806 1 112 ALA H 1 113 ASN HD21 0.000 . 5.500 4.019 3.924 4.130 . 0 0 "[ . 1 . 2]" 1 807 1 111 GLU QB 1 112 ALA H 0.000 . 4.000 2.656 2.640 2.686 . 0 0 "[ . 1 . 2]" 1 808 1 111 GLU QG 1 112 ALA H 0.000 . 5.000 4.082 4.070 4.145 . 0 0 "[ . 1 . 2]" 1 809 1 112 ALA H 1 113 ASN QB 0.000 . 6.300 4.153 4.138 4.166 . 0 0 "[ . 1 . 2]" 1 810 1 112 ALA MB 1 113 ASN HB2 0.000 . 6.300 4.213 4.197 4.226 . 0 0 "[ . 1 . 2]" 1 811 1 112 ALA MB 1 113 ASN HD21 0.000 . 5.000 3.152 2.899 3.442 . 0 0 "[ . 1 . 2]" 1 812 1 112 ALA MB 1 113 ASN HB3 0.000 . 6.300 5.266 5.263 5.270 . 0 0 "[ . 1 . 2]" 1 813 1 112 ALA MB 1 113 ASN H 0.000 . 4.000 2.526 2.506 2.543 . 0 0 "[ . 1 . 2]" 1 814 1 113 ASN H 1 114 GLY H 0.000 . 2.700 2.489 2.481 2.496 . 0 0 "[ . 1 . 2]" 1 815 1 113 ASN H 1 114 GLY QA 0.000 . 5.000 4.500 4.494 4.505 . 0 0 "[ . 1 . 2]" 1 816 1 112 ALA HA 1 113 ASN H 3.200 3.200 8.200 3.520 3.517 3.522 . 0 0 "[ . 1 . 2]" 1 817 1 112 ALA MB 1 113 ASN HD22 0.000 . 5.000 4.070 3.970 4.155 . 0 0 "[ . 1 . 2]" 1 818 1 114 GLY H 1 115 GLY QA 0.000 . 6.300 4.075 4.063 4.094 . 0 0 "[ . 1 . 2]" 1 819 1 113 ASN HA 1 114 GLY H 3.200 3.200 8.200 3.477 3.473 3.481 . 0 0 "[ . 1 . 2]" 1 820 1 113 ASN HB2 1 114 GLY H 0.000 . 4.200 2.880 2.855 2.918 . 0 0 "[ . 1 . 2]" 1 821 1 114 GLY H 1 115 GLY H 0.000 . 2.700 1.953 1.947 1.960 . 0 0 "[ . 1 . 2]" 1 822 1 113 ASN HB3 1 114 GLY H 0.000 . 4.200 3.533 3.514 3.559 . 0 0 "[ . 1 . 2]" 1 823 1 114 GLY QA 1 115 GLY QA 0.000 . 7.100 3.770 3.766 3.775 . 0 0 "[ . 1 . 2]" 1 824 1 115 GLY QA 1 116 HIS QB 0.000 . 7.100 3.912 3.653 3.949 . 0 0 "[ . 1 . 2]" 1 825 1 114 GLY HA2 1 115 GLY H 2.700 2.700 7.700 3.070 3.059 3.094 . 0 0 "[ . 1 . 2]" 1 826 1 115 GLY H 1 116 HIS H 2.700 2.700 7.700 4.436 4.420 4.456 . 0 0 "[ . 1 . 2]" 1 827 1 114 GLY HA3 1 115 GLY H 2.700 2.700 7.700 3.430 3.421 3.434 . 0 0 "[ . 1 . 2]" 1 828 1 115 GLY HA2 1 116 HIS H 0.000 . 2.700 2.736 2.719 2.749 0.049 16 0 "[ . 1 . 2]" 1 829 1 116 HIS H 1 117 PHE H 3.200 3.200 8.200 4.450 4.444 4.454 . 0 0 "[ . 1 . 2]" 1 830 1 115 GLY HA3 1 116 HIS H 0.000 . 2.700 2.487 2.472 2.503 . 0 0 "[ . 1 . 2]" 1 831 1 117 PHE H 1 118 PRO HD3 3.200 3.200 8.200 4.703 4.690 4.721 . 0 0 "[ . 1 . 2]" 1 832 1 116 HIS HA 1 117 PHE H 0.000 . 2.700 2.306 2.293 2.321 . 0 0 "[ . 1 . 2]" 1 833 1 116 HIS QB 1 117 PHE H 0.000 . 4.000 2.775 2.760 2.812 . 0 0 "[ . 1 . 2]" 1 834 1 117 PHE H 1 118 PRO HD2 3.200 3.200 8.200 5.214 5.158 5.257 . 0 0 "[ . 1 . 2]" 1 835 1 117 PHE HA 1 118 PRO HD2 0.000 . 2.700 2.800 2.782 2.814 0.114 18 0 "[ . 1 . 2]" 1 836 1 117 PHE HB3 1 118 PRO HD2 0.000 . 4.200 3.665 3.551 3.777 . 0 0 "[ . 1 . 2]" 1 837 1 117 PHE HA 1 118 PRO HD3 0.000 . 2.700 1.855 1.844 1.871 . 0 0 "[ . 1 . 2]" 1 838 1 117 PHE HB2 1 118 PRO HD2 0.000 . 4.200 2.595 2.476 2.715 . 0 0 "[ . 1 . 2]" 1 839 1 117 PHE HB2 1 118 PRO HD3 0.000 . 4.200 3.344 3.281 3.418 . 0 0 "[ . 1 . 2]" 1 840 1 117 PHE HB3 1 118 PRO HD3 0.000 . 4.200 3.728 3.678 3.805 . 0 0 "[ . 1 . 2]" 1 841 1 118 PRO HB2 1 119 THR H 0.000 . 4.200 3.762 3.713 3.798 . 0 0 "[ . 1 . 2]" 1 842 1 118 PRO HB3 1 119 THR H 0.000 . 4.200 3.878 3.822 3.918 . 0 0 "[ . 1 . 2]" 1 843 1 118 PRO HD3 1 119 THR H 3.200 3.200 8.200 5.701 5.685 5.713 . 0 0 "[ . 1 . 2]" 1 844 1 119 THR H 1 120 ASP H 0.000 . 2.700 2.708 2.693 2.725 0.025 9 0 "[ . 1 . 2]" 1 845 1 118 PRO HD2 1 119 THR H 3.200 3.200 8.200 5.309 5.271 5.357 . 0 0 "[ . 1 . 2]" 1 846 1 118 PRO HB2 1 119 THR HA 0.000 . 5.500 4.881 4.863 4.907 . 0 0 "[ . 1 . 2]" 1 847 1 118 PRO HA 1 119 THR H 0.000 . 2.700 2.215 2.208 2.222 . 0 0 "[ . 1 . 2]" 1 848 1 120 ASP H 1 121 VAL H 0.000 . 2.700 2.583 2.551 2.611 . 0 0 "[ . 1 . 2]" 1 849 1 119 THR HA 1 120 ASP H 2.700 2.700 7.700 3.557 3.551 3.563 . 0 0 "[ . 1 . 2]" 1 850 1 119 THR MG 1 120 ASP H 0.000 . 4.000 1.842 1.831 1.847 . 0 0 "[ . 1 . 2]" 1 851 1 120 ASP H 1 121 VAL MG2 0.000 . 5.000 4.277 4.265 4.285 . 0 0 "[ . 1 . 2]" 1 852 1 119 THR MG 1 120 ASP HA 0.000 . 5.000 3.656 3.492 3.741 . 0 0 "[ . 1 . 2]" 1 853 1 119 THR HB 1 120 ASP H 0.000 . 4.200 4.048 3.986 4.073 . 0 0 "[ . 1 . 2]" 1 854 1 121 VAL H 1 122 ASP H 0.000 . 2.700 2.461 2.431 2.479 . 0 0 "[ . 1 . 2]" 1 855 1 121 VAL H 1 122 ASP HA 0.000 . 5.500 5.177 5.155 5.190 . 0 0 "[ . 1 . 2]" 1 856 1 120 ASP HA 1 121 VAL H 2.700 2.700 7.700 3.517 3.510 3.524 . 0 0 "[ . 1 . 2]" 1 857 1 120 ASP QB 1 121 VAL H 0.000 . 5.000 2.632 2.607 2.657 . 0 0 "[ . 1 . 2]" 1 858 1 121 VAL H 1 122 ASP QB 0.000 . 6.300 4.160 4.082 4.216 . 0 0 "[ . 1 . 2]" 1 859 1 121 VAL MG1 1 122 ASP HA 0.000 . 4.000 3.375 3.370 3.380 . 0 0 "[ . 1 . 2]" 1 860 1 121 VAL MG2 1 122 ASP H 0.000 . 5.000 3.918 3.902 3.928 . 0 0 "[ . 1 . 2]" 1 861 1 121 VAL HA 1 122 ASP H 2.700 2.700 7.700 3.565 3.560 3.569 . 0 0 "[ . 1 . 2]" 1 862 1 122 ASP H 1 123 GLN QG 0.000 . 6.300 4.603 4.371 5.108 . 0 0 "[ . 1 . 2]" 1 863 1 122 ASP H 1 123 GLN QB 0.000 . 6.300 4.459 4.311 4.529 . 0 0 "[ . 1 . 2]" 1 864 1 122 ASP H 1 123 GLN H 0.000 . 2.700 2.693 2.686 2.700 0.000 16 0 "[ . 1 . 2]" 1 865 1 121 VAL MG1 1 122 ASP H 0.000 . 4.000 3.144 3.114 3.169 . 0 0 "[ . 1 . 2]" 1 866 1 121 VAL HB 1 122 ASP H 0.000 . 3.200 2.560 2.537 2.583 . 0 0 "[ . 1 . 2]" 1 867 1 122 ASP HA 1 123 GLN H 2.700 2.700 7.700 3.562 3.560 3.564 . 0 0 "[ . 1 . 2]" 1 868 1 123 GLN H 1 124 LYS H 0.000 . 2.700 2.721 2.714 2.730 0.030 15 0 "[ . 1 . 2]" 1 869 1 122 ASP QB 1 123 GLN H 0.000 . 4.000 2.609 2.552 2.658 . 0 0 "[ . 1 . 2]" 1 870 1 123 GLN H 1 124 LYS QB 0.000 . 6.300 4.461 4.442 4.491 . 0 0 "[ . 1 . 2]" 1 871 1 124 LYS H 1 125 VAL HB 0.000 . 5.500 4.446 4.414 4.486 . 0 0 "[ . 1 . 2]" 1 872 1 123 GLN QG 1 124 LYS H 0.000 . 5.000 3.404 1.849 4.091 . 0 0 "[ . 1 . 2]" 1 873 1 123 GLN HA 1 124 LYS H 2.700 2.700 7.700 3.610 3.606 3.614 . 0 0 "[ . 1 . 2]" 1 874 1 124 LYS H 1 125 VAL H 0.000 . 2.700 2.729 2.716 2.743 0.043 17 0 "[ . 1 . 2]" 1 875 1 123 GLN QB 1 124 LYS H 0.000 . 3.500 2.595 2.380 3.082 . 0 0 "[ . 1 . 2]" 1 876 1 124 LYS H 1 125 VAL MG2 0.000 . 6.300 4.739 4.680 4.777 . 0 0 "[ . 1 . 2]" 1 877 1 124 LYS H 1 125 VAL HA 0.000 . 5.500 5.427 5.418 5.442 . 0 0 "[ . 1 . 2]" 1 878 1 125 VAL H 1 126 ASP HA 0.000 . 5.500 5.268 5.264 5.273 . 0 0 "[ . 1 . 2]" 1 879 1 124 LYS HA 1 125 VAL H 2.700 2.700 7.700 3.531 3.527 3.533 . 0 0 "[ . 1 . 2]" 1 880 1 124 LYS QD 1 125 VAL H 0.000 . 6.300 4.814 4.804 4.828 . 0 0 "[ . 1 . 2]" 1 881 1 125 VAL H 1 126 ASP QB 0.000 . 6.300 4.247 4.239 4.254 . 0 0 "[ . 1 . 2]" 1 882 1 124 LYS QB 1 125 VAL H 0.000 . 4.000 2.633 2.608 2.652 . 0 0 "[ . 1 . 2]" 1 883 1 125 VAL H 1 126 ASP H 0.000 . 2.700 2.581 2.575 2.587 . 0 0 "[ . 1 . 2]" 1 884 1 124 LYS QG 1 125 VAL H 0.000 . 6.300 4.140 4.092 4.180 . 0 0 "[ . 1 . 2]" 1 885 1 125 VAL MG2 1 126 ASP H 0.000 . 5.000 4.017 3.991 4.039 . 0 0 "[ . 1 . 2]" 1 886 1 125 VAL MG1 1 126 ASP HA 0.000 . 3.500 2.959 2.948 2.976 . 0 0 "[ . 1 . 2]" 1 887 1 126 ASP H 1 127 GLN QG 0.000 . 4.000 3.714 3.706 3.722 . 0 0 "[ . 1 . 2]" 1 888 1 125 VAL HB 1 126 ASP H 0.000 . 3.200 2.644 2.606 2.675 . 0 0 "[ . 1 . 2]" 1 889 1 126 ASP H 1 127 GLN H 0.000 . 2.700 2.573 2.563 2.584 . 0 0 "[ . 1 . 2]" 1 890 1 126 ASP H 1 127 GLN HA 0.000 . 5.500 5.276 5.269 5.285 . 0 0 "[ . 1 . 2]" 1 891 1 125 VAL HA 1 126 ASP H 2.700 2.700 7.700 3.546 3.541 3.550 . 0 0 "[ . 1 . 2]" 1 892 1 126 ASP H 1 127 GLN QB 0.000 . 5.000 4.502 4.493 4.510 . 0 0 "[ . 1 . 2]" 1 893 1 126 ASP HA 1 127 GLN H 2.700 2.700 7.700 3.510 3.506 3.514 . 0 0 "[ . 1 . 2]" 1 894 1 126 ASP QB 1 127 GLN H 0.000 . 3.500 2.535 2.522 2.547 . 0 0 "[ . 1 . 2]" 1 895 1 127 GLN H 1 128 VAL H 0.000 . 2.700 2.625 2.601 2.637 . 0 0 "[ . 1 . 2]" 1 896 1 126 ASP QB 1 127 GLN HA 0.000 . 5.000 4.092 4.075 4.122 . 0 0 "[ . 1 . 2]" 1 897 1 127 GLN H 1 128 VAL HB 0.000 . 5.500 4.580 4.549 4.598 . 0 0 "[ . 1 . 2]" 1 898 1 127 GLN H 1 128 VAL QG 0.000 . 7.000 4.020 3.979 4.055 . 0 0 "[ . 1 . 2]" 1 899 1 127 GLN H 1 128 VAL HA 0.000 . 5.500 5.315 5.297 5.325 . 0 0 "[ . 1 . 2]" 1 900 1 127 GLN QG 1 128 VAL H 0.000 . 5.000 3.886 3.867 3.902 . 0 0 "[ . 1 . 2]" 1 901 1 128 VAL H 1 129 ALA MB 0.000 . 5.000 4.108 4.096 4.129 . 0 0 "[ . 1 . 2]" 1 902 1 128 VAL H 1 129 ALA HA 0.000 . 5.500 5.316 5.308 5.332 . 0 0 "[ . 1 . 2]" 1 903 1 128 VAL H 1 129 ALA H 0.000 . 2.700 2.629 2.618 2.649 . 0 0 "[ . 1 . 2]" 1 904 1 127 GLN HA 1 128 VAL H 2.700 2.700 7.700 3.553 3.545 3.558 . 0 0 "[ . 1 . 2]" 1 905 1 127 GLN QB 1 128 VAL H 0.000 . 3.500 2.531 2.513 2.547 . 0 0 "[ . 1 . 2]" 1 906 1 128 VAL HB 1 129 ALA H 0.000 . 3.200 2.629 2.612 2.651 . 0 0 "[ . 1 . 2]" 1 907 1 128 VAL MG1 1 129 ALA H 0.000 . 4.000 3.342 3.332 3.357 . 0 0 "[ . 1 . 2]" 1 908 1 128 VAL HA 1 129 ALA H 2.700 2.700 5.900 3.551 3.548 3.556 . 0 0 "[ . 1 . 2]" 1 909 1 128 VAL MG2 1 129 ALA H 0.000 . 5.000 3.914 3.899 3.930 . 0 0 "[ . 1 . 2]" 1 910 1 129 ALA H 1 130 ARG H 0.000 . 2.700 2.630 2.595 2.691 . 0 0 "[ . 1 . 2]" 1 911 1 130 ARG H 1 131 GLN H 0.000 . 2.700 2.666 2.613 2.716 0.016 3 0 "[ . 1 . 2]" 1 912 1 129 ALA HA 1 130 ARG H 2.700 2.700 7.700 3.563 3.555 3.582 . 0 0 "[ . 1 . 2]" 1 913 1 129 ALA MB 1 130 ARG H 0.000 . 4.000 2.620 2.573 2.664 . 0 0 "[ . 1 . 2]" 1 914 1 131 GLN H 1 132 GLY H 0.000 . 2.700 2.415 2.341 2.435 . 0 0 "[ . 1 . 2]" 1 915 1 130 ARG HA 1 131 GLN H 2.700 2.700 7.700 3.526 3.500 3.542 . 0 0 "[ . 1 . 2]" 1 916 1 130 ARG QB 1 131 GLN H 0.000 . 4.000 2.876 2.677 3.521 . 0 0 "[ . 1 . 2]" 1 917 1 130 ARG HG3 1 131 GLN H 0.000 . 4.200 4.182 3.020 4.258 0.058 9 0 "[ . 1 . 2]" 1 918 1 130 ARG HG2 1 131 GLN H 0.000 . 4.200 3.271 2.213 4.300 0.100 1 0 "[ . 1 . 2]" 1 919 1 132 GLY H 1 133 ALA HA 0.000 . 5.500 5.031 4.964 5.074 . 0 0 "[ . 1 . 2]" 1 920 1 131 GLN HG3 1 132 GLY H 0.000 . 4.200 4.257 3.638 4.316 0.116 13 0 "[ . 1 . 2]" 1 921 1 131 GLN QB 1 132 GLY QA 0.000 . 7.100 4.428 4.087 4.630 . 0 0 "[ . 1 . 2]" 1 922 1 132 GLY H 1 133 ALA H 0.000 . 2.700 2.252 2.165 2.310 . 0 0 "[ . 1 . 2]" 1 923 1 131 GLN HA 1 132 GLY H 2.700 2.700 7.700 3.334 3.314 3.367 . 0 0 "[ . 1 . 2]" 1 924 1 132 GLY QA 1 133 ALA HA 0.000 . 5.000 4.068 4.053 4.077 . 0 0 "[ . 1 . 2]" 1 925 1 132 GLY QA 1 133 ALA MB 0.000 . 5.800 4.127 4.094 4.151 . 0 0 "[ . 1 . 2]" 1 926 1 131 GLN QB 1 132 GLY H 0.000 . 4.000 3.381 3.197 3.714 . 0 0 "[ . 1 . 2]" 1 927 1 131 GLN HG2 1 132 GLY H 0.000 . 4.200 4.047 2.802 4.330 0.130 9 0 "[ . 1 . 2]" 1 928 1 132 GLY HA2 1 133 ALA H 2.700 2.700 7.700 3.060 3.051 3.067 . 0 0 "[ . 1 . 2]" 1 929 1 133 ALA H 1 134 THR H 3.200 3.200 8.200 4.570 4.540 4.585 . 0 0 "[ . 1 . 2]" 1 930 1 132 GLY HA3 1 133 ALA H 2.700 2.700 7.700 3.463 3.457 3.469 . 0 0 "[ . 1 . 2]" 1 931 1 133 ALA MB 1 134 THR H 0.000 . 3.500 2.517 2.345 2.635 . 0 0 "[ . 1 . 2]" 1 932 1 133 ALA HA 1 134 THR H 0.000 . 2.700 2.470 2.422 2.575 . 0 0 "[ . 1 . 2]" 1 933 1 135 PRO HA 1 136 LEU HG 0.000 . 4.200 4.206 4.166 4.250 0.050 19 0 "[ . 1 . 2]" 1 934 1 134 THR HB 1 135 PRO HA 0.000 . 5.500 5.056 4.892 5.240 . 0 0 "[ . 1 . 2]" 1 935 1 136 LEU H 1 137 VAL H 3.200 3.200 8.200 4.488 4.463 4.515 . 0 0 "[ . 1 . 2]" 1 936 1 135 PRO HA 1 136 LEU H 0.000 . 2.700 2.223 2.217 2.228 . 0 0 "[ . 1 . 2]" 1 937 1 135 PRO QB 1 136 LEU H 0.000 . 4.000 3.629 3.620 3.639 . 0 0 "[ . 1 . 2]" 1 938 1 136 LEU HA 1 137 VAL H 0.000 . 2.700 2.250 2.239 2.270 . 0 0 "[ . 1 . 2]" 1 939 1 136 LEU QD 1 137 VAL H 0.000 . 5.700 3.635 3.586 3.682 . 0 0 "[ . 1 . 2]" 1 940 1 137 VAL H 1 138 VAL H 3.200 3.200 8.200 4.508 4.495 4.537 . 0 0 "[ . 1 . 2]" 1 941 1 137 VAL HA 1 138 VAL HA 0.000 . 5.500 4.467 4.463 4.476 . 0 0 "[ . 1 . 2]" 1 942 1 137 VAL HB 1 138 VAL H 0.000 . 4.200 4.184 4.104 4.204 0.004 10 0 "[ . 1 . 2]" 1 943 1 137 VAL MG1 1 138 VAL HA 0.000 . 5.000 3.651 3.576 3.821 . 0 0 "[ . 1 . 2]" 1 944 1 138 VAL H 1 139 VAL H 3.200 3.200 8.200 4.412 4.374 4.434 . 0 0 "[ . 1 . 2]" 1 945 1 137 VAL MG1 1 138 VAL H 0.000 . 3.500 2.580 2.472 2.636 . 0 0 "[ . 1 . 2]" 1 946 1 137 VAL HA 1 138 VAL H 0.000 . 2.700 2.228 2.219 2.236 . 0 0 "[ . 1 . 2]" 1 947 1 139 VAL HA 1 140 GLU QB 0.000 . 5.000 3.865 3.844 3.889 . 0 0 "[ . 1 . 2]" 1 948 1 138 VAL HA 1 139 VAL H 0.000 . 2.700 2.219 2.206 2.228 . 0 0 "[ . 1 . 2]" 1 949 1 138 VAL HB 1 139 VAL H 0.000 . 5.500 4.249 4.214 4.333 . 0 0 "[ . 1 . 2]" 1 950 1 139 VAL H 1 140 GLU H 3.200 3.200 8.200 4.481 4.468 4.492 . 0 0 "[ . 1 . 2]" 1 951 1 140 GLU H 1 141 GLY H 3.200 3.200 8.200 4.202 4.178 4.228 . 0 0 "[ . 1 . 2]" 1 952 1 140 GLU HA 1 141 GLY QA 0.000 . 5.000 4.037 4.033 4.041 . 0 0 "[ . 1 . 2]" 1 953 1 139 VAL HB 1 140 GLU H 0.000 . 2.700 2.641 2.618 2.660 . 0 0 "[ . 1 . 2]" 1 954 1 139 VAL MG1 1 140 GLU H 0.000 . 5.000 3.524 3.490 3.546 . 0 0 "[ . 1 . 2]" 1 955 1 139 VAL HA 1 140 GLU H 0.000 . 2.700 2.337 2.331 2.342 . 0 0 "[ . 1 . 2]" 1 956 1 139 VAL MG2 1 140 GLU H 0.000 . 5.000 3.832 3.799 3.858 . 0 0 "[ . 1 . 2]" 1 957 1 141 GLY H 1 142 SER H 3.200 3.200 8.200 4.568 4.526 4.589 . 0 0 "[ . 1 . 2]" 1 958 1 140 GLU HA 1 141 GLY H 0.000 . 2.700 2.222 2.213 2.232 . 0 0 "[ . 1 . 2]" 1 959 1 140 GLU QG 1 141 GLY H 0.000 . 4.000 2.971 2.906 3.021 . 0 0 "[ . 1 . 2]" 1 960 1 140 GLU QB 1 141 GLY H 0.000 . 5.000 3.770 3.744 3.794 . 0 0 "[ . 1 . 2]" 1 961 1 142 SER H 1 143 ARG H 0.000 . 2.700 2.438 2.338 2.515 . 0 0 "[ . 1 . 2]" 1 962 1 142 SER H 1 143 ARG HB3 0.000 . 5.500 4.003 3.945 4.042 . 0 0 "[ . 1 . 2]" 1 963 1 141 GLY QA 1 142 SER H 0.000 . 3.500 2.177 2.171 2.184 . 0 0 "[ . 1 . 2]" 1 964 1 142 SER HB2 1 143 ARG H 0.000 . 5.500 4.278 4.152 4.375 . 0 0 "[ . 1 . 2]" 1 965 1 143 ARG H 1 144 VAL H 3.200 3.200 8.200 4.499 4.481 4.516 . 0 0 "[ . 1 . 2]" 1 966 1 142 SER HA 1 143 ARG H 2.700 2.700 7.700 3.255 3.204 3.288 . 0 0 "[ . 1 . 2]" 1 967 1 142 SER HB3 1 143 ARG H 0.000 . 5.500 4.521 4.432 4.640 . 0 0 "[ . 1 . 2]" 1 968 1 143 ARG HG2 1 144 VAL H 0.000 . 4.200 4.251 4.243 4.272 0.072 12 0 "[ . 1 . 2]" 1 969 1 143 ARG QB 1 144 VAL H 0.000 . 4.000 2.501 2.415 2.523 . 0 0 "[ . 1 . 2]" 1 970 1 144 VAL HA 1 145 LEU HG 0.000 . 4.200 3.543 3.512 3.588 . 0 0 "[ . 1 . 2]" 1 971 1 143 ARG HA 1 144 VAL H 0.000 . 2.700 2.482 2.472 2.515 . 0 0 "[ . 1 . 2]" 1 972 1 143 ARG HG3 1 144 VAL H 0.000 . 4.200 3.224 3.180 3.232 . 0 0 "[ . 1 . 2]" 1 973 1 143 ARG QD 1 144 VAL H 0.000 . 5.000 4.461 4.327 4.472 . 0 0 "[ . 1 . 2]" 1 974 1 144 VAL HB 1 145 LEU H 0.000 . 5.500 4.109 4.082 4.148 . 0 0 "[ . 1 . 2]" 1 975 1 145 LEU H 1 146 GLY H 0.000 . 2.700 2.172 2.145 2.197 . 0 0 "[ . 1 . 2]" 1 976 1 145 LEU H 1 146 GLY QA 0.000 . 6.300 4.293 4.268 4.311 . 0 0 "[ . 1 . 2]" 1 977 1 144 VAL H 1 145 LEU H 3.200 3.200 8.200 4.534 4.521 4.558 . 0 0 "[ . 1 . 2]" 1 978 1 144 VAL HA 1 145 LEU H 0.000 . 2.700 2.210 2.201 2.217 . 0 0 "[ . 1 . 2]" 1 979 1 145 LEU HA 1 146 GLY H 2.700 2.700 7.700 3.469 3.455 3.479 . 0 0 "[ . 1 . 2]" 1 980 1 146 GLY H 1 147 VAL HA 0.000 . 5.500 4.737 4.716 4.750 . 0 0 "[ . 1 . 2]" 1 981 1 146 GLY HA2 1 147 VAL H 0.000 . 2.700 2.561 2.551 2.574 . 0 0 "[ . 1 . 2]" 1 982 1 146 GLY HA3 1 147 VAL HB 0.000 . 5.500 5.180 5.163 5.203 . 0 0 "[ . 1 . 2]" 1 983 1 145 LEU HG 1 146 GLY H 0.000 . 5.500 3.058 3.008 3.131 . 0 0 "[ . 1 . 2]" 1 984 1 146 GLY HA2 1 147 VAL HB 0.000 . 5.500 4.865 4.849 4.890 . 0 0 "[ . 1 . 2]" 1 985 1 145 LEU HB2 1 146 GLY H 0.000 . 4.200 3.866 3.820 3.925 . 0 0 "[ . 1 . 2]" 1 986 1 145 LEU MD1 1 146 GLY H 0.000 . 5.000 2.156 2.109 2.201 . 0 0 "[ . 1 . 2]" 1 987 1 145 LEU MD2 1 146 GLY H 0.000 . 5.000 4.291 4.276 4.316 . 0 0 "[ . 1 . 2]" 1 988 1 146 GLY HA3 1 147 VAL H 0.000 . 2.700 2.644 2.633 2.657 . 0 0 "[ . 1 . 2]" 1 989 1 145 LEU HB3 1 146 GLY H 0.000 . 4.200 4.267 4.260 4.279 0.079 9 0 "[ . 1 . 2]" 1 990 1 147 VAL H 1 148 ILE H 3.200 3.200 8.200 4.484 4.467 4.493 . 0 0 "[ . 1 . 2]" 1 991 1 146 GLY H 1 147 VAL H 3.200 3.200 8.200 4.430 4.425 4.438 . 0 0 "[ . 1 . 2]" 1 992 1 147 VAL HB 1 148 ILE H 0.000 . 5.500 3.981 3.958 3.992 . 0 0 "[ . 1 . 2]" 1 993 1 147 VAL MG1 1 148 ILE H 0.000 . 3.500 2.261 2.208 2.310 . 0 0 "[ . 1 . 2]" 1 994 1 148 ILE H 1 149 ALA H 3.200 3.200 8.200 4.258 4.238 4.316 . 0 0 "[ . 1 . 2]" 1 995 1 147 VAL MG2 1 148 ILE H 0.000 . 5.000 4.034 4.013 4.064 . 0 0 "[ . 1 . 2]" 1 996 1 147 VAL HA 1 148 ILE H 0.000 . 2.700 2.228 2.220 2.238 . 0 0 "[ . 1 . 2]" 1 997 1 149 ALA HA 1 150 LEU HG 0.000 . 4.200 3.295 3.170 4.080 . 0 0 "[ . 1 . 2]" 1 998 1 148 ILE QG 1 149 ALA H 0.000 . 5.000 4.368 4.338 4.382 . 0 0 "[ . 1 . 2]" 1 999 1 149 ALA HA 1 150 LEU MD1 0.000 . 5.000 4.025 2.493 4.210 . 0 0 "[ . 1 . 2]" 1 1000 1 148 ILE MG 1 149 ALA H 0.000 . 4.000 3.076 2.833 3.228 . 0 0 "[ . 1 . 2]" 1 1001 1 148 ILE HB 1 149 ALA H 0.000 . 5.500 4.399 4.343 4.416 . 0 0 "[ . 1 . 2]" 1 1002 1 148 ILE HA 1 149 ALA H 0.000 . 2.700 2.248 2.230 2.257 . 0 0 "[ . 1 . 2]" 1 1003 1 149 ALA H 1 150 LEU H 3.200 3.200 8.200 4.417 4.395 4.426 . 0 0 "[ . 1 . 2]" 1 1004 1 149 ALA HA 1 150 LEU H 0.000 . 2.700 2.180 2.170 2.212 . 0 0 "[ . 1 . 2]" 1 1005 1 149 ALA MB 1 150 LEU H 0.000 . 4.000 3.351 3.336 3.373 . 0 0 "[ . 1 . 2]" 1 1006 1 150 LEU HA 1 151 LYS H 0.000 . 2.700 2.319 2.292 2.349 . 0 0 "[ . 1 . 2]" 1 1007 1 150 LEU QD 1 151 LYS H 0.000 . 5.700 4.130 4.084 4.230 . 0 0 "[ . 1 . 2]" 1 1008 1 150 LEU HB3 1 151 LYS H 0.000 . 3.200 3.208 3.126 3.255 0.055 1 0 "[ . 1 . 2]" 1 1009 1 152 ASP H 1 153 ILE H 3.200 3.200 8.200 4.625 4.570 4.671 . 0 0 "[ . 1 . 2]" 1 1010 1 151 LYS HA 1 152 ASP H 0.000 . 2.700 2.373 2.275 2.478 . 0 0 "[ . 1 . 2]" 1 1011 1 151 LYS QB 1 152 ASP H 0.000 . 4.000 2.606 2.454 2.834 . 0 0 "[ . 1 . 2]" 1 1012 1 151 LYS QD 1 152 ASP H 0.000 . 5.000 4.381 3.571 4.511 . 0 0 "[ . 1 . 2]" 1 1013 1 151 LYS QG 1 152 ASP H 0.000 . 5.000 3.786 3.298 4.524 . 0 0 "[ . 1 . 2]" 1 1014 1 151 LYS QE 1 152 ASP H 0.000 . 6.300 5.486 5.142 5.666 . 0 0 "[ . 1 . 2]" 1 1015 1 152 ASP HA 1 153 ILE H 0.000 . 2.700 2.268 2.220 2.304 . 0 0 "[ . 1 . 2]" 1 1016 1 152 ASP QB 1 153 ILE H 0.000 . 4.000 3.615 3.582 3.666 . 0 0 "[ . 1 . 2]" 1 1017 1 153 ILE HA 1 154 VAL H 0.000 . 2.700 2.332 2.309 2.358 . 0 0 "[ . 1 . 2]" 1 1018 1 153 ILE HB 1 154 VAL H 0.000 . 4.200 4.190 4.159 4.223 0.023 20 0 "[ . 1 . 2]" 1 1019 1 153 ILE QG 1 154 VAL H 0.000 . 5.000 2.260 2.160 2.763 . 0 0 "[ . 1 . 2]" 1 1020 1 153 ILE MG 1 154 VAL H 0.000 . 4.000 3.356 3.342 3.371 . 0 0 "[ . 1 . 2]" 1 1021 1 153 ILE MD 1 154 VAL H 0.000 . 5.000 2.834 2.106 4.117 . 0 0 "[ . 1 . 2]" 1 1022 1 154 VAL HA 1 155 LYS H 0.000 . 2.700 2.235 2.228 2.242 . 0 0 "[ . 1 . 2]" 1 1023 1 154 VAL QG 1 155 LYS H 0.000 . 5.700 2.488 2.310 2.639 . 0 0 "[ . 1 . 2]" 1 1024 1 154 VAL HB 1 155 LYS H 0.000 . 4.200 4.145 4.123 4.181 . 0 0 "[ . 1 . 2]" 1 1025 1 155 LYS HA 1 156 GLY H 0.000 . 2.700 2.277 2.269 2.291 . 0 0 "[ . 1 . 2]" 1 1026 1 155 LYS QB 1 156 GLY H 0.000 . 4.000 3.239 2.943 3.607 . 0 0 "[ . 1 . 2]" 1 1027 1 25 SER H 1 27 PHE H 3.200 3.200 8.200 6.095 5.996 6.180 . 0 0 "[ . 1 . 2]" 1 1028 1 24 ALA MB 1 26 GLU H 0.000 . 6.300 4.045 3.862 4.180 . 0 0 "[ . 1 . 2]" 1 1029 1 24 ALA HA 1 26 GLU H 0.000 . 4.200 4.083 3.978 4.208 0.008 2 0 "[ . 1 . 2]" 1 1030 1 30 ALA H 1 33 VAL HB 0.000 . 3.200 3.130 2.975 3.220 0.020 5 0 "[ . 1 . 2]" 1 1031 1 30 ALA H 1 33 VAL MG1 0.000 . 5.000 4.026 3.866 4.161 . 0 0 "[ . 1 . 2]" 1 1032 1 28 ILE MG 1 31 GLN QE 0.000 . 7.100 5.291 5.287 5.295 . 0 0 "[ . 1 . 2]" 1 1033 1 31 GLN H 1 33 VAL H 0.000 . 5.500 4.900 4.768 4.934 . 0 0 "[ . 1 . 2]" 1 1034 1 30 ALA MB 1 32 GLY H 0.000 . 6.300 5.258 5.251 5.275 . 0 0 "[ . 1 . 2]" 1 1035 1 31 GLN QB 1 33 VAL H 0.000 . 6.300 4.951 4.889 4.975 . 0 0 "[ . 1 . 2]" 1 1036 1 29 PRO HB3 1 33 VAL H 0.000 . 4.200 4.260 4.244 4.285 0.085 13 0 "[ . 1 . 2]" 1 1037 1 29 PRO HB2 1 33 VAL H 0.000 . 5.500 3.566 3.526 3.626 . 0 0 "[ . 1 . 2]" 1 1038 1 33 VAL MG1 1 37 THR HB 0.000 . 3.500 1.903 1.840 2.164 . 0 0 "[ . 1 . 2]" 1 1039 1 29 PRO HA 1 33 VAL H 0.000 . 5.500 5.442 5.329 5.480 . 0 0 "[ . 1 . 2]" 1 1040 1 29 PRO QG 1 33 VAL H 0.000 . 6.300 5.031 4.977 5.137 . 0 0 "[ . 1 . 2]" 1 1041 1 33 VAL MG1 1 37 THR HA 0.000 . 5.000 4.171 4.158 4.188 . 0 0 "[ . 1 . 2]" 1 1042 1 31 GLN HA 1 33 VAL H 0.000 . 4.200 3.436 3.391 3.614 . 0 0 "[ . 1 . 2]" 1 1043 1 30 ALA MB 1 33 VAL H 0.000 . 6.300 4.340 4.087 4.400 . 0 0 "[ . 1 . 2]" 1 1044 1 34 ASP H 1 37 THR H 0.000 . 4.200 4.130 4.018 4.206 0.006 7 0 "[ . 1 . 2]" 1 1045 1 34 ASP H 1 38 LEU H 0.000 . 5.500 4.688 4.552 4.758 . 0 0 "[ . 1 . 2]" 1 1046 1 34 ASP H 1 37 THR HB 0.000 . 4.200 2.746 2.702 2.799 . 0 0 "[ . 1 . 2]" 1 1047 1 34 ASP HB3 1 37 THR HB 0.000 . 4.200 4.206 4.129 4.261 0.061 13 0 "[ . 1 . 2]" 1 1048 1 34 ASP HB2 1 37 THR HB 0.000 . 4.200 2.916 2.743 4.106 . 0 0 "[ . 1 . 2]" 1 1049 1 35 GLU HA 1 38 LEU HB3 0.000 . 4.200 2.139 2.019 2.195 . 0 0 "[ . 1 . 2]" 1 1050 1 35 GLU H 1 37 THR H 3.200 3.200 5.500 4.238 4.189 4.314 . 0 0 "[ . 1 . 2]" 1 1051 1 35 GLU HA 1 38 LEU HB2 0.000 . 4.200 3.168 3.065 3.246 . 0 0 "[ . 1 . 2]" 1 1052 1 36 LYS HA 1 39 ALA MB 0.000 . 4.000 2.363 2.196 2.678 . 0 0 "[ . 1 . 2]" 1 1053 1 34 ASP HA 1 36 LYS H 0.000 . 5.500 4.328 4.107 4.426 . 0 0 "[ . 1 . 2]" 1 1054 1 34 ASP QB 1 36 LYS H 0.000 . 4.000 2.925 2.733 3.028 . 0 0 "[ . 1 . 2]" 1 1055 1 37 THR H 1 39 ALA MB 0.000 . 6.300 4.653 4.566 4.780 . 0 0 "[ . 1 . 2]" 1 1056 1 34 ASP HB3 1 37 THR H 0.000 . 4.200 3.287 3.123 4.254 0.054 13 0 "[ . 1 . 2]" 1 1057 1 37 THR HA 1 40 ASP QB 0.000 . 4.000 2.998 2.914 3.058 . 0 0 "[ . 1 . 2]" 1 1058 1 34 ASP HB2 1 37 THR H 0.000 . 4.200 2.694 2.622 3.249 . 0 0 "[ . 1 . 2]" 1 1059 1 35 GLU HA 1 37 THR H 0.000 . 5.500 4.372 4.239 4.495 . 0 0 "[ . 1 . 2]" 1 1060 1 35 GLU HA 1 38 LEU HG 0.000 . 4.200 4.178 3.990 4.227 0.027 3 0 "[ . 1 . 2]" 1 1061 1 35 GLU HA 1 38 LEU H 0.000 . 4.200 3.110 2.991 3.203 . 0 0 "[ . 1 . 2]" 1 1062 1 38 LEU HA 1 41 ALA MB 0.000 . 4.000 3.023 2.947 3.086 . 0 0 "[ . 1 . 2]" 1 1063 1 36 LYS HA 1 38 LEU H 0.000 . 5.500 4.370 4.338 4.446 . 0 0 "[ . 1 . 2]" 1 1064 1 35 GLU HA 1 39 ALA H 0.000 . 5.500 4.139 4.053 4.188 . 0 0 "[ . 1 . 2]" 1 1065 1 39 ALA HA 1 42 ALA MB 0.000 . 3.500 1.932 1.840 2.046 . 0 0 "[ . 1 . 2]" 1 1066 1 36 LYS HA 1 39 ALA H 0.000 . 5.500 3.213 3.110 3.433 . 0 0 "[ . 1 . 2]" 1 1067 1 37 THR HA 1 40 ASP H 0.000 . 4.200 3.576 3.531 3.659 . 0 0 "[ . 1 . 2]" 1 1068 1 38 LEU QB 1 40 ASP H 0.000 . 6.300 4.934 4.899 4.975 . 0 0 "[ . 1 . 2]" 1 1069 1 36 LYS HA 1 40 ASP H 0.000 . 5.500 4.212 4.154 4.323 . 0 0 "[ . 1 . 2]" 1 1070 1 38 LEU HA 1 40 ASP H 0.000 . 5.500 4.641 4.577 4.749 . 0 0 "[ . 1 . 2]" 1 1071 1 40 ASP HA 1 43 GLN HB3 0.000 . 4.200 4.254 4.243 4.280 0.080 14 0 "[ . 1 . 2]" 1 1072 1 36 LYS QG 1 40 ASP H 0.000 . 6.300 4.278 4.094 4.717 . 0 0 "[ . 1 . 2]" 1 1073 1 40 ASP HA 1 44 LEU QD 0.000 . 4.700 3.450 3.428 3.475 . 0 0 "[ . 1 . 2]" 1 1074 1 40 ASP HA 1 43 GLN HB2 0.000 . 5.500 2.732 2.723 2.746 . 0 0 "[ . 1 . 2]" 1 1075 1 41 ALA HA 1 44 LEU QD 0.000 . 4.700 1.728 1.716 1.739 . 0 0 "[ . 1 . 2]" 1 1076 1 41 ALA HA 1 44 LEU HB3 0.000 . 4.200 4.346 4.331 4.355 0.155 14 0 "[ . 1 . 2]" 1 1077 1 41 ALA HA 1 44 LEU HG 0.000 . 5.500 1.942 1.913 1.964 . 0 0 "[ . 1 . 2]" 1 1078 1 37 THR HA 1 41 ALA H 0.000 . 5.500 4.203 4.075 4.303 . 0 0 "[ . 1 . 2]" 1 1079 1 38 LEU HA 1 41 ALA H 0.000 . 4.200 3.899 3.865 3.935 . 0 0 "[ . 1 . 2]" 1 1080 1 42 ALA HA 1 45 ALA MB 0.000 . 4.000 3.036 2.982 3.094 . 0 0 "[ . 1 . 2]" 1 1081 1 40 ASP HA 1 42 ALA H 0.000 . 5.500 4.300 4.269 4.326 . 0 0 "[ . 1 . 2]" 1 1082 1 42 ALA H 1 45 ALA MB 0.000 . 6.300 4.698 4.616 4.779 . 0 0 "[ . 1 . 2]" 1 1083 1 38 LEU QB 1 42 ALA H 0.000 . 6.300 5.198 5.156 5.242 . 0 0 "[ . 1 . 2]" 1 1084 1 43 GLN HE22 1 47 LEU QD 0.000 . 7.000 5.077 4.991 5.184 . 0 0 "[ . 1 . 2]" 1 1085 1 43 GLN HE21 1 47 LEU QD 0.000 . 7.000 4.868 4.745 5.012 . 0 0 "[ . 1 . 2]" 1 1086 1 43 GLN HA 1 47 LEU QD 0.000 . 4.700 3.503 3.488 3.517 . 0 0 "[ . 1 . 2]" 1 1087 1 44 LEU HA 1 47 LEU QD 0.000 . 4.700 1.743 1.737 1.759 . 0 0 "[ . 1 . 2]" 1 1088 1 44 LEU HA 1 47 LEU HG 0.000 . 4.200 1.849 1.837 1.859 . 0 0 "[ . 1 . 2]" 1 1089 1 46 SER H 1 49 ASP QB 0.000 . 6.300 5.614 5.572 5.625 . 0 0 "[ . 1 . 2]" 1 1090 1 46 SER HA 1 49 ASP HB3 0.000 . 4.200 2.894 2.849 2.911 . 0 0 "[ . 1 . 2]" 1 1091 1 43 GLN HA 1 46 SER H 0.000 . 4.200 3.444 3.393 3.512 . 0 0 "[ . 1 . 2]" 1 1092 1 47 LEU H 1 49 ASP H 3.200 3.200 5.500 3.931 3.914 3.949 . 0 0 "[ . 1 . 2]" 1 1093 1 45 ALA MB 1 47 LEU H 0.000 . 6.300 4.512 4.498 4.528 . 0 0 "[ . 1 . 2]" 1 1094 1 45 ALA H 1 47 LEU H 3.200 3.200 5.500 4.252 4.239 4.271 . 0 0 "[ . 1 . 2]" 1 1095 1 45 ALA HA 1 47 LEU H 0.000 . 5.500 4.083 4.061 4.106 . 0 0 "[ . 1 . 2]" 1 1096 1 43 GLN HA 1 47 LEU H 0.000 . 5.500 4.894 4.826 4.975 . 0 0 "[ . 1 . 2]" 1 1097 1 48 ALA HA 1 50 GLU QG 0.000 . 5.000 4.482 4.478 4.488 . 0 0 "[ . 1 . 2]" 1 1098 1 46 SER HB2 1 49 ASP H 0.000 . 5.500 4.626 4.591 4.646 . 0 0 "[ . 1 . 2]" 1 1099 1 49 ASP HA 1 51 THR MG 0.000 . 4.000 3.363 3.352 3.369 . 0 0 "[ . 1 . 2]" 1 1100 1 47 LEU HG 1 49 ASP H 0.000 . 5.500 5.583 5.573 5.600 0.100 4 0 "[ . 1 . 2]" 1 1101 1 47 LEU HB2 1 49 ASP H 0.000 . 5.500 4.578 4.549 4.597 . 0 0 "[ . 1 . 2]" 1 1102 1 46 SER HB3 1 49 ASP H 0.000 . 5.500 5.519 5.503 5.525 0.025 6 0 "[ . 1 . 2]" 1 1103 1 49 ASP H 1 51 THR MG 0.000 . 6.300 5.292 5.285 5.302 . 0 0 "[ . 1 . 2]" 1 1104 1 47 LEU HB3 1 49 ASP H 0.000 . 5.500 5.363 5.347 5.381 . 0 0 "[ . 1 . 2]" 1 1105 1 49 ASP HB2 1 51 THR H 0.000 . 4.200 2.593 2.578 2.606 . 0 0 "[ . 1 . 2]" 1 1106 1 49 ASP HB3 1 51 THR H 0.000 . 5.500 4.208 4.193 4.222 . 0 0 "[ . 1 . 2]" 1 1107 1 49 ASP HA 1 51 THR H 0.000 . 4.200 3.479 3.459 3.494 . 0 0 "[ . 1 . 2]" 1 1108 1 51 THR H 1 55 ARG H 0.000 . 5.500 5.439 5.417 5.471 . 0 0 "[ . 1 . 2]" 1 1109 1 49 ASP H 1 51 THR H 3.200 3.200 5.500 5.292 5.284 5.302 . 0 0 "[ . 1 . 2]" 1 1110 1 51 THR H 1 54 GLY QA 0.000 . 6.300 3.452 3.399 3.485 . 0 0 "[ . 1 . 2]" 1 1111 1 51 THR H 1 55 ARG QG 0.000 . 6.300 5.594 5.474 5.621 . 0 0 "[ . 1 . 2]" 1 1112 1 51 THR HB 1 53 GLU H 0.000 . 3.200 3.109 3.055 3.164 . 0 0 "[ . 1 . 2]" 1 1113 1 51 THR HA 1 53 GLU H 0.000 . 5.500 4.082 4.038 4.136 . 0 0 "[ . 1 . 2]" 1 1114 1 51 THR MG 1 53 GLU H 0.000 . 6.300 4.430 4.348 4.485 . 0 0 "[ . 1 . 2]" 1 1115 1 53 GLU H 1 55 ARG H 3.200 3.200 5.500 4.511 4.442 4.574 . 0 0 "[ . 1 . 2]" 1 1116 1 51 THR MG 1 54 GLY HA2 0.000 . 6.300 4.503 4.432 4.554 . 0 0 "[ . 1 . 2]" 1 1117 1 54 GLY QA 1 57 ILE HB 0.000 . 4.000 3.229 3.173 3.308 . 0 0 "[ . 1 . 2]" 1 1118 1 51 THR MG 1 54 GLY HA3 0.000 . 6.300 3.949 3.874 4.009 . 0 0 "[ . 1 . 2]" 1 1119 1 54 GLY QA 1 58 VAL MG2 0.000 . 4.800 3.596 3.583 3.607 . 0 0 "[ . 1 . 2]" 1 1120 1 54 GLY QA 1 57 ILE QG 0.000 . 4.800 3.581 3.443 3.715 . 0 0 "[ . 1 . 2]" 1 1121 1 51 THR HB 1 54 GLY H 0.000 . 5.500 3.598 3.510 3.682 . 0 0 "[ . 1 . 2]" 1 1122 1 55 ARG H 1 58 VAL MG2 0.000 . 6.300 4.560 4.529 4.586 . 0 0 "[ . 1 . 2]" 1 1123 1 55 ARG HA 1 58 VAL HB 0.000 . 4.200 2.963 2.920 3.006 . 0 0 "[ . 1 . 2]" 1 1124 1 55 ARG HA 1 58 VAL MG2 0.000 . 3.500 2.886 2.819 2.919 . 0 0 "[ . 1 . 2]" 1 1125 1 55 ARG HA 1 59 ILE MD 0.000 . 4.000 3.357 3.354 3.360 . 0 0 "[ . 1 . 2]" 1 1126 1 52 PRO HA 1 55 ARG H 0.000 . 4.200 3.925 3.874 3.987 . 0 0 "[ . 1 . 2]" 1 1127 1 52 PRO HA 1 56 SER H 0.000 . 5.500 4.941 4.851 5.027 . 0 0 "[ . 1 . 2]" 1 1128 1 56 SER H 1 59 ILE HB 0.000 . 5.500 5.125 5.003 5.204 . 0 0 "[ . 1 . 2]" 1 1129 1 54 GLY QA 1 56 SER H 0.000 . 6.300 4.102 4.050 4.144 . 0 0 "[ . 1 . 2]" 1 1130 1 56 SER HA 1 59 ILE HB 0.000 . 3.200 2.743 2.563 2.877 . 0 0 "[ . 1 . 2]" 1 1131 1 56 SER H 1 59 ILE MD 0.000 . 6.300 3.692 3.576 3.824 . 0 0 "[ . 1 . 2]" 1 1132 1 53 GLU HA 1 56 SER H 0.000 . 3.200 2.979 2.869 3.094 . 0 0 "[ . 1 . 2]" 1 1133 1 56 SER HA 1 59 ILE QG 0.000 . 6.300 3.937 3.769 4.085 . 0 0 "[ . 1 . 2]" 1 1134 1 56 SER HA 1 59 ILE MD 0.000 . 5.000 2.364 2.195 2.621 . 0 0 "[ . 1 . 2]" 1 1135 1 54 GLY QA 1 57 ILE H 0.000 . 5.000 3.645 3.567 3.718 . 0 0 "[ . 1 . 2]" 1 1136 1 57 ILE HA 1 60 LEU HB2 0.000 . 4.200 2.744 2.633 2.819 . 0 0 "[ . 1 . 2]" 1 1137 1 57 ILE HA 1 60 LEU HB3 0.000 . 3.200 2.286 2.215 2.335 . 0 0 "[ . 1 . 2]" 1 1138 1 58 VAL HA 1 61 ALA MB 0.000 . 3.500 2.944 2.932 2.951 . 0 0 "[ . 1 . 2]" 1 1139 1 55 ARG HA 1 58 VAL H 0.000 . 4.200 3.570 3.524 3.605 . 0 0 "[ . 1 . 2]" 1 1140 1 56 SER HA 1 59 ILE H 0.000 . 5.500 3.712 3.604 3.784 . 0 0 "[ . 1 . 2]" 1 1141 1 59 ILE HA 1 62 LYS QB 0.000 . 4.000 2.906 2.757 3.045 . 0 0 "[ . 1 . 2]" 1 1142 1 57 ILE HA 1 59 ILE H 0.000 . 5.500 4.273 4.192 4.339 . 0 0 "[ . 1 . 2]" 1 1143 1 60 LEU HA 1 63 GLN HB3 0.000 . 5.500 4.412 4.165 4.587 . 0 0 "[ . 1 . 2]" 1 1144 1 60 LEU H 1 62 LYS QE 0.000 . 6.300 5.436 4.953 5.646 . 0 0 "[ . 1 . 2]" 1 1145 1 57 ILE HA 1 60 LEU H 0.000 . 4.200 3.111 3.028 3.179 . 0 0 "[ . 1 . 2]" 1 1146 1 56 SER HA 1 60 LEU H 0.000 . 5.500 4.172 4.123 4.219 . 0 0 "[ . 1 . 2]" 1 1147 1 57 ILE HA 1 61 ALA H 0.000 . 5.500 4.287 4.236 4.332 . 0 0 "[ . 1 . 2]" 1 1148 1 59 ILE HA 1 61 ALA H 0.000 . 5.500 4.282 4.249 4.308 . 0 0 "[ . 1 . 2]" 1 1149 1 58 VAL HA 1 61 ALA H 0.000 . 5.500 3.575 3.552 3.590 . 0 0 "[ . 1 . 2]" 1 1150 1 62 LYS HA 1 66 ASN HA 0.000 . 5.500 4.199 4.152 4.222 . 0 0 "[ . 1 . 2]" 1 1151 1 58 VAL MG1 1 62 LYS H 0.000 . 6.300 4.674 4.598 4.786 . 0 0 "[ . 1 . 2]" 1 1152 1 59 ILE HA 1 62 LYS H 0.000 . 4.200 3.321 3.259 3.400 . 0 0 "[ . 1 . 2]" 1 1153 1 59 ILE MG 1 62 LYS H 0.000 . 6.300 4.439 4.363 4.488 . 0 0 "[ . 1 . 2]" 1 1154 1 59 ILE HA 1 63 GLN H 0.000 . 5.500 3.825 3.652 3.964 . 0 0 "[ . 1 . 2]" 1 1155 1 59 ILE MG 1 63 GLN H 0.000 . 6.300 3.433 3.285 3.620 . 0 0 "[ . 1 . 2]" 1 1156 1 62 LYS HA 1 64 ARG H 0.000 . 5.500 4.799 4.765 4.836 . 0 0 "[ . 1 . 2]" 1 1157 1 64 ARG H 1 66 ASN H 3.200 3.200 5.500 4.241 4.169 4.268 . 0 0 "[ . 1 . 2]" 1 1158 1 60 LEU MD1 1 64 ARG H 0.000 . 6.300 4.894 4.760 5.173 . 0 0 "[ . 1 . 2]" 1 1159 1 62 LYS H 1 64 ARG H 3.200 3.200 5.500 4.265 4.204 4.331 . 0 0 "[ . 1 . 2]" 1 1160 1 62 LYS QB 1 64 ARG H 0.000 . 6.300 4.626 4.580 4.662 . 0 0 "[ . 1 . 2]" 1 1161 1 61 ALA HA 1 64 ARG H 0.000 . 4.200 4.256 4.204 4.295 0.095 2 0 "[ . 1 . 2]" 1 1162 1 60 LEU MD2 1 64 ARG H 0.000 . 6.300 5.269 5.252 5.286 . 0 0 "[ . 1 . 2]" 1 1163 1 65 PHE H 1 67 LEU H 3.200 3.200 5.500 5.426 5.259 5.524 0.024 2 0 "[ . 1 . 2]" 1 1164 1 61 ALA HA 1 65 PHE H 0.000 . 5.500 3.692 3.627 3.755 . 0 0 "[ . 1 . 2]" 1 1165 1 63 GLN H 1 65 PHE H 3.200 3.200 5.500 4.469 4.393 4.524 . 0 0 "[ . 1 . 2]" 1 1166 1 62 LYS HA 1 65 PHE H 0.000 . 4.200 4.351 4.331 4.370 0.170 20 0 "[ . 1 . 2]" 1 1167 1 63 GLN HA 1 66 ASN H 0.000 . 5.500 5.492 5.415 5.517 0.017 17 0 "[ . 1 . 2]" 1 1168 1 62 LYS HA 1 66 ASN H 0.000 . 4.200 3.184 3.133 3.225 . 0 0 "[ . 1 . 2]" 1 1169 1 64 ARG HA 1 66 ASN H 0.000 . 5.500 5.505 5.457 5.522 0.022 13 0 "[ . 1 . 2]" 1 1170 1 71 ASP H 1 74 SER QB 0.000 . 6.300 5.595 5.420 5.627 . 0 0 "[ . 1 . 2]" 1 1171 1 72 VAL H 1 74 SER H 3.200 3.200 5.500 4.015 3.954 4.090 . 0 0 "[ . 1 . 2]" 1 1172 1 72 VAL HA 1 75 LEU HB3 0.000 . 5.500 4.696 4.558 4.956 . 0 0 "[ . 1 . 2]" 1 1173 1 72 VAL HA 1 75 LEU QD 0.000 . 5.700 3.971 3.441 4.133 . 0 0 "[ . 1 . 2]" 1 1174 1 72 VAL HA 1 75 LEU HB2 0.000 . 3.200 3.006 2.902 3.219 0.019 1 0 "[ . 1 . 2]" 1 1175 1 73 GLN H 1 75 LEU H 3.200 3.200 5.500 4.063 3.994 4.202 . 0 0 "[ . 1 . 2]" 1 1176 1 71 ASP QB 1 73 GLN H 0.000 . 6.300 5.156 4.929 5.309 . 0 0 "[ . 1 . 2]" 1 1177 1 71 ASP HA 1 73 GLN H 0.000 . 4.200 3.925 3.731 4.076 . 0 0 "[ . 1 . 2]" 1 1178 1 73 GLN HA 1 76 HIS HA 0.000 . 5.500 3.624 3.412 3.837 . 0 0 "[ . 1 . 2]" 1 1179 1 72 VAL HB 1 74 SER H 0.000 . 5.500 4.754 4.673 4.808 . 0 0 "[ . 1 . 2]" 1 1180 1 71 ASP QB 1 74 SER HB3 0.000 . 5.000 3.636 3.141 3.791 . 0 0 "[ . 1 . 2]" 1 1181 1 71 ASP QB 1 74 SER H 0.000 . 5.000 4.050 3.631 4.237 . 0 0 "[ . 1 . 2]" 1 1182 1 71 ASP QB 1 74 SER HB2 0.000 . 5.000 3.132 2.684 3.420 . 0 0 "[ . 1 . 2]" 1 1183 1 72 VAL HA 1 74 SER H 0.000 . 5.500 4.267 4.089 4.343 . 0 0 "[ . 1 . 2]" 1 1184 1 74 SER H 1 76 HIS H 3.200 3.200 5.500 3.618 3.551 3.687 . 0 0 "[ . 1 . 2]" 1 1185 1 71 ASP HA 1 74 SER H 0.000 . 5.500 3.509 3.406 3.641 . 0 0 "[ . 1 . 2]" 1 1186 1 72 VAL MG1 1 74 SER H 0.000 . 6.300 4.865 4.696 4.990 . 0 0 "[ . 1 . 2]" 1 1187 1 72 VAL MG2 1 74 SER H 0.000 . 6.300 5.196 5.139 5.259 . 0 0 "[ . 1 . 2]" 1 1188 1 72 VAL HA 1 75 LEU H 0.000 . 4.200 3.513 3.457 3.556 . 0 0 "[ . 1 . 2]" 1 1189 1 73 GLN HA 1 75 LEU H 0.000 . 4.200 4.285 4.267 4.304 0.104 18 0 "[ . 1 . 2]" 1 1190 1 75 LEU H 1 77 ALA MB 0.000 . 6.300 4.245 4.116 4.286 . 0 0 "[ . 1 . 2]" 1 1191 1 75 LEU H 1 77 ALA H 3.200 3.200 5.500 3.859 3.729 3.918 . 0 0 "[ . 1 . 2]" 1 1192 1 71 ASP QB 1 75 LEU H 0.000 . 6.300 3.927 3.649 4.414 . 0 0 "[ . 1 . 2]" 1 1193 1 72 VAL MG1 1 76 HIS HA 0.000 . 6.300 3.688 3.504 3.813 . 0 0 "[ . 1 . 2]" 1 1194 1 73 GLN HA 1 77 ALA H 0.000 . 5.500 4.198 3.975 4.325 . 0 0 "[ . 1 . 2]" 1 1195 1 75 LEU QD 1 77 ALA H 0.000 . 7.000 4.837 4.524 5.038 . 0 0 "[ . 1 . 2]" 1 1196 1 75 LEU QB 1 77 ALA H 0.000 . 4.000 3.373 3.257 3.561 . 0 0 "[ . 1 . 2]" 1 1197 1 84 ALA HA 1 87 ARG QD 0.000 . 6.300 5.099 4.787 5.198 . 0 0 "[ . 1 . 2]" 1 1198 1 84 ALA HA 1 87 ARG HA 0.000 . 5.500 2.754 2.707 2.841 . 0 0 "[ . 1 . 2]" 1 1199 1 82 PHE HE1 1 84 ALA HA 0.000 . 4.200 2.563 2.369 2.705 . 0 0 "[ . 1 . 2]" 1 1200 1 82 PHE HD1 1 84 ALA HA 0.000 . 4.200 4.227 4.110 4.257 0.057 11 0 "[ . 1 . 2]" 1 1201 1 83 THR HA 1 85 GLN H 0.000 . 4.200 3.825 3.765 3.940 . 0 0 "[ . 1 . 2]" 1 1202 1 83 THR HB 1 85 GLN H 0.000 . 2.700 2.690 2.605 2.707 0.007 17 0 "[ . 1 . 2]" 1 1203 1 83 THR MG 1 85 GLN H 0.000 . 5.000 4.180 4.170 4.190 . 0 0 "[ . 1 . 2]" 1 1204 1 86 SER QB 1 88 MET ME 0.000 . 4.800 2.810 2.409 3.569 . 0 0 "[ . 1 . 2]" 1 1205 1 84 ALA HA 1 86 SER H 0.000 . 5.500 3.910 3.691 4.384 . 0 0 "[ . 1 . 2]" 1 1206 1 83 THR MG 1 86 SER H 0.000 . 6.300 4.898 4.521 5.109 . 0 0 "[ . 1 . 2]" 1 1207 1 86 SER QB 1 88 MET QG 0.000 . 4.800 1.901 1.775 2.136 . 0 0 "[ . 1 . 2]" 1 1208 1 84 ALA MB 1 86 SER H 0.000 . 6.300 4.601 4.530 4.793 . 0 0 "[ . 1 . 2]" 1 1209 1 83 THR HB 1 86 SER H 0.000 . 5.500 4.188 3.109 4.678 . 0 0 "[ . 1 . 2]" 1 1210 1 84 ALA HA 1 87 ARG H 0.000 . 5.500 2.739 2.583 3.030 . 0 0 "[ . 1 . 2]" 1 1211 1 83 THR H 1 87 ARG H 0.000 . 5.500 4.713 4.480 4.843 . 0 0 "[ . 1 . 2]" 1 1212 1 85 GLN QB 1 87 ARG H 0.000 . 6.300 4.221 4.134 4.267 . 0 0 "[ . 1 . 2]" 1 1213 1 86 SER QB 1 88 MET H 0.000 . 5.000 3.669 3.047 4.343 . 0 0 "[ . 1 . 2]" 1 1214 1 86 SER HA 1 88 MET H 0.000 . 5.500 5.047 4.939 5.129 . 0 0 "[ . 1 . 2]" 1 1215 1 91 ILE HG12 1 93 ILE HB 0.000 . 4.200 3.998 3.483 4.145 . 0 0 "[ . 1 . 2]" 1 1216 1 91 ILE MD 1 93 ILE HB 0.000 . 5.000 3.806 2.930 4.079 . 0 0 "[ . 1 . 2]" 1 1217 1 93 ILE H 1 97 MET HA 0.000 . 4.200 3.005 2.962 3.057 . 0 0 "[ . 1 . 2]" 1 1218 1 91 ILE QG 1 93 ILE HA 0.000 . 6.300 4.865 4.456 5.003 . 0 0 "[ . 1 . 2]" 1 1219 1 93 ILE H 1 97 MET QB 0.000 . 6.300 4.575 4.523 4.642 . 0 0 "[ . 1 . 2]" 1 1220 1 93 ILE MG 1 96 ARG HB2 0.000 . 4.000 1.773 1.742 1.823 . 0 0 "[ . 1 . 2]" 1 1221 1 93 ILE MG 1 95 ASN QB 0.000 . 4.800 3.478 3.351 3.575 . 0 0 "[ . 1 . 2]" 1 1222 1 93 ILE H 1 96 ARG HB2 0.000 . 4.200 3.928 3.809 4.002 . 0 0 "[ . 1 . 2]" 1 1223 1 93 ILE H 1 97 MET QG 0.000 . 6.300 2.894 2.830 2.989 . 0 0 "[ . 1 . 2]" 1 1224 1 93 ILE HG12 1 95 ASN QB 0.000 . 3.500 3.157 3.134 3.180 . 0 0 "[ . 1 . 2]" 1 1225 1 96 ARG HE 1 98 ILE MD 0.000 . 5.000 2.549 1.856 3.119 . 0 0 "[ . 1 . 2]" 1 1226 1 92 ASN HA 1 96 ARG H 0.000 . 5.500 5.375 5.331 5.416 . 0 0 "[ . 1 . 2]" 1 1227 1 93 ILE MG 1 96 ARG HD2 0.000 . 5.000 4.074 3.723 4.173 . 0 0 "[ . 1 . 2]" 1 1228 1 94 ASP HB3 1 96 ARG H 0.000 . 5.500 5.020 5.010 5.042 . 0 0 "[ . 1 . 2]" 1 1229 1 93 ILE QG 1 96 ARG H 0.000 . 6.300 2.807 2.741 2.883 . 0 0 "[ . 1 . 2]" 1 1230 1 94 ASP HB2 1 96 ARG H 0.000 . 4.200 4.311 4.295 4.330 0.130 11 0 "[ . 1 . 2]" 1 1231 1 94 ASP H 1 96 ARG H 3.200 3.200 5.500 4.326 4.295 4.369 . 0 0 "[ . 1 . 2]" 1 1232 1 93 ILE HB 1 96 ARG H 0.000 . 5.500 4.522 4.484 4.556 . 0 0 "[ . 1 . 2]" 1 1233 1 93 ILE H 1 96 ARG H 0.000 . 3.200 3.337 3.310 3.361 0.161 11 0 "[ . 1 . 2]" 1 1234 1 93 ILE MG 1 96 ARG HD3 0.000 . 5.000 2.659 2.309 2.785 . 0 0 "[ . 1 . 2]" 1 1235 1 93 ILE MG 1 96 ARG H 0.000 . 5.000 1.832 1.823 1.840 . 0 0 "[ . 1 . 2]" 1 1236 1 96 ARG QB 1 98 ILE MD 0.000 . 4.800 3.017 2.527 3.176 . 0 0 "[ . 1 . 2]" 1 1237 1 98 ILE MG 1 100 LYS H 0.000 . 6.300 4.662 4.569 4.735 . 0 0 "[ . 1 . 2]" 1 1238 1 101 GLY HA2 1 105 ALA MB 0.000 . 5.000 3.865 3.779 4.142 . 0 0 "[ . 1 . 2]" 1 1239 1 101 GLY HA3 1 105 ALA MB 0.000 . 5.000 2.735 2.669 2.995 . 0 0 "[ . 1 . 2]" 1 1240 1 102 SER H 1 105 ALA MB 0.000 . 4.000 2.703 2.554 2.900 . 0 0 "[ . 1 . 2]" 1 1241 1 102 SER H 1 106 ILE MD 0.000 . 6.300 4.136 4.042 4.229 . 0 0 "[ . 1 . 2]" 1 1242 1 102 SER H 1 105 ALA H 0.000 . 5.500 3.973 3.891 4.135 . 0 0 "[ . 1 . 2]" 1 1243 1 102 SER H 1 106 ILE QG 0.000 . 5.000 3.433 3.379 3.493 . 0 0 "[ . 1 . 2]" 1 1244 1 103 VAL MG1 1 107 ARG QD 0.000 . 5.800 3.163 2.908 3.363 . 0 0 "[ . 1 . 2]" 1 1245 1 103 VAL MG1 1 107 ARG QG 0.000 . 5.800 4.307 4.241 4.322 . 0 0 "[ . 1 . 2]" 1 1246 1 103 VAL MG1 1 107 ARG HB2 0.000 . 5.000 2.894 2.846 2.953 . 0 0 "[ . 1 . 2]" 1 1247 1 103 VAL MG1 1 107 ARG HB3 0.000 . 5.000 3.406 3.315 3.532 . 0 0 "[ . 1 . 2]" 1 1248 1 103 VAL H 1 105 ALA H 3.200 3.200 5.500 4.393 4.342 4.440 . 0 0 "[ . 1 . 2]" 1 1249 1 103 VAL HA 1 106 ILE HB 0.000 . 2.700 2.715 2.682 2.751 0.051 3 0 "[ . 1 . 2]" 1 1250 1 104 ASP HA 1 107 ARG QG 0.000 . 6.300 4.146 4.043 4.289 . 0 0 "[ . 1 . 2]" 1 1251 1 102 SER QB 1 104 ASP H 0.000 . 4.000 2.937 2.838 3.295 . 0 0 "[ . 1 . 2]" 1 1252 1 102 SER HA 1 104 ASP H 0.000 . 4.200 4.209 4.189 4.234 0.034 3 0 "[ . 1 . 2]" 1 1253 1 104 ASP HA 1 107 ARG HB3 0.000 . 3.200 2.906 2.846 3.019 . 0 0 "[ . 1 . 2]" 1 1254 1 104 ASP H 1 106 ILE H 0.000 . 5.500 4.333 4.279 4.391 . 0 0 "[ . 1 . 2]" 1 1255 1 104 ASP HA 1 107 ARG HB2 0.000 . 4.200 4.205 4.167 4.220 0.020 9 0 "[ . 1 . 2]" 1 1256 1 104 ASP HA 1 107 ARG QD 0.000 . 6.300 4.582 3.494 5.064 . 0 0 "[ . 1 . 2]" 1 1257 1 103 VAL HB 1 105 ALA H 0.000 . 5.500 5.183 5.138 5.230 . 0 0 "[ . 1 . 2]" 1 1258 1 103 VAL HA 1 105 ALA H 0.000 . 5.500 4.526 4.451 4.566 . 0 0 "[ . 1 . 2]" 1 1259 1 105 ALA HA 1 108 ARG QB 0.000 . 3.500 2.942 2.878 3.037 . 0 0 "[ . 1 . 2]" 1 1260 1 105 ALA H 1 108 ARG QD 0.000 . 6.300 4.232 4.042 4.470 . 0 0 "[ . 1 . 2]" 1 1261 1 105 ALA HA 1 108 ARG QD 0.000 . 4.000 2.368 2.218 2.505 . 0 0 "[ . 1 . 2]" 1 1262 1 105 ALA H 1 107 ARG QB 0.000 . 6.300 4.740 4.623 4.852 . 0 0 "[ . 1 . 2]" 1 1263 1 103 VAL MG1 1 105 ALA H 0.000 . 6.300 5.002 4.906 5.078 . 0 0 "[ . 1 . 2]" 1 1264 1 105 ALA H 1 107 ARG H 0.000 . 5.500 4.205 4.124 4.257 . 0 0 "[ . 1 . 2]" 1 1265 1 102 SER QB 1 105 ALA H 0.000 . 5.000 2.581 2.359 3.526 . 0 0 "[ . 1 . 2]" 1 1266 1 102 SER HA 1 105 ALA H 0.000 . 5.500 4.592 4.527 4.659 . 0 0 "[ . 1 . 2]" 1 1267 1 105 ALA HA 1 108 ARG QG 0.000 . 5.000 3.870 3.744 3.933 . 0 0 "[ . 1 . 2]" 1 1268 1 106 ILE HA 1 109 HIS HB2 0.000 . 3.200 3.213 3.204 3.222 0.022 16 0 "[ . 1 . 2]" 1 1269 1 104 ASP QB 1 106 ILE H 0.000 . 6.300 4.780 4.743 4.815 . 0 0 "[ . 1 . 2]" 1 1270 1 102 SER H 1 106 ILE H 0.000 . 5.500 4.092 4.005 4.148 . 0 0 "[ . 1 . 2]" 1 1271 1 104 ASP HA 1 106 ILE H 0.000 . 5.500 4.924 4.835 5.030 . 0 0 "[ . 1 . 2]" 1 1272 1 106 ILE HA 1 110 VAL MG2 0.000 . 6.300 4.002 3.931 4.083 . 0 0 "[ . 1 . 2]" 1 1273 1 106 ILE HA 1 109 HIS HB3 0.000 . 2.700 2.086 2.038 2.116 . 0 0 "[ . 1 . 2]" 1 1274 1 102 SER QB 1 106 ILE H 0.000 . 6.300 4.145 3.965 4.850 . 0 0 "[ . 1 . 2]" 1 1275 1 103 VAL HA 1 106 ILE H 0.000 . 4.200 3.646 3.591 3.704 . 0 0 "[ . 1 . 2]" 1 1276 1 103 VAL MG1 1 107 ARG HE 0.000 . 6.300 3.988 2.662 5.279 . 0 0 "[ . 1 . 2]" 1 1277 1 104 ASP HA 1 107 ARG H 0.000 . 4.200 4.020 3.970 4.067 . 0 0 "[ . 1 . 2]" 1 1278 1 107 ARG HA 1 110 VAL MG2 0.000 . 4.000 2.978 2.881 3.029 . 0 0 "[ . 1 . 2]" 1 1279 1 103 VAL HA 1 107 ARG H 0.000 . 5.500 3.419 3.390 3.468 . 0 0 "[ . 1 . 2]" 1 1280 1 104 ASP QB 1 107 ARG H 0.000 . 6.300 5.223 5.178 5.251 . 0 0 "[ . 1 . 2]" 1 1281 1 107 ARG HA 1 110 VAL HB 0.000 . 3.200 2.806 2.763 2.848 . 0 0 "[ . 1 . 2]" 1 1282 1 103 VAL MG1 1 107 ARG H 0.000 . 6.300 3.811 3.772 3.847 . 0 0 "[ . 1 . 2]" 1 1283 1 105 ALA MB 1 108 ARG H 0.000 . 6.300 4.790 4.723 4.848 . 0 0 "[ . 1 . 2]" 1 1284 1 108 ARG HA 1 111 GLU QB 0.000 . 4.000 2.989 2.913 3.044 . 0 0 "[ . 1 . 2]" 1 1285 1 105 ALA HA 1 108 ARG H 0.000 . 4.200 3.817 3.707 3.895 . 0 0 "[ . 1 . 2]" 1 1286 1 108 ARG H 1 110 VAL H 3.200 3.200 5.500 4.193 4.161 4.223 . 0 0 "[ . 1 . 2]" 1 1287 1 104 ASP QB 1 108 ARG H 0.000 . 6.300 5.283 5.025 5.481 . 0 0 "[ . 1 . 2]" 1 1288 1 104 ASP HA 1 108 ARG H 0.000 . 4.200 4.090 4.003 4.189 . 0 0 "[ . 1 . 2]" 1 1289 1 106 ILE HA 1 108 ARG H 0.000 . 5.500 4.495 4.471 4.531 . 0 0 "[ . 1 . 2]" 1 1290 1 106 ILE MG 1 109 HIS HB3 0.000 . 6.300 3.152 3.103 3.209 . 0 0 "[ . 1 . 2]" 1 1291 1 106 ILE MD 1 109 HIS HB3 0.000 . 6.300 3.208 3.139 3.256 . 0 0 "[ . 1 . 2]" 1 1292 1 109 HIS HA 1 112 ALA MB 0.000 . 3.500 2.507 2.471 2.527 . 0 0 "[ . 1 . 2]" 1 1293 1 106 ILE MG 1 109 HIS H 0.000 . 5.000 4.241 4.237 4.245 . 0 0 "[ . 1 . 2]" 1 1294 1 106 ILE HA 1 109 HIS H 0.000 . 3.200 3.211 3.195 3.225 0.025 8 0 "[ . 1 . 2]" 1 1295 1 109 HIS H 1 112 ALA MB 0.000 . 6.300 4.480 4.464 4.490 . 0 0 "[ . 1 . 2]" 1 1296 1 105 ALA HA 1 109 HIS H 0.000 . 4.200 4.317 4.308 4.328 0.128 18 0 "[ . 1 . 2]" 1 1297 1 109 HIS H 1 111 GLU H 3.200 3.200 5.500 4.411 4.380 4.461 . 0 0 "[ . 1 . 2]" 1 1298 1 107 ARG H 1 109 HIS H 3.200 3.200 5.500 3.895 3.869 3.911 . 0 0 "[ . 1 . 2]" 1 1299 1 106 ILE MD 1 109 HIS HB2 0.000 . 6.300 3.830 3.731 3.886 . 0 0 "[ . 1 . 2]" 1 1300 1 106 ILE MG 1 109 HIS HB2 0.000 . 6.300 4.571 4.521 4.629 . 0 0 "[ . 1 . 2]" 1 1301 1 106 ILE MD 1 109 HIS H 0.000 . 6.300 4.532 4.464 4.578 . 0 0 "[ . 1 . 2]" 1 1302 1 106 ILE MG 1 110 VAL H 0.000 . 6.300 3.683 3.598 3.737 . 0 0 "[ . 1 . 2]" 1 1303 1 107 ARG HA 1 110 VAL H 0.000 . 3.200 3.274 3.254 3.297 0.097 8 0 "[ . 1 . 2]" 1 1304 1 110 VAL H 1 112 ALA H 3.200 3.200 5.500 3.948 3.922 3.970 . 0 0 "[ . 1 . 2]" 1 1305 1 110 VAL HA 1 113 ASN HB2 0.000 . 3.200 2.506 2.497 2.522 . 0 0 "[ . 1 . 2]" 1 1306 1 108 ARG HA 1 110 VAL H 0.000 . 5.500 4.430 4.374 4.466 . 0 0 "[ . 1 . 2]" 1 1307 1 106 ILE HA 1 110 VAL H 0.000 . 4.200 4.151 4.092 4.196 . 0 0 "[ . 1 . 2]" 1 1308 1 110 VAL HA 1 113 ASN HB3 0.000 . 4.200 3.952 3.943 3.963 . 0 0 "[ . 1 . 2]" 1 1309 1 111 GLU H 1 113 ASN H 3.200 3.200 5.500 4.137 4.127 4.146 . 0 0 "[ . 1 . 2]" 1 1310 1 107 ARG HA 1 111 GLU H 0.000 . 4.200 4.208 4.178 4.235 0.035 3 0 "[ . 1 . 2]" 1 1311 1 108 ARG HA 1 111 GLU H 0.000 . 4.200 3.742 3.681 3.808 . 0 0 "[ . 1 . 2]" 1 1312 1 109 HIS HB2 1 112 ALA H 0.000 . 5.500 5.616 5.607 5.630 0.130 16 0 "[ . 1 . 2]" 1 1313 1 112 ALA H 1 114 GLY H 3.200 3.200 5.500 3.769 3.749 3.799 . 0 0 "[ . 1 . 2]" 1 1314 1 108 ARG HA 1 112 ALA H 0.000 . 4.200 4.162 4.134 4.197 . 0 0 "[ . 1 . 2]" 1 1315 1 110 VAL HA 1 112 ALA H 0.000 . 5.500 4.332 4.325 4.340 . 0 0 "[ . 1 . 2]" 1 1316 1 110 VAL MG1 1 112 ALA H 0.000 . 6.300 4.814 4.773 4.845 . 0 0 "[ . 1 . 2]" 1 1317 1 110 VAL MG2 1 112 ALA H 0.000 . 6.300 5.264 5.258 5.268 . 0 0 "[ . 1 . 2]" 1 1318 1 108 ARG QB 1 112 ALA H 0.000 . 6.300 4.820 4.787 4.847 . 0 0 "[ . 1 . 2]" 1 1319 1 109 HIS HA 1 112 ALA H 0.000 . 4.200 3.427 3.408 3.443 . 0 0 "[ . 1 . 2]" 1 1320 1 110 VAL MG2 1 113 ASN HB3 0.000 . 6.300 5.280 5.276 5.284 . 0 0 "[ . 1 . 2]" 1 1321 1 110 VAL MG2 1 113 ASN HB2 0.000 . 6.300 4.289 4.284 4.295 . 0 0 "[ . 1 . 2]" 1 1322 1 110 VAL HA 1 113 ASN HD21 0.000 . 5.500 2.964 2.634 3.207 . 0 0 "[ . 1 . 2]" 1 1323 1 111 GLU HA 1 113 ASN H 0.000 . 4.200 4.283 4.270 4.288 0.088 14 0 "[ . 1 . 2]" 1 1324 1 113 ASN H 1 115 GLY H 3.200 3.200 8.200 3.506 3.474 3.534 . 0 0 "[ . 1 . 2]" 1 1325 1 110 VAL HA 1 113 ASN H 0.000 . 4.200 3.439 3.424 3.460 . 0 0 "[ . 1 . 2]" 1 1326 1 109 HIS HA 1 113 ASN HD22 0.000 . 4.200 4.218 4.207 4.228 0.028 20 0 "[ . 1 . 2]" 1 1327 1 110 VAL MG2 1 113 ASN H 0.000 . 6.300 5.084 5.072 5.096 . 0 0 "[ . 1 . 2]" 1 1328 1 110 VAL MG1 1 113 ASN H 0.000 . 6.300 4.600 4.538 4.637 . 0 0 "[ . 1 . 2]" 1 1329 1 113 ASN H 1 115 GLY QA 0.000 . 6.300 5.167 5.112 5.230 . 0 0 "[ . 1 . 2]" 1 1330 1 110 VAL HA 1 113 ASN HD22 0.000 . 5.500 4.198 4.045 4.292 . 0 0 "[ . 1 . 2]" 1 1331 1 111 GLU QG 1 113 ASN H 0.000 . 6.300 5.498 5.481 5.633 . 0 0 "[ . 1 . 2]" 1 1332 1 109 HIS HA 1 113 ASN H 0.000 . 4.200 4.043 4.015 4.059 . 0 0 "[ . 1 . 2]" 1 1333 1 111 GLU QB 1 113 ASN H 0.000 . 6.300 4.662 4.654 4.673 . 0 0 "[ . 1 . 2]" 1 1334 1 109 HIS HA 1 113 ASN HD21 0.000 . 4.200 3.403 3.346 3.531 . 0 0 "[ . 1 . 2]" 1 1335 1 111 GLU HA 1 114 GLY H 0.000 . 4.200 3.224 3.195 3.273 . 0 0 "[ . 1 . 2]" 1 1336 1 110 VAL HA 1 114 GLY H 0.000 . 5.500 4.565 4.546 4.587 . 0 0 "[ . 1 . 2]" 1 1337 1 112 ALA HA 1 114 GLY H 0.000 . 4.200 3.822 3.812 3.830 . 0 0 "[ . 1 . 2]" 1 1338 1 110 VAL MG1 1 114 GLY H 0.000 . 6.300 4.474 4.420 4.513 . 0 0 "[ . 1 . 2]" 1 1339 1 112 ALA MB 1 114 GLY H 0.000 . 5.000 4.185 4.179 4.200 . 0 0 "[ . 1 . 2]" 1 1340 1 113 ASN HB2 1 115 GLY H 0.000 . 4.200 2.732 2.685 2.810 . 0 0 "[ . 1 . 2]" 1 1341 1 112 ALA HA 1 115 GLY H 0.000 . 5.500 5.620 5.611 5.629 0.129 12 0 "[ . 1 . 2]" 1 1342 1 111 GLU QG 1 115 GLY H 0.000 . 6.300 4.888 4.829 5.275 . 0 0 "[ . 1 . 2]" 1 1343 1 111 GLU QB 1 115 GLY H 0.000 . 6.300 5.031 5.001 5.077 . 0 0 "[ . 1 . 2]" 1 1344 1 111 GLU HA 1 115 GLY QA 0.000 . 5.000 4.504 4.469 4.516 . 0 0 "[ . 1 . 2]" 1 1345 1 111 GLU HA 1 115 GLY H 0.000 . 3.200 3.159 3.125 3.202 0.002 16 0 "[ . 1 . 2]" 1 1346 1 113 ASN HB3 1 115 GLY H 0.000 . 3.200 3.251 3.242 3.257 0.057 8 0 "[ . 1 . 2]" 1 1347 1 113 ASN HA 1 115 GLY H 0.000 . 5.500 4.538 4.511 4.556 . 0 0 "[ . 1 . 2]" 1 1348 1 118 PRO HB3 1 121 VAL MG2 0.000 . 4.000 3.307 3.253 3.334 . 0 0 "[ . 1 . 2]" 1 1349 1 118 PRO HB2 1 121 VAL MG2 0.000 . 4.000 2.230 2.190 2.262 . 0 0 "[ . 1 . 2]" 1 1350 1 119 THR H 1 121 VAL H 3.200 3.200 5.500 4.137 4.108 4.162 . 0 0 "[ . 1 . 2]" 1 1351 1 119 THR HA 1 122 ASP HB3 0.000 . 4.200 3.185 2.265 3.811 . 0 0 "[ . 1 . 2]" 1 1352 1 119 THR HA 1 122 ASP HB2 0.000 . 4.200 2.520 2.142 3.108 . 0 0 "[ . 1 . 2]" 1 1353 1 118 PRO HB2 1 120 ASP H 0.000 . 4.200 3.390 3.345 3.429 . 0 0 "[ . 1 . 2]" 1 1354 1 118 PRO HA 1 120 ASP H 0.000 . 4.200 3.941 3.887 4.021 . 0 0 "[ . 1 . 2]" 1 1355 1 120 ASP H 1 122 ASP H 3.200 3.200 5.500 4.172 4.089 4.225 . 0 0 "[ . 1 . 2]" 1 1356 1 120 ASP HA 1 123 GLN QB 0.000 . 3.000 2.693 2.677 2.710 . 0 0 "[ . 1 . 2]" 1 1357 1 120 ASP HA 1 123 GLN QG 0.000 . 4.000 3.272 3.031 3.574 . 0 0 "[ . 1 . 2]" 1 1358 1 118 PRO HB3 1 120 ASP H 0.000 . 4.200 4.144 4.119 4.182 . 0 0 "[ . 1 . 2]" 1 1359 1 119 THR HA 1 121 VAL H 0.000 . 4.200 4.046 4.026 4.088 . 0 0 "[ . 1 . 2]" 1 1360 1 118 PRO HB2 1 121 VAL H 0.000 . 3.200 2.316 2.277 2.350 . 0 0 "[ . 1 . 2]" 1 1361 1 121 VAL HA 1 124 LYS QB 0.000 . 5.000 2.129 2.034 2.237 . 0 0 "[ . 1 . 2]" 1 1362 1 121 VAL HA 1 124 LYS QG 0.000 . 5.000 2.884 2.548 3.018 . 0 0 "[ . 1 . 2]" 1 1363 1 118 PRO QB 1 121 VAL HB 0.000 . 4.000 2.282 2.240 2.332 . 0 0 "[ . 1 . 2]" 1 1364 1 118 PRO HA 1 121 VAL H 0.000 . 5.500 4.439 4.404 4.470 . 0 0 "[ . 1 . 2]" 1 1365 1 118 PRO QG 1 121 VAL MG2 0.000 . 4.800 2.407 2.353 2.476 . 0 0 "[ . 1 . 2]" 1 1366 1 119 THR MG 1 121 VAL H 0.000 . 6.300 4.064 4.013 4.118 . 0 0 "[ . 1 . 2]" 1 1367 1 121 VAL H 1 123 GLN H 3.200 3.200 5.500 3.736 3.696 3.771 . 0 0 "[ . 1 . 2]" 1 1368 1 118 PRO QG 1 121 VAL H 0.000 . 6.300 3.844 3.787 3.889 . 0 0 "[ . 1 . 2]" 1 1369 1 119 THR HB 1 121 VAL H 0.000 . 5.500 5.656 5.644 5.666 0.166 16 0 "[ . 1 . 2]" 1 1370 1 118 PRO QD 1 121 VAL H 0.000 . 5.000 4.493 4.479 4.506 . 0 0 "[ . 1 . 2]" 1 1371 1 118 PRO HB3 1 121 VAL H 0.000 . 4.200 3.955 3.923 3.983 . 0 0 "[ . 1 . 2]" 1 1372 1 119 THR HA 1 122 ASP H 0.000 . 4.200 3.177 3.129 3.203 . 0 0 "[ . 1 . 2]" 1 1373 1 118 PRO HB3 1 122 ASP H 0.000 . 5.500 5.419 5.352 5.473 . 0 0 "[ . 1 . 2]" 1 1374 1 118 PRO QD 1 122 ASP H 0.000 . 6.300 4.092 4.019 4.127 . 0 0 "[ . 1 . 2]" 1 1375 1 119 THR HB 1 122 ASP H 0.000 . 5.500 5.435 5.385 5.463 . 0 0 "[ . 1 . 2]" 1 1376 1 120 ASP HA 1 122 ASP H 0.000 . 5.500 4.785 4.741 4.813 . 0 0 "[ . 1 . 2]" 1 1377 1 122 ASP H 1 124 LYS H 3.200 3.200 5.500 4.208 4.155 4.275 . 0 0 "[ . 1 . 2]" 1 1378 1 119 THR MG 1 122 ASP H 0.000 . 6.300 4.919 4.857 4.977 . 0 0 "[ . 1 . 2]" 1 1379 1 122 ASP HA 1 125 VAL HB 0.000 . 3.200 2.221 2.142 2.314 . 0 0 "[ . 1 . 2]" 1 1380 1 121 VAL MG2 1 123 GLN H 0.000 . 6.300 5.127 5.089 5.161 . 0 0 "[ . 1 . 2]" 1 1381 1 121 VAL HB 1 123 GLN H 0.000 . 5.500 4.836 4.809 4.877 . 0 0 "[ . 1 . 2]" 1 1382 1 123 GLN H 1 125 VAL HB 0.000 . 5.500 4.499 4.424 4.567 . 0 0 "[ . 1 . 2]" 1 1383 1 119 THR HB 1 123 GLN H 0.000 . 5.500 5.659 5.643 5.671 0.171 18 0 "[ . 1 . 2]" 1 1384 1 120 ASP HA 1 123 GLN H 0.000 . 4.200 3.662 3.608 3.717 . 0 0 "[ . 1 . 2]" 1 1385 1 121 VAL HA 1 123 GLN H 0.000 . 4.200 4.086 4.044 4.142 . 0 0 "[ . 1 . 2]" 1 1386 1 123 GLN H 1 125 VAL MG2 0.000 . 6.300 5.172 5.132 5.231 . 0 0 "[ . 1 . 2]" 1 1387 1 121 VAL MG1 1 123 GLN H 0.000 . 6.300 4.722 4.697 4.752 . 0 0 "[ . 1 . 2]" 1 1388 1 123 GLN H 1 125 VAL H 3.200 3.200 5.500 3.936 3.895 3.969 . 0 0 "[ . 1 . 2]" 1 1389 1 119 THR MG 1 123 GLN H 0.000 . 6.300 5.094 5.012 5.124 . 0 0 "[ . 1 . 2]" 1 1390 1 120 ASP HA 1 124 LYS H 0.000 . 4.200 4.233 4.214 4.262 0.062 11 0 "[ . 1 . 2]" 1 1391 1 121 VAL HA 1 124 LYS H 0.000 . 3.200 2.901 2.824 2.976 . 0 0 "[ . 1 . 2]" 1 1392 1 121 VAL MG1 1 124 LYS H 0.000 . 6.300 4.362 4.300 4.432 . 0 0 "[ . 1 . 2]" 1 1393 1 124 LYS HA 1 127 GLN QB 0.000 . 3.500 2.486 2.413 2.522 . 0 0 "[ . 1 . 2]" 1 1394 1 124 LYS HA 1 127 GLN QG 0.000 . 4.000 2.455 2.350 2.723 . 0 0 "[ . 1 . 2]" 1 1395 1 124 LYS H 1 126 ASP H 3.200 3.200 5.500 4.061 4.048 4.072 . 0 0 "[ . 1 . 2]" 1 1396 1 122 ASP QB 1 124 LYS H 0.000 . 6.300 4.839 4.808 4.881 . 0 0 "[ . 1 . 2]" 1 1397 1 121 VAL MG1 1 125 VAL H 0.000 . 5.000 3.772 3.721 3.857 . 0 0 "[ . 1 . 2]" 1 1398 1 125 VAL H 1 127 GLN QB 0.000 . 6.300 4.860 4.816 4.885 . 0 0 "[ . 1 . 2]" 1 1399 1 123 GLN HA 1 125 VAL H 0.000 . 4.200 4.206 4.199 4.211 0.011 11 0 "[ . 1 . 2]" 1 1400 1 125 VAL HA 1 128 VAL HB 0.000 . 3.200 2.779 2.656 2.824 . 0 0 "[ . 1 . 2]" 1 1401 1 125 VAL HA 1 128 VAL MG1 0.000 . 6.300 3.982 3.847 4.033 . 0 0 "[ . 1 . 2]" 1 1402 1 122 ASP HA 1 125 VAL H 0.000 . 4.200 3.275 3.222 3.341 . 0 0 "[ . 1 . 2]" 1 1403 1 125 VAL H 1 127 GLN H 3.200 3.200 5.500 4.000 3.968 4.019 . 0 0 "[ . 1 . 2]" 1 1404 1 125 VAL H 1 128 VAL HB 0.000 . 5.500 5.290 5.192 5.321 . 0 0 "[ . 1 . 2]" 1 1405 1 121 VAL HA 1 125 VAL H 0.000 . 4.200 3.911 3.888 3.953 . 0 0 "[ . 1 . 2]" 1 1406 1 124 LYS HA 1 126 ASP H 0.000 . 4.200 4.178 4.154 4.203 0.003 3 0 "[ . 1 . 2]" 1 1407 1 122 ASP HA 1 126 ASP H 0.000 . 4.200 4.268 4.238 4.301 0.101 7 0 "[ . 1 . 2]" 1 1408 1 123 GLN HA 1 126 ASP HB2 0.000 . 2.700 2.749 2.732 2.759 0.059 20 0 "[ . 1 . 2]" 1 1409 1 126 ASP H 1 129 ALA MB 0.000 . 6.300 4.744 4.727 4.778 . 0 0 "[ . 1 . 2]" 1 1410 1 123 GLN HA 1 126 ASP H 0.000 . 4.200 3.107 3.097 3.117 . 0 0 "[ . 1 . 2]" 1 1411 1 126 ASP HA 1 129 ALA MB 0.000 . 3.000 2.523 2.504 2.530 . 0 0 "[ . 1 . 2]" 1 1412 1 123 GLN HA 1 126 ASP HB3 0.000 . 2.700 2.732 2.721 2.742 0.042 18 0 "[ . 1 . 2]" 1 1413 1 125 VAL HB 1 127 GLN H 0.000 . 5.500 4.929 4.892 4.955 . 0 0 "[ . 1 . 2]" 1 1414 1 127 GLN HA 1 130 ARG QG 0.000 . 5.000 3.715 1.885 4.048 . 0 0 "[ . 1 . 2]" 1 1415 1 123 GLN HA 1 127 GLN H 0.000 . 4.200 4.268 4.250 4.283 0.083 14 0 "[ . 1 . 2]" 1 1416 1 124 LYS HA 1 127 GLN H 0.000 . 4.200 3.138 3.085 3.180 . 0 0 "[ . 1 . 2]" 1 1417 1 127 GLN HA 1 130 ARG QD 0.000 . 4.000 3.087 1.869 3.576 . 0 0 "[ . 1 . 2]" 1 1418 1 127 GLN H 1 130 ARG QD 0.000 . 6.300 5.502 4.431 5.626 . 0 0 "[ . 1 . 2]" 1 1419 1 127 GLN H 1 129 ALA H 3.200 3.200 5.500 4.050 4.020 4.060 . 0 0 "[ . 1 . 2]" 1 1420 1 125 VAL HA 1 127 GLN H 0.000 . 5.500 4.347 4.321 4.374 . 0 0 "[ . 1 . 2]" 1 1421 1 124 LYS QB 1 127 GLN H 0.000 . 6.300 4.661 4.626 4.691 . 0 0 "[ . 1 . 2]" 1 1422 1 127 GLN H 1 130 ARG QB 0.000 . 6.300 4.753 4.616 5.422 . 0 0 "[ . 1 . 2]" 1 1423 1 125 VAL MG1 1 127 GLN H 0.000 . 6.300 4.602 4.586 4.621 . 0 0 "[ . 1 . 2]" 1 1424 1 127 GLN H 1 129 ALA MB 0.000 . 6.300 4.583 4.557 4.621 . 0 0 "[ . 1 . 2]" 1 1425 1 127 GLN HA 1 130 ARG QB 0.000 . 3.500 2.440 2.282 3.133 . 0 0 "[ . 1 . 2]" 1 1426 1 126 ASP QB 1 128 VAL H 0.000 . 6.300 4.692 4.643 4.722 . 0 0 "[ . 1 . 2]" 1 1427 1 128 VAL H 1 130 ARG H 3.200 3.200 5.500 4.131 4.064 4.248 . 0 0 "[ . 1 . 2]" 1 1428 1 128 VAL HA 1 131 GLN QB 0.000 . 4.000 3.104 2.734 3.585 . 0 0 "[ . 1 . 2]" 1 1429 1 124 LYS HA 1 128 VAL H 0.000 . 4.200 4.174 4.127 4.219 0.019 11 0 "[ . 1 . 2]" 1 1430 1 125 VAL HA 1 128 VAL H 0.000 . 4.200 3.451 3.382 3.487 . 0 0 "[ . 1 . 2]" 1 1431 1 126 ASP H 1 128 VAL H 3.200 3.200 5.500 4.103 4.027 4.150 . 0 0 "[ . 1 . 2]" 1 1432 1 126 ASP HA 1 128 VAL H 0.000 . 5.500 4.366 4.298 4.421 . 0 0 "[ . 1 . 2]" 1 1433 1 129 ALA H 1 131 GLN H 3.200 3.200 5.500 4.143 4.054 4.275 . 0 0 "[ . 1 . 2]" 1 1434 1 126 ASP HA 1 129 ALA H 0.000 . 4.200 3.427 3.374 3.469 . 0 0 "[ . 1 . 2]" 1 1435 1 125 VAL HA 1 129 ALA H 0.000 . 5.500 4.446 4.410 4.521 . 0 0 "[ . 1 . 2]" 1 1436 1 127 GLN HA 1 129 ALA H 0.000 . 4.200 4.256 4.213 4.269 0.069 14 0 "[ . 1 . 2]" 1 1437 1 127 GLN HA 1 130 ARG H 0.000 . 4.200 3.271 3.206 3.337 . 0 0 "[ . 1 . 2]" 1 1438 1 130 ARG H 1 132 GLY H 3.200 3.200 5.500 3.832 3.781 3.870 . 0 0 "[ . 1 . 2]" 1 1439 1 128 VAL HA 1 130 ARG H 0.000 . 5.500 4.447 4.342 4.555 . 0 0 "[ . 1 . 2]" 1 1440 1 126 ASP HA 1 130 ARG H 0.000 . 5.500 4.357 4.292 4.420 . 0 0 "[ . 1 . 2]" 1 1441 1 129 ALA HA 1 131 GLN H 0.000 . 5.500 4.316 4.228 4.396 . 0 0 "[ . 1 . 2]" 1 1442 1 128 VAL HA 1 131 GLN H 0.000 . 4.200 3.587 3.529 3.824 . 0 0 "[ . 1 . 2]" 1 1443 1 131 GLN H 1 133 ALA MB 0.000 . 6.300 4.107 3.983 4.200 . 0 0 "[ . 1 . 2]" 1 1444 1 127 GLN HA 1 131 GLN H 0.000 . 5.500 4.287 4.210 4.399 . 0 0 "[ . 1 . 2]" 1 1445 1 130 ARG HA 1 132 GLY H 0.000 . 5.500 3.653 3.570 3.707 . 0 0 "[ . 1 . 2]" 1 1446 1 128 VAL HA 1 132 GLY H 0.000 . 5.500 4.877 4.811 4.956 . 0 0 "[ . 1 . 2]" 1 1447 1 129 ALA HA 1 132 GLY H 0.000 . 4.200 3.498 3.360 3.570 . 0 0 "[ . 1 . 2]" 1 1448 1 130 ARG QB 1 132 GLY H 0.000 . 6.300 4.460 4.308 4.714 . 0 0 "[ . 1 . 2]" 1 1449 1 133 ALA H 1 135 PRO QD 0.000 . 5.000 4.501 4.480 4.518 . 0 0 "[ . 1 . 2]" 1 1450 1 129 ALA HA 1 133 ALA H 0.000 . 3.200 3.089 3.011 3.211 0.011 3 0 "[ . 1 . 2]" 1 1451 1 131 GLN HG2 1 133 ALA H 0.000 . 5.500 3.943 2.213 5.347 . 0 0 "[ . 1 . 2]" 1 1452 1 131 GLN HA 1 133 ALA H 0.000 . 5.500 4.797 4.724 4.871 . 0 0 "[ . 1 . 2]" 1 1453 1 131 GLN HG3 1 133 ALA H 0.000 . 5.500 4.362 3.067 4.570 . 0 0 "[ . 1 . 2]" 1 1454 1 131 GLN H 1 133 ALA H 3.200 3.200 8.200 3.448 3.395 3.521 . 0 0 "[ . 1 . 2]" 1 1455 1 130 ARG HA 1 133 ALA H 0.000 . 5.500 5.586 5.564 5.604 0.104 6 0 "[ . 1 . 2]" 1 1456 1 129 ALA MB 1 133 ALA H 0.000 . 6.300 4.569 4.513 4.644 . 0 0 "[ . 1 . 2]" 1 1457 1 131 GLN QB 1 133 ALA H 0.000 . 5.000 3.452 3.030 4.184 . 0 0 "[ . 1 . 2]" 1 1458 1 137 VAL MG1 1 139 VAL H 0.000 . 6.300 4.213 4.103 4.306 . 0 0 "[ . 1 . 2]" 1 1459 1 140 GLU H 1 143 ARG HA 0.000 . 5.500 5.069 5.043 5.088 . 0 0 "[ . 1 . 2]" 1 1460 1 140 GLU H 1 143 ARG H 0.000 . 4.200 3.460 3.372 3.521 . 0 0 "[ . 1 . 2]" 1 1461 1 140 GLU H 1 143 ARG QG 0.000 . 6.300 3.045 2.906 3.193 . 0 0 "[ . 1 . 2]" 1 1462 1 140 GLU H 1 144 VAL HA 0.000 . 4.200 3.440 3.383 3.479 . 0 0 "[ . 1 . 2]" 1 1463 1 139 VAL MG2 1 141 GLY H 0.000 . 6.300 4.925 4.814 5.033 . 0 0 "[ . 1 . 2]" 1 1464 1 139 VAL HA 1 143 ARG H 0.000 . 5.500 5.082 5.007 5.155 . 0 0 "[ . 1 . 2]" 1 1465 1 141 GLY QA 1 143 ARG H 0.000 . 5.000 3.401 3.328 3.462 . 0 0 "[ . 1 . 2]" 1 1466 1 139 VAL HB 1 143 ARG H 0.000 . 5.500 3.807 3.727 3.889 . 0 0 "[ . 1 . 2]" 1 1467 1 139 VAL MG1 1 143 ARG H 0.000 . 5.000 4.232 4.221 4.241 . 0 0 "[ . 1 . 2]" 1 1468 1 144 VAL MG1 1 146 GLY H 0.000 . 3.500 1.987 1.861 2.175 . 0 0 "[ . 1 . 2]" 1 1469 1 144 VAL MG1 1 146 GLY HA3 0.000 . 5.000 3.960 3.829 4.070 . 0 0 "[ . 1 . 2]" 1 1470 1 144 VAL MG1 1 146 GLY HA2 0.000 . 4.000 2.965 2.790 3.098 . 0 0 "[ . 1 . 2]" 1 1471 1 144 VAL HB 1 146 GLY H 0.000 . 4.200 4.292 4.283 4.301 0.101 19 0 "[ . 1 . 2]" 1 1472 1 144 VAL HA 1 146 GLY H 0.000 . 4.200 3.671 3.596 3.719 . 0 0 "[ . 1 . 2]" 1 1473 1 147 VAL MG1 1 149 ALA HA 0.000 . 4.000 3.423 3.407 3.434 . 0 0 "[ . 1 . 2]" 1 1474 1 147 VAL HB 1 149 ALA HA 0.000 . 5.500 5.557 5.550 5.571 0.071 3 0 "[ . 1 . 2]" 1 1475 1 147 VAL MG1 1 149 ALA H 0.000 . 6.300 3.726 3.672 3.836 . 0 0 "[ . 1 . 2]" 1 1476 1 23 GLN H 1 151 LYS QB 0.000 . 6.300 4.667 4.185 5.385 . 0 0 "[ . 1 . 2]" 1 1477 1 23 GLN H 1 153 ILE MG 0.000 . 6.300 4.405 3.750 5.064 . 0 0 "[ . 1 . 2]" 1 1478 1 23 GLN H 1 151 LYS H 0.000 . 4.200 3.450 3.271 3.598 . 0 0 "[ . 1 . 2]" 1 1479 1 23 GLN H 1 153 ILE H 0.000 . 5.500 4.473 4.093 4.993 . 0 0 "[ . 1 . 2]" 1 1480 1 23 GLN H 1 150 LEU MD2 0.000 . 6.300 4.866 4.608 4.978 . 0 0 "[ . 1 . 2]" 1 1481 1 23 GLN H 1 150 LEU HB3 0.000 . 5.500 3.858 3.714 4.066 . 0 0 "[ . 1 . 2]" 1 1482 1 23 GLN H 1 152 ASP HA 0.000 . 4.200 3.704 3.506 3.839 . 0 0 "[ . 1 . 2]" 1 1483 1 23 GLN H 1 152 ASP QB 0.000 . 6.300 5.468 5.170 5.605 . 0 0 "[ . 1 . 2]" 1 1484 1 24 ALA HA 1 150 LEU HB2 0.000 . 4.200 3.967 3.530 4.118 . 0 0 "[ . 1 . 2]" 1 1485 1 24 ALA MB 1 57 ILE QG 0.000 . 4.800 2.085 1.891 2.463 . 0 0 "[ . 1 . 2]" 1 1486 1 24 ALA H 1 150 LEU MD2 0.000 . 5.000 2.642 2.440 2.854 . 0 0 "[ . 1 . 2]" 1 1487 1 24 ALA MB 1 57 ILE MD 0.000 . 7.100 3.643 3.454 3.883 . 0 0 "[ . 1 . 2]" 1 1488 1 24 ALA H 1 56 SER QB 0.000 . 5.000 1.743 1.716 1.845 . 0 0 "[ . 1 . 2]" 1 1489 1 24 ALA HA 1 148 ILE MG 0.000 . 5.000 3.382 3.288 3.559 . 0 0 "[ . 1 . 2]" 1 1490 1 24 ALA HA 1 150 LEU HG 0.000 . 4.200 3.248 1.862 3.475 . 0 0 "[ . 1 . 2]" 1 1491 1 24 ALA MB 1 60 LEU MD1 0.000 . 4.800 1.777 1.736 1.818 . 0 0 "[ . 1 . 2]" 1 1492 1 24 ALA HA 1 57 ILE QG 0.000 . 5.000 3.988 3.849 4.417 . 0 0 "[ . 1 . 2]" 1 1493 1 25 SER HB2 1 151 LYS QB 0.000 . 6.300 3.239 2.688 3.654 . 0 0 "[ . 1 . 2]" 1 1494 1 25 SER H 1 149 ALA H 0.000 . 5.500 4.662 4.588 4.706 . 0 0 "[ . 1 . 2]" 1 1495 1 25 SER H 1 150 LEU MD2 0.000 . 5.000 3.559 3.415 4.173 . 0 0 "[ . 1 . 2]" 1 1496 1 25 SER H 1 148 ILE MG 0.000 . 6.300 3.930 3.782 4.054 . 0 0 "[ . 1 . 2]" 1 1497 1 25 SER H 1 150 LEU HA 0.000 . 3.200 2.281 2.111 2.424 . 0 0 "[ . 1 . 2]" 1 1498 1 25 SER H 1 151 LYS H 0.000 . 4.200 3.502 3.347 3.714 . 0 0 "[ . 1 . 2]" 1 1499 1 25 SER HB2 1 151 LYS QG 0.000 . 4.000 2.052 1.823 2.636 . 0 0 "[ . 1 . 2]" 1 1500 1 25 SER H 1 60 LEU QD 0.000 . 7.000 2.488 2.337 2.759 . 0 0 "[ . 1 . 2]" 1 1501 1 25 SER HB3 1 151 LYS QG 0.000 . 4.000 3.045 2.456 3.554 . 0 0 "[ . 1 . 2]" 1 1502 1 25 SER HA 1 60 LEU MD1 0.000 . 4.000 2.657 2.311 2.938 . 0 0 "[ . 1 . 2]" 1 1503 1 25 SER H 1 150 LEU HG 0.000 . 5.500 4.447 3.135 4.673 . 0 0 "[ . 1 . 2]" 1 1504 1 25 SER H 1 149 ALA MB 0.000 . 5.000 4.187 4.174 4.200 . 0 0 "[ . 1 . 2]" 1 1505 1 26 GLU H 1 149 ALA HA 0.000 . 5.500 5.248 5.214 5.296 . 0 0 "[ . 1 . 2]" 1 1506 1 26 GLU H 1 150 LEU HA 0.000 . 4.200 3.893 3.755 3.999 . 0 0 "[ . 1 . 2]" 1 1507 1 26 GLU H 1 149 ALA MB 0.000 . 4.000 3.283 3.193 3.369 . 0 0 "[ . 1 . 2]" 1 1508 1 26 GLU H 1 149 ALA H 0.000 . 4.200 3.754 3.616 3.833 . 0 0 "[ . 1 . 2]" 1 1509 1 26 GLU H 1 148 ILE MG 0.000 . 6.300 4.138 3.859 4.345 . 0 0 "[ . 1 . 2]" 1 1510 1 26 GLU H 1 148 ILE HA 0.000 . 5.500 5.153 5.009 5.291 . 0 0 "[ . 1 . 2]" 1 1511 1 26 GLU H 1 60 LEU QD 0.000 . 4.700 2.514 2.372 2.781 . 0 0 "[ . 1 . 2]" 1 1512 1 26 GLU H 1 150 LEU HG 0.000 . 5.500 5.475 4.268 5.630 0.130 9 0 "[ . 1 . 2]" 1 1513 1 26 GLU H 1 150 LEU MD2 0.000 . 6.300 4.798 4.603 5.328 . 0 0 "[ . 1 . 2]" 1 1514 1 26 GLU HA 1 60 LEU MD1 0.000 . 5.000 2.411 2.188 2.753 . 0 0 "[ . 1 . 2]" 1 1515 1 26 GLU H 1 151 LYS H 0.000 . 5.500 5.093 4.946 5.347 . 0 0 "[ . 1 . 2]" 1 1516 1 27 PHE QB 1 35 GLU QG 0.000 . 4.800 3.874 3.852 3.897 . 0 0 "[ . 1 . 2]" 1 1517 1 27 PHE H 1 35 GLU QG 0.000 . 6.300 4.106 3.985 4.262 . 0 0 "[ . 1 . 2]" 1 1518 1 27 PHE HA 1 148 ILE HA 0.000 . 2.700 2.566 2.383 2.705 0.005 3 0 "[ . 1 . 2]" 1 1519 1 27 PHE HB2 1 60 LEU QD 0.000 . 4.700 3.550 3.524 3.564 . 0 0 "[ . 1 . 2]" 1 1520 1 27 PHE HB3 1 60 LEU QD 0.000 . 4.700 2.305 2.283 2.385 . 0 0 "[ . 1 . 2]" 1 1521 1 27 PHE H 1 60 LEU MD1 0.000 . 6.300 3.777 3.521 3.996 . 0 0 "[ . 1 . 2]" 1 1522 1 27 PHE HA 1 149 ALA MB 0.000 . 6.300 3.357 3.185 3.464 . 0 0 "[ . 1 . 2]" 1 1523 1 27 PHE H 1 60 LEU MD2 0.000 . 6.300 3.681 3.544 3.787 . 0 0 "[ . 1 . 2]" 1 1524 1 28 ILE H 1 147 VAL MG2 0.000 . 6.300 4.651 4.605 4.723 . 0 0 "[ . 1 . 2]" 1 1525 1 28 ILE H 1 147 VAL HB 0.000 . 4.200 3.386 3.320 3.461 . 0 0 "[ . 1 . 2]" 1 1526 1 28 ILE H 1 148 ILE HA 0.000 . 4.200 3.868 3.714 3.916 . 0 0 "[ . 1 . 2]" 1 1527 1 28 ILE H 1 38 LEU QD 0.000 . 5.700 2.768 2.501 2.905 . 0 0 "[ . 1 . 2]" 1 1528 1 28 ILE MG 1 124 LYS QE 0.000 . 4.800 2.966 2.436 3.565 . 0 0 "[ . 1 . 2]" 1 1529 1 28 ILE H 1 149 ALA H 0.000 . 5.500 4.103 4.024 4.258 . 0 0 "[ . 1 . 2]" 1 1530 1 28 ILE H 1 147 VAL H 0.000 . 3.200 3.173 3.055 3.234 0.034 19 0 "[ . 1 . 2]" 1 1531 1 28 ILE H 1 38 LEU HG 0.000 . 5.500 5.224 4.857 5.510 0.010 10 0 "[ . 1 . 2]" 1 1532 1 29 PRO HB3 1 35 GLU HA 0.000 . 4.200 2.701 2.687 2.723 . 0 0 "[ . 1 . 2]" 1 1533 1 29 PRO HB2 1 35 GLU HA 0.000 . 4.200 4.200 4.181 4.231 0.031 2 0 "[ . 1 . 2]" 1 1534 1 30 ALA H 1 146 GLY H 0.000 . 4.200 3.533 3.506 3.570 . 0 0 "[ . 1 . 2]" 1 1535 1 30 ALA H 1 121 VAL MG2 0.000 . 5.000 3.589 3.566 3.610 . 0 0 "[ . 1 . 2]" 1 1536 1 30 ALA H 1 35 GLU HA 0.000 . 5.500 5.357 5.301 5.448 . 0 0 "[ . 1 . 2]" 1 1537 1 30 ALA H 1 145 LEU QD 0.000 . 7.000 4.014 3.977 4.047 . 0 0 "[ . 1 . 2]" 1 1538 1 30 ALA H 1 145 LEU HA 0.000 . 5.500 3.558 3.529 3.589 . 0 0 "[ . 1 . 2]" 1 1539 1 30 ALA HA 1 121 VAL MG2 0.000 . 3.500 1.693 1.687 1.697 . 0 0 "[ . 1 . 2]" 1 1540 1 30 ALA H 1 146 GLY HA3 0.000 . 3.200 2.537 2.500 2.562 . 0 0 "[ . 1 . 2]" 1 1541 1 30 ALA HA 1 121 VAL HB 0.000 . 3.200 3.025 2.990 3.050 . 0 0 "[ . 1 . 2]" 1 1542 1 30 ALA H 1 146 GLY HA2 0.000 . 3.200 1.945 1.930 1.959 . 0 0 "[ . 1 . 2]" 1 1543 1 30 ALA H 1 38 LEU QB 0.000 . 6.300 3.642 3.574 3.702 . 0 0 "[ . 1 . 2]" 1 1544 1 30 ALA H 1 147 VAL H 0.000 . 4.200 4.235 4.219 4.245 0.045 5 0 "[ . 1 . 2]" 1 1545 1 30 ALA MB 1 118 PRO QG 0.000 . 4.800 1.689 1.667 1.706 . 0 0 "[ . 1 . 2]" 1 1546 1 31 GLN H 1 121 VAL MG2 0.000 . 6.300 2.454 2.403 2.500 . 0 0 "[ . 1 . 2]" 1 1547 1 31 GLN H 1 120 ASP QB 0.000 . 6.300 4.551 4.492 4.611 . 0 0 "[ . 1 . 2]" 1 1548 1 32 GLY QA 1 118 PRO QG 0.000 . 7.100 5.302 5.226 5.416 . 0 0 "[ . 1 . 2]" 1 1549 1 33 VAL MG1 1 145 LEU QD 0.000 . 5.000 3.080 3.054 3.109 . 0 0 "[ . 1 . 2]" 1 1550 1 33 VAL H 1 145 LEU HA 0.000 . 5.500 4.848 4.505 4.953 . 0 0 "[ . 1 . 2]" 1 1551 1 33 VAL MG2 1 145 LEU QB 0.000 . 4.300 2.544 2.463 2.681 . 0 0 "[ . 1 . 2]" 1 1552 1 33 VAL MG2 1 145 LEU HA 0.000 . 4.000 1.987 1.826 2.206 . 0 0 "[ . 1 . 2]" 1 1553 1 33 VAL MG1 1 145 LEU HA 0.000 . 5.000 2.787 2.539 3.047 . 0 0 "[ . 1 . 2]" 1 1554 1 33 VAL MG1 1 145 LEU QB 0.000 . 5.800 1.947 1.813 2.095 . 0 0 "[ . 1 . 2]" 1 1555 1 29 PRO QG 1 34 ASP H 0.000 . 6.300 5.106 5.043 5.147 . 0 0 "[ . 1 . 2]" 1 1556 1 29 PRO HB3 1 34 ASP H 0.000 . 5.500 4.417 4.381 4.456 . 0 0 "[ . 1 . 2]" 1 1557 1 29 PRO QG 1 35 GLU H 0.000 . 5.000 2.141 2.122 2.205 . 0 0 "[ . 1 . 2]" 1 1558 1 29 PRO QG 1 35 GLU HA 0.000 . 5.000 2.155 2.079 2.191 . 0 0 "[ . 1 . 2]" 1 1559 1 29 PRO HA 1 38 LEU HB3 0.000 . 5.500 3.477 3.406 3.540 . 0 0 "[ . 1 . 2]" 1 1560 1 33 VAL MG1 1 38 LEU H 0.000 . 5.000 2.904 2.707 2.996 . 0 0 "[ . 1 . 2]" 1 1561 1 38 LEU HA 1 145 LEU QD 0.000 . 4.200 2.028 1.974 2.129 . 0 0 "[ . 1 . 2]" 1 1562 1 38 LEU H 1 145 LEU QB 0.000 . 6.300 4.249 4.170 4.394 . 0 0 "[ . 1 . 2]" 1 1563 1 29 PRO HA 1 38 LEU HB2 0.000 . 5.500 2.576 2.545 2.625 . 0 0 "[ . 1 . 2]" 1 1564 1 29 PRO QB 1 38 LEU H 0.000 . 6.300 3.991 3.923 4.025 . 0 0 "[ . 1 . 2]" 1 1565 1 38 LEU HA 1 145 LEU HB3 0.000 . 4.200 4.259 4.244 4.273 0.073 12 0 "[ . 1 . 2]" 1 1566 1 39 ALA HA 1 61 ALA MB 0.000 . 4.000 3.082 2.860 3.277 . 0 0 "[ . 1 . 2]" 1 1567 1 40 ASP HA 1 68 ARG QG 0.000 . 5.000 3.609 2.784 4.462 . 0 0 "[ . 1 . 2]" 1 1568 1 40 ASP HA 1 61 ALA MB 0.000 . 5.000 3.608 3.493 3.697 . 0 0 "[ . 1 . 2]" 1 1569 1 41 ALA HA 1 98 ILE MD 0.000 . 5.000 2.231 2.132 2.326 . 0 0 "[ . 1 . 2]" 1 1570 1 41 ALA H 1 145 LEU MD1 0.000 . 5.000 4.239 4.228 4.250 . 0 0 "[ . 1 . 2]" 1 1571 1 41 ALA HA 1 98 ILE MG 0.000 . 4.000 2.998 2.903 3.161 . 0 0 "[ . 1 . 2]" 1 1572 1 41 ALA H 1 145 LEU MD2 0.000 . 5.000 3.581 3.505 3.679 . 0 0 "[ . 1 . 2]" 1 1573 1 41 ALA H 1 98 ILE MD 0.000 . 5.000 3.888 3.773 4.020 . 0 0 "[ . 1 . 2]" 1 1574 1 41 ALA MB 1 98 ILE MG 0.000 . 4.300 1.775 1.740 1.817 . 0 0 "[ . 1 . 2]" 1 1575 1 42 ALA H 1 138 VAL MG1 0.000 . 5.000 3.149 2.960 3.340 . 0 0 "[ . 1 . 2]" 1 1576 1 42 ALA HA 1 138 VAL MG1 0.000 . 5.000 2.514 2.374 2.659 . 0 0 "[ . 1 . 2]" 1 1577 1 42 ALA HA 1 138 VAL MG2 0.000 . 4.000 2.161 2.049 2.259 . 0 0 "[ . 1 . 2]" 1 1578 1 42 ALA HA 1 98 ILE MG 0.000 . 5.000 4.192 4.178 4.207 . 0 0 "[ . 1 . 2]" 1 1579 1 27 PHE HZ 1 42 ALA MB 0.000 . 6.300 5.351 5.329 5.367 . 0 0 "[ . 1 . 2]" 1 1580 1 42 ALA H 1 148 ILE MD 0.000 . 6.300 4.090 4.011 4.201 . 0 0 "[ . 1 . 2]" 1 1581 1 43 GLN HE22 1 68 ARG H 0.000 . 4.200 3.103 2.989 3.184 . 0 0 "[ . 1 . 2]" 1 1582 1 43 GLN HE22 1 62 LYS QG 0.000 . 5.000 2.240 2.127 2.347 . 0 0 "[ . 1 . 2]" 1 1583 1 43 GLN HA 1 58 VAL MG2 0.000 . 5.000 2.768 2.706 2.825 . 0 0 "[ . 1 . 2]" 1 1584 1 43 GLN H 1 138 VAL MG2 0.000 . 6.300 5.128 5.035 5.227 . 0 0 "[ . 1 . 2]" 1 1585 1 43 GLN HE22 1 69 GLU QB 0.000 . 5.000 4.510 4.419 4.534 . 0 0 "[ . 1 . 2]" 1 1586 1 43 GLN HE22 1 58 VAL MG1 0.000 . 5.000 2.838 2.768 2.922 . 0 0 "[ . 1 . 2]" 1 1587 1 43 GLN HE22 1 58 VAL HA 0.000 . 4.200 4.329 4.314 4.350 0.150 14 0 "[ . 1 . 2]" 1 1588 1 43 GLN HE21 1 58 VAL MG1 0.000 . 5.000 1.858 1.840 1.997 . 0 0 "[ . 1 . 2]" 1 1589 1 43 GLN HE21 1 62 LYS QE 0.000 . 4.000 2.501 1.895 3.445 . 0 0 "[ . 1 . 2]" 1 1590 1 43 GLN HE21 1 61 ALA MB 0.000 . 3.500 2.778 2.711 2.878 . 0 0 "[ . 1 . 2]" 1 1591 1 43 GLN HE21 1 58 VAL MG2 0.000 . 6.300 4.140 4.090 4.196 . 0 0 "[ . 1 . 2]" 1 1592 1 43 GLN HE21 1 69 GLU QB 0.000 . 6.300 5.634 5.537 5.660 . 0 0 "[ . 1 . 2]" 1 1593 1 43 GLN HE22 1 62 LYS QB 0.000 . 5.000 4.314 4.168 4.450 . 0 0 "[ . 1 . 2]" 1 1594 1 43 GLN HE21 1 62 LYS QG 0.000 . 6.300 2.348 2.260 2.409 . 0 0 "[ . 1 . 2]" 1 1595 1 43 GLN HE22 1 61 ALA MB 0.000 . 4.000 3.348 3.274 3.363 . 0 0 "[ . 1 . 2]" 1 1596 1 43 GLN HA 1 58 VAL MG1 0.000 . 5.000 3.347 3.215 3.467 . 0 0 "[ . 1 . 2]" 1 1597 1 43 GLN HE22 1 62 LYS QD 0.000 . 5.000 2.985 2.161 3.525 . 0 0 "[ . 1 . 2]" 1 1598 1 43 GLN HE21 1 62 LYS QB 0.000 . 5.000 4.458 4.370 4.495 . 0 0 "[ . 1 . 2]" 1 1599 1 43 GLN HE21 1 69 GLU HA 0.000 . 4.200 3.996 3.906 4.220 0.020 6 0 "[ . 1 . 2]" 1 1600 1 43 GLN HA 1 61 ALA MB 0.000 . 5.000 3.917 3.815 4.008 . 0 0 "[ . 1 . 2]" 1 1601 1 43 GLN HE21 1 58 VAL HA 0.000 . 4.200 2.691 2.664 2.722 . 0 0 "[ . 1 . 2]" 1 1602 1 43 GLN HE22 1 69 GLU HA 0.000 . 3.200 2.822 2.746 3.039 . 0 0 "[ . 1 . 2]" 1 1603 1 43 GLN HE22 1 62 LYS QE 0.000 . 4.000 2.427 1.768 3.591 . 0 0 "[ . 1 . 2]" 1 1604 1 43 GLN QG 1 61 ALA MB 0.000 . 4.800 1.857 1.789 1.957 . 0 0 "[ . 1 . 2]" 1 1605 1 43 GLN HE21 1 68 ARG H 0.000 . 4.200 4.293 4.255 4.325 0.125 7 0 "[ . 1 . 2]" 1 1606 1 43 GLN HE22 1 58 VAL MG2 0.000 . 6.300 5.230 5.202 5.253 . 0 0 "[ . 1 . 2]" 1 1607 1 43 GLN HA 1 57 ILE MG 0.000 . 4.000 3.431 3.420 3.445 . 0 0 "[ . 1 . 2]" 1 1608 1 44 LEU H 1 91 ILE MG 0.000 . 6.300 4.396 4.304 4.543 . 0 0 "[ . 1 . 2]" 1 1609 1 44 LEU H 1 70 ARG HA 0.000 . 5.500 4.816 4.678 5.048 . 0 0 "[ . 1 . 2]" 1 1610 1 45 ALA H 1 91 ILE MD 0.000 . 6.300 4.559 4.423 4.750 . 0 0 "[ . 1 . 2]" 1 1611 1 45 ALA MB 1 100 LYS QG 0.000 . 4.300 2.307 1.823 2.527 . 0 0 "[ . 1 . 2]" 1 1612 1 45 ALA MB 1 90 GLY HA3 0.000 . 5.000 3.404 3.347 3.462 . 0 0 "[ . 1 . 2]" 1 1613 1 45 ALA HA 1 90 GLY HA2 0.000 . 2.700 2.021 1.914 2.155 . 0 0 "[ . 1 . 2]" 1 1614 1 45 ALA H 1 91 ILE MG 0.000 . 6.300 3.053 2.917 3.218 . 0 0 "[ . 1 . 2]" 1 1615 1 45 ALA H 1 90 GLY QA 0.000 . 6.300 4.597 4.514 4.706 . 0 0 "[ . 1 . 2]" 1 1616 1 45 ALA H 1 138 VAL MG1 0.000 . 6.300 4.123 3.944 4.291 . 0 0 "[ . 1 . 2]" 1 1617 1 45 ALA HA 1 91 ILE MG 0.000 . 3.500 2.245 2.093 2.368 . 0 0 "[ . 1 . 2]" 1 1618 1 45 ALA MB 1 100 LYS QD 0.000 . 5.800 3.833 2.758 4.093 . 0 0 "[ . 1 . 2]" 1 1619 1 45 ALA HA 1 90 GLY HA3 0.000 . 3.200 3.303 3.274 3.329 0.129 1 0 "[ . 1 . 2]" 1 1620 1 45 ALA MB 1 100 LYS QB 0.000 . 4.800 1.860 1.748 2.059 . 0 0 "[ . 1 . 2]" 1 1621 1 45 ALA HA 1 138 VAL MG2 0.000 . 6.300 5.298 5.289 5.305 . 0 0 "[ . 1 . 2]" 1 1622 1 45 ALA MB 1 100 LYS HA 0.000 . 6.300 3.627 3.520 3.695 . 0 0 "[ . 1 . 2]" 1 1623 1 45 ALA H 1 98 ILE MD 0.000 . 6.300 4.292 4.179 4.412 . 0 0 "[ . 1 . 2]" 1 1624 1 45 ALA HA 1 98 ILE MG 0.000 . 6.300 3.870 3.721 4.039 . 0 0 "[ . 1 . 2]" 1 1625 1 45 ALA HA 1 91 ILE HB 0.000 . 3.200 3.100 3.042 3.206 0.006 6 0 "[ . 1 . 2]" 1 1626 1 46 SER H 1 100 LYS QB 0.000 . 6.300 4.524 4.345 4.713 . 0 0 "[ . 1 . 2]" 1 1627 1 46 SER HB2 1 58 VAL MG2 0.000 . 4.000 2.468 2.431 2.544 . 0 0 "[ . 1 . 2]" 1 1628 1 46 SER HB3 1 58 VAL MG2 0.000 . 4.000 3.366 3.356 3.372 . 0 0 "[ . 1 . 2]" 1 1629 1 46 SER HA 1 58 VAL MG2 0.000 . 5.000 4.091 4.058 4.110 . 0 0 "[ . 1 . 2]" 1 1630 1 47 LEU H 1 58 VAL MG2 0.000 . 5.000 4.005 3.961 4.044 . 0 0 "[ . 1 . 2]" 1 1631 1 47 LEU H 1 58 VAL MG1 0.000 . 6.300 5.258 5.252 5.264 . 0 0 "[ . 1 . 2]" 1 1632 1 47 LEU H 1 100 LYS QG 0.000 . 6.300 5.145 4.968 5.630 . 0 0 "[ . 1 . 2]" 1 1633 1 48 ALA H 1 58 VAL MG2 0.000 . 6.300 5.309 5.290 5.324 . 0 0 "[ . 1 . 2]" 1 1634 1 49 ASP H 1 58 VAL MG2 0.000 . 6.300 4.870 4.814 4.920 . 0 0 "[ . 1 . 2]" 1 1635 1 49 ASP HA 1 54 GLY QA 0.000 . 5.000 4.511 4.500 4.519 . 0 0 "[ . 1 . 2]" 1 1636 1 49 ASP H 1 54 GLY QA 0.000 . 6.300 4.220 4.159 4.290 . 0 0 "[ . 1 . 2]" 1 1637 1 49 ASP HA 1 81 PRO HB3 0.000 . 5.500 5.401 5.094 5.506 0.006 12 0 "[ . 1 . 2]" 1 1638 1 49 ASP H 1 82 PHE H 0.000 . 5.500 5.124 4.782 5.326 . 0 0 "[ . 1 . 2]" 1 1639 1 49 ASP HB3 1 54 GLY HA3 0.000 . 4.200 3.831 3.759 3.891 . 0 0 "[ . 1 . 2]" 1 1640 1 49 ASP HB2 1 54 GLY HA2 0.000 . 3.200 3.238 3.226 3.251 0.051 19 0 "[ . 1 . 2]" 1 1641 1 49 ASP HB2 1 54 GLY HA3 0.000 . 3.200 2.645 2.570 2.708 . 0 0 "[ . 1 . 2]" 1 1642 1 49 ASP HB3 1 54 GLY HA2 0.000 . 4.200 3.915 3.903 3.926 . 0 0 "[ . 1 . 2]" 1 1643 1 50 GLU HA 1 55 ARG HE 0.000 . 5.500 5.080 4.734 5.512 0.012 5 0 "[ . 1 . 2]" 1 1644 1 57 ILE QG 1 150 LEU MD1 0.000 . 4.800 3.439 3.353 3.539 . 0 0 "[ . 1 . 2]" 1 1645 1 57 ILE QG 1 148 ILE MG 0.000 . 4.800 2.372 2.230 2.588 . 0 0 "[ . 1 . 2]" 1 1646 1 24 ALA MB 1 57 ILE HA 0.000 . 4.000 1.949 1.807 2.299 . 0 0 "[ . 1 . 2]" 1 1647 1 24 ALA HA 1 57 ILE HA 0.000 . 5.500 4.570 4.449 5.081 . 0 0 "[ . 1 . 2]" 1 1648 1 43 GLN HG2 1 58 VAL HA 0.000 . 3.200 1.810 1.793 1.824 . 0 0 "[ . 1 . 2]" 1 1649 1 43 GLN HG3 1 58 VAL HA 0.000 . 3.200 3.251 3.230 3.281 0.081 16 0 "[ . 1 . 2]" 1 1650 1 61 ALA HA 1 66 ASN QB 0.000 . 5.000 4.566 4.548 4.576 . 0 0 "[ . 1 . 2]" 1 1651 1 62 LYS HA 1 67 LEU HA 0.000 . 5.500 1.843 1.825 1.849 . 0 0 "[ . 1 . 2]" 1 1652 1 62 LYS HA 1 67 LEU QD 0.000 . 5.700 3.022 2.677 4.182 . 0 0 "[ . 1 . 2]" 1 1653 1 43 GLN QG 1 62 LYS H 0.000 . 6.300 4.255 4.175 4.371 . 0 0 "[ . 1 . 2]" 1 1654 1 36 LYS QD 1 66 ASN HB2 0.000 . 5.000 2.885 2.102 3.185 . 0 0 "[ . 1 . 2]" 1 1655 1 36 LYS QG 1 66 ASN HB2 0.000 . 6.300 2.448 1.864 3.579 . 0 0 "[ . 1 . 2]" 1 1656 1 36 LYS QD 1 66 ASN HB3 0.000 . 5.000 4.185 3.193 4.477 . 0 0 "[ . 1 . 2]" 1 1657 1 36 LYS QG 1 66 ASN H 0.000 . 6.300 4.803 4.362 5.635 . 0 0 "[ . 1 . 2]" 1 1658 1 36 LYS QE 1 66 ASN H 0.000 . 6.300 5.452 4.785 5.665 . 0 0 "[ . 1 . 2]" 1 1659 1 36 LYS QG 1 66 ASN HB3 0.000 . 6.300 3.312 2.711 4.063 . 0 0 "[ . 1 . 2]" 1 1660 1 62 LYS QD 1 67 LEU HA 0.000 . 5.000 3.067 3.029 3.094 . 0 0 "[ . 1 . 2]" 1 1661 1 62 LYS HB3 1 67 LEU H 0.000 . 5.500 4.296 4.259 4.322 . 0 0 "[ . 1 . 2]" 1 1662 1 62 LYS HB2 1 67 LEU H 0.000 . 5.500 5.622 5.576 5.649 0.149 20 0 "[ . 1 . 2]" 1 1663 1 62 LYS HA 1 67 LEU H 0.000 . 3.200 3.217 3.153 3.245 0.045 20 0 "[ . 1 . 2]" 1 1664 1 62 LYS QD 1 67 LEU H 0.000 . 6.300 5.637 5.555 5.668 . 0 0 "[ . 1 . 2]" 1 1665 1 62 LYS QG 1 67 LEU H 0.000 . 6.300 4.783 4.537 4.853 . 0 0 "[ . 1 . 2]" 1 1666 1 62 LYS QG 1 68 ARG H 0.000 . 6.300 1.843 1.826 1.861 . 0 0 "[ . 1 . 2]" 1 1667 1 47 LEU MD1 1 70 ARG HB3 0.000 . 5.000 1.829 1.773 1.899 . 0 0 "[ . 1 . 2]" 1 1668 1 47 LEU MD2 1 70 ARG HB3 0.000 . 4.000 2.013 1.832 2.695 . 0 0 "[ . 1 . 2]" 1 1669 1 47 LEU QD 1 70 ARG HE 0.000 . 7.000 3.748 2.363 4.308 . 0 0 "[ . 1 . 2]" 1 1670 1 43 GLN HE22 1 70 ARG H 0.000 . 5.500 5.549 5.521 5.615 0.115 6 0 "[ . 1 . 2]" 1 1671 1 47 LEU MD2 1 70 ARG HB2 0.000 . 4.000 3.234 3.102 3.336 . 0 0 "[ . 1 . 2]" 1 1672 1 47 LEU MD1 1 70 ARG H 0.000 . 6.300 3.925 3.405 4.010 . 0 0 "[ . 1 . 2]" 1 1673 1 47 LEU MD1 1 70 ARG HB2 0.000 . 5.000 1.778 1.716 2.407 . 0 0 "[ . 1 . 2]" 1 1674 1 47 LEU MD2 1 70 ARG H 0.000 . 6.300 3.474 3.191 3.554 . 0 0 "[ . 1 . 2]" 1 1675 1 44 LEU MD2 1 71 ASP H 0.000 . 6.300 4.307 4.069 4.502 . 0 0 "[ . 1 . 2]" 1 1676 1 44 LEU MD1 1 71 ASP H 0.000 . 6.300 5.326 5.304 5.340 . 0 0 "[ . 1 . 2]" 1 1677 1 72 VAL MG1 1 79 PHE HD2 0.000 . 4.000 3.365 3.356 3.388 . 0 0 "[ . 1 . 2]" 1 1678 1 72 VAL MG2 1 79 PHE HE1 0.000 . 4.000 2.123 1.963 2.419 . 0 0 "[ . 1 . 2]" 1 1679 1 72 VAL MG2 1 79 PHE HD1 0.000 . 4.000 3.352 3.336 3.363 . 0 0 "[ . 1 . 2]" 1 1680 1 72 VAL MG1 1 79 PHE HE2 0.000 . 4.000 2.006 1.969 2.164 . 0 0 "[ . 1 . 2]" 1 1681 1 72 VAL MG2 1 91 ILE MD 0.000 . 4.800 1.705 1.591 1.814 . 0 0 "[ . 1 . 2]" 1 1682 1 75 LEU H 1 93 ILE MD 0.000 . 6.300 3.812 3.185 3.955 . 0 0 "[ . 1 . 2]" 1 1683 1 75 LEU HB2 1 93 ILE MD 0.000 . 4.000 1.789 1.757 1.834 . 0 0 "[ . 1 . 2]" 1 1684 1 72 VAL HA 1 77 ALA H 0.000 . 5.500 2.532 2.392 2.728 . 0 0 "[ . 1 . 2]" 1 1685 1 72 VAL HA 1 77 ALA MB 0.000 . 5.000 1.819 1.806 1.834 . 0 0 "[ . 1 . 2]" 1 1686 1 72 VAL HB 1 77 ALA H 0.000 . 5.500 4.304 4.235 4.409 . 0 0 "[ . 1 . 2]" 1 1687 1 77 ALA H 1 93 ILE MD 0.000 . 6.300 3.580 3.375 3.820 . 0 0 "[ . 1 . 2]" 1 1688 1 72 VAL MG1 1 77 ALA H 0.000 . 6.300 1.859 1.847 1.887 . 0 0 "[ . 1 . 2]" 1 1689 1 77 ALA H 1 93 ILE QG 0.000 . 6.300 4.780 4.090 4.890 . 0 0 "[ . 1 . 2]" 1 1690 1 77 ALA H 1 93 ILE HA 0.000 . 5.500 5.397 4.508 5.510 0.010 14 0 "[ . 1 . 2]" 1 1691 1 78 THR H 1 92 ASN QB 0.000 . 5.000 3.655 3.176 3.756 . 0 0 "[ . 1 . 2]" 1 1692 1 78 THR H 1 93 ILE HB 0.000 . 4.200 3.692 3.616 4.108 . 0 0 "[ . 1 . 2]" 1 1693 1 78 THR H 1 91 ILE QG 0.000 . 6.300 3.516 3.447 3.618 . 0 0 "[ . 1 . 2]" 1 1694 1 78 THR H 1 93 ILE HA 0.000 . 3.200 3.270 3.250 3.295 0.095 9 0 "[ . 1 . 2]" 1 1695 1 78 THR H 1 92 ASN H 0.000 . 3.200 3.302 3.278 3.331 0.131 11 0 "[ . 1 . 2]" 1 1696 1 78 THR H 1 91 ILE HA 0.000 . 5.500 5.210 5.173 5.255 . 0 0 "[ . 1 . 2]" 1 1697 1 78 THR H 1 93 ILE H 0.000 . 5.500 4.872 4.841 4.899 . 0 0 "[ . 1 . 2]" 1 1698 1 78 THR H 1 91 ILE MD 0.000 . 6.300 4.456 4.335 4.613 . 0 0 "[ . 1 . 2]" 1 1699 1 72 VAL MG1 1 78 THR H 0.000 . 6.300 3.615 3.408 3.682 . 0 0 "[ . 1 . 2]" 1 1700 1 79 PHE H 1 91 ILE HG12 0.000 . 5.500 5.559 5.543 5.571 0.071 14 0 "[ . 1 . 2]" 1 1701 1 79 PHE H 1 91 ILE HG13 0.000 . 5.500 4.294 4.149 4.378 . 0 0 "[ . 1 . 2]" 1 1702 1 48 ALA MB 1 79 PHE HB2 0.000 . 3.500 2.942 2.926 2.956 . 0 0 "[ . 1 . 2]" 1 1703 1 48 ALA MB 1 79 PHE HB3 0.000 . 3.500 1.816 1.784 1.871 . 0 0 "[ . 1 . 2]" 1 1704 1 72 VAL MG1 1 79 PHE H 0.000 . 6.300 3.775 3.716 3.900 . 0 0 "[ . 1 . 2]" 1 1705 1 80 VAL H 1 90 GLY HA3 0.000 . 5.500 5.031 4.996 5.108 . 0 0 "[ . 1 . 2]" 1 1706 1 80 VAL H 1 91 ILE QG 0.000 . 6.300 3.948 3.793 4.066 . 0 0 "[ . 1 . 2]" 1 1707 1 80 VAL H 1 92 ASN H 0.000 . 5.500 4.561 4.426 4.658 . 0 0 "[ . 1 . 2]" 1 1708 1 80 VAL H 1 90 GLY HA2 0.000 . 5.500 4.791 4.764 4.834 . 0 0 "[ . 1 . 2]" 1 1709 1 80 VAL H 1 90 GLY H 0.000 . 4.200 3.577 3.534 3.647 . 0 0 "[ . 1 . 2]" 1 1710 1 80 VAL H 1 89 SER QB 0.000 . 6.300 5.155 5.075 5.344 . 0 0 "[ . 1 . 2]" 1 1711 1 80 VAL H 1 91 ILE HA 0.000 . 3.200 2.679 2.555 2.746 . 0 0 "[ . 1 . 2]" 1 1712 1 80 VAL H 1 91 ILE HB 0.000 . 5.500 3.756 3.643 3.846 . 0 0 "[ . 1 . 2]" 1 1713 1 82 PHE QB 1 100 LYS QE 0.000 . 4.300 3.444 3.433 3.463 . 0 0 "[ . 1 . 2]" 1 1714 1 82 PHE H 1 89 SER HA 0.000 . 5.500 4.584 4.492 4.710 . 0 0 "[ . 1 . 2]" 1 1715 1 49 ASP HA 1 82 PHE H 0.000 . 5.500 2.911 2.533 3.102 . 0 0 "[ . 1 . 2]" 1 1716 1 82 PHE H 1 89 SER HB3 0.000 . 4.200 3.339 3.249 3.429 . 0 0 "[ . 1 . 2]" 1 1717 1 82 PHE QB 1 89 SER HB2 0.000 . 5.000 2.681 2.493 2.765 . 0 0 "[ . 1 . 2]" 1 1718 1 82 PHE H 1 90 GLY H 0.000 . 5.500 5.229 5.042 5.358 . 0 0 "[ . 1 . 2]" 1 1719 1 82 PHE QB 1 89 SER HB3 0.000 . 4.000 1.859 1.844 1.904 . 0 0 "[ . 1 . 2]" 1 1720 1 82 PHE H 1 89 SER HB2 0.000 . 4.200 2.875 2.682 3.053 . 0 0 "[ . 1 . 2]" 1 1721 1 48 ALA MB 1 82 PHE H 0.000 . 6.300 3.993 3.809 4.131 . 0 0 "[ . 1 . 2]" 1 1722 1 82 PHE HZ 1 87 ARG H 0.000 . 4.200 4.211 4.200 4.259 0.059 3 0 "[ . 1 . 2]" 1 1723 1 82 PHE HE1 1 87 ARG HA 0.000 . 4.200 2.585 2.296 3.042 . 0 0 "[ . 1 . 2]" 1 1724 1 87 ARG H 1 105 ALA MB 0.000 . 6.300 4.555 4.416 4.751 . 0 0 "[ . 1 . 2]" 1 1725 1 88 MET ME 1 106 ILE HB 0.000 . 5.000 4.176 4.033 4.201 . 0 0 "[ . 1 . 2]" 1 1726 1 88 MET QG 1 105 ALA MB 0.000 . 4.800 2.212 1.698 2.368 . 0 0 "[ . 1 . 2]" 1 1727 1 88 MET HB3 1 106 ILE MD 0.000 . 4.000 2.721 2.014 3.006 . 0 0 "[ . 1 . 2]" 1 1728 1 88 MET ME 1 106 ILE HA 0.000 . 5.000 2.165 2.040 2.215 . 0 0 "[ . 1 . 2]" 1 1729 1 82 PHE HA 1 88 MET H 0.000 . 4.200 4.226 4.203 4.261 0.061 3 0 "[ . 1 . 2]" 1 1730 1 88 MET HA 1 101 GLY HA3 0.000 . 3.200 3.089 2.697 3.204 0.004 11 0 "[ . 1 . 2]" 1 1731 1 88 MET HA 1 101 GLY HA2 0.000 . 3.200 2.276 2.164 2.584 . 0 0 "[ . 1 . 2]" 1 1732 1 88 MET HB2 1 106 ILE MD 0.000 . 4.000 2.714 2.620 3.415 . 0 0 "[ . 1 . 2]" 1 1733 1 83 THR H 1 88 MET H 0.000 . 4.200 3.079 2.979 3.148 . 0 0 "[ . 1 . 2]" 1 1734 1 88 MET HA 1 100 LYS QG 0.000 . 5.000 4.504 4.361 4.531 . 0 0 "[ . 1 . 2]" 1 1735 1 89 SER H 1 106 ILE MD 0.000 . 6.300 3.933 3.465 4.020 . 0 0 "[ . 1 . 2]" 1 1736 1 89 SER H 1 105 ALA MB 0.000 . 6.300 5.332 5.312 5.345 . 0 0 "[ . 1 . 2]" 1 1737 1 89 SER H 1 101 GLY QA 0.000 . 4.000 3.098 3.029 3.180 . 0 0 "[ . 1 . 2]" 1 1738 1 89 SER H 1 99 ARG QB 0.000 . 6.300 4.373 4.268 5.110 . 0 0 "[ . 1 . 2]" 1 1739 1 89 SER H 1 100 LYS QE 0.000 . 6.300 2.886 2.282 4.062 . 0 0 "[ . 1 . 2]" 1 1740 1 89 SER H 1 100 LYS QG 0.000 . 5.000 2.772 2.689 2.953 . 0 0 "[ . 1 . 2]" 1 1741 1 89 SER H 1 99 ARG HA 0.000 . 5.500 5.167 5.047 5.209 . 0 0 "[ . 1 . 2]" 1 1742 1 89 SER H 1 100 LYS H 0.000 . 3.200 3.232 3.218 3.253 0.053 14 0 "[ . 1 . 2]" 1 1743 1 80 VAL MG2 1 90 GLY H 0.000 . 6.300 4.037 3.702 4.329 . 0 0 "[ . 1 . 2]" 1 1744 1 90 GLY H 1 99 ARG QD 0.000 . 6.300 4.377 2.835 4.997 . 0 0 "[ . 1 . 2]" 1 1745 1 45 ALA MB 1 90 GLY H 0.000 . 6.300 4.955 4.831 5.104 . 0 0 "[ . 1 . 2]" 1 1746 1 90 GLY HA2 1 99 ARG QD 0.000 . 6.300 4.459 3.168 5.310 . 0 0 "[ . 1 . 2]" 1 1747 1 90 GLY HA2 1 99 ARG HA 0.000 . 2.700 2.741 2.719 2.764 0.064 14 0 "[ . 1 . 2]" 1 1748 1 90 GLY HA2 1 98 ILE MG 0.000 . 6.300 4.745 4.644 4.826 . 0 0 "[ . 1 . 2]" 1 1749 1 80 VAL HB 1 90 GLY H 0.000 . 2.700 2.404 2.097 2.694 . 0 0 "[ . 1 . 2]" 1 1750 1 90 GLY HA3 1 98 ILE MG 0.000 . 6.300 4.774 4.702 4.850 . 0 0 "[ . 1 . 2]" 1 1751 1 90 GLY HA3 1 99 ARG QD 0.000 . 6.300 2.939 1.790 3.777 . 0 0 "[ . 1 . 2]" 1 1752 1 45 ALA MB 1 90 GLY HA2 0.000 . 3.500 2.600 2.489 2.759 . 0 0 "[ . 1 . 2]" 1 1753 1 45 ALA HA 1 90 GLY H 0.000 . 5.500 4.648 4.491 4.831 . 0 0 "[ . 1 . 2]" 1 1754 1 80 VAL MG1 1 90 GLY H 0.000 . 5.000 3.120 2.533 3.473 . 0 0 "[ . 1 . 2]" 1 1755 1 44 LEU QD 1 91 ILE MD 0.000 . 5.500 2.914 2.694 3.282 . 0 0 "[ . 1 . 2]" 1 1756 1 91 ILE MG 1 98 ILE MD 0.000 . 5.800 3.820 3.710 3.897 . 0 0 "[ . 1 . 2]" 1 1757 1 45 ALA MB 1 91 ILE MG 0.000 . 4.300 3.038 3.018 3.058 . 0 0 "[ . 1 . 2]" 1 1758 1 79 PHE HB3 1 91 ILE HA 0.000 . 5.500 4.766 4.743 4.818 . 0 0 "[ . 1 . 2]" 1 1759 1 91 ILE H 1 99 ARG HA 0.000 . 4.200 3.084 3.035 3.192 . 0 0 "[ . 1 . 2]" 1 1760 1 44 LEU HB2 1 91 ILE MG 0.000 . 5.000 1.804 1.775 1.828 . 0 0 "[ . 1 . 2]" 1 1761 1 79 PHE HA 1 91 ILE HB 0.000 . 3.200 3.269 3.253 3.284 0.084 3 0 "[ . 1 . 2]" 1 1762 1 79 PHE HA 1 91 ILE QG 0.000 . 4.000 2.297 2.140 2.438 . 0 0 "[ . 1 . 2]" 1 1763 1 79 PHE HB2 1 91 ILE HA 0.000 . 5.500 5.539 5.526 5.560 0.060 1 0 "[ . 1 . 2]" 1 1764 1 45 ALA HA 1 91 ILE H 0.000 . 4.200 2.700 2.622 2.805 . 0 0 "[ . 1 . 2]" 1 1765 1 78 THR MG 1 91 ILE HA 0.000 . 6.300 4.549 4.484 4.649 . 0 0 "[ . 1 . 2]" 1 1766 1 45 ALA MB 1 91 ILE H 0.000 . 6.300 3.520 3.470 3.596 . 0 0 "[ . 1 . 2]" 1 1767 1 91 ILE H 1 98 ILE HB 0.000 . 4.200 3.846 3.706 3.926 . 0 0 "[ . 1 . 2]" 1 1768 1 91 ILE MG 1 98 ILE HB 0.000 . 3.500 2.536 2.450 2.613 . 0 0 "[ . 1 . 2]" 1 1769 1 78 THR HA 1 91 ILE QG 0.000 . 6.300 4.612 4.550 4.698 . 0 0 "[ . 1 . 2]" 1 1770 1 77 ALA MB 1 91 ILE MD 0.000 . 5.800 2.813 2.617 2.974 . 0 0 "[ . 1 . 2]" 1 1771 1 79 PHE HA 1 91 ILE HA 0.000 . 2.700 2.615 2.573 2.662 . 0 0 "[ . 1 . 2]" 1 1772 1 44 LEU QD 1 91 ILE MG 0.000 . 5.000 2.168 1.987 2.302 . 0 0 "[ . 1 . 2]" 1 1773 1 91 ILE H 1 98 ILE MG 0.000 . 6.300 4.237 4.182 4.288 . 0 0 "[ . 1 . 2]" 1 1774 1 91 ILE MG 1 98 ILE MG 0.000 . 4.800 3.361 3.351 3.370 . 0 0 "[ . 1 . 2]" 1 1775 1 92 ASN HA 1 97 MET HA 0.000 . 2.200 2.289 2.268 2.312 0.112 4 0 "[ . 1 . 2]" 1 1776 1 80 VAL MG2 1 92 ASN H 0.000 . 5.000 3.173 2.960 3.460 . 0 0 "[ . 1 . 2]" 1 1777 1 78 THR HB 1 92 ASN HD22 0.000 . 5.500 5.131 4.851 5.198 . 0 0 "[ . 1 . 2]" 1 1778 1 92 ASN HA 1 97 MET QG 0.000 . 6.300 2.799 2.718 2.890 . 0 0 "[ . 1 . 2]" 1 1779 1 80 VAL MG2 1 92 ASN HD21 0.000 . 4.000 2.431 2.262 2.849 . 0 0 "[ . 1 . 2]" 1 1780 1 92 ASN HD21 1 97 MET QG 0.000 . 6.300 5.509 5.470 5.569 . 0 0 "[ . 1 . 2]" 1 1781 1 78 THR HB 1 92 ASN HA 0.000 . 5.500 5.260 5.136 5.433 . 0 0 "[ . 1 . 2]" 1 1782 1 78 THR HB 1 92 ASN HD21 0.000 . 4.200 3.588 3.253 3.661 . 0 0 "[ . 1 . 2]" 1 1783 1 78 THR MG 1 92 ASN HD22 0.000 . 5.000 4.202 4.199 4.206 . 0 0 "[ . 1 . 2]" 1 1784 1 92 ASN HD22 1 97 MET QG 0.000 . 6.300 5.646 5.638 5.653 . 0 0 "[ . 1 . 2]" 1 1785 1 78 THR MG 1 92 ASN H 0.000 . 6.300 3.817 3.755 3.965 . 0 0 "[ . 1 . 2]" 1 1786 1 92 ASN HA 1 97 MET HB3 0.000 . 5.500 4.128 4.070 4.243 . 0 0 "[ . 1 . 2]" 1 1787 1 77 ALA MB 1 92 ASN H 0.000 . 5.000 4.047 3.977 4.088 . 0 0 "[ . 1 . 2]" 1 1788 1 80 VAL MG2 1 92 ASN QB 0.000 . 5.800 3.602 3.468 3.824 . 0 0 "[ . 1 . 2]" 1 1789 1 78 THR MG 1 92 ASN HD21 0.000 . 6.300 3.045 3.017 3.101 . 0 0 "[ . 1 . 2]" 1 1790 1 80 VAL MG2 1 92 ASN HD22 0.000 . 4.000 1.902 1.786 2.390 . 0 0 "[ . 1 . 2]" 1 1791 1 78 THR MG 1 92 ASN QB 0.000 . 5.800 3.535 3.445 3.722 . 0 0 "[ . 1 . 2]" 1 1792 1 78 THR HB 1 92 ASN H 0.000 . 4.200 3.362 3.239 3.542 . 0 0 "[ . 1 . 2]" 1 1793 1 78 THR HB 1 92 ASN QB 0.000 . 3.500 2.726 2.615 2.851 . 0 0 "[ . 1 . 2]" 1 1794 1 79 PHE HA 1 92 ASN H 0.000 . 4.200 3.710 3.641 3.758 . 0 0 "[ . 1 . 2]" 1 1795 1 72 VAL MG1 1 92 ASN H 0.000 . 6.300 5.262 5.195 5.280 . 0 0 "[ . 1 . 2]" 1 1796 1 75 LEU QD 1 93 ILE MG 0.000 . 6.500 3.427 3.259 3.537 . 0 0 "[ . 1 . 2]" 1 1797 1 75 LEU QB 1 93 ILE MG 0.000 . 5.800 4.114 4.036 4.234 . 0 0 "[ . 1 . 2]" 1 1798 1 77 ALA MB 1 93 ILE HB 0.000 . 3.500 1.710 1.694 1.755 . 0 0 "[ . 1 . 2]" 1 1799 1 75 LEU QD 1 93 ILE MD 0.000 . 5.000 1.698 1.620 1.823 . 0 0 "[ . 1 . 2]" 1 1800 1 75 LEU HB2 1 93 ILE HB 0.000 . 4.200 4.248 4.122 4.293 0.093 10 0 "[ . 1 . 2]" 1 1801 1 77 ALA MB 1 93 ILE H 0.000 . 6.300 4.236 3.827 4.298 . 0 0 "[ . 1 . 2]" 1 1802 1 77 ALA HA 1 93 ILE HB 0.000 . 4.200 3.165 3.067 3.954 . 0 0 "[ . 1 . 2]" 1 1803 1 77 ALA MB 1 94 ASP H 0.000 . 5.000 4.099 2.872 4.217 . 0 0 "[ . 1 . 2]" 1 1804 1 76 HIS QB 1 94 ASP H 0.000 . 6.300 5.539 5.121 5.631 . 0 0 "[ . 1 . 2]" 1 1805 1 77 ALA HA 1 94 ASP H 0.000 . 4.200 3.864 3.447 3.947 . 0 0 "[ . 1 . 2]" 1 1806 1 78 THR H 1 94 ASP H 0.000 . 5.500 5.311 5.254 5.353 . 0 0 "[ . 1 . 2]" 1 1807 1 75 LEU QD 1 96 ARG HD3 0.000 . 5.700 3.581 3.404 4.120 . 0 0 "[ . 1 . 2]" 1 1808 1 75 LEU QD 1 96 ARG H 0.000 . 7.000 5.151 4.004 5.231 . 0 0 "[ . 1 . 2]" 1 1809 1 75 LEU QD 1 96 ARG HD2 0.000 . 5.700 4.247 4.231 4.256 . 0 0 "[ . 1 . 2]" 1 1810 1 44 LEU HB3 1 96 ARG HE 0.000 . 5.500 5.553 5.539 5.577 0.077 11 0 "[ . 1 . 2]" 1 1811 1 92 ASN HA 1 97 MET H 0.000 . 5.500 5.121 5.094 5.146 . 0 0 "[ . 1 . 2]" 1 1812 1 92 ASN QB 1 97 MET HA 0.000 . 5.000 3.816 3.765 3.858 . 0 0 "[ . 1 . 2]" 1 1813 1 97 MET H 1 140 GLU HG2 0.000 . 5.500 5.134 5.010 5.246 . 0 0 "[ . 1 . 2]" 1 1814 1 97 MET H 1 141 GLY QA 0.000 . 6.300 4.113 4.040 4.252 . 0 0 "[ . 1 . 2]" 1 1815 1 97 MET H 1 140 GLU HG3 0.000 . 5.500 3.705 3.532 3.832 . 0 0 "[ . 1 . 2]" 1 1816 1 44 LEU MD2 1 98 ILE MD 0.000 . 4.800 3.017 2.919 3.112 . 0 0 "[ . 1 . 2]" 1 1817 1 91 ILE H 1 98 ILE H 0.000 . 4.200 3.590 3.545 3.634 . 0 0 "[ . 1 . 2]" 1 1818 1 90 GLY HA3 1 98 ILE H 0.000 . 5.500 5.366 5.308 5.462 . 0 0 "[ . 1 . 2]" 1 1819 1 91 ILE HB 1 98 ILE H 0.000 . 5.500 5.585 5.566 5.604 0.104 3 0 "[ . 1 . 2]" 1 1820 1 92 ASN QB 1 98 ILE H 0.000 . 6.300 5.091 5.008 5.257 . 0 0 "[ . 1 . 2]" 1 1821 1 92 ASN HA 1 98 ILE H 0.000 . 4.200 3.321 3.275 3.393 . 0 0 "[ . 1 . 2]" 1 1822 1 44 LEU MD1 1 98 ILE MD 0.000 . 4.800 1.671 1.609 1.708 . 0 0 "[ . 1 . 2]" 1 1823 1 41 ALA MB 1 98 ILE MD 0.000 . 5.800 1.614 1.573 1.651 . 0 0 "[ . 1 . 2]" 1 1824 1 45 ALA MB 1 98 ILE HB 0.000 . 6.300 3.311 3.200 3.422 . 0 0 "[ . 1 . 2]" 1 1825 1 91 ILE MG 1 98 ILE H 0.000 . 4.000 2.739 2.657 2.925 . 0 0 "[ . 1 . 2]" 1 1826 1 99 ARG QB 1 139 VAL MG2 0.000 . 4.800 2.186 2.091 2.216 . 0 0 "[ . 1 . 2]" 1 1827 1 45 ALA MB 1 99 ARG H 0.000 . 6.300 3.635 3.482 3.819 . 0 0 "[ . 1 . 2]" 1 1828 1 99 ARG H 1 139 VAL HB 0.000 . 4.200 4.259 4.246 4.270 0.070 19 0 "[ . 1 . 2]" 1 1829 1 45 ALA MB 1 99 ARG HA 0.000 . 6.300 2.746 2.659 2.838 . 0 0 "[ . 1 . 2]" 1 1830 1 99 ARG H 1 106 ILE MD 0.000 . 6.300 4.736 4.670 4.944 . 0 0 "[ . 1 . 2]" 1 1831 1 90 GLY HA3 1 99 ARG HA 0.000 . 2.200 1.863 1.848 1.904 . 0 0 "[ . 1 . 2]" 1 1832 1 99 ARG H 1 140 GLU HA 0.000 . 4.200 4.015 3.986 4.029 . 0 0 "[ . 1 . 2]" 1 1833 1 99 ARG H 1 139 VAL MG2 0.000 . 5.000 1.935 1.856 2.008 . 0 0 "[ . 1 . 2]" 1 1834 1 99 ARG H 1 139 VAL MG1 0.000 . 6.300 4.614 4.583 4.649 . 0 0 "[ . 1 . 2]" 1 1835 1 99 ARG H 1 140 GLU QB 0.000 . 6.300 4.995 4.967 5.022 . 0 0 "[ . 1 . 2]" 1 1836 1 90 GLY HA3 1 99 ARG H 0.000 . 5.500 4.748 4.719 4.776 . 0 0 "[ . 1 . 2]" 1 1837 1 99 ARG QB 1 139 VAL MG1 0.000 . 5.800 4.292 4.169 4.316 . 0 0 "[ . 1 . 2]" 1 1838 1 100 LYS H 1 139 VAL QG 0.000 . 7.000 4.502 4.455 4.540 . 0 0 "[ . 1 . 2]" 1 1839 1 90 GLY QA 1 100 LYS H 0.000 . 5.000 2.769 2.721 2.817 . 0 0 "[ . 1 . 2]" 1 1840 1 100 LYS HB3 1 138 VAL HA 0.000 . 4.200 3.640 3.452 3.738 . 0 0 "[ . 1 . 2]" 1 1841 1 100 LYS HA 1 106 ILE MD 0.000 . 4.000 2.727 2.534 2.917 . 0 0 "[ . 1 . 2]" 1 1842 1 88 MET QB 1 100 LYS H 0.000 . 6.300 4.115 4.018 4.539 . 0 0 "[ . 1 . 2]" 1 1843 1 100 LYS QD 1 136 LEU QD 0.000 . 5.500 2.645 2.426 3.106 . 0 0 "[ . 1 . 2]" 1 1844 1 100 LYS H 1 138 VAL MG2 0.000 . 6.300 4.277 4.225 4.326 . 0 0 "[ . 1 . 2]" 1 1845 1 100 LYS H 1 138 VAL HA 0.000 . 5.500 4.574 4.525 4.593 . 0 0 "[ . 1 . 2]" 1 1846 1 100 LYS H 1 106 ILE MD 0.000 . 6.300 3.370 3.319 3.419 . 0 0 "[ . 1 . 2]" 1 1847 1 100 LYS HA 1 138 VAL HA 0.000 . 2.200 2.193 2.126 2.219 0.019 5 0 "[ . 1 . 2]" 1 1848 1 100 LYS HA 1 137 VAL HA 0.000 . 5.500 5.301 5.273 5.340 . 0 0 "[ . 1 . 2]" 1 1849 1 89 SER HA 1 100 LYS H 0.000 . 5.500 4.791 4.776 4.809 . 0 0 "[ . 1 . 2]" 1 1850 1 88 MET ME 1 100 LYS H 0.000 . 6.300 5.228 5.060 5.256 . 0 0 "[ . 1 . 2]" 1 1851 1 88 MET HA 1 100 LYS H 0.000 . 5.500 5.306 5.252 5.389 . 0 0 "[ . 1 . 2]" 1 1852 1 100 LYS HB2 1 138 VAL MG2 0.000 . 3.500 2.214 2.094 2.415 . 0 0 "[ . 1 . 2]" 1 1853 1 100 LYS HB2 1 138 VAL HA 0.000 . 5.500 3.895 3.811 4.089 . 0 0 "[ . 1 . 2]" 1 1854 1 100 LYS HA 1 138 VAL QG 0.000 . 4.200 2.409 2.343 2.483 . 0 0 "[ . 1 . 2]" 1 1855 1 100 LYS HB3 1 138 VAL MG2 0.000 . 3.500 1.968 1.824 2.078 . 0 0 "[ . 1 . 2]" 1 1856 1 45 ALA MB 1 100 LYS H 0.000 . 5.000 2.735 2.631 2.827 . 0 0 "[ . 1 . 2]" 1 1857 1 101 GLY HA3 1 106 ILE MD 0.000 . 4.000 1.991 1.930 2.050 . 0 0 "[ . 1 . 2]" 1 1858 1 88 MET QB 1 101 GLY QA 0.000 . 4.800 1.869 1.797 2.550 . 0 0 "[ . 1 . 2]" 1 1859 1 101 GLY QA 1 106 ILE MG 0.000 . 5.800 4.320 4.249 4.330 . 0 0 "[ . 1 . 2]" 1 1860 1 101 GLY H 1 138 VAL MG2 0.000 . 5.000 3.663 3.504 3.758 . 0 0 "[ . 1 . 2]" 1 1861 1 101 GLY H 1 106 ILE QG 0.000 . 4.000 1.858 1.832 1.996 . 0 0 "[ . 1 . 2]" 1 1862 1 101 GLY QA 1 136 LEU QD 0.000 . 5.500 3.661 3.648 3.669 . 0 0 "[ . 1 . 2]" 1 1863 1 101 GLY H 1 138 VAL HA 0.000 . 4.200 3.757 3.704 3.823 . 0 0 "[ . 1 . 2]" 1 1864 1 101 GLY QA 1 106 ILE QG 0.000 . 4.800 2.152 2.012 2.200 . 0 0 "[ . 1 . 2]" 1 1865 1 101 GLY H 1 136 LEU QD 0.000 . 7.000 4.183 4.034 4.256 . 0 0 "[ . 1 . 2]" 1 1866 1 101 GLY H 1 137 VAL HB 0.000 . 4.200 3.807 3.663 3.939 . 0 0 "[ . 1 . 2]" 1 1867 1 101 GLY H 1 106 ILE MD 0.000 . 4.000 2.254 2.073 2.726 . 0 0 "[ . 1 . 2]" 1 1868 1 88 MET QG 1 101 GLY QA 0.000 . 5.800 3.672 3.276 3.763 . 0 0 "[ . 1 . 2]" 1 1869 1 101 GLY HA2 1 106 ILE MD 0.000 . 4.000 3.307 3.226 3.340 . 0 0 "[ . 1 . 2]" 1 1870 1 88 MET HA 1 102 SER H 0.000 . 4.200 3.573 3.462 3.721 . 0 0 "[ . 1 . 2]" 1 1871 1 88 MET QG 1 102 SER H 0.000 . 5.000 4.458 3.914 4.502 . 0 0 "[ . 1 . 2]" 1 1872 1 87 ARG QB 1 102 SER H 0.000 . 5.000 3.583 3.449 3.805 . 0 0 "[ . 1 . 2]" 1 1873 1 87 ARG QD 1 102 SER H 0.000 . 6.300 5.367 5.227 5.623 . 0 0 "[ . 1 . 2]" 1 1874 1 102 SER H 1 136 LEU QD 0.000 . 5.700 3.934 3.849 3.997 . 0 0 "[ . 1 . 2]" 1 1875 1 88 MET QB 1 102 SER H 0.000 . 5.000 3.062 2.845 4.465 . 0 0 "[ . 1 . 2]" 1 1876 1 103 VAL H 1 147 VAL MG1 0.000 . 6.300 5.308 5.282 5.328 . 0 0 "[ . 1 . 2]" 1 1877 1 103 VAL HA 1 137 VAL HB 0.000 . 4.200 2.775 2.575 3.102 . 0 0 "[ . 1 . 2]" 1 1878 1 103 VAL H 1 135 PRO QG 0.000 . 6.300 4.017 3.896 4.197 . 0 0 "[ . 1 . 2]" 1 1879 1 103 VAL H 1 136 LEU HA 0.000 . 5.500 3.833 3.650 3.940 . 0 0 "[ . 1 . 2]" 1 1880 1 103 VAL H 1 136 LEU QD 0.000 . 5.700 4.054 3.878 4.168 . 0 0 "[ . 1 . 2]" 1 1881 1 103 VAL H 1 137 VAL MG2 0.000 . 6.300 3.540 3.210 3.648 . 0 0 "[ . 1 . 2]" 1 1882 1 88 MET QG 1 105 ALA HA 0.000 . 6.300 4.439 3.856 4.604 . 0 0 "[ . 1 . 2]" 1 1883 1 87 ARG QB 1 105 ALA H 0.000 . 6.300 4.413 4.237 4.595 . 0 0 "[ . 1 . 2]" 1 1884 1 101 GLY QA 1 106 ILE H 0.000 . 6.300 3.516 3.441 3.588 . 0 0 "[ . 1 . 2]" 1 1885 1 88 MET QG 1 106 ILE H 0.000 . 6.300 5.167 4.116 5.355 . 0 0 "[ . 1 . 2]" 1 1886 1 106 ILE HB 1 137 VAL HB 0.000 . 3.200 2.204 2.060 2.289 . 0 0 "[ . 1 . 2]" 1 1887 1 106 ILE HB 1 137 VAL MG1 0.000 . 5.000 3.015 2.967 3.167 . 0 0 "[ . 1 . 2]" 1 1888 1 106 ILE H 1 137 VAL MG1 0.000 . 6.300 5.070 5.022 5.154 . 0 0 "[ . 1 . 2]" 1 1889 1 88 MET ME 1 106 ILE MD 0.000 . 5.800 1.688 1.654 1.746 . 0 0 "[ . 1 . 2]" 1 1890 1 88 MET ME 1 106 ILE H 0.000 . 6.300 2.853 2.726 2.890 . 0 0 "[ . 1 . 2]" 1 1891 1 106 ILE MD 1 139 VAL MG1 0.000 . 5.800 3.638 3.486 3.903 . 0 0 "[ . 1 . 2]" 1 1892 1 106 ILE H 1 137 VAL HB 0.000 . 5.500 4.225 4.144 4.282 . 0 0 "[ . 1 . 2]" 1 1893 1 106 ILE HB 1 137 VAL MG2 0.000 . 5.000 3.226 2.859 3.390 . 0 0 "[ . 1 . 2]" 1 1894 1 106 ILE MD 1 139 VAL MG2 0.000 . 5.800 2.816 2.564 3.070 . 0 0 "[ . 1 . 2]" 1 1895 1 107 ARG QG 1 117 PHE HE2 0.000 . 5.000 2.149 2.042 2.290 . 0 0 "[ . 1 . 2]" 1 1896 1 107 ARG QG 1 117 PHE HD1 0.000 . 6.300 5.021 4.791 5.168 . 0 0 "[ . 1 . 2]" 1 1897 1 107 ARG H 1 144 VAL MG2 0.000 . 6.300 5.243 5.142 5.274 . 0 0 "[ . 1 . 2]" 1 1898 1 88 MET ME 1 109 HIS H 0.000 . 5.000 3.508 2.889 3.660 . 0 0 "[ . 1 . 2]" 1 1899 1 88 MET ME 1 109 HIS HB2 0.000 . 4.000 2.573 1.872 2.710 . 0 0 "[ . 1 . 2]" 1 1900 1 88 MET ME 1 109 HIS HB3 0.000 . 4.000 2.839 2.301 2.961 . 0 0 "[ . 1 . 2]" 1 1901 1 110 VAL HA 1 142 SER HA 0.000 . 5.500 3.658 3.531 3.825 . 0 0 "[ . 1 . 2]" 1 1902 1 110 VAL MG1 1 143 ARG HA 0.000 . 5.000 2.534 2.285 2.766 . 0 0 "[ . 1 . 2]" 1 1903 1 110 VAL H 1 117 PHE HD2 0.000 . 5.500 4.395 4.327 4.480 . 0 0 "[ . 1 . 2]" 1 1904 1 110 VAL H 1 144 VAL MG2 0.000 . 6.300 4.808 4.668 4.940 . 0 0 "[ . 1 . 2]" 1 1905 1 110 VAL MG2 1 144 VAL MG2 0.000 . 4.300 1.877 1.751 2.010 . 0 0 "[ . 1 . 2]" 1 1906 1 110 VAL MG2 1 142 SER HA 0.000 . 5.000 4.163 4.047 4.178 . 0 0 "[ . 1 . 2]" 1 1907 1 110 VAL MG1 1 142 SER HA 0.000 . 5.000 4.174 4.164 4.183 . 0 0 "[ . 1 . 2]" 1 1908 1 113 ASN HB2 1 142 SER HB2 0.000 . 5.500 3.089 2.724 3.681 . 0 0 "[ . 1 . 2]" 1 1909 1 113 ASN H 1 142 SER HB3 0.000 . 5.500 5.456 5.282 5.521 0.021 16 0 "[ . 1 . 2]" 1 1910 1 113 ASN HB3 1 142 SER HB3 0.000 . 5.500 2.061 1.874 2.165 . 0 0 "[ . 1 . 2]" 1 1911 1 113 ASN HB2 1 142 SER HB3 0.000 . 4.200 3.627 3.453 3.731 . 0 0 "[ . 1 . 2]" 1 1912 1 113 ASN HB3 1 142 SER HB2 0.000 . 5.500 2.218 1.897 2.781 . 0 0 "[ . 1 . 2]" 1 1913 1 115 GLY H 1 142 SER HA 0.000 . 5.500 4.702 4.499 4.926 . 0 0 "[ . 1 . 2]" 1 1914 1 115 GLY HA2 1 142 SER HB2 0.000 . 4.200 3.230 3.119 3.354 . 0 0 "[ . 1 . 2]" 1 1915 1 110 VAL MG1 1 115 GLY H 0.000 . 5.000 3.191 3.113 3.252 . 0 0 "[ . 1 . 2]" 1 1916 1 110 VAL HB 1 115 GLY QA 0.000 . 6.300 5.318 5.202 5.390 . 0 0 "[ . 1 . 2]" 1 1917 1 110 VAL MG2 1 115 GLY H 0.000 . 6.300 5.113 5.059 5.159 . 0 0 "[ . 1 . 2]" 1 1918 1 110 VAL MG1 1 115 GLY QA 0.000 . 4.300 2.576 2.500 2.774 . 0 0 "[ . 1 . 2]" 1 1919 1 115 GLY H 1 142 SER HB3 0.000 . 5.500 4.338 4.221 4.441 . 0 0 "[ . 1 . 2]" 1 1920 1 110 VAL MG2 1 115 GLY QA 0.000 . 7.100 4.469 4.388 4.572 . 0 0 "[ . 1 . 2]" 1 1921 1 115 GLY HA3 1 142 SER HB2 0.000 . 4.200 2.098 1.992 2.212 . 0 0 "[ . 1 . 2]" 1 1922 1 110 VAL HA 1 115 GLY H 0.000 . 5.500 3.845 3.787 3.896 . 0 0 "[ . 1 . 2]" 1 1923 1 115 GLY H 1 142 SER HB2 0.000 . 4.200 3.012 2.613 3.568 . 0 0 "[ . 1 . 2]" 1 1924 1 116 HIS H 1 143 ARG HA 0.000 . 4.200 2.922 2.795 3.041 . 0 0 "[ . 1 . 2]" 1 1925 1 110 VAL MG1 1 116 HIS H 0.000 . 4.000 2.606 2.525 2.657 . 0 0 "[ . 1 . 2]" 1 1926 1 111 GLU QG 1 116 HIS HA 0.000 . 4.000 3.577 3.564 3.598 . 0 0 "[ . 1 . 2]" 1 1927 1 116 HIS H 1 144 VAL MG2 0.000 . 6.300 4.860 4.740 5.073 . 0 0 "[ . 1 . 2]" 1 1928 1 110 VAL HA 1 116 HIS HA 0.000 . 5.500 5.554 5.532 5.577 0.077 14 0 "[ . 1 . 2]" 1 1929 1 110 VAL HB 1 116 HIS H 0.000 . 5.500 5.465 5.344 5.517 0.017 3 0 "[ . 1 . 2]" 1 1930 1 110 VAL MG1 1 116 HIS HA 0.000 . 5.000 2.107 2.020 2.212 . 0 0 "[ . 1 . 2]" 1 1931 1 110 VAL MG2 1 116 HIS H 0.000 . 6.300 4.608 4.545 4.691 . 0 0 "[ . 1 . 2]" 1 1932 1 116 HIS H 1 142 SER HB2 0.000 . 5.500 4.435 4.266 4.651 . 0 0 "[ . 1 . 2]" 1 1933 1 110 VAL MG1 1 117 PHE H 0.000 . 5.000 2.954 2.761 3.008 . 0 0 "[ . 1 . 2]" 1 1934 1 107 ARG QG 1 117 PHE H 0.000 . 6.300 5.094 4.888 5.228 . 0 0 "[ . 1 . 2]" 1 1935 1 110 VAL MG2 1 117 PHE H 0.000 . 6.300 4.455 4.376 4.540 . 0 0 "[ . 1 . 2]" 1 1936 1 111 GLU HG3 1 117 PHE H 0.000 . 5.500 4.961 4.832 5.440 . 0 0 "[ . 1 . 2]" 1 1937 1 111 GLU HG2 1 117 PHE H 0.000 . 5.500 5.014 4.348 5.151 . 0 0 "[ . 1 . 2]" 1 1938 1 118 PRO HD3 1 144 VAL MG2 0.000 . 3.500 2.759 2.442 2.918 . 0 0 "[ . 1 . 2]" 1 1939 1 118 PRO HD3 1 144 VAL MG1 0.000 . 4.000 3.389 3.381 3.395 . 0 0 "[ . 1 . 2]" 1 1940 1 118 PRO HD2 1 144 VAL MG2 0.000 . 3.500 2.897 2.690 2.932 . 0 0 "[ . 1 . 2]" 1 1941 1 30 ALA MB 1 118 PRO QD 0.000 . 5.800 2.337 2.272 2.424 . 0 0 "[ . 1 . 2]" 1 1942 1 118 PRO HD2 1 144 VAL MG1 0.000 . 4.000 2.823 2.760 2.940 . 0 0 "[ . 1 . 2]" 1 1943 1 31 GLN HB3 1 119 THR H 0.000 . 5.500 5.546 5.535 5.556 0.056 10 0 "[ . 1 . 2]" 1 1944 1 31 GLN HB2 1 119 THR H 0.000 . 5.500 5.500 5.421 5.516 0.016 15 0 "[ . 1 . 2]" 1 1945 1 31 GLN QB 1 120 ASP H 0.000 . 6.300 4.604 4.528 4.647 . 0 0 "[ . 1 . 2]" 1 1946 1 30 ALA MB 1 121 VAL MG1 0.000 . 4.800 2.601 2.565 2.652 . 0 0 "[ . 1 . 2]" 1 1947 1 30 ALA MB 1 121 VAL MG2 0.000 . 4.300 3.011 3.002 3.029 . 0 0 "[ . 1 . 2]" 1 1948 1 30 ALA MB 1 121 VAL H 0.000 . 6.300 5.084 5.065 5.103 . 0 0 "[ . 1 . 2]" 1 1949 1 121 VAL MG2 1 146 GLY HA2 0.000 . 4.000 3.387 3.372 3.395 . 0 0 "[ . 1 . 2]" 1 1950 1 30 ALA MB 1 122 ASP H 0.000 . 6.300 5.372 5.359 5.383 . 0 0 "[ . 1 . 2]" 1 1951 1 122 ASP HA 1 147 VAL QG 0.000 . 4.700 3.442 3.367 3.489 . 0 0 "[ . 1 . 2]" 1 1952 1 117 PHE QB 1 122 ASP H 0.000 . 6.300 4.575 4.447 4.650 . 0 0 "[ . 1 . 2]" 1 1953 1 118 PRO QB 1 123 GLN H 0.000 . 6.300 5.633 5.613 5.652 . 0 0 "[ . 1 . 2]" 1 1954 1 28 ILE MG 1 124 LYS H 0.000 . 6.300 5.263 5.248 5.284 . 0 0 "[ . 1 . 2]" 1 1955 1 125 VAL HA 1 147 VAL MG1 0.000 . 3.000 2.536 2.519 2.546 . 0 0 "[ . 1 . 2]" 1 1956 1 125 VAL HA 1 135 PRO QG 0.000 . 4.000 3.104 3.008 3.198 . 0 0 "[ . 1 . 2]" 1 1957 1 125 VAL HA 1 135 PRO QB 0.000 . 5.000 1.993 1.950 2.071 . 0 0 "[ . 1 . 2]" 1 1958 1 125 VAL MG1 1 135 PRO QG 0.000 . 4.800 1.935 1.894 1.985 . 0 0 "[ . 1 . 2]" 1 1959 1 126 ASP H 1 147 VAL MG2 0.000 . 6.300 5.350 5.330 5.372 . 0 0 "[ . 1 . 2]" 1 1960 1 128 VAL MG2 1 149 ALA MB 0.000 . 4.800 1.671 1.606 1.751 . 0 0 "[ . 1 . 2]" 1 1961 1 128 VAL H 1 149 ALA MB 0.000 . 6.300 4.592 4.538 4.714 . 0 0 "[ . 1 . 2]" 1 1962 1 128 VAL H 1 135 PRO QG 0.000 . 6.300 4.198 4.112 4.316 . 0 0 "[ . 1 . 2]" 1 1963 1 129 ALA H 1 135 PRO QG 0.000 . 5.000 3.071 2.954 3.179 . 0 0 "[ . 1 . 2]" 1 1964 1 129 ALA H 1 135 PRO QD 0.000 . 6.300 3.378 3.308 3.461 . 0 0 "[ . 1 . 2]" 1 1965 1 128 VAL HA 1 133 ALA H 0.000 . 5.500 3.869 3.797 3.954 . 0 0 "[ . 1 . 2]" 1 1966 1 128 VAL MG1 1 133 ALA H 0.000 . 5.000 3.100 3.025 3.218 . 0 0 "[ . 1 . 2]" 1 1967 1 133 ALA HA 1 151 LYS QB 0.000 . 5.000 4.308 3.546 4.522 . 0 0 "[ . 1 . 2]" 1 1968 1 128 VAL MG2 1 133 ALA H 0.000 . 6.300 5.163 5.119 5.229 . 0 0 "[ . 1 . 2]" 1 1969 1 128 VAL MG1 1 134 THR H 0.000 . 4.000 3.034 2.924 3.099 . 0 0 "[ . 1 . 2]" 1 1970 1 134 THR H 1 150 LEU HG 0.000 . 5.500 4.246 4.075 5.198 . 0 0 "[ . 1 . 2]" 1 1971 1 134 THR H 1 150 LEU H 0.000 . 3.200 2.694 2.662 2.715 . 0 0 "[ . 1 . 2]" 1 1972 1 134 THR H 1 151 LYS HA 0.000 . 5.500 3.665 3.457 3.763 . 0 0 "[ . 1 . 2]" 1 1973 1 134 THR H 1 151 LYS QG 0.000 . 6.300 4.921 4.293 5.730 . 0 0 "[ . 1 . 2]" 1 1974 1 134 THR H 1 150 LEU HB3 0.000 . 4.200 4.260 4.244 4.323 0.123 8 0 "[ . 1 . 2]" 1 1975 1 134 THR H 1 150 LEU HB2 0.000 . 3.200 2.695 2.650 2.961 . 0 0 "[ . 1 . 2]" 1 1976 1 134 THR H 1 149 ALA HA 0.000 . 4.200 4.328 4.313 4.364 0.164 19 0 "[ . 1 . 2]" 1 1977 1 135 PRO QB 1 147 VAL QG 0.000 . 5.500 2.137 2.098 2.173 . 0 0 "[ . 1 . 2]" 1 1978 1 135 PRO HA 1 147 VAL MG1 0.000 . 3.000 2.559 2.541 2.608 . 0 0 "[ . 1 . 2]" 1 1979 1 128 VAL MG1 1 135 PRO HA 0.000 . 3.500 2.577 2.425 2.712 . 0 0 "[ . 1 . 2]" 1 1980 1 128 VAL MG2 1 135 PRO HA 0.000 . 5.000 3.586 3.392 3.742 . 0 0 "[ . 1 . 2]" 1 1981 1 135 PRO HA 1 149 ALA MB 0.000 . 5.000 3.480 3.441 3.601 . 0 0 "[ . 1 . 2]" 1 1982 1 125 VAL QG 1 135 PRO QB 0.000 . 5.500 1.619 1.608 1.626 . 0 0 "[ . 1 . 2]" 1 1983 1 136 LEU QB 1 150 LEU MD2 0.000 . 5.800 3.680 3.617 3.739 . 0 0 "[ . 1 . 2]" 1 1984 1 136 LEU H 1 147 VAL HA 0.000 . 5.500 4.729 4.672 4.874 . 0 0 "[ . 1 . 2]" 1 1985 1 136 LEU HG 1 150 LEU MD2 0.000 . 3.500 3.012 2.998 3.028 . 0 0 "[ . 1 . 2]" 1 1986 1 136 LEU QB 1 148 ILE MD 0.000 . 4.800 2.939 2.905 3.002 . 0 0 "[ . 1 . 2]" 1 1987 1 136 LEU H 1 148 ILE H 0.000 . 3.200 3.103 3.059 3.217 0.017 8 0 "[ . 1 . 2]" 1 1988 1 136 LEU H 1 149 ALA HA 0.000 . 4.200 3.335 3.291 3.454 . 0 0 "[ . 1 . 2]" 1 1989 1 136 LEU QB 1 148 ILE HB 0.000 . 3.500 2.031 1.974 2.194 . 0 0 "[ . 1 . 2]" 1 1990 1 136 LEU H 1 148 ILE HB 0.000 . 3.200 3.229 3.213 3.240 0.040 11 0 "[ . 1 . 2]" 1 1991 1 136 LEU H 1 148 ILE MG 0.000 . 6.300 4.048 3.986 4.125 . 0 0 "[ . 1 . 2]" 1 1992 1 136 LEU H 1 147 VAL MG1 0.000 . 4.000 2.819 2.730 2.975 . 0 0 "[ . 1 . 2]" 1 1993 1 136 LEU H 1 148 ILE HA 0.000 . 5.500 4.738 4.705 4.842 . 0 0 "[ . 1 . 2]" 1 1994 1 101 GLY QA 1 137 VAL H 0.000 . 6.300 4.336 4.270 4.362 . 0 0 "[ . 1 . 2]" 1 1995 1 137 VAL H 1 147 VAL MG1 0.000 . 6.300 3.999 3.968 4.060 . 0 0 "[ . 1 . 2]" 1 1996 1 137 VAL MG1 1 144 VAL MG1 0.000 . 4.300 1.686 1.646 1.708 . 0 0 "[ . 1 . 2]" 1 1997 1 102 SER HA 1 137 VAL H 0.000 . 5.500 3.859 3.811 3.923 . 0 0 "[ . 1 . 2]" 1 1998 1 137 VAL H 1 148 ILE HB 0.000 . 5.500 5.577 5.567 5.585 0.085 12 0 "[ . 1 . 2]" 1 1999 1 106 ILE QG 1 137 VAL H 0.000 . 5.000 2.821 2.656 3.037 . 0 0 "[ . 1 . 2]" 1 2000 1 100 LYS HA 1 137 VAL H 0.000 . 5.500 4.603 4.521 4.652 . 0 0 "[ . 1 . 2]" 1 2001 1 103 VAL HA 1 137 VAL H 0.000 . 5.500 3.618 3.447 3.735 . 0 0 "[ . 1 . 2]" 1 2002 1 137 VAL H 1 147 VAL HA 0.000 . 5.500 4.615 4.572 4.671 . 0 0 "[ . 1 . 2]" 1 2003 1 137 VAL H 1 148 ILE H 0.000 . 5.500 4.652 4.632 4.670 . 0 0 "[ . 1 . 2]" 1 2004 1 106 ILE MG 1 137 VAL MG1 0.000 . 4.300 1.743 1.705 1.776 . 0 0 "[ . 1 . 2]" 1 2005 1 103 VAL MG2 1 137 VAL H 0.000 . 6.300 3.105 2.872 3.271 . 0 0 "[ . 1 . 2]" 1 2006 1 101 GLY H 1 137 VAL H 0.000 . 3.200 3.063 2.987 3.114 . 0 0 "[ . 1 . 2]" 1 2007 1 100 LYS HA 1 138 VAL H 0.000 . 5.500 4.581 4.549 4.614 . 0 0 "[ . 1 . 2]" 1 2008 1 38 LEU QD 1 138 VAL HB 0.000 . 4.700 2.408 2.281 2.526 . 0 0 "[ . 1 . 2]" 1 2009 1 138 VAL MG1 1 145 LEU QD 0.000 . 5.500 1.606 1.552 1.640 . 0 0 "[ . 1 . 2]" 1 2010 1 138 VAL H 1 148 ILE H 0.000 . 5.500 4.178 4.147 4.227 . 0 0 "[ . 1 . 2]" 1 2011 1 138 VAL HB 1 145 LEU HB2 0.000 . 5.500 5.265 5.217 5.496 . 0 0 "[ . 1 . 2]" 1 2012 1 138 VAL H 1 146 GLY QA 0.000 . 6.300 4.310 4.286 4.354 . 0 0 "[ . 1 . 2]" 1 2013 1 138 VAL H 1 146 GLY H 0.000 . 3.200 3.316 3.299 3.348 0.148 8 0 "[ . 1 . 2]" 1 2014 1 38 LEU HG 1 138 VAL HB 0.000 . 5.500 5.015 4.880 5.085 . 0 0 "[ . 1 . 2]" 1 2015 1 38 LEU HB2 1 138 VAL HB 0.000 . 5.500 5.472 5.319 5.529 0.029 4 0 "[ . 1 . 2]" 1 2016 1 138 VAL H 1 145 LEU H 0.000 . 5.500 4.360 4.320 4.384 . 0 0 "[ . 1 . 2]" 1 2017 1 138 VAL H 1 148 ILE QG 0.000 . 6.300 4.058 4.016 4.132 . 0 0 "[ . 1 . 2]" 1 2018 1 138 VAL H 1 144 VAL MG1 0.000 . 6.300 3.134 3.006 3.222 . 0 0 "[ . 1 . 2]" 1 2019 1 106 ILE MG 1 138 VAL H 0.000 . 6.300 4.158 4.107 4.237 . 0 0 "[ . 1 . 2]" 1 2020 1 138 VAL H 1 147 VAL HA 0.000 . 4.200 2.977 2.921 3.050 . 0 0 "[ . 1 . 2]" 1 2021 1 99 ARG QB 1 139 VAL H 0.000 . 6.300 3.566 3.455 3.615 . 0 0 "[ . 1 . 2]" 1 2022 1 99 ARG HA 1 139 VAL H 0.000 . 5.500 4.704 4.661 4.721 . 0 0 "[ . 1 . 2]" 1 2023 1 106 ILE MG 1 139 VAL MG1 0.000 . 4.300 1.942 1.887 2.027 . 0 0 "[ . 1 . 2]" 1 2024 1 139 VAL HA 1 145 LEU HB2 0.000 . 5.500 5.011 4.996 5.039 . 0 0 "[ . 1 . 2]" 1 2025 1 139 VAL HB 1 144 VAL HA 0.000 . 3.200 3.297 3.280 3.308 0.108 10 0 "[ . 1 . 2]" 1 2026 1 139 VAL HA 1 145 LEU HB3 0.000 . 4.200 4.022 3.953 4.096 . 0 0 "[ . 1 . 2]" 1 2027 1 98 ILE HA 1 139 VAL H 0.000 . 4.200 4.246 4.222 4.274 0.074 3 0 "[ . 1 . 2]" 1 2028 1 139 VAL H 1 144 VAL HA 0.000 . 5.500 4.427 4.390 4.470 . 0 0 "[ . 1 . 2]" 1 2029 1 139 VAL H 1 145 LEU H 0.000 . 5.500 4.345 4.321 4.364 . 0 0 "[ . 1 . 2]" 1 2030 1 106 ILE MD 1 139 VAL H 0.000 . 6.300 4.091 3.983 4.360 . 0 0 "[ . 1 . 2]" 1 2031 1 99 ARG H 1 139 VAL H 0.000 . 3.200 2.535 2.518 2.548 . 0 0 "[ . 1 . 2]" 1 2032 1 100 LYS HA 1 139 VAL H 0.000 . 4.200 3.779 3.704 3.811 . 0 0 "[ . 1 . 2]" 1 2033 1 45 ALA MB 1 139 VAL H 0.000 . 6.300 4.381 4.292 4.506 . 0 0 "[ . 1 . 2]" 1 2034 1 101 GLY H 1 139 VAL H 0.000 . 5.500 5.347 5.271 5.531 0.031 3 0 "[ . 1 . 2]" 1 2035 1 139 VAL HA 1 145 LEU HA 0.000 . 5.500 4.598 4.567 4.621 . 0 0 "[ . 1 . 2]" 1 2036 1 99 ARG QG 1 139 VAL H 0.000 . 6.300 4.854 4.698 5.014 . 0 0 "[ . 1 . 2]" 1 2037 1 139 VAL H 1 145 LEU QB 0.000 . 6.300 5.669 5.653 5.686 . 0 0 "[ . 1 . 2]" 1 2038 1 98 ILE QG 1 139 VAL H 0.000 . 6.300 5.282 5.220 5.398 . 0 0 "[ . 1 . 2]" 1 2039 1 100 LYS QB 1 139 VAL H 0.000 . 6.300 4.680 4.598 4.733 . 0 0 "[ . 1 . 2]" 1 2040 1 140 GLU QB 1 145 LEU HG 0.000 . 3.500 3.244 3.228 3.253 . 0 0 "[ . 1 . 2]" 1 2041 1 98 ILE HA 1 140 GLU H 0.000 . 5.500 4.588 4.566 4.606 . 0 0 "[ . 1 . 2]" 1 2042 1 98 ILE QG 1 140 GLU H 0.000 . 6.300 4.408 4.376 4.530 . 0 0 "[ . 1 . 2]" 1 2043 1 41 ALA MB 1 140 GLU HA 0.000 . 6.300 4.486 4.406 4.572 . 0 0 "[ . 1 . 2]" 1 2044 1 98 ILE MD 1 140 GLU HA 0.000 . 4.000 3.391 3.387 3.397 . 0 0 "[ . 1 . 2]" 1 2045 1 98 ILE MG 1 140 GLU HA 0.000 . 5.000 3.281 3.228 3.346 . 0 0 "[ . 1 . 2]" 1 2046 1 98 ILE MG 1 140 GLU H 0.000 . 6.300 4.487 4.414 4.558 . 0 0 "[ . 1 . 2]" 1 2047 1 140 GLU H 1 145 LEU HB2 0.000 . 5.500 5.278 5.206 5.405 . 0 0 "[ . 1 . 2]" 1 2048 1 98 ILE HA 1 140 GLU HA 0.000 . 2.200 2.303 2.291 2.317 0.117 16 0 "[ . 1 . 2]" 1 2049 1 140 GLU H 1 145 LEU HG 0.000 . 4.200 3.304 3.234 3.347 . 0 0 "[ . 1 . 2]" 1 2050 1 140 GLU H 1 145 LEU H 0.000 . 4.200 3.455 3.410 3.538 . 0 0 "[ . 1 . 2]" 1 2051 1 140 GLU QB 1 145 LEU QD 0.000 . 6.500 1.765 1.728 1.822 . 0 0 "[ . 1 . 2]" 1 2052 1 98 ILE MD 1 140 GLU H 0.000 . 6.300 4.913 4.873 4.943 . 0 0 "[ . 1 . 2]" 1 2053 1 98 ILE QG 1 140 GLU HA 0.000 . 4.000 1.871 1.859 1.956 . 0 0 "[ . 1 . 2]" 1 2054 1 96 ARG HA 1 141 GLY QA 0.000 . 6.300 5.412 5.304 5.616 . 0 0 "[ . 1 . 2]" 1 2055 1 97 MET QB 1 141 GLY H 0.000 . 5.000 3.071 3.022 3.100 . 0 0 "[ . 1 . 2]" 1 2056 1 98 ILE MD 1 141 GLY H 0.000 . 6.300 4.796 4.756 4.851 . 0 0 "[ . 1 . 2]" 1 2057 1 99 ARG H 1 141 GLY H 0.000 . 5.500 5.452 5.353 5.511 0.011 11 0 "[ . 1 . 2]" 1 2058 1 97 MET HB3 1 141 GLY QA 0.000 . 5.000 4.331 4.246 4.405 . 0 0 "[ . 1 . 2]" 1 2059 1 97 MET H 1 141 GLY H 0.000 . 3.200 3.181 3.138 3.219 0.019 8 0 "[ . 1 . 2]" 1 2060 1 97 MET HB2 1 141 GLY QA 0.000 . 3.500 3.141 3.131 3.148 . 0 0 "[ . 1 . 2]" 1 2061 1 98 ILE HA 1 141 GLY H 0.000 . 4.200 3.550 3.494 3.586 . 0 0 "[ . 1 . 2]" 1 2062 1 115 GLY QA 1 142 SER HB3 0.000 . 4.000 3.621 3.612 3.632 . 0 0 "[ . 1 . 2]" 1 2063 1 113 ASN HD21 1 142 SER HA 0.000 . 4.200 4.122 3.903 4.204 0.004 18 0 "[ . 1 . 2]" 1 2064 1 113 ASN HB2 1 142 SER HA 0.000 . 4.200 3.076 2.898 3.379 . 0 0 "[ . 1 . 2]" 1 2065 1 33 VAL MG2 1 143 ARG HE 0.000 . 5.000 2.994 2.481 4.190 . 0 0 "[ . 1 . 2]" 1 2066 1 110 VAL MG2 1 143 ARG H 0.000 . 6.300 4.435 4.349 4.497 . 0 0 "[ . 1 . 2]" 1 2067 1 118 PRO QD 1 144 VAL HB 0.000 . 5.000 1.820 1.804 1.844 . 0 0 "[ . 1 . 2]" 1 2068 1 118 PRO HD2 1 144 VAL H 0.000 . 5.500 4.403 4.320 4.488 . 0 0 "[ . 1 . 2]" 1 2069 1 118 PRO QG 1 144 VAL H 0.000 . 6.300 4.281 4.120 4.359 . 0 0 "[ . 1 . 2]" 1 2070 1 118 PRO HD3 1 144 VAL H 0.000 . 5.500 2.990 2.881 3.041 . 0 0 "[ . 1 . 2]" 1 2071 1 117 PHE HA 1 144 VAL H 0.000 . 5.500 2.874 2.730 2.984 . 0 0 "[ . 1 . 2]" 1 2072 1 139 VAL HA 1 144 VAL H 0.000 . 5.500 4.586 4.537 4.627 . 0 0 "[ . 1 . 2]" 1 2073 1 139 VAL HA 1 144 VAL HA 0.000 . 2.700 1.905 1.874 1.951 . 0 0 "[ . 1 . 2]" 1 2074 1 117 PHE HA 1 144 VAL HB 0.000 . 4.200 2.785 2.695 2.941 . 0 0 "[ . 1 . 2]" 1 2075 1 110 VAL MG1 1 144 VAL H 0.000 . 6.300 3.607 3.353 3.814 . 0 0 "[ . 1 . 2]" 1 2076 1 139 VAL MG1 1 144 VAL HA 0.000 . 4.000 1.757 1.752 1.766 . 0 0 "[ . 1 . 2]" 1 2077 1 110 VAL MG2 1 144 VAL HA 0.000 . 5.000 3.637 3.502 3.748 . 0 0 "[ . 1 . 2]" 1 2078 1 41 ALA MB 1 145 LEU MD1 0.000 . 4.800 2.388 2.297 2.454 . 0 0 "[ . 1 . 2]" 1 2079 1 106 ILE MG 1 145 LEU H 0.000 . 6.300 5.218 5.135 5.277 . 0 0 "[ . 1 . 2]" 1 2080 1 137 VAL MG1 1 145 LEU H 0.000 . 5.000 4.190 4.183 4.205 . 0 0 "[ . 1 . 2]" 1 2081 1 38 LEU HA 1 145 LEU HB2 0.000 . 3.200 2.641 2.612 2.657 . 0 0 "[ . 1 . 2]" 1 2082 1 138 VAL HB 1 145 LEU H 0.000 . 5.500 4.487 4.432 4.583 . 0 0 "[ . 1 . 2]" 1 2083 1 139 VAL HB 1 145 LEU H 0.000 . 5.500 4.472 4.443 4.517 . 0 0 "[ . 1 . 2]" 1 2084 1 139 VAL HA 1 145 LEU H 0.000 . 3.200 1.955 1.928 1.995 . 0 0 "[ . 1 . 2]" 1 2085 1 138 VAL MG1 1 146 GLY H 0.000 . 6.300 4.177 3.971 4.349 . 0 0 "[ . 1 . 2]" 1 2086 1 38 LEU QD 1 146 GLY H 0.000 . 5.700 2.782 2.755 2.811 . 0 0 "[ . 1 . 2]" 1 2087 1 139 VAL HA 1 146 GLY H 0.000 . 5.500 3.865 3.818 3.911 . 0 0 "[ . 1 . 2]" 1 2088 1 29 PRO HA 1 146 GLY HA2 0.000 . 2.700 2.875 2.867 2.882 0.182 19 0 "[ . 1 . 2]" 1 2089 1 137 VAL MG1 1 146 GLY H 0.000 . 5.000 3.758 3.665 3.812 . 0 0 "[ . 1 . 2]" 1 2090 1 30 ALA MB 1 146 GLY HA3 0.000 . 4.000 3.424 3.413 3.438 . 0 0 "[ . 1 . 2]" 1 2091 1 30 ALA MB 1 146 GLY HA2 0.000 . 3.500 2.304 2.285 2.330 . 0 0 "[ . 1 . 2]" 1 2092 1 29 PRO HA 1 146 GLY HA3 0.000 . 2.200 2.199 2.128 2.228 0.028 10 0 "[ . 1 . 2]" 1 2093 1 38 LEU HB3 1 146 GLY HA3 0.000 . 4.200 3.975 3.873 4.099 . 0 0 "[ . 1 . 2]" 1 2094 1 29 PRO HA 1 146 GLY H 0.000 . 5.500 4.670 4.625 4.686 . 0 0 "[ . 1 . 2]" 1 2095 1 30 ALA MB 1 146 GLY H 0.000 . 5.000 2.691 2.650 2.741 . 0 0 "[ . 1 . 2]" 1 2096 1 38 LEU QD 1 146 GLY HA2 0.000 . 5.700 2.834 2.817 2.857 . 0 0 "[ . 1 . 2]" 1 2097 1 138 VAL HB 1 146 GLY H 0.000 . 4.200 3.765 3.678 3.809 . 0 0 "[ . 1 . 2]" 1 2098 1 118 PRO QG 1 146 GLY H 0.000 . 6.300 5.248 5.217 5.285 . 0 0 "[ . 1 . 2]" 1 2099 1 38 LEU QD 1 146 GLY HA3 0.000 . 5.700 1.668 1.628 1.685 . 0 0 "[ . 1 . 2]" 1 2100 1 137 VAL HA 1 146 GLY H 0.000 . 5.500 4.896 4.851 4.966 . 0 0 "[ . 1 . 2]" 1 2101 1 38 LEU HG 1 147 VAL H 0.000 . 5.500 5.274 5.188 5.435 . 0 0 "[ . 1 . 2]" 1 2102 1 30 ALA MB 1 147 VAL H 0.000 . 6.300 4.385 4.352 4.434 . 0 0 "[ . 1 . 2]" 1 2103 1 29 PRO HA 1 147 VAL H 0.000 . 4.200 3.924 3.883 3.942 . 0 0 "[ . 1 . 2]" 1 2104 1 38 LEU QB 1 147 VAL H 0.000 . 6.300 4.817 4.732 4.960 . 0 0 "[ . 1 . 2]" 1 2105 1 136 LEU QB 1 147 VAL HA 0.000 . 6.300 4.638 4.557 4.875 . 0 0 "[ . 1 . 2]" 1 2106 1 29 PRO QD 1 147 VAL H 0.000 . 6.300 5.190 5.154 5.241 . 0 0 "[ . 1 . 2]" 1 2107 1 27 PHE HA 1 147 VAL H 0.000 . 5.500 4.921 4.854 4.985 . 0 0 "[ . 1 . 2]" 1 2108 1 28 ILE MG 1 147 VAL H 0.000 . 6.300 3.982 3.833 4.219 . 0 0 "[ . 1 . 2]" 1 2109 1 28 ILE MD 1 147 VAL H 0.000 . 6.300 5.027 4.492 5.255 . 0 0 "[ . 1 . 2]" 1 2110 1 137 VAL HA 1 147 VAL HA 0.000 . 2.700 2.008 1.965 2.088 . 0 0 "[ . 1 . 2]" 1 2111 1 27 PHE HB2 1 147 VAL H 0.000 . 5.500 4.407 4.334 4.511 . 0 0 "[ . 1 . 2]" 1 2112 1 138 VAL MG2 1 148 ILE MD 0.000 . 4.800 1.793 1.743 1.852 . 0 0 "[ . 1 . 2]" 1 2113 1 60 LEU MD1 1 148 ILE MG 0.000 . 5.800 2.835 2.605 3.124 . 0 0 "[ . 1 . 2]" 1 2114 1 42 ALA MB 1 148 ILE MD 0.000 . 5.800 1.719 1.691 1.755 . 0 0 "[ . 1 . 2]" 1 2115 1 136 LEU HA 1 148 ILE H 0.000 . 5.500 4.590 4.556 4.686 . 0 0 "[ . 1 . 2]" 1 2116 1 137 VAL HA 1 148 ILE H 0.000 . 4.200 3.268 3.135 3.373 . 0 0 "[ . 1 . 2]" 1 2117 1 136 LEU QB 1 148 ILE H 0.000 . 5.000 3.035 2.949 3.288 . 0 0 "[ . 1 . 2]" 1 2118 1 135 PRO HA 1 148 ILE H 0.000 . 5.500 4.320 4.297 4.343 . 0 0 "[ . 1 . 2]" 1 2119 1 27 PHE HA 1 148 ILE MG 0.000 . 5.000 4.081 3.892 4.170 . 0 0 "[ . 1 . 2]" 1 2120 1 24 ALA HA 1 149 ALA HA 0.000 . 5.500 5.496 5.433 5.541 0.041 15 0 "[ . 1 . 2]" 1 2121 1 26 GLU QB 1 149 ALA H 0.000 . 5.000 4.466 4.454 4.482 . 0 0 "[ . 1 . 2]" 1 2122 1 128 VAL MG1 1 149 ALA HA 0.000 . 3.500 2.326 2.248 2.518 . 0 0 "[ . 1 . 2]" 1 2123 1 27 PHE HA 1 149 ALA H 0.000 . 4.200 2.358 2.294 2.423 . 0 0 "[ . 1 . 2]" 1 2124 1 135 PRO HA 1 149 ALA HA 0.000 . 2.200 2.221 2.202 2.265 0.065 8 0 "[ . 1 . 2]" 1 2125 1 128 VAL MG2 1 149 ALA HA 0.000 . 4.000 3.113 2.927 3.278 . 0 0 "[ . 1 . 2]" 1 2126 1 135 PRO HA 1 150 LEU H 0.000 . 4.200 3.500 3.462 3.522 . 0 0 "[ . 1 . 2]" 1 2127 1 57 ILE MD 1 150 LEU MD2 0.000 . 4.800 2.579 2.442 2.717 . 0 0 "[ . 1 . 2]" 1 2128 1 57 ILE MD 1 150 LEU MD1 0.000 . 5.800 3.044 2.887 3.610 . 0 0 "[ . 1 . 2]" 1 2129 1 53 GLU QG 1 150 LEU MD2 0.000 . 4.800 3.550 3.297 3.576 . 0 0 "[ . 1 . 2]" 1 2130 1 134 THR HB 1 150 LEU HB3 0.000 . 4.200 3.790 3.494 4.032 . 0 0 "[ . 1 . 2]" 1 2131 1 136 LEU H 1 150 LEU H 0.000 . 5.500 3.993 3.967 4.028 . 0 0 "[ . 1 . 2]" 1 2132 1 24 ALA MB 1 150 LEU MD2 0.000 . 4.800 1.760 1.700 1.869 . 0 0 "[ . 1 . 2]" 1 2133 1 57 ILE MG 1 150 LEU MD2 0.000 . 4.800 3.421 3.411 3.434 . 0 0 "[ . 1 . 2]" 1 2134 1 134 THR HB 1 150 LEU H 0.000 . 4.200 3.301 3.119 3.539 . 0 0 "[ . 1 . 2]" 1 2135 1 128 VAL MG1 1 150 LEU H 0.000 . 5.000 2.976 2.901 3.045 . 0 0 "[ . 1 . 2]" 1 2136 1 134 THR HB 1 150 LEU HB2 0.000 . 3.200 2.171 1.889 2.428 . 0 0 "[ . 1 . 2]" 1 2137 1 24 ALA HA 1 150 LEU HA 0.000 . 2.200 1.855 1.843 1.870 . 0 0 "[ . 1 . 2]" 1 2138 1 22 ARG HA 1 151 LYS H 0.000 . 5.500 5.130 4.825 5.350 . 0 0 "[ . 1 . 2]" 1 2139 1 25 SER HB3 1 151 LYS H 0.000 . 5.500 4.579 4.402 4.860 . 0 0 "[ . 1 . 2]" 1 2140 1 133 ALA MB 1 151 LYS QB 0.000 . 5.800 3.383 2.205 3.969 . 0 0 "[ . 1 . 2]" 1 2141 1 23 GLN QG 1 151 LYS H 0.000 . 6.300 5.302 3.606 5.645 . 0 0 "[ . 1 . 2]" 1 2142 1 134 THR H 1 151 LYS H 0.000 . 5.500 4.697 4.576 4.756 . 0 0 "[ . 1 . 2]" 1 2143 1 24 ALA HA 1 151 LYS H 0.000 . 4.200 3.512 3.403 3.591 . 0 0 "[ . 1 . 2]" 1 2144 1 23 GLN QB 1 151 LYS H 0.000 . 6.300 4.290 4.082 5.140 . 0 0 "[ . 1 . 2]" 1 2145 1 25 SER HB2 1 151 LYS H 0.000 . 5.500 3.199 2.916 3.638 . 0 0 "[ . 1 . 2]" 1 2146 1 133 ALA HA 1 152 ASP H 0.000 . 5.500 3.821 3.405 4.268 . 0 0 "[ . 1 . 2]" 1 2147 1 22 ARG HA 1 152 ASP H 0.000 . 5.500 5.084 4.705 5.358 . 0 0 "[ . 1 . 2]" 1 2148 1 133 ALA MB 1 152 ASP H 0.000 . 5.000 4.200 4.182 4.212 . 0 0 "[ . 1 . 2]" 1 2149 1 21 ASN QB 1 153 ILE H 0.000 . 6.300 4.817 3.727 5.615 . 0 0 "[ . 1 . 2]" 1 2150 1 22 ARG QG 1 153 ILE H 0.000 . 5.000 4.108 3.486 4.460 . 0 0 "[ . 1 . 2]" 1 2151 1 22 ARG HA 1 153 ILE H 0.000 . 4.200 3.469 3.017 3.836 . 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 144 _Distance_constraint_stats_list.Viol_count 211 _Distance_constraint_stats_list.Viol_total 297.734 _Distance_constraint_stats_list.Viol_max 0.213 _Distance_constraint_stats_list.Viol_rms 0.0239 _Distance_constraint_stats_list.Viol_average_all_restraints 0.0052 _Distance_constraint_stats_list.Viol_average_violations_only 0.0706 _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 23 GLN 0.000 0.000 . 0 "[ . 1 . 2]" 1 25 SER 0.000 0.000 . 0 "[ . 1 . 2]" 1 26 GLU 0.000 0.000 . 0 "[ . 1 . 2]" 1 28 ILE 0.000 0.000 . 0 "[ . 1 . 2]" 1 30 ALA 0.000 0.000 . 0 "[ . 1 . 2]" 1 33 VAL 0.000 0.000 . 0 "[ . 1 . 2]" 1 34 ASP 0.000 0.000 . 0 "[ . 1 . 2]" 1 35 GLU 0.000 0.000 . 0 "[ . 1 . 2]" 1 36 LYS 0.000 0.000 . 0 "[ . 1 . 2]" 1 37 THR 0.000 0.000 . 0 "[ . 1 . 2]" 1 38 LEU 0.000 0.000 . 0 "[ . 1 . 2]" 1 39 ALA 0.000 0.000 . 0 "[ . 1 . 2]" 1 40 ASP 0.000 0.000 . 0 "[ . 1 . 2]" 1 41 ALA 0.000 0.000 . 0 "[ . 1 . 2]" 1 42 ALA 0.000 0.000 . 0 "[ . 1 . 2]" 1 43 GLN 0.000 0.000 . 0 "[ . 1 . 2]" 1 44 LEU 0.000 0.000 . 0 "[ . 1 . 2]" 1 45 ALA 0.000 0.000 . 0 "[ . 1 . 2]" 1 53 GLU 0.007 0.007 6 0 "[ . 1 . 2]" 1 54 GLY 0.050 0.024 10 0 "[ . 1 . 2]" 1 55 ARG 0.000 0.000 . 0 "[ . 1 . 2]" 1 56 SER 0.000 0.000 . 0 "[ . 1 . 2]" 1 57 ILE 0.007 0.007 6 0 "[ . 1 . 2]" 1 58 VAL 1.726 0.109 19 0 "[ . 1 . 2]" 1 59 ILE 0.000 0.000 . 0 "[ . 1 . 2]" 1 60 LEU 0.000 0.000 . 0 "[ . 1 . 2]" 1 61 ALA 0.681 0.102 10 0 "[ . 1 . 2]" 1 62 LYS 1.676 0.109 19 0 "[ . 1 . 2]" 1 63 GLN 0.000 0.000 . 0 "[ . 1 . 2]" 1 64 ARG 0.000 0.000 . 0 "[ . 1 . 2]" 1 66 ASN 0.681 0.102 10 0 "[ . 1 . 2]" 1 78 THR 0.000 0.000 . 0 "[ . 1 . 2]" 1 80 VAL 0.000 0.000 . 0 "[ . 1 . 2]" 1 83 THR 0.000 0.000 11 0 "[ . 1 . 2]" 1 88 MET 0.000 0.000 11 0 "[ . 1 . 2]" 1 89 SER 1.626 0.142 3 0 "[ . 1 . 2]" 1 90 GLY 0.000 0.000 . 0 "[ . 1 . 2]" 1 91 ILE 0.000 0.000 . 0 "[ . 1 . 2]" 1 92 ASN 0.000 0.000 . 0 "[ . 1 . 2]" 1 93 ILE 0.289 0.034 11 0 "[ . 1 . 2]" 1 96 ARG 0.289 0.034 11 0 "[ . 1 . 2]" 1 97 MET 0.000 0.000 . 0 "[ . 1 . 2]" 1 98 ILE 0.000 0.000 . 0 "[ . 1 . 2]" 1 99 ARG 0.000 0.000 . 0 "[ . 1 . 2]" 1 100 LYS 1.626 0.142 3 0 "[ . 1 . 2]" 1 101 GLY 0.000 0.000 . 0 "[ . 1 . 2]" 1 102 SER 0.008 0.008 17 0 "[ . 1 . 2]" 1 103 VAL 0.000 0.000 . 0 "[ . 1 . 2]" 1 104 ASP 0.000 0.000 . 0 "[ . 1 . 2]" 1 105 ALA 0.000 0.000 . 0 "[ . 1 . 2]" 1 106 ILE 0.008 0.008 17 0 "[ . 1 . 2]" 1 107 ARG 0.000 0.000 . 0 "[ . 1 . 2]" 1 108 ARG 0.000 0.000 . 0 "[ . 1 . 2]" 1 109 HIS 0.000 0.000 . 0 "[ . 1 . 2]" 1 110 VAL 0.378 0.076 20 0 "[ . 1 . 2]" 1 111 GLU 0.000 0.000 . 0 "[ . 1 . 2]" 1 112 ALA 0.000 0.000 . 0 "[ . 1 . 2]" 1 113 ASN 0.000 0.000 . 0 "[ . 1 . 2]" 1 114 GLY 0.000 0.000 . 0 "[ . 1 . 2]" 1 115 GLY 0.378 0.076 20 0 "[ . 1 . 2]" 1 118 PRO 0.000 0.000 . 0 "[ . 1 . 2]" 1 119 THR 0.000 0.000 . 0 "[ . 1 . 2]" 1 120 ASP 0.000 0.000 . 0 "[ . 1 . 2]" 1 121 VAL 1.148 0.093 11 0 "[ . 1 . 2]" 1 122 ASP 0.000 0.000 . 0 "[ . 1 . 2]" 1 123 GLN 0.000 0.000 . 0 "[ . 1 . 2]" 1 124 LYS 0.000 0.000 . 0 "[ . 1 . 2]" 1 125 VAL 1.148 0.093 11 0 "[ . 1 . 2]" 1 126 ASP 0.000 0.000 . 0 "[ . 1 . 2]" 1 127 GLN 0.000 0.000 . 0 "[ . 1 . 2]" 1 128 VAL 4.277 0.181 17 0 "[ . 1 . 2]" 1 129 ALA 0.000 0.000 . 0 "[ . 1 . 2]" 1 130 ARG 0.000 0.000 . 0 "[ . 1 . 2]" 1 131 GLN 0.000 0.000 . 0 "[ . 1 . 2]" 1 133 ALA 4.277 0.181 17 0 "[ . 1 . 2]" 1 134 THR 0.313 0.132 19 0 "[ . 1 . 2]" 1 136 LEU 4.434 0.213 2 0 "[ . 1 . 2]" 1 137 VAL 0.000 0.000 . 0 "[ . 1 . 2]" 1 138 VAL 0.000 0.000 . 0 "[ . 1 . 2]" 1 139 VAL 0.000 0.000 . 0 "[ . 1 . 2]" 1 140 GLU 0.000 0.000 . 0 "[ . 1 . 2]" 1 141 GLY 0.000 0.000 . 0 "[ . 1 . 2]" 1 143 ARG 0.000 0.000 . 0 "[ . 1 . 2]" 1 145 LEU 0.000 0.000 . 0 "[ . 1 . 2]" 1 146 GLY 0.000 0.000 . 0 "[ . 1 . 2]" 1 147 VAL 0.000 0.000 . 0 "[ . 1 . 2]" 1 148 ILE 4.434 0.213 2 0 "[ . 1 . 2]" 1 149 ALA 0.000 0.000 . 0 "[ . 1 . 2]" 1 150 LEU 0.313 0.132 19 0 "[ . 1 . 2]" 1 151 LYS 0.000 0.000 . 0 "[ . 1 . 2]" stop_ loop_ _Distance_constraint_stats.Restraint_ID _Distance_constraint_stats.Atom_1_entity_assembly_ID _Distance_constraint_stats.Atom_1_comp_index_ID _Distance_constraint_stats.Atom_1_comp_ID _Distance_constraint_stats.Atom_1_ID _Distance_constraint_stats.Atom_2_entity_assembly_ID _Distance_constraint_stats.Atom_2_comp_index_ID _Distance_constraint_stats.Atom_2_comp_ID _Distance_constraint_stats.Atom_2_ID _Distance_constraint_stats.Node_1_distance_val _Distance_constraint_stats.Node_1_distance_lower_bound_val _Distance_constraint_stats.Node_1_distance_upper_bound_val _Distance_constraint_stats.Distance_average _Distance_constraint_stats.Distance_minimum _Distance_constraint_stats.Distance_maximum _Distance_constraint_stats.Max_violation _Distance_constraint_stats.Max_violation_model_number _Distance_constraint_stats.Over_cutoff_violation_count _Distance_constraint_stats.Over_cutoff_viol_per_model _Distance_constraint_stats.Distance_constraint_stats_ID 1 1 23 GLN H 1 151 LYS O 2.100 . 2.500 2.219 2.184 2.263 . 0 0 "[ . 1 . 2]" 2 2 1 23 GLN N 1 151 LYS O 3.100 2.600 3.500 3.164 3.122 3.223 . 0 0 "[ . 1 . 2]" 2 3 1 23 GLN O 1 151 LYS H 2.100 . 2.500 2.081 2.039 2.185 . 0 0 "[ . 1 . 2]" 2 4 1 23 GLN O 1 151 LYS N 3.100 2.600 3.500 2.963 2.887 3.053 . 0 0 "[ . 1 . 2]" 2 5 1 25 SER H 1 149 ALA O 2.100 . 2.500 2.167 2.132 2.216 . 0 0 "[ . 1 . 2]" 2 6 1 25 SER N 1 149 ALA O 3.100 2.600 3.500 3.136 3.099 3.192 . 0 0 "[ . 1 . 2]" 2 7 1 26 GLU H 1 149 ALA O 2.100 . 2.500 2.317 2.259 2.387 . 0 0 "[ . 1 . 2]" 2 8 1 26 GLU N 1 149 ALA O 3.100 2.600 3.500 3.299 3.243 3.370 . 0 0 "[ . 1 . 2]" 2 9 1 26 GLU O 1 149 ALA H 2.100 . 2.500 1.977 1.937 2.013 . 0 0 "[ . 1 . 2]" 2 10 1 26 GLU O 1 149 ALA N 3.100 2.600 3.500 2.817 2.783 2.851 . 0 0 "[ . 1 . 2]" 2 11 1 28 ILE H 1 147 VAL O 2.100 . 2.500 2.156 2.096 2.193 . 0 0 "[ . 1 . 2]" 2 12 1 28 ILE N 1 147 VAL O 3.100 2.600 3.500 2.981 2.919 3.051 . 0 0 "[ . 1 . 2]" 2 13 1 28 ILE O 1 147 VAL H 2.100 . 2.500 1.910 1.881 1.952 . 0 0 "[ . 1 . 2]" 2 14 1 28 ILE O 1 147 VAL N 3.100 2.600 3.500 2.795 2.759 2.857 . 0 0 "[ . 1 . 2]" 2 15 1 30 ALA O 1 33 VAL H 2.100 . 2.500 2.205 2.079 2.242 . 0 0 "[ . 1 . 2]" 2 16 1 30 ALA O 1 33 VAL N 3.100 2.600 3.500 3.065 3.037 3.102 . 0 0 "[ . 1 . 2]" 2 17 1 140 GLU H 1 143 ARG O 2.100 . 2.500 2.062 2.037 2.085 . 0 0 "[ . 1 . 2]" 2 18 1 140 GLU N 1 143 ARG O 3.100 2.600 3.500 2.934 2.913 2.947 . 0 0 "[ . 1 . 2]" 2 19 1 140 GLU O 1 143 ARG H 2.100 . 2.500 2.339 2.313 2.375 . 0 0 "[ . 1 . 2]" 2 20 1 140 GLU O 1 143 ARG N 3.100 2.600 3.500 3.279 3.250 3.308 . 0 0 "[ . 1 . 2]" 2 21 1 138 VAL O 1 145 LEU H 2.100 . 2.500 1.942 1.917 1.970 . 0 0 "[ . 1 . 2]" 2 22 1 138 VAL O 1 145 LEU N 3.100 2.600 3.500 2.837 2.815 2.866 . 0 0 "[ . 1 . 2]" 2 23 1 138 VAL O 1 146 GLY H 2.100 . 2.500 2.370 2.335 2.397 . 0 0 "[ . 1 . 2]" 2 24 1 138 VAL O 1 146 GLY N 3.100 2.600 3.500 3.291 3.245 3.319 . 0 0 "[ . 1 . 2]" 2 25 1 138 VAL H 1 146 GLY O 2.100 . 2.500 1.901 1.873 1.967 . 0 0 "[ . 1 . 2]" 2 26 1 138 VAL N 1 146 GLY O 3.100 2.600 3.500 2.879 2.850 2.948 . 0 0 "[ . 1 . 2]" 2 27 1 136 LEU O 1 148 ILE H 2.100 . 2.500 1.611 1.587 1.650 0.213 2 0 "[ . 1 . 2]" 2 28 1 136 LEU O 1 148 ILE N 3.100 2.600 3.500 2.568 2.543 2.603 0.057 2 0 "[ . 1 . 2]" 2 29 1 136 LEU H 1 148 ILE O 2.100 . 2.500 1.855 1.838 1.878 . 0 0 "[ . 1 . 2]" 2 30 1 136 LEU N 1 148 ILE O 3.100 2.600 3.500 2.826 2.803 2.845 . 0 0 "[ . 1 . 2]" 2 31 1 134 THR O 1 150 LEU H 2.100 . 2.500 2.020 1.902 2.201 . 0 0 "[ . 1 . 2]" 2 32 1 134 THR O 1 150 LEU N 3.100 2.600 3.500 2.973 2.850 3.151 . 0 0 "[ . 1 . 2]" 2 33 1 134 THR H 1 150 LEU O 2.100 . 2.500 1.812 1.668 1.862 0.132 19 0 "[ . 1 . 2]" 2 34 1 134 THR N 1 150 LEU O 3.100 2.600 3.500 2.706 2.585 2.789 0.015 19 0 "[ . 1 . 2]" 2 35 1 101 GLY O 1 137 VAL H 2.100 . 2.500 2.074 2.022 2.105 . 0 0 "[ . 1 . 2]" 2 36 1 101 GLY O 1 137 VAL N 3.100 2.600 3.500 3.009 2.968 3.048 . 0 0 "[ . 1 . 2]" 2 37 1 101 GLY H 1 137 VAL O 2.100 . 2.500 2.205 2.167 2.260 . 0 0 "[ . 1 . 2]" 2 38 1 101 GLY N 1 137 VAL O 3.100 2.600 3.500 3.136 3.105 3.171 . 0 0 "[ . 1 . 2]" 2 39 1 99 ARG O 1 139 VAL H 2.100 . 2.500 1.999 1.925 2.020 . 0 0 "[ . 1 . 2]" 2 40 1 99 ARG O 1 139 VAL N 3.100 2.600 3.500 2.905 2.837 2.921 . 0 0 "[ . 1 . 2]" 2 41 1 99 ARG H 1 139 VAL O 2.100 . 2.500 2.250 2.215 2.265 . 0 0 "[ . 1 . 2]" 2 42 1 99 ARG N 1 139 VAL O 3.100 2.600 3.500 3.111 3.084 3.122 . 0 0 "[ . 1 . 2]" 2 43 1 97 MET O 1 141 GLY H 2.100 . 2.500 1.981 1.946 2.035 . 0 0 "[ . 1 . 2]" 2 44 1 97 MET O 1 141 GLY N 3.100 2.600 3.500 2.924 2.882 2.980 . 0 0 "[ . 1 . 2]" 2 45 1 89 SER O 1 100 LYS H 2.100 . 2.500 1.719 1.658 1.747 0.142 3 0 "[ . 1 . 2]" 2 46 1 89 SER O 1 100 LYS N 3.100 2.600 3.500 2.676 2.623 2.706 . 0 0 "[ . 1 . 2]" 2 47 1 89 SER H 1 100 LYS O 2.100 . 2.500 1.884 1.850 1.923 . 0 0 "[ . 1 . 2]" 2 48 1 89 SER N 1 100 LYS O 3.100 2.600 3.500 2.861 2.826 2.901 . 0 0 "[ . 1 . 2]" 2 49 1 91 ILE O 1 98 ILE H 2.100 . 2.500 2.246 2.204 2.293 . 0 0 "[ . 1 . 2]" 2 50 1 91 ILE O 1 98 ILE N 3.100 2.600 3.500 3.132 3.102 3.153 . 0 0 "[ . 1 . 2]" 2 51 1 91 ILE H 1 98 ILE O 2.100 . 2.500 1.987 1.960 2.001 . 0 0 "[ . 1 . 2]" 2 52 1 91 ILE N 1 98 ILE O 3.100 2.600 3.500 2.928 2.906 2.939 . 0 0 "[ . 1 . 2]" 2 53 1 93 ILE O 1 96 ARG H 2.100 . 2.500 1.936 1.901 1.959 . 0 0 "[ . 1 . 2]" 2 54 1 93 ILE O 1 96 ARG N 3.100 2.600 3.500 2.778 2.759 2.793 . 0 0 "[ . 1 . 2]" 2 55 1 93 ILE H 1 96 ARG O 2.100 . 2.500 1.788 1.766 1.814 0.034 11 0 "[ . 1 . 2]" 2 56 1 93 ILE N 1 96 ARG O 3.100 2.600 3.500 2.703 2.680 2.739 . 0 0 "[ . 1 . 2]" 2 57 1 83 THR O 1 88 MET H 2.100 . 2.500 2.464 2.439 2.500 0.000 11 0 "[ . 1 . 2]" 2 58 1 83 THR O 1 88 MET N 3.100 2.600 3.500 3.366 3.321 3.415 . 0 0 "[ . 1 . 2]" 2 59 1 83 THR H 1 88 MET O 2.100 . 2.500 2.145 2.117 2.162 . 0 0 "[ . 1 . 2]" 2 60 1 83 THR N 1 88 MET O 3.100 2.600 3.500 3.060 3.027 3.081 . 0 0 "[ . 1 . 2]" 2 61 1 80 VAL O 1 90 GLY H 2.100 . 2.500 2.148 2.082 2.190 . 0 0 "[ . 1 . 2]" 2 62 1 80 VAL O 1 90 GLY N 3.100 2.600 3.500 3.106 3.050 3.147 . 0 0 "[ . 1 . 2]" 2 63 1 80 VAL H 1 90 GLY O 2.100 . 2.500 1.910 1.884 1.970 . 0 0 "[ . 1 . 2]" 2 64 1 80 VAL N 1 90 GLY O 3.100 2.600 3.500 2.720 2.660 2.760 . 0 0 "[ . 1 . 2]" 2 65 1 78 THR O 1 92 ASN H 2.100 . 2.500 1.955 1.929 1.993 . 0 0 "[ . 1 . 2]" 2 66 1 78 THR O 1 92 ASN N 3.100 2.600 3.500 2.924 2.897 2.960 . 0 0 "[ . 1 . 2]" 2 67 1 78 THR H 1 92 ASN O 2.100 . 2.500 1.907 1.815 1.948 . 0 0 "[ . 1 . 2]" 2 68 1 78 THR N 1 92 ASN O 3.100 2.600 3.500 2.880 2.752 2.924 . 0 0 "[ . 1 . 2]" 2 69 1 41 ALA O 1 45 ALA H 2.100 . 2.500 2.056 2.000 2.097 . 0 0 "[ . 1 . 2]" 2 70 1 41 ALA O 1 45 ALA N 3.100 2.600 3.500 3.012 2.951 3.056 . 0 0 "[ . 1 . 2]" 2 71 1 40 ASP O 1 44 LEU H 2.100 . 2.500 2.161 2.134 2.191 . 0 0 "[ . 1 . 2]" 2 72 1 40 ASP O 1 44 LEU N 3.100 2.600 3.500 3.113 3.088 3.140 . 0 0 "[ . 1 . 2]" 2 73 1 39 ALA O 1 43 GLN H 2.100 . 2.500 2.138 2.104 2.192 . 0 0 "[ . 1 . 2]" 2 74 1 39 ALA O 1 43 GLN N 3.100 2.600 3.500 2.927 2.880 2.993 . 0 0 "[ . 1 . 2]" 2 75 1 38 LEU O 1 42 ALA H 2.100 . 2.500 1.907 1.873 1.941 . 0 0 "[ . 1 . 2]" 2 76 1 38 LEU O 1 42 ALA N 3.100 2.600 3.500 2.698 2.660 2.731 . 0 0 "[ . 1 . 2]" 2 77 1 37 THR O 1 41 ALA H 2.100 . 2.500 2.223 2.157 2.280 . 0 0 "[ . 1 . 2]" 2 78 1 37 THR O 1 41 ALA N 3.100 2.600 3.500 3.205 3.133 3.264 . 0 0 "[ . 1 . 2]" 2 79 1 36 LYS O 1 40 ASP H 2.100 . 2.500 2.073 2.006 2.204 . 0 0 "[ . 1 . 2]" 2 80 1 36 LYS O 1 40 ASP N 3.100 2.600 3.500 3.018 2.949 3.163 . 0 0 "[ . 1 . 2]" 2 81 1 35 GLU O 1 39 ALA H 2.100 . 2.500 1.896 1.824 1.918 . 0 0 "[ . 1 . 2]" 2 82 1 35 GLU O 1 39 ALA N 3.100 2.600 3.500 2.786 2.698 2.824 . 0 0 "[ . 1 . 2]" 2 83 1 60 LEU O 1 64 ARG H 2.100 . 2.500 2.134 2.090 2.246 . 0 0 "[ . 1 . 2]" 2 84 1 60 LEU O 1 64 ARG N 3.100 2.600 3.500 3.019 2.957 3.145 . 0 0 "[ . 1 . 2]" 2 85 1 59 ILE O 1 63 GLN H 2.100 . 2.500 2.000 1.949 2.105 . 0 0 "[ . 1 . 2]" 2 86 1 59 ILE O 1 63 GLN N 3.100 2.600 3.500 2.965 2.901 3.077 . 0 0 "[ . 1 . 2]" 2 87 1 58 VAL O 1 62 LYS H 2.100 . 2.500 2.563 2.487 2.609 0.109 19 0 "[ . 1 . 2]" 2 88 1 58 VAL O 1 62 LYS N 3.100 2.600 3.500 3.514 3.440 3.554 0.054 19 0 "[ . 1 . 2]" 2 89 1 57 ILE O 1 61 ALA H 2.100 . 2.500 2.147 2.117 2.194 . 0 0 "[ . 1 . 2]" 2 90 1 57 ILE O 1 61 ALA N 3.100 2.600 3.500 3.055 3.022 3.112 . 0 0 "[ . 1 . 2]" 2 91 1 56 SER O 1 60 LEU H 2.100 . 2.500 1.981 1.911 2.023 . 0 0 "[ . 1 . 2]" 2 92 1 56 SER O 1 60 LEU N 3.100 2.600 3.500 2.763 2.685 2.811 . 0 0 "[ . 1 . 2]" 2 93 1 55 ARG O 1 59 ILE H 2.100 . 2.500 2.129 2.093 2.146 . 0 0 "[ . 1 . 2]" 2 94 1 55 ARG O 1 59 ILE N 3.100 2.600 3.500 3.023 2.959 3.049 . 0 0 "[ . 1 . 2]" 2 95 1 54 GLY O 1 58 VAL H 2.100 . 2.500 2.493 2.470 2.524 0.024 10 0 "[ . 1 . 2]" 2 96 1 54 GLY O 1 58 VAL N 3.100 2.600 3.500 3.468 3.445 3.498 . 0 0 "[ . 1 . 2]" 2 97 1 53 GLU O 1 57 ILE H 2.100 . 2.500 1.836 1.793 1.881 0.007 6 0 "[ . 1 . 2]" 2 98 1 53 GLU O 1 57 ILE N 3.100 2.600 3.500 2.779 2.731 2.821 . 0 0 "[ . 1 . 2]" 2 99 1 110 VAL O 1 114 GLY H 2.100 . 2.500 2.308 2.282 2.324 . 0 0 "[ . 1 . 2]" 2 100 1 110 VAL O 1 114 GLY N 3.100 2.600 3.500 3.069 3.042 3.090 . 0 0 "[ . 1 . 2]" 2 101 1 109 HIS O 1 113 ASN H 2.100 . 2.500 2.030 2.025 2.038 . 0 0 "[ . 1 . 2]" 2 102 1 109 HIS O 1 113 ASN N 3.100 2.600 3.500 2.905 2.886 2.913 . 0 0 "[ . 1 . 2]" 2 103 1 108 ARG O 1 112 ALA H 2.100 . 2.500 2.076 2.044 2.100 . 0 0 "[ . 1 . 2]" 2 104 1 108 ARG O 1 112 ALA N 3.100 2.600 3.500 2.960 2.931 2.986 . 0 0 "[ . 1 . 2]" 2 105 1 107 ARG O 1 111 GLU H 2.100 . 2.500 2.213 2.189 2.250 . 0 0 "[ . 1 . 2]" 2 106 1 107 ARG O 1 111 GLU N 3.100 2.600 3.500 3.191 3.169 3.230 . 0 0 "[ . 1 . 2]" 2 107 1 106 ILE O 1 110 VAL H 2.100 . 2.500 1.890 1.846 1.927 . 0 0 "[ . 1 . 2]" 2 108 1 106 ILE O 1 110 VAL N 3.100 2.600 3.500 2.764 2.718 2.807 . 0 0 "[ . 1 . 2]" 2 109 1 105 ALA O 1 109 HIS H 2.100 . 2.500 2.068 2.044 2.088 . 0 0 "[ . 1 . 2]" 2 110 1 105 ALA O 1 109 HIS N 3.100 2.600 3.500 2.934 2.918 2.948 . 0 0 "[ . 1 . 2]" 2 111 1 104 ASP O 1 108 ARG H 2.100 . 2.500 2.261 2.235 2.302 . 0 0 "[ . 1 . 2]" 2 112 1 104 ASP O 1 108 ARG N 3.100 2.600 3.500 3.188 3.153 3.233 . 0 0 "[ . 1 . 2]" 2 113 1 103 VAL O 1 107 ARG H 2.100 . 2.500 1.915 1.882 1.955 . 0 0 "[ . 1 . 2]" 2 114 1 103 VAL O 1 107 ARG N 3.100 2.600 3.500 2.819 2.783 2.865 . 0 0 "[ . 1 . 2]" 2 115 1 127 GLN O 1 131 GLN H 2.100 . 2.500 2.211 2.160 2.350 . 0 0 "[ . 1 . 2]" 2 116 1 127 GLN O 1 131 GLN N 3.100 2.600 3.500 3.085 3.025 3.255 . 0 0 "[ . 1 . 2]" 2 117 1 126 ASP O 1 130 ARG H 2.100 . 2.500 2.128 2.091 2.179 . 0 0 "[ . 1 . 2]" 2 118 1 126 ASP O 1 130 ARG N 3.100 2.600 3.500 3.036 3.007 3.088 . 0 0 "[ . 1 . 2]" 2 119 1 125 VAL O 1 129 ALA H 2.100 . 2.500 2.251 2.203 2.306 . 0 0 "[ . 1 . 2]" 2 120 1 125 VAL O 1 129 ALA N 3.100 2.600 3.500 3.149 3.095 3.195 . 0 0 "[ . 1 . 2]" 2 121 1 124 LYS O 1 128 VAL H 2.100 . 2.500 2.040 2.002 2.070 . 0 0 "[ . 1 . 2]" 2 122 1 124 LYS O 1 128 VAL N 3.100 2.600 3.500 2.941 2.899 2.973 . 0 0 "[ . 1 . 2]" 2 123 1 123 GLN O 1 127 GLN H 2.100 . 2.500 1.964 1.935 1.981 . 0 0 "[ . 1 . 2]" 2 124 1 123 GLN O 1 127 GLN N 3.100 2.600 3.500 2.856 2.823 2.875 . 0 0 "[ . 1 . 2]" 2 125 1 122 ASP O 1 126 ASP H 2.100 . 2.500 2.089 2.061 2.116 . 0 0 "[ . 1 . 2]" 2 126 1 122 ASP O 1 126 ASP N 3.100 2.600 3.500 2.948 2.914 2.981 . 0 0 "[ . 1 . 2]" 2 127 1 121 VAL O 1 125 VAL H 2.100 . 2.500 1.743 1.707 1.784 0.093 11 0 "[ . 1 . 2]" 2 128 1 121 VAL O 1 125 VAL N 3.100 2.600 3.500 2.649 2.611 2.692 . 0 0 "[ . 1 . 2]" 2 129 1 120 ASP O 1 124 LYS H 2.100 . 2.500 2.110 2.086 2.130 . 0 0 "[ . 1 . 2]" 2 130 1 120 ASP O 1 124 LYS N 3.100 2.600 3.500 3.032 2.998 3.064 . 0 0 "[ . 1 . 2]" 2 131 1 119 THR O 1 123 GLN H 2.100 . 2.500 1.846 1.818 1.863 . 0 0 "[ . 1 . 2]" 2 132 1 119 THR O 1 123 GLN N 3.100 2.600 3.500 2.758 2.737 2.778 . 0 0 "[ . 1 . 2]" 2 133 1 34 ASP O 1 38 LEU H 2.100 . 2.500 1.990 1.919 2.018 . 0 0 "[ . 1 . 2]" 2 134 1 34 ASP O 1 38 LEU N 3.100 2.600 3.500 2.907 2.847 2.937 . 0 0 "[ . 1 . 2]" 2 135 1 61 ALA O 1 66 ASN H 2.100 . 2.500 1.771 1.698 1.831 0.102 10 0 "[ . 1 . 2]" 2 136 1 61 ALA O 1 66 ASN N 3.100 2.600 3.500 2.701 2.638 2.761 . 0 0 "[ . 1 . 2]" 2 137 1 102 SER O 1 106 ILE H 2.100 . 2.500 1.843 1.792 1.876 0.008 17 0 "[ . 1 . 2]" 2 138 1 102 SER O 1 106 ILE N 3.100 2.600 3.500 2.813 2.756 2.846 . 0 0 "[ . 1 . 2]" 2 139 1 110 VAL O 1 115 GLY H 2.100 . 2.500 1.787 1.724 1.846 0.076 20 0 "[ . 1 . 2]" 2 140 1 110 VAL O 1 115 GLY N 3.100 2.600 3.500 2.705 2.635 2.763 . 0 0 "[ . 1 . 2]" 2 141 1 118 PRO O 1 122 ASP H 2.100 . 2.500 1.905 1.812 1.981 . 0 0 "[ . 1 . 2]" 2 142 1 118 PRO O 1 122 ASP N 3.100 2.600 3.500 2.868 2.768 2.947 . 0 0 "[ . 1 . 2]" 2 143 1 128 VAL O 1 133 ALA H 2.100 . 2.500 1.658 1.619 1.720 0.181 17 0 "[ . 1 . 2]" 2 144 1 128 VAL O 1 133 ALA N 3.100 2.600 3.500 2.528 2.479 2.612 0.121 13 0 "[ . 1 . 2]" 2 stop_ save_
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