NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
397768 | 1t17 | 6120 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1t17 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 2204 _Distance_constraint_stats_list.Viol_count 2816 _Distance_constraint_stats_list.Viol_total 2092.138 _Distance_constraint_stats_list.Viol_max 0.516 _Distance_constraint_stats_list.Viol_rms 0.0129 _Distance_constraint_stats_list.Viol_average_all_restraints 0.0024 _Distance_constraint_stats_list.Viol_average_violations_only 0.0371 _Distance_constraint_stats_list.Cutoff_violation_report 0.500 _Distance_constraint_stats_list.Details ; Description of the tags in this list: * 1 * Administrative tag * 2 * Administrative tag * 3 * Administrative tag * 4 * ID of the restraint list. * 5 * Number of restraints in list. * 6 * Number of violated restraints (each model violation is used). * 7 * Sum of violations in Angstrom. * 8 * Maximum violation of a restraint without averaging in any way. * 9 * Rms of violations over all restraints. * 10 * Average violation over all restraints. * 11 * Average violation over violated restraints. This violation is averaged over only those models in which the restraint is violated. These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998). * 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table. * 13 * This tag Description of the tags in the per residue table below: * 1 * Chain identifier (can be absent if none defined) * 2 * Residue number * 3 * Residue name * 4 * Maximum violation in ensemble of models (without any averaging) * 5 * Model number with the maximum violation * 6 * Number of models with a violation above cutoff * 7 * List of models (1 character per model) with a violation above cutoff. An '*' marks a violation above the cutoff. A '+' indicates the largest violation above the cutoff and a '-' marks the smallest violation over cutoff. For models 5, 15, 25,... a ' ' is replaced by a '.'. For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1. * 8 * Administrative tag * 9 * Administrative tag Description of the tags in the per restraint table below: * 1 * Restraint ID within restraint list. First node, FIRST member, first atom's: * 2 * Chain identifier (can be absent if none defined) * 3 * Residue number * 4 * Residue name * 5 * Name of (pseudo-)atom First node, SECOND member, first atom's: * 6 * Chain identifier (can be absent if none defined) * 7 * Residue number * 8 * Residue name * 9 * Name of (pseudo-)atom FIRST node's: * 10 * Target distance value (Angstrom) * 11 * Lower bound distance (Angstrom) * 12 * Upper bound distance (Angstrom) * 13 * Average distance in ensemble of models * 14 * Minimum distance in ensemble of models * 15 * Maximum distance in ensemble of models * 16 * Maximum violation (without any averaging) * 17 * Model number with the maximum violation * 18 * Number of models with a violation above cutoff * 19 * List of models with a violation above cutoff. See description above. * 20 * Administrative tag * 21 * Administrative tag ; loop_ _Distance_constraint_stats_per_res.Atom_entity_assembly_ID _Distance_constraint_stats_per_res.Atom_comp_index_ID _Distance_constraint_stats_per_res.Atom_comp_ID _Distance_constraint_stats_per_res.Total_violation _Distance_constraint_stats_per_res.Max_violation _Distance_constraint_stats_per_res.Max_violation_model_number _Distance_constraint_stats_per_res.Over_cutoff_viol_count _Distance_constraint_stats_per_res.Over_cutoff_viol_per_model 1 1 MET 1.526 0.234 1 0 "[ . 1 . 2]" 1 2 HIS 0.351 0.068 11 0 "[ . 1 . 2]" 1 3 ARG 0.126 0.058 20 0 "[ . 1 . 2]" 1 4 HIS 0.671 0.058 20 0 "[ . 1 . 2]" 1 5 VAL 0.620 0.082 5 0 "[ . 1 . 2]" 1 6 VAL 1.204 0.124 10 0 "[ . 1 . 2]" 1 7 THR 0.068 0.029 16 0 "[ . 1 . 2]" 1 8 LYS 1.456 0.175 15 0 "[ . 1 . 2]" 1 9 VAL 1.183 0.175 15 0 "[ . 1 . 2]" 1 10 LEU 0.127 0.050 10 0 "[ . 1 . 2]" 1 11 PRO 0.000 0.000 . 0 "[ . 1 . 2]" 1 12 TYR 0.191 0.051 6 0 "[ . 1 . 2]" 1 13 THR 0.219 0.039 18 0 "[ . 1 . 2]" 1 14 PRO 0.000 0.000 . 0 "[ . 1 . 2]" 1 15 ASP 1.241 0.087 18 0 "[ . 1 . 2]" 1 16 GLN 0.530 0.087 18 0 "[ . 1 . 2]" 1 17 LEU 2.165 0.199 20 0 "[ . 1 . 2]" 1 18 PHE 0.236 0.043 7 0 "[ . 1 . 2]" 1 19 GLU 3.154 0.160 19 0 "[ . 1 . 2]" 1 20 LEU 3.525 0.199 20 0 "[ . 1 . 2]" 1 21 VAL 2.991 0.138 6 0 "[ . 1 . 2]" 1 22 GLY 1.920 0.113 17 0 "[ . 1 . 2]" 1 23 ASP 2.471 0.183 17 0 "[ . 1 . 2]" 1 24 VAL 2.393 0.194 9 0 "[ . 1 . 2]" 1 25 ASP 1.150 0.194 9 0 "[ . 1 . 2]" 1 26 ALA 0.585 0.259 11 0 "[ . 1 . 2]" 1 27 TYR 3.333 0.259 11 0 "[ . 1 . 2]" 1 28 PRO 0.000 0.000 . 0 "[ . 1 . 2]" 1 29 LYS 0.000 0.000 . 0 "[ . 1 . 2]" 1 30 PHE 0.000 0.000 . 0 "[ . 1 . 2]" 1 31 VAL 2.614 0.226 19 0 "[ . 1 . 2]" 1 32 PRO 0.345 0.082 17 0 "[ . 1 . 2]" 1 33 TRP 5.918 0.350 8 0 "[ . 1 . 2]" 1 34 ILE 0.153 0.049 3 0 "[ . 1 . 2]" 1 35 THR 2.323 0.140 18 0 "[ . 1 . 2]" 1 36 GLY 2.619 0.165 5 0 "[ . 1 . 2]" 1 37 MET 1.228 0.086 6 0 "[ . 1 . 2]" 1 38 ARG 1.380 0.068 6 0 "[ . 1 . 2]" 1 39 THR 0.706 0.068 6 0 "[ . 1 . 2]" 1 40 TRP 0.641 0.071 13 0 "[ . 1 . 2]" 1 41 ASN 0.591 0.055 4 0 "[ . 1 . 2]" 1 42 GLY 1.278 0.100 4 0 "[ . 1 . 2]" 1 43 ARG 0.258 0.076 10 0 "[ . 1 . 2]" 1 44 VAL 0.123 0.039 15 0 "[ . 1 . 2]" 1 45 ASP 1.227 0.131 11 0 "[ . 1 . 2]" 1 46 GLY 1.184 0.079 10 0 "[ . 1 . 2]" 1 47 ALA 0.908 0.079 10 0 "[ . 1 . 2]" 1 48 VAL 0.802 0.062 4 0 "[ . 1 . 2]" 1 49 SER 1.129 0.088 10 0 "[ . 1 . 2]" 1 50 THR 0.131 0.076 10 0 "[ . 1 . 2]" 1 51 VAL 3.230 0.100 4 0 "[ . 1 . 2]" 1 52 ASP 0.497 0.063 5 0 "[ . 1 . 2]" 1 53 ALA 0.615 0.071 13 0 "[ . 1 . 2]" 1 54 GLU 0.000 0.000 . 0 "[ . 1 . 2]" 1 55 ALA 1.028 0.049 14 0 "[ . 1 . 2]" 1 56 GLN 1.934 0.165 5 0 "[ . 1 . 2]" 1 57 VAL 1.139 0.099 10 0 "[ . 1 . 2]" 1 58 GLY 1.680 0.140 18 0 "[ . 1 . 2]" 1 60 SER 0.507 0.048 7 0 "[ . 1 . 2]" 1 61 PHE 0.507 0.048 7 0 "[ . 1 . 2]" 1 62 LEU 1.239 0.214 13 0 "[ . 1 . 2]" 1 63 ARG 0.072 0.036 6 0 "[ . 1 . 2]" 1 64 GLU 0.716 0.065 1 0 "[ . 1 . 2]" 1 65 LYS 2.495 0.140 17 0 "[ . 1 . 2]" 1 66 PHE 3.038 0.140 17 0 "[ . 1 . 2]" 1 67 ALA 0.534 0.044 2 0 "[ . 1 . 2]" 1 68 THR 1.180 0.175 6 0 "[ . 1 . 2]" 1 69 ARG 0.120 0.052 14 0 "[ . 1 . 2]" 1 70 VAL 1.124 0.090 12 0 "[ . 1 . 2]" 1 71 ARG 0.974 0.090 3 0 "[ . 1 . 2]" 1 72 ARG 0.378 0.078 17 0 "[ . 1 . 2]" 1 73 ASP 1.368 0.088 10 0 "[ . 1 . 2]" 1 74 LYS 0.229 0.061 12 0 "[ . 1 . 2]" 1 75 ASP 0.800 0.117 4 0 "[ . 1 . 2]" 1 76 ALA 0.752 0.117 4 0 "[ . 1 . 2]" 1 77 ARG 1.456 0.097 6 0 "[ . 1 . 2]" 1 78 SER 3.884 0.097 6 0 "[ . 1 . 2]" 1 79 ILE 3.128 0.142 9 0 "[ . 1 . 2]" 1 80 ASP 2.472 0.142 9 0 "[ . 1 . 2]" 1 81 VAL 0.991 0.084 2 0 "[ . 1 . 2]" 1 82 SER 0.467 0.061 8 0 "[ . 1 . 2]" 1 83 LEU 1.614 0.175 6 0 "[ . 1 . 2]" 1 84 LEU 1.620 0.276 15 0 "[ . 1 . 2]" 1 85 TYR 3.153 0.276 15 0 "[ . 1 . 2]" 1 86 GLY 0.873 0.105 15 0 "[ . 1 . 2]" 1 87 PRO 0.186 0.167 20 0 "[ . 1 . 2]" 1 88 PHE 0.561 0.167 20 0 "[ . 1 . 2]" 1 89 LYS 0.466 0.089 7 0 "[ . 1 . 2]" 1 90 ARG 0.921 0.084 19 0 "[ . 1 . 2]" 1 91 LEU 0.186 0.056 19 0 "[ . 1 . 2]" 1 92 ASN 1.071 0.117 11 0 "[ . 1 . 2]" 1 93 ASN 0.888 0.084 2 0 "[ . 1 . 2]" 1 94 GLY 0.956 0.167 17 0 "[ . 1 . 2]" 1 95 TRP 1.255 0.167 17 0 "[ . 1 . 2]" 1 96 ARG 0.943 0.115 8 0 "[ . 1 . 2]" 1 97 PHE 0.656 0.081 17 0 "[ . 1 . 2]" 1 98 MET 0.312 0.072 10 0 "[ . 1 . 2]" 1 99 PRO 1.159 0.115 12 0 "[ . 1 . 2]" 1 100 GLU 2.235 0.152 6 0 "[ . 1 . 2]" 1 101 GLY 1.733 0.143 2 0 "[ . 1 . 2]" 1 102 ASP 1.970 0.143 2 0 "[ . 1 . 2]" 1 103 ALA 0.749 0.042 10 0 "[ . 1 . 2]" 1 104 THR 1.815 0.152 6 0 "[ . 1 . 2]" 1 105 ARG 0.885 0.305 10 0 "[ . 1 . 2]" 1 106 VAL 0.371 0.042 20 0 "[ . 1 . 2]" 1 107 GLU 1.246 0.196 10 0 "[ . 1 . 2]" 1 108 PHE 1.878 0.196 10 0 "[ . 1 . 2]" 1 109 VAL 0.942 0.074 2 0 "[ . 1 . 2]" 1 110 ILE 0.705 0.101 2 0 "[ . 1 . 2]" 1 111 GLU 0.397 0.059 8 0 "[ . 1 . 2]" 1 112 PHE 0.694 0.117 15 0 "[ . 1 . 2]" 1 113 ALA 1.903 0.234 1 0 "[ . 1 . 2]" 1 114 PHE 0.564 0.083 19 0 "[ . 1 . 2]" 1 115 LYS 1.589 0.127 13 0 "[ . 1 . 2]" 1 116 SER 0.956 0.063 3 0 "[ . 1 . 2]" 1 117 ALA 1.292 0.082 13 0 "[ . 1 . 2]" 1 118 LEU 1.131 0.082 13 0 "[ . 1 . 2]" 1 119 LEU 0.813 0.054 13 0 "[ . 1 . 2]" 1 120 ASP 1.782 0.116 8 0 "[ . 1 . 2]" 1 121 ALA 1.070 0.116 8 0 "[ . 1 . 2]" 1 122 MET 0.873 0.083 8 0 "[ . 1 . 2]" 1 123 LEU 0.644 0.083 8 0 "[ . 1 . 2]" 1 124 ALA 0.003 0.003 5 0 "[ . 1 . 2]" 1 125 ALA 0.000 0.000 . 0 "[ . 1 . 2]" 1 126 ASN 0.941 0.066 10 0 "[ . 1 . 2]" 1 127 VAL 1.271 0.076 3 0 "[ . 1 . 2]" 1 128 ASP 1.729 0.076 3 0 "[ . 1 . 2]" 1 129 ARG 0.530 0.061 20 0 "[ . 1 . 2]" 1 130 ALA 2.945 0.125 8 0 "[ . 1 . 2]" 1 131 ALA 1.277 0.073 2 0 "[ . 1 . 2]" 1 132 GLY 1.108 0.099 18 0 "[ . 1 . 2]" 1 133 LYS 5.925 0.232 13 0 "[ . 1 . 2]" 1 134 LEU 3.392 0.516 19 1 "[ . 1 . +2]" 1 135 ILE 3.460 0.516 19 1 "[ . 1 . +2]" 1 136 ALA 0.086 0.031 2 0 "[ . 1 . 2]" 1 137 CYS 2.135 0.188 18 0 "[ . 1 . 2]" 1 138 PHE 0.481 0.128 19 0 "[ . 1 . 2]" 1 139 GLU 1.183 0.105 6 0 "[ . 1 . 2]" 1 140 ALA 2.129 0.105 6 0 "[ . 1 . 2]" 1 141 ARG 1.480 0.088 18 0 "[ . 1 . 2]" 1 142 ALA 0.518 0.046 9 0 "[ . 1 . 2]" 1 143 GLN 0.983 0.084 18 0 "[ . 1 . 2]" 1 144 GLN 0.408 0.048 3 0 "[ . 1 . 2]" 1 145 LEU 0.616 0.038 9 0 "[ . 1 . 2]" 1 146 HIS 0.673 0.118 3 0 "[ . 1 . 2]" 1 147 GLY 0.228 0.090 3 0 "[ . 1 . 2]" 1 148 ALA 0.174 0.050 3 0 "[ . 1 . 2]" stop_ loop_ _Distance_constraint_stats.Restraint_ID _Distance_constraint_stats.Atom_1_entity_assembly_ID _Distance_constraint_stats.Atom_1_comp_index_ID _Distance_constraint_stats.Atom_1_comp_ID _Distance_constraint_stats.Atom_1_ID _Distance_constraint_stats.Atom_2_entity_assembly_ID _Distance_constraint_stats.Atom_2_comp_index_ID _Distance_constraint_stats.Atom_2_comp_ID _Distance_constraint_stats.Atom_2_ID _Distance_constraint_stats.Node_1_distance_val _Distance_constraint_stats.Node_1_distance_lower_bound_val _Distance_constraint_stats.Node_1_distance_upper_bound_val _Distance_constraint_stats.Distance_average _Distance_constraint_stats.Distance_minimum _Distance_constraint_stats.Distance_maximum _Distance_constraint_stats.Max_violation _Distance_constraint_stats.Max_violation_model_number _Distance_constraint_stats.Over_cutoff_violation_count _Distance_constraint_stats.Over_cutoff_viol_per_model _Distance_constraint_stats.Distance_constraint_stats_ID 1 1 1 MET HA 1 2 HIS H . . 2.830 2.719 2.335 2.898 0.068 11 0 "[ . 1 . 2]" 1 2 1 1 MET HA 1 113 ALA HA . . 4.790 4.607 2.543 5.024 0.234 1 0 "[ . 1 . 2]" 1 3 1 1 MET HA 1 113 ALA MB . . 6.220 4.482 2.929 5.058 . 0 0 "[ . 1 . 2]" 1 4 1 1 MET QB 1 2 HIS H . . 3.430 2.172 1.929 2.839 . 0 0 "[ . 1 . 2]" 1 5 1 1 MET HB2 1 2 HIS H . . 3.800 3.551 2.922 3.822 0.022 18 0 "[ . 1 . 2]" 1 6 1 1 MET HB3 1 2 HIS H . . 3.800 2.242 1.938 3.853 0.053 16 0 "[ . 1 . 2]" 1 7 1 1 MET QG 1 2 HIS H . . 5.570 3.192 1.916 4.596 . 0 0 "[ . 1 . 2]" 1 8 1 2 HIS H 1 2 HIS HD2 . . 4.690 2.369 1.977 3.869 . 0 0 "[ . 1 . 2]" 1 9 1 2 HIS H 1 3 ARG H . . 5.030 4.505 4.097 4.648 . 0 0 "[ . 1 . 2]" 1 10 1 2 HIS H 1 112 PHE H . . 4.630 4.377 3.776 4.682 0.052 5 0 "[ . 1 . 2]" 1 11 1 2 HIS H 1 113 ALA MB . . 6.530 4.752 3.949 5.354 . 0 0 "[ . 1 . 2]" 1 12 1 2 HIS H 1 124 ALA MB . . 6.530 5.395 5.185 5.475 . 0 0 "[ . 1 . 2]" 1 13 1 2 HIS HA 1 3 ARG H . . 2.430 2.238 2.186 2.428 . 0 0 "[ . 1 . 2]" 1 14 1 2 HIS QB 1 3 ARG H . . 6.380 3.230 2.549 3.490 . 0 0 "[ . 1 . 2]" 1 15 1 2 HIS QB 1 112 PHE H . . 6.380 4.349 3.534 5.745 . 0 0 "[ . 1 . 2]" 1 16 1 2 HIS HD2 1 113 ALA HA . . 5.500 4.344 4.032 4.614 . 0 0 "[ . 1 . 2]" 1 17 1 2 HIS HD2 1 113 ALA MB . . 6.530 5.263 4.834 5.411 . 0 0 "[ . 1 . 2]" 1 18 1 3 ARG H 1 3 ARG HB2 . . 3.730 3.168 2.896 3.333 . 0 0 "[ . 1 . 2]" 1 19 1 3 ARG H 1 3 ARG QB . . 3.380 2.478 2.332 2.577 . 0 0 "[ . 1 . 2]" 1 20 1 3 ARG H 1 3 ARG HB3 . . 3.730 2.590 2.451 2.709 . 0 0 "[ . 1 . 2]" 1 21 1 3 ARG H 1 3 ARG HG2 . . 5.500 4.317 4.180 4.474 . 0 0 "[ . 1 . 2]" 1 22 1 3 ARG H 1 3 ARG HG3 . . 5.500 4.736 4.548 4.999 . 0 0 "[ . 1 . 2]" 1 23 1 3 ARG H 1 4 HIS H . . 4.940 4.334 4.146 4.467 . 0 0 "[ . 1 . 2]" 1 24 1 3 ARG HA 1 4 HIS H . . 2.400 2.270 2.225 2.405 0.005 18 0 "[ . 1 . 2]" 1 25 1 3 ARG HA 1 110 ILE H . . 5.500 4.716 4.131 5.030 . 0 0 "[ . 1 . 2]" 1 26 1 3 ARG HA 1 111 GLU HA . . 3.420 2.574 2.280 2.764 . 0 0 "[ . 1 . 2]" 1 27 1 3 ARG HA 1 111 GLU QB . . 6.380 4.078 2.421 4.542 . 0 0 "[ . 1 . 2]" 1 28 1 3 ARG HA 1 111 GLU HG2 . . 5.500 2.777 1.993 4.751 . 0 0 "[ . 1 . 2]" 1 29 1 3 ARG HA 1 111 GLU HG3 . . 5.500 3.535 2.679 5.291 . 0 0 "[ . 1 . 2]" 1 30 1 3 ARG HA 1 112 PHE H . . 4.540 3.936 3.508 4.366 . 0 0 "[ . 1 . 2]" 1 31 1 3 ARG QB 1 4 HIS H . . 4.310 3.781 3.492 3.921 . 0 0 "[ . 1 . 2]" 1 32 1 3 ARG HB2 1 4 HIS H . . 4.510 4.229 3.843 4.392 . 0 0 "[ . 1 . 2]" 1 33 1 3 ARG HB3 1 4 HIS H . . 4.510 4.263 3.989 4.453 . 0 0 "[ . 1 . 2]" 1 34 1 3 ARG QG 1 4 HIS H . . 3.200 2.573 1.912 2.989 . 0 0 "[ . 1 . 2]" 1 35 1 3 ARG QG 1 5 VAL QG . . 7.530 3.268 2.446 4.619 . 0 0 "[ . 1 . 2]" 1 36 1 3 ARG QG 1 111 GLU HA . . 6.380 3.599 3.051 4.069 . 0 0 "[ . 1 . 2]" 1 37 1 3 ARG QG 1 111 GLU QB . . 6.670 3.776 2.426 4.290 . 0 0 "[ . 1 . 2]" 1 38 1 3 ARG QG 1 111 GLU QG . . 6.320 2.021 1.774 3.570 . 0 0 "[ . 1 . 2]" 1 39 1 3 ARG HG2 1 4 HIS H . . 3.610 2.879 1.918 3.528 . 0 0 "[ . 1 . 2]" 1 40 1 3 ARG HG2 1 5 VAL MG1 . . 9.430 4.668 3.693 5.774 . 0 0 "[ . 1 . 2]" 1 41 1 3 ARG HG2 1 5 VAL MG2 . . 9.430 3.973 2.495 6.013 . 0 0 "[ . 1 . 2]" 1 42 1 3 ARG HG2 1 111 GLU HG2 . . 7.250 3.876 2.684 5.423 . 0 0 "[ . 1 . 2]" 1 43 1 3 ARG HG2 1 111 GLU HG3 . . 7.250 3.776 2.525 6.676 . 0 0 "[ . 1 . 2]" 1 44 1 3 ARG HG3 1 4 HIS H . . 3.610 3.222 2.106 3.668 0.058 20 0 "[ . 1 . 2]" 1 45 1 3 ARG HG3 1 5 VAL MG1 . . 9.430 5.645 5.053 6.167 . 0 0 "[ . 1 . 2]" 1 46 1 3 ARG HG3 1 5 VAL MG2 . . 9.430 4.988 3.677 6.669 . 0 0 "[ . 1 . 2]" 1 47 1 3 ARG HG3 1 111 GLU HG2 . . 7.250 2.533 1.987 3.733 . 0 0 "[ . 1 . 2]" 1 48 1 3 ARG HG3 1 111 GLU HG3 . . 7.250 2.346 2.008 5.021 . 0 0 "[ . 1 . 2]" 1 49 1 4 HIS H 1 4 HIS HA . . 2.900 2.920 2.900 2.930 0.030 10 0 "[ . 1 . 2]" 1 50 1 4 HIS H 1 4 HIS HB2 . . 3.980 2.396 2.152 2.680 . 0 0 "[ . 1 . 2]" 1 51 1 4 HIS H 1 4 HIS HB3 . . 3.980 3.321 3.214 3.455 . 0 0 "[ . 1 . 2]" 1 52 1 4 HIS H 1 110 ILE H . . 3.920 3.134 2.734 3.636 . 0 0 "[ . 1 . 2]" 1 53 1 4 HIS H 1 110 ILE MG . . 6.530 4.225 3.831 4.507 . 0 0 "[ . 1 . 2]" 1 54 1 4 HIS H 1 111 GLU HA . . 3.860 3.712 3.070 3.910 0.050 18 0 "[ . 1 . 2]" 1 55 1 4 HIS H 1 127 VAL MG1 . . 5.810 4.625 4.347 4.733 . 0 0 "[ . 1 . 2]" 1 56 1 4 HIS H 1 127 VAL MG2 . . 6.530 5.134 4.764 5.319 . 0 0 "[ . 1 . 2]" 1 57 1 4 HIS HA 1 5 VAL H . . 2.590 2.229 2.204 2.282 . 0 0 "[ . 1 . 2]" 1 58 1 4 HIS HA 1 5 VAL MG1 . . 6.530 4.550 3.208 5.408 . 0 0 "[ . 1 . 2]" 1 59 1 4 HIS HA 1 5 VAL QG . . 5.370 3.225 3.035 3.483 . 0 0 "[ . 1 . 2]" 1 60 1 4 HIS HA 1 5 VAL MG2 . . 6.530 4.065 3.053 5.418 . 0 0 "[ . 1 . 2]" 1 61 1 4 HIS QB 1 5 VAL H . . 4.990 3.389 3.204 3.490 . 0 0 "[ . 1 . 2]" 1 62 1 4 HIS QB 1 5 VAL QG . . 7.030 4.329 4.224 4.404 . 0 0 "[ . 1 . 2]" 1 63 1 4 HIS QB 1 6 VAL MG1 . . 7.410 5.198 5.095 5.243 . 0 0 "[ . 1 . 2]" 1 64 1 4 HIS QB 1 110 ILE MD . . 6.150 1.987 1.684 2.615 . 0 0 "[ . 1 . 2]" 1 65 1 4 HIS QB 1 127 VAL MG1 . . 6.630 2.327 2.136 2.535 . 0 0 "[ . 1 . 2]" 1 66 1 4 HIS QB 1 127 VAL MG2 . . 4.780 3.251 2.888 3.463 . 0 0 "[ . 1 . 2]" 1 67 1 4 HIS HB2 1 5 VAL MG1 . . 8.280 6.319 5.484 6.895 . 0 0 "[ . 1 . 2]" 1 68 1 4 HIS HB2 1 5 VAL MG2 . . 8.280 5.952 5.238 6.965 . 0 0 "[ . 1 . 2]" 1 69 1 4 HIS HB2 1 110 ILE MD . . 6.370 2.023 1.776 2.658 . 0 0 "[ . 1 . 2]" 1 70 1 4 HIS HB2 1 110 ILE MG . . 5.010 4.040 3.901 4.133 . 0 0 "[ . 1 . 2]" 1 71 1 4 HIS HB2 1 127 VAL MG2 . . 5.010 3.508 3.029 3.819 . 0 0 "[ . 1 . 2]" 1 72 1 4 HIS HB3 1 5 VAL MG1 . . 8.280 5.468 4.695 5.943 . 0 0 "[ . 1 . 2]" 1 73 1 4 HIS HB3 1 5 VAL MG2 . . 8.280 5.265 4.716 5.955 . 0 0 "[ . 1 . 2]" 1 74 1 4 HIS HB3 1 110 ILE MD . . 6.370 3.033 2.093 3.880 . 0 0 "[ . 1 . 2]" 1 75 1 4 HIS HB3 1 110 ILE MG . . 5.010 3.573 3.291 3.757 . 0 0 "[ . 1 . 2]" 1 76 1 4 HIS HB3 1 127 VAL MG2 . . 5.010 3.855 3.635 4.014 . 0 0 "[ . 1 . 2]" 1 77 1 4 HIS HD2 1 6 VAL MG1 . . 6.530 5.198 4.857 5.315 . 0 0 "[ . 1 . 2]" 1 78 1 4 HIS HD2 1 6 VAL MG2 . . 6.530 3.806 3.519 4.133 . 0 0 "[ . 1 . 2]" 1 79 1 4 HIS HD2 1 127 VAL MG1 . . 6.400 2.165 1.972 2.368 . 0 0 "[ . 1 . 2]" 1 80 1 4 HIS HD2 1 127 VAL MG2 . . 5.500 4.397 4.197 4.550 . 0 0 "[ . 1 . 2]" 1 81 1 4 HIS HD2 1 131 ALA MB . . 6.530 4.656 4.126 5.036 . 0 0 "[ . 1 . 2]" 1 82 1 5 VAL H 1 5 VAL HB . . 3.210 2.871 2.559 3.266 0.056 5 0 "[ . 1 . 2]" 1 83 1 5 VAL H 1 5 VAL MG1 . . 4.760 3.040 1.844 3.845 . 0 0 "[ . 1 . 2]" 1 84 1 5 VAL H 1 5 VAL QG . . 4.030 2.068 1.838 2.419 . 0 0 "[ . 1 . 2]" 1 85 1 5 VAL H 1 5 VAL MG2 . . 4.760 2.788 1.987 3.710 . 0 0 "[ . 1 . 2]" 1 86 1 5 VAL H 1 6 VAL H . . 4.790 4.517 4.468 4.574 . 0 0 "[ . 1 . 2]" 1 87 1 5 VAL H 1 127 VAL MG1 . . 6.340 5.274 5.099 5.350 . 0 0 "[ . 1 . 2]" 1 88 1 5 VAL HA 1 6 VAL H . . 2.400 2.279 2.208 2.355 . 0 0 "[ . 1 . 2]" 1 89 1 5 VAL HA 1 6 VAL MG1 . . 6.530 5.278 5.143 5.393 . 0 0 "[ . 1 . 2]" 1 90 1 5 VAL HA 1 6 VAL MG2 . . 4.510 3.063 2.934 3.247 . 0 0 "[ . 1 . 2]" 1 91 1 5 VAL HA 1 109 VAL HA . . 3.080 2.739 2.371 3.080 . 0 0 "[ . 1 . 2]" 1 92 1 5 VAL HA 1 110 ILE H . . 4.040 3.622 3.453 3.897 . 0 0 "[ . 1 . 2]" 1 93 1 5 VAL HB 1 6 VAL H . . 3.860 3.879 3.834 3.942 0.082 5 0 "[ . 1 . 2]" 1 94 1 5 VAL HB 1 6 VAL MG2 . . 6.530 4.704 4.456 5.032 . 0 0 "[ . 1 . 2]" 1 95 1 5 VAL QG 1 6 VAL H . . 4.890 2.298 1.969 2.656 . 0 0 "[ . 1 . 2]" 1 96 1 5 VAL QG 1 7 THR HA . . 8.090 4.554 4.218 4.871 . 0 0 "[ . 1 . 2]" 1 97 1 5 VAL QG 1 7 THR MG . . 9.120 4.530 4.159 5.034 . 0 0 "[ . 1 . 2]" 1 98 1 5 VAL QG 1 108 PHE H . . 8.090 4.002 3.468 4.326 . 0 0 "[ . 1 . 2]" 1 99 1 5 VAL QG 1 108 PHE QB . . 8.970 4.825 4.446 5.071 . 0 0 "[ . 1 . 2]" 1 100 1 5 VAL QG 1 108 PHE QD . . 10.210 5.840 5.304 6.188 . 0 0 "[ . 1 . 2]" 1 101 1 5 VAL MG1 1 6 VAL H . . 5.230 3.035 1.973 4.322 . 0 0 "[ . 1 . 2]" 1 102 1 5 VAL MG2 1 6 VAL H . . 5.230 3.444 1.974 4.389 . 0 0 "[ . 1 . 2]" 1 103 1 6 VAL H 1 6 VAL HB . . 3.170 3.004 2.776 3.160 . 0 0 "[ . 1 . 2]" 1 104 1 6 VAL H 1 6 VAL MG1 . . 4.790 3.964 3.907 3.999 . 0 0 "[ . 1 . 2]" 1 105 1 6 VAL H 1 6 VAL MG2 . . 4.700 2.537 2.372 2.724 . 0 0 "[ . 1 . 2]" 1 106 1 6 VAL H 1 7 THR H . . 4.910 4.060 3.792 4.317 . 0 0 "[ . 1 . 2]" 1 107 1 6 VAL H 1 108 PHE H . . 3.920 2.968 2.601 3.280 . 0 0 "[ . 1 . 2]" 1 108 1 6 VAL H 1 109 VAL HA . . 3.730 3.719 3.613 3.781 0.051 11 0 "[ . 1 . 2]" 1 109 1 6 VAL H 1 109 VAL QG . . 6.690 3.793 3.156 4.469 . 0 0 "[ . 1 . 2]" 1 110 1 6 VAL HA 1 6 VAL MG2 . . 3.550 2.627 2.543 2.764 . 0 0 "[ . 1 . 2]" 1 111 1 6 VAL HA 1 7 THR H . . 2.400 2.198 2.182 2.254 . 0 0 "[ . 1 . 2]" 1 112 1 6 VAL HA 1 7 THR HA . . 4.910 4.391 4.384 4.410 . 0 0 "[ . 1 . 2]" 1 113 1 6 VAL HA 1 7 THR HB . . 4.970 4.366 4.195 4.524 . 0 0 "[ . 1 . 2]" 1 114 1 6 VAL HA 1 7 THR MG . . 6.530 5.419 5.344 5.468 . 0 0 "[ . 1 . 2]" 1 115 1 6 VAL HB 1 7 THR H . . 4.380 4.175 3.668 4.399 0.019 1 0 "[ . 1 . 2]" 1 116 1 6 VAL HB 1 108 PHE H . . 3.270 3.209 2.850 3.394 0.124 10 0 "[ . 1 . 2]" 1 117 1 6 VAL HB 1 108 PHE HB2 . . 4.290 3.195 1.904 4.231 . 0 0 "[ . 1 . 2]" 1 118 1 6 VAL HB 1 108 PHE QB . . 3.890 2.125 1.852 2.569 . 0 0 "[ . 1 . 2]" 1 119 1 6 VAL HB 1 108 PHE HB3 . . 4.290 2.349 1.988 2.965 . 0 0 "[ . 1 . 2]" 1 120 1 6 VAL MG1 1 7 THR H . . 4.170 3.010 2.535 3.305 . 0 0 "[ . 1 . 2]" 1 121 1 6 VAL MG1 1 7 THR HA . . 6.530 4.313 4.137 4.521 . 0 0 "[ . 1 . 2]" 1 122 1 6 VAL MG1 1 7 THR HB . . 6.530 5.089 4.754 5.298 . 0 0 "[ . 1 . 2]" 1 123 1 6 VAL MG1 1 8 LYS H . . 6.530 4.822 4.555 5.271 . 0 0 "[ . 1 . 2]" 1 124 1 6 VAL MG1 1 8 LYS HB2 . . 6.530 5.255 4.192 5.391 . 0 0 "[ . 1 . 2]" 1 125 1 6 VAL MG1 1 8 LYS HB3 . . 6.530 3.959 3.667 5.215 . 0 0 "[ . 1 . 2]" 1 126 1 6 VAL MG1 1 108 PHE H . . 5.540 4.466 4.171 4.681 . 0 0 "[ . 1 . 2]" 1 127 1 6 VAL MG1 1 108 PHE HB2 . . 6.530 4.347 3.408 5.400 . 0 0 "[ . 1 . 2]" 1 128 1 6 VAL MG1 1 108 PHE QB . . 5.850 3.497 3.122 4.013 . 0 0 "[ . 1 . 2]" 1 129 1 6 VAL MG1 1 108 PHE HB3 . . 6.530 3.806 3.203 4.359 . 0 0 "[ . 1 . 2]" 1 130 1 6 VAL MG1 1 131 ALA H . . 6.090 4.846 4.537 5.003 . 0 0 "[ . 1 . 2]" 1 131 1 6 VAL MG1 1 131 ALA MB . . 6.100 2.108 1.839 2.404 . 0 0 "[ . 1 . 2]" 1 132 1 6 VAL MG2 1 7 THR H . . 5.260 4.400 4.342 4.441 . 0 0 "[ . 1 . 2]" 1 133 1 6 VAL MG2 1 108 PHE H . . 6.030 4.068 3.719 4.456 . 0 0 "[ . 1 . 2]" 1 134 1 6 VAL MG2 1 108 PHE QB . . 6.170 2.897 2.252 3.396 . 0 0 "[ . 1 . 2]" 1 135 1 6 VAL MG2 1 108 PHE QD . . 8.650 3.462 2.448 4.691 . 0 0 "[ . 1 . 2]" 1 136 1 6 VAL MG2 1 131 ALA MB . . 6.350 2.344 1.966 2.620 . 0 0 "[ . 1 . 2]" 1 137 1 6 VAL MG2 1 135 ILE MD . . 7.560 3.962 3.402 5.103 . 0 0 "[ . 1 . 2]" 1 138 1 6 VAL MG2 1 135 ILE QG . . 7.410 4.934 4.317 5.406 . 0 0 "[ . 1 . 2]" 1 139 1 7 THR H 1 7 THR HB . . 3.020 2.429 2.331 2.500 . 0 0 "[ . 1 . 2]" 1 140 1 7 THR H 1 7 THR MG . . 4.760 3.724 3.652 3.778 . 0 0 "[ . 1 . 2]" 1 141 1 7 THR H 1 8 LYS H . . 4.570 4.344 4.187 4.511 . 0 0 "[ . 1 . 2]" 1 142 1 7 THR HA 1 7 THR MG . . 3.610 2.539 2.451 2.660 . 0 0 "[ . 1 . 2]" 1 143 1 7 THR HA 1 8 LYS H . . 2.400 2.166 2.150 2.220 . 0 0 "[ . 1 . 2]" 1 144 1 7 THR HA 1 8 LYS QB . . 5.850 4.345 3.973 4.610 . 0 0 "[ . 1 . 2]" 1 145 1 7 THR HA 1 106 VAL H . . 4.760 4.600 4.419 4.789 0.029 16 0 "[ . 1 . 2]" 1 146 1 7 THR HA 1 107 GLU HA . . 3.050 2.493 2.211 2.933 . 0 0 "[ . 1 . 2]" 1 147 1 7 THR HA 1 108 PHE H . . 3.730 3.508 3.252 3.697 . 0 0 "[ . 1 . 2]" 1 148 1 7 THR HB 1 8 LYS H . . 4.660 4.471 4.218 4.602 . 0 0 "[ . 1 . 2]" 1 149 1 7 THR MG 1 8 LYS H . . 4.570 2.809 2.424 3.224 . 0 0 "[ . 1 . 2]" 1 150 1 7 THR MG 1 9 VAL HA . . 6.160 5.012 4.904 5.070 . 0 0 "[ . 1 . 2]" 1 151 1 7 THR MG 1 108 PHE H . . 6.530 5.237 4.855 5.407 . 0 0 "[ . 1 . 2]" 1 152 1 8 LYS H 1 8 LYS HB2 . . 4.140 3.754 3.068 3.923 . 0 0 "[ . 1 . 2]" 1 153 1 8 LYS H 1 8 LYS QB . . 3.680 3.013 2.598 3.216 . 0 0 "[ . 1 . 2]" 1 154 1 8 LYS H 1 8 LYS HB3 . . 4.140 3.205 2.705 3.899 . 0 0 "[ . 1 . 2]" 1 155 1 8 LYS H 1 106 VAL H . . 3.270 3.061 2.831 3.273 0.003 20 0 "[ . 1 . 2]" 1 156 1 8 LYS H 1 106 VAL HB . . 3.830 3.594 3.062 3.833 0.003 1 0 "[ . 1 . 2]" 1 157 1 8 LYS H 1 106 VAL MG1 . . 5.540 4.326 3.804 4.582 . 0 0 "[ . 1 . 2]" 1 158 1 8 LYS H 1 106 VAL MG2 . . 6.530 4.797 4.496 5.007 . 0 0 "[ . 1 . 2]" 1 159 1 8 LYS H 1 107 GLU HA . . 3.830 3.690 3.507 3.878 0.048 17 0 "[ . 1 . 2]" 1 160 1 8 LYS HA 1 8 LYS QD . . 4.920 3.913 3.516 4.284 . 0 0 "[ . 1 . 2]" 1 161 1 8 LYS HA 1 9 VAL H . . 2.710 2.453 2.349 2.561 . 0 0 "[ . 1 . 2]" 1 162 1 8 LYS HA 1 9 VAL HB . . 4.510 4.278 4.134 4.411 . 0 0 "[ . 1 . 2]" 1 163 1 8 LYS HA 1 9 VAL MG1 . . 6.530 4.451 3.478 5.413 . 0 0 "[ . 1 . 2]" 1 164 1 8 LYS HA 1 9 VAL QG . . 5.430 3.512 3.278 3.786 . 0 0 "[ . 1 . 2]" 1 165 1 8 LYS HA 1 9 VAL MG2 . . 6.530 4.490 3.306 5.396 . 0 0 "[ . 1 . 2]" 1 166 1 8 LYS QB 1 9 VAL H . . 3.540 2.579 2.398 3.533 . 0 0 "[ . 1 . 2]" 1 167 1 8 LYS QB 1 10 LEU H . . 6.380 5.326 4.910 5.620 . 0 0 "[ . 1 . 2]" 1 168 1 8 LYS QB 1 106 VAL HB . . 5.250 4.326 2.677 4.766 . 0 0 "[ . 1 . 2]" 1 169 1 8 LYS QB 1 135 ILE MD . . 5.520 2.322 1.842 3.380 . 0 0 "[ . 1 . 2]" 1 170 1 8 LYS QB 1 135 ILE MG . . 4.150 2.392 1.977 2.736 . 0 0 "[ . 1 . 2]" 1 171 1 8 LYS HB2 1 9 VAL H . . 3.830 2.661 2.422 3.930 0.100 15 0 "[ . 1 . 2]" 1 172 1 8 LYS HB2 1 106 VAL HB . . 5.500 4.872 3.602 5.446 . 0 0 "[ . 1 . 2]" 1 173 1 8 LYS HB2 1 135 ILE HB . . 5.500 5.365 4.553 5.526 0.026 2 0 "[ . 1 . 2]" 1 174 1 8 LYS HB2 1 135 ILE MD . . 6.220 3.420 1.887 4.082 . 0 0 "[ . 1 . 2]" 1 175 1 8 LYS HB2 1 135 ILE MG . . 4.920 2.710 2.278 2.990 . 0 0 "[ . 1 . 2]" 1 176 1 8 LYS HB3 1 9 VAL H . . 3.830 3.821 2.580 4.005 0.175 15 0 "[ . 1 . 2]" 1 177 1 8 LYS HB3 1 106 VAL HB . . 5.500 4.960 2.699 5.340 . 0 0 "[ . 1 . 2]" 1 178 1 8 LYS HB3 1 135 ILE HB . . 5.500 4.907 4.501 5.613 0.113 15 0 "[ . 1 . 2]" 1 179 1 8 LYS HB3 1 135 ILE MD . . 6.220 2.436 1.956 4.340 . 0 0 "[ . 1 . 2]" 1 180 1 8 LYS HB3 1 135 ILE MG . . 4.920 2.701 2.084 3.387 . 0 0 "[ . 1 . 2]" 1 181 1 8 LYS QD 1 9 VAL H . . 5.880 4.268 3.163 5.033 . 0 0 "[ . 1 . 2]" 1 182 1 8 LYS QD 1 106 VAL MG1 . . 5.950 3.486 2.596 4.231 . 0 0 "[ . 1 . 2]" 1 183 1 8 LYS QD 1 106 VAL MG2 . . 5.890 3.744 2.563 4.258 . 0 0 "[ . 1 . 2]" 1 184 1 8 LYS QD 1 135 ILE HA . . 6.380 4.356 3.040 5.586 . 0 0 "[ . 1 . 2]" 1 185 1 8 LYS QD 1 135 ILE MD . . 6.970 2.751 1.933 4.185 . 0 0 "[ . 1 . 2]" 1 186 1 8 LYS QD 1 135 ILE MG . . 5.570 2.624 1.724 3.607 . 0 0 "[ . 1 . 2]" 1 187 1 8 LYS QG 1 9 VAL H . . 4.580 3.658 1.986 4.257 . 0 0 "[ . 1 . 2]" 1 188 1 8 LYS QG 1 106 VAL HB . . 6.380 2.521 1.916 4.909 . 0 0 "[ . 1 . 2]" 1 189 1 8 LYS QG 1 135 ILE MD . . 6.910 2.982 1.927 3.863 . 0 0 "[ . 1 . 2]" 1 190 1 8 LYS QG 1 135 ILE MG . . 6.190 2.853 2.035 3.692 . 0 0 "[ . 1 . 2]" 1 191 1 9 VAL H 1 9 VAL HB . . 3.270 2.925 2.591 3.244 . 0 0 "[ . 1 . 2]" 1 192 1 9 VAL H 1 9 VAL MG1 . . 4.640 2.889 2.043 3.821 . 0 0 "[ . 1 . 2]" 1 193 1 9 VAL H 1 9 VAL QG . . 4.000 2.497 2.036 3.016 . 0 0 "[ . 1 . 2]" 1 194 1 9 VAL H 1 9 VAL MG2 . . 4.640 3.524 2.991 3.940 . 0 0 "[ . 1 . 2]" 1 195 1 9 VAL H 1 10 LEU H . . 4.570 4.230 4.091 4.303 . 0 0 "[ . 1 . 2]" 1 196 1 9 VAL H 1 10 LEU QD . . 8.100 2.888 2.630 3.128 . 0 0 "[ . 1 . 2]" 1 197 1 9 VAL H 1 135 ILE MG . . 6.310 4.699 4.341 4.989 . 0 0 "[ . 1 . 2]" 1 198 1 9 VAL HA 1 10 LEU H . . 2.490 2.194 2.182 2.217 . 0 0 "[ . 1 . 2]" 1 199 1 9 VAL HA 1 104 THR H . . 4.790 4.656 4.406 4.810 0.020 16 0 "[ . 1 . 2]" 1 200 1 9 VAL HA 1 105 ARG HA . . 2.990 2.328 1.991 2.728 . 0 0 "[ . 1 . 2]" 1 201 1 9 VAL HA 1 106 VAL H . . 3.700 3.275 3.096 3.405 . 0 0 "[ . 1 . 2]" 1 202 1 9 VAL HB 1 10 LEU H . . 4.910 4.354 4.208 4.490 . 0 0 "[ . 1 . 2]" 1 203 1 9 VAL QG 1 10 LEU H . . 4.220 2.625 2.464 2.852 . 0 0 "[ . 1 . 2]" 1 204 1 9 VAL QG 1 103 ALA H . . 7.030 4.470 3.817 4.844 . 0 0 "[ . 1 . 2]" 1 205 1 9 VAL QG 1 103 ALA MB . . 6.620 2.164 1.840 2.442 . 0 0 "[ . 1 . 2]" 1 206 1 9 VAL QG 1 104 THR H . . 5.760 3.292 3.043 3.475 . 0 0 "[ . 1 . 2]" 1 207 1 9 VAL QG 1 105 ARG QB . . 7.450 2.861 1.941 3.707 . 0 0 "[ . 1 . 2]" 1 208 1 9 VAL QG 1 106 VAL H . . 8.090 3.998 2.867 4.557 . 0 0 "[ . 1 . 2]" 1 209 1 9 VAL MG1 1 10 LEU H . . 4.950 3.446 2.489 4.107 . 0 0 "[ . 1 . 2]" 1 210 1 9 VAL MG1 1 103 ALA MB . . 7.560 3.043 1.844 3.930 . 0 0 "[ . 1 . 2]" 1 211 1 9 VAL MG2 1 10 LEU H . . 4.950 3.250 2.484 4.070 . 0 0 "[ . 1 . 2]" 1 212 1 9 VAL MG2 1 103 ALA MB . . 7.560 3.049 1.881 4.246 . 0 0 "[ . 1 . 2]" 1 213 1 10 LEU H 1 10 LEU QB . . 3.610 2.744 2.502 2.945 . 0 0 "[ . 1 . 2]" 1 214 1 10 LEU H 1 10 LEU HG . . 3.950 2.828 2.562 3.058 . 0 0 "[ . 1 . 2]" 1 215 1 10 LEU H 1 11 PRO QD . . 6.260 4.019 3.899 4.094 . 0 0 "[ . 1 . 2]" 1 216 1 10 LEU H 1 103 ALA MB . . 6.530 3.731 3.238 4.281 . 0 0 "[ . 1 . 2]" 1 217 1 10 LEU H 1 104 THR H . . 3.270 3.199 2.990 3.320 0.050 10 0 "[ . 1 . 2]" 1 218 1 10 LEU H 1 104 THR MG . . 4.450 2.839 2.600 3.229 . 0 0 "[ . 1 . 2]" 1 219 1 10 LEU H 1 105 ARG HA . . 4.200 3.598 3.268 4.059 . 0 0 "[ . 1 . 2]" 1 220 1 10 LEU HA 1 10 LEU QD . . 4.050 2.060 1.921 2.510 . 0 0 "[ . 1 . 2]" 1 221 1 10 LEU HA 1 10 LEU HG . . 3.920 3.346 3.228 3.462 . 0 0 "[ . 1 . 2]" 1 222 1 10 LEU QB 1 11 PRO QD . . 5.310 2.928 2.674 3.155 . 0 0 "[ . 1 . 2]" 1 223 1 10 LEU QB 1 12 TYR H . . 5.790 3.437 3.166 3.840 . 0 0 "[ . 1 . 2]" 1 224 1 10 LEU QB 1 106 VAL MG2 . . 7.250 4.065 3.534 4.718 . 0 0 "[ . 1 . 2]" 1 225 1 10 LEU HB2 1 11 PRO HD2 . . 5.500 4.331 3.965 4.625 . 0 0 "[ . 1 . 2]" 1 226 1 10 LEU HB2 1 11 PRO HD3 . . 5.500 4.714 4.531 4.839 . 0 0 "[ . 1 . 2]" 1 227 1 10 LEU HB2 1 12 TYR QD . . 7.640 2.832 2.156 3.612 . 0 0 "[ . 1 . 2]" 1 228 1 10 LEU HB2 1 12 TYR QE . . 7.630 4.377 2.211 5.763 . 0 0 "[ . 1 . 2]" 1 229 1 10 LEU HB3 1 11 PRO HD2 . . 5.500 3.126 2.830 3.402 . 0 0 "[ . 1 . 2]" 1 230 1 10 LEU HB3 1 11 PRO HD3 . . 5.500 3.938 3.663 4.173 . 0 0 "[ . 1 . 2]" 1 231 1 10 LEU HB3 1 12 TYR QD . . 7.640 2.271 1.956 3.226 . 0 0 "[ . 1 . 2]" 1 232 1 10 LEU HB3 1 12 TYR QE . . 7.630 3.040 2.058 4.142 . 0 0 "[ . 1 . 2]" 1 233 1 10 LEU QD 1 11 PRO QD . . 5.320 2.975 2.736 3.239 . 0 0 "[ . 1 . 2]" 1 234 1 10 LEU QD 1 12 TYR H . . 8.100 4.812 4.581 5.160 . 0 0 "[ . 1 . 2]" 1 235 1 10 LEU QD 1 12 TYR QD . . 6.930 2.906 2.380 3.828 . 0 0 "[ . 1 . 2]" 1 236 1 10 LEU QD 1 12 TYR QE . . 7.460 3.128 2.263 4.031 . 0 0 "[ . 1 . 2]" 1 237 1 10 LEU QD 1 106 VAL HB . . 6.140 4.300 3.837 4.563 . 0 0 "[ . 1 . 2]" 1 238 1 10 LEU QD 1 106 VAL MG2 . . 8.410 3.496 3.094 3.789 . 0 0 "[ . 1 . 2]" 1 239 1 10 LEU QD 1 139 GLU HA . . 4.780 2.662 2.327 3.138 . 0 0 "[ . 1 . 2]" 1 240 1 10 LEU QD 1 139 GLU HB2 . . 3.860 2.810 2.736 2.913 . 0 0 "[ . 1 . 2]" 1 241 1 10 LEU QD 1 139 GLU HB3 . . 5.460 3.885 3.771 3.971 . 0 0 "[ . 1 . 2]" 1 242 1 10 LEU QD 1 139 GLU QG . . 4.330 1.970 1.795 2.327 . 0 0 "[ . 1 . 2]" 1 243 1 10 LEU QD 1 142 ALA MB . . 9.130 3.236 2.799 3.775 . 0 0 "[ . 1 . 2]" 1 244 1 10 LEU MD1 1 11 PRO HD2 . . 6.530 4.846 4.525 4.998 . 0 0 "[ . 1 . 2]" 1 245 1 10 LEU MD1 1 11 PRO HD3 . . 6.530 5.390 5.165 5.489 . 0 0 "[ . 1 . 2]" 1 246 1 10 LEU MD1 1 12 TYR QD . . 7.270 3.007 2.395 3.984 . 0 0 "[ . 1 . 2]" 1 247 1 10 LEU MD1 1 12 TYR QE . . 7.850 3.444 2.308 4.579 . 0 0 "[ . 1 . 2]" 1 248 1 10 LEU MD1 1 139 GLU H . . 6.530 3.783 3.470 4.215 . 0 0 "[ . 1 . 2]" 1 249 1 10 LEU MD1 1 139 GLU HA . . 5.320 2.727 2.371 3.262 . 0 0 "[ . 1 . 2]" 1 250 1 10 LEU MD1 1 139 GLU HB2 . . 4.260 3.225 3.020 3.385 . 0 0 "[ . 1 . 2]" 1 251 1 10 LEU MD1 1 139 GLU HG2 . . 5.130 3.409 2.432 4.036 . 0 0 "[ . 1 . 2]" 1 252 1 10 LEU MD1 1 139 GLU HG3 . . 5.130 2.905 2.267 3.580 . 0 0 "[ . 1 . 2]" 1 253 1 10 LEU MD2 1 11 PRO HD2 . . 6.530 3.366 3.016 3.646 . 0 0 "[ . 1 . 2]" 1 254 1 10 LEU MD2 1 11 PRO HD3 . . 6.530 3.420 3.214 3.804 . 0 0 "[ . 1 . 2]" 1 255 1 10 LEU MD2 1 12 TYR QD . . 7.270 4.075 3.761 4.957 . 0 0 "[ . 1 . 2]" 1 256 1 10 LEU MD2 1 12 TYR QE . . 7.850 3.754 3.165 4.679 . 0 0 "[ . 1 . 2]" 1 257 1 10 LEU MD2 1 139 GLU H . . 6.530 4.586 4.244 4.929 . 0 0 "[ . 1 . 2]" 1 258 1 10 LEU MD2 1 139 GLU HA . . 5.320 3.781 3.378 4.125 . 0 0 "[ . 1 . 2]" 1 259 1 10 LEU MD2 1 139 GLU HB2 . . 4.260 3.099 3.009 3.225 . 0 0 "[ . 1 . 2]" 1 260 1 10 LEU MD2 1 139 GLU HG2 . . 5.130 3.254 2.523 3.748 . 0 0 "[ . 1 . 2]" 1 261 1 10 LEU MD2 1 139 GLU HG3 . . 5.130 2.074 1.889 2.617 . 0 0 "[ . 1 . 2]" 1 262 1 10 LEU HG 1 104 THR MG . . 5.190 4.112 3.946 4.204 . 0 0 "[ . 1 . 2]" 1 263 1 11 PRO HA 1 12 TYR H . . 2.740 2.520 2.380 2.617 . 0 0 "[ . 1 . 2]" 1 264 1 11 PRO HA 1 103 ALA MB . . 4.230 2.098 1.897 2.597 . 0 0 "[ . 1 . 2]" 1 265 1 11 PRO QB 1 103 ALA MB . . 5.730 2.208 1.892 2.718 . 0 0 "[ . 1 . 2]" 1 266 1 11 PRO HB2 1 103 ALA MB . . 6.160 3.577 3.279 4.123 . 0 0 "[ . 1 . 2]" 1 267 1 11 PRO HB3 1 103 ALA MB . . 6.160 2.230 1.903 2.757 . 0 0 "[ . 1 . 2]" 1 268 1 12 TYR H 1 12 TYR HA . . 2.930 2.925 2.810 2.944 0.014 12 0 "[ . 1 . 2]" 1 269 1 12 TYR H 1 13 THR H . . 4.600 4.427 4.356 4.526 . 0 0 "[ . 1 . 2]" 1 270 1 12 TYR H 1 103 ALA MB . . 5.190 3.900 3.505 4.240 . 0 0 "[ . 1 . 2]" 1 271 1 12 TYR H 1 104 THR H . . 3.170 3.081 2.892 3.221 0.051 6 0 "[ . 1 . 2]" 1 272 1 12 TYR H 1 104 THR MG . . 5.040 3.779 3.267 4.118 . 0 0 "[ . 1 . 2]" 1 273 1 12 TYR HA 1 13 THR H . . 2.870 2.595 2.429 2.715 . 0 0 "[ . 1 . 2]" 1 274 1 12 TYR QB 1 13 THR H . . 4.240 2.265 2.016 2.593 . 0 0 "[ . 1 . 2]" 1 275 1 12 TYR QD 1 13 THR H . . 7.640 3.629 3.093 3.891 . 0 0 "[ . 1 . 2]" 1 276 1 12 TYR QD 1 16 GLN HG2 . . 7.640 5.005 3.505 5.943 . 0 0 "[ . 1 . 2]" 1 277 1 12 TYR QD 1 16 GLN HG3 . . 7.640 4.576 3.382 5.693 . 0 0 "[ . 1 . 2]" 1 278 1 12 TYR QD 1 142 ALA MB . . 6.810 2.847 2.422 3.464 . 0 0 "[ . 1 . 2]" 1 279 1 12 TYR QD 1 146 HIS HB2 . . 7.640 4.666 3.113 6.248 . 0 0 "[ . 1 . 2]" 1 280 1 12 TYR QD 1 146 HIS HB3 . . 7.640 5.098 3.546 6.093 . 0 0 "[ . 1 . 2]" 1 281 1 12 TYR QE 1 16 GLN HG2 . . 7.630 6.201 2.754 7.028 . 0 0 "[ . 1 . 2]" 1 282 1 12 TYR QE 1 16 GLN HG3 . . 7.630 5.697 1.967 6.972 . 0 0 "[ . 1 . 2]" 1 283 1 12 TYR QE 1 139 GLU HA . . 7.630 3.496 2.058 4.905 . 0 0 "[ . 1 . 2]" 1 284 1 12 TYR QE 1 139 GLU HG2 . . 7.630 2.792 1.994 6.033 . 0 0 "[ . 1 . 2]" 1 285 1 12 TYR QE 1 139 GLU QG . . 7.430 2.652 1.921 5.343 . 0 0 "[ . 1 . 2]" 1 286 1 12 TYR QE 1 139 GLU HG3 . . 7.630 3.579 2.309 5.962 . 0 0 "[ . 1 . 2]" 1 287 1 12 TYR QE 1 142 ALA MB . . 6.740 2.568 1.906 3.373 . 0 0 "[ . 1 . 2]" 1 288 1 12 TYR QE 1 143 GLN HA . . 7.260 3.959 2.337 5.677 . 0 0 "[ . 1 . 2]" 1 289 1 12 TYR QE 1 146 HIS HB2 . . 7.630 4.218 2.627 6.352 . 0 0 "[ . 1 . 2]" 1 290 1 12 TYR QE 1 146 HIS HB3 . . 7.630 4.575 2.760 6.190 . 0 0 "[ . 1 . 2]" 1 291 1 13 THR H 1 13 THR MG . . 3.430 2.114 1.905 2.479 . 0 0 "[ . 1 . 2]" 1 292 1 13 THR H 1 14 PRO QD . . 6.380 4.315 4.288 4.329 . 0 0 "[ . 1 . 2]" 1 293 1 13 THR H 1 16 GLN H . . 5.280 4.472 4.091 5.319 0.039 18 0 "[ . 1 . 2]" 1 294 1 13 THR HA 1 13 THR HB . . 2.520 2.502 2.373 2.559 0.039 20 0 "[ . 1 . 2]" 1 295 1 13 THR HA 1 13 THR MG . . 3.520 2.462 2.321 2.651 . 0 0 "[ . 1 . 2]" 1 296 1 13 THR HA 1 15 ASP H . . 5.000 3.862 3.679 4.022 . 0 0 "[ . 1 . 2]" 1 297 1 13 THR MG 1 14 PRO QD . . 6.130 3.195 3.041 3.444 . 0 0 "[ . 1 . 2]" 1 298 1 13 THR MG 1 15 ASP H . . 6.060 4.116 3.984 4.205 . 0 0 "[ . 1 . 2]" 1 299 1 14 PRO HA 1 17 LEU H . . 4.850 3.289 3.062 3.417 . 0 0 "[ . 1 . 2]" 1 300 1 14 PRO QG 1 15 ASP H . . 5.420 3.614 3.224 3.771 . 0 0 "[ . 1 . 2]" 1 301 1 15 ASP H 1 15 ASP HA . . 2.770 2.779 2.696 2.815 0.045 17 0 "[ . 1 . 2]" 1 302 1 15 ASP H 1 15 ASP HB2 . . 2.710 2.536 2.336 2.704 . 0 0 "[ . 1 . 2]" 1 303 1 15 ASP H 1 15 ASP HB3 . . 2.590 2.397 2.259 2.580 . 0 0 "[ . 1 . 2]" 1 304 1 15 ASP H 1 16 GLN H . . 2.740 2.610 2.519 2.827 0.087 18 0 "[ . 1 . 2]" 1 305 1 15 ASP H 1 16 GLN HA . . 5.500 5.122 5.049 5.306 . 0 0 "[ . 1 . 2]" 1 306 1 15 ASP HA 1 18 PHE H . . 3.610 3.240 3.108 3.321 . 0 0 "[ . 1 . 2]" 1 307 1 15 ASP HA 1 18 PHE HA . . 5.500 5.263 5.118 5.538 0.038 16 0 "[ . 1 . 2]" 1 308 1 15 ASP HA 1 18 PHE HB2 . . 5.070 2.813 2.635 3.132 . 0 0 "[ . 1 . 2]" 1 309 1 15 ASP HA 1 18 PHE QB . . 4.560 2.775 2.602 3.090 . 0 0 "[ . 1 . 2]" 1 310 1 15 ASP HA 1 18 PHE HB3 . . 5.070 4.255 3.792 4.729 . 0 0 "[ . 1 . 2]" 1 311 1 15 ASP HA 1 19 GLU H . . 5.310 5.332 5.167 5.395 0.085 20 0 "[ . 1 . 2]" 1 312 1 15 ASP HB2 1 16 GLN H . . 4.450 3.840 3.670 3.989 . 0 0 "[ . 1 . 2]" 1 313 1 15 ASP HB3 1 16 GLN H . . 3.800 2.483 2.348 2.648 . 0 0 "[ . 1 . 2]" 1 314 1 16 GLN H 1 16 GLN HB2 . . 3.170 2.202 2.025 2.497 . 0 0 "[ . 1 . 2]" 1 315 1 16 GLN H 1 16 GLN HB3 . . 3.890 3.445 3.266 3.551 . 0 0 "[ . 1 . 2]" 1 316 1 16 GLN H 1 16 GLN HG2 . . 4.140 3.185 2.196 3.992 . 0 0 "[ . 1 . 2]" 1 317 1 16 GLN H 1 16 GLN QG . . 3.940 2.861 2.179 3.545 . 0 0 "[ . 1 . 2]" 1 318 1 16 GLN H 1 16 GLN HG3 . . 4.140 3.615 2.592 4.174 0.034 12 0 "[ . 1 . 2]" 1 319 1 16 GLN H 1 17 LEU H . . 3.170 2.767 2.724 2.825 . 0 0 "[ . 1 . 2]" 1 320 1 16 GLN HA 1 16 GLN HB3 . . 2.930 2.723 2.539 2.887 . 0 0 "[ . 1 . 2]" 1 321 1 16 GLN HA 1 19 GLU H . . 3.860 3.569 3.442 3.673 . 0 0 "[ . 1 . 2]" 1 322 1 16 GLN HA 1 19 GLU QB . . 4.420 3.513 3.223 3.628 . 0 0 "[ . 1 . 2]" 1 323 1 16 GLN HA 1 19 GLU HG2 . . 5.500 4.845 4.579 5.114 . 0 0 "[ . 1 . 2]" 1 324 1 16 GLN HA 1 19 GLU HG3 . . 5.500 3.373 3.000 3.664 . 0 0 "[ . 1 . 2]" 1 325 1 16 GLN HA 1 20 LEU H . . 4.970 4.912 4.587 5.023 0.053 12 0 "[ . 1 . 2]" 1 326 1 16 GLN HB3 1 17 LEU H . . 3.800 3.652 3.228 3.848 0.048 9 0 "[ . 1 . 2]" 1 327 1 17 LEU H 1 17 LEU HB2 . . 3.050 2.434 2.357 2.551 . 0 0 "[ . 1 . 2]" 1 328 1 17 LEU H 1 17 LEU MD1 . . 4.570 3.172 2.883 3.366 . 0 0 "[ . 1 . 2]" 1 329 1 17 LEU H 1 17 LEU QD . . 3.900 2.991 2.809 3.057 . 0 0 "[ . 1 . 2]" 1 330 1 17 LEU H 1 17 LEU MD2 . . 4.570 3.689 3.434 3.875 . 0 0 "[ . 1 . 2]" 1 331 1 17 LEU H 1 17 LEU HG . . 2.960 2.273 2.011 2.454 . 0 0 "[ . 1 . 2]" 1 332 1 17 LEU H 1 18 PHE H . . 2.740 2.597 2.471 2.684 . 0 0 "[ . 1 . 2]" 1 333 1 17 LEU HA 1 17 LEU MD1 . . 4.790 3.912 3.845 3.959 . 0 0 "[ . 1 . 2]" 1 334 1 17 LEU HA 1 17 LEU QD . . 4.160 2.415 2.263 2.724 . 0 0 "[ . 1 . 2]" 1 335 1 17 LEU HA 1 17 LEU MD2 . . 4.790 2.440 2.277 2.786 . 0 0 "[ . 1 . 2]" 1 336 1 17 LEU HA 1 19 GLU H . . 4.630 3.936 3.828 4.084 . 0 0 "[ . 1 . 2]" 1 337 1 17 LEU HA 1 20 LEU H . . 3.140 2.864 2.831 2.913 . 0 0 "[ . 1 . 2]" 1 338 1 17 LEU HA 1 20 LEU HB2 . . 3.210 2.080 1.957 2.305 . 0 0 "[ . 1 . 2]" 1 339 1 17 LEU HA 1 20 LEU HB3 . . 3.490 3.393 3.200 3.543 0.053 20 0 "[ . 1 . 2]" 1 340 1 17 LEU HA 1 21 VAL H . . 4.260 3.859 3.672 4.053 . 0 0 "[ . 1 . 2]" 1 341 1 17 LEU HB2 1 18 PHE H . . 3.860 2.734 2.567 2.824 . 0 0 "[ . 1 . 2]" 1 342 1 17 LEU HB2 1 21 VAL H . . 5.190 5.153 4.911 5.305 0.115 6 0 "[ . 1 . 2]" 1 343 1 17 LEU HB3 1 21 VAL H . . 5.500 4.232 4.108 4.385 . 0 0 "[ . 1 . 2]" 1 344 1 17 LEU QD 1 18 PHE H . . 8.100 4.027 3.891 4.132 . 0 0 "[ . 1 . 2]" 1 345 1 17 LEU HG 1 20 LEU H . . 5.500 5.572 5.391 5.699 0.199 20 0 "[ . 1 . 2]" 1 346 1 17 LEU HG 1 21 VAL MG2 . . 6.530 5.275 4.930 5.450 . 0 0 "[ . 1 . 2]" 1 347 1 18 PHE H 1 18 PHE HA . . 2.740 2.698 2.692 2.709 . 0 0 "[ . 1 . 2]" 1 348 1 18 PHE H 1 18 PHE HB2 . . 3.550 1.937 1.902 2.045 . 0 0 "[ . 1 . 2]" 1 349 1 18 PHE H 1 18 PHE QB . . 3.070 1.913 1.886 1.993 . 0 0 "[ . 1 . 2]" 1 350 1 18 PHE H 1 18 PHE HB3 . . 3.550 2.987 2.756 3.206 . 0 0 "[ . 1 . 2]" 1 351 1 18 PHE H 1 19 GLU H . . 2.990 2.898 2.865 2.918 . 0 0 "[ . 1 . 2]" 1 352 1 18 PHE HA 1 18 PHE HB2 . . 3.020 2.785 2.665 2.901 . 0 0 "[ . 1 . 2]" 1 353 1 18 PHE HA 1 18 PHE HB3 . . 3.020 3.010 2.931 3.063 0.043 7 0 "[ . 1 . 2]" 1 354 1 18 PHE HA 1 19 GLU H . . 3.610 3.589 3.570 3.605 . 0 0 "[ . 1 . 2]" 1 355 1 18 PHE HA 1 19 GLU QG . . 6.380 5.049 4.951 5.118 . 0 0 "[ . 1 . 2]" 1 356 1 18 PHE HA 1 20 LEU H . . 4.630 4.278 4.182 4.429 . 0 0 "[ . 1 . 2]" 1 357 1 18 PHE HA 1 21 VAL H . . 5.500 3.522 3.445 3.595 . 0 0 "[ . 1 . 2]" 1 358 1 18 PHE HA 1 21 VAL HB . . 4.170 2.933 2.683 3.262 . 0 0 "[ . 1 . 2]" 1 359 1 18 PHE HA 1 97 PHE QD . . 7.620 6.521 5.801 7.055 . 0 0 "[ . 1 . 2]" 1 360 1 18 PHE QB 1 19 GLU H . . 3.930 2.627 2.491 2.777 . 0 0 "[ . 1 . 2]" 1 361 1 18 PHE QB 1 19 GLU QG . . 5.200 3.005 2.881 3.157 . 0 0 "[ . 1 . 2]" 1 362 1 18 PHE HB2 1 19 GLU H . . 4.600 3.426 3.197 3.632 . 0 0 "[ . 1 . 2]" 1 363 1 18 PHE HB3 1 19 GLU H . . 4.600 2.739 2.549 3.027 . 0 0 "[ . 1 . 2]" 1 364 1 18 PHE QD 1 19 GLU H . . 7.620 4.354 3.977 4.679 . 0 0 "[ . 1 . 2]" 1 365 1 18 PHE QD 1 19 GLU HA . . 7.620 4.162 3.687 5.018 . 0 0 "[ . 1 . 2]" 1 366 1 18 PHE QD 1 19 GLU QB . . 8.500 5.472 4.902 5.958 . 0 0 "[ . 1 . 2]" 1 367 1 18 PHE QD 1 19 GLU HG2 . . 6.600 4.163 3.148 4.894 . 0 0 "[ . 1 . 2]" 1 368 1 18 PHE QD 1 19 GLU QG . . 6.340 4.016 3.085 4.644 . 0 0 "[ . 1 . 2]" 1 369 1 18 PHE QD 1 19 GLU HG3 . . 6.600 5.310 4.435 5.777 . 0 0 "[ . 1 . 2]" 1 370 1 18 PHE QD 1 74 LYS QG . . 8.500 6.750 6.233 6.992 . 0 0 "[ . 1 . 2]" 1 371 1 18 PHE QE 1 74 LYS HA . . 5.730 4.896 3.911 5.458 . 0 0 "[ . 1 . 2]" 1 372 1 18 PHE QE 1 74 LYS QB . . 8.340 3.502 2.520 4.101 . 0 0 "[ . 1 . 2]" 1 373 1 18 PHE QE 1 74 LYS HG2 . . 7.620 6.074 5.331 6.745 . 0 0 "[ . 1 . 2]" 1 374 1 18 PHE QE 1 74 LYS HG3 . . 7.620 5.606 4.955 6.526 . 0 0 "[ . 1 . 2]" 1 375 1 19 GLU H 1 19 GLU HA . . 2.900 2.840 2.830 2.844 . 0 0 "[ . 1 . 2]" 1 376 1 19 GLU H 1 19 GLU QB . . 3.560 2.327 2.277 2.394 . 0 0 "[ . 1 . 2]" 1 377 1 19 GLU H 1 19 GLU HG2 . . 3.050 2.920 2.776 3.051 0.001 11 0 "[ . 1 . 2]" 1 378 1 19 GLU H 1 19 GLU QG . . 2.860 2.586 2.470 2.684 . 0 0 "[ . 1 . 2]" 1 379 1 19 GLU H 1 19 GLU HG3 . . 3.050 2.888 2.692 3.038 . 0 0 "[ . 1 . 2]" 1 380 1 19 GLU H 1 20 LEU H . . 2.620 2.409 2.389 2.446 . 0 0 "[ . 1 . 2]" 1 381 1 19 GLU H 1 21 VAL H . . 4.850 4.017 3.845 4.168 . 0 0 "[ . 1 . 2]" 1 382 1 19 GLU H 1 21 VAL HB . . 5.500 5.241 5.063 5.474 . 0 0 "[ . 1 . 2]" 1 383 1 19 GLU HA 1 19 GLU HG2 . . 3.580 2.278 2.221 2.344 . 0 0 "[ . 1 . 2]" 1 384 1 19 GLU HA 1 19 GLU QG . . 3.300 2.251 2.196 2.313 . 0 0 "[ . 1 . 2]" 1 385 1 19 GLU HA 1 19 GLU HG3 . . 3.580 3.520 3.465 3.565 . 0 0 "[ . 1 . 2]" 1 386 1 19 GLU HA 1 20 LEU H . . 3.520 3.544 3.521 3.581 0.061 19 0 "[ . 1 . 2]" 1 387 1 19 GLU HA 1 20 LEU HA . . 5.500 4.738 4.716 4.761 . 0 0 "[ . 1 . 2]" 1 388 1 19 GLU HA 1 21 VAL H . . 4.660 4.407 4.202 4.609 . 0 0 "[ . 1 . 2]" 1 389 1 19 GLU HA 1 22 GLY H . . 3.360 3.393 3.302 3.469 0.109 12 0 "[ . 1 . 2]" 1 390 1 19 GLU HA 1 23 ASP H . . 5.500 4.871 4.351 5.314 . 0 0 "[ . 1 . 2]" 1 391 1 19 GLU HA 1 27 TYR H . . 5.100 5.163 5.056 5.260 0.160 19 0 "[ . 1 . 2]" 1 392 1 19 GLU QB 1 20 LEU H . . 3.870 2.897 2.756 2.976 . 0 0 "[ . 1 . 2]" 1 393 1 19 GLU QB 1 20 LEU HB3 . . 6.380 5.492 5.386 5.590 . 0 0 "[ . 1 . 2]" 1 394 1 19 GLU QB 1 20 LEU HG . . 5.480 4.420 4.198 4.857 . 0 0 "[ . 1 . 2]" 1 395 1 19 GLU QB 1 21 VAL H . . 6.380 4.864 4.738 5.003 . 0 0 "[ . 1 . 2]" 1 396 1 19 GLU QB 1 26 ALA MB . . 7.400 3.189 2.688 3.783 . 0 0 "[ . 1 . 2]" 1 397 1 19 GLU QG 1 20 LEU H . . 5.150 4.229 4.120 4.306 . 0 0 "[ . 1 . 2]" 1 398 1 19 GLU HG2 1 20 LEU H . . 5.500 4.742 4.678 4.817 . 0 0 "[ . 1 . 2]" 1 399 1 19 GLU HG3 1 20 LEU H . . 5.500 4.754 4.566 4.887 . 0 0 "[ . 1 . 2]" 1 400 1 20 LEU H 1 20 LEU HB2 . . 2.710 2.033 2.006 2.106 . 0 0 "[ . 1 . 2]" 1 401 1 20 LEU H 1 20 LEU HB3 . . 3.240 3.246 3.163 3.409 0.169 20 0 "[ . 1 . 2]" 1 402 1 20 LEU H 1 20 LEU HG . . 3.610 3.573 3.460 3.663 0.053 5 0 "[ . 1 . 2]" 1 403 1 20 LEU H 1 21 VAL H . . 2.800 2.489 2.415 2.580 . 0 0 "[ . 1 . 2]" 1 404 1 20 LEU H 1 21 VAL HB . . 5.410 4.625 4.476 4.834 . 0 0 "[ . 1 . 2]" 1 405 1 20 LEU H 1 21 VAL MG2 . . 4.950 3.847 3.638 3.976 . 0 0 "[ . 1 . 2]" 1 406 1 20 LEU HA 1 20 LEU HB3 . . 2.960 2.803 2.683 2.856 . 0 0 "[ . 1 . 2]" 1 407 1 20 LEU HA 1 20 LEU HG . . 3.550 2.728 2.246 3.570 0.020 20 0 "[ . 1 . 2]" 1 408 1 20 LEU HA 1 23 ASP H . . 3.730 3.249 2.860 3.510 . 0 0 "[ . 1 . 2]" 1 409 1 20 LEU HA 1 23 ASP HB2 . . 3.980 2.072 1.973 2.314 . 0 0 "[ . 1 . 2]" 1 410 1 20 LEU HA 1 23 ASP HB3 . . 4.380 3.552 2.512 4.038 . 0 0 "[ . 1 . 2]" 1 411 1 20 LEU HB2 1 21 VAL H . . 3.170 3.156 2.863 3.248 0.078 6 0 "[ . 1 . 2]" 1 412 1 20 LEU HB2 1 21 VAL MG2 . . 6.530 3.830 3.495 4.026 . 0 0 "[ . 1 . 2]" 1 413 1 20 LEU HB3 1 21 VAL H . . 3.520 3.163 2.924 3.471 . 0 0 "[ . 1 . 2]" 1 414 1 20 LEU HB3 1 21 VAL MG2 . . 6.530 3.487 3.168 3.854 . 0 0 "[ . 1 . 2]" 1 415 1 20 LEU QD 1 21 VAL H . . 7.600 4.103 3.983 4.280 . 0 0 "[ . 1 . 2]" 1 416 1 20 LEU QD 1 21 VAL HA . . 8.100 4.546 4.301 4.900 . 0 0 "[ . 1 . 2]" 1 417 1 20 LEU QD 1 135 ILE MG . . 9.130 4.926 4.302 5.439 . 0 0 "[ . 1 . 2]" 1 418 1 20 LEU QD 1 138 PHE QD . . 10.220 2.562 2.070 3.128 . 0 0 "[ . 1 . 2]" 1 419 1 20 LEU HG 1 21 VAL H . . 5.500 5.118 5.031 5.225 . 0 0 "[ . 1 . 2]" 1 420 1 20 LEU HG 1 138 PHE QD . . 7.620 3.051 2.323 4.355 . 0 0 "[ . 1 . 2]" 1 421 1 21 VAL H 1 21 VAL HA . . 2.830 2.789 2.772 2.800 . 0 0 "[ . 1 . 2]" 1 422 1 21 VAL H 1 21 VAL HB . . 2.460 2.434 2.342 2.598 0.138 6 0 "[ . 1 . 2]" 1 423 1 21 VAL H 1 21 VAL MG1 . . 4.610 3.698 3.689 3.702 . 0 0 "[ . 1 . 2]" 1 424 1 21 VAL H 1 21 VAL MG2 . . 3.430 2.105 1.963 2.313 . 0 0 "[ . 1 . 2]" 1 425 1 21 VAL H 1 22 GLY H . . 2.590 2.648 2.604 2.703 0.113 17 0 "[ . 1 . 2]" 1 426 1 21 VAL H 1 23 ASP H . . 4.790 3.962 3.738 4.168 . 0 0 "[ . 1 . 2]" 1 427 1 21 VAL HA 1 21 VAL MG2 . . 3.430 2.362 2.246 2.456 . 0 0 "[ . 1 . 2]" 1 428 1 21 VAL HA 1 22 GLY QA . . 5.020 4.342 4.313 4.368 . 0 0 "[ . 1 . 2]" 1 429 1 21 VAL HA 1 24 VAL H . . 5.500 5.481 4.907 5.617 0.117 8 0 "[ . 1 . 2]" 1 430 1 21 VAL HB 1 22 GLY H . . 4.480 2.846 2.638 3.042 . 0 0 "[ . 1 . 2]" 1 431 1 21 VAL HB 1 97 PHE QE . . 7.620 4.698 4.010 5.310 . 0 0 "[ . 1 . 2]" 1 432 1 21 VAL MG1 1 79 ILE MG . . 7.180 3.707 3.405 4.600 . 0 0 "[ . 1 . 2]" 1 433 1 21 VAL MG1 1 95 TRP HD1 . . 6.530 4.987 3.826 5.416 . 0 0 "[ . 1 . 2]" 1 434 1 21 VAL MG1 1 97 PHE QE . . 8.650 3.293 2.670 4.506 . 0 0 "[ . 1 . 2]" 1 435 1 21 VAL MG2 1 97 PHE QE . . 8.650 2.167 1.816 2.822 . 0 0 "[ . 1 . 2]" 1 436 1 22 GLY H 1 23 ASP H . . 3.330 2.564 2.204 2.769 . 0 0 "[ . 1 . 2]" 1 437 1 22 GLY QA 1 24 VAL MG1 . . 7.410 4.200 3.789 4.545 . 0 0 "[ . 1 . 2]" 1 438 1 23 ASP H 1 23 ASP HA . . 2.870 2.736 2.648 2.797 . 0 0 "[ . 1 . 2]" 1 439 1 23 ASP H 1 23 ASP HB2 . . 2.830 2.367 2.162 2.850 0.020 12 0 "[ . 1 . 2]" 1 440 1 23 ASP H 1 23 ASP HB3 . . 2.620 2.579 2.164 2.803 0.183 17 0 "[ . 1 . 2]" 1 441 1 23 ASP H 1 24 VAL H . . 3.670 2.691 2.575 2.903 . 0 0 "[ . 1 . 2]" 1 442 1 23 ASP H 1 24 VAL MG1 . . 6.530 4.039 3.618 4.449 . 0 0 "[ . 1 . 2]" 1 443 1 23 ASP HA 1 23 ASP HB2 . . 2.960 2.534 2.302 2.635 . 0 0 "[ . 1 . 2]" 1 444 1 23 ASP HA 1 23 ASP HB3 . . 3.020 3.039 2.971 3.055 0.035 1 0 "[ . 1 . 2]" 1 445 1 23 ASP HA 1 24 VAL H . . 3.610 3.478 3.390 3.625 0.015 18 0 "[ . 1 . 2]" 1 446 1 23 ASP HA 1 24 VAL MG1 . . 6.530 4.992 4.818 5.371 . 0 0 "[ . 1 . 2]" 1 447 1 23 ASP HA 1 24 VAL MG2 . . 6.310 4.761 4.454 4.874 . 0 0 "[ . 1 . 2]" 1 448 1 23 ASP HA 1 25 ASP H . . 3.800 3.544 3.261 3.721 . 0 0 "[ . 1 . 2]" 1 449 1 23 ASP HA 1 26 ALA H . . 4.450 2.969 2.634 3.653 . 0 0 "[ . 1 . 2]" 1 450 1 23 ASP HB2 1 24 VAL H . . 4.040 4.078 3.746 4.144 0.104 9 0 "[ . 1 . 2]" 1 451 1 23 ASP HB3 1 24 VAL H . . 4.230 3.151 2.761 3.423 . 0 0 "[ . 1 . 2]" 1 452 1 23 ASP HB3 1 26 ALA MB . . 6.530 4.773 4.408 5.287 . 0 0 "[ . 1 . 2]" 1 453 1 24 VAL H 1 24 VAL HA . . 2.930 2.834 2.695 2.895 . 0 0 "[ . 1 . 2]" 1 454 1 24 VAL H 1 24 VAL HB . . 3.580 3.535 3.500 3.572 . 0 0 "[ . 1 . 2]" 1 455 1 24 VAL H 1 24 VAL MG1 . . 3.430 2.419 1.997 2.699 . 0 0 "[ . 1 . 2]" 1 456 1 24 VAL H 1 24 VAL MG2 . . 3.430 1.986 1.847 2.413 . 0 0 "[ . 1 . 2]" 1 457 1 24 VAL H 1 25 ASP H . . 2.740 2.495 2.258 2.844 0.104 12 0 "[ . 1 . 2]" 1 458 1 24 VAL H 1 25 ASP HA . . 5.470 5.063 4.884 5.337 . 0 0 "[ . 1 . 2]" 1 459 1 24 VAL H 1 25 ASP QB . . 6.250 4.295 4.013 4.684 . 0 0 "[ . 1 . 2]" 1 460 1 24 VAL H 1 70 VAL QG . . 7.750 4.842 4.488 5.096 . 0 0 "[ . 1 . 2]" 1 461 1 24 VAL HA 1 24 VAL HB . . 2.560 2.492 2.423 2.587 0.027 17 0 "[ . 1 . 2]" 1 462 1 24 VAL HA 1 24 VAL MG1 . . 3.430 2.253 2.076 2.351 . 0 0 "[ . 1 . 2]" 1 463 1 24 VAL HA 1 27 TYR QD . . 7.640 4.478 2.826 6.154 . 0 0 "[ . 1 . 2]" 1 464 1 24 VAL HB 1 25 ASP H . . 4.230 4.144 3.846 4.424 0.194 9 0 "[ . 1 . 2]" 1 465 1 24 VAL HB 1 25 ASP HA . . 5.500 4.837 4.542 5.059 . 0 0 "[ . 1 . 2]" 1 466 1 24 VAL HB 1 39 THR MG . . 4.920 1.864 1.755 2.117 . 0 0 "[ . 1 . 2]" 1 467 1 24 VAL HB 1 70 VAL HB . . 5.500 5.056 4.493 5.405 . 0 0 "[ . 1 . 2]" 1 468 1 24 VAL MG1 1 25 ASP H . . 4.980 4.179 4.018 4.264 . 0 0 "[ . 1 . 2]" 1 469 1 24 VAL MG1 1 25 ASP QB . . 7.400 4.991 4.861 5.092 . 0 0 "[ . 1 . 2]" 1 470 1 24 VAL MG1 1 27 TYR QD . . 8.670 5.525 4.635 6.324 . 0 0 "[ . 1 . 2]" 1 471 1 24 VAL MG1 1 27 TYR QE . . 8.660 5.626 3.830 6.560 . 0 0 "[ . 1 . 2]" 1 472 1 24 VAL MG1 1 37 MET HG2 . . 6.530 4.875 3.935 5.438 . 0 0 "[ . 1 . 2]" 1 473 1 24 VAL MG1 1 37 MET HG3 . . 6.530 4.825 4.334 5.277 . 0 0 "[ . 1 . 2]" 1 474 1 24 VAL MG1 1 39 THR MG . . 5.420 3.071 2.807 3.374 . 0 0 "[ . 1 . 2]" 1 475 1 24 VAL MG1 1 53 ALA HA . . 6.530 5.329 5.275 5.387 . 0 0 "[ . 1 . 2]" 1 476 1 24 VAL MG1 1 53 ALA MB . . 6.660 3.377 3.224 3.560 . 0 0 "[ . 1 . 2]" 1 477 1 24 VAL MG1 1 70 VAL HB . . 5.410 4.061 3.432 4.326 . 0 0 "[ . 1 . 2]" 1 478 1 24 VAL MG2 1 25 ASP H . . 4.050 2.529 2.180 3.163 . 0 0 "[ . 1 . 2]" 1 479 1 24 VAL MG2 1 25 ASP HA . . 6.530 4.013 3.665 4.275 . 0 0 "[ . 1 . 2]" 1 480 1 24 VAL MG2 1 25 ASP QB . . 7.400 2.623 2.454 3.049 . 0 0 "[ . 1 . 2]" 1 481 1 24 VAL MG2 1 39 THR MG . . 4.670 1.973 1.711 2.709 . 0 0 "[ . 1 . 2]" 1 482 1 24 VAL MG2 1 70 VAL HB . . 5.380 4.221 4.011 4.376 . 0 0 "[ . 1 . 2]" 1 483 1 24 VAL MG2 1 70 VAL QG . . 6.730 2.405 2.119 2.570 . 0 0 "[ . 1 . 2]" 1 484 1 25 ASP H 1 25 ASP HA . . 2.870 2.896 2.849 2.917 0.047 18 0 "[ . 1 . 2]" 1 485 1 25 ASP H 1 25 ASP QB . . 3.340 2.578 2.419 2.762 . 0 0 "[ . 1 . 2]" 1 486 1 25 ASP H 1 26 ALA H . . 2.830 1.905 1.674 2.323 . 0 0 "[ . 1 . 2]" 1 487 1 25 ASP H 1 26 ALA HA . . 4.790 4.379 4.153 4.758 . 0 0 "[ . 1 . 2]" 1 488 1 25 ASP H 1 26 ALA MB . . 5.040 3.323 2.997 3.580 . 0 0 "[ . 1 . 2]" 1 489 1 25 ASP H 1 39 THR MG . . 5.750 3.978 3.395 4.251 . 0 0 "[ . 1 . 2]" 1 490 1 25 ASP HA 1 26 ALA MB . . 6.530 4.829 4.677 5.037 . 0 0 "[ . 1 . 2]" 1 491 1 25 ASP HA 1 37 MET HG2 . . 4.260 3.893 3.509 4.276 0.016 1 0 "[ . 1 . 2]" 1 492 1 25 ASP HA 1 37 MET QG . . 3.850 3.482 3.347 3.557 . 0 0 "[ . 1 . 2]" 1 493 1 25 ASP HA 1 37 MET HG3 . . 4.260 4.014 3.535 4.278 0.018 17 0 "[ . 1 . 2]" 1 494 1 25 ASP HA 1 39 THR MG . . 5.540 3.698 2.998 4.030 . 0 0 "[ . 1 . 2]" 1 495 1 25 ASP QB 1 26 ALA H . . 3.930 3.206 1.987 3.746 . 0 0 "[ . 1 . 2]" 1 496 1 25 ASP QB 1 26 ALA HA . . 4.890 4.044 3.537 4.260 . 0 0 "[ . 1 . 2]" 1 497 1 25 ASP QB 1 26 ALA MB . . 6.290 3.846 3.523 4.255 . 0 0 "[ . 1 . 2]" 1 498 1 25 ASP QB 1 39 THR MG . . 7.400 3.142 2.692 3.514 . 0 0 "[ . 1 . 2]" 1 499 1 26 ALA H 1 26 ALA HA . . 2.930 2.873 2.637 2.942 0.012 8 0 "[ . 1 . 2]" 1 500 1 26 ALA H 1 26 ALA MB . . 3.430 2.265 1.947 2.525 . 0 0 "[ . 1 . 2]" 1 501 1 26 ALA H 1 27 TYR H . . 3.610 3.216 2.550 3.869 0.259 11 0 "[ . 1 . 2]" 1 502 1 26 ALA MB 1 27 TYR H . . 4.390 1.910 1.801 2.234 . 0 0 "[ . 1 . 2]" 1 503 1 26 ALA MB 1 27 TYR HA . . 6.530 3.655 3.560 3.815 . 0 0 "[ . 1 . 2]" 1 504 1 26 ALA MB 1 27 TYR QD . . 7.120 3.356 2.133 4.399 . 0 0 "[ . 1 . 2]" 1 505 1 26 ALA MB 1 27 TYR QE . . 6.610 4.581 3.704 5.073 . 0 0 "[ . 1 . 2]" 1 506 1 27 TYR H 1 27 TYR HB2 . . 3.830 3.480 2.189 3.942 0.112 14 0 "[ . 1 . 2]" 1 507 1 27 TYR H 1 27 TYR QB . . 3.660 2.835 2.166 3.289 . 0 0 "[ . 1 . 2]" 1 508 1 27 TYR H 1 27 TYR HB3 . . 3.830 3.303 2.820 4.036 0.206 16 0 "[ . 1 . 2]" 1 509 1 27 TYR HA 1 31 VAL QG . . 6.750 3.950 3.194 4.882 . 0 0 "[ . 1 . 2]" 1 510 1 27 TYR QB 1 31 VAL QG . . 7.650 2.463 1.902 3.643 . 0 0 "[ . 1 . 2]" 1 511 1 27 TYR HB2 1 31 VAL MG1 . . 9.650 3.540 2.084 7.106 . 0 0 "[ . 1 . 2]" 1 512 1 27 TYR HB2 1 31 VAL MG2 . . 9.650 3.686 2.093 4.950 . 0 0 "[ . 1 . 2]" 1 513 1 27 TYR HB3 1 31 VAL MG1 . . 9.650 3.566 2.110 6.121 . 0 0 "[ . 1 . 2]" 1 514 1 27 TYR HB3 1 31 VAL MG2 . . 9.650 3.774 2.303 5.308 . 0 0 "[ . 1 . 2]" 1 515 1 27 TYR QD 1 31 VAL QG . . 8.400 2.429 1.771 3.912 . 0 0 "[ . 1 . 2]" 1 516 1 27 TYR QE 1 31 VAL QG . . 9.070 3.370 1.901 5.237 . 0 0 "[ . 1 . 2]" 1 517 1 28 PRO QG 1 29 LYS QB . . 7.250 4.368 3.325 5.708 . 0 0 "[ . 1 . 2]" 1 518 1 28 PRO QG 1 29 LYS QG . . 7.250 4.903 3.122 5.716 . 0 0 "[ . 1 . 2]" 1 519 1 30 PHE QD 1 33 TRP H . . 7.620 5.961 5.228 6.824 . 0 0 "[ . 1 . 2]" 1 520 1 30 PHE QE 1 31 VAL QG . . 7.920 4.703 2.514 5.329 . 0 0 "[ . 1 . 2]" 1 521 1 30 PHE QE 1 33 TRP QB . . 8.500 6.495 5.323 6.960 . 0 0 "[ . 1 . 2]" 1 522 1 30 PHE QE 1 137 CYS HB2 . . 7.620 3.849 2.724 6.012 . 0 0 "[ . 1 . 2]" 1 523 1 30 PHE QE 1 137 CYS HB3 . . 7.620 4.774 1.967 6.890 . 0 0 "[ . 1 . 2]" 1 524 1 31 VAL H 1 31 VAL HB . . 3.730 3.716 2.731 3.956 0.226 19 0 "[ . 1 . 2]" 1 525 1 31 VAL H 1 31 VAL QG . . 4.130 2.361 2.049 3.213 . 0 0 "[ . 1 . 2]" 1 526 1 31 VAL H 1 33 TRP H . . 5.500 5.465 4.851 5.647 0.147 11 0 "[ . 1 . 2]" 1 527 1 31 VAL HA 1 34 ILE H . . 5.000 4.030 3.805 4.284 . 0 0 "[ . 1 . 2]" 1 528 1 31 VAL HB 1 34 ILE H . . 4.570 3.398 3.049 3.967 . 0 0 "[ . 1 . 2]" 1 529 1 31 VAL HB 1 34 ILE HB . . 5.500 3.608 3.225 4.228 . 0 0 "[ . 1 . 2]" 1 530 1 31 VAL HB 1 34 ILE MD . . 5.380 4.358 4.219 4.465 . 0 0 "[ . 1 . 2]" 1 531 1 31 VAL HB 1 34 ILE MG . . 6.530 2.162 1.843 3.370 . 0 0 "[ . 1 . 2]" 1 532 1 31 VAL QG 1 33 TRP H . . 8.090 4.204 2.406 4.791 . 0 0 "[ . 1 . 2]" 1 533 1 31 VAL QG 1 33 TRP HE3 . . 6.850 3.526 2.280 4.778 . 0 0 "[ . 1 . 2]" 1 534 1 31 VAL QG 1 33 TRP HZ3 . . 7.620 2.464 1.824 4.391 . 0 0 "[ . 1 . 2]" 1 535 1 31 VAL QG 1 34 ILE H . . 5.630 3.456 1.880 4.007 . 0 0 "[ . 1 . 2]" 1 536 1 31 VAL QG 1 34 ILE MD . . 9.120 3.757 3.029 4.187 . 0 0 "[ . 1 . 2]" 1 537 1 31 VAL QG 1 34 ILE QG . . 8.960 4.395 3.615 5.057 . 0 0 "[ . 1 . 2]" 1 538 1 31 VAL QG 1 34 ILE MG . . 7.180 2.080 1.734 2.775 . 0 0 "[ . 1 . 2]" 1 539 1 31 VAL QG 1 137 CYS HB2 . . 7.560 4.802 3.818 5.594 . 0 0 "[ . 1 . 2]" 1 540 1 31 VAL QG 1 137 CYS HB3 . . 8.090 4.312 3.578 4.976 . 0 0 "[ . 1 . 2]" 1 541 1 31 VAL MG1 1 34 ILE H . . 6.190 4.103 1.882 4.954 . 0 0 "[ . 1 . 2]" 1 542 1 31 VAL MG1 1 34 ILE MG . . 7.560 2.869 1.823 4.080 . 0 0 "[ . 1 . 2]" 1 543 1 31 VAL MG2 1 34 ILE H . . 6.190 4.202 3.502 5.031 . 0 0 "[ . 1 . 2]" 1 544 1 31 VAL MG2 1 34 ILE MG . . 7.560 2.482 1.742 3.490 . 0 0 "[ . 1 . 2]" 1 545 1 32 PRO HA 1 34 ILE MG . . 5.790 4.623 4.438 4.706 . 0 0 "[ . 1 . 2]" 1 546 1 32 PRO QB 1 133 LYS QD . . 5.800 3.169 2.823 3.632 . 0 0 "[ . 1 . 2]" 1 547 1 32 PRO QD 1 33 TRP H . . 3.880 2.260 2.233 2.390 . 0 0 "[ . 1 . 2]" 1 548 1 32 PRO QD 1 34 ILE MG . . 7.410 4.834 4.633 5.424 . 0 0 "[ . 1 . 2]" 1 549 1 32 PRO QD 1 133 LYS QD . . 6.080 3.548 1.901 4.384 . 0 0 "[ . 1 . 2]" 1 550 1 32 PRO HD2 1 33 TRP H . . 4.040 2.280 2.253 2.416 . 0 0 "[ . 1 . 2]" 1 551 1 32 PRO HD2 1 133 LYS HD2 . . 7.250 4.056 2.406 4.763 . 0 0 "[ . 1 . 2]" 1 552 1 32 PRO HD2 1 133 LYS HD3 . . 7.250 4.644 2.010 6.181 . 0 0 "[ . 1 . 2]" 1 553 1 32 PRO HD3 1 33 TRP H . . 4.040 3.689 3.656 3.790 . 0 0 "[ . 1 . 2]" 1 554 1 32 PRO HD3 1 133 LYS HD2 . . 7.250 5.166 3.583 5.697 . 0 0 "[ . 1 . 2]" 1 555 1 32 PRO HD3 1 133 LYS HD3 . . 7.250 5.927 3.712 7.290 0.040 2 0 "[ . 1 . 2]" 1 556 1 32 PRO HG2 1 33 TRP H . . 3.360 2.744 2.426 3.040 . 0 0 "[ . 1 . 2]" 1 557 1 32 PRO HG2 1 133 LYS HB3 . . 5.500 5.404 4.982 5.582 0.082 17 0 "[ . 1 . 2]" 1 558 1 32 PRO HG2 1 133 LYS HD2 . . 5.500 2.542 1.996 3.077 . 0 0 "[ . 1 . 2]" 1 559 1 32 PRO HG2 1 133 LYS QD . . 4.750 2.409 1.857 2.814 . 0 0 "[ . 1 . 2]" 1 560 1 32 PRO HG2 1 133 LYS HD3 . . 5.500 3.377 1.972 4.439 . 0 0 "[ . 1 . 2]" 1 561 1 32 PRO HG3 1 33 TRP H . . 5.500 4.022 3.824 4.210 . 0 0 "[ . 1 . 2]" 1 562 1 32 PRO HG3 1 133 LYS QD . . 5.020 3.821 3.227 4.277 . 0 0 "[ . 1 . 2]" 1 563 1 33 TRP H 1 33 TRP HA . . 2.800 2.738 2.666 2.799 . 0 0 "[ . 1 . 2]" 1 564 1 33 TRP H 1 33 TRP HB2 . . 3.360 3.419 3.321 3.515 0.155 16 0 "[ . 1 . 2]" 1 565 1 33 TRP H 1 33 TRP QB . . 3.070 2.213 2.019 2.779 . 0 0 "[ . 1 . 2]" 1 566 1 33 TRP H 1 33 TRP HB3 . . 3.360 2.253 2.036 2.924 . 0 0 "[ . 1 . 2]" 1 567 1 33 TRP H 1 34 ILE H . . 3.550 2.712 2.586 2.875 . 0 0 "[ . 1 . 2]" 1 568 1 33 TRP H 1 133 LYS QD . . 5.360 2.910 1.896 3.979 . 0 0 "[ . 1 . 2]" 1 569 1 33 TRP H 1 133 LYS HG2 . . 4.230 4.195 3.830 4.388 0.158 16 0 "[ . 1 . 2]" 1 570 1 33 TRP H 1 134 LEU H . . 5.500 5.581 5.369 5.850 0.350 8 0 "[ . 1 . 2]" 1 571 1 33 TRP HA 1 33 TRP HB2 . . 2.960 2.323 2.217 2.645 . 0 0 "[ . 1 . 2]" 1 572 1 33 TRP HA 1 33 TRP QB . . 2.640 2.132 2.125 2.147 . 0 0 "[ . 1 . 2]" 1 573 1 33 TRP HA 1 33 TRP HB3 . . 2.960 2.578 2.249 2.723 . 0 0 "[ . 1 . 2]" 1 574 1 33 TRP HA 1 133 LYS QE . . 6.380 3.116 1.912 5.264 . 0 0 "[ . 1 . 2]" 1 575 1 33 TRP QB 1 133 LYS QD . . 6.320 2.698 1.932 3.649 . 0 0 "[ . 1 . 2]" 1 576 1 33 TRP QB 1 133 LYS HG2 . . 4.260 2.658 1.979 2.978 . 0 0 "[ . 1 . 2]" 1 577 1 33 TRP QB 1 133 LYS HG3 . . 4.290 2.990 2.496 3.456 . 0 0 "[ . 1 . 2]" 1 578 1 33 TRP HB2 1 133 LYS HD2 . . 7.250 4.560 2.826 5.323 . 0 0 "[ . 1 . 2]" 1 579 1 33 TRP HB2 1 133 LYS HD3 . . 7.250 4.361 2.773 5.988 . 0 0 "[ . 1 . 2]" 1 580 1 33 TRP HB2 1 133 LYS HG2 . . 4.660 3.508 2.936 4.298 . 0 0 "[ . 1 . 2]" 1 581 1 33 TRP HB2 1 133 LYS HG3 . . 4.600 4.195 2.974 4.773 0.173 16 0 "[ . 1 . 2]" 1 582 1 33 TRP HB3 1 133 LYS HD2 . . 7.250 3.503 1.992 4.210 . 0 0 "[ . 1 . 2]" 1 583 1 33 TRP HB3 1 133 LYS HD3 . . 7.250 3.455 1.957 4.866 . 0 0 "[ . 1 . 2]" 1 584 1 33 TRP HB3 1 133 LYS HG2 . . 4.660 2.798 1.991 3.382 . 0 0 "[ . 1 . 2]" 1 585 1 33 TRP HB3 1 133 LYS HG3 . . 4.600 3.072 2.572 3.558 . 0 0 "[ . 1 . 2]" 1 586 1 33 TRP HE1 1 34 ILE H . . 5.500 5.368 4.884 5.549 0.049 3 0 "[ . 1 . 2]" 1 587 1 33 TRP HH2 1 137 CYS HB3 . . 5.500 5.463 5.072 5.595 0.095 13 0 "[ . 1 . 2]" 1 588 1 34 ILE H 1 34 ILE HB . . 3.360 2.711 2.486 2.815 . 0 0 "[ . 1 . 2]" 1 589 1 34 ILE HA 1 57 VAL HA . . 4.630 3.492 3.120 3.854 . 0 0 "[ . 1 . 2]" 1 590 1 34 ILE HB 1 34 ILE MD . . 3.740 2.322 2.084 2.631 . 0 0 "[ . 1 . 2]" 1 591 1 34 ILE MD 1 37 MET QB . . 5.950 3.065 2.464 3.794 . 0 0 "[ . 1 . 2]" 1 592 1 34 ILE QG 1 35 THR H . . 6.160 1.999 1.901 2.569 . 0 0 "[ . 1 . 2]" 1 593 1 34 ILE QG 1 57 VAL MG1 . . 7.400 3.460 2.930 3.947 . 0 0 "[ . 1 . 2]" 1 594 1 34 ILE MG 1 35 THR H . . 4.510 2.249 2.086 2.595 . 0 0 "[ . 1 . 2]" 1 595 1 34 ILE MG 1 36 GLY H . . 5.570 4.149 3.934 4.347 . 0 0 "[ . 1 . 2]" 1 596 1 34 ILE MG 1 37 MET QB . . 7.380 3.263 3.100 3.393 . 0 0 "[ . 1 . 2]" 1 597 1 34 ILE MG 1 55 ALA HA . . 6.530 5.266 5.059 5.333 . 0 0 "[ . 1 . 2]" 1 598 1 34 ILE MG 1 57 VAL HA . . 6.530 5.311 5.149 5.430 . 0 0 "[ . 1 . 2]" 1 599 1 35 THR H 1 35 THR HB . . 4.070 3.486 3.388 3.599 . 0 0 "[ . 1 . 2]" 1 600 1 35 THR H 1 35 THR MG . . 3.920 1.985 1.882 2.152 . 0 0 "[ . 1 . 2]" 1 601 1 35 THR H 1 36 GLY H . . 3.680 2.962 2.848 3.072 . 0 0 "[ . 1 . 2]" 1 602 1 35 THR H 1 56 GLN QB . . 6.380 3.899 3.629 4.068 . 0 0 "[ . 1 . 2]" 1 603 1 35 THR H 1 57 VAL HA . . 3.780 3.784 3.359 3.879 0.099 10 0 "[ . 1 . 2]" 1 604 1 35 THR HA 1 35 THR HB . . 2.650 2.340 2.327 2.401 . 0 0 "[ . 1 . 2]" 1 605 1 35 THR HA 1 36 GLY H . . 3.610 3.556 3.530 3.580 . 0 0 "[ . 1 . 2]" 1 606 1 35 THR HA 1 58 GLY H . . 4.630 4.702 4.659 4.770 0.140 18 0 "[ . 1 . 2]" 1 607 1 35 THR HA 1 58 GLY QA . . 5.170 4.340 4.215 4.539 . 0 0 "[ . 1 . 2]" 1 608 1 35 THR HB 1 36 GLY H . . 3.860 3.517 3.470 3.565 . 0 0 "[ . 1 . 2]" 1 609 1 35 THR MG 1 36 GLY H . . 3.460 1.806 1.660 1.831 . 0 0 "[ . 1 . 2]" 1 610 1 35 THR MG 1 36 GLY HA2 . . 6.530 4.309 4.058 4.359 . 0 0 "[ . 1 . 2]" 1 611 1 35 THR MG 1 57 VAL HA . . 6.530 1.935 1.890 2.188 . 0 0 "[ . 1 . 2]" 1 612 1 35 THR MG 1 58 GLY H . . 5.970 1.998 1.902 2.251 . 0 0 "[ . 1 . 2]" 1 613 1 35 THR MG 1 58 GLY QA . . 6.440 2.825 2.724 2.889 . 0 0 "[ . 1 . 2]" 1 614 1 36 GLY H 1 36 GLY HA2 . . 2.870 2.929 2.908 2.947 0.077 15 0 "[ . 1 . 2]" 1 615 1 36 GLY H 1 37 MET H . . 4.760 4.595 4.568 4.619 . 0 0 "[ . 1 . 2]" 1 616 1 36 GLY H 1 55 ALA HA . . 5.500 5.082 4.767 5.316 . 0 0 "[ . 1 . 2]" 1 617 1 36 GLY H 1 56 GLN H . . 3.760 3.293 2.865 3.573 . 0 0 "[ . 1 . 2]" 1 618 1 36 GLY H 1 56 GLN HA . . 4.970 4.663 4.528 4.762 . 0 0 "[ . 1 . 2]" 1 619 1 36 GLY H 1 56 GLN HB2 . . 3.580 1.975 1.901 2.106 . 0 0 "[ . 1 . 2]" 1 620 1 36 GLY H 1 56 GLN QB . . 3.330 1.943 1.883 2.061 . 0 0 "[ . 1 . 2]" 1 621 1 36 GLY H 1 56 GLN HB3 . . 3.580 2.900 2.632 3.185 . 0 0 "[ . 1 . 2]" 1 622 1 36 GLY H 1 57 VAL HA . . 5.340 4.932 4.800 5.032 . 0 0 "[ . 1 . 2]" 1 623 1 36 GLY HA2 1 37 MET H . . 3.140 2.333 2.300 2.368 . 0 0 "[ . 1 . 2]" 1 624 1 36 GLY HA2 1 56 GLN HB2 . . 5.500 4.095 3.990 4.165 . 0 0 "[ . 1 . 2]" 1 625 1 36 GLY HA2 1 56 GLN QB . . 5.350 3.990 3.883 4.050 . 0 0 "[ . 1 . 2]" 1 626 1 36 GLY HA2 1 56 GLN HB3 . . 5.500 5.510 5.283 5.665 0.165 5 0 "[ . 1 . 2]" 1 627 1 36 GLY HA2 1 56 GLN QG . . 6.380 5.285 5.022 5.465 . 0 0 "[ . 1 . 2]" 1 628 1 36 GLY HA3 1 37 MET H . . 2.930 2.964 2.912 3.016 0.086 6 0 "[ . 1 . 2]" 1 629 1 36 GLY HA3 1 37 MET HA . . 4.570 4.324 4.311 4.339 . 0 0 "[ . 1 . 2]" 1 630 1 36 GLY HA3 1 37 MET QB . . 5.360 4.666 4.617 4.734 . 0 0 "[ . 1 . 2]" 1 631 1 36 GLY HA3 1 56 GLN QB . . 5.980 2.706 2.558 2.873 . 0 0 "[ . 1 . 2]" 1 632 1 37 MET H 1 37 MET HB2 . . 4.010 3.754 3.385 4.005 . 0 0 "[ . 1 . 2]" 1 633 1 37 MET H 1 37 MET QB . . 3.730 2.934 2.662 3.205 . 0 0 "[ . 1 . 2]" 1 634 1 37 MET H 1 37 MET HB3 . . 4.010 3.065 2.753 3.380 . 0 0 "[ . 1 . 2]" 1 635 1 37 MET H 1 37 MET QG . . 5.050 3.692 2.963 4.204 . 0 0 "[ . 1 . 2]" 1 636 1 37 MET H 1 38 ARG H . . 4.790 4.329 4.289 4.360 . 0 0 "[ . 1 . 2]" 1 637 1 37 MET HA 1 38 ARG H . . 2.400 2.362 2.311 2.378 . 0 0 "[ . 1 . 2]" 1 638 1 37 MET HA 1 38 ARG HB2 . . 4.660 3.987 3.972 4.016 . 0 0 "[ . 1 . 2]" 1 639 1 37 MET HA 1 55 ALA HA . . 2.870 2.265 2.035 2.495 . 0 0 "[ . 1 . 2]" 1 640 1 37 MET HA 1 55 ALA MB . . 6.530 3.538 2.870 3.879 . 0 0 "[ . 1 . 2]" 1 641 1 37 MET HA 1 56 GLN H . . 5.500 3.839 3.770 3.908 . 0 0 "[ . 1 . 2]" 1 642 1 37 MET QB 1 38 ARG H . . 3.890 3.163 2.801 3.633 . 0 0 "[ . 1 . 2]" 1 643 1 37 MET QB 1 39 THR MG . . 7.410 4.198 3.701 4.721 . 0 0 "[ . 1 . 2]" 1 644 1 37 MET HB2 1 38 ARG H . . 4.110 3.370 2.850 4.123 0.013 17 0 "[ . 1 . 2]" 1 645 1 37 MET HB3 1 38 ARG H . . 4.110 4.102 4.013 4.177 0.067 16 0 "[ . 1 . 2]" 1 646 1 37 MET QG 1 38 ARG H . . 4.710 2.911 1.936 3.682 . 0 0 "[ . 1 . 2]" 1 647 1 37 MET QG 1 39 THR MG . . 5.490 3.356 2.681 3.920 . 0 0 "[ . 1 . 2]" 1 648 1 37 MET HG2 1 38 ARG H . . 5.500 3.567 1.943 3.877 . 0 0 "[ . 1 . 2]" 1 649 1 37 MET HG2 1 39 THR MG . . 6.000 3.819 3.002 4.407 . 0 0 "[ . 1 . 2]" 1 650 1 37 MET HG3 1 38 ARG H . . 5.500 3.692 2.075 4.696 . 0 0 "[ . 1 . 2]" 1 651 1 37 MET HG3 1 39 THR MG . . 6.000 3.898 2.777 4.834 . 0 0 "[ . 1 . 2]" 1 652 1 38 ARG H 1 38 ARG HB2 . . 3.300 3.002 2.814 3.073 . 0 0 "[ . 1 . 2]" 1 653 1 38 ARG H 1 38 ARG HB3 . . 3.490 3.487 3.398 3.530 0.040 1 0 "[ . 1 . 2]" 1 654 1 38 ARG H 1 38 ARG QD . . 5.260 4.335 4.011 4.750 . 0 0 "[ . 1 . 2]" 1 655 1 38 ARG H 1 39 THR H . . 5.250 4.148 4.078 4.228 . 0 0 "[ . 1 . 2]" 1 656 1 38 ARG H 1 39 THR MG . . 6.500 3.173 3.017 3.302 . 0 0 "[ . 1 . 2]" 1 657 1 38 ARG H 1 53 ALA MB . . 6.530 4.545 4.293 4.754 . 0 0 "[ . 1 . 2]" 1 658 1 38 ARG H 1 54 GLU H . . 3.640 3.017 2.826 3.325 . 0 0 "[ . 1 . 2]" 1 659 1 38 ARG H 1 55 ALA HA . . 3.830 3.812 3.591 3.879 0.049 14 0 "[ . 1 . 2]" 1 660 1 38 ARG H 1 55 ALA MB . . 6.530 4.343 3.847 4.584 . 0 0 "[ . 1 . 2]" 1 661 1 38 ARG HA 1 39 THR H . . 2.560 2.274 2.254 2.305 . 0 0 "[ . 1 . 2]" 1 662 1 38 ARG HA 1 39 THR MG . . 5.570 3.539 3.147 3.705 . 0 0 "[ . 1 . 2]" 1 663 1 38 ARG HA 1 54 GLU H . . 5.500 4.796 4.691 4.924 . 0 0 "[ . 1 . 2]" 1 664 1 38 ARG HB2 1 39 THR H . . 4.570 4.470 4.404 4.518 . 0 0 "[ . 1 . 2]" 1 665 1 38 ARG HB3 1 39 THR H . . 3.580 3.587 3.487 3.648 0.068 6 0 "[ . 1 . 2]" 1 666 1 38 ARG HB3 1 39 THR MG . . 6.530 4.575 4.497 4.667 . 0 0 "[ . 1 . 2]" 1 667 1 38 ARG QD 1 39 THR H . . 6.380 4.293 2.105 5.160 . 0 0 "[ . 1 . 2]" 1 668 1 39 THR H 1 39 THR HB . . 4.200 3.780 3.758 3.833 . 0 0 "[ . 1 . 2]" 1 669 1 39 THR H 1 39 THR MG . . 3.990 2.924 2.662 3.078 . 0 0 "[ . 1 . 2]" 1 670 1 39 THR H 1 40 TRP H . . 4.570 4.200 4.133 4.271 . 0 0 "[ . 1 . 2]" 1 671 1 39 THR HA 1 39 THR HB . . 2.520 2.523 2.449 2.562 0.042 1 0 "[ . 1 . 2]" 1 672 1 39 THR HA 1 39 THR MG . . 3.430 2.411 2.298 2.583 . 0 0 "[ . 1 . 2]" 1 673 1 39 THR HA 1 40 TRP H . . 2.430 2.151 2.149 2.156 . 0 0 "[ . 1 . 2]" 1 674 1 39 THR HA 1 40 TRP HE3 . . 3.890 3.443 3.058 3.820 . 0 0 "[ . 1 . 2]" 1 675 1 39 THR HA 1 51 VAL MG1 . . 6.530 5.449 5.399 5.491 . 0 0 "[ . 1 . 2]" 1 676 1 39 THR HA 1 52 ASP H . . 5.500 4.853 4.753 4.979 . 0 0 "[ . 1 . 2]" 1 677 1 39 THR HA 1 53 ALA HA . . 2.900 2.628 2.542 2.861 . 0 0 "[ . 1 . 2]" 1 678 1 39 THR HA 1 53 ALA MB . . 4.950 3.720 3.507 3.986 . 0 0 "[ . 1 . 2]" 1 679 1 39 THR HA 1 54 GLU H . . 4.480 3.672 3.490 3.851 . 0 0 "[ . 1 . 2]" 1 680 1 39 THR HB 1 40 TRP H . . 3.700 3.624 3.536 3.710 0.010 14 0 "[ . 1 . 2]" 1 681 1 39 THR HB 1 51 VAL MG1 . . 5.750 4.709 4.631 4.757 . 0 0 "[ . 1 . 2]" 1 682 1 39 THR HB 1 53 ALA MB . . 6.530 3.836 3.501 4.413 . 0 0 "[ . 1 . 2]" 1 683 1 39 THR MG 1 40 TRP H . . 5.190 4.180 4.073 4.298 . 0 0 "[ . 1 . 2]" 1 684 1 39 THR MG 1 40 TRP HE3 . . 6.530 5.021 4.740 5.314 . 0 0 "[ . 1 . 2]" 1 685 1 39 THR MG 1 51 VAL MG2 . . 7.120 3.533 3.417 3.665 . 0 0 "[ . 1 . 2]" 1 686 1 39 THR MG 1 53 ALA HA . . 3.770 2.496 2.033 2.896 . 0 0 "[ . 1 . 2]" 1 687 1 39 THR MG 1 54 GLU H . . 5.500 3.513 3.114 3.861 . 0 0 "[ . 1 . 2]" 1 688 1 40 TRP H 1 40 TRP HE3 . . 5.500 2.903 2.401 3.324 . 0 0 "[ . 1 . 2]" 1 689 1 40 TRP H 1 51 VAL MG1 . . 5.660 4.325 4.243 4.396 . 0 0 "[ . 1 . 2]" 1 690 1 40 TRP H 1 51 VAL MG2 . . 5.720 2.310 1.942 2.556 . 0 0 "[ . 1 . 2]" 1 691 1 40 TRP H 1 52 ASP H . . 4.170 3.361 3.293 3.453 . 0 0 "[ . 1 . 2]" 1 692 1 40 TRP H 1 53 ALA HA . . 4.170 4.096 3.983 4.241 0.071 13 0 "[ . 1 . 2]" 1 693 1 40 TRP HA 1 40 TRP HB2 . . 2.770 2.228 2.212 2.249 . 0 0 "[ . 1 . 2]" 1 694 1 40 TRP HA 1 40 TRP HB3 . . 2.930 2.696 2.648 2.741 . 0 0 "[ . 1 . 2]" 1 695 1 40 TRP HA 1 41 ASN H . . 2.870 2.667 2.630 2.727 . 0 0 "[ . 1 . 2]" 1 696 1 40 TRP HA 1 41 ASN HA . . 4.970 4.635 4.613 4.668 . 0 0 "[ . 1 . 2]" 1 697 1 40 TRP HB2 1 41 ASN H . . 3.550 2.669 2.597 2.774 . 0 0 "[ . 1 . 2]" 1 698 1 40 TRP HB3 1 41 ASN H . . 3.860 3.877 3.807 3.915 0.055 4 0 "[ . 1 . 2]" 1 699 1 40 TRP HD1 1 41 ASN H . . 4.410 2.421 2.007 2.918 . 0 0 "[ . 1 . 2]" 1 700 1 40 TRP HD1 1 41 ASN HB2 . . 4.010 3.864 3.654 4.031 0.021 4 0 "[ . 1 . 2]" 1 701 1 40 TRP HD1 1 41 ASN HB3 . . 5.500 5.194 4.789 5.494 . 0 0 "[ . 1 . 2]" 1 702 1 40 TRP HE1 1 41 ASN H . . 5.500 4.416 4.023 4.763 . 0 0 "[ . 1 . 2]" 1 703 1 40 TRP HE1 1 41 ASN HB2 . . 5.340 3.778 3.609 3.969 . 0 0 "[ . 1 . 2]" 1 704 1 40 TRP HE1 1 41 ASN HB3 . . 5.500 5.076 4.783 5.320 . 0 0 "[ . 1 . 2]" 1 705 1 40 TRP HE1 1 41 ASN HD21 . . 5.130 2.787 1.896 3.984 . 0 0 "[ . 1 . 2]" 1 706 1 40 TRP HE1 1 41 ASN QD . . 4.900 2.455 1.843 3.268 . 0 0 "[ . 1 . 2]" 1 707 1 40 TRP HE1 1 41 ASN HD22 . . 5.130 2.853 2.224 3.616 . 0 0 "[ . 1 . 2]" 1 708 1 41 ASN H 1 41 ASN HA . . 2.400 2.169 2.167 2.173 . 0 0 "[ . 1 . 2]" 1 709 1 41 ASN H 1 41 ASN HB2 . . 3.300 3.217 3.164 3.271 . 0 0 "[ . 1 . 2]" 1 710 1 41 ASN H 1 42 GLY H . . 3.450 3.392 3.184 3.469 0.019 4 0 "[ . 1 . 2]" 1 711 1 41 ASN H 1 51 VAL MG1 . . 6.530 3.838 3.668 4.029 . 0 0 "[ . 1 . 2]" 1 712 1 41 ASN HA 1 41 ASN HB2 . . 2.930 2.891 2.848 2.953 0.023 1 0 "[ . 1 . 2]" 1 713 1 41 ASN HA 1 42 GLY H . . 2.930 2.311 2.286 2.372 . 0 0 "[ . 1 . 2]" 1 714 1 41 ASN HA 1 51 VAL MG1 . . 5.910 4.514 4.422 4.709 . 0 0 "[ . 1 . 2]" 1 715 1 41 ASN HB2 1 42 GLY H . . 4.940 4.722 4.698 4.738 . 0 0 "[ . 1 . 2]" 1 716 1 41 ASN HB2 1 51 VAL MG1 . . 6.530 5.413 5.386 5.433 . 0 0 "[ . 1 . 2]" 1 717 1 41 ASN HB2 1 51 VAL MG2 . . 6.530 5.122 4.803 5.312 . 0 0 "[ . 1 . 2]" 1 718 1 41 ASN HB3 1 42 GLY H . . 4.760 4.129 4.048 4.209 . 0 0 "[ . 1 . 2]" 1 719 1 41 ASN HB3 1 42 GLY HA3 . . 5.500 4.866 4.808 4.944 . 0 0 "[ . 1 . 2]" 1 720 1 41 ASN HB3 1 51 VAL MG1 . . 6.530 5.268 5.199 5.393 . 0 0 "[ . 1 . 2]" 1 721 1 41 ASN HB3 1 51 VAL MG2 . . 6.530 5.387 5.301 5.441 . 0 0 "[ . 1 . 2]" 1 722 1 41 ASN HB3 1 52 ASP H . . 4.720 3.466 3.282 3.619 . 0 0 "[ . 1 . 2]" 1 723 1 42 GLY H 1 42 GLY HA2 . . 2.900 2.795 2.765 2.833 . 0 0 "[ . 1 . 2]" 1 724 1 42 GLY H 1 43 ARG H . . 4.540 4.159 4.073 4.262 . 0 0 "[ . 1 . 2]" 1 725 1 42 GLY H 1 51 VAL HA . . 4.320 4.369 4.338 4.420 0.100 4 0 "[ . 1 . 2]" 1 726 1 42 GLY H 1 51 VAL HB . . 5.500 4.051 3.909 4.149 . 0 0 "[ . 1 . 2]" 1 727 1 42 GLY H 1 51 VAL MG1 . . 4.640 3.342 3.173 3.482 . 0 0 "[ . 1 . 2]" 1 728 1 42 GLY H 1 51 VAL MG2 . . 6.530 5.342 5.202 5.454 . 0 0 "[ . 1 . 2]" 1 729 1 42 GLY H 1 52 ASP H . . 5.500 5.125 5.036 5.232 . 0 0 "[ . 1 . 2]" 1 730 1 42 GLY HA2 1 43 ARG H . . 3.140 3.090 2.986 3.173 0.033 18 0 "[ . 1 . 2]" 1 731 1 42 GLY HA2 1 51 VAL HA . . 3.330 3.130 3.077 3.223 . 0 0 "[ . 1 . 2]" 1 732 1 42 GLY HA2 1 51 VAL HB . . 5.500 4.375 4.255 4.501 . 0 0 "[ . 1 . 2]" 1 733 1 42 GLY HA2 1 51 VAL MG1 . . 4.760 3.598 3.554 3.648 . 0 0 "[ . 1 . 2]" 1 734 1 42 GLY HA2 1 51 VAL MG2 . . 6.530 5.505 5.433 5.584 . 0 0 "[ . 1 . 2]" 1 735 1 42 GLY HA3 1 43 ARG H . . 3.420 2.262 2.225 2.318 . 0 0 "[ . 1 . 2]" 1 736 1 42 GLY HA3 1 50 THR H . . 4.970 4.655 4.516 4.793 . 0 0 "[ . 1 . 2]" 1 737 1 42 GLY HA3 1 50 THR HB . . 5.500 4.808 4.656 5.015 . 0 0 "[ . 1 . 2]" 1 738 1 42 GLY HA3 1 50 THR MG . . 5.470 4.314 4.061 4.435 . 0 0 "[ . 1 . 2]" 1 739 1 42 GLY HA3 1 51 VAL H . . 4.410 4.414 4.395 4.446 0.036 10 0 "[ . 1 . 2]" 1 740 1 42 GLY HA3 1 51 VAL HA . . 3.020 2.003 1.956 2.053 . 0 0 "[ . 1 . 2]" 1 741 1 42 GLY HA3 1 51 VAL HB . . 4.200 3.095 2.973 3.190 . 0 0 "[ . 1 . 2]" 1 742 1 42 GLY HA3 1 51 VAL MG1 . . 4.390 2.004 1.961 2.085 . 0 0 "[ . 1 . 2]" 1 743 1 42 GLY HA3 1 51 VAL MG2 . . 5.130 4.280 4.237 4.336 . 0 0 "[ . 1 . 2]" 1 744 1 42 GLY HA3 1 52 ASP H . . 5.130 3.972 3.880 4.036 . 0 0 "[ . 1 . 2]" 1 745 1 43 ARG H 1 43 ARG QB . . 3.760 3.182 3.011 3.280 . 0 0 "[ . 1 . 2]" 1 746 1 43 ARG H 1 43 ARG QG . . 4.670 2.216 1.957 2.365 . 0 0 "[ . 1 . 2]" 1 747 1 43 ARG H 1 44 VAL H . . 4.450 4.420 4.374 4.477 0.027 11 0 "[ . 1 . 2]" 1 748 1 43 ARG H 1 49 SER HA . . 5.500 5.048 4.884 5.457 . 0 0 "[ . 1 . 2]" 1 749 1 43 ARG H 1 50 THR H . . 3.360 3.157 3.006 3.436 0.076 10 0 "[ . 1 . 2]" 1 750 1 43 ARG H 1 50 THR HA . . 5.500 4.787 4.738 4.912 . 0 0 "[ . 1 . 2]" 1 751 1 43 ARG H 1 50 THR HB . . 4.850 3.398 3.037 3.597 . 0 0 "[ . 1 . 2]" 1 752 1 43 ARG H 1 50 THR MG . . 5.540 4.005 3.723 4.272 . 0 0 "[ . 1 . 2]" 1 753 1 43 ARG H 1 51 VAL HA . . 3.700 3.667 3.549 3.704 0.004 14 0 "[ . 1 . 2]" 1 754 1 43 ARG H 1 51 VAL HB . . 5.500 4.924 4.683 5.114 . 0 0 "[ . 1 . 2]" 1 755 1 43 ARG H 1 51 VAL MG1 . . 4.230 2.735 2.434 2.988 . 0 0 "[ . 1 . 2]" 1 756 1 43 ARG H 1 51 VAL MG2 . . 6.530 5.289 5.084 5.472 . 0 0 "[ . 1 . 2]" 1 757 1 43 ARG HA 1 43 ARG HB2 . . 2.990 2.579 2.512 2.621 . 0 0 "[ . 1 . 2]" 1 758 1 43 ARG HA 1 43 ARG QB . . 2.700 2.210 2.206 2.215 . 0 0 "[ . 1 . 2]" 1 759 1 43 ARG HA 1 43 ARG HB3 . . 2.990 2.405 2.373 2.462 . 0 0 "[ . 1 . 2]" 1 760 1 43 ARG HA 1 43 ARG QD . . 4.980 4.286 3.935 4.403 . 0 0 "[ . 1 . 2]" 1 761 1 43 ARG HA 1 44 VAL H . . 2.900 2.458 2.391 2.530 . 0 0 "[ . 1 . 2]" 1 762 1 43 ARG QB 1 44 VAL MG2 . . 7.410 5.399 5.366 5.421 . 0 0 "[ . 1 . 2]" 1 763 1 43 ARG QB 1 50 THR HB . . 6.380 4.658 4.309 4.899 . 0 0 "[ . 1 . 2]" 1 764 1 43 ARG HB2 1 44 VAL H . . 3.920 2.593 2.423 2.780 . 0 0 "[ . 1 . 2]" 1 765 1 43 ARG HB3 1 44 VAL H . . 3.920 3.779 3.695 3.854 . 0 0 "[ . 1 . 2]" 1 766 1 43 ARG QD 1 44 VAL H . . 6.380 4.242 3.240 4.660 . 0 0 "[ . 1 . 2]" 1 767 1 43 ARG QD 1 50 THR HB . . 6.380 3.768 3.236 4.338 . 0 0 "[ . 1 . 2]" 1 768 1 43 ARG QD 1 50 THR MG . . 7.400 4.499 4.016 5.004 . 0 0 "[ . 1 . 2]" 1 769 1 43 ARG QG 1 44 VAL H . . 5.350 3.981 3.697 4.226 . 0 0 "[ . 1 . 2]" 1 770 1 43 ARG QG 1 50 THR H . . 5.970 3.185 2.897 3.424 . 0 0 "[ . 1 . 2]" 1 771 1 43 ARG QG 1 50 THR HB . . 5.350 2.431 2.008 2.703 . 0 0 "[ . 1 . 2]" 1 772 1 43 ARG QG 1 50 THR MG . . 7.400 3.416 2.933 3.644 . 0 0 "[ . 1 . 2]" 1 773 1 43 ARG QG 1 51 VAL H . . 6.380 5.608 5.443 5.732 . 0 0 "[ . 1 . 2]" 1 774 1 43 ARG QG 1 51 VAL MG1 . . 6.820 4.250 4.162 4.354 . 0 0 "[ . 1 . 2]" 1 775 1 44 VAL H 1 44 VAL HB . . 3.080 3.054 2.978 3.119 0.039 15 0 "[ . 1 . 2]" 1 776 1 44 VAL H 1 44 VAL MG2 . . 4.610 3.887 3.801 3.935 . 0 0 "[ . 1 . 2]" 1 777 1 44 VAL H 1 45 ASP H . . 4.480 4.275 4.183 4.452 . 0 0 "[ . 1 . 2]" 1 778 1 44 VAL HA 1 44 VAL HB . . 2.740 2.474 2.396 2.523 . 0 0 "[ . 1 . 2]" 1 779 1 44 VAL HA 1 44 VAL MG2 . . 3.430 2.277 2.143 2.424 . 0 0 "[ . 1 . 2]" 1 780 1 44 VAL HA 1 45 ASP H . . 2.400 2.192 2.182 2.227 . 0 0 "[ . 1 . 2]" 1 781 1 44 VAL HA 1 49 SER HA . . 4.350 2.304 2.126 2.481 . 0 0 "[ . 1 . 2]" 1 782 1 44 VAL HA 1 49 SER QB . . 6.380 3.870 3.211 4.301 . 0 0 "[ . 1 . 2]" 1 783 1 44 VAL HA 1 50 THR H . . 4.010 3.245 3.082 3.365 . 0 0 "[ . 1 . 2]" 1 784 1 44 VAL HB 1 45 ASP H . . 4.630 4.365 4.182 4.451 . 0 0 "[ . 1 . 2]" 1 785 1 44 VAL HB 1 49 SER HA . . 5.500 3.950 3.475 4.325 . 0 0 "[ . 1 . 2]" 1 786 1 44 VAL HB 1 50 THR H . . 5.500 4.638 4.453 4.854 . 0 0 "[ . 1 . 2]" 1 787 1 44 VAL MG2 1 45 ASP H . . 4.390 2.717 2.301 2.902 . 0 0 "[ . 1 . 2]" 1 788 1 44 VAL MG2 1 45 ASP HA . . 6.530 3.868 3.626 4.080 . 0 0 "[ . 1 . 2]" 1 789 1 44 VAL MG2 1 45 ASP HB2 . . 6.530 5.013 4.814 5.130 . 0 0 "[ . 1 . 2]" 1 790 1 44 VAL MG2 1 45 ASP HB3 . . 6.530 5.040 4.512 5.238 . 0 0 "[ . 1 . 2]" 1 791 1 44 VAL MG2 1 46 GLY H . . 5.940 4.626 4.337 4.823 . 0 0 "[ . 1 . 2]" 1 792 1 44 VAL MG2 1 48 VAL H . . 5.010 3.848 3.540 4.060 . 0 0 "[ . 1 . 2]" 1 793 1 44 VAL MG2 1 49 SER HA . . 4.230 2.974 2.784 3.438 . 0 0 "[ . 1 . 2]" 1 794 1 44 VAL MG2 1 49 SER QB . . 5.270 3.112 2.097 3.588 . 0 0 "[ . 1 . 2]" 1 795 1 44 VAL MG2 1 50 THR H . . 5.750 4.516 4.315 4.726 . 0 0 "[ . 1 . 2]" 1 796 1 45 ASP H 1 45 ASP HA . . 2.900 2.910 2.904 2.915 0.015 20 0 "[ . 1 . 2]" 1 797 1 45 ASP H 1 45 ASP HB2 . . 3.050 2.947 2.798 3.181 0.131 11 0 "[ . 1 . 2]" 1 798 1 45 ASP H 1 45 ASP HB3 . . 2.800 2.797 2.548 2.845 0.045 4 0 "[ . 1 . 2]" 1 799 1 45 ASP H 1 46 GLY H . . 5.500 4.331 4.291 4.460 . 0 0 "[ . 1 . 2]" 1 800 1 45 ASP H 1 48 VAL H . . 3.610 3.489 3.424 3.554 . 0 0 "[ . 1 . 2]" 1 801 1 45 ASP H 1 48 VAL HB . . 3.860 3.745 3.400 3.864 0.004 13 0 "[ . 1 . 2]" 1 802 1 45 ASP H 1 49 SER HA . . 3.270 3.074 2.717 3.175 . 0 0 "[ . 1 . 2]" 1 803 1 45 ASP H 1 49 SER QB . . 5.630 4.770 4.109 5.030 . 0 0 "[ . 1 . 2]" 1 804 1 45 ASP HA 1 45 ASP HB2 . . 2.680 2.596 2.439 2.640 . 0 0 "[ . 1 . 2]" 1 805 1 45 ASP HA 1 45 ASP HB3 . . 3.050 3.044 3.037 3.049 . 0 0 "[ . 1 . 2]" 1 806 1 45 ASP HA 1 46 GLY H . . 2.490 2.302 2.272 2.454 . 0 0 "[ . 1 . 2]" 1 807 1 45 ASP HB2 1 46 GLY H . . 4.600 4.351 3.898 4.457 . 0 0 "[ . 1 . 2]" 1 808 1 45 ASP HB3 1 46 GLY H . . 3.980 3.984 3.858 4.020 0.040 5 0 "[ . 1 . 2]" 1 809 1 46 GLY H 1 46 GLY HA2 . . 2.680 2.300 2.253 2.684 0.004 10 0 "[ . 1 . 2]" 1 810 1 46 GLY H 1 46 GLY QA . . 2.400 2.152 2.151 2.153 . 0 0 "[ . 1 . 2]" 1 811 1 46 GLY H 1 46 GLY HA3 . . 2.680 2.665 2.266 2.727 0.047 16 0 "[ . 1 . 2]" 1 812 1 46 GLY H 1 47 ALA H . . 4.690 4.594 4.547 4.614 . 0 0 "[ . 1 . 2]" 1 813 1 46 GLY QA 1 47 ALA H . . 2.950 2.175 2.169 2.183 . 0 0 "[ . 1 . 2]" 1 814 1 46 GLY QA 1 47 ALA HA . . 5.700 3.958 3.937 4.132 . 0 0 "[ . 1 . 2]" 1 815 1 46 GLY QA 1 47 ALA MB . . 5.600 3.662 3.471 3.696 . 0 0 "[ . 1 . 2]" 1 816 1 46 GLY QA 1 48 VAL H . . 4.300 3.463 3.321 3.550 . 0 0 "[ . 1 . 2]" 1 817 1 46 GLY HA2 1 47 ALA H . . 3.210 3.113 2.201 3.259 0.049 15 0 "[ . 1 . 2]" 1 818 1 46 GLY HA2 1 47 ALA MB . . 6.430 4.349 3.949 4.425 . 0 0 "[ . 1 . 2]" 1 819 1 46 GLY HA2 1 48 VAL H . . 5.070 4.271 3.669 4.433 . 0 0 "[ . 1 . 2]" 1 820 1 46 GLY HA3 1 47 ALA H . . 3.210 2.320 2.204 3.289 0.079 10 0 "[ . 1 . 2]" 1 821 1 46 GLY HA3 1 47 ALA MB . . 6.430 3.943 3.848 3.968 . 0 0 "[ . 1 . 2]" 1 822 1 46 GLY HA3 1 48 VAL H . . 5.070 3.708 3.466 4.374 . 0 0 "[ . 1 . 2]" 1 823 1 47 ALA H 1 47 ALA HA . . 2.900 2.849 2.243 2.926 0.026 18 0 "[ . 1 . 2]" 1 824 1 47 ALA H 1 47 ALA MB . . 3.430 2.157 2.077 2.694 . 0 0 "[ . 1 . 2]" 1 825 1 47 ALA H 1 48 VAL H . . 2.990 2.978 2.847 3.019 0.029 7 0 "[ . 1 . 2]" 1 826 1 47 ALA H 1 48 VAL MG2 . . 5.570 3.687 3.488 4.548 . 0 0 "[ . 1 . 2]" 1 827 1 47 ALA HA 1 48 VAL H . . 3.170 2.902 2.857 2.995 . 0 0 "[ . 1 . 2]" 1 828 1 47 ALA HA 1 74 LYS H . . 4.070 3.986 3.554 4.085 0.015 4 0 "[ . 1 . 2]" 1 829 1 47 ALA HA 1 74 LYS QB . . 6.380 4.438 3.869 4.684 . 0 0 "[ . 1 . 2]" 1 830 1 47 ALA HA 1 74 LYS HD2 . . 5.500 3.954 2.758 5.008 . 0 0 "[ . 1 . 2]" 1 831 1 47 ALA HA 1 74 LYS QD . . 5.200 3.002 1.984 4.172 . 0 0 "[ . 1 . 2]" 1 832 1 47 ALA HA 1 74 LYS HD3 . . 5.500 3.298 1.993 5.122 . 0 0 "[ . 1 . 2]" 1 833 1 47 ALA HA 1 74 LYS HG2 . . 5.500 2.889 1.987 3.467 . 0 0 "[ . 1 . 2]" 1 834 1 47 ALA HA 1 74 LYS QG . . 4.850 2.794 1.971 3.345 . 0 0 "[ . 1 . 2]" 1 835 1 47 ALA HA 1 74 LYS HG3 . . 5.500 3.861 2.821 4.745 . 0 0 "[ . 1 . 2]" 1 836 1 47 ALA MB 1 48 VAL H . . 4.420 3.729 3.681 3.747 . 0 0 "[ . 1 . 2]" 1 837 1 47 ALA MB 1 48 VAL HB . . 6.530 4.869 4.714 4.918 . 0 0 "[ . 1 . 2]" 1 838 1 47 ALA MB 1 48 VAL MG2 . . 7.310 3.271 3.017 3.409 . 0 0 "[ . 1 . 2]" 1 839 1 47 ALA MB 1 73 ASP HA . . 5.320 4.158 4.047 4.278 . 0 0 "[ . 1 . 2]" 1 840 1 47 ALA MB 1 74 LYS H . . 4.480 2.809 2.658 2.979 . 0 0 "[ . 1 . 2]" 1 841 1 47 ALA MB 1 74 LYS QB . . 5.170 3.646 3.467 3.759 . 0 0 "[ . 1 . 2]" 1 842 1 47 ALA MB 1 74 LYS QD . . 5.270 2.586 1.859 3.323 . 0 0 "[ . 1 . 2]" 1 843 1 47 ALA MB 1 74 LYS QE . . 7.060 2.709 1.848 3.748 . 0 0 "[ . 1 . 2]" 1 844 1 47 ALA MB 1 74 LYS QG . . 5.080 1.815 1.720 1.885 . 0 0 "[ . 1 . 2]" 1 845 1 47 ALA MB 1 75 ASP H . . 3.460 2.383 2.077 2.545 . 0 0 "[ . 1 . 2]" 1 846 1 47 ALA MB 1 75 ASP HB2 . . 4.610 1.946 1.827 2.053 . 0 0 "[ . 1 . 2]" 1 847 1 47 ALA MB 1 75 ASP QB . . 4.280 1.935 1.818 2.039 . 0 0 "[ . 1 . 2]" 1 848 1 47 ALA MB 1 75 ASP HB3 . . 4.610 3.389 3.211 3.505 . 0 0 "[ . 1 . 2]" 1 849 1 47 ALA MB 1 76 ALA H . . 6.340 4.207 3.976 4.326 . 0 0 "[ . 1 . 2]" 1 850 1 48 VAL H 1 48 VAL HB . . 3.050 2.624 2.515 2.773 . 0 0 "[ . 1 . 2]" 1 851 1 48 VAL H 1 48 VAL MG1 . . 4.610 3.753 3.709 3.829 . 0 0 "[ . 1 . 2]" 1 852 1 48 VAL H 1 48 VAL MG2 . . 4.050 3.184 3.101 3.245 . 0 0 "[ . 1 . 2]" 1 853 1 48 VAL H 1 49 SER H . . 4.510 4.404 4.373 4.447 . 0 0 "[ . 1 . 2]" 1 854 1 48 VAL HA 1 49 SER H . . 2.400 2.328 2.306 2.409 0.009 10 0 "[ . 1 . 2]" 1 855 1 48 VAL HA 1 49 SER QB . . 6.160 4.059 3.815 4.396 . 0 0 "[ . 1 . 2]" 1 856 1 48 VAL HA 1 73 ASP HA . . 2.960 2.119 2.006 2.278 . 0 0 "[ . 1 . 2]" 1 857 1 48 VAL HA 1 73 ASP QB . . 6.380 3.778 3.631 4.215 . 0 0 "[ . 1 . 2]" 1 858 1 48 VAL HA 1 74 LYS H . . 3.490 3.406 3.266 3.515 0.025 4 0 "[ . 1 . 2]" 1 859 1 48 VAL HB 1 49 SER H . . 4.070 4.078 3.883 4.132 0.062 4 0 "[ . 1 . 2]" 1 860 1 48 VAL MG1 1 49 SER H . . 3.680 2.055 1.949 2.272 . 0 0 "[ . 1 . 2]" 1 861 1 48 VAL MG1 1 71 ARG QG . . 7.410 3.726 2.872 5.031 . 0 0 "[ . 1 . 2]" 1 862 1 48 VAL MG1 1 72 ARG H . . 5.290 3.535 3.179 3.896 . 0 0 "[ . 1 . 2]" 1 863 1 48 VAL MG1 1 73 ASP HA . . 6.370 3.556 3.337 3.782 . 0 0 "[ . 1 . 2]" 1 864 1 48 VAL MG1 1 73 ASP HB2 . . 6.530 3.589 3.317 4.216 . 0 0 "[ . 1 . 2]" 1 865 1 48 VAL MG1 1 73 ASP HB3 . . 6.530 4.988 4.779 5.334 . 0 0 "[ . 1 . 2]" 1 866 1 48 VAL MG2 1 49 SER H . . 4.510 3.736 3.684 3.798 . 0 0 "[ . 1 . 2]" 1 867 1 48 VAL MG2 1 73 ASP HA . . 4.880 2.554 2.277 2.813 . 0 0 "[ . 1 . 2]" 1 868 1 48 VAL MG2 1 73 ASP HB2 . . 6.530 2.519 2.026 3.232 . 0 0 "[ . 1 . 2]" 1 869 1 48 VAL MG2 1 73 ASP QB . . 6.390 2.466 2.009 3.081 . 0 0 "[ . 1 . 2]" 1 870 1 48 VAL MG2 1 73 ASP HB3 . . 6.530 3.595 3.304 3.882 . 0 0 "[ . 1 . 2]" 1 871 1 48 VAL MG2 1 74 LYS H . . 6.530 3.564 3.306 3.746 . 0 0 "[ . 1 . 2]" 1 872 1 49 SER H 1 50 THR H . . 4.510 4.240 4.047 4.357 . 0 0 "[ . 1 . 2]" 1 873 1 49 SER H 1 72 ARG H . . 3.920 2.837 2.688 3.069 . 0 0 "[ . 1 . 2]" 1 874 1 49 SER H 1 72 ARG QB . . 5.260 3.933 2.777 4.395 . 0 0 "[ . 1 . 2]" 1 875 1 49 SER H 1 73 ASP HA . . 3.550 3.578 3.543 3.638 0.088 10 0 "[ . 1 . 2]" 1 876 1 49 SER HA 1 50 THR H . . 2.400 2.253 2.215 2.325 . 0 0 "[ . 1 . 2]" 1 877 1 49 SER HA 1 50 THR HB . . 4.820 4.457 4.323 4.554 . 0 0 "[ . 1 . 2]" 1 878 1 49 SER HA 1 50 THR MG . . 6.530 5.419 5.395 5.451 . 0 0 "[ . 1 . 2]" 1 879 1 49 SER QB 1 50 THR H . . 4.020 3.338 2.977 3.538 . 0 0 "[ . 1 . 2]" 1 880 1 50 THR H 1 50 THR HB . . 2.960 2.609 2.426 2.757 . 0 0 "[ . 1 . 2]" 1 881 1 50 THR H 1 50 THR MG . . 4.510 3.847 3.751 3.908 . 0 0 "[ . 1 . 2]" 1 882 1 50 THR H 1 51 VAL H . . 4.510 4.298 4.187 4.453 . 0 0 "[ . 1 . 2]" 1 883 1 50 THR HA 1 51 VAL H . . 2.400 2.161 2.150 2.193 . 0 0 "[ . 1 . 2]" 1 884 1 50 THR HA 1 51 VAL MG1 . . 5.940 3.379 3.294 3.469 . 0 0 "[ . 1 . 2]" 1 885 1 50 THR HA 1 51 VAL MG2 . . 5.570 3.951 3.866 4.078 . 0 0 "[ . 1 . 2]" 1 886 1 50 THR HA 1 71 ARG HA . . 2.990 2.393 2.111 2.494 . 0 0 "[ . 1 . 2]" 1 887 1 50 THR HA 1 71 ARG QG . . 6.380 2.994 2.498 4.889 . 0 0 "[ . 1 . 2]" 1 888 1 50 THR HA 1 72 ARG H . . 3.860 3.502 3.031 3.697 . 0 0 "[ . 1 . 2]" 1 889 1 50 THR HB 1 51 VAL H . . 4.480 4.380 4.296 4.457 . 0 0 "[ . 1 . 2]" 1 890 1 50 THR MG 1 51 VAL H . . 3.800 2.750 2.652 2.896 . 0 0 "[ . 1 . 2]" 1 891 1 50 THR MG 1 70 VAL H . . 6.000 4.040 3.652 4.263 . 0 0 "[ . 1 . 2]" 1 892 1 50 THR MG 1 71 ARG HA . . 4.390 3.228 2.774 3.473 . 0 0 "[ . 1 . 2]" 1 893 1 50 THR MG 1 71 ARG HB2 . . 5.660 4.242 3.905 4.525 . 0 0 "[ . 1 . 2]" 1 894 1 51 VAL H 1 51 VAL MG2 . . 3.610 2.523 2.441 2.624 . 0 0 "[ . 1 . 2]" 1 895 1 51 VAL H 1 52 ASP H . . 4.510 4.377 4.374 4.380 . 0 0 "[ . 1 . 2]" 1 896 1 51 VAL H 1 70 VAL H . . 3.210 3.263 3.217 3.300 0.090 12 0 "[ . 1 . 2]" 1 897 1 51 VAL H 1 70 VAL HB . . 5.070 4.989 4.674 5.108 0.038 14 0 "[ . 1 . 2]" 1 898 1 51 VAL H 1 71 ARG HA . . 3.730 3.770 3.573 3.820 0.090 3 0 "[ . 1 . 2]" 1 899 1 51 VAL HA 1 51 VAL HB . . 2.680 2.354 2.331 2.366 . 0 0 "[ . 1 . 2]" 1 900 1 51 VAL HA 1 51 VAL MG1 . . 3.430 2.469 2.442 2.513 . 0 0 "[ . 1 . 2]" 1 901 1 51 VAL HA 1 52 ASP H . . 2.710 2.565 2.551 2.573 . 0 0 "[ . 1 . 2]" 1 902 1 51 VAL HB 1 52 ASP H . . 3.210 2.406 2.376 2.467 . 0 0 "[ . 1 . 2]" 1 903 1 51 VAL MG1 1 52 ASP H . . 4.670 3.899 3.872 3.949 . 0 0 "[ . 1 . 2]" 1 904 1 51 VAL MG2 1 52 ASP H . . 4.790 2.953 2.875 3.071 . 0 0 "[ . 1 . 2]" 1 905 1 51 VAL MG2 1 70 VAL H . . 5.850 3.727 3.552 3.904 . 0 0 "[ . 1 . 2]" 1 906 1 51 VAL MG2 1 70 VAL HB . . 6.500 4.326 4.018 4.539 . 0 0 "[ . 1 . 2]" 1 907 1 52 ASP H 1 52 ASP HB2 . . 3.550 2.849 2.681 2.947 . 0 0 "[ . 1 . 2]" 1 908 1 52 ASP H 1 52 ASP QB . . 3.180 2.732 2.608 2.801 . 0 0 "[ . 1 . 2]" 1 909 1 52 ASP H 1 52 ASP HB3 . . 3.550 3.522 3.491 3.571 0.021 11 0 "[ . 1 . 2]" 1 910 1 52 ASP HA 1 53 ALA H . . 2.710 2.338 2.304 2.395 . 0 0 "[ . 1 . 2]" 1 911 1 52 ASP HA 1 53 ALA MB . . 4.950 3.879 3.797 3.955 . 0 0 "[ . 1 . 2]" 1 912 1 52 ASP HA 1 69 ARG HA . . 2.900 2.439 2.233 2.760 . 0 0 "[ . 1 . 2]" 1 913 1 52 ASP HA 1 70 VAL H . . 3.830 3.132 2.987 3.310 . 0 0 "[ . 1 . 2]" 1 914 1 52 ASP QB 1 53 ALA H . . 3.410 2.967 2.773 3.085 . 0 0 "[ . 1 . 2]" 1 915 1 52 ASP HB2 1 53 ALA H . . 3.640 3.661 3.617 3.703 0.063 5 0 "[ . 1 . 2]" 1 916 1 52 ASP HB3 1 53 ALA H . . 3.640 3.141 2.874 3.319 . 0 0 "[ . 1 . 2]" 1 917 1 53 ALA H 1 53 ALA MB . . 3.610 2.360 2.259 2.473 . 0 0 "[ . 1 . 2]" 1 918 1 53 ALA H 1 54 GLU H . . 4.600 4.129 4.034 4.210 . 0 0 "[ . 1 . 2]" 1 919 1 53 ALA H 1 68 THR H . . 3.270 2.470 2.268 2.661 . 0 0 "[ . 1 . 2]" 1 920 1 53 ALA H 1 69 ARG HA . . 3.700 3.344 3.194 3.515 . 0 0 "[ . 1 . 2]" 1 921 1 53 ALA HA 1 54 GLU H . . 2.650 2.198 2.188 2.204 . 0 0 "[ . 1 . 2]" 1 922 1 53 ALA MB 1 54 GLU H . . 4.300 3.476 3.389 3.509 . 0 0 "[ . 1 . 2]" 1 923 1 53 ALA MB 1 55 ALA MB . . 7.560 3.781 3.606 3.904 . 0 0 "[ . 1 . 2]" 1 924 1 53 ALA MB 1 68 THR H . . 4.950 3.168 2.944 3.468 . 0 0 "[ . 1 . 2]" 1 925 1 53 ALA MB 1 70 VAL HB . . 6.530 1.932 1.787 2.131 . 0 0 "[ . 1 . 2]" 1 926 1 53 ALA MB 1 70 VAL MG1 . . 7.560 2.089 1.865 2.568 . 0 0 "[ . 1 . 2]" 1 927 1 53 ALA MB 1 70 VAL QG . . 7.240 2.042 1.848 2.401 . 0 0 "[ . 1 . 2]" 1 928 1 53 ALA MB 1 70 VAL MG2 . . 7.560 2.997 2.660 3.193 . 0 0 "[ . 1 . 2]" 1 929 1 54 GLU H 1 54 GLU HG2 . . 5.500 4.466 4.311 4.738 . 0 0 "[ . 1 . 2]" 1 930 1 54 GLU H 1 54 GLU HG3 . . 5.500 4.508 4.004 4.743 . 0 0 "[ . 1 . 2]" 1 931 1 54 GLU HA 1 55 ALA H . . 2.650 2.231 2.209 2.238 . 0 0 "[ . 1 . 2]" 1 932 1 54 GLU HA 1 67 ALA HA . . 3.020 2.096 1.970 2.397 . 0 0 "[ . 1 . 2]" 1 933 1 54 GLU HA 1 67 ALA MB . . 4.110 2.928 2.672 3.246 . 0 0 "[ . 1 . 2]" 1 934 1 54 GLU HA 1 68 THR H . . 4.070 3.602 3.395 3.841 . 0 0 "[ . 1 . 2]" 1 935 1 54 GLU QB 1 67 ALA HA . . 6.380 3.842 3.434 4.163 . 0 0 "[ . 1 . 2]" 1 936 1 54 GLU QB 1 67 ALA MB . . 7.250 3.119 2.746 3.803 . 0 0 "[ . 1 . 2]" 1 937 1 54 GLU QG 1 55 ALA H . . 5.250 3.361 3.017 3.775 . 0 0 "[ . 1 . 2]" 1 938 1 54 GLU QG 1 55 ALA HA . . 6.220 4.591 3.963 5.381 . 0 0 "[ . 1 . 2]" 1 939 1 54 GLU QG 1 55 ALA MB . . 7.410 4.789 4.506 5.258 . 0 0 "[ . 1 . 2]" 1 940 1 54 GLU QG 1 65 LYS QB . . 7.250 3.437 2.907 4.262 . 0 0 "[ . 1 . 2]" 1 941 1 54 GLU QG 1 65 LYS QD . . 6.320 3.864 3.021 5.048 . 0 0 "[ . 1 . 2]" 1 942 1 54 GLU QG 1 67 ALA HA . . 6.380 3.131 2.482 3.712 . 0 0 "[ . 1 . 2]" 1 943 1 54 GLU QG 1 67 ALA MB . . 5.540 2.404 1.758 3.088 . 0 0 "[ . 1 . 2]" 1 944 1 54 GLU HG2 1 55 ALA H . . 5.500 3.653 3.061 4.245 . 0 0 "[ . 1 . 2]" 1 945 1 54 GLU HG2 1 65 LYS HD2 . . 7.250 4.774 3.549 6.568 . 0 0 "[ . 1 . 2]" 1 946 1 54 GLU HG2 1 65 LYS HD3 . . 7.250 5.039 3.403 6.627 . 0 0 "[ . 1 . 2]" 1 947 1 54 GLU HG2 1 67 ALA MB . . 5.810 3.377 2.048 4.438 . 0 0 "[ . 1 . 2]" 1 948 1 54 GLU HG3 1 55 ALA H . . 5.500 4.329 3.401 5.239 . 0 0 "[ . 1 . 2]" 1 949 1 54 GLU HG3 1 65 LYS HD2 . . 7.250 5.029 3.550 6.354 . 0 0 "[ . 1 . 2]" 1 950 1 54 GLU HG3 1 65 LYS HD3 . . 7.250 5.340 3.623 7.001 . 0 0 "[ . 1 . 2]" 1 951 1 54 GLU HG3 1 67 ALA MB . . 5.810 2.582 1.915 3.409 . 0 0 "[ . 1 . 2]" 1 952 1 55 ALA H 1 55 ALA HA . . 2.900 2.935 2.921 2.941 0.041 6 0 "[ . 1 . 2]" 1 953 1 55 ALA H 1 56 GLN H . . 5.100 4.536 4.467 4.561 . 0 0 "[ . 1 . 2]" 1 954 1 55 ALA H 1 66 PHE H . . 3.890 3.615 3.340 3.788 . 0 0 "[ . 1 . 2]" 1 955 1 55 ALA H 1 67 ALA HA . . 3.760 3.229 2.973 3.555 . 0 0 "[ . 1 . 2]" 1 956 1 55 ALA H 1 67 ALA MB . . 6.160 4.458 4.184 4.804 . 0 0 "[ . 1 . 2]" 1 957 1 55 ALA HA 1 56 GLN H . . 2.620 2.395 2.327 2.555 . 0 0 "[ . 1 . 2]" 1 958 1 55 ALA MB 1 56 GLN H . . 4.080 2.700 2.464 2.863 . 0 0 "[ . 1 . 2]" 1 959 1 55 ALA MB 1 56 GLN HG2 . . 6.530 5.339 5.117 5.563 . 0 0 "[ . 1 . 2]" 1 960 1 55 ALA MB 1 56 GLN HG3 . . 6.530 5.151 4.545 5.391 . 0 0 "[ . 1 . 2]" 1 961 1 56 GLN H 1 56 GLN HA . . 2.870 2.915 2.902 2.918 0.048 19 0 "[ . 1 . 2]" 1 962 1 56 GLN H 1 56 GLN HB2 . . 3.700 2.514 2.449 2.662 . 0 0 "[ . 1 . 2]" 1 963 1 56 GLN H 1 56 GLN QB . . 3.490 2.468 2.406 2.609 . 0 0 "[ . 1 . 2]" 1 964 1 56 GLN H 1 56 GLN HB3 . . 3.700 3.595 3.522 3.756 0.056 20 0 "[ . 1 . 2]" 1 965 1 56 GLN H 1 56 GLN HG2 . . 5.250 4.170 3.916 4.484 . 0 0 "[ . 1 . 2]" 1 966 1 56 GLN H 1 56 GLN QG . . 4.700 3.465 3.239 3.565 . 0 0 "[ . 1 . 2]" 1 967 1 56 GLN H 1 56 GLN HG3 . . 5.250 3.719 3.333 3.891 . 0 0 "[ . 1 . 2]" 1 968 1 56 GLN HA 1 56 GLN QG . . 3.660 2.087 2.015 2.337 . 0 0 "[ . 1 . 2]" 1 969 1 56 GLN HA 1 57 VAL MG1 . . 5.230 3.891 3.572 4.252 . 0 0 "[ . 1 . 2]" 1 970 1 56 GLN HA 1 57 VAL MG2 . . 4.390 3.214 2.990 3.491 . 0 0 "[ . 1 . 2]" 1 971 1 56 GLN HA 1 65 LYS HA . . 3.920 2.439 2.269 2.678 . 0 0 "[ . 1 . 2]" 1 972 1 56 GLN HA 1 65 LYS QB . . 6.130 3.649 3.365 4.246 . 0 0 "[ . 1 . 2]" 1 973 1 56 GLN QG 1 57 VAL H . . 5.070 3.414 3.269 3.632 . 0 0 "[ . 1 . 2]" 1 974 1 56 GLN QG 1 65 LYS QB . . 7.060 1.977 1.827 2.668 . 0 0 "[ . 1 . 2]" 1 975 1 56 GLN QG 1 65 LYS QG . . 5.090 3.580 1.966 3.812 . 0 0 "[ . 1 . 2]" 1 976 1 56 GLN HG2 1 57 VAL H . . 5.500 3.523 3.358 3.794 . 0 0 "[ . 1 . 2]" 1 977 1 56 GLN HG2 1 65 LYS HG2 . . 5.760 4.013 2.012 4.337 . 0 0 "[ . 1 . 2]" 1 978 1 56 GLN HG2 1 65 LYS HG3 . . 5.760 4.498 2.964 4.787 . 0 0 "[ . 1 . 2]" 1 979 1 56 GLN HG3 1 57 VAL H . . 5.500 4.589 4.489 4.666 . 0 0 "[ . 1 . 2]" 1 980 1 56 GLN HG3 1 65 LYS HG2 . . 5.760 4.970 3.351 5.476 . 0 0 "[ . 1 . 2]" 1 981 1 56 GLN HG3 1 65 LYS HG3 . . 5.760 5.633 4.649 5.822 0.062 7 0 "[ . 1 . 2]" 1 982 1 57 VAL H 1 57 VAL HB . . 4.070 3.656 3.510 3.759 . 0 0 "[ . 1 . 2]" 1 983 1 57 VAL H 1 57 VAL MG2 . . 3.680 2.058 1.892 2.201 . 0 0 "[ . 1 . 2]" 1 984 1 57 VAL H 1 64 GLU H . . 3.520 3.369 3.004 3.501 . 0 0 "[ . 1 . 2]" 1 985 1 57 VAL HA 1 57 VAL HB . . 2.930 2.621 2.544 2.714 . 0 0 "[ . 1 . 2]" 1 986 1 57 VAL HA 1 58 GLY H . . 2.830 2.191 2.185 2.198 . 0 0 "[ . 1 . 2]" 1 987 1 57 VAL HA 1 58 GLY QA . . 6.380 3.902 3.897 3.908 . 0 0 "[ . 1 . 2]" 1 988 1 57 VAL HB 1 58 GLY H . . 3.490 3.480 3.378 3.578 0.088 18 0 "[ . 1 . 2]" 1 989 1 57 VAL HB 1 66 PHE QD . . 7.620 6.106 5.720 6.666 . 0 0 "[ . 1 . 2]" 1 990 1 57 VAL MG1 1 58 GLY H . . 5.850 3.712 3.530 3.876 . 0 0 "[ . 1 . 2]" 1 991 1 57 VAL MG1 1 66 PHE QD . . 8.120 3.629 3.334 4.020 . 0 0 "[ . 1 . 2]" 1 992 1 57 VAL MG2 1 58 GLY H . . 5.720 4.323 4.221 4.417 . 0 0 "[ . 1 . 2]" 1 993 1 57 VAL MG2 1 62 LEU QB . . 7.190 3.427 3.026 4.311 . 0 0 "[ . 1 . 2]" 1 994 1 57 VAL MG2 1 64 GLU HB2 . . 5.500 2.801 2.298 3.200 . 0 0 "[ . 1 . 2]" 1 995 1 57 VAL MG2 1 66 PHE QD . . 7.560 3.485 2.773 4.290 . 0 0 "[ . 1 . 2]" 1 996 1 58 GLY QA 1 63 ARG HA . . 5.110 4.140 3.561 4.326 . 0 0 "[ . 1 . 2]" 1 997 1 60 SER HA 1 61 PHE HA . . 5.030 5.055 5.030 5.078 0.048 7 0 "[ . 1 . 2]" 1 998 1 60 SER QB 1 61 PHE HA . . 6.380 5.071 4.945 5.561 . 0 0 "[ . 1 . 2]" 1 999 1 60 SER QB 1 62 LEU H . . 6.070 2.761 2.485 3.629 . 0 0 "[ . 1 . 2]" 1 1000 1 61 PHE H 1 61 PHE HA . . 2.460 2.205 2.203 2.222 . 0 0 "[ . 1 . 2]" 1 1001 1 61 PHE H 1 62 LEU H . . 2.830 2.716 2.684 2.741 . 0 0 "[ . 1 . 2]" 1 1002 1 61 PHE HA 1 62 LEU H . . 3.420 3.223 3.169 3.383 . 0 0 "[ . 1 . 2]" 1 1003 1 61 PHE QD 1 62 LEU H . . 7.620 4.519 4.090 4.814 . 0 0 "[ . 1 . 2]" 1 1004 1 61 PHE QD 1 62 LEU HB2 . . 7.620 3.804 3.098 5.121 . 0 0 "[ . 1 . 2]" 1 1005 1 61 PHE QD 1 62 LEU HB3 . . 7.620 4.986 3.953 6.022 . 0 0 "[ . 1 . 2]" 1 1006 1 61 PHE QD 1 62 LEU MD1 . . 8.650 4.052 2.694 6.280 . 0 0 "[ . 1 . 2]" 1 1007 1 61 PHE QD 1 62 LEU QD . . 8.240 3.885 2.681 5.265 . 0 0 "[ . 1 . 2]" 1 1008 1 61 PHE QD 1 62 LEU MD2 . . 8.650 5.348 4.519 6.076 . 0 0 "[ . 1 . 2]" 1 1009 1 61 PHE QD 1 62 LEU HG . . 7.620 5.945 3.319 7.160 . 0 0 "[ . 1 . 2]" 1 1010 1 61 PHE QD 1 119 LEU MD1 . . 8.650 4.167 2.657 5.060 . 0 0 "[ . 1 . 2]" 1 1011 1 61 PHE QD 1 119 LEU MD2 . . 8.650 4.076 2.637 4.966 . 0 0 "[ . 1 . 2]" 1 1012 1 61 PHE QE 1 123 LEU MD1 . . 8.650 5.286 4.072 5.704 . 0 0 "[ . 1 . 2]" 1 1013 1 61 PHE QE 1 123 LEU MD2 . . 8.650 5.845 4.556 6.293 . 0 0 "[ . 1 . 2]" 1 1014 1 62 LEU H 1 62 LEU HA . . 2.900 2.917 2.894 2.938 0.038 4 0 "[ . 1 . 2]" 1 1015 1 62 LEU H 1 62 LEU HB2 . . 3.360 3.139 2.637 3.574 0.214 13 0 "[ . 1 . 2]" 1 1016 1 62 LEU H 1 62 LEU QB . . 3.070 2.597 2.441 2.693 . 0 0 "[ . 1 . 2]" 1 1017 1 62 LEU H 1 62 LEU HB3 . . 3.360 2.879 2.538 3.422 0.062 16 0 "[ . 1 . 2]" 1 1018 1 62 LEU H 1 62 LEU MD1 . . 5.690 4.447 3.922 4.792 . 0 0 "[ . 1 . 2]" 1 1019 1 62 LEU H 1 62 LEU QD . . 4.970 3.808 3.690 3.926 . 0 0 "[ . 1 . 2]" 1 1020 1 62 LEU H 1 62 LEU MD2 . . 5.690 4.278 3.844 4.724 . 0 0 "[ . 1 . 2]" 1 1021 1 62 LEU H 1 62 LEU HG . . 5.160 4.499 4.020 4.851 . 0 0 "[ . 1 . 2]" 1 1022 1 62 LEU H 1 63 ARG H . . 4.600 3.857 3.647 4.229 . 0 0 "[ . 1 . 2]" 1 1023 1 62 LEU HA 1 63 ARG H . . 2.680 2.227 2.179 2.253 . 0 0 "[ . 1 . 2]" 1 1024 1 62 LEU QB 1 63 ARG H . . 4.540 3.984 3.529 4.069 . 0 0 "[ . 1 . 2]" 1 1025 1 62 LEU HB2 1 63 ARG H . . 4.850 4.552 4.257 4.706 . 0 0 "[ . 1 . 2]" 1 1026 1 62 LEU HB3 1 63 ARG H . . 4.850 4.439 3.675 4.665 . 0 0 "[ . 1 . 2]" 1 1027 1 62 LEU QD 1 63 ARG H . . 5.620 3.819 2.885 4.124 . 0 0 "[ . 1 . 2]" 1 1028 1 62 LEU QD 1 64 GLU QG . . 6.690 2.440 1.752 3.212 . 0 0 "[ . 1 . 2]" 1 1029 1 62 LEU QD 1 114 PHE QE . . 7.490 2.777 2.504 3.085 . 0 0 "[ . 1 . 2]" 1 1030 1 62 LEU MD1 1 63 ARG H . . 5.910 4.297 3.268 5.024 . 0 0 "[ . 1 . 2]" 1 1031 1 62 LEU MD1 1 64 GLU HB2 . . 6.530 4.592 3.427 5.543 . 0 0 "[ . 1 . 2]" 1 1032 1 62 LEU MD1 1 64 GLU HG2 . . 8.280 4.583 2.277 5.529 . 0 0 "[ . 1 . 2]" 1 1033 1 62 LEU MD1 1 64 GLU HG3 . . 8.280 3.362 1.942 4.267 . 0 0 "[ . 1 . 2]" 1 1034 1 62 LEU MD1 1 114 PHE QE . . 8.250 3.923 2.647 5.334 . 0 0 "[ . 1 . 2]" 1 1035 1 62 LEU MD2 1 63 ARG H . . 5.910 4.629 2.903 5.025 . 0 0 "[ . 1 . 2]" 1 1036 1 62 LEU MD2 1 64 GLU HB2 . . 6.530 2.808 1.841 4.187 . 0 0 "[ . 1 . 2]" 1 1037 1 62 LEU MD2 1 64 GLU HG2 . . 8.280 4.012 3.246 4.931 . 0 0 "[ . 1 . 2]" 1 1038 1 62 LEU MD2 1 64 GLU HG3 . . 8.280 2.681 1.903 3.510 . 0 0 "[ . 1 . 2]" 1 1039 1 62 LEU MD2 1 114 PHE QE . . 8.250 3.027 2.635 4.814 . 0 0 "[ . 1 . 2]" 1 1040 1 62 LEU HG 1 63 ARG H . . 4.140 3.678 3.367 4.112 . 0 0 "[ . 1 . 2]" 1 1041 1 62 LEU HG 1 114 PHE QE . . 7.620 5.660 5.327 6.015 . 0 0 "[ . 1 . 2]" 1 1042 1 63 ARG H 1 63 ARG HB2 . . 3.390 2.186 2.042 2.397 . 0 0 "[ . 1 . 2]" 1 1043 1 63 ARG H 1 63 ARG QB . . 3.210 2.118 2.020 2.225 . 0 0 "[ . 1 . 2]" 1 1044 1 63 ARG H 1 63 ARG HB3 . . 3.390 2.980 2.592 3.386 . 0 0 "[ . 1 . 2]" 1 1045 1 63 ARG H 1 63 ARG HG2 . . 5.070 4.354 3.703 4.665 . 0 0 "[ . 1 . 2]" 1 1046 1 63 ARG H 1 63 ARG QG . . 4.780 3.814 3.223 4.053 . 0 0 "[ . 1 . 2]" 1 1047 1 63 ARG H 1 63 ARG HG3 . . 5.070 4.244 3.544 4.568 . 0 0 "[ . 1 . 2]" 1 1048 1 63 ARG H 1 64 GLU H . . 4.600 4.207 4.145 4.287 . 0 0 "[ . 1 . 2]" 1 1049 1 63 ARG HA 1 63 ARG QD . . 3.750 2.945 2.240 3.391 . 0 0 "[ . 1 . 2]" 1 1050 1 63 ARG HA 1 63 ARG HG2 . . 3.640 2.967 1.988 3.676 0.036 6 0 "[ . 1 . 2]" 1 1051 1 63 ARG HA 1 63 ARG QG . . 3.300 2.177 1.970 2.522 . 0 0 "[ . 1 . 2]" 1 1052 1 63 ARG HA 1 63 ARG HG3 . . 3.640 2.715 2.099 3.542 . 0 0 "[ . 1 . 2]" 1 1053 1 63 ARG HA 1 64 GLU H . . 2.990 2.299 2.261 2.311 . 0 0 "[ . 1 . 2]" 1 1054 1 63 ARG QB 1 64 GLU QG . . 7.250 3.959 3.912 4.060 . 0 0 "[ . 1 . 2]" 1 1055 1 63 ARG HB2 1 64 GLU H . . 5.500 4.715 4.667 4.742 . 0 0 "[ . 1 . 2]" 1 1056 1 63 ARG HB3 1 64 GLU H . . 5.500 4.281 4.003 4.473 . 0 0 "[ . 1 . 2]" 1 1057 1 63 ARG QG 1 64 GLU H . . 5.110 3.780 3.401 4.080 . 0 0 "[ . 1 . 2]" 1 1058 1 63 ARG QG 1 64 GLU QG . . 7.250 5.098 4.479 5.401 . 0 0 "[ . 1 . 2]" 1 1059 1 63 ARG HG2 1 64 GLU H . . 5.500 4.680 3.777 5.520 0.020 9 0 "[ . 1 . 2]" 1 1060 1 63 ARG HG3 1 64 GLU H . . 5.500 4.440 3.481 5.474 . 0 0 "[ . 1 . 2]" 1 1061 1 64 GLU H 1 64 GLU HA . . 2.900 2.884 2.882 2.897 . 0 0 "[ . 1 . 2]" 1 1062 1 64 GLU H 1 64 GLU HB2 . . 3.110 2.802 2.743 2.826 . 0 0 "[ . 1 . 2]" 1 1063 1 64 GLU H 1 64 GLU HB3 . . 3.830 3.842 3.814 3.862 0.032 15 0 "[ . 1 . 2]" 1 1064 1 64 GLU H 1 64 GLU HG2 . . 4.040 3.821 3.351 3.911 . 0 0 "[ . 1 . 2]" 1 1065 1 64 GLU H 1 64 GLU QG . . 3.560 3.295 3.191 3.393 . 0 0 "[ . 1 . 2]" 1 1066 1 64 GLU H 1 64 GLU HG3 . . 4.040 3.618 3.480 4.008 . 0 0 "[ . 1 . 2]" 1 1067 1 64 GLU H 1 65 LYS H . . 5.500 4.365 4.259 4.415 . 0 0 "[ . 1 . 2]" 1 1068 1 64 GLU HA 1 64 GLU HB3 . . 2.830 2.561 2.539 2.598 . 0 0 "[ . 1 . 2]" 1 1069 1 64 GLU HA 1 64 GLU HG2 . . 3.980 2.259 2.194 2.460 . 0 0 "[ . 1 . 2]" 1 1070 1 64 GLU HA 1 64 GLU QG . . 3.680 2.226 2.169 2.425 . 0 0 "[ . 1 . 2]" 1 1071 1 64 GLU HA 1 64 GLU HG3 . . 3.980 3.365 3.289 3.676 . 0 0 "[ . 1 . 2]" 1 1072 1 64 GLU HA 1 65 LYS H . . 2.460 2.382 2.243 2.525 0.065 1 0 "[ . 1 . 2]" 1 1073 1 64 GLU HB2 1 65 LYS H . . 4.170 3.952 3.676 4.231 0.061 4 0 "[ . 1 . 2]" 1 1074 1 64 GLU HB3 1 65 LYS H . . 3.800 2.779 2.398 3.225 . 0 0 "[ . 1 . 2]" 1 1075 1 64 GLU QG 1 65 LYS H . . 5.050 3.999 3.892 4.312 . 0 0 "[ . 1 . 2]" 1 1076 1 64 GLU HG2 1 65 LYS H . . 5.500 4.168 4.054 4.555 . 0 0 "[ . 1 . 2]" 1 1077 1 64 GLU HG3 1 65 LYS H . . 5.500 5.148 4.984 5.350 . 0 0 "[ . 1 . 2]" 1 1078 1 65 LYS H 1 65 LYS HB2 . . 3.700 3.572 2.575 3.782 0.082 17 0 "[ . 1 . 2]" 1 1079 1 65 LYS H 1 65 LYS HB3 . . 3.700 3.263 2.959 3.711 0.011 11 0 "[ . 1 . 2]" 1 1080 1 65 LYS H 1 65 LYS QD . . 5.360 3.908 3.369 4.151 . 0 0 "[ . 1 . 2]" 1 1081 1 65 LYS H 1 65 LYS HG2 . . 4.380 2.771 2.019 3.842 . 0 0 "[ . 1 . 2]" 1 1082 1 65 LYS H 1 65 LYS QG . . 4.010 1.971 1.834 2.374 . 0 0 "[ . 1 . 2]" 1 1083 1 65 LYS H 1 65 LYS HG3 . . 4.380 2.085 1.911 2.589 . 0 0 "[ . 1 . 2]" 1 1084 1 65 LYS H 1 66 PHE H . . 5.340 4.510 4.448 4.588 . 0 0 "[ . 1 . 2]" 1 1085 1 65 LYS HA 1 66 PHE H . . 2.960 2.360 2.295 2.456 . 0 0 "[ . 1 . 2]" 1 1086 1 65 LYS QB 1 66 PHE H . . 3.550 2.718 2.510 2.879 . 0 0 "[ . 1 . 2]" 1 1087 1 65 LYS HB2 1 66 PHE H . . 3.760 2.876 2.543 3.816 0.056 11 0 "[ . 1 . 2]" 1 1088 1 65 LYS HB3 1 66 PHE H . . 3.760 3.740 2.819 3.900 0.140 17 0 "[ . 1 . 2]" 1 1089 1 65 LYS QD 1 66 PHE H . . 5.760 4.279 3.100 5.203 . 0 0 "[ . 1 . 2]" 1 1090 1 65 LYS QG 1 66 PHE H . . 5.220 4.213 4.057 4.339 . 0 0 "[ . 1 . 2]" 1 1091 1 65 LYS HG2 1 66 PHE H . . 5.500 5.125 4.528 5.344 . 0 0 "[ . 1 . 2]" 1 1092 1 65 LYS HG3 1 66 PHE H . . 5.500 4.507 4.296 5.014 . 0 0 "[ . 1 . 2]" 1 1093 1 66 PHE HA 1 66 PHE HB2 . . 3.020 3.051 2.965 3.075 0.055 18 0 "[ . 1 . 2]" 1 1094 1 66 PHE HA 1 66 PHE HB3 . . 2.930 2.431 2.329 2.500 . 0 0 "[ . 1 . 2]" 1 1095 1 66 PHE HA 1 67 ALA H . . 2.590 2.363 2.292 2.474 . 0 0 "[ . 1 . 2]" 1 1096 1 66 PHE HA 1 86 GLY HA2 . . 3.670 2.959 2.353 3.649 . 0 0 "[ . 1 . 2]" 1 1097 1 66 PHE HA 1 86 GLY HA3 . . 4.290 4.171 3.746 4.328 0.038 13 0 "[ . 1 . 2]" 1 1098 1 66 PHE HA 1 87 PRO QD . . 6.380 4.451 3.354 5.298 . 0 0 "[ . 1 . 2]" 1 1099 1 66 PHE HB2 1 67 ALA H . . 3.670 3.633 3.019 3.714 0.044 2 0 "[ . 1 . 2]" 1 1100 1 66 PHE HB2 1 86 GLY HA2 . . 5.100 4.519 3.564 5.173 0.073 14 0 "[ . 1 . 2]" 1 1101 1 66 PHE HB2 1 86 GLY HA3 . . 5.500 4.674 3.492 5.161 . 0 0 "[ . 1 . 2]" 1 1102 1 66 PHE HB2 1 87 PRO QD . . 6.380 4.708 3.513 5.739 . 0 0 "[ . 1 . 2]" 1 1103 1 66 PHE HB3 1 67 ALA H . . 3.270 2.916 2.705 3.153 . 0 0 "[ . 1 . 2]" 1 1104 1 66 PHE HB3 1 86 GLY HA2 . . 5.220 2.925 1.972 3.731 . 0 0 "[ . 1 . 2]" 1 1105 1 66 PHE HB3 1 86 GLY HA3 . . 5.500 3.093 2.051 3.475 . 0 0 "[ . 1 . 2]" 1 1106 1 66 PHE HB3 1 87 PRO HD2 . . 5.500 4.335 3.644 5.038 . 0 0 "[ . 1 . 2]" 1 1107 1 66 PHE HB3 1 87 PRO QD . . 5.170 3.269 2.520 4.231 . 0 0 "[ . 1 . 2]" 1 1108 1 66 PHE HB3 1 87 PRO HD3 . . 5.500 3.534 2.550 5.266 . 0 0 "[ . 1 . 2]" 1 1109 1 66 PHE QD 1 68 THR MG . . 7.560 5.151 4.952 5.310 . 0 0 "[ . 1 . 2]" 1 1110 1 67 ALA H 1 84 LEU QB . . 6.380 5.045 4.570 5.485 . 0 0 "[ . 1 . 2]" 1 1111 1 67 ALA H 1 85 TYR H . . 4.040 3.803 3.390 4.070 0.030 16 0 "[ . 1 . 2]" 1 1112 1 67 ALA HA 1 68 THR H . . 2.400 2.274 2.255 2.287 . 0 0 "[ . 1 . 2]" 1 1113 1 67 ALA MB 1 68 THR H . . 3.610 2.944 2.886 3.042 . 0 0 "[ . 1 . 2]" 1 1114 1 67 ALA MB 1 68 THR HA . . 5.230 3.958 3.896 4.010 . 0 0 "[ . 1 . 2]" 1 1115 1 67 ALA MB 1 84 LEU QB . . 6.500 3.470 2.975 4.044 . 0 0 "[ . 1 . 2]" 1 1116 1 67 ALA MB 1 85 TYR H . . 5.780 3.270 2.958 3.792 . 0 0 "[ . 1 . 2]" 1 1117 1 67 ALA MB 1 85 TYR QD . . 7.400 3.830 3.242 4.455 . 0 0 "[ . 1 . 2]" 1 1118 1 68 THR H 1 68 THR HA . . 2.930 2.897 2.881 2.911 . 0 0 "[ . 1 . 2]" 1 1119 1 68 THR H 1 68 THR MG . . 4.420 3.429 3.331 3.514 . 0 0 "[ . 1 . 2]" 1 1120 1 68 THR H 1 69 ARG H . . 4.820 4.385 4.361 4.410 . 0 0 "[ . 1 . 2]" 1 1121 1 68 THR H 1 70 VAL QG . . 7.190 5.080 4.772 5.329 . 0 0 "[ . 1 . 2]" 1 1122 1 68 THR HA 1 68 THR HB . . 2.930 2.671 2.622 2.720 . 0 0 "[ . 1 . 2]" 1 1123 1 68 THR HA 1 69 ARG H . . 2.770 2.397 2.319 2.610 . 0 0 "[ . 1 . 2]" 1 1124 1 68 THR HA 1 83 LEU HA . . 3.270 3.298 3.082 3.445 0.175 6 0 "[ . 1 . 2]" 1 1125 1 68 THR HB 1 69 ARG H . . 2.900 2.725 2.235 2.952 0.052 14 0 "[ . 1 . 2]" 1 1126 1 68 THR MG 1 69 ARG H . . 4.300 3.568 3.489 3.623 . 0 0 "[ . 1 . 2]" 1 1127 1 68 THR MG 1 83 LEU QB . . 7.410 3.139 2.798 3.791 . 0 0 "[ . 1 . 2]" 1 1128 1 68 THR MG 1 84 LEU QB . . 6.040 3.346 3.122 3.601 . 0 0 "[ . 1 . 2]" 1 1129 1 68 THR MG 1 84 LEU MD1 . . 7.560 5.009 4.081 5.181 . 0 0 "[ . 1 . 2]" 1 1130 1 68 THR MG 1 84 LEU MD2 . . 7.560 4.696 4.281 5.203 . 0 0 "[ . 1 . 2]" 1 1131 1 69 ARG H 1 82 SER H . . 4.820 3.051 2.823 3.253 . 0 0 "[ . 1 . 2]" 1 1132 1 69 ARG H 1 83 LEU HA . . 4.320 4.048 3.867 4.271 . 0 0 "[ . 1 . 2]" 1 1133 1 69 ARG HA 1 70 VAL H . . 2.830 2.230 2.225 2.239 . 0 0 "[ . 1 . 2]" 1 1134 1 69 ARG HA 1 70 VAL HB . . 5.470 4.619 4.375 4.779 . 0 0 "[ . 1 . 2]" 1 1135 1 69 ARG HA 1 70 VAL QG . . 7.500 3.702 3.501 4.027 . 0 0 "[ . 1 . 2]" 1 1136 1 69 ARG QB 1 70 VAL QG . . 8.470 4.664 4.355 4.940 . 0 0 "[ . 1 . 2]" 1 1137 1 69 ARG QD 1 70 VAL QG . . 8.960 5.001 4.026 5.797 . 0 0 "[ . 1 . 2]" 1 1138 1 70 VAL H 1 70 VAL HB . . 3.240 2.735 2.436 2.904 . 0 0 "[ . 1 . 2]" 1 1139 1 70 VAL H 1 70 VAL MG1 . . 4.730 2.015 1.860 2.286 . 0 0 "[ . 1 . 2]" 1 1140 1 70 VAL H 1 70 VAL QG . . 4.130 2.007 1.855 2.267 . 0 0 "[ . 1 . 2]" 1 1141 1 70 VAL H 1 70 VAL MG2 . . 4.730 3.743 3.694 3.791 . 0 0 "[ . 1 . 2]" 1 1142 1 70 VAL HA 1 71 ARG H . . 2.740 2.230 2.184 2.269 . 0 0 "[ . 1 . 2]" 1 1143 1 70 VAL HA 1 71 ARG HA . . 4.630 4.345 4.327 4.366 . 0 0 "[ . 1 . 2]" 1 1144 1 70 VAL HA 1 81 VAL HA . . 3.390 2.473 2.276 2.687 . 0 0 "[ . 1 . 2]" 1 1145 1 70 VAL HA 1 81 VAL MG2 . . 6.190 2.018 1.778 2.300 . 0 0 "[ . 1 . 2]" 1 1146 1 70 VAL HB 1 71 ARG H . . 5.190 4.200 4.005 4.382 . 0 0 "[ . 1 . 2]" 1 1147 1 70 VAL HB 1 81 VAL MG1 . . 5.010 3.243 2.376 3.830 . 0 0 "[ . 1 . 2]" 1 1148 1 70 VAL QG 1 71 ARG H . . 5.530 2.383 2.088 2.682 . 0 0 "[ . 1 . 2]" 1 1149 1 70 VAL QG 1 71 ARG HA . . 8.090 3.401 3.182 3.535 . 0 0 "[ . 1 . 2]" 1 1150 1 70 VAL QG 1 71 ARG HB3 . . 8.090 4.910 4.755 5.058 . 0 0 "[ . 1 . 2]" 1 1151 1 70 VAL QG 1 71 ARG QD . . 8.960 4.974 4.638 5.443 . 0 0 "[ . 1 . 2]" 1 1152 1 70 VAL QG 1 71 ARG QG . . 6.490 4.104 3.774 4.178 . 0 0 "[ . 1 . 2]" 1 1153 1 70 VAL QG 1 72 ARG H . . 8.090 3.884 3.507 4.254 . 0 0 "[ . 1 . 2]" 1 1154 1 70 VAL QG 1 79 ILE HA . . 7.810 4.683 4.352 4.981 . 0 0 "[ . 1 . 2]" 1 1155 1 70 VAL QG 1 81 VAL HA . . 8.090 3.907 3.560 4.166 . 0 0 "[ . 1 . 2]" 1 1156 1 70 VAL QG 1 81 VAL HB . . 6.690 4.532 4.121 4.711 . 0 0 "[ . 1 . 2]" 1 1157 1 70 VAL QG 1 81 VAL MG1 . . 6.890 3.498 2.856 3.930 . 0 0 "[ . 1 . 2]" 1 1158 1 70 VAL QG 1 81 VAL MG2 . . 6.270 2.105 1.768 2.293 . 0 0 "[ . 1 . 2]" 1 1159 1 70 VAL MG1 1 71 ARG H . . 6.370 3.988 3.721 4.209 . 0 0 "[ . 1 . 2]" 1 1160 1 70 VAL MG1 1 81 VAL MG1 . . 7.560 4.336 3.656 4.787 . 0 0 "[ . 1 . 2]" 1 1161 1 70 VAL MG1 1 81 VAL MG2 . . 6.720 3.782 3.467 3.971 . 0 0 "[ . 1 . 2]" 1 1162 1 70 VAL MG2 1 71 ARG H . . 6.370 2.403 2.096 2.714 . 0 0 "[ . 1 . 2]" 1 1163 1 70 VAL MG2 1 81 VAL MG1 . . 7.560 3.707 2.921 4.176 . 0 0 "[ . 1 . 2]" 1 1164 1 70 VAL MG2 1 81 VAL MG2 . . 6.720 2.117 1.773 2.315 . 0 0 "[ . 1 . 2]" 1 1165 1 71 ARG H 1 71 ARG HB2 . . 3.760 2.574 2.408 3.588 . 0 0 "[ . 1 . 2]" 1 1166 1 71 ARG H 1 71 ARG HB3 . . 3.830 3.586 3.363 3.763 . 0 0 "[ . 1 . 2]" 1 1167 1 71 ARG H 1 72 ARG H . . 4.480 4.250 4.087 4.460 . 0 0 "[ . 1 . 2]" 1 1168 1 71 ARG H 1 80 ASP H . . 4.600 2.855 2.454 3.105 . 0 0 "[ . 1 . 2]" 1 1169 1 71 ARG H 1 81 VAL HA . . 3.890 3.303 3.081 3.554 . 0 0 "[ . 1 . 2]" 1 1170 1 71 ARG HA 1 72 ARG H . . 2.560 2.234 2.225 2.275 . 0 0 "[ . 1 . 2]" 1 1171 1 71 ARG HA 1 72 ARG QD . . 6.380 5.217 3.475 5.771 . 0 0 "[ . 1 . 2]" 1 1172 1 71 ARG HB2 1 80 ASP H . . 4.380 3.297 2.934 4.197 . 0 0 "[ . 1 . 2]" 1 1173 1 71 ARG HB3 1 72 ARG H . . 5.280 3.613 3.311 3.932 . 0 0 "[ . 1 . 2]" 1 1174 1 71 ARG HB3 1 72 ARG QB . . 6.380 5.437 5.196 5.794 . 0 0 "[ . 1 . 2]" 1 1175 1 71 ARG HB3 1 80 ASP H . . 5.100 3.976 3.581 4.999 . 0 0 "[ . 1 . 2]" 1 1176 1 71 ARG QD 1 72 ARG H . . 6.380 5.547 5.261 5.703 . 0 0 "[ . 1 . 2]" 1 1177 1 71 ARG QG 1 72 ARG H . . 5.040 3.931 3.666 4.422 . 0 0 "[ . 1 . 2]" 1 1178 1 71 ARG QG 1 72 ARG QB . . 7.250 5.728 5.321 5.802 . 0 0 "[ . 1 . 2]" 1 1179 1 71 ARG HG2 1 72 ARG H . . 5.500 4.390 3.995 5.229 . 0 0 "[ . 1 . 2]" 1 1180 1 71 ARG HG3 1 72 ARG H . . 5.500 4.469 4.107 5.392 . 0 0 "[ . 1 . 2]" 1 1181 1 72 ARG H 1 72 ARG QB . . 3.890 2.688 2.270 3.094 . 0 0 "[ . 1 . 2]" 1 1182 1 72 ARG H 1 73 ASP H . . 4.690 4.512 4.450 4.565 . 0 0 "[ . 1 . 2]" 1 1183 1 72 ARG HA 1 73 ASP H . . 2.680 2.386 2.340 2.433 . 0 0 "[ . 1 . 2]" 1 1184 1 72 ARG HA 1 78 SER H . . 5.500 5.095 4.847 5.405 . 0 0 "[ . 1 . 2]" 1 1185 1 72 ARG HA 1 79 ILE HA . . 3.240 2.767 2.325 2.931 . 0 0 "[ . 1 . 2]" 1 1186 1 72 ARG HA 1 80 ASP H . . 3.860 3.853 3.657 3.938 0.078 17 0 "[ . 1 . 2]" 1 1187 1 73 ASP H 1 73 ASP HA . . 2.870 2.890 2.883 2.905 0.035 20 0 "[ . 1 . 2]" 1 1188 1 73 ASP H 1 73 ASP HB2 . . 3.110 3.073 2.741 3.153 0.043 10 0 "[ . 1 . 2]" 1 1189 1 73 ASP H 1 73 ASP HB3 . . 3.110 2.903 2.804 3.105 . 0 0 "[ . 1 . 2]" 1 1190 1 73 ASP H 1 74 LYS H . . 4.630 4.159 4.061 4.294 . 0 0 "[ . 1 . 2]" 1 1191 1 73 ASP H 1 78 SER H . . 3.730 3.431 3.163 3.731 0.001 15 0 "[ . 1 . 2]" 1 1192 1 73 ASP HA 1 74 LYS H . . 2.520 2.265 2.252 2.285 . 0 0 "[ . 1 . 2]" 1 1193 1 73 ASP HA 1 74 LYS HA . . 5.500 4.421 4.411 4.430 . 0 0 "[ . 1 . 2]" 1 1194 1 73 ASP HA 1 74 LYS QB . . 5.230 4.272 4.107 4.358 . 0 0 "[ . 1 . 2]" 1 1195 1 73 ASP HA 1 75 ASP H . . 4.410 3.469 3.372 3.585 . 0 0 "[ . 1 . 2]" 1 1196 1 73 ASP HA 1 76 ALA H . . 5.410 4.129 4.034 4.235 . 0 0 "[ . 1 . 2]" 1 1197 1 73 ASP QB 1 74 LYS H . . 4.300 3.795 3.575 3.899 . 0 0 "[ . 1 . 2]" 1 1198 1 73 ASP QB 1 74 LYS QB . . 7.260 5.308 5.099 5.403 . 0 0 "[ . 1 . 2]" 1 1199 1 73 ASP QB 1 76 ALA H . . 6.380 2.590 2.093 2.750 . 0 0 "[ . 1 . 2]" 1 1200 1 73 ASP QB 1 78 SER H . . 6.380 2.496 2.243 2.801 . 0 0 "[ . 1 . 2]" 1 1201 1 73 ASP HB2 1 74 LYS H . . 4.480 4.458 4.366 4.541 0.061 12 0 "[ . 1 . 2]" 1 1202 1 73 ASP HB2 1 76 ALA MB . . 4.640 3.026 2.797 3.326 . 0 0 "[ . 1 . 2]" 1 1203 1 73 ASP HB3 1 74 LYS H . . 4.480 4.117 3.758 4.275 . 0 0 "[ . 1 . 2]" 1 1204 1 73 ASP HB3 1 76 ALA MB . . 4.640 2.031 1.957 2.270 . 0 0 "[ . 1 . 2]" 1 1205 1 74 LYS H 1 74 LYS HA . . 2.930 2.906 2.879 2.929 . 0 0 "[ . 1 . 2]" 1 1206 1 74 LYS H 1 74 LYS QB . . 3.680 2.535 2.388 2.658 . 0 0 "[ . 1 . 2]" 1 1207 1 74 LYS H 1 74 LYS HD2 . . 5.500 4.147 2.968 4.961 . 0 0 "[ . 1 . 2]" 1 1208 1 74 LYS H 1 74 LYS HD3 . . 5.500 4.241 2.958 4.988 . 0 0 "[ . 1 . 2]" 1 1209 1 74 LYS H 1 74 LYS HG2 . . 4.110 2.491 2.046 3.363 . 0 0 "[ . 1 . 2]" 1 1210 1 74 LYS H 1 74 LYS QG . . 3.950 2.317 1.963 2.612 . 0 0 "[ . 1 . 2]" 1 1211 1 74 LYS H 1 74 LYS HG3 . . 4.110 3.252 1.977 3.953 . 0 0 "[ . 1 . 2]" 1 1212 1 74 LYS H 1 75 ASP H . . 2.560 2.245 2.058 2.392 . 0 0 "[ . 1 . 2]" 1 1213 1 74 LYS H 1 76 ALA H . . 4.290 3.800 3.613 3.946 . 0 0 "[ . 1 . 2]" 1 1214 1 74 LYS HA 1 76 ALA MB . . 6.530 5.358 5.314 5.435 . 0 0 "[ . 1 . 2]" 1 1215 1 74 LYS HA 1 77 ARG H . . 3.730 3.195 3.131 3.305 . 0 0 "[ . 1 . 2]" 1 1216 1 74 LYS QB 1 75 ASP H . . 4.950 3.854 3.761 3.924 . 0 0 "[ . 1 . 2]" 1 1217 1 74 LYS QD 1 75 ASP H . . 6.380 4.542 2.858 5.037 . 0 0 "[ . 1 . 2]" 1 1218 1 74 LYS QE 1 75 ASP H . . 6.380 5.050 4.061 5.687 . 0 0 "[ . 1 . 2]" 1 1219 1 74 LYS QG 1 75 ASP H . . 3.340 2.743 2.570 2.989 . 0 0 "[ . 1 . 2]" 1 1220 1 75 ASP H 1 75 ASP HB2 . . 3.240 2.152 2.092 2.196 . 0 0 "[ . 1 . 2]" 1 1221 1 75 ASP H 1 75 ASP QB . . 3.020 2.119 2.070 2.150 . 0 0 "[ . 1 . 2]" 1 1222 1 75 ASP H 1 75 ASP HB3 . . 3.240 3.186 3.059 3.294 0.054 4 0 "[ . 1 . 2]" 1 1223 1 75 ASP H 1 76 ALA H . . 2.400 2.114 2.071 2.216 . 0 0 "[ . 1 . 2]" 1 1224 1 75 ASP H 1 76 ALA HA . . 4.760 4.793 4.755 4.877 0.117 4 0 "[ . 1 . 2]" 1 1225 1 75 ASP H 1 76 ALA MB . . 5.570 3.853 3.739 3.939 . 0 0 "[ . 1 . 2]" 1 1226 1 75 ASP H 1 77 ARG H . . 4.410 3.345 3.271 3.449 . 0 0 "[ . 1 . 2]" 1 1227 1 75 ASP HA 1 75 ASP HB2 . . 3.020 2.890 2.829 2.944 . 0 0 "[ . 1 . 2]" 1 1228 1 75 ASP HA 1 75 ASP HB3 . . 3.020 2.886 2.826 2.942 . 0 0 "[ . 1 . 2]" 1 1229 1 75 ASP HA 1 76 ALA HA . . 5.500 4.626 4.600 4.656 . 0 0 "[ . 1 . 2]" 1 1230 1 75 ASP QB 1 76 ALA H . . 3.250 2.991 2.924 3.019 . 0 0 "[ . 1 . 2]" 1 1231 1 75 ASP QB 1 76 ALA MB . . 5.970 3.507 3.390 3.553 . 0 0 "[ . 1 . 2]" 1 1232 1 75 ASP HB2 1 76 ALA H . . 3.490 3.371 3.189 3.505 0.015 14 0 "[ . 1 . 2]" 1 1233 1 75 ASP HB2 1 76 ALA MB . . 6.530 4.300 4.130 4.490 . 0 0 "[ . 1 . 2]" 1 1234 1 75 ASP HB3 1 76 ALA H . . 3.490 3.353 3.231 3.467 . 0 0 "[ . 1 . 2]" 1 1235 1 75 ASP HB3 1 76 ALA MB . . 6.530 3.724 3.538 3.859 . 0 0 "[ . 1 . 2]" 1 1236 1 76 ALA H 1 76 ALA HA . . 2.930 2.932 2.920 2.939 0.009 2 0 "[ . 1 . 2]" 1 1237 1 76 ALA H 1 76 ALA MB . . 3.430 2.296 2.197 2.382 . 0 0 "[ . 1 . 2]" 1 1238 1 76 ALA H 1 77 ARG H . . 2.520 1.986 1.887 2.094 . 0 0 "[ . 1 . 2]" 1 1239 1 76 ALA H 1 78 SER H . . 4.230 3.808 3.699 3.968 . 0 0 "[ . 1 . 2]" 1 1240 1 76 ALA HA 1 77 ARG H . . 3.640 3.511 3.496 3.540 . 0 0 "[ . 1 . 2]" 1 1241 1 76 ALA MB 1 77 ARG H . . 3.830 2.971 2.880 3.051 . 0 0 "[ . 1 . 2]" 1 1242 1 76 ALA MB 1 77 ARG HA . . 5.440 4.440 4.352 4.490 . 0 0 "[ . 1 . 2]" 1 1243 1 76 ALA MB 1 78 SER H . . 4.950 2.744 2.607 2.995 . 0 0 "[ . 1 . 2]" 1 1244 1 76 ALA MB 1 78 SER HB2 . . 4.700 3.767 3.634 3.815 . 0 0 "[ . 1 . 2]" 1 1245 1 76 ALA MB 1 78 SER HB3 . . 5.190 4.188 4.061 4.247 . 0 0 "[ . 1 . 2]" 1 1246 1 77 ARG H 1 77 ARG HA . . 2.490 2.160 2.159 2.162 . 0 0 "[ . 1 . 2]" 1 1247 1 77 ARG H 1 78 SER H . . 2.650 2.660 2.595 2.690 0.040 3 0 "[ . 1 . 2]" 1 1248 1 77 ARG HA 1 78 SER H . . 2.830 2.885 2.812 2.927 0.097 6 0 "[ . 1 . 2]" 1 1249 1 77 ARG HA 1 97 PHE QD . . 7.620 4.670 3.554 5.780 . 0 0 "[ . 1 . 2]" 1 1250 1 77 ARG HA 1 97 PHE QE . . 7.620 4.672 3.331 6.028 . 0 0 "[ . 1 . 2]" 1 1251 1 77 ARG QB 1 78 SER HA . . 6.380 4.242 4.207 4.327 . 0 0 "[ . 1 . 2]" 1 1252 1 78 SER H 1 78 SER HB2 . . 3.420 3.376 3.287 3.431 0.011 6 0 "[ . 1 . 2]" 1 1253 1 78 SER H 1 78 SER HB3 . . 3.950 3.741 3.725 3.766 . 0 0 "[ . 1 . 2]" 1 1254 1 78 SER H 1 79 ILE H . . 4.380 4.455 4.446 4.468 0.088 17 0 "[ . 1 . 2]" 1 1255 1 78 SER HA 1 78 SER HB2 . . 2.930 2.865 2.842 2.903 . 0 0 "[ . 1 . 2]" 1 1256 1 78 SER HA 1 78 SER HB3 . . 2.800 2.256 2.255 2.260 . 0 0 "[ . 1 . 2]" 1 1257 1 78 SER HA 1 79 ILE H . . 2.460 2.481 2.403 2.549 0.089 13 0 "[ . 1 . 2]" 1 1258 1 78 SER HA 1 96 ARG HA . . 3.270 3.046 2.110 3.312 0.042 4 0 "[ . 1 . 2]" 1 1259 1 78 SER HA 1 96 ARG HD2 . . 5.500 4.815 3.971 5.503 0.003 7 0 "[ . 1 . 2]" 1 1260 1 78 SER HA 1 96 ARG HD3 . . 5.500 4.490 3.060 5.489 . 0 0 "[ . 1 . 2]" 1 1261 1 78 SER HA 1 96 ARG QG . . 6.380 4.142 2.952 4.862 . 0 0 "[ . 1 . 2]" 1 1262 1 78 SER HA 1 97 PHE H . . 3.950 3.816 2.950 3.984 0.034 20 0 "[ . 1 . 2]" 1 1263 1 78 SER HA 1 97 PHE QD . . 7.620 3.448 2.457 4.688 . 0 0 "[ . 1 . 2]" 1 1264 1 78 SER HA 1 97 PHE QE . . 7.620 3.363 2.583 4.851 . 0 0 "[ . 1 . 2]" 1 1265 1 78 SER HB2 1 79 ILE H . . 3.020 2.832 2.636 3.032 0.012 8 0 "[ . 1 . 2]" 1 1266 1 78 SER HB2 1 96 ARG HA . . 5.500 4.512 3.459 4.895 . 0 0 "[ . 1 . 2]" 1 1267 1 78 SER HB2 1 96 ARG HD2 . . 5.500 4.619 3.918 5.285 . 0 0 "[ . 1 . 2]" 1 1268 1 78 SER HB2 1 96 ARG QD . . 4.930 3.444 2.537 4.310 . 0 0 "[ . 1 . 2]" 1 1269 1 78 SER HB2 1 96 ARG HD3 . . 5.500 3.665 2.557 5.510 0.010 16 0 "[ . 1 . 2]" 1 1270 1 78 SER HB2 1 97 PHE QD . . 7.620 6.055 5.054 6.861 . 0 0 "[ . 1 . 2]" 1 1271 1 78 SER HB3 1 79 ILE H . . 3.170 3.132 3.044 3.253 0.083 8 0 "[ . 1 . 2]" 1 1272 1 78 SER HB3 1 96 ARG HD2 . . 5.380 3.254 2.746 4.052 . 0 0 "[ . 1 . 2]" 1 1273 1 78 SER HB3 1 96 ARG QD . . 4.760 2.441 1.969 3.858 . 0 0 "[ . 1 . 2]" 1 1274 1 78 SER HB3 1 96 ARG HD3 . . 5.380 2.689 1.995 4.841 . 0 0 "[ . 1 . 2]" 1 1275 1 78 SER HB3 1 97 PHE QE . . 7.620 5.331 4.425 6.399 . 0 0 "[ . 1 . 2]" 1 1276 1 79 ILE H 1 79 ILE HB . . 2.710 2.592 2.478 2.699 . 0 0 "[ . 1 . 2]" 1 1277 1 79 ILE H 1 80 ASP H . . 5.500 4.397 4.314 4.461 . 0 0 "[ . 1 . 2]" 1 1278 1 79 ILE H 1 95 TRP H . . 3.490 3.040 2.574 3.453 . 0 0 "[ . 1 . 2]" 1 1279 1 79 ILE H 1 95 TRP QB . . 4.950 3.888 2.770 4.558 . 0 0 "[ . 1 . 2]" 1 1280 1 79 ILE H 1 96 ARG HA . . 4.290 3.500 3.157 3.866 . 0 0 "[ . 1 . 2]" 1 1281 1 79 ILE HA 1 79 ILE MG . . 3.580 2.691 2.485 3.105 . 0 0 "[ . 1 . 2]" 1 1282 1 79 ILE HA 1 80 ASP H . . 2.400 2.271 2.227 2.355 . 0 0 "[ . 1 . 2]" 1 1283 1 79 ILE HA 1 80 ASP HA . . 5.500 4.382 4.359 4.423 . 0 0 "[ . 1 . 2]" 1 1284 1 79 ILE HA 1 80 ASP HB3 . . 5.500 4.550 4.501 4.928 . 0 0 "[ . 1 . 2]" 1 1285 1 79 ILE HB 1 80 ASP H . . 4.230 4.273 4.138 4.372 0.142 9 0 "[ . 1 . 2]" 1 1286 1 79 ILE HB 1 95 TRP H . . 4.850 3.145 2.528 4.614 . 0 0 "[ . 1 . 2]" 1 1287 1 79 ILE HB 1 95 TRP QB . . 5.380 2.618 1.950 4.918 . 0 0 "[ . 1 . 2]" 1 1288 1 79 ILE HB 1 95 TRP HD1 . . 4.140 2.834 1.931 3.870 . 0 0 "[ . 1 . 2]" 1 1289 1 79 ILE HB 1 97 PHE QE . . 7.620 3.639 2.410 5.815 . 0 0 "[ . 1 . 2]" 1 1290 1 79 ILE MD 1 80 ASP H . . 4.300 2.892 2.084 3.269 . 0 0 "[ . 1 . 2]" 1 1291 1 79 ILE MD 1 80 ASP HA . . 6.530 5.007 3.932 5.453 . 0 0 "[ . 1 . 2]" 1 1292 1 79 ILE MD 1 95 TRP HD1 . . 4.950 4.005 3.623 4.299 . 0 0 "[ . 1 . 2]" 1 1293 1 79 ILE MG 1 80 ASP H . . 4.670 2.460 2.205 3.108 . 0 0 "[ . 1 . 2]" 1 1294 1 79 ILE MG 1 95 TRP H . . 5.780 2.557 1.917 3.404 . 0 0 "[ . 1 . 2]" 1 1295 1 79 ILE MG 1 95 TRP HD1 . . 4.260 2.259 1.757 3.654 . 0 0 "[ . 1 . 2]" 1 1296 1 79 ILE MG 1 97 PHE QE . . 8.650 4.688 3.866 5.885 . 0 0 "[ . 1 . 2]" 1 1297 1 80 ASP H 1 80 ASP HB2 . . 3.420 3.187 2.828 3.286 . 0 0 "[ . 1 . 2]" 1 1298 1 80 ASP H 1 80 ASP HB3 . . 2.900 2.814 2.740 2.994 0.094 17 0 "[ . 1 . 2]" 1 1299 1 80 ASP H 1 81 VAL H . . 4.450 4.310 4.242 4.401 . 0 0 "[ . 1 . 2]" 1 1300 1 80 ASP HA 1 80 ASP HB3 . . 3.050 3.054 3.016 3.056 0.006 15 0 "[ . 1 . 2]" 1 1301 1 80 ASP HA 1 81 VAL H . . 2.400 2.330 2.305 2.387 . 0 0 "[ . 1 . 2]" 1 1302 1 80 ASP HA 1 81 VAL HB . . 5.000 4.473 4.274 4.684 . 0 0 "[ . 1 . 2]" 1 1303 1 80 ASP HA 1 94 GLY HA2 . . 3.920 2.323 2.168 2.783 . 0 0 "[ . 1 . 2]" 1 1304 1 80 ASP HA 1 94 GLY QA . . 3.400 2.223 1.941 2.514 . 0 0 "[ . 1 . 2]" 1 1305 1 80 ASP HA 1 94 GLY HA3 . . 3.920 3.170 1.981 3.901 . 0 0 "[ . 1 . 2]" 1 1306 1 80 ASP HA 1 95 TRP H . . 3.760 3.566 3.285 3.863 0.103 8 0 "[ . 1 . 2]" 1 1307 1 80 ASP HB2 1 81 VAL H . . 4.200 4.220 4.142 4.266 0.066 17 0 "[ . 1 . 2]" 1 1308 1 80 ASP HB3 1 81 VAL H . . 4.010 3.989 3.542 4.067 0.057 20 0 "[ . 1 . 2]" 1 1309 1 80 ASP HB3 1 81 VAL HA . . 4.880 4.510 4.138 4.576 . 0 0 "[ . 1 . 2]" 1 1310 1 81 VAL H 1 81 VAL HB . . 2.830 2.689 2.605 2.840 0.010 19 0 "[ . 1 . 2]" 1 1311 1 81 VAL H 1 81 VAL MG2 . . 4.540 3.028 2.666 3.326 . 0 0 "[ . 1 . 2]" 1 1312 1 81 VAL H 1 93 ASN H . . 3.830 3.011 2.627 3.503 . 0 0 "[ . 1 . 2]" 1 1313 1 81 VAL H 1 94 GLY QA . . 5.110 3.155 2.782 3.491 . 0 0 "[ . 1 . 2]" 1 1314 1 81 VAL HA 1 82 SER H . . 2.560 2.226 2.184 2.306 . 0 0 "[ . 1 . 2]" 1 1315 1 81 VAL HB 1 93 ASN H . . 4.630 2.975 2.185 3.443 . 0 0 "[ . 1 . 2]" 1 1316 1 81 VAL HB 1 93 ASN HB2 . . 3.550 2.595 1.974 3.634 0.084 2 0 "[ . 1 . 2]" 1 1317 1 81 VAL HB 1 93 ASN QB . . 3.280 2.035 1.845 2.392 . 0 0 "[ . 1 . 2]" 1 1318 1 81 VAL HB 1 93 ASN HB3 . . 3.550 2.370 1.928 3.316 . 0 0 "[ . 1 . 2]" 1 1319 1 81 VAL MG1 1 82 SER H . . 4.170 2.488 2.076 2.899 . 0 0 "[ . 1 . 2]" 1 1320 1 81 VAL MG1 1 91 LEU QD . . 8.780 3.475 3.067 3.768 . 0 0 "[ . 1 . 2]" 1 1321 1 81 VAL MG1 1 93 ASN H . . 5.010 3.592 3.080 4.103 . 0 0 "[ . 1 . 2]" 1 1322 1 81 VAL MG1 1 93 ASN HB2 . . 5.600 3.014 1.997 3.729 . 0 0 "[ . 1 . 2]" 1 1323 1 81 VAL MG1 1 93 ASN QB . . 5.210 2.727 1.978 3.204 . 0 0 "[ . 1 . 2]" 1 1324 1 81 VAL MG1 1 93 ASN HB3 . . 5.600 3.432 2.536 4.423 . 0 0 "[ . 1 . 2]" 1 1325 1 81 VAL MG2 1 82 SER H . . 5.940 4.006 3.776 4.249 . 0 0 "[ . 1 . 2]" 1 1326 1 81 VAL MG2 1 93 ASN HB2 . . 5.940 3.807 3.002 4.754 . 0 0 "[ . 1 . 2]" 1 1327 1 81 VAL MG2 1 93 ASN QB . . 5.680 2.903 2.201 3.363 . 0 0 "[ . 1 . 2]" 1 1328 1 81 VAL MG2 1 93 ASN HB3 . . 5.940 3.056 2.264 3.724 . 0 0 "[ . 1 . 2]" 1 1329 1 82 SER HA 1 83 LEU H . . 2.590 2.465 2.377 2.623 0.033 16 0 "[ . 1 . 2]" 1 1330 1 82 SER HA 1 92 ASN HA . . 3.140 2.845 2.474 3.183 0.043 1 0 "[ . 1 . 2]" 1 1331 1 82 SER HA 1 92 ASN HB2 . . 5.500 5.141 4.404 5.522 0.022 18 0 "[ . 1 . 2]" 1 1332 1 82 SER HA 1 92 ASN HB3 . . 5.500 4.653 3.197 5.490 . 0 0 "[ . 1 . 2]" 1 1333 1 82 SER HA 1 93 ASN H . . 3.760 3.742 3.590 3.821 0.061 8 0 "[ . 1 . 2]" 1 1334 1 82 SER QB 1 83 LEU H . . 4.270 2.560 2.269 2.760 . 0 0 "[ . 1 . 2]" 1 1335 1 82 SER QB 1 83 LEU HA . . 4.860 4.433 4.359 4.516 . 0 0 "[ . 1 . 2]" 1 1336 1 82 SER QB 1 92 ASN HA . . 6.380 4.689 4.382 4.981 . 0 0 "[ . 1 . 2]" 1 1337 1 82 SER QB 1 92 ASN HD21 . . 6.380 4.772 3.437 5.459 . 0 0 "[ . 1 . 2]" 1 1338 1 82 SER QB 1 92 ASN HD22 . . 6.380 3.746 2.518 4.429 . 0 0 "[ . 1 . 2]" 1 1339 1 82 SER QB 1 93 ASN H . . 6.380 5.530 5.329 5.662 . 0 0 "[ . 1 . 2]" 1 1340 1 83 LEU H 1 83 LEU HB2 . . 3.860 2.829 2.123 3.231 . 0 0 "[ . 1 . 2]" 1 1341 1 83 LEU H 1 83 LEU QB . . 3.310 2.101 1.970 2.526 . 0 0 "[ . 1 . 2]" 1 1342 1 83 LEU H 1 83 LEU HB3 . . 3.860 2.318 1.993 3.536 . 0 0 "[ . 1 . 2]" 1 1343 1 83 LEU H 1 91 LEU H . . 4.450 4.347 3.936 4.506 0.056 19 0 "[ . 1 . 2]" 1 1344 1 83 LEU HA 1 83 LEU QD . . 3.930 2.514 1.947 3.213 . 0 0 "[ . 1 . 2]" 1 1345 1 83 LEU HA 1 85 TYR H . . 5.030 4.270 4.202 4.386 . 0 0 "[ . 1 . 2]" 1 1346 1 83 LEU QB 1 84 LEU H . . 4.050 3.550 2.906 3.731 . 0 0 "[ . 1 . 2]" 1 1347 1 83 LEU QB 1 91 LEU H . . 5.540 3.179 2.029 4.397 . 0 0 "[ . 1 . 2]" 1 1348 1 83 LEU HB2 1 84 LEU H . . 4.410 3.936 3.688 4.380 . 0 0 "[ . 1 . 2]" 1 1349 1 83 LEU HB2 1 84 LEU QB . . 6.380 5.707 5.483 5.818 . 0 0 "[ . 1 . 2]" 1 1350 1 83 LEU HB3 1 84 LEU H . . 4.410 4.196 2.982 4.510 0.100 6 0 "[ . 1 . 2]" 1 1351 1 83 LEU HB3 1 84 LEU QB . . 6.380 5.674 5.010 5.896 . 0 0 "[ . 1 . 2]" 1 1352 1 83 LEU QD 1 85 TYR H . . 7.070 3.220 2.240 5.191 . 0 0 "[ . 1 . 2]" 1 1353 1 83 LEU QD 1 88 PHE H . . 8.100 3.235 1.698 4.365 . 0 0 "[ . 1 . 2]" 1 1354 1 83 LEU QD 1 91 LEU H . . 7.070 3.268 1.729 4.595 . 0 0 "[ . 1 . 2]" 1 1355 1 83 LEU QD 1 92 ASN QD . . 8.970 4.846 2.211 5.864 . 0 0 "[ . 1 . 2]" 1 1356 1 83 LEU HG 1 84 LEU H . . 4.660 3.840 2.490 4.733 0.073 13 0 "[ . 1 . 2]" 1 1357 1 84 LEU H 1 84 LEU HG . . 5.500 4.508 3.628 4.863 . 0 0 "[ . 1 . 2]" 1 1358 1 84 LEU QB 1 85 TYR H . . 3.870 2.449 2.282 2.862 . 0 0 "[ . 1 . 2]" 1 1359 1 84 LEU QB 1 85 TYR QD . . 8.520 4.601 3.798 5.626 . 0 0 "[ . 1 . 2]" 1 1360 1 84 LEU QD 1 88 PHE QD . . 10.220 6.308 4.457 6.875 . 0 0 "[ . 1 . 2]" 1 1361 1 84 LEU QD 1 88 PHE QE . . 10.220 5.452 4.518 6.235 . 0 0 "[ . 1 . 2]" 1 1362 1 84 LEU HG 1 85 TYR H . . 4.040 3.986 2.364 4.316 0.276 15 0 "[ . 1 . 2]" 1 1363 1 85 TYR H 1 86 GLY H . . 5.500 1.775 1.724 1.837 . 0 0 "[ . 1 . 2]" 1 1364 1 85 TYR HA 1 85 TYR HB2 . . 2.900 2.881 2.549 2.968 0.068 18 0 "[ . 1 . 2]" 1 1365 1 85 TYR HA 1 85 TYR HB3 . . 2.900 2.945 2.869 3.084 0.184 14 0 "[ . 1 . 2]" 1 1366 1 85 TYR HA 1 86 GLY H . . 3.520 3.425 3.331 3.600 0.080 1 0 "[ . 1 . 2]" 1 1367 1 85 TYR QB 1 86 GLY H . . 3.550 3.113 2.645 3.338 . 0 0 "[ . 1 . 2]" 1 1368 1 85 TYR HB2 1 86 GLY H . . 3.950 3.614 2.961 4.055 0.105 15 0 "[ . 1 . 2]" 1 1369 1 85 TYR HB3 1 86 GLY H . . 3.950 3.431 2.689 3.761 . 0 0 "[ . 1 . 2]" 1 1370 1 85 TYR QD 1 86 GLY H . . 7.640 4.731 3.719 4.906 . 0 0 "[ . 1 . 2]" 1 1371 1 86 GLY HA2 1 87 PRO QD . . 3.800 2.677 1.854 3.211 . 0 0 "[ . 1 . 2]" 1 1372 1 86 GLY HA3 1 87 PRO QD . . 3.660 2.134 1.854 3.140 . 0 0 "[ . 1 . 2]" 1 1373 1 87 PRO HA 1 88 PHE H . . 3.330 2.763 2.148 3.497 0.167 20 0 "[ . 1 . 2]" 1 1374 1 87 PRO HA 1 88 PHE HA . . 5.500 4.640 4.264 5.199 . 0 0 "[ . 1 . 2]" 1 1375 1 88 PHE H 1 89 LYS H . . 5.500 3.662 2.551 4.651 . 0 0 "[ . 1 . 2]" 1 1376 1 88 PHE HA 1 89 LYS H . . 2.770 2.611 2.229 2.859 0.089 7 0 "[ . 1 . 2]" 1 1377 1 88 PHE QB 1 90 ARG H . . 6.220 5.226 3.270 5.645 . 0 0 "[ . 1 . 2]" 1 1378 1 89 LYS H 1 89 LYS HB2 . . 3.300 3.110 2.606 3.322 0.022 3 0 "[ . 1 . 2]" 1 1379 1 89 LYS H 1 89 LYS HB3 . . 3.300 3.009 2.346 3.335 0.035 13 0 "[ . 1 . 2]" 1 1380 1 89 LYS H 1 89 LYS QE . . 6.380 5.402 5.041 5.731 . 0 0 "[ . 1 . 2]" 1 1381 1 89 LYS H 1 89 LYS HG2 . . 5.160 4.533 4.392 4.644 . 0 0 "[ . 1 . 2]" 1 1382 1 89 LYS H 1 89 LYS QG . . 4.770 4.194 4.012 4.278 . 0 0 "[ . 1 . 2]" 1 1383 1 89 LYS H 1 89 LYS HG3 . . 5.160 4.954 4.638 5.158 . 0 0 "[ . 1 . 2]" 1 1384 1 89 LYS H 1 90 ARG H . . 2.900 2.197 1.895 2.895 . 0 0 "[ . 1 . 2]" 1 1385 1 89 LYS HA 1 89 LYS QB . . 2.710 2.436 2.316 2.521 . 0 0 "[ . 1 . 2]" 1 1386 1 89 LYS HA 1 89 LYS HG2 . . 3.670 2.224 2.020 2.534 . 0 0 "[ . 1 . 2]" 1 1387 1 89 LYS HA 1 89 LYS HG3 . . 3.670 3.153 2.505 3.577 . 0 0 "[ . 1 . 2]" 1 1388 1 89 LYS QB 1 90 ARG H . . 3.660 2.398 2.014 2.630 . 0 0 "[ . 1 . 2]" 1 1389 1 89 LYS QB 1 90 ARG HA . . 6.380 4.541 4.378 4.628 . 0 0 "[ . 1 . 2]" 1 1390 1 89 LYS QB 1 113 ALA MB . . 5.270 2.488 1.763 3.170 . 0 0 "[ . 1 . 2]" 1 1391 1 89 LYS HB2 1 90 ARG H . . 4.010 3.623 3.358 3.829 . 0 0 "[ . 1 . 2]" 1 1392 1 89 LYS HB3 1 90 ARG H . . 4.010 2.438 2.025 2.691 . 0 0 "[ . 1 . 2]" 1 1393 1 89 LYS QD 1 90 ARG H . . 5.260 3.505 1.950 4.395 . 0 0 "[ . 1 . 2]" 1 1394 1 89 LYS QD 1 113 ALA H . . 6.380 5.247 4.934 5.672 . 0 0 "[ . 1 . 2]" 1 1395 1 89 LYS QE 1 90 ARG H . . 5.230 4.493 3.921 4.720 . 0 0 "[ . 1 . 2]" 1 1396 1 89 LYS QE 1 113 ALA MB . . 6.500 2.718 1.879 4.388 . 0 0 "[ . 1 . 2]" 1 1397 1 89 LYS QG 1 90 ARG H . . 4.930 4.084 3.382 4.421 . 0 0 "[ . 1 . 2]" 1 1398 1 89 LYS QG 1 90 ARG QB . . 7.260 3.831 3.408 4.189 . 0 0 "[ . 1 . 2]" 1 1399 1 89 LYS HG2 1 90 ARG H . . 5.500 4.356 3.618 4.755 . 0 0 "[ . 1 . 2]" 1 1400 1 89 LYS HG3 1 90 ARG H . . 5.500 4.943 4.042 5.263 . 0 0 "[ . 1 . 2]" 1 1401 1 90 ARG H 1 90 ARG HG2 . . 4.630 4.641 4.456 4.714 0.084 19 0 "[ . 1 . 2]" 1 1402 1 90 ARG H 1 90 ARG HG3 . . 4.630 4.504 3.782 4.703 0.073 19 0 "[ . 1 . 2]" 1 1403 1 90 ARG H 1 91 LEU H . . 5.500 4.033 3.738 4.494 . 0 0 "[ . 1 . 2]" 1 1404 1 90 ARG H 1 113 ALA H . . 4.410 4.320 3.898 4.451 0.041 15 0 "[ . 1 . 2]" 1 1405 1 90 ARG H 1 113 ALA MB . . 4.880 2.683 1.907 3.323 . 0 0 "[ . 1 . 2]" 1 1406 1 90 ARG HA 1 90 ARG QG . . 4.020 2.216 2.058 2.562 . 0 0 "[ . 1 . 2]" 1 1407 1 90 ARG HA 1 91 LEU H . . 2.400 2.259 2.226 2.363 . 0 0 "[ . 1 . 2]" 1 1408 1 90 ARG QB 1 91 LEU H . . 4.050 3.581 3.328 3.782 . 0 0 "[ . 1 . 2]" 1 1409 1 90 ARG QB 1 111 GLU QB . . 7.250 5.030 4.080 5.769 . 0 0 "[ . 1 . 2]" 1 1410 1 90 ARG QB 1 113 ALA H . . 5.380 4.235 3.461 4.731 . 0 0 "[ . 1 . 2]" 1 1411 1 90 ARG QB 1 113 ALA MB . . 6.040 2.175 1.830 2.855 . 0 0 "[ . 1 . 2]" 1 1412 1 90 ARG QD 1 91 LEU H . . 6.380 4.641 4.142 5.363 . 0 0 "[ . 1 . 2]" 1 1413 1 90 ARG QD 1 111 GLU QB . . 7.250 4.678 3.563 5.314 . 0 0 "[ . 1 . 2]" 1 1414 1 90 ARG QD 1 113 ALA MB . . 6.970 3.708 3.134 4.545 . 0 0 "[ . 1 . 2]" 1 1415 1 90 ARG QG 1 91 LEU H . . 3.900 2.911 1.990 3.491 . 0 0 "[ . 1 . 2]" 1 1416 1 90 ARG QG 1 111 GLU QB . . 6.980 4.926 3.543 5.340 . 0 0 "[ . 1 . 2]" 1 1417 1 90 ARG HG2 1 91 LEU H . . 4.480 3.127 2.494 3.672 . 0 0 "[ . 1 . 2]" 1 1418 1 90 ARG HG3 1 91 LEU H . . 4.480 4.027 2.021 4.500 0.020 2 0 "[ . 1 . 2]" 1 1419 1 91 LEU H 1 91 LEU QB . . 3.850 2.905 2.754 2.954 . 0 0 "[ . 1 . 2]" 1 1420 1 91 LEU H 1 91 LEU HG . . 4.720 4.567 3.928 4.732 0.012 13 0 "[ . 1 . 2]" 1 1421 1 91 LEU H 1 92 ASN H . . 4.820 3.954 3.610 4.271 . 0 0 "[ . 1 . 2]" 1 1422 1 91 LEU H 1 113 ALA MB . . 5.940 4.713 4.217 4.829 . 0 0 "[ . 1 . 2]" 1 1423 1 91 LEU HA 1 91 LEU HG . . 4.140 2.609 2.192 3.468 . 0 0 "[ . 1 . 2]" 1 1424 1 91 LEU HA 1 92 ASN H . . 2.400 2.213 2.176 2.366 . 0 0 "[ . 1 . 2]" 1 1425 1 91 LEU HA 1 112 PHE QB . . 6.380 3.801 3.369 4.796 . 0 0 "[ . 1 . 2]" 1 1426 1 91 LEU HA 1 113 ALA H . . 4.850 3.831 3.318 4.676 . 0 0 "[ . 1 . 2]" 1 1427 1 91 LEU QB 1 92 ASN H . . 5.790 3.803 3.508 4.004 . 0 0 "[ . 1 . 2]" 1 1428 1 91 LEU QD 1 92 ASN H . . 5.020 3.383 2.029 3.879 . 0 0 "[ . 1 . 2]" 1 1429 1 91 LEU QD 1 112 PHE HA . . 6.200 2.574 2.156 3.152 . 0 0 "[ . 1 . 2]" 1 1430 1 91 LEU QD 1 112 PHE QB . . 7.390 2.150 1.721 3.456 . 0 0 "[ . 1 . 2]" 1 1431 1 91 LEU MD1 1 92 ASN H . . 5.320 4.052 2.032 4.423 . 0 0 "[ . 1 . 2]" 1 1432 1 91 LEU MD1 1 112 PHE HA . . 6.530 2.597 2.161 3.197 . 0 0 "[ . 1 . 2]" 1 1433 1 91 LEU MD1 1 112 PHE HB2 . . 9.670 2.714 2.007 4.231 . 0 0 "[ . 1 . 2]" 1 1434 1 91 LEU MD1 1 112 PHE HB3 . . 9.670 2.339 1.792 3.962 . 0 0 "[ . 1 . 2]" 1 1435 1 91 LEU MD2 1 92 ASN H . . 5.320 3.818 2.784 4.585 . 0 0 "[ . 1 . 2]" 1 1436 1 91 LEU MD2 1 112 PHE HA . . 6.530 4.407 3.889 4.933 . 0 0 "[ . 1 . 2]" 1 1437 1 91 LEU MD2 1 112 PHE HB2 . . 9.670 5.251 4.235 6.580 . 0 0 "[ . 1 . 2]" 1 1438 1 91 LEU MD2 1 112 PHE HB3 . . 9.670 4.520 3.358 6.540 . 0 0 "[ . 1 . 2]" 1 1439 1 91 LEU HG 1 92 ASN H . . 3.830 2.857 2.006 3.474 . 0 0 "[ . 1 . 2]" 1 1440 1 91 LEU HG 1 92 ASN HA . . 5.500 4.109 3.291 4.843 . 0 0 "[ . 1 . 2]" 1 1441 1 92 ASN H 1 92 ASN HB2 . . 3.730 2.697 2.329 2.924 . 0 0 "[ . 1 . 2]" 1 1442 1 92 ASN H 1 92 ASN QB . . 3.260 2.620 2.289 2.780 . 0 0 "[ . 1 . 2]" 1 1443 1 92 ASN H 1 92 ASN HB3 . . 3.730 3.586 3.230 3.847 0.117 11 0 "[ . 1 . 2]" 1 1444 1 92 ASN H 1 111 GLU H . . 3.980 3.333 2.648 3.773 . 0 0 "[ . 1 . 2]" 1 1445 1 92 ASN H 1 111 GLU QB . . 6.380 2.409 1.933 3.637 . 0 0 "[ . 1 . 2]" 1 1446 1 92 ASN H 1 112 PHE HA . . 4.170 3.490 3.041 4.156 . 0 0 "[ . 1 . 2]" 1 1447 1 92 ASN HA 1 92 ASN HB2 . . 2.990 2.976 2.867 3.065 0.075 11 0 "[ . 1 . 2]" 1 1448 1 92 ASN HA 1 92 ASN HB3 . . 2.990 2.771 2.533 2.925 . 0 0 "[ . 1 . 2]" 1 1449 1 92 ASN HA 1 92 ASN HD22 . . 5.500 3.888 3.378 4.568 . 0 0 "[ . 1 . 2]" 1 1450 1 92 ASN HA 1 93 ASN H . . 2.710 2.397 2.274 2.553 . 0 0 "[ . 1 . 2]" 1 1451 1 92 ASN HA 1 93 ASN QB . . 5.420 3.993 3.894 4.194 . 0 0 "[ . 1 . 2]" 1 1452 1 92 ASN QB 1 93 ASN H . . 4.010 2.936 2.422 3.225 . 0 0 "[ . 1 . 2]" 1 1453 1 92 ASN QB 1 111 GLU H . . 6.380 4.122 3.754 4.306 . 0 0 "[ . 1 . 2]" 1 1454 1 92 ASN QB 1 111 GLU QB . . 5.660 2.297 1.880 3.924 . 0 0 "[ . 1 . 2]" 1 1455 1 92 ASN QB 1 111 GLU QG . . 7.250 3.671 2.055 4.311 . 0 0 "[ . 1 . 2]" 1 1456 1 92 ASN HB2 1 93 ASN H . . 4.260 4.174 3.609 4.328 0.068 12 0 "[ . 1 . 2]" 1 1457 1 92 ASN HB2 1 111 GLU QB . . 6.380 2.399 1.960 4.018 . 0 0 "[ . 1 . 2]" 1 1458 1 92 ASN HB3 1 93 ASN H . . 4.260 3.001 2.461 3.327 . 0 0 "[ . 1 . 2]" 1 1459 1 92 ASN HB3 1 111 GLU QB . . 6.380 3.107 2.147 5.490 . 0 0 "[ . 1 . 2]" 1 1460 1 92 ASN HD21 1 111 GLU QB . . 6.380 4.350 3.481 5.280 . 0 0 "[ . 1 . 2]" 1 1461 1 92 ASN HD22 1 111 GLU QB . . 6.380 5.498 4.887 5.726 . 0 0 "[ . 1 . 2]" 1 1462 1 93 ASN H 1 94 GLY H . . 4.970 4.220 3.954 4.404 . 0 0 "[ . 1 . 2]" 1 1463 1 93 ASN HA 1 94 GLY H . . 2.520 2.337 2.252 2.495 . 0 0 "[ . 1 . 2]" 1 1464 1 93 ASN HA 1 94 GLY QA . . 5.670 3.979 3.959 4.021 . 0 0 "[ . 1 . 2]" 1 1465 1 93 ASN HA 1 110 ILE HA . . 3.170 2.910 2.498 3.202 0.032 10 0 "[ . 1 . 2]" 1 1466 1 93 ASN HA 1 110 ILE HB . . 5.500 4.830 4.000 5.319 . 0 0 "[ . 1 . 2]" 1 1467 1 93 ASN HA 1 111 GLU H . . 3.830 3.194 2.894 3.642 . 0 0 "[ . 1 . 2]" 1 1468 1 94 GLY H 1 95 TRP H . . 4.450 4.353 4.231 4.496 0.046 12 0 "[ . 1 . 2]" 1 1469 1 94 GLY H 1 109 VAL H . . 5.500 3.415 2.993 3.744 . 0 0 "[ . 1 . 2]" 1 1470 1 94 GLY H 1 109 VAL HB . . 5.500 4.557 3.036 5.490 . 0 0 "[ . 1 . 2]" 1 1471 1 94 GLY H 1 109 VAL QG . . 7.100 2.327 1.885 3.744 . 0 0 "[ . 1 . 2]" 1 1472 1 94 GLY QA 1 95 TRP H . . 2.810 2.227 2.181 2.297 . 0 0 "[ . 1 . 2]" 1 1473 1 94 GLY QA 1 95 TRP HD1 . . 6.380 4.347 2.838 5.700 . 0 0 "[ . 1 . 2]" 1 1474 1 94 GLY HA2 1 95 TRP H . . 3.020 2.295 2.220 2.430 . 0 0 "[ . 1 . 2]" 1 1475 1 94 GLY HA3 1 95 TRP H . . 3.020 3.034 2.830 3.187 0.167 17 0 "[ . 1 . 2]" 1 1476 1 95 TRP H 1 95 TRP HD1 . . 4.940 3.402 2.215 4.052 . 0 0 "[ . 1 . 2]" 1 1477 1 95 TRP H 1 96 ARG H . . 4.630 4.251 4.026 4.491 . 0 0 "[ . 1 . 2]" 1 1478 1 95 TRP HA 1 96 ARG H . . 2.400 2.271 2.207 2.515 0.115 8 0 "[ . 1 . 2]" 1 1479 1 95 TRP HA 1 107 GLU H . . 5.500 4.899 4.515 5.236 . 0 0 "[ . 1 . 2]" 1 1480 1 95 TRP HA 1 108 PHE HA . . 3.240 2.613 2.252 3.245 0.005 16 0 "[ . 1 . 2]" 1 1481 1 95 TRP QB 1 96 ARG H . . 4.050 3.295 2.397 3.733 . 0 0 "[ . 1 . 2]" 1 1482 1 95 TRP QB 1 97 PHE QE . . 8.500 3.479 1.972 5.996 . 0 0 "[ . 1 . 2]" 1 1483 1 95 TRP HE3 1 106 VAL MG1 . . 5.750 3.415 2.225 4.109 . 0 0 "[ . 1 . 2]" 1 1484 1 95 TRP HZ3 1 106 VAL MG1 . . 6.030 3.855 1.918 5.170 . 0 0 "[ . 1 . 2]" 1 1485 1 96 ARG H 1 96 ARG HB2 . . 3.890 2.583 2.300 2.777 . 0 0 "[ . 1 . 2]" 1 1486 1 96 ARG H 1 96 ARG QB . . 3.480 2.536 2.270 2.716 . 0 0 "[ . 1 . 2]" 1 1487 1 96 ARG H 1 96 ARG HB3 . . 3.890 3.707 3.503 3.839 . 0 0 "[ . 1 . 2]" 1 1488 1 96 ARG H 1 96 ARG HD2 . . 5.500 5.087 4.235 5.458 . 0 0 "[ . 1 . 2]" 1 1489 1 96 ARG H 1 96 ARG QD . . 5.260 4.572 2.518 4.857 . 0 0 "[ . 1 . 2]" 1 1490 1 96 ARG H 1 96 ARG HD3 . . 5.500 5.262 2.537 5.516 0.016 12 0 "[ . 1 . 2]" 1 1491 1 96 ARG H 1 96 ARG HG2 . . 4.450 3.431 3.065 4.439 . 0 0 "[ . 1 . 2]" 1 1492 1 96 ARG H 1 96 ARG QG . . 4.060 3.159 2.843 3.813 . 0 0 "[ . 1 . 2]" 1 1493 1 96 ARG H 1 96 ARG HG3 . . 4.450 3.755 3.289 4.451 0.001 2 0 "[ . 1 . 2]" 1 1494 1 96 ARG H 1 97 PHE H . . 5.000 4.459 4.374 4.571 . 0 0 "[ . 1 . 2]" 1 1495 1 96 ARG H 1 106 VAL HA . . 5.190 4.867 4.472 5.197 0.007 9 0 "[ . 1 . 2]" 1 1496 1 96 ARG H 1 106 VAL MG1 . . 6.530 3.553 3.120 4.029 . 0 0 "[ . 1 . 2]" 1 1497 1 96 ARG H 1 108 PHE HA . . 4.110 3.595 3.119 3.990 . 0 0 "[ . 1 . 2]" 1 1498 1 96 ARG HA 1 96 ARG HD2 . . 5.500 3.333 2.367 4.376 . 0 0 "[ . 1 . 2]" 1 1499 1 96 ARG HA 1 96 ARG QD . . 4.790 2.972 2.286 3.519 . 0 0 "[ . 1 . 2]" 1 1500 1 96 ARG HA 1 96 ARG HD3 . . 5.500 3.525 2.846 4.127 . 0 0 "[ . 1 . 2]" 1 1501 1 96 ARG HA 1 96 ARG HG2 . . 4.230 2.445 2.135 3.557 . 0 0 "[ . 1 . 2]" 1 1502 1 96 ARG HA 1 96 ARG HG3 . . 4.230 3.539 2.259 3.675 . 0 0 "[ . 1 . 2]" 1 1503 1 96 ARG HA 1 97 PHE H . . 2.430 2.374 2.310 2.468 0.038 7 0 "[ . 1 . 2]" 1 1504 1 96 ARG HA 1 107 GLU H . . 4.790 4.697 4.500 4.842 0.052 13 0 "[ . 1 . 2]" 1 1505 1 96 ARG QB 1 97 PHE H . . 3.670 2.787 2.527 2.964 . 0 0 "[ . 1 . 2]" 1 1506 1 96 ARG QB 1 97 PHE QB . . 7.250 4.812 4.367 4.992 . 0 0 "[ . 1 . 2]" 1 1507 1 96 ARG QB 1 107 GLU H . . 6.380 3.291 2.677 4.284 . 0 0 "[ . 1 . 2]" 1 1508 1 96 ARG HB2 1 97 PHE H . . 4.070 4.008 3.700 4.151 0.081 17 0 "[ . 1 . 2]" 1 1509 1 96 ARG HB3 1 97 PHE H . . 4.070 2.844 2.573 3.035 . 0 0 "[ . 1 . 2]" 1 1510 1 96 ARG QD 1 97 PHE H . . 5.290 3.674 2.861 4.676 . 0 0 "[ . 1 . 2]" 1 1511 1 96 ARG HD2 1 97 PHE H . . 5.500 3.938 2.899 5.541 0.041 16 0 "[ . 1 . 2]" 1 1512 1 96 ARG HD3 1 97 PHE H . . 5.500 4.731 3.151 5.407 . 0 0 "[ . 1 . 2]" 1 1513 1 96 ARG QG 1 97 PHE H . . 4.750 4.150 3.390 4.290 . 0 0 "[ . 1 . 2]" 1 1514 1 96 ARG HG2 1 97 PHE H . . 5.500 4.424 3.927 4.633 . 0 0 "[ . 1 . 2]" 1 1515 1 96 ARG HG3 1 97 PHE H . . 5.500 5.121 3.507 5.360 . 0 0 "[ . 1 . 2]" 1 1516 1 97 PHE H 1 98 MET H . . 4.820 4.150 3.774 4.613 . 0 0 "[ . 1 . 2]" 1 1517 1 97 PHE H 1 98 MET QG . . 6.380 4.608 3.923 5.433 . 0 0 "[ . 1 . 2]" 1 1518 1 97 PHE H 1 106 VAL MG2 . . 6.530 5.154 4.670 5.325 . 0 0 "[ . 1 . 2]" 1 1519 1 97 PHE HA 1 98 MET H . . 2.960 2.240 2.193 2.383 . 0 0 "[ . 1 . 2]" 1 1520 1 97 PHE HA 1 98 MET HA . . 4.760 4.374 4.340 4.460 . 0 0 "[ . 1 . 2]" 1 1521 1 97 PHE HA 1 104 THR MG . . 6.530 4.330 3.905 4.778 . 0 0 "[ . 1 . 2]" 1 1522 1 97 PHE HA 1 106 VAL HA . . 3.520 2.293 1.968 2.732 . 0 0 "[ . 1 . 2]" 1 1523 1 97 PHE HA 1 107 GLU H . . 4.200 3.380 3.013 3.798 . 0 0 "[ . 1 . 2]" 1 1524 1 97 PHE QB 1 104 THR MG . . 5.960 3.546 3.010 3.907 . 0 0 "[ . 1 . 2]" 1 1525 1 97 PHE HB2 1 104 THR MG . . 6.530 4.644 3.104 5.305 . 0 0 "[ . 1 . 2]" 1 1526 1 97 PHE HB3 1 104 THR MG . . 6.530 3.892 3.572 4.524 . 0 0 "[ . 1 . 2]" 1 1527 1 97 PHE QD 1 106 VAL MG1 . . 8.000 2.359 1.855 3.358 . 0 0 "[ . 1 . 2]" 1 1528 1 97 PHE QD 1 106 VAL MG2 . . 5.740 2.589 1.934 3.698 . 0 0 "[ . 1 . 2]" 1 1529 1 97 PHE QE 1 106 VAL MG1 . . 7.380 3.025 1.866 5.083 . 0 0 "[ . 1 . 2]" 1 1530 1 97 PHE QE 1 106 VAL MG2 . . 6.910 4.000 2.479 5.304 . 0 0 "[ . 1 . 2]" 1 1531 1 98 MET H 1 98 MET HB2 . . 3.420 2.630 2.328 2.885 . 0 0 "[ . 1 . 2]" 1 1532 1 98 MET H 1 98 MET HB3 . . 3.420 3.334 3.041 3.484 0.064 9 0 "[ . 1 . 2]" 1 1533 1 98 MET H 1 98 MET QG . . 4.580 3.920 3.601 4.092 . 0 0 "[ . 1 . 2]" 1 1534 1 98 MET H 1 104 THR MG . . 5.630 3.981 3.416 4.398 . 0 0 "[ . 1 . 2]" 1 1535 1 98 MET H 1 105 ARG H . . 3.580 3.456 3.095 3.652 0.072 10 0 "[ . 1 . 2]" 1 1536 1 98 MET H 1 105 ARG QB . . 5.670 3.632 2.995 4.894 . 0 0 "[ . 1 . 2]" 1 1537 1 98 MET H 1 105 ARG QG . . 6.380 4.631 2.866 5.682 . 0 0 "[ . 1 . 2]" 1 1538 1 98 MET H 1 106 VAL HA . . 3.920 3.338 2.966 3.932 0.012 17 0 "[ . 1 . 2]" 1 1539 1 98 MET H 1 106 VAL MG2 . . 5.570 3.737 3.253 4.089 . 0 0 "[ . 1 . 2]" 1 1540 1 98 MET HA 1 98 MET HB2 . . 2.990 2.894 2.796 2.964 . 0 0 "[ . 1 . 2]" 1 1541 1 98 MET HA 1 98 MET HB3 . . 2.990 2.908 2.832 2.990 . 0 0 "[ . 1 . 2]" 1 1542 1 98 MET QB 1 105 ARG H . . 5.280 4.199 3.564 4.556 . 0 0 "[ . 1 . 2]" 1 1543 1 98 MET HB2 1 105 ARG H . . 5.500 5.047 4.547 5.391 . 0 0 "[ . 1 . 2]" 1 1544 1 98 MET HB3 1 105 ARG H . . 5.500 4.503 3.724 4.914 . 0 0 "[ . 1 . 2]" 1 1545 1 99 PRO HA 1 100 GLU QB . . 5.910 4.245 4.050 4.542 . 0 0 "[ . 1 . 2]" 1 1546 1 99 PRO HA 1 100 GLU QG . . 6.380 3.610 3.130 3.996 . 0 0 "[ . 1 . 2]" 1 1547 1 99 PRO HA 1 105 ARG QB . . 6.380 4.498 3.823 5.415 . 0 0 "[ . 1 . 2]" 1 1548 1 99 PRO HB2 1 100 GLU QG . . 5.260 4.720 4.643 4.848 . 0 0 "[ . 1 . 2]" 1 1549 1 99 PRO HB3 1 100 GLU H . . 3.580 3.633 3.507 3.695 0.115 12 0 "[ . 1 . 2]" 1 1550 1 100 GLU H 1 101 GLY H . . 4.600 3.268 2.811 4.358 . 0 0 "[ . 1 . 2]" 1 1551 1 100 GLU H 1 103 ALA H . . 5.500 4.348 4.041 4.741 . 0 0 "[ . 1 . 2]" 1 1552 1 100 GLU H 1 104 THR H . . 4.760 4.807 4.761 4.912 0.152 6 0 "[ . 1 . 2]" 1 1553 1 100 GLU H 1 104 THR HA . . 3.800 2.551 2.425 2.943 . 0 0 "[ . 1 . 2]" 1 1554 1 100 GLU H 1 104 THR MG . . 6.530 5.113 4.992 5.333 . 0 0 "[ . 1 . 2]" 1 1555 1 100 GLU H 1 105 ARG H . . 4.760 3.881 3.607 4.430 . 0 0 "[ . 1 . 2]" 1 1556 1 100 GLU HA 1 101 GLY H . . 2.590 2.476 2.261 2.647 0.057 7 0 "[ . 1 . 2]" 1 1557 1 100 GLU HA 1 101 GLY HA2 . . 5.030 4.446 4.387 4.591 . 0 0 "[ . 1 . 2]" 1 1558 1 100 GLU HA 1 101 GLY HA3 . . 4.970 4.431 4.365 4.754 . 0 0 "[ . 1 . 2]" 1 1559 1 100 GLU QG 1 101 GLY H . . 6.380 4.317 4.010 4.496 . 0 0 "[ . 1 . 2]" 1 1560 1 101 GLY H 1 101 GLY HA2 . . 2.740 2.333 2.272 2.441 . 0 0 "[ . 1 . 2]" 1 1561 1 101 GLY H 1 101 GLY HA3 . . 2.900 2.903 2.669 2.960 0.060 6 0 "[ . 1 . 2]" 1 1562 1 101 GLY H 1 102 ASP H . . 5.500 4.538 4.413 4.597 . 0 0 "[ . 1 . 2]" 1 1563 1 101 GLY HA2 1 102 ASP H . . 3.140 3.187 3.070 3.283 0.143 2 0 "[ . 1 . 2]" 1 1564 1 101 GLY HA2 1 103 ALA H . . 4.660 4.575 4.493 4.673 0.013 17 0 "[ . 1 . 2]" 1 1565 1 101 GLY HA3 1 102 ASP H . . 2.770 2.222 2.200 2.270 . 0 0 "[ . 1 . 2]" 1 1566 1 101 GLY HA3 1 103 ALA H . . 3.520 3.349 3.294 3.446 . 0 0 "[ . 1 . 2]" 1 1567 1 102 ASP H 1 102 ASP HA . . 2.900 2.842 2.785 2.902 0.002 17 0 "[ . 1 . 2]" 1 1568 1 102 ASP H 1 102 ASP HB2 . . 3.700 3.573 3.530 3.662 . 0 0 "[ . 1 . 2]" 1 1569 1 102 ASP H 1 102 ASP HB3 . . 3.240 2.440 2.340 2.626 . 0 0 "[ . 1 . 2]" 1 1570 1 102 ASP H 1 103 ALA H . . 2.620 2.313 2.007 2.518 . 0 0 "[ . 1 . 2]" 1 1571 1 102 ASP H 1 103 ALA MB . . 6.220 4.024 3.888 4.214 . 0 0 "[ . 1 . 2]" 1 1572 1 102 ASP HA 1 102 ASP HB2 . . 2.710 2.386 2.367 2.418 . 0 0 "[ . 1 . 2]" 1 1573 1 102 ASP HA 1 102 ASP HB3 . . 2.560 2.572 2.533 2.599 0.039 10 0 "[ . 1 . 2]" 1 1574 1 102 ASP HB2 1 103 ALA H . . 4.260 4.217 4.063 4.302 0.042 10 0 "[ . 1 . 2]" 1 1575 1 102 ASP HB3 1 103 ALA H . . 3.950 3.966 3.908 3.991 0.041 15 0 "[ . 1 . 2]" 1 1576 1 103 ALA H 1 103 ALA HA . . 2.930 2.935 2.923 2.942 0.012 10 0 "[ . 1 . 2]" 1 1577 1 103 ALA H 1 103 ALA MB . . 3.430 2.337 2.120 2.525 . 0 0 "[ . 1 . 2]" 1 1578 1 103 ALA H 1 104 THR H . . 4.660 4.518 4.454 4.563 . 0 0 "[ . 1 . 2]" 1 1579 1 103 ALA HA 1 104 THR H . . 3.110 2.488 2.412 2.515 . 0 0 "[ . 1 . 2]" 1 1580 1 103 ALA HA 1 104 THR HA . . 5.070 4.407 4.350 4.457 . 0 0 "[ . 1 . 2]" 1 1581 1 103 ALA MB 1 104 THR H . . 3.430 2.519 2.372 2.674 . 0 0 "[ . 1 . 2]" 1 1582 1 103 ALA MB 1 104 THR HA . . 5.190 4.104 3.987 4.216 . 0 0 "[ . 1 . 2]" 1 1583 1 103 ALA MB 1 104 THR HB . . 6.000 4.535 4.408 4.650 . 0 0 "[ . 1 . 2]" 1 1584 1 104 THR H 1 104 THR HA . . 2.930 2.943 2.920 2.949 0.019 11 0 "[ . 1 . 2]" 1 1585 1 104 THR H 1 104 THR HB . . 2.650 2.454 2.248 2.625 . 0 0 "[ . 1 . 2]" 1 1586 1 104 THR H 1 104 THR MG . . 4.300 2.856 2.784 3.233 . 0 0 "[ . 1 . 2]" 1 1587 1 104 THR H 1 105 ARG H . . 4.850 4.521 4.450 4.600 . 0 0 "[ . 1 . 2]" 1 1588 1 104 THR H 1 105 ARG HA . . 4.970 4.875 4.722 5.097 0.127 7 0 "[ . 1 . 2]" 1 1589 1 104 THR HA 1 105 ARG H . . 2.430 2.280 2.270 2.287 . 0 0 "[ . 1 . 2]" 1 1590 1 104 THR HB 1 105 ARG H . . 4.350 4.352 4.337 4.374 0.024 6 0 "[ . 1 . 2]" 1 1591 1 104 THR MG 1 105 ARG H . . 3.800 2.908 2.634 3.005 . 0 0 "[ . 1 . 2]" 1 1592 1 104 THR MG 1 105 ARG HB2 . . 6.530 4.908 4.773 5.172 . 0 0 "[ . 1 . 2]" 1 1593 1 104 THR MG 1 105 ARG QB . . 5.990 4.326 4.199 4.408 . 0 0 "[ . 1 . 2]" 1 1594 1 104 THR MG 1 105 ARG HB3 . . 6.530 4.812 4.604 4.949 . 0 0 "[ . 1 . 2]" 1 1595 1 105 ARG H 1 105 ARG HB2 . . 3.420 2.850 2.554 3.725 0.305 10 0 "[ . 1 . 2]" 1 1596 1 105 ARG H 1 105 ARG QB . . 3.080 2.418 2.362 2.625 . 0 0 "[ . 1 . 2]" 1 1597 1 105 ARG H 1 105 ARG HB3 . . 3.420 2.653 2.471 2.886 . 0 0 "[ . 1 . 2]" 1 1598 1 105 ARG H 1 106 VAL H . . 4.940 4.453 4.343 4.499 . 0 0 "[ . 1 . 2]" 1 1599 1 105 ARG HA 1 106 VAL H . . 2.430 2.264 2.239 2.309 . 0 0 "[ . 1 . 2]" 1 1600 1 105 ARG HA 1 106 VAL HB . . 4.970 4.553 4.465 4.630 . 0 0 "[ . 1 . 2]" 1 1601 1 105 ARG HA 1 106 VAL MG2 . . 4.510 3.564 3.392 3.686 . 0 0 "[ . 1 . 2]" 1 1602 1 105 ARG HB2 1 106 VAL H . . 5.500 4.281 3.150 4.450 . 0 0 "[ . 1 . 2]" 1 1603 1 105 ARG HB3 1 106 VAL H . . 5.500 4.097 3.852 4.313 . 0 0 "[ . 1 . 2]" 1 1604 1 105 ARG QG 1 106 VAL H . . 6.380 2.627 2.303 4.046 . 0 0 "[ . 1 . 2]" 1 1605 1 106 VAL H 1 106 VAL HB . . 2.560 2.558 2.484 2.602 0.042 20 0 "[ . 1 . 2]" 1 1606 1 106 VAL H 1 106 VAL MG1 . . 4.730 3.811 3.762 3.836 . 0 0 "[ . 1 . 2]" 1 1607 1 106 VAL H 1 106 VAL MG2 . . 3.460 2.771 2.495 2.903 . 0 0 "[ . 1 . 2]" 1 1608 1 106 VAL H 1 107 GLU H . . 5.070 4.426 4.344 4.511 . 0 0 "[ . 1 . 2]" 1 1609 1 106 VAL HA 1 106 VAL MG1 . . 3.490 2.372 2.295 2.475 . 0 0 "[ . 1 . 2]" 1 1610 1 106 VAL HA 1 106 VAL MG2 . . 3.490 2.346 2.231 2.489 . 0 0 "[ . 1 . 2]" 1 1611 1 106 VAL HA 1 107 GLU H . . 2.400 2.238 2.190 2.268 . 0 0 "[ . 1 . 2]" 1 1612 1 106 VAL HB 1 107 GLU H . . 4.910 4.149 4.025 4.361 . 0 0 "[ . 1 . 2]" 1 1613 1 106 VAL MG1 1 107 GLU H . . 4.300 2.346 2.055 2.856 . 0 0 "[ . 1 . 2]" 1 1614 1 106 VAL MG1 1 107 GLU HA . . 5.570 3.741 3.542 3.908 . 0 0 "[ . 1 . 2]" 1 1615 1 106 VAL MG1 1 108 PHE H . . 6.340 4.255 3.958 4.507 . 0 0 "[ . 1 . 2]" 1 1616 1 106 VAL MG2 1 107 GLU H . . 5.380 4.039 3.981 4.084 . 0 0 "[ . 1 . 2]" 1 1617 1 106 VAL MG2 1 107 GLU QG . . 6.630 4.907 4.727 4.950 . 0 0 "[ . 1 . 2]" 1 1618 1 107 GLU H 1 107 GLU HB2 . . 3.140 2.781 2.727 2.907 . 0 0 "[ . 1 . 2]" 1 1619 1 107 GLU H 1 108 PHE H . . 4.940 4.343 4.270 4.423 . 0 0 "[ . 1 . 2]" 1 1620 1 107 GLU HA 1 108 PHE H . . 2.400 2.219 2.203 2.260 . 0 0 "[ . 1 . 2]" 1 1621 1 107 GLU HB2 1 108 PHE H . . 4.540 4.151 3.987 4.238 . 0 0 "[ . 1 . 2]" 1 1622 1 107 GLU HB3 1 108 PHE H . . 3.420 3.412 3.173 3.616 0.196 10 0 "[ . 1 . 2]" 1 1623 1 107 GLU HB3 1 109 VAL H . . 5.500 5.409 5.242 5.515 0.015 3 0 "[ . 1 . 2]" 1 1624 1 108 PHE H 1 108 PHE HB2 . . 3.240 2.673 2.079 3.094 . 0 0 "[ . 1 . 2]" 1 1625 1 108 PHE H 1 108 PHE QB . . 2.840 2.269 2.058 2.378 . 0 0 "[ . 1 . 2]" 1 1626 1 108 PHE H 1 108 PHE HB3 . . 3.240 2.733 2.319 3.390 0.150 11 0 "[ . 1 . 2]" 1 1627 1 108 PHE HA 1 109 VAL H . . 2.990 2.199 2.193 2.212 . 0 0 "[ . 1 . 2]" 1 1628 1 108 PHE QB 1 109 VAL QG . . 8.970 4.334 4.131 4.541 . 0 0 "[ . 1 . 2]" 1 1629 1 108 PHE HB2 1 135 ILE MD . . 6.530 4.650 3.608 5.320 . 0 0 "[ . 1 . 2]" 1 1630 1 108 PHE HB3 1 135 ILE MD . . 6.530 4.620 4.109 5.307 . 0 0 "[ . 1 . 2]" 1 1631 1 108 PHE QD 1 109 VAL QG . . 10.210 3.867 3.287 4.904 . 0 0 "[ . 1 . 2]" 1 1632 1 108 PHE QD 1 110 ILE HB . . 7.620 5.659 4.965 6.691 . 0 0 "[ . 1 . 2]" 1 1633 1 108 PHE QD 1 110 ILE MG . . 6.110 3.180 2.673 3.940 . 0 0 "[ . 1 . 2]" 1 1634 1 108 PHE QD 1 131 ALA MB . . 8.650 3.657 2.218 5.649 . 0 0 "[ . 1 . 2]" 1 1635 1 108 PHE QD 1 134 LEU QD . . 8.760 3.037 2.261 4.320 . 0 0 "[ . 1 . 2]" 1 1636 1 109 VAL H 1 109 VAL HB . . 3.610 3.563 2.589 3.684 0.074 8 0 "[ . 1 . 2]" 1 1637 1 109 VAL HA 1 110 ILE H . . 2.400 2.198 2.182 2.282 . 0 0 "[ . 1 . 2]" 1 1638 1 109 VAL HB 1 110 ILE H . . 3.890 3.519 3.064 3.964 0.074 2 0 "[ . 1 . 2]" 1 1639 1 109 VAL QG 1 110 ILE H . . 5.790 3.507 2.158 3.702 . 0 0 "[ . 1 . 2]" 1 1640 1 110 ILE H 1 110 ILE MD . . 4.950 3.251 1.899 3.988 . 0 0 "[ . 1 . 2]" 1 1641 1 110 ILE H 1 110 ILE HG12 . . 4.170 3.723 3.506 4.016 . 0 0 "[ . 1 . 2]" 1 1642 1 110 ILE H 1 110 ILE QG . . 3.890 2.642 2.096 3.631 . 0 0 "[ . 1 . 2]" 1 1643 1 110 ILE H 1 110 ILE HG13 . . 4.170 2.818 2.112 4.271 0.101 2 0 "[ . 1 . 2]" 1 1644 1 110 ILE H 1 110 ILE MG . . 4.330 2.401 1.968 2.780 . 0 0 "[ . 1 . 2]" 1 1645 1 110 ILE H 1 111 GLU H . . 5.030 4.376 4.265 4.511 . 0 0 "[ . 1 . 2]" 1 1646 1 110 ILE HA 1 110 ILE HB . . 2.830 2.295 2.213 2.374 . 0 0 "[ . 1 . 2]" 1 1647 1 110 ILE HA 1 111 GLU H . . 2.560 2.201 2.176 2.243 . 0 0 "[ . 1 . 2]" 1 1648 1 110 ILE HA 1 111 GLU QB . . 5.660 4.213 3.951 4.526 . 0 0 "[ . 1 . 2]" 1 1649 1 110 ILE HB 1 111 GLU H . . 4.010 3.425 3.241 3.645 . 0 0 "[ . 1 . 2]" 1 1650 1 110 ILE MD 1 111 GLU H . . 5.290 3.484 2.720 4.143 . 0 0 "[ . 1 . 2]" 1 1651 1 110 ILE MD 1 111 GLU HA . . 6.530 3.069 2.624 3.601 . 0 0 "[ . 1 . 2]" 1 1652 1 110 ILE MD 1 111 GLU QB . . 7.160 4.572 4.088 5.056 . 0 0 "[ . 1 . 2]" 1 1653 1 110 ILE MD 1 111 GLU HG2 . . 6.190 4.525 4.105 4.894 . 0 0 "[ . 1 . 2]" 1 1654 1 110 ILE MD 1 111 GLU QG . . 5.810 4.019 3.819 4.229 . 0 0 "[ . 1 . 2]" 1 1655 1 110 ILE MD 1 111 GLU HG3 . . 6.190 4.561 4.028 4.972 . 0 0 "[ . 1 . 2]" 1 1656 1 110 ILE MD 1 112 PHE QD . . 8.650 2.691 1.813 3.802 . 0 0 "[ . 1 . 2]" 1 1657 1 110 ILE MD 1 112 PHE QE . . 8.650 2.125 1.761 3.439 . 0 0 "[ . 1 . 2]" 1 1658 1 110 ILE QG 1 111 GLU H . . 5.230 4.074 3.107 4.525 . 0 0 "[ . 1 . 2]" 1 1659 1 110 ILE QG 1 112 PHE QD . . 8.500 3.901 2.077 4.807 . 0 0 "[ . 1 . 2]" 1 1660 1 110 ILE HG12 1 111 GLU H . . 5.500 4.868 3.158 5.559 0.059 8 0 "[ . 1 . 2]" 1 1661 1 110 ILE HG13 1 111 GLU H . . 5.500 4.633 4.198 4.804 . 0 0 "[ . 1 . 2]" 1 1662 1 110 ILE MG 1 111 GLU H . . 6.470 4.286 4.172 4.388 . 0 0 "[ . 1 . 2]" 1 1663 1 110 ILE MG 1 112 PHE QE . . 8.400 4.363 3.347 5.384 . 0 0 "[ . 1 . 2]" 1 1664 1 111 GLU H 1 111 GLU HG2 . . 4.720 4.197 2.104 4.630 . 0 0 "[ . 1 . 2]" 1 1665 1 111 GLU H 1 111 GLU QG . . 4.380 3.344 2.055 3.969 . 0 0 "[ . 1 . 2]" 1 1666 1 111 GLU H 1 111 GLU HG3 . . 4.720 3.577 2.850 4.391 . 0 0 "[ . 1 . 2]" 1 1667 1 111 GLU HA 1 111 GLU HG2 . . 4.260 2.412 2.010 3.589 . 0 0 "[ . 1 . 2]" 1 1668 1 111 GLU HA 1 111 GLU HG3 . . 4.260 2.924 2.519 3.854 . 0 0 "[ . 1 . 2]" 1 1669 1 111 GLU HA 1 112 PHE H . . 2.520 2.238 2.202 2.343 . 0 0 "[ . 1 . 2]" 1 1670 1 111 GLU QB 1 112 PHE H . . 4.300 3.303 2.843 3.708 . 0 0 "[ . 1 . 2]" 1 1671 1 111 GLU QG 1 112 PHE H . . 4.800 3.803 3.184 4.339 . 0 0 "[ . 1 . 2]" 1 1672 1 111 GLU HG2 1 112 PHE H . . 5.500 4.016 3.268 5.142 . 0 0 "[ . 1 . 2]" 1 1673 1 111 GLU HG3 1 112 PHE H . . 5.500 4.885 4.373 5.240 . 0 0 "[ . 1 . 2]" 1 1674 1 112 PHE H 1 113 ALA H . . 4.940 4.385 4.318 4.447 . 0 0 "[ . 1 . 2]" 1 1675 1 112 PHE HA 1 112 PHE HB2 . . 2.990 2.694 2.527 3.033 0.043 8 0 "[ . 1 . 2]" 1 1676 1 112 PHE HA 1 112 PHE QB . . 2.760 2.281 2.233 2.587 . 0 0 "[ . 1 . 2]" 1 1677 1 112 PHE HA 1 112 PHE HB3 . . 2.990 2.478 2.379 2.839 . 0 0 "[ . 1 . 2]" 1 1678 1 112 PHE HA 1 113 ALA H . . 2.560 2.441 2.372 2.574 0.014 16 0 "[ . 1 . 2]" 1 1679 1 112 PHE HA 1 113 ALA MB . . 4.950 3.835 3.759 3.923 . 0 0 "[ . 1 . 2]" 1 1680 1 112 PHE QB 1 113 ALA H . . 3.170 2.602 2.313 2.806 . 0 0 "[ . 1 . 2]" 1 1681 1 112 PHE QB 1 113 ALA MB . . 6.910 4.329 4.236 4.395 . 0 0 "[ . 1 . 2]" 1 1682 1 112 PHE HB2 1 113 ALA H . . 3.830 2.879 2.335 3.947 0.117 15 0 "[ . 1 . 2]" 1 1683 1 112 PHE HB3 1 113 ALA H . . 3.830 3.555 2.537 3.921 0.091 13 0 "[ . 1 . 2]" 1 1684 1 112 PHE QD 1 113 ALA HA . . 6.690 3.878 2.826 5.905 . 0 0 "[ . 1 . 2]" 1 1685 1 112 PHE QD 1 113 ALA MB . . 8.150 4.670 4.087 5.705 . 0 0 "[ . 1 . 2]" 1 1686 1 112 PHE QD 1 124 ALA HA . . 7.620 5.469 4.772 6.044 . 0 0 "[ . 1 . 2]" 1 1687 1 112 PHE QD 1 127 VAL MG2 . . 8.650 3.918 3.000 4.540 . 0 0 "[ . 1 . 2]" 1 1688 1 112 PHE QE 1 124 ALA HA . . 7.620 4.111 3.270 6.532 . 0 0 "[ . 1 . 2]" 1 1689 1 112 PHE QE 1 124 ALA MB . . 8.650 3.376 2.076 6.491 . 0 0 "[ . 1 . 2]" 1 1690 1 112 PHE QE 1 127 VAL MG1 . . 8.650 3.982 3.074 5.796 . 0 0 "[ . 1 . 2]" 1 1691 1 112 PHE QE 1 127 VAL MG2 . . 7.970 2.413 1.944 3.655 . 0 0 "[ . 1 . 2]" 1 1692 1 113 ALA H 1 114 PHE H . . 4.720 4.316 4.147 4.515 . 0 0 "[ . 1 . 2]" 1 1693 1 113 ALA H 1 114 PHE QB . . 6.380 5.512 5.088 5.649 . 0 0 "[ . 1 . 2]" 1 1694 1 113 ALA HA 1 114 PHE H . . 2.620 2.194 2.187 2.238 . 0 0 "[ . 1 . 2]" 1 1695 1 113 ALA MB 1 114 PHE H . . 3.950 3.262 3.022 3.345 . 0 0 "[ . 1 . 2]" 1 1696 1 114 PHE H 1 114 PHE HB2 . . 4.040 2.108 2.030 2.411 . 0 0 "[ . 1 . 2]" 1 1697 1 114 PHE H 1 114 PHE QB . . 3.770 2.086 2.012 2.377 . 0 0 "[ . 1 . 2]" 1 1698 1 114 PHE H 1 114 PHE HB3 . . 4.040 3.343 3.248 3.605 . 0 0 "[ . 1 . 2]" 1 1699 1 114 PHE HA 1 115 LYS H . . 2.680 2.521 2.408 2.584 . 0 0 "[ . 1 . 2]" 1 1700 1 114 PHE HA 1 115 LYS HB2 . . 4.970 4.909 4.619 5.025 0.055 11 0 "[ . 1 . 2]" 1 1701 1 114 PHE HA 1 115 LYS HD2 . . 3.980 3.704 2.858 4.008 0.028 9 0 "[ . 1 . 2]" 1 1702 1 114 PHE HA 1 115 LYS QD . . 3.770 3.175 2.804 3.405 . 0 0 "[ . 1 . 2]" 1 1703 1 114 PHE HA 1 115 LYS HD3 . . 3.980 3.605 3.065 4.063 0.083 19 0 "[ . 1 . 2]" 1 1704 1 114 PHE QB 1 116 SER H . . 5.050 3.043 2.774 3.312 . 0 0 "[ . 1 . 2]" 1 1705 1 114 PHE QB 1 120 ASP HB2 . . 6.380 3.156 2.928 3.395 . 0 0 "[ . 1 . 2]" 1 1706 1 114 PHE HB2 1 115 LYS H . . 4.070 3.923 3.783 4.079 0.009 20 0 "[ . 1 . 2]" 1 1707 1 114 PHE HB3 1 115 LYS H . . 4.070 2.539 2.343 2.754 . 0 0 "[ . 1 . 2]" 1 1708 1 114 PHE QD 1 115 LYS H . . 7.620 2.638 2.175 3.344 . 0 0 "[ . 1 . 2]" 1 1709 1 114 PHE QD 1 119 LEU MD1 . . 8.650 4.623 4.173 5.256 . 0 0 "[ . 1 . 2]" 1 1710 1 114 PHE QD 1 119 LEU MD2 . . 8.650 5.938 5.716 6.225 . 0 0 "[ . 1 . 2]" 1 1711 1 114 PHE QD 1 120 ASP HA . . 6.600 2.247 2.008 2.891 . 0 0 "[ . 1 . 2]" 1 1712 1 114 PHE QE 1 119 LEU MD1 . . 8.650 4.801 4.254 5.170 . 0 0 "[ . 1 . 2]" 1 1713 1 114 PHE QE 1 119 LEU MD2 . . 7.780 5.768 5.491 5.878 . 0 0 "[ . 1 . 2]" 1 1714 1 114 PHE QE 1 123 LEU QB . . 8.500 2.342 1.848 2.794 . 0 0 "[ . 1 . 2]" 1 1715 1 114 PHE QE 1 123 LEU MD1 . . 6.360 2.199 1.945 2.519 . 0 0 "[ . 1 . 2]" 1 1716 1 114 PHE QE 1 123 LEU MD2 . . 8.150 3.500 3.147 3.984 . 0 0 "[ . 1 . 2]" 1 1717 1 114 PHE QE 1 123 LEU HG . . 7.620 4.539 4.341 4.871 . 0 0 "[ . 1 . 2]" 1 1718 1 114 PHE QE 1 124 ALA HA . . 6.130 4.187 4.058 4.431 . 0 0 "[ . 1 . 2]" 1 1719 1 114 PHE QE 1 124 ALA MB . . 7.350 3.666 3.518 3.885 . 0 0 "[ . 1 . 2]" 1 1720 1 115 LYS H 1 115 LYS HB2 . . 3.240 2.520 2.338 2.639 . 0 0 "[ . 1 . 2]" 1 1721 1 115 LYS H 1 115 LYS HB3 . . 3.830 3.611 3.569 3.664 . 0 0 "[ . 1 . 2]" 1 1722 1 115 LYS H 1 115 LYS QD . . 4.740 1.960 1.888 2.140 . 0 0 "[ . 1 . 2]" 1 1723 1 115 LYS H 1 115 LYS QE . . 6.070 3.585 2.713 4.039 . 0 0 "[ . 1 . 2]" 1 1724 1 115 LYS H 1 115 LYS HG2 . . 3.890 3.924 3.829 4.017 0.127 13 0 "[ . 1 . 2]" 1 1725 1 115 LYS H 1 115 LYS HG3 . . 4.410 2.971 2.635 3.871 . 0 0 "[ . 1 . 2]" 1 1726 1 115 LYS H 1 116 SER H . . 3.330 2.372 2.266 2.478 . 0 0 "[ . 1 . 2]" 1 1727 1 115 LYS HA 1 115 LYS HB3 . . 2.620 2.435 2.376 2.551 . 0 0 "[ . 1 . 2]" 1 1728 1 115 LYS HA 1 115 LYS HG2 . . 3.550 3.437 3.360 3.623 0.073 13 0 "[ . 1 . 2]" 1 1729 1 115 LYS HA 1 115 LYS HG3 . . 2.650 2.433 2.372 2.529 . 0 0 "[ . 1 . 2]" 1 1730 1 115 LYS HB2 1 115 LYS QD . . 3.280 2.306 2.154 2.535 . 0 0 "[ . 1 . 2]" 1 1731 1 115 LYS HB2 1 116 SER H . . 4.230 2.520 2.441 2.772 . 0 0 "[ . 1 . 2]" 1 1732 1 115 LYS HB3 1 116 SER H . . 5.100 3.672 3.401 3.899 . 0 0 "[ . 1 . 2]" 1 1733 1 115 LYS QD 1 116 SER H . . 6.040 3.504 3.220 3.823 . 0 0 "[ . 1 . 2]" 1 1734 1 115 LYS QE 1 116 SER H . . 5.050 4.328 3.759 4.579 . 0 0 "[ . 1 . 2]" 1 1735 1 116 SER H 1 116 SER HA . . 2.830 2.860 2.830 2.893 0.063 3 0 "[ . 1 . 2]" 1 1736 1 116 SER H 1 116 SER HB2 . . 3.580 2.331 2.122 3.175 . 0 0 "[ . 1 . 2]" 1 1737 1 116 SER H 1 116 SER HB3 . . 3.580 3.256 2.088 3.585 0.005 11 0 "[ . 1 . 2]" 1 1738 1 116 SER HA 1 117 ALA MB . . 6.530 3.942 3.898 3.992 . 0 0 "[ . 1 . 2]" 1 1739 1 116 SER HA 1 119 LEU H . . 4.320 4.337 4.314 4.367 0.047 18 0 "[ . 1 . 2]" 1 1740 1 116 SER QB 1 117 ALA H . . 4.150 3.477 3.290 3.712 . 0 0 "[ . 1 . 2]" 1 1741 1 116 SER QB 1 119 LEU H . . 4.440 2.140 1.914 3.013 . 0 0 "[ . 1 . 2]" 1 1742 1 116 SER QB 1 119 LEU HA . . 6.380 4.261 4.082 4.796 . 0 0 "[ . 1 . 2]" 1 1743 1 116 SER QB 1 119 LEU HB2 . . 6.380 2.050 1.871 2.446 . 0 0 "[ . 1 . 2]" 1 1744 1 116 SER QB 1 119 LEU HG . . 6.380 2.589 2.246 3.122 . 0 0 "[ . 1 . 2]" 1 1745 1 116 SER HB2 1 117 ALA H . . 4.690 4.418 3.916 4.614 . 0 0 "[ . 1 . 2]" 1 1746 1 116 SER HB2 1 119 LEU H . . 4.660 3.089 2.473 3.761 . 0 0 "[ . 1 . 2]" 1 1747 1 116 SER HB2 1 119 LEU MD1 . . 6.530 2.692 2.075 3.718 . 0 0 "[ . 1 . 2]" 1 1748 1 116 SER HB3 1 117 ALA H . . 4.690 3.706 3.400 4.532 . 0 0 "[ . 1 . 2]" 1 1749 1 116 SER HB3 1 119 LEU H . . 4.660 2.205 1.927 3.196 . 0 0 "[ . 1 . 2]" 1 1750 1 116 SER HB3 1 119 LEU MD1 . . 6.530 3.300 2.587 3.792 . 0 0 "[ . 1 . 2]" 1 1751 1 117 ALA HA 1 118 LEU H . . 3.520 3.560 3.513 3.602 0.082 13 0 "[ . 1 . 2]" 1 1752 1 117 ALA HA 1 118 LEU HA . . 5.500 4.753 4.724 4.772 . 0 0 "[ . 1 . 2]" 1 1753 1 117 ALA HA 1 120 ASP H . . 3.860 3.289 3.203 3.416 . 0 0 "[ . 1 . 2]" 1 1754 1 117 ALA HA 1 120 ASP HB2 . . 3.140 2.041 1.988 2.143 . 0 0 "[ . 1 . 2]" 1 1755 1 117 ALA HA 1 120 ASP HB3 . . 3.210 3.232 3.167 3.260 0.050 8 0 "[ . 1 . 2]" 1 1756 1 117 ALA HA 1 121 ALA H . . 4.790 4.451 4.375 4.537 . 0 0 "[ . 1 . 2]" 1 1757 1 117 ALA MB 1 118 LEU H . . 4.140 2.844 2.644 3.002 . 0 0 "[ . 1 . 2]" 1 1758 1 117 ALA MB 1 118 LEU HA . . 4.950 3.848 3.763 3.925 . 0 0 "[ . 1 . 2]" 1 1759 1 117 ALA MB 1 118 LEU QD . . 9.130 2.860 2.644 3.012 . 0 0 "[ . 1 . 2]" 1 1760 1 117 ALA MB 1 120 ASP HB2 . . 6.530 3.706 3.643 3.812 . 0 0 "[ . 1 . 2]" 1 1761 1 117 ALA MB 1 120 ASP HB3 . . 5.660 4.300 4.172 4.377 . 0 0 "[ . 1 . 2]" 1 1762 1 118 LEU H 1 118 LEU HB2 . . 3.360 2.034 2.008 2.057 . 0 0 "[ . 1 . 2]" 1 1763 1 118 LEU H 1 118 LEU QB . . 3.130 2.016 1.991 2.039 . 0 0 "[ . 1 . 2]" 1 1764 1 118 LEU H 1 118 LEU HB3 . . 3.360 3.321 3.275 3.369 0.009 13 0 "[ . 1 . 2]" 1 1765 1 118 LEU H 1 118 LEU HG . . 4.140 4.116 4.030 4.147 0.007 19 0 "[ . 1 . 2]" 1 1766 1 118 LEU H 1 119 LEU H . . 2.650 2.645 2.579 2.704 0.054 13 0 "[ . 1 . 2]" 1 1767 1 118 LEU HA 1 118 LEU HB2 . . 3.020 2.923 2.898 2.944 . 0 0 "[ . 1 . 2]" 1 1768 1 118 LEU HA 1 118 LEU HB3 . . 3.020 2.761 2.728 2.795 . 0 0 "[ . 1 . 2]" 1 1769 1 118 LEU HA 1 118 LEU MD1 . . 3.770 2.112 2.003 2.341 . 0 0 "[ . 1 . 2]" 1 1770 1 118 LEU HA 1 118 LEU QD . . 3.340 1.958 1.871 2.068 . 0 0 "[ . 1 . 2]" 1 1771 1 118 LEU HA 1 118 LEU MD2 . . 3.770 2.332 2.166 2.506 . 0 0 "[ . 1 . 2]" 1 1772 1 118 LEU HA 1 118 LEU HG . . 3.730 3.622 3.615 3.636 . 0 0 "[ . 1 . 2]" 1 1773 1 118 LEU HA 1 119 LEU MD2 . . 6.530 5.234 5.095 5.307 . 0 0 "[ . 1 . 2]" 1 1774 1 118 LEU HA 1 120 ASP H . . 4.010 4.002 3.925 4.056 0.046 8 0 "[ . 1 . 2]" 1 1775 1 118 LEU HA 1 121 ALA H . . 3.760 3.630 3.535 3.683 . 0 0 "[ . 1 . 2]" 1 1776 1 118 LEU HA 1 121 ALA MB . . 4.540 3.510 3.362 3.647 . 0 0 "[ . 1 . 2]" 1 1777 1 118 LEU HA 1 122 MET H . . 4.570 4.174 4.062 4.342 . 0 0 "[ . 1 . 2]" 1 1778 1 118 LEU QB 1 118 LEU HG . . 2.590 2.166 2.164 2.166 . 0 0 "[ . 1 . 2]" 1 1779 1 118 LEU QB 1 120 ASP H . . 6.130 4.341 4.258 4.398 . 0 0 "[ . 1 . 2]" 1 1780 1 118 LEU HB2 1 119 LEU H . . 3.580 2.901 2.804 3.033 . 0 0 "[ . 1 . 2]" 1 1781 1 118 LEU HB2 1 119 LEU HG . . 5.500 4.094 3.739 4.389 . 0 0 "[ . 1 . 2]" 1 1782 1 118 LEU HB3 1 119 LEU H . . 3.580 3.001 2.836 3.119 . 0 0 "[ . 1 . 2]" 1 1783 1 118 LEU HB3 1 119 LEU HG . . 5.500 3.809 3.514 3.981 . 0 0 "[ . 1 . 2]" 1 1784 1 118 LEU QD 1 119 LEU H . . 8.100 3.966 3.918 4.010 . 0 0 "[ . 1 . 2]" 1 1785 1 118 LEU QD 1 119 LEU MD2 . . 9.130 4.406 4.257 4.520 . 0 0 "[ . 1 . 2]" 1 1786 1 118 LEU HG 1 119 LEU H . . 5.500 5.076 4.946 5.175 . 0 0 "[ . 1 . 2]" 1 1787 1 119 LEU H 1 119 LEU HA . . 2.800 2.811 2.786 2.831 0.031 5 0 "[ . 1 . 2]" 1 1788 1 119 LEU H 1 119 LEU HB2 . . 2.770 2.314 2.199 2.521 . 0 0 "[ . 1 . 2]" 1 1789 1 119 LEU H 1 119 LEU HB3 . . 3.670 3.511 3.479 3.546 . 0 0 "[ . 1 . 2]" 1 1790 1 119 LEU H 1 119 LEU MD1 . . 5.070 3.762 3.428 3.933 . 0 0 "[ . 1 . 2]" 1 1791 1 119 LEU H 1 119 LEU MD2 . . 5.160 3.327 3.218 3.453 . 0 0 "[ . 1 . 2]" 1 1792 1 119 LEU H 1 119 LEU HG . . 3.360 2.482 2.066 2.771 . 0 0 "[ . 1 . 2]" 1 1793 1 119 LEU H 1 120 ASP H . . 2.960 2.564 2.504 2.637 . 0 0 "[ . 1 . 2]" 1 1794 1 119 LEU HA 1 119 LEU HB3 . . 2.990 2.538 2.419 2.604 . 0 0 "[ . 1 . 2]" 1 1795 1 119 LEU HA 1 119 LEU MD2 . . 3.430 1.959 1.896 2.089 . 0 0 "[ . 1 . 2]" 1 1796 1 119 LEU HA 1 119 LEU HG . . 3.450 3.092 3.065 3.146 . 0 0 "[ . 1 . 2]" 1 1797 1 119 LEU HA 1 120 ASP H . . 3.610 3.516 3.503 3.538 . 0 0 "[ . 1 . 2]" 1 1798 1 119 LEU HA 1 120 ASP HB2 . . 5.500 5.494 5.464 5.528 0.028 8 0 "[ . 1 . 2]" 1 1799 1 119 LEU HA 1 122 MET H . . 3.330 3.035 2.998 3.092 . 0 0 "[ . 1 . 2]" 1 1800 1 119 LEU HA 1 122 MET HB2 . . 3.490 2.004 1.965 2.064 . 0 0 "[ . 1 . 2]" 1 1801 1 119 LEU HA 1 122 MET QB . . 3.240 1.912 1.857 1.965 . 0 0 "[ . 1 . 2]" 1 1802 1 119 LEU HA 1 122 MET HB3 . . 3.490 2.425 2.251 2.623 . 0 0 "[ . 1 . 2]" 1 1803 1 119 LEU HA 1 122 MET QG . . 6.380 3.714 3.596 3.879 . 0 0 "[ . 1 . 2]" 1 1804 1 119 LEU HB2 1 120 ASP H . . 3.490 3.145 3.065 3.209 . 0 0 "[ . 1 . 2]" 1 1805 1 119 LEU HB3 1 120 ASP H . . 5.500 3.960 3.841 4.126 . 0 0 "[ . 1 . 2]" 1 1806 1 119 LEU HG 1 120 ASP H . . 5.500 4.691 4.342 4.881 . 0 0 "[ . 1 . 2]" 1 1807 1 120 ASP H 1 120 ASP HB2 . . 2.680 2.023 2.009 2.040 . 0 0 "[ . 1 . 2]" 1 1808 1 120 ASP H 1 120 ASP HB3 . . 3.170 3.069 3.015 3.125 . 0 0 "[ . 1 . 2]" 1 1809 1 120 ASP HA 1 120 ASP HB3 . . 3.020 2.972 2.951 2.993 . 0 0 "[ . 1 . 2]" 1 1810 1 120 ASP HA 1 123 LEU H . . 4.140 3.888 3.774 3.986 . 0 0 "[ . 1 . 2]" 1 1811 1 120 ASP HA 1 124 ALA H . . 5.500 3.814 3.616 4.078 . 0 0 "[ . 1 . 2]" 1 1812 1 120 ASP HB2 1 121 ALA H . . 3.110 3.163 3.100 3.226 0.116 8 0 "[ . 1 . 2]" 1 1813 1 120 ASP HB2 1 121 ALA MB . . 6.530 4.492 4.379 4.566 . 0 0 "[ . 1 . 2]" 1 1814 1 120 ASP HB3 1 121 ALA H . . 2.960 2.466 2.382 2.569 . 0 0 "[ . 1 . 2]" 1 1815 1 120 ASP HB3 1 121 ALA MB . . 5.260 3.491 3.372 3.590 . 0 0 "[ . 1 . 2]" 1 1816 1 121 ALA H 1 121 ALA HA . . 2.900 2.858 2.843 2.869 . 0 0 "[ . 1 . 2]" 1 1817 1 121 ALA H 1 121 ALA MB . . 3.430 2.075 1.973 2.198 . 0 0 "[ . 1 . 2]" 1 1818 1 121 ALA H 1 122 MET H . . 3.020 2.427 2.369 2.494 . 0 0 "[ . 1 . 2]" 1 1819 1 121 ALA H 1 124 ALA MB . . 6.530 4.272 4.124 4.478 . 0 0 "[ . 1 . 2]" 1 1820 1 121 ALA HA 1 124 ALA H . . 3.950 3.434 3.244 3.618 . 0 0 "[ . 1 . 2]" 1 1821 1 121 ALA HA 1 124 ALA MB . . 3.920 2.230 2.031 2.401 . 0 0 "[ . 1 . 2]" 1 1822 1 121 ALA MB 1 122 MET H . . 4.170 2.750 2.616 2.889 . 0 0 "[ . 1 . 2]" 1 1823 1 121 ALA MB 1 122 MET HA . . 5.500 3.783 3.685 3.843 . 0 0 "[ . 1 . 2]" 1 1824 1 121 ALA MB 1 122 MET QB . . 6.350 4.014 3.938 4.099 . 0 0 "[ . 1 . 2]" 1 1825 1 121 ALA MB 1 122 MET HG2 . . 6.530 5.105 4.783 5.355 . 0 0 "[ . 1 . 2]" 1 1826 1 121 ALA MB 1 122 MET QG . . 6.390 4.522 4.372 4.655 . 0 0 "[ . 1 . 2]" 1 1827 1 121 ALA MB 1 122 MET HG3 . . 6.530 5.077 4.754 5.328 . 0 0 "[ . 1 . 2]" 1 1828 1 121 ALA MB 1 123 LEU H . . 6.530 4.735 4.604 4.818 . 0 0 "[ . 1 . 2]" 1 1829 1 121 ALA MB 1 124 ALA H . . 6.530 4.669 4.517 4.825 . 0 0 "[ . 1 . 2]" 1 1830 1 121 ALA MB 1 124 ALA MB . . 7.340 3.737 3.534 3.876 . 0 0 "[ . 1 . 2]" 1 1831 1 122 MET H 1 122 MET HB2 . . 3.240 1.984 1.970 2.001 . 0 0 "[ . 1 . 2]" 1 1832 1 122 MET H 1 122 MET QB . . 3.020 1.961 1.951 1.974 . 0 0 "[ . 1 . 2]" 1 1833 1 122 MET H 1 122 MET HB3 . . 3.240 3.075 3.016 3.143 . 0 0 "[ . 1 . 2]" 1 1834 1 122 MET H 1 122 MET HG2 . . 4.630 4.003 3.805 4.152 . 0 0 "[ . 1 . 2]" 1 1835 1 122 MET H 1 122 MET QG . . 4.230 3.485 3.397 3.559 . 0 0 "[ . 1 . 2]" 1 1836 1 122 MET H 1 122 MET HG3 . . 4.630 3.848 3.609 3.981 . 0 0 "[ . 1 . 2]" 1 1837 1 122 MET H 1 123 LEU H . . 2.770 2.783 2.743 2.853 0.083 8 0 "[ . 1 . 2]" 1 1838 1 122 MET H 1 123 LEU HG . . 5.500 5.486 5.382 5.582 0.082 4 0 "[ . 1 . 2]" 1 1839 1 122 MET H 1 124 ALA H . . 4.940 4.100 3.933 4.315 . 0 0 "[ . 1 . 2]" 1 1840 1 122 MET HA 1 122 MET HB2 . . 2.960 2.825 2.799 2.860 . 0 0 "[ . 1 . 2]" 1 1841 1 122 MET HA 1 122 MET HB3 . . 2.960 2.970 2.943 2.988 0.028 4 0 "[ . 1 . 2]" 1 1842 1 122 MET HA 1 122 MET HG2 . . 3.890 2.080 2.021 2.228 . 0 0 "[ . 1 . 2]" 1 1843 1 122 MET HA 1 122 MET QG . . 3.620 2.046 1.999 2.141 . 0 0 "[ . 1 . 2]" 1 1844 1 122 MET HA 1 122 MET HG3 . . 3.890 3.109 2.772 3.366 . 0 0 "[ . 1 . 2]" 1 1845 1 122 MET HA 1 123 LEU H . . 3.640 3.624 3.611 3.630 . 0 0 "[ . 1 . 2]" 1 1846 1 122 MET HA 1 125 ALA H . . 3.730 3.655 3.568 3.713 . 0 0 "[ . 1 . 2]" 1 1847 1 122 MET HA 1 125 ALA MB . . 4.880 2.473 2.369 2.637 . 0 0 "[ . 1 . 2]" 1 1848 1 122 MET QB 1 123 LEU H . . 3.810 2.520 2.451 2.630 . 0 0 "[ . 1 . 2]" 1 1849 1 122 MET QB 1 123 LEU HG . . 4.680 3.330 3.224 3.438 . 0 0 "[ . 1 . 2]" 1 1850 1 122 MET QB 1 125 ALA MB . . 7.410 4.197 4.127 4.325 . 0 0 "[ . 1 . 2]" 1 1851 1 122 MET HB2 1 123 LEU H . . 4.010 3.225 3.161 3.313 . 0 0 "[ . 1 . 2]" 1 1852 1 122 MET HB3 1 123 LEU H . . 4.010 2.633 2.543 2.782 . 0 0 "[ . 1 . 2]" 1 1853 1 122 MET HG2 1 123 LEU H . . 5.500 4.784 4.687 4.872 . 0 0 "[ . 1 . 2]" 1 1854 1 122 MET HG3 1 123 LEU H . . 5.500 5.133 5.095 5.199 . 0 0 "[ . 1 . 2]" 1 1855 1 123 LEU H 1 123 LEU HB2 . . 3.860 2.137 2.099 2.174 . 0 0 "[ . 1 . 2]" 1 1856 1 123 LEU H 1 123 LEU QB . . 3.480 2.117 2.080 2.153 . 0 0 "[ . 1 . 2]" 1 1857 1 123 LEU H 1 123 LEU HB3 . . 3.860 3.437 3.400 3.465 . 0 0 "[ . 1 . 2]" 1 1858 1 123 LEU H 1 123 LEU MD1 . . 5.190 3.381 3.238 3.587 . 0 0 "[ . 1 . 2]" 1 1859 1 123 LEU H 1 123 LEU HG . . 4.910 3.073 2.978 3.161 . 0 0 "[ . 1 . 2]" 1 1860 1 123 LEU H 1 124 ALA H . . 2.870 2.513 2.459 2.597 . 0 0 "[ . 1 . 2]" 1 1861 1 123 LEU HA 1 123 LEU MD2 . . 3.800 2.518 2.344 2.645 . 0 0 "[ . 1 . 2]" 1 1862 1 123 LEU HA 1 123 LEU HG . . 4.200 2.475 2.418 2.575 . 0 0 "[ . 1 . 2]" 1 1863 1 123 LEU HA 1 126 ASN H . . 4.140 3.309 3.236 3.395 . 0 0 "[ . 1 . 2]" 1 1864 1 123 LEU HA 1 126 ASN HB3 . . 4.200 3.927 3.688 4.080 . 0 0 "[ . 1 . 2]" 1 1865 1 123 LEU QB 1 124 ALA H . . 4.300 2.667 2.539 2.768 . 0 0 "[ . 1 . 2]" 1 1866 1 123 LEU QB 1 124 ALA HA . . 4.950 3.887 3.827 3.932 . 0 0 "[ . 1 . 2]" 1 1867 1 123 LEU HB2 1 124 ALA HA . . 5.500 4.723 4.654 4.803 . 0 0 "[ . 1 . 2]" 1 1868 1 123 LEU HB3 1 124 ALA HA . . 5.500 4.137 4.036 4.202 . 0 0 "[ . 1 . 2]" 1 1869 1 123 LEU MD1 1 124 ALA H . . 6.530 4.473 4.352 4.610 . 0 0 "[ . 1 . 2]" 1 1870 1 123 LEU MD2 1 124 ALA H . . 6.530 4.781 4.643 4.867 . 0 0 "[ . 1 . 2]" 1 1871 1 123 LEU MD2 1 127 VAL HA . . 6.530 5.277 5.117 5.344 . 0 0 "[ . 1 . 2]" 1 1872 1 123 LEU MD2 1 127 VAL HB . . 6.530 5.160 5.005 5.318 . 0 0 "[ . 1 . 2]" 1 1873 1 123 LEU HG 1 124 ALA H . . 5.310 4.831 4.781 4.885 . 0 0 "[ . 1 . 2]" 1 1874 1 124 ALA H 1 124 ALA HA . . 2.830 2.802 2.770 2.833 0.003 5 0 "[ . 1 . 2]" 1 1875 1 124 ALA H 1 124 ALA MB . . 3.430 2.162 2.149 2.174 . 0 0 "[ . 1 . 2]" 1 1876 1 124 ALA H 1 125 ALA H . . 3.240 2.619 2.533 2.689 . 0 0 "[ . 1 . 2]" 1 1877 1 124 ALA H 1 125 ALA MB . . 6.530 4.146 4.073 4.250 . 0 0 "[ . 1 . 2]" 1 1878 1 124 ALA H 1 126 ASN H . . 5.500 4.616 4.567 4.655 . 0 0 "[ . 1 . 2]" 1 1879 1 124 ALA HA 1 125 ALA HA . . 4.970 4.708 4.679 4.731 . 0 0 "[ . 1 . 2]" 1 1880 1 124 ALA HA 1 125 ALA MB . . 6.530 4.919 4.911 4.941 . 0 0 "[ . 1 . 2]" 1 1881 1 124 ALA HA 1 127 VAL H . . 4.200 3.306 3.262 3.375 . 0 0 "[ . 1 . 2]" 1 1882 1 124 ALA HA 1 127 VAL HB . . 3.550 1.977 1.949 2.032 . 0 0 "[ . 1 . 2]" 1 1883 1 124 ALA HA 1 127 VAL MG1 . . 4.110 2.726 2.487 2.994 . 0 0 "[ . 1 . 2]" 1 1884 1 124 ALA HA 1 127 VAL MG2 . . 4.820 2.943 2.731 3.088 . 0 0 "[ . 1 . 2]" 1 1885 1 124 ALA MB 1 125 ALA H . . 3.950 3.120 3.057 3.165 . 0 0 "[ . 1 . 2]" 1 1886 1 125 ALA H 1 125 ALA MB . . 3.430 2.071 1.982 2.192 . 0 0 "[ . 1 . 2]" 1 1887 1 125 ALA H 1 126 ASN H . . 2.900 2.525 2.463 2.570 . 0 0 "[ . 1 . 2]" 1 1888 1 125 ALA HA 1 127 VAL H . . 5.340 4.048 3.735 4.214 . 0 0 "[ . 1 . 2]" 1 1889 1 125 ALA MB 1 126 ASN H . . 3.740 2.458 2.311 2.540 . 0 0 "[ . 1 . 2]" 1 1890 1 125 ALA MB 1 126 ASN QD . . 6.440 4.259 4.147 4.522 . 0 0 "[ . 1 . 2]" 1 1891 1 126 ASN H 1 126 ASN HB2 . . 3.490 3.537 3.517 3.556 0.066 10 0 "[ . 1 . 2]" 1 1892 1 126 ASN H 1 126 ASN HB3 . . 3.080 2.367 2.280 2.492 . 0 0 "[ . 1 . 2]" 1 1893 1 126 ASN H 1 127 VAL H . . 2.870 2.512 2.469 2.557 . 0 0 "[ . 1 . 2]" 1 1894 1 126 ASN H 1 127 VAL MG1 . . 6.530 4.694 4.624 4.884 . 0 0 "[ . 1 . 2]" 1 1895 1 126 ASN HA 1 126 ASN HB2 . . 2.590 2.421 2.378 2.478 . 0 0 "[ . 1 . 2]" 1 1896 1 126 ASN HA 1 126 ASN HB3 . . 2.650 2.574 2.510 2.629 . 0 0 "[ . 1 . 2]" 1 1897 1 126 ASN HA 1 128 ASP H . . 4.290 3.851 3.609 4.011 . 0 0 "[ . 1 . 2]" 1 1898 1 126 ASN HA 1 129 ARG H . . 3.520 2.953 2.911 3.050 . 0 0 "[ . 1 . 2]" 1 1899 1 126 ASN HA 1 129 ARG HB2 . . 4.170 2.889 2.704 3.125 . 0 0 "[ . 1 . 2]" 1 1900 1 126 ASN HA 1 129 ARG HB3 . . 4.970 4.420 4.173 4.730 . 0 0 "[ . 1 . 2]" 1 1901 1 126 ASN HB2 1 127 VAL H . . 5.220 4.205 4.129 4.344 . 0 0 "[ . 1 . 2]" 1 1902 1 126 ASN HB3 1 127 VAL H . . 4.350 3.999 3.892 4.249 . 0 0 "[ . 1 . 2]" 1 1903 1 127 VAL H 1 127 VAL HB . . 2.490 2.016 1.995 2.046 . 0 0 "[ . 1 . 2]" 1 1904 1 127 VAL H 1 127 VAL MG1 . . 3.680 2.885 2.749 3.013 . 0 0 "[ . 1 . 2]" 1 1905 1 127 VAL H 1 127 VAL MG2 . . 4.140 3.445 3.364 3.511 . 0 0 "[ . 1 . 2]" 1 1906 1 127 VAL H 1 128 ASP H . . 2.900 2.898 2.755 2.946 0.046 6 0 "[ . 1 . 2]" 1 1907 1 127 VAL HA 1 127 VAL HB . . 2.900 2.684 2.651 2.715 . 0 0 "[ . 1 . 2]" 1 1908 1 127 VAL HA 1 127 VAL MG2 . . 3.430 2.051 1.957 2.174 . 0 0 "[ . 1 . 2]" 1 1909 1 127 VAL HA 1 130 ALA H . . 3.890 3.454 3.328 3.588 . 0 0 "[ . 1 . 2]" 1 1910 1 127 VAL HA 1 130 ALA HA . . 5.440 5.432 5.352 5.467 0.027 14 0 "[ . 1 . 2]" 1 1911 1 127 VAL HA 1 130 ALA MB . . 3.490 2.596 2.399 2.785 . 0 0 "[ . 1 . 2]" 1 1912 1 127 VAL HA 1 131 ALA H . . 4.230 4.009 3.714 4.228 . 0 0 "[ . 1 . 2]" 1 1913 1 127 VAL HB 1 128 ASP H . . 3.520 3.560 3.535 3.596 0.076 3 0 "[ . 1 . 2]" 1 1914 1 127 VAL MG1 1 128 ASP H . . 3.520 1.969 1.903 2.132 . 0 0 "[ . 1 . 2]" 1 1915 1 127 VAL MG1 1 128 ASP HA . . 6.530 2.881 2.816 2.919 . 0 0 "[ . 1 . 2]" 1 1916 1 127 VAL MG1 1 128 ASP QB . . 7.030 2.956 2.862 3.044 . 0 0 "[ . 1 . 2]" 1 1917 1 127 VAL MG1 1 129 ARG H . . 6.530 4.287 4.108 4.493 . 0 0 "[ . 1 . 2]" 1 1918 1 127 VAL MG1 1 130 ALA MB . . 7.560 4.533 4.327 4.681 . 0 0 "[ . 1 . 2]" 1 1919 1 127 VAL MG1 1 131 ALA H . . 6.530 4.442 4.329 4.534 . 0 0 "[ . 1 . 2]" 1 1920 1 127 VAL MG2 1 128 ASP H . . 5.380 4.135 4.040 4.250 . 0 0 "[ . 1 . 2]" 1 1921 1 127 VAL MG2 1 128 ASP HA . . 6.220 4.588 4.474 4.732 . 0 0 "[ . 1 . 2]" 1 1922 1 127 VAL MG2 1 128 ASP QB . . 7.310 5.181 5.047 5.291 . 0 0 "[ . 1 . 2]" 1 1923 1 128 ASP H 1 128 ASP HA . . 2.740 2.757 2.743 2.768 0.028 5 0 "[ . 1 . 2]" 1 1924 1 128 ASP H 1 128 ASP QB . . 3.310 2.112 1.990 2.188 . 0 0 "[ . 1 . 2]" 1 1925 1 128 ASP H 1 129 ARG H . . 2.680 2.682 2.594 2.741 0.061 20 0 "[ . 1 . 2]" 1 1926 1 128 ASP H 1 131 ALA MB . . 6.500 4.521 4.276 4.732 . 0 0 "[ . 1 . 2]" 1 1927 1 128 ASP HA 1 131 ALA H . . 3.670 3.475 3.378 3.631 . 0 0 "[ . 1 . 2]" 1 1928 1 128 ASP HA 1 131 ALA MB . . 4.820 2.554 2.266 2.812 . 0 0 "[ . 1 . 2]" 1 1929 1 128 ASP HA 1 132 GLY H . . 4.630 4.272 3.838 4.443 . 0 0 "[ . 1 . 2]" 1 1930 1 128 ASP QB 1 129 ARG H . . 3.830 2.448 2.222 2.679 . 0 0 "[ . 1 . 2]" 1 1931 1 129 ARG H 1 129 ARG HA . . 2.800 2.744 2.718 2.788 . 0 0 "[ . 1 . 2]" 1 1932 1 129 ARG H 1 129 ARG HB2 . . 2.960 2.426 2.387 2.482 . 0 0 "[ . 1 . 2]" 1 1933 1 129 ARG H 1 129 ARG HB3 . . 3.610 3.545 3.540 3.549 . 0 0 "[ . 1 . 2]" 1 1934 1 129 ARG H 1 129 ARG HG2 . . 3.920 2.471 2.067 3.879 . 0 0 "[ . 1 . 2]" 1 1935 1 129 ARG H 1 129 ARG QG . . 3.540 2.255 2.053 2.729 . 0 0 "[ . 1 . 2]" 1 1936 1 129 ARG H 1 129 ARG HG3 . . 3.920 3.194 2.613 3.495 . 0 0 "[ . 1 . 2]" 1 1937 1 129 ARG H 1 130 ALA H . . 2.800 2.780 2.631 2.828 0.028 20 0 "[ . 1 . 2]" 1 1938 1 129 ARG H 1 130 ALA MB . . 6.530 4.289 4.192 4.375 . 0 0 "[ . 1 . 2]" 1 1939 1 129 ARG H 1 131 ALA H . . 5.100 4.074 3.870 4.242 . 0 0 "[ . 1 . 2]" 1 1940 1 129 ARG HA 1 129 ARG HB3 . . 2.680 2.573 2.543 2.600 . 0 0 "[ . 1 . 2]" 1 1941 1 129 ARG HA 1 129 ARG HG2 . . 4.040 2.770 2.428 3.309 . 0 0 "[ . 1 . 2]" 1 1942 1 129 ARG HA 1 129 ARG QG . . 3.730 2.565 2.200 2.867 . 0 0 "[ . 1 . 2]" 1 1943 1 129 ARG HA 1 129 ARG HG3 . . 4.040 3.511 2.234 3.763 . 0 0 "[ . 1 . 2]" 1 1944 1 129 ARG HA 1 131 ALA H . . 5.070 4.370 4.093 4.707 . 0 0 "[ . 1 . 2]" 1 1945 1 129 ARG HA 1 132 GLY H . . 3.550 3.213 3.115 3.367 . 0 0 "[ . 1 . 2]" 1 1946 1 129 ARG HB2 1 130 ALA H . . 3.420 2.464 2.368 2.542 . 0 0 "[ . 1 . 2]" 1 1947 1 129 ARG HB2 1 130 ALA HA . . 5.000 4.252 4.187 4.324 . 0 0 "[ . 1 . 2]" 1 1948 1 129 ARG HB2 1 130 ALA MB . . 4.790 3.856 3.771 3.987 . 0 0 "[ . 1 . 2]" 1 1949 1 129 ARG HB3 1 129 ARG QG . . 2.740 2.446 2.179 2.562 . 0 0 "[ . 1 . 2]" 1 1950 1 129 ARG HB3 1 130 ALA H . . 3.520 3.470 3.328 3.554 0.034 18 0 "[ . 1 . 2]" 1 1951 1 129 ARG QG 1 130 ALA H . . 6.380 4.070 3.966 4.377 . 0 0 "[ . 1 . 2]" 1 1952 1 130 ALA H 1 130 ALA HA . . 2.770 2.773 2.757 2.791 0.021 19 0 "[ . 1 . 2]" 1 1953 1 130 ALA H 1 130 ALA MB . . 3.430 2.034 1.933 2.157 . 0 0 "[ . 1 . 2]" 1 1954 1 130 ALA H 1 131 ALA H . . 2.710 2.729 2.635 2.771 0.061 1 0 "[ . 1 . 2]" 1 1955 1 130 ALA H 1 131 ALA MB . . 6.530 4.296 4.172 4.374 . 0 0 "[ . 1 . 2]" 1 1956 1 130 ALA HA 1 131 ALA H . . 3.580 3.602 3.566 3.630 0.050 13 0 "[ . 1 . 2]" 1 1957 1 130 ALA HA 1 131 ALA HA . . 5.500 4.768 4.741 4.792 . 0 0 "[ . 1 . 2]" 1 1958 1 130 ALA HA 1 131 ALA MB . . 6.530 5.010 4.985 5.032 . 0 0 "[ . 1 . 2]" 1 1959 1 130 ALA HA 1 133 LYS H . . 3.390 3.368 3.297 3.479 0.089 2 0 "[ . 1 . 2]" 1 1960 1 130 ALA HA 1 133 LYS HB2 . . 4.760 4.808 4.604 4.885 0.125 8 0 "[ . 1 . 2]" 1 1961 1 130 ALA HA 1 133 LYS HB3 . . 4.480 3.450 3.080 3.815 . 0 0 "[ . 1 . 2]" 1 1962 1 130 ALA HA 1 133 LYS HG2 . . 4.850 2.746 2.063 3.413 . 0 0 "[ . 1 . 2]" 1 1963 1 130 ALA MB 1 131 ALA H . . 3.860 2.668 2.459 2.886 . 0 0 "[ . 1 . 2]" 1 1964 1 130 ALA MB 1 133 LYS H . . 6.530 4.602 4.536 4.700 . 0 0 "[ . 1 . 2]" 1 1965 1 131 ALA H 1 131 ALA MB . . 3.430 2.070 1.943 2.170 . 0 0 "[ . 1 . 2]" 1 1966 1 131 ALA H 1 132 GLY H . . 2.710 2.567 2.478 2.663 . 0 0 "[ . 1 . 2]" 1 1967 1 131 ALA HA 1 132 GLY H . . 3.550 3.562 3.529 3.623 0.073 2 0 "[ . 1 . 2]" 1 1968 1 131 ALA HA 1 133 LYS H . . 4.690 4.483 4.217 4.693 0.003 8 0 "[ . 1 . 2]" 1 1969 1 131 ALA HA 1 134 LEU H . . 4.350 3.367 3.241 3.511 . 0 0 "[ . 1 . 2]" 1 1970 1 131 ALA HA 1 134 LEU HB2 . . 4.410 4.121 3.889 4.340 . 0 0 "[ . 1 . 2]" 1 1971 1 131 ALA HA 1 134 LEU HB3 . . 3.700 2.705 2.316 3.195 . 0 0 "[ . 1 . 2]" 1 1972 1 131 ALA HA 1 134 LEU QD . . 6.180 2.190 1.832 3.101 . 0 0 "[ . 1 . 2]" 1 1973 1 131 ALA MB 1 132 GLY H . . 3.740 2.819 2.450 2.952 . 0 0 "[ . 1 . 2]" 1 1974 1 131 ALA MB 1 134 LEU HB2 . . 6.530 5.440 5.218 5.559 . 0 0 "[ . 1 . 2]" 1 1975 1 132 GLY H 1 132 GLY HA3 . . 2.560 2.252 2.246 2.260 . 0 0 "[ . 1 . 2]" 1 1976 1 132 GLY H 1 133 LYS H . . 2.990 2.654 2.565 2.848 . 0 0 "[ . 1 . 2]" 1 1977 1 132 GLY HA2 1 135 ILE H . . 3.730 3.516 3.377 3.695 . 0 0 "[ . 1 . 2]" 1 1978 1 132 GLY HA2 1 135 ILE HB . . 4.040 2.744 2.644 2.862 . 0 0 "[ . 1 . 2]" 1 1979 1 132 GLY HA2 1 135 ILE MD . . 5.440 3.051 2.183 4.657 . 0 0 "[ . 1 . 2]" 1 1980 1 132 GLY HA2 1 135 ILE MG . . 5.570 3.960 3.796 4.175 . 0 0 "[ . 1 . 2]" 1 1981 1 132 GLY HA2 1 136 ALA H . . 4.320 4.168 3.884 4.351 0.031 2 0 "[ . 1 . 2]" 1 1982 1 132 GLY HA3 1 133 LYS H . . 2.930 2.846 2.774 2.943 0.013 1 0 "[ . 1 . 2]" 1 1983 1 132 GLY HA3 1 135 ILE HB . . 4.290 4.323 4.260 4.389 0.099 18 0 "[ . 1 . 2]" 1 1984 1 133 LYS H 1 133 LYS HA . . 2.870 2.826 2.790 2.855 . 0 0 "[ . 1 . 2]" 1 1985 1 133 LYS H 1 133 LYS HB2 . . 3.490 3.477 3.398 3.547 0.057 10 0 "[ . 1 . 2]" 1 1986 1 133 LYS H 1 133 LYS HB3 . . 2.520 2.214 2.087 2.397 . 0 0 "[ . 1 . 2]" 1 1987 1 133 LYS H 1 133 LYS HD2 . . 5.500 4.985 4.812 5.175 . 0 0 "[ . 1 . 2]" 1 1988 1 133 LYS H 1 133 LYS QD . . 5.100 4.115 3.597 4.503 . 0 0 "[ . 1 . 2]" 1 1989 1 133 LYS H 1 133 LYS HD3 . . 5.500 4.467 3.703 5.193 . 0 0 "[ . 1 . 2]" 1 1990 1 133 LYS H 1 133 LYS HG2 . . 2.960 2.919 2.681 3.192 0.232 13 0 "[ . 1 . 2]" 1 1991 1 133 LYS H 1 133 LYS HG3 . . 4.010 3.554 2.559 4.133 0.123 5 0 "[ . 1 . 2]" 1 1992 1 133 LYS H 1 134 LEU H . . 3.450 2.559 2.487 2.680 . 0 0 "[ . 1 . 2]" 1 1993 1 133 LYS H 1 135 ILE H . . 4.910 4.044 3.927 4.209 . 0 0 "[ . 1 . 2]" 1 1994 1 133 LYS HA 1 133 LYS HB2 . . 2.930 2.284 2.240 2.358 . 0 0 "[ . 1 . 2]" 1 1995 1 133 LYS HA 1 133 LYS HB3 . . 2.650 2.645 2.531 2.731 0.081 20 0 "[ . 1 . 2]" 1 1996 1 133 LYS HA 1 133 LYS HD2 . . 5.500 4.874 4.269 5.427 . 0 0 "[ . 1 . 2]" 1 1997 1 133 LYS HA 1 133 LYS QD . . 5.140 4.262 4.086 4.384 . 0 0 "[ . 1 . 2]" 1 1998 1 133 LYS HA 1 133 LYS HD3 . . 5.500 4.850 4.570 5.321 . 0 0 "[ . 1 . 2]" 1 1999 1 133 LYS HA 1 133 LYS HG2 . . 4.110 3.859 3.646 4.182 0.072 13 0 "[ . 1 . 2]" 1 2000 1 133 LYS HA 1 135 ILE H . . 4.320 4.329 4.114 4.540 0.220 19 0 "[ . 1 . 2]" 1 2001 1 133 LYS HA 1 136 ALA H . . 3.490 3.257 3.115 3.468 . 0 0 "[ . 1 . 2]" 1 2002 1 133 LYS HA 1 136 ALA MB . . 3.920 2.439 2.254 2.643 . 0 0 "[ . 1 . 2]" 1 2003 1 133 LYS HA 1 137 CYS H . . 4.350 4.085 3.798 4.270 . 0 0 "[ . 1 . 2]" 1 2004 1 133 LYS HB2 1 134 LEU H . . 4.410 4.148 4.078 4.216 . 0 0 "[ . 1 . 2]" 1 2005 1 133 LYS HB2 1 137 CYS H . . 5.410 5.283 4.938 5.442 0.032 12 0 "[ . 1 . 2]" 1 2006 1 133 LYS HB3 1 134 LEU H . . 4.200 3.709 3.483 3.976 . 0 0 "[ . 1 . 2]" 1 2007 1 133 LYS QD 1 133 LYS HG2 . . 2.600 2.398 2.193 2.558 . 0 0 "[ . 1 . 2]" 1 2008 1 133 LYS QD 1 133 LYS HG3 . . 2.620 2.314 2.197 2.490 . 0 0 "[ . 1 . 2]" 1 2009 1 133 LYS QE 1 134 LEU HB3 . . 5.910 3.834 3.483 4.480 . 0 0 "[ . 1 . 2]" 1 2010 1 133 LYS QE 1 134 LEU QD . . 8.980 4.318 3.432 4.937 . 0 0 "[ . 1 . 2]" 1 2011 1 133 LYS QE 1 134 LEU HG . . 6.380 5.537 4.569 5.865 . 0 0 "[ . 1 . 2]" 1 2012 1 134 LEU H 1 134 LEU HB2 . . 4.010 3.264 2.954 3.447 . 0 0 "[ . 1 . 2]" 1 2013 1 134 LEU H 1 134 LEU HB3 . . 3.170 2.063 1.988 2.148 . 0 0 "[ . 1 . 2]" 1 2014 1 134 LEU H 1 134 LEU MD1 . . 5.440 4.036 3.254 4.362 . 0 0 "[ . 1 . 2]" 1 2015 1 134 LEU H 1 134 LEU QD . . 5.080 3.420 3.149 3.696 . 0 0 "[ . 1 . 2]" 1 2016 1 134 LEU H 1 134 LEU MD2 . . 5.440 3.739 3.276 4.197 . 0 0 "[ . 1 . 2]" 1 2017 1 134 LEU H 1 135 ILE H . . 3.700 2.659 2.520 2.751 . 0 0 "[ . 1 . 2]" 1 2018 1 134 LEU HA 1 137 CYS H . . 3.760 3.261 3.176 3.429 . 0 0 "[ . 1 . 2]" 1 2019 1 134 LEU HA 1 137 CYS HB2 . . 3.980 2.850 2.578 3.103 . 0 0 "[ . 1 . 2]" 1 2020 1 134 LEU HA 1 137 CYS HB3 . . 3.860 2.782 2.610 3.151 . 0 0 "[ . 1 . 2]" 1 2021 1 134 LEU HA 1 138 PHE H . . 4.510 4.163 3.674 4.334 . 0 0 "[ . 1 . 2]" 1 2022 1 134 LEU HB2 1 135 ILE H . . 5.220 4.187 4.077 4.321 . 0 0 "[ . 1 . 2]" 1 2023 1 134 LEU HB3 1 135 ILE H . . 3.520 3.415 2.938 3.705 0.185 17 0 "[ . 1 . 2]" 1 2024 1 134 LEU QD 1 135 ILE H . . 5.470 2.928 1.858 3.651 . 0 0 "[ . 1 . 2]" 1 2025 1 134 LEU QD 1 135 ILE HA . . 8.100 2.525 2.004 3.373 . 0 0 "[ . 1 . 2]" 1 2026 1 134 LEU QD 1 135 ILE MG . . 8.750 4.076 3.598 4.777 . 0 0 "[ . 1 . 2]" 1 2027 1 134 LEU MD1 1 135 ILE H . . 6.030 3.169 1.863 4.663 . 0 0 "[ . 1 . 2]" 1 2028 1 134 LEU MD2 1 135 ILE H . . 6.030 3.879 2.481 4.469 . 0 0 "[ . 1 . 2]" 1 2029 1 134 LEU HG 1 135 ILE H . . 3.760 2.570 2.119 4.276 0.516 19 1 "[ . 1 . +2]" 1 2030 1 135 ILE H 1 135 ILE HA . . 2.830 2.808 2.777 2.854 0.024 18 0 "[ . 1 . 2]" 1 2031 1 135 ILE H 1 135 ILE HB . . 2.490 2.246 2.149 2.409 . 0 0 "[ . 1 . 2]" 1 2032 1 135 ILE H 1 135 ILE MD . . 5.320 3.444 3.157 3.656 . 0 0 "[ . 1 . 2]" 1 2033 1 135 ILE H 1 135 ILE HG12 . . 3.760 3.516 2.059 3.828 0.068 15 0 "[ . 1 . 2]" 1 2034 1 135 ILE H 1 135 ILE QG . . 3.600 2.390 2.043 2.588 . 0 0 "[ . 1 . 2]" 1 2035 1 135 ILE H 1 135 ILE HG13 . . 3.760 2.621 2.362 3.615 . 0 0 "[ . 1 . 2]" 1 2036 1 135 ILE H 1 136 ALA H . . 2.830 2.645 2.481 2.782 . 0 0 "[ . 1 . 2]" 1 2037 1 135 ILE H 1 137 CYS H . . 4.910 3.873 3.741 4.003 . 0 0 "[ . 1 . 2]" 1 2038 1 135 ILE HA 1 138 PHE H . . 3.450 3.373 3.222 3.459 0.009 10 0 "[ . 1 . 2]" 1 2039 1 135 ILE HA 1 138 PHE HB3 . . 4.450 2.796 2.265 3.110 . 0 0 "[ . 1 . 2]" 1 2040 1 135 ILE HB 1 136 ALA H . . 3.300 2.767 2.510 2.941 . 0 0 "[ . 1 . 2]" 1 2041 1 135 ILE HB 1 136 ALA MB . . 5.190 4.098 3.901 4.251 . 0 0 "[ . 1 . 2]" 1 2042 1 135 ILE QG 1 136 ALA H . . 5.200 4.263 3.976 4.377 . 0 0 "[ . 1 . 2]" 1 2043 1 135 ILE MG 1 136 ALA H . . 4.980 3.228 2.894 3.603 . 0 0 "[ . 1 . 2]" 1 2044 1 136 ALA H 1 136 ALA HA . . 2.870 2.805 2.762 2.843 . 0 0 "[ . 1 . 2]" 1 2045 1 136 ALA H 1 136 ALA MB . . 3.430 2.060 1.942 2.164 . 0 0 "[ . 1 . 2]" 1 2046 1 136 ALA H 1 137 CYS H . . 2.680 2.588 2.458 2.707 0.027 1 0 "[ . 1 . 2]" 1 2047 1 136 ALA HA 1 139 GLU H . . 3.830 3.284 3.185 3.505 . 0 0 "[ . 1 . 2]" 1 2048 1 136 ALA HA 1 139 GLU HB2 . . 4.200 2.849 2.685 3.216 . 0 0 "[ . 1 . 2]" 1 2049 1 136 ALA HA 1 139 GLU HB3 . . 4.010 2.794 2.609 3.000 . 0 0 "[ . 1 . 2]" 1 2050 1 136 ALA HA 1 139 GLU QG . . 6.380 4.457 4.100 4.816 . 0 0 "[ . 1 . 2]" 1 2051 1 136 ALA HA 1 140 ALA H . . 4.010 3.731 3.378 3.893 . 0 0 "[ . 1 . 2]" 1 2052 1 136 ALA MB 1 137 CYS H . . 3.490 2.823 2.704 2.908 . 0 0 "[ . 1 . 2]" 1 2053 1 136 ALA MB 1 139 GLU H . . 6.530 4.535 4.452 4.661 . 0 0 "[ . 1 . 2]" 1 2054 1 136 ALA MB 1 139 GLU HB2 . . 6.530 4.451 4.312 4.760 . 0 0 "[ . 1 . 2]" 1 2055 1 136 ALA MB 1 139 GLU HB3 . . 6.250 4.092 3.909 4.409 . 0 0 "[ . 1 . 2]" 1 2056 1 137 CYS H 1 137 CYS HA . . 2.770 2.789 2.775 2.842 0.072 18 0 "[ . 1 . 2]" 1 2057 1 137 CYS H 1 137 CYS HB2 . . 2.900 2.384 2.206 2.592 . 0 0 "[ . 1 . 2]" 1 2058 1 137 CYS H 1 137 CYS HB3 . . 2.740 2.637 2.413 2.928 0.188 18 0 "[ . 1 . 2]" 1 2059 1 137 CYS H 1 138 PHE H . . 2.710 2.685 2.505 2.727 0.017 3 0 "[ . 1 . 2]" 1 2060 1 137 CYS H 1 139 GLU H . . 3.950 3.960 3.758 4.000 0.050 13 0 "[ . 1 . 2]" 1 2061 1 137 CYS HA 1 137 CYS HB2 . . 2.990 2.533 2.412 2.709 . 0 0 "[ . 1 . 2]" 1 2062 1 137 CYS HA 1 140 ALA H . . 3.700 3.607 3.444 3.728 0.028 6 0 "[ . 1 . 2]" 1 2063 1 137 CYS HA 1 140 ALA MB . . 4.050 2.767 2.569 3.006 . 0 0 "[ . 1 . 2]" 1 2064 1 137 CYS HB2 1 138 PHE H . . 3.760 3.718 3.429 3.888 0.128 19 0 "[ . 1 . 2]" 1 2065 1 137 CYS HB3 1 138 PHE H . . 3.390 2.484 2.456 2.609 . 0 0 "[ . 1 . 2]" 1 2066 1 138 PHE H 1 138 PHE HB2 . . 2.830 2.430 2.250 2.673 . 0 0 "[ . 1 . 2]" 1 2067 1 138 PHE H 1 138 PHE HB3 . . 2.590 2.273 2.063 2.450 . 0 0 "[ . 1 . 2]" 1 2068 1 138 PHE H 1 139 GLU H . . 2.830 2.715 2.664 2.786 . 0 0 "[ . 1 . 2]" 1 2069 1 138 PHE H 1 140 ALA H . . 5.130 4.360 4.174 4.454 . 0 0 "[ . 1 . 2]" 1 2070 1 138 PHE H 1 140 ALA MB . . 6.530 4.928 4.726 5.057 . 0 0 "[ . 1 . 2]" 1 2071 1 138 PHE HA 1 141 ARG H . . 3.860 3.475 3.405 3.786 . 0 0 "[ . 1 . 2]" 1 2072 1 138 PHE HA 1 141 ARG HB2 . . 5.500 2.557 2.422 3.016 . 0 0 "[ . 1 . 2]" 1 2073 1 138 PHE HA 1 141 ARG HB3 . . 4.290 3.584 3.436 3.863 . 0 0 "[ . 1 . 2]" 1 2074 1 138 PHE HA 1 142 ALA H . . 4.260 4.174 3.809 4.290 0.030 9 0 "[ . 1 . 2]" 1 2075 1 138 PHE HB2 1 139 GLU H . . 4.230 3.904 3.769 4.059 . 0 0 "[ . 1 . 2]" 1 2076 1 138 PHE HB3 1 139 GLU H . . 3.640 2.555 2.411 2.722 . 0 0 "[ . 1 . 2]" 1 2077 1 139 GLU H 1 139 GLU HB2 . . 3.240 2.185 2.117 2.284 . 0 0 "[ . 1 . 2]" 1 2078 1 139 GLU H 1 139 GLU HB3 . . 3.450 2.820 2.736 2.927 . 0 0 "[ . 1 . 2]" 1 2079 1 139 GLU H 1 139 GLU HG2 . . 5.280 4.316 4.167 4.465 . 0 0 "[ . 1 . 2]" 1 2080 1 139 GLU H 1 139 GLU QG . . 4.860 3.796 3.710 3.871 . 0 0 "[ . 1 . 2]" 1 2081 1 139 GLU H 1 139 GLU HG3 . . 5.280 4.224 4.080 4.409 . 0 0 "[ . 1 . 2]" 1 2082 1 139 GLU H 1 140 ALA H . . 2.770 2.736 2.612 2.793 0.023 10 0 "[ . 1 . 2]" 1 2083 1 139 GLU H 1 140 ALA MB . . 6.530 4.257 4.080 4.355 . 0 0 "[ . 1 . 2]" 1 2084 1 139 GLU HA 1 139 GLU HB2 . . 2.960 2.655 2.610 2.715 . 0 0 "[ . 1 . 2]" 1 2085 1 139 GLU HA 1 139 GLU HG2 . . 3.700 2.326 2.090 2.640 . 0 0 "[ . 1 . 2]" 1 2086 1 139 GLU HA 1 139 GLU QG . . 3.500 2.200 2.067 2.303 . 0 0 "[ . 1 . 2]" 1 2087 1 139 GLU HA 1 139 GLU HG3 . . 3.700 2.917 2.449 3.436 . 0 0 "[ . 1 . 2]" 1 2088 1 139 GLU HA 1 141 ARG H . . 4.970 4.376 4.177 4.712 . 0 0 "[ . 1 . 2]" 1 2089 1 139 GLU HA 1 142 ALA H . . 3.800 3.241 3.155 3.340 . 0 0 "[ . 1 . 2]" 1 2090 1 139 GLU HA 1 142 ALA MB . . 3.920 2.445 2.135 2.608 . 0 0 "[ . 1 . 2]" 1 2091 1 139 GLU HA 1 143 GLN H . . 4.480 4.265 4.007 4.327 . 0 0 "[ . 1 . 2]" 1 2092 1 139 GLU HB2 1 140 ALA H . . 3.520 3.556 3.523 3.625 0.105 6 0 "[ . 1 . 2]" 1 2093 1 139 GLU HB2 1 140 ALA MB . . 6.530 4.983 4.908 5.074 . 0 0 "[ . 1 . 2]" 1 2094 1 139 GLU HB2 1 142 ALA MB . . 6.530 4.730 4.492 4.874 . 0 0 "[ . 1 . 2]" 1 2095 1 139 GLU HB3 1 140 ALA H . . 3.950 2.505 2.439 2.763 . 0 0 "[ . 1 . 2]" 1 2096 1 139 GLU HB3 1 140 ALA MB . . 6.530 3.823 3.709 3.939 . 0 0 "[ . 1 . 2]" 1 2097 1 139 GLU QG 1 140 ALA H . . 5.020 4.202 4.009 4.396 . 0 0 "[ . 1 . 2]" 1 2098 1 139 GLU HG2 1 140 ALA H . . 5.310 4.481 4.220 4.764 . 0 0 "[ . 1 . 2]" 1 2099 1 139 GLU HG3 1 140 ALA H . . 5.310 5.097 5.006 5.281 . 0 0 "[ . 1 . 2]" 1 2100 1 140 ALA H 1 140 ALA HA . . 2.770 2.772 2.757 2.791 0.021 1 0 "[ . 1 . 2]" 1 2101 1 140 ALA H 1 140 ALA MB . . 3.430 2.065 1.935 2.161 . 0 0 "[ . 1 . 2]" 1 2102 1 140 ALA H 1 141 ARG H . . 2.710 2.732 2.703 2.798 0.088 18 0 "[ . 1 . 2]" 1 2103 1 140 ALA H 1 142 ALA MB . . 6.530 4.699 4.444 4.896 . 0 0 "[ . 1 . 2]" 1 2104 1 140 ALA HA 1 142 ALA H . . 5.190 4.273 4.215 4.493 . 0 0 "[ . 1 . 2]" 1 2105 1 140 ALA HA 1 143 GLN H . . 3.330 3.364 3.345 3.414 0.084 18 0 "[ . 1 . 2]" 1 2106 1 140 ALA HA 1 143 GLN HB2 . . 3.610 2.983 2.815 3.052 . 0 0 "[ . 1 . 2]" 1 2107 1 140 ALA HA 1 143 GLN HB3 . . 3.730 3.714 3.553 3.747 0.017 2 0 "[ . 1 . 2]" 1 2108 1 140 ALA HA 1 143 GLN QG . . 5.640 4.926 4.677 5.076 . 0 0 "[ . 1 . 2]" 1 2109 1 140 ALA HA 1 144 GLN H . . 4.290 4.064 3.994 4.110 . 0 0 "[ . 1 . 2]" 1 2110 1 140 ALA MB 1 141 ARG H . . 3.610 2.643 2.439 2.780 . 0 0 "[ . 1 . 2]" 1 2111 1 140 ALA MB 1 141 ARG HA . . 6.530 3.767 3.654 3.836 . 0 0 "[ . 1 . 2]" 1 2112 1 140 ALA MB 1 143 GLN H . . 6.530 4.562 4.533 4.587 . 0 0 "[ . 1 . 2]" 1 2113 1 140 ALA MB 1 144 GLN H . . 6.030 4.488 4.445 4.541 . 0 0 "[ . 1 . 2]" 1 2114 1 141 ARG H 1 141 ARG HB2 . . 2.990 2.027 2.025 2.029 . 0 0 "[ . 1 . 2]" 1 2115 1 141 ARG H 1 141 ARG HB3 . . 3.210 3.249 3.233 3.261 0.051 1 0 "[ . 1 . 2]" 1 2116 1 141 ARG H 1 141 ARG QG . . 4.120 3.336 3.279 3.565 . 0 0 "[ . 1 . 2]" 1 2117 1 141 ARG H 1 142 ALA H . . 2.680 2.633 2.595 2.680 . 9 0 "[ . 1 . 2]" 1 2118 1 141 ARG H 1 142 ALA MB . . 6.530 4.211 4.126 4.253 . 0 0 "[ . 1 . 2]" 1 2119 1 141 ARG HA 1 144 GLN H . . 3.170 3.153 3.114 3.182 0.012 15 0 "[ . 1 . 2]" 1 2120 1 141 ARG HA 1 144 GLN QB . . 3.990 2.168 2.125 2.223 . 0 0 "[ . 1 . 2]" 1 2121 1 141 ARG HA 1 144 GLN HG2 . . 4.940 4.825 4.692 4.988 0.048 3 0 "[ . 1 . 2]" 1 2122 1 141 ARG HA 1 144 GLN QG . . 4.740 4.301 4.190 4.344 . 0 0 "[ . 1 . 2]" 1 2123 1 141 ARG HA 1 144 GLN HG3 . . 4.940 4.850 4.504 4.967 0.027 2 0 "[ . 1 . 2]" 1 2124 1 141 ARG HB2 1 142 ALA H . . 3.360 3.217 3.068 3.256 . 0 0 "[ . 1 . 2]" 1 2125 1 141 ARG HB2 1 143 GLN H . . 5.500 5.418 5.243 5.470 . 0 0 "[ . 1 . 2]" 1 2126 1 141 ARG HB3 1 142 ALA H . . 4.450 3.115 2.905 3.167 . 0 0 "[ . 1 . 2]" 1 2127 1 141 ARG QG 1 142 ALA H . . 6.380 4.558 4.417 4.644 . 0 0 "[ . 1 . 2]" 1 2128 1 142 ALA H 1 142 ALA HA . . 2.800 2.805 2.780 2.812 0.012 18 0 "[ . 1 . 2]" 1 2129 1 142 ALA H 1 142 ALA MB . . 3.430 2.091 1.966 2.164 . 0 0 "[ . 1 . 2]" 1 2130 1 142 ALA H 1 143 GLN H . . 2.650 2.641 2.614 2.696 0.046 9 0 "[ . 1 . 2]" 1 2131 1 142 ALA H 1 144 GLN H . . 4.790 3.852 3.821 3.933 . 0 0 "[ . 1 . 2]" 1 2132 1 142 ALA HA 1 144 GLN H . . 4.910 4.322 4.280 4.348 . 0 0 "[ . 1 . 2]" 1 2133 1 142 ALA HA 1 145 LEU H . . 3.490 3.495 3.414 3.511 0.021 18 0 "[ . 1 . 2]" 1 2134 1 142 ALA HA 1 145 LEU HB2 . . 4.200 3.546 3.172 4.218 0.018 14 0 "[ . 1 . 2]" 1 2135 1 142 ALA HA 1 145 LEU HB3 . . 4.660 3.340 2.817 3.612 . 0 0 "[ . 1 . 2]" 1 2136 1 142 ALA HA 1 146 HIS H . . 4.170 3.892 3.748 4.012 . 0 0 "[ . 1 . 2]" 1 2137 1 142 ALA HA 1 146 HIS HD2 . . 4.320 4.143 3.971 4.342 0.022 5 0 "[ . 1 . 2]" 1 2138 1 142 ALA MB 1 143 GLN H . . 3.610 2.611 2.532 2.718 . 0 0 "[ . 1 . 2]" 1 2139 1 142 ALA MB 1 143 GLN HA . . 6.530 3.814 3.723 3.860 . 0 0 "[ . 1 . 2]" 1 2140 1 142 ALA MB 1 144 GLN H . . 6.530 4.402 4.377 4.429 . 0 0 "[ . 1 . 2]" 1 2141 1 142 ALA MB 1 146 HIS HD2 . . 5.010 3.664 3.285 3.955 . 0 0 "[ . 1 . 2]" 1 2142 1 143 GLN H 1 143 GLN HB2 . . 2.900 2.065 2.053 2.078 . 0 0 "[ . 1 . 2]" 1 2143 1 143 GLN H 1 143 GLN HB3 . . 3.270 3.123 3.102 3.147 . 0 0 "[ . 1 . 2]" 1 2144 1 143 GLN H 1 143 GLN HG2 . . 5.500 4.333 4.071 4.564 . 0 0 "[ . 1 . 2]" 1 2145 1 143 GLN H 1 143 GLN QG . . 4.840 3.557 3.494 3.653 . 0 0 "[ . 1 . 2]" 1 2146 1 143 GLN H 1 143 GLN HG3 . . 5.500 3.789 3.724 3.900 . 0 0 "[ . 1 . 2]" 1 2147 1 143 GLN H 1 144 GLN H . . 2.960 2.483 2.455 2.507 . 0 0 "[ . 1 . 2]" 1 2148 1 143 GLN HA 1 143 GLN HB3 . . 2.930 2.922 2.912 2.931 0.001 1 0 "[ . 1 . 2]" 1 2149 1 143 GLN HA 1 143 GLN HG2 . . 3.300 2.384 2.008 2.887 . 0 0 "[ . 1 . 2]" 1 2150 1 143 GLN HA 1 143 GLN QG . . 2.930 2.090 1.980 2.174 . 0 0 "[ . 1 . 2]" 1 2151 1 143 GLN HA 1 143 GLN HG3 . . 3.300 2.543 2.066 3.010 . 0 0 "[ . 1 . 2]" 1 2152 1 143 GLN HA 1 146 HIS H . . 3.830 3.485 3.370 3.690 . 0 0 "[ . 1 . 2]" 1 2153 1 143 GLN HA 1 147 GLY H . . 4.070 3.412 2.267 3.831 . 0 0 "[ . 1 . 2]" 1 2154 1 143 GLN HA 1 147 GLY QA . . 4.980 4.263 3.012 4.504 . 0 0 "[ . 1 . 2]" 1 2155 1 143 GLN HB2 1 144 GLN H . . 3.450 3.452 3.426 3.471 0.021 16 0 "[ . 1 . 2]" 1 2156 1 143 GLN HB3 1 144 GLN H . . 3.730 3.168 3.147 3.194 . 0 0 "[ . 1 . 2]" 1 2157 1 143 GLN QG 1 144 GLN H . . 5.120 4.546 4.525 4.583 . 0 0 "[ . 1 . 2]" 1 2158 1 143 GLN HG2 1 144 GLN H . . 5.470 5.001 4.948 5.125 . 0 0 "[ . 1 . 2]" 1 2159 1 143 GLN HG3 1 144 GLN H . . 5.470 5.229 5.067 5.368 . 0 0 "[ . 1 . 2]" 1 2160 1 144 GLN H 1 144 GLN QB . . 3.560 2.199 2.175 2.205 . 0 0 "[ . 1 . 2]" 1 2161 1 144 GLN H 1 144 GLN HG2 . . 4.850 4.326 4.319 4.348 . 0 0 "[ . 1 . 2]" 1 2162 1 144 GLN H 1 144 GLN QG . . 4.440 3.945 3.929 3.991 . 0 0 "[ . 1 . 2]" 1 2163 1 144 GLN H 1 144 GLN HG3 . . 4.850 4.551 4.514 4.647 . 0 0 "[ . 1 . 2]" 1 2164 1 144 GLN H 1 145 LEU H . . 2.830 2.555 2.479 2.601 . 0 0 "[ . 1 . 2]" 1 2165 1 144 GLN H 1 146 HIS H . . 4.660 4.306 4.167 4.438 . 0 0 "[ . 1 . 2]" 1 2166 1 144 GLN HA 1 144 GLN HG2 . . 3.420 2.819 2.598 2.974 . 0 0 "[ . 1 . 2]" 1 2167 1 144 GLN HA 1 144 GLN QG . . 2.920 2.539 2.521 2.557 . 0 0 "[ . 1 . 2]" 1 2168 1 144 GLN HA 1 144 GLN HG3 . . 3.420 2.950 2.786 3.439 0.019 3 0 "[ . 1 . 2]" 1 2169 1 144 GLN HA 1 145 LEU H . . 3.640 3.571 3.532 3.589 . 0 0 "[ . 1 . 2]" 1 2170 1 144 GLN HA 1 146 HIS H . . 5.100 4.937 4.744 5.111 0.011 3 0 "[ . 1 . 2]" 1 2171 1 144 GLN HA 1 147 GLY H . . 4.970 3.594 3.415 4.661 . 0 0 "[ . 1 . 2]" 1 2172 1 144 GLN QB 1 145 LEU H . . 4.020 2.822 2.745 2.997 . 0 0 "[ . 1 . 2]" 1 2173 1 144 GLN QB 1 145 LEU HA . . 5.540 4.302 4.277 4.411 . 0 0 "[ . 1 . 2]" 1 2174 1 144 GLN QB 1 146 HIS H . . 6.380 5.086 4.975 5.297 . 0 0 "[ . 1 . 2]" 1 2175 1 144 GLN QG 1 145 LEU H . . 5.050 3.810 3.650 4.071 . 0 0 "[ . 1 . 2]" 1 2176 1 144 GLN QG 1 147 GLY QA . . 7.260 4.834 4.514 5.473 . 0 0 "[ . 1 . 2]" 1 2177 1 144 GLN HG2 1 145 LEU H . . 5.280 3.942 3.764 4.248 . 0 0 "[ . 1 . 2]" 1 2178 1 144 GLN HG2 1 145 LEU HA . . 5.500 3.726 3.546 4.069 . 0 0 "[ . 1 . 2]" 1 2179 1 144 GLN HG3 1 145 LEU H . . 5.280 5.049 4.912 5.216 . 0 0 "[ . 1 . 2]" 1 2180 1 144 GLN HG3 1 145 LEU HA . . 5.500 5.382 5.215 5.508 0.008 3 0 "[ . 1 . 2]" 1 2181 1 145 LEU H 1 145 LEU HB2 . . 3.110 2.312 2.152 2.861 . 0 0 "[ . 1 . 2]" 1 2182 1 145 LEU H 1 145 LEU HB3 . . 2.830 2.699 2.168 2.860 0.030 9 0 "[ . 1 . 2]" 1 2183 1 145 LEU H 1 145 LEU HG . . 4.170 4.178 4.151 4.208 0.038 9 0 "[ . 1 . 2]" 1 2184 1 145 LEU H 1 146 HIS H . . 2.830 2.586 2.511 2.705 . 0 0 "[ . 1 . 2]" 1 2185 1 145 LEU H 1 147 GLY H . . 4.350 3.572 3.365 3.974 . 0 0 "[ . 1 . 2]" 1 2186 1 145 LEU HB2 1 146 HIS H . . 3.950 3.554 3.362 3.968 0.018 1 0 "[ . 1 . 2]" 1 2187 1 145 LEU HB3 1 146 HIS H . . 3.330 2.491 2.316 2.590 . 0 0 "[ . 1 . 2]" 1 2188 1 145 LEU HG 1 146 HIS H . . 5.500 4.556 3.008 5.032 . 0 0 "[ . 1 . 2]" 1 2189 1 146 HIS H 1 146 HIS HA . . 2.870 2.807 2.793 2.864 . 0 0 "[ . 1 . 2]" 1 2190 1 146 HIS H 1 146 HIS HB2 . . 3.360 2.205 2.048 3.478 0.118 3 0 "[ . 1 . 2]" 1 2191 1 146 HIS H 1 146 HIS QB . . 3.120 2.058 2.031 2.172 . 0 0 "[ . 1 . 2]" 1 2192 1 146 HIS H 1 146 HIS HB3 . . 3.360 3.248 2.160 3.405 0.045 18 0 "[ . 1 . 2]" 1 2193 1 146 HIS H 1 146 HIS HD2 . . 5.500 3.480 3.082 3.861 . 0 0 "[ . 1 . 2]" 1 2194 1 146 HIS H 1 147 GLY H . . 2.590 2.574 2.492 2.604 0.014 17 0 "[ . 1 . 2]" 1 2195 1 146 HIS H 1 147 GLY QA . . 5.170 4.392 4.243 4.445 . 0 0 "[ . 1 . 2]" 1 2196 1 146 HIS HA 1 146 HIS HB2 . . 3.020 2.875 2.239 2.968 . 0 0 "[ . 1 . 2]" 1 2197 1 146 HIS HA 1 146 HIS HB3 . . 3.020 2.747 2.689 2.770 . 0 0 "[ . 1 . 2]" 1 2198 1 146 HIS HA 1 147 GLY H . . 3.550 3.540 3.381 3.640 0.090 3 0 "[ . 1 . 2]" 1 2199 1 146 HIS QB 1 147 GLY H . . 5.020 3.037 2.836 3.789 . 0 0 "[ . 1 . 2]" 1 2200 1 146 HIS HB2 1 147 GLY H . . 5.500 3.328 3.061 4.566 . 0 0 "[ . 1 . 2]" 1 2201 1 146 HIS HB3 1 147 GLY H . . 5.500 3.545 3.328 4.047 . 0 0 "[ . 1 . 2]" 1 2202 1 147 GLY H 1 148 ALA H . . 3.080 2.969 2.847 3.090 0.010 19 0 "[ . 1 . 2]" 1 2203 1 148 ALA H 1 148 ALA HA . . 2.770 2.647 2.212 2.820 0.050 3 0 "[ . 1 . 2]" 1 2204 1 148 ALA H 1 148 ALA MB . . 3.430 2.449 1.989 2.893 . 0 0 "[ . 1 . 2]" 1 stop_ save_
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