NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
646666 | 6uyi | 28042 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_6uyi 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 4832 _Distance_constraint_stats_list.Viol_count 9350 _Distance_constraint_stats_list.Viol_total 16968.295 _Distance_constraint_stats_list.Viol_max 0.498 _Distance_constraint_stats_list.Viol_rms 0.0522 _Distance_constraint_stats_list.Viol_average_all_restraints 0.0156 _Distance_constraint_stats_list.Viol_average_violations_only 0.1210 _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 21.564 0.420 13 0 "[ . 1 .]" 1 2 GLN 24.823 0.420 13 0 "[ . 1 .]" 1 3 ILE 19.501 0.340 11 0 "[ . 1 .]" 1 4 PHE 9.131 0.326 7 0 "[ . 1 .]" 1 5 VAL 13.395 0.261 15 0 "[ . 1 .]" 1 6 LYS 10.978 0.347 5 0 "[ . 1 .]" 1 7 THR 2.992 0.217 8 0 "[ . 1 .]" 1 8 LEU 10.285 0.220 6 0 "[ . 1 .]" 1 9 THR 2.560 0.220 6 0 "[ . 1 .]" 1 10 GLY 0.455 0.134 7 0 "[ . 1 .]" 1 11 LYS 2.945 0.377 14 0 "[ . 1 .]" 1 12 THR 13.653 0.347 5 0 "[ . 1 .]" 1 13 ILE 13.585 0.261 15 0 "[ . 1 .]" 1 14 THR 12.574 0.389 13 0 "[ . 1 .]" 1 15 LEU 8.126 0.271 9 0 "[ . 1 .]" 1 16 GLU 11.174 0.377 11 0 "[ . 1 .]" 1 17 VAL 24.277 0.359 12 0 "[ . 1 .]" 1 18 GLU 4.481 0.298 13 0 "[ . 1 .]" 1 19 PRO 8.899 0.317 2 0 "[ . 1 .]" 1 20 SER 0.706 0.104 6 0 "[ . 1 .]" 1 21 ASP 0.000 0.000 . 0 "[ . 1 .]" 1 22 THR 2.123 0.144 9 0 "[ . 1 .]" 1 23 ILE 4.025 0.297 9 0 "[ . 1 .]" 1 24 GLU 0.419 0.112 6 0 "[ . 1 .]" 1 25 ASN 4.720 0.318 13 0 "[ . 1 .]" 1 26 VAL 9.126 0.318 13 0 "[ . 1 .]" 1 27 LYS 2.021 0.183 8 0 "[ . 1 .]" 1 28 ALA 8.782 0.411 7 0 "[ . 1 .]" 1 29 LYS 7.948 0.266 3 0 "[ . 1 .]" 1 30 ILE 22.278 0.411 7 0 "[ . 1 .]" 1 31 GLN 4.394 0.318 1 0 "[ . 1 .]" 1 32 ASP 0.451 0.217 9 0 "[ . 1 .]" 1 33 LYS 6.051 0.325 2 0 "[ . 1 .]" 1 34 GLU 6.309 0.354 10 0 "[ . 1 .]" 1 35 GLY 0.037 0.020 15 0 "[ . 1 .]" 1 36 ILE 22.738 0.467 10 0 "[ . 1 .]" 1 37 PRO 4.852 0.467 10 0 "[ . 1 .]" 1 38 PRO 5.146 0.464 6 0 "[ . 1 .]" 1 39 ASP 0.000 0.000 . 0 "[ . 1 .]" 1 40 GLN 4.309 0.283 12 0 "[ . 1 .]" 1 41 GLN 2.918 0.282 4 0 "[ . 1 .]" 1 42 ARG 0.646 0.149 13 0 "[ . 1 .]" 1 43 LEU 8.162 0.369 7 0 "[ . 1 .]" 1 44 ILE 3.035 0.149 13 0 "[ . 1 .]" 1 45 PHE 1.971 0.135 6 0 "[ . 1 .]" 1 46 ALA 0.104 0.075 2 0 "[ . 1 .]" 1 47 GLY 2.622 0.267 3 0 "[ . 1 .]" 1 48 LYS 12.338 0.498 12 0 "[ . 1 .]" 1 49 GLN 5.376 0.283 4 0 "[ . 1 .]" 1 50 LEU 1.197 0.155 13 0 "[ . 1 .]" 1 51 GLU 0.576 0.260 11 0 "[ . 1 .]" 1 52 ASP 1.520 0.297 9 0 "[ . 1 .]" 1 54 ARG 9.260 0.416 11 0 "[ . 1 .]" 1 55 THR 2.829 0.144 9 0 "[ . 1 .]" 1 56 LEU 6.355 0.209 13 0 "[ . 1 .]" 1 57 SER 1.244 0.158 13 0 "[ . 1 .]" 1 58 ASP 5.559 0.310 11 0 "[ . 1 .]" 1 59 TYR 20.938 0.416 11 0 "[ . 1 .]" 1 60 ASN 2.215 0.211 11 0 "[ . 1 .]" 1 61 ILE 13.386 0.283 12 0 "[ . 1 .]" 1 62 GLN 0.438 0.279 2 0 "[ . 1 .]" 1 63 LYS 15.262 0.298 2 0 "[ . 1 .]" 1 64 GLU 11.177 0.416 2 0 "[ . 1 .]" 1 65 SER 4.175 0.255 2 0 "[ . 1 .]" 1 66 THR 8.469 0.221 6 0 "[ . 1 .]" 1 67 LEU 1.604 0.186 9 0 "[ . 1 .]" 1 69 LEU 6.378 0.268 5 0 "[ . 1 .]" 1 70 VAL 10.623 0.315 12 0 "[ . 1 .]" 1 71 LEU 8.184 0.313 5 0 "[ . 1 .]" 1 72 ARG 1.305 0.261 5 0 "[ . 1 .]" 1 73 LEU 0.075 0.039 10 0 "[ . 1 .]" 1 74 ARG 1.249 0.274 12 0 "[ . 1 .]" 1 75 GLY 0.060 0.035 5 0 "[ . 1 .]" 1 77 ASP 0.000 0.000 . 0 "[ . 1 .]" 2 1 MET 21.300 0.356 1 0 "[ . 1 .]" 2 2 GLN 24.561 0.407 2 0 "[ . 1 .]" 2 3 ILE 20.582 0.315 13 0 "[ . 1 .]" 2 4 PHE 6.705 0.336 12 0 "[ . 1 .]" 2 5 VAL 18.823 0.321 3 0 "[ . 1 .]" 2 6 LYS 10.379 0.348 8 0 "[ . 1 .]" 2 7 THR 2.190 0.215 3 0 "[ . 1 .]" 2 8 LEU 9.190 0.276 5 0 "[ . 1 .]" 2 9 THR 3.298 0.276 5 0 "[ . 1 .]" 2 10 GLY 0.752 0.099 8 0 "[ . 1 .]" 2 11 LYS 2.631 0.383 8 0 "[ . 1 .]" 2 12 THR 12.632 0.348 8 0 "[ . 1 .]" 2 13 ILE 16.628 0.352 12 0 "[ . 1 .]" 2 14 THR 13.020 0.356 14 0 "[ . 1 .]" 2 15 LEU 5.918 0.187 2 0 "[ . 1 .]" 2 16 GLU 10.571 0.407 2 0 "[ . 1 .]" 2 17 VAL 22.051 0.380 3 0 "[ . 1 .]" 2 18 GLU 5.060 0.299 9 0 "[ . 1 .]" 2 19 PRO 9.463 0.316 3 0 "[ . 1 .]" 2 20 SER 0.248 0.099 15 0 "[ . 1 .]" 2 21 ASP 0.000 0.000 . 0 "[ . 1 .]" 2 22 THR 3.491 0.193 1 0 "[ . 1 .]" 2 23 ILE 4.797 0.230 10 0 "[ . 1 .]" 2 24 GLU 0.354 0.137 14 0 "[ . 1 .]" 2 25 ASN 4.852 0.323 14 0 "[ . 1 .]" 2 26 VAL 9.277 0.323 14 0 "[ . 1 .]" 2 27 LYS 1.735 0.203 7 0 "[ . 1 .]" 2 28 ALA 8.938 0.435 9 0 "[ . 1 .]" 2 29 LYS 8.279 0.284 10 0 "[ . 1 .]" 2 30 ILE 22.793 0.435 9 0 "[ . 1 .]" 2 31 GLN 4.888 0.277 13 0 "[ . 1 .]" 2 32 ASP 0.000 0.000 . 0 "[ . 1 .]" 2 33 LYS 4.344 0.294 15 0 "[ . 1 .]" 2 34 GLU 4.970 0.352 12 0 "[ . 1 .]" 2 35 GLY 0.000 0.000 . 0 "[ . 1 .]" 2 36 ILE 20.103 0.373 7 0 "[ . 1 .]" 2 37 PRO 5.248 0.314 8 0 "[ . 1 .]" 2 38 PRO 5.089 0.473 3 0 "[ . 1 .]" 2 39 ASP 0.501 0.252 14 0 "[ . 1 .]" 2 40 GLN 3.087 0.293 3 0 "[ . 1 .]" 2 41 GLN 3.213 0.278 7 0 "[ . 1 .]" 2 42 ARG 0.446 0.153 15 0 "[ . 1 .]" 2 43 LEU 8.698 0.408 1 0 "[ . 1 .]" 2 44 ILE 1.152 0.274 15 0 "[ . 1 .]" 2 45 PHE 3.894 0.162 13 0 "[ . 1 .]" 2 48 ARG 1.999 0.228 9 0 "[ . 1 .]" 2 49 GLN 1.345 0.274 15 0 "[ . 1 .]" 2 50 LEU 0.939 0.132 2 0 "[ . 1 .]" 2 51 GLU 1.105 0.329 15 0 "[ . 1 .]" 2 52 ASP 0.897 0.180 15 0 "[ . 1 .]" 2 54 ARG 5.955 0.341 15 0 "[ . 1 .]" 2 55 THR 3.739 0.193 1 0 "[ . 1 .]" 2 56 LEU 8.324 0.233 5 0 "[ . 1 .]" 2 57 SER 1.514 0.179 5 0 "[ . 1 .]" 2 58 ASP 4.533 0.270 7 0 "[ . 1 .]" 2 59 TYR 18.792 0.341 15 0 "[ . 1 .]" 2 60 ASN 0.916 0.088 14 0 "[ . 1 .]" 2 61 ILE 16.589 0.314 7 0 "[ . 1 .]" 2 62 GLN 1.178 0.285 15 0 "[ . 1 .]" 2 63 LYS 14.627 0.346 1 0 "[ . 1 .]" 2 64 GLU 9.445 0.399 2 0 "[ . 1 .]" 2 65 SER 2.394 0.162 13 0 "[ . 1 .]" 2 66 THR 6.784 0.230 12 0 "[ . 1 .]" 2 67 LEU 2.003 0.238 3 0 "[ . 1 .]" 2 69 LEU 6.203 0.317 1 0 "[ . 1 .]" 2 70 VAL 2.755 0.261 1 0 "[ . 1 .]" 2 71 LEU 5.855 0.373 7 0 "[ . 1 .]" 2 72 ARG 0.021 0.009 7 0 "[ . 1 .]" 2 73 LEU 11.198 0.389 10 0 "[ . 1 .]" 2 74 ARG 1.287 0.316 7 0 "[ . 1 .]" 2 75 GLY 1.844 0.389 10 0 "[ . 1 .]" 2 76 GLY 0.000 0.000 . 0 "[ . 1 .]" 3 24 ASN 0.496 0.134 14 0 "[ . 1 .]" 3 25 LYS 3.773 0.173 10 0 "[ . 1 .]" 3 26 TYR 9.908 0.269 9 0 "[ . 1 .]" 3 27 LEU 12.634 0.363 11 0 "[ . 1 .]" 3 28 VAL 18.923 0.332 14 0 "[ . 1 .]" 3 29 GLU 9.050 0.257 13 0 "[ . 1 .]" 3 30 PHE 18.436 0.230 10 0 "[ . 1 .]" 3 31 ARG 2.198 0.160 7 0 "[ . 1 .]" 3 32 ALA 14.514 0.339 1 0 "[ . 1 .]" 3 33 GLY 2.254 0.160 7 0 "[ . 1 .]" 3 34 LYS 10.138 0.291 14 0 "[ . 1 .]" 3 35 MET 4.725 0.192 8 0 "[ . 1 .]" 3 36 SER 8.140 0.360 8 0 "[ . 1 .]" 3 37 LEU 8.086 0.360 8 0 "[ . 1 .]" 3 38 LYS 4.545 0.227 14 0 "[ . 1 .]" 3 39 GLY 0.041 0.036 8 0 "[ . 1 .]" 3 40 THR 3.636 0.155 7 0 "[ . 1 .]" 3 41 THR 0.483 0.130 2 0 "[ . 1 .]" 3 42 VAL 1.992 0.113 9 0 "[ . 1 .]" 3 43 THR 7.955 0.344 5 0 "[ . 1 .]" 3 44 PRO 0.674 0.113 8 0 "[ . 1 .]" 3 45 ASP 1.359 0.272 6 0 "[ . 1 .]" 3 46 LYS 4.710 0.263 13 0 "[ . 1 .]" 3 47 ARG 6.018 0.396 12 0 "[ . 1 .]" 3 48 LYS 2.477 0.276 15 0 "[ . 1 .]" 3 49 GLY 2.273 0.266 13 0 "[ . 1 .]" 3 50 LEU 16.787 0.320 2 0 "[ . 1 .]" 3 51 VAL 9.303 0.191 9 0 "[ . 1 .]" 3 52 TYR 21.798 0.297 13 0 "[ . 1 .]" 3 53 ILE 45.068 0.363 11 0 "[ . 1 .]" 3 54 GLN 15.705 0.377 8 0 "[ . 1 .]" 3 55 GLN 17.273 0.393 6 0 "[ . 1 .]" 3 56 THR 26.362 0.399 11 0 "[ . 1 .]" 3 57 ASP 2.776 0.109 5 0 "[ . 1 .]" 3 58 ASP 11.829 0.399 11 0 "[ . 1 .]" 3 59 SER 13.450 0.351 8 0 "[ . 1 .]" 3 60 LEU 21.365 0.282 14 0 "[ . 1 .]" 3 61 ILE 35.326 0.365 3 0 "[ . 1 .]" 3 62 HIS 27.485 0.377 8 0 "[ . 1 .]" 3 63 PHE 14.812 0.251 9 0 "[ . 1 .]" 3 64 CYS 7.190 0.297 13 0 "[ . 1 .]" 3 65 TRP 26.902 0.396 12 0 "[ . 1 .]" 3 66 LYS 18.930 0.320 2 0 "[ . 1 .]" 3 67 ASP 4.736 0.245 5 0 "[ . 1 .]" 3 68 ARG 10.813 0.264 12 0 "[ . 1 .]" 3 69 THR 11.732 0.213 7 0 "[ . 1 .]" 3 70 SER 7.410 0.376 12 0 "[ . 1 .]" 3 71 GLY 13.717 0.376 12 0 "[ . 1 .]" 3 72 ASN 4.455 0.208 3 0 "[ . 1 .]" 3 73 VAL 6.700 0.258 5 0 "[ . 1 .]" 3 74 GLU 3.742 0.270 6 0 "[ . 1 .]" 3 75 ASP 8.910 0.331 3 0 "[ . 1 .]" 3 76 ASP 3.979 0.214 2 0 "[ . 1 .]" 3 77 LEU 17.557 0.419 12 0 "[ . 1 .]" 3 78 ILE 32.649 0.419 12 0 "[ . 1 .]" 3 79 ILE 22.074 0.498 12 0 "[ . 1 .]" 3 80 PHE 8.113 0.276 6 0 "[ . 1 .]" 3 81 PRO 1.757 0.166 9 0 "[ . 1 .]" 3 82 ASP 1.649 0.166 9 0 "[ . 1 .]" 3 83 ASP 5.100 0.290 10 0 "[ . 1 .]" 3 84 CYS 8.323 0.390 7 0 "[ . 1 .]" 3 85 GLU 19.567 0.326 4 0 "[ . 1 .]" 3 86 PHE 14.874 0.270 10 0 "[ . 1 .]" 3 87 LYS 12.109 0.258 7 0 "[ . 1 .]" 3 88 ARG 1.980 0.143 3 0 "[ . 1 .]" 3 89 VAL 3.762 0.185 5 0 "[ . 1 .]" 3 90 PRO 0.000 0.000 . 0 "[ . 1 .]" 3 91 GLN 3.419 0.194 3 0 "[ . 1 .]" 3 92 CYS 5.335 0.213 6 0 "[ . 1 .]" 3 93 PRO 0.000 0.000 . 0 "[ . 1 .]" 3 94 SER 0.168 0.050 6 0 "[ . 1 .]" 3 95 GLY 3.264 0.213 6 0 "[ . 1 .]" 3 96 ARG 0.857 0.177 10 0 "[ . 1 .]" 3 97 VAL 6.323 0.278 5 0 "[ . 1 .]" 3 98 TYR 1.856 0.174 14 0 "[ . 1 .]" 3 99 VAL 10.039 0.258 7 0 "[ . 1 .]" 3 100 LEU 7.752 0.259 6 0 "[ . 1 .]" 3 101 LYS 22.234 0.255 10 0 "[ . 1 .]" 3 102 PHE 18.166 0.313 10 0 "[ . 1 .]" 3 103 LYS 13.311 0.390 7 0 "[ . 1 .]" 3 104 ALA 12.181 0.267 9 0 "[ . 1 .]" 3 105 GLY 1.782 0.187 7 0 "[ . 1 .]" 3 106 SER 0.000 0.000 . 0 "[ . 1 .]" 3 107 LYS 6.764 0.334 8 0 "[ . 1 .]" 3 108 ARG 7.780 0.255 3 0 "[ . 1 .]" 3 109 LEU 4.838 0.221 14 0 "[ . 1 .]" 3 110 PHE 5.206 0.190 9 0 "[ . 1 .]" 3 111 PHE 25.188 0.339 1 0 "[ . 1 .]" 3 112 TRP 14.996 0.263 13 0 "[ . 1 .]" 3 113 MET 5.728 0.249 9 0 "[ . 1 .]" 3 114 GLN 4.745 0.233 9 0 "[ . 1 .]" 3 115 GLU 8.284 0.249 9 0 "[ . 1 .]" 3 116 PRO 4.265 0.290 6 0 "[ . 1 .]" 3 117 LYS 8.767 0.244 12 0 "[ . 1 .]" 3 118 THR 4.937 0.320 5 0 "[ . 1 .]" 3 119 ASP 5.452 0.244 12 0 "[ . 1 .]" 3 120 GLN 6.787 0.320 5 0 "[ . 1 .]" 3 121 ASP 3.136 0.292 7 0 "[ . 1 .]" 3 122 GLU 9.700 0.398 14 0 "[ . 1 .]" 3 123 GLU 14.620 0.399 1 0 "[ . 1 .]" 3 124 HIS 19.276 0.336 2 0 "[ . 1 .]" 3 125 CYS 17.430 0.398 14 0 "[ . 1 .]" 3 126 ARG 13.206 0.394 1 0 "[ . 1 .]" 3 127 LYS 7.207 0.272 6 0 "[ . 1 .]" 3 128 VAL 13.802 0.347 1 0 "[ . 1 .]" 3 129 ASN 10.163 0.352 3 0 "[ . 1 .]" 3 130 GLU 20.628 0.369 8 0 "[ . 1 .]" 3 131 TYR 2.064 0.182 6 0 "[ . 1 .]" 3 132 LEU 8.408 0.293 3 0 "[ . 1 .]" 3 133 ASN 9.106 0.321 13 0 "[ . 1 .]" 3 134 ASN 20.812 0.369 8 0 "[ . 1 .]" 3 135 PRO 2.050 0.248 11 0 "[ . 1 .]" 3 136 PRO 0.095 0.021 6 0 "[ . 1 .]" 4 5 GLN 0.586 0.121 5 0 "[ . 1 .]" 4 6 GLU 1.724 0.290 6 0 "[ . 1 .]" 4 7 PRO 4.013 0.233 9 0 "[ . 1 .]" 4 8 GLU 0.000 0.000 . 0 "[ . 1 .]" 4 9 PRO 0.279 0.062 10 0 "[ . 1 .]" 4 10 PRO 0.385 0.180 4 0 "[ . 1 .]" 4 11 GLU 0.145 0.050 6 0 "[ . 1 .]" 4 12 PRO 4.876 0.344 5 0 "[ . 1 .]" 4 13 PHE 4.269 0.219 1 0 "[ . 1 .]" 4 14 GLU 3.877 0.219 1 0 "[ . 1 .]" 4 15 TYR 14.974 0.290 4 0 "[ . 1 .]" 4 16 ILE 13.868 0.315 13 0 "[ . 1 .]" 4 17 ASP 4.430 0.239 6 0 "[ . 1 .]" 4 18 ASP 5.397 0.315 13 0 "[ . 1 .]" stop_ loop_ _Distance_constraint_stats.Restraint_ID _Distance_constraint_stats.Atom_1_entity_assembly_ID _Distance_constraint_stats.Atom_1_comp_index_ID _Distance_constraint_stats.Atom_1_comp_ID _Distance_constraint_stats.Atom_1_ID _Distance_constraint_stats.Atom_2_entity_assembly_ID _Distance_constraint_stats.Atom_2_comp_index_ID _Distance_constraint_stats.Atom_2_comp_ID _Distance_constraint_stats.Atom_2_ID _Distance_constraint_stats.Node_1_distance_val _Distance_constraint_stats.Node_1_distance_lower_bound_val _Distance_constraint_stats.Node_1_distance_upper_bound_val _Distance_constraint_stats.Distance_average _Distance_constraint_stats.Distance_minimum _Distance_constraint_stats.Distance_maximum _Distance_constraint_stats.Max_violation _Distance_constraint_stats.Max_violation_model_number _Distance_constraint_stats.Over_cutoff_violation_count _Distance_constraint_stats.Over_cutoff_viol_per_model _Distance_constraint_stats.Distance_constraint_stats_ID 1 3 24 ASN HA 3 24 ASN QB 2.500 . 3.000 2.371 2.297 2.525 . 0 0 "[ . 1 .]" 1 2 3 24 ASN HA 3 25 LYS HA 5.000 . 5.500 4.572 4.340 4.693 . 0 0 "[ . 1 .]" 1 3 3 24 ASN QB 3 25 LYS HA 5.000 . 5.500 4.401 4.222 4.607 . 0 0 "[ . 1 .]" 1 4 3 24 ASN QD 3 58 ASP H 5.000 . 5.500 5.380 4.941 5.532 0.032 3 0 "[ . 1 .]" 1 5 3 24 ASN HA 3 25 LYS H 3.000 . 3.500 2.629 2.158 3.037 . 0 0 "[ . 1 .]" 1 6 3 24 ASN HA 3 24 ASN QD 4.000 . 4.500 2.917 2.267 4.017 . 0 0 "[ . 1 .]" 1 7 3 24 ASN QB 3 25 LYS H 4.000 . 4.500 3.608 1.993 3.921 . 0 0 "[ . 1 .]" 1 8 3 24 ASN QB 3 24 ASN QD 2.500 . 3.000 2.412 2.230 2.532 . 0 0 "[ . 1 .]" 1 9 3 24 ASN QB 3 54 GLN QE 4.000 . 4.500 3.315 1.903 4.346 . 0 0 "[ . 1 .]" 1 10 3 25 LYS HA 3 25 LYS QB 2.500 . 3.000 2.304 2.184 2.393 . 0 0 "[ . 1 .]" 1 11 3 25 LYS HA 3 25 LYS QG 3.000 . 3.500 2.756 2.314 3.310 . 0 0 "[ . 1 .]" 1 12 3 25 LYS HA 3 25 LYS QE 5.000 . 5.500 4.657 3.915 5.606 0.106 15 0 "[ . 1 .]" 1 13 3 24 ASN HA 3 25 LYS QB 4.500 . 5.000 4.775 4.358 5.134 0.134 14 0 "[ . 1 .]" 1 14 3 24 ASN HA 3 25 LYS QG 4.500 . 5.000 4.272 3.697 4.796 . 0 0 "[ . 1 .]" 1 15 3 24 ASN HA 3 25 LYS QD 6.000 . 6.500 5.985 5.392 6.523 0.023 7 0 "[ . 1 .]" 1 16 3 24 ASN QB 3 25 LYS QG 5.000 . 5.500 4.573 3.953 5.321 . 0 0 "[ . 1 .]" 1 17 3 25 LYS QE 3 25 LYS QG 3.000 . 3.500 2.232 2.126 2.321 . 0 0 "[ . 1 .]" 1 18 3 25 LYS QB 3 25 LYS QE 4.000 . 4.500 2.962 2.009 3.650 . 0 0 "[ . 1 .]" 1 19 3 25 LYS H 3 26 TYR H 4.000 . 4.500 4.610 4.586 4.632 0.132 2 0 "[ . 1 .]" 1 20 3 25 LYS H 3 25 LYS HA 3.000 . 3.500 2.868 2.836 2.905 . 0 0 "[ . 1 .]" 1 21 3 25 LYS HA 3 26 TYR H 3.000 . 3.500 2.296 2.197 2.424 . 0 0 "[ . 1 .]" 1 22 3 25 LYS H 3 25 LYS QB 3.000 . 3.500 2.439 2.356 2.623 . 0 0 "[ . 1 .]" 1 23 3 25 LYS QB 3 26 TYR H 3.500 . 4.000 2.706 2.394 2.973 . 0 0 "[ . 1 .]" 1 24 3 25 LYS H 3 25 LYS QG 3.000 . 3.500 2.173 1.899 2.391 . 0 0 "[ . 1 .]" 1 25 3 25 LYS QG 3 26 TYR H 4.000 . 4.500 3.831 3.349 4.530 0.030 4 0 "[ . 1 .]" 1 26 3 25 LYS HA 3 26 TYR HA 5.000 . 5.500 4.355 4.326 4.374 . 0 0 "[ . 1 .]" 1 27 3 26 TYR HA 3 26 TYR QB 2.500 . 3.000 2.435 2.402 2.461 . 0 0 "[ . 1 .]" 1 28 3 26 TYR HA 3 26 TYR QE 4.000 . 4.500 4.242 4.224 4.272 . 0 0 "[ . 1 .]" 1 29 3 26 TYR HA 3 54 GLN QB 3.000 . 3.500 2.956 2.579 3.126 . 0 0 "[ . 1 .]" 1 30 3 26 TYR HA 3 27 LEU QD 5.000 . 5.500 4.218 3.996 4.383 . 0 0 "[ . 1 .]" 1 31 3 26 TYR QB 3 29 GLU QB 3.000 . 3.500 3.233 3.082 3.405 . 0 0 "[ . 1 .]" 1 32 3 26 TYR HA 3 26 TYR QD 3.000 . 3.500 2.107 1.961 2.245 . 0 0 "[ . 1 .]" 1 33 3 25 LYS HA 3 26 TYR QD 5.000 . 5.500 3.465 3.303 3.641 . 0 0 "[ . 1 .]" 1 34 3 26 TYR QD 3 29 GLU HA 5.000 . 5.500 4.879 4.792 5.054 . 0 0 "[ . 1 .]" 1 35 3 26 TYR QD 3 29 GLU QB 3.000 . 3.500 2.714 2.574 2.847 . 0 0 "[ . 1 .]" 1 36 3 26 TYR QD 3 29 GLU QG 4.000 . 4.500 3.645 3.320 3.955 . 0 0 "[ . 1 .]" 1 37 3 26 TYR QD 3 52 TYR QB 5.000 . 5.500 2.685 2.578 2.879 . 0 0 "[ . 1 .]" 1 38 3 26 TYR QD 3 52 TYR QD 4.000 . 4.500 3.230 3.063 3.410 . 0 0 "[ . 1 .]" 1 39 3 26 TYR QD 3 52 TYR QE 4.000 . 4.500 4.218 3.987 4.391 . 0 0 "[ . 1 .]" 1 40 3 26 TYR QD 3 54 GLN HA 4.000 . 4.500 3.237 2.811 3.540 . 0 0 "[ . 1 .]" 1 41 3 26 TYR QD 3 54 GLN QB 4.000 . 4.500 2.551 2.276 2.822 . 0 0 "[ . 1 .]" 1 42 3 26 TYR QD 3 50 LEU QD 4.000 . 4.500 4.092 3.914 4.241 . 0 0 "[ . 1 .]" 1 43 3 24 ASN HA 3 26 TYR QE 6.000 . 6.500 5.344 4.678 6.038 . 0 0 "[ . 1 .]" 1 44 3 24 ASN QB 3 26 TYR QE 5.000 . 5.500 3.901 3.256 4.537 . 0 0 "[ . 1 .]" 1 45 3 24 ASN QB 3 26 TYR QD 6.000 . 6.500 4.468 3.893 5.064 . 0 0 "[ . 1 .]" 1 46 3 25 LYS HA 3 26 TYR QE 6.000 . 6.500 4.953 4.670 5.146 . 0 0 "[ . 1 .]" 1 47 3 26 TYR QB 3 26 TYR QE 4.000 . 4.500 4.006 4.000 4.012 . 0 0 "[ . 1 .]" 1 48 3 26 TYR QE 3 29 GLU QB 4.000 . 4.500 4.353 4.071 4.563 0.063 10 0 "[ . 1 .]" 1 49 3 26 TYR QE 3 52 TYR QB 6.000 . 6.500 3.667 3.495 3.849 . 0 0 "[ . 1 .]" 1 50 3 26 TYR QE 3 52 TYR QD 4.000 . 4.500 3.387 3.274 3.488 . 0 0 "[ . 1 .]" 1 51 3 26 TYR QE 3 52 TYR QE 3.000 . 3.500 3.250 3.112 3.339 . 0 0 "[ . 1 .]" 1 52 3 26 TYR QE 3 54 GLN HA 5.000 . 5.500 4.707 4.448 4.939 . 0 0 "[ . 1 .]" 1 53 3 26 TYR QE 3 54 GLN QB 4.000 . 4.500 2.739 2.529 2.817 . 0 0 "[ . 1 .]" 1 54 3 26 TYR QE 3 50 LEU QD 4.000 . 4.500 4.051 3.755 4.171 . 0 0 "[ . 1 .]" 1 55 3 26 TYR H 3 27 LEU H 4.000 . 4.500 4.363 4.290 4.464 . 0 0 "[ . 1 .]" 1 56 3 26 TYR H 3 28 VAL H 5.000 . 5.500 5.698 5.615 5.769 0.269 9 0 "[ . 1 .]" 1 57 3 26 TYR HA 3 53 ILE H 4.000 . 4.500 4.550 4.435 4.632 0.132 12 0 "[ . 1 .]" 1 58 3 25 LYS H 3 26 TYR HA 5.000 . 5.500 5.400 5.307 5.518 0.018 12 0 "[ . 1 .]" 1 59 3 26 TYR H 3 26 TYR HA 3.000 . 3.500 2.919 2.897 2.941 . 0 0 "[ . 1 .]" 1 60 3 26 TYR HA 3 27 LEU H 3.000 . 3.500 2.104 2.062 2.125 . 0 0 "[ . 1 .]" 1 61 3 26 TYR HA 3 55 GLN H 4.000 . 4.500 3.881 3.725 4.037 . 0 0 "[ . 1 .]" 1 62 3 26 TYR HA 3 54 GLN H 5.000 . 5.500 4.599 4.503 4.697 . 0 0 "[ . 1 .]" 1 63 3 26 TYR HA 3 28 VAL H 3.500 . 4.000 3.727 3.656 3.801 . 0 0 "[ . 1 .]" 1 64 3 26 TYR QB 3 53 ILE H 4.000 . 4.500 3.651 3.249 4.006 . 0 0 "[ . 1 .]" 1 65 3 26 TYR H 3 26 TYR QB 3.000 . 3.500 2.298 2.223 2.379 . 0 0 "[ . 1 .]" 1 66 3 26 TYR QB 3 27 LEU H 3.000 . 3.500 3.355 3.149 3.511 0.011 9 0 "[ . 1 .]" 1 67 3 26 TYR QB 3 28 VAL H 3.000 . 3.500 3.116 2.885 3.305 . 0 0 "[ . 1 .]" 1 68 3 26 TYR QD 3 53 ILE H 4.000 . 4.500 4.637 4.581 4.739 0.239 7 0 "[ . 1 .]" 1 69 3 25 LYS H 3 26 TYR QD 5.000 . 5.500 4.777 4.479 5.091 . 0 0 "[ . 1 .]" 1 70 3 26 TYR H 3 26 TYR QD 3.000 . 3.500 2.824 2.682 3.028 . 0 0 "[ . 1 .]" 1 71 3 26 TYR QD 3 27 LEU H 4.000 . 4.500 4.069 3.932 4.194 . 0 0 "[ . 1 .]" 1 72 3 26 TYR QD 3 55 GLN H 4.000 . 4.500 4.544 4.259 4.622 0.122 9 0 "[ . 1 .]" 1 73 3 26 TYR QD 3 54 GLN H 5.000 . 5.500 5.266 4.925 5.444 . 0 0 "[ . 1 .]" 1 74 3 26 TYR QD 3 28 VAL H 4.500 . 5.000 4.880 4.831 4.938 . 0 0 "[ . 1 .]" 1 75 3 26 TYR QD 3 54 GLN QE 4.000 . 4.500 4.396 4.022 4.606 0.106 9 0 "[ . 1 .]" 1 76 3 26 TYR H 3 26 TYR QE 5.000 . 5.500 4.850 4.732 4.901 . 0 0 "[ . 1 .]" 1 77 3 26 TYR QE 3 27 LEU H 5.500 . 6.000 5.986 5.967 6.013 0.013 11 0 "[ . 1 .]" 1 78 3 26 TYR QE 3 55 GLN H 6.000 . 6.500 5.925 5.758 6.054 . 0 0 "[ . 1 .]" 1 79 3 26 TYR QE 3 54 GLN QE 4.000 . 4.500 3.139 2.702 3.402 . 0 0 "[ . 1 .]" 1 80 3 27 LEU HA 3 27 LEU HG 4.000 . 4.500 2.982 2.883 3.089 . 0 0 "[ . 1 .]" 1 81 3 27 LEU HA 3 27 LEU QD 3.000 . 3.500 2.071 2.001 2.110 . 0 0 "[ . 1 .]" 1 82 3 27 LEU QB 3 54 GLN HA 4.000 . 4.500 3.984 3.782 4.107 . 0 0 "[ . 1 .]" 1 83 3 27 LEU QB 3 53 ILE HB 4.000 . 4.500 2.340 2.227 2.446 . 0 0 "[ . 1 .]" 1 84 3 27 LEU QB 3 27 LEU QD 2.500 . 3.000 1.905 1.887 1.916 . 0 0 "[ . 1 .]" 1 85 3 27 LEU HG 3 53 ILE MG 4.000 . 4.500 3.070 2.880 3.197 . 0 0 "[ . 1 .]" 1 86 3 25 LYS HA 3 27 LEU QD 5.000 . 5.500 5.594 5.461 5.673 0.173 10 0 "[ . 1 .]" 1 87 3 25 LYS QB 3 27 LEU QD 5.000 . 5.500 3.847 3.421 4.666 . 0 0 "[ . 1 .]" 1 88 3 27 LEU QD 3 55 GLN QB 3.000 . 3.500 1.949 1.867 2.167 . 0 0 "[ . 1 .]" 1 89 3 27 LEU QD 3 61 ILE MD 3.000 . 3.500 1.863 1.818 1.935 . 0 0 "[ . 1 .]" 1 90 3 27 LEU H 3 55 GLN H 4.000 . 4.500 3.639 3.524 3.901 . 0 0 "[ . 1 .]" 1 91 3 27 LEU H 3 54 GLN H 5.000 . 5.500 4.289 4.228 4.331 . 0 0 "[ . 1 .]" 1 92 3 27 LEU H 3 28 VAL H 3.000 . 3.500 2.556 2.516 2.600 . 0 0 "[ . 1 .]" 1 93 3 27 LEU HA 3 53 ILE H 5.000 . 5.500 5.839 5.810 5.863 0.363 11 0 "[ . 1 .]" 1 94 3 26 TYR H 3 27 LEU HA 5.000 . 5.500 5.137 5.013 5.260 . 0 0 "[ . 1 .]" 1 95 3 27 LEU H 3 27 LEU HA 3.000 . 3.500 2.824 2.814 2.831 . 0 0 "[ . 1 .]" 1 96 3 27 LEU HA 3 55 GLN H 5.000 . 5.500 5.421 5.297 5.629 0.129 12 0 "[ . 1 .]" 1 97 3 27 LEU HA 3 28 VAL H 3.000 . 3.500 3.517 3.510 3.523 0.023 9 0 "[ . 1 .]" 1 98 3 27 LEU H 3 27 LEU HG 3.000 . 3.500 2.166 2.073 2.244 . 0 0 "[ . 1 .]" 1 99 3 27 LEU HG 3 55 GLN H 4.000 . 4.500 2.757 2.539 3.041 . 0 0 "[ . 1 .]" 1 100 3 27 LEU HG 3 28 VAL H 4.000 . 4.500 4.271 4.164 4.365 . 0 0 "[ . 1 .]" 1 101 3 27 LEU QB 3 53 ILE H 4.000 . 4.500 4.128 4.063 4.204 . 0 0 "[ . 1 .]" 1 102 3 27 LEU H 3 27 LEU QB 3.000 . 3.500 2.398 2.355 2.441 . 0 0 "[ . 1 .]" 1 103 3 27 LEU QB 3 54 GLN H 4.000 . 4.500 4.572 4.493 4.632 0.132 7 0 "[ . 1 .]" 1 104 3 27 LEU QB 3 28 VAL H 3.000 . 3.500 2.644 2.593 2.698 . 0 0 "[ . 1 .]" 1 105 3 27 LEU H 3 27 LEU QD 3.000 . 3.500 3.039 2.940 3.103 . 0 0 "[ . 1 .]" 1 106 3 27 LEU QD 3 55 GLN H 3.000 . 3.500 3.142 2.916 3.380 . 0 0 "[ . 1 .]" 1 107 3 27 LEU QD 3 28 VAL H 4.000 . 4.500 4.114 4.079 4.145 . 0 0 "[ . 1 .]" 1 108 3 27 LEU QD 3 55 GLN QE 4.000 . 4.500 3.534 3.374 3.724 . 0 0 "[ . 1 .]" 1 109 3 28 VAL HA 3 28 VAL HB 3.000 . 3.500 2.639 2.620 2.661 . 0 0 "[ . 1 .]" 1 110 3 28 VAL HA 3 28 VAL QG 3.000 . 3.500 2.073 2.027 2.105 . 0 0 "[ . 1 .]" 1 111 3 28 VAL QG 3 29 GLU QB 4.000 . 4.500 3.790 3.761 3.812 . 0 0 "[ . 1 .]" 1 112 3 28 VAL QG 3 29 GLU QG 4.000 . 4.500 3.473 3.419 3.527 . 0 0 "[ . 1 .]" 1 113 3 28 VAL QG 3 128 VAL QG 4.000 . 4.500 2.094 1.885 2.183 . 0 0 "[ . 1 .]" 1 114 3 28 VAL H 3 54 GLN H 5.000 . 5.500 5.155 5.131 5.191 . 0 0 "[ . 1 .]" 1 115 3 28 VAL HA 3 29 GLU H 3.000 . 3.500 2.367 2.358 2.378 . 0 0 "[ . 1 .]" 1 116 3 27 LEU H 3 28 VAL HA 5.000 . 5.500 5.143 5.109 5.173 . 0 0 "[ . 1 .]" 1 117 3 28 VAL H 3 28 VAL HA 3.000 . 3.500 2.946 2.940 2.952 . 0 0 "[ . 1 .]" 1 118 3 28 VAL HA 3 53 ILE H 4.000 . 4.500 4.350 4.321 4.384 . 0 0 "[ . 1 .]" 1 119 3 28 VAL HB 3 53 ILE H 4.000 . 4.500 4.170 4.128 4.225 . 0 0 "[ . 1 .]" 1 120 3 28 VAL HB 3 29 GLU H 4.000 . 4.500 3.962 3.922 3.997 . 0 0 "[ . 1 .]" 1 121 3 28 VAL H 3 28 VAL HB 3.000 . 3.500 3.138 3.096 3.168 . 0 0 "[ . 1 .]" 1 122 3 28 VAL QG 3 132 LEU H 6.000 . 6.500 5.669 5.548 5.865 . 0 0 "[ . 1 .]" 1 123 3 28 VAL QG 3 30 PHE H 3.000 . 3.500 3.682 3.645 3.709 0.209 6 0 "[ . 1 .]" 1 124 3 28 VAL QG 3 131 TYR H 6.000 . 6.500 5.028 4.942 5.172 . 0 0 "[ . 1 .]" 1 125 3 28 VAL QG 3 53 ILE H 3.000 . 3.500 1.938 1.922 1.967 . 0 0 "[ . 1 .]" 1 126 3 28 VAL QG 3 129 ASN H 5.000 . 5.500 5.141 5.038 5.268 . 0 0 "[ . 1 .]" 1 127 3 28 VAL QG 3 128 VAL H 3.000 . 3.500 3.186 3.048 3.420 . 0 0 "[ . 1 .]" 1 128 3 28 VAL QG 3 127 LYS H 4.000 . 4.500 4.029 3.894 4.220 . 0 0 "[ . 1 .]" 1 129 3 28 VAL QG 3 124 HIS H 4.000 . 4.500 4.790 4.738 4.832 0.332 14 0 "[ . 1 .]" 1 130 3 28 VAL QG 3 29 GLU H 3.000 . 3.500 1.904 1.854 1.971 . 0 0 "[ . 1 .]" 1 131 3 27 LEU H 3 28 VAL QG 4.000 . 4.500 4.477 4.434 4.503 0.003 14 0 "[ . 1 .]" 1 132 3 28 VAL H 3 28 VAL QG 3.000 . 3.500 2.573 2.535 2.619 . 0 0 "[ . 1 .]" 1 133 3 28 VAL QG 3 64 CYS H 6.000 . 6.500 5.363 5.280 5.455 . 0 0 "[ . 1 .]" 1 134 3 28 VAL QG 3 52 TYR H 6.000 . 6.500 4.390 4.327 4.429 . 0 0 "[ . 1 .]" 1 135 3 29 GLU HA 3 52 TYR HA 3.000 . 3.500 2.102 2.079 2.126 . 0 0 "[ . 1 .]" 1 136 3 29 GLU HA 3 52 TYR QB 4.000 . 4.500 2.374 2.272 2.436 . 0 0 "[ . 1 .]" 1 137 3 29 GLU HA 3 50 LEU QD 4.000 . 4.500 3.464 3.291 3.746 . 0 0 "[ . 1 .]" 1 138 3 28 VAL QG 3 29 GLU HA 4.000 . 4.500 2.869 2.846 2.898 . 0 0 "[ . 1 .]" 1 139 3 29 GLU QB 3 52 TYR HA 3.000 . 3.500 3.229 3.174 3.289 . 0 0 "[ . 1 .]" 1 140 3 29 GLU QB 3 52 TYR QB 3.000 . 3.500 1.944 1.911 1.970 . 0 0 "[ . 1 .]" 1 141 3 29 GLU QB 3 50 LEU HG 4.000 . 4.500 3.773 3.622 3.940 . 0 0 "[ . 1 .]" 1 142 3 29 GLU QB 3 50 LEU QD 3.000 . 3.500 2.570 2.395 2.792 . 0 0 "[ . 1 .]" 1 143 3 29 GLU QG 3 52 TYR QB 5.000 . 5.500 3.515 3.398 3.666 . 0 0 "[ . 1 .]" 1 144 3 29 GLU QG 3 50 LEU QD 4.000 . 4.500 4.234 4.031 4.439 . 0 0 "[ . 1 .]" 1 145 3 29 GLU H 3 53 ILE H 5.000 . 5.500 4.604 4.586 4.648 . 0 0 "[ . 1 .]" 1 146 3 28 VAL H 3 29 GLU H 4.000 . 4.500 4.396 4.385 4.406 . 0 0 "[ . 1 .]" 1 147 3 29 GLU HA 3 30 PHE H 2.500 . 3.000 2.096 2.088 2.107 . 0 0 "[ . 1 .]" 1 148 3 29 GLU HA 3 53 ILE H 4.000 . 4.500 3.796 3.779 3.834 . 0 0 "[ . 1 .]" 1 149 3 29 GLU HA 3 52 TYR H 4.000 . 4.500 4.319 4.276 4.354 . 0 0 "[ . 1 .]" 1 150 3 29 GLU H 3 29 GLU HA 3.000 . 3.500 2.831 2.823 2.837 . 0 0 "[ . 1 .]" 1 151 3 29 GLU HA 3 51 VAL H 4.000 . 4.500 4.652 4.599 4.691 0.191 9 0 "[ . 1 .]" 1 152 3 28 VAL H 3 29 GLU HA 5.000 . 5.500 4.969 4.951 4.988 . 0 0 "[ . 1 .]" 1 153 3 29 GLU QG 3 30 PHE H 4.000 . 4.500 4.429 4.369 4.479 . 0 0 "[ . 1 .]" 1 154 3 29 GLU QG 3 53 ILE H 5.000 . 5.500 4.407 4.301 4.528 . 0 0 "[ . 1 .]" 1 155 3 29 GLU H 3 29 GLU QG 3.000 . 3.500 2.501 2.439 2.567 . 0 0 "[ . 1 .]" 1 156 3 26 TYR H 3 29 GLU QG 5.000 . 5.500 5.540 5.402 5.618 0.118 9 0 "[ . 1 .]" 1 157 3 27 LEU H 3 29 GLU QG 5.000 . 5.500 5.458 5.317 5.563 0.063 3 0 "[ . 1 .]" 1 158 3 28 VAL H 3 29 GLU QG 4.000 . 4.500 3.905 3.814 4.016 . 0 0 "[ . 1 .]" 1 159 3 29 GLU QB 3 30 PHE H 3.000 . 3.500 3.274 3.263 3.289 . 0 0 "[ . 1 .]" 1 160 3 29 GLU QB 3 53 ILE H 4.000 . 4.500 3.910 3.809 3.969 . 0 0 "[ . 1 .]" 1 161 3 29 GLU QB 3 52 TYR H 6.000 . 6.500 4.987 4.926 5.033 . 0 0 "[ . 1 .]" 1 162 3 29 GLU H 3 29 GLU QB 3.000 . 3.500 3.420 3.412 3.427 . 0 0 "[ . 1 .]" 1 163 3 29 GLU QB 3 51 VAL H 5.000 . 5.500 5.463 5.411 5.503 0.003 5 0 "[ . 1 .]" 1 164 3 28 VAL H 3 29 GLU QB 5.000 . 5.500 4.578 4.481 4.647 . 0 0 "[ . 1 .]" 1 165 3 30 PHE HA 3 30 PHE QB 2.500 . 3.000 2.178 2.174 2.181 . 0 0 "[ . 1 .]" 1 166 3 30 PHE HA 3 50 LEU QD 3.000 . 3.500 2.873 2.700 3.095 . 0 0 "[ . 1 .]" 1 167 3 30 PHE HZ 3 113 MET ME 4.000 . 4.500 4.128 3.729 4.376 . 0 0 "[ . 1 .]" 1 168 3 28 VAL HA 3 30 PHE QD 6.000 . 6.500 4.883 4.857 4.920 . 0 0 "[ . 1 .]" 1 169 3 29 GLU HA 3 30 PHE QD 5.000 . 5.500 3.567 3.493 3.629 . 0 0 "[ . 1 .]" 1 170 3 30 PHE HA 3 30 PHE QD 4.000 . 4.500 3.696 3.689 3.707 . 0 0 "[ . 1 .]" 1 171 3 30 PHE QD 3 32 ALA MB 3.000 . 3.500 2.591 2.324 2.734 . 0 0 "[ . 1 .]" 1 172 3 30 PHE QD 3 113 MET ME 4.000 . 4.500 2.598 2.132 3.598 . 0 0 "[ . 1 .]" 1 173 3 30 PHE QD 3 124 HIS HA 6.000 . 6.500 4.053 3.865 4.240 . 0 0 "[ . 1 .]" 1 174 3 30 PHE QD 3 51 VAL HB 4.000 . 4.500 3.588 3.541 3.652 . 0 0 "[ . 1 .]" 1 175 3 30 PHE QD 3 51 VAL QG 3.000 . 3.500 3.606 3.557 3.670 0.170 1 0 "[ . 1 .]" 1 176 3 28 VAL QG 3 30 PHE QD 3.000 . 3.500 2.169 2.102 2.245 . 0 0 "[ . 1 .]" 1 177 3 30 PHE QD 3 128 VAL QG 3.000 . 3.500 3.579 3.520 3.678 0.178 9 0 "[ . 1 .]" 1 178 3 30 PHE QD 3 124 HIS HE1 5.000 . 5.500 4.982 4.658 5.282 . 0 0 "[ . 1 .]" 1 179 3 30 PHE HA 3 30 PHE QE 5.000 . 5.500 5.600 5.590 5.615 0.115 11 0 "[ . 1 .]" 1 180 3 30 PHE QE 3 32 ALA MB 3.000 . 3.500 2.005 1.903 2.164 . 0 0 "[ . 1 .]" 1 181 3 30 PHE QE 3 113 MET ME 4.000 . 4.500 3.021 2.546 3.412 . 0 0 "[ . 1 .]" 1 182 3 30 PHE QE 3 51 VAL HB 4.000 . 4.500 2.834 2.780 2.906 . 0 0 "[ . 1 .]" 1 183 3 30 PHE QE 3 51 VAL QG 3.000 . 3.500 2.415 2.339 2.539 . 0 0 "[ . 1 .]" 1 184 3 28 VAL QG 3 30 PHE QE 3.000 . 3.500 2.477 2.415 2.519 . 0 0 "[ . 1 .]" 1 185 3 30 PHE QE 3 128 VAL QG 3.000 . 3.500 1.953 1.874 2.088 . 0 0 "[ . 1 .]" 1 186 3 30 PHE QE 3 53 ILE MD 4.000 . 4.500 4.300 4.219 4.410 . 0 0 "[ . 1 .]" 1 187 3 30 PHE HZ 3 51 VAL QG 4.000 . 4.500 2.326 2.243 2.403 . 0 0 "[ . 1 .]" 1 188 3 30 PHE H 3 53 ILE H 5.000 . 5.500 5.668 5.636 5.713 0.213 12 0 "[ . 1 .]" 1 189 3 30 PHE H 3 31 ARG H 4.000 . 4.500 4.383 4.347 4.398 . 0 0 "[ . 1 .]" 1 190 3 29 GLU H 3 30 PHE H 4.000 . 4.500 3.899 3.884 3.910 . 0 0 "[ . 1 .]" 1 191 3 30 PHE H 3 51 VAL H 3.000 . 3.500 3.125 3.072 3.195 . 0 0 "[ . 1 .]" 1 192 3 30 PHE H 3 30 PHE HA 3.000 . 3.500 2.900 2.895 2.906 . 0 0 "[ . 1 .]" 1 193 3 30 PHE HA 3 31 ARG H 3.000 . 3.500 2.346 2.289 2.374 . 0 0 "[ . 1 .]" 1 194 3 30 PHE H 3 30 PHE QB 3.000 . 3.500 3.246 3.237 3.255 . 0 0 "[ . 1 .]" 1 195 3 30 PHE QB 3 31 ARG H 3.000 . 3.500 2.561 2.494 2.714 . 0 0 "[ . 1 .]" 1 196 3 30 PHE H 3 30 PHE QD 4.000 . 4.500 3.017 2.965 3.059 . 0 0 "[ . 1 .]" 1 197 3 30 PHE QD 3 125 CYS H 6.000 . 6.500 5.750 5.526 5.952 . 0 0 "[ . 1 .]" 1 198 3 30 PHE QD 3 128 VAL H 6.000 . 6.500 5.870 5.796 6.036 . 0 0 "[ . 1 .]" 1 199 3 30 PHE QD 3 31 ARG H 4.000 . 4.500 3.520 3.434 3.665 . 0 0 "[ . 1 .]" 1 200 3 30 PHE QD 3 124 HIS H 5.000 . 5.500 5.627 5.578 5.659 0.159 8 0 "[ . 1 .]" 1 201 3 29 GLU H 3 30 PHE QD 4.000 . 4.500 2.978 2.929 3.031 . 0 0 "[ . 1 .]" 1 202 3 30 PHE QD 3 51 VAL H 4.000 . 4.500 4.016 3.935 4.125 . 0 0 "[ . 1 .]" 1 203 3 30 PHE QD 3 32 ALA H 5.000 . 5.500 4.288 4.202 4.430 . 0 0 "[ . 1 .]" 1 204 3 30 PHE H 3 30 PHE QE 4.000 . 4.500 4.279 4.240 4.315 . 0 0 "[ . 1 .]" 1 205 3 30 PHE QE 3 128 VAL H 4.000 . 4.500 4.639 4.567 4.730 0.230 10 0 "[ . 1 .]" 1 206 3 29 GLU H 3 30 PHE QE 4.000 . 4.500 4.646 4.593 4.682 0.182 9 0 "[ . 1 .]" 1 207 3 30 PHE QE 3 51 VAL H 5.000 . 5.500 4.313 4.218 4.418 . 0 0 "[ . 1 .]" 1 208 3 30 PHE QE 3 32 ALA H 5.000 . 5.500 5.025 4.904 5.205 . 0 0 "[ . 1 .]" 1 209 3 30 PHE QE 3 113 MET HA 5.000 . 5.500 4.097 3.870 4.400 . 0 0 "[ . 1 .]" 1 210 3 30 PHE QE 3 31 ARG H 6.000 . 6.500 5.705 5.631 5.826 . 0 0 "[ . 1 .]" 1 211 3 30 PHE QE 3 115 GLU H 6.000 . 6.500 6.589 6.542 6.645 0.145 9 0 "[ . 1 .]" 1 212 3 30 PHE QD 3 115 GLU H 5.000 . 5.500 5.031 4.908 5.112 . 0 0 "[ . 1 .]" 1 213 3 30 PHE QD 3 114 GLN H 6.000 . 6.500 4.262 4.114 4.414 . 0 0 "[ . 1 .]" 1 214 3 31 ARG HA 3 31 ARG QD 4.000 . 4.500 3.951 3.863 3.996 . 0 0 "[ . 1 .]" 1 215 3 31 ARG HA 3 50 LEU HA 3.000 . 3.500 2.369 2.227 2.578 . 0 0 "[ . 1 .]" 1 216 3 31 ARG QB 3 31 ARG QD 3.000 . 3.500 2.146 2.119 2.257 . 0 0 "[ . 1 .]" 1 217 3 30 PHE HA 3 31 ARG QG 4.000 . 4.500 3.707 3.548 3.805 . 0 0 "[ . 1 .]" 1 218 3 30 PHE QB 3 31 ARG QG 5.000 . 5.500 4.512 4.310 4.595 . 0 0 "[ . 1 .]" 1 219 3 31 ARG QG 3 50 LEU QD 3.000 . 3.500 2.055 1.926 2.171 . 0 0 "[ . 1 .]" 1 220 3 31 ARG H 3 115 GLU H 5.000 . 5.500 4.906 4.596 5.269 . 0 0 "[ . 1 .]" 1 221 3 31 ARG H 3 32 ALA H 4.000 . 4.500 4.479 4.445 4.512 0.012 1 0 "[ . 1 .]" 1 222 3 31 ARG HA 3 51 VAL H 4.000 . 4.500 3.575 3.452 3.682 . 0 0 "[ . 1 .]" 1 223 3 31 ARG HA 3 32 ALA H 2.500 . 3.000 2.133 2.124 2.148 . 0 0 "[ . 1 .]" 1 224 3 31 ARG QB 3 33 GLY H 5.000 . 5.500 5.586 5.501 5.660 0.160 7 0 "[ . 1 .]" 1 225 3 31 ARG H 3 31 ARG QB 3.000 . 3.500 2.366 2.306 2.460 . 0 0 "[ . 1 .]" 1 226 3 31 ARG QB 3 32 ALA H 3.000 . 3.500 3.310 3.240 3.388 . 0 0 "[ . 1 .]" 1 227 3 31 ARG H 3 31 ARG QG 4.000 . 4.500 2.353 2.161 2.520 . 0 0 "[ . 1 .]" 1 228 3 31 ARG QG 3 32 ALA H 4.000 . 4.500 4.061 3.934 4.196 . 0 0 "[ . 1 .]" 1 229 3 31 ARG HA 3 32 ALA MB 4.500 . 5.000 4.000 3.963 4.043 . 0 0 "[ . 1 .]" 1 230 3 31 ARG QB 3 115 GLU H 4.000 . 4.500 3.459 3.076 3.939 . 0 0 "[ . 1 .]" 1 231 3 31 ARG H 3 114 GLN H 5.000 2.800 5.500 4.871 4.672 5.031 . 0 0 "[ . 1 .]" 1 232 3 32 ALA HA 3 51 VAL QG 4.000 . 4.500 4.460 4.324 4.527 0.027 9 0 "[ . 1 .]" 1 233 3 32 ALA MB 3 33 GLY QA 5.000 . 5.500 3.806 3.776 3.855 . 0 0 "[ . 1 .]" 1 234 3 32 ALA MB 3 50 LEU HA 4.000 . 4.500 3.799 3.559 3.950 . 0 0 "[ . 1 .]" 1 235 3 32 ALA MB 3 111 PHE HA 4.000 . 4.500 4.291 4.147 4.400 . 0 0 "[ . 1 .]" 1 236 3 32 ALA MB 3 111 PHE QB 3.000 . 3.500 2.421 2.346 2.504 . 0 0 "[ . 1 .]" 1 237 3 32 ALA MB 3 51 VAL HB 4.000 . 4.500 2.601 2.491 2.705 . 0 0 "[ . 1 .]" 1 238 3 32 ALA MB 3 51 VAL QG 2.500 . 3.000 2.111 1.993 2.210 . 0 0 "[ . 1 .]" 1 239 3 31 ARG QD 3 32 ALA H 5.500 2.800 6.000 5.285 5.099 5.398 . 0 0 "[ . 1 .]" 1 240 3 32 ALA H 3 50 LEU HA 4.000 . 4.500 2.316 2.140 2.425 . 0 0 "[ . 1 .]" 1 241 3 32 ALA H 3 50 LEU H 4.000 . 4.500 4.242 4.071 4.445 . 0 0 "[ . 1 .]" 1 242 3 32 ALA H 3 51 VAL H 4.000 . 4.500 3.169 3.078 3.220 . 0 0 "[ . 1 .]" 1 243 3 32 ALA H 3 114 GLN H 5.000 . 5.500 4.508 4.251 4.737 . 0 0 "[ . 1 .]" 1 244 3 32 ALA H 3 65 TRP HE1 5.000 . 5.500 4.331 4.126 4.616 . 0 0 "[ . 1 .]" 1 245 3 31 ARG H 3 32 ALA HA 5.000 . 5.500 5.559 5.524 5.617 0.117 1 0 "[ . 1 .]" 1 246 3 32 ALA H 3 32 ALA HA 3.000 . 3.500 2.899 2.873 2.915 . 0 0 "[ . 1 .]" 1 247 3 32 ALA MB 3 33 GLY H 3.000 . 3.500 2.809 2.707 2.940 . 0 0 "[ . 1 .]" 1 248 3 30 PHE H 3 32 ALA MB 5.000 . 5.500 4.871 4.815 4.944 . 0 0 "[ . 1 .]" 1 249 3 32 ALA MB 3 112 TRP H 3.000 . 3.500 3.329 3.172 3.436 . 0 0 "[ . 1 .]" 1 250 3 32 ALA MB 3 111 PHE H 5.000 . 5.500 5.743 5.694 5.824 0.324 10 0 "[ . 1 .]" 1 251 3 32 ALA MB 3 113 MET H 5.000 . 5.500 4.370 4.133 4.619 . 0 0 "[ . 1 .]" 1 252 3 32 ALA MB 3 115 GLU H 4.500 . 5.000 5.155 5.061 5.224 0.224 13 0 "[ . 1 .]" 1 253 3 32 ALA MB 3 50 LEU H 5.000 . 5.500 5.147 4.973 5.297 . 0 0 "[ . 1 .]" 1 254 3 32 ALA MB 3 51 VAL H 4.000 . 4.500 2.887 2.709 3.064 . 0 0 "[ . 1 .]" 1 255 3 32 ALA H 3 32 ALA MB 3.000 . 3.500 2.696 2.668 2.736 . 0 0 "[ . 1 .]" 1 256 3 32 ALA MB 3 114 GLN H 4.000 . 4.500 3.602 3.517 3.669 . 0 0 "[ . 1 .]" 1 257 3 32 ALA MB 3 65 TRP HE1 4.000 . 4.500 3.657 3.500 3.781 . 0 0 "[ . 1 .]" 1 258 3 32 ALA HA 3 33 GLY H 2.500 . 3.000 2.212 2.190 2.226 . 0 0 "[ . 1 .]" 1 259 3 32 ALA HA 3 114 GLN H 3.500 . 4.000 2.631 2.419 2.826 . 0 0 "[ . 1 .]" 1 260 3 32 ALA HA 3 115 GLU H 4.500 . 5.000 4.801 4.600 4.970 . 0 0 "[ . 1 .]" 1 261 3 32 ALA HA 3 112 TRP H 5.000 . 5.500 4.295 4.203 4.374 . 0 0 "[ . 1 .]" 1 262 3 33 GLY H 3 112 TRP H 4.000 . 4.500 2.779 2.705 2.872 . 0 0 "[ . 1 .]" 1 263 3 33 GLY H 3 34 LYS H 4.000 . 4.500 4.514 4.499 4.539 0.039 13 0 "[ . 1 .]" 1 264 3 32 ALA H 3 33 GLY H 4.000 . 4.500 4.272 4.231 4.308 . 0 0 "[ . 1 .]" 1 265 3 33 GLY H 3 114 GLN H 4.500 . 5.000 4.334 4.059 4.558 . 0 0 "[ . 1 .]" 1 266 3 33 GLY H 3 65 TRP HE1 5.000 . 5.500 4.481 4.160 4.646 . 0 0 "[ . 1 .]" 1 267 3 33 GLY QA 3 49 GLY H 4.000 . 4.500 2.191 1.943 2.364 . 0 0 "[ . 1 .]" 1 268 3 33 GLY QA 3 34 LYS H 3.000 . 3.500 2.215 2.192 2.269 . 0 0 "[ . 1 .]" 1 269 3 33 GLY QA 3 112 TRP HE1 4.000 . 4.500 2.281 2.207 2.336 . 0 0 "[ . 1 .]" 1 270 3 33 GLY QA 3 65 TRP HE1 4.000 . 4.500 2.617 2.263 2.800 . 0 0 "[ . 1 .]" 1 271 3 33 GLY QA 3 50 LEU H 6.000 . 6.500 5.257 5.052 5.392 . 0 0 "[ . 1 .]" 1 272 3 33 GLY H 3 115 GLU H 6.000 . 6.500 6.506 6.317 6.641 0.141 10 0 "[ . 1 .]" 1 273 3 34 LYS HA 3 34 LYS QG 3.000 . 3.500 2.943 2.120 3.311 . 0 0 "[ . 1 .]" 1 274 3 34 LYS HA 3 34 LYS QD 4.000 . 4.500 4.231 3.593 4.463 . 0 0 "[ . 1 .]" 1 275 3 34 LYS HA 3 34 LYS QE 4.000 . 4.500 4.286 3.931 4.518 0.018 14 0 "[ . 1 .]" 1 276 3 34 LYS HA 3 111 PHE HA 3.000 . 3.500 2.471 2.312 2.610 . 0 0 "[ . 1 .]" 1 277 3 34 LYS QB 3 34 LYS QD 3.000 . 3.500 2.231 2.084 2.276 . 0 0 "[ . 1 .]" 1 278 3 34 LYS QB 3 34 LYS QE 3.000 . 3.500 2.059 2.003 2.249 . 0 0 "[ . 1 .]" 1 279 3 34 LYS QB 3 45 ASP HA 6.000 . 6.500 6.486 5.968 6.772 0.272 6 0 "[ . 1 .]" 1 280 3 34 LYS QB 3 45 ASP QB 4.000 . 4.500 3.784 3.179 4.106 . 0 0 "[ . 1 .]" 1 281 3 34 LYS QE 3 34 LYS QG 3.000 . 3.500 2.343 2.199 2.697 . 0 0 "[ . 1 .]" 1 282 3 34 LYS H 3 112 TRP H 5.000 . 5.500 4.978 4.900 5.100 . 0 0 "[ . 1 .]" 1 283 3 34 LYS H 3 45 ASP H 5.000 . 5.500 4.655 4.438 4.981 . 0 0 "[ . 1 .]" 1 284 3 34 LYS H 3 112 TRP HE1 4.000 . 4.500 3.549 3.401 3.630 . 0 0 "[ . 1 .]" 1 285 3 34 LYS H 3 65 TRP HE1 4.000 . 4.500 3.399 3.243 3.532 . 0 0 "[ . 1 .]" 1 286 3 34 LYS HA 3 35 MET H 3.000 . 3.500 2.443 2.344 2.540 . 0 0 "[ . 1 .]" 1 287 3 34 LYS HA 3 112 TRP H 4.000 . 4.500 3.881 3.725 4.059 . 0 0 "[ . 1 .]" 1 288 3 34 LYS HA 3 111 PHE H 4.500 . 5.000 5.007 4.874 5.098 0.098 9 0 "[ . 1 .]" 1 289 3 34 LYS HA 3 112 TRP HE1 4.000 . 4.500 4.584 4.517 4.657 0.157 13 0 "[ . 1 .]" 1 290 3 34 LYS HA 3 65 TRP HE1 4.000 . 4.500 4.509 4.223 4.690 0.190 10 0 "[ . 1 .]" 1 291 3 34 LYS QG 3 35 MET H 4.000 . 4.500 3.151 1.895 4.198 . 0 0 "[ . 1 .]" 1 292 3 34 LYS H 3 34 LYS QG 4.000 . 4.500 2.478 1.890 3.967 . 0 0 "[ . 1 .]" 1 293 3 34 LYS QG 3 65 TRP HE1 4.000 . 4.500 4.247 2.688 4.791 0.291 14 0 "[ . 1 .]" 1 294 3 34 LYS QE 3 35 MET H 5.500 . 6.000 4.414 3.820 4.741 . 0 0 "[ . 1 .]" 1 295 3 34 LYS H 3 34 LYS QE 4.000 . 4.500 4.225 3.855 4.561 0.061 4 0 "[ . 1 .]" 1 296 3 34 LYS QE 3 65 TRP HE1 5.000 . 5.500 5.038 4.048 5.563 0.063 6 0 "[ . 1 .]" 1 297 3 34 LYS QB 3 35 MET H 3.000 . 3.500 2.523 2.123 3.274 . 0 0 "[ . 1 .]" 1 298 3 34 LYS H 3 34 LYS QB 3.000 . 3.500 2.619 2.268 2.875 . 0 0 "[ . 1 .]" 1 299 3 35 MET HA 3 35 MET QG 3.000 . 3.500 2.633 2.595 2.705 . 0 0 "[ . 1 .]" 1 300 3 35 MET HA 3 35 MET ME 4.500 . 5.000 3.774 3.620 4.328 . 0 0 "[ . 1 .]" 1 301 3 35 MET HA 3 44 PRO HA 3.000 . 3.500 2.585 2.267 2.803 . 0 0 "[ . 1 .]" 1 302 3 35 MET HA 3 42 VAL QG 4.500 . 5.000 4.313 4.083 4.533 . 0 0 "[ . 1 .]" 1 303 3 35 MET QB 3 35 MET ME 4.000 . 4.500 2.034 2.002 2.154 . 0 0 "[ . 1 .]" 1 304 3 35 MET QB 3 44 PRO HA 4.000 . 4.500 2.318 2.018 2.491 . 0 0 "[ . 1 .]" 1 305 3 35 MET ME 3 35 MET QG 3.000 . 3.500 2.284 2.235 2.336 . 0 0 "[ . 1 .]" 1 306 3 35 MET QG 3 44 PRO HA 4.000 . 4.500 2.155 2.045 2.713 . 0 0 "[ . 1 .]" 1 307 3 35 MET ME 3 44 PRO HA 3.000 . 3.500 2.246 2.010 3.456 . 0 0 "[ . 1 .]" 1 308 3 35 MET ME 3 44 PRO QB 4.000 . 4.500 2.203 1.926 3.584 . 0 0 "[ . 1 .]" 1 309 3 35 MET ME 3 44 PRO QG 5.000 . 5.500 3.066 1.942 4.470 . 0 0 "[ . 1 .]" 1 310 3 35 MET ME 3 44 PRO QD 3.000 . 3.500 2.633 2.304 3.555 0.055 4 0 "[ . 1 .]" 1 311 3 35 MET ME 3 42 VAL QG 3.000 . 3.500 1.988 1.766 2.125 0.034 8 0 "[ . 1 .]" 1 312 3 35 MET H 3 112 TRP H 5.000 . 5.500 5.532 5.284 5.647 0.147 10 0 "[ . 1 .]" 1 313 3 34 LYS H 3 35 MET H 4.500 . 5.000 4.566 4.525 4.595 . 0 0 "[ . 1 .]" 1 314 3 35 MET H 3 111 PHE H 5.000 . 5.500 5.269 5.012 5.372 . 0 0 "[ . 1 .]" 1 315 3 35 MET H 3 110 PHE H 4.000 . 4.500 3.646 3.511 3.789 . 0 0 "[ . 1 .]" 1 316 3 35 MET H 3 45 ASP H 4.500 . 5.000 4.659 4.478 4.816 . 0 0 "[ . 1 .]" 1 317 3 35 MET HA 3 36 SER H 3.000 . 3.500 2.556 2.487 2.584 . 0 0 "[ . 1 .]" 1 318 3 35 MET H 3 35 MET HA 3.000 . 3.500 2.956 2.948 2.967 . 0 0 "[ . 1 .]" 1 319 3 35 MET HA 3 45 ASP H 3.000 . 3.500 2.469 2.297 2.658 . 0 0 "[ . 1 .]" 1 320 3 35 MET QB 3 36 SER H 3.000 . 3.500 2.357 2.283 2.632 . 0 0 "[ . 1 .]" 1 321 3 35 MET H 3 35 MET QB 3.500 . 4.000 2.863 2.772 2.921 . 0 0 "[ . 1 .]" 1 322 3 35 MET QB 3 112 TRP HE1 6.000 . 6.500 5.463 5.212 5.634 . 0 0 "[ . 1 .]" 1 323 3 35 MET QG 3 36 SER H 4.500 . 5.000 4.189 4.121 4.442 . 0 0 "[ . 1 .]" 1 324 3 35 MET H 3 35 MET QG 3.000 2.450 3.500 2.539 2.430 2.682 0.020 12 0 "[ . 1 .]" 1 325 3 35 MET QG 3 112 TRP H 4.000 . 4.500 3.647 3.448 3.795 . 0 0 "[ . 1 .]" 1 326 3 35 MET QG 3 112 TRP HE1 4.000 . 4.500 3.602 3.201 3.808 . 0 0 "[ . 1 .]" 1 327 3 35 MET ME 3 36 SER H 5.000 . 5.500 4.052 3.818 4.558 . 0 0 "[ . 1 .]" 1 328 3 35 MET ME 3 43 THR H 4.000 . 4.500 4.107 3.660 4.492 . 0 0 "[ . 1 .]" 1 329 3 35 MET ME 3 112 TRP HE1 5.000 . 5.500 5.038 4.751 5.654 0.154 8 0 "[ . 1 .]" 1 330 3 35 MET ME 3 42 VAL H 5.500 . 6.000 5.377 5.162 5.619 . 0 0 "[ . 1 .]" 1 331 3 35 MET QB 3 42 VAL MG1 3.000 . 3.500 2.231 2.076 2.399 . 0 0 "[ . 1 .]" 1 332 3 35 MET QB 3 42 VAL MG2 5.000 . 5.500 4.197 4.099 4.368 . 0 0 "[ . 1 .]" 1 333 3 36 SER HA 3 36 SER QB 2.500 . 3.000 2.385 2.378 2.396 . 0 0 "[ . 1 .]" 1 334 3 35 MET H 3 36 SER H 4.000 . 4.500 4.450 4.430 4.496 . 0 0 "[ . 1 .]" 1 335 3 36 SER H 3 43 THR H 3.000 . 3.500 2.787 2.664 2.939 . 0 0 "[ . 1 .]" 1 336 3 36 SER H 3 37 LEU H 4.000 . 4.500 4.298 4.249 4.412 . 0 0 "[ . 1 .]" 1 337 3 36 SER H 3 36 SER HA 3.000 . 3.500 2.957 2.953 2.963 . 0 0 "[ . 1 .]" 1 338 3 36 SER HA 3 37 LEU H 2.500 . 3.000 2.170 2.162 2.189 . 0 0 "[ . 1 .]" 1 339 3 36 SER H 3 36 SER QB 3.000 . 3.500 2.560 2.495 2.617 . 0 0 "[ . 1 .]" 1 340 3 36 SER QB 3 43 THR H 4.000 . 4.500 3.492 3.378 3.801 . 0 0 "[ . 1 .]" 1 341 3 36 SER QB 3 37 LEU H 3.000 . 3.500 3.254 3.034 3.342 . 0 0 "[ . 1 .]" 1 342 3 36 SER QB 3 42 VAL QG 6.000 . 6.500 4.560 4.393 4.776 . 0 0 "[ . 1 .]" 1 343 3 37 LEU HA 3 37 LEU QB 2.500 . 3.000 2.310 2.295 2.413 . 0 0 "[ . 1 .]" 1 344 3 37 LEU HA 3 42 VAL HA 2.500 . 3.000 2.232 2.165 2.290 . 0 0 "[ . 1 .]" 1 345 3 37 LEU HA 3 37 LEU HG 3.000 . 3.500 3.189 2.247 3.279 . 0 0 "[ . 1 .]" 1 346 3 37 LEU HA 3 42 VAL QG 3.000 . 3.500 2.861 2.746 3.076 . 0 0 "[ . 1 .]" 1 347 3 37 LEU HA 3 37 LEU QD 3.000 . 3.500 2.075 1.992 2.939 . 0 0 "[ . 1 .]" 1 348 3 37 LEU QB 3 42 VAL HA 4.000 . 4.500 3.330 3.196 3.428 . 0 0 "[ . 1 .]" 1 349 3 37 LEU QB 3 37 LEU HG 2.500 . 3.000 2.369 2.354 2.480 . 0 0 "[ . 1 .]" 1 350 3 37 LEU QB 3 42 VAL QG 3.000 . 3.500 2.143 2.039 2.771 . 0 0 "[ . 1 .]" 1 351 3 37 LEU HG 3 42 VAL QG 4.000 . 4.500 3.845 2.280 4.015 . 0 0 "[ . 1 .]" 1 352 3 37 LEU QD 3 38 LYS HA 4.000 . 4.500 3.723 3.092 3.920 . 0 0 "[ . 1 .]" 1 353 3 37 LEU QD 3 40 THR HB 4.000 . 4.500 4.391 4.284 4.484 . 0 0 "[ . 1 .]" 1 354 3 37 LEU H 3 38 LYS H 5.000 . 5.500 4.327 4.278 4.422 . 0 0 "[ . 1 .]" 1 355 3 36 SER H 3 37 LEU HA 4.000 . 4.500 4.749 4.702 4.860 0.360 8 0 "[ . 1 .]" 1 356 3 37 LEU HA 3 43 THR H 4.000 . 4.500 3.454 3.193 3.595 . 0 0 "[ . 1 .]" 1 357 3 37 LEU H 3 37 LEU HA 3.000 . 3.500 2.936 2.934 2.939 . 0 0 "[ . 1 .]" 1 358 3 37 LEU HA 3 38 LYS H 2.500 . 3.000 2.121 2.095 2.158 . 0 0 "[ . 1 .]" 1 359 3 37 LEU QB 3 110 PHE H 6.000 . 6.500 5.068 4.902 5.307 . 0 0 "[ . 1 .]" 1 360 3 37 LEU H 3 37 LEU QB 2.500 . 3.000 2.363 2.335 2.401 . 0 0 "[ . 1 .]" 1 361 3 37 LEU QB 3 38 LYS H 4.000 . 4.500 3.815 3.767 3.846 . 0 0 "[ . 1 .]" 1 362 3 37 LEU HG 3 40 THR H 5.000 . 5.500 5.213 4.815 5.592 0.092 4 0 "[ . 1 .]" 1 363 3 37 LEU H 3 37 LEU HG 4.000 . 4.500 4.274 4.228 4.490 . 0 0 "[ . 1 .]" 1 364 3 37 LEU HG 3 38 LYS H 3.000 . 3.500 3.395 2.875 3.509 0.009 2 0 "[ . 1 .]" 1 365 3 37 LEU QD 3 40 THR H 4.000 . 4.500 3.457 3.252 3.733 . 0 0 "[ . 1 .]" 1 366 3 37 LEU QD 3 43 THR H 5.000 . 5.500 4.345 4.148 4.965 . 0 0 "[ . 1 .]" 1 367 3 37 LEU QD 3 41 THR H 3.000 . 3.500 2.226 1.993 2.769 . 0 0 "[ . 1 .]" 1 368 3 37 LEU H 3 37 LEU QD 4.000 . 4.500 3.831 3.783 3.853 . 0 0 "[ . 1 .]" 1 369 3 37 LEU QD 3 38 LYS H 2.500 . 3.000 2.326 2.196 2.631 . 0 0 "[ . 1 .]" 1 370 3 37 LEU QD 3 42 VAL H 4.000 . 4.500 3.421 3.196 4.212 . 0 0 "[ . 1 .]" 1 371 3 37 LEU HA 3 42 VAL H 5.000 2.800 5.500 4.608 4.580 4.649 . 0 0 "[ . 1 .]" 1 372 3 37 LEU HA 3 41 THR H 4.500 . 5.000 4.352 4.276 4.538 . 0 0 "[ . 1 .]" 1 373 3 37 LEU QD 3 38 LYS QB 6.000 . 6.500 4.087 3.899 4.306 . 0 0 "[ . 1 .]" 1 374 3 38 LYS HA 3 38 LYS QB 2.500 . 3.000 2.362 2.178 2.507 . 0 0 "[ . 1 .]" 1 375 3 38 LYS HA 3 38 LYS QG 3.000 . 3.500 2.553 2.051 3.278 . 0 0 "[ . 1 .]" 1 376 3 38 LYS HA 3 38 LYS QD 4.000 . 4.500 3.934 1.997 4.491 . 0 0 "[ . 1 .]" 1 377 3 38 LYS HA 3 38 LYS QE 5.000 . 5.500 4.416 3.867 4.869 . 0 0 "[ . 1 .]" 1 378 3 36 SER QB 3 38 LYS QB 4.000 . 4.500 4.632 4.492 4.727 0.227 14 0 "[ . 1 .]" 1 379 3 38 LYS QB 3 38 LYS QE 3.000 . 3.500 2.850 2.002 3.632 0.132 15 0 "[ . 1 .]" 1 380 3 38 LYS QB 3 41 THR HB 4.000 . 4.500 3.761 3.384 4.257 . 0 0 "[ . 1 .]" 1 381 3 36 SER QB 3 38 LYS QG 4.000 . 4.500 3.474 3.028 4.418 . 0 0 "[ . 1 .]" 1 382 3 38 LYS QE 3 38 LYS QG 3.000 . 3.500 2.290 2.120 2.737 . 0 0 "[ . 1 .]" 1 383 3 38 LYS QG 3 39 GLY QA 5.000 . 5.500 5.023 4.455 5.505 0.005 8 0 "[ . 1 .]" 1 384 3 36 SER QB 3 38 LYS QE 4.000 . 4.500 3.511 2.694 4.631 0.131 11 0 "[ . 1 .]" 1 385 3 38 LYS H 3 38 LYS QG 4.000 . 4.500 2.782 1.941 3.595 . 0 0 "[ . 1 .]" 1 386 3 38 LYS QG 3 39 GLY H 4.000 . 4.500 4.198 3.888 4.536 0.036 8 0 "[ . 1 .]" 1 387 3 38 LYS H 3 39 GLY H 5.000 . 5.500 4.142 4.064 4.222 . 0 0 "[ . 1 .]" 1 388 3 38 LYS H 3 42 VAL H 5.000 . 5.500 5.000 4.937 5.068 . 0 0 "[ . 1 .]" 1 389 3 37 LEU H 3 38 LYS HA 5.000 . 5.500 5.041 4.995 5.089 . 0 0 "[ . 1 .]" 1 390 3 38 LYS H 3 38 LYS HA 3.000 . 3.500 2.957 2.950 2.961 . 0 0 "[ . 1 .]" 1 391 3 38 LYS HA 3 39 GLY H 3.000 . 3.500 2.161 2.141 2.186 . 0 0 "[ . 1 .]" 1 392 3 38 LYS QB 3 40 THR H 5.500 . 6.000 4.609 4.469 4.852 . 0 0 "[ . 1 .]" 1 393 3 38 LYS QB 3 41 THR H 4.000 . 4.500 4.158 3.911 4.505 0.005 12 0 "[ . 1 .]" 1 394 3 37 LEU H 3 38 LYS QB 5.000 . 5.500 5.500 5.343 5.577 0.077 15 0 "[ . 1 .]" 1 395 3 38 LYS H 3 38 LYS QB 2.500 . 3.000 2.630 2.379 3.078 0.078 5 0 "[ . 1 .]" 1 396 3 38 LYS QB 3 39 GLY H 4.000 . 4.500 3.531 3.410 3.663 . 0 0 "[ . 1 .]" 1 397 3 39 GLY QA 3 40 THR MG 4.000 . 4.500 3.381 3.264 3.517 . 0 0 "[ . 1 .]" 1 398 3 39 GLY H 3 40 THR H 5.000 . 5.500 4.104 4.001 4.333 . 0 0 "[ . 1 .]" 1 399 3 39 GLY QA 3 40 THR H 2.500 . 3.000 2.248 2.151 2.301 . 0 0 "[ . 1 .]" 1 400 3 39 GLY QA 3 41 THR H 4.000 . 4.500 3.734 3.585 3.790 . 0 0 "[ . 1 .]" 1 401 3 40 THR HA 3 40 THR HB 2.500 . 3.000 2.575 2.527 2.620 . 0 0 "[ . 1 .]" 1 402 3 40 THR HA 3 40 THR MG 3.000 . 3.500 2.201 2.067 2.304 . 0 0 "[ . 1 .]" 1 403 3 37 LEU QD 3 40 THR HA 3.000 . 3.500 2.617 2.473 2.748 . 0 0 "[ . 1 .]" 1 404 3 40 THR H 3 41 THR H 3.000 . 3.500 2.074 1.961 2.323 . 0 0 "[ . 1 .]" 1 405 3 38 LYS H 3 40 THR H 5.000 . 5.500 4.579 4.395 5.055 . 0 0 "[ . 1 .]" 1 406 3 40 THR H 3 40 THR HA 3.000 . 3.500 2.930 2.912 2.952 . 0 0 "[ . 1 .]" 1 407 3 40 THR HA 3 41 THR H 3.500 . 4.000 3.048 3.013 3.088 . 0 0 "[ . 1 .]" 1 408 3 40 THR H 3 40 THR HB 4.000 . 4.500 3.799 3.751 3.838 . 0 0 "[ . 1 .]" 1 409 3 40 THR HB 3 41 THR H 4.500 . 5.000 4.357 4.305 4.402 . 0 0 "[ . 1 .]" 1 410 3 40 THR H 3 40 THR MG 3.000 . 3.500 3.266 2.993 3.455 . 0 0 "[ . 1 .]" 1 411 3 40 THR MG 3 41 THR H 4.000 . 4.500 4.370 4.332 4.401 . 0 0 "[ . 1 .]" 1 412 3 40 THR HB 3 42 VAL H 6.000 . 6.500 6.412 6.292 6.503 0.003 6 0 "[ . 1 .]" 1 413 3 41 THR HA 3 41 THR MG 3.000 . 3.500 2.286 2.247 2.342 . 0 0 "[ . 1 .]" 1 414 3 41 THR HA 3 42 VAL QG 4.000 . 4.500 3.482 3.444 3.582 . 0 0 "[ . 1 .]" 1 415 3 41 THR MG 3 43 THR HA 4.500 . 5.000 4.188 3.994 4.329 . 0 0 "[ . 1 .]" 1 416 3 41 THR MG 3 43 THR HB 5.000 . 5.500 4.809 4.423 5.005 . 0 0 "[ . 1 .]" 1 417 3 38 LYS H 3 41 THR H 4.000 . 4.500 3.065 2.982 3.257 . 0 0 "[ . 1 .]" 1 418 3 41 THR H 3 42 VAL H 4.000 . 4.500 4.346 4.295 4.381 . 0 0 "[ . 1 .]" 1 419 3 41 THR H 3 41 THR HA 3.000 . 3.500 2.959 2.957 2.963 . 0 0 "[ . 1 .]" 1 420 3 41 THR HA 3 42 VAL H 2.500 . 3.000 2.158 2.145 2.169 . 0 0 "[ . 1 .]" 1 421 3 40 THR H 3 41 THR HB 4.000 . 4.500 3.909 3.807 4.150 . 0 0 "[ . 1 .]" 1 422 3 41 THR H 3 41 THR HB 3.000 . 3.500 2.657 2.621 2.687 . 0 0 "[ . 1 .]" 1 423 3 38 LYS H 3 41 THR HB 4.000 . 4.500 3.617 3.467 3.823 . 0 0 "[ . 1 .]" 1 424 3 41 THR HB 3 42 VAL H 4.000 . 4.500 4.169 4.129 4.224 . 0 0 "[ . 1 .]" 1 425 3 41 THR MG 3 43 THR H 5.000 . 5.500 4.141 3.994 4.246 . 0 0 "[ . 1 .]" 1 426 3 41 THR H 3 41 THR MG 4.000 . 4.500 3.858 3.843 3.871 . 0 0 "[ . 1 .]" 1 427 3 41 THR MG 3 42 VAL H 3.000 . 3.500 2.508 2.306 2.655 . 0 0 "[ . 1 .]" 1 428 3 40 THR H 3 41 THR MG 5.000 . 5.500 5.085 5.012 5.266 . 0 0 "[ . 1 .]" 1 429 3 42 VAL HA 3 42 VAL QG 2.500 . 3.000 2.102 2.072 2.136 . 0 0 "[ . 1 .]" 1 430 3 37 LEU QD 3 42 VAL HA 3.000 . 3.500 2.597 2.354 3.531 0.031 7 0 "[ . 1 .]" 1 431 3 35 MET ME 3 42 VAL HB 4.000 . 4.500 3.559 3.164 3.827 . 0 0 "[ . 1 .]" 1 432 3 37 LEU HA 3 42 VAL HB 6.000 . 6.500 5.023 4.926 5.122 . 0 0 "[ . 1 .]" 1 433 3 35 MET QG 3 42 VAL QG 5.000 . 5.500 3.570 3.394 3.750 . 0 0 "[ . 1 .]" 1 434 3 37 LEU QD 3 42 VAL QG 3.000 . 3.500 1.833 1.813 1.879 . 0 0 "[ . 1 .]" 1 435 3 42 VAL QG 3 97 VAL QG 4.000 . 4.500 3.432 3.185 3.700 . 0 0 "[ . 1 .]" 1 436 3 36 SER H 3 42 VAL HA 4.000 . 4.500 4.302 4.148 4.503 0.003 7 0 "[ . 1 .]" 1 437 3 42 VAL HA 3 43 THR H 3.000 . 3.500 2.173 2.155 2.185 . 0 0 "[ . 1 .]" 1 438 3 37 LEU H 3 42 VAL HA 4.000 . 4.500 4.554 4.509 4.576 0.076 11 0 "[ . 1 .]" 1 439 3 38 LYS H 3 42 VAL HA 3.500 . 4.000 3.585 3.419 3.668 . 0 0 "[ . 1 .]" 1 440 3 42 VAL HB 3 43 THR H 4.000 . 4.500 4.253 4.214 4.272 . 0 0 "[ . 1 .]" 1 441 3 42 VAL H 3 42 VAL HB 3.000 . 3.500 2.526 2.495 2.550 . 0 0 "[ . 1 .]" 1 442 3 36 SER H 3 42 VAL QG 3.000 . 3.500 3.300 3.127 3.417 . 0 0 "[ . 1 .]" 1 443 3 40 THR H 3 42 VAL QG 6.000 . 6.500 5.693 5.560 5.872 . 0 0 "[ . 1 .]" 1 444 3 35 MET H 3 42 VAL QG 5.500 . 6.000 4.798 4.579 5.016 . 0 0 "[ . 1 .]" 1 445 3 42 VAL QG 3 43 THR H 3.000 . 3.500 2.648 2.441 2.800 . 0 0 "[ . 1 .]" 1 446 3 41 THR H 3 42 VAL QG 4.000 . 4.500 4.207 4.138 4.307 . 0 0 "[ . 1 .]" 1 447 3 42 VAL QG 3 45 ASP H 6.000 . 6.500 5.611 5.343 5.721 . 0 0 "[ . 1 .]" 1 448 3 37 LEU H 3 42 VAL QG 4.000 . 4.500 4.041 3.875 4.270 . 0 0 "[ . 1 .]" 1 449 3 38 LYS H 3 42 VAL QG 4.000 . 4.500 4.099 3.999 4.242 . 0 0 "[ . 1 .]" 1 450 3 42 VAL H 3 42 VAL QG 3.000 . 3.500 2.495 2.425 2.546 . 0 0 "[ . 1 .]" 1 451 3 35 MET ME 3 43 THR HA 4.000 . 4.500 3.680 3.320 4.397 . 0 0 "[ . 1 .]" 1 452 3 43 THR HA 3 44 PRO QG 4.500 . 5.000 3.973 3.903 4.017 . 0 0 "[ . 1 .]" 1 453 3 43 THR HA 3 44 PRO QD 3.000 . 3.500 2.053 1.983 2.093 0.017 15 0 "[ . 1 .]" 1 454 3 43 THR HA 3 43 THR HB 2.500 . 3.000 2.620 2.451 3.013 0.013 9 0 "[ . 1 .]" 1 455 3 43 THR HA 3 43 THR MG 3.000 . 3.500 2.293 2.157 2.414 . 0 0 "[ . 1 .]" 1 456 3 42 VAL QG 3 43 THR HA 5.000 . 5.500 3.694 3.584 3.792 . 0 0 "[ . 1 .]" 1 457 3 43 THR MG 3 44 PRO QG 5.000 . 5.500 4.587 3.115 5.294 . 0 0 "[ . 1 .]" 1 458 3 37 LEU H 3 43 THR H 5.000 . 5.500 4.834 4.722 4.914 . 0 0 "[ . 1 .]" 1 459 3 38 LYS H 3 43 THR H 4.000 . 4.500 4.544 4.349 4.621 0.121 2 0 "[ . 1 .]" 1 460 3 42 VAL H 3 43 THR H 4.000 . 4.500 4.378 4.344 4.433 . 0 0 "[ . 1 .]" 1 461 3 36 SER H 3 43 THR HA 4.000 . 4.500 4.607 4.510 4.720 0.220 9 0 "[ . 1 .]" 1 462 3 42 VAL H 3 43 THR HA 5.000 . 5.500 4.971 4.912 5.056 . 0 0 "[ . 1 .]" 1 463 3 36 SER H 3 43 THR HB 4.000 . 4.500 4.322 3.549 4.633 0.133 3 0 "[ . 1 .]" 1 464 3 43 THR H 3 43 THR HB 3.000 . 3.500 3.385 2.531 3.701 0.201 3 0 "[ . 1 .]" 1 465 3 36 SER H 3 43 THR MG 5.000 . 5.500 4.565 4.192 4.826 . 0 0 "[ . 1 .]" 1 466 3 43 THR H 3 43 THR MG 4.000 . 4.500 3.096 2.678 3.847 . 0 0 "[ . 1 .]" 1 467 3 42 VAL QG 3 44 PRO HA 5.000 . 5.500 4.056 3.806 4.241 . 0 0 "[ . 1 .]" 1 468 3 43 THR HB 3 44 PRO QG 6.000 . 6.500 4.886 4.359 5.717 . 0 0 "[ . 1 .]" 1 469 3 43 THR HB 3 44 PRO QD 4.500 . 5.000 3.268 2.739 4.168 . 0 0 "[ . 1 .]" 1 470 3 43 THR MG 3 44 PRO QD 3.000 . 3.500 3.075 1.989 3.613 0.113 8 0 "[ . 1 .]" 1 471 3 36 SER H 3 44 PRO HA 4.000 . 4.500 3.811 3.553 4.018 . 0 0 "[ . 1 .]" 1 472 3 35 MET H 3 44 PRO HA 4.500 . 5.000 4.910 4.637 5.061 0.061 15 0 "[ . 1 .]" 1 473 3 43 THR H 3 44 PRO HA 5.000 . 5.500 5.017 4.924 5.116 . 0 0 "[ . 1 .]" 1 474 3 44 PRO HA 3 45 ASP H 3.000 . 3.500 2.232 2.206 2.258 . 0 0 "[ . 1 .]" 1 475 3 44 PRO HA 3 112 TRP HE1 4.000 . 4.500 4.262 4.140 4.402 . 0 0 "[ . 1 .]" 1 476 3 44 PRO QB 3 45 ASP H 3.000 . 3.500 3.011 2.923 3.162 . 0 0 "[ . 1 .]" 1 477 3 44 PRO QB 3 112 TRP HE1 4.000 . 4.500 3.702 3.388 3.912 . 0 0 "[ . 1 .]" 1 478 3 44 PRO QG 3 45 ASP H 5.000 . 5.500 4.517 4.449 4.700 . 0 0 "[ . 1 .]" 1 479 3 43 THR H 3 44 PRO QD 5.000 . 5.500 4.273 4.002 4.359 . 0 0 "[ . 1 .]" 1 480 3 45 ASP HA 3 45 ASP QB 2.500 . 3.000 2.368 2.169 2.466 . 0 0 "[ . 1 .]" 1 481 3 45 ASP H 3 112 TRP HE1 4.000 . 4.500 2.913 2.675 3.125 . 0 0 "[ . 1 .]" 1 482 3 45 ASP HA 3 46 LYS H 2.500 . 3.000 2.187 2.150 2.266 . 0 0 "[ . 1 .]" 1 483 3 45 ASP H 3 45 ASP HA 2.500 . 3.000 2.942 2.929 2.953 . 0 0 "[ . 1 .]" 1 484 3 45 ASP HA 3 47 ARG H 4.000 . 4.500 3.650 3.500 3.824 . 0 0 "[ . 1 .]" 1 485 3 34 LYS H 3 45 ASP QB 4.000 . 4.500 3.429 3.053 3.833 . 0 0 "[ . 1 .]" 1 486 3 45 ASP QB 3 46 LYS H 4.000 . 4.500 3.181 2.798 3.848 . 0 0 "[ . 1 .]" 1 487 3 45 ASP H 3 45 ASP QB 3.000 . 3.500 2.462 2.376 2.545 . 0 0 "[ . 1 .]" 1 488 3 45 ASP QB 3 112 TRP HE1 5.000 . 5.500 3.694 3.408 4.012 . 0 0 "[ . 1 .]" 1 489 3 45 ASP HA 3 46 LYS HA 4.000 . 4.500 4.347 4.316 4.391 . 0 0 "[ . 1 .]" 1 490 3 46 LYS HA 3 46 LYS QB 2.500 . 3.000 2.434 2.349 2.499 . 0 0 "[ . 1 .]" 1 491 3 46 LYS HA 3 46 LYS QG 3.000 . 3.500 2.451 2.112 2.952 . 0 0 "[ . 1 .]" 1 492 3 46 LYS HA 3 46 LYS QD 3.000 . 3.500 2.457 1.998 3.244 . 0 0 "[ . 1 .]" 1 493 3 46 LYS QB 3 46 LYS QD 3.000 . 3.500 2.266 2.133 2.428 . 0 0 "[ . 1 .]" 1 494 3 46 LYS H 3 46 LYS QB 2.500 . 3.000 2.294 2.137 2.468 . 0 0 "[ . 1 .]" 1 495 3 46 LYS QB 3 47 ARG H 3.000 . 3.500 3.288 3.187 3.364 . 0 0 "[ . 1 .]" 1 496 3 46 LYS QB 3 112 TRP HE1 6.000 . 6.500 6.391 6.305 6.447 . 0 0 "[ . 1 .]" 1 497 3 45 ASP H 3 46 LYS H 4.000 . 4.500 4.463 4.339 4.539 0.039 13 0 "[ . 1 .]" 1 498 3 46 LYS H 3 47 ARG H 4.000 . 4.500 2.614 2.472 2.745 . 0 0 "[ . 1 .]" 1 499 3 46 LYS HA 3 47 ARG H 4.000 . 4.500 3.384 3.357 3.431 . 0 0 "[ . 1 .]" 1 500 3 46 LYS HA 3 112 TRP HE1 4.000 . 4.500 4.696 4.614 4.763 0.263 13 0 "[ . 1 .]" 1 501 3 46 LYS QE 3 47 ARG H 6.000 . 6.500 6.261 5.663 6.607 0.107 4 0 "[ . 1 .]" 1 502 3 46 LYS H 3 46 LYS QG 3.000 . 3.500 2.978 2.058 3.561 0.061 12 0 "[ . 1 .]" 1 503 3 46 LYS QG 3 47 ARG H 5.000 . 5.500 4.631 4.270 4.888 . 0 0 "[ . 1 .]" 1 504 3 46 LYS QG 3 112 TRP HE1 6.000 . 6.500 6.297 5.999 6.503 0.003 9 0 "[ . 1 .]" 1 505 3 46 LYS H 3 46 LYS QD 4.000 . 4.500 2.713 2.010 4.424 . 0 0 "[ . 1 .]" 1 506 3 46 LYS QD 3 47 ARG H 5.000 . 5.500 4.509 4.179 5.143 . 0 0 "[ . 1 .]" 1 507 3 46 LYS QD 3 112 TRP HE1 6.000 . 6.500 5.640 5.330 6.370 . 0 0 "[ . 1 .]" 1 508 3 47 ARG HA 3 47 ARG QG 3.000 . 3.500 2.217 2.046 2.336 . 0 0 "[ . 1 .]" 1 509 3 47 ARG QB 3 47 ARG QD 3.000 . 3.500 2.362 2.278 2.474 . 0 0 "[ . 1 .]" 1 510 3 47 ARG H 3 47 ARG HE 4.000 . 4.500 3.737 3.491 4.034 . 0 0 "[ . 1 .]" 1 511 3 47 ARG QB 3 48 LYS H 4.000 . 4.500 3.876 3.826 3.917 . 0 0 "[ . 1 .]" 1 512 3 47 ARG H 3 47 ARG QB 2.500 . 3.000 2.291 2.068 2.408 . 0 0 "[ . 1 .]" 1 513 3 47 ARG QB 3 47 ARG HE 3.000 . 3.500 2.199 2.134 2.314 . 0 0 "[ . 1 .]" 1 514 3 47 ARG HA 3 48 LYS H 3.000 . 3.500 2.385 2.286 2.535 . 0 0 "[ . 1 .]" 1 515 3 46 LYS H 3 47 ARG HA 5.000 . 5.500 5.074 4.968 5.252 . 0 0 "[ . 1 .]" 1 516 3 47 ARG HA 3 47 ARG HE 5.000 . 5.500 4.759 4.686 5.004 . 0 0 "[ . 1 .]" 1 517 3 47 ARG QD 3 48 LYS H 5.500 . 6.000 5.618 4.977 5.989 . 0 0 "[ . 1 .]" 1 518 3 47 ARG H 3 47 ARG QD 4.000 . 4.500 3.566 2.255 4.320 . 0 0 "[ . 1 .]" 1 519 3 47 ARG QG 3 48 LYS H 4.000 . 4.500 4.347 4.153 4.435 . 0 0 "[ . 1 .]" 1 520 3 47 ARG H 3 47 ARG QG 3.000 . 3.500 2.711 2.205 3.521 0.021 13 0 "[ . 1 .]" 1 521 3 46 LYS H 3 47 ARG HE 5.000 . 5.500 5.375 5.105 5.561 0.061 10 0 "[ . 1 .]" 1 522 3 48 LYS HA 3 48 LYS QB 2.500 . 3.000 2.354 2.181 2.427 . 0 0 "[ . 1 .]" 1 523 3 48 LYS HA 3 48 LYS QG 2.500 . 3.000 2.534 2.311 3.276 0.276 15 0 "[ . 1 .]" 1 524 3 48 LYS HA 3 48 LYS QD 4.000 . 4.500 4.056 3.723 4.469 . 0 0 "[ . 1 .]" 1 525 3 48 LYS HA 3 48 LYS QE 5.000 . 5.500 4.562 3.999 5.545 0.045 15 0 "[ . 1 .]" 1 526 3 48 LYS HA 3 68 ARG QB 5.000 . 5.500 4.659 4.450 4.950 . 0 0 "[ . 1 .]" 1 527 3 48 LYS QB 3 48 LYS QE 3.000 . 3.500 3.062 2.002 3.637 0.137 2 0 "[ . 1 .]" 1 528 3 48 LYS QE 3 48 LYS QG 2.500 . 3.000 2.202 2.127 2.321 . 0 0 "[ . 1 .]" 1 529 3 47 ARG H 3 48 LYS H 4.000 . 4.500 3.861 3.639 4.015 . 0 0 "[ . 1 .]" 1 530 3 48 LYS QB 3 49 GLY H 3.000 . 3.500 3.096 2.919 3.233 . 0 0 "[ . 1 .]" 1 531 3 48 LYS H 3 48 LYS QB 3.000 . 3.500 2.444 2.307 2.621 . 0 0 "[ . 1 .]" 1 532 3 48 LYS QG 3 49 GLY H 4.000 . 4.500 4.040 3.888 4.125 . 0 0 "[ . 1 .]" 1 533 3 48 LYS H 3 48 LYS QG 3.000 . 3.500 2.095 1.847 2.455 . 0 0 "[ . 1 .]" 1 534 3 48 LYS HA 3 49 GLY H 3.000 . 3.500 2.200 2.180 2.215 . 0 0 "[ . 1 .]" 1 535 3 48 LYS H 3 48 LYS QD 4.000 . 4.500 3.529 1.965 3.999 0.035 4 0 "[ . 1 .]" 1 536 3 48 LYS H 3 48 LYS QE 5.000 . 5.500 4.213 3.545 4.693 . 0 0 "[ . 1 .]" 1 537 3 48 LYS QD 3 49 GLY H 6.000 . 6.500 5.240 4.966 5.704 . 0 0 "[ . 1 .]" 1 538 3 48 LYS HA 3 65 TRP HE1 6.000 . 6.500 5.018 4.579 5.281 . 0 0 "[ . 1 .]" 1 539 3 48 LYS H 3 69 THR H 5.000 . 5.500 5.367 5.260 5.507 0.007 15 0 "[ . 1 .]" 1 540 3 48 LYS H 3 68 ARG H 4.500 . 5.000 5.016 4.971 5.119 0.119 5 0 "[ . 1 .]" 1 541 3 48 LYS H 3 67 ASP HA 6.000 . 6.500 6.030 5.892 6.226 . 0 0 "[ . 1 .]" 1 542 3 48 LYS H 3 69 THR HA 6.000 . 6.500 6.413 6.193 6.557 0.057 15 0 "[ . 1 .]" 1 543 3 49 GLY QA 3 67 ASP HA 3.000 . 3.500 2.295 2.214 2.392 . 0 0 "[ . 1 .]" 1 544 3 49 GLY H 3 50 LEU H 4.000 . 4.500 4.229 4.123 4.286 . 0 0 "[ . 1 .]" 1 545 3 48 LYS H 3 49 GLY H 5.000 . 5.500 4.591 4.555 4.614 . 0 0 "[ . 1 .]" 1 546 3 49 GLY H 3 68 ARG H 5.000 . 5.500 4.292 4.229 4.335 . 0 0 "[ . 1 .]" 1 547 3 32 ALA H 3 49 GLY H 5.000 . 5.500 3.672 3.476 3.841 . 0 0 "[ . 1 .]" 1 548 3 49 GLY H 3 65 TRP HE1 4.000 . 4.500 3.339 2.937 3.585 . 0 0 "[ . 1 .]" 1 549 3 49 GLY QA 3 69 THR H 4.000 . 4.500 4.276 4.171 4.385 . 0 0 "[ . 1 .]" 1 550 3 49 GLY QA 3 67 ASP H 5.000 . 5.500 4.335 4.189 4.418 . 0 0 "[ . 1 .]" 1 551 3 49 GLY QA 3 50 LEU H 2.500 . 3.000 2.198 2.141 2.234 . 0 0 "[ . 1 .]" 1 552 3 49 GLY QA 3 68 ARG H 3.000 . 3.500 1.941 1.881 2.018 . 0 0 "[ . 1 .]" 1 553 3 32 ALA H 3 49 GLY QA 4.000 . 4.500 4.163 3.960 4.363 . 0 0 "[ . 1 .]" 1 554 3 49 GLY QA 3 65 TRP HE1 3.000 . 3.500 2.804 2.637 2.957 . 0 0 "[ . 1 .]" 1 555 3 50 LEU HA 3 51 VAL HB 5.000 . 5.500 4.483 4.437 4.532 . 0 0 "[ . 1 .]" 1 556 3 50 LEU HA 3 50 LEU HG 3.000 . 3.500 2.478 2.364 2.563 . 0 0 "[ . 1 .]" 1 557 3 50 LEU HA 3 50 LEU QD 3.000 . 3.500 2.325 2.186 2.483 . 0 0 "[ . 1 .]" 1 558 3 50 LEU QB 3 68 ARG QG 3.000 . 3.500 3.010 2.896 3.189 . 0 0 "[ . 1 .]" 1 559 3 50 LEU QB 3 68 ARG QD 5.000 . 5.500 3.281 2.339 3.819 . 0 0 "[ . 1 .]" 1 560 3 49 GLY QA 3 50 LEU QB 4.000 . 4.500 3.679 3.648 3.703 . 0 0 "[ . 1 .]" 1 561 3 31 ARG HA 3 50 LEU QD 3.000 . 3.500 2.026 1.976 2.050 . 0 0 "[ . 1 .]" 1 562 3 31 ARG QB 3 50 LEU QD 4.000 . 4.500 3.350 3.244 3.456 . 0 0 "[ . 1 .]" 1 563 3 50 LEU QD 3 66 LYS QB 4.000 . 4.500 3.778 3.329 4.072 . 0 0 "[ . 1 .]" 1 564 3 50 LEU QD 3 66 LYS QD 3.500 . 4.000 3.010 1.990 4.184 0.184 11 0 "[ . 1 .]" 1 565 3 50 LEU H 3 52 TYR H 5.000 . 5.500 5.716 5.671 5.778 0.278 4 0 "[ . 1 .]" 1 566 3 50 LEU H 3 68 ARG H 4.000 . 4.500 4.503 4.462 4.559 0.059 10 0 "[ . 1 .]" 1 567 3 50 LEU H 3 51 VAL H 4.000 . 4.500 4.174 4.112 4.217 . 0 0 "[ . 1 .]" 1 568 3 50 LEU H 3 66 LYS H 3.000 . 3.500 2.689 2.564 2.841 . 0 0 "[ . 1 .]" 1 569 3 50 LEU H 3 65 TRP HE1 4.000 . 4.500 3.789 3.670 3.878 . 0 0 "[ . 1 .]" 1 570 3 50 LEU HA 3 51 VAL H 3.000 . 3.500 2.171 2.158 2.184 . 0 0 "[ . 1 .]" 1 571 3 50 LEU QB 3 52 TYR H 4.000 . 4.500 4.652 4.630 4.672 0.172 6 0 "[ . 1 .]" 1 572 3 50 LEU H 3 50 LEU QB 3.000 . 3.500 2.645 2.610 2.687 . 0 0 "[ . 1 .]" 1 573 3 50 LEU QB 3 51 VAL H 4.000 . 4.500 3.749 3.710 3.799 . 0 0 "[ . 1 .]" 1 574 3 32 ALA H 3 50 LEU QB 4.000 . 4.500 4.281 4.117 4.416 . 0 0 "[ . 1 .]" 1 575 3 50 LEU HG 3 52 TYR H 5.000 . 5.500 4.565 4.378 4.783 . 0 0 "[ . 1 .]" 1 576 3 50 LEU H 3 50 LEU HG 4.000 . 4.500 4.497 4.474 4.516 0.016 9 0 "[ . 1 .]" 1 577 3 50 LEU HG 3 51 VAL H 3.000 . 3.500 2.643 2.538 2.773 . 0 0 "[ . 1 .]" 1 578 3 32 ALA H 3 50 LEU HG 4.000 . 4.500 4.500 4.124 4.651 0.151 4 0 "[ . 1 .]" 1 579 3 30 PHE H 3 50 LEU QD 3.000 . 3.500 3.113 3.011 3.232 . 0 0 "[ . 1 .]" 1 580 3 31 ARG H 3 50 LEU QD 4.000 . 4.500 2.954 2.747 3.110 . 0 0 "[ . 1 .]" 1 581 3 50 LEU QD 3 52 TYR H 4.000 . 4.500 4.230 4.095 4.417 . 0 0 "[ . 1 .]" 1 582 3 50 LEU H 3 50 LEU QD 4.000 . 4.500 3.929 3.883 3.966 . 0 0 "[ . 1 .]" 1 583 3 50 LEU QD 3 51 VAL H 3.000 . 3.500 3.357 3.232 3.471 . 0 0 "[ . 1 .]" 1 584 3 32 ALA H 3 50 LEU QD 3.000 . 3.500 3.477 3.324 3.575 0.075 5 0 "[ . 1 .]" 1 585 3 50 LEU QD 3 66 LYS H 4.000 . 4.500 4.411 4.340 4.464 . 0 0 "[ . 1 .]" 1 586 3 50 LEU HA 3 65 TRP HE1 5.000 . 5.500 4.859 4.744 4.996 . 0 0 "[ . 1 .]" 1 587 3 32 ALA MB 3 51 VAL HA 4.000 . 4.500 4.376 4.266 4.478 . 0 0 "[ . 1 .]" 1 588 3 51 VAL HA 3 65 TRP HA 4.000 . 4.500 2.754 2.708 2.818 . 0 0 "[ . 1 .]" 1 589 3 50 LEU QD 3 51 VAL HA 4.000 . 4.500 4.592 4.539 4.689 0.189 12 0 "[ . 1 .]" 1 590 3 51 VAL HA 3 51 VAL QG 3.000 . 3.500 2.080 2.054 2.109 . 0 0 "[ . 1 .]" 1 591 3 29 GLU HA 3 51 VAL QG 5.000 . 5.500 4.189 4.133 4.238 . 0 0 "[ . 1 .]" 1 592 3 51 VAL QG 3 53 ILE MD 5.000 . 5.500 3.810 3.734 3.912 . 0 0 "[ . 1 .]" 1 593 3 51 VAL QG 3 128 VAL QG 3.000 . 3.500 2.644 2.519 2.837 . 0 0 "[ . 1 .]" 1 594 3 28 VAL QG 3 51 VAL QG 4.000 . 4.500 2.967 2.856 3.037 . 0 0 "[ . 1 .]" 1 595 3 51 VAL H 3 65 TRP HE1 5.000 . 5.500 5.081 4.993 5.198 . 0 0 "[ . 1 .]" 1 596 3 51 VAL HA 3 52 TYR H 2.500 . 3.000 2.160 2.145 2.173 . 0 0 "[ . 1 .]" 1 597 3 50 LEU H 3 51 VAL HA 4.000 . 4.500 4.531 4.504 4.557 0.057 15 0 "[ . 1 .]" 1 598 3 51 VAL HA 3 64 CYS H 5.000 . 5.500 5.169 5.107 5.209 . 0 0 "[ . 1 .]" 1 599 3 32 ALA H 3 51 VAL HA 5.000 . 5.500 5.589 5.527 5.638 0.138 7 0 "[ . 1 .]" 1 600 3 51 VAL HA 3 66 LYS H 4.000 . 4.500 3.941 3.814 4.015 . 0 0 "[ . 1 .]" 1 601 3 51 VAL HA 3 65 TRP HE1 5.000 . 5.500 5.176 5.131 5.209 . 0 0 "[ . 1 .]" 1 602 3 30 PHE H 3 51 VAL HB 4.000 . 4.500 3.736 3.626 3.898 . 0 0 "[ . 1 .]" 1 603 3 51 VAL HB 3 52 TYR H 4.000 . 4.500 4.460 4.424 4.496 . 0 0 "[ . 1 .]" 1 604 3 51 VAL H 3 51 VAL HB 3.000 . 3.500 2.385 2.337 2.435 . 0 0 "[ . 1 .]" 1 605 3 32 ALA H 3 51 VAL HB 5.000 . 5.500 4.674 4.582 4.777 . 0 0 "[ . 1 .]" 1 606 3 33 GLY H 3 51 VAL QG 5.000 . 5.500 4.814 4.681 4.951 . 0 0 "[ . 1 .]" 1 607 3 30 PHE H 3 51 VAL QG 4.000 . 4.500 3.898 3.860 3.946 . 0 0 "[ . 1 .]" 1 608 3 51 VAL QG 3 53 ILE H 4.000 . 4.500 4.639 4.602 4.681 0.181 10 0 "[ . 1 .]" 1 609 3 51 VAL QG 3 112 TRP H 5.000 . 5.500 5.032 4.916 5.178 . 0 0 "[ . 1 .]" 1 610 3 51 VAL QG 3 65 TRP H 5.000 . 5.500 5.015 4.899 5.097 . 0 0 "[ . 1 .]" 1 611 3 51 VAL QG 3 52 TYR H 2.500 . 3.000 2.889 2.758 2.999 . 0 0 "[ . 1 .]" 1 612 3 50 LEU H 3 51 VAL QG 5.000 . 5.500 4.200 4.087 4.299 . 0 0 "[ . 1 .]" 1 613 3 51 VAL QG 3 64 CYS H 4.000 . 4.500 4.378 4.274 4.447 . 0 0 "[ . 1 .]" 1 614 3 51 VAL H 3 51 VAL QG 3.000 . 3.500 2.684 2.568 2.751 . 0 0 "[ . 1 .]" 1 615 3 32 ALA H 3 51 VAL QG 4.000 . 4.500 3.807 3.677 3.975 . 0 0 "[ . 1 .]" 1 616 3 51 VAL QG 3 66 LYS H 4.000 . 4.500 4.476 4.420 4.511 0.011 10 0 "[ . 1 .]" 1 617 3 51 VAL QG 3 65 TRP HE1 4.000 . 4.500 3.107 2.979 3.192 . 0 0 "[ . 1 .]" 1 618 3 29 GLU QG 3 52 TYR HA 4.000 . 4.500 4.388 4.320 4.421 . 0 0 "[ . 1 .]" 1 619 3 51 VAL QG 3 52 TYR HA 4.000 . 4.500 3.385 3.318 3.444 . 0 0 "[ . 1 .]" 1 620 3 52 TYR HA 3 53 ILE MD 6.000 . 6.500 4.661 4.581 4.738 . 0 0 "[ . 1 .]" 1 621 3 28 VAL QG 3 52 TYR HA 4.000 . 4.500 2.345 2.307 2.383 . 0 0 "[ . 1 .]" 1 622 3 50 LEU QD 3 52 TYR QB 5.000 . 5.500 2.261 2.106 2.547 . 0 0 "[ . 1 .]" 1 623 3 26 TYR HA 3 52 TYR QD 5.000 . 5.500 4.047 3.935 4.137 . 0 0 "[ . 1 .]" 1 624 3 26 TYR QB 3 52 TYR QD 5.000 . 5.500 3.561 3.104 3.924 . 0 0 "[ . 1 .]" 1 625 3 29 GLU HA 3 52 TYR QD 5.000 . 5.500 4.415 4.331 4.470 . 0 0 "[ . 1 .]" 1 626 3 50 LEU QB 3 52 TYR QD 5.000 . 5.500 2.945 2.775 3.112 . 0 0 "[ . 1 .]" 1 627 3 52 TYR HA 3 52 TYR QD 4.000 . 4.500 3.687 3.677 3.696 . 0 0 "[ . 1 .]" 1 628 3 52 TYR QD 3 53 ILE HA 5.000 . 5.500 3.640 3.516 3.696 . 0 0 "[ . 1 .]" 1 629 3 52 TYR QD 3 54 GLN HA 5.000 . 5.500 4.484 4.411 4.640 . 0 0 "[ . 1 .]" 1 630 3 52 TYR QD 3 54 GLN QB 4.000 . 4.500 3.008 2.938 3.048 . 0 0 "[ . 1 .]" 1 631 3 52 TYR QD 3 64 CYS QB 5.000 . 5.500 3.634 3.455 4.000 . 0 0 "[ . 1 .]" 1 632 3 52 TYR QD 3 65 TRP HA 5.000 . 5.500 4.076 3.954 4.151 . 0 0 "[ . 1 .]" 1 633 3 52 TYR QD 3 66 LYS QB 4.000 . 4.500 3.372 2.980 3.715 . 0 0 "[ . 1 .]" 1 634 3 50 LEU HG 3 52 TYR QD 4.000 . 4.500 3.712 3.480 3.947 . 0 0 "[ . 1 .]" 1 635 3 50 LEU QD 3 52 TYR QD 3.000 . 3.500 2.647 2.455 2.842 . 0 0 "[ . 1 .]" 1 636 3 52 TYR QD 3 73 VAL QG 6.000 . 6.500 4.191 3.977 4.308 . 0 0 "[ . 1 .]" 1 637 3 51 VAL QG 3 52 TYR QD 5.000 . 5.500 4.540 4.488 4.582 . 0 0 "[ . 1 .]" 1 638 3 26 TYR QB 3 52 TYR QE 5.000 . 5.500 5.256 4.915 5.508 0.008 5 0 "[ . 1 .]" 1 639 3 50 LEU QB 3 52 TYR QE 4.000 . 4.500 4.084 3.921 4.368 . 0 0 "[ . 1 .]" 1 640 3 52 TYR QE 3 54 GLN HA 5.000 . 5.500 5.270 5.117 5.474 . 0 0 "[ . 1 .]" 1 641 3 52 TYR QE 3 54 GLN QB 4.000 . 4.500 2.871 2.696 3.167 . 0 0 "[ . 1 .]" 1 642 3 52 TYR QE 3 64 CYS QB 4.000 . 4.500 2.683 2.609 2.726 . 0 0 "[ . 1 .]" 1 643 3 52 TYR QE 3 65 TRP HA 5.000 . 5.500 4.266 4.181 4.346 . 0 0 "[ . 1 .]" 1 644 3 52 TYR QE 3 66 LYS HA 5.000 . 5.500 4.299 4.034 4.525 . 0 0 "[ . 1 .]" 1 645 3 52 TYR QE 3 66 LYS QB 3.000 . 3.500 2.140 2.025 2.247 . 0 0 "[ . 1 .]" 1 646 3 52 TYR QE 3 66 LYS QE . . 3.500 3.266 2.699 3.625 0.125 15 0 "[ . 1 .]" 1 647 3 52 TYR QE 3 73 VAL HA 5.000 . 5.500 3.904 3.656 4.044 . 0 0 "[ . 1 .]" 1 648 3 50 LEU QD 3 52 TYR QE 4.000 . 4.500 4.047 3.856 4.251 . 0 0 "[ . 1 .]" 1 649 3 52 TYR QE 3 73 VAL QG 4.000 . 4.500 2.379 2.127 2.553 . 0 0 "[ . 1 .]" 1 650 3 52 TYR QE 3 66 LYS QD 3.000 . 3.500 3.251 2.731 3.673 0.173 9 0 "[ . 1 .]" 1 651 3 52 TYR H 3 64 CYS H 4.000 . 4.500 3.759 3.698 3.835 . 0 0 "[ . 1 .]" 1 652 3 51 VAL H 3 52 TYR H 4.000 . 4.500 4.260 4.238 4.297 . 0 0 "[ . 1 .]" 1 653 3 52 TYR H 3 66 LYS H 4.000 . 4.500 4.357 4.161 4.499 . 0 0 "[ . 1 .]" 1 654 3 30 PHE H 3 52 TYR HA 3.000 . 3.500 3.594 3.564 3.619 0.119 12 0 "[ . 1 .]" 1 655 3 52 TYR HA 3 53 ILE H 3.000 . 3.500 2.267 2.251 2.278 . 0 0 "[ . 1 .]" 1 656 3 52 TYR HA 3 64 CYS H 5.000 . 5.500 5.288 5.229 5.344 . 0 0 "[ . 1 .]" 1 657 3 27 LEU H 3 52 TYR HA 6.000 . 6.500 6.240 6.176 6.298 . 0 0 "[ . 1 .]" 1 658 3 28 VAL H 3 52 TYR HA 4.000 . 4.500 4.234 4.204 4.265 . 0 0 "[ . 1 .]" 1 659 3 52 TYR QD 3 53 ILE H 4.000 . 4.500 3.223 3.154 3.266 . 0 0 "[ . 1 .]" 1 660 3 52 TYR QD 3 65 TRP H 5.000 . 5.500 5.620 5.567 5.654 0.154 9 0 "[ . 1 .]" 1 661 3 52 TYR H 3 52 TYR QD 3.000 . 3.500 2.667 2.543 2.864 . 0 0 "[ . 1 .]" 1 662 3 50 LEU H 3 52 TYR QD 5.000 . 5.500 4.935 4.859 5.008 . 0 0 "[ . 1 .]" 1 663 3 52 TYR QD 3 64 CYS H 4.000 . 4.500 4.388 4.288 4.501 0.001 12 0 "[ . 1 .]" 1 664 3 27 LEU H 3 52 TYR QD 5.000 . 5.500 4.952 4.808 5.029 . 0 0 "[ . 1 .]" 1 665 3 51 VAL H 3 52 TYR QD 5.000 . 5.500 4.792 4.724 4.893 . 0 0 "[ . 1 .]" 1 666 3 52 TYR QD 3 54 GLN H 4.000 . 4.500 4.106 3.996 4.216 . 0 0 "[ . 1 .]" 1 667 3 52 TYR QD 3 66 LYS H 4.000 . 4.500 3.533 3.297 3.710 . 0 0 "[ . 1 .]" 1 668 3 28 VAL H 3 52 TYR QD 4.000 . 4.500 4.701 4.640 4.732 0.232 13 0 "[ . 1 .]" 1 669 3 52 TYR QD 3 54 GLN QE 5.000 . 5.500 5.250 5.033 5.574 0.074 4 0 "[ . 1 .]" 1 670 3 52 TYR QE 3 53 ILE H 5.000 . 5.500 5.400 5.338 5.447 . 0 0 "[ . 1 .]" 1 671 3 52 TYR QE 3 65 TRP H 5.000 . 5.500 4.733 4.658 4.803 . 0 0 "[ . 1 .]" 1 672 3 52 TYR H 3 52 TYR QE 4.000 . 4.500 4.213 4.123 4.343 . 0 0 "[ . 1 .]" 1 673 3 50 LEU H 3 52 TYR QE 5.000 . 5.500 5.559 5.458 5.671 0.171 2 0 "[ . 1 .]" 1 674 3 52 TYR QE 3 64 CYS H 4.000 . 4.500 4.505 4.389 4.591 0.091 12 0 "[ . 1 .]" 1 675 3 52 TYR QE 3 54 GLN H 4.000 . 4.500 4.608 4.541 4.658 0.158 3 0 "[ . 1 .]" 1 676 3 52 TYR QE 3 66 LYS H 4.000 . 4.500 3.352 3.207 3.535 . 0 0 "[ . 1 .]" 1 677 3 52 TYR QE 3 54 GLN QE 4.000 . 4.500 3.782 3.491 4.228 . 0 0 "[ . 1 .]" 1 678 3 52 TYR QB 3 53 ILE H 3.000 . 3.500 2.616 2.553 2.654 . 0 0 "[ . 1 .]" 1 679 3 27 LEU H 3 52 TYR QB 5.000 . 5.500 5.352 5.258 5.430 . 0 0 "[ . 1 .]" 1 680 3 28 VAL H 3 52 TYR QB 4.000 . 4.500 4.087 4.025 4.141 . 0 0 "[ . 1 .]" 1 681 3 53 ILE HA 3 63 PHE HA 4.000 . 4.500 2.904 2.798 3.022 . 0 0 "[ . 1 .]" 1 682 3 53 ILE HA 3 53 ILE QG 3.000 . 3.500 2.349 2.329 2.365 . 0 0 "[ . 1 .]" 1 683 3 53 ILE HA 3 53 ILE MG 3.000 . 3.500 2.312 2.283 2.352 . 0 0 "[ . 1 .]" 1 684 3 53 ILE HA 3 53 ILE MD 3.000 . 3.500 3.782 3.768 3.799 0.299 9 0 "[ . 1 .]" 1 685 3 53 ILE HA 3 61 ILE MG 5.000 . 5.500 3.979 3.920 4.015 . 0 0 "[ . 1 .]" 1 686 3 53 ILE HB 3 53 ILE MD 3.000 . 3.500 2.218 2.178 2.280 . 0 0 "[ . 1 .]" 1 687 3 53 ILE HB 3 61 ILE MD 5.000 . 5.500 5.338 5.301 5.423 . 0 0 "[ . 1 .]" 1 688 3 53 ILE HB 3 128 VAL QG 5.000 . 5.500 4.587 4.369 4.704 . 0 0 "[ . 1 .]" 1 689 3 52 TYR HA 3 53 ILE QG 4.000 . 4.500 3.424 3.330 3.503 . 0 0 "[ . 1 .]" 1 690 3 53 ILE QG 3 63 PHE QB 3.000 . 3.500 3.480 3.227 3.570 0.070 8 0 "[ . 1 .]" 1 691 3 51 VAL QG 3 53 ILE QG 5.000 . 5.500 3.334 3.288 3.394 . 0 0 "[ . 1 .]" 1 692 3 53 ILE QG 3 53 ILE MG 2.500 . 3.000 2.278 2.257 2.296 . 0 0 "[ . 1 .]" 1 693 3 53 ILE QG 3 128 VAL QG 4.000 . 4.500 3.287 3.164 3.418 . 0 0 "[ . 1 .]" 1 694 3 53 ILE MD 3 53 ILE MG 2.500 . 3.000 1.973 1.882 2.023 . 0 0 "[ . 1 .]" 1 695 3 53 ILE MG 3 61 ILE MG 2.500 . 3.000 1.826 1.814 1.837 . 0 0 "[ . 1 .]" 1 696 3 53 ILE MG 3 61 ILE MD 3.500 . 4.000 2.963 2.930 3.013 . 0 0 "[ . 1 .]" 1 697 3 53 ILE MG 3 132 LEU HG 4.000 . 4.500 3.509 3.348 3.823 . 0 0 "[ . 1 .]" 1 698 3 53 ILE MG 3 132 LEU QD 3.500 . 4.000 2.647 2.519 2.913 . 0 0 "[ . 1 .]" 1 699 3 27 LEU QD 3 53 ILE MG 3.000 . 3.500 2.093 1.985 2.200 . 0 0 "[ . 1 .]" 1 700 3 52 TYR H 3 53 ILE H 4.000 . 4.500 4.449 4.418 4.461 . 0 0 "[ . 1 .]" 1 701 3 53 ILE H 3 64 CYS H 5.000 . 5.500 5.140 5.067 5.202 . 0 0 "[ . 1 .]" 1 702 3 27 LEU H 3 53 ILE H 4.000 . 4.500 4.066 4.004 4.116 . 0 0 "[ . 1 .]" 1 703 3 53 ILE H 3 54 GLN H 4.000 . 4.500 4.420 4.405 4.437 . 0 0 "[ . 1 .]" 1 704 3 28 VAL H 3 53 ILE H 3.000 . 3.500 2.387 2.355 2.414 . 0 0 "[ . 1 .]" 1 705 3 53 ILE HA 3 62 HIS H 4.000 . 4.500 4.653 4.619 4.685 0.185 3 0 "[ . 1 .]" 1 706 3 52 TYR H 3 53 ILE HA 5.000 . 5.500 4.900 4.880 4.916 . 0 0 "[ . 1 .]" 1 707 3 53 ILE HA 3 64 CYS H 3.000 . 3.500 3.197 3.124 3.280 . 0 0 "[ . 1 .]" 1 708 3 27 LEU H 3 53 ILE HA 4.000 . 4.500 4.771 4.737 4.796 0.296 12 0 "[ . 1 .]" 1 709 3 53 ILE HA 3 63 PHE H 5.000 . 5.500 5.108 5.034 5.223 . 0 0 "[ . 1 .]" 1 710 3 53 ILE HA 3 55 GLN H 6.000 . 6.500 6.084 6.024 6.226 . 0 0 "[ . 1 .]" 1 711 3 53 ILE HA 3 54 GLN H 2.500 . 3.000 2.180 2.168 2.195 . 0 0 "[ . 1 .]" 1 712 3 28 VAL H 3 53 ILE HA 4.000 . 4.500 4.453 4.412 4.505 0.005 12 0 "[ . 1 .]" 1 713 3 53 ILE H 3 53 ILE HB 3.000 . 3.500 2.513 2.499 2.528 . 0 0 "[ . 1 .]" 1 714 3 53 ILE HB 3 62 HIS H 6.000 . 6.500 6.212 6.155 6.298 . 0 0 "[ . 1 .]" 1 715 3 29 GLU H 3 53 ILE HB 5.000 . 5.500 5.707 5.661 5.757 0.257 13 0 "[ . 1 .]" 1 716 3 27 LEU H 3 53 ILE HB 4.000 . 4.500 3.611 3.496 3.728 . 0 0 "[ . 1 .]" 1 717 3 53 ILE HB 3 54 GLN H 4.000 . 4.500 4.107 4.077 4.154 . 0 0 "[ . 1 .]" 1 718 3 28 VAL H 3 53 ILE HB 3.000 . 3.500 2.442 2.341 2.553 . 0 0 "[ . 1 .]" 1 719 3 53 ILE H 3 53 ILE QG 4.000 . 4.500 2.843 2.776 2.917 . 0 0 "[ . 1 .]" 1 720 3 52 TYR H 3 53 ILE QG 6.000 . 6.500 4.418 4.344 4.508 . 0 0 "[ . 1 .]" 1 721 3 53 ILE QG 3 64 CYS H 4.000 . 4.500 3.781 3.601 3.890 . 0 0 "[ . 1 .]" 1 722 3 53 ILE QG 3 54 GLN H 4.000 . 4.500 3.931 3.866 3.988 . 0 0 "[ . 1 .]" 1 723 3 28 VAL H 3 53 ILE QG 4.000 . 4.500 4.174 4.063 4.289 . 0 0 "[ . 1 .]" 1 724 3 53 ILE H 3 53 ILE MG 4.000 . 4.500 3.755 3.746 3.763 . 0 0 "[ . 1 .]" 1 725 3 53 ILE MG 3 62 HIS H 4.000 . 4.500 3.242 3.168 3.295 . 0 0 "[ . 1 .]" 1 726 3 53 ILE MG 3 64 CYS H 4.000 . 4.500 4.667 4.593 4.729 0.229 2 0 "[ . 1 .]" 1 727 3 27 LEU H 3 53 ILE MG 4.000 . 4.500 3.183 3.125 3.271 . 0 0 "[ . 1 .]" 1 728 3 53 ILE MG 3 63 PHE H 4.000 . 4.500 4.621 4.559 4.683 0.183 1 0 "[ . 1 .]" 1 729 3 53 ILE MG 3 55 GLN H 4.000 . 4.500 4.075 3.967 4.296 . 0 0 "[ . 1 .]" 1 730 3 53 ILE MG 3 54 GLN H 4.000 . 4.500 2.305 2.232 2.386 . 0 0 "[ . 1 .]" 1 731 3 28 VAL H 3 53 ILE MG 3.000 . 3.500 3.633 3.598 3.672 0.172 12 0 "[ . 1 .]" 1 732 3 53 ILE MD 3 132 LEU H 3.000 . 3.500 3.575 3.482 3.746 0.246 1 0 "[ . 1 .]" 1 733 3 53 ILE MD 3 131 TYR H 4.500 . 5.000 3.897 3.735 4.057 . 0 0 "[ . 1 .]" 1 734 3 53 ILE H 3 53 ILE MD 4.000 . 4.500 3.879 3.829 3.921 . 0 0 "[ . 1 .]" 1 735 3 53 ILE MD 3 129 ASN H 4.500 . 5.000 4.864 4.772 4.980 . 0 0 "[ . 1 .]" 1 736 3 53 ILE MD 3 128 VAL H 4.000 . 4.500 4.280 4.187 4.383 . 0 0 "[ . 1 .]" 1 737 3 53 ILE MD 3 133 ASN H 5.000 . 5.500 5.540 5.417 5.601 0.101 3 0 "[ . 1 .]" 1 738 3 53 ILE MD 3 127 LYS H 6.000 . 6.500 6.185 6.043 6.396 . 0 0 "[ . 1 .]" 1 739 3 54 GLN HA 3 54 GLN QB 2.500 . 3.000 2.327 2.183 2.382 . 0 0 "[ . 1 .]" 1 740 3 27 LEU HG 3 54 GLN HA 4.000 . 4.500 2.994 2.566 3.237 . 0 0 "[ . 1 .]" 1 741 3 53 ILE MG 3 54 GLN HA 4.000 . 4.500 3.387 3.283 3.462 . 0 0 "[ . 1 .]" 1 742 3 27 LEU QD 3 54 GLN HA 4.000 . 4.500 3.618 3.367 3.791 . 0 0 "[ . 1 .]" 1 743 3 54 GLN H 3 54 GLN QE 5.000 . 5.500 4.714 4.553 5.124 . 0 0 "[ . 1 .]" 1 744 3 53 ILE H 3 54 GLN HA 6.000 . 6.500 4.963 4.914 5.019 . 0 0 "[ . 1 .]" 1 745 3 27 LEU H 3 54 GLN HA 4.000 . 4.500 2.407 2.199 2.525 . 0 0 "[ . 1 .]" 1 746 3 54 GLN HA 3 55 GLN H 2.500 . 3.000 2.186 2.164 2.231 . 0 0 "[ . 1 .]" 1 747 3 54 GLN H 3 54 GLN HA 3.000 . 3.500 2.948 2.939 2.955 . 0 0 "[ . 1 .]" 1 748 3 28 VAL H 3 54 GLN HA 4.000 . 4.500 4.499 4.371 4.587 0.087 10 0 "[ . 1 .]" 1 749 3 54 GLN HA 3 54 GLN QE 4.000 . 4.500 4.541 4.500 4.616 0.116 11 0 "[ . 1 .]" 1 750 3 54 GLN QB 3 62 HIS H 4.000 . 4.500 4.013 3.778 4.711 0.211 12 0 "[ . 1 .]" 1 751 3 54 GLN QB 3 55 GLN H 4.000 . 4.500 3.553 2.795 3.763 . 0 0 "[ . 1 .]" 1 752 3 54 GLN H 3 54 GLN QB 3.000 . 3.500 2.703 2.581 3.104 . 0 0 "[ . 1 .]" 1 753 3 54 GLN QG 3 56 THR H 5.000 . 5.500 4.507 4.137 4.701 . 0 0 "[ . 1 .]" 1 754 3 54 GLN QG 3 62 HIS H 4.000 . 4.500 4.476 3.163 4.877 0.377 8 0 "[ . 1 .]" 1 755 3 54 GLN QG 3 55 GLN H 3.000 . 3.500 2.629 2.230 3.722 0.222 12 0 "[ . 1 .]" 1 756 3 54 GLN H 3 54 GLN QG 4.000 . 4.500 3.746 2.265 4.140 . 0 0 "[ . 1 .]" 1 757 3 54 GLN QE 3 54 GLN QG 2.500 . 3.000 2.567 2.414 2.652 . 0 0 "[ . 1 .]" 1 758 3 55 GLN HA 3 55 GLN QG 3.000 . 3.500 2.408 2.390 2.445 . 0 0 "[ . 1 .]" 1 759 3 55 GLN HA 3 59 SER HA 5.000 . 5.500 5.010 4.916 5.119 . 0 0 "[ . 1 .]" 1 760 3 55 GLN HA 3 61 ILE HA 3.000 . 3.500 2.398 2.358 2.468 . 0 0 "[ . 1 .]" 1 761 3 55 GLN HA 3 61 ILE MG 4.000 . 4.500 3.898 3.862 3.932 . 0 0 "[ . 1 .]" 1 762 3 55 GLN HA 3 61 ILE MD 3.000 . 3.500 2.696 2.657 2.725 . 0 0 "[ . 1 .]" 1 763 3 27 LEU QD 3 55 GLN HA 4.000 . 4.500 3.564 3.421 3.701 . 0 0 "[ . 1 .]" 1 764 3 55 GLN QB 3 59 SER HA 4.000 . 4.500 4.559 4.516 4.590 0.090 2 0 "[ . 1 .]" 1 765 3 55 GLN QB 3 61 ILE MG 3.000 . 3.500 3.668 3.645 3.724 0.224 7 0 "[ . 1 .]" 1 766 3 55 GLN QB 3 61 ILE MD 3.000 . 3.500 2.016 1.984 2.098 . 0 0 "[ . 1 .]" 1 767 3 55 GLN QG 3 59 SER HA 3.000 . 3.500 2.520 2.463 2.570 . 0 0 "[ . 1 .]" 1 768 3 55 GLN QG 3 59 SER QB 4.000 . 4.500 4.243 4.078 4.364 . 0 0 "[ . 1 .]" 1 769 3 55 GLN QG 3 61 ILE MD 3.000 . 3.500 2.070 2.041 2.176 . 0 0 "[ . 1 .]" 1 770 3 55 GLN HA 3 62 HIS HD2 4.000 . 4.500 2.911 2.837 3.010 . 0 0 "[ . 1 .]" 1 771 3 54 GLN H 3 55 GLN H 4.000 . 4.500 4.280 4.239 4.339 . 0 0 "[ . 1 .]" 1 772 3 28 VAL H 3 55 GLN H 6.000 . 6.500 6.082 5.964 6.311 . 0 0 "[ . 1 .]" 1 773 3 54 GLN QE 3 55 GLN H 5.000 . 5.500 4.982 4.547 5.174 . 0 0 "[ . 1 .]" 1 774 3 55 GLN QE 3 59 SER H 4.000 . 4.500 4.582 4.551 4.602 0.102 4 0 "[ . 1 .]" 1 775 3 55 GLN QE 3 56 THR H 5.000 . 5.500 4.981 4.905 5.056 . 0 0 "[ . 1 .]" 1 776 3 55 GLN H 3 55 GLN QE 5.000 . 5.500 5.800 5.773 5.836 0.336 13 0 "[ . 1 .]" 1 777 3 55 GLN HA 3 56 THR H 2.500 . 3.000 2.117 2.107 2.128 . 0 0 "[ . 1 .]" 1 778 3 55 GLN HA 3 62 HIS H 4.000 . 4.500 3.018 2.980 3.087 . 0 0 "[ . 1 .]" 1 779 3 55 GLN HA 3 55 GLN QE 4.000 . 4.500 4.369 4.344 4.397 . 0 0 "[ . 1 .]" 1 780 3 55 GLN QG 3 59 SER H 4.000 . 4.500 3.316 3.266 3.374 . 0 0 "[ . 1 .]" 1 781 3 55 GLN QG 3 56 THR H 3.000 . 3.500 2.737 2.642 2.823 . 0 0 "[ . 1 .]" 1 782 3 55 GLN QG 3 62 HIS H 4.500 . 5.000 4.843 4.805 4.963 . 0 0 "[ . 1 .]" 1 783 3 55 GLN QG 3 60 LEU H 5.000 . 5.500 3.359 3.231 3.447 . 0 0 "[ . 1 .]" 1 784 3 55 GLN H 3 55 GLN QG 4.000 . 4.500 3.954 3.941 3.973 . 0 0 "[ . 1 .]" 1 785 3 55 GLN QE 3 55 GLN QG 2.500 . 3.000 2.148 2.138 2.155 . 0 0 "[ . 1 .]" 1 786 3 24 ASN QB 3 56 THR MG 6.000 . 6.500 3.847 2.992 4.694 . 0 0 "[ . 1 .]" 1 787 3 24 ASN HA 3 56 THR MG 5.000 . 5.500 4.297 3.229 5.493 . 0 0 "[ . 1 .]" 1 788 3 54 GLN QB 3 56 THR MG 3.500 . 4.000 4.067 3.983 4.180 0.180 12 0 "[ . 1 .]" 1 789 3 55 GLN HA 3 56 THR MG 4.000 . 4.500 3.836 3.706 3.917 . 0 0 "[ . 1 .]" 1 790 3 56 THR HA 3 56 THR MG 3.000 . 3.500 2.204 2.178 2.262 . 0 0 "[ . 1 .]" 1 791 3 56 THR HA 3 56 THR HB 2.500 . 3.000 2.528 2.494 2.549 . 0 0 "[ . 1 .]" 1 792 3 56 THR MG 3 57 ASP HA 5.000 . 5.500 5.433 5.402 5.486 . 0 0 "[ . 1 .]" 1 793 3 56 THR H 3 57 ASP H 5.000 . 5.500 4.541 4.520 4.555 . 0 0 "[ . 1 .]" 1 794 3 56 THR H 3 62 HIS H 4.000 . 4.500 4.121 4.082 4.208 . 0 0 "[ . 1 .]" 1 795 3 56 THR H 3 58 ASP H 5.000 . 5.500 4.177 4.153 4.197 . 0 0 "[ . 1 .]" 1 796 3 56 THR H 3 60 LEU H 4.000 . 4.500 3.151 3.058 3.236 . 0 0 "[ . 1 .]" 1 797 3 56 THR HA 3 59 SER H 4.000 . 4.500 4.741 4.706 4.789 0.289 14 0 "[ . 1 .]" 1 798 3 56 THR H 3 56 THR HA 3.000 . 3.500 2.892 2.884 2.905 . 0 0 "[ . 1 .]" 1 799 3 56 THR HA 3 57 ASP H 3.000 . 3.500 2.439 2.417 2.452 . 0 0 "[ . 1 .]" 1 800 3 56 THR HA 3 58 ASP H 3.000 . 3.500 3.874 3.860 3.899 0.399 11 0 "[ . 1 .]" 1 801 3 55 GLN H 3 56 THR HA 5.000 . 5.500 4.989 4.918 5.040 . 0 0 "[ . 1 .]" 1 802 3 54 GLN QE 3 56 THR HA 4.000 . 4.500 4.606 4.488 4.665 0.165 5 0 "[ . 1 .]" 1 803 3 56 THR H 3 56 THR HB 4.000 . 4.500 3.594 3.580 3.619 . 0 0 "[ . 1 .]" 1 804 3 56 THR HB 3 57 ASP H 3.000 . 3.500 2.192 2.156 2.231 . 0 0 "[ . 1 .]" 1 805 3 56 THR H 3 56 THR MG 3.000 . 3.500 2.622 2.583 2.654 . 0 0 "[ . 1 .]" 1 806 3 56 THR MG 3 57 ASP H 3.000 . 3.500 3.312 3.263 3.393 . 0 0 "[ . 1 .]" 1 807 3 56 THR MG 3 62 HIS H 4.000 . 4.500 4.445 4.353 4.510 0.010 7 0 "[ . 1 .]" 1 808 3 56 THR MG 3 58 ASP H 4.000 . 4.500 4.028 3.998 4.079 . 0 0 "[ . 1 .]" 1 809 3 55 GLN H 3 56 THR MG 4.000 . 4.500 4.821 4.682 4.893 0.393 6 0 "[ . 1 .]" 1 810 3 54 GLN QE 3 56 THR MG 3.000 . 3.500 2.775 2.621 3.120 . 0 0 "[ . 1 .]" 1 811 3 56 THR MG 3 59 SER H 6.000 . 6.500 5.198 5.150 5.245 . 0 0 "[ . 1 .]" 1 812 3 56 THR MG 3 60 LEU H 5.500 . 6.000 4.590 4.539 4.669 . 0 0 "[ . 1 .]" 1 813 3 57 ASP HA 3 57 ASP QB 2.500 . 3.000 2.417 2.405 2.427 . 0 0 "[ . 1 .]" 1 814 3 57 ASP H 3 58 ASP H 4.000 . 4.500 2.630 2.613 2.673 . 0 0 "[ . 1 .]" 1 815 3 56 THR H 3 57 ASP HA 5.000 . 5.500 5.592 5.577 5.609 0.109 5 0 "[ . 1 .]" 1 816 3 57 ASP H 3 57 ASP HA 3.000 . 3.500 2.825 2.815 2.833 . 0 0 "[ . 1 .]" 1 817 3 57 ASP HA 3 58 ASP H 3.000 . 3.500 3.385 3.376 3.391 . 0 0 "[ . 1 .]" 1 818 3 57 ASP H 3 57 ASP QB 3.000 . 3.500 2.326 2.227 2.360 . 0 0 "[ . 1 .]" 1 819 3 57 ASP QB 3 58 ASP H 3.000 . 3.500 3.232 3.222 3.243 . 0 0 "[ . 1 .]" 1 820 3 58 ASP HA 3 58 ASP QB 2.500 . 3.000 2.401 2.358 2.410 . 0 0 "[ . 1 .]" 1 821 3 58 ASP H 3 60 LEU H 3.000 . 3.500 3.360 3.319 3.425 . 0 0 "[ . 1 .]" 1 822 3 58 ASP HA 3 59 SER H 3.000 . 3.500 3.253 3.208 3.298 . 0 0 "[ . 1 .]" 1 823 3 58 ASP H 3 58 ASP HA 3.000 . 3.500 2.925 2.919 2.933 . 0 0 "[ . 1 .]" 1 824 3 58 ASP HA 3 60 LEU H 4.000 . 4.500 4.444 4.420 4.478 . 0 0 "[ . 1 .]" 1 825 3 58 ASP QB 3 59 SER H 4.000 . 4.500 3.470 3.409 3.531 . 0 0 "[ . 1 .]" 1 826 3 58 ASP H 3 58 ASP QB 2.500 . 3.000 2.347 2.326 2.438 . 0 0 "[ . 1 .]" 1 827 3 58 ASP QB 3 60 LEU H 4.000 . 4.500 2.975 2.876 3.053 . 0 0 "[ . 1 .]" 1 828 3 59 SER HA 3 59 SER QB 2.500 . 3.000 2.404 2.335 2.474 . 0 0 "[ . 1 .]" 1 829 3 56 THR H 3 59 SER H 4.000 . 4.500 4.069 4.002 4.155 . 0 0 "[ . 1 .]" 1 830 3 57 ASP H 3 59 SER H 5.000 . 5.500 4.239 4.214 4.267 . 0 0 "[ . 1 .]" 1 831 3 58 ASP H 3 59 SER H 3.000 . 3.500 2.460 2.426 2.493 . 0 0 "[ . 1 .]" 1 832 3 59 SER H 3 60 LEU H 3.000 . 3.500 2.517 2.476 2.567 . 0 0 "[ . 1 .]" 1 833 3 59 SER H 3 59 SER HA 2.500 . 3.000 2.272 2.260 2.283 . 0 0 "[ . 1 .]" 1 834 3 56 THR H 3 59 SER HA 4.000 . 4.500 4.484 4.405 4.541 0.041 10 0 "[ . 1 .]" 1 835 3 58 ASP H 3 59 SER HA 4.000 . 4.500 4.650 4.623 4.674 0.174 12 0 "[ . 1 .]" 1 836 3 59 SER HA 3 60 LEU H 3.000 . 3.500 2.991 2.933 3.046 . 0 0 "[ . 1 .]" 1 837 3 55 GLN QE 3 59 SER HA 3.000 . 3.500 2.615 2.583 2.651 . 0 0 "[ . 1 .]" 1 838 3 59 SER H 3 59 SER QB 2.500 . 3.000 3.167 3.011 3.351 0.351 8 0 "[ . 1 .]" 1 839 3 59 SER QB 3 60 LEU H 3.000 . 3.500 3.681 3.632 3.715 0.215 11 0 "[ . 1 .]" 1 840 3 55 GLN QE 3 59 SER QB 4.000 . 4.500 3.613 3.182 3.971 . 0 0 "[ . 1 .]" 1 841 3 60 LEU HA 3 60 LEU HG 4.000 . 4.500 3.100 3.063 3.146 . 0 0 "[ . 1 .]" 1 842 3 60 LEU HA 3 60 LEU QD 3.000 . 3.500 2.008 1.996 2.054 . 0 0 "[ . 1 .]" 1 843 3 60 LEU HA 3 78 ILE MG 4.000 . 4.500 3.140 3.069 3.240 . 0 0 "[ . 1 .]" 1 844 3 60 LEU HA 3 78 ILE MD 4.000 . 4.500 4.723 4.670 4.772 0.272 12 0 "[ . 1 .]" 1 845 3 60 LEU QB 3 60 LEU HG 2.500 . 3.000 2.359 2.345 2.373 . 0 0 "[ . 1 .]" 1 846 3 60 LEU QB 3 60 LEU QD 2.500 . 3.000 1.916 1.905 1.943 . 0 0 "[ . 1 .]" 1 847 3 60 LEU QB 3 78 ILE MG 3.000 . 3.500 1.858 1.831 1.875 . 0 0 "[ . 1 .]" 1 848 3 60 LEU QB 3 78 ILE MD 4.000 . 4.500 2.459 2.406 2.515 . 0 0 "[ . 1 .]" 1 849 3 58 ASP QB 3 60 LEU HG 4.000 . 4.500 2.144 2.091 2.217 . 0 0 "[ . 1 .]" 1 850 3 60 LEU HG 3 78 ILE MG 4.000 . 4.500 4.241 4.194 4.269 . 0 0 "[ . 1 .]" 1 851 3 60 LEU HG 3 78 ILE MD 4.000 . 4.500 4.451 4.358 4.518 0.018 4 0 "[ . 1 .]" 1 852 3 58 ASP HA 3 60 LEU QD 5.000 . 5.500 4.214 4.126 4.278 . 0 0 "[ . 1 .]" 1 853 3 58 ASP QB 3 60 LEU QD 4.000 . 4.500 2.100 1.961 2.236 . 0 0 "[ . 1 .]" 1 854 3 60 LEU QD 3 78 ILE HB 5.000 . 5.500 4.154 4.077 4.212 . 0 0 "[ . 1 .]" 1 855 3 60 LEU QD 3 78 ILE QG 5.000 . 5.500 3.625 3.556 3.711 . 0 0 "[ . 1 .]" 1 856 3 60 LEU QD 3 78 ILE MG 3.000 . 3.500 2.347 2.259 2.413 . 0 0 "[ . 1 .]" 1 857 3 60 LEU QD 3 78 ILE MD 4.000 . 4.500 2.100 2.016 2.273 . 0 0 "[ . 1 .]" 1 858 3 60 LEU H 3 61 ILE H 4.000 . 4.500 4.335 4.320 4.357 . 0 0 "[ . 1 .]" 1 859 3 59 SER H 3 60 LEU HA 5.000 . 5.500 5.198 5.161 5.235 . 0 0 "[ . 1 .]" 1 860 3 56 THR H 3 60 LEU HA 5.000 . 5.500 4.944 4.877 5.004 . 0 0 "[ . 1 .]" 1 861 3 60 LEU H 3 60 LEU HA 3.000 . 3.500 2.925 2.919 2.937 . 0 0 "[ . 1 .]" 1 862 3 60 LEU HA 3 79 ILE H 5.000 . 5.500 5.663 5.594 5.732 0.232 13 0 "[ . 1 .]" 1 863 3 60 LEU HA 3 61 ILE H 2.500 . 3.000 2.124 2.107 2.138 . 0 0 "[ . 1 .]" 1 864 3 59 SER H 3 60 LEU QB 5.000 . 5.500 4.599 4.549 4.661 . 0 0 "[ . 1 .]" 1 865 3 56 THR H 3 60 LEU QB 5.000 . 5.500 3.661 3.575 3.797 . 0 0 "[ . 1 .]" 1 866 3 60 LEU QB 3 62 HIS H 5.000 . 5.500 4.927 4.868 5.011 . 0 0 "[ . 1 .]" 1 867 3 58 ASP H 3 60 LEU QB 5.000 . 5.500 4.347 4.286 4.458 . 0 0 "[ . 1 .]" 1 868 3 60 LEU H 3 60 LEU QB 2.500 . 3.000 2.437 2.419 2.470 . 0 0 "[ . 1 .]" 1 869 3 60 LEU QB 3 61 ILE H 3.000 . 3.500 3.320 3.252 3.363 . 0 0 "[ . 1 .]" 1 870 3 59 SER H 3 60 LEU HG 4.000 . 4.500 4.023 4.001 4.056 . 0 0 "[ . 1 .]" 1 871 3 58 ASP H 3 60 LEU HG 4.000 . 4.500 4.187 4.058 4.351 . 0 0 "[ . 1 .]" 1 872 3 60 LEU H 3 60 LEU HG 2.500 . 3.000 2.375 2.324 2.439 . 0 0 "[ . 1 .]" 1 873 3 60 LEU HG 3 61 ILE H 4.500 . 5.000 5.111 5.096 5.122 0.122 13 0 "[ . 1 .]" 1 874 3 59 SER H 3 60 LEU QD 4.000 . 4.500 4.477 4.452 4.508 0.008 10 0 "[ . 1 .]" 1 875 3 56 THR H 3 60 LEU QD 5.000 . 5.500 4.929 4.861 5.013 . 0 0 "[ . 1 .]" 1 876 3 58 ASP H 3 60 LEU QD 4.000 . 4.500 4.287 4.160 4.492 . 0 0 "[ . 1 .]" 1 877 3 60 LEU H 3 60 LEU QD 2.500 . 3.000 3.152 3.120 3.178 0.178 6 0 "[ . 1 .]" 1 878 3 60 LEU QD 3 61 ILE H 3.000 . 3.500 3.512 3.473 3.578 0.078 4 0 "[ . 1 .]" 1 879 3 55 GLN QG 3 61 ILE HA 4.000 . 4.500 3.426 3.367 3.588 . 0 0 "[ . 1 .]" 1 880 3 61 ILE HA 3 61 ILE MG 3.000 . 3.500 2.384 2.368 2.408 . 0 0 "[ . 1 .]" 1 881 3 61 ILE HA 3 61 ILE MD 3.000 . 3.500 2.007 1.983 2.039 . 0 0 "[ . 1 .]" 1 882 3 61 ILE HB 3 79 ILE HB 4.000 . 4.500 3.497 3.351 3.674 . 0 0 "[ . 1 .]" 1 883 3 53 ILE MG 3 61 ILE HB 4.000 . 4.500 4.143 4.115 4.168 . 0 0 "[ . 1 .]" 1 884 3 53 ILE MD 3 61 ILE HB 5.000 . 5.500 5.423 5.350 5.540 0.040 4 0 "[ . 1 .]" 1 885 3 61 ILE HB 3 61 ILE QG 2.500 . 3.000 2.182 2.179 2.187 . 0 0 "[ . 1 .]" 1 886 3 61 ILE HB 3 61 ILE MD 2.500 . 3.000 3.195 3.193 3.202 0.202 11 0 "[ . 1 .]" 1 887 3 61 ILE MG 3 63 PHE QB 5.000 . 5.500 3.666 3.540 3.792 . 0 0 "[ . 1 .]" 1 888 3 53 ILE QG 3 61 ILE MG 5.000 . 5.500 3.379 3.317 3.424 . 0 0 "[ . 1 .]" 1 889 3 61 ILE QG 3 61 ILE MG 2.500 . 3.000 2.285 2.268 2.304 . 0 0 "[ . 1 .]" 1 890 3 53 ILE HA 3 61 ILE MD 5.000 . 5.500 5.693 5.662 5.734 0.234 12 0 "[ . 1 .]" 1 891 3 54 GLN HA 3 61 ILE MD 5.000 . 5.500 4.855 4.666 4.965 . 0 0 "[ . 1 .]" 1 892 3 59 SER HA 3 61 ILE MD 4.000 . 4.500 4.055 3.981 4.220 . 0 0 "[ . 1 .]" 1 893 3 60 LEU HA 3 61 ILE MD 5.000 . 5.500 4.243 4.176 4.309 . 0 0 "[ . 1 .]" 1 894 3 61 ILE MD 3 136 PRO QB 5.000 . 5.500 4.842 4.367 5.342 . 0 0 "[ . 1 .]" 1 895 3 61 ILE MD 3 136 PRO QG 4.000 . 4.500 3.774 3.327 4.075 . 0 0 "[ . 1 .]" 1 896 3 56 THR H 3 61 ILE H 5.000 . 5.500 5.101 5.044 5.157 . 0 0 "[ . 1 .]" 1 897 3 61 ILE H 3 80 PHE H 6.000 . 6.500 5.890 5.700 6.024 . 0 0 "[ . 1 .]" 1 898 3 56 THR H 3 61 ILE HA 3.000 . 3.500 3.753 3.721 3.797 0.297 13 0 "[ . 1 .]" 1 899 3 61 ILE HA 3 62 HIS H 2.500 . 3.000 2.093 2.079 2.121 . 0 0 "[ . 1 .]" 1 900 3 55 GLN H 3 61 ILE HA 5.000 . 5.500 4.714 4.642 4.812 . 0 0 "[ . 1 .]" 1 901 3 61 ILE QG 3 62 HIS H 4.000 . 4.500 4.678 4.657 4.699 0.199 6 0 "[ . 1 .]" 1 902 3 61 ILE H 3 61 ILE QG 3.000 . 3.500 2.177 2.133 2.210 . 0 0 "[ . 1 .]" 1 903 3 59 SER H 3 61 ILE MD 5.000 . 5.500 5.472 5.419 5.544 0.044 13 0 "[ . 1 .]" 1 904 3 56 THR H 3 61 ILE MD 4.000 . 4.500 4.054 4.020 4.080 . 0 0 "[ . 1 .]" 1 905 3 61 ILE MD 3 62 HIS H 3.000 . 3.500 3.477 3.423 3.509 0.009 10 0 "[ . 1 .]" 1 906 3 60 LEU H 3 61 ILE MD 4.000 . 4.500 4.562 4.519 4.599 0.099 10 0 "[ . 1 .]" 1 907 3 55 GLN H 3 61 ILE MD 4.000 . 4.500 4.000 3.929 4.112 . 0 0 "[ . 1 .]" 1 908 3 54 GLN H 3 61 ILE MD 4.000 . 4.500 4.632 4.562 4.685 0.185 9 0 "[ . 1 .]" 1 909 3 61 ILE H 3 61 ILE MD 3.000 . 3.500 3.249 3.197 3.314 . 0 0 "[ . 1 .]" 1 910 3 55 GLN QE 3 61 ILE MD 3.000 . 3.500 2.235 2.167 2.331 . 0 0 "[ . 1 .]" 1 911 3 61 ILE MG 3 132 LEU H 4.000 . 4.500 4.137 3.983 4.463 . 0 0 "[ . 1 .]" 1 912 3 61 ILE MG 3 131 TYR H 6.000 . 6.500 5.311 5.204 5.423 . 0 0 "[ . 1 .]" 1 913 3 53 ILE H 3 61 ILE MG 5.000 . 5.500 5.749 5.721 5.769 0.269 6 0 "[ . 1 .]" 1 914 3 61 ILE MG 3 133 ASN H 5.000 . 5.500 5.343 5.231 5.539 0.039 1 0 "[ . 1 .]" 1 915 3 56 THR H 3 61 ILE MG 5.000 . 5.500 5.441 5.414 5.471 . 0 0 "[ . 1 .]" 1 916 3 61 ILE MG 3 62 HIS H 3.000 . 3.500 2.824 2.722 2.872 . 0 0 "[ . 1 .]" 1 917 3 61 ILE MG 3 134 ASN H 5.000 . 5.500 5.809 5.707 5.865 0.365 3 0 "[ . 1 .]" 1 918 3 61 ILE MG 3 63 PHE H 4.000 . 4.500 3.988 3.942 4.030 . 0 0 "[ . 1 .]" 1 919 3 55 GLN H 3 61 ILE MG 5.000 . 5.500 4.829 4.753 4.937 . 0 0 "[ . 1 .]" 1 920 3 54 GLN H 3 61 ILE MG 4.000 . 4.500 3.556 3.476 3.624 . 0 0 "[ . 1 .]" 1 921 3 61 ILE MG 3 79 ILE H 4.000 . 4.500 3.616 3.571 3.651 . 0 0 "[ . 1 .]" 1 922 3 61 ILE H 3 61 ILE MG 3.000 . 3.500 3.735 3.725 3.743 0.243 4 0 "[ . 1 .]" 1 923 3 55 GLN QE 3 61 ILE MG 5.000 . 5.500 4.937 4.890 5.029 . 0 0 "[ . 1 .]" 1 924 3 61 ILE HB 3 62 HIS H 4.000 . 4.500 4.223 4.180 4.246 . 0 0 "[ . 1 .]" 1 925 3 60 LEU H 3 61 ILE HB 6.000 . 6.500 6.587 6.558 6.624 0.124 12 0 "[ . 1 .]" 1 926 3 61 ILE HB 3 79 ILE H 4.000 . 4.500 3.264 3.203 3.347 . 0 0 "[ . 1 .]" 1 927 3 61 ILE H 3 61 ILE HB 3.000 . 3.500 2.443 2.426 2.462 . 0 0 "[ . 1 .]" 1 928 3 61 ILE MG 3 64 CYS H 6.000 . 6.500 5.612 5.539 5.708 . 0 0 "[ . 1 .]" 1 929 3 62 HIS HA 3 78 ILE HA 3.000 . 3.500 2.225 2.194 2.264 . 0 0 "[ . 1 .]" 1 930 3 61 ILE MG 3 62 HIS HA 5.000 . 5.500 3.939 3.876 3.984 . 0 0 "[ . 1 .]" 1 931 3 62 HIS HA 3 78 ILE MG 4.000 . 4.500 3.694 3.613 3.779 . 0 0 "[ . 1 .]" 1 932 3 56 THR HA 3 62 HIS HD2 5.000 . 5.500 4.290 4.247 4.353 . 0 0 "[ . 1 .]" 1 933 3 60 LEU HA 3 62 HIS HD2 6.000 . 6.500 5.246 5.185 5.315 . 0 0 "[ . 1 .]" 1 934 3 60 LEU QB 3 62 HIS HD2 5.000 . 5.500 3.512 3.434 3.624 . 0 0 "[ . 1 .]" 1 935 3 61 ILE HA 3 62 HIS HD2 5.000 . 5.500 3.433 3.350 3.496 . 0 0 "[ . 1 .]" 1 936 3 62 HIS HA 3 62 HIS HD2 5.000 . 5.500 4.004 3.950 4.074 . 0 0 "[ . 1 .]" 1 937 3 62 HIS HD2 3 78 ILE MG 5.000 . 5.500 4.538 4.472 4.604 . 0 0 "[ . 1 .]" 1 938 3 56 THR HB 3 62 HIS HD2 4.000 . 4.500 4.501 4.468 4.523 0.023 11 0 "[ . 1 .]" 1 939 3 56 THR MG 3 62 HIS HD2 3.000 . 3.500 2.275 2.249 2.303 . 0 0 "[ . 1 .]" 1 940 3 60 LEU QD 3 62 HIS HD2 5.000 . 5.500 4.915 4.827 5.010 . 0 0 "[ . 1 .]" 1 941 3 62 HIS HD2 3 78 ILE MD 5.000 . 5.500 4.841 4.750 5.002 . 0 0 "[ . 1 .]" 1 942 3 61 ILE MG 3 62 HIS HD2 5.000 . 5.500 4.906 4.827 4.977 . 0 0 "[ . 1 .]" 1 943 3 56 THR HA 3 62 HIS HE1 6.000 . 6.500 6.755 6.726 6.781 0.281 7 0 "[ . 1 .]" 1 944 3 62 HIS HE1 3 78 ILE HA 5.000 . 5.500 5.310 5.279 5.357 . 0 0 "[ . 1 .]" 1 945 3 62 HIS HE1 3 78 ILE MG 4.000 . 4.500 4.434 4.348 4.484 . 0 0 "[ . 1 .]" 1 946 3 56 THR HB 3 62 HIS HE1 6.000 . 6.500 5.351 5.235 5.439 . 0 0 "[ . 1 .]" 1 947 3 56 THR MG 3 62 HIS HE1 4.000 . 4.500 3.274 3.224 3.307 . 0 0 "[ . 1 .]" 1 948 3 60 LEU QD 3 62 HIS HE1 4.000 . 4.500 4.050 3.913 4.143 . 0 0 "[ . 1 .]" 1 949 3 62 HIS HE1 3 78 ILE MD 3.000 . 3.500 2.192 2.110 2.384 . 0 0 "[ . 1 .]" 1 950 3 62 HIS HE1 3 78 ILE QG 4.000 . 4.500 2.778 2.760 2.794 . 0 0 "[ . 1 .]" 1 951 3 62 HIS HE1 3 78 ILE HB 5.000 . 5.500 5.339 5.275 5.434 . 0 0 "[ . 1 .]" 1 952 3 62 HIS H 3 63 PHE H 4.000 . 4.500 4.329 4.304 4.354 . 0 0 "[ . 1 .]" 1 953 3 55 GLN H 3 62 HIS H 4.000 . 4.500 4.602 4.534 4.723 0.223 11 0 "[ . 1 .]" 1 954 3 54 GLN H 3 62 HIS H 3.000 . 3.500 2.939 2.900 2.979 . 0 0 "[ . 1 .]" 1 955 3 61 ILE H 3 62 HIS H 4.000 . 4.500 4.419 4.395 4.462 . 0 0 "[ . 1 .]" 1 956 3 62 HIS HA 3 64 CYS H 5.000 . 5.500 5.463 5.420 5.530 0.030 11 0 "[ . 1 .]" 1 957 3 62 HIS HA 3 63 PHE H 2.500 . 3.000 2.152 2.131 2.167 . 0 0 "[ . 1 .]" 1 958 3 62 HIS HA 3 77 LEU H 4.000 . 4.500 4.533 4.216 4.636 0.136 5 0 "[ . 1 .]" 1 959 3 54 GLN H 3 62 HIS HA 4.000 . 4.500 4.640 4.570 4.777 0.277 12 0 "[ . 1 .]" 1 960 3 62 HIS HA 3 79 ILE H 4.000 . 4.500 3.403 3.338 3.455 . 0 0 "[ . 1 .]" 1 961 3 62 HIS H 3 62 HIS QB 3.000 . 3.500 2.365 2.350 2.393 . 0 0 "[ . 1 .]" 1 962 3 62 HIS QB 3 63 PHE H 3.000 . 3.500 3.467 3.418 3.515 0.015 3 0 "[ . 1 .]" 1 963 3 54 GLN H 3 62 HIS QB 4.000 . 4.500 2.857 2.780 3.009 . 0 0 "[ . 1 .]" 1 964 3 56 THR H 3 62 HIS HD2 3.000 . 3.500 2.322 2.274 2.359 . 0 0 "[ . 1 .]" 1 965 3 57 ASP H 3 62 HIS HD2 5.500 . 6.000 6.093 6.073 6.107 0.107 12 0 "[ . 1 .]" 1 966 3 62 HIS H 3 62 HIS HD2 3.000 . 3.500 2.699 2.647 2.775 . 0 0 "[ . 1 .]" 1 967 3 58 ASP H 3 62 HIS HD2 5.000 . 5.500 5.757 5.728 5.788 0.288 6 0 "[ . 1 .]" 1 968 3 60 LEU H 3 62 HIS HD2 4.000 . 4.500 4.472 4.424 4.501 0.001 6 0 "[ . 1 .]" 1 969 3 62 HIS HD2 3 63 PHE H 6.000 . 6.500 6.044 5.996 6.097 . 0 0 "[ . 1 .]" 1 970 3 55 GLN H 3 62 HIS HD2 5.000 . 5.500 4.979 4.915 5.036 . 0 0 "[ . 1 .]" 1 971 3 54 GLN H 3 62 HIS HD2 5.000 . 5.500 4.945 4.889 4.999 . 0 0 "[ . 1 .]" 1 972 3 62 HIS HA 3 63 PHE HA 4.000 . 4.500 4.428 4.422 4.441 . 0 0 "[ . 1 .]" 1 973 3 53 ILE QG 3 63 PHE HA 4.000 . 4.500 2.630 2.468 2.728 . 0 0 "[ . 1 .]" 1 974 3 51 VAL QG 3 63 PHE HA 5.000 . 5.500 4.723 4.643 4.830 . 0 0 "[ . 1 .]" 1 975 3 53 ILE MG 3 63 PHE HA 4.000 . 4.500 3.471 3.408 3.531 . 0 0 "[ . 1 .]" 1 976 3 53 ILE MD 3 63 PHE HA 4.000 . 4.500 4.253 4.102 4.360 . 0 0 "[ . 1 .]" 1 977 3 63 PHE QB 3 79 ILE MD 3.000 . 3.500 2.917 2.295 3.128 . 0 0 "[ . 1 .]" 1 978 3 63 PHE QB 3 132 LEU QD 4.000 . 4.500 2.300 2.011 2.591 . 0 0 "[ . 1 .]" 1 979 3 53 ILE HA 3 63 PHE QD 6.000 . 6.500 4.646 4.465 4.846 . 0 0 "[ . 1 .]" 1 980 3 63 PHE HA 3 63 PHE QD 4.000 . 4.500 2.944 2.900 2.988 . 0 0 "[ . 1 .]" 1 981 3 63 PHE QD 3 65 TRP HA 6.000 . 6.500 5.738 5.558 5.816 . 0 0 "[ . 1 .]" 1 982 3 51 VAL QG 3 63 PHE QD 5.000 . 5.500 3.769 3.637 3.945 . 0 0 "[ . 1 .]" 1 983 3 63 PHE QD 3 100 LEU QD 4.000 . 4.500 3.403 3.239 3.508 . 0 0 "[ . 1 .]" 1 984 3 63 PHE QD 3 132 LEU QD 4.000 . 4.500 2.090 1.855 2.333 . 0 0 "[ . 1 .]" 1 985 3 63 PHE QD 3 77 LEU QD 4.000 . 4.500 3.760 2.538 4.104 . 0 0 "[ . 1 .]" 1 986 3 63 PHE QD 3 109 LEU QD 4.000 . 4.500 4.206 3.981 4.405 . 0 0 "[ . 1 .]" 1 987 3 53 ILE MD 3 63 PHE QD 4.000 . 4.500 2.986 2.601 3.147 . 0 0 "[ . 1 .]" 1 988 3 53 ILE HB 3 63 PHE QD 5.000 . 5.500 5.465 5.199 5.563 0.063 10 0 "[ . 1 .]" 1 989 3 63 PHE QD 3 128 VAL QG 4.000 . 4.500 3.340 3.197 3.502 . 0 0 "[ . 1 .]" 1 990 3 63 PHE QD 3 79 ILE MD 4.000 . 4.500 4.180 3.840 4.364 . 0 0 "[ . 1 .]" 1 991 3 63 PHE QE 3 86 PHE QD 4.000 . 4.500 4.603 4.554 4.645 0.145 5 0 "[ . 1 .]" 1 992 3 63 PHE QE 3 111 PHE QD 5.000 . 5.500 4.973 4.839 5.060 . 0 0 "[ . 1 .]" 1 993 3 63 PHE QE 3 111 PHE QE 4.000 . 4.500 3.725 3.537 3.856 . 0 0 "[ . 1 .]" 1 994 3 63 PHE QE 3 111 PHE HZ 4.000 . 4.500 3.229 2.873 3.402 . 0 0 "[ . 1 .]" 1 995 3 51 VAL QG 3 63 PHE QE 3.000 . 3.500 2.520 2.342 2.752 . 0 0 "[ . 1 .]" 1 996 3 63 PHE QE 3 100 LEU QD 3.000 . 3.500 3.111 2.892 3.239 . 0 0 "[ . 1 .]" 1 997 3 63 PHE QE 3 132 LEU QD 5.000 . 5.500 2.923 2.698 3.221 . 0 0 "[ . 1 .]" 1 998 3 63 PHE QE 3 77 LEU QD 5.000 . 5.500 4.732 3.626 5.087 . 0 0 "[ . 1 .]" 1 999 3 63 PHE QE 3 109 LEU QD 4.000 . 4.500 3.474 3.256 3.738 . 0 0 "[ . 1 .]" 1 1000 3 53 ILE MD 3 63 PHE QE 4.000 . 4.500 3.574 3.377 3.835 . 0 0 "[ . 1 .]" 1 1001 3 63 PHE HZ 3 111 PHE HZ 5.000 . 5.500 4.172 3.685 4.401 . 0 0 "[ . 1 .]" 1 1002 3 51 VAL QG 3 63 PHE HZ 3.000 . 3.500 2.419 2.291 2.553 . 0 0 "[ . 1 .]" 1 1003 3 63 PHE HZ 3 100 LEU QD 4.000 . 4.500 3.421 3.161 3.571 . 0 0 "[ . 1 .]" 1 1004 3 63 PHE HZ 3 109 LEU QD 6.000 . 6.500 4.482 4.114 4.704 . 0 0 "[ . 1 .]" 1 1005 3 63 PHE HZ 3 128 VAL QG 6.000 . 6.500 4.149 3.941 4.441 . 0 0 "[ . 1 .]" 1 1006 3 63 PHE H 3 77 LEU H 4.000 . 4.500 3.227 3.039 3.309 . 0 0 "[ . 1 .]" 1 1007 3 54 GLN H 3 63 PHE H 5.000 . 5.500 5.050 4.976 5.194 . 0 0 "[ . 1 .]" 1 1008 3 63 PHE H 3 79 ILE H 4.000 . 4.500 3.340 3.239 3.402 . 0 0 "[ . 1 .]" 1 1009 3 63 PHE H 3 78 ILE H 5.000 . 5.500 4.569 4.499 4.640 . 0 0 "[ . 1 .]" 1 1010 3 53 ILE H 3 63 PHE HA 5.000 . 5.500 5.436 5.315 5.541 0.041 12 0 "[ . 1 .]" 1 1011 3 52 TYR H 3 63 PHE HA 5.000 . 5.500 5.295 5.188 5.401 . 0 0 "[ . 1 .]" 1 1012 3 63 PHE HA 3 64 CYS H 2.500 . 3.000 2.181 2.154 2.197 . 0 0 "[ . 1 .]" 1 1013 3 63 PHE HA 3 77 LEU H 5.000 . 5.500 4.727 4.690 4.772 . 0 0 "[ . 1 .]" 1 1014 3 54 GLN H 3 63 PHE HA 4.000 . 4.500 4.064 3.986 4.176 . 0 0 "[ . 1 .]" 1 1015 3 63 PHE HA 3 79 ILE H 5.000 . 5.500 5.528 5.479 5.580 0.080 13 0 "[ . 1 .]" 1 1016 3 63 PHE H 3 78 ILE HA 4.000 . 4.500 2.959 2.886 3.015 . 0 0 "[ . 1 .]" 1 1017 3 63 PHE QB 3 64 CYS H 4.000 . 4.500 3.941 3.925 3.954 . 0 0 "[ . 1 .]" 1 1018 3 63 PHE H 3 63 PHE QB 3.000 . 3.500 2.337 2.311 2.355 . 0 0 "[ . 1 .]" 1 1019 3 63 PHE QB 3 77 LEU H 4.000 . 4.500 3.233 3.028 3.333 . 0 0 "[ . 1 .]" 1 1020 3 63 PHE QB 3 79 ILE H 5.000 . 5.500 3.779 3.704 3.839 . 0 0 "[ . 1 .]" 1 1021 3 52 TYR H 3 63 PHE QD 6.000 . 6.500 5.638 5.537 5.733 . 0 0 "[ . 1 .]" 1 1022 3 63 PHE QD 3 76 ASP H 5.000 . 5.500 5.624 5.588 5.714 0.214 2 0 "[ . 1 .]" 1 1023 3 63 PHE QD 3 64 CYS H 4.000 . 4.500 3.923 3.863 3.963 . 0 0 "[ . 1 .]" 1 1024 3 63 PHE H 3 63 PHE QD 4.000 . 4.500 4.191 4.166 4.221 . 0 0 "[ . 1 .]" 1 1025 3 63 PHE QD 3 77 LEU H 4.000 . 4.500 3.600 3.500 3.840 . 0 0 "[ . 1 .]" 1 1026 3 63 PHE QE 3 64 CYS H 5.000 . 5.500 4.975 4.910 5.012 . 0 0 "[ . 1 .]" 1 1027 3 63 PHE H 3 63 PHE QE 6.000 . 6.500 6.241 6.223 6.272 . 0 0 "[ . 1 .]" 1 1028 3 63 PHE QE 3 77 LEU H 6.000 . 6.500 5.795 5.667 6.036 . 0 0 "[ . 1 .]" 1 1029 3 63 PHE QD 3 65 TRP H 5.000 . 5.500 4.645 4.445 4.765 . 0 0 "[ . 1 .]" 1 1030 3 52 TYR H 3 63 PHE QE 6.000 . 6.500 5.348 5.225 5.457 . 0 0 "[ . 1 .]" 1 1031 3 63 PHE HA 3 132 LEU QD 4.000 . 4.500 3.571 3.373 3.860 . 0 0 "[ . 1 .]" 1 1032 3 64 CYS HA 3 76 ASP HA 3.000 . 3.500 2.283 2.168 2.395 . 0 0 "[ . 1 .]" 1 1033 3 64 CYS HA 3 73 VAL QG 4.000 . 4.500 3.522 3.291 3.709 . 0 0 "[ . 1 .]" 1 1034 3 63 PHE HA 3 64 CYS QB 5.000 . 5.500 4.513 4.364 4.835 . 0 0 "[ . 1 .]" 1 1035 3 64 CYS QB 3 76 ASP HA 4.000 . 4.500 3.135 2.167 3.639 . 0 0 "[ . 1 .]" 1 1036 3 63 PHE H 3 64 CYS H 4.000 . 4.500 4.246 4.217 4.283 . 0 0 "[ . 1 .]" 1 1037 3 64 CYS H 3 77 LEU H 5.000 . 5.500 4.795 4.718 4.881 . 0 0 "[ . 1 .]" 1 1038 3 54 GLN H 3 64 CYS H 4.000 . 4.500 4.450 4.359 4.570 0.070 13 0 "[ . 1 .]" 1 1039 3 64 CYS HA 3 65 TRP H 3.000 . 3.500 2.146 2.114 2.170 . 0 0 "[ . 1 .]" 1 1040 3 52 TYR H 3 64 CYS HA 4.500 . 5.000 5.247 5.180 5.297 0.297 13 0 "[ . 1 .]" 1 1041 3 64 CYS H 3 64 CYS HA 3.000 . 3.500 2.950 2.943 2.959 . 0 0 "[ . 1 .]" 1 1042 3 64 CYS HA 3 77 LEU H 4.000 . 4.500 3.415 3.285 3.578 . 0 0 "[ . 1 .]" 1 1043 3 53 ILE MD 3 64 CYS H 5.000 . 5.500 5.407 5.228 5.512 0.012 5 0 "[ . 1 .]" 1 1044 3 64 CYS QB 3 65 TRP H 3.000 . 3.500 2.811 2.717 2.927 . 0 0 "[ . 1 .]" 1 1045 3 52 TYR H 3 64 CYS QB 4.000 . 4.500 4.026 3.839 4.424 . 0 0 "[ . 1 .]" 1 1046 3 64 CYS H 3 64 CYS QB 3.000 . 3.500 2.651 2.446 3.105 . 0 0 "[ . 1 .]" 1 1047 3 64 CYS H 3 64 CYS HG 4.000 . 4.500 3.218 2.623 3.626 . 0 0 "[ . 1 .]" 1 1048 3 64 CYS HG 3 65 TRP H 5.000 . 5.500 5.162 4.819 5.402 . 0 0 "[ . 1 .]" 1 1049 3 52 TYR H 3 64 CYS HG 6.000 . 6.500 6.254 5.898 6.382 . 0 0 "[ . 1 .]" 1 1050 3 54 GLN H 3 64 CYS HG 5.000 . 5.500 4.632 4.329 4.960 . 0 0 "[ . 1 .]" 1 1051 3 62 HIS H 3 64 CYS HG 6.000 . 6.500 5.508 5.190 5.725 . 0 0 "[ . 1 .]" 1 1052 3 63 PHE H 3 64 CYS HG 5.000 . 5.500 4.327 3.874 4.940 . 0 0 "[ . 1 .]" 1 1053 3 64 CYS HG 3 77 LEU H 5.000 . 5.500 4.318 3.741 4.887 . 0 0 "[ . 1 .]" 1 1054 3 64 CYS HG 3 76 ASP H 6.000 . 6.500 6.075 5.622 6.290 . 0 0 "[ . 1 .]" 1 1055 3 51 VAL QG 3 65 TRP HA 4.000 . 4.500 3.363 3.255 3.438 . 0 0 "[ . 1 .]" 1 1056 3 65 TRP QB 3 75 ASP QB 4.000 . 4.500 1.973 1.888 2.047 . 0 0 "[ . 1 .]" 1 1057 3 51 VAL QG 3 65 TRP QB 4.500 . 5.000 3.073 2.965 3.186 . 0 0 "[ . 1 .]" 1 1058 3 51 VAL QG 3 65 TRP HD1 3.000 . 3.500 1.798 1.774 1.821 0.026 5 0 "[ . 1 .]" 1 1059 3 34 LYS QD 3 65 TRP HE3 5.000 . 5.500 4.372 3.396 5.162 . 0 0 "[ . 1 .]" 1 1060 3 34 LYS QE 3 65 TRP HE3 5.000 . 5.500 3.807 3.004 4.728 . 0 0 "[ . 1 .]" 1 1061 3 65 TRP HE3 3 66 LYS HA 5.000 . 5.500 3.905 3.800 4.084 . 0 0 "[ . 1 .]" 1 1062 3 65 TRP HE3 3 73 VAL HA 5.000 . 5.500 5.267 5.150 5.337 . 0 0 "[ . 1 .]" 1 1063 3 65 TRP HE3 3 74 GLU HA 5.000 . 5.500 4.841 4.781 4.922 . 0 0 "[ . 1 .]" 1 1064 3 65 TRP HE3 3 74 GLU QB 3.000 . 3.500 1.931 1.865 2.031 . 0 0 "[ . 1 .]" 1 1065 3 65 TRP HE3 3 74 GLU QG 3.000 . 3.500 3.476 3.196 3.642 0.142 6 0 "[ . 1 .]" 1 1066 3 65 TRP HE3 3 75 ASP HA 5.000 . 5.500 5.074 4.947 5.147 . 0 0 "[ . 1 .]" 1 1067 3 33 GLY QA 3 65 TRP HZ2 5.000 . 5.500 2.662 2.365 2.826 . 0 0 "[ . 1 .]" 1 1068 3 49 GLY QA 3 65 TRP HZ2 4.000 . 4.500 2.501 2.417 2.584 . 0 0 "[ . 1 .]" 1 1069 3 65 TRP QB 3 65 TRP HZ2 5.000 . 5.500 5.637 5.619 5.655 0.155 12 0 "[ . 1 .]" 1 1070 3 65 TRP HZ2 3 67 ASP HA 5.000 . 5.500 3.753 3.549 3.889 . 0 0 "[ . 1 .]" 1 1071 3 34 LYS QE 3 65 TRP HZ3 5.000 . 5.500 3.817 2.931 4.837 . 0 0 "[ . 1 .]" 1 1072 3 65 TRP HZ3 3 67 ASP HA 5.000 . 5.500 3.980 3.910 4.108 . 0 0 "[ . 1 .]" 1 1073 3 65 TRP HZ3 3 67 ASP QB 3.000 . 3.500 2.760 2.473 2.896 . 0 0 "[ . 1 .]" 1 1074 3 65 TRP HZ3 3 74 GLU QB 3.000 . 3.500 2.311 2.224 2.414 . 0 0 "[ . 1 .]" 1 1075 3 65 TRP HZ3 3 74 GLU QG 4.000 . 4.500 2.817 2.114 3.530 . 0 0 "[ . 1 .]" 1 1076 3 65 TRP HZ3 3 75 ASP HA 6.000 . 6.500 6.767 6.673 6.831 0.331 3 0 "[ . 1 .]" 1 1077 3 65 TRP HH2 3 67 ASP HA 4.000 . 4.500 3.310 3.180 3.410 . 0 0 "[ . 1 .]" 1 1078 3 65 TRP HH2 3 67 ASP QB 4.000 . 4.500 3.136 2.795 3.363 . 0 0 "[ . 1 .]" 1 1079 3 34 LYS QE 3 65 TRP HH2 5.000 . 5.500 4.158 3.435 5.052 . 0 0 "[ . 1 .]" 1 1080 3 32 ALA MB 3 65 TRP HD1 4.000 . 4.500 3.864 3.706 4.019 . 0 0 "[ . 1 .]" 1 1081 3 65 TRP HA 3 65 TRP HD1 5.000 . 5.500 3.045 3.018 3.075 . 0 0 "[ . 1 .]" 1 1082 3 52 TYR H 3 65 TRP H 5.000 . 5.500 5.187 5.121 5.232 . 0 0 "[ . 1 .]" 1 1083 3 64 CYS H 3 65 TRP H 4.000 . 4.500 4.451 4.428 4.474 . 0 0 "[ . 1 .]" 1 1084 3 65 TRP H 3 77 LEU H 5.000 . 5.500 5.185 5.066 5.439 . 0 0 "[ . 1 .]" 1 1085 3 65 TRP H 3 66 LYS H 4.000 . 4.500 4.111 4.075 4.196 . 0 0 "[ . 1 .]" 1 1086 3 34 LYS H 3 65 TRP HD1 5.000 . 5.500 5.544 5.493 5.620 0.120 10 0 "[ . 1 .]" 1 1087 3 65 TRP H 3 65 TRP HD1 5.000 . 5.500 5.335 5.284 5.377 . 0 0 "[ . 1 .]" 1 1088 3 52 TYR H 3 65 TRP HD1 4.500 . 5.000 5.086 5.020 5.116 0.116 2 0 "[ . 1 .]" 1 1089 3 50 LEU H 3 65 TRP HD1 4.000 . 4.500 4.128 4.048 4.202 . 0 0 "[ . 1 .]" 1 1090 3 51 VAL H 3 65 TRP HD1 5.000 . 5.500 4.325 4.196 4.463 . 0 0 "[ . 1 .]" 1 1091 3 32 ALA H 3 65 TRP HD1 5.000 . 5.500 5.275 5.070 5.523 0.023 9 0 "[ . 1 .]" 1 1092 3 65 TRP HD1 3 66 LYS H 4.000 . 4.500 4.303 4.230 4.395 . 0 0 "[ . 1 .]" 1 1093 3 49 GLY H 3 65 TRP HZ2 4.000 . 4.500 3.032 2.612 3.220 . 0 0 "[ . 1 .]" 1 1094 3 34 LYS H 3 65 TRP HZ2 4.000 . 4.500 2.706 2.427 2.934 . 0 0 "[ . 1 .]" 1 1095 3 50 LEU H 3 65 TRP HZ2 4.000 . 4.500 4.694 4.644 4.737 0.237 12 0 "[ . 1 .]" 1 1096 3 48 LYS H 3 65 TRP HZ2 5.000 . 5.500 5.124 4.870 5.391 . 0 0 "[ . 1 .]" 1 1097 3 65 TRP HZ2 3 68 ARG H 4.000 . 4.500 4.658 4.439 4.764 0.264 12 0 "[ . 1 .]" 1 1098 3 47 ARG H 3 65 TRP HZ2 5.000 . 5.500 5.516 5.431 5.601 0.101 12 0 "[ . 1 .]" 1 1099 3 65 TRP HA 3 75 ASP H 4.500 . 5.000 4.745 4.657 4.817 . 0 0 "[ . 1 .]" 1 1100 3 65 TRP H 3 65 TRP HA 2.500 . 3.000 2.949 2.942 2.959 . 0 0 "[ . 1 .]" 1 1101 3 52 TYR H 3 65 TRP HA 3.000 . 3.500 3.476 3.391 3.537 0.037 7 0 "[ . 1 .]" 1 1102 3 50 LEU H 3 65 TRP HA 4.000 . 4.500 3.917 3.868 4.000 . 0 0 "[ . 1 .]" 1 1103 3 51 VAL H 3 65 TRP HA 5.000 . 5.500 4.996 4.950 5.039 . 0 0 "[ . 1 .]" 1 1104 3 65 TRP HA 3 66 LYS H 2.500 . 3.000 2.125 2.092 2.146 . 0 0 "[ . 1 .]" 1 1105 3 65 TRP HA 3 65 TRP HE1 5.000 . 5.500 4.926 4.899 4.944 . 0 0 "[ . 1 .]" 1 1106 3 65 TRP QB 3 75 ASP H 4.000 . 4.500 3.293 3.208 3.359 . 0 0 "[ . 1 .]" 1 1107 3 65 TRP H 3 65 TRP QB 3.000 . 3.500 2.522 2.451 2.575 . 0 0 "[ . 1 .]" 1 1108 3 65 TRP QB 3 66 LYS H 3.500 . 4.000 3.864 3.841 3.886 . 0 0 "[ . 1 .]" 1 1109 3 65 TRP HE3 3 75 ASP H 4.000 . 4.500 3.177 3.023 3.289 . 0 0 "[ . 1 .]" 1 1110 3 65 TRP H 3 65 TRP HE3 4.000 . 4.500 4.390 4.345 4.437 . 0 0 "[ . 1 .]" 1 1111 3 65 TRP HE3 3 67 ASP H 4.000 . 4.500 4.406 4.150 4.539 0.039 2 0 "[ . 1 .]" 1 1112 3 65 TRP HE3 3 66 LYS H 4.000 . 4.500 4.646 4.605 4.719 0.219 13 0 "[ . 1 .]" 1 1113 3 65 TRP HE3 3 74 GLU H 4.000 . 4.500 3.501 3.393 3.601 . 0 0 "[ . 1 .]" 1 1114 3 65 TRP HZ3 3 75 ASP H 5.000 . 5.500 5.062 4.914 5.207 . 0 0 "[ . 1 .]" 1 1115 3 65 TRP HZ3 3 67 ASP H 4.000 . 4.500 4.142 3.857 4.278 . 0 0 "[ . 1 .]" 1 1116 3 65 TRP HZ3 3 68 ARG H 5.500 . 6.000 6.038 5.932 6.128 0.128 13 0 "[ . 1 .]" 1 1117 3 65 TRP HZ3 3 74 GLU H 4.000 . 4.500 4.416 4.268 4.504 0.004 10 0 "[ . 1 .]" 1 1118 3 47 ARG HE 3 65 TRP HZ3 5.000 . 5.500 5.548 5.407 5.611 0.111 13 0 "[ . 1 .]" 1 1119 3 65 TRP HH2 3 67 ASP H 5.000 . 5.500 5.103 4.832 5.262 . 0 0 "[ . 1 .]" 1 1120 3 65 TRP HH2 3 68 ARG H 5.000 . 5.500 4.764 4.585 4.830 . 0 0 "[ . 1 .]" 1 1121 3 47 ARG H 3 65 TRP HH2 4.500 2.800 5.000 5.297 5.189 5.396 0.396 12 0 "[ . 1 .]" 1 1122 3 47 ARG HE 3 65 TRP HH2 4.000 . 4.500 4.301 4.118 4.499 . 0 0 "[ . 1 .]" 1 1123 3 52 TYR H 3 65 TRP QB 5.000 . 5.500 4.875 4.779 4.929 . 0 0 "[ . 1 .]" 1 1124 3 48 LYS H 3 65 TRP HH2 6.000 . 6.500 5.609 5.407 5.969 . 0 0 "[ . 1 .]" 1 1125 3 66 LYS HA 3 66 LYS QG 3.000 . 3.500 2.969 2.499 3.202 . 0 0 "[ . 1 .]" 1 1126 3 66 LYS HA 3 66 LYS QD 4.000 . 4.500 4.293 3.953 4.514 0.014 15 0 "[ . 1 .]" 1 1127 3 66 LYS HA 3 73 VAL HA 2.500 . 3.000 2.045 2.024 2.077 . 0 0 "[ . 1 .]" 1 1128 3 66 LYS HA 3 73 VAL HB 5.000 . 5.500 5.048 5.017 5.093 . 0 0 "[ . 1 .]" 1 1129 3 66 LYS HA 3 73 VAL QG 3.000 . 3.500 3.187 3.092 3.224 . 0 0 "[ . 1 .]" 1 1130 3 66 LYS QB 3 66 LYS QE 3.000 . 3.500 2.033 2.005 2.077 . 0 0 "[ . 1 .]" 1 1131 3 66 LYS QB 3 73 VAL HA 3.000 . 3.500 2.196 2.100 2.531 . 0 0 "[ . 1 .]" 1 1132 3 66 LYS QB 3 73 VAL QG 3.000 . 3.500 2.222 2.069 2.351 . 0 0 "[ . 1 .]" 1 1133 3 66 LYS QE 3 66 LYS QG 3.000 . 3.500 2.272 2.212 2.329 . 0 0 "[ . 1 .]" 1 1134 3 66 LYS QG 3 68 ARG HA 4.000 . 4.500 3.540 3.465 3.769 . 0 0 "[ . 1 .]" 1 1135 3 66 LYS QG 3 73 VAL HA 4.000 . 4.500 3.771 2.895 4.149 . 0 0 "[ . 1 .]" 1 1136 3 66 LYS QD 3 71 GLY QA 3.000 . 3.500 3.018 2.180 3.645 0.145 10 0 "[ . 1 .]" 1 1137 3 66 LYS HA 3 66 LYS QE 4.000 . 4.500 4.329 4.135 4.522 0.022 8 0 "[ . 1 .]" 1 1138 3 66 LYS QE 3 68 ARG HA 4.000 . 4.500 4.519 4.409 4.609 0.109 15 0 "[ . 1 .]" 1 1139 3 66 LYS QE 3 71 GLY QA 3.000 . 3.500 2.953 2.261 3.674 0.174 11 0 "[ . 1 .]" 1 1140 3 50 LEU QD 3 66 LYS QE 3.000 . 3.500 3.108 2.294 3.820 0.320 2 0 "[ . 1 .]" 1 1141 3 66 LYS QE 3 73 VAL QG 3.000 . 3.500 3.179 2.620 3.758 0.258 5 0 "[ . 1 .]" 1 1142 3 66 LYS H 3 67 ASP H 5.000 . 5.500 4.483 4.411 4.520 . 0 0 "[ . 1 .]" 1 1143 3 51 VAL H 3 66 LYS H 5.000 . 5.500 5.160 5.105 5.207 . 0 0 "[ . 1 .]" 1 1144 3 66 LYS H 3 74 GLU H 4.000 . 4.500 4.509 4.327 4.628 0.128 5 0 "[ . 1 .]" 1 1145 3 65 TRP HE1 3 66 LYS H 5.000 . 5.500 5.250 5.141 5.350 . 0 0 "[ . 1 .]" 1 1146 3 66 LYS HA 3 75 ASP H 3.000 . 3.500 3.605 3.502 3.725 0.225 5 0 "[ . 1 .]" 1 1147 3 66 LYS HA 3 67 ASP H 2.500 . 3.000 2.189 2.123 2.232 . 0 0 "[ . 1 .]" 1 1148 3 66 LYS HA 3 73 VAL H 4.000 . 4.500 4.529 4.485 4.577 0.077 4 0 "[ . 1 .]" 1 1149 3 66 LYS H 3 66 LYS HA 3.000 . 3.500 2.934 2.923 2.945 . 0 0 "[ . 1 .]" 1 1150 3 66 LYS HA 3 74 GLU H 3.000 . 3.500 1.934 1.793 2.140 0.007 7 0 "[ . 1 .]" 1 1151 3 66 LYS QG 3 71 GLY H 4.000 . 4.500 3.984 3.670 4.223 . 0 0 "[ . 1 .]" 1 1152 3 66 LYS QG 3 67 ASP H 3.000 . 3.500 2.945 2.528 3.270 . 0 0 "[ . 1 .]" 1 1153 3 66 LYS QG 3 68 ARG H 5.000 . 5.500 4.187 4.046 4.530 . 0 0 "[ . 1 .]" 1 1154 3 66 LYS H 3 66 LYS QG 3.500 . 4.000 3.056 2.460 3.880 . 0 0 "[ . 1 .]" 1 1155 3 66 LYS QG 3 74 GLU H 4.000 . 4.500 4.473 3.900 4.770 0.270 6 0 "[ . 1 .]" 1 1156 3 50 LEU QB 3 66 LYS H 4.000 . 4.500 3.188 3.032 3.290 . 0 0 "[ . 1 .]" 1 1157 3 66 LYS H 3 66 LYS QD 5.000 . 5.500 4.189 3.578 4.838 . 0 0 "[ . 1 .]" 1 1158 3 65 TRP H 3 66 LYS QB 5.000 . 5.500 4.858 4.782 4.972 . 0 0 "[ . 1 .]" 1 1159 3 66 LYS QB 3 67 ASP H 3.000 . 3.500 3.296 2.988 3.745 0.245 5 0 "[ . 1 .]" 1 1160 3 66 LYS QB 3 73 VAL H 4.000 . 4.500 3.700 3.424 4.300 . 0 0 "[ . 1 .]" 1 1161 3 66 LYS H 3 66 LYS QB 2.500 . 3.000 2.356 2.211 2.503 . 0 0 "[ . 1 .]" 1 1162 3 66 LYS QB 3 74 GLU H 4.000 . 4.500 3.560 3.386 3.959 . 0 0 "[ . 1 .]" 1 1163 3 50 LEU H 3 66 LYS QG 4.500 . 5.000 3.042 2.376 4.082 . 0 0 "[ . 1 .]" 1 1164 3 66 LYS QD 3 71 GLY H 5.000 . 5.500 5.056 4.262 5.657 0.157 10 0 "[ . 1 .]" 1 1165 3 66 LYS QD 3 72 ASN H 5.000 . 5.500 4.802 3.840 5.590 0.090 4 0 "[ . 1 .]" 1 1166 3 66 LYS QD 3 67 ASP H 5.000 . 5.500 4.862 4.443 5.185 . 0 0 "[ . 1 .]" 1 1167 3 67 ASP H 3 71 GLY H 4.000 . 4.500 4.555 4.529 4.618 0.118 5 0 "[ . 1 .]" 1 1168 3 67 ASP H 3 68 ARG H 5.000 . 5.500 4.544 4.516 4.585 . 0 0 "[ . 1 .]" 1 1169 3 67 ASP H 3 74 GLU H 4.000 . 4.500 2.907 2.785 3.033 . 0 0 "[ . 1 .]" 1 1170 3 67 ASP HA 3 69 THR H 4.000 . 4.500 3.648 3.593 3.693 . 0 0 "[ . 1 .]" 1 1171 3 67 ASP H 3 67 ASP HA 3.000 . 3.500 2.894 2.865 2.917 . 0 0 "[ . 1 .]" 1 1172 3 50 LEU H 3 67 ASP HA 4.000 . 4.500 3.943 3.819 4.037 . 0 0 "[ . 1 .]" 1 1173 3 67 ASP HA 3 68 ARG H 3.000 . 3.500 2.179 2.161 2.195 . 0 0 "[ . 1 .]" 1 1174 3 67 ASP QB 3 71 GLY H 4.000 . 4.500 3.582 3.364 3.846 . 0 0 "[ . 1 .]" 1 1175 3 67 ASP QB 3 70 SER H 4.000 . 4.500 2.989 2.914 3.082 . 0 0 "[ . 1 .]" 1 1176 3 67 ASP QB 3 69 THR H 5.000 . 5.500 3.269 2.499 3.428 . 0 0 "[ . 1 .]" 1 1177 3 67 ASP QB 3 72 ASN H 3.500 . 4.000 3.527 3.339 4.208 0.208 3 0 "[ . 1 .]" 1 1178 3 67 ASP H 3 67 ASP QB 2.500 . 3.000 2.373 2.270 2.792 . 0 0 "[ . 1 .]" 1 1179 3 67 ASP QB 3 68 ARG H 4.000 . 4.500 3.610 3.005 3.747 . 0 0 "[ . 1 .]" 1 1180 3 68 ARG HA 3 68 ARG QB 2.500 . 3.000 2.415 2.360 2.432 . 0 0 "[ . 1 .]" 1 1181 3 68 ARG HA 3 68 ARG QG 3.000 . 3.500 2.391 2.132 2.646 . 0 0 "[ . 1 .]" 1 1182 3 68 ARG HA 3 68 ARG QD 4.000 . 4.500 3.303 2.052 4.131 . 0 0 "[ . 1 .]" 1 1183 3 68 ARG QB 3 68 ARG QD 3.000 . 3.500 2.333 2.069 2.595 . 0 0 "[ . 1 .]" 1 1184 3 49 GLY QA 3 68 ARG QG 4.000 . 4.500 2.049 2.024 2.146 . 0 0 "[ . 1 .]" 1 1185 3 50 LEU QD 3 68 ARG QG 4.000 . 4.500 3.463 3.232 3.702 . 0 0 "[ . 1 .]" 1 1186 3 50 LEU QD 3 68 ARG QD 3.000 . 3.500 2.904 2.489 3.220 . 0 0 "[ . 1 .]" 1 1187 3 68 ARG H 3 71 GLY H 5.000 . 5.500 4.505 4.460 4.528 . 0 0 "[ . 1 .]" 1 1188 3 65 TRP HE1 3 68 ARG H 6.000 . 6.500 6.187 5.997 6.301 . 0 0 "[ . 1 .]" 1 1189 3 68 ARG HA 3 71 GLY H 4.000 . 4.500 3.211 3.125 3.299 . 0 0 "[ . 1 .]" 1 1190 3 68 ARG HA 3 69 THR H 4.000 . 4.500 3.411 3.395 3.422 . 0 0 "[ . 1 .]" 1 1191 3 67 ASP H 3 68 ARG HA 5.000 . 5.500 5.338 5.272 5.416 . 0 0 "[ . 1 .]" 1 1192 3 50 LEU H 3 68 ARG HA 5.000 . 5.500 5.498 5.400 5.608 0.108 5 0 "[ . 1 .]" 1 1193 3 68 ARG QG 3 69 THR H 4.000 . 4.500 4.309 4.166 4.366 . 0 0 "[ . 1 .]" 1 1194 3 50 LEU H 3 68 ARG QG 4.000 . 4.500 3.637 3.533 3.768 . 0 0 "[ . 1 .]" 1 1195 3 68 ARG H 3 68 ARG QG 3.000 . 3.500 2.520 2.438 2.646 . 0 0 "[ . 1 .]" 1 1196 3 32 ALA H 3 68 ARG QG 4.000 . 4.500 4.492 4.305 4.616 0.116 7 0 "[ . 1 .]" 1 1197 3 68 ARG QB 3 69 THR H 3.000 . 3.500 3.072 3.044 3.116 . 0 0 "[ . 1 .]" 1 1198 3 50 LEU H 3 68 ARG QB 5.000 . 5.500 5.542 5.484 5.580 0.080 6 0 "[ . 1 .]" 1 1199 3 68 ARG H 3 68 ARG QB 3.000 . 3.500 2.344 2.290 2.452 . 0 0 "[ . 1 .]" 1 1200 3 67 ASP HA 3 68 ARG QB 6.000 . 6.500 4.370 4.325 4.468 . 0 0 "[ . 1 .]" 1 1201 3 50 LEU QB 3 68 ARG QB 6.000 . 6.500 4.970 4.852 5.133 . 0 0 "[ . 1 .]" 1 1202 3 68 ARG QB 3 71 GLY H 5.500 . 6.000 4.777 4.704 4.850 . 0 0 "[ . 1 .]" 1 1203 3 69 THR HA 3 69 THR HB 3.000 . 3.500 3.011 3.006 3.015 . 0 0 "[ . 1 .]" 1 1204 3 69 THR HA 3 69 THR MG 2.500 . 3.000 2.380 2.357 2.402 . 0 0 "[ . 1 .]" 1 1205 3 69 THR MG 3 70 SER HA 4.000 . 4.500 3.578 3.554 3.593 . 0 0 "[ . 1 .]" 1 1206 3 69 THR H 3 72 ASN H 5.000 . 5.500 5.374 5.326 5.479 . 0 0 "[ . 1 .]" 1 1207 3 67 ASP H 3 69 THR H 5.000 . 5.500 5.257 5.185 5.340 . 0 0 "[ . 1 .]" 1 1208 3 68 ARG H 3 69 THR H 3.000 . 3.500 2.465 2.397 2.512 . 0 0 "[ . 1 .]" 1 1209 3 69 THR HA 3 71 GLY H 4.000 . 4.500 4.591 4.558 4.622 0.122 5 0 "[ . 1 .]" 1 1210 3 69 THR HA 3 70 SER H 3.000 . 3.500 3.553 3.547 3.556 0.056 6 0 "[ . 1 .]" 1 1211 3 69 THR H 3 69 THR HA 3.000 . 3.500 2.783 2.776 2.791 . 0 0 "[ . 1 .]" 1 1212 3 68 ARG H 3 69 THR HA 5.000 . 5.500 4.988 4.934 5.024 . 0 0 "[ . 1 .]" 1 1213 3 69 THR MG 3 71 GLY H 4.000 . 4.500 4.676 4.641 4.700 0.200 12 0 "[ . 1 .]" 1 1214 3 69 THR MG 3 70 SER H 3.000 . 3.500 3.167 3.141 3.189 . 0 0 "[ . 1 .]" 1 1215 3 69 THR H 3 69 THR MG 3.000 . 3.500 3.679 3.671 3.691 0.191 13 0 "[ . 1 .]" 1 1216 3 48 LYS H 3 69 THR MG 6.000 . 6.500 6.338 6.173 6.470 . 0 0 "[ . 1 .]" 1 1217 3 68 ARG H 3 69 THR MG 5.000 . 5.500 5.673 5.629 5.713 0.213 7 0 "[ . 1 .]" 1 1218 3 69 THR HB 3 71 GLY H 4.000 . 4.500 4.225 4.156 4.280 . 0 0 "[ . 1 .]" 1 1219 3 69 THR HB 3 70 SER H 3.000 . 3.500 2.504 2.474 2.532 . 0 0 "[ . 1 .]" 1 1220 3 69 THR H 3 69 THR HB 2.500 . 3.000 2.369 2.344 2.395 . 0 0 "[ . 1 .]" 1 1221 3 68 ARG H 3 69 THR HB 4.000 . 4.500 4.601 4.561 4.645 0.145 7 0 "[ . 1 .]" 1 1222 3 70 SER HA 3 70 SER QB 2.500 . 3.000 2.364 2.193 2.382 . 0 0 "[ . 1 .]" 1 1223 3 69 THR H 3 70 SER H 3.000 . 3.500 2.767 2.754 2.778 . 0 0 "[ . 1 .]" 1 1224 3 67 ASP H 3 70 SER H 5.000 . 5.500 4.964 4.858 5.090 . 0 0 "[ . 1 .]" 1 1225 3 68 ARG H 3 70 SER H 4.000 . 4.500 4.574 4.525 4.612 0.112 7 0 "[ . 1 .]" 1 1226 3 70 SER QB 3 71 GLY H 4.000 . 4.500 3.177 3.067 3.671 . 0 0 "[ . 1 .]" 1 1227 3 70 SER H 3 70 SER QB 3.000 . 3.500 2.555 2.521 2.923 . 0 0 "[ . 1 .]" 1 1228 3 70 SER QB 3 72 ASN H 3.000 . 3.500 2.795 2.664 3.545 0.045 1 0 "[ . 1 .]" 1 1229 3 70 SER QB 3 72 ASN QD 4.000 . 4.500 3.836 1.902 4.562 0.062 13 0 "[ . 1 .]" 1 1230 3 70 SER HA 3 71 GLY H 3.000 . 3.500 3.384 3.366 3.403 . 0 0 "[ . 1 .]" 1 1231 3 70 SER H 3 70 SER HA 3.000 . 3.500 2.960 2.956 2.963 . 0 0 "[ . 1 .]" 1 1232 3 70 SER H 3 71 GLY H 3.000 . 3.500 1.860 1.820 1.896 . 0 0 "[ . 1 .]" 1 1233 3 69 THR H 3 71 GLY H 4.000 . 4.500 3.546 3.519 3.564 . 0 0 "[ . 1 .]" 1 1234 3 71 GLY H 3 72 ASN H 3.000 . 3.500 2.463 2.421 2.502 . 0 0 "[ . 1 .]" 1 1235 3 71 GLY H 3 71 GLY QA 2.500 . 3.000 2.206 2.196 2.212 . 0 0 "[ . 1 .]" 1 1236 3 70 SER H 3 71 GLY QA 3.000 . 3.500 3.852 3.817 3.876 0.376 12 0 "[ . 1 .]" 1 1237 3 69 THR H 3 71 GLY QA 5.000 . 5.500 4.856 4.801 4.898 . 0 0 "[ . 1 .]" 1 1238 3 71 GLY QA 3 72 ASN H 3.000 . 3.500 2.851 2.838 2.876 . 0 0 "[ . 1 .]" 1 1239 3 67 ASP H 3 71 GLY QA 5.000 . 5.500 4.577 4.504 4.644 . 0 0 "[ . 1 .]" 1 1240 3 72 ASN HA 3 72 ASN QB 2.500 . 3.000 2.261 2.168 2.373 . 0 0 "[ . 1 .]" 1 1241 3 72 ASN HA 3 73 VAL QG 4.000 . 4.500 3.471 3.402 3.584 . 0 0 "[ . 1 .]" 1 1242 3 72 ASN QB 3 73 VAL QG 4.000 . 4.500 4.433 4.218 4.664 0.164 5 0 "[ . 1 .]" 1 1243 3 70 SER H 3 72 ASN H 3.000 . 3.500 3.370 3.325 3.423 . 0 0 "[ . 1 .]" 1 1244 3 67 ASP H 3 72 ASN H 4.000 . 4.500 3.622 3.512 3.860 . 0 0 "[ . 1 .]" 1 1245 3 72 ASN H 3 73 VAL H 4.000 . 4.500 4.543 4.529 4.556 0.056 7 0 "[ . 1 .]" 1 1246 3 72 ASN H 3 72 ASN QD 4.000 . 4.500 4.075 2.476 4.549 0.049 5 0 "[ . 1 .]" 1 1247 3 71 GLY H 3 72 ASN HA 5.000 . 5.500 5.146 5.108 5.177 . 0 0 "[ . 1 .]" 1 1248 3 72 ASN H 3 72 ASN HA 3.000 . 3.500 2.941 2.937 2.949 . 0 0 "[ . 1 .]" 1 1249 3 72 ASN HA 3 73 VAL H 2.500 . 3.000 2.279 2.232 2.314 . 0 0 "[ . 1 .]" 1 1250 3 72 ASN HA 3 74 GLU H 5.000 . 5.500 5.511 5.424 5.596 0.096 10 0 "[ . 1 .]" 1 1251 3 72 ASN HA 3 72 ASN QD 4.000 . 4.500 4.118 3.908 4.371 . 0 0 "[ . 1 .]" 1 1252 3 71 GLY H 3 72 ASN QB 4.000 . 4.500 4.477 4.333 4.630 0.130 10 0 "[ . 1 .]" 1 1253 3 70 SER H 3 72 ASN QB 5.000 . 5.500 4.822 4.555 5.111 . 0 0 "[ . 1 .]" 1 1254 3 72 ASN H 3 72 ASN QB 2.500 . 3.000 2.489 2.355 2.658 . 0 0 "[ . 1 .]" 1 1255 3 67 ASP H 3 72 ASN QB 4.500 . 5.000 4.623 4.119 5.087 0.087 11 0 "[ . 1 .]" 1 1256 3 72 ASN QB 3 73 VAL H 3.000 . 3.500 3.134 2.741 3.562 0.062 13 0 "[ . 1 .]" 1 1257 3 72 ASN QB 3 74 GLU H 5.000 . 5.500 5.053 4.771 5.347 . 0 0 "[ . 1 .]" 1 1258 3 72 ASN QB 3 72 ASN QD 2.500 . 3.000 2.215 2.167 2.266 . 0 0 "[ . 1 .]" 1 1259 3 73 VAL HA 3 73 VAL HB 3.000 . 3.500 3.023 3.020 3.027 . 0 0 "[ . 1 .]" 1 1260 3 73 VAL HA 3 73 VAL QG 2.500 . 3.000 2.046 2.018 2.060 . 0 0 "[ . 1 .]" 1 1261 3 64 CYS QB 3 73 VAL QG 3.000 . 3.500 2.058 1.926 2.165 . 0 0 "[ . 1 .]" 1 1262 3 66 LYS QD 3 73 VAL QG 3.000 . 3.500 3.242 2.479 3.691 0.191 7 0 "[ . 1 .]" 1 1263 3 73 VAL QG 3 76 ASP HA 4.000 . 4.500 3.637 3.525 3.703 . 0 0 "[ . 1 .]" 1 1264 3 67 ASP H 3 73 VAL H 5.000 . 5.500 5.120 5.038 5.228 . 0 0 "[ . 1 .]" 1 1265 3 73 VAL H 3 74 GLU H 4.000 . 4.500 4.298 4.256 4.343 . 0 0 "[ . 1 .]" 1 1266 3 73 VAL HA 3 75 ASP H 3.000 . 3.500 3.565 3.446 3.636 0.136 12 0 "[ . 1 .]" 1 1267 3 65 TRP H 3 73 VAL HA 5.000 . 5.500 4.737 4.574 4.930 . 0 0 "[ . 1 .]" 1 1268 3 66 LYS H 3 73 VAL HA 4.000 . 4.500 4.194 4.044 4.341 . 0 0 "[ . 1 .]" 1 1269 3 73 VAL HA 3 74 GLU H 2.500 . 3.000 2.166 2.142 2.177 . 0 0 "[ . 1 .]" 1 1270 3 67 ASP H 3 73 VAL HB 6.000 . 6.500 6.371 6.328 6.445 . 0 0 "[ . 1 .]" 1 1271 3 73 VAL H 3 73 VAL HB 2.500 . 3.000 2.460 2.431 2.476 . 0 0 "[ . 1 .]" 1 1272 3 73 VAL HB 3 74 GLU H 4.000 . 4.500 4.419 4.385 4.440 . 0 0 "[ . 1 .]" 1 1273 3 73 VAL QG 3 75 ASP H 2.500 . 3.000 2.620 2.523 2.768 . 0 0 "[ . 1 .]" 1 1274 3 65 TRP H 3 73 VAL QG 3.000 . 3.500 2.996 2.824 3.216 . 0 0 "[ . 1 .]" 1 1275 3 72 ASN H 3 73 VAL QG 5.000 . 5.500 5.165 5.128 5.209 . 0 0 "[ . 1 .]" 1 1276 3 73 VAL QG 3 76 ASP H 4.000 . 4.500 4.191 4.107 4.281 . 0 0 "[ . 1 .]" 1 1277 3 67 ASP H 3 73 VAL QG 4.000 . 4.500 4.569 4.462 4.629 0.129 12 0 "[ . 1 .]" 1 1278 3 73 VAL H 3 73 VAL QG 2.500 . 3.000 2.169 2.101 2.247 . 0 0 "[ . 1 .]" 1 1279 3 66 LYS H 3 73 VAL QG 4.000 . 4.500 3.951 3.834 4.036 . 0 0 "[ . 1 .]" 1 1280 3 73 VAL QG 3 74 GLU H 3.000 . 3.500 3.006 2.884 3.082 . 0 0 "[ . 1 .]" 1 1281 3 52 TYR H 3 73 VAL QG 6.000 . 6.500 5.373 5.224 5.476 . 0 0 "[ . 1 .]" 1 1282 3 74 GLU HA 3 74 GLU QB 2.500 . 3.000 2.363 2.346 2.426 . 0 0 "[ . 1 .]" 1 1283 3 74 GLU HA 3 74 GLU QG 3.000 . 3.500 2.592 2.300 2.904 . 0 0 "[ . 1 .]" 1 1284 3 74 GLU HA 3 75 ASP H 3.000 . 3.500 3.510 3.461 3.530 0.030 7 0 "[ . 1 .]" 1 1285 3 67 ASP H 3 74 GLU HA 5.000 . 5.500 4.955 4.789 5.134 . 0 0 "[ . 1 .]" 1 1286 3 73 VAL H 3 74 GLU HA 5.000 . 5.500 5.220 5.157 5.268 . 0 0 "[ . 1 .]" 1 1287 3 74 GLU H 3 74 GLU HA 3.000 . 3.500 2.888 2.861 2.911 . 0 0 "[ . 1 .]" 1 1288 3 72 ASN QD 3 74 GLU HA 4.000 . 4.500 3.676 3.242 4.029 . 0 0 "[ . 1 .]" 1 1289 3 74 GLU QB 3 75 ASP H 3.000 . 3.500 2.779 2.605 2.962 . 0 0 "[ . 1 .]" 1 1290 3 65 TRP H 3 74 GLU QB 5.000 . 5.500 4.968 4.856 5.080 . 0 0 "[ . 1 .]" 1 1291 3 67 ASP H 3 74 GLU QB 4.000 . 4.500 3.340 2.985 3.805 . 0 0 "[ . 1 .]" 1 1292 3 74 GLU H 3 74 GLU QB 3.000 . 3.500 2.350 2.263 2.490 . 0 0 "[ . 1 .]" 1 1293 3 72 ASN QD 3 74 GLU QB 4.000 . 4.500 4.168 3.302 4.565 0.065 14 0 "[ . 1 .]" 1 1294 3 74 GLU QG 3 75 ASP H 4.000 . 4.500 3.893 3.640 4.135 . 0 0 "[ . 1 .]" 1 1295 3 74 GLU H 3 74 GLU QG 4.000 . 4.500 3.339 2.252 4.092 . 0 0 "[ . 1 .]" 1 1296 3 72 ASN QD 3 74 GLU QG 5.000 . 5.500 4.133 2.545 5.452 . 0 0 "[ . 1 .]" 1 1297 3 75 ASP HA 3 75 ASP QB 2.500 . 3.000 2.367 2.306 2.496 . 0 0 "[ . 1 .]" 1 1298 3 65 TRP H 3 75 ASP H 3.000 . 3.500 2.845 2.761 2.955 . 0 0 "[ . 1 .]" 1 1299 3 75 ASP H 3 76 ASP H 4.000 . 4.500 4.463 4.439 4.476 . 0 0 "[ . 1 .]" 1 1300 3 67 ASP H 3 75 ASP H 4.500 . 5.000 5.075 4.869 5.191 0.191 6 0 "[ . 1 .]" 1 1301 3 74 GLU H 3 75 ASP H 3.000 . 3.500 2.410 2.299 2.504 . 0 0 "[ . 1 .]" 1 1302 3 75 ASP H 3 75 ASP HA 3.000 . 3.500 2.963 2.959 2.969 . 0 0 "[ . 1 .]" 1 1303 3 75 ASP HA 3 76 ASP H 2.500 . 3.000 2.249 2.231 2.269 . 0 0 "[ . 1 .]" 1 1304 3 75 ASP H 3 75 ASP QB 3.000 . 3.500 2.646 2.469 2.735 . 0 0 "[ . 1 .]" 1 1305 3 65 TRP H 3 75 ASP QB 4.000 . 4.500 2.278 2.042 2.959 . 0 0 "[ . 1 .]" 1 1306 3 75 ASP QB 3 76 ASP H 3.000 . 3.500 2.943 2.774 3.470 . 0 0 "[ . 1 .]" 1 1307 3 75 ASP QB 3 77 LEU H 5.000 . 5.500 4.523 4.331 4.979 . 0 0 "[ . 1 .]" 1 1308 3 64 CYS HA 3 76 ASP QB 4.000 . 4.500 3.732 3.315 3.964 . 0 0 "[ . 1 .]" 1 1309 3 73 VAL QG 3 76 ASP QB 3.000 . 3.500 2.323 2.071 2.452 . 0 0 "[ . 1 .]" 1 1310 3 76 ASP H 3 77 LEU H 4.000 . 4.500 3.691 3.580 3.991 . 0 0 "[ . 1 .]" 1 1311 3 75 ASP H 3 76 ASP HA 5.000 . 5.500 5.132 5.097 5.151 . 0 0 "[ . 1 .]" 1 1312 3 65 TRP H 3 76 ASP HA 4.000 . 4.500 3.838 3.665 3.940 . 0 0 "[ . 1 .]" 1 1313 3 76 ASP H 3 76 ASP HA 3.000 . 3.500 2.894 2.883 2.904 . 0 0 "[ . 1 .]" 1 1314 3 64 CYS H 3 76 ASP HA 4.000 . 4.500 4.468 4.287 4.594 0.094 11 0 "[ . 1 .]" 1 1315 3 63 PHE H 3 76 ASP HA 4.000 . 4.500 4.611 4.565 4.679 0.179 6 0 "[ . 1 .]" 1 1316 3 76 ASP HA 3 77 LEU H 2.500 . 3.000 2.210 2.132 2.266 . 0 0 "[ . 1 .]" 1 1317 3 76 ASP H 3 76 ASP QB 3.000 . 3.500 3.041 2.790 3.346 . 0 0 "[ . 1 .]" 1 1318 3 76 ASP QB 3 77 LEU H 4.000 . 4.500 3.814 3.322 4.031 . 0 0 "[ . 1 .]" 1 1319 3 77 LEU HA 3 77 LEU QB 2.500 . 3.000 2.290 2.169 2.325 . 0 0 "[ . 1 .]" 1 1320 3 77 LEU HA 3 77 LEU HG 3.000 . 3.500 3.283 3.166 3.583 0.083 6 0 "[ . 1 .]" 1 1321 3 77 LEU HA 3 78 ILE MD 4.000 . 4.500 4.867 4.813 4.919 0.419 12 0 "[ . 1 .]" 1 1322 3 77 LEU HA 3 77 LEU QD 3.000 . 3.500 2.212 2.023 3.102 . 0 0 "[ . 1 .]" 1 1323 3 77 LEU HA 3 79 ILE MD 4.000 . 4.500 4.266 3.992 4.404 . 0 0 "[ . 1 .]" 1 1324 3 77 LEU QB 3 77 LEU HG 2.500 . 3.000 2.374 2.344 2.497 . 0 0 "[ . 1 .]" 1 1325 3 77 LEU HB3 3 79 ILE MD 3.000 . 3.500 3.034 2.743 3.726 0.226 11 0 "[ . 1 .]" 1 1326 3 77 LEU HB2 3 79 ILE MD 3.000 . 3.500 2.431 2.214 2.552 . 0 0 "[ . 1 .]" 1 1327 3 75 ASP QB 3 77 LEU HG 4.000 . 4.500 3.649 3.255 4.589 0.089 6 0 "[ . 1 .]" 1 1328 3 77 LEU HG 3 79 ILE MD 4.000 . 4.500 4.397 3.456 4.615 0.115 8 0 "[ . 1 .]" 1 1329 3 75 ASP HA 3 77 LEU QD 4.000 . 4.500 3.991 3.316 4.227 . 0 0 "[ . 1 .]" 1 1330 3 75 ASP QB 3 77 LEU QD 3.000 . 3.500 3.392 2.425 3.822 0.322 9 0 "[ . 1 .]" 1 1331 3 76 ASP HA 3 77 LEU QD 4.000 . 4.500 3.886 3.052 4.126 . 0 0 "[ . 1 .]" 1 1332 3 77 LEU H 3 78 ILE H 4.000 . 4.500 4.359 4.246 4.416 . 0 0 "[ . 1 .]" 1 1333 3 63 PHE H 3 77 LEU HA 4.000 . 4.500 4.702 4.673 4.751 0.251 9 0 "[ . 1 .]" 1 1334 3 77 LEU H 3 77 LEU HA 3.000 . 3.500 2.957 2.915 2.970 . 0 0 "[ . 1 .]" 1 1335 3 77 LEU HA 3 79 ILE H 5.500 . 6.000 5.826 5.745 5.902 . 0 0 "[ . 1 .]" 1 1336 3 77 LEU HA 3 78 ILE H 2.500 . 3.000 2.170 2.146 2.205 . 0 0 "[ . 1 .]" 1 1337 3 76 ASP H 3 77 LEU QB 5.000 . 5.500 4.760 4.496 4.885 . 0 0 "[ . 1 .]" 1 1338 3 63 PHE H 3 77 LEU QB 4.000 . 4.500 4.066 3.950 4.457 . 0 0 "[ . 1 .]" 1 1339 3 77 LEU H 3 77 LEU QB 3.000 . 3.500 2.793 2.659 3.306 . 0 0 "[ . 1 .]" 1 1340 3 77 LEU QB 3 78 ILE H 4.000 . 4.500 3.077 2.942 3.216 . 0 0 "[ . 1 .]" 1 1341 3 76 ASP H 3 77 LEU HG 4.000 . 4.500 3.181 2.914 4.571 0.071 11 0 "[ . 1 .]" 1 1342 3 63 PHE H 3 77 LEU HG 5.000 . 5.500 5.277 3.652 5.604 0.104 13 0 "[ . 1 .]" 1 1343 3 77 LEU H 3 77 LEU HG 3.000 . 3.500 2.529 2.048 2.681 . 0 0 "[ . 1 .]" 1 1344 3 77 LEU HG 3 78 ILE H 5.000 . 5.500 5.124 4.775 5.267 . 0 0 "[ . 1 .]" 1 1345 3 76 ASP H 3 77 LEU QD 3.000 . 3.500 2.605 2.101 2.849 . 0 0 "[ . 1 .]" 1 1346 3 63 PHE H 3 77 LEU QD 5.000 . 5.500 5.014 4.151 5.177 . 0 0 "[ . 1 .]" 1 1347 3 77 LEU H 3 77 LEU QD 3.000 . 3.500 3.192 2.708 3.343 . 0 0 "[ . 1 .]" 1 1348 3 77 LEU QD 3 78 ILE H 4.000 . 4.500 3.674 3.426 4.377 . 0 0 "[ . 1 .]" 1 1349 3 78 ILE HA 3 78 ILE HB 3.000 . 3.500 3.019 3.016 3.023 . 0 0 "[ . 1 .]" 1 1350 3 78 ILE HA 3 78 ILE QG 3.000 . 3.500 2.348 2.330 2.381 . 0 0 "[ . 1 .]" 1 1351 3 61 ILE MG 3 78 ILE HA 4.000 . 4.500 4.650 4.615 4.679 0.179 3 0 "[ . 1 .]" 1 1352 3 78 ILE HA 3 78 ILE MG 3.000 . 3.500 2.429 2.392 2.453 . 0 0 "[ . 1 .]" 1 1353 3 78 ILE HA 3 78 ILE MD 4.000 . 4.500 3.783 3.769 3.795 . 0 0 "[ . 1 .]" 1 1354 3 78 ILE HB 3 78 ILE MD 2.500 . 3.000 2.228 2.158 2.293 . 0 0 "[ . 1 .]" 1 1355 3 62 HIS HA 3 78 ILE QG 5.000 . 5.500 2.952 2.897 3.002 . 0 0 "[ . 1 .]" 1 1356 3 78 ILE QG 3 78 ILE MG 2.500 . 3.000 2.223 2.198 2.236 . 0 0 "[ . 1 .]" 1 1357 3 78 ILE MD 3 78 ILE MG 2.500 . 3.000 1.906 1.844 1.991 . 0 0 "[ . 1 .]" 1 1358 3 62 HIS HA 3 78 ILE MD 4.000 . 4.500 4.642 4.592 4.688 0.188 4 0 "[ . 1 .]" 1 1359 3 77 LEU H 3 78 ILE HA 5.000 . 5.500 4.833 4.610 4.913 . 0 0 "[ . 1 .]" 1 1360 3 78 ILE H 3 78 ILE HA 3.000 . 3.500 2.881 2.866 2.897 . 0 0 "[ . 1 .]" 1 1361 3 63 PHE H 3 78 ILE QG 5.000 . 5.500 4.331 4.256 4.384 . 0 0 "[ . 1 .]" 1 1362 3 78 ILE QG 3 79 ILE H 4.000 . 4.500 4.100 4.053 4.132 . 0 0 "[ . 1 .]" 1 1363 3 78 ILE H 3 78 ILE QG 3.000 . 3.500 2.326 2.253 2.455 . 0 0 "[ . 1 .]" 1 1364 3 78 ILE HB 3 79 ILE H 4.000 . 4.500 4.327 4.281 4.389 . 0 0 "[ . 1 .]" 1 1365 3 78 ILE H 3 78 ILE HB 2.500 . 3.000 2.351 2.315 2.383 . 0 0 "[ . 1 .]" 1 1366 3 78 ILE H 3 78 ILE MD 3.000 . 3.500 3.442 3.384 3.485 . 0 0 "[ . 1 .]" 1 1367 3 56 THR H 3 78 ILE MG 5.000 . 5.500 5.526 5.453 5.607 0.107 12 0 "[ . 1 .]" 1 1368 3 62 HIS H 3 78 ILE MG 4.000 . 4.500 4.664 4.602 4.748 0.248 12 0 "[ . 1 .]" 1 1369 3 60 LEU H 3 78 ILE MG 4.000 . 4.500 4.767 4.751 4.782 0.282 14 0 "[ . 1 .]" 1 1370 3 63 PHE H 3 78 ILE MG 5.000 . 5.500 4.815 4.741 4.878 . 0 0 "[ . 1 .]" 1 1371 3 78 ILE MG 3 80 PHE H 4.000 . 4.500 3.908 3.683 4.171 . 0 0 "[ . 1 .]" 1 1372 3 78 ILE MG 3 79 ILE H 3.000 . 3.500 2.865 2.772 2.972 . 0 0 "[ . 1 .]" 1 1373 3 78 ILE H 3 78 ILE MG 3.000 . 3.500 3.711 3.695 3.728 0.228 13 0 "[ . 1 .]" 1 1374 3 61 ILE H 3 78 ILE MG 4.000 . 4.500 3.014 2.964 3.078 . 0 0 "[ . 1 .]" 1 1375 3 62 HIS H 3 78 ILE HA 4.500 . 5.000 4.592 4.552 4.618 . 0 0 "[ . 1 .]" 1 1376 3 61 ILE H 3 78 ILE HA 5.000 . 5.500 4.816 4.758 4.899 . 0 0 "[ . 1 .]" 1 1377 3 79 ILE HA 3 79 ILE QG 3.000 . 3.500 2.975 2.475 3.072 . 0 0 "[ . 1 .]" 1 1378 3 79 ILE HA 3 79 ILE MG 2.500 . 3.000 2.234 2.142 2.573 . 0 0 "[ . 1 .]" 1 1379 3 79 ILE HA 3 79 ILE MD 3.000 . 3.500 2.066 2.014 2.135 . 0 0 "[ . 1 .]" 1 1380 3 79 ILE HA 3 132 LEU QD 4.000 . 4.500 4.310 4.183 4.429 . 0 0 "[ . 1 .]" 1 1381 3 79 ILE HB 3 79 ILE QG 2.500 . 3.000 2.203 2.179 2.301 . 0 0 "[ . 1 .]" 1 1382 3 79 ILE HB 3 79 ILE MD 2.500 . 3.000 3.115 2.483 3.217 0.217 12 0 "[ . 1 .]" 1 1383 3 79 ILE HB 3 132 LEU QD 3.000 . 3.500 1.943 1.899 2.164 . 0 0 "[ . 1 .]" 1 1384 3 79 ILE QG 3 79 ILE MG 3.000 . 3.500 2.189 2.086 2.295 . 0 0 "[ . 1 .]" 1 1385 3 79 ILE QG 3 100 LEU QD 4.000 . 4.500 3.225 2.908 3.398 . 0 0 "[ . 1 .]" 1 1386 3 79 ILE QG 3 132 LEU QD 4.000 . 4.500 2.429 2.177 2.730 . 0 0 "[ . 1 .]" 1 1387 3 79 ILE MG 3 80 PHE HA 5.000 . 5.500 4.195 3.848 4.302 . 0 0 "[ . 1 .]" 1 1388 3 79 ILE MD 3 79 ILE MG 2.500 . 3.000 2.183 1.832 3.221 0.221 3 0 "[ . 1 .]" 1 1389 3 79 ILE MG 3 100 LEU QD 3.000 . 3.500 3.333 3.224 3.556 0.056 3 0 "[ . 1 .]" 1 1390 3 79 ILE MG 3 132 LEU QD 3.000 . 3.500 2.415 1.913 2.642 . 0 0 "[ . 1 .]" 1 1391 3 78 ILE HA 3 79 ILE MD 4.000 . 4.500 3.785 3.255 3.943 . 0 0 "[ . 1 .]" 1 1392 3 79 ILE MD 3 100 LEU QD 3.000 . 3.500 3.451 3.289 3.570 0.070 4 0 "[ . 1 .]" 1 1393 3 79 ILE MD 3 102 PHE HZ 3.000 . 3.500 2.755 2.476 3.069 . 0 0 "[ . 1 .]" 1 1394 3 78 ILE H 3 79 ILE H 4.000 . 4.500 4.462 4.408 4.509 0.009 10 0 "[ . 1 .]" 1 1395 3 61 ILE H 3 79 ILE H 5.000 . 5.500 4.138 4.048 4.192 . 0 0 "[ . 1 .]" 1 1396 3 63 PHE H 3 79 ILE HA 5.000 . 5.500 5.630 5.593 5.677 0.177 11 0 "[ . 1 .]" 1 1397 3 79 ILE HA 3 80 PHE H 2.500 . 3.000 2.107 2.088 2.155 . 0 0 "[ . 1 .]" 1 1398 3 79 ILE H 3 79 ILE HA 2.500 . 3.000 2.948 2.939 2.955 . 0 0 "[ . 1 .]" 1 1399 3 63 PHE H 3 79 ILE QG 4.000 . 4.500 3.110 2.795 4.673 0.173 9 0 "[ . 1 .]" 1 1400 3 79 ILE QG 3 80 PHE H 4.000 . 4.500 4.653 4.009 4.776 0.276 6 0 "[ . 1 .]" 1 1401 3 79 ILE H 3 79 ILE QG 3.000 . 3.500 2.601 2.372 3.794 0.294 9 0 "[ . 1 .]" 1 1402 3 79 ILE HB 3 80 PHE H 4.000 . 4.500 4.199 4.053 4.527 0.027 9 0 "[ . 1 .]" 1 1403 3 79 ILE H 3 79 ILE HB 3.000 . 3.500 2.600 2.298 2.673 . 0 0 "[ . 1 .]" 1 1404 3 61 ILE H 3 79 ILE HB 5.000 . 5.500 5.428 5.275 5.551 0.051 13 0 "[ . 1 .]" 1 1405 3 79 ILE MD 3 84 CYS H 5.000 . 5.500 5.486 5.204 5.677 0.177 3 0 "[ . 1 .]" 1 1406 3 77 LEU H 3 79 ILE MD 4.000 . 4.500 4.436 3.897 4.579 0.079 11 0 "[ . 1 .]" 1 1407 3 79 ILE MD 3 80 PHE H 4.000 . 4.500 3.739 3.631 4.002 . 0 0 "[ . 1 .]" 1 1408 3 79 ILE H 3 79 ILE MD 4.000 . 4.500 3.140 2.548 3.281 . 0 0 "[ . 1 .]" 1 1409 3 78 ILE H 3 79 ILE MD 4.000 . 4.500 3.804 3.563 3.933 . 0 0 "[ . 1 .]" 1 1410 3 79 ILE MG 3 132 LEU H 5.000 . 5.500 5.412 4.804 5.580 0.080 6 0 "[ . 1 .]" 1 1411 3 79 ILE MG 3 82 ASP H 6.000 . 6.500 5.110 4.431 5.271 . 0 0 "[ . 1 .]" 1 1412 3 79 ILE MG 3 84 CYS H 4.000 . 4.500 3.109 2.614 3.324 . 0 0 "[ . 1 .]" 1 1413 3 79 ILE MG 3 83 ASP H 4.000 . 4.500 3.677 3.283 3.801 . 0 0 "[ . 1 .]" 1 1414 3 79 ILE MG 3 80 PHE H 3.000 . 3.500 2.676 2.536 2.987 . 0 0 "[ . 1 .]" 1 1415 3 79 ILE H 3 79 ILE MG 4.000 . 4.500 3.806 3.563 3.856 . 0 0 "[ . 1 .]" 1 1416 3 80 PHE HA 3 81 PRO QG 4.500 . 5.000 3.938 3.861 4.106 . 0 0 "[ . 1 .]" 1 1417 3 80 PHE HA 3 81 PRO QD 3.000 . 3.500 2.066 2.008 2.201 . 0 0 "[ . 1 .]" 1 1418 3 80 PHE QB 3 81 PRO QD 3.000 . 3.500 2.031 2.011 2.048 . 0 0 "[ . 1 .]" 1 1419 3 79 ILE HA 3 80 PHE QD 5.000 . 5.500 3.541 3.214 3.796 . 0 0 "[ . 1 .]" 1 1420 3 80 PHE HA 3 80 PHE QD 4.000 . 4.500 2.946 2.890 3.002 . 0 0 "[ . 1 .]" 1 1421 3 80 PHE QD 3 81 PRO QD 4.000 . 4.500 2.304 2.035 2.594 . 0 0 "[ . 1 .]" 1 1422 3 78 ILE MG 3 80 PHE QD 4.000 . 4.500 3.084 2.861 3.243 . 0 0 "[ . 1 .]" 1 1423 3 60 LEU QD 3 80 PHE QD 4.000 . 4.500 3.656 3.527 3.819 . 0 0 "[ . 1 .]" 1 1424 3 60 LEU HA 3 80 PHE QE 6.000 . 6.500 4.452 4.273 4.777 . 0 0 "[ . 1 .]" 1 1425 3 79 ILE HA 3 80 PHE QE 6.000 . 6.500 5.217 4.772 5.596 . 0 0 "[ . 1 .]" 1 1426 3 80 PHE HA 3 80 PHE QE 4.000 . 4.500 4.446 4.403 4.501 0.001 4 0 "[ . 1 .]" 1 1427 3 78 ILE MG 3 80 PHE QE 4.000 . 4.500 2.573 2.323 2.829 . 0 0 "[ . 1 .]" 1 1428 3 60 LEU QD 3 80 PHE QE 3.000 . 3.500 2.408 2.192 2.681 . 0 0 "[ . 1 .]" 1 1429 3 78 ILE MD 3 80 PHE QE 5.000 . 5.500 3.917 3.729 4.030 . 0 0 "[ . 1 .]" 1 1430 3 79 ILE MG 3 80 PHE QE 6.000 . 6.500 6.230 5.953 6.474 . 0 0 "[ . 1 .]" 1 1431 3 78 ILE HB 3 80 PHE QE 5.000 . 5.500 3.594 3.286 3.875 . 0 0 "[ . 1 .]" 1 1432 3 78 ILE MG 3 80 PHE HZ 4.000 . 4.500 3.384 3.101 3.805 . 0 0 "[ . 1 .]" 1 1433 3 60 LEU QD 3 80 PHE HZ 3.000 . 3.500 2.043 1.929 2.233 . 0 0 "[ . 1 .]" 1 1434 3 78 ILE MD 3 80 PHE HZ 5.000 . 5.500 4.393 4.043 4.736 . 0 0 "[ . 1 .]" 1 1435 3 79 ILE H 3 80 PHE H 4.000 . 4.500 4.315 4.260 4.385 . 0 0 "[ . 1 .]" 1 1436 3 80 PHE H 3 80 PHE HA 3.000 . 3.500 2.900 2.858 2.929 . 0 0 "[ . 1 .]" 1 1437 3 80 PHE H 3 80 PHE QB 2.500 . 3.000 2.252 2.189 2.332 . 0 0 "[ . 1 .]" 1 1438 3 80 PHE H 3 80 PHE QD 3.000 . 3.500 2.375 2.293 2.456 . 0 0 "[ . 1 .]" 1 1439 3 80 PHE H 3 80 PHE QE 4.000 . 4.500 4.588 4.525 4.636 0.136 12 0 "[ . 1 .]" 1 1440 3 81 PRO HA 3 81 PRO QG 3.000 . 3.500 3.030 2.853 3.490 . 0 0 "[ . 1 .]" 1 1441 3 81 PRO HA 3 133 ASN HA 3.000 . 3.500 2.110 2.008 2.781 . 0 0 "[ . 1 .]" 1 1442 3 81 PRO QB 3 133 ASN HA 4.000 . 4.500 3.235 3.024 3.574 . 0 0 "[ . 1 .]" 1 1443 3 80 PHE H 3 81 PRO QD 4.500 . 5.000 4.412 4.397 4.419 . 0 0 "[ . 1 .]" 1 1444 3 81 PRO HA 3 133 ASN H 5.000 . 5.500 4.519 4.407 4.729 . 0 0 "[ . 1 .]" 1 1445 3 81 PRO HA 3 82 ASP H 3.000 . 3.500 2.199 2.151 2.224 . 0 0 "[ . 1 .]" 1 1446 3 81 PRO QG 3 82 ASP H 4.000 . 4.500 4.610 4.567 4.666 0.166 9 0 "[ . 1 .]" 1 1447 3 81 PRO QB 3 82 ASP H 3.000 . 3.500 3.139 3.046 3.289 . 0 0 "[ . 1 .]" 1 1448 3 82 ASP HA 3 82 ASP QB 2.500 . 3.000 2.375 2.341 2.443 . 0 0 "[ . 1 .]" 1 1449 3 82 ASP HA 3 103 LYS QB 5.000 . 5.500 4.357 3.983 5.140 . 0 0 "[ . 1 .]" 1 1450 3 82 ASP HA 3 103 LYS QD 3.500 . 4.000 2.658 2.331 3.545 . 0 0 "[ . 1 .]" 1 1451 3 82 ASP HA 3 103 LYS QE 4.000 . 4.500 3.863 3.646 4.193 . 0 0 "[ . 1 .]" 1 1452 3 82 ASP H 3 84 CYS H 4.000 . 4.500 3.992 3.877 4.174 . 0 0 "[ . 1 .]" 1 1453 3 82 ASP H 3 83 ASP H 4.000 . 4.500 2.738 2.690 2.783 . 0 0 "[ . 1 .]" 1 1454 3 82 ASP H 3 82 ASP HA 2.500 . 3.000 2.292 2.284 2.301 . 0 0 "[ . 1 .]" 1 1455 3 82 ASP HA 3 84 CYS H 4.000 . 4.500 3.894 3.708 4.233 . 0 0 "[ . 1 .]" 1 1456 3 82 ASP HA 3 83 ASP H 3.500 . 4.000 3.185 3.167 3.251 . 0 0 "[ . 1 .]" 1 1457 3 82 ASP H 3 82 ASP QB 3.000 . 3.500 3.243 2.930 3.371 . 0 0 "[ . 1 .]" 1 1458 3 82 ASP QB 3 83 ASP H 4.000 . 4.500 3.604 3.530 3.631 . 0 0 "[ . 1 .]" 1 1459 3 83 ASP HA 3 83 ASP QB 2.500 . 3.000 2.413 2.398 2.441 . 0 0 "[ . 1 .]" 1 1460 3 83 ASP HA 3 84 CYS HA 4.000 . 4.500 4.516 4.490 4.544 0.044 9 0 "[ . 1 .]" 1 1461 3 79 ILE MG 3 83 ASP HA 4.000 . 4.500 4.615 4.550 4.790 0.290 10 0 "[ . 1 .]" 1 1462 3 79 ILE MG 3 83 ASP QB 3.000 . 3.500 2.091 1.989 2.392 . 0 0 "[ . 1 .]" 1 1463 3 80 PHE H 3 83 ASP H 4.500 . 5.000 4.706 4.567 4.837 . 0 0 "[ . 1 .]" 1 1464 3 83 ASP HA 3 85 GLU H 6.000 . 6.500 6.681 6.508 6.780 0.280 1 0 "[ . 1 .]" 1 1465 3 82 ASP H 3 83 ASP HA 5.000 . 5.500 5.343 5.309 5.366 . 0 0 "[ . 1 .]" 1 1466 3 83 ASP HA 3 84 CYS H 4.000 . 4.500 3.490 3.454 3.539 . 0 0 "[ . 1 .]" 1 1467 3 83 ASP HA 3 104 ALA H 5.000 . 5.500 3.197 2.870 3.862 . 0 0 "[ . 1 .]" 1 1468 3 83 ASP H 3 83 ASP HA 3.000 . 3.500 2.901 2.851 2.918 . 0 0 "[ . 1 .]" 1 1469 3 83 ASP HA 3 103 LYS H 4.000 . 4.500 3.893 3.769 4.146 . 0 0 "[ . 1 .]" 1 1470 3 80 PHE H 3 83 ASP HA 5.000 . 5.500 5.290 5.142 5.452 . 0 0 "[ . 1 .]" 1 1471 3 83 ASP QB 3 84 CYS H 3.000 . 3.500 2.783 2.530 2.935 . 0 0 "[ . 1 .]" 1 1472 3 83 ASP H 3 83 ASP QB 2.500 . 3.000 2.317 2.269 2.345 . 0 0 "[ . 1 .]" 1 1473 3 80 PHE H 3 83 ASP QB 4.000 . 4.500 2.555 2.444 2.675 . 0 0 "[ . 1 .]" 1 1474 3 84 CYS HA 3 84 CYS QB 2.500 . 3.000 2.297 2.180 2.522 . 0 0 "[ . 1 .]" 1 1475 3 84 CYS HA 3 85 GLU QG 5.000 . 5.500 5.479 5.401 5.583 0.083 10 0 "[ . 1 .]" 1 1476 3 84 CYS HA 3 102 PHE HA 3.000 . 3.500 2.067 2.013 2.125 . 0 0 "[ . 1 .]" 1 1477 3 84 CYS HA 3 103 LYS QB 5.000 . 5.500 3.771 3.491 4.207 . 0 0 "[ . 1 .]" 1 1478 3 84 CYS HA 3 103 LYS QG 3.000 . 3.500 2.805 2.491 3.287 . 0 0 "[ . 1 .]" 1 1479 3 84 CYS HA 3 103 LYS QD 5.000 . 5.500 4.269 3.982 4.746 . 0 0 "[ . 1 .]" 1 1480 3 84 CYS HA 3 100 LEU QD 5.000 . 5.500 3.702 3.454 3.913 . 0 0 "[ . 1 .]" 1 1481 3 84 CYS QB 3 102 PHE HA 3.000 . 3.500 2.898 2.138 3.699 0.199 3 0 "[ . 1 .]" 1 1482 3 79 ILE MG 3 84 CYS QB 3.000 . 3.500 2.270 1.864 2.873 . 0 0 "[ . 1 .]" 1 1483 3 79 ILE MD 3 84 CYS QB 4.000 . 4.500 3.576 3.181 4.008 . 0 0 "[ . 1 .]" 1 1484 3 84 CYS QB 3 100 LEU QD 3.000 . 3.500 2.082 1.926 2.317 . 0 0 "[ . 1 .]" 1 1485 3 84 CYS QB 3 132 LEU QD 4.000 . 4.500 3.545 2.703 4.075 . 0 0 "[ . 1 .]" 1 1486 3 83 ASP H 3 84 CYS H 3.000 . 3.500 2.309 2.197 2.509 . 0 0 "[ . 1 .]" 1 1487 3 84 CYS H 3 103 LYS H 5.000 . 5.500 4.041 3.800 4.456 . 0 0 "[ . 1 .]" 1 1488 3 84 CYS HA 3 85 GLU H 2.500 . 3.000 2.321 2.224 2.382 . 0 0 "[ . 1 .]" 1 1489 3 84 CYS HA 3 104 ALA H 5.500 . 6.000 4.354 4.141 4.689 . 0 0 "[ . 1 .]" 1 1490 3 83 ASP H 3 84 CYS HA 5.000 . 5.500 4.981 4.883 5.105 . 0 0 "[ . 1 .]" 1 1491 3 84 CYS HA 3 103 LYS H 3.000 . 3.500 2.061 1.803 2.490 . 0 0 "[ . 1 .]" 1 1492 3 84 CYS HA 3 101 LYS H 4.000 . 4.500 4.624 4.564 4.664 0.164 11 0 "[ . 1 .]" 1 1493 3 84 CYS HA 3 102 PHE H 5.000 . 5.500 4.515 4.407 4.598 . 0 0 "[ . 1 .]" 1 1494 3 84 CYS QB 3 85 GLU H 3.000 . 3.500 2.607 2.307 3.257 . 0 0 "[ . 1 .]" 1 1495 3 84 CYS H 3 84 CYS QB 3.000 . 3.500 2.880 2.512 3.113 . 0 0 "[ . 1 .]" 1 1496 3 84 CYS QB 3 103 LYS H 4.000 . 4.500 3.857 3.343 4.535 0.035 3 0 "[ . 1 .]" 1 1497 3 84 CYS H 3 84 CYS HG 4.000 . 4.500 3.500 2.623 4.621 0.121 10 0 "[ . 1 .]" 1 1498 3 84 CYS HG 3 103 LYS H 4.500 . 5.000 4.835 3.726 5.390 0.390 7 0 "[ . 1 .]" 1 1499 3 83 ASP H 3 84 CYS HG 6.000 . 6.500 5.447 4.691 6.640 0.140 9 0 "[ . 1 .]" 1 1500 3 84 CYS HG 3 85 GLU H 4.000 . 4.500 3.621 3.272 4.325 . 0 0 "[ . 1 .]" 1 1501 3 84 CYS HG 3 101 LYS H 5.000 . 5.500 5.250 4.271 5.633 0.133 11 0 "[ . 1 .]" 1 1502 3 83 ASP H 3 84 CYS QB 5.000 . 5.500 4.680 4.315 5.059 . 0 0 "[ . 1 .]" 1 1503 3 85 GLU HA 3 85 GLU QB 2.500 . 3.000 2.193 2.175 2.221 . 0 0 "[ . 1 .]" 1 1504 3 85 GLU HA 3 85 GLU QG 3.000 . 3.500 2.938 2.753 3.258 . 0 0 "[ . 1 .]" 1 1505 3 85 GLU HA 3 100 LEU QD 5.000 . 5.500 3.658 3.522 3.768 . 0 0 "[ . 1 .]" 1 1506 3 85 GLU QG 3 87 LYS QB 4.000 . 4.500 2.724 2.626 2.894 . 0 0 "[ . 1 .]" 1 1507 3 85 GLU QG 3 87 LYS QG 4.000 . 4.500 3.072 2.900 3.351 . 0 0 "[ . 1 .]" 1 1508 3 85 GLU QG 3 87 LYS QD 3.000 . 3.500 2.802 2.692 2.917 . 0 0 "[ . 1 .]" 1 1509 3 85 GLU QG 3 101 LYS QB 3.500 . 4.000 4.155 4.086 4.255 0.255 10 0 "[ . 1 .]" 1 1510 3 85 GLU QG 3 101 LYS QG 4.000 . 4.500 2.230 2.125 2.425 . 0 0 "[ . 1 .]" 1 1511 3 85 GLU QG 3 101 LYS QD 3.000 . 3.500 2.380 2.212 2.559 . 0 0 "[ . 1 .]" 1 1512 3 85 GLU QG 3 103 LYS QE 3.000 . 3.500 3.715 3.515 3.826 0.326 4 0 "[ . 1 .]" 1 1513 3 84 CYS H 3 85 GLU H 4.000 . 4.500 4.386 4.355 4.443 . 0 0 "[ . 1 .]" 1 1514 3 85 GLU H 3 103 LYS H 4.000 . 4.500 3.841 3.724 3.942 . 0 0 "[ . 1 .]" 1 1515 3 85 GLU H 3 101 LYS H 3.000 . 3.500 2.714 2.650 2.837 . 0 0 "[ . 1 .]" 1 1516 3 85 GLU H 3 86 PHE H 4.000 . 4.500 4.302 4.186 4.370 . 0 0 "[ . 1 .]" 1 1517 3 85 GLU H 3 85 GLU HA 3.000 . 3.500 2.933 2.922 2.942 . 0 0 "[ . 1 .]" 1 1518 3 84 CYS H 3 85 GLU HA 5.000 . 5.500 4.784 4.717 4.886 . 0 0 "[ . 1 .]" 1 1519 3 85 GLU HA 3 101 LYS H 4.000 . 4.500 4.665 4.611 4.710 0.210 6 0 "[ . 1 .]" 1 1520 3 85 GLU HA 3 86 PHE H 2.500 . 3.000 2.139 2.113 2.162 . 0 0 "[ . 1 .]" 1 1521 3 85 GLU HA 3 133 ASN QD 4.000 . 4.500 2.759 2.223 4.701 0.201 5 0 "[ . 1 .]" 1 1522 3 85 GLU HA 3 129 ASN QD 5.000 . 5.500 5.409 5.319 5.460 . 0 0 "[ . 1 .]" 1 1523 3 85 GLU H 3 85 GLU QG 3.000 . 3.500 3.617 3.499 3.738 0.238 9 0 "[ . 1 .]" 1 1524 3 85 GLU QG 3 87 LYS H 4.000 . 4.500 3.703 3.603 3.877 . 0 0 "[ . 1 .]" 1 1525 3 85 GLU QG 3 101 LYS H 4.000 . 4.500 3.423 3.268 3.614 . 0 0 "[ . 1 .]" 1 1526 3 85 GLU QG 3 86 PHE H 3.000 . 3.500 2.953 2.620 3.438 . 0 0 "[ . 1 .]" 1 1527 3 85 GLU H 3 85 GLU QB 3.000 . 3.500 2.461 2.342 2.551 . 0 0 "[ . 1 .]" 1 1528 3 85 GLU QB 3 87 LYS H 5.000 . 5.500 5.582 5.503 5.662 0.162 4 0 "[ . 1 .]" 1 1529 3 85 GLU QB 3 86 PHE H 3.000 . 3.500 3.616 3.545 3.680 0.180 9 0 "[ . 1 .]" 1 1530 3 86 PHE HA 3 100 LEU HA 3.000 . 3.500 2.576 2.490 2.708 . 0 0 "[ . 1 .]" 1 1531 3 86 PHE HA 3 100 LEU QD 4.000 . 4.500 2.573 2.457 2.766 . 0 0 "[ . 1 .]" 1 1532 3 86 PHE HA 3 128 VAL QG 4.000 . 4.500 4.093 3.995 4.279 . 0 0 "[ . 1 .]" 1 1533 3 86 PHE QB 3 100 LEU QD 3.000 . 3.500 2.750 2.601 2.888 . 0 0 "[ . 1 .]" 1 1534 3 86 PHE QB 3 128 VAL QG 3.000 . 3.500 2.067 1.960 2.159 . 0 0 "[ . 1 .]" 1 1535 3 86 PHE HA 3 86 PHE QD 4.000 . 4.500 2.266 2.225 2.323 . 0 0 "[ . 1 .]" 1 1536 3 86 PHE HA 3 87 LYS HA 5.000 . 5.500 4.410 4.402 4.420 . 0 0 "[ . 1 .]" 1 1537 3 86 PHE QD 3 100 LEU HA 4.000 . 4.500 2.828 2.643 2.943 . 0 0 "[ . 1 .]" 1 1538 3 86 PHE QD 3 100 LEU QB 4.000 . 4.500 2.372 2.241 2.556 . 0 0 "[ . 1 .]" 1 1539 3 86 PHE QD 3 100 LEU HG 5.000 . 5.500 4.633 4.488 4.799 . 0 0 "[ . 1 .]" 1 1540 3 86 PHE QD 3 125 CYS HA 3.000 . 3.500 2.547 2.454 2.663 . 0 0 "[ . 1 .]" 1 1541 3 86 PHE QD 3 100 LEU QD 3.000 . 3.500 2.083 1.949 2.237 . 0 0 "[ . 1 .]" 1 1542 3 86 PHE QD 3 128 VAL QG 4.000 . 4.500 2.744 2.635 2.850 . 0 0 "[ . 1 .]" 1 1543 3 86 PHE QD 3 128 VAL HB 4.000 . 4.500 2.685 2.446 2.851 . 0 0 "[ . 1 .]" 1 1544 3 86 PHE QD 3 87 LYS HA 5.000 . 5.500 4.479 4.399 4.540 . 0 0 "[ . 1 .]" 1 1545 3 63 PHE QE 3 86 PHE QE 4.000 . 4.500 4.541 4.478 4.638 0.138 10 0 "[ . 1 .]" 1 1546 3 86 PHE HA 3 86 PHE QE 5.000 . 5.500 4.232 4.196 4.271 . 0 0 "[ . 1 .]" 1 1547 3 86 PHE QE 3 125 CYS HA 4.000 . 4.500 2.227 2.085 2.338 . 0 0 "[ . 1 .]" 1 1548 3 63 PHE HZ 3 86 PHE QE 4.000 . 4.500 4.361 4.188 4.483 . 0 0 "[ . 1 .]" 1 1549 3 86 PHE QE 3 100 LEU QD 4.000 . 4.500 3.747 3.582 3.915 . 0 0 "[ . 1 .]" 1 1550 3 86 PHE QE 3 128 VAL QG 4.000 . 4.500 3.007 2.836 3.203 . 0 0 "[ . 1 .]" 1 1551 3 86 PHE QE 3 128 VAL HB 5.000 . 5.500 3.785 3.631 3.896 . 0 0 "[ . 1 .]" 1 1552 3 86 PHE HZ 3 125 CYS HA 4.000 . 4.500 4.509 4.424 4.578 0.078 10 0 "[ . 1 .]" 1 1553 3 86 PHE H 3 129 ASN QD 3.000 . 3.500 3.582 3.530 3.643 0.143 4 0 "[ . 1 .]" 1 1554 3 85 GLU H 3 86 PHE HA 5.000 . 5.500 4.813 4.708 4.916 . 0 0 "[ . 1 .]" 1 1555 3 86 PHE HA 3 99 VAL H 4.000 . 4.500 4.590 4.535 4.652 0.152 9 0 "[ . 1 .]" 1 1556 3 86 PHE HA 3 87 LYS H 2.500 . 3.000 2.155 2.144 2.177 . 0 0 "[ . 1 .]" 1 1557 3 86 PHE HA 3 100 LEU H 5.000 . 5.500 4.969 4.877 5.045 . 0 0 "[ . 1 .]" 1 1558 3 86 PHE HA 3 101 LYS H 4.000 . 4.500 3.788 3.676 3.913 . 0 0 "[ . 1 .]" 1 1559 3 86 PHE QB 3 129 ASN H 4.000 . 4.500 3.155 2.834 3.482 . 0 0 "[ . 1 .]" 1 1560 3 85 GLU H 3 86 PHE QB 5.000 . 5.500 5.261 5.108 5.355 . 0 0 "[ . 1 .]" 1 1561 3 86 PHE QB 3 87 LYS H 4.000 . 4.500 3.838 3.807 3.878 . 0 0 "[ . 1 .]" 1 1562 3 86 PHE QB 3 101 LYS H 5.000 . 5.500 5.275 5.176 5.441 . 0 0 "[ . 1 .]" 1 1563 3 86 PHE H 3 86 PHE QB 3.000 . 3.500 2.406 2.366 2.431 . 0 0 "[ . 1 .]" 1 1564 3 86 PHE QB 3 129 ASN QD 3.000 . 3.500 2.060 1.907 2.170 . 0 0 "[ . 1 .]" 1 1565 3 86 PHE QD 3 129 ASN H 4.000 . 4.500 3.737 3.594 3.858 . 0 0 "[ . 1 .]" 1 1566 3 86 PHE QD 3 125 CYS H 4.500 . 5.000 5.173 5.095 5.270 0.270 10 0 "[ . 1 .]" 1 1567 3 86 PHE QD 3 128 VAL H 4.000 . 4.500 4.515 4.314 4.617 0.117 12 0 "[ . 1 .]" 1 1568 3 86 PHE QD 3 99 VAL H 5.000 . 5.500 4.797 4.722 4.885 . 0 0 "[ . 1 .]" 1 1569 3 86 PHE QD 3 126 ARG H 5.000 . 5.500 5.077 4.952 5.314 . 0 0 "[ . 1 .]" 1 1570 3 86 PHE QD 3 87 LYS H 4.000 . 4.500 3.626 3.545 3.682 . 0 0 "[ . 1 .]" 1 1571 3 86 PHE QD 3 100 LEU H 4.000 . 4.500 4.354 4.224 4.464 . 0 0 "[ . 1 .]" 1 1572 3 86 PHE H 3 86 PHE QD 4.000 . 4.500 4.243 4.212 4.270 . 0 0 "[ . 1 .]" 1 1573 3 86 PHE QD 3 129 ASN QD 4.000 . 4.500 2.693 2.415 2.916 . 0 0 "[ . 1 .]" 1 1574 3 86 PHE QE 3 125 CYS H 4.000 . 4.500 4.438 4.281 4.534 0.034 6 0 "[ . 1 .]" 1 1575 3 86 PHE QE 3 128 VAL H 5.000 . 5.500 5.309 5.149 5.412 . 0 0 "[ . 1 .]" 1 1576 3 86 PHE QE 3 126 ARG H 5.000 . 5.500 5.546 5.508 5.590 0.090 7 0 "[ . 1 .]" 1 1577 3 86 PHE QE 3 87 LYS H 4.000 . 4.500 4.670 4.601 4.713 0.213 5 0 "[ . 1 .]" 1 1578 3 86 PHE QE 3 98 TYR H 5.000 . 5.500 5.187 5.090 5.289 . 0 0 "[ . 1 .]" 1 1579 3 86 PHE QE 3 100 LEU H 5.000 . 5.500 4.286 3.969 4.573 . 0 0 "[ . 1 .]" 1 1580 3 86 PHE QE 3 101 LYS H 6.000 . 6.500 6.476 6.245 6.635 0.135 1 0 "[ . 1 .]" 1 1581 3 86 PHE H 3 86 PHE QE 6.000 . 6.500 6.282 6.264 6.300 . 0 0 "[ . 1 .]" 1 1582 3 86 PHE H 3 87 LYS H 4.000 . 4.500 4.342 4.295 4.378 . 0 0 "[ . 1 .]" 1 1583 3 86 PHE QE 3 99 VAL H 5.000 . 5.500 4.532 4.429 4.690 . 0 0 "[ . 1 .]" 1 1584 3 87 LYS HA 3 87 LYS QB 2.500 . 3.000 2.184 2.177 2.189 . 0 0 "[ . 1 .]" 1 1585 3 87 LYS HA 3 87 LYS QG 3.000 . 3.500 3.307 3.294 3.314 . 0 0 "[ . 1 .]" 1 1586 3 87 LYS HA 3 87 LYS QD 4.000 . 4.500 4.309 4.238 4.468 . 0 0 "[ . 1 .]" 1 1587 3 87 LYS QB 3 87 LYS QE 4.000 . 4.500 3.143 2.006 3.632 . 0 0 "[ . 1 .]" 1 1588 3 87 LYS QB 3 99 VAL QG 3.000 . 3.500 3.607 3.546 3.680 0.180 5 0 "[ . 1 .]" 1 1589 3 87 LYS QE 3 87 LYS QG 3.000 . 3.500 2.189 2.123 2.283 . 0 0 "[ . 1 .]" 1 1590 3 87 LYS QG 3 99 VAL QG 3.000 . 3.500 1.863 1.804 1.946 . 0 0 "[ . 1 .]" 1 1591 3 87 LYS H 3 101 LYS H 4.000 . 4.500 4.596 4.530 4.626 0.126 15 0 "[ . 1 .]" 1 1592 3 87 LYS HA 3 88 ARG H 2.500 . 3.000 2.430 2.365 2.450 . 0 0 "[ . 1 .]" 1 1593 3 87 LYS H 3 87 LYS HA 3.000 . 3.500 2.948 2.944 2.954 . 0 0 "[ . 1 .]" 1 1594 3 87 LYS QB 3 99 VAL H 4.000 . 4.500 4.698 4.625 4.758 0.258 7 0 "[ . 1 .]" 1 1595 3 87 LYS QB 3 88 ARG H 3.000 . 3.500 2.392 2.339 2.494 . 0 0 "[ . 1 .]" 1 1596 3 87 LYS H 3 87 LYS QB 3.000 . 3.500 3.046 2.984 3.078 . 0 0 "[ . 1 .]" 1 1597 3 87 LYS QB 3 101 LYS H 5.000 . 5.500 5.648 5.604 5.696 0.196 13 0 "[ . 1 .]" 1 1598 3 87 LYS QG 3 99 VAL H 4.000 . 4.500 3.158 3.054 3.242 . 0 0 "[ . 1 .]" 1 1599 3 87 LYS QG 3 88 ARG H 4.000 . 4.500 3.294 3.071 3.458 . 0 0 "[ . 1 .]" 1 1600 3 87 LYS H 3 87 LYS QG 3.000 . 3.500 2.285 2.262 2.312 . 0 0 "[ . 1 .]" 1 1601 3 86 PHE H 3 87 LYS QG 5.000 . 5.500 5.289 5.196 5.485 . 0 0 "[ . 1 .]" 1 1602 3 87 LYS H 3 87 LYS QD 4.000 . 4.500 4.184 4.039 4.255 . 0 0 "[ . 1 .]" 1 1603 3 88 ARG HA 3 98 TYR HA 4.000 . 4.500 2.058 2.014 2.086 . 0 0 "[ . 1 .]" 1 1604 3 87 LYS H 3 88 ARG H 4.000 . 4.500 4.448 4.436 4.463 . 0 0 "[ . 1 .]" 1 1605 3 88 ARG H 3 89 VAL H 4.000 . 4.500 4.587 4.558 4.599 0.099 11 0 "[ . 1 .]" 1 1606 3 88 ARG HA 3 99 VAL H 4.000 . 4.500 3.415 3.275 3.523 . 0 0 "[ . 1 .]" 1 1607 3 87 LYS H 3 88 ARG HA 5.000 . 5.500 4.885 4.822 4.932 . 0 0 "[ . 1 .]" 1 1608 3 88 ARG HA 3 98 TYR H 5.000 . 5.500 4.729 4.656 4.825 . 0 0 "[ . 1 .]" 1 1609 3 88 ARG HA 3 89 VAL H 3.000 . 3.500 2.357 2.248 2.399 . 0 0 "[ . 1 .]" 1 1610 3 88 ARG H 3 88 ARG QG 4.000 . 4.500 2.412 1.955 3.986 . 0 0 "[ . 1 .]" 1 1611 3 88 ARG QG 3 89 VAL H 4.000 . 4.500 3.120 1.980 3.500 . 0 0 "[ . 1 .]" 1 1612 3 88 ARG H 3 88 ARG QB 3.000 . 3.500 2.516 2.300 2.671 . 0 0 "[ . 1 .]" 1 1613 3 88 ARG QB 3 89 VAL H 4.000 . 4.500 2.711 2.502 3.536 . 0 0 "[ . 1 .]" 1 1614 3 88 ARG H 3 88 ARG QD 4.000 . 4.500 4.073 3.687 4.643 0.143 3 0 "[ . 1 .]" 1 1615 3 88 ARG QD 3 89 VAL H 4.000 . 4.500 4.421 3.982 4.551 0.051 12 0 "[ . 1 .]" 1 1616 3 89 VAL HA 3 90 PRO QD 3.000 . 3.500 2.102 2.084 2.117 . 0 0 "[ . 1 .]" 1 1617 3 89 VAL HA 3 89 VAL QG 3.000 . 3.500 2.045 2.003 2.130 . 0 0 "[ . 1 .]" 1 1618 3 89 VAL HA 3 89 VAL HB 3.000 . 3.500 3.023 3.017 3.026 . 0 0 "[ . 1 .]" 1 1619 3 88 ARG HA 3 89 VAL QG 4.000 . 4.500 3.292 3.193 3.503 . 0 0 "[ . 1 .]" 1 1620 3 89 VAL QG 3 99 VAL QG 3.000 . 3.500 1.981 1.830 2.181 . 0 0 "[ . 1 .]" 1 1621 3 89 VAL HB 3 99 VAL H 5.000 . 5.500 5.475 5.391 5.584 0.084 5 0 "[ . 1 .]" 1 1622 3 89 VAL H 3 89 VAL HB 3.000 . 3.500 2.630 2.529 2.687 . 0 0 "[ . 1 .]" 1 1623 3 88 ARG H 3 89 VAL HA 5.000 . 5.500 5.273 5.175 5.342 . 0 0 "[ . 1 .]" 1 1624 3 89 VAL HA 3 92 CYS H 6.000 . 6.500 5.956 5.900 6.051 . 0 0 "[ . 1 .]" 1 1625 3 89 VAL HA 3 91 GLN QE 6.000 . 6.500 4.969 4.088 6.538 0.038 14 0 "[ . 1 .]" 1 1626 3 89 VAL QG 3 99 VAL H 3.000 . 3.500 2.868 2.688 3.114 . 0 0 "[ . 1 .]" 1 1627 3 89 VAL QG 3 111 PHE H 5.000 . 5.500 4.258 3.949 4.866 . 0 0 "[ . 1 .]" 1 1628 3 88 ARG H 3 89 VAL QG 5.000 . 5.500 4.803 4.623 4.892 . 0 0 "[ . 1 .]" 1 1629 3 87 LYS H 3 89 VAL QG 4.500 . 5.000 4.973 4.869 5.038 0.038 10 0 "[ . 1 .]" 1 1630 3 89 VAL H 3 89 VAL QG 3.000 . 3.500 2.490 2.345 2.654 . 0 0 "[ . 1 .]" 1 1631 3 89 VAL QG 3 91 GLN H 3.000 . 3.500 2.761 2.573 2.933 . 0 0 "[ . 1 .]" 1 1632 3 89 VAL QG 3 92 CYS H 3.500 . 4.000 3.589 3.433 3.797 . 0 0 "[ . 1 .]" 1 1633 3 89 VAL QG 3 91 GLN QE 4.000 . 4.500 3.507 2.966 4.385 . 0 0 "[ . 1 .]" 1 1634 3 89 VAL HB 3 92 CYS H 4.000 . 4.500 4.611 4.540 4.685 0.185 5 0 "[ . 1 .]" 1 1635 3 89 VAL QG 3 90 PRO HA 4.000 . 4.500 4.277 4.177 4.347 . 0 0 "[ . 1 .]" 1 1636 3 90 PRO QB 3 90 PRO QD 3.000 . 3.500 2.857 2.830 2.893 . 0 0 "[ . 1 .]" 1 1637 3 90 PRO HA 3 90 PRO QD 3.000 . 3.500 3.473 3.459 3.493 . 0 0 "[ . 1 .]" 1 1638 3 89 VAL QG 3 90 PRO QD 3.000 . 3.500 3.000 2.785 3.109 . 0 0 "[ . 1 .]" 1 1639 3 90 PRO HA 3 91 GLN H 3.000 . 3.500 2.626 2.615 2.636 . 0 0 "[ . 1 .]" 1 1640 3 90 PRO HA 3 92 CYS H 4.000 . 4.500 3.973 3.806 4.306 . 0 0 "[ . 1 .]" 1 1641 3 91 GLN H 3 92 CYS H 3.000 . 3.500 1.986 1.925 2.167 . 0 0 "[ . 1 .]" 1 1642 3 91 GLN H 3 91 GLN QE 5.000 . 5.500 5.120 4.875 5.590 0.090 13 0 "[ . 1 .]" 1 1643 3 91 GLN H 3 91 GLN HA 3.000 . 3.500 2.955 2.947 2.959 . 0 0 "[ . 1 .]" 1 1644 3 91 GLN HA 3 92 CYS H 3.000 . 3.500 3.527 3.505 3.567 0.067 13 0 "[ . 1 .]" 1 1645 3 91 GLN HA 3 91 GLN QE 4.000 . 4.500 4.162 3.123 4.620 0.120 3 0 "[ . 1 .]" 1 1646 3 91 GLN H 3 91 GLN QB 3.000 . 3.500 2.379 2.341 2.536 . 0 0 "[ . 1 .]" 1 1647 3 91 GLN QB 3 92 CYS H 4.000 . 4.500 2.696 2.351 2.814 . 0 0 "[ . 1 .]" 1 1648 3 91 GLN QB 3 91 GLN QE 3.000 . 3.500 3.494 2.337 3.648 0.148 15 0 "[ . 1 .]" 1 1649 3 91 GLN H 3 91 GLN QG 3.500 . 4.000 3.767 2.673 4.141 0.141 13 0 "[ . 1 .]" 1 1650 3 91 GLN QG 3 92 CYS H 4.000 . 4.500 4.400 3.963 4.552 0.052 4 0 "[ . 1 .]" 1 1651 3 91 GLN QE 3 91 GLN QG 2.500 . 3.000 2.286 2.186 2.456 . 0 0 "[ . 1 .]" 1 1652 3 92 CYS HA 3 95 GLY H 6.000 . 6.500 6.632 6.583 6.713 0.213 6 0 "[ . 1 .]" 1 1653 3 92 CYS H 3 92 CYS HA 3.000 . 3.500 2.961 2.955 2.967 . 0 0 "[ . 1 .]" 1 1654 3 92 CYS QB 3 95 GLY H 5.000 . 5.500 5.326 5.202 5.429 . 0 0 "[ . 1 .]" 1 1655 3 92 CYS H 3 92 CYS QB 3.000 . 3.500 2.667 2.421 3.071 . 0 0 "[ . 1 .]" 1 1656 3 92 CYS H 3 93 PRO QD 4.000 . 4.500 3.342 2.986 3.846 . 0 0 "[ . 1 .]" 1 1657 3 95 GLY H 3 95 GLY QA 2.500 . 3.000 2.438 2.400 2.493 . 0 0 "[ . 1 .]" 1 1658 3 96 ARG QD 3 113 MET H 3.500 . 4.000 3.981 3.772 4.177 0.177 10 0 "[ . 1 .]" 1 1659 3 97 VAL HA 3 112 TRP HA 4.000 . 4.500 2.333 2.224 2.451 . 0 0 "[ . 1 .]" 1 1660 3 97 VAL HA 3 97 VAL QG 3.000 . 3.500 2.087 2.046 2.116 . 0 0 "[ . 1 .]" 1 1661 3 35 MET ME 3 97 VAL QG 4.500 . 5.000 2.675 2.131 2.915 . 0 0 "[ . 1 .]" 1 1662 3 89 VAL HB 3 97 VAL QG 4.000 . 4.500 2.356 2.079 2.789 . 0 0 "[ . 1 .]" 1 1663 3 97 VAL HA 3 112 TRP H 5.000 . 5.500 4.915 4.809 5.021 . 0 0 "[ . 1 .]" 1 1664 3 97 VAL HA 3 99 VAL H 6.000 . 6.500 6.287 6.249 6.314 . 0 0 "[ . 1 .]" 1 1665 3 97 VAL HA 3 111 PHE H 4.000 . 4.500 4.696 4.660 4.778 0.278 5 0 "[ . 1 .]" 1 1666 3 97 VAL HA 3 113 MET H 4.000 . 4.500 3.599 3.508 3.755 . 0 0 "[ . 1 .]" 1 1667 3 97 VAL HA 3 98 TYR H 3.000 . 3.500 2.130 2.116 2.145 . 0 0 "[ . 1 .]" 1 1668 3 95 GLY H 3 97 VAL QG 4.000 . 4.500 3.905 3.735 4.049 . 0 0 "[ . 1 .]" 1 1669 3 97 VAL QG 3 112 TRP H 4.000 . 4.500 4.478 4.290 4.553 0.053 8 0 "[ . 1 .]" 1 1670 3 97 VAL QG 3 99 VAL H 4.000 . 4.500 4.585 4.531 4.629 0.129 9 0 "[ . 1 .]" 1 1671 3 97 VAL QG 3 111 PHE H 4.000 . 4.500 3.388 3.289 3.463 . 0 0 "[ . 1 .]" 1 1672 3 97 VAL QG 3 113 MET H 4.000 . 4.500 4.027 3.881 4.193 . 0 0 "[ . 1 .]" 1 1673 3 97 VAL QG 3 98 TYR H 3.000 . 3.500 2.593 2.301 2.673 . 0 0 "[ . 1 .]" 1 1674 3 97 VAL QG 3 100 LEU H 6.000 . 6.500 6.332 6.270 6.376 . 0 0 "[ . 1 .]" 1 1675 3 89 VAL H 3 97 VAL QG 4.000 . 4.500 3.500 3.411 3.665 . 0 0 "[ . 1 .]" 1 1676 3 92 CYS H 3 97 VAL QG 4.000 . 4.500 4.511 4.357 4.690 0.190 12 0 "[ . 1 .]" 1 1677 3 95 GLY H 3 97 VAL HB 5.000 . 5.500 5.584 5.483 5.666 0.166 12 0 "[ . 1 .]" 1 1678 3 97 VAL HB 3 98 TYR H 4.000 . 4.500 4.219 4.186 4.253 . 0 0 "[ . 1 .]" 1 1679 3 92 CYS H 3 97 VAL HB 5.000 . 5.500 5.052 4.848 5.291 . 0 0 "[ . 1 .]" 1 1680 3 89 VAL QG 3 98 TYR HA 3.000 . 3.500 2.581 2.206 3.238 . 0 0 "[ . 1 .]" 1 1681 3 98 TYR HA 3 99 VAL QG 4.000 . 4.500 3.522 3.420 3.648 . 0 0 "[ . 1 .]" 1 1682 3 88 ARG HA 3 98 TYR QD 4.000 . 4.500 2.326 1.950 2.767 . 0 0 "[ . 1 .]" 1 1683 3 88 ARG QD 3 98 TYR QD 5.000 . 5.500 5.125 4.376 5.597 0.097 12 0 "[ . 1 .]" 1 1684 3 97 VAL HA 3 98 TYR QD 5.000 . 5.500 3.663 3.436 4.293 . 0 0 "[ . 1 .]" 1 1685 3 98 TYR HA 3 98 TYR QD 4.000 . 4.500 2.771 2.347 2.943 . 0 0 "[ . 1 .]" 1 1686 3 98 TYR QD 3 125 CYS QB 5.000 . 5.500 4.052 3.894 4.181 . 0 0 "[ . 1 .]" 1 1687 3 89 VAL QG 3 98 TYR QD 5.000 . 5.500 4.491 4.296 4.925 . 0 0 "[ . 1 .]" 1 1688 3 97 VAL QG 3 98 TYR QD 6.000 . 6.500 4.376 4.270 4.617 . 0 0 "[ . 1 .]" 1 1689 3 87 LYS HA 3 98 TYR QD 4.000 . 4.500 3.507 3.117 3.731 . 0 0 "[ . 1 .]" 1 1690 3 88 ARG HA 3 98 TYR QE 4.000 . 4.500 3.584 3.374 3.857 . 0 0 "[ . 1 .]" 1 1691 3 88 ARG QD 3 98 TYR QE 4.000 . 4.500 4.078 3.081 4.530 0.030 14 0 "[ . 1 .]" 1 1692 3 98 TYR HA 3 98 TYR QE 5.000 . 5.500 4.518 4.357 4.565 . 0 0 "[ . 1 .]" 1 1693 3 98 TYR QE 3 122 GLU HA 6.000 . 6.500 4.520 4.127 4.899 . 0 0 "[ . 1 .]" 1 1694 3 98 TYR QE 3 125 CYS HA 5.000 . 5.500 5.082 4.620 5.442 . 0 0 "[ . 1 .]" 1 1695 3 98 TYR QE 3 125 CYS QB 4.000 . 4.500 3.234 2.995 3.544 . 0 0 "[ . 1 .]" 1 1696 3 87 LYS HA 3 98 TYR QE 5.000 . 5.500 4.605 3.366 4.995 . 0 0 "[ . 1 .]" 1 1697 3 98 TYR H 3 113 MET H 4.000 . 4.500 4.592 4.497 4.674 0.174 14 0 "[ . 1 .]" 1 1698 3 89 VAL QG 3 98 TYR H 4.000 . 4.500 3.714 3.375 4.532 0.032 3 0 "[ . 1 .]" 1 1699 3 98 TYR QD 3 99 VAL H 4.000 . 4.500 3.654 3.298 3.784 . 0 0 "[ . 1 .]" 1 1700 3 98 TYR QD 3 113 MET H 4.000 . 4.500 3.818 3.577 4.288 . 0 0 "[ . 1 .]" 1 1701 3 88 ARG H 3 98 TYR QD 3.000 . 3.500 3.361 3.215 3.498 . 0 0 "[ . 1 .]" 1 1702 3 87 LYS H 3 98 TYR QD 4.000 . 4.500 4.125 3.350 4.369 . 0 0 "[ . 1 .]" 1 1703 3 98 TYR H 3 98 TYR QD 3.000 . 3.500 2.928 2.801 3.374 . 0 0 "[ . 1 .]" 1 1704 3 89 VAL H 3 98 TYR QD 4.000 . 4.500 4.451 4.194 4.624 0.124 12 0 "[ . 1 .]" 1 1705 3 98 TYR QE 3 113 MET H 5.000 . 5.500 4.302 3.890 5.533 0.033 12 0 "[ . 1 .]" 1 1706 3 98 TYR HA 3 99 VAL H 3.000 . 3.500 2.305 2.270 2.328 . 0 0 "[ . 1 .]" 1 1707 3 89 VAL H 3 98 TYR HA 4.000 . 4.500 3.012 2.872 3.239 . 0 0 "[ . 1 .]" 1 1708 3 98 TYR QB 3 99 VAL H 4.000 . 4.500 2.628 2.569 2.704 . 0 0 "[ . 1 .]" 1 1709 3 89 VAL QG 3 99 VAL HA 4.000 . 4.500 3.548 3.365 3.771 . 0 0 "[ . 1 .]" 1 1710 3 99 VAL HA 3 99 VAL QG 2.500 . 3.000 2.336 2.290 2.357 . 0 0 "[ . 1 .]" 1 1711 3 99 VAL QG 3 108 ARG QB 4.000 . 4.500 2.550 2.259 2.960 . 0 0 "[ . 1 .]" 1 1712 3 99 VAL QG 3 110 PHE HA 4.000 . 4.500 3.041 2.908 3.320 . 0 0 "[ . 1 .]" 1 1713 3 99 VAL HB 3 110 PHE HA 4.000 . 4.500 3.542 3.493 3.629 . 0 0 "[ . 1 .]" 1 1714 3 99 VAL HB 3 110 PHE QB 5.000 . 5.500 4.427 4.221 4.683 . 0 0 "[ . 1 .]" 1 1715 3 89 VAL QG 3 99 VAL HB 3.000 . 3.500 1.976 1.932 2.020 . 0 0 "[ . 1 .]" 1 1716 3 86 PHE HA 3 99 VAL QG 5.000 . 5.500 4.262 4.198 4.350 . 0 0 "[ . 1 .]" 1 1717 3 87 LYS QD 3 99 VAL QG 3.000 . 3.500 3.056 2.506 3.333 . 0 0 "[ . 1 .]" 1 1718 3 87 LYS QE 3 99 VAL QG 3.000 . 3.500 2.346 1.839 3.458 . 0 0 "[ . 1 .]" 1 1719 3 99 VAL QG 3 101 LYS QG 3.000 . 3.500 2.909 2.754 3.102 . 0 0 "[ . 1 .]" 1 1720 3 99 VAL QG 3 108 ARG HA 4.000 . 4.500 3.687 3.356 4.068 . 0 0 "[ . 1 .]" 1 1721 3 99 VAL QG 3 100 LEU QD 5.000 . 5.500 4.234 4.209 4.256 . 0 0 "[ . 1 .]" 1 1722 3 99 VAL H 3 111 PHE H 5.000 . 5.500 4.891 4.844 4.945 . 0 0 "[ . 1 .]" 1 1723 3 88 ARG H 3 99 VAL H 5.000 . 5.500 4.762 4.728 4.811 . 0 0 "[ . 1 .]" 1 1724 3 87 LYS H 3 99 VAL H 3.000 . 3.500 2.996 2.941 3.070 . 0 0 "[ . 1 .]" 1 1725 3 98 TYR H 3 99 VAL H 4.000 . 4.500 4.471 4.453 4.496 . 0 0 "[ . 1 .]" 1 1726 3 99 VAL H 3 100 LEU H 4.000 . 4.500 4.336 4.289 4.376 . 0 0 "[ . 1 .]" 1 1727 3 99 VAL H 3 101 LYS H 6.000 . 6.500 6.160 5.974 6.263 . 0 0 "[ . 1 .]" 1 1728 3 89 VAL H 3 99 VAL H 5.000 . 5.500 4.513 4.294 4.620 . 0 0 "[ . 1 .]" 1 1729 3 99 VAL HA 3 111 PHE H 4.000 . 4.500 3.263 3.206 3.323 . 0 0 "[ . 1 .]" 1 1730 3 99 VAL HA 3 110 PHE H 4.500 . 5.000 4.798 4.742 4.902 . 0 0 "[ . 1 .]" 1 1731 3 99 VAL HA 3 100 LEU H 3.000 . 3.500 2.171 2.150 2.191 . 0 0 "[ . 1 .]" 1 1732 3 99 VAL H 3 99 VAL HB 4.000 . 4.500 3.130 3.042 3.191 . 0 0 "[ . 1 .]" 1 1733 3 99 VAL HB 3 111 PHE H 4.000 . 4.500 4.611 4.551 4.699 0.199 10 0 "[ . 1 .]" 1 1734 3 98 TYR H 3 99 VAL HB 5.000 . 5.500 5.423 5.380 5.471 . 0 0 "[ . 1 .]" 1 1735 3 99 VAL HB 3 100 LEU H 4.000 . 4.500 4.154 4.122 4.208 . 0 0 "[ . 1 .]" 1 1736 3 99 VAL H 3 99 VAL QG 2.500 . 3.000 1.962 1.913 2.006 . 0 0 "[ . 1 .]" 1 1737 3 99 VAL QG 3 111 PHE H 4.000 . 4.500 4.451 4.364 4.550 0.050 10 0 "[ . 1 .]" 1 1738 3 99 VAL QG 3 110 PHE H 4.000 . 4.500 4.328 4.205 4.524 0.024 8 0 "[ . 1 .]" 1 1739 3 99 VAL QG 3 109 LEU H 3.000 . 3.500 3.013 2.755 3.288 . 0 0 "[ . 1 .]" 1 1740 3 88 ARG H 3 99 VAL QG 5.000 . 5.500 4.388 4.268 4.547 . 0 0 "[ . 1 .]" 1 1741 3 87 LYS H 3 99 VAL QG 3.000 . 3.500 3.039 2.924 3.136 . 0 0 "[ . 1 .]" 1 1742 3 99 VAL QG 3 108 ARG H 5.000 . 5.500 5.369 5.181 5.485 . 0 0 "[ . 1 .]" 1 1743 3 99 VAL QG 3 100 LEU H 3.000 . 3.500 2.413 2.194 2.577 . 0 0 "[ . 1 .]" 1 1744 3 99 VAL QG 3 101 LYS H 4.000 . 4.500 3.696 3.505 3.775 . 0 0 "[ . 1 .]" 1 1745 3 99 VAL QG 3 102 PHE H 5.000 . 5.500 5.509 5.391 5.603 0.103 10 0 "[ . 1 .]" 1 1746 3 89 VAL H 3 99 VAL QG 5.000 . 5.500 4.242 3.851 4.491 . 0 0 "[ . 1 .]" 1 1747 3 87 LYS QD 3 99 VAL H 5.500 . 6.000 5.234 4.961 5.382 . 0 0 "[ . 1 .]" 1 1748 3 85 GLU QG 3 100 LEU HA 4.000 . 4.500 4.364 4.225 4.571 0.071 7 0 "[ . 1 .]" 1 1749 3 100 LEU HA 3 100 LEU HG 4.000 . 4.500 3.095 3.021 3.124 . 0 0 "[ . 1 .]" 1 1750 3 99 VAL QG 3 100 LEU HA 4.000 . 4.500 3.476 3.424 3.513 . 0 0 "[ . 1 .]" 1 1751 3 100 LEU HA 3 100 LEU QD 3.000 . 3.500 2.051 2.023 2.096 . 0 0 "[ . 1 .]" 1 1752 3 77 LEU QD 3 100 LEU QD 4.000 . 4.500 4.237 2.898 4.574 0.074 12 0 "[ . 1 .]" 1 1753 3 100 LEU QD 3 109 LEU QD 3.000 . 3.500 2.364 2.255 2.441 . 0 0 "[ . 1 .]" 1 1754 3 100 LEU QD 3 132 LEU QD 3.000 . 3.500 2.409 2.234 2.551 . 0 0 "[ . 1 .]" 1 1755 3 100 LEU H 3 101 LYS H 4.000 . 4.500 4.353 4.264 4.398 . 0 0 "[ . 1 .]" 1 1756 3 85 GLU H 3 100 LEU HA 4.000 . 4.500 4.222 4.073 4.388 . 0 0 "[ . 1 .]" 1 1757 3 87 LYS H 3 100 LEU HA 4.000 . 4.500 3.587 3.495 3.747 . 0 0 "[ . 1 .]" 1 1758 3 100 LEU HA 3 101 LYS H 2.500 . 3.000 2.177 2.160 2.195 . 0 0 "[ . 1 .]" 1 1759 3 100 LEU HG 3 109 LEU H 5.000 . 5.500 4.152 3.986 4.326 . 0 0 "[ . 1 .]" 1 1760 3 100 LEU H 3 100 LEU HG 4.000 . 4.500 4.312 4.260 4.362 . 0 0 "[ . 1 .]" 1 1761 3 100 LEU HG 3 101 LYS H 3.000 . 3.500 3.282 3.184 3.423 . 0 0 "[ . 1 .]" 1 1762 3 100 LEU HG 3 102 PHE H 5.000 . 5.500 4.537 4.217 4.991 . 0 0 "[ . 1 .]" 1 1763 3 100 LEU QB 3 109 LEU H 4.000 . 4.500 2.985 2.802 3.166 . 0 0 "[ . 1 .]" 1 1764 3 100 LEU H 3 100 LEU QB 3.000 . 3.500 2.329 2.305 2.359 . 0 0 "[ . 1 .]" 1 1765 3 100 LEU QB 3 101 LYS H 4.000 . 4.500 3.864 3.838 3.927 . 0 0 "[ . 1 .]" 1 1766 3 85 GLU H 3 100 LEU QD 3.000 . 3.500 2.500 2.368 2.728 . 0 0 "[ . 1 .]" 1 1767 3 100 LEU QD 3 109 LEU H 4.000 . 4.500 4.224 4.090 4.333 . 0 0 "[ . 1 .]" 1 1768 3 87 LYS H 3 100 LEU QD 4.000 . 4.500 4.231 4.108 4.338 . 0 0 "[ . 1 .]" 1 1769 3 100 LEU H 3 100 LEU QD 3.500 . 4.000 3.776 3.765 3.796 . 0 0 "[ . 1 .]" 1 1770 3 100 LEU QD 3 101 LYS H 3.000 . 3.500 2.506 2.339 2.691 . 0 0 "[ . 1 .]" 1 1771 3 86 PHE H 3 100 LEU QD 3.000 . 3.500 3.579 3.503 3.619 0.119 3 0 "[ . 1 .]" 1 1772 3 101 LYS HA 3 101 LYS QG 3.000 . 3.500 3.241 3.214 3.273 . 0 0 "[ . 1 .]" 1 1773 3 101 LYS HA 3 101 LYS QD 4.000 . 4.500 4.389 4.360 4.420 . 0 0 "[ . 1 .]" 1 1774 3 101 LYS HA 3 108 ARG HA 3.000 . 3.500 2.428 2.200 2.565 . 0 0 "[ . 1 .]" 1 1775 3 101 LYS HA 3 108 ARG QB 5.000 . 5.500 3.558 2.180 4.294 . 0 0 "[ . 1 .]" 1 1776 3 101 LYS HA 3 108 ARG QD 3.500 . 4.000 4.125 3.923 4.252 0.252 14 0 "[ . 1 .]" 1 1777 3 100 LEU HG 3 101 LYS HA 4.000 . 4.500 3.907 3.813 4.101 . 0 0 "[ . 1 .]" 1 1778 3 99 VAL QG 3 101 LYS HA 4.000 . 4.500 3.834 3.720 3.897 . 0 0 "[ . 1 .]" 1 1779 3 99 VAL QG 3 101 LYS QB 3.000 . 3.500 3.205 3.026 3.277 . 0 0 "[ . 1 .]" 1 1780 3 85 GLU QB 3 101 LYS QG 4.000 . 4.500 2.103 2.050 2.313 . 0 0 "[ . 1 .]" 1 1781 3 86 PHE HA 3 101 LYS QG 5.000 . 5.500 4.207 4.040 4.346 . 0 0 "[ . 1 .]" 1 1782 3 101 LYS QE 3 101 LYS QG 2.500 . 3.000 2.216 2.204 2.234 . 0 0 "[ . 1 .]" 1 1783 3 101 LYS QG 3 103 LYS HA 5.000 . 5.500 5.276 4.919 5.565 0.065 10 0 "[ . 1 .]" 1 1784 3 101 LYS QG 3 108 ARG HA 5.000 . 5.500 5.045 4.731 5.282 . 0 0 "[ . 1 .]" 1 1785 3 101 LYS QG 3 108 ARG QD 5.000 . 5.500 5.088 4.492 5.642 0.142 5 0 "[ . 1 .]" 1 1786 3 85 GLU QB 3 101 LYS QD 3.000 . 3.500 3.281 3.164 3.444 . 0 0 "[ . 1 .]" 1 1787 3 99 VAL QG 3 101 LYS QD 3.000 . 3.500 3.384 3.301 3.488 . 0 0 "[ . 1 .]" 1 1788 3 101 LYS QB 3 101 LYS QE 3.000 . 3.500 2.028 2.014 2.045 . 0 0 "[ . 1 .]" 1 1789 3 101 LYS H 3 102 PHE H 4.000 . 4.500 4.404 4.301 4.507 0.007 6 0 "[ . 1 .]" 1 1790 3 86 PHE H 3 101 LYS H 5.000 . 5.500 4.972 4.912 5.063 . 0 0 "[ . 1 .]" 1 1791 3 85 GLU H 3 101 LYS HA 4.000 . 4.500 4.523 4.436 4.569 0.069 10 0 "[ . 1 .]" 1 1792 3 101 LYS HA 3 107 LYS H 5.000 . 5.500 5.288 4.628 5.591 0.091 2 0 "[ . 1 .]" 1 1793 3 101 LYS HA 3 109 LEU H 4.000 . 4.500 3.675 3.532 3.806 . 0 0 "[ . 1 .]" 1 1794 3 101 LYS HA 3 108 ARG H 5.000 . 5.500 4.981 4.799 5.143 . 0 0 "[ . 1 .]" 1 1795 3 101 LYS HA 3 102 PHE H 3.000 . 3.500 2.165 2.093 2.214 . 0 0 "[ . 1 .]" 1 1796 3 101 LYS H 3 101 LYS QG 3.000 . 3.500 1.943 1.906 1.962 . 0 0 "[ . 1 .]" 1 1797 3 101 LYS QG 3 102 PHE H 4.000 . 4.500 4.382 4.211 4.467 . 0 0 "[ . 1 .]" 1 1798 3 101 LYS H 3 101 LYS QB 2.500 . 3.000 3.092 3.031 3.122 0.122 9 0 "[ . 1 .]" 1 1799 3 101 LYS QB 3 102 PHE H 4.000 . 4.500 3.100 2.886 3.287 . 0 0 "[ . 1 .]" 1 1800 3 101 LYS H 3 101 LYS QD 4.000 . 4.500 3.887 3.844 3.923 . 0 0 "[ . 1 .]" 1 1801 3 101 LYS QD 3 102 PHE H 5.000 . 5.500 5.556 5.373 5.682 0.182 1 0 "[ . 1 .]" 1 1802 3 102 PHE HA 3 103 LYS QG 4.000 . 4.500 3.863 3.806 3.945 . 0 0 "[ . 1 .]" 1 1803 3 84 CYS HA 3 102 PHE QB 5.000 . 5.500 4.145 4.101 4.234 . 0 0 "[ . 1 .]" 1 1804 3 102 PHE QB 3 107 LYS QB 4.000 . 4.500 3.467 2.319 4.623 0.123 5 0 "[ . 1 .]" 1 1805 3 83 ASP HA 3 102 PHE QD 5.000 . 5.500 5.177 4.893 5.363 . 0 0 "[ . 1 .]" 1 1806 3 83 ASP QB 3 102 PHE QD 4.000 . 4.500 4.348 4.044 4.525 0.025 6 0 "[ . 1 .]" 1 1807 3 84 CYS HA 3 102 PHE QD 5.000 . 5.500 4.334 4.051 4.449 . 0 0 "[ . 1 .]" 1 1808 3 101 LYS HA 3 102 PHE QD 4.000 . 4.500 3.056 2.885 3.203 . 0 0 "[ . 1 .]" 1 1809 3 102 PHE HA 3 102 PHE QD 4.000 . 4.500 3.051 3.000 3.075 . 0 0 "[ . 1 .]" 1 1810 3 102 PHE QB 3 102 PHE QD 2.500 . 3.000 2.154 2.143 2.165 . 0 0 "[ . 1 .]" 1 1811 3 102 PHE QD 3 107 LYS QB 4.000 . 4.500 3.105 2.233 4.471 . 0 0 "[ . 1 .]" 1 1812 3 102 PHE QD 3 107 LYS QG 5.000 . 5.500 3.559 2.116 4.843 . 0 0 "[ . 1 .]" 1 1813 3 102 PHE QD 3 107 LYS QD 3.000 . 3.500 3.242 2.508 3.602 0.102 4 0 "[ . 1 .]" 1 1814 3 102 PHE QD 3 107 LYS QE 4.000 . 4.500 4.212 2.955 4.641 0.141 6 0 "[ . 1 .]" 1 1815 3 102 PHE QD 3 108 ARG HA 4.000 . 4.500 3.243 2.591 3.778 . 0 0 "[ . 1 .]" 1 1816 3 100 LEU QD 3 102 PHE QD 4.000 . 4.500 3.952 3.680 4.214 . 0 0 "[ . 1 .]" 1 1817 3 102 PHE QD 3 109 LEU QD 4.000 . 4.500 4.108 3.770 4.370 . 0 0 "[ . 1 .]" 1 1818 3 79 ILE MD 3 102 PHE QD 5.000 . 5.500 3.651 3.341 4.346 . 0 0 "[ . 1 .]" 1 1819 3 102 PHE QD 3 109 LEU HG 4.000 . 4.500 3.957 3.505 4.270 . 0 0 "[ . 1 .]" 1 1820 3 79 ILE HA 3 102 PHE QE 6.000 . 6.500 4.210 3.841 4.496 . 0 0 "[ . 1 .]" 1 1821 3 83 ASP QB 3 102 PHE QE 5.000 . 5.500 4.960 4.728 5.082 . 0 0 "[ . 1 .]" 1 1822 3 102 PHE HA 3 102 PHE QE 5.000 . 5.500 4.550 4.504 4.599 . 0 0 "[ . 1 .]" 1 1823 3 102 PHE QB 3 102 PHE QE 4.000 . 4.500 3.964 3.952 3.974 . 0 0 "[ . 1 .]" 1 1824 3 102 PHE QE 3 107 LYS QE 4.000 . 4.500 3.653 2.706 4.065 . 0 0 "[ . 1 .]" 1 1825 3 102 PHE QE 3 109 LEU QD 3.000 . 3.500 2.489 1.971 2.830 . 0 0 "[ . 1 .]" 1 1826 3 79 ILE MD 3 102 PHE QE 4.000 . 4.500 2.016 1.789 2.589 0.011 8 0 "[ . 1 .]" 1 1827 3 102 PHE QE 3 109 LEU HG 4.000 . 4.500 2.444 2.136 2.652 . 0 0 "[ . 1 .]" 1 1828 3 100 LEU HG 3 102 PHE QE 4.000 . 4.500 3.142 2.839 3.367 . 0 0 "[ . 1 .]" 1 1829 3 102 PHE QE 3 107 LYS QB 5.000 . 5.500 3.803 2.959 5.008 . 0 0 "[ . 1 .]" 1 1830 3 102 PHE QE 3 107 LYS QD 4.000 . 4.500 2.662 2.085 3.785 . 0 0 "[ . 1 .]" 1 1831 3 77 LEU QD 3 102 PHE QE 3.000 . 3.500 3.595 2.889 3.813 0.313 10 0 "[ . 1 .]" 1 1832 3 100 LEU QD 3 102 PHE HZ 4.000 . 4.500 2.810 2.338 3.372 . 0 0 "[ . 1 .]" 1 1833 3 77 LEU QD 3 102 PHE HZ 4.000 . 4.500 2.964 1.979 3.214 . 0 0 "[ . 1 .]" 1 1834 3 102 PHE HZ 3 107 LYS QE 4.000 . 4.500 4.125 3.064 4.578 0.078 9 0 "[ . 1 .]" 1 1835 3 102 PHE HZ 3 109 LEU HG 4.000 . 4.500 4.475 4.234 4.569 0.069 7 0 "[ . 1 .]" 1 1836 3 102 PHE HZ 3 109 LEU QD 3.000 . 3.500 3.029 2.622 3.347 . 0 0 "[ . 1 .]" 1 1837 3 102 PHE H 3 107 LYS H 4.000 . 4.500 3.621 2.911 3.944 . 0 0 "[ . 1 .]" 1 1838 3 102 PHE H 3 103 LYS H 4.000 . 4.500 4.362 4.317 4.408 . 0 0 "[ . 1 .]" 1 1839 3 85 GLU H 3 102 PHE HA 3.000 . 3.500 3.580 3.453 3.648 0.148 6 0 "[ . 1 .]" 1 1840 3 102 PHE HA 3 104 ALA H 3.000 . 3.500 3.674 3.626 3.718 0.218 12 0 "[ . 1 .]" 1 1841 3 102 PHE HA 3 103 LYS H 2.500 . 3.000 2.114 2.099 2.135 . 0 0 "[ . 1 .]" 1 1842 3 102 PHE QB 3 105 GLY H 4.000 . 4.500 1.939 1.799 2.551 0.001 9 0 "[ . 1 .]" 1 1843 3 102 PHE QB 3 104 ALA H 3.000 . 3.500 3.130 2.980 3.190 . 0 0 "[ . 1 .]" 1 1844 3 102 PHE QB 3 107 LYS H 3.000 . 3.500 2.379 1.831 2.742 . 0 0 "[ . 1 .]" 1 1845 3 102 PHE QB 3 103 LYS H 4.000 . 4.500 3.454 3.420 3.511 . 0 0 "[ . 1 .]" 1 1846 3 102 PHE H 3 102 PHE QB 3.000 . 3.500 2.304 2.263 2.348 . 0 0 "[ . 1 .]" 1 1847 3 102 PHE QD 3 105 GLY H 5.000 . 5.500 3.809 3.360 4.589 . 0 0 "[ . 1 .]" 1 1848 3 85 GLU H 3 102 PHE QD 5.000 . 5.500 5.250 5.112 5.326 . 0 0 "[ . 1 .]" 1 1849 3 102 PHE QD 3 104 ALA H 4.000 . 4.500 4.405 4.355 4.490 . 0 0 "[ . 1 .]" 1 1850 3 102 PHE QD 3 107 LYS H 5.000 . 5.500 3.650 3.136 4.111 . 0 0 "[ . 1 .]" 1 1851 3 102 PHE QD 3 109 LEU H 4.000 . 4.500 4.415 4.194 4.539 0.039 9 0 "[ . 1 .]" 1 1852 3 102 PHE QD 3 103 LYS H 4.000 . 4.500 4.466 4.396 4.518 0.018 12 0 "[ . 1 .]" 1 1853 3 102 PHE QD 3 108 ARG H 4.000 . 4.500 4.598 4.453 4.694 0.194 12 0 "[ . 1 .]" 1 1854 3 101 LYS H 3 102 PHE QD 5.000 . 5.500 4.991 4.827 5.175 . 0 0 "[ . 1 .]" 1 1855 3 80 PHE H 3 102 PHE QD 6.000 . 6.500 5.805 5.593 6.081 . 0 0 "[ . 1 .]" 1 1856 3 102 PHE H 3 102 PHE QD 3.000 . 3.500 2.036 1.895 2.201 . 0 0 "[ . 1 .]" 1 1857 3 102 PHE QE 3 104 ALA H 6.000 . 6.500 6.567 6.504 6.673 0.173 1 0 "[ . 1 .]" 1 1858 3 102 PHE QE 3 107 LYS H 6.000 . 6.500 5.444 5.106 5.937 . 0 0 "[ . 1 .]" 1 1859 3 102 PHE QE 3 109 LEU H 4.000 . 4.500 4.068 3.835 4.230 . 0 0 "[ . 1 .]" 1 1860 3 102 PHE QE 3 103 LYS H 6.000 . 6.500 6.191 6.131 6.267 . 0 0 "[ . 1 .]" 1 1861 3 102 PHE QE 3 108 ARG H 5.000 . 5.500 5.350 5.137 5.626 0.126 8 0 "[ . 1 .]" 1 1862 3 101 LYS H 3 102 PHE QE 5.000 . 5.500 5.686 5.617 5.753 0.253 6 0 "[ . 1 .]" 1 1863 3 80 PHE H 3 102 PHE QE 5.000 . 5.500 5.580 5.456 5.670 0.170 8 0 "[ . 1 .]" 1 1864 3 102 PHE H 3 102 PHE QE 4.000 . 4.500 4.315 4.192 4.447 . 0 0 "[ . 1 .]" 1 1865 3 84 CYS HA 3 103 LYS HA 5.000 . 5.500 4.613 4.336 5.082 . 0 0 "[ . 1 .]" 1 1866 3 101 LYS QE 3 103 LYS HA 4.000 . 4.500 3.794 3.532 3.993 . 0 0 "[ . 1 .]" 1 1867 3 103 LYS HA 3 103 LYS QB 2.500 . 3.000 2.400 2.393 2.410 . 0 0 "[ . 1 .]" 1 1868 3 103 LYS HA 3 103 LYS QG 2.500 . 3.000 2.290 2.250 2.312 . 0 0 "[ . 1 .]" 1 1869 3 103 LYS HA 3 103 LYS QD 4.000 . 4.500 3.932 3.894 3.942 . 0 0 "[ . 1 .]" 1 1870 3 103 LYS HA 3 104 ALA HA 5.000 . 5.500 4.587 4.523 4.740 . 0 0 "[ . 1 .]" 1 1871 3 83 ASP HA 3 103 LYS QB 4.000 . 4.500 2.962 2.799 3.347 . 0 0 "[ . 1 .]" 1 1872 3 103 LYS QB 3 103 LYS QD 2.500 . 3.000 2.136 2.128 2.153 . 0 0 "[ . 1 .]" 1 1873 3 103 LYS QB 3 103 LYS QE 3.500 . 4.000 3.540 3.530 3.551 . 0 0 "[ . 1 .]" 1 1874 3 103 LYS QB 3 104 ALA HA 5.000 . 5.500 3.974 3.829 4.114 . 0 0 "[ . 1 .]" 1 1875 3 85 GLU QB 3 103 LYS QG 4.000 . 4.500 2.804 2.679 2.956 . 0 0 "[ . 1 .]" 1 1876 3 85 GLU QG 3 103 LYS QG 4.000 . 4.500 4.545 4.338 4.672 0.172 1 0 "[ . 1 .]" 1 1877 3 103 LYS QE 3 103 LYS QG 2.500 . 3.000 2.133 2.124 2.144 . 0 0 "[ . 1 .]" 1 1878 3 82 ASP QB 3 103 LYS QD 5.000 . 5.500 3.333 2.975 4.075 . 0 0 "[ . 1 .]" 1 1879 3 85 GLU HA 3 103 LYS QE 5.000 . 5.500 3.234 2.839 3.723 . 0 0 "[ . 1 .]" 1 1880 3 85 GLU QB 3 103 LYS QE 3.000 . 3.500 1.920 1.875 2.003 . 0 0 "[ . 1 .]" 1 1881 3 103 LYS H 3 105 GLY H 4.000 . 4.500 3.800 3.704 4.061 . 0 0 "[ . 1 .]" 1 1882 3 103 LYS HA 3 105 GLY H 4.000 . 4.500 4.395 3.945 4.687 0.187 7 0 "[ . 1 .]" 1 1883 3 85 GLU H 3 103 LYS HA 5.000 . 5.500 5.567 5.476 5.687 0.187 10 0 "[ . 1 .]" 1 1884 3 103 LYS HA 3 104 ALA H 3.000 . 3.500 3.522 3.493 3.530 0.030 13 0 "[ . 1 .]" 1 1885 3 103 LYS H 3 103 LYS HA 3.000 . 3.500 2.809 2.795 2.821 . 0 0 "[ . 1 .]" 1 1886 3 103 LYS QB 3 105 GLY H 4.000 . 4.500 4.488 4.419 4.535 0.035 13 0 "[ . 1 .]" 1 1887 3 103 LYS QB 3 104 ALA H 3.000 . 3.500 2.651 2.605 2.829 . 0 0 "[ . 1 .]" 1 1888 3 103 LYS H 3 103 LYS QB 2.500 . 3.000 2.377 2.358 2.393 . 0 0 "[ . 1 .]" 1 1889 3 103 LYS H 3 103 LYS QE 4.000 . 4.500 4.321 4.276 4.411 . 0 0 "[ . 1 .]" 1 1890 3 85 GLU H 3 103 LYS QG 4.000 . 4.500 3.469 3.334 3.611 . 0 0 "[ . 1 .]" 1 1891 3 84 CYS H 3 103 LYS QG 4.000 . 4.500 4.107 3.742 4.625 0.125 9 0 "[ . 1 .]" 1 1892 3 103 LYS QG 3 104 ALA H 4.000 . 4.500 4.098 4.064 4.182 . 0 0 "[ . 1 .]" 1 1893 3 103 LYS H 3 103 LYS QG 2.500 . 3.000 2.217 2.176 2.292 . 0 0 "[ . 1 .]" 1 1894 3 101 LYS H 3 103 LYS QG 5.000 . 5.500 5.436 5.333 5.560 0.060 9 0 "[ . 1 .]" 1 1895 3 102 PHE H 3 103 LYS QG 5.000 . 5.500 5.395 5.318 5.451 . 0 0 "[ . 1 .]" 1 1896 3 103 LYS QD 3 104 ALA H 5.000 . 5.500 4.811 4.758 5.016 . 0 0 "[ . 1 .]" 1 1897 3 103 LYS QG 3 104 ALA HA 5.000 . 5.500 5.725 5.689 5.767 0.267 9 0 "[ . 1 .]" 1 1898 3 83 ASP HA 3 104 ALA MB 5.000 . 5.500 3.053 2.643 3.694 . 0 0 "[ . 1 .]" 1 1899 3 103 LYS QB 3 104 ALA MB 4.000 . 4.500 3.558 3.374 3.853 . 0 0 "[ . 1 .]" 1 1900 3 104 ALA MB 3 105 GLY QA 4.000 . 4.500 3.628 3.574 3.660 . 0 0 "[ . 1 .]" 1 1901 3 103 LYS H 3 104 ALA H 3.000 . 3.500 2.618 2.587 2.651 . 0 0 "[ . 1 .]" 1 1902 3 102 PHE H 3 104 ALA H 5.000 . 5.500 5.641 5.502 5.678 0.178 13 0 "[ . 1 .]" 1 1903 3 104 ALA HA 3 105 GLY H 3.000 . 3.500 3.445 3.414 3.460 . 0 0 "[ . 1 .]" 1 1904 3 104 ALA H 3 104 ALA HA 2.500 . 3.000 2.932 2.844 2.969 . 0 0 "[ . 1 .]" 1 1905 3 103 LYS H 3 104 ALA HA 5.000 . 5.500 5.245 5.215 5.277 . 0 0 "[ . 1 .]" 1 1906 3 104 ALA MB 3 105 GLY H 2.500 . 3.000 2.941 2.878 3.040 0.040 12 0 "[ . 1 .]" 1 1907 3 104 ALA H 3 104 ALA MB 2.500 . 3.000 2.369 2.280 2.441 . 0 0 "[ . 1 .]" 1 1908 3 103 LYS H 3 104 ALA MB 4.000 . 4.500 4.455 4.376 4.538 0.038 8 0 "[ . 1 .]" 1 1909 3 104 ALA H 3 105 GLY H 3.000 . 3.500 2.222 1.958 2.609 . 0 0 "[ . 1 .]" 1 1910 3 105 GLY H 3 105 GLY QA 2.500 . 3.000 2.294 2.216 2.428 . 0 0 "[ . 1 .]" 1 1911 3 104 ALA H 3 105 GLY QA 4.000 . 4.500 4.196 3.947 4.586 0.086 2 0 "[ . 1 .]" 1 1912 3 105 GLY QA 3 107 LYS H 4.000 . 4.500 3.107 2.922 3.416 . 0 0 "[ . 1 .]" 1 1913 3 106 SER HA 3 106 SER QB 2.500 . 3.000 2.285 2.156 2.374 . 0 0 "[ . 1 .]" 1 1914 3 105 GLY H 3 106 SER HA 5.000 . 5.500 4.943 4.720 5.144 . 0 0 "[ . 1 .]" 1 1915 3 106 SER HA 3 107 LYS H 3.000 . 3.500 3.088 2.901 3.229 . 0 0 "[ . 1 .]" 1 1916 3 106 SER H 3 106 SER QB 3.000 . 3.500 2.875 2.527 3.445 . 0 0 "[ . 1 .]" 1 1917 3 106 SER QB 3 107 LYS H 4.000 . 4.500 3.795 3.534 4.033 . 0 0 "[ . 1 .]" 1 1918 3 107 LYS HA 3 107 LYS QB 2.500 . 3.000 2.343 2.173 2.461 . 0 0 "[ . 1 .]" 1 1919 3 107 LYS HA 3 107 LYS QG 3.000 . 3.500 2.618 2.067 3.312 . 0 0 "[ . 1 .]" 1 1920 3 107 LYS HA 3 107 LYS QD 3.500 . 4.000 3.987 3.314 4.276 0.276 4 0 "[ . 1 .]" 1 1921 3 107 LYS HA 3 107 LYS QE 4.500 . 5.000 4.507 4.164 5.334 0.334 8 0 "[ . 1 .]" 1 1922 3 107 LYS QB 3 107 LYS QD 3.000 . 3.500 2.114 1.990 2.183 . 0 0 "[ . 1 .]" 1 1923 3 107 LYS QB 3 107 LYS QE 3.000 . 3.500 2.418 2.075 3.512 0.012 2 0 "[ . 1 .]" 1 1924 3 107 LYS QE 3 107 LYS QG 3.000 . 3.500 2.319 2.012 2.721 . 0 0 "[ . 1 .]" 1 1925 3 107 LYS QE 3 109 LEU HG 5.000 . 5.500 4.371 2.724 4.952 . 0 0 "[ . 1 .]" 1 1926 3 105 GLY H 3 107 LYS H 4.000 . 4.500 4.439 4.041 4.637 0.137 12 0 "[ . 1 .]" 1 1927 3 107 LYS H 3 108 ARG H 4.000 . 4.500 4.514 4.424 4.564 0.064 13 0 "[ . 1 .]" 1 1928 3 107 LYS H 3 107 LYS HA 3.000 . 3.500 2.921 2.801 2.962 . 0 0 "[ . 1 .]" 1 1929 3 107 LYS HA 3 108 ARG H 3.000 . 3.500 2.249 2.149 2.397 . 0 0 "[ . 1 .]" 1 1930 3 107 LYS H 3 107 LYS QD 4.000 . 4.500 4.373 3.811 4.743 0.243 1 0 "[ . 1 .]" 1 1931 3 107 LYS QD 3 108 ARG H 4.000 . 4.500 3.831 2.595 4.723 0.223 4 0 "[ . 1 .]" 1 1932 3 102 PHE H 3 107 LYS QD 5.000 . 5.500 4.958 4.080 5.264 . 0 0 "[ . 1 .]" 1 1933 3 107 LYS H 3 107 LYS QB 3.000 . 3.500 2.556 2.216 3.144 . 0 0 "[ . 1 .]" 1 1934 3 107 LYS QB 3 108 ARG H 3.000 . 3.500 3.224 2.448 3.657 0.157 2 0 "[ . 1 .]" 1 1935 3 102 PHE H 3 107 LYS QB 5.000 . 5.500 4.288 3.432 5.360 . 0 0 "[ . 1 .]" 1 1936 3 107 LYS H 3 107 LYS QE 5.000 . 5.500 4.690 4.317 5.831 0.331 2 0 "[ . 1 .]" 1 1937 3 107 LYS QE 3 108 ARG H 5.000 . 5.500 4.897 4.005 5.507 0.007 8 0 "[ . 1 .]" 1 1938 3 107 LYS H 3 107 LYS QG 4.000 . 4.500 3.344 1.879 4.069 . 0 0 "[ . 1 .]" 1 1939 3 107 LYS QG 3 108 ARG H 4.000 . 4.500 2.709 1.911 4.159 . 0 0 "[ . 1 .]" 1 1940 3 77 LEU QD 3 107 LYS QE 4.000 . 4.500 3.628 3.009 4.090 . 0 0 "[ . 1 .]" 1 1941 3 107 LYS QE 3 109 LEU MD1 3.500 . 4.000 3.615 2.233 4.116 0.116 14 0 "[ . 1 .]" 1 1942 3 107 LYS QE 3 109 LEU MD2 3.500 . 4.000 3.366 2.062 3.972 . 0 0 "[ . 1 .]" 1 1943 3 107 LYS QG 3 109 LEU MD1 5.000 . 5.500 4.467 3.696 5.514 0.014 6 0 "[ . 1 .]" 1 1944 3 107 LYS QG 3 109 LEU MD2 5.000 . 5.500 3.249 2.309 4.854 . 0 0 "[ . 1 .]" 1 1945 3 107 LYS QD 3 109 LEU HG 4.500 . 5.000 3.124 2.581 4.904 . 0 0 "[ . 1 .]" 1 1946 3 101 LYS QB 3 108 ARG HA 5.000 . 5.500 3.730 3.365 4.040 . 0 0 "[ . 1 .]" 1 1947 3 108 ARG HA 3 108 ARG QB 2.500 . 3.000 2.360 2.171 2.491 . 0 0 "[ . 1 .]" 1 1948 3 108 ARG HA 3 108 ARG QG 3.000 . 3.500 2.463 2.048 3.366 . 0 0 "[ . 1 .]" 1 1949 3 108 ARG HA 3 108 ARG QD 3.500 . 4.000 3.710 3.213 4.028 0.028 10 0 "[ . 1 .]" 1 1950 3 108 ARG QB 3 108 ARG QD 3.000 . 3.500 2.169 2.095 2.402 . 0 0 "[ . 1 .]" 1 1951 3 99 VAL QG 3 108 ARG QG 3.000 . 3.500 3.304 2.668 3.578 0.078 10 0 "[ . 1 .]" 1 1952 3 99 VAL QG 3 108 ARG QD 4.000 . 4.500 3.663 2.888 4.520 0.020 9 0 "[ . 1 .]" 1 1953 3 108 ARG HA 3 109 LEU H 2.500 . 3.000 2.197 2.133 2.321 . 0 0 "[ . 1 .]" 1 1954 3 102 PHE H 3 108 ARG HA 4.000 . 4.500 3.516 3.180 3.893 . 0 0 "[ . 1 .]" 1 1955 3 108 ARG QB 3 109 LEU H 4.000 . 4.500 3.025 2.558 3.575 . 0 0 "[ . 1 .]" 1 1956 3 108 ARG H 3 108 ARG QB 3.000 . 3.500 2.738 2.449 3.234 . 0 0 "[ . 1 .]" 1 1957 3 108 ARG H 3 108 ARG QG 3.000 . 3.500 3.014 2.058 3.755 0.255 3 0 "[ . 1 .]" 1 1958 3 102 PHE H 3 108 ARG QG 5.000 . 5.500 3.791 3.123 5.575 0.075 4 0 "[ . 1 .]" 1 1959 3 108 ARG H 3 108 ARG QD 4.000 . 4.500 3.760 2.537 4.717 0.217 15 0 "[ . 1 .]" 1 1960 3 109 LEU HA 3 109 LEU QB 2.500 . 3.000 2.321 2.314 2.331 . 0 0 "[ . 1 .]" 1 1961 3 109 LEU HA 3 109 LEU HG 3.000 . 3.500 3.171 3.131 3.200 . 0 0 "[ . 1 .]" 1 1962 3 100 LEU QD 3 109 LEU HA 5.000 . 5.500 5.525 5.460 5.565 0.065 9 0 "[ . 1 .]" 1 1963 3 109 LEU HA 3 109 LEU QD 2.500 . 3.000 2.043 2.011 2.101 . 0 0 "[ . 1 .]" 1 1964 3 109 LEU QB 3 109 LEU HG 2.500 . 3.000 2.351 2.345 2.363 . 0 0 "[ . 1 .]" 1 1965 3 100 LEU QD 3 109 LEU QB 4.000 . 4.500 3.114 3.043 3.153 . 0 0 "[ . 1 .]" 1 1966 3 109 LEU QB 3 109 LEU QD 2.500 . 3.000 1.924 1.907 1.934 . 0 0 "[ . 1 .]" 1 1967 3 100 LEU QD 3 109 LEU HG 4.000 . 4.500 3.707 3.571 3.808 . 0 0 "[ . 1 .]" 1 1968 3 108 ARG H 3 109 LEU H 4.000 . 4.500 4.311 4.040 4.414 . 0 0 "[ . 1 .]" 1 1969 3 100 LEU H 3 109 LEU H 4.000 . 4.500 2.854 2.771 3.061 . 0 0 "[ . 1 .]" 1 1970 3 101 LYS H 3 109 LEU H 5.000 . 5.500 4.884 4.730 4.988 . 0 0 "[ . 1 .]" 1 1971 3 102 PHE H 3 109 LEU H 5.000 . 5.500 5.150 4.866 5.378 . 0 0 "[ . 1 .]" 1 1972 3 109 LEU HA 3 110 PHE H 2.500 . 3.000 2.289 2.234 2.336 . 0 0 "[ . 1 .]" 1 1973 3 109 LEU H 3 109 LEU HA 3.000 . 3.500 2.956 2.938 2.961 . 0 0 "[ . 1 .]" 1 1974 3 109 LEU QB 3 110 PHE H 3.000 . 3.500 2.760 2.632 2.927 . 0 0 "[ . 1 .]" 1 1975 3 109 LEU H 3 109 LEU QB 3.000 . 3.500 2.626 2.537 2.671 . 0 0 "[ . 1 .]" 1 1976 3 100 LEU H 3 109 LEU QB 4.000 . 4.500 3.013 2.932 3.120 . 0 0 "[ . 1 .]" 1 1977 3 109 LEU QD 3 110 PHE H 3.500 . 4.000 3.417 3.381 3.483 . 0 0 "[ . 1 .]" 1 1978 3 109 LEU H 3 109 LEU QD 3.000 . 3.500 3.227 3.075 3.302 . 0 0 "[ . 1 .]" 1 1979 3 100 LEU H 3 109 LEU QD 4.000 . 4.500 4.458 4.380 4.529 0.029 14 0 "[ . 1 .]" 1 1980 3 109 LEU HG 3 110 PHE H 5.000 . 5.500 5.052 5.010 5.102 . 0 0 "[ . 1 .]" 1 1981 3 109 LEU H 3 109 LEU HG 3.000 . 3.500 2.550 2.258 2.650 . 0 0 "[ . 1 .]" 1 1982 3 100 LEU H 3 109 LEU HG 4.000 . 4.500 4.669 4.632 4.721 0.221 14 0 "[ . 1 .]" 1 1983 3 35 MET ME 3 110 PHE QB 5.000 . 5.500 3.380 2.050 3.774 . 0 0 "[ . 1 .]" 1 1984 3 42 VAL QG 3 110 PHE QB 4.000 . 4.500 2.384 2.267 2.592 . 0 0 "[ . 1 .]" 1 1985 3 37 LEU QB 3 110 PHE QD 4.000 . 4.500 2.764 2.663 2.900 . 0 0 "[ . 1 .]" 1 1986 3 99 VAL HA 3 110 PHE QD 4.000 . 4.500 3.710 3.411 4.111 . 0 0 "[ . 1 .]" 1 1987 3 109 LEU HA 3 110 PHE QD 4.000 . 4.500 3.252 3.000 3.537 . 0 0 "[ . 1 .]" 1 1988 3 110 PHE HA 3 110 PHE QD 4.000 . 4.500 2.868 2.737 2.953 . 0 0 "[ . 1 .]" 1 1989 3 37 LEU QD 3 110 PHE QD 4.000 . 4.500 3.540 3.492 3.597 . 0 0 "[ . 1 .]" 1 1990 3 42 VAL QG 3 110 PHE QD 4.000 . 4.500 2.752 2.610 2.861 . 0 0 "[ . 1 .]" 1 1991 3 99 VAL QG 3 110 PHE QD 4.000 . 4.500 2.917 2.678 3.290 . 0 0 "[ . 1 .]" 1 1992 3 89 VAL QG 3 110 PHE QD 3.000 . 3.500 2.442 2.095 2.825 . 0 0 "[ . 1 .]" 1 1993 3 97 VAL QG 3 110 PHE QD 3.000 . 3.500 3.307 3.053 3.466 . 0 0 "[ . 1 .]" 1 1994 3 109 LEU QD 3 110 PHE QD 5.000 . 5.500 4.387 4.210 4.567 . 0 0 "[ . 1 .]" 1 1995 3 37 LEU HA 3 110 PHE QE 5.000 . 5.500 4.793 4.594 4.983 . 0 0 "[ . 1 .]" 1 1996 3 37 LEU QB 3 110 PHE QE 4.000 . 4.500 2.294 2.139 2.456 . 0 0 "[ . 1 .]" 1 1997 3 99 VAL HA 3 110 PHE QE 5.000 . 5.500 4.846 4.631 5.125 . 0 0 "[ . 1 .]" 1 1998 3 108 ARG HA 3 110 PHE QE 5.000 . 5.500 5.465 5.231 5.611 0.111 5 0 "[ . 1 .]" 1 1999 3 108 ARG QB 3 110 PHE QE 4.000 . 4.500 3.312 3.053 3.999 . 0 0 "[ . 1 .]" 1 2000 3 109 LEU HA 3 110 PHE QE 5.000 . 5.500 4.343 4.070 4.596 . 0 0 "[ . 1 .]" 1 2001 3 110 PHE HA 3 110 PHE QE 6.000 . 6.500 4.584 4.536 4.614 . 0 0 "[ . 1 .]" 1 2002 3 37 LEU QD 3 110 PHE QE 3.000 . 3.500 1.857 1.817 2.005 . 0 0 "[ . 1 .]" 1 2003 3 42 VAL QG 3 110 PHE QE 4.000 . 4.500 2.895 2.670 3.027 . 0 0 "[ . 1 .]" 1 2004 3 99 VAL HB 3 110 PHE QE 3.000 . 3.500 3.046 2.716 3.414 . 0 0 "[ . 1 .]" 1 2005 3 99 VAL QG 3 110 PHE QE 4.000 . 4.500 2.587 2.342 2.890 . 0 0 "[ . 1 .]" 1 2006 3 89 VAL QG 3 110 PHE QE 3.000 . 3.500 2.645 2.398 2.839 . 0 0 "[ . 1 .]" 1 2007 3 97 VAL QG 3 110 PHE QE 4.500 . 5.000 4.751 4.436 4.946 . 0 0 "[ . 1 .]" 1 2008 3 108 ARG QB 3 110 PHE HZ 5.000 . 5.500 3.456 2.888 4.130 . 0 0 "[ . 1 .]" 1 2009 3 37 LEU QD 3 110 PHE HZ 4.000 . 4.500 2.220 2.122 2.402 . 0 0 "[ . 1 .]" 1 2010 3 42 VAL QG 3 110 PHE HZ 4.000 . 4.500 3.337 3.035 3.487 . 0 0 "[ . 1 .]" 1 2011 3 99 VAL QG 3 110 PHE HZ 4.000 . 4.500 3.224 2.962 3.484 . 0 0 "[ . 1 .]" 1 2012 3 89 VAL QG 3 110 PHE HZ 4.500 . 5.000 4.506 4.235 4.683 . 0 0 "[ . 1 .]" 1 2013 3 100 LEU H 3 110 PHE H 5.000 . 5.500 4.760 4.667 4.858 . 0 0 "[ . 1 .]" 1 2014 3 35 MET H 3 110 PHE HA 5.000 . 5.500 5.209 4.958 5.315 . 0 0 "[ . 1 .]" 1 2015 3 110 PHE HA 3 111 PHE H 2.500 . 3.000 2.194 2.183 2.201 . 0 0 "[ . 1 .]" 1 2016 3 110 PHE H 3 110 PHE HA 3.000 . 3.500 2.962 2.959 2.965 . 0 0 "[ . 1 .]" 1 2017 3 100 LEU H 3 110 PHE HA 4.000 . 4.500 3.561 3.463 3.724 . 0 0 "[ . 1 .]" 1 2018 3 36 SER H 3 110 PHE QB 5.000 . 5.500 4.550 4.432 4.707 . 0 0 "[ . 1 .]" 1 2019 3 35 MET H 3 110 PHE QB 4.000 . 4.500 3.386 3.103 3.533 . 0 0 "[ . 1 .]" 1 2020 3 110 PHE QB 3 111 PHE H 3.000 . 3.500 3.071 3.010 3.152 . 0 0 "[ . 1 .]" 1 2021 3 110 PHE H 3 110 PHE QB 3.000 . 3.500 2.516 2.444 2.571 . 0 0 "[ . 1 .]" 1 2022 3 36 SER H 3 110 PHE QD 5.500 . 6.000 5.478 5.351 5.610 . 0 0 "[ . 1 .]" 1 2023 3 35 MET H 3 110 PHE QD 5.500 . 6.000 4.938 4.845 5.016 . 0 0 "[ . 1 .]" 1 2024 3 110 PHE QD 3 111 PHE H 4.000 . 4.500 4.062 3.922 4.152 . 0 0 "[ . 1 .]" 1 2025 3 110 PHE H 3 110 PHE QD 3.000 . 3.500 2.684 2.529 2.819 . 0 0 "[ . 1 .]" 1 2026 3 37 LEU H 3 110 PHE QD 4.000 . 4.500 3.981 3.909 4.089 . 0 0 "[ . 1 .]" 1 2027 3 100 LEU H 3 110 PHE QD 5.500 . 6.000 5.068 4.875 5.325 . 0 0 "[ . 1 .]" 1 2028 3 110 PHE H 3 110 PHE QE 4.500 . 5.000 4.710 4.618 4.871 . 0 0 "[ . 1 .]" 1 2029 3 37 LEU H 3 110 PHE QE 4.000 . 4.500 4.617 4.554 4.659 0.159 10 0 "[ . 1 .]" 1 2030 3 108 ARG H 3 110 PHE QE 5.000 . 5.500 5.160 4.616 5.423 . 0 0 "[ . 1 .]" 1 2031 3 100 LEU H 3 110 PHE QE 6.000 . 6.500 5.730 5.522 5.996 . 0 0 "[ . 1 .]" 1 2032 3 35 MET QB 3 110 PHE QB 3.000 2.110 3.500 1.948 1.920 2.001 0.190 9 0 "[ . 1 .]" 1 2033 3 99 VAL H 3 110 PHE QD 6.000 . 6.500 5.242 4.983 5.666 . 0 0 "[ . 1 .]" 1 2034 3 51 VAL QG 3 111 PHE QB 4.000 . 4.500 3.117 3.017 3.220 . 0 0 "[ . 1 .]" 1 2035 3 32 ALA MB 3 111 PHE QE 4.000 . 4.500 4.692 4.550 4.839 0.339 1 0 "[ . 1 .]" 1 2036 3 111 PHE HA 3 111 PHE QD 4.000 . 4.500 2.815 2.748 2.909 . 0 0 "[ . 1 .]" 1 2037 3 111 PHE HA 3 112 TRP HD1 4.000 . 4.500 3.192 3.048 3.287 . 0 0 "[ . 1 .]" 1 2038 3 32 ALA MB 3 111 PHE QD 4.000 . 4.500 3.058 2.949 3.210 . 0 0 "[ . 1 .]" 1 2039 3 34 LYS HA 3 111 PHE QD 4.000 . 4.500 2.492 2.363 2.663 . 0 0 "[ . 1 .]" 1 2040 3 34 LYS QG 3 111 PHE QD 5.000 . 5.500 4.082 2.684 4.712 . 0 0 "[ . 1 .]" 1 2041 3 34 LYS QD 3 111 PHE QD 5.000 . 5.500 5.112 3.897 5.713 0.213 5 0 "[ . 1 .]" 1 2042 3 86 PHE QE 3 111 PHE QD 3.000 . 3.500 3.168 2.865 3.392 . 0 0 "[ . 1 .]" 1 2043 3 99 VAL HA 3 111 PHE QD 5.000 . 5.500 3.718 3.615 3.800 . 0 0 "[ . 1 .]" 1 2044 3 109 LEU QB 3 111 PHE QD 5.000 . 5.500 3.317 3.195 3.440 . 0 0 "[ . 1 .]" 1 2045 3 110 PHE HA 3 111 PHE QD 4.000 . 4.500 3.492 3.299 3.614 . 0 0 "[ . 1 .]" 1 2046 3 63 PHE HZ 3 111 PHE QD 5.000 . 5.500 4.345 4.209 4.537 . 0 0 "[ . 1 .]" 1 2047 3 51 VAL QG 3 111 PHE QD 4.000 . 4.500 3.056 2.921 3.182 . 0 0 "[ . 1 .]" 1 2048 3 100 LEU QD 3 111 PHE QD 4.000 . 4.500 4.404 4.304 4.514 0.014 7 0 "[ . 1 .]" 1 2049 3 109 LEU QD 3 111 PHE QD 4.000 . 4.500 4.393 4.275 4.501 0.001 14 0 "[ . 1 .]" 1 2050 3 34 LYS HA 3 111 PHE QE 5.000 . 5.500 3.275 3.188 3.365 . 0 0 "[ . 1 .]" 1 2051 3 34 LYS QG 3 111 PHE QE 4.000 . 4.500 3.478 1.904 4.231 . 0 0 "[ . 1 .]" 1 2052 3 34 LYS QD 3 111 PHE QE 5.000 . 5.500 3.766 2.091 4.707 . 0 0 "[ . 1 .]" 1 2053 3 65 TRP HA 3 111 PHE QE 5.000 . 5.500 5.237 5.052 5.422 . 0 0 "[ . 1 .]" 1 2054 3 65 TRP QB 3 111 PHE QE 5.000 . 5.500 3.358 3.202 3.461 . 0 0 "[ . 1 .]" 1 2055 3 100 LEU QB 3 111 PHE QE 4.000 . 4.500 3.088 2.996 3.146 . 0 0 "[ . 1 .]" 1 2056 3 109 LEU HA 3 111 PHE QE 5.000 . 5.500 4.371 4.247 4.533 . 0 0 "[ . 1 .]" 1 2057 3 109 LEU QB 3 111 PHE QE 3.000 . 3.500 1.924 1.836 2.038 . 0 0 "[ . 1 .]" 1 2058 3 109 LEU HG 3 111 PHE QE 4.000 . 4.500 4.238 4.125 4.346 . 0 0 "[ . 1 .]" 1 2059 3 110 PHE HA 3 111 PHE QE 4.500 . 5.000 4.818 4.708 4.926 . 0 0 "[ . 1 .]" 1 2060 3 111 PHE HA 3 111 PHE QE 4.000 . 4.500 4.497 4.467 4.536 0.036 10 0 "[ . 1 .]" 1 2061 3 111 PHE QB 3 111 PHE QE 4.000 . 4.500 3.942 3.933 3.947 . 0 0 "[ . 1 .]" 1 2062 3 63 PHE HZ 3 111 PHE QE 4.000 . 4.500 3.722 3.368 3.981 . 0 0 "[ . 1 .]" 1 2063 3 51 VAL QG 3 111 PHE QE 4.000 . 4.500 3.330 3.072 3.532 . 0 0 "[ . 1 .]" 1 2064 3 100 LEU QD 3 111 PHE QE 3.000 . 3.500 3.368 3.280 3.459 . 0 0 "[ . 1 .]" 1 2065 3 100 LEU HG 3 111 PHE QE 5.000 . 5.500 5.436 5.248 5.540 0.040 6 0 "[ . 1 .]" 1 2066 3 109 LEU QD 3 111 PHE QE 3.000 . 3.500 2.637 2.418 2.796 . 0 0 "[ . 1 .]" 1 2067 3 34 LYS QG 3 111 PHE HZ 5.000 . 5.500 4.809 3.075 5.638 0.138 8 0 "[ . 1 .]" 1 2068 3 109 LEU QB 3 111 PHE HZ 4.000 . 4.500 3.143 3.073 3.190 . 0 0 "[ . 1 .]" 1 2069 3 51 VAL QG 3 111 PHE HZ 4.000 . 4.500 4.135 3.816 4.369 . 0 0 "[ . 1 .]" 1 2070 3 109 LEU QD 3 111 PHE HZ 3.000 . 3.500 2.844 2.758 2.937 . 0 0 "[ . 1 .]" 1 2071 3 109 LEU HG 3 111 PHE HZ 5.000 . 5.500 5.554 5.442 5.605 0.105 1 0 "[ . 1 .]" 1 2072 3 100 LEU QD 3 111 PHE HZ 4.000 . 4.500 4.697 4.602 4.759 0.259 6 0 "[ . 1 .]" 1 2073 3 110 PHE H 3 111 PHE H 4.000 . 4.500 4.416 4.393 4.454 . 0 0 "[ . 1 .]" 1 2074 3 98 TYR H 3 111 PHE H 4.000 . 4.500 3.206 3.114 3.252 . 0 0 "[ . 1 .]" 1 2075 3 33 GLY H 3 111 PHE HA 5.000 . 5.500 4.619 4.513 4.727 . 0 0 "[ . 1 .]" 1 2076 3 35 MET H 3 111 PHE HA 4.000 . 4.500 3.722 3.523 3.834 . 0 0 "[ . 1 .]" 1 2077 3 111 PHE HA 3 112 TRP H 3.000 . 3.500 2.274 2.247 2.303 . 0 0 "[ . 1 .]" 1 2078 3 34 LYS H 3 111 PHE HA 5.000 . 5.500 4.812 4.741 4.877 . 0 0 "[ . 1 .]" 1 2079 3 35 MET H 3 111 PHE QB 6.000 . 6.500 5.399 5.234 5.487 . 0 0 "[ . 1 .]" 1 2080 3 111 PHE QB 3 112 TRP H 3.000 . 3.500 2.532 2.472 2.581 . 0 0 "[ . 1 .]" 1 2081 3 111 PHE H 3 111 PHE QB 3.000 . 3.500 2.660 2.628 2.690 . 0 0 "[ . 1 .]" 1 2082 3 33 GLY H 3 111 PHE QD 5.000 . 5.500 4.175 4.087 4.293 . 0 0 "[ . 1 .]" 1 2083 3 49 GLY H 3 111 PHE QD 5.000 . 5.500 5.652 5.513 5.766 0.266 13 0 "[ . 1 .]" 1 2084 3 35 MET H 3 111 PHE QD 5.000 . 5.500 4.577 4.465 4.697 . 0 0 "[ . 1 .]" 1 2085 3 111 PHE QD 3 112 TRP H 3.000 . 3.500 3.527 3.480 3.562 0.062 10 0 "[ . 1 .]" 1 2086 3 34 LYS H 3 111 PHE QD 4.000 . 4.500 3.761 3.641 3.897 . 0 0 "[ . 1 .]" 1 2087 3 111 PHE H 3 111 PHE QD 3.000 . 3.500 3.051 2.902 3.140 . 0 0 "[ . 1 .]" 1 2088 3 110 PHE H 3 111 PHE QD 5.000 . 5.500 4.251 4.059 4.340 . 0 0 "[ . 1 .]" 1 2089 3 100 LEU H 3 111 PHE QD 4.000 . 4.500 3.654 3.520 3.797 . 0 0 "[ . 1 .]" 1 2090 3 111 PHE QD 3 112 TRP HE1 5.000 . 5.500 5.627 5.582 5.679 0.179 9 0 "[ . 1 .]" 1 2091 3 65 TRP HE1 3 111 PHE QD 4.000 . 4.500 3.123 2.878 3.271 . 0 0 "[ . 1 .]" 1 2092 3 35 MET H 3 111 PHE QE 6.000 . 6.500 4.753 4.609 4.932 . 0 0 "[ . 1 .]" 1 2093 3 111 PHE QE 3 112 TRP H 5.000 . 5.500 5.714 5.674 5.735 0.235 12 0 "[ . 1 .]" 1 2094 3 111 PHE H 3 111 PHE QE 5.000 . 5.500 5.047 4.982 5.077 . 0 0 "[ . 1 .]" 1 2095 3 110 PHE H 3 111 PHE QE 4.500 . 5.000 4.112 3.939 4.219 . 0 0 "[ . 1 .]" 1 2096 3 100 LEU H 3 111 PHE QE 4.000 . 4.500 4.167 4.061 4.256 . 0 0 "[ . 1 .]" 1 2097 3 65 TRP HE1 3 111 PHE QE 4.000 . 4.500 3.274 2.907 3.678 . 0 0 "[ . 1 .]" 1 2098 3 98 TYR QD 3 111 PHE H 6.000 . 6.500 5.365 5.147 5.653 . 0 0 "[ . 1 .]" 1 2099 3 110 PHE H 3 111 PHE HZ 5.000 . 5.500 5.185 5.057 5.279 . 0 0 "[ . 1 .]" 1 2100 3 97 VAL QG 3 112 TRP HA 4.000 . 4.500 3.035 2.913 3.128 . 0 0 "[ . 1 .]" 1 2101 3 46 LYS HA 3 112 TRP HZ2 3.000 . 3.500 3.372 3.284 3.495 . 0 0 "[ . 1 .]" 1 2102 3 46 LYS QB 3 112 TRP HZ2 5.000 . 5.500 5.223 5.080 5.316 . 0 0 "[ . 1 .]" 1 2103 3 46 LYS HA 3 112 TRP HH2 5.000 . 5.500 4.846 4.685 4.965 . 0 0 "[ . 1 .]" 1 2104 3 34 LYS HA 3 112 TRP HD1 4.000 . 4.500 3.894 3.782 3.958 . 0 0 "[ . 1 .]" 1 2105 3 35 MET HA 3 112 TRP HD1 5.000 . 5.500 4.448 4.085 4.795 . 0 0 "[ . 1 .]" 1 2106 3 35 MET QB 3 112 TRP HD1 5.000 . 5.500 4.216 4.028 4.389 . 0 0 "[ . 1 .]" 1 2107 3 35 MET QG 3 112 TRP HD1 4.000 . 4.500 2.071 1.887 2.235 . 0 0 "[ . 1 .]" 1 2108 3 44 PRO HA 3 112 TRP HD1 5.000 . 5.500 3.697 3.488 4.184 . 0 0 "[ . 1 .]" 1 2109 3 111 PHE H 3 112 TRP H 4.000 . 4.500 4.392 4.380 4.403 . 0 0 "[ . 1 .]" 1 2110 3 112 TRP H 3 113 MET H 5.000 . 5.500 4.357 4.331 4.373 . 0 0 "[ . 1 .]" 1 2111 3 112 TRP H 3 112 TRP HE1 5.000 . 5.500 4.227 4.157 4.288 . 0 0 "[ . 1 .]" 1 2112 3 33 GLY H 3 112 TRP HE1 5.000 . 5.500 3.946 3.838 4.015 . 0 0 "[ . 1 .]" 1 2113 3 33 GLY H 3 112 TRP HD1 5.000 . 5.500 4.090 3.985 4.160 . 0 0 "[ . 1 .]" 1 2114 3 112 TRP H 3 112 TRP HD1 3.000 . 3.500 2.611 2.472 2.715 . 0 0 "[ . 1 .]" 1 2115 3 34 LYS H 3 112 TRP HD1 4.000 . 4.500 4.627 4.531 4.704 0.204 8 0 "[ . 1 .]" 1 2116 3 45 ASP H 3 112 TRP HD1 4.000 . 4.500 3.680 3.415 4.102 . 0 0 "[ . 1 .]" 1 2117 3 112 TRP H 3 112 TRP HA 3.000 . 3.500 2.950 2.941 2.955 . 0 0 "[ . 1 .]" 1 2118 3 112 TRP HA 3 113 MET H 3.000 . 3.500 2.193 2.171 2.235 . 0 0 "[ . 1 .]" 1 2119 3 98 TYR H 3 112 TRP HA 4.000 . 4.500 3.197 3.064 3.265 . 0 0 "[ . 1 .]" 1 2120 3 46 LYS H 3 112 TRP HZ2 5.000 . 5.500 5.586 5.517 5.649 0.149 9 0 "[ . 1 .]" 1 2121 3 45 ASP H 3 112 TRP HZ2 6.000 . 6.500 5.132 5.009 5.240 . 0 0 "[ . 1 .]" 1 2122 3 47 ARG H 3 112 TRP HZ2 5.000 . 5.500 4.984 4.811 5.214 . 0 0 "[ . 1 .]" 1 2123 3 112 TRP H 3 112 TRP QB 3.000 . 3.500 3.057 3.031 3.094 . 0 0 "[ . 1 .]" 1 2124 3 112 TRP QB 3 113 MET H 4.000 . 4.500 3.029 2.955 3.070 . 0 0 "[ . 1 .]" 1 2125 3 33 GLY H 3 112 TRP HZ3 5.000 . 5.500 5.271 5.093 5.518 0.018 10 0 "[ . 1 .]" 1 2126 3 35 MET ME 3 112 TRP HA 6.000 . 6.500 5.105 4.856 5.375 . 0 0 "[ . 1 .]" 1 2127 3 35 MET H 3 112 TRP HD1 5.000 . 5.500 4.633 4.352 4.761 . 0 0 "[ . 1 .]" 1 2128 3 35 MET ME 3 112 TRP QB 5.000 . 5.500 3.174 2.840 3.690 . 0 0 "[ . 1 .]" 1 2129 3 32 ALA HA 3 113 MET HA 3.000 . 3.500 2.689 2.275 3.102 . 0 0 "[ . 1 .]" 1 2130 3 32 ALA MB 3 113 MET HA 3.000 . 3.500 2.640 2.343 3.132 . 0 0 "[ . 1 .]" 1 2131 3 113 MET HA 3 113 MET ME 4.000 . 4.500 3.335 3.093 3.694 . 0 0 "[ . 1 .]" 1 2132 3 113 MET H 3 115 GLU H 5.000 . 5.500 5.521 5.224 5.693 0.193 12 0 "[ . 1 .]" 1 2133 3 33 GLY H 3 113 MET HA 4.000 . 4.500 4.037 3.754 4.347 . 0 0 "[ . 1 .]" 1 2134 3 113 MET HA 3 115 GLU H 4.000 . 4.500 3.583 3.470 3.658 . 0 0 "[ . 1 .]" 1 2135 3 113 MET HA 3 114 GLN H 3.000 . 3.500 2.155 2.125 2.185 . 0 0 "[ . 1 .]" 1 2136 3 113 MET H 3 113 MET QG 4.000 . 4.500 3.088 1.910 4.061 . 0 0 "[ . 1 .]" 1 2137 3 113 MET ME 3 125 CYS H 4.000 . 4.500 3.953 3.813 4.093 . 0 0 "[ . 1 .]" 1 2138 3 113 MET ME 3 122 GLU H 5.000 . 5.500 4.975 4.386 5.504 0.004 1 0 "[ . 1 .]" 1 2139 3 113 MET H 3 113 MET ME 4.000 . 4.500 4.324 3.940 4.584 0.084 12 0 "[ . 1 .]" 1 2140 3 113 MET ME 3 124 HIS H 4.000 . 4.500 4.435 4.250 4.564 0.064 2 0 "[ . 1 .]" 1 2141 3 113 MET ME 3 115 GLU H 4.000 . 4.500 4.322 3.828 4.749 0.249 9 0 "[ . 1 .]" 1 2142 3 113 MET ME 3 121 ASP H 5.000 . 5.500 4.571 4.293 5.255 . 0 0 "[ . 1 .]" 1 2143 3 113 MET ME 3 114 GLN H 5.000 . 5.500 4.335 3.907 4.859 . 0 0 "[ . 1 .]" 1 2144 3 113 MET QB 3 115 GLU H 5.000 . 5.500 3.133 2.490 3.858 . 0 0 "[ . 1 .]" 1 2145 3 113 MET QG 3 115 GLU H 5.000 . 5.500 3.237 1.767 4.855 0.033 2 0 "[ . 1 .]" 1 2146 3 32 ALA MB 3 114 GLN QB 5.000 . 5.500 4.246 3.963 4.471 . 0 0 "[ . 1 .]" 1 2147 3 113 MET H 3 114 GLN H 5.000 . 5.500 4.567 4.500 4.598 . 0 0 "[ . 1 .]" 1 2148 3 33 GLY H 3 114 GLN HA 5.000 . 5.500 5.341 5.187 5.514 0.014 1 0 "[ . 1 .]" 1 2149 3 114 GLN HA 3 115 GLU H 4.000 . 4.500 3.310 3.196 3.432 . 0 0 "[ . 1 .]" 1 2150 3 32 ALA H 3 114 GLN HA 6.000 . 6.500 6.592 6.545 6.688 0.188 14 0 "[ . 1 .]" 1 2151 3 114 GLN QB 3 115 GLU H 4.000 . 4.500 3.388 3.097 3.573 . 0 0 "[ . 1 .]" 1 2152 3 114 GLN HA 4 7 PRO HA 5.500 . 6.000 6.157 6.062 6.233 0.233 9 0 "[ . 1 .]" 1 2153 3 114 GLN HA 4 7 PRO QB 4.000 . 4.500 4.090 3.406 4.544 0.044 4 0 "[ . 1 .]" 1 2154 3 114 GLN HA 4 7 PRO QG 4.000 . 4.500 2.584 2.154 3.788 . 0 0 "[ . 1 .]" 1 2155 3 114 GLN HA 4 7 PRO QD 3.000 . 3.500 3.504 3.116 3.729 0.229 9 0 "[ . 1 .]" 1 2156 3 32 ALA H 3 114 GLN QE 5.000 . 5.500 4.911 3.534 5.560 0.060 4 0 "[ . 1 .]" 1 2157 3 31 ARG QD 3 115 GLU HA 4.000 . 4.500 3.617 2.671 4.370 . 0 0 "[ . 1 .]" 1 2158 3 115 GLU HA 3 116 PRO QG 4.000 . 4.500 3.998 3.838 4.062 . 0 0 "[ . 1 .]" 1 2159 3 115 GLU HA 3 116 PRO QD 3.000 . 3.500 2.073 1.960 2.128 . 0 0 "[ . 1 .]" 1 2160 3 115 GLU QB 3 116 PRO QD 4.000 . 4.500 2.526 2.241 2.905 . 0 0 "[ . 1 .]" 1 2161 3 114 GLN H 3 115 GLU H 4.000 . 4.500 2.216 2.001 2.401 . 0 0 "[ . 1 .]" 1 2162 3 115 GLU HA 3 117 LYS H 4.000 . 4.500 4.063 3.809 4.321 . 0 0 "[ . 1 .]" 1 2163 3 31 ARG H 3 115 GLU HA 5.000 . 5.500 5.094 4.307 5.496 . 0 0 "[ . 1 .]" 1 2164 3 115 GLU QB 3 117 LYS H 3.000 . 3.500 2.731 2.636 2.844 . 0 0 "[ . 1 .]" 1 2165 3 115 GLU H 3 115 GLU QB 3.000 . 3.500 2.372 2.327 2.424 . 0 0 "[ . 1 .]" 1 2166 3 114 GLN H 3 115 GLU QB 4.000 . 4.500 4.274 4.066 4.520 0.020 1 0 "[ . 1 .]" 1 2167 3 115 GLU QG 3 117 LYS H 5.000 . 5.500 4.763 4.419 4.917 . 0 0 "[ . 1 .]" 1 2168 3 31 ARG H 3 115 GLU QG 4.000 . 4.500 2.757 2.197 3.655 . 0 0 "[ . 1 .]" 1 2169 3 115 GLU H 3 115 GLU QG 3.000 . 3.500 2.343 2.087 3.264 . 0 0 "[ . 1 .]" 1 2170 3 116 PRO HA 3 116 PRO QG 3.000 . 3.500 3.428 2.927 3.509 0.009 10 0 "[ . 1 .]" 1 2171 3 116 PRO HA 3 116 PRO QD 3.000 . 3.500 3.394 3.336 3.422 . 0 0 "[ . 1 .]" 1 2172 3 116 PRO QB 3 116 PRO QD 3.000 . 3.500 2.808 2.747 2.836 . 0 0 "[ . 1 .]" 1 2173 3 116 PRO QG 3 117 LYS QG 4.000 . 4.500 2.670 2.394 3.995 . 0 0 "[ . 1 .]" 1 2174 3 116 PRO HA 3 117 LYS H 3.000 . 3.500 3.511 3.475 3.541 0.041 12 0 "[ . 1 .]" 1 2175 3 115 GLU H 3 116 PRO HA 5.000 . 5.500 5.604 5.527 5.710 0.210 12 0 "[ . 1 .]" 1 2176 3 116 PRO QG 3 117 LYS H 3.000 . 3.500 2.776 2.542 3.699 0.199 8 0 "[ . 1 .]" 1 2177 3 116 PRO QB 3 117 LYS H 4.000 . 4.500 3.235 2.572 3.441 . 0 0 "[ . 1 .]" 1 2178 3 116 PRO QD 3 117 LYS H 3.000 . 3.500 2.603 2.496 2.769 . 0 0 "[ . 1 .]" 1 2179 3 115 GLU H 3 116 PRO QD 4.000 . 4.500 4.417 4.326 4.452 . 0 0 "[ . 1 .]" 1 2180 3 116 PRO HA 4 7 PRO HA 5.000 . 5.500 4.980 4.527 5.511 0.011 12 0 "[ . 1 .]" 1 2181 3 116 PRO HA 4 7 PRO QB 4.000 . 4.500 3.663 2.698 4.572 0.072 14 0 "[ . 1 .]" 1 2182 3 116 PRO HA 4 7 PRO QG 3.000 . 3.500 2.900 2.004 3.712 0.212 14 0 "[ . 1 .]" 1 2183 3 116 PRO HA 4 7 PRO QD 3.000 . 3.500 2.321 1.916 3.032 . 0 0 "[ . 1 .]" 1 2184 3 117 LYS HA 3 117 LYS QB 2.500 . 3.000 2.341 2.333 2.353 . 0 0 "[ . 1 .]" 1 2185 3 117 LYS HA 3 117 LYS QG 3.000 . 3.500 2.809 2.253 2.970 . 0 0 "[ . 1 .]" 1 2186 3 117 LYS HA 3 117 LYS QD 3.000 . 3.500 2.325 1.982 3.661 0.161 5 0 "[ . 1 .]" 1 2187 3 117 LYS QB 3 117 LYS QD 3.000 . 3.500 2.298 2.145 2.353 . 0 0 "[ . 1 .]" 1 2188 3 117 LYS QB 3 117 LYS QE 4.000 . 4.500 3.367 2.090 3.859 . 0 0 "[ . 1 .]" 1 2189 3 117 LYS QE 3 117 LYS QG 3.000 . 3.500 2.171 2.114 2.310 . 0 0 "[ . 1 .]" 1 2190 3 117 LYS HA 3 117 LYS QE 4.000 . 4.500 4.069 3.897 4.425 . 0 0 "[ . 1 .]" 1 2191 3 117 LYS H 3 120 GLN H 6.000 . 6.500 5.716 5.321 5.964 . 0 0 "[ . 1 .]" 1 2192 3 115 GLU H 3 117 LYS H 5.000 . 5.500 5.514 5.440 5.592 0.092 8 0 "[ . 1 .]" 1 2193 3 117 LYS H 3 119 ASP H 5.000 . 5.500 4.893 4.756 5.039 . 0 0 "[ . 1 .]" 1 2194 3 117 LYS HA 3 118 THR H 3.000 . 3.500 2.196 2.178 2.221 . 0 0 "[ . 1 .]" 1 2195 3 117 LYS H 3 117 LYS HA 3.000 . 3.500 2.957 2.950 2.964 . 0 0 "[ . 1 .]" 1 2196 3 117 LYS HA 3 119 ASP H 3.000 . 3.500 3.661 3.602 3.744 0.244 12 0 "[ . 1 .]" 1 2197 3 117 LYS QG 3 118 THR H 4.000 . 4.500 4.438 4.003 4.574 0.074 6 0 "[ . 1 .]" 1 2198 3 117 LYS H 3 117 LYS QG 2.500 . 3.000 2.669 2.569 2.801 . 0 0 "[ . 1 .]" 1 2199 3 117 LYS QG 3 119 ASP H 4.000 . 4.500 4.498 4.445 4.577 0.077 6 0 "[ . 1 .]" 1 2200 3 117 LYS QB 3 118 THR H 3.000 . 3.500 2.873 2.797 2.957 . 0 0 "[ . 1 .]" 1 2201 3 117 LYS H 3 117 LYS QB 3.000 . 3.500 2.573 2.497 2.613 . 0 0 "[ . 1 .]" 1 2202 3 117 LYS QB 3 119 ASP H 3.000 . 3.500 2.399 2.357 2.461 . 0 0 "[ . 1 .]" 1 2203 3 117 LYS H 3 117 LYS QE 4.000 . 4.500 4.501 4.149 4.614 0.114 13 0 "[ . 1 .]" 1 2204 3 117 LYS QD 3 118 THR H 4.000 . 4.500 3.787 3.574 4.602 0.102 9 0 "[ . 1 .]" 1 2205 3 117 LYS H 3 117 LYS QD 4.000 . 4.500 3.905 3.671 4.678 0.178 2 0 "[ . 1 .]" 1 2206 3 117 LYS QD 3 119 ASP H 4.000 . 4.500 4.310 4.221 4.453 . 0 0 "[ . 1 .]" 1 2207 3 118 THR HA 3 118 THR HB 2.500 . 3.000 2.449 2.424 2.477 . 0 0 "[ . 1 .]" 1 2208 3 118 THR HA 3 118 THR MG 2.500 . 3.000 2.317 2.228 2.380 . 0 0 "[ . 1 .]" 1 2209 3 117 LYS H 3 118 THR H 5.000 . 5.500 4.447 4.425 4.474 . 0 0 "[ . 1 .]" 1 2210 3 118 THR H 3 119 ASP H 4.000 . 4.500 2.451 2.366 2.575 . 0 0 "[ . 1 .]" 1 2211 3 118 THR HA 3 120 GLN H 4.000 . 4.500 3.197 3.148 3.261 . 0 0 "[ . 1 .]" 1 2212 3 118 THR HA 3 119 ASP H 4.000 . 4.500 3.176 3.069 3.281 . 0 0 "[ . 1 .]" 1 2213 3 118 THR HA 3 121 ASP H 4.000 . 4.500 2.651 2.473 2.908 . 0 0 "[ . 1 .]" 1 2214 3 118 THR H 3 118 THR MG 4.000 . 4.500 2.510 2.376 2.595 . 0 0 "[ . 1 .]" 1 2215 3 117 LYS H 3 118 THR MG 5.000 . 5.500 4.818 4.657 4.975 . 0 0 "[ . 1 .]" 1 2216 3 118 THR MG 3 119 ASP H 4.000 . 4.500 4.201 4.142 4.250 . 0 0 "[ . 1 .]" 1 2217 3 118 THR MG 3 121 ASP H 5.000 . 5.500 4.368 4.276 4.527 . 0 0 "[ . 1 .]" 1 2218 3 96 ARG HE 3 118 THR MG 3.000 . 3.500 2.194 1.911 2.978 . 0 0 "[ . 1 .]" 1 2219 3 118 THR H 3 118 THR HB 4.000 . 4.500 3.657 3.620 3.679 . 0 0 "[ . 1 .]" 1 2220 3 118 THR HB 3 120 GLN H 4.000 . 4.500 4.762 4.682 4.820 0.320 5 0 "[ . 1 .]" 1 2221 3 118 THR HB 3 119 ASP H 4.000 . 4.500 4.353 4.252 4.414 . 0 0 "[ . 1 .]" 1 2222 3 118 THR HB 3 121 ASP H 4.000 . 4.500 3.738 3.470 4.044 . 0 0 "[ . 1 .]" 1 2223 3 96 ARG HE 3 118 THR HA 4.000 . 4.500 4.221 3.786 4.539 0.039 7 0 "[ . 1 .]" 1 2224 3 96 ARG HE 3 118 THR HB 5.000 2.800 5.500 4.336 2.718 5.537 0.082 12 0 "[ . 1 .]" 1 2225 3 96 ARG QD 3 118 THR MG 4.000 . 4.500 2.901 1.912 3.445 . 0 0 "[ . 1 .]" 1 2226 3 119 ASP H 3 121 ASP H 4.000 . 4.500 3.894 3.767 4.060 . 0 0 "[ . 1 .]" 1 2227 3 118 THR H 3 119 ASP HA 5.000 . 5.500 4.616 4.563 4.760 . 0 0 "[ . 1 .]" 1 2228 3 119 ASP HA 3 120 GLN H 3.000 . 3.500 3.453 3.436 3.479 . 0 0 "[ . 1 .]" 1 2229 3 119 ASP H 3 119 ASP HA 2.500 . 3.000 2.797 2.773 2.809 . 0 0 "[ . 1 .]" 1 2230 3 119 ASP HA 3 121 ASP H 4.000 . 4.500 4.312 4.105 4.532 0.032 5 0 "[ . 1 .]" 1 2231 3 119 ASP QB 3 120 GLN H 3.000 . 3.500 2.972 2.852 3.011 . 0 0 "[ . 1 .]" 1 2232 3 117 LYS H 3 119 ASP QB 5.000 . 5.500 5.672 5.590 5.743 0.243 9 0 "[ . 1 .]" 1 2233 3 119 ASP H 3 119 ASP QB 2.500 . 3.000 2.273 2.184 2.335 . 0 0 "[ . 1 .]" 1 2234 3 119 ASP QB 3 120 GLN QE 4.000 . 4.500 3.107 1.895 4.553 0.053 12 0 "[ . 1 .]" 1 2235 3 120 GLN HA 3 120 GLN QB 2.500 . 3.000 2.358 2.315 2.396 . 0 0 "[ . 1 .]" 1 2236 3 120 GLN HA 3 120 GLN QG 2.500 . 3.000 2.737 2.307 3.054 0.054 1 0 "[ . 1 .]" 1 2237 3 120 GLN H 3 121 ASP H 3.000 . 3.500 2.009 1.823 2.186 . 0 0 "[ . 1 .]" 1 2238 3 120 GLN H 3 120 GLN QE 5.000 . 5.500 4.389 3.719 5.555 0.055 5 0 "[ . 1 .]" 1 2239 3 120 GLN H 3 120 GLN HA 3.000 . 3.500 2.960 2.949 2.967 . 0 0 "[ . 1 .]" 1 2240 3 120 GLN HA 3 122 GLU H 4.000 . 4.500 4.062 3.845 4.212 . 0 0 "[ . 1 .]" 1 2241 3 120 GLN HA 3 124 HIS H 4.000 . 4.500 4.165 4.040 4.394 . 0 0 "[ . 1 .]" 1 2242 3 120 GLN HA 3 121 ASP H 3.000 . 3.500 3.284 3.094 3.435 . 0 0 "[ . 1 .]" 1 2243 3 120 GLN HA 3 123 GLU H 3.000 . 3.500 3.174 3.019 3.258 . 0 0 "[ . 1 .]" 1 2244 3 120 GLN HA 3 120 GLN QE 4.000 . 4.500 3.615 3.013 4.703 0.203 14 0 "[ . 1 .]" 1 2245 3 120 GLN H 3 120 GLN QB 3.000 . 3.500 2.591 2.542 2.681 . 0 0 "[ . 1 .]" 1 2246 3 120 GLN QB 3 122 GLU H 5.000 . 5.500 5.047 4.910 5.171 . 0 0 "[ . 1 .]" 1 2247 3 120 GLN QB 3 124 HIS H 4.000 . 4.500 3.985 3.634 4.353 . 0 0 "[ . 1 .]" 1 2248 3 119 ASP H 3 120 GLN QB 5.000 . 5.500 4.823 4.706 4.908 . 0 0 "[ . 1 .]" 1 2249 3 120 GLN QB 3 121 ASP H 3.000 . 3.500 3.379 3.049 3.643 0.143 7 0 "[ . 1 .]" 1 2250 3 120 GLN QB 3 123 GLU H 4.000 . 4.500 4.416 4.124 4.618 0.118 10 0 "[ . 1 .]" 1 2251 3 120 GLN H 3 120 GLN QG 3.000 . 3.500 2.807 2.631 3.022 . 0 0 "[ . 1 .]" 1 2252 3 119 ASP H 3 120 GLN QG 4.000 . 4.500 4.323 4.087 4.542 0.042 5 0 "[ . 1 .]" 1 2253 3 120 GLN QG 3 121 ASP H 4.000 . 4.500 4.335 4.173 4.498 . 0 0 "[ . 1 .]" 1 2254 3 121 ASP H 3 123 GLU H 4.000 . 4.500 4.068 3.860 4.210 . 0 0 "[ . 1 .]" 1 2255 3 121 ASP HA 3 122 GLU H 4.000 . 4.500 3.542 3.528 3.555 . 0 0 "[ . 1 .]" 1 2256 3 121 ASP HA 3 124 HIS H 4.000 . 4.500 3.644 3.470 3.817 . 0 0 "[ . 1 .]" 1 2257 3 121 ASP H 3 121 ASP HA 3.000 . 3.500 2.816 2.808 2.829 . 0 0 "[ . 1 .]" 1 2258 3 121 ASP HA 3 123 GLU H 4.000 . 4.500 4.433 4.319 4.510 0.010 4 0 "[ . 1 .]" 1 2259 3 121 ASP QB 3 122 GLU H 3.000 . 3.500 2.515 2.338 3.367 . 0 0 "[ . 1 .]" 1 2260 3 121 ASP H 3 121 ASP QB 2.500 . 3.000 2.268 2.164 2.357 . 0 0 "[ . 1 .]" 1 2261 3 122 GLU HA 3 122 GLU QB 2.500 . 3.000 2.306 2.167 2.401 . 0 0 "[ . 1 .]" 1 2262 3 122 GLU HA 3 122 GLU QG 3.000 . 3.500 2.699 2.289 3.309 . 0 0 "[ . 1 .]" 1 2263 3 122 GLU HA 3 125 CYS QB 3.000 . 3.500 2.457 2.323 2.650 . 0 0 "[ . 1 .]" 1 2264 3 122 GLU QB 3 125 CYS QB 4.000 . 4.500 3.927 3.767 4.132 . 0 0 "[ . 1 .]" 1 2265 3 120 GLN H 3 122 GLU H 4.000 . 4.500 4.346 3.916 4.629 0.129 4 0 "[ . 1 .]" 1 2266 3 122 GLU H 3 125 CYS H 5.000 . 5.500 4.695 4.629 4.816 . 0 0 "[ . 1 .]" 1 2267 3 122 GLU H 3 124 HIS H 4.000 . 4.500 4.196 4.110 4.343 . 0 0 "[ . 1 .]" 1 2268 3 121 ASP H 3 122 GLU H 3.000 . 3.500 2.685 2.642 2.761 . 0 0 "[ . 1 .]" 1 2269 3 122 GLU H 3 123 GLU H 3.000 . 3.500 2.616 2.508 2.691 . 0 0 "[ . 1 .]" 1 2270 3 122 GLU HA 3 125 CYS H 3.000 . 3.500 3.441 3.365 3.507 0.007 6 0 "[ . 1 .]" 1 2271 3 122 GLU H 3 122 GLU HA 3.000 . 3.500 2.835 2.812 2.856 . 0 0 "[ . 1 .]" 1 2272 3 122 GLU HA 3 124 HIS H 4.000 . 4.500 4.461 4.411 4.510 0.010 14 0 "[ . 1 .]" 1 2273 3 122 GLU HA 3 126 ARG H 5.000 . 5.500 4.012 3.809 4.315 . 0 0 "[ . 1 .]" 1 2274 3 121 ASP H 3 122 GLU HA 5.000 . 5.500 5.297 5.263 5.355 . 0 0 "[ . 1 .]" 1 2275 3 122 GLU HA 3 123 GLU H 3.000 . 3.500 3.517 3.493 3.533 0.033 11 0 "[ . 1 .]" 1 2276 3 122 GLU QB 3 125 CYS H 4.000 . 4.500 4.825 4.761 4.898 0.398 14 0 "[ . 1 .]" 1 2277 3 122 GLU H 3 122 GLU QB 2.500 . 3.000 2.356 2.307 2.413 . 0 0 "[ . 1 .]" 1 2278 3 122 GLU QB 3 124 HIS H 5.000 . 5.500 4.899 4.638 5.270 . 0 0 "[ . 1 .]" 1 2279 3 121 ASP H 3 122 GLU QB 4.000 . 4.500 4.668 4.577 4.792 0.292 7 0 "[ . 1 .]" 1 2280 3 122 GLU QB 3 123 GLU H 3.000 . 3.500 2.915 2.518 3.493 . 0 0 "[ . 1 .]" 1 2281 3 122 GLU H 3 122 GLU QG 3.000 . 3.500 2.183 2.062 2.264 . 0 0 "[ . 1 .]" 1 2282 3 122 GLU QG 3 124 HIS H 5.000 . 5.500 5.133 4.268 5.666 0.166 10 0 "[ . 1 .]" 1 2283 3 121 ASP H 3 122 GLU QG 4.000 . 4.500 4.198 3.861 4.471 . 0 0 "[ . 1 .]" 1 2284 3 122 GLU QG 3 123 GLU H 4.000 . 4.500 3.310 2.079 4.131 . 0 0 "[ . 1 .]" 1 2285 3 123 GLU HA 3 123 GLU QB 2.500 . 3.000 2.362 2.342 2.494 . 0 0 "[ . 1 .]" 1 2286 3 123 GLU HA 3 123 GLU QG 3.000 . 3.500 2.323 2.177 2.344 . 0 0 "[ . 1 .]" 1 2287 3 123 GLU HA 3 125 CYS H 4.000 . 4.500 4.351 4.272 4.418 . 0 0 "[ . 1 .]" 1 2288 3 123 GLU HA 3 127 LYS H 4.000 . 4.500 3.939 3.818 4.123 . 0 0 "[ . 1 .]" 1 2289 3 123 GLU HA 3 124 HIS H 4.000 . 4.500 3.545 3.524 3.557 . 0 0 "[ . 1 .]" 1 2290 3 123 GLU HA 3 126 ARG H 3.000 . 3.500 3.351 3.243 3.456 . 0 0 "[ . 1 .]" 1 2291 3 123 GLU H 3 123 GLU HA 2.500 . 3.000 2.810 2.801 2.827 . 0 0 "[ . 1 .]" 1 2292 3 123 GLU QB 3 125 CYS H 5.000 . 5.500 4.549 4.496 4.590 . 0 0 "[ . 1 .]" 1 2293 3 122 GLU H 3 123 GLU QB 4.000 . 4.500 4.312 4.183 4.395 . 0 0 "[ . 1 .]" 1 2294 3 123 GLU QB 3 124 HIS H 3.000 . 3.500 2.457 2.377 2.513 . 0 0 "[ . 1 .]" 1 2295 3 123 GLU QB 3 126 ARG H 4.000 . 4.500 4.855 4.797 4.894 0.394 1 0 "[ . 1 .]" 1 2296 3 123 GLU H 3 123 GLU QB 2.500 . 3.000 2.196 2.099 2.215 . 0 0 "[ . 1 .]" 1 2297 3 123 GLU QG 3 124 HIS H 4.000 . 4.500 3.552 3.445 4.107 . 0 0 "[ . 1 .]" 1 2298 3 123 GLU H 3 123 GLU QG 3.000 . 3.500 3.880 3.733 3.899 0.399 1 0 "[ . 1 .]" 1 2299 3 123 GLU QG 3 127 LYS QE 3.000 . 3.500 2.579 1.964 3.584 0.084 8 0 "[ . 1 .]" 1 2300 3 123 GLU QG 3 127 LYS HA 5.000 . 5.500 5.190 5.043 5.466 . 0 0 "[ . 1 .]" 1 2301 3 28 VAL HA 3 124 HIS HD2 5.000 . 5.500 5.681 5.630 5.735 0.235 10 0 "[ . 1 .]" 1 2302 3 123 GLU QB 3 124 HIS HD2 4.000 . 4.500 2.983 2.731 3.091 . 0 0 "[ . 1 .]" 1 2303 3 124 HIS HA 3 124 HIS HD2 4.000 . 4.500 2.147 2.107 2.220 . 0 0 "[ . 1 .]" 1 2304 3 124 HIS HD2 3 127 LYS QB 4.000 . 4.500 3.770 3.612 3.900 . 0 0 "[ . 1 .]" 1 2305 3 124 HIS HD2 3 127 LYS QG 5.000 . 5.500 4.378 4.115 4.650 . 0 0 "[ . 1 .]" 1 2306 3 28 VAL QG 3 124 HIS HD2 4.000 . 4.500 3.411 3.263 3.553 . 0 0 "[ . 1 .]" 1 2307 3 30 PHE HA 3 124 HIS HE1 5.000 . 5.500 4.330 4.049 4.580 . 0 0 "[ . 1 .]" 1 2308 3 30 PHE QB 3 124 HIS HE1 4.000 . 4.500 3.061 2.688 3.401 . 0 0 "[ . 1 .]" 1 2309 3 115 GLU QB 3 124 HIS HE1 5.000 . 5.500 5.043 4.570 5.526 0.026 2 0 "[ . 1 .]" 1 2310 3 115 GLU QG 3 124 HIS HE1 4.000 . 4.500 4.274 3.701 4.616 0.116 14 0 "[ . 1 .]" 1 2311 3 120 GLN QB 3 124 HIS HE1 4.000 . 4.500 2.689 2.532 3.057 . 0 0 "[ . 1 .]" 1 2312 3 120 GLN QG 3 124 HIS HE1 4.000 . 4.500 4.232 3.779 4.561 0.061 5 0 "[ . 1 .]" 1 2313 3 28 VAL QG 3 124 HIS HE1 5.000 . 5.500 5.363 5.145 5.522 0.022 12 0 "[ . 1 .]" 1 2314 3 124 HIS H 3 126 ARG H 4.000 . 4.500 4.023 3.984 4.072 . 0 0 "[ . 1 .]" 1 2315 3 121 ASP H 3 124 HIS H 5.000 . 5.500 4.777 4.697 4.923 . 0 0 "[ . 1 .]" 1 2316 3 123 GLU H 3 124 HIS H 3.000 . 3.500 2.639 2.577 2.676 . 0 0 "[ . 1 .]" 1 2317 3 124 HIS HA 3 125 CYS H 4.000 . 4.500 3.490 3.480 3.499 . 0 0 "[ . 1 .]" 1 2318 3 124 HIS HA 3 127 LYS H 4.000 . 4.500 3.426 3.338 3.501 . 0 0 "[ . 1 .]" 1 2319 3 124 HIS H 3 124 HIS HA 3.000 . 3.500 2.818 2.805 2.832 . 0 0 "[ . 1 .]" 1 2320 3 124 HIS HA 3 126 ARG H 4.000 . 4.500 4.413 4.347 4.456 . 0 0 "[ . 1 .]" 1 2321 3 124 HIS HD2 3 125 CYS H 4.000 . 4.500 4.761 4.737 4.775 0.275 3 0 "[ . 1 .]" 1 2322 3 124 HIS H 3 124 HIS HD2 6.000 . 6.500 2.817 2.750 2.884 . 0 0 "[ . 1 .]" 1 2323 3 124 HIS HD2 3 126 ARG H 5.000 . 5.500 5.793 5.721 5.836 0.336 2 0 "[ . 1 .]" 1 2324 3 113 MET ME 3 125 CYS HA 4.000 . 4.500 4.580 4.332 4.682 0.182 14 0 "[ . 1 .]" 1 2325 3 125 CYS HA 3 128 VAL HB 4.000 . 4.500 2.866 2.779 2.964 . 0 0 "[ . 1 .]" 1 2326 3 125 CYS HA 3 128 VAL QG 4.000 . 4.500 2.631 2.215 3.080 . 0 0 "[ . 1 .]" 1 2327 3 125 CYS H 3 128 VAL H 4.000 . 4.500 4.606 4.527 4.663 0.163 9 0 "[ . 1 .]" 1 2328 3 125 CYS H 3 127 LYS H 4.000 . 4.500 4.051 3.935 4.088 . 0 0 "[ . 1 .]" 1 2329 3 124 HIS H 3 125 CYS H 3.000 . 3.500 2.526 2.496 2.577 . 0 0 "[ . 1 .]" 1 2330 3 125 CYS H 3 126 ARG H 3.000 . 3.500 2.630 2.603 2.653 . 0 0 "[ . 1 .]" 1 2331 3 125 CYS HA 3 129 ASN H 4.000 . 4.500 4.431 4.270 4.527 0.027 5 0 "[ . 1 .]" 1 2332 3 125 CYS H 3 125 CYS HA 3.000 . 3.500 2.813 2.806 2.826 . 0 0 "[ . 1 .]" 1 2333 3 125 CYS HA 3 128 VAL H 4.000 . 4.500 3.539 3.422 3.719 . 0 0 "[ . 1 .]" 1 2334 3 125 CYS HA 3 127 LYS H 4.000 . 4.500 4.522 4.373 4.578 0.078 1 0 "[ . 1 .]" 1 2335 3 125 CYS HA 3 126 ARG H 4.000 . 4.500 3.553 3.544 3.566 . 0 0 "[ . 1 .]" 1 2336 3 125 CYS HA 3 129 ASN QD 5.000 . 5.500 4.114 3.677 4.347 . 0 0 "[ . 1 .]" 1 2337 3 125 CYS H 3 125 CYS QB 2.500 . 3.000 2.240 2.217 2.312 . 0 0 "[ . 1 .]" 1 2338 3 122 GLU H 3 125 CYS QB 5.000 . 5.500 4.659 4.524 4.820 . 0 0 "[ . 1 .]" 1 2339 3 124 HIS H 3 125 CYS QB 4.000 . 4.500 4.266 4.203 4.407 . 0 0 "[ . 1 .]" 1 2340 3 125 CYS QB 3 126 ARG H 4.000 . 4.500 2.453 2.389 2.536 . 0 0 "[ . 1 .]" 1 2341 3 123 GLU H 3 125 CYS QB 4.000 . 4.500 4.633 4.550 4.724 0.224 12 0 "[ . 1 .]" 1 2342 3 126 ARG HA 3 126 ARG QB 2.500 . 3.000 2.372 2.352 2.411 . 0 0 "[ . 1 .]" 1 2343 3 126 ARG HA 3 126 ARG QG 3.000 . 3.500 2.383 2.239 2.935 . 0 0 "[ . 1 .]" 1 2344 3 126 ARG HA 3 126 ARG QD 3.500 . 4.000 3.682 1.995 4.129 0.129 9 0 "[ . 1 .]" 1 2345 3 126 ARG QB 3 126 ARG QD 2.500 . 3.000 2.234 2.114 2.650 . 0 0 "[ . 1 .]" 1 2346 3 126 ARG H 3 129 ASN H 5.000 . 5.500 5.047 4.914 5.177 . 0 0 "[ . 1 .]" 1 2347 3 123 GLU H 3 126 ARG H 4.000 . 4.500 4.545 4.502 4.633 0.133 5 0 "[ . 1 .]" 1 2348 3 126 ARG HA 3 129 ASN H 4.000 . 4.500 3.667 3.594 3.771 . 0 0 "[ . 1 .]" 1 2349 3 125 CYS H 3 126 ARG HA 5.000 . 5.500 5.255 5.235 5.277 . 0 0 "[ . 1 .]" 1 2350 3 126 ARG HA 3 128 VAL H 4.000 . 4.500 4.369 4.296 4.523 0.023 1 0 "[ . 1 .]" 1 2351 3 126 ARG HA 3 127 LYS H 4.000 . 4.500 3.522 3.494 3.543 . 0 0 "[ . 1 .]" 1 2352 3 126 ARG HA 3 130 GLU H 4.000 . 4.500 4.087 3.935 4.318 . 0 0 "[ . 1 .]" 1 2353 3 126 ARG HA 3 129 ASN QD 4.000 . 4.500 2.226 1.905 2.922 . 0 0 "[ . 1 .]" 1 2354 3 125 CYS H 3 126 ARG QG 6.000 . 6.500 5.883 4.373 6.274 . 0 0 "[ . 1 .]" 1 2355 3 126 ARG QG 3 127 LYS H 4.000 . 4.500 3.682 3.521 4.149 . 0 0 "[ . 1 .]" 1 2356 3 126 ARG H 3 126 ARG QG 3.500 . 4.000 3.643 2.320 4.038 0.038 14 0 "[ . 1 .]" 1 2357 3 126 ARG QB 3 127 LYS H 2.500 . 3.000 2.545 2.476 2.705 . 0 0 "[ . 1 .]" 1 2358 3 126 ARG H 3 126 ARG QB 2.500 . 3.000 2.284 2.251 2.350 . 0 0 "[ . 1 .]" 1 2359 3 126 ARG QD 3 127 LYS H 5.000 . 5.500 4.766 4.535 5.274 . 0 0 "[ . 1 .]" 1 2360 3 126 ARG H 3 126 ARG QD 4.000 . 4.500 4.391 3.852 4.639 0.139 3 0 "[ . 1 .]" 1 2361 3 127 LYS HA 3 127 LYS QG 3.000 . 3.500 2.233 2.063 2.419 . 0 0 "[ . 1 .]" 1 2362 3 127 LYS HA 3 127 LYS QD 3.500 . 4.000 2.983 2.146 4.076 0.076 8 0 "[ . 1 .]" 1 2363 3 127 LYS HA 3 130 GLU QB 3.000 . 3.500 2.309 2.035 3.070 . 0 0 "[ . 1 .]" 1 2364 3 127 LYS HA 3 130 GLU QG 3.000 . 3.500 3.162 2.283 3.620 0.120 3 0 "[ . 1 .]" 1 2365 3 126 ARG QG 3 127 LYS QB 5.000 . 5.500 5.008 4.747 5.772 0.272 6 0 "[ . 1 .]" 1 2366 3 127 LYS QB 3 127 LYS QD 3.000 . 3.500 2.217 2.093 2.377 . 0 0 "[ . 1 .]" 1 2367 3 127 LYS QE 3 127 LYS QG 3.000 . 3.500 2.186 2.116 2.676 . 0 0 "[ . 1 .]" 1 2368 3 127 LYS HA 3 127 LYS QE 4.000 . 4.500 3.993 2.914 4.635 0.135 6 0 "[ . 1 .]" 1 2369 3 127 LYS QB 3 127 LYS QE 3.000 . 3.500 3.477 2.027 3.666 0.166 2 0 "[ . 1 .]" 1 2370 3 127 LYS H 3 130 GLU H 4.000 . 4.500 4.595 4.549 4.659 0.159 10 0 "[ . 1 .]" 1 2371 3 126 ARG H 3 127 LYS H 3.000 . 3.500 2.603 2.550 2.656 . 0 0 "[ . 1 .]" 1 2372 3 127 LYS HA 3 132 LEU H 6.000 . 6.500 6.003 5.789 6.251 . 0 0 "[ . 1 .]" 1 2373 3 127 LYS HA 3 131 TYR H 4.000 . 4.500 3.755 3.497 4.090 . 0 0 "[ . 1 .]" 1 2374 3 127 LYS HA 3 129 ASN H 4.000 . 4.500 4.523 4.452 4.557 0.057 4 0 "[ . 1 .]" 1 2375 3 127 LYS HA 3 128 VAL H 4.000 . 4.500 3.541 3.521 3.566 . 0 0 "[ . 1 .]" 1 2376 3 127 LYS H 3 127 LYS HA 3.000 . 3.500 2.816 2.804 2.845 . 0 0 "[ . 1 .]" 1 2377 3 127 LYS HA 3 130 GLU H 3.000 . 3.500 3.343 3.248 3.443 . 0 0 "[ . 1 .]" 1 2378 3 126 ARG H 3 127 LYS HA 5.000 . 5.500 5.233 5.185 5.278 . 0 0 "[ . 1 .]" 1 2379 3 125 CYS H 3 127 LYS QB 5.000 . 5.500 4.764 4.671 4.872 . 0 0 "[ . 1 .]" 1 2380 3 127 LYS QB 3 128 VAL H 3.000 . 3.500 2.705 2.547 2.883 . 0 0 "[ . 1 .]" 1 2381 3 127 LYS H 3 127 LYS QB 2.500 . 3.000 2.168 2.058 2.304 . 0 0 "[ . 1 .]" 1 2382 3 126 ARG H 3 127 LYS QB 4.000 . 4.500 4.353 4.236 4.500 . 0 0 "[ . 1 .]" 1 2383 3 127 LYS QG 3 128 VAL H 4.000 . 4.500 4.405 4.151 4.599 0.099 2 0 "[ . 1 .]" 1 2384 3 127 LYS H 3 127 LYS QG 3.500 . 4.000 3.113 2.281 3.693 . 0 0 "[ . 1 .]" 1 2385 3 127 LYS QG 3 130 GLU H 6.000 . 6.500 5.194 5.081 5.383 . 0 0 "[ . 1 .]" 1 2386 3 127 LYS QD 3 128 VAL H 4.000 . 4.500 4.503 4.286 4.728 0.228 3 0 "[ . 1 .]" 1 2387 3 127 LYS H 3 127 LYS QD 3.000 . 3.500 2.877 2.250 3.673 0.173 9 0 "[ . 1 .]" 1 2388 3 127 LYS QE 3 128 VAL H 6.000 . 6.500 6.072 5.037 6.237 . 0 0 "[ . 1 .]" 1 2389 3 127 LYS H 3 127 LYS QE 4.000 . 4.500 4.429 4.075 4.609 0.109 8 0 "[ . 1 .]" 1 2390 3 53 ILE MG 3 128 VAL HA 4.000 . 4.500 4.600 4.550 4.650 0.150 2 0 "[ . 1 .]" 1 2391 3 53 ILE MD 3 128 VAL HA 3.000 . 3.500 2.057 1.955 2.197 . 0 0 "[ . 1 .]" 1 2392 3 128 VAL HA 3 128 VAL QG 3.000 . 3.500 2.074 2.039 2.093 . 0 0 "[ . 1 .]" 1 2393 3 28 VAL QG 3 128 VAL HA 4.000 . 4.500 2.760 2.653 2.898 . 0 0 "[ . 1 .]" 1 2394 3 53 ILE MG 3 128 VAL QG 4.000 . 4.500 4.452 4.315 4.542 0.042 5 0 "[ . 1 .]" 1 2395 3 53 ILE MD 3 128 VAL QG 3.000 . 3.500 2.132 1.958 2.222 . 0 0 "[ . 1 .]" 1 2396 3 128 VAL QG 3 132 LEU HG 4.000 . 4.500 3.209 2.732 3.413 . 0 0 "[ . 1 .]" 1 2397 3 128 VAL QG 3 132 LEU QD 3.000 . 3.500 1.840 1.750 1.907 0.050 1 0 "[ . 1 .]" 1 2398 3 127 LYS H 3 128 VAL H 3.000 . 3.500 2.646 2.547 2.697 . 0 0 "[ . 1 .]" 1 2399 3 128 VAL H 3 130 GLU H 4.000 . 4.500 3.958 3.887 4.080 . 0 0 "[ . 1 .]" 1 2400 3 126 ARG H 3 128 VAL H 4.000 . 4.500 4.054 4.006 4.124 . 0 0 "[ . 1 .]" 1 2401 3 128 VAL HA 3 132 LEU H 4.000 . 4.500 4.203 4.030 4.322 . 0 0 "[ . 1 .]" 1 2402 3 128 VAL HA 3 131 TYR H 4.000 . 4.500 3.725 3.386 3.902 . 0 0 "[ . 1 .]" 1 2403 3 128 VAL HA 3 129 ASN H 4.000 . 4.500 3.591 3.569 3.605 . 0 0 "[ . 1 .]" 1 2404 3 128 VAL H 3 128 VAL HA 3.000 . 3.500 2.803 2.795 2.811 . 0 0 "[ . 1 .]" 1 2405 3 127 LYS H 3 128 VAL HA 5.000 . 5.500 5.244 5.161 5.285 . 0 0 "[ . 1 .]" 1 2406 3 128 VAL HA 3 130 GLU H 5.000 . 5.500 4.457 4.395 4.559 . 0 0 "[ . 1 .]" 1 2407 3 128 VAL HB 3 132 LEU H 6.000 . 6.500 5.932 5.731 6.020 . 0 0 "[ . 1 .]" 1 2408 3 128 VAL HB 3 129 ASN H 3.000 . 3.500 2.464 2.403 2.515 . 0 0 "[ . 1 .]" 1 2409 3 128 VAL H 3 128 VAL HB 4.000 . 4.500 2.409 2.368 2.447 . 0 0 "[ . 1 .]" 1 2410 3 128 VAL HB 3 130 GLU H 4.000 . 4.500 4.697 4.601 4.847 0.347 1 0 "[ . 1 .]" 1 2411 3 128 VAL QG 3 132 LEU H 4.000 . 4.500 4.185 3.933 4.296 . 0 0 "[ . 1 .]" 1 2412 3 128 VAL QG 3 131 TYR H 5.000 . 5.500 4.442 4.186 4.583 . 0 0 "[ . 1 .]" 1 2413 3 128 VAL QG 3 129 ASN H 3.000 . 3.500 3.001 2.980 3.046 . 0 0 "[ . 1 .]" 1 2414 3 128 VAL H 3 128 VAL QG 3.000 . 3.500 2.299 2.242 2.385 . 0 0 "[ . 1 .]" 1 2415 3 128 VAL QG 3 133 ASN H 5.000 . 5.500 5.596 5.408 5.697 0.197 14 0 "[ . 1 .]" 1 2416 3 127 LYS H 3 128 VAL QG 4.000 . 4.500 4.177 4.106 4.216 . 0 0 "[ . 1 .]" 1 2417 3 128 VAL QG 3 130 GLU H 4.000 . 4.500 4.440 4.379 4.519 0.019 9 0 "[ . 1 .]" 1 2418 3 128 VAL QG 3 129 ASN QD 4.000 . 4.500 3.905 3.704 4.057 . 0 0 "[ . 1 .]" 1 2419 3 129 ASN HA 3 129 ASN QB 2.500 . 3.000 2.254 2.166 2.421 . 0 0 "[ . 1 .]" 1 2420 3 128 VAL QG 3 129 ASN HA 4.000 . 4.500 3.182 3.137 3.270 . 0 0 "[ . 1 .]" 1 2421 3 126 ARG HA 3 129 ASN QB 4.000 . 4.500 4.045 2.944 4.662 0.162 5 0 "[ . 1 .]" 1 2422 3 129 ASN QB 3 130 GLU HA 4.000 . 4.500 4.053 3.786 4.216 . 0 0 "[ . 1 .]" 1 2423 3 128 VAL H 3 129 ASN H 3.000 . 3.500 2.830 2.771 2.866 . 0 0 "[ . 1 .]" 1 2424 3 127 LYS H 3 129 ASN H 5.000 . 5.500 4.385 4.262 4.475 . 0 0 "[ . 1 .]" 1 2425 3 129 ASN H 3 130 GLU H 3.000 . 3.500 2.447 2.335 2.642 . 0 0 "[ . 1 .]" 1 2426 3 86 PHE H 3 129 ASN H 5.000 . 5.500 5.060 4.715 5.447 . 0 0 "[ . 1 .]" 1 2427 3 129 ASN H 3 129 ASN QD 3.000 . 3.500 2.752 2.507 2.884 . 0 0 "[ . 1 .]" 1 2428 3 129 ASN HA 3 132 LEU H 4.000 . 4.500 3.339 3.144 3.518 . 0 0 "[ . 1 .]" 1 2429 3 129 ASN HA 3 131 TYR H 4.500 . 5.000 4.183 3.955 4.371 . 0 0 "[ . 1 .]" 1 2430 3 129 ASN H 3 129 ASN HA 3.000 . 3.500 2.878 2.824 2.910 . 0 0 "[ . 1 .]" 1 2431 3 128 VAL H 3 129 ASN HA 5.000 . 5.500 5.396 5.362 5.427 . 0 0 "[ . 1 .]" 1 2432 3 129 ASN HA 3 133 ASN H 4.000 . 4.500 3.750 3.588 3.973 . 0 0 "[ . 1 .]" 1 2433 3 129 ASN HA 3 130 GLU H 3.000 . 3.500 3.475 3.438 3.532 0.032 13 0 "[ . 1 .]" 1 2434 3 129 ASN HA 3 134 ASN H 5.000 . 5.500 5.436 5.167 5.554 0.054 13 0 "[ . 1 .]" 1 2435 3 86 PHE H 3 129 ASN HA 4.000 . 4.500 3.605 3.335 3.761 . 0 0 "[ . 1 .]" 1 2436 3 129 ASN HA 3 133 ASN QD 4.000 . 4.500 2.713 2.340 3.542 . 0 0 "[ . 1 .]" 1 2437 3 129 ASN HA 3 129 ASN QD 4.000 . 4.500 3.952 3.654 4.116 . 0 0 "[ . 1 .]" 1 2438 3 129 ASN H 3 129 ASN QB 2.500 . 3.000 2.650 2.331 2.822 . 0 0 "[ . 1 .]" 1 2439 3 129 ASN QB 3 130 GLU H 3.000 . 3.500 3.190 2.581 3.522 0.022 6 0 "[ . 1 .]" 1 2440 3 127 LYS H 3 129 ASN QD 6.000 . 6.500 4.930 4.778 5.198 . 0 0 "[ . 1 .]" 1 2441 3 129 ASN HA 3 130 GLU HA 4.000 . 4.500 4.698 4.660 4.728 0.228 3 0 "[ . 1 .]" 1 2442 3 130 GLU HA 3 130 GLU QB 2.500 . 3.000 2.206 2.149 2.280 . 0 0 "[ . 1 .]" 1 2443 3 130 GLU HA 3 130 GLU QG 3.000 . 3.500 2.751 2.423 3.201 . 0 0 "[ . 1 .]" 1 2444 3 130 GLU HA 3 134 ASN QB 4.000 . 4.500 2.847 2.341 3.309 . 0 0 "[ . 1 .]" 1 2445 3 129 ASN QB 3 130 GLU QB 4.000 . 4.500 4.358 3.795 4.686 0.186 12 0 "[ . 1 .]" 1 2446 3 130 GLU QG 3 134 ASN QB 3.500 . 4.000 2.636 2.098 3.492 . 0 0 "[ . 1 .]" 1 2447 3 130 GLU H 3 133 ASN H 4.000 . 4.500 4.563 4.513 4.713 0.213 1 0 "[ . 1 .]" 1 2448 3 129 ASN QD 3 130 GLU H 4.000 . 4.500 4.067 3.842 4.368 . 0 0 "[ . 1 .]" 1 2449 3 130 GLU HA 3 132 LEU H 4.000 . 4.500 4.372 4.066 4.559 0.059 3 0 "[ . 1 .]" 1 2450 3 130 GLU HA 3 131 TYR H 4.000 . 4.500 3.509 3.435 3.547 . 0 0 "[ . 1 .]" 1 2451 3 130 GLU HA 3 133 ASN H 4.000 . 4.500 3.558 3.417 3.700 . 0 0 "[ . 1 .]" 1 2452 3 130 GLU H 3 130 GLU HA 3.000 . 3.500 2.833 2.804 2.866 . 0 0 "[ . 1 .]" 1 2453 3 130 GLU HA 3 134 ASN H 4.000 . 4.500 3.248 3.096 3.391 . 0 0 "[ . 1 .]" 1 2454 3 130 GLU HA 3 133 ASN QD 5.000 . 5.500 3.810 2.550 4.021 . 0 0 "[ . 1 .]" 1 2455 3 130 GLU HA 3 134 ASN QD 4.000 . 4.500 3.620 2.695 4.639 0.139 9 0 "[ . 1 .]" 1 2456 3 130 GLU QB 3 132 LEU H 4.500 . 5.000 4.842 4.712 5.107 0.107 9 0 "[ . 1 .]" 1 2457 3 130 GLU QB 3 131 TYR H 3.000 . 3.500 3.023 2.669 3.590 0.090 1 0 "[ . 1 .]" 1 2458 3 129 ASN H 3 130 GLU QB 4.000 . 4.500 4.182 4.017 4.537 0.037 1 0 "[ . 1 .]" 1 2459 3 130 GLU QB 3 133 ASN H 4.500 . 5.000 5.022 4.950 5.076 0.076 5 0 "[ . 1 .]" 1 2460 3 130 GLU H 3 130 GLU QB 2.500 . 3.000 2.137 2.081 2.216 . 0 0 "[ . 1 .]" 1 2461 3 130 GLU QB 3 134 ASN H 4.000 . 4.500 4.736 4.525 4.869 0.369 8 0 "[ . 1 .]" 1 2462 3 130 GLU QB 3 133 ASN QD 5.000 . 5.500 4.992 3.816 5.198 . 0 0 "[ . 1 .]" 1 2463 3 129 ASN QD 3 130 GLU QB 6.000 . 6.500 4.975 4.615 5.572 . 0 0 "[ . 1 .]" 1 2464 3 130 GLU QG 3 131 TYR H 4.000 . 4.500 2.913 2.314 3.324 . 0 0 "[ . 1 .]" 1 2465 3 129 ASN H 3 130 GLU QG 5.000 . 5.500 5.556 4.827 5.852 0.352 3 0 "[ . 1 .]" 1 2466 3 130 GLU H 3 130 GLU QG 3.000 . 3.500 3.538 2.832 3.841 0.341 3 0 "[ . 1 .]" 1 2467 3 130 GLU QG 3 131 TYR HA 4.000 . 4.500 3.137 3.033 3.301 . 0 0 "[ . 1 .]" 1 2468 3 53 ILE MG 3 131 TYR HA 5.000 . 5.500 4.721 4.398 5.111 . 0 0 "[ . 1 .]" 1 2469 3 53 ILE MD 3 131 TYR HA 5.000 . 5.500 4.732 4.423 4.960 . 0 0 "[ . 1 .]" 1 2470 3 27 LEU QD 3 131 TYR HA 5.000 . 5.500 3.390 3.107 3.942 . 0 0 "[ . 1 .]" 1 2471 3 53 ILE MG 3 131 TYR QB 4.000 . 4.500 2.446 2.226 2.800 . 0 0 "[ . 1 .]" 1 2472 3 53 ILE MD 3 131 TYR QB 4.000 . 4.500 2.265 2.015 2.447 . 0 0 "[ . 1 .]" 1 2473 3 27 LEU QD 3 131 TYR QB 4.000 . 4.500 2.073 1.998 2.376 . 0 0 "[ . 1 .]" 1 2474 3 127 LYS QB 3 131 TYR QD 4.000 . 4.500 2.626 2.243 3.368 . 0 0 "[ . 1 .]" 1 2475 3 127 LYS QG 3 131 TYR QD 5.000 . 5.500 3.834 3.444 4.281 . 0 0 "[ . 1 .]" 1 2476 3 127 LYS QD 3 131 TYR QD 6.000 . 6.500 4.864 4.142 5.437 . 0 0 "[ . 1 .]" 1 2477 3 127 LYS QE 3 131 TYR QD 6.000 . 6.500 5.491 3.705 6.352 . 0 0 "[ . 1 .]" 1 2478 3 128 VAL HA 3 131 TYR QD 5.000 . 5.500 3.371 2.784 4.211 . 0 0 "[ . 1 .]" 1 2479 3 130 GLU QG 3 131 TYR QD 5.000 . 5.500 2.989 1.950 3.491 . 0 0 "[ . 1 .]" 1 2480 3 131 TYR HA 3 131 TYR QD 3.000 . 3.500 1.998 1.892 2.098 . 0 0 "[ . 1 .]" 1 2481 3 131 TYR QD 3 135 PRO HA 4.500 . 5.000 3.194 2.672 3.935 . 0 0 "[ . 1 .]" 1 2482 3 131 TYR QD 3 136 PRO QD 4.500 . 5.000 2.751 1.940 4.117 . 0 0 "[ . 1 .]" 1 2483 3 131 TYR QD 3 132 LEU QD 6.000 . 6.500 4.852 4.662 5.032 . 0 0 "[ . 1 .]" 1 2484 3 27 LEU QD 3 131 TYR QD 4.000 . 4.500 2.634 2.429 3.294 . 0 0 "[ . 1 .]" 1 2485 3 28 VAL QG 3 131 TYR QD 3.000 . 3.500 3.018 2.791 3.306 . 0 0 "[ . 1 .]" 1 2486 3 28 VAL HA 3 131 TYR QD 4.000 . 4.500 4.496 4.232 4.605 0.105 8 0 "[ . 1 .]" 1 2487 3 53 ILE MG 3 131 TYR QD 4.000 . 4.500 3.785 3.458 3.975 . 0 0 "[ . 1 .]" 1 2488 3 61 ILE MG 3 131 TYR QD 6.000 . 6.500 4.662 4.574 4.780 . 0 0 "[ . 1 .]" 1 2489 3 27 LEU HA 3 131 TYR QE 5.000 . 5.500 4.061 3.858 4.146 . 0 0 "[ . 1 .]" 1 2490 3 127 LYS HA 3 131 TYR QE 4.000 . 4.500 3.691 3.532 3.892 . 0 0 "[ . 1 .]" 1 2491 3 127 LYS QB 3 131 TYR QE 4.000 . 4.500 2.128 1.942 2.916 . 0 0 "[ . 1 .]" 1 2492 3 127 LYS QG 3 131 TYR QE 5.000 . 5.500 2.423 2.022 3.066 . 0 0 "[ . 1 .]" 1 2493 3 127 LYS QD 3 131 TYR QE 5.000 . 5.500 3.566 2.456 4.402 . 0 0 "[ . 1 .]" 1 2494 3 127 LYS QE 3 131 TYR QE 5.000 . 5.500 3.883 2.108 4.783 . 0 0 "[ . 1 .]" 1 2495 3 128 VAL HA 3 131 TYR QE 5.000 . 5.500 5.286 4.829 5.617 0.117 3 0 "[ . 1 .]" 1 2496 3 130 GLU QB 3 131 TYR QE 5.000 . 5.500 4.655 3.679 5.271 . 0 0 "[ . 1 .]" 1 2497 3 130 GLU QG 3 131 TYR QE 4.000 . 4.500 3.397 2.664 3.870 . 0 0 "[ . 1 .]" 1 2498 3 131 TYR HA 3 131 TYR QE 4.500 . 5.000 4.221 4.174 4.261 . 0 0 "[ . 1 .]" 1 2499 3 131 TYR QE 3 135 PRO HA 6.000 . 6.500 5.121 4.667 5.609 . 0 0 "[ . 1 .]" 1 2500 3 131 TYR QE 3 136 PRO QD 5.000 . 5.500 3.892 3.247 5.003 . 0 0 "[ . 1 .]" 1 2501 3 27 LEU QD 3 131 TYR QE 4.000 . 4.500 3.050 2.456 3.878 . 0 0 "[ . 1 .]" 1 2502 3 28 VAL HA 3 131 TYR QE 5.000 . 5.500 3.681 3.350 4.005 . 0 0 "[ . 1 .]" 1 2503 3 28 VAL QG 3 131 TYR QE 3.500 . 4.000 3.091 2.749 3.325 . 0 0 "[ . 1 .]" 1 2504 3 53 ILE QG 3 131 TYR QE 6.000 . 6.500 6.292 6.083 6.476 . 0 0 "[ . 1 .]" 1 2505 3 53 ILE MG 3 131 TYR QE 5.000 . 5.500 5.243 5.133 5.378 . 0 0 "[ . 1 .]" 1 2506 3 53 ILE MD 3 131 TYR QE 4.000 . 4.500 4.573 4.417 4.682 0.182 6 0 "[ . 1 .]" 1 2507 3 129 ASN H 3 131 TYR H 4.000 . 4.500 4.048 3.930 4.151 . 0 0 "[ . 1 .]" 1 2508 3 128 VAL H 3 131 TYR H 5.000 . 5.500 4.659 4.573 4.751 . 0 0 "[ . 1 .]" 1 2509 3 131 TYR H 3 133 ASN H 4.000 . 4.500 3.751 3.594 3.834 . 0 0 "[ . 1 .]" 1 2510 3 127 LYS H 3 131 TYR H 6.000 . 6.500 5.823 5.651 5.992 . 0 0 "[ . 1 .]" 1 2511 3 130 GLU H 3 131 TYR H 3.000 . 3.500 2.596 2.527 2.658 . 0 0 "[ . 1 .]" 1 2512 3 131 TYR HA 3 132 LEU H 3.500 . 4.000 3.484 3.418 3.519 . 0 0 "[ . 1 .]" 1 2513 3 131 TYR H 3 131 TYR HA 3.000 . 3.500 2.899 2.882 2.932 . 0 0 "[ . 1 .]" 1 2514 3 131 TYR HA 3 133 ASN H 4.000 . 4.500 4.170 4.045 4.320 . 0 0 "[ . 1 .]" 1 2515 3 130 GLU H 3 131 TYR HA 5.000 . 5.500 5.213 5.144 5.261 . 0 0 "[ . 1 .]" 1 2516 3 131 TYR HA 3 134 ASN H 3.500 . 4.000 3.488 3.364 3.603 . 0 0 "[ . 1 .]" 1 2517 3 131 TYR QB 3 132 LEU H 3.000 . 3.500 2.813 2.602 3.086 . 0 0 "[ . 1 .]" 1 2518 3 131 TYR H 3 131 TYR QB 3.000 . 3.500 2.340 2.289 2.439 . 0 0 "[ . 1 .]" 1 2519 3 130 GLU H 3 131 TYR QB 5.000 . 5.500 4.606 4.492 4.711 . 0 0 "[ . 1 .]" 1 2520 3 131 TYR H 3 131 TYR QE 5.000 . 5.500 4.807 4.535 5.066 . 0 0 "[ . 1 .]" 1 2521 3 128 VAL H 3 131 TYR QE 6.000 . 6.500 5.301 4.927 5.787 . 0 0 "[ . 1 .]" 1 2522 3 127 LYS H 3 131 TYR QE 6.000 . 6.500 5.295 5.181 5.775 . 0 0 "[ . 1 .]" 1 2523 3 130 GLU H 3 131 TYR QE 6.000 . 6.500 5.983 5.732 6.171 . 0 0 "[ . 1 .]" 1 2524 3 28 VAL H 3 131 TYR QE 5.000 . 5.500 4.740 4.371 5.052 . 0 0 "[ . 1 .]" 1 2525 3 131 TYR QD 3 132 LEU H 5.000 . 5.500 4.523 4.353 4.638 . 0 0 "[ . 1 .]" 1 2526 3 131 TYR H 3 131 TYR QD 3.000 . 3.500 3.249 2.831 3.439 . 0 0 "[ . 1 .]" 1 2527 3 127 LYS H 3 131 TYR QD 6.000 . 6.500 5.508 5.232 6.027 . 0 0 "[ . 1 .]" 1 2528 3 130 GLU H 3 131 TYR QD 5.000 . 5.500 4.912 4.672 5.012 . 0 0 "[ . 1 .]" 1 2529 3 131 TYR QD 3 134 ASN H 5.000 . 5.500 5.092 4.565 5.279 . 0 0 "[ . 1 .]" 1 2530 3 28 VAL H 3 131 TYR QD 4.500 . 5.000 4.381 3.751 4.652 . 0 0 "[ . 1 .]" 1 2531 3 27 LEU H 3 131 TYR QE 6.000 . 6.500 5.770 5.569 5.948 . 0 0 "[ . 1 .]" 1 2532 3 53 ILE MD 3 131 TYR QD 4.000 . 4.500 2.661 2.379 2.814 . 0 0 "[ . 1 .]" 1 2533 3 27 LEU QB 3 131 TYR QE 4.000 . 4.500 3.157 2.996 3.291 . 0 0 "[ . 1 .]" 1 2534 3 53 ILE MG 3 132 LEU HA 4.000 . 4.500 4.349 4.267 4.547 0.047 9 0 "[ . 1 .]" 1 2535 3 53 ILE MD 3 132 LEU HA 5.000 . 5.500 4.151 4.026 4.245 . 0 0 "[ . 1 .]" 1 2536 3 61 ILE MG 3 132 LEU HA 3.000 . 3.500 2.596 2.413 2.874 . 0 0 "[ . 1 .]" 1 2537 3 61 ILE MD 3 132 LEU HA 5.000 . 5.500 4.549 4.350 4.871 . 0 0 "[ . 1 .]" 1 2538 3 79 ILE MG 3 132 LEU HA 4.000 . 4.500 3.589 2.871 3.887 . 0 0 "[ . 1 .]" 1 2539 3 128 VAL QG 3 132 LEU HA 5.000 . 5.500 5.394 5.070 5.563 0.063 14 0 "[ . 1 .]" 1 2540 3 132 LEU HA 3 132 LEU HG 4.000 . 4.500 2.843 2.741 2.936 . 0 0 "[ . 1 .]" 1 2541 3 132 LEU HA 3 132 LEU QD 3.000 . 3.500 1.981 1.955 2.007 . 0 0 "[ . 1 .]" 1 2542 3 129 ASN HA 3 132 LEU QB 4.000 . 4.500 2.600 2.400 2.889 . 0 0 "[ . 1 .]" 1 2543 3 79 ILE MG 3 132 LEU QB 3.000 . 3.500 2.358 1.981 2.561 . 0 0 "[ . 1 .]" 1 2544 3 100 LEU QD 3 132 LEU QB 5.000 . 5.500 3.725 3.404 3.913 . 0 0 "[ . 1 .]" 1 2545 3 128 VAL QG 3 132 LEU QB 4.000 . 4.500 3.591 3.360 3.725 . 0 0 "[ . 1 .]" 1 2546 3 53 ILE HA 3 132 LEU QD 4.000 . 4.500 4.419 4.144 4.650 0.150 1 0 "[ . 1 .]" 1 2547 3 85 GLU HA 3 132 LEU QD 5.000 . 5.500 4.898 4.556 5.090 . 0 0 "[ . 1 .]" 1 2548 3 129 ASN HA 3 132 LEU QD 4.000 . 4.500 3.038 2.745 3.436 . 0 0 "[ . 1 .]" 1 2549 3 53 ILE QG 3 132 LEU QD 3.000 . 3.500 2.695 2.450 2.831 . 0 0 "[ . 1 .]" 1 2550 3 53 ILE MD 3 132 LEU QD 3.000 . 3.500 2.130 1.990 2.259 . 0 0 "[ . 1 .]" 1 2551 3 79 ILE MD 3 132 LEU QD 4.500 . 5.000 3.631 3.316 3.766 . 0 0 "[ . 1 .]" 1 2552 3 131 TYR H 3 132 LEU H 3.000 . 3.500 2.337 2.200 2.409 . 0 0 "[ . 1 .]" 1 2553 3 129 ASN H 3 132 LEU H 5.000 . 5.500 4.687 4.629 4.719 . 0 0 "[ . 1 .]" 1 2554 3 132 LEU H 3 133 ASN H 3.000 . 3.500 2.369 2.224 2.513 . 0 0 "[ . 1 .]" 1 2555 3 130 GLU H 3 132 LEU H 4.000 . 4.500 3.967 3.911 4.017 . 0 0 "[ . 1 .]" 1 2556 3 132 LEU H 3 134 ASN H 4.000 . 4.500 3.587 3.394 3.675 . 0 0 "[ . 1 .]" 1 2557 3 132 LEU H 3 133 ASN QD 4.000 . 4.500 4.472 4.245 4.605 0.105 1 0 "[ . 1 .]" 1 2558 3 132 LEU H 3 132 LEU HA 3.000 . 3.500 2.896 2.855 2.927 . 0 0 "[ . 1 .]" 1 2559 3 131 TYR H 3 132 LEU HA 5.000 . 5.500 5.020 4.883 5.085 . 0 0 "[ . 1 .]" 1 2560 3 132 LEU HA 3 133 ASN H 4.000 . 4.500 3.470 3.415 3.508 . 0 0 "[ . 1 .]" 1 2561 3 132 LEU HA 3 134 ASN H 5.000 . 5.500 4.472 4.340 4.552 . 0 0 "[ . 1 .]" 1 2562 3 132 LEU H 3 132 LEU QB 3.000 . 3.500 2.379 2.341 2.421 . 0 0 "[ . 1 .]" 1 2563 3 131 TYR H 3 132 LEU QB 5.000 . 5.500 4.371 4.222 4.479 . 0 0 "[ . 1 .]" 1 2564 3 132 LEU QB 3 133 ASN H 3.000 . 3.500 2.941 2.711 3.173 . 0 0 "[ . 1 .]" 1 2565 3 132 LEU QB 3 134 ASN H 4.000 . 4.500 4.617 4.503 4.708 0.208 13 0 "[ . 1 .]" 1 2566 3 132 LEU QB 3 133 ASN QD 5.000 . 5.500 3.539 3.343 4.688 . 0 0 "[ . 1 .]" 1 2567 3 132 LEU H 3 132 LEU QD 3.000 . 3.500 3.169 3.113 3.279 . 0 0 "[ . 1 .]" 1 2568 3 131 TYR H 3 132 LEU QD 5.000 . 5.500 4.426 4.295 4.537 . 0 0 "[ . 1 .]" 1 2569 3 129 ASN H 3 132 LEU QD 5.000 . 5.500 4.289 4.149 4.448 . 0 0 "[ . 1 .]" 1 2570 3 85 GLU H 3 132 LEU QD 5.000 . 5.500 5.265 5.011 5.421 . 0 0 "[ . 1 .]" 1 2571 3 132 LEU QD 3 133 ASN H 4.000 . 4.500 4.223 4.118 4.309 . 0 0 "[ . 1 .]" 1 2572 3 84 CYS H 3 132 LEU QD 5.000 . 5.500 4.801 4.330 5.209 . 0 0 "[ . 1 .]" 1 2573 3 130 GLU H 3 132 LEU QD 5.000 . 5.500 5.132 4.952 5.380 . 0 0 "[ . 1 .]" 1 2574 3 132 LEU QD 3 134 ASN H 5.000 . 5.500 5.336 5.282 5.367 . 0 0 "[ . 1 .]" 1 2575 3 63 PHE H 3 132 LEU QD 4.000 . 4.500 4.075 3.890 4.436 . 0 0 "[ . 1 .]" 1 2576 3 80 PHE H 3 132 LEU QD 5.000 . 5.500 5.085 4.981 5.191 . 0 0 "[ . 1 .]" 1 2577 3 79 ILE H 3 132 LEU QD 4.000 . 4.500 3.601 3.419 3.906 . 0 0 "[ . 1 .]" 1 2578 3 86 PHE H 3 132 LEU QD 5.000 . 5.500 4.504 3.997 4.722 . 0 0 "[ . 1 .]" 1 2579 3 132 LEU QD 3 133 ASN QD 5.000 . 5.500 4.369 4.131 5.501 0.001 5 0 "[ . 1 .]" 1 2580 3 132 LEU H 3 132 LEU HG 3.000 . 3.500 2.341 2.254 2.543 . 0 0 "[ . 1 .]" 1 2581 3 132 LEU HG 3 133 ASN H 4.000 . 4.500 4.378 4.341 4.430 . 0 0 "[ . 1 .]" 1 2582 3 132 LEU HG 3 134 ASN H 5.000 . 5.500 5.749 5.713 5.793 0.293 3 0 "[ . 1 .]" 1 2583 3 64 CYS H 3 132 LEU QD 6.000 . 6.500 5.154 4.956 5.432 . 0 0 "[ . 1 .]" 1 2584 3 81 PRO HA 3 133 ASN QB 5.000 . 5.500 4.080 3.736 4.776 . 0 0 "[ . 1 .]" 1 2585 3 82 ASP H 3 133 ASN H 6.000 . 6.500 4.804 4.509 4.931 . 0 0 "[ . 1 .]" 1 2586 3 133 ASN H 3 134 ASN H 2.500 . 3.000 1.933 1.788 2.094 0.012 13 0 "[ . 1 .]" 1 2587 3 133 ASN H 3 133 ASN QD 3.000 . 3.500 3.347 3.183 3.473 . 0 0 "[ . 1 .]" 1 2588 3 82 ASP H 3 133 ASN QD 5.000 . 5.500 4.754 4.598 5.281 . 0 0 "[ . 1 .]" 1 2589 3 133 ASN QD 3 134 ASN H 4.000 . 4.500 4.479 3.500 4.624 0.124 13 0 "[ . 1 .]" 1 2590 3 86 PHE H 3 133 ASN QD 5.000 . 5.500 3.248 2.962 4.756 . 0 0 "[ . 1 .]" 1 2591 3 132 LEU H 3 133 ASN HA 5.000 . 5.500 5.055 4.933 5.179 . 0 0 "[ . 1 .]" 1 2592 3 133 ASN H 3 133 ASN HA 3.000 . 3.500 2.955 2.934 2.967 . 0 0 "[ . 1 .]" 1 2593 3 82 ASP H 3 133 ASN HA 3.000 . 3.500 1.963 1.842 2.236 . 0 0 "[ . 1 .]" 1 2594 3 84 CYS H 3 133 ASN HA 5.000 . 5.500 4.826 4.230 5.378 . 0 0 "[ . 1 .]" 1 2595 3 133 ASN HA 3 134 ASN H 4.000 . 4.500 3.449 3.379 3.474 . 0 0 "[ . 1 .]" 1 2596 3 133 ASN HA 3 133 ASN QD 4.000 . 4.500 4.044 3.989 4.298 . 0 0 "[ . 1 .]" 1 2597 3 133 ASN H 3 133 ASN QB 2.500 . 3.000 2.575 2.472 2.958 . 0 0 "[ . 1 .]" 1 2598 3 133 ASN QB 3 134 ASN H 3.000 . 3.500 3.057 2.849 3.778 0.278 1 0 "[ . 1 .]" 1 2599 3 133 ASN QB 3 133 ASN QD 2.500 . 3.000 2.172 2.156 2.191 . 0 0 "[ . 1 .]" 1 2600 3 81 PRO QG 3 133 ASN HA 4.500 . 5.000 4.504 4.047 5.108 0.108 5 0 "[ . 1 .]" 1 2601 3 134 ASN HA 3 134 ASN QB 2.500 . 3.000 2.339 2.265 2.397 . 0 0 "[ . 1 .]" 1 2602 3 134 ASN HA 3 135 PRO QG 4.000 . 4.500 4.032 3.976 4.151 . 0 0 "[ . 1 .]" 1 2603 3 134 ASN HA 3 135 PRO QD 3.000 . 3.500 2.130 2.072 2.235 . 0 0 "[ . 1 .]" 1 2604 3 134 ASN QB 3 135 PRO QD 4.000 . 4.500 3.756 3.722 3.799 . 0 0 "[ . 1 .]" 1 2605 3 134 ASN H 3 134 ASN QD 4.000 . 4.500 4.246 4.033 4.541 0.041 14 0 "[ . 1 .]" 1 2606 3 133 ASN H 3 134 ASN QD 5.000 . 5.500 5.272 4.862 5.821 0.321 13 0 "[ . 1 .]" 1 2607 3 133 ASN H 3 134 ASN HA 4.000 . 4.500 4.689 4.570 4.812 0.312 3 0 "[ . 1 .]" 1 2608 3 134 ASN H 3 134 ASN HA 3.000 . 3.500 2.950 2.940 2.960 . 0 0 "[ . 1 .]" 1 2609 3 133 ASN H 3 134 ASN QB 4.000 . 4.500 4.311 3.937 4.517 0.017 12 0 "[ . 1 .]" 1 2610 3 134 ASN H 3 134 ASN QB 2.500 . 3.000 2.778 2.678 2.907 . 0 0 "[ . 1 .]" 1 2611 3 134 ASN QB 3 134 ASN QD 2.500 . 3.000 2.232 2.169 2.528 . 0 0 "[ . 1 .]" 1 2612 3 135 PRO HA 3 135 PRO QG 3.000 . 3.500 3.346 2.905 3.504 0.004 7 0 "[ . 1 .]" 1 2613 3 135 PRO HA 3 135 PRO QD 4.000 . 4.500 3.388 3.355 3.408 . 0 0 "[ . 1 .]" 1 2614 3 135 PRO HA 3 136 PRO QD 2.500 . 3.000 2.047 2.021 2.079 . 0 0 "[ . 1 .]" 1 2615 3 61 ILE MD 3 135 PRO HA 4.000 . 4.500 3.077 2.561 3.440 . 0 0 "[ . 1 .]" 1 2616 3 134 ASN HA 3 135 PRO QB 5.000 . 5.500 4.816 4.700 4.901 . 0 0 "[ . 1 .]" 1 2617 3 61 ILE QG 3 135 PRO QB 5.000 . 5.500 2.044 1.949 2.293 . 0 0 "[ . 1 .]" 1 2618 3 61 ILE MD 3 135 PRO QB 3.000 . 3.500 2.112 1.984 2.419 . 0 0 "[ . 1 .]" 1 2619 3 133 ASN H 3 135 PRO QD 4.000 . 4.500 3.782 3.514 4.050 . 0 0 "[ . 1 .]" 1 2620 3 134 ASN H 3 135 PRO QD 3.000 . 3.500 2.779 2.618 2.947 . 0 0 "[ . 1 .]" 1 2621 3 134 ASN H 3 135 PRO HA 4.000 . 4.500 4.338 4.258 4.438 . 0 0 "[ . 1 .]" 1 2622 3 134 ASN H 3 135 PRO QG 4.000 . 4.500 4.560 4.080 4.748 0.248 11 0 "[ . 1 .]" 1 2623 3 61 ILE H 3 135 PRO QB 5.000 . 5.500 4.583 4.263 4.822 . 0 0 "[ . 1 .]" 1 2624 3 136 PRO HA 3 136 PRO QG 3.000 . 3.500 3.123 2.913 3.521 0.021 6 0 "[ . 1 .]" 1 2625 3 136 PRO HA 3 136 PRO QD 4.000 . 4.500 3.366 3.302 3.470 . 0 0 "[ . 1 .]" 1 2626 3 136 PRO QB 3 136 PRO QD 3.000 . 3.500 2.859 2.829 2.900 . 0 0 "[ . 1 .]" 1 2627 3 27 LEU QD 3 136 PRO QB 4.000 . 4.500 3.652 3.268 4.101 . 0 0 "[ . 1 .]" 1 2628 3 27 LEU QD 3 136 PRO QG 3.000 . 3.500 2.163 1.831 2.668 . 0 0 "[ . 1 .]" 1 2629 3 135 PRO QB 3 136 PRO QD 3.000 . 3.500 2.405 2.278 2.584 . 0 0 "[ . 1 .]" 1 2630 3 61 ILE MD 3 136 PRO QD 4.000 . 4.500 2.406 1.981 2.657 . 0 0 "[ . 1 .]" 1 2631 3 27 LEU QD 3 136 PRO QD 3.000 . 3.500 2.288 2.086 2.689 . 0 0 "[ . 1 .]" 1 2632 3 55 GLN QE 3 136 PRO QD 6.000 . 6.500 2.229 2.026 2.553 . 0 0 "[ . 1 .]" 1 2633 3 55 GLN QE 3 136 PRO QB 4.000 . 4.500 3.036 2.380 4.108 . 0 0 "[ . 1 .]" 1 2634 4 5 GLN HA 4 5 GLN QB 2.500 . 3.000 2.420 2.364 2.527 . 0 0 "[ . 1 .]" 1 2635 4 5 GLN HA 4 5 GLN QG 3.000 . 3.500 2.364 2.096 2.938 . 0 0 "[ . 1 .]" 1 2636 4 6 GLU HA 4 6 GLU QB 2.500 . 3.000 2.390 2.366 2.413 . 0 0 "[ . 1 .]" 1 2637 4 6 GLU HA 4 6 GLU QG 3.000 . 3.500 2.320 2.240 2.370 . 0 0 "[ . 1 .]" 1 2638 4 6 GLU HA 4 7 PRO QD 3.000 . 3.500 2.103 2.068 2.150 . 0 0 "[ . 1 .]" 1 2639 4 6 GLU QB 4 7 PRO QD 4.000 . 4.500 2.578 2.059 3.772 . 0 0 "[ . 1 .]" 1 2640 4 6 GLU QG 4 7 PRO QD 5.000 . 5.500 3.324 2.992 3.928 . 0 0 "[ . 1 .]" 1 2641 4 6 GLU HA 4 7 PRO QG 4.500 . 5.000 4.042 3.951 4.083 . 0 0 "[ . 1 .]" 1 2642 4 7 PRO HA 4 7 PRO QG 3.000 . 3.500 3.423 2.882 3.512 0.012 5 0 "[ . 1 .]" 1 2643 4 7 PRO HA 4 7 PRO QD 4.000 . 4.500 3.409 3.329 3.455 . 0 0 "[ . 1 .]" 1 2644 4 7 PRO HA 4 8 GLU H 2.500 . 3.000 2.258 2.198 2.313 . 0 0 "[ . 1 .]" 1 2645 4 7 PRO QB 4 8 GLU H 3.000 . 3.500 3.005 2.846 3.174 . 0 0 "[ . 1 .]" 1 2646 4 8 GLU HA 4 8 GLU QG 3.000 . 3.500 2.546 2.298 3.307 . 0 0 "[ . 1 .]" 1 2647 4 8 GLU HA 4 9 PRO QG 5.000 . 5.500 3.980 3.812 4.108 . 0 0 "[ . 1 .]" 1 2648 4 8 GLU HA 4 9 PRO QD 3.000 . 3.500 2.075 1.973 2.175 . 0 0 "[ . 1 .]" 1 2649 4 7 PRO HA 4 8 GLU QB 5.000 . 5.500 4.427 4.339 4.498 . 0 0 "[ . 1 .]" 1 2650 4 8 GLU QB 4 9 PRO QD 4.000 . 4.500 2.094 2.026 2.195 . 0 0 "[ . 1 .]" 1 2651 4 8 GLU QG 4 9 PRO QD 4.500 . 5.000 3.222 3.018 3.736 . 0 0 "[ . 1 .]" 1 2652 4 8 GLU H 4 8 GLU HA 3.000 . 3.500 2.876 2.848 2.929 . 0 0 "[ . 1 .]" 1 2653 4 8 GLU H 4 8 GLU QB 3.000 . 3.500 2.404 2.344 2.576 . 0 0 "[ . 1 .]" 1 2654 4 8 GLU H 4 8 GLU QG 3.000 . 3.500 2.299 1.947 2.570 . 0 0 "[ . 1 .]" 1 2655 4 9 PRO QG 4 10 PRO QD 5.000 . 5.500 4.138 3.994 4.291 . 0 0 "[ . 1 .]" 1 2656 4 8 GLU H 4 9 PRO QD 5.000 . 5.500 4.417 4.387 4.435 . 0 0 "[ . 1 .]" 1 2657 4 10 PRO HA 4 11 GLU QG 5.000 . 5.500 3.861 3.309 4.569 . 0 0 "[ . 1 .]" 1 2658 4 9 PRO HA 4 10 PRO QB 5.000 . 5.500 4.729 4.624 4.830 . 0 0 "[ . 1 .]" 1 2659 4 9 PRO QB 4 10 PRO QB 5.500 . 6.000 4.759 4.477 5.085 . 0 0 "[ . 1 .]" 1 2660 4 9 PRO HA 4 10 PRO QD 4.000 . 4.500 2.044 1.987 2.146 . 0 0 "[ . 1 .]" 1 2661 4 9 PRO QB 4 10 PRO QD 4.000 . 4.500 2.638 2.294 3.026 . 0 0 "[ . 1 .]" 1 2662 4 10 PRO QB 4 11 GLU H 3.000 . 3.500 2.317 2.053 2.658 . 0 0 "[ . 1 .]" 1 2663 4 10 PRO QG 4 11 GLU H 4.000 . 4.500 4.079 3.749 4.246 . 0 0 "[ . 1 .]" 1 2664 4 10 PRO HA 4 11 GLU H 3.000 . 3.500 2.616 2.390 2.861 . 0 0 "[ . 1 .]" 1 2665 4 10 PRO QB 4 13 PHE QD 4.500 . 5.000 4.236 3.953 4.651 . 0 0 "[ . 1 .]" 1 2666 4 10 PRO QB 4 13 PHE QE 4.500 . 5.000 4.184 3.750 4.858 . 0 0 "[ . 1 .]" 1 2667 4 10 PRO QG 4 13 PHE QE 5.000 . 5.500 4.543 3.603 5.161 . 0 0 "[ . 1 .]" 1 2668 4 11 GLU HA 4 11 GLU QG 3.000 . 3.500 3.207 2.769 3.397 . 0 0 "[ . 1 .]" 1 2669 4 11 GLU HA 4 12 PRO QB 6.000 . 6.500 4.762 4.653 4.836 . 0 0 "[ . 1 .]" 1 2670 4 11 GLU HA 4 12 PRO QG 4.500 . 5.000 3.993 3.859 4.114 . 0 0 "[ . 1 .]" 1 2671 4 11 GLU HA 4 12 PRO QD 2.500 . 3.000 2.096 1.997 2.203 . 0 0 "[ . 1 .]" 1 2672 4 11 GLU QB 4 12 PRO QD 4.000 . 4.500 2.062 1.983 2.135 . 0 0 "[ . 1 .]" 1 2673 4 11 GLU QG 4 12 PRO QD 5.000 . 5.500 3.614 3.460 3.779 . 0 0 "[ . 1 .]" 1 2674 4 11 GLU H 4 11 GLU HA 3.000 . 3.500 2.945 2.879 2.960 . 0 0 "[ . 1 .]" 1 2675 4 11 GLU H 4 11 GLU QB 3.000 . 3.500 2.812 2.399 3.007 . 0 0 "[ . 1 .]" 1 2676 4 11 GLU H 4 11 GLU QG 3.000 . 3.500 2.148 1.923 2.790 . 0 0 "[ . 1 .]" 1 2677 4 12 PRO HA 4 13 PHE H 3.000 . 3.500 2.245 2.202 2.298 . 0 0 "[ . 1 .]" 1 2678 4 12 PRO QB 4 13 PHE H 3.000 . 3.500 3.065 2.915 3.172 . 0 0 "[ . 1 .]" 1 2679 4 12 PRO QG 4 13 PHE H 4.000 . 4.500 4.579 4.456 4.641 0.141 2 0 "[ . 1 .]" 1 2680 4 11 GLU H 4 12 PRO QD 5.000 . 5.500 4.410 4.391 4.429 . 0 0 "[ . 1 .]" 1 2681 4 12 PRO QD 4 13 PHE H 4.500 . 5.000 5.016 5.001 5.034 0.034 13 0 "[ . 1 .]" 1 2682 4 13 PHE QD 4 15 TYR HA 4.000 . 4.500 3.599 3.509 3.677 . 0 0 "[ . 1 .]" 1 2683 4 13 PHE HA 4 13 PHE QD 4.000 . 4.500 3.703 3.698 3.709 . 0 0 "[ . 1 .]" 1 2684 4 13 PHE HA 4 13 PHE QE 6.000 . 6.500 5.606 5.595 5.614 . 0 0 "[ . 1 .]" 1 2685 4 13 PHE HA 4 14 GLU H 3.000 . 3.500 2.415 2.373 2.469 . 0 0 "[ . 1 .]" 1 2686 4 13 PHE QB 4 14 GLU H 3.000 . 3.500 2.410 2.311 2.479 . 0 0 "[ . 1 .]" 1 2687 4 13 PHE H 4 13 PHE QD 4.000 . 4.500 2.883 2.805 2.957 . 0 0 "[ . 1 .]" 1 2688 4 13 PHE QD 4 14 GLU H 4.000 . 4.500 3.087 3.004 3.186 . 0 0 "[ . 1 .]" 1 2689 4 13 PHE QD 4 16 ILE H 5.000 . 5.500 5.532 5.322 5.604 0.104 6 0 "[ . 1 .]" 1 2690 4 13 PHE QD 4 15 TYR H 5.000 . 5.500 4.304 4.195 4.416 . 0 0 "[ . 1 .]" 1 2691 4 13 PHE H 4 13 PHE QE 4.000 . 4.500 4.267 4.217 4.332 . 0 0 "[ . 1 .]" 1 2692 4 13 PHE QE 4 14 GLU H 5.000 . 5.500 5.293 5.200 5.363 . 0 0 "[ . 1 .]" 1 2693 4 13 PHE H 4 14 GLU H 4.000 . 4.500 4.395 4.375 4.409 . 0 0 "[ . 1 .]" 1 2694 4 13 PHE QD 4 15 TYR QD 5.000 . 5.500 4.918 4.686 5.133 . 0 0 "[ . 1 .]" 1 2695 4 14 GLU HA 4 14 GLU QG 3.000 . 3.500 2.389 2.313 3.286 . 0 0 "[ . 1 .]" 1 2696 4 13 PHE HA 4 14 GLU QB 6.000 . 6.500 4.403 4.090 4.526 . 0 0 "[ . 1 .]" 1 2697 4 13 PHE HA 4 14 GLU QG 5.000 . 5.500 4.119 3.556 5.719 0.219 1 0 "[ . 1 .]" 1 2698 4 14 GLU HA 4 15 TYR H 3.000 . 3.500 2.176 2.138 2.199 . 0 0 "[ . 1 .]" 1 2699 4 14 GLU H 4 14 GLU QB 2.500 . 3.000 2.345 2.300 2.547 . 0 0 "[ . 1 .]" 1 2700 4 14 GLU QB 4 15 TYR H 3.000 . 3.500 3.130 2.940 3.674 0.174 3 0 "[ . 1 .]" 1 2701 4 14 GLU H 4 14 GLU QG 4.000 . 4.500 2.793 2.053 3.964 . 0 0 "[ . 1 .]" 1 2702 4 14 GLU QG 4 15 TYR H 4.000 . 4.500 3.593 2.506 3.956 . 0 0 "[ . 1 .]" 1 2703 4 14 GLU H 4 15 TYR H 4.000 . 4.500 4.547 4.508 4.565 0.065 6 0 "[ . 1 .]" 1 2704 4 15 TYR HA 4 15 TYR QD 3.000 . 3.500 2.473 2.230 2.645 . 0 0 "[ . 1 .]" 1 2705 4 15 TYR QB 4 15 TYR QD 2.500 . 3.000 2.168 2.146 2.201 . 0 0 "[ . 1 .]" 1 2706 4 15 TYR QD 4 16 ILE HA 5.000 . 5.500 4.121 3.957 4.241 . 0 0 "[ . 1 .]" 1 2707 4 15 TYR QD 4 17 ASP HA 5.000 . 5.500 4.732 4.544 4.903 . 0 0 "[ . 1 .]" 1 2708 4 15 TYR QD 4 17 ASP QB 5.000 . 5.500 4.817 4.591 5.598 0.098 3 0 "[ . 1 .]" 1 2709 4 15 TYR HA 4 15 TYR QE 4.000 . 4.500 4.598 4.522 4.633 0.133 2 0 "[ . 1 .]" 1 2710 4 15 TYR QB 4 15 TYR QE 4.000 . 4.500 3.972 3.959 3.987 . 0 0 "[ . 1 .]" 1 2711 4 15 TYR QE 4 16 ILE HA 5.000 . 5.500 4.577 4.483 4.639 . 0 0 "[ . 1 .]" 1 2712 4 15 TYR QE 4 17 ASP HA 4.000 . 4.500 3.240 2.878 3.531 . 0 0 "[ . 1 .]" 1 2713 4 15 TYR QE 4 17 ASP QB 4.000 . 4.500 3.317 3.013 4.237 . 0 0 "[ . 1 .]" 1 2714 3 110 PHE HZ 4 15 TYR QE 4.000 . 4.500 2.565 2.108 2.860 . 0 0 "[ . 1 .]" 1 2715 4 15 TYR HA 4 16 ILE H 2.500 . 3.000 2.134 2.110 2.172 . 0 0 "[ . 1 .]" 1 2716 4 15 TYR HA 4 17 ASP H 6.000 . 6.500 5.903 5.753 6.056 . 0 0 "[ . 1 .]" 1 2717 4 15 TYR QB 4 16 ILE H 4.000 . 4.500 3.725 3.646 3.808 . 0 0 "[ . 1 .]" 1 2718 4 15 TYR H 4 15 TYR QB 3.000 . 3.500 2.435 2.366 2.467 . 0 0 "[ . 1 .]" 1 2719 4 15 TYR QD 4 16 ILE H 4.000 . 4.500 2.760 2.332 3.077 . 0 0 "[ . 1 .]" 1 2720 4 15 TYR QD 4 18 ASP H 5.000 . 5.500 5.593 5.491 5.713 0.213 6 0 "[ . 1 .]" 1 2721 4 15 TYR H 4 15 TYR QD 4.000 . 4.500 4.143 4.095 4.188 . 0 0 "[ . 1 .]" 1 2722 4 15 TYR QD 4 17 ASP H 4.000 . 4.500 4.621 4.500 4.718 0.218 4 0 "[ . 1 .]" 1 2723 4 15 TYR QE 4 16 ILE H 4.000 . 4.500 4.010 3.851 4.177 . 0 0 "[ . 1 .]" 1 2724 4 15 TYR QE 4 18 ASP H 4.000 . 4.500 4.529 4.425 4.575 0.075 5 0 "[ . 1 .]" 1 2725 4 15 TYR H 4 15 TYR QE 6.000 . 6.500 6.114 6.057 6.167 . 0 0 "[ . 1 .]" 1 2726 4 15 TYR QE 4 17 ASP H 4.000 . 4.500 4.058 3.982 4.157 . 0 0 "[ . 1 .]" 1 2727 4 15 TYR HA 4 16 ILE HA 5.000 . 5.500 4.384 4.364 4.412 . 0 0 "[ . 1 .]" 1 2728 4 16 ILE HA 4 16 ILE QG 3.000 . 3.500 2.547 2.415 3.138 . 0 0 "[ . 1 .]" 1 2729 4 16 ILE HA 4 16 ILE HB 3.000 . 3.500 3.018 2.993 3.035 . 0 0 "[ . 1 .]" 1 2730 4 16 ILE HA 4 16 ILE MG 3.000 . 3.500 2.267 2.163 2.340 . 0 0 "[ . 1 .]" 1 2731 4 16 ILE HA 4 16 ILE MD 4.000 . 4.500 3.658 2.039 3.867 . 0 0 "[ . 1 .]" 1 2732 4 14 GLU QB 4 16 ILE QG 6.000 . 6.500 3.354 2.941 3.945 . 0 0 "[ . 1 .]" 1 2733 4 14 GLU QG 4 16 ILE QG 6.000 . 6.500 4.282 2.439 5.515 . 0 0 "[ . 1 .]" 1 2734 4 15 TYR HA 4 16 ILE QG 5.000 . 5.500 3.461 3.108 3.946 . 0 0 "[ . 1 .]" 1 2735 4 16 ILE HB 4 16 ILE QG 2.500 . 3.000 2.390 2.191 2.505 . 0 0 "[ . 1 .]" 1 2736 4 16 ILE QG 4 16 ILE MG 2.500 . 3.000 2.185 2.068 2.292 . 0 0 "[ . 1 .]" 1 2737 4 16 ILE HB 4 16 ILE MD 2.500 . 3.000 2.312 2.048 3.200 0.200 6 0 "[ . 1 .]" 1 2738 4 14 GLU QB 4 16 ILE MD 4.000 . 4.500 3.223 2.483 4.116 . 0 0 "[ . 1 .]" 1 2739 4 14 GLU QG 4 16 ILE MD 4.000 . 4.500 4.209 3.209 4.678 0.178 8 0 "[ . 1 .]" 1 2740 4 15 TYR HA 4 16 ILE MG 5.000 . 5.500 5.351 5.241 5.416 . 0 0 "[ . 1 .]" 1 2741 4 16 ILE MG 4 18 ASP HA 4.000 . 4.500 4.037 3.524 4.493 . 0 0 "[ . 1 .]" 1 2742 4 16 ILE H 4 16 ILE HA 3.000 . 3.500 2.945 2.940 2.950 . 0 0 "[ . 1 .]" 1 2743 4 16 ILE HA 4 18 ASP H 5.000 . 5.500 4.949 4.900 5.018 . 0 0 "[ . 1 .]" 1 2744 4 16 ILE HA 4 17 ASP H 2.500 . 3.000 2.168 2.149 2.188 . 0 0 "[ . 1 .]" 1 2745 4 16 ILE H 4 16 ILE HB 3.000 . 3.500 2.844 2.734 2.993 . 0 0 "[ . 1 .]" 1 2746 4 16 ILE HB 4 18 ASP H 6.000 . 6.500 4.093 3.972 4.183 . 0 0 "[ . 1 .]" 1 2747 4 16 ILE HB 4 17 ASP H 4.000 . 4.500 4.090 3.912 4.238 . 0 0 "[ . 1 .]" 1 2748 4 16 ILE H 4 16 ILE MG 4.000 . 4.500 3.904 3.868 3.928 . 0 0 "[ . 1 .]" 1 2749 4 16 ILE MG 4 18 ASP H 4.000 . 4.500 3.931 3.595 4.494 . 0 0 "[ . 1 .]" 1 2750 4 15 TYR H 4 16 ILE MG 5.000 . 5.500 5.707 5.604 5.790 0.290 4 0 "[ . 1 .]" 1 2751 4 16 ILE MG 4 17 ASP H 3.000 . 3.500 2.654 2.467 2.818 . 0 0 "[ . 1 .]" 1 2752 4 16 ILE H 4 16 ILE QG 4.000 . 4.500 2.686 2.399 3.148 . 0 0 "[ . 1 .]" 1 2753 4 16 ILE QG 4 18 ASP H 5.000 . 5.500 5.725 5.586 5.815 0.315 13 0 "[ . 1 .]" 1 2754 4 16 ILE QG 4 17 ASP H 4.000 . 4.500 4.372 4.257 4.739 0.239 6 0 "[ . 1 .]" 1 2755 4 16 ILE H 4 18 ASP H 5.000 . 5.500 4.726 4.579 4.879 . 0 0 "[ . 1 .]" 1 2756 4 15 TYR H 4 16 ILE H 4.000 . 4.500 4.299 4.223 4.423 . 0 0 "[ . 1 .]" 1 2757 4 16 ILE H 4 17 ASP H 4.000 . 4.500 4.242 4.174 4.312 . 0 0 "[ . 1 .]" 1 2758 4 16 ILE HA 4 17 ASP HA 5.000 . 5.500 4.357 4.331 4.384 . 0 0 "[ . 1 .]" 1 2759 4 17 ASP HA 4 17 ASP QB 2.500 . 3.000 2.347 2.184 2.381 . 0 0 "[ . 1 .]" 1 2760 4 16 ILE HB 4 17 ASP HA 6.000 . 6.500 4.961 4.854 5.091 . 0 0 "[ . 1 .]" 1 2761 4 16 ILE MG 4 17 ASP HA 5.000 . 5.500 4.294 4.149 4.546 . 0 0 "[ . 1 .]" 1 2762 4 16 ILE MD 4 17 ASP HA 6.000 . 6.500 6.286 5.725 6.516 0.016 11 0 "[ . 1 .]" 1 2763 4 16 ILE MG 4 17 ASP QB 4.000 . 4.500 4.019 3.832 4.502 0.002 12 0 "[ . 1 .]" 1 2764 4 16 ILE H 4 17 ASP HA 4.000 . 4.500 4.650 4.590 4.727 0.227 6 0 "[ . 1 .]" 1 2765 4 17 ASP HA 4 18 ASP H 3.000 . 3.500 2.291 2.278 2.305 . 0 0 "[ . 1 .]" 1 2766 4 17 ASP H 4 17 ASP HA 3.000 . 3.500 2.869 2.836 2.893 . 0 0 "[ . 1 .]" 1 2767 4 17 ASP QB 4 18 ASP H 4.000 . 4.500 3.987 3.793 4.033 . 0 0 "[ . 1 .]" 1 2768 4 17 ASP H 4 17 ASP QB 3.000 . 3.500 2.345 2.269 2.723 . 0 0 "[ . 1 .]" 1 2769 4 18 ASP HA 4 18 ASP QB 2.500 . 3.000 2.248 2.180 2.447 . 0 0 "[ . 1 .]" 1 2770 4 16 ILE MG 4 18 ASP QB 4.000 . 4.500 3.638 2.869 4.598 0.098 14 0 "[ . 1 .]" 1 2771 4 18 ASP H 4 18 ASP HA 2.500 . 3.000 2.879 2.301 2.964 . 0 0 "[ . 1 .]" 1 2772 4 18 ASP H 4 18 ASP QB 3.000 . 3.500 2.662 2.331 2.991 . 0 0 "[ . 1 .]" 1 2773 4 17 ASP H 4 18 ASP QB 6.000 . 6.500 5.272 4.940 5.568 . 0 0 "[ . 1 .]" 1 2774 4 17 ASP H 4 18 ASP H 4.000 . 4.500 4.006 3.960 4.068 . 0 0 "[ . 1 .]" 1 2775 3 35 MET ME 4 13 PHE H 4.500 . 5.000 4.707 4.559 4.944 . 0 0 "[ . 1 .]" 1 2776 3 37 LEU MD2 4 15 TYR H 4.500 . 5.000 5.072 5.020 5.134 0.134 7 0 "[ . 1 .]" 1 2777 3 40 THR HB 4 14 GLU HA 4.000 . 4.500 4.344 4.199 4.485 . 0 0 "[ . 1 .]" 1 2778 3 40 THR HB 4 14 GLU QB 4.000 . 4.500 3.901 3.471 4.606 0.106 10 0 "[ . 1 .]" 1 2779 3 40 THR HB 4 14 GLU QG 4.500 . 5.000 3.944 2.426 5.057 0.057 2 0 "[ . 1 .]" 1 2780 3 40 THR HA 4 16 ILE MG 6.000 . 6.500 5.608 5.398 5.874 . 0 0 "[ . 1 .]" 1 2781 3 40 THR HB 4 16 ILE MG 4.000 . 4.500 4.515 4.348 4.591 0.091 7 0 "[ . 1 .]" 1 2782 3 40 THR HB 4 16 ILE HA 4.000 . 4.500 4.476 4.370 4.532 0.032 9 0 "[ . 1 .]" 1 2783 3 40 THR HB 4 16 ILE QG 4.000 . 4.500 3.247 2.898 4.539 0.039 6 0 "[ . 1 .]" 1 2784 3 40 THR MG 4 16 ILE QG 6.000 . 6.500 3.401 2.930 4.595 . 0 0 "[ . 1 .]" 1 2785 3 40 THR HB 4 16 ILE MD 4.000 . 4.500 4.146 2.459 4.634 0.134 3 0 "[ . 1 .]" 1 2786 3 40 THR MG 4 16 ILE MD 4.000 . 4.500 4.177 2.663 4.576 0.076 13 0 "[ . 1 .]" 1 2787 3 40 THR HA 4 15 TYR H 5.000 . 5.500 3.746 3.593 3.950 . 0 0 "[ . 1 .]" 1 2788 3 40 THR HB 4 15 TYR H 5.000 . 5.500 3.406 3.340 3.506 . 0 0 "[ . 1 .]" 1 2789 3 40 THR MG 4 16 ILE H 5.000 . 5.500 5.541 5.453 5.608 0.108 9 0 "[ . 1 .]" 1 2790 3 40 THR MG 4 15 TYR H 4.000 . 4.500 4.483 4.405 4.546 0.046 4 0 "[ . 1 .]" 1 2791 3 40 THR MG 4 17 ASP H 5.000 . 5.500 4.643 4.486 4.787 . 0 0 "[ . 1 .]" 1 2792 3 40 THR HA 4 16 ILE HA 5.000 . 5.500 4.894 4.712 5.249 . 0 0 "[ . 1 .]" 1 2793 3 41 THR MG 4 12 PRO HA 4.000 . 4.500 4.060 3.902 4.191 . 0 0 "[ . 1 .]" 1 2794 3 41 THR MG 4 12 PRO QB 3.000 . 3.500 2.949 2.749 3.057 . 0 0 "[ . 1 .]" 1 2795 3 41 THR MG 4 12 PRO QG 4.000 . 4.500 4.392 4.112 4.522 0.022 4 0 "[ . 1 .]" 1 2796 3 41 THR MG 4 13 PHE HA 5.000 . 5.500 3.908 3.646 4.119 . 0 0 "[ . 1 .]" 1 2797 3 41 THR HA 4 14 GLU HA 3.000 . 3.500 2.205 2.103 2.382 . 0 0 "[ . 1 .]" 1 2798 3 41 THR HB 4 14 GLU HA 5.000 . 5.500 4.998 4.816 5.221 . 0 0 "[ . 1 .]" 1 2799 3 41 THR MG 4 14 GLU HA 3.500 . 4.000 3.358 3.121 3.584 . 0 0 "[ . 1 .]" 1 2800 3 41 THR HA 4 14 GLU QB 4.000 . 4.500 4.168 3.761 4.403 . 0 0 "[ . 1 .]" 1 2801 3 41 THR HA 4 14 GLU QG 4.500 . 5.000 3.570 3.285 5.130 0.130 2 0 "[ . 1 .]" 1 2802 3 41 THR MG 4 14 GLU QG 6.000 . 6.500 3.783 3.157 5.448 . 0 0 "[ . 1 .]" 1 2803 3 41 THR HA 4 13 PHE H 4.500 . 5.000 4.511 4.414 4.626 . 0 0 "[ . 1 .]" 1 2804 3 41 THR HA 4 15 TYR H 4.000 . 4.500 2.969 2.841 3.098 . 0 0 "[ . 1 .]" 1 2805 3 41 THR HB 4 13 PHE H 5.500 . 6.000 5.987 5.814 6.055 0.055 6 0 "[ . 1 .]" 1 2806 3 41 THR MG 4 13 PHE H 4.000 . 4.500 3.080 2.960 3.189 . 0 0 "[ . 1 .]" 1 2807 3 41 THR MG 4 14 GLU H 5.000 . 5.500 4.433 4.115 4.693 . 0 0 "[ . 1 .]" 1 2808 3 41 THR MG 4 15 TYR H 4.500 . 5.000 4.705 4.582 4.836 . 0 0 "[ . 1 .]" 1 2809 3 42 VAL H 4 13 PHE H 4.000 . 4.500 3.053 2.945 3.144 . 0 0 "[ . 1 .]" 1 2810 3 42 VAL H 4 14 GLU H 5.000 . 5.500 4.868 4.791 4.938 . 0 0 "[ . 1 .]" 1 2811 3 42 VAL H 4 15 TYR H 4.000 . 4.500 3.815 3.627 3.922 . 0 0 "[ . 1 .]" 1 2812 3 42 VAL HA 4 13 PHE H 5.000 . 5.500 4.909 4.801 5.050 . 0 0 "[ . 1 .]" 1 2813 3 42 VAL HB 4 13 PHE H 4.000 . 4.500 3.498 3.370 3.629 . 0 0 "[ . 1 .]" 1 2814 3 42 VAL HB 4 15 TYR H 5.000 . 5.500 5.098 4.964 5.253 . 0 0 "[ . 1 .]" 1 2815 3 42 VAL QG 4 13 PHE H 4.000 . 4.500 4.013 3.943 4.099 . 0 0 "[ . 1 .]" 1 2816 3 42 VAL QG 4 14 GLU H 5.000 . 5.500 5.546 5.522 5.613 0.113 9 0 "[ . 1 .]" 1 2817 3 42 VAL QG 4 16 ILE H 5.000 . 5.500 5.383 5.123 5.555 0.055 15 0 "[ . 1 .]" 1 2818 3 42 VAL QG 4 15 TYR H 4.000 . 4.500 3.429 3.367 3.570 . 0 0 "[ . 1 .]" 1 2819 3 43 THR HA 4 12 PRO HA 4.000 . 4.500 2.401 2.029 2.671 . 0 0 "[ . 1 .]" 1 2820 3 43 THR HA 4 12 PRO QB 4.000 . 4.500 2.808 2.246 3.249 . 0 0 "[ . 1 .]" 1 2821 3 43 THR HA 4 12 PRO QG 4.000 . 4.500 3.828 2.841 4.523 0.023 7 0 "[ . 1 .]" 1 2822 3 43 THR HA 4 13 PHE H 4.000 . 4.500 3.827 3.505 4.007 . 0 0 "[ . 1 .]" 1 2823 3 43 THR MG 4 13 PHE H 5.000 . 5.500 4.212 3.713 5.163 . 0 0 "[ . 1 .]" 1 2824 3 44 PRO QD 4 11 GLU HA 5.000 . 5.500 3.563 3.343 4.107 . 0 0 "[ . 1 .]" 1 2825 3 44 PRO QD 4 12 PRO QD 4.000 . 4.500 2.912 2.338 3.648 . 0 0 "[ . 1 .]" 1 2826 3 46 LYS HA 4 9 PRO QB 5.000 . 5.500 3.612 3.118 4.251 . 0 0 "[ . 1 .]" 1 2827 3 46 LYS HA 4 9 PRO QG 4.000 . 4.500 3.204 2.237 3.653 . 0 0 "[ . 1 .]" 1 2828 3 46 LYS HA 4 9 PRO QD 5.000 . 5.500 4.906 3.935 5.489 . 0 0 "[ . 1 .]" 1 2829 3 92 CYS HA 4 13 PHE QB 5.000 . 5.500 3.943 3.627 4.070 . 0 0 "[ . 1 .]" 1 2830 3 93 PRO QD 4 13 PHE QB 6.000 . 6.500 5.285 4.945 5.457 . 0 0 "[ . 1 .]" 1 2831 3 94 SER QB 4 10 PRO HA 5.000 . 5.500 5.006 4.252 5.514 0.014 10 0 "[ . 1 .]" 1 2832 3 94 SER QB 4 11 GLU HG3 5.000 . 5.500 5.361 4.628 5.550 0.050 6 0 "[ . 1 .]" 1 2833 3 94 SER QB 4 11 GLU HG2 5.000 . 5.500 4.474 3.773 5.249 . 0 0 "[ . 1 .]" 1 2834 3 95 GLY QA 4 10 PRO QB 4.000 . 4.500 3.973 3.325 4.470 . 0 0 "[ . 1 .]" 1 2835 3 95 GLY QA 4 10 PRO QG 5.000 . 5.500 4.232 3.462 5.156 . 0 0 "[ . 1 .]" 1 2836 3 110 PHE QE 4 15 TYR HA 6.000 . 6.500 5.456 5.097 5.740 . 0 0 "[ . 1 .]" 1 2837 3 110 PHE QE 4 15 TYR QD 4.000 . 4.500 3.215 2.899 3.395 . 0 0 "[ . 1 .]" 1 2838 3 112 TRP HH2 4 8 GLU HA 5.000 . 5.500 4.984 3.915 5.491 . 0 0 "[ . 1 .]" 1 2839 3 112 TRP HZ2 4 9 PRO HA 5.000 . 5.500 4.498 3.920 4.941 . 0 0 "[ . 1 .]" 1 2840 3 112 TRP HH2 4 9 PRO HA 5.000 . 5.500 3.934 3.455 4.455 . 0 0 "[ . 1 .]" 1 2841 3 112 TRP HZ2 4 9 PRO QB 4.000 . 4.500 3.589 2.818 4.502 0.002 10 0 "[ . 1 .]" 1 2842 3 112 TRP HH2 4 9 PRO QB 5.000 . 5.500 3.911 2.757 5.143 . 0 0 "[ . 1 .]" 1 2843 3 112 TRP HZ2 4 9 PRO QG 4.000 . 4.500 3.969 2.453 4.533 0.033 15 0 "[ . 1 .]" 1 2844 3 112 TRP HH2 4 9 PRO QG 4.000 . 4.500 3.827 2.671 4.523 0.023 1 0 "[ . 1 .]" 1 2845 3 112 TRP HZ2 4 9 PRO QD 5.000 . 5.500 5.070 4.264 5.562 0.062 10 0 "[ . 1 .]" 1 2846 3 112 TRP HH2 4 9 PRO QD 4.000 . 4.500 3.911 3.233 4.468 . 0 0 "[ . 1 .]" 1 2847 3 112 TRP QB 4 10 PRO QG 4.000 . 4.500 2.237 1.921 3.134 . 0 0 "[ . 1 .]" 1 2848 3 112 TRP HE3 4 7 PRO QB 5.000 . 5.500 4.844 4.243 5.295 . 0 0 "[ . 1 .]" 1 2849 3 112 TRP HE3 4 7 PRO QG 5.000 . 5.500 4.482 4.115 5.509 0.009 3 0 "[ . 1 .]" 1 2850 3 112 TRP HE3 4 9 PRO HA 5.000 . 5.500 3.651 2.882 4.485 . 0 0 "[ . 1 .]" 1 2851 3 112 TRP HE3 4 10 PRO QD 4.000 . 4.500 2.851 2.519 3.520 . 0 0 "[ . 1 .]" 1 2852 3 112 TRP HZ3 4 7 PRO HA 6.000 . 6.500 5.956 5.587 6.316 . 0 0 "[ . 1 .]" 1 2853 3 112 TRP HZ3 4 7 PRO QB 4.000 . 4.500 4.045 3.221 4.537 0.037 4 0 "[ . 1 .]" 1 2854 3 112 TRP HZ3 4 7 PRO QG 4.000 . 4.500 3.382 2.705 4.679 0.179 6 0 "[ . 1 .]" 1 2855 3 112 TRP HZ3 4 9 PRO HA 5.000 . 5.500 3.469 2.881 4.286 . 0 0 "[ . 1 .]" 1 2856 3 116 PRO QB 4 5 GLN QB 5.500 . 6.000 4.729 2.012 6.024 0.024 1 0 "[ . 1 .]" 1 2857 3 116 PRO QG 4 5 GLN QB 6.000 . 6.500 5.252 3.380 6.214 . 0 0 "[ . 1 .]" 1 2858 3 116 PRO QG 4 5 GLN HA 4.500 . 5.000 4.485 2.033 5.121 0.121 5 0 "[ . 1 .]" 1 2859 3 116 PRO QB 4 5 GLN HA 4.500 . 5.000 4.019 2.042 5.027 0.027 8 0 "[ . 1 .]" 1 2860 3 116 PRO HA 4 6 GLU HA 5.000 . 5.500 3.941 2.142 5.471 . 0 0 "[ . 1 .]" 1 2861 3 116 PRO QB 4 6 GLU HA 4.000 . 4.500 3.245 2.344 4.575 0.075 12 0 "[ . 1 .]" 1 2862 3 116 PRO QG 4 6 GLU HA 3.500 . 4.000 3.959 3.111 4.290 0.290 6 0 "[ . 1 .]" 1 2863 3 116 PRO QD 4 6 GLU HA 6.000 . 6.500 3.715 3.303 4.249 . 0 0 "[ . 1 .]" 1 2864 3 116 PRO QG 4 6 GLU QB 6.000 . 6.500 5.278 4.416 5.721 . 0 0 "[ . 1 .]" 1 2865 3 116 PRO QB 4 6 GLU QB 5.000 . 5.500 4.885 3.915 5.515 0.015 8 0 "[ . 1 .]" 1 2866 3 116 PRO QB 4 6 GLU QG 5.000 . 5.500 4.159 2.369 5.098 . 0 0 "[ . 1 .]" 1 2867 3 116 PRO QG 4 6 GLU QG 4.000 . 4.500 3.919 2.789 4.549 0.049 3 0 "[ . 1 .]" 1 2868 3 31 ARG QD 4 6 GLU QG 5.000 . 5.500 4.326 3.375 5.245 . 0 0 "[ . 1 .]" 1 2869 3 48 LYS QE 4 6 GLU QG 5.000 . 5.500 5.458 4.723 5.642 0.142 1 0 "[ . 1 .]" 1 2870 3 48 LYS QE 4 6 GLU QB 5.000 . 5.500 4.363 3.840 5.163 . 0 0 "[ . 1 .]" 1 2871 3 31 ARG QD 4 6 GLU QB 6.000 . 6.500 5.359 4.803 6.425 . 0 0 "[ . 1 .]" 1 2872 3 116 PRO QB 4 7 PRO QD 6.000 . 6.500 2.864 2.081 3.707 . 0 0 "[ . 1 .]" 1 2873 3 116 PRO QG 4 7 PRO QD 5.000 . 5.500 3.906 3.164 4.637 . 0 0 "[ . 1 .]" 1 2874 3 35 MET ME 4 9 PRO QB 6.000 . 6.500 5.342 4.511 6.420 . 0 0 "[ . 1 .]" 1 2875 3 44 PRO QG 4 9 PRO QB 4.000 . 4.500 3.330 2.719 4.284 . 0 0 "[ . 1 .]" 1 2876 3 44 PRO QG 4 9 PRO QG 5.000 . 5.500 4.687 3.981 5.439 . 0 0 "[ . 1 .]" 1 2877 3 46 LYS QG 4 9 PRO QG 5.000 . 5.500 2.841 2.027 4.018 . 0 0 "[ . 1 .]" 1 2878 3 46 LYS QD 4 9 PRO QG 5.000 . 5.500 2.852 1.935 3.787 . 0 0 "[ . 1 .]" 1 2879 3 46 LYS QD 4 9 PRO QD 6.000 . 6.500 4.454 2.656 5.495 . 0 0 "[ . 1 .]" 1 2880 3 46 LYS QE 4 9 PRO QG 5.000 . 5.500 2.818 2.027 4.470 . 0 0 "[ . 1 .]" 1 2881 3 95 GLY H 4 10 PRO QB 5.000 . 5.500 4.643 4.171 5.391 . 0 0 "[ . 1 .]" 1 2882 3 35 MET ME 4 10 PRO HA 5.500 . 6.000 5.632 5.214 6.180 0.180 4 0 "[ . 1 .]" 1 2883 3 35 MET ME 4 10 PRO QG 3.000 . 3.500 2.771 2.204 3.302 . 0 0 "[ . 1 .]" 1 2884 3 35 MET ME 4 10 PRO QD 5.000 . 5.500 3.754 3.315 4.918 . 0 0 "[ . 1 .]" 1 2885 3 35 MET ME 4 10 PRO QB 5.000 . 5.500 3.269 2.631 4.153 . 0 0 "[ . 1 .]" 1 2886 3 44 PRO QG 4 10 PRO QD 5.000 . 5.500 3.134 2.559 4.110 . 0 0 "[ . 1 .]" 1 2887 3 97 VAL QG 4 10 PRO QG 4.000 . 4.500 2.521 1.896 3.243 . 0 0 "[ . 1 .]" 1 2888 3 97 VAL QG 4 10 PRO QB 5.000 . 5.500 2.950 2.549 3.486 . 0 0 "[ . 1 .]" 1 2889 3 97 VAL QG 4 10 PRO QD 6.000 . 6.500 3.989 3.447 4.785 . 0 0 "[ . 1 .]" 1 2890 3 97 VAL QG 4 10 PRO HA 6.000 . 6.500 4.913 4.400 5.552 . 0 0 "[ . 1 .]" 1 2891 3 35 MET ME 4 12 PRO HA 4.000 . 4.500 4.223 4.041 4.370 . 0 0 "[ . 1 .]" 1 2892 3 44 PRO QG 4 12 PRO HA 5.000 . 5.500 4.165 3.556 4.462 . 0 0 "[ . 1 .]" 1 2893 3 44 PRO QD 4 12 PRO HA 3.500 . 4.000 2.489 2.030 2.723 . 0 0 "[ . 1 .]" 1 2894 3 43 THR HB 4 12 PRO HA 4.000 . 4.500 4.667 4.564 4.844 0.344 5 0 "[ . 1 .]" 1 2895 3 43 THR MG 4 12 PRO HA 5.000 . 5.500 3.330 3.049 3.606 . 0 0 "[ . 1 .]" 1 2896 3 42 VAL QG 4 12 PRO HA 6.000 . 6.500 4.404 4.251 4.605 . 0 0 "[ . 1 .]" 1 2897 3 35 MET ME 4 12 PRO QB 5.000 . 5.500 5.392 5.027 5.692 0.192 8 0 "[ . 1 .]" 1 2898 3 44 PRO QD 4 12 PRO QB 4.000 . 4.500 3.301 2.513 3.825 . 0 0 "[ . 1 .]" 1 2899 3 43 THR HB 4 12 PRO QB 6.000 . 6.500 3.796 3.279 4.440 . 0 0 "[ . 1 .]" 1 2900 3 43 THR MG 4 12 PRO QB 4.000 . 4.500 2.282 1.938 3.249 . 0 0 "[ . 1 .]" 1 2901 3 44 PRO QD 4 12 PRO QG 3.500 . 4.000 3.361 2.484 4.108 0.108 3 0 "[ . 1 .]" 1 2902 3 43 THR HB 4 12 PRO QG 6.000 . 6.500 4.304 3.270 5.503 . 0 0 "[ . 1 .]" 1 2903 3 43 THR MG 4 12 PRO QG 3.500 . 4.000 2.924 1.975 3.878 . 0 0 "[ . 1 .]" 1 2904 3 43 THR MG 4 12 PRO QD 5.000 . 5.500 3.950 2.734 4.504 . 0 0 "[ . 1 .]" 1 2905 3 42 VAL H 4 12 PRO HA 5.000 . 5.500 4.761 4.606 4.896 . 0 0 "[ . 1 .]" 1 2906 3 35 MET ME 4 13 PHE QD 3.500 . 4.000 3.642 3.365 3.904 . 0 0 "[ . 1 .]" 1 2907 3 91 GLN QB 4 13 PHE QD 6.000 . 6.500 2.530 2.096 3.040 . 0 0 "[ . 1 .]" 1 2908 3 42 VAL HB 4 13 PHE QD 5.000 . 5.500 3.696 3.562 3.852 . 0 0 "[ . 1 .]" 1 2909 3 42 VAL QG 4 13 PHE QD 5.000 . 5.500 3.725 3.638 3.870 . 0 0 "[ . 1 .]" 1 2910 3 89 VAL QG 4 13 PHE QD 5.000 . 5.500 4.099 3.925 4.319 . 0 0 "[ . 1 .]" 1 2911 3 97 VAL QG 4 13 PHE QD 5.000 . 5.500 4.166 3.973 4.428 . 0 0 "[ . 1 .]" 1 2912 3 110 PHE QE 4 13 PHE QE 4.000 . 4.500 4.503 4.174 4.576 0.076 13 0 "[ . 1 .]" 1 2913 3 35 MET ME 4 13 PHE QE 3.000 . 3.500 2.026 1.798 2.298 0.002 8 0 "[ . 1 .]" 1 2914 3 35 MET QB 4 13 PHE QE 6.000 . 6.500 4.781 4.393 5.101 . 0 0 "[ . 1 .]" 1 2915 3 91 GLN QB 4 13 PHE QE 5.000 . 5.500 2.708 2.444 3.053 . 0 0 "[ . 1 .]" 1 2916 3 42 VAL HB 4 13 PHE QE 5.000 . 5.500 3.065 2.903 3.282 . 0 0 "[ . 1 .]" 1 2917 3 89 VAL HB 4 13 PHE QE 5.000 . 5.500 4.402 4.109 4.611 . 0 0 "[ . 1 .]" 1 2918 3 42 VAL QG 4 13 PHE QE 4.000 . 4.500 2.629 2.459 2.913 . 0 0 "[ . 1 .]" 1 2919 3 89 VAL QG 4 13 PHE QE 4.000 . 4.500 2.506 2.321 2.736 . 0 0 "[ . 1 .]" 1 2920 3 97 VAL QG 4 13 PHE QE 4.000 . 4.500 2.787 2.627 2.996 . 0 0 "[ . 1 .]" 1 2921 3 35 MET ME 4 13 PHE HZ 4.500 . 5.000 3.492 2.876 3.960 . 0 0 "[ . 1 .]" 1 2922 3 42 VAL HB 4 13 PHE HZ 6.000 . 6.500 3.075 2.963 3.345 . 0 0 "[ . 1 .]" 1 2923 3 89 VAL HB 4 13 PHE HZ 6.000 . 6.500 3.920 3.631 4.137 . 0 0 "[ . 1 .]" 1 2924 3 42 VAL QG 4 13 PHE HZ 4.000 . 4.500 2.625 2.436 2.864 . 0 0 "[ . 1 .]" 1 2925 3 89 VAL QG 4 13 PHE HZ 4.000 . 4.500 2.734 2.342 3.317 . 0 0 "[ . 1 .]" 1 2926 3 37 LEU QD 4 13 PHE HZ 6.000 . 6.500 5.424 5.197 5.642 . 0 0 "[ . 1 .]" 1 2927 3 97 VAL QG 4 13 PHE HZ 4.000 . 4.500 2.627 2.246 2.864 . 0 0 "[ . 1 .]" 1 2928 3 42 VAL H 4 13 PHE HA 5.000 . 5.500 4.816 4.777 4.869 . 0 0 "[ . 1 .]" 1 2929 3 92 CYS H 4 13 PHE QD 5.000 . 5.500 4.423 4.202 4.684 . 0 0 "[ . 1 .]" 1 2930 3 42 VAL H 4 13 PHE QD 4.000 . 4.500 4.275 4.156 4.400 . 0 0 "[ . 1 .]" 1 2931 3 92 CYS H 4 13 PHE QE 4.000 . 4.500 4.516 4.241 4.638 0.138 3 0 "[ . 1 .]" 1 2932 3 42 VAL H 4 13 PHE QE 5.000 . 5.500 4.590 4.434 4.764 . 0 0 "[ . 1 .]" 1 2933 3 40 THR MG 4 14 GLU HA 6.000 . 6.500 5.613 5.512 5.707 . 0 0 "[ . 1 .]" 1 2934 3 42 VAL QG 4 14 GLU HA 5.000 . 5.500 4.227 4.164 4.334 . 0 0 "[ . 1 .]" 1 2935 3 37 LEU QD 4 14 GLU HA 6.000 . 6.500 4.652 4.510 5.233 . 0 0 "[ . 1 .]" 1 2936 3 40 THR MG 4 14 GLU QB 6.000 . 6.500 5.096 4.787 5.624 . 0 0 "[ . 1 .]" 1 2937 3 40 THR MG 4 14 GLU QG 6.000 . 6.500 5.122 3.794 5.902 . 0 0 "[ . 1 .]" 1 2938 3 41 THR H 4 14 GLU HA 5.000 . 5.500 4.769 4.676 4.869 . 0 0 "[ . 1 .]" 1 2939 3 42 VAL H 4 14 GLU HA 4.000 . 4.500 3.312 3.148 3.498 . 0 0 "[ . 1 .]" 1 2940 3 42 VAL H 4 14 GLU QB 5.000 . 5.500 5.249 4.975 5.401 . 0 0 "[ . 1 .]" 1 2941 3 42 VAL H 4 14 GLU QG 6.000 . 6.500 4.907 4.639 5.713 . 0 0 "[ . 1 .]" 1 2942 3 110 PHE HZ 4 15 TYR QD 4.000 . 4.500 2.672 2.252 3.081 . 0 0 "[ . 1 .]" 1 2943 3 37 LEU QD 4 15 TYR QD 3.000 . 3.500 1.974 1.798 2.197 0.002 4 0 "[ . 1 .]" 1 2944 3 42 VAL QG 4 15 TYR QD 3.000 . 3.500 3.086 2.793 3.288 . 0 0 "[ . 1 .]" 1 2945 3 99 VAL QG 4 15 TYR QD 5.000 . 5.500 4.362 4.200 4.498 . 0 0 "[ . 1 .]" 1 2946 3 89 VAL QG 4 15 TYR QD 3.000 . 3.500 2.764 2.515 3.333 . 0 0 "[ . 1 .]" 1 2947 3 40 THR MG 4 15 TYR HA 6.000 . 6.500 5.861 5.783 5.946 . 0 0 "[ . 1 .]" 1 2948 3 42 VAL QG 4 15 TYR HA 5.000 . 5.500 4.030 3.836 4.232 . 0 0 "[ . 1 .]" 1 2949 3 89 VAL QG 4 15 TYR HA 6.000 . 6.500 4.080 3.731 4.505 . 0 0 "[ . 1 .]" 1 2950 3 37 LEU QD 4 15 TYR HA 5.000 . 5.500 4.784 4.517 5.044 . 0 0 "[ . 1 .]" 1 2951 3 40 THR MG 4 15 TYR QB 6.000 . 6.500 4.840 4.582 4.982 . 0 0 "[ . 1 .]" 1 2952 3 42 VAL QG 4 15 TYR QB 4.000 . 4.500 1.895 1.792 2.024 0.008 3 0 "[ . 1 .]" 1 2953 3 89 VAL QG 4 15 TYR QB 6.000 . 6.500 3.422 2.949 3.923 . 0 0 "[ . 1 .]" 1 2954 3 37 LEU QD 4 15 TYR QB 4.000 . 4.500 2.460 2.144 2.746 . 0 0 "[ . 1 .]" 1 2955 3 40 THR HA 4 15 TYR QD 5.000 . 5.500 4.003 3.641 4.417 . 0 0 "[ . 1 .]" 1 2956 3 40 THR MG 4 15 TYR QD 5.000 . 5.500 4.642 4.369 4.876 . 0 0 "[ . 1 .]" 1 2957 3 108 ARG QD 4 15 TYR QD 5.000 . 5.500 5.198 4.644 5.602 0.102 8 0 "[ . 1 .]" 1 2958 3 108 ARG QB 4 15 TYR QE 5.000 . 5.500 3.936 3.342 4.517 . 0 0 "[ . 1 .]" 1 2959 3 108 ARG QG 4 15 TYR QE 5.000 . 5.500 4.228 2.842 5.102 . 0 0 "[ . 1 .]" 1 2960 3 108 ARG QD 4 15 TYR QE 5.000 . 5.500 3.295 2.734 3.876 . 0 0 "[ . 1 .]" 1 2961 3 40 THR HA 4 15 TYR QE 6.000 . 6.500 5.774 5.499 5.997 . 0 0 "[ . 1 .]" 1 2962 3 40 THR MG 4 15 TYR QE 5.000 . 5.500 5.591 5.542 5.655 0.155 7 0 "[ . 1 .]" 1 2963 3 42 VAL QG 4 15 TYR QE 4.000 . 4.500 4.477 4.344 4.587 0.087 8 0 "[ . 1 .]" 1 2964 3 89 VAL QG 4 15 TYR QE 4.000 . 4.500 3.287 2.871 3.825 . 0 0 "[ . 1 .]" 1 2965 3 99 VAL QG 4 15 TYR QE 4.000 . 4.500 3.460 3.058 3.775 . 0 0 "[ . 1 .]" 1 2966 3 37 LEU QD 4 15 TYR QE 4.000 . 4.500 2.945 2.658 3.222 . 0 0 "[ . 1 .]" 1 2967 3 110 PHE QE 4 15 TYR QE 4.000 . 4.500 3.349 2.700 3.707 . 0 0 "[ . 1 .]" 1 2968 3 91 GLN QE 4 15 TYR HA 4.500 . 5.000 3.283 2.454 4.177 . 0 0 "[ . 1 .]" 1 2969 3 40 THR MG 4 16 ILE HA 5.000 . 5.500 3.561 3.508 3.695 . 0 0 "[ . 1 .]" 1 2970 3 40 THR MG 4 16 ILE HB 6.000 . 6.500 5.563 5.390 5.794 . 0 0 "[ . 1 .]" 1 2971 3 91 GLN QE 4 16 ILE HB 4.500 . 5.000 3.419 3.233 3.845 . 0 0 "[ . 1 .]" 1 2972 3 91 GLN QE 4 16 ILE MG 4.000 . 4.500 4.548 4.516 4.587 0.087 10 0 "[ . 1 .]" 1 2973 3 91 GLN QE 4 16 ILE H 4.500 . 5.000 2.274 1.765 2.971 0.035 3 0 "[ . 1 .]" 1 2974 3 91 GLN QG 4 16 ILE MD 4.000 . 4.500 4.372 3.272 4.694 0.194 3 0 "[ . 1 .]" 1 2975 3 91 GLN QG 4 13 PHE QE 4.000 . 4.500 3.665 2.937 4.476 . 0 0 "[ . 1 .]" 1 2976 3 91 GLN QG 4 13 PHE QD 4.000 . 4.500 3.700 2.893 4.516 0.016 12 0 "[ . 1 .]" 1 2977 3 91 GLN QG 4 15 TYR HA 4.000 . 4.500 2.555 2.066 4.375 . 0 0 "[ . 1 .]" 1 2978 3 101 LYS QG 4 15 TYR QE 6.000 . 6.500 6.639 6.553 6.681 0.181 15 0 "[ . 1 .]" 1 2979 3 101 LYS QD 4 15 TYR QE 5.500 . 6.000 5.762 5.580 5.887 . 0 0 "[ . 1 .]" 1 2980 3 91 GLN HA 4 13 PHE QE 6.000 . 6.500 5.569 5.279 5.962 . 0 0 "[ . 1 .]" 1 2981 3 91 GLN HA 4 13 PHE QD 6.000 . 6.500 5.198 4.787 5.685 . 0 0 "[ . 1 .]" 1 2982 1 70 VAL QG 3 60 LEU MD1 2.500 . 3.000 1.767 1.742 1.784 0.058 12 0 "[ . 1 .]" 1 2983 1 70 VAL QG 3 60 LEU MD2 2.500 . 3.000 1.865 1.777 1.955 0.023 13 0 "[ . 1 .]" 1 2984 1 70 VAL HB 3 60 LEU MD1 4.000 . 4.500 3.398 3.079 3.745 . 0 0 "[ . 1 .]" 1 2985 1 70 VAL HB 3 60 LEU MD2 4.000 . 4.500 4.191 3.942 4.388 . 0 0 "[ . 1 .]" 1 2986 1 70 VAL HA 3 60 LEU MD1 4.000 . 4.500 4.603 4.545 4.699 0.199 4 0 "[ . 1 .]" 1 2987 1 70 VAL HA 3 60 LEU MD2 4.000 . 4.500 4.312 4.124 4.474 . 0 0 "[ . 1 .]" 1 2988 1 42 ARG QB 3 60 LEU MD1 5.000 . 5.500 4.207 3.873 4.375 . 0 0 "[ . 1 .]" 1 2989 1 42 ARG QB 3 60 LEU MD2 5.000 . 5.500 5.301 5.064 5.449 . 0 0 "[ . 1 .]" 1 2990 1 49 GLN QG 3 60 LEU MD1 6.000 . 6.500 5.239 4.904 5.377 . 0 0 "[ . 1 .]" 1 2991 1 49 GLN QG 3 60 LEU MD2 6.000 . 6.500 6.480 6.297 6.573 0.073 13 0 "[ . 1 .]" 1 2992 1 42 ARG QD 3 60 LEU QD 6.000 . 6.500 4.315 3.466 5.369 . 0 0 "[ . 1 .]" 1 2993 1 44 ILE QG 3 60 LEU QD 6.000 . 6.500 3.970 3.817 4.174 . 0 0 "[ . 1 .]" 1 2994 1 44 ILE HB 3 60 LEU QD 6.000 . 6.500 4.462 4.284 4.651 . 0 0 "[ . 1 .]" 1 2995 1 44 ILE QG 3 78 ILE MD 4.000 . 4.500 3.331 3.096 3.529 . 0 0 "[ . 1 .]" 1 2996 1 44 ILE HB 3 78 ILE MD 5.500 . 6.000 4.907 4.691 5.052 . 0 0 "[ . 1 .]" 1 2997 1 44 ILE HB 3 78 ILE MG 5.500 . 6.000 4.317 4.120 4.479 . 0 0 "[ . 1 .]" 1 2998 1 47 GLY QA 3 77 LEU HG 5.000 . 5.500 5.493 4.527 5.767 0.267 3 0 "[ . 1 .]" 1 2999 1 47 GLY QA 3 77 LEU MD1 4.000 . 4.500 3.439 2.511 3.707 . 0 0 "[ . 1 .]" 1 3000 1 47 GLY QA 3 77 LEU MD2 4.000 . 4.500 4.566 4.361 4.741 0.241 6 0 "[ . 1 .]" 1 3001 1 48 LYS QB 3 77 LEU MD1 5.500 . 6.000 3.948 2.928 5.928 . 0 0 "[ . 1 .]" 1 3002 1 48 LYS QB 3 77 LEU MD2 5.500 . 6.000 3.051 1.922 5.826 . 0 0 "[ . 1 .]" 1 3003 1 48 LYS QG 3 77 LEU MD1 5.000 . 5.500 3.037 1.925 4.677 . 0 0 "[ . 1 .]" 1 3004 1 48 LYS QG 3 77 LEU MD2 5.000 . 5.500 2.872 1.816 4.944 . 0 0 "[ . 1 .]" 1 3005 1 48 LYS QD 3 77 LEU MD1 4.000 . 4.500 2.836 2.418 4.031 . 0 0 "[ . 1 .]" 1 3006 1 48 LYS QD 3 77 LEU MD2 4.000 . 4.500 3.302 2.239 3.855 . 0 0 "[ . 1 .]" 1 3007 1 48 LYS QE 3 77 LEU MD1 4.000 . 4.500 2.896 2.069 4.198 . 0 0 "[ . 1 .]" 1 3008 1 48 LYS QE 3 77 LEU MD2 4.000 . 4.500 2.849 1.967 3.804 . 0 0 "[ . 1 .]" 1 3009 1 48 LYS HA 3 77 LEU MD1 5.000 . 5.500 4.261 3.809 5.178 . 0 0 "[ . 1 .]" 1 3010 1 48 LYS HA 3 77 LEU MD2 5.000 . 5.500 2.912 2.391 4.905 . 0 0 "[ . 1 .]" 1 3011 1 48 LYS HA 3 79 ILE MD 5.000 . 5.500 4.704 4.457 5.288 . 0 0 "[ . 1 .]" 1 3012 1 48 LYS HA 3 78 ILE MD 5.000 . 5.500 5.073 4.718 5.556 0.056 11 0 "[ . 1 .]" 1 3013 1 44 ILE MG 3 78 ILE MG 3.000 . 3.500 2.882 2.776 3.061 . 0 0 "[ . 1 .]" 1 3014 1 44 ILE MD 3 78 ILE MG 3.000 . 3.500 2.323 2.102 2.508 . 0 0 "[ . 1 .]" 1 3015 1 44 ILE MG 3 78 ILE MD 2.500 . 3.000 3.075 3.017 3.116 0.116 12 0 "[ . 1 .]" 1 3016 1 44 ILE MD 3 78 ILE MD 2.500 . 3.000 2.290 2.069 2.464 . 0 0 "[ . 1 .]" 1 3017 1 70 VAL QG 3 78 ILE MG 4.000 . 4.500 3.715 3.582 3.781 . 0 0 "[ . 1 .]" 1 3018 1 49 GLN QB 3 78 ILE MG 4.000 . 4.500 4.712 4.597 4.783 0.283 4 0 "[ . 1 .]" 1 3019 1 49 GLN QG 3 78 ILE MG 5.000 . 5.500 5.565 5.407 5.671 0.171 14 0 "[ . 1 .]" 1 3020 1 70 VAL QG 3 78 ILE MD 3.000 . 3.500 3.749 3.674 3.815 0.315 12 0 "[ . 1 .]" 1 3021 1 49 GLN QB 3 78 ILE MD 3.000 . 3.500 2.657 2.474 2.805 . 0 0 "[ . 1 .]" 1 3022 1 49 GLN QG 3 78 ILE MD 4.000 . 4.500 3.940 3.528 4.229 . 0 0 "[ . 1 .]" 1 3023 1 48 LYS QG 3 79 ILE MD 6.000 . 6.500 4.674 4.000 5.625 . 0 0 "[ . 1 .]" 1 3024 1 48 LYS QD 3 79 ILE MD 5.500 . 6.000 4.891 4.173 6.034 0.034 4 0 "[ . 1 .]" 1 3025 1 48 LYS QE 3 79 ILE MD 5.000 . 5.500 5.852 5.619 5.998 0.498 12 0 "[ . 1 .]" 1 3026 1 47 GLY QA 3 79 ILE MD 4.000 . 4.500 1.884 1.838 1.937 . 0 0 "[ . 1 .]" 1 3027 1 45 PHE QD 3 104 ALA MB 4.000 . 4.500 3.877 3.526 4.461 . 0 0 "[ . 1 .]" 1 3028 1 45 PHE HZ 3 104 ALA MB 4.000 . 4.500 3.606 3.189 4.073 . 0 0 "[ . 1 .]" 1 3029 1 45 PHE QE 3 104 ALA MB 4.000 . 4.500 2.623 2.128 3.252 . 0 0 "[ . 1 .]" 1 3030 1 45 PHE HZ 3 104 ALA HA 5.000 . 5.500 4.736 4.028 5.515 0.015 6 0 "[ . 1 .]" 1 3031 1 45 PHE QE 3 104 ALA HA 5.000 3.300 5.500 4.532 4.138 5.297 . 0 0 "[ . 1 .]" 1 3032 1 65 SER HA 3 104 ALA MB 4.000 . 4.500 4.662 4.555 4.755 0.255 2 0 "[ . 1 .]" 1 3033 1 66 THR HB 3 104 ALA MB 5.500 . 6.000 3.209 2.805 3.638 . 0 0 "[ . 1 .]" 1 3034 1 46 ALA HA 3 104 ALA MB 6.000 3.500 6.500 4.173 3.471 4.947 0.029 2 0 "[ . 1 .]" 1 3035 1 46 ALA MB 3 104 ALA MB 5.500 3.500 6.000 4.957 4.438 5.646 . 0 0 "[ . 1 .]" 1 3036 1 48 LYS QD 2 73 LEU MD2 3.000 . 3.500 3.274 1.798 3.619 0.119 15 0 "[ . 1 .]" 1 3037 1 48 LYS QE 2 73 LEU MD2 3.000 . 3.500 2.123 1.807 3.212 . 0 0 "[ . 1 .]" 1 3038 1 48 LYS HE3 2 73 LEU QB 3.000 . 3.500 3.478 2.075 3.777 0.277 9 0 "[ . 1 .]" 1 3039 1 48 LYS HE2 2 73 LEU QB 3.000 . 3.500 2.761 2.103 3.795 0.295 4 0 "[ . 1 .]" 1 3040 1 54 ARG QG 2 73 LEU MD1 3.000 . 3.500 3.222 2.636 3.493 . 0 0 "[ . 1 .]" 1 3041 1 54 ARG QD 2 73 LEU MD1 3.000 . 3.500 2.759 2.002 3.419 . 0 0 "[ . 1 .]" 1 3042 1 58 ASP QB 2 73 LEU MD1 5.000 . 5.500 4.412 3.598 5.519 0.019 1 0 "[ . 1 .]" 1 3043 1 49 GLN QB 2 73 LEU MD2 5.000 . 5.500 5.197 4.393 5.696 0.196 5 0 "[ . 1 .]" 1 3044 1 59 TYR QD 2 73 LEU MD2 4.000 . 4.500 4.285 3.144 4.683 0.183 4 0 "[ . 1 .]" 1 3045 1 59 TYR QD 2 73 LEU MD1 5.000 . 5.500 3.811 3.281 4.870 . 0 0 "[ . 1 .]" 1 3046 1 59 TYR QE 2 73 LEU MD2 3.000 . 3.500 2.996 1.821 3.511 0.011 4 0 "[ . 1 .]" 1 3047 1 59 TYR QE 2 73 LEU MD1 4.000 . 4.500 2.405 1.919 3.487 . 0 0 "[ . 1 .]" 1 3048 1 60 ASN QB 2 73 LEU QD 6.000 . 6.500 6.593 6.155 6.711 0.211 11 0 "[ . 1 .]" 1 3049 1 59 TYR QE 2 73 LEU QB 5.000 . 5.500 3.952 3.335 4.535 . 0 0 "[ . 1 .]" 1 3050 1 48 LYS QB 2 73 LEU MD2 5.000 . 5.500 2.325 1.887 2.886 . 0 0 "[ . 1 .]" 1 3051 1 48 LYS QB 2 73 LEU QB 5.500 . 6.000 4.046 3.510 4.304 . 0 0 "[ . 1 .]" 1 3052 1 48 LYS QG 2 73 LEU MD2 4.000 . 4.500 2.854 2.010 4.394 . 0 0 "[ . 1 .]" 1 3053 1 54 ARG HD3 2 73 LEU QB 3.500 . 4.000 4.081 4.002 4.141 0.141 3 0 "[ . 1 .]" 1 3054 1 54 ARG HD2 2 73 LEU QB 3.500 . 4.000 4.030 3.374 4.176 0.176 11 0 "[ . 1 .]" 1 3055 1 46 ALA HA 3 102 PHE QD 5.000 . 5.500 3.122 2.450 3.692 . 0 0 "[ . 1 .]" 1 3056 1 46 ALA HA 3 102 PHE QE 5.000 . 5.500 4.366 3.289 4.986 . 0 0 "[ . 1 .]" 1 3057 1 46 ALA MB 3 107 LYS QE 4.500 . 5.000 3.692 2.603 4.942 . 0 0 "[ . 1 .]" 1 3058 1 46 ALA MB 3 107 LYS QD 6.000 . 6.500 4.525 2.888 5.630 . 0 0 "[ . 1 .]" 1 3059 1 48 LYS QG 3 107 LYS QE 5.000 . 5.500 4.528 3.692 5.398 . 0 0 "[ . 1 .]" 1 3060 1 48 LYS QD 3 107 LYS QE 5.000 . 5.500 3.555 2.706 5.550 0.050 4 0 "[ . 1 .]" 1 3061 1 48 LYS QE 3 107 LYS QE 6.000 . 6.500 3.913 3.011 5.172 . 0 0 "[ . 1 .]" 1 3062 1 46 ALA HA 3 107 LYS QE 6.000 . 6.500 5.242 4.005 6.575 0.075 2 0 "[ . 1 .]" 1 3063 1 46 ALA MB 3 77 LEU QD 6.000 . 6.500 4.535 4.330 4.986 . 0 0 "[ . 1 .]" 1 3064 1 8 LEU MD1 3 80 PHE QR 4.000 . 4.500 4.580 4.521 4.658 0.158 7 0 "[ . 1 .]" 1 3065 1 8 LEU MD2 3 80 PHE QR 4.000 . 4.500 3.217 2.908 4.162 . 0 0 "[ . 1 .]" 1 3066 1 44 ILE MD 3 80 PHE QR 4.500 . 5.000 1.727 1.689 1.778 0.111 12 0 "[ . 1 .]" 1 3067 1 44 ILE MG 3 80 PHE QR 4.000 . 4.500 1.871 1.817 1.937 . 0 0 "[ . 1 .]" 1 3068 1 48 LYS QD 3 109 LEU QD 6.000 . 6.500 5.205 4.780 5.730 . 0 0 "[ . 1 .]" 1 3069 1 48 LYS QE 3 109 LEU QD 6.000 . 6.500 5.294 4.657 5.914 . 0 0 "[ . 1 .]" 1 3070 1 47 GLY QA 3 109 LEU QD 6.000 . 6.500 5.568 5.227 5.874 . 0 0 "[ . 1 .]" 1 3071 3 92 CYS HA 4 13 PHE QD 5.000 . 5.500 4.919 4.663 5.121 . 0 0 "[ . 1 .]" 1 3072 3 92 CYS QB 4 13 PHE QD 6.000 . 6.500 2.866 2.584 3.099 . 0 0 "[ . 1 .]" 1 3073 3 92 CYS QB 4 13 PHE QE 5.000 . 5.500 3.825 3.443 4.375 . 0 0 "[ . 1 .]" 1 3074 1 70 VAL MG1 3 80 PHE QR 5.000 . 5.500 3.730 3.506 3.954 . 0 0 "[ . 1 .]" 1 3075 1 70 VAL MG2 3 80 PHE QR 5.000 . 5.500 1.897 1.754 2.074 0.046 4 0 "[ . 1 .]" 1 3076 1 48 LYS HA 2 73 LEU MD2 4.000 . 4.500 4.227 3.373 4.584 0.084 9 0 "[ . 1 .]" 1 3077 1 48 LYS HA 2 73 LEU MD1 5.000 . 5.500 5.196 4.753 5.847 0.347 11 0 "[ . 1 .]" 1 3078 1 51 GLU QG 2 73 LEU MD1 5.000 . 5.500 4.283 3.038 5.319 . 0 0 "[ . 1 .]" 1 3079 1 48 LYS QD 2 76 GLY QA 5.000 . 5.500 3.692 3.490 4.131 . 0 0 "[ . 1 .]" 1 3080 1 48 LYS QE 2 76 GLY QA 4.000 . 4.500 3.708 3.629 3.868 . 0 0 "[ . 1 .]" 1 3081 1 1 MET HA 1 1 MET QB 2.500 . 3.000 2.402 2.389 2.422 . 0 0 "[ . 1 .]" 1 3082 1 1 MET HA 1 1 MET QG 2.500 . 3.000 2.388 2.354 2.419 . 0 0 "[ . 1 .]" 1 3083 1 1 MET HA 1 2 GLN QG 3.000 . 3.500 3.808 3.746 3.920 0.420 13 0 "[ . 1 .]" 1 3084 1 1 MET HA 1 16 GLU HA 5.000 . 5.500 5.562 5.496 5.610 0.110 6 0 "[ . 1 .]" 1 3085 1 1 MET HA 1 63 LYS HA 3.000 . 3.500 3.476 3.270 3.620 0.120 14 0 "[ . 1 .]" 1 3086 1 1 MET HA 1 63 LYS QB 2.500 . 3.000 2.905 2.674 3.092 0.092 9 0 "[ . 1 .]" 1 3087 1 1 MET HA 1 63 LYS QG 4.000 . 4.500 2.146 2.032 2.401 . 0 0 "[ . 1 .]" 1 3088 1 1 MET HA 1 63 LYS QD 4.000 . 4.500 2.999 2.750 3.708 . 0 0 "[ . 1 .]" 1 3089 1 1 MET HA 1 17 VAL QG 4.000 . 4.500 4.577 4.543 4.615 0.115 13 0 "[ . 1 .]" 1 3090 1 1 MET HA 1 3 ILE MG 5.000 . 5.500 4.819 4.706 4.901 . 0 0 "[ . 1 .]" 1 3091 1 1 MET QB 1 1 MET ME 2.500 . 3.000 2.083 2.030 2.234 . 0 0 "[ . 1 .]" 1 3092 1 1 MET QB 1 17 VAL QG 4.000 . 4.500 3.072 2.991 3.176 . 0 0 "[ . 1 .]" 1 3093 1 1 MET ME 1 1 MET QG 2.500 . 3.000 2.206 2.085 2.274 . 0 0 "[ . 1 .]" 1 3094 1 1 MET QG 1 63 LYS HA 4.000 . 4.500 2.021 1.930 2.111 . 0 0 "[ . 1 .]" 1 3095 1 1 MET QG 1 63 LYS QB 4.000 . 4.500 1.996 1.959 2.040 . 0 0 "[ . 1 .]" 1 3096 1 1 MET QG 1 63 LYS QG 4.000 . 4.500 2.821 2.666 2.971 . 0 0 "[ . 1 .]" 1 3097 1 1 MET QG 1 63 LYS QD 4.000 . 4.500 3.733 3.575 4.369 . 0 0 "[ . 1 .]" 1 3098 1 1 MET QG 1 17 VAL QG 3.000 . 3.500 3.412 3.287 3.503 0.003 14 0 "[ . 1 .]" 1 3099 1 1 MET QG 1 3 ILE MG 3.000 . 3.500 2.931 2.831 3.078 . 0 0 "[ . 1 .]" 1 3100 1 1 MET ME 1 18 GLU HA 4.000 . 4.500 3.338 3.135 3.572 . 0 0 "[ . 1 .]" 1 3101 1 1 MET ME 1 19 PRO HA 3.000 . 3.500 2.034 1.991 2.113 . 0 0 "[ . 1 .]" 1 3102 1 1 MET ME 1 19 PRO QB 2.500 . 3.000 3.275 3.200 3.317 0.317 2 0 "[ . 1 .]" 1 3103 1 1 MET ME 1 19 PRO QG 2.500 . 3.000 2.967 2.861 3.014 0.014 5 0 "[ . 1 .]" 1 3104 1 1 MET ME 1 19 PRO QD 3.000 . 3.500 3.096 3.010 3.193 . 0 0 "[ . 1 .]" 1 3105 1 1 MET ME 1 57 SER QB 4.000 . 4.500 4.537 4.437 4.658 0.158 13 0 "[ . 1 .]" 1 3106 1 1 MET ME 1 61 ILE HA 5.000 . 5.500 4.842 4.640 5.025 . 0 0 "[ . 1 .]" 1 3107 1 1 MET ME 1 62 GLN HA 3.000 . 3.500 3.426 3.244 3.559 0.059 3 0 "[ . 1 .]" 1 3108 1 1 MET ME 1 63 LYS HA 3.000 . 3.500 3.736 3.675 3.789 0.289 13 0 "[ . 1 .]" 1 3109 1 1 MET ME 1 63 LYS QB 4.500 . 5.000 4.637 4.544 4.711 . 0 0 "[ . 1 .]" 1 3110 1 1 MET ME 1 17 VAL QG 2.500 . 3.000 2.318 2.221 2.386 . 0 0 "[ . 1 .]" 1 3111 1 1 MET ME 1 3 ILE MD 3.000 . 3.500 3.687 3.622 3.840 0.340 11 0 "[ . 1 .]" 1 3112 1 1 MET ME 1 3 ILE MG 2.500 . 3.000 2.553 2.483 2.602 . 0 0 "[ . 1 .]" 1 3113 1 1 MET ME 1 56 LEU QD 2.500 . 3.000 2.285 1.814 2.523 . 0 0 "[ . 1 .]" 1 3114 1 1 MET ME 1 61 ILE MD 4.000 . 4.500 4.453 4.239 4.600 0.100 14 0 "[ . 1 .]" 1 3115 1 1 MET ME 1 61 ILE MG 3.000 . 3.500 2.525 2.133 2.744 . 0 0 "[ . 1 .]" 1 3116 1 1 MET HA 1 2 GLN HA 5.000 . 5.500 4.559 4.536 4.594 . 0 0 "[ . 1 .]" 1 3117 1 1 MET ME 1 2 GLN HA 5.000 . 5.500 4.920 4.776 5.042 . 0 0 "[ . 1 .]" 1 3118 1 2 GLN HA 1 2 GLN QG 3.000 . 3.500 3.248 3.230 3.263 . 0 0 "[ . 1 .]" 1 3119 1 2 GLN HA 1 3 ILE HA 5.000 . 5.500 4.451 4.428 4.468 . 0 0 "[ . 1 .]" 1 3120 1 2 GLN HA 1 16 GLU HA 3.000 . 3.500 2.017 1.947 2.071 . 0 0 "[ . 1 .]" 1 3121 1 2 GLN HA 1 16 GLU QB 4.000 . 4.500 4.061 3.821 4.176 . 0 0 "[ . 1 .]" 1 3122 1 2 GLN HA 1 16 GLU QG 4.000 . 4.500 4.003 3.647 4.877 0.377 11 0 "[ . 1 .]" 1 3123 1 2 GLN HA 1 64 GLU HA 6.000 . 6.500 6.173 5.981 6.379 . 0 0 "[ . 1 .]" 1 3124 1 2 GLN HA 1 64 GLU QG 6.000 . 6.500 6.087 6.026 6.199 . 0 0 "[ . 1 .]" 1 3125 1 2 GLN HA 1 17 VAL QG 4.000 . 4.500 2.437 2.352 2.531 . 0 0 "[ . 1 .]" 1 3126 1 2 GLN HA 1 3 ILE MD 4.000 . 4.500 4.666 4.610 4.736 0.236 11 0 "[ . 1 .]" 1 3127 1 2 GLN HA 1 3 ILE MG 4.000 . 4.500 3.519 3.460 3.697 . 0 0 "[ . 1 .]" 1 3128 1 2 GLN HA 1 3 ILE HB 5.000 . 5.500 5.535 5.513 5.550 0.050 5 0 "[ . 1 .]" 1 3129 1 2 GLN HA 1 14 THR MG 4.000 . 4.500 4.049 3.620 4.370 . 0 0 "[ . 1 .]" 1 3130 1 1 MET HA 1 2 GLN QB 4.000 . 4.500 4.560 4.507 4.608 0.108 9 0 "[ . 1 .]" 1 3131 1 2 GLN QB 1 64 GLU HA 5.000 . 5.500 5.142 4.924 5.428 . 0 0 "[ . 1 .]" 1 3132 1 2 GLN QB 1 64 GLU QG 4.000 . 4.500 4.757 4.674 4.916 0.416 2 0 "[ . 1 .]" 1 3133 1 2 GLN QB 1 14 THR MG 2.500 . 3.000 2.143 1.939 2.474 . 0 0 "[ . 1 .]" 1 3134 1 2 GLN QB 1 14 THR HB 4.000 . 4.500 4.242 4.086 4.432 . 0 0 "[ . 1 .]" 1 3135 1 2 GLN QG 1 14 THR HA 5.000 . 5.500 4.805 4.552 5.023 . 0 0 "[ . 1 .]" 1 3136 1 2 GLN QG 1 64 GLU HA 5.000 . 5.500 3.285 3.057 3.543 . 0 0 "[ . 1 .]" 1 3137 1 2 GLN QG 1 64 GLU QG 2.500 . 3.000 2.863 2.776 2.994 . 0 0 "[ . 1 .]" 1 3138 1 2 GLN QG 1 14 THR MG 2.500 . 3.000 2.318 2.097 2.533 . 0 0 "[ . 1 .]" 1 3139 1 2 GLN QG 1 14 THR HB 4.000 . 4.500 4.770 4.601 4.889 0.389 13 0 "[ . 1 .]" 1 3140 1 3 ILE H 1 15 LEU QB 5.000 . 5.500 3.647 3.520 3.734 . 0 0 "[ . 1 .]" 1 3141 1 3 ILE H 1 15 LEU HG 5.000 . 5.500 5.276 4.996 5.657 0.157 9 0 "[ . 1 .]" 1 3142 1 1 MET QG 1 3 ILE H 5.000 . 5.500 5.414 5.341 5.494 . 0 0 "[ . 1 .]" 1 3143 1 1 MET ME 1 3 ILE H 5.000 . 5.500 5.533 5.475 5.594 0.094 13 0 "[ . 1 .]" 1 3144 1 2 GLN HA 1 3 ILE H 3.000 . 3.500 2.324 2.291 2.358 . 0 0 "[ . 1 .]" 1 3145 1 2 GLN QB 1 3 ILE H 3.000 . 3.500 2.546 2.449 2.680 . 0 0 "[ . 1 .]" 1 3146 1 2 GLN QG 1 3 ILE H 3.000 . 3.500 3.301 3.145 3.409 . 0 0 "[ . 1 .]" 1 3147 1 3 ILE H 1 14 THR HA 5.000 . 5.500 4.059 3.972 4.164 . 0 0 "[ . 1 .]" 1 3148 1 3 ILE H 1 16 GLU HA 4.000 . 4.500 3.742 3.689 3.800 . 0 0 "[ . 1 .]" 1 3149 1 3 ILE H 1 16 GLU QB 5.000 . 5.500 5.373 5.273 5.415 . 0 0 "[ . 1 .]" 1 3150 1 3 ILE H 1 64 GLU HA 6.000 . 6.500 5.070 4.888 5.286 . 0 0 "[ . 1 .]" 1 3151 1 3 ILE H 1 3 ILE MD 4.000 . 4.500 3.827 3.796 3.877 . 0 0 "[ . 1 .]" 1 3152 1 3 ILE H 1 3 ILE MG 4.000 . 4.500 3.126 3.050 3.206 . 0 0 "[ . 1 .]" 1 3153 1 3 ILE H 1 14 THR MG 4.000 . 4.500 3.019 2.493 3.423 . 0 0 "[ . 1 .]" 1 3154 1 3 ILE H 1 14 THR HB 5.000 . 5.500 5.505 5.363 5.627 0.127 14 0 "[ . 1 .]" 1 3155 1 3 ILE HA 1 64 GLU HA 4.000 . 4.500 2.871 2.632 2.979 . 0 0 "[ . 1 .]" 1 3156 1 3 ILE HA 1 64 GLU QG 4.000 . 4.500 4.491 4.228 4.654 0.154 13 0 "[ . 1 .]" 1 3157 1 3 ILE HA 1 17 VAL QG 4.000 . 4.500 4.224 4.138 4.335 . 0 0 "[ . 1 .]" 1 3158 1 3 ILE HA 1 3 ILE MD 4.000 . 4.500 4.137 4.117 4.149 . 0 0 "[ . 1 .]" 1 3159 1 3 ILE HA 1 3 ILE MG 3.000 . 3.500 2.203 2.111 2.269 . 0 0 "[ . 1 .]" 1 3160 1 3 ILE HB 1 3 ILE MD 3.000 . 3.500 2.395 2.368 2.427 . 0 0 "[ . 1 .]" 1 3161 1 3 ILE MG 1 63 LYS QB 5.000 . 5.500 4.640 4.446 4.832 . 0 0 "[ . 1 .]" 1 3162 1 4 PHE H 1 4 PHE QD 4.000 . 4.500 2.508 2.170 3.111 . 0 0 "[ . 1 .]" 1 3163 1 4 PHE H 1 4 PHE QE 5.000 . 5.500 4.542 4.418 4.663 . 0 0 "[ . 1 .]" 1 3164 1 4 PHE H 1 5 VAL MG2 4.000 . 4.500 4.420 4.289 4.502 0.002 1 0 "[ . 1 .]" 1 3165 1 3 ILE HA 1 4 PHE H 4.000 . 4.500 2.258 2.211 2.328 . 0 0 "[ . 1 .]" 1 3166 1 4 PHE H 1 64 GLU HA 5.000 . 5.500 3.214 2.837 3.556 . 0 0 "[ . 1 .]" 1 3167 1 4 PHE H 1 66 THR HA 4.000 . 4.500 3.391 3.055 3.722 . 0 0 "[ . 1 .]" 1 3168 1 3 ILE MD 1 4 PHE H 5.000 . 5.500 4.734 4.544 4.837 . 0 0 "[ . 1 .]" 1 3169 1 3 ILE MG 1 4 PHE H 4.000 . 4.500 3.675 3.572 3.744 . 0 0 "[ . 1 .]" 1 3170 1 3 ILE HB 1 4 PHE H 4.000 . 4.500 2.884 2.654 3.015 . 0 0 "[ . 1 .]" 1 3171 1 4 PHE H 1 66 THR MG 5.000 . 5.500 5.022 4.599 5.399 . 0 0 "[ . 1 .]" 1 3172 1 4 PHE H 1 67 LEU QD 5.000 . 5.500 3.383 3.111 3.754 . 0 0 "[ . 1 .]" 1 3173 1 4 PHE HA 1 14 THR HA 4.000 . 4.500 2.165 2.030 2.551 . 0 0 "[ . 1 .]" 1 3174 1 4 PHE HA 1 66 THR HA 4.000 . 4.500 4.620 4.550 4.692 0.192 14 0 "[ . 1 .]" 1 3175 1 4 PHE HA 1 5 VAL QG 4.000 . 4.500 3.749 3.656 3.843 . 0 0 "[ . 1 .]" 1 3176 1 4 PHE HA 1 12 THR MG 4.000 . 4.500 3.189 2.832 3.476 . 0 0 "[ . 1 .]" 1 3177 1 4 PHE HA 1 14 THR MG 4.000 . 4.500 2.960 2.728 3.173 . 0 0 "[ . 1 .]" 1 3178 1 4 PHE HA 1 14 THR HB 5.000 . 5.500 4.759 4.432 5.291 . 0 0 "[ . 1 .]" 1 3179 1 4 PHE QB 1 66 THR HA 4.000 . 4.500 2.372 2.198 2.482 . 0 0 "[ . 1 .]" 1 3180 1 4 PHE QB 1 5 VAL QG 5.000 . 5.500 4.371 4.303 4.471 . 0 0 "[ . 1 .]" 1 3181 1 4 PHE QB 1 12 THR MG 3.000 . 3.500 2.127 1.955 2.581 . 0 0 "[ . 1 .]" 1 3182 1 4 PHE QB 1 66 THR MG 4.000 . 4.500 3.114 2.846 3.354 . 0 0 "[ . 1 .]" 1 3183 1 3 ILE HA 1 4 PHE QD 5.000 . 5.500 3.269 2.934 3.974 . 0 0 "[ . 1 .]" 1 3184 1 4 PHE HA 1 4 PHE QD 4.000 . 4.500 2.593 1.933 3.030 . 0 0 "[ . 1 .]" 1 3185 1 4 PHE QD 1 14 THR HA 4.000 . 4.500 3.324 2.376 3.813 . 0 0 "[ . 1 .]" 1 3186 1 4 PHE QD 1 64 GLU HA 4.000 . 4.500 2.443 1.976 3.445 . 0 0 "[ . 1 .]" 1 3187 1 4 PHE QD 1 64 GLU QB 5.000 . 5.500 3.527 3.246 3.707 . 0 0 "[ . 1 .]" 1 3188 1 4 PHE QD 1 64 GLU QG 4.000 . 4.500 3.863 3.366 4.527 0.027 2 0 "[ . 1 .]" 1 3189 1 4 PHE QD 1 66 THR HA 4.000 . 4.500 4.314 3.983 4.610 0.110 15 0 "[ . 1 .]" 1 3190 1 3 ILE MG 1 4 PHE QD 5.000 . 5.500 4.849 4.585 5.315 . 0 0 "[ . 1 .]" 1 3191 1 3 ILE MG 1 4 PHE QE 6.000 . 7.000 5.841 5.581 6.128 . 0 0 "[ . 1 .]" 1 3192 1 3 ILE HB 1 4 PHE QD 5.000 . 5.500 4.887 4.717 5.223 . 0 0 "[ . 1 .]" 1 3193 1 4 PHE QD 1 5 VAL QG 5.000 . 5.500 5.134 4.888 5.358 . 0 0 "[ . 1 .]" 1 3194 1 4 PHE QD 1 12 THR MG 3.000 . 3.500 2.454 1.804 3.590 0.090 5 0 "[ . 1 .]" 1 3195 1 4 PHE QD 1 66 THR MG 4.000 . 4.500 4.592 4.435 4.721 0.221 6 0 "[ . 1 .]" 1 3196 1 4 PHE QD 1 14 THR MG 2.500 . 3.000 2.349 1.868 2.864 . 0 0 "[ . 1 .]" 1 3197 1 4 PHE QD 1 14 THR HB 4.000 . 4.500 4.499 3.773 4.772 0.272 7 0 "[ . 1 .]" 1 3198 1 2 GLN QB 1 4 PHE QE 4.000 . 4.500 4.526 4.147 4.826 0.326 7 0 "[ . 1 .]" 1 3199 1 2 GLN QG 1 4 PHE QE 4.000 . 4.500 2.914 2.650 3.089 . 0 0 "[ . 1 .]" 1 3200 1 3 ILE HA 1 4 PHE QE 5.000 . 5.500 4.586 4.297 4.839 . 0 0 "[ . 1 .]" 1 3201 1 4 PHE QE 1 14 THR HA 5.000 . 5.500 4.508 4.201 4.874 . 0 0 "[ . 1 .]" 1 3202 1 4 PHE QE 1 63 LYS QG 4.000 . 4.500 4.565 4.333 4.728 0.228 4 0 "[ . 1 .]" 1 3203 1 4 PHE QE 1 64 GLU HA 3.000 . 3.500 2.698 2.021 3.165 . 0 0 "[ . 1 .]" 1 3204 1 4 PHE QE 1 64 GLU QB 4.000 . 4.500 2.891 2.225 3.587 . 0 0 "[ . 1 .]" 1 3205 1 4 PHE QE 1 64 GLU QG 3.000 . 3.500 2.422 1.917 3.206 . 0 0 "[ . 1 .]" 1 3206 1 4 PHE QE 1 14 THR MG 2.500 . 3.000 2.227 1.825 2.657 . 0 0 "[ . 1 .]" 1 3207 1 4 PHE QE 1 14 THR HB 4.000 . 4.500 4.181 3.905 4.535 0.035 8 0 "[ . 1 .]" 1 3208 1 4 PHE QD 1 12 THR HB 6.000 . 6.500 4.609 3.737 6.110 . 0 0 "[ . 1 .]" 1 3209 1 4 PHE HA 1 5 VAL H 5.000 . 5.500 2.170 2.161 2.186 . 0 0 "[ . 1 .]" 1 3210 1 4 PHE QB 1 5 VAL H 5.000 . 5.500 3.342 3.258 3.515 . 0 0 "[ . 1 .]" 1 3211 1 4 PHE QD 1 5 VAL H 4.000 . 4.500 4.252 3.970 4.500 0.000 7 0 "[ . 1 .]" 1 3212 1 4 PHE QE 1 5 VAL H 6.000 . 6.500 6.152 6.029 6.275 . 0 0 "[ . 1 .]" 1 3213 1 5 VAL H 1 14 THR MG 4.000 . 4.500 4.536 4.418 4.645 0.145 8 0 "[ . 1 .]" 1 3214 1 5 VAL H 1 13 ILE MG 4.500 . 5.000 4.940 4.413 5.261 0.261 15 0 "[ . 1 .]" 1 3215 1 3 ILE MG 1 5 VAL H 6.000 . 6.500 6.431 6.229 6.530 0.030 11 0 "[ . 1 .]" 1 3216 1 3 ILE MD 1 5 VAL H 5.000 . 5.500 5.595 5.361 5.699 0.199 12 0 "[ . 1 .]" 1 3217 1 5 VAL H 1 5 VAL HB 4.000 . 4.500 2.490 2.441 2.542 . 0 0 "[ . 1 .]" 1 3218 1 5 VAL H 1 5 VAL QG . . 3.500 2.694 2.617 2.739 . 0 0 "[ . 1 .]" 1 3219 1 5 VAL H 1 12 THR MG 3.000 . 3.500 3.049 2.835 3.299 . 0 0 "[ . 1 .]" 1 3220 1 5 VAL H 1 13 ILE HB 4.000 . 4.500 3.856 3.300 4.379 . 0 0 "[ . 1 .]" 1 3221 1 5 VAL H 1 13 ILE QG 5.000 . 5.500 3.945 3.629 4.504 . 0 0 "[ . 1 .]" 1 3222 1 5 VAL H 1 13 ILE MD 4.500 . 5.000 5.076 4.906 5.169 0.169 14 0 "[ . 1 .]" 1 3223 1 5 VAL H 1 15 LEU QD 4.000 . 4.500 4.444 4.218 4.562 0.062 12 0 "[ . 1 .]" 1 3224 1 5 VAL H 1 14 THR HA 5.000 . 5.500 3.074 2.794 3.379 . 0 0 "[ . 1 .]" 1 3225 1 5 VAL H 1 14 THR HB 6.000 . 6.500 5.834 5.503 6.143 . 0 0 "[ . 1 .]" 1 3226 1 5 VAL HA 1 69 LEU QB 5.000 . 5.500 4.666 4.307 5.120 . 0 0 "[ . 1 .]" 1 3227 1 5 VAL HA 1 5 VAL QG 3.000 . 3.500 2.016 1.998 2.033 . 0 0 "[ . 1 .]" 1 3228 1 5 VAL QG 1 6 LYS QB 4.500 2.800 5.000 4.237 4.174 4.319 . 0 0 "[ . 1 .]" 1 3229 1 5 VAL QG 1 69 LEU HG 3.500 . 4.000 3.353 2.523 4.230 0.230 7 0 "[ . 1 .]" 1 3230 1 6 LYS HA 1 6 LYS QG 3.000 . 3.500 2.054 1.990 2.226 . 0 0 "[ . 1 .]" 1 3231 1 6 LYS HA 1 6 LYS QD 4.000 . 4.500 3.309 2.941 3.469 . 0 0 "[ . 1 .]" 1 3232 1 6 LYS HA 1 6 LYS QE 4.000 . 4.500 4.168 3.912 4.478 . 0 0 "[ . 1 .]" 1 3233 1 6 LYS HA 1 12 THR HA 3.000 . 3.500 2.118 2.050 2.276 . 0 0 "[ . 1 .]" 1 3234 1 5 VAL QG 1 6 LYS HA 4.000 . 4.500 3.892 3.774 4.058 . 0 0 "[ . 1 .]" 1 3235 1 6 LYS HA 1 12 THR HB 4.000 . 4.500 4.761 4.604 4.847 0.347 5 0 "[ . 1 .]" 1 3236 1 6 LYS HA 1 12 THR MG 4.000 . 4.500 3.242 2.675 3.523 . 0 0 "[ . 1 .]" 1 3237 1 6 LYS QB 1 12 THR HA 4.000 . 4.500 3.857 3.644 4.318 . 0 0 "[ . 1 .]" 1 3238 1 6 LYS QB 1 12 THR MG 4.000 . 4.500 3.393 3.201 4.125 . 0 0 "[ . 1 .]" 1 3239 1 6 LYS QB 1 66 THR MG 2.500 . 3.000 2.477 2.241 3.063 0.063 7 0 "[ . 1 .]" 1 3240 1 6 LYS QG 1 10 GLY QA 4.000 . 4.500 2.985 2.566 4.634 0.134 7 0 "[ . 1 .]" 1 3241 1 6 LYS QG 1 12 THR HA 3.000 . 3.500 3.003 2.446 3.338 . 0 0 "[ . 1 .]" 1 3242 1 6 LYS QG 1 12 THR HB 4.000 . 4.500 4.484 3.828 4.656 0.156 15 0 "[ . 1 .]" 1 3243 1 6 LYS QG 1 12 THR MG 3.500 . 4.000 3.648 2.128 3.889 . 0 0 "[ . 1 .]" 1 3244 1 6 LYS QD 1 10 GLY QA 4.000 . 4.500 4.126 3.360 4.571 0.071 11 0 "[ . 1 .]" 1 3245 1 6 LYS QD 1 12 THR HA 3.000 . 3.500 3.758 3.622 3.828 0.328 12 0 "[ . 1 .]" 1 3246 1 6 LYS QD 1 66 THR HA 5.000 . 5.500 5.316 4.595 5.616 0.116 3 0 "[ . 1 .]" 1 3247 1 6 LYS QD 1 12 THR MG 2.500 . 3.000 2.957 2.485 3.087 0.087 10 0 "[ . 1 .]" 1 3248 1 6 LYS QB 1 6 LYS QE 4.000 . 4.500 3.228 2.037 3.629 . 0 0 "[ . 1 .]" 1 3249 1 6 LYS QE 1 6 LYS QG 2.500 . 3.000 2.166 2.124 2.337 . 0 0 "[ . 1 .]" 1 3250 1 6 LYS QE 1 10 GLY QA 3.000 . 3.500 3.011 2.586 3.556 0.056 7 0 "[ . 1 .]" 1 3251 1 5 VAL QG 1 7 THR HA 4.000 . 4.500 3.912 3.646 4.126 . 0 0 "[ . 1 .]" 1 3252 1 7 THR HA 1 7 THR MG 2.500 . 3.000 2.310 2.236 2.414 . 0 0 "[ . 1 .]" 1 3253 1 7 THR HA 1 69 LEU QD 4.000 . 4.500 3.123 2.473 3.376 . 0 0 "[ . 1 .]" 1 3254 1 7 THR HA 1 7 THR HB 2.500 . 3.000 2.449 2.441 2.463 . 0 0 "[ . 1 .]" 1 3255 1 7 THR HA 1 71 LEU QD 4.000 . 4.500 4.158 3.967 4.467 . 0 0 "[ . 1 .]" 1 3256 1 7 THR HB 1 13 ILE MD 5.000 . 5.500 4.960 4.472 5.581 0.081 8 0 "[ . 1 .]" 1 3257 1 8 LEU HA 1 8 LEU QB 2.500 . 3.000 2.379 2.336 2.523 . 0 0 "[ . 1 .]" 1 3258 1 7 THR HB 1 8 LEU HA 4.000 . 4.500 4.693 4.623 4.717 0.217 8 0 "[ . 1 .]" 1 3259 1 8 LEU HA 1 8 LEU QD 2.500 . 3.000 2.015 1.865 2.077 . 0 0 "[ . 1 .]" 1 3260 1 8 LEU HA 1 8 LEU HG 3.000 . 3.500 3.225 3.115 3.544 0.044 11 0 "[ . 1 .]" 1 3261 1 8 LEU QB 1 9 THR HA 4.000 . 4.500 3.984 3.920 4.038 . 0 0 "[ . 1 .]" 1 3262 1 8 LEU QB 1 70 VAL HA 4.000 . 4.500 4.579 4.322 4.709 0.209 8 0 "[ . 1 .]" 1 3263 1 8 LEU QB 1 9 THR HB 5.000 . 5.500 5.376 5.157 5.461 . 0 0 "[ . 1 .]" 1 3264 1 8 LEU QB 1 9 THR MG 4.000 . 4.500 2.972 2.559 3.116 . 0 0 "[ . 1 .]" 1 3265 1 8 LEU QB 1 8 LEU QD 2.500 . 3.000 1.933 1.912 1.980 . 0 0 "[ . 1 .]" 1 3266 1 8 LEU HG 1 70 VAL HA 4.000 . 4.500 3.272 2.772 4.615 0.115 14 0 "[ . 1 .]" 1 3267 1 8 LEU HG 1 9 THR MG 4.000 . 4.500 4.671 4.561 4.720 0.220 6 0 "[ . 1 .]" 1 3268 1 8 LEU HG 1 71 LEU QD 2.500 . 3.000 3.113 2.882 3.213 0.213 12 0 "[ . 1 .]" 1 3269 1 9 THR HA 1 9 THR HB 2.500 . 3.000 2.426 2.408 2.454 . 0 0 "[ . 1 .]" 1 3270 1 9 THR HA 1 9 THR MG 2.500 . 3.000 2.415 2.368 2.439 . 0 0 "[ . 1 .]" 1 3271 1 11 LYS HA 1 11 LYS QB 2.500 . 3.000 2.394 2.342 2.514 . 0 0 "[ . 1 .]" 1 3272 1 11 LYS HA 1 11 LYS QG 2.500 . 3.000 2.353 2.063 2.957 . 0 0 "[ . 1 .]" 1 3273 1 11 LYS HA 1 11 LYS QD 3.000 . 3.500 3.292 2.000 3.877 0.377 14 0 "[ . 1 .]" 1 3274 1 11 LYS HA 1 11 LYS QE 5.000 . 5.500 4.364 3.388 4.921 . 0 0 "[ . 1 .]" 1 3275 1 11 LYS QB 1 11 LYS QE 4.000 . 4.500 3.635 3.530 3.774 . 0 0 "[ . 1 .]" 1 3276 1 7 THR HB 1 11 LYS QB 5.000 . 5.500 4.274 3.934 4.515 . 0 0 "[ . 1 .]" 1 3277 1 11 LYS QE 1 11 LYS QG 2.500 . 3.000 2.227 2.123 2.354 . 0 0 "[ . 1 .]" 1 3278 1 11 LYS QG 1 13 ILE MD 4.500 . 5.000 3.495 2.013 4.628 . 0 0 "[ . 1 .]" 1 3279 1 11 LYS QD 1 13 ILE MD 4.500 . 5.000 3.519 1.829 5.113 0.113 11 0 "[ . 1 .]" 1 3280 1 11 LYS QD 1 13 ILE MG 4.500 . 5.000 4.255 2.906 5.192 0.192 14 0 "[ . 1 .]" 1 3281 1 6 LYS QE 1 12 THR HA 6.000 . 6.500 4.572 4.112 5.530 . 0 0 "[ . 1 .]" 1 3282 1 11 LYS QE 1 13 ILE MD 4.000 . 4.500 3.295 1.986 4.164 . 0 0 "[ . 1 .]" 1 3283 1 6 LYS QE 1 12 THR HB 6.000 . 6.500 4.670 3.907 6.079 . 0 0 "[ . 1 .]" 1 3284 1 11 LYS QE 1 13 ILE QG 5.000 . 5.500 3.492 2.758 4.664 . 0 0 "[ . 1 .]" 1 3285 1 11 LYS QE 1 13 ILE MG 4.000 . 4.500 3.091 2.051 4.512 0.012 8 0 "[ . 1 .]" 1 3286 1 11 LYS HA 1 12 THR HB 5.000 . 5.500 4.576 4.534 4.604 . 0 0 "[ . 1 .]" 1 3287 1 11 LYS HA 1 12 THR HA 5.000 . 5.500 4.409 4.397 4.425 . 0 0 "[ . 1 .]" 1 3288 1 11 LYS QB 1 12 THR HA 5.000 . 5.500 4.580 4.453 4.695 . 0 0 "[ . 1 .]" 1 3289 1 11 LYS QG 1 12 THR HA 5.000 . 5.500 4.208 3.664 5.392 . 0 0 "[ . 1 .]" 1 3290 1 11 LYS QG 1 12 THR HB 5.000 . 5.500 4.803 4.433 5.392 . 0 0 "[ . 1 .]" 1 3291 1 5 VAL QG 1 12 THR HA 4.000 . 4.500 4.529 4.476 4.594 0.094 12 0 "[ . 1 .]" 1 3292 1 12 THR HA 1 12 THR HB 3.000 . 3.500 3.014 3.010 3.020 . 0 0 "[ . 1 .]" 1 3293 1 12 THR HA 1 12 THR MG 2.500 . 3.000 2.346 2.262 2.384 . 0 0 "[ . 1 .]" 1 3294 1 5 VAL HA 1 12 THR MG 5.000 . 5.500 4.278 4.088 4.417 . 0 0 "[ . 1 .]" 1 3295 1 12 THR MG 1 66 THR HA 4.000 . 4.500 4.519 4.364 4.657 0.157 7 0 "[ . 1 .]" 1 3296 1 13 ILE H 1 13 ILE MD 4.000 . 4.500 3.640 3.082 3.848 . 0 0 "[ . 1 .]" 1 3297 1 5 VAL QG 1 13 ILE H 4.000 . 4.500 3.696 3.541 3.775 . 0 0 "[ . 1 .]" 1 3298 1 13 ILE HA 1 13 ILE MD 3.500 . 4.000 3.585 2.008 4.087 0.087 15 0 "[ . 1 .]" 1 3299 1 12 THR MG 1 13 ILE HA 3.000 . 3.500 3.619 3.558 3.707 0.207 4 0 "[ . 1 .]" 1 3300 1 13 ILE HA 1 14 THR HB 4.500 . 5.000 4.898 4.697 5.085 0.085 8 0 "[ . 1 .]" 1 3301 1 13 ILE HA 1 13 ILE HB 3.000 . 3.500 2.917 2.776 3.014 . 0 0 "[ . 1 .]" 1 3302 1 13 ILE HA 1 13 ILE QG 2.500 . 3.000 2.955 2.754 3.134 0.134 13 0 "[ . 1 .]" 1 3303 1 13 ILE HA 1 13 ILE MG 2.500 . 3.000 2.135 2.054 2.223 . 0 0 "[ . 1 .]" 1 3304 1 11 LYS QB 1 13 ILE MD 5.000 . 5.500 3.886 2.728 5.034 . 0 0 "[ . 1 .]" 1 3305 1 12 THR HA 1 13 ILE MD 4.000 . 4.500 4.452 3.528 4.677 0.177 7 0 "[ . 1 .]" 1 3306 1 13 ILE HB 1 13 ILE MD 2.500 . 3.000 2.521 2.307 3.205 0.205 8 0 "[ . 1 .]" 1 3307 1 13 ILE MD 1 13 ILE MG 2.500 . 3.000 1.948 1.806 2.003 . 0 0 "[ . 1 .]" 1 3308 1 13 ILE HB 1 13 ILE QG 2.500 . 3.000 2.322 2.187 2.403 . 0 0 "[ . 1 .]" 1 3309 1 13 ILE QG 1 34 GLU QG 4.000 . 4.500 3.376 2.346 3.723 . 0 0 "[ . 1 .]" 1 3310 1 5 VAL QG 1 13 ILE QG 2.500 . 3.000 3.090 2.906 3.161 0.161 13 0 "[ . 1 .]" 1 3311 1 13 ILE QG 1 13 ILE MG 2.500 . 3.000 2.295 2.213 2.335 . 0 0 "[ . 1 .]" 1 3312 1 12 THR HA 1 13 ILE MG 5.000 . 5.500 5.042 4.601 5.381 . 0 0 "[ . 1 .]" 1 3313 1 13 ILE MG 1 33 LYS HA 4.000 . 4.500 4.371 4.122 4.565 0.065 2 0 "[ . 1 .]" 1 3314 1 13 ILE MG 1 33 LYS QG 3.100 . 3.600 3.124 1.947 3.670 0.070 1 0 "[ . 1 .]" 1 3315 1 13 ILE MG 1 34 GLU HA 5.000 . 5.500 5.232 4.934 5.566 0.066 13 0 "[ . 1 .]" 1 3316 1 13 ILE MG 1 34 GLU QB 4.000 . 4.500 4.638 4.519 4.722 0.222 3 0 "[ . 1 .]" 1 3317 1 7 THR HA 1 13 ILE MD 6.000 . 6.500 5.315 4.848 6.171 . 0 0 "[ . 1 .]" 1 3318 1 14 THR H 1 14 THR MG 3.000 . 3.500 3.731 3.663 3.771 0.271 11 0 "[ . 1 .]" 1 3319 1 14 THR H 1 14 THR HB 4.000 . 4.500 2.713 2.520 2.908 . 0 0 "[ . 1 .]" 1 3320 1 13 ILE MG 1 14 THR H 5.000 . 5.500 3.217 2.898 3.449 . 0 0 "[ . 1 .]" 1 3321 1 13 ILE MD 1 14 THR H 5.000 . 5.500 5.121 3.875 5.458 . 0 0 "[ . 1 .]" 1 3322 1 14 THR HA 1 15 LEU HA 4.000 . 4.500 4.409 4.384 4.425 . 0 0 "[ . 1 .]" 1 3323 1 5 VAL QG 1 14 THR HA 4.000 . 4.500 4.061 3.663 4.330 . 0 0 "[ . 1 .]" 1 3324 1 14 THR HA 1 14 THR MG 2.500 . 3.000 2.184 1.995 2.274 . 0 0 "[ . 1 .]" 1 3325 1 14 THR HA 1 14 THR HB 3.000 . 3.500 2.994 2.961 3.016 . 0 0 "[ . 1 .]" 1 3326 1 14 THR HA 1 15 LEU QD 4.000 . 4.500 4.238 3.969 4.505 0.005 3 0 "[ . 1 .]" 1 3327 1 14 THR HA 1 15 LEU HG 4.000 . 4.500 3.808 3.538 4.197 . 0 0 "[ . 1 .]" 1 3328 1 14 THR MG 1 16 GLU HA 5.000 . 5.500 4.371 4.057 4.720 . 0 0 "[ . 1 .]" 1 3329 1 13 ILE MG 1 14 THR HB 6.000 . 6.500 5.139 4.825 5.404 . 0 0 "[ . 1 .]" 1 3330 1 2 GLN QB 1 15 LEU H 4.000 . 4.500 3.526 3.324 3.669 . 0 0 "[ . 1 .]" 1 3331 1 2 GLN QG 1 15 LEU H 4.000 . 4.500 4.621 4.576 4.695 0.195 15 0 "[ . 1 .]" 1 3332 1 14 THR HA 1 15 LEU H 3.000 . 3.500 2.169 2.142 2.183 . 0 0 "[ . 1 .]" 1 3333 1 5 VAL QG 1 15 LEU H 5.000 . 5.500 3.659 3.286 4.095 . 0 0 "[ . 1 .]" 1 3334 1 14 THR MG 1 15 LEU H 3.000 . 3.500 2.664 2.203 3.028 . 0 0 "[ . 1 .]" 1 3335 1 14 THR HB 1 15 LEU H 4.000 . 4.500 4.016 3.734 4.130 . 0 0 "[ . 1 .]" 1 3336 1 15 LEU H 1 15 LEU QD 4.000 . 4.500 3.465 3.289 3.699 . 0 0 "[ . 1 .]" 1 3337 1 15 LEU H 1 15 LEU HG 5.000 . 5.500 2.925 2.656 3.442 . 0 0 "[ . 1 .]" 1 3338 1 15 LEU HA 1 33 LYS QD 4.000 . 4.500 4.517 3.917 4.648 0.148 14 0 "[ . 1 .]" 1 3339 1 15 LEU HA 1 33 LYS QE 4.000 . 4.500 3.601 3.078 4.278 . 0 0 "[ . 1 .]" 1 3340 1 14 THR MG 1 15 LEU HA 4.000 . 4.500 3.992 3.697 4.455 . 0 0 "[ . 1 .]" 1 3341 1 14 THR HB 1 15 LEU HA 4.000 . 4.500 4.561 4.358 4.722 0.222 11 0 "[ . 1 .]" 1 3342 1 13 ILE MG 1 15 LEU HA 5.000 . 5.500 5.149 4.280 5.616 0.116 11 0 "[ . 1 .]" 1 3343 1 15 LEU HA 1 15 LEU QD 2.500 . 3.000 2.048 2.009 2.233 . 0 0 "[ . 1 .]" 1 3344 1 15 LEU HA 1 15 LEU HG 4.000 . 4.500 2.917 2.460 3.134 . 0 0 "[ . 1 .]" 1 3345 1 3 ILE MD 1 15 LEU QB 3.000 . 3.500 3.513 3.303 3.580 0.080 12 0 "[ . 1 .]" 1 3346 1 5 VAL QG 1 15 LEU QB 2.500 . 3.000 3.116 3.006 3.250 0.250 13 0 "[ . 1 .]" 1 3347 1 15 LEU QB 1 15 LEU QD 2.500 . 3.000 1.896 1.828 1.924 . 0 0 "[ . 1 .]" 1 3348 1 15 LEU QD 1 33 LYS QB 2.500 . 3.000 2.681 2.203 3.013 0.013 13 0 "[ . 1 .]" 1 3349 1 2 GLN QB 1 16 GLU HA 4.000 . 4.500 2.197 2.119 2.285 . 0 0 "[ . 1 .]" 1 3350 1 2 GLN QG 1 16 GLU HA 4.000 . 4.500 4.141 4.089 4.228 . 0 0 "[ . 1 .]" 1 3351 1 16 GLU HA 1 16 GLU QB 2.500 . 3.000 2.301 2.171 2.350 . 0 0 "[ . 1 .]" 1 3352 1 16 GLU HA 1 16 GLU QG 3.000 . 3.500 2.607 2.347 3.322 . 0 0 "[ . 1 .]" 1 3353 1 16 GLU HA 1 17 VAL QG 3.000 . 3.500 3.329 3.293 3.386 . 0 0 "[ . 1 .]" 1 3354 1 3 ILE MG 1 16 GLU HA 5.000 . 5.500 5.235 5.155 5.361 . 0 0 "[ . 1 .]" 1 3355 1 16 GLU QB 1 17 VAL HA 4.000 . 4.500 4.486 4.303 4.550 0.050 13 0 "[ . 1 .]" 1 3356 1 16 GLU QB 1 17 VAL QG 4.000 . 4.500 4.050 4.004 4.137 . 0 0 "[ . 1 .]" 1 3357 1 16 GLU QG 1 17 VAL HA 4.000 . 4.500 3.715 3.498 4.391 . 0 0 "[ . 1 .]" 1 3358 1 16 GLU QG 1 17 VAL QG 3.000 . 3.500 3.810 3.665 3.859 0.359 12 0 "[ . 1 .]" 1 3359 1 1 MET ME 1 17 VAL H 4.000 . 4.500 4.580 4.548 4.617 0.117 13 0 "[ . 1 .]" 1 3360 1 2 GLN HA 1 17 VAL H 6.000 . 6.500 1.883 1.819 1.926 . 0 0 "[ . 1 .]" 1 3361 1 2 GLN QG 1 17 VAL H 4.000 . 4.500 4.730 4.665 4.783 0.283 6 0 "[ . 1 .]" 1 3362 1 16 GLU QB 1 17 VAL H 3.000 . 3.500 3.755 3.461 3.856 0.356 14 0 "[ . 1 .]" 1 3363 1 16 GLU QG 1 17 VAL H 4.000 . 4.500 3.308 2.884 4.404 . 0 0 "[ . 1 .]" 1 3364 1 3 ILE MG 1 17 VAL H 4.000 . 4.500 4.126 3.940 4.288 . 0 0 "[ . 1 .]" 1 3365 1 3 ILE MD 1 17 VAL H 4.000 . 4.500 4.751 4.667 4.788 0.288 12 0 "[ . 1 .]" 1 3366 1 17 VAL H 1 17 VAL MG1 3.000 . 3.500 2.938 2.867 2.974 . 0 0 "[ . 1 .]" 1 3367 1 17 VAL H 1 17 VAL MG2 3.000 . 3.500 2.118 2.020 2.171 . 0 0 "[ . 1 .]" 1 3368 1 17 VAL HA 1 18 GLU QG 3.000 . 3.500 3.454 3.395 3.523 0.023 11 0 "[ . 1 .]" 1 3369 1 17 VAL HA 1 29 LYS QD 5.000 . 5.500 3.974 3.714 5.185 . 0 0 "[ . 1 .]" 1 3370 1 17 VAL HA 1 29 LYS QE 3.000 . 3.500 2.672 2.275 3.533 0.033 3 0 "[ . 1 .]" 1 3371 1 17 VAL HA 1 17 VAL QG 2.500 . 3.000 2.241 2.214 2.322 . 0 0 "[ . 1 .]" 1 3372 1 3 ILE MD 1 17 VAL HA 4.500 . 5.000 5.205 5.121 5.314 0.314 13 0 "[ . 1 .]" 1 3373 1 17 VAL HA 1 17 VAL HB 3.000 . 3.500 2.440 2.431 2.452 . 0 0 "[ . 1 .]" 1 3374 1 15 LEU QB 1 17 VAL QG 6.000 . 6.500 2.586 2.442 2.654 . 0 0 "[ . 1 .]" 1 3375 1 17 VAL QG 1 18 GLU QG 4.000 . 4.500 4.310 4.233 4.419 . 0 0 "[ . 1 .]" 1 3376 1 3 ILE MD 1 17 VAL QG 2.500 . 3.000 1.845 1.800 1.869 0.000 3 0 "[ . 1 .]" 1 3377 1 3 ILE MG 1 17 VAL QG 2.500 . 3.000 2.173 2.063 2.294 . 0 0 "[ . 1 .]" 1 3378 1 3 ILE HB 1 17 VAL QG 4.000 . 4.500 3.851 3.761 3.953 . 0 0 "[ . 1 .]" 1 3379 1 17 VAL QG 1 26 VAL QG 2.500 . 3.000 2.030 1.915 2.180 . 0 0 "[ . 1 .]" 1 3380 1 3 ILE MD 1 17 VAL HB 4.000 . 4.500 3.692 3.594 3.813 . 0 0 "[ . 1 .]" 1 3381 1 1 MET QG 1 18 GLU HA 5.000 . 5.500 4.778 4.543 5.017 . 0 0 "[ . 1 .]" 1 3382 1 18 GLU HA 1 18 GLU QG 3.000 . 3.500 2.376 2.333 2.743 . 0 0 "[ . 1 .]" 1 3383 1 18 GLU HA 1 19 PRO HA 4.000 . 4.500 4.394 4.374 4.409 . 0 0 "[ . 1 .]" 1 3384 1 18 GLU HA 1 19 PRO QB 4.000 . 4.500 4.784 4.771 4.798 0.298 13 0 "[ . 1 .]" 1 3385 1 18 GLU HA 1 19 PRO QG 4.000 . 4.500 3.863 3.835 3.894 . 0 0 "[ . 1 .]" 1 3386 1 18 GLU HA 1 19 PRO QD 3.000 . 3.500 1.980 1.958 2.000 . 0 0 "[ . 1 .]" 1 3387 1 17 VAL QG 1 18 GLU HA 5.000 . 5.500 3.729 3.670 3.779 . 0 0 "[ . 1 .]" 1 3388 1 18 GLU HA 1 56 LEU QD 4.000 . 4.500 4.328 4.096 4.446 . 0 0 "[ . 1 .]" 1 3389 1 18 GLU QB 1 21 ASP HA 4.000 . 4.500 3.869 3.630 4.138 . 0 0 "[ . 1 .]" 1 3390 1 19 PRO HA 1 19 PRO QG 2.500 . 3.000 2.917 2.871 2.977 . 0 0 "[ . 1 .]" 1 3391 1 19 PRO HA 1 19 PRO QD 3.000 . 3.500 3.392 3.373 3.413 . 0 0 "[ . 1 .]" 1 3392 1 17 VAL QG 1 19 PRO HA 4.000 . 4.500 4.474 4.380 4.554 0.054 13 0 "[ . 1 .]" 1 3393 1 19 PRO QB 1 19 PRO QD 2.500 . 3.000 2.751 2.716 2.775 . 0 0 "[ . 1 .]" 1 3394 1 19 PRO QB 1 57 SER HA 4.000 . 4.500 3.977 3.598 4.182 . 0 0 "[ . 1 .]" 1 3395 1 19 PRO QB 1 57 SER QB 2.500 . 3.000 2.655 2.361 2.770 . 0 0 "[ . 1 .]" 1 3396 1 19 PRO QG 1 57 SER QB 4.000 . 4.500 4.440 4.132 4.552 0.052 15 0 "[ . 1 .]" 1 3397 1 18 GLU QB 1 19 PRO QD 3.000 . 3.500 2.241 2.139 2.333 . 0 0 "[ . 1 .]" 1 3398 1 18 GLU QG 1 19 PRO QD 3.000 . 3.500 3.291 3.217 3.702 0.202 11 0 "[ . 1 .]" 1 3399 1 19 PRO QG 1 56 LEU QD 6.000 . 6.500 4.931 4.595 5.112 . 0 0 "[ . 1 .]" 1 3400 1 20 SER HA 1 20 SER QB 2.500 . 3.000 2.270 2.180 2.376 . 0 0 "[ . 1 .]" 1 3401 1 20 SER HA 1 21 ASP QB 5.000 . 5.500 5.080 4.998 5.257 . 0 0 "[ . 1 .]" 1 3402 1 20 SER HA 1 55 THR HA 5.000 . 5.500 5.200 4.982 5.298 . 0 0 "[ . 1 .]" 1 3403 1 20 SER HA 1 55 THR MG 3.000 . 3.500 3.389 2.974 3.513 0.013 2 0 "[ . 1 .]" 1 3404 1 20 SER HA 1 55 THR HB 3.000 . 3.500 2.946 2.675 3.017 . 0 0 "[ . 1 .]" 1 3405 1 20 SER QB 1 55 THR MG 3.500 . 4.000 3.943 3.679 4.044 0.044 6 0 "[ . 1 .]" 1 3406 1 20 SER QB 1 55 THR HB 4.000 . 4.500 4.527 4.314 4.604 0.104 6 0 "[ . 1 .]" 1 3407 1 21 ASP HA 1 25 ASN QB 4.000 . 4.500 3.966 3.846 4.190 . 0 0 "[ . 1 .]" 1 3408 1 21 ASP HA 1 22 THR MG 3.500 . 4.000 3.515 3.352 3.621 . 0 0 "[ . 1 .]" 1 3409 1 21 ASP HA 1 26 VAL QG 5.500 2.300 6.000 4.947 4.714 5.113 . 0 0 "[ . 1 .]" 1 3410 1 21 ASP HA 1 56 LEU QD 4.500 . 5.000 4.488 4.150 4.611 . 0 0 "[ . 1 .]" 1 3411 1 17 VAL HA 1 21 ASP QB 5.000 . 5.500 3.844 3.675 4.240 . 0 0 "[ . 1 .]" 1 3412 1 21 ASP QB 1 25 ASN QB 4.000 . 4.500 3.529 2.481 4.270 . 0 0 "[ . 1 .]" 1 3413 1 17 VAL QG 1 21 ASP QB 4.000 . 4.500 3.342 3.203 3.539 . 0 0 "[ . 1 .]" 1 3414 1 17 VAL HB 1 21 ASP QB 3.000 . 3.500 2.720 2.552 2.978 . 0 0 "[ . 1 .]" 1 3415 1 21 ASP QB 1 26 VAL QG 4.000 . 4.500 3.019 2.789 3.205 . 0 0 "[ . 1 .]" 1 3416 1 21 ASP QB 1 56 LEU QD 3.000 . 3.500 2.037 1.964 2.135 . 0 0 "[ . 1 .]" 1 3417 1 22 THR HA 1 55 THR HA 3.000 2.200 3.500 2.101 2.056 2.150 0.144 9 0 "[ . 1 .]" 1 3418 1 22 THR HA 1 23 ILE MD 5.000 . 5.500 4.029 3.693 4.264 . 0 0 "[ . 1 .]" 1 3419 1 22 THR HA 1 22 THR MG 2.500 . 3.000 2.330 2.257 2.400 . 0 0 "[ . 1 .]" 1 3420 1 22 THR HA 1 55 THR HB 4.000 . 4.500 3.808 3.696 3.878 . 0 0 "[ . 1 .]" 1 3421 1 22 THR HA 1 22 THR HB 2.500 . 3.000 2.432 2.416 2.455 . 0 0 "[ . 1 .]" 1 3422 1 22 THR MG 1 54 ARG HA 5.000 . 5.500 5.171 5.069 5.288 . 0 0 "[ . 1 .]" 1 3423 1 22 THR MG 1 55 THR HB 4.500 . 5.000 4.284 4.186 4.369 . 0 0 "[ . 1 .]" 1 3424 1 23 ILE H 1 24 GLU HA 5.000 . 5.500 5.238 5.207 5.278 . 0 0 "[ . 1 .]" 1 3425 1 23 ILE H 1 23 ILE MD 5.000 . 5.500 3.085 2.844 3.229 . 0 0 "[ . 1 .]" 1 3426 1 23 ILE H 1 56 LEU QD 5.000 . 5.500 4.902 4.128 5.246 . 0 0 "[ . 1 .]" 1 3427 1 23 ILE HA 1 23 ILE MG 3.000 . 3.500 2.338 2.267 2.389 . 0 0 "[ . 1 .]" 1 3428 1 23 ILE HA 1 23 ILE MD 3.000 . 3.500 2.019 1.990 2.063 . 0 0 "[ . 1 .]" 1 3429 1 23 ILE HA 1 26 VAL HB 4.000 . 4.500 2.656 2.537 2.791 . 0 0 "[ . 1 .]" 1 3430 1 23 ILE HA 1 26 VAL QG 4.000 . 4.500 2.816 2.633 2.902 . 0 0 "[ . 1 .]" 1 3431 1 23 ILE HA 1 56 LEU QD 5.000 . 5.500 3.609 3.160 3.923 . 0 0 "[ . 1 .]" 1 3432 1 23 ILE MG 1 50 LEU QB 2.500 . 3.000 1.955 1.868 2.075 . 0 0 "[ . 1 .]" 1 3433 1 23 ILE QG 1 23 ILE MG 2.500 . 3.000 2.249 2.188 2.297 . 0 0 "[ . 1 .]" 1 3434 1 23 ILE MD 1 23 ILE MG 2.500 . 3.000 1.922 1.822 2.072 . 0 0 "[ . 1 .]" 1 3435 1 23 ILE MG 1 26 VAL HB 3.000 . 3.500 3.314 3.081 3.483 . 0 0 "[ . 1 .]" 1 3436 1 23 ILE MD 1 54 ARG HA 5.000 . 5.500 5.292 4.814 5.616 0.116 13 0 "[ . 1 .]" 1 3437 1 23 ILE MD 1 54 ARG QG 6.000 . 6.500 4.705 4.188 5.165 . 0 0 "[ . 1 .]" 1 3438 1 23 ILE MD 1 55 THR HB 6.000 . 6.500 5.172 4.882 5.528 . 0 0 "[ . 1 .]" 1 3439 1 22 THR HB 1 23 ILE MD 5.000 . 5.500 5.136 4.811 5.301 . 0 0 "[ . 1 .]" 1 3440 1 23 ILE MD 1 26 VAL HB 4.000 . 4.500 3.618 3.461 3.768 . 0 0 "[ . 1 .]" 1 3441 1 23 ILE MD 1 26 VAL QG 2.500 . 3.000 3.079 3.034 3.176 0.176 3 0 "[ . 1 .]" 1 3442 1 24 GLU HA 1 24 GLU QB 2.500 . 3.000 2.339 2.190 2.368 . 0 0 "[ . 1 .]" 1 3443 1 24 GLU HA 1 24 GLU QG 3.000 . 3.500 2.601 2.358 3.304 . 0 0 "[ . 1 .]" 1 3444 1 24 GLU HA 1 27 LYS QE 4.000 . 4.500 1.989 1.930 2.181 . 0 0 "[ . 1 .]" 1 3445 1 23 ILE MG 1 24 GLU HA 4.000 . 4.500 3.579 3.436 3.756 . 0 0 "[ . 1 .]" 1 3446 1 25 ASN HA 1 25 ASN QB 2.500 . 3.000 2.407 2.364 2.427 . 0 0 "[ . 1 .]" 1 3447 1 25 ASN HA 1 28 ALA MB 2.500 . 3.000 2.790 2.688 2.840 . 0 0 "[ . 1 .]" 1 3448 1 25 ASN HA 1 26 VAL QG 4.000 . 4.500 4.748 4.724 4.818 0.318 13 0 "[ . 1 .]" 1 3449 1 25 ASN QB 1 26 VAL HA 4.000 . 4.500 3.888 3.842 4.063 . 0 0 "[ . 1 .]" 1 3450 1 25 ASN QB 1 28 ALA MB 4.000 . 4.500 4.208 4.065 4.468 . 0 0 "[ . 1 .]" 1 3451 1 22 THR MG 1 25 ASN QB 5.000 . 5.500 4.076 3.665 4.346 . 0 0 "[ . 1 .]" 1 3452 1 25 ASN QB 1 26 VAL QG 4.000 . 4.500 3.083 2.978 3.189 . 0 0 "[ . 1 .]" 1 3453 1 25 ASN HA 1 28 ALA HA 5.500 . 6.000 5.461 5.377 5.505 . 0 0 "[ . 1 .]" 1 3454 1 23 ILE HA 1 26 VAL H 4.000 . 4.500 3.317 3.254 3.399 . 0 0 "[ . 1 .]" 1 3455 1 25 ASN HA 1 26 VAL H 4.000 . 4.500 3.528 3.521 3.543 . 0 0 "[ . 1 .]" 1 3456 1 25 ASN QB 1 26 VAL H 3.000 . 3.500 2.510 2.392 2.551 . 0 0 "[ . 1 .]" 1 3457 1 23 ILE MG 1 26 VAL H 5.000 . 5.500 4.422 4.293 4.542 . 0 0 "[ . 1 .]" 1 3458 1 23 ILE MD 1 26 VAL H 5.000 . 5.500 4.701 4.643 4.758 . 0 0 "[ . 1 .]" 1 3459 1 26 VAL H 1 26 VAL HB 4.000 . 4.500 2.376 2.360 2.405 . 0 0 "[ . 1 .]" 1 3460 1 26 VAL H 1 26 VAL QG 3.000 . 3.500 2.269 2.195 2.393 . 0 0 "[ . 1 .]" 1 3461 1 26 VAL H 1 56 LEU QD 4.000 . 4.500 4.377 4.086 4.559 0.059 3 0 "[ . 1 .]" 1 3462 1 26 VAL HA 1 29 LYS QG 4.000 . 4.500 3.238 2.017 4.190 . 0 0 "[ . 1 .]" 1 3463 1 26 VAL HA 1 29 LYS QD 4.000 . 4.500 2.340 2.040 2.895 . 0 0 "[ . 1 .]" 1 3464 1 26 VAL HA 1 29 LYS QE 3.000 . 3.500 3.530 3.497 3.636 0.136 3 0 "[ . 1 .]" 1 3465 1 17 VAL QG 1 26 VAL HA 5.000 . 5.500 2.825 2.663 3.198 . 0 0 "[ . 1 .]" 1 3466 1 15 LEU QD 1 26 VAL HA 6.000 . 6.500 3.997 3.549 4.403 . 0 0 "[ . 1 .]" 1 3467 1 26 VAL HA 1 26 VAL QG 2.500 . 3.000 2.069 1.971 2.104 . 0 0 "[ . 1 .]" 1 3468 1 26 VAL HA 1 56 LEU QD 4.000 . 4.500 4.288 4.137 4.544 0.044 3 0 "[ . 1 .]" 1 3469 1 25 ASN QB 1 26 VAL HB 4.000 . 4.500 4.566 4.524 4.593 0.093 6 0 "[ . 1 .]" 1 3470 1 26 VAL HB 1 27 LYS HA 4.000 . 4.500 4.406 4.366 4.440 . 0 0 "[ . 1 .]" 1 3471 1 26 VAL HB 1 56 LEU QD 3.000 . 3.500 3.607 3.562 3.648 0.148 12 0 "[ . 1 .]" 1 3472 1 17 VAL HA 1 26 VAL QG 5.000 . 5.500 4.439 4.232 4.597 . 0 0 "[ . 1 .]" 1 3473 1 17 VAL HB 1 26 VAL QG 4.000 . 4.500 2.905 2.720 3.049 . 0 0 "[ . 1 .]" 1 3474 1 26 VAL QG 1 56 LEU QD 2.500 . 3.000 1.821 1.785 1.900 0.015 11 0 "[ . 1 .]" 1 3475 1 26 VAL QG 1 56 LEU HG 3.000 . 3.500 2.771 2.476 3.664 0.164 13 0 "[ . 1 .]" 1 3476 1 25 ASN HA 1 27 LYS H 6.000 . 6.500 4.499 4.441 4.705 . 0 0 "[ . 1 .]" 1 3477 1 25 ASN QB 1 27 LYS H 6.000 . 6.500 4.718 4.680 4.847 . 0 0 "[ . 1 .]" 1 3478 1 26 VAL HA 1 27 LYS H 5.000 . 5.500 3.551 3.541 3.580 . 0 0 "[ . 1 .]" 1 3479 1 27 LYS H 1 27 LYS QD 5.000 . 5.500 4.032 2.593 4.296 . 0 0 "[ . 1 .]" 1 3480 1 27 LYS H 1 27 LYS QE 5.000 . 5.500 3.511 3.407 3.654 . 0 0 "[ . 1 .]" 1 3481 1 27 LYS H 1 28 ALA MB 5.000 . 5.500 4.309 4.251 4.344 . 0 0 "[ . 1 .]" 1 3482 1 26 VAL HB 1 27 LYS H 5.000 . 5.500 2.595 2.488 2.619 . 0 0 "[ . 1 .]" 1 3483 1 26 VAL QG 1 27 LYS H 4.000 . 4.500 3.091 2.989 3.145 . 0 0 "[ . 1 .]" 1 3484 1 27 LYS H 1 43 LEU QD 4.000 . 4.500 3.126 2.833 3.307 . 0 0 "[ . 1 .]" 1 3485 1 27 LYS HA 1 30 ILE HA 5.000 . 5.500 5.372 5.249 5.436 . 0 0 "[ . 1 .]" 1 3486 1 26 VAL QG 1 27 LYS HA 3.000 . 3.500 3.264 3.141 3.408 . 0 0 "[ . 1 .]" 1 3487 1 27 LYS HA 1 30 ILE MG 4.000 . 4.500 4.185 4.026 4.274 . 0 0 "[ . 1 .]" 1 3488 1 27 LYS HA 1 30 ILE MD 4.000 . 4.500 2.621 2.196 4.635 0.135 14 0 "[ . 1 .]" 1 3489 1 27 LYS HA 1 43 LEU QD 3.000 . 3.500 2.481 2.369 2.631 . 0 0 "[ . 1 .]" 1 3490 1 24 GLU HA 1 27 LYS QB 4.000 . 4.500 2.843 2.537 3.879 . 0 0 "[ . 1 .]" 1 3491 1 27 LYS QB 1 27 LYS QE 3.000 . 3.500 2.039 2.008 2.129 . 0 0 "[ . 1 .]" 1 3492 1 27 LYS QB 1 38 PRO HA 4.000 . 4.500 3.100 2.727 3.393 . 0 0 "[ . 1 .]" 1 3493 1 27 LYS QB 1 38 PRO QB 3.000 . 3.500 3.420 3.005 3.582 0.082 2 0 "[ . 1 .]" 1 3494 1 27 LYS HA 1 27 LYS QD 4.000 . 4.500 3.873 3.199 4.464 . 0 0 "[ . 1 .]" 1 3495 1 24 GLU QB 1 27 LYS QE 3.000 . 3.500 3.450 3.202 3.612 0.112 6 0 "[ . 1 .]" 1 3496 1 27 LYS HA 1 27 LYS QE 5.000 . 5.500 4.364 4.274 4.408 . 0 0 "[ . 1 .]" 1 3497 1 23 ILE MG 1 27 LYS QE 3.000 . 3.500 2.183 2.069 2.363 . 0 0 "[ . 1 .]" 1 3498 1 27 LYS QE 1 43 LEU QD 3.000 . 3.500 3.569 3.372 3.683 0.183 8 0 "[ . 1 .]" 1 3499 1 27 LYS QB 1 28 ALA HA 4.500 . 5.000 3.964 3.809 4.420 . 0 0 "[ . 1 .]" 1 3500 1 27 LYS HA 1 28 ALA HA 5.000 . 5.500 4.823 4.811 4.834 . 0 0 "[ . 1 .]" 1 3501 1 28 ALA H 1 28 ALA MB 3.000 . 3.500 2.169 2.069 2.222 . 0 0 "[ . 1 .]" 1 3502 1 28 ALA HA 1 31 GLN HA 4.500 . 5.000 5.090 5.054 5.117 0.117 6 0 "[ . 1 .]" 1 3503 1 28 ALA HA 1 31 GLN QB 3.000 . 3.500 2.541 2.500 2.607 . 0 0 "[ . 1 .]" 1 3504 1 28 ALA HA 1 31 GLN QG 4.000 . 4.500 4.494 4.164 4.631 0.131 14 0 "[ . 1 .]" 1 3505 1 24 GLU HA 1 28 ALA MB 4.500 . 5.000 4.888 4.539 5.048 0.048 13 0 "[ . 1 .]" 1 3506 1 28 ALA MB 1 29 LYS H 3.000 . 3.500 2.484 2.454 2.555 . 0 0 "[ . 1 .]" 1 3507 1 29 LYS H 1 29 LYS QG 4.000 . 4.500 2.336 1.881 3.260 . 0 0 "[ . 1 .]" 1 3508 1 29 LYS H 1 29 LYS QD 4.000 . 4.500 3.546 2.347 3.864 . 0 0 "[ . 1 .]" 1 3509 1 29 LYS H 1 29 LYS QE 4.000 . 4.500 4.325 4.024 4.541 0.041 4 0 "[ . 1 .]" 1 3510 1 29 LYS HA 1 29 LYS QG 3.000 . 3.500 2.285 2.050 2.595 . 0 0 "[ . 1 .]" 1 3511 1 29 LYS HA 1 29 LYS QD 4.000 . 4.500 3.866 3.232 4.001 . 0 0 "[ . 1 .]" 1 3512 1 29 LYS HA 1 29 LYS QE 4.000 . 4.500 4.670 4.307 4.756 0.256 2 0 "[ . 1 .]" 1 3513 1 29 LYS HA 1 32 ASP QB 3.000 . 3.500 3.123 2.955 3.375 . 0 0 "[ . 1 .]" 1 3514 1 15 LEU QD 1 29 LYS HA 3.000 . 3.500 3.445 3.223 3.655 0.155 3 0 "[ . 1 .]" 1 3515 1 26 VAL HA 1 29 LYS QB 4.000 . 4.500 2.921 2.806 3.453 . 0 0 "[ . 1 .]" 1 3516 1 29 LYS HA 1 29 LYS QB 2.500 . 3.000 2.402 2.245 2.462 . 0 0 "[ . 1 .]" 1 3517 1 29 LYS QB 1 29 LYS QD 3.000 . 3.500 2.136 2.023 2.465 . 0 0 "[ . 1 .]" 1 3518 1 29 LYS QB 1 29 LYS QE 3.000 . 3.500 3.474 2.001 3.619 0.119 7 0 "[ . 1 .]" 1 3519 1 15 LEU QD 1 29 LYS QB 2.500 . 3.000 1.855 1.748 1.957 0.052 14 0 "[ . 1 .]" 1 3520 1 26 VAL QG 1 29 LYS QB 5.000 . 5.500 3.293 3.202 3.470 . 0 0 "[ . 1 .]" 1 3521 1 29 LYS QE 1 29 LYS QG 2.500 . 3.000 2.232 2.015 2.916 . 0 0 "[ . 1 .]" 1 3522 1 17 VAL QG 1 29 LYS QG 3.000 . 3.500 3.609 3.393 3.766 0.266 3 0 "[ . 1 .]" 1 3523 1 26 VAL QG 1 29 LYS QG 4.000 . 4.500 4.056 3.196 4.490 . 0 0 "[ . 1 .]" 1 3524 1 17 VAL QG 1 29 LYS QD 2.500 . 3.000 2.077 1.883 3.008 0.008 14 0 "[ . 1 .]" 1 3525 1 15 LEU QD 1 29 LYS QD 3.000 . 3.500 3.019 2.696 3.484 . 0 0 "[ . 1 .]" 1 3526 1 26 VAL QG 1 29 LYS QD 2.500 . 3.000 3.045 2.917 3.266 0.266 3 0 "[ . 1 .]" 1 3527 1 17 VAL QG 1 29 LYS QE 2.500 . 3.000 2.069 1.894 2.835 . 0 0 "[ . 1 .]" 1 3528 1 17 VAL HB 1 29 LYS QE 4.000 . 4.500 3.640 3.385 4.296 . 0 0 "[ . 1 .]" 1 3529 1 26 VAL H 1 29 LYS QE 6.000 . 6.500 4.963 4.715 5.941 . 0 0 "[ . 1 .]" 1 3530 1 15 LEU MD1 1 30 ILE H 3.000 . 3.500 2.943 2.806 3.192 . 0 0 "[ . 1 .]" 1 3531 1 28 ALA MB 1 30 ILE H 3.500 . 4.000 4.388 4.361 4.411 0.411 7 0 "[ . 1 .]" 1 3532 1 26 VAL HA 1 30 ILE H 5.000 . 5.500 4.547 4.509 4.599 . 0 0 "[ . 1 .]" 1 3533 1 27 LYS HA 1 30 ILE H 5.000 . 5.500 3.337 3.258 3.393 . 0 0 "[ . 1 .]" 1 3534 1 29 LYS HA 1 30 ILE H 4.000 . 4.500 3.517 3.511 3.522 . 0 0 "[ . 1 .]" 1 3535 1 29 LYS QB 1 30 ILE H 5.000 . 5.500 2.601 2.546 2.690 . 0 0 "[ . 1 .]" 1 3536 1 29 LYS QD 1 30 ILE H 5.000 . 5.500 4.663 4.169 5.244 . 0 0 "[ . 1 .]" 1 3537 1 29 LYS QE 1 30 ILE H 6.000 . 6.500 5.990 4.877 6.129 . 0 0 "[ . 1 .]" 1 3538 1 15 LEU QD 1 30 ILE H 4.000 . 4.500 2.902 2.764 3.106 . 0 0 "[ . 1 .]" 1 3539 1 26 VAL QG 1 30 ILE H 4.000 . 4.500 4.077 4.009 4.147 . 0 0 "[ . 1 .]" 1 3540 1 30 ILE H 1 30 ILE MG 4.000 . 4.500 3.767 3.741 3.788 . 0 0 "[ . 1 .]" 1 3541 1 30 ILE H 1 30 ILE MD 4.000 . 4.500 3.538 3.453 3.844 . 0 0 "[ . 1 .]" 1 3542 1 30 ILE H 1 30 ILE HB 4.000 . 4.500 2.448 2.358 2.493 . 0 0 "[ . 1 .]" 1 3543 1 30 ILE H 1 30 ILE QG 4.000 . 4.500 2.331 2.260 2.467 . 0 0 "[ . 1 .]" 1 3544 1 30 ILE HA 1 33 LYS HA 5.000 . 5.500 5.349 5.000 5.578 0.078 12 0 "[ . 1 .]" 1 3545 1 30 ILE HA 1 33 LYS QB 4.000 . 4.500 2.526 2.068 2.796 . 0 0 "[ . 1 .]" 1 3546 1 30 ILE HA 1 33 LYS QG 4.000 . 4.500 3.868 3.135 4.666 0.166 9 0 "[ . 1 .]" 1 3547 1 30 ILE HA 1 33 LYS QD 5.000 . 5.500 4.533 3.768 4.905 . 0 0 "[ . 1 .]" 1 3548 1 13 ILE MD 1 30 ILE HA 5.000 . 5.500 4.147 3.232 5.632 0.132 13 0 "[ . 1 .]" 1 3549 1 13 ILE MG 1 30 ILE HA 5.000 . 5.500 4.544 3.409 5.234 . 0 0 "[ . 1 .]" 1 3550 1 15 LEU QD 1 30 ILE HA 4.000 . 4.500 2.344 2.061 2.605 . 0 0 "[ . 1 .]" 1 3551 1 30 ILE HA 1 30 ILE MG 3.000 . 3.500 2.388 2.326 2.465 . 0 0 "[ . 1 .]" 1 3552 1 30 ILE HA 1 30 ILE MD 4.000 . 4.500 3.554 2.011 3.801 . 0 0 "[ . 1 .]" 1 3553 1 30 ILE QG 1 30 ILE MG 3.000 . 3.500 2.265 2.167 2.417 . 0 0 "[ . 1 .]" 1 3554 1 30 ILE QG 1 43 LEU QD 2.500 . 3.000 3.082 2.259 3.278 0.278 5 0 "[ . 1 .]" 1 3555 1 30 ILE MG 1 31 GLN QG 5.000 . 5.500 5.055 4.832 5.509 0.009 11 0 "[ . 1 .]" 1 3556 1 30 ILE MD 1 30 ILE MG 2.500 . 3.000 1.859 1.815 1.981 . 0 0 "[ . 1 .]" 1 3557 1 30 ILE HB 1 30 ILE MD 3.000 . 3.500 2.417 2.254 3.163 . 0 0 "[ . 1 .]" 1 3558 1 5 VAL QG 1 30 ILE HB 4.000 . 4.500 4.443 4.192 4.644 0.144 3 0 "[ . 1 .]" 1 3559 1 15 LEU QD 1 30 ILE HB 4.000 . 4.500 3.896 3.733 4.134 . 0 0 "[ . 1 .]" 1 3560 1 30 ILE HB 1 43 LEU QD 3.000 . 3.500 3.719 3.568 3.869 0.369 7 0 "[ . 1 .]" 1 3561 1 30 ILE HB 1 30 ILE QG 2.500 . 3.000 2.384 2.184 2.423 . 0 0 "[ . 1 .]" 1 3562 1 31 GLN HA 1 31 GLN QG 2.500 . 3.000 2.408 2.235 2.901 . 0 0 "[ . 1 .]" 1 3563 1 30 ILE MG 1 31 GLN HA 4.000 . 4.500 3.391 3.232 3.600 . 0 0 "[ . 1 .]" 1 3564 1 31 GLN HA 1 36 ILE MG 5.000 . 5.500 4.795 4.388 5.178 . 0 0 "[ . 1 .]" 1 3565 1 31 GLN QB 1 37 PRO HA 4.000 . 4.500 3.961 3.547 4.394 . 0 0 "[ . 1 .]" 1 3566 1 30 ILE MG 1 31 GLN QB 4.000 . 4.500 4.261 4.069 4.378 . 0 0 "[ . 1 .]" 1 3567 1 31 GLN QB 1 36 ILE HB 6.000 . 6.500 4.809 4.517 5.208 . 0 0 "[ . 1 .]" 1 3568 1 31 GLN QG 1 35 GLY QA 4.000 . 4.500 3.583 2.769 4.520 0.020 15 0 "[ . 1 .]" 1 3569 1 32 ASP HA 1 32 ASP QB 2.500 . 3.000 2.404 2.373 2.442 . 0 0 "[ . 1 .]" 1 3570 1 32 ASP QB 1 33 LYS HA 4.000 . 4.500 4.090 3.888 4.435 . 0 0 "[ . 1 .]" 1 3571 1 32 ASP QB 1 33 LYS QG 4.000 . 4.500 3.704 3.213 4.717 0.217 9 0 "[ . 1 .]" 1 3572 1 33 LYS HA 1 33 LYS QB 2.500 . 3.000 2.464 2.402 2.539 . 0 0 "[ . 1 .]" 1 3573 1 33 LYS HA 1 33 LYS QG 2.500 . 3.000 2.117 1.969 2.409 . 0 0 "[ . 1 .]" 1 3574 1 33 LYS HA 1 33 LYS QD 2.500 . 3.000 2.918 2.471 3.325 0.325 2 0 "[ . 1 .]" 1 3575 1 33 LYS HA 1 33 LYS QE 4.000 . 4.500 3.986 3.260 4.469 . 0 0 "[ . 1 .]" 1 3576 1 15 LEU QD 1 33 LYS HA 4.000 . 4.500 4.455 4.241 4.566 0.066 11 0 "[ . 1 .]" 1 3577 1 15 LEU HA 1 33 LYS QB 6.000 . 6.500 5.976 5.429 6.344 . 0 0 "[ . 1 .]" 1 3578 1 33 LYS QB 1 33 LYS QD 2.500 . 3.000 2.064 2.003 2.203 . 0 0 "[ . 1 .]" 1 3579 1 33 LYS QB 1 33 LYS QE 3.000 . 3.500 3.578 3.520 3.703 0.203 13 0 "[ . 1 .]" 1 3580 1 13 ILE MG 1 33 LYS QB 2.500 . 3.000 2.253 1.952 2.577 . 0 0 "[ . 1 .]" 1 3581 1 33 LYS QE 1 33 LYS QG 2.500 . 3.000 2.142 2.099 2.196 . 0 0 "[ . 1 .]" 1 3582 1 15 LEU QD 1 33 LYS QG 2.500 . 3.000 2.066 1.823 3.271 0.271 9 0 "[ . 1 .]" 1 3583 1 13 ILE MG 1 33 LYS QD 3.500 . 4.000 2.329 1.826 3.959 . 0 0 "[ . 1 .]" 1 3584 1 15 LEU QD 1 33 LYS QD 2.500 . 3.000 2.126 1.824 2.408 . 0 0 "[ . 1 .]" 1 3585 1 13 ILE MD 1 33 LYS QE 5.000 . 5.500 5.296 4.564 5.641 0.141 14 0 "[ . 1 .]" 1 3586 1 13 ILE MG 1 33 LYS QE 3.000 . 3.500 3.479 3.288 3.579 0.079 4 0 "[ . 1 .]" 1 3587 1 15 LEU QD 1 33 LYS QE 3.000 . 3.500 2.028 1.888 2.233 . 0 0 "[ . 1 .]" 1 3588 1 13 ILE QG 1 33 LYS QD 5.000 . 5.500 4.804 4.333 5.734 0.234 15 0 "[ . 1 .]" 1 3589 1 34 GLU HA 1 34 GLU QB 2.500 . 3.000 2.417 2.357 2.491 . 0 0 "[ . 1 .]" 1 3590 1 34 GLU HA 1 34 GLU QG 3.000 . 3.500 2.745 2.261 2.958 . 0 0 "[ . 1 .]" 1 3591 1 13 ILE MD 1 34 GLU HA 5.000 . 5.500 4.500 4.126 5.340 . 0 0 "[ . 1 .]" 1 3592 1 34 GLU HA 1 36 ILE MD 4.500 . 5.000 5.055 4.913 5.210 0.210 12 0 "[ . 1 .]" 1 3593 1 34 GLU HA 1 36 ILE HB 6.000 . 6.500 6.225 5.955 6.565 0.065 1 0 "[ . 1 .]" 1 3594 1 13 ILE MD 1 34 GLU QB 4.000 . 4.500 3.396 2.849 4.585 0.085 14 0 "[ . 1 .]" 1 3595 1 30 ILE MG 1 34 GLU QB 2.500 . 3.000 2.625 2.330 2.972 . 0 0 "[ . 1 .]" 1 3596 1 34 GLU QB 1 36 ILE MD 3.500 . 4.000 2.831 2.505 3.041 . 0 0 "[ . 1 .]" 1 3597 1 13 ILE MD 1 34 GLU QG 2.500 . 3.000 2.022 1.790 2.984 0.010 2 0 "[ . 1 .]" 1 3598 1 13 ILE MG 1 34 GLU QG 2.500 . 3.000 2.975 2.836 3.057 0.057 10 0 "[ . 1 .]" 1 3599 1 30 ILE MG 1 34 GLU QG 3.000 . 3.500 3.424 2.805 3.669 0.169 9 0 "[ . 1 .]" 1 3600 1 34 GLU QG 1 36 ILE MD 3.500 . 4.000 3.807 2.935 4.354 0.354 10 0 "[ . 1 .]" 1 3601 1 35 GLY QA 1 36 ILE HA 4.000 . 4.500 4.052 3.996 4.118 . 0 0 "[ . 1 .]" 1 3602 1 36 ILE HA 1 37 PRO QB 5.000 . 5.500 4.695 4.656 4.769 . 0 0 "[ . 1 .]" 1 3603 1 36 ILE HA 1 37 PRO QG 4.000 . 4.500 3.948 3.897 4.019 . 0 0 "[ . 1 .]" 1 3604 1 36 ILE HA 1 37 PRO QD 3.000 . 3.500 2.030 1.979 2.092 0.021 14 0 "[ . 1 .]" 1 3605 1 36 ILE HA 1 36 ILE MG 2.500 . 3.000 2.298 2.169 2.379 . 0 0 "[ . 1 .]" 1 3606 1 36 ILE HA 1 36 ILE MD 3.000 . 3.500 2.826 2.003 3.786 0.286 4 0 "[ . 1 .]" 1 3607 1 36 ILE HA 1 36 ILE HB 3.000 . 3.500 3.021 3.009 3.032 . 0 0 "[ . 1 .]" 1 3608 1 36 ILE MG 1 38 PRO HA 4.000 . 4.500 4.687 4.568 4.760 0.260 2 0 "[ . 1 .]" 1 3609 1 36 ILE MG 1 40 GLN HA 4.000 . 4.500 4.359 4.076 4.735 0.235 5 0 "[ . 1 .]" 1 3610 1 36 ILE MD 1 36 ILE MG 2.500 . 3.000 1.897 1.785 2.038 0.015 9 0 "[ . 1 .]" 1 3611 1 36 ILE MD 1 41 GLN QG 4.000 . 4.500 3.878 2.863 4.717 0.217 3 0 "[ . 1 .]" 1 3612 1 36 ILE HB 1 36 ILE MD 2.500 . 3.000 2.800 2.248 3.223 0.223 10 0 "[ . 1 .]" 1 3613 1 30 ILE HA 1 36 ILE HB 5.000 . 5.500 5.556 5.431 5.657 0.157 2 0 "[ . 1 .]" 1 3614 1 31 GLN HA 1 36 ILE HB 4.000 . 4.500 3.589 3.163 4.028 . 0 0 "[ . 1 .]" 1 3615 1 34 GLU QB 1 36 ILE HB 4.000 . 4.500 3.587 3.380 3.729 . 0 0 "[ . 1 .]" 1 3616 1 34 GLU QG 1 36 ILE HB 5.500 . 6.000 5.278 4.918 5.588 . 0 0 "[ . 1 .]" 1 3617 1 30 ILE MG 1 36 ILE HB 2.500 . 3.000 2.308 2.168 2.429 . 0 0 "[ . 1 .]" 1 3618 1 30 ILE MD 1 36 ILE HB 4.000 . 4.500 4.629 4.376 4.804 0.304 3 0 "[ . 1 .]" 1 3619 1 30 ILE HB 1 36 ILE HB 4.000 . 4.500 4.320 4.052 4.511 0.011 2 0 "[ . 1 .]" 1 3620 1 34 GLU HA 1 36 ILE QG 4.500 . 5.000 4.264 4.112 4.573 . 0 0 "[ . 1 .]" 1 3621 1 36 ILE HA 1 36 ILE QG 3.000 . 3.500 2.716 2.321 3.081 . 0 0 "[ . 1 .]" 1 3622 1 30 ILE MG 1 36 ILE QG 2.500 . 3.000 3.013 2.843 3.256 0.256 12 0 "[ . 1 .]" 1 3623 1 30 ILE MD 1 36 ILE QG 4.500 . 5.000 5.034 4.740 5.353 0.353 8 0 "[ . 1 .]" 1 3624 1 31 GLN HA 1 37 PRO HA 4.000 . 4.500 4.643 4.481 4.818 0.318 1 0 "[ . 1 .]" 1 3625 1 37 PRO HA 1 37 PRO QG 3.000 . 3.500 3.202 2.896 3.510 0.010 7 0 "[ . 1 .]" 1 3626 1 37 PRO HA 1 38 PRO QG 4.000 . 4.500 3.944 3.866 4.083 . 0 0 "[ . 1 .]" 1 3627 1 37 PRO HA 1 38 PRO QD 3.000 . 3.500 2.041 1.983 2.173 . 0 0 "[ . 1 .]" 1 3628 1 37 PRO QB 1 37 PRO QD 3.000 . 3.500 2.770 2.740 2.809 . 0 0 "[ . 1 .]" 1 3629 1 37 PRO QB 1 38 PRO QD 3.000 . 3.500 2.474 2.215 2.636 . 0 0 "[ . 1 .]" 1 3630 1 37 PRO QB 1 39 ASP QB 3.000 . 3.500 3.109 2.969 3.496 . 0 0 "[ . 1 .]" 1 3631 1 36 ILE MG 1 37 PRO QB 4.000 . 4.500 4.307 3.999 4.690 0.190 6 0 "[ . 1 .]" 1 3632 1 36 ILE MG 1 37 PRO QG 3.600 . 4.100 3.968 3.288 4.567 0.467 10 0 "[ . 1 .]" 1 3633 1 37 PRO QD 1 40 GLN QG 4.000 . 4.500 3.504 2.467 4.056 . 0 0 "[ . 1 .]" 1 3634 1 36 ILE MG 1 37 PRO QD 3.000 . 3.500 2.529 2.106 2.918 . 0 0 "[ . 1 .]" 1 3635 1 36 ILE MD 1 37 PRO QD 4.000 . 4.500 3.845 3.098 4.683 0.183 1 0 "[ . 1 .]" 1 3636 1 36 ILE HB 1 37 PRO QD 4.000 . 4.500 4.220 4.035 4.344 . 0 0 "[ . 1 .]" 1 3637 1 38 PRO HA 1 38 PRO QG 2.500 . 3.000 2.997 2.851 3.464 0.464 6 0 "[ . 1 .]" 1 3638 1 28 ALA HA 1 38 PRO QB 5.000 . 5.500 5.419 4.680 5.608 0.108 12 0 "[ . 1 .]" 1 3639 1 38 PRO QB 1 38 PRO QD 2.500 . 3.000 2.751 2.733 2.781 . 0 0 "[ . 1 .]" 1 3640 1 38 PRO QB 1 39 ASP QB 4.000 . 4.500 4.267 3.800 4.466 . 0 0 "[ . 1 .]" 1 3641 1 38 PRO HA 1 38 PRO QD 4.000 . 4.500 3.342 3.205 3.408 . 0 0 "[ . 1 .]" 1 3642 1 38 PRO QB 1 39 ASP H 5.000 . 5.500 2.724 2.454 3.189 . 0 0 "[ . 1 .]" 1 3643 1 39 ASP HA 1 39 ASP QB 2.500 . 3.000 2.405 2.385 2.415 . 0 0 "[ . 1 .]" 1 3644 1 40 GLN HA 1 40 GLN QB 2.500 . 3.000 2.405 2.362 2.464 . 0 0 "[ . 1 .]" 1 3645 1 40 GLN HA 1 40 GLN QG 2.500 . 3.000 2.304 2.169 2.487 . 0 0 "[ . 1 .]" 1 3646 1 40 GLN HA 1 72 ARG QB 3.500 . 4.000 2.876 1.974 3.806 . 0 0 "[ . 1 .]" 1 3647 1 40 GLN HA 1 72 ARG QG 3.500 . 4.000 2.809 1.992 4.128 0.128 15 0 "[ . 1 .]" 1 3648 1 40 GLN HA 1 72 ARG QD 4.000 . 4.500 3.142 2.373 4.645 0.145 5 0 "[ . 1 .]" 1 3649 1 40 GLN HA 1 71 LEU QD 4.000 . 4.500 4.509 3.940 4.783 0.283 12 0 "[ . 1 .]" 1 3650 1 36 ILE MG 1 40 GLN QB 3.000 . 3.500 2.434 1.922 3.067 . 0 0 "[ . 1 .]" 1 3651 1 36 ILE MD 1 40 GLN QB 4.000 . 4.500 4.171 3.630 4.667 0.167 12 0 "[ . 1 .]" 1 3652 1 40 GLN QB 1 71 LEU QD 3.500 . 4.000 3.207 2.291 3.798 . 0 0 "[ . 1 .]" 1 3653 1 40 GLN QG 1 72 ARG QB 4.000 . 4.500 2.227 2.032 3.059 . 0 0 "[ . 1 .]" 1 3654 1 40 GLN QG 1 72 ARG QG . . 3.500 3.254 2.117 3.761 0.261 5 0 "[ . 1 .]" 1 3655 1 40 GLN QG 1 72 ARG QD 5.000 . 5.500 3.388 2.084 4.524 . 0 0 "[ . 1 .]" 1 3656 1 36 ILE MG 1 40 GLN QG 3.500 . 4.000 3.877 2.721 4.260 0.260 14 0 "[ . 1 .]" 1 3657 1 40 GLN QB 1 41 GLN HA 5.000 . 5.500 4.166 3.964 4.516 . 0 0 "[ . 1 .]" 1 3658 1 41 GLN HA 1 71 LEU HA 5.000 . 5.500 4.003 3.161 4.752 . 0 0 "[ . 1 .]" 1 3659 1 41 GLN HA 1 69 LEU QD 3.000 . 3.500 2.312 2.026 2.524 . 0 0 "[ . 1 .]" 1 3660 1 41 GLN HA 1 71 LEU QD 3.000 . 3.500 3.038 2.419 3.571 0.071 15 0 "[ . 1 .]" 1 3661 1 41 GLN QB 1 69 LEU QD 2.500 . 3.000 2.980 1.908 3.268 0.268 5 0 "[ . 1 .]" 1 3662 1 41 GLN HA 1 41 GLN QG 2.500 . 3.000 2.392 2.044 3.282 0.282 4 0 "[ . 1 .]" 1 3663 1 36 ILE MG 1 41 GLN QG 2.500 . 3.000 2.038 1.782 3.072 0.072 4 0 "[ . 1 .]" 1 3664 1 42 ARG HA 1 42 ARG QB 2.500 . 3.000 2.417 2.373 2.503 . 0 0 "[ . 1 .]" 1 3665 1 42 ARG HA 1 42 ARG QD 4.000 . 4.500 3.531 2.005 4.179 . 0 0 "[ . 1 .]" 1 3666 1 42 ARG HA 1 43 LEU HA 6.000 . 6.500 4.433 4.388 4.480 . 0 0 "[ . 1 .]" 1 3667 1 42 ARG HA 1 44 ILE MD 5.500 . 6.000 5.388 5.165 5.614 . 0 0 "[ . 1 .]" 1 3668 1 42 ARG HA 1 70 VAL HB 4.500 . 5.000 4.770 4.549 4.987 . 0 0 "[ . 1 .]" 1 3669 1 42 ARG QB 1 42 ARG QD 3.000 . 3.500 2.210 2.118 2.305 . 0 0 "[ . 1 .]" 1 3670 1 42 ARG QB 1 44 ILE MD 3.000 . 3.500 3.314 3.116 3.498 . 0 0 "[ . 1 .]" 1 3671 1 42 ARG QB 1 70 VAL QG 4.000 . 4.500 2.838 2.594 2.993 . 0 0 "[ . 1 .]" 1 3672 1 42 ARG QB 1 44 ILE QG 5.000 . 5.500 3.260 3.079 3.394 . 0 0 "[ . 1 .]" 1 3673 1 42 ARG QD 1 70 VAL HB 5.000 . 5.500 3.559 2.821 4.728 . 0 0 "[ . 1 .]" 1 3674 1 43 LEU HA 1 69 LEU HA 4.000 . 4.500 2.846 2.747 3.082 . 0 0 "[ . 1 .]" 1 3675 1 43 LEU HA 1 43 LEU QD 3.000 . 3.500 2.023 1.974 2.076 . 0 0 "[ . 1 .]" 1 3676 1 43 LEU HA 1 43 LEU HG 4.000 . 4.500 3.087 2.890 3.268 . 0 0 "[ . 1 .]" 1 3677 1 43 LEU QB 1 43 LEU QD 2.500 . 3.000 1.935 1.916 1.957 . 0 0 "[ . 1 .]" 1 3678 1 23 ILE MG 1 43 LEU HG 3.500 . 4.000 3.986 3.678 4.197 0.197 9 0 "[ . 1 .]" 1 3679 1 44 ILE HA 1 49 GLN QB 5.000 . 5.500 4.179 4.037 4.403 . 0 0 "[ . 1 .]" 1 3680 1 42 ARG QD 1 44 ILE MD 4.000 . 4.500 4.373 4.010 4.649 0.149 13 0 "[ . 1 .]" 1 3681 1 44 ILE MD 1 44 ILE MG 2.500 . 3.000 1.962 1.909 2.056 . 0 0 "[ . 1 .]" 1 3682 1 44 ILE QG 1 44 ILE MG 3.000 . 3.500 2.201 2.153 2.223 . 0 0 "[ . 1 .]" 1 3683 1 44 ILE HB 1 44 ILE MD 3.000 . 3.500 2.297 2.213 2.356 . 0 0 "[ . 1 .]" 1 3684 1 42 ARG HA 1 44 ILE QG 5.000 . 5.500 4.646 4.471 4.811 . 0 0 "[ . 1 .]" 1 3685 1 44 ILE QG 1 49 GLN QB 4.000 . 4.500 2.585 2.402 2.871 . 0 0 "[ . 1 .]" 1 3686 1 44 ILE HA 1 45 PHE HA 4.000 . 4.500 4.433 4.425 4.440 . 0 0 "[ . 1 .]" 1 3687 1 45 PHE HA 1 50 LEU QD 4.000 . 4.500 4.084 3.728 4.385 . 0 0 "[ . 1 .]" 1 3688 1 44 ILE MG 1 45 PHE HA 4.000 . 4.500 3.595 3.491 3.671 . 0 0 "[ . 1 .]" 1 3689 1 45 PHE HA 1 61 ILE MD 5.000 . 5.500 5.142 4.911 5.427 . 0 0 "[ . 1 .]" 1 3690 1 45 PHE QB 1 50 LEU QD 4.000 . 4.500 2.121 1.936 2.507 . 0 0 "[ . 1 .]" 1 3691 1 45 PHE QB 1 61 ILE MD 5.000 . 5.500 2.534 2.250 2.816 . 0 0 "[ . 1 .]" 1 3692 1 45 PHE QB 1 67 LEU QD 4.000 . 4.500 2.398 1.946 2.852 . 0 0 "[ . 1 .]" 1 3693 1 45 PHE HA 1 45 PHE QD 4.000 . 4.500 2.736 2.601 2.826 . 0 0 "[ . 1 .]" 1 3694 1 45 PHE QD 1 60 ASN QB 5.000 . 5.500 4.530 4.195 4.943 . 0 0 "[ . 1 .]" 1 3695 1 45 PHE QD 1 61 ILE HA 4.000 . 4.500 4.025 3.729 4.397 . 0 0 "[ . 1 .]" 1 3696 1 45 PHE QD 1 65 SER HA 5.000 . 5.500 5.493 5.281 5.632 0.132 15 0 "[ . 1 .]" 1 3697 1 45 PHE QD 1 65 SER QB 5.000 . 5.500 3.945 3.439 4.805 . 0 0 "[ . 1 .]" 1 3698 1 45 PHE QD 1 67 LEU HA 5.000 . 5.500 2.374 2.142 2.522 . 0 0 "[ . 1 .]" 1 3699 1 45 PHE QD 1 50 LEU QD 3.000 . 3.500 3.435 3.166 3.635 0.135 6 0 "[ . 1 .]" 1 3700 1 45 PHE QD 1 67 LEU HG 4.000 . 4.500 2.387 2.021 3.207 . 0 0 "[ . 1 .]" 1 3701 1 45 PHE QD 1 61 ILE MD 4.000 . 4.500 3.119 2.958 3.257 . 0 0 "[ . 1 .]" 1 3702 1 45 PHE QD 1 61 ILE MG 4.000 . 4.500 4.109 3.968 4.262 . 0 0 "[ . 1 .]" 1 3703 1 45 PHE QD 1 67 LEU QD 2.500 . 3.000 2.772 2.282 3.133 0.133 3 0 "[ . 1 .]" 1 3704 1 45 PHE QE 1 60 ASN QB 4.000 . 4.500 3.228 2.700 3.702 . 0 0 "[ . 1 .]" 1 3705 1 45 PHE QE 1 61 ILE HA 4.000 . 4.500 2.943 2.653 3.162 . 0 0 "[ . 1 .]" 1 3706 1 45 PHE QE 1 65 SER HA 4.000 . 4.500 3.712 3.463 3.940 . 0 0 "[ . 1 .]" 1 3707 1 45 PHE QE 1 65 SER QB 4.000 . 4.500 2.859 2.226 3.899 . 0 0 "[ . 1 .]" 1 3708 1 45 PHE QE 1 61 ILE MD 4.000 . 4.500 4.372 4.216 4.522 0.022 3 0 "[ . 1 .]" 1 3709 1 45 PHE QE 1 61 ILE MG 4.000 . 4.500 4.014 3.790 4.166 . 0 0 "[ . 1 .]" 1 3710 1 45 PHE HZ 1 60 ASN QB 5.000 . 5.500 5.080 4.537 5.519 0.019 11 0 "[ . 1 .]" 1 3711 1 45 PHE HZ 1 61 ILE HA 4.000 . 4.500 3.543 3.250 3.762 . 0 0 "[ . 1 .]" 1 3712 1 45 PHE HZ 1 65 SER HA 4.000 . 4.500 4.445 4.166 4.551 0.051 4 0 "[ . 1 .]" 1 3713 1 45 PHE HZ 1 65 SER QB 4.000 . 4.500 3.324 3.005 3.955 . 0 0 "[ . 1 .]" 1 3714 1 45 PHE HZ 1 61 ILE HB 6.000 . 6.500 6.362 6.187 6.563 0.063 3 0 "[ . 1 .]" 1 3715 1 45 PHE HZ 1 61 ILE MG 4.000 . 4.500 4.433 4.069 4.628 0.128 4 0 "[ . 1 .]" 1 3716 1 45 PHE HA 1 46 ALA MB 5.000 . 5.500 4.174 4.118 4.217 . 0 0 "[ . 1 .]" 1 3717 1 48 LYS HA 1 48 LYS QB 2.500 . 3.000 2.269 2.163 2.321 . 0 0 "[ . 1 .]" 1 3718 1 48 LYS HA 1 48 LYS QG 3.000 . 3.500 2.744 2.344 3.372 . 0 0 "[ . 1 .]" 1 3719 1 48 LYS HA 1 48 LYS QD 3.500 . 4.000 3.604 2.039 4.215 0.215 13 0 "[ . 1 .]" 1 3720 1 48 LYS HA 1 48 LYS QE 4.000 . 4.500 4.261 3.340 4.752 0.252 4 0 "[ . 1 .]" 1 3721 1 44 ILE MG 1 48 LYS HA 4.000 . 4.500 3.743 3.556 4.107 . 0 0 "[ . 1 .]" 1 3722 1 44 ILE QG 1 48 LYS HA 5.000 . 5.500 5.402 5.251 5.577 0.077 4 0 "[ . 1 .]" 1 3723 1 48 LYS QB 1 48 LYS QE 3.000 . 3.500 2.501 2.016 3.555 0.055 11 0 "[ . 1 .]" 1 3724 1 48 LYS QE 1 48 LYS QG 3.000 . 3.500 2.095 1.955 2.266 . 0 0 "[ . 1 .]" 1 3725 1 48 LYS HA 1 50 LEU QD 6.000 . 6.500 5.224 4.483 5.521 . 0 0 "[ . 1 .]" 1 3726 1 48 LYS QB 1 50 LEU QD 4.000 . 4.500 3.699 2.580 4.504 0.004 14 0 "[ . 1 .]" 1 3727 1 48 LYS QG 1 50 LEU QD 5.000 . 5.500 4.619 3.375 5.550 0.050 2 0 "[ . 1 .]" 1 3728 1 48 LYS QD 1 50 LEU QD 5.000 . 5.500 4.875 4.507 5.410 . 0 0 "[ . 1 .]" 1 3729 1 48 LYS QE 1 50 LEU QD 5.000 . 5.500 5.424 5.005 5.655 0.155 13 0 "[ . 1 .]" 1 3730 1 44 ILE MG 1 49 GLN HA 5.000 . 5.500 2.607 2.492 2.908 . 0 0 "[ . 1 .]" 1 3731 1 49 GLN QB 1 51 GLU HA 5.000 . 5.500 5.069 4.964 5.287 . 0 0 "[ . 1 .]" 1 3732 1 44 ILE MD 1 49 GLN QB 3.000 . 3.500 3.336 3.214 3.460 . 0 0 "[ . 1 .]" 1 3733 1 49 GLN QG 1 51 GLU HA 3.500 . 4.000 3.847 3.496 4.076 0.076 13 0 "[ . 1 .]" 1 3734 1 44 ILE MD 1 49 GLN QG 4.000 . 4.500 3.191 3.040 3.319 . 0 0 "[ . 1 .]" 1 3735 1 44 ILE QG 1 49 GLN QG 5.000 . 5.500 2.054 1.984 2.287 . 0 0 "[ . 1 .]" 1 3736 1 50 LEU HA 1 50 LEU QD 3.000 . 3.500 2.136 2.017 2.453 . 0 0 "[ . 1 .]" 1 3737 1 23 ILE MG 1 50 LEU HA 4.000 . 4.500 3.866 3.546 4.119 . 0 0 "[ . 1 .]" 1 3738 1 23 ILE MD 1 50 LEU HA 4.000 . 4.500 3.693 3.379 3.831 . 0 0 "[ . 1 .]" 1 3739 1 50 LEU QB 1 50 LEU QD 2.500 . 3.000 1.915 1.895 1.940 . 0 0 "[ . 1 .]" 1 3740 1 23 ILE MD 1 50 LEU QB 3.000 . 3.500 2.202 1.982 2.701 . 0 0 "[ . 1 .]" 1 3741 1 23 ILE MG 1 50 LEU QD 2.500 . 3.000 2.554 2.232 2.974 . 0 0 "[ . 1 .]" 1 3742 1 23 ILE QG 1 50 LEU QD 4.000 . 4.500 3.229 2.865 3.527 . 0 0 "[ . 1 .]" 1 3743 1 23 ILE MD 1 50 LEU QD 4.000 . 4.500 1.950 1.764 2.207 0.036 6 0 "[ . 1 .]" 1 3744 1 50 LEU QD 1 67 LEU HG 4.000 . 4.500 3.647 2.891 4.486 . 0 0 "[ . 1 .]" 1 3745 1 26 VAL QG 1 50 LEU QD 6.000 . 6.500 3.407 3.208 3.641 . 0 0 "[ . 1 .]" 1 3746 1 43 LEU QD 1 50 LEU QD 4.000 . 4.500 2.663 2.470 2.990 . 0 0 "[ . 1 .]" 1 3747 1 50 LEU QD 1 56 LEU QD 5.000 . 5.500 2.806 2.383 3.550 . 0 0 "[ . 1 .]" 1 3748 1 50 LEU QD 1 61 ILE MD 4.000 . 4.500 1.934 1.787 2.154 0.013 9 0 "[ . 1 .]" 1 3749 1 50 LEU QD 1 61 ILE MG 5.000 . 5.500 3.963 3.774 4.140 . 0 0 "[ . 1 .]" 1 3750 1 50 LEU QD 1 67 LEU QD 4.000 . 4.500 2.100 1.927 2.596 . 0 0 "[ . 1 .]" 1 3751 1 51 GLU HA 1 51 GLU QG 3.000 . 3.500 2.668 2.321 3.301 . 0 0 "[ . 1 .]" 1 3752 1 51 GLU QG 1 54 ARG QG 3.500 . 4.000 3.207 1.879 4.260 0.260 11 0 "[ . 1 .]" 1 3753 1 52 ASP HA 1 59 TYR QE 6.000 . 6.500 6.460 5.936 6.740 0.240 9 0 "[ . 1 .]" 1 3754 1 23 ILE HA 1 52 ASP HA 5.000 . 5.500 5.497 4.801 5.797 0.297 9 0 "[ . 1 .]" 1 3755 1 23 ILE MG 1 52 ASP HA 4.000 . 4.500 3.222 2.757 3.527 . 0 0 "[ . 1 .]" 1 3756 1 23 ILE HB 1 52 ASP HA 3.000 . 3.500 2.539 2.012 2.994 . 0 0 "[ . 1 .]" 1 3757 1 23 ILE QG 1 52 ASP HA 4.000 . 4.500 3.725 3.158 4.294 . 0 0 "[ . 1 .]" 1 3758 1 23 ILE MD 1 52 ASP HA 5.000 . 5.500 5.079 4.706 5.423 . 0 0 "[ . 1 .]" 1 3759 1 54 ARG HA 1 54 ARG QG 2.500 . 3.000 2.639 2.394 2.796 . 0 0 "[ . 1 .]" 1 3760 1 54 ARG HA 1 54 ARG QD 3.000 . 3.500 3.133 2.866 3.599 0.099 14 0 "[ . 1 .]" 1 3761 1 54 ARG HA 1 58 ASP QB 4.000 . 4.500 3.853 3.545 4.118 . 0 0 "[ . 1 .]" 1 3762 1 54 ARG HA 1 55 THR MG 3.500 . 4.000 3.352 3.227 3.418 . 0 0 "[ . 1 .]" 1 3763 1 54 ARG QB 1 54 ARG QD 2.500 . 3.000 2.131 2.044 2.218 . 0 0 "[ . 1 .]" 1 3764 1 23 ILE MD 1 55 THR HA 5.000 . 5.500 3.414 2.951 3.823 . 0 0 "[ . 1 .]" 1 3765 1 55 THR HA 1 55 THR MG 3.000 . 3.500 2.311 2.276 2.386 . 0 0 "[ . 1 .]" 1 3766 1 22 THR MG 1 55 THR HA 3.500 . 4.000 3.666 3.575 3.784 . 0 0 "[ . 1 .]" 1 3767 1 22 THR HB 1 55 THR HA 4.000 . 4.500 4.270 4.223 4.347 . 0 0 "[ . 1 .]" 1 3768 1 22 THR HA 1 55 THR MG 3.000 . 3.500 2.647 2.377 2.849 . 0 0 "[ . 1 .]" 1 3769 1 54 ARG QD 1 55 THR MG 5.500 . 6.000 5.175 4.555 5.570 . 0 0 "[ . 1 .]" 1 3770 1 55 THR MG 1 57 SER QB 5.000 . 5.500 5.174 5.109 5.247 . 0 0 "[ . 1 .]" 1 3771 1 22 THR MG 1 55 THR MG 2.500 . 3.000 2.420 2.238 2.674 . 0 0 "[ . 1 .]" 1 3772 1 22 THR HB 1 55 THR MG 4.000 . 4.500 3.921 3.728 4.139 . 0 0 "[ . 1 .]" 1 3773 1 55 THR HA 1 55 THR HB 3.000 . 3.500 2.440 2.396 2.453 . 0 0 "[ . 1 .]" 1 3774 1 22 THR HB 1 55 THR HB 5.500 . 6.000 6.039 5.949 6.077 0.077 1 0 "[ . 1 .]" 1 3775 1 56 LEU H 1 56 LEU QD 3.000 . 3.500 3.012 2.148 3.145 . 0 0 "[ . 1 .]" 1 3776 1 56 LEU H 1 56 LEU HG 4.000 . 4.500 2.518 2.285 3.989 . 0 0 "[ . 1 .]" 1 3777 1 56 LEU HA 1 56 LEU QD 3.000 . 3.500 2.111 2.018 2.717 . 0 0 "[ . 1 .]" 1 3778 1 56 LEU HA 1 56 LEU HG 3.000 . 3.500 2.681 2.079 2.793 . 0 0 "[ . 1 .]" 1 3779 1 56 LEU HA 1 61 ILE HB 4.000 . 4.500 3.012 2.879 3.108 . 0 0 "[ . 1 .]" 1 3780 1 56 LEU HA 1 61 ILE MD 4.000 . 4.500 2.030 1.985 2.094 . 0 0 "[ . 1 .]" 1 3781 1 56 LEU HA 1 61 ILE MG 4.000 . 4.500 4.004 3.933 4.138 . 0 0 "[ . 1 .]" 1 3782 1 17 VAL QG 1 56 LEU QB 3.500 . 4.000 3.680 3.611 3.831 . 0 0 "[ . 1 .]" 1 3783 1 56 LEU QB 1 56 LEU QD 2.500 . 3.000 1.891 1.819 1.936 . 0 0 "[ . 1 .]" 1 3784 1 56 LEU QB 1 61 ILE HB 5.000 . 5.500 2.141 2.068 2.307 . 0 0 "[ . 1 .]" 1 3785 1 56 LEU QB 1 61 ILE MD 5.000 . 5.500 2.965 2.806 3.310 . 0 0 "[ . 1 .]" 1 3786 1 56 LEU QB 1 61 ILE MG 4.000 . 4.500 2.768 2.528 3.383 . 0 0 "[ . 1 .]" 1 3787 1 19 PRO HA 1 56 LEU QD 3.000 . 3.500 3.363 3.066 3.501 0.001 15 0 "[ . 1 .]" 1 3788 1 56 LEU QD 1 61 ILE HA 4.000 . 4.500 4.647 4.571 4.709 0.209 13 0 "[ . 1 .]" 1 3789 1 56 LEU QD 1 61 ILE HB 3.000 . 3.500 2.558 2.454 2.840 . 0 0 "[ . 1 .]" 1 3790 1 56 LEU QD 1 61 ILE MD 2.500 . 3.000 1.944 1.789 2.775 0.011 9 0 "[ . 1 .]" 1 3791 1 56 LEU QD 1 61 ILE MG 2.500 . 3.000 2.037 1.943 2.148 . 0 0 "[ . 1 .]" 1 3792 1 56 LEU QD 1 61 ILE QG 5.000 . 5.500 3.438 3.311 3.977 . 0 0 "[ . 1 .]" 1 3793 1 23 ILE MD 1 56 LEU HG 3.000 . 3.500 3.164 2.742 3.577 0.077 11 0 "[ . 1 .]" 1 3794 1 57 SER HA 1 57 SER QB 2.500 . 3.000 2.188 2.185 2.192 . 0 0 "[ . 1 .]" 1 3795 1 57 SER QB 1 60 ASN HA 4.000 . 4.500 4.525 4.463 4.565 0.065 6 0 "[ . 1 .]" 1 3796 1 58 ASP HA 1 58 ASP QB 2.500 . 3.000 2.404 2.391 2.425 . 0 0 "[ . 1 .]" 1 3797 1 59 TYR HA 1 60 ASN QB 4.000 . 4.500 3.882 3.848 3.918 . 0 0 "[ . 1 .]" 1 3798 1 59 TYR HA 1 61 ILE HA 6.000 . 6.500 6.471 6.410 6.532 0.032 3 0 "[ . 1 .]" 1 3799 1 50 LEU QD 1 59 TYR HA 4.000 . 4.500 4.433 4.301 4.580 0.080 8 0 "[ . 1 .]" 1 3800 1 59 TYR HA 1 61 ILE MD 4.000 . 4.500 4.588 4.549 4.634 0.134 13 0 "[ . 1 .]" 1 3801 1 50 LEU QD 1 59 TYR QB 5.000 . 5.500 2.576 2.343 2.745 . 0 0 "[ . 1 .]" 1 3802 1 59 TYR QB 1 61 ILE MD 4.000 . 4.500 1.997 1.967 2.048 . 0 0 "[ . 1 .]" 1 3803 1 59 TYR QB 1 61 ILE MG 5.000 . 5.500 4.389 4.313 4.470 . 0 0 "[ . 1 .]" 1 3804 1 48 LYS QB 1 59 TYR QD 5.000 . 5.500 2.680 1.913 3.877 . 0 0 "[ . 1 .]" 1 3805 1 48 LYS QG 1 59 TYR QD 4.000 . 4.500 3.415 1.952 4.571 0.071 15 0 "[ . 1 .]" 1 3806 1 48 LYS QD 1 59 TYR QD 4.000 . 4.500 3.345 2.769 4.676 0.176 6 0 "[ . 1 .]" 1 3807 1 48 LYS QE 1 59 TYR QD 4.000 . 4.500 3.967 3.290 4.615 0.115 9 0 "[ . 1 .]" 1 3808 1 54 ARG HA 1 59 TYR QD 5.000 . 5.500 5.648 5.593 5.708 0.208 3 0 "[ . 1 .]" 1 3809 1 54 ARG QG 1 59 TYR QD 4.000 . 4.500 4.747 4.599 4.916 0.416 11 0 "[ . 1 .]" 1 3810 1 54 ARG QD 1 59 TYR QD 4.000 . 4.500 4.302 3.460 4.544 0.044 3 0 "[ . 1 .]" 1 3811 1 56 LEU HA 1 59 TYR QD 4.000 . 4.500 3.538 3.105 3.623 . 0 0 "[ . 1 .]" 1 3812 1 58 ASP HA 1 59 TYR QD 4.000 . 4.500 4.648 4.580 4.810 0.310 11 0 "[ . 1 .]" 1 3813 1 58 ASP QB 1 59 TYR QD 4.000 . 4.500 2.265 2.144 2.428 . 0 0 "[ . 1 .]" 1 3814 1 59 TYR HA 1 59 TYR QD 3.000 . 3.500 2.987 2.859 3.019 . 0 0 "[ . 1 .]" 1 3815 1 50 LEU QD 1 59 TYR QD 4.000 . 4.500 2.528 2.317 2.627 . 0 0 "[ . 1 .]" 1 3816 1 23 ILE MG 1 59 TYR QD 5.000 . 5.500 5.541 5.366 5.627 0.127 5 0 "[ . 1 .]" 1 3817 1 23 ILE QG 1 59 TYR QD 5.000 . 5.500 4.114 3.811 4.452 . 0 0 "[ . 1 .]" 1 3818 1 23 ILE MD 1 59 TYR QD 4.000 . 4.500 3.131 2.809 3.294 . 0 0 "[ . 1 .]" 1 3819 1 56 LEU QD 1 59 TYR QD 4.000 . 4.500 4.462 4.380 4.672 0.172 11 0 "[ . 1 .]" 1 3820 1 59 TYR QD 1 61 ILE MD 4.000 . 4.500 3.275 2.905 3.382 . 0 0 "[ . 1 .]" 1 3821 1 48 LYS QB 1 59 TYR QE 5.000 . 5.500 2.278 1.789 2.724 0.011 11 0 "[ . 1 .]" 1 3822 1 48 LYS QG 1 59 TYR QE 4.000 . 4.500 3.525 2.031 4.508 0.008 9 0 "[ . 1 .]" 1 3823 1 48 LYS QD 1 59 TYR QE 4.000 . 4.500 3.930 3.020 4.504 0.004 6 0 "[ . 1 .]" 1 3824 1 48 LYS QE 1 59 TYR QE 4.000 . 4.500 3.868 3.350 4.583 0.083 11 0 "[ . 1 .]" 1 3825 1 50 LEU HA 1 59 TYR QE 5.000 . 5.500 3.026 2.734 3.391 . 0 0 "[ . 1 .]" 1 3826 1 50 LEU QB 1 59 TYR QE 5.000 . 5.500 4.087 3.911 4.346 . 0 0 "[ . 1 .]" 1 3827 1 54 ARG HA 1 59 TYR QE 4.000 . 4.500 4.317 4.220 4.372 . 0 0 "[ . 1 .]" 1 3828 1 54 ARG QB 1 59 TYR QE 4.000 . 4.500 1.806 1.736 1.840 0.064 11 0 "[ . 1 .]" 1 3829 1 54 ARG QG 1 59 TYR QE 3.000 . 3.500 2.662 2.524 2.953 . 0 0 "[ . 1 .]" 1 3830 1 54 ARG QD 1 59 TYR QE 3.000 . 3.500 2.902 2.081 3.203 . 0 0 "[ . 1 .]" 1 3831 1 56 LEU HA 1 59 TYR QE 5.000 . 5.500 5.355 4.928 5.459 . 0 0 "[ . 1 .]" 1 3832 1 58 ASP HA 1 59 TYR QE 5.000 . 5.500 5.721 5.663 5.782 0.282 9 0 "[ . 1 .]" 1 3833 1 58 ASP QB 1 59 TYR QE 4.000 . 4.500 2.929 2.851 3.003 . 0 0 "[ . 1 .]" 1 3834 1 59 TYR HA 1 59 TYR QE 4.000 . 4.500 4.526 4.497 4.556 0.056 3 0 "[ . 1 .]" 1 3835 1 50 LEU QD 1 59 TYR QE 4.000 . 4.500 2.737 2.569 2.928 . 0 0 "[ . 1 .]" 1 3836 1 23 ILE MG 1 59 TYR QE 5.000 . 5.500 4.875 4.470 5.037 . 0 0 "[ . 1 .]" 1 3837 1 23 ILE QG 1 59 TYR QE 4.000 . 4.500 3.161 2.629 3.329 . 0 0 "[ . 1 .]" 1 3838 1 23 ILE MD 1 59 TYR QE 4.000 . 4.500 3.288 2.595 3.595 . 0 0 "[ . 1 .]" 1 3839 1 56 LEU QD 1 59 TYR QE 5.000 . 5.500 5.551 5.483 5.595 0.095 2 0 "[ . 1 .]" 1 3840 1 59 TYR QE 1 61 ILE MD 4.000 . 4.500 4.719 4.520 4.783 0.283 12 0 "[ . 1 .]" 1 3841 1 60 ASN HA 1 60 ASN QB 2.500 . 3.000 2.439 2.421 2.445 . 0 0 "[ . 1 .]" 1 3842 1 60 ASN QB 1 61 ILE MD 5.000 . 5.500 5.481 5.433 5.511 0.011 6 0 "[ . 1 .]" 1 3843 1 61 ILE HA 1 62 GLN HA 5.000 . 5.500 4.409 4.389 4.434 . 0 0 "[ . 1 .]" 1 3844 1 61 ILE HA 1 62 GLN QG 5.000 . 5.500 3.918 3.692 4.072 . 0 0 "[ . 1 .]" 1 3845 1 61 ILE HA 1 61 ILE MD 4.000 . 4.500 3.807 3.785 3.831 . 0 0 "[ . 1 .]" 1 3846 1 61 ILE HA 1 61 ILE MG 3.000 . 3.500 2.389 2.343 2.417 . 0 0 "[ . 1 .]" 1 3847 1 3 ILE MD 1 61 ILE HB 4.000 . 4.500 4.644 4.584 4.709 0.209 3 0 "[ . 1 .]" 1 3848 1 3 ILE MG 1 61 ILE HB 4.000 . 4.500 4.141 4.016 4.243 . 0 0 "[ . 1 .]" 1 3849 1 56 LEU HG 1 61 ILE MD 4.000 . 4.500 3.594 1.989 3.913 . 0 0 "[ . 1 .]" 1 3850 1 61 ILE MD 1 61 ILE MG 2.500 . 3.000 2.147 1.943 2.229 . 0 0 "[ . 1 .]" 1 3851 1 61 ILE MG 1 63 LYS HA 4.000 . 4.500 4.616 4.560 4.718 0.218 4 0 "[ . 1 .]" 1 3852 1 56 LEU HG 1 61 ILE MG 4.000 . 4.500 4.338 2.542 4.663 0.163 6 0 "[ . 1 .]" 1 3853 1 61 ILE QG 1 61 ILE MG 3.000 . 3.500 2.204 2.157 2.233 . 0 0 "[ . 1 .]" 1 3854 1 59 TYR HA 1 61 ILE QG 6.000 . 6.500 4.343 4.173 4.427 . 0 0 "[ . 1 .]" 1 3855 1 59 TYR QB 1 61 ILE QG 6.000 . 6.500 2.211 2.009 2.293 . 0 0 "[ . 1 .]" 1 3856 1 62 GLN HA 1 62 GLN QB 2.500 . 3.000 2.380 2.187 2.413 . 0 0 "[ . 1 .]" 1 3857 1 62 GLN HA 1 62 GLN QG 2.500 . 3.000 2.475 2.324 3.279 0.279 2 0 "[ . 1 .]" 1 3858 1 62 GLN HA 1 63 LYS QB 4.000 . 4.500 4.382 4.348 4.404 . 0 0 "[ . 1 .]" 1 3859 1 62 GLN HA 1 63 LYS QG 5.500 . 6.000 5.772 5.726 5.816 . 0 0 "[ . 1 .]" 1 3860 1 3 ILE MG 1 62 GLN HA 5.000 . 5.500 4.584 4.413 4.835 . 0 0 "[ . 1 .]" 1 3861 1 61 ILE MG 1 62 GLN HA 5.000 . 5.500 3.888 3.796 3.986 . 0 0 "[ . 1 .]" 1 3862 1 61 ILE MG 1 62 GLN QG 5.000 . 5.500 4.647 3.957 4.867 . 0 0 "[ . 1 .]" 1 3863 1 1 MET QB 1 63 LYS HA 4.000 . 4.500 4.077 3.949 4.207 . 0 0 "[ . 1 .]" 1 3864 1 63 LYS HA 1 63 LYS QB 2.500 . 3.000 2.438 2.418 2.452 . 0 0 "[ . 1 .]" 1 3865 1 63 LYS HA 1 63 LYS QG 3.000 . 3.500 2.297 2.276 2.317 . 0 0 "[ . 1 .]" 1 3866 1 63 LYS HA 1 63 LYS QD 4.000 . 4.500 3.975 3.951 4.089 . 0 0 "[ . 1 .]" 1 3867 1 63 LYS HA 1 63 LYS QE 4.000 . 4.500 4.423 4.077 4.485 . 0 0 "[ . 1 .]" 1 3868 1 63 LYS HA 1 64 GLU QG 4.000 . 4.500 4.038 3.822 4.140 . 0 0 "[ . 1 .]" 1 3869 1 17 VAL QG 1 63 LYS HA 4.000 . 4.500 4.550 4.473 4.656 0.156 13 0 "[ . 1 .]" 1 3870 1 3 ILE MG 1 63 LYS HA 3.000 . 3.500 2.932 2.688 3.168 . 0 0 "[ . 1 .]" 1 3871 1 63 LYS QB 1 63 LYS QD 2.500 . 3.000 2.166 2.106 2.487 . 0 0 "[ . 1 .]" 1 3872 1 63 LYS QB 1 64 GLU QB 5.000 . 5.500 3.769 3.608 3.924 . 0 0 "[ . 1 .]" 1 3873 1 63 LYS QB 1 64 GLU QG 2.500 . 3.000 3.023 2.665 3.165 0.165 1 0 "[ . 1 .]" 1 3874 1 63 LYS QE 1 63 LYS QG 2.500 . 3.000 2.168 2.114 2.470 . 0 0 "[ . 1 .]" 1 3875 1 63 LYS QG 1 64 GLU HA 4.000 . 4.500 3.610 3.568 3.657 . 0 0 "[ . 1 .]" 1 3876 1 63 LYS QG 1 64 GLU QB 4.000 . 4.500 3.545 3.459 3.673 . 0 0 "[ . 1 .]" 1 3877 1 63 LYS QG 1 64 GLU QG 3.000 2.110 3.500 1.961 1.908 2.053 0.202 13 0 "[ . 1 .]" 1 3878 1 63 LYS QD 1 64 GLU HA 5.000 . 5.500 5.494 4.777 5.602 0.102 15 0 "[ . 1 .]" 1 3879 1 63 LYS QD 1 64 GLU QG 2.500 . 3.000 2.894 2.033 3.298 0.298 2 0 "[ . 1 .]" 1 3880 1 1 MET HA 1 63 LYS QE 6.000 . 6.500 3.517 3.131 4.731 . 0 0 "[ . 1 .]" 1 3881 1 63 LYS QB 1 63 LYS QE 3.000 . 3.500 3.209 1.837 3.529 0.029 12 0 "[ . 1 .]" 1 3882 1 63 LYS QE 1 64 GLU QB 4.000 . 4.500 4.537 3.711 4.714 0.214 10 0 "[ . 1 .]" 1 3883 1 63 LYS QE 1 64 GLU QG 3.000 . 3.500 2.660 1.959 3.677 0.177 10 0 "[ . 1 .]" 1 3884 1 3 ILE MD 1 63 LYS HA 6.000 3.800 6.500 5.710 5.482 5.910 . 0 0 "[ . 1 .]" 1 3885 1 64 GLU HA 1 64 GLU QG 3.000 . 3.500 2.341 2.306 2.417 . 0 0 "[ . 1 .]" 1 3886 1 3 ILE MG 1 64 GLU HA 5.000 . 5.500 4.221 4.076 4.332 . 0 0 "[ . 1 .]" 1 3887 1 65 SER HA 1 65 SER QB 2.500 . 3.000 2.390 2.305 2.448 . 0 0 "[ . 1 .]" 1 3888 1 65 SER HA 1 66 THR HA 5.000 . 5.500 4.380 4.361 4.400 . 0 0 "[ . 1 .]" 1 3889 1 3 ILE MG 1 65 SER HA 4.000 . 4.500 4.513 4.420 4.603 0.103 11 0 "[ . 1 .]" 1 3890 1 65 SER HA 1 66 THR MG 5.000 . 5.500 5.444 5.417 5.479 . 0 0 "[ . 1 .]" 1 3891 1 61 ILE MG 1 65 SER HA 4.000 . 4.500 4.511 4.395 4.585 0.085 8 0 "[ . 1 .]" 1 3892 1 65 SER HA 1 66 THR HB 5.000 . 5.500 4.681 4.642 4.753 . 0 0 "[ . 1 .]" 1 3893 1 65 SER HA 1 67 LEU QD 4.000 . 4.500 4.124 3.987 4.369 . 0 0 "[ . 1 .]" 1 3894 1 3 ILE MG 1 65 SER QB 4.000 . 4.500 2.302 2.172 2.430 . 0 0 "[ . 1 .]" 1 3895 1 61 ILE MD 1 65 SER QB 5.000 . 5.500 4.386 4.208 4.612 . 0 0 "[ . 1 .]" 1 3896 1 61 ILE MG 1 65 SER QB 3.000 . 3.500 1.995 1.948 2.039 . 0 0 "[ . 1 .]" 1 3897 1 65 SER QB 1 67 LEU QD 4.000 . 4.500 2.512 2.324 2.827 . 0 0 "[ . 1 .]" 1 3898 1 3 ILE MD 1 65 SER QB 6.000 . 6.500 4.104 3.930 4.277 . 0 0 "[ . 1 .]" 1 3899 1 5 VAL QG 1 66 THR HA 4.000 . 4.500 4.663 4.598 4.698 0.198 4 0 "[ . 1 .]" 1 3900 1 66 THR HA 1 66 THR MG 3.000 . 3.500 2.328 2.270 2.381 . 0 0 "[ . 1 .]" 1 3901 1 66 THR HA 1 67 LEU QD 4.000 . 4.500 3.144 2.951 3.364 . 0 0 "[ . 1 .]" 1 3902 1 6 LYS HA 1 66 THR MG 4.000 . 4.500 4.568 4.490 4.674 0.174 7 0 "[ . 1 .]" 1 3903 1 6 LYS QG 1 66 THR MG 5.000 . 5.500 3.937 1.945 4.210 . 0 0 "[ . 1 .]" 1 3904 1 6 LYS QD 1 66 THR MG 2.500 . 3.000 2.850 2.389 3.071 0.071 2 0 "[ . 1 .]" 1 3905 1 4 PHE QB 1 66 THR HB 5.000 . 5.500 4.604 4.548 4.660 . 0 0 "[ . 1 .]" 1 3906 1 67 LEU HA 1 67 LEU HG 4.000 . 4.500 2.241 2.127 2.432 . 0 0 "[ . 1 .]" 1 3907 1 5 VAL QG 1 67 LEU HA 4.000 . 4.500 4.590 4.505 4.686 0.186 9 0 "[ . 1 .]" 1 3908 1 67 LEU HA 1 67 LEU QD 3.000 . 3.500 2.816 2.345 3.079 . 0 0 "[ . 1 .]" 1 3909 1 45 PHE HA 1 67 LEU QB 5.000 . 5.500 4.859 4.103 5.434 . 0 0 "[ . 1 .]" 1 3910 1 67 LEU QB 1 67 LEU QD 2.500 . 3.000 1.834 1.790 1.908 0.010 6 0 "[ . 1 .]" 1 3911 1 45 PHE HA 1 67 LEU HG 5.000 . 5.500 4.000 3.717 4.241 . 0 0 "[ . 1 .]" 1 3912 1 61 ILE MD 1 67 LEU HG 4.000 . 4.500 3.749 3.419 4.107 . 0 0 "[ . 1 .]" 1 3913 1 61 ILE MG 1 67 LEU HG 4.000 . 4.500 3.980 3.588 4.482 . 0 0 "[ . 1 .]" 1 3914 1 45 PHE HA 1 67 LEU QD 4.000 . 4.500 4.226 3.958 4.488 . 0 0 "[ . 1 .]" 1 3915 1 69 LEU HA 1 70 VAL HA 5.000 . 5.500 4.411 4.378 4.459 . 0 0 "[ . 1 .]" 1 3916 1 44 ILE MD 1 69 LEU HA 5.500 . 6.000 4.993 4.786 5.363 . 0 0 "[ . 1 .]" 1 3917 1 5 VAL QG 1 69 LEU HA 4.000 . 4.500 3.927 3.632 4.245 . 0 0 "[ . 1 .]" 1 3918 1 69 LEU HA 1 69 LEU QD 2.500 . 3.000 2.275 1.989 2.902 . 0 0 "[ . 1 .]" 1 3919 1 30 ILE MG 1 69 LEU HA 5.000 . 5.500 5.659 5.582 5.750 0.250 14 0 "[ . 1 .]" 1 3920 1 30 ILE MD 1 69 LEU HA 5.000 . 5.500 4.702 4.351 5.584 0.084 14 0 "[ . 1 .]" 1 3921 1 43 LEU QD 1 69 LEU HA 4.000 . 4.500 2.844 2.509 3.134 . 0 0 "[ . 1 .]" 1 3922 1 69 LEU HA 1 71 LEU QD 4.000 . 4.500 4.476 4.135 4.613 0.113 12 0 "[ . 1 .]" 1 3923 1 43 LEU HG 1 69 LEU HA 5.000 . 5.500 4.899 4.564 5.248 . 0 0 "[ . 1 .]" 1 3924 1 69 LEU HA 1 69 LEU HG 4.000 . 4.500 2.484 2.031 3.167 . 0 0 "[ . 1 .]" 1 3925 1 69 LEU QB 1 70 VAL HA 4.000 . 4.500 4.454 4.189 4.691 0.191 9 0 "[ . 1 .]" 1 3926 1 5 VAL QG 1 69 LEU QB 2.500 . 3.000 2.371 1.975 2.943 . 0 0 "[ . 1 .]" 1 3927 1 69 LEU QB 1 69 LEU QD 2.500 . 3.000 1.884 1.790 1.917 0.010 14 0 "[ . 1 .]" 1 3928 1 30 ILE MD 1 69 LEU QB 3.500 . 4.000 3.749 3.102 4.111 0.111 11 0 "[ . 1 .]" 1 3929 1 43 LEU QD 1 69 LEU QB 3.000 . 3.500 3.285 2.763 3.607 0.107 11 0 "[ . 1 .]" 1 3930 1 69 LEU QB 1 69 LEU HG 2.500 . 3.000 2.395 2.350 2.534 . 0 0 "[ . 1 .]" 1 3931 1 7 THR HB 1 69 LEU QD 4.000 . 4.500 3.629 3.426 3.845 . 0 0 "[ . 1 .]" 1 3932 1 70 VAL HA 1 71 LEU HA 5.000 . 5.500 4.386 4.367 4.409 . 0 0 "[ . 1 .]" 1 3933 1 70 VAL HA 1 70 VAL HB 3.000 . 3.500 3.028 3.024 3.033 . 0 0 "[ . 1 .]" 1 3934 1 70 VAL HA 1 70 VAL QG 2.500 . 3.000 2.116 2.085 2.143 . 0 0 "[ . 1 .]" 1 3935 1 69 LEU QD 1 70 VAL HA 5.000 . 5.500 3.866 3.442 4.231 . 0 0 "[ . 1 .]" 1 3936 1 70 VAL HA 1 71 LEU QD 3.000 . 3.500 3.656 3.565 3.752 0.252 3 0 "[ . 1 .]" 1 3937 1 44 ILE MD 1 70 VAL QG 3.000 . 3.500 1.920 1.824 2.070 . 0 0 "[ . 1 .]" 1 3938 1 71 LEU HA 1 71 LEU QB 2.500 . 3.000 2.306 2.285 2.315 . 0 0 "[ . 1 .]" 1 3939 1 36 ILE MG 1 71 LEU HA 4.000 . 4.500 3.842 3.472 4.064 . 0 0 "[ . 1 .]" 1 3940 1 36 ILE MD 1 71 LEU HA 4.000 . 4.500 4.665 4.560 4.813 0.313 5 0 "[ . 1 .]" 1 3941 1 71 LEU HA 1 71 LEU QD 2.500 . 3.000 2.038 2.015 2.065 . 0 0 "[ . 1 .]" 1 3942 1 71 LEU HA 1 71 LEU HG 4.000 . 4.500 3.231 3.186 3.293 . 0 0 "[ . 1 .]" 1 3943 1 71 LEU QB 1 71 LEU QD 2.500 . 3.000 1.927 1.911 1.947 . 0 0 "[ . 1 .]" 1 3944 1 71 LEU QB 1 71 LEU HG 2.500 . 3.000 2.345 2.338 2.355 . 0 0 "[ . 1 .]" 1 3945 1 70 VAL HA 1 71 LEU HG 3.000 . 3.500 3.405 3.319 3.501 0.001 15 0 "[ . 1 .]" 1 3946 1 72 ARG HA 1 72 ARG QG 2.500 . 3.000 2.366 2.145 2.681 . 0 0 "[ . 1 .]" 1 3947 1 72 ARG HA 1 72 ARG QD 4.000 . 4.500 3.777 2.044 4.190 . 0 0 "[ . 1 .]" 1 3948 1 72 ARG QB 1 72 ARG QD 2.500 . 3.000 2.218 2.123 2.305 . 0 0 "[ . 1 .]" 1 3949 1 73 LEU HA 1 73 LEU QD 3.000 . 3.500 2.095 1.875 2.403 . 0 0 "[ . 1 .]" 1 3950 1 73 LEU HA 1 73 LEU HG 3.000 . 3.500 2.999 2.262 3.539 0.039 10 0 "[ . 1 .]" 1 3951 1 74 ARG HA 1 74 ARG QB 2.500 . 3.000 2.393 2.351 2.467 . 0 0 "[ . 1 .]" 1 3952 1 74 ARG HA 1 74 ARG QG 2.500 . 3.000 2.555 2.184 2.935 . 0 0 "[ . 1 .]" 1 3953 1 74 ARG QG 1 75 GLY QA 5.000 . 5.500 5.148 3.186 5.515 0.015 14 0 "[ . 1 .]" 1 3954 1 74 ARG HA 1 74 ARG QD 3.000 . 3.500 2.640 2.008 3.774 0.274 12 0 "[ . 1 .]" 1 3955 1 74 ARG QB 1 74 ARG QD 2.500 . 3.000 2.278 2.187 2.690 . 0 0 "[ . 1 .]" 1 3956 1 73 LEU QB 1 75 GLY QA 5.000 . 5.500 4.472 3.530 5.535 0.035 5 0 "[ . 1 .]" 1 3957 1 74 ARG HA 1 75 GLY QA 4.000 . 4.500 4.171 3.900 4.468 . 0 0 "[ . 1 .]" 1 3958 1 74 ARG QB 1 75 GLY QA 5.000 . 5.500 3.845 3.621 4.301 . 0 0 "[ . 1 .]" 1 3959 1 77 ASP HA 1 77 ASP QB 2.500 . 3.000 2.329 2.160 2.436 . 0 0 "[ . 1 .]" 1 3960 2 1 MET HA 2 1 MET QB 2.500 . 3.000 2.400 2.389 2.441 . 0 0 "[ . 1 .]" 1 3961 2 1 MET HA 2 1 MET QG 2.500 . 3.000 2.383 2.220 2.418 . 0 0 "[ . 1 .]" 1 3962 2 1 MET HA 2 2 GLN QG 3.000 . 3.500 3.803 3.718 3.856 0.356 1 0 "[ . 1 .]" 1 3963 2 1 MET HA 2 16 GLU HA 5.000 . 5.500 5.539 5.467 5.611 0.111 11 0 "[ . 1 .]" 1 3964 2 1 MET HA 2 63 LYS HA 3.000 . 3.500 3.516 3.323 3.599 0.099 15 0 "[ . 1 .]" 1 3965 2 1 MET HA 2 63 LYS QB 2.500 . 3.000 2.849 2.412 3.105 0.105 12 0 "[ . 1 .]" 1 3966 2 1 MET HA 2 63 LYS QG 4.000 . 4.500 2.273 2.018 4.506 0.006 6 0 "[ . 1 .]" 1 3967 2 1 MET HA 2 63 LYS QD 4.000 . 4.500 3.080 2.568 4.426 . 0 0 "[ . 1 .]" 1 3968 2 1 MET HA 2 17 VAL QG 4.000 . 4.500 4.566 4.477 4.602 0.102 5 0 "[ . 1 .]" 1 3969 2 1 MET HA 2 3 ILE MG 5.000 . 5.500 4.887 4.767 5.541 0.041 12 0 "[ . 1 .]" 1 3970 2 1 MET QB 2 1 MET ME 2.500 . 3.000 2.087 2.029 2.197 . 0 0 "[ . 1 .]" 1 3971 2 1 MET QB 2 17 VAL QG 4.000 . 4.500 3.051 2.857 3.155 . 0 0 "[ . 1 .]" 1 3972 2 1 MET ME 2 1 MET QG 2.500 . 3.000 2.214 2.110 2.281 . 0 0 "[ . 1 .]" 1 3973 2 1 MET QG 2 63 LYS HA 4.000 . 4.500 2.015 1.960 2.077 . 0 0 "[ . 1 .]" 1 3974 2 1 MET QG 2 63 LYS QB 4.000 . 4.500 1.998 1.951 2.031 . 0 0 "[ . 1 .]" 1 3975 2 1 MET QG 2 63 LYS QG 4.000 . 4.500 2.833 2.550 3.790 . 0 0 "[ . 1 .]" 1 3976 2 1 MET QG 2 63 LYS QD 4.000 . 4.500 3.788 3.499 4.492 . 0 0 "[ . 1 .]" 1 3977 2 1 MET QG 2 17 VAL QG 3.000 . 3.500 3.345 2.914 3.453 . 0 0 "[ . 1 .]" 1 3978 2 1 MET QG 2 3 ILE MG 3.000 . 3.500 2.952 2.857 3.323 . 0 0 "[ . 1 .]" 1 3979 2 1 MET ME 2 18 GLU HA 4.000 . 4.500 3.221 2.887 3.468 . 0 0 "[ . 1 .]" 1 3980 2 1 MET ME 2 19 PRO HA 3.000 . 3.500 2.037 1.976 2.184 . 0 0 "[ . 1 .]" 1 3981 2 1 MET ME 2 19 PRO QB 2.500 . 3.000 3.278 3.221 3.316 0.316 3 0 "[ . 1 .]" 1 3982 2 1 MET ME 2 19 PRO QG 2.500 . 3.000 2.948 2.781 3.023 0.023 13 0 "[ . 1 .]" 1 3983 2 1 MET ME 2 19 PRO QD 3.000 . 3.500 3.033 2.869 3.236 . 0 0 "[ . 1 .]" 1 3984 2 1 MET ME 2 57 SER QB 4.000 . 4.500 4.554 4.485 4.679 0.179 5 0 "[ . 1 .]" 1 3985 2 1 MET ME 2 61 ILE HA 5.000 . 5.500 4.889 4.727 5.025 . 0 0 "[ . 1 .]" 1 3986 2 1 MET ME 2 62 GLN HA 3.000 . 3.500 3.382 3.223 3.535 0.035 11 0 "[ . 1 .]" 1 3987 2 1 MET ME 2 63 LYS HA 3.000 . 3.500 3.731 3.658 3.771 0.271 14 0 "[ . 1 .]" 1 3988 2 1 MET ME 2 63 LYS QB 4.500 . 5.000 4.637 4.477 4.699 . 0 0 "[ . 1 .]" 1 3989 2 1 MET ME 2 17 VAL QG 2.500 . 3.000 2.292 2.170 2.360 . 0 0 "[ . 1 .]" 1 3990 2 1 MET ME 2 3 ILE MD 3.000 . 3.500 3.698 3.620 3.765 0.265 5 0 "[ . 1 .]" 1 3991 2 1 MET ME 2 3 ILE MG 2.500 . 3.000 2.576 2.511 2.862 . 0 0 "[ . 1 .]" 1 3992 2 1 MET ME 2 56 LEU QD 2.500 . 3.000 2.259 2.053 2.433 . 0 0 "[ . 1 .]" 1 3993 2 1 MET ME 2 61 ILE MD 4.000 . 4.500 4.516 4.334 4.635 0.135 12 0 "[ . 1 .]" 1 3994 2 1 MET ME 2 61 ILE MG 3.000 . 3.500 2.823 2.641 3.049 . 0 0 "[ . 1 .]" 1 3995 2 1 MET HA 2 2 GLN HA 5.000 . 5.500 4.561 4.501 4.592 . 0 0 "[ . 1 .]" 1 3996 2 1 MET ME 2 2 GLN HA 5.000 . 5.500 4.913 4.445 5.044 . 0 0 "[ . 1 .]" 1 3997 2 2 GLN HA 2 2 GLN QG 3.000 . 3.500 3.250 3.238 3.271 . 0 0 "[ . 1 .]" 1 3998 2 2 GLN HA 2 3 ILE HA 5.000 . 5.500 4.447 4.427 4.481 . 0 0 "[ . 1 .]" 1 3999 2 2 GLN HA 2 16 GLU HA 3.000 . 3.500 2.029 1.966 2.320 . 0 0 "[ . 1 .]" 1 4000 2 2 GLN HA 2 16 GLU QB 4.000 . 4.500 4.043 3.844 4.404 . 0 0 "[ . 1 .]" 1 4001 2 2 GLN HA 2 16 GLU QG 4.000 . 4.500 4.170 3.585 4.907 0.407 2 0 "[ . 1 .]" 1 4002 2 2 GLN HA 2 64 GLU HA 6.000 . 6.500 6.220 5.980 6.375 . 0 0 "[ . 1 .]" 1 4003 2 2 GLN HA 2 64 GLU QG 6.000 . 6.500 6.107 6.018 6.208 . 0 0 "[ . 1 .]" 1 4004 2 2 GLN HA 2 17 VAL QG 4.000 . 4.500 2.453 2.327 2.572 . 0 0 "[ . 1 .]" 1 4005 2 2 GLN HA 2 3 ILE MD 4.000 . 4.500 4.659 4.373 4.725 0.225 9 0 "[ . 1 .]" 1 4006 2 2 GLN HA 2 3 ILE MG 4.000 . 4.500 3.569 3.510 3.647 . 0 0 "[ . 1 .]" 1 4007 2 2 GLN HA 2 3 ILE HB 5.000 . 5.500 5.539 5.513 5.565 0.065 12 0 "[ . 1 .]" 1 4008 2 2 GLN HA 2 14 THR MG 4.000 . 4.500 4.061 3.856 4.573 0.073 2 0 "[ . 1 .]" 1 4009 2 1 MET HA 2 2 GLN QB 4.000 . 4.500 4.528 4.153 4.594 0.094 2 0 "[ . 1 .]" 1 4010 2 2 GLN QB 2 64 GLU HA 5.000 . 5.500 5.205 4.915 5.415 . 0 0 "[ . 1 .]" 1 4011 2 2 GLN QB 2 64 GLU QG 4.000 . 4.500 4.789 4.642 4.899 0.399 2 0 "[ . 1 .]" 1 4012 2 2 GLN QB 2 14 THR MG 2.500 . 3.000 2.131 1.965 2.733 . 0 0 "[ . 1 .]" 1 4013 2 2 GLN QB 2 14 THR HB 4.000 . 4.500 4.214 3.845 4.348 . 0 0 "[ . 1 .]" 1 4014 2 2 GLN QG 2 14 THR HA 5.000 . 5.500 4.720 4.551 4.907 . 0 0 "[ . 1 .]" 1 4015 2 2 GLN QG 2 64 GLU HA 5.000 . 5.500 3.353 3.016 3.605 . 0 0 "[ . 1 .]" 1 4016 2 2 GLN QG 2 64 GLU QG 2.500 . 3.000 2.907 2.718 3.011 0.011 2 0 "[ . 1 .]" 1 4017 2 2 GLN QG 2 14 THR MG 2.500 . 3.000 2.312 2.179 2.691 . 0 0 "[ . 1 .]" 1 4018 2 2 GLN QG 2 14 THR HB 4.000 . 4.500 4.772 4.680 4.856 0.356 14 0 "[ . 1 .]" 1 4019 2 3 ILE H 2 15 LEU QB 5.000 . 5.500 3.600 3.396 3.739 . 0 0 "[ . 1 .]" 1 4020 2 3 ILE H 2 15 LEU HG 5.000 . 5.500 5.283 5.001 5.548 0.048 1 0 "[ . 1 .]" 1 4021 2 1 MET QG 2 3 ILE H 5.000 . 5.500 5.364 5.123 5.435 . 0 0 "[ . 1 .]" 1 4022 2 1 MET ME 2 3 ILE H 5.000 . 5.500 5.531 5.477 5.564 0.064 3 0 "[ . 1 .]" 1 4023 2 2 GLN HA 2 3 ILE H 3.000 . 3.500 2.317 2.266 2.411 . 0 0 "[ . 1 .]" 1 4024 2 2 GLN QB 2 3 ILE H 3.000 . 3.500 2.569 2.385 2.672 . 0 0 "[ . 1 .]" 1 4025 2 2 GLN QG 2 3 ILE H 3.000 . 3.500 3.318 3.184 3.441 . 0 0 "[ . 1 .]" 1 4026 2 3 ILE H 2 14 THR HA 5.000 . 5.500 4.037 4.003 4.127 . 0 0 "[ . 1 .]" 1 4027 2 3 ILE H 2 16 GLU HA 4.000 . 4.500 3.753 3.663 3.804 . 0 0 "[ . 1 .]" 1 4028 2 3 ILE H 2 16 GLU QB 5.000 . 5.500 5.374 5.291 5.467 . 0 0 "[ . 1 .]" 1 4029 2 3 ILE H 2 64 GLU HA 6.000 . 6.500 5.115 4.944 5.268 . 0 0 "[ . 1 .]" 1 4030 2 3 ILE H 2 3 ILE MD 4.000 . 4.500 3.813 3.771 3.859 . 0 0 "[ . 1 .]" 1 4031 2 3 ILE H 2 3 ILE MG 4.000 . 4.500 3.145 3.092 3.199 . 0 0 "[ . 1 .]" 1 4032 2 3 ILE H 2 14 THR MG 4.000 . 4.500 3.102 2.832 3.534 . 0 0 "[ . 1 .]" 1 4033 2 3 ILE H 2 14 THR HB 5.000 . 5.500 5.537 5.349 5.634 0.134 14 0 "[ . 1 .]" 1 4034 2 3 ILE HA 2 64 GLU HA 4.000 . 4.500 2.888 2.691 2.990 . 0 0 "[ . 1 .]" 1 4035 2 3 ILE HA 2 64 GLU QG 4.000 . 4.500 4.488 4.287 4.737 0.237 12 0 "[ . 1 .]" 1 4036 2 3 ILE HA 2 17 VAL QG 4.000 . 4.500 4.198 4.121 4.299 . 0 0 "[ . 1 .]" 1 4037 2 3 ILE HA 2 3 ILE MD 4.000 . 4.500 4.134 4.101 4.151 . 0 0 "[ . 1 .]" 1 4038 2 3 ILE HA 2 3 ILE MG 3.000 . 3.500 2.153 2.119 2.184 . 0 0 "[ . 1 .]" 1 4039 2 3 ILE HB 2 3 ILE MD 3.000 . 3.500 2.399 2.380 2.443 . 0 0 "[ . 1 .]" 1 4040 2 3 ILE MG 2 63 LYS QB 5.000 . 5.500 4.589 4.131 5.112 . 0 0 "[ . 1 .]" 1 4041 2 4 PHE H 2 4 PHE QD 4.000 . 4.500 2.727 2.110 3.161 . 0 0 "[ . 1 .]" 1 4042 2 4 PHE H 2 4 PHE QE 5.000 . 5.500 4.561 4.360 4.667 . 0 0 "[ . 1 .]" 1 4043 2 4 PHE H 2 5 VAL MG2 4.000 . 4.500 4.483 4.352 4.547 0.047 11 0 "[ . 1 .]" 1 4044 2 3 ILE HA 2 4 PHE H 4.000 . 4.500 2.271 2.196 2.379 . 0 0 "[ . 1 .]" 1 4045 2 4 PHE H 2 64 GLU HA 5.000 . 5.500 3.224 2.907 3.746 . 0 0 "[ . 1 .]" 1 4046 2 4 PHE H 2 66 THR HA 4.000 . 4.500 3.405 2.810 3.629 . 0 0 "[ . 1 .]" 1 4047 2 3 ILE MD 2 4 PHE H 5.000 . 5.500 4.711 4.470 4.843 . 0 0 "[ . 1 .]" 1 4048 2 3 ILE MG 2 4 PHE H 4.000 . 4.500 3.668 3.555 3.749 . 0 0 "[ . 1 .]" 1 4049 2 3 ILE HB 2 4 PHE H 4.000 . 4.500 2.849 2.570 3.031 . 0 0 "[ . 1 .]" 1 4050 2 4 PHE H 2 66 THR MG 5.000 . 5.500 5.075 4.454 5.319 . 0 0 "[ . 1 .]" 1 4051 2 4 PHE H 2 67 LEU QD 5.000 . 5.500 3.781 3.466 4.671 . 0 0 "[ . 1 .]" 1 4052 2 4 PHE HA 2 14 THR HA 4.000 . 4.500 2.237 2.027 2.573 . 0 0 "[ . 1 .]" 1 4053 2 4 PHE HA 2 66 THR HA 4.000 . 4.500 4.573 4.483 4.625 0.125 7 0 "[ . 1 .]" 1 4054 2 4 PHE HA 2 5 VAL QG 4.000 . 4.500 3.826 3.679 3.937 . 0 0 "[ . 1 .]" 1 4055 2 4 PHE HA 2 12 THR MG 4.000 . 4.500 3.054 2.903 3.164 . 0 0 "[ . 1 .]" 1 4056 2 4 PHE HA 2 14 THR MG 4.000 . 4.500 3.043 2.576 3.185 . 0 0 "[ . 1 .]" 1 4057 2 4 PHE HA 2 14 THR HB 5.000 . 5.500 4.871 4.502 5.295 . 0 0 "[ . 1 .]" 1 4058 2 4 PHE QB 2 66 THR HA 4.000 . 4.500 2.254 2.119 2.428 . 0 0 "[ . 1 .]" 1 4059 2 4 PHE QB 2 5 VAL QG 5.000 . 5.500 4.387 4.321 4.540 . 0 0 "[ . 1 .]" 1 4060 2 4 PHE QB 2 12 THR MG 3.000 . 3.500 1.991 1.950 2.148 . 0 0 "[ . 1 .]" 1 4061 2 4 PHE QB 2 66 THR MG 4.000 . 4.500 3.170 2.803 3.337 . 0 0 "[ . 1 .]" 1 4062 2 3 ILE HA 2 4 PHE QD 5.000 . 5.500 3.470 2.864 3.968 . 0 0 "[ . 1 .]" 1 4063 2 4 PHE HA 2 4 PHE QD 4.000 . 4.500 2.328 1.926 3.059 . 0 0 "[ . 1 .]" 1 4064 2 4 PHE QD 2 14 THR HA 4.000 . 4.500 2.971 2.348 4.020 . 0 0 "[ . 1 .]" 1 4065 2 4 PHE QD 2 64 GLU HA 4.000 . 4.500 2.835 1.935 3.472 . 0 0 "[ . 1 .]" 1 4066 2 4 PHE QD 2 64 GLU QB 5.000 . 5.500 3.641 3.433 3.830 . 0 0 "[ . 1 .]" 1 4067 2 4 PHE QD 2 64 GLU QG 4.000 . 4.500 4.016 3.397 4.393 . 0 0 "[ . 1 .]" 1 4068 2 4 PHE QD 2 66 THR HA 4.000 . 4.500 4.182 3.924 4.614 0.114 11 0 "[ . 1 .]" 1 4069 2 3 ILE MG 2 4 PHE QD 5.000 . 5.500 4.984 4.535 5.330 . 0 0 "[ . 1 .]" 1 4070 2 3 ILE MG 2 4 PHE QE 6.000 . 7.000 5.828 5.575 6.066 . 0 0 "[ . 1 .]" 1 4071 2 3 ILE HB 2 4 PHE QD 5.000 . 5.500 4.964 4.714 5.261 . 0 0 "[ . 1 .]" 1 4072 2 4 PHE QD 2 5 VAL QG 5.000 . 5.500 5.115 4.940 5.421 . 0 0 "[ . 1 .]" 1 4073 2 4 PHE QD 2 12 THR MG 3.000 . 3.500 2.731 1.799 3.403 0.001 11 0 "[ . 1 .]" 1 4074 2 4 PHE QD 2 66 THR MG 4.000 . 4.500 4.510 4.328 4.665 0.165 6 0 "[ . 1 .]" 1 4075 2 4 PHE QD 2 14 THR MG 2.500 . 3.000 2.149 1.859 2.848 . 0 0 "[ . 1 .]" 1 4076 2 4 PHE QD 2 14 THR HB 4.000 . 4.500 4.384 3.781 4.782 0.282 1 0 "[ . 1 .]" 1 4077 2 2 GLN QB 2 4 PHE QE 4.000 . 4.500 4.388 4.132 4.836 0.336 12 0 "[ . 1 .]" 1 4078 2 2 GLN QG 2 4 PHE QE 4.000 . 4.500 2.831 2.723 3.056 . 0 0 "[ . 1 .]" 1 4079 2 3 ILE HA 2 4 PHE QE 5.000 . 5.500 4.603 4.320 4.824 . 0 0 "[ . 1 .]" 1 4080 2 4 PHE QE 2 14 THR HA 5.000 . 5.500 4.373 4.172 4.883 . 0 0 "[ . 1 .]" 1 4081 2 4 PHE QE 2 63 LYS QG 4.000 . 4.500 4.638 4.287 4.772 0.272 2 0 "[ . 1 .]" 1 4082 2 4 PHE QE 2 64 GLU HA 3.000 . 3.500 2.889 1.956 3.176 . 0 0 "[ . 1 .]" 1 4083 2 4 PHE QE 2 64 GLU QB 4.000 . 4.500 2.781 2.272 3.710 . 0 0 "[ . 1 .]" 1 4084 2 4 PHE QE 2 64 GLU QG 3.000 . 3.500 2.576 1.916 2.984 . 0 0 "[ . 1 .]" 1 4085 2 4 PHE QE 2 14 THR MG 2.500 . 3.000 2.067 1.828 2.654 . 0 0 "[ . 1 .]" 1 4086 2 4 PHE QE 2 14 THR HB 4.000 . 4.500 4.225 3.917 4.574 0.074 2 0 "[ . 1 .]" 1 4087 2 4 PHE QD 2 12 THR HB 6.000 . 6.500 4.959 3.452 5.865 . 0 0 "[ . 1 .]" 1 4088 2 4 PHE HA 2 5 VAL H 5.000 . 5.500 2.167 2.146 2.191 . 0 0 "[ . 1 .]" 1 4089 2 4 PHE QB 2 5 VAL H 5.000 . 5.500 3.318 3.233 3.572 . 0 0 "[ . 1 .]" 1 4090 2 4 PHE QD 2 5 VAL H 4.000 . 4.500 4.164 3.944 4.537 0.037 12 0 "[ . 1 .]" 1 4091 2 4 PHE QE 2 5 VAL H 6.000 . 6.500 6.177 6.043 6.296 . 0 0 "[ . 1 .]" 1 4092 2 5 VAL H 2 14 THR MG 4.000 . 4.500 4.585 4.273 4.677 0.177 3 0 "[ . 1 .]" 1 4093 2 5 VAL H 2 13 ILE MG 4.000 . 4.500 4.657 4.475 4.740 0.240 6 0 "[ . 1 .]" 1 4094 2 3 ILE MG 2 5 VAL H 6.000 . 6.500 6.460 6.167 6.542 0.042 11 0 "[ . 1 .]" 1 4095 2 3 ILE MD 2 5 VAL H 5.000 . 5.500 5.664 5.579 5.730 0.230 10 0 "[ . 1 .]" 1 4096 2 5 VAL H 2 5 VAL HB 4.000 . 4.500 2.454 2.353 2.517 . 0 0 "[ . 1 .]" 1 4097 2 5 VAL H 2 5 VAL QG . . 3.500 2.767 2.617 2.827 . 0 0 "[ . 1 .]" 1 4098 2 5 VAL H 2 12 THR MG 3.000 . 3.500 2.933 2.630 3.483 . 0 0 "[ . 1 .]" 1 4099 2 5 VAL H 2 13 ILE HB 4.000 . 4.500 3.537 3.438 3.606 . 0 0 "[ . 1 .]" 1 4100 2 5 VAL H 2 13 ILE QG 5.000 . 5.500 4.197 3.795 4.428 . 0 0 "[ . 1 .]" 1 4101 2 5 VAL H 2 13 ILE MD 4.500 . 5.000 5.095 4.956 5.173 0.173 12 0 "[ . 1 .]" 1 4102 2 5 VAL H 2 15 LEU QD 4.000 . 4.500 4.438 4.060 4.547 0.047 10 0 "[ . 1 .]" 1 4103 2 5 VAL H 2 14 THR HA 5.000 . 5.500 3.136 2.903 3.438 . 0 0 "[ . 1 .]" 1 4104 2 5 VAL H 2 14 THR HB 6.000 . 6.500 5.872 5.610 6.196 . 0 0 "[ . 1 .]" 1 4105 2 5 VAL HA 2 69 LEU QB 5.000 . 5.500 4.321 4.125 4.688 . 0 0 "[ . 1 .]" 1 4106 2 5 VAL HA 2 5 VAL QG 3.000 . 3.500 2.000 1.984 2.021 . 0 0 "[ . 1 .]" 1 4107 2 5 VAL QG 2 6 LYS QB 4.500 2.800 5.000 4.257 4.110 4.382 . 0 0 "[ . 1 .]" 1 4108 2 5 VAL QG 2 69 LEU HG 3.500 . 4.000 3.914 2.568 4.200 0.200 4 0 "[ . 1 .]" 1 4109 2 6 LYS HA 2 6 LYS QG 3.000 . 3.500 2.038 1.989 2.221 . 0 0 "[ . 1 .]" 1 4110 2 6 LYS HA 2 6 LYS QD 4.000 . 4.500 3.270 2.843 3.501 . 0 0 "[ . 1 .]" 1 4111 2 6 LYS HA 2 6 LYS QE 4.000 . 4.500 4.352 3.959 4.461 . 0 0 "[ . 1 .]" 1 4112 2 6 LYS HA 2 12 THR HA 3.000 . 3.500 2.075 2.019 2.164 . 0 0 "[ . 1 .]" 1 4113 2 5 VAL QG 2 6 LYS HA 4.000 . 4.500 3.896 3.793 4.023 . 0 0 "[ . 1 .]" 1 4114 2 6 LYS HA 2 12 THR HB 4.000 . 4.500 4.766 4.650 4.848 0.348 8 0 "[ . 1 .]" 1 4115 2 6 LYS HA 2 12 THR MG 4.000 . 4.500 3.386 2.996 3.550 . 0 0 "[ . 1 .]" 1 4116 2 6 LYS QB 2 12 THR HA 4.000 . 4.500 3.832 3.528 4.251 . 0 0 "[ . 1 .]" 1 4117 2 6 LYS QB 2 12 THR MG 4.000 . 4.500 3.608 3.267 4.198 . 0 0 "[ . 1 .]" 1 4118 2 6 LYS QB 2 66 THR MG 2.500 . 3.000 2.465 2.326 3.040 0.040 8 0 "[ . 1 .]" 1 4119 2 6 LYS QG 2 10 GLY QA 4.000 . 4.500 2.741 2.324 4.599 0.099 8 0 "[ . 1 .]" 1 4120 2 6 LYS QG 2 12 THR HA 3.000 . 3.500 2.954 2.315 3.291 . 0 0 "[ . 1 .]" 1 4121 2 6 LYS QG 2 12 THR HB 4.000 . 4.500 4.481 3.791 4.632 0.132 3 0 "[ . 1 .]" 1 4122 2 6 LYS QG 2 12 THR MG 3.500 . 4.000 3.771 2.159 3.983 . 0 0 "[ . 1 .]" 1 4123 2 6 LYS QD 2 10 GLY QA 4.000 . 4.500 3.663 2.998 4.593 0.093 2 0 "[ . 1 .]" 1 4124 2 6 LYS QD 2 12 THR HA 3.000 . 3.500 3.636 3.459 3.738 0.238 11 0 "[ . 1 .]" 1 4125 2 6 LYS QD 2 66 THR HA 5.000 . 5.500 5.189 4.409 5.574 0.074 12 0 "[ . 1 .]" 1 4126 2 6 LYS QD 2 12 THR MG 2.500 . 3.000 3.047 2.795 3.153 0.153 8 0 "[ . 1 .]" 1 4127 2 6 LYS QB 2 6 LYS QE 4.000 . 4.500 2.561 2.058 3.709 . 0 0 "[ . 1 .]" 1 4128 2 6 LYS QE 2 6 LYS QG 2.500 . 3.000 2.198 2.118 2.328 . 0 0 "[ . 1 .]" 1 4129 2 6 LYS QE 2 10 GLY QA 3.000 . 3.500 3.527 3.405 3.583 0.083 9 0 "[ . 1 .]" 1 4130 2 6 LYS QE 2 66 THR MG 3.000 . 3.500 2.771 2.037 3.617 0.117 3 0 "[ . 1 .]" 1 4131 2 5 VAL QG 2 7 THR HA 4.000 . 4.500 3.928 3.697 4.076 . 0 0 "[ . 1 .]" 1 4132 2 7 THR HA 2 7 THR MG 2.500 . 3.000 2.277 2.007 2.363 . 0 0 "[ . 1 .]" 1 4133 2 7 THR HA 2 69 LEU QD 4.000 . 4.500 3.040 2.774 3.370 . 0 0 "[ . 1 .]" 1 4134 2 7 THR HA 2 7 THR HB 2.500 . 3.000 2.481 2.440 2.937 . 0 0 "[ . 1 .]" 1 4135 2 7 THR HA 2 71 LEU QD 4.000 . 4.500 4.288 4.093 4.545 0.045 7 0 "[ . 1 .]" 1 4136 2 7 THR HB 2 13 ILE MD 5.000 . 5.500 4.614 4.308 5.504 0.004 9 0 "[ . 1 .]" 1 4137 2 8 LEU HA 2 8 LEU QB 2.500 . 3.000 2.370 2.350 2.504 . 0 0 "[ . 1 .]" 1 4138 2 7 THR HB 2 8 LEU HA 4.000 . 4.500 4.643 4.559 4.715 0.215 3 0 "[ . 1 .]" 1 4139 2 8 LEU HA 2 8 LEU QD 2.500 . 3.000 2.047 1.888 2.110 . 0 0 "[ . 1 .]" 1 4140 2 8 LEU HA 2 8 LEU HG 3.000 . 3.500 3.102 3.007 3.552 0.052 6 0 "[ . 1 .]" 1 4141 2 8 LEU QB 2 9 THR HA 4.000 . 4.500 3.935 3.867 4.150 . 0 0 "[ . 1 .]" 1 4142 2 8 LEU QB 2 70 VAL HA 4.000 . 4.500 4.639 4.175 4.761 0.261 1 0 "[ . 1 .]" 1 4143 2 8 LEU QB 2 9 THR HB 5.000 . 5.500 5.275 5.103 5.382 . 0 0 "[ . 1 .]" 1 4144 2 8 LEU QB 2 9 THR MG 4.000 . 4.500 2.867 2.587 3.027 . 0 0 "[ . 1 .]" 1 4145 2 8 LEU QB 2 8 LEU QD 2.500 . 3.000 1.910 1.891 1.981 . 0 0 "[ . 1 .]" 1 4146 2 8 LEU HG 2 70 VAL HA 4.000 . 4.500 3.118 2.855 4.570 0.070 6 0 "[ . 1 .]" 1 4147 2 8 LEU HG 2 9 THR MG 4.000 . 4.500 4.720 4.645 4.776 0.276 5 0 "[ . 1 .]" 1 4148 2 8 LEU HG 2 71 LEU QD 2.500 . 3.000 3.081 3.039 3.143 0.143 12 0 "[ . 1 .]" 1 4149 2 9 THR HA 2 9 THR HB 2.500 . 3.000 2.419 2.385 2.452 . 0 0 "[ . 1 .]" 1 4150 2 9 THR HA 2 9 THR MG 2.500 . 3.000 2.421 2.365 2.459 . 0 0 "[ . 1 .]" 1 4151 2 11 LYS HA 2 11 LYS QB 2.500 . 3.000 2.401 2.332 2.481 . 0 0 "[ . 1 .]" 1 4152 2 11 LYS HA 2 11 LYS QG 2.500 . 3.000 2.304 2.083 3.003 0.003 4 0 "[ . 1 .]" 1 4153 2 11 LYS HA 2 11 LYS QD 3.000 . 3.500 3.299 2.026 3.883 0.383 8 0 "[ . 1 .]" 1 4154 2 11 LYS HA 2 11 LYS QE 5.000 . 5.500 4.479 4.048 4.922 . 0 0 "[ . 1 .]" 1 4155 2 11 LYS QB 2 11 LYS QE 4.000 . 4.500 3.521 2.522 3.741 . 0 0 "[ . 1 .]" 1 4156 2 7 THR HB 2 11 LYS QB 5.000 . 5.500 4.144 3.490 4.515 . 0 0 "[ . 1 .]" 1 4157 2 11 LYS QE 2 11 LYS QG 2.500 . 3.000 2.191 2.126 2.322 . 0 0 "[ . 1 .]" 1 4158 2 11 LYS QG 2 13 ILE MD 4.500 . 5.000 3.931 2.130 4.806 . 0 0 "[ . 1 .]" 1 4159 2 11 LYS QD 2 13 ILE MD 4.500 . 5.000 3.328 2.441 4.999 . 0 0 "[ . 1 .]" 1 4160 2 11 LYS QD 2 13 ILE MG 4.500 . 5.000 4.276 3.280 5.136 0.136 4 0 "[ . 1 .]" 1 4161 2 6 LYS QE 2 12 THR HA 6.000 . 6.500 5.228 4.381 5.515 . 0 0 "[ . 1 .]" 1 4162 2 11 LYS QE 2 13 ILE MD 4.000 . 4.500 3.470 2.019 4.227 . 0 0 "[ . 1 .]" 1 4163 2 6 LYS QE 2 12 THR HB 6.000 . 6.500 5.772 4.129 6.176 . 0 0 "[ . 1 .]" 1 4164 2 11 LYS QE 2 13 ILE QG 5.000 . 5.500 3.077 2.186 4.001 . 0 0 "[ . 1 .]" 1 4165 2 11 LYS QE 2 13 ILE MG 4.000 . 4.500 3.561 2.647 4.110 . 0 0 "[ . 1 .]" 1 4166 2 11 LYS QB 2 12 THR HA 5.000 . 5.500 4.599 4.401 4.707 . 0 0 "[ . 1 .]" 1 4167 2 11 LYS QG 2 12 THR HA 5.000 . 5.500 4.406 3.648 5.329 . 0 0 "[ . 1 .]" 1 4168 2 11 LYS QG 2 12 THR HB 5.000 . 5.500 4.832 4.452 5.352 . 0 0 "[ . 1 .]" 1 4169 2 11 LYS HA 2 12 THR HB 5.000 . 5.500 4.558 4.531 4.593 . 0 0 "[ . 1 .]" 1 4170 2 11 LYS HA 2 12 THR HA 5.000 . 5.500 4.399 4.385 4.429 . 0 0 "[ . 1 .]" 1 4171 2 5 VAL QG 2 12 THR HA 4.000 . 4.500 4.488 4.259 4.580 0.080 11 0 "[ . 1 .]" 1 4172 2 12 THR HA 2 12 THR HB 3.000 . 3.500 3.011 3.005 3.016 . 0 0 "[ . 1 .]" 1 4173 2 12 THR HA 2 12 THR MG 2.500 . 3.000 2.355 2.269 2.396 . 0 0 "[ . 1 .]" 1 4174 2 5 VAL HA 2 12 THR MG 5.000 . 5.500 4.302 4.081 4.478 . 0 0 "[ . 1 .]" 1 4175 2 12 THR MG 2 66 THR HA 4.000 . 4.500 4.431 4.234 4.621 0.121 12 0 "[ . 1 .]" 1 4176 2 13 ILE H 2 13 ILE MD 4.000 . 4.500 3.799 3.230 3.897 . 0 0 "[ . 1 .]" 1 4177 2 5 VAL QG 2 13 ILE H 4.000 . 4.500 3.609 3.428 3.709 . 0 0 "[ . 1 .]" 1 4178 2 13 ILE HA 2 13 ILE MD 3.500 . 4.000 3.740 2.045 3.893 . 0 0 "[ . 1 .]" 1 4179 2 12 THR MG 2 13 ILE HA 3.000 . 3.500 3.630 3.489 3.746 0.246 9 0 "[ . 1 .]" 1 4180 2 13 ILE HA 2 14 THR HB 4.500 . 5.000 4.927 4.751 5.251 0.251 2 0 "[ . 1 .]" 1 4181 2 13 ILE HA 2 13 ILE HB 3.000 . 3.500 2.990 2.954 3.026 . 0 0 "[ . 1 .]" 1 4182 2 13 ILE HA 2 13 ILE QG 2.500 . 3.000 2.700 2.515 3.069 0.069 9 0 "[ . 1 .]" 1 4183 2 13 ILE HA 2 13 ILE MG 2.500 . 3.000 2.211 2.147 2.299 . 0 0 "[ . 1 .]" 1 4184 2 11 LYS QB 2 13 ILE MD 5.000 . 5.500 3.906 3.322 4.708 . 0 0 "[ . 1 .]" 1 4185 2 12 THR HA 2 13 ILE MD 4.000 . 4.500 4.623 3.863 4.723 0.223 3 0 "[ . 1 .]" 1 4186 2 13 ILE HB 2 13 ILE MD 2.500 . 3.000 2.401 2.300 3.199 0.199 9 0 "[ . 1 .]" 1 4187 2 13 ILE MD 2 13 ILE MG 2.500 . 3.000 1.953 1.888 2.004 . 0 0 "[ . 1 .]" 1 4188 2 13 ILE HB 2 13 ILE QG 2.500 . 3.000 2.335 2.193 2.381 . 0 0 "[ . 1 .]" 1 4189 2 13 ILE QG 2 34 GLU QG 4.000 . 4.500 3.611 2.285 4.028 . 0 0 "[ . 1 .]" 1 4190 2 5 VAL QG 2 13 ILE QG 2.500 . 3.000 3.187 3.128 3.321 0.321 3 0 "[ . 1 .]" 1 4191 2 13 ILE QG 2 13 ILE MG 2.500 . 3.000 2.306 2.222 2.353 . 0 0 "[ . 1 .]" 1 4192 2 12 THR HA 2 13 ILE MG 5.000 . 5.500 5.233 5.123 5.376 . 0 0 "[ . 1 .]" 1 4193 2 13 ILE MG 2 33 LYS HA 4.000 . 4.500 4.575 4.385 4.794 0.294 15 0 "[ . 1 .]" 1 4194 2 13 ILE MG 2 33 LYS QG 3.100 . 3.600 3.475 3.300 3.672 0.072 12 0 "[ . 1 .]" 1 4195 2 13 ILE MG 2 34 GLU HA 5.000 . 5.500 5.294 4.961 5.545 0.045 11 0 "[ . 1 .]" 1 4196 2 13 ILE MG 2 34 GLU QB 4.000 . 4.500 4.623 4.505 4.852 0.352 12 0 "[ . 1 .]" 1 4197 2 7 THR HA 2 13 ILE MD 6.000 . 6.500 4.981 4.500 6.381 . 0 0 "[ . 1 .]" 1 4198 2 14 THR H 2 14 THR MG 3.000 . 3.500 3.725 3.552 3.773 0.273 11 0 "[ . 1 .]" 1 4199 2 14 THR H 2 14 THR HB 4.000 . 4.500 2.731 2.576 3.107 . 0 0 "[ . 1 .]" 1 4200 2 13 ILE MG 2 14 THR H 5.000 . 5.500 3.100 2.734 3.280 . 0 0 "[ . 1 .]" 1 4201 2 13 ILE MD 2 14 THR H 5.000 . 5.500 5.312 3.859 5.492 . 0 0 "[ . 1 .]" 1 4202 2 14 THR HA 2 15 LEU HA 4.000 . 4.500 4.405 4.386 4.419 . 0 0 "[ . 1 .]" 1 4203 2 5 VAL QG 2 14 THR HA 4.000 . 4.500 4.181 3.971 4.404 . 0 0 "[ . 1 .]" 1 4204 2 14 THR HA 2 14 THR MG 2.500 . 3.000 2.143 2.001 2.261 . 0 0 "[ . 1 .]" 1 4205 2 14 THR HA 2 14 THR HB 3.000 . 3.500 2.990 2.891 3.010 . 0 0 "[ . 1 .]" 1 4206 2 14 THR HA 2 15 LEU QD 4.000 . 4.500 4.305 4.060 4.492 . 0 0 "[ . 1 .]" 1 4207 2 14 THR HA 2 15 LEU HG 4.000 . 4.500 3.845 3.673 4.107 . 0 0 "[ . 1 .]" 1 4208 2 14 THR MG 2 16 GLU HA 5.000 . 5.500 4.344 4.094 5.011 . 0 0 "[ . 1 .]" 1 4209 2 13 ILE MG 2 14 THR HB 6.000 . 6.500 4.927 4.738 5.172 . 0 0 "[ . 1 .]" 1 4210 2 2 GLN QB 2 15 LEU H 4.000 . 4.500 3.514 3.414 3.592 . 0 0 "[ . 1 .]" 1 4211 2 2 GLN QG 2 15 LEU H 4.000 . 4.500 4.600 4.550 4.656 0.156 12 0 "[ . 1 .]" 1 4212 2 14 THR HA 2 15 LEU H 3.000 . 3.500 2.159 2.132 2.186 . 0 0 "[ . 1 .]" 1 4213 2 5 VAL QG 2 15 LEU H 5.000 . 5.500 3.731 3.612 3.884 . 0 0 "[ . 1 .]" 1 4214 2 14 THR MG 2 15 LEU H 3.000 . 3.500 2.733 2.554 2.996 . 0 0 "[ . 1 .]" 1 4215 2 14 THR HB 2 15 LEU H 4.000 . 4.500 4.031 3.748 4.116 . 0 0 "[ . 1 .]" 1 4216 2 15 LEU H 2 15 LEU QD 4.000 . 4.500 3.488 3.321 3.652 . 0 0 "[ . 1 .]" 1 4217 2 15 LEU H 2 15 LEU HG 5.000 . 5.500 2.946 2.700 3.274 . 0 0 "[ . 1 .]" 1 4218 2 15 LEU HA 2 33 LYS QD 4.000 . 4.500 4.263 3.778 4.578 0.078 2 0 "[ . 1 .]" 1 4219 2 15 LEU HA 2 33 LYS QE 4.000 . 4.500 3.651 2.841 4.404 . 0 0 "[ . 1 .]" 1 4220 2 14 THR MG 2 15 LEU HA 4.000 . 4.500 4.032 3.701 4.687 0.187 2 0 "[ . 1 .]" 1 4221 2 14 THR HB 2 15 LEU HA 4.000 . 4.500 4.561 4.302 4.681 0.181 11 0 "[ . 1 .]" 1 4222 2 13 ILE MG 2 15 LEU HA 5.000 . 5.500 4.696 4.175 5.026 . 0 0 "[ . 1 .]" 1 4223 2 15 LEU HA 2 15 LEU QD 2.500 . 3.000 2.060 2.011 2.106 . 0 0 "[ . 1 .]" 1 4224 2 15 LEU HA 2 15 LEU HG 4.000 . 4.500 2.888 2.608 3.114 . 0 0 "[ . 1 .]" 1 4225 2 3 ILE MD 2 15 LEU QB 3.000 . 3.500 3.457 3.174 3.617 0.117 12 0 "[ . 1 .]" 1 4226 2 5 VAL QG 2 15 LEU QB 2.500 . 3.000 3.095 3.013 3.179 0.179 12 0 "[ . 1 .]" 1 4227 2 15 LEU QB 2 15 LEU QD 2.500 . 3.000 1.888 1.864 1.933 . 0 0 "[ . 1 .]" 1 4228 2 15 LEU QD 2 33 LYS QB 2.500 . 3.000 2.538 2.054 2.861 . 0 0 "[ . 1 .]" 1 4229 2 2 GLN QB 2 16 GLU HA 4.000 . 4.500 2.192 2.141 2.235 . 0 0 "[ . 1 .]" 1 4230 2 2 GLN QG 2 16 GLU HA 4.000 . 4.500 4.141 4.100 4.271 . 0 0 "[ . 1 .]" 1 4231 2 16 GLU HA 2 16 GLU QB 2.500 . 3.000 2.279 2.172 2.350 . 0 0 "[ . 1 .]" 1 4232 2 16 GLU HA 2 16 GLU QG 3.000 . 3.500 2.728 2.335 3.322 . 0 0 "[ . 1 .]" 1 4233 2 16 GLU HA 2 17 VAL QG 3.000 . 3.500 3.348 3.308 3.402 . 0 0 "[ . 1 .]" 1 4234 2 3 ILE MG 2 16 GLU HA 5.000 . 5.500 5.269 5.210 5.435 . 0 0 "[ . 1 .]" 1 4235 2 16 GLU QB 2 17 VAL HA 4.000 . 4.500 4.466 4.283 4.541 0.041 12 0 "[ . 1 .]" 1 4236 2 16 GLU QB 2 17 VAL QG 4.000 . 4.500 4.065 4.000 4.142 . 0 0 "[ . 1 .]" 1 4237 2 16 GLU QG 2 17 VAL HA 4.000 . 4.500 3.809 3.505 4.401 . 0 0 "[ . 1 .]" 1 4238 2 16 GLU QG 2 17 VAL QG 3.000 . 3.500 3.789 3.638 3.880 0.380 3 0 "[ . 1 .]" 1 4239 2 1 MET ME 2 17 VAL H 4.000 . 4.500 4.553 4.290 4.628 0.128 5 0 "[ . 1 .]" 1 4240 2 2 GLN HA 2 17 VAL H 6.000 . 6.500 1.872 1.835 1.923 . 0 0 "[ . 1 .]" 1 4241 2 2 GLN QG 2 17 VAL H 4.000 . 4.500 4.719 4.696 4.757 0.257 12 0 "[ . 1 .]" 1 4242 2 16 GLU QB 2 17 VAL H 3.000 . 3.500 3.715 3.506 3.864 0.364 7 0 "[ . 1 .]" 1 4243 2 16 GLU QG 2 17 VAL H 4.000 . 4.500 3.488 2.837 4.404 . 0 0 "[ . 1 .]" 1 4244 2 3 ILE MG 2 17 VAL H 4.000 . 4.500 4.124 3.961 4.441 . 0 0 "[ . 1 .]" 1 4245 2 3 ILE MD 2 17 VAL H 4.000 . 4.500 4.742 4.661 4.815 0.315 13 0 "[ . 1 .]" 1 4246 2 17 VAL H 2 17 VAL MG1 3.000 . 3.500 2.930 2.848 2.962 . 0 0 "[ . 1 .]" 1 4247 2 17 VAL H 2 17 VAL MG2 3.000 . 3.500 2.127 2.021 2.226 . 0 0 "[ . 1 .]" 1 4248 2 17 VAL HA 2 18 GLU QG 3.000 . 3.500 3.450 3.272 3.547 0.047 4 0 "[ . 1 .]" 1 4249 2 17 VAL HA 2 29 LYS QD 5.000 . 5.500 3.827 3.544 4.130 . 0 0 "[ . 1 .]" 1 4250 2 17 VAL HA 2 29 LYS QE 3.000 . 3.500 2.621 2.143 3.692 0.192 14 0 "[ . 1 .]" 1 4251 2 17 VAL HA 2 17 VAL QG 2.500 . 3.000 2.250 2.218 2.295 . 0 0 "[ . 1 .]" 1 4252 2 3 ILE MD 2 17 VAL HA 4.500 . 5.000 5.194 5.014 5.273 0.273 2 0 "[ . 1 .]" 1 4253 2 17 VAL HA 2 17 VAL HB 3.000 . 3.500 2.437 2.413 2.461 . 0 0 "[ . 1 .]" 1 4254 2 15 LEU QB 2 17 VAL QG 6.000 . 6.500 2.581 2.431 2.724 . 0 0 "[ . 1 .]" 1 4255 2 17 VAL QG 2 18 GLU QG 4.000 . 4.500 4.302 4.088 4.465 . 0 0 "[ . 1 .]" 1 4256 2 3 ILE MD 2 17 VAL QG 2.500 . 3.000 1.848 1.831 1.865 . 0 0 "[ . 1 .]" 1 4257 2 3 ILE MG 2 17 VAL QG 2.500 . 3.000 2.094 2.010 2.211 . 0 0 "[ . 1 .]" 1 4258 2 3 ILE HB 2 17 VAL QG 4.000 . 4.500 3.838 3.773 3.907 . 0 0 "[ . 1 .]" 1 4259 2 17 VAL QG 2 26 VAL QG 2.500 . 3.000 2.103 1.919 2.321 . 0 0 "[ . 1 .]" 1 4260 2 3 ILE MD 2 17 VAL HB 4.000 . 4.500 3.681 3.448 3.797 . 0 0 "[ . 1 .]" 1 4261 2 1 MET QG 2 18 GLU HA 5.000 . 5.500 4.669 4.409 4.840 . 0 0 "[ . 1 .]" 1 4262 2 18 GLU HA 2 18 GLU QG 3.000 . 3.500 2.428 2.329 2.757 . 0 0 "[ . 1 .]" 1 4263 2 18 GLU HA 2 19 PRO HA 4.000 . 4.500 4.387 4.363 4.404 . 0 0 "[ . 1 .]" 1 4264 2 18 GLU HA 2 19 PRO QB 4.000 . 4.500 4.784 4.773 4.799 0.299 9 0 "[ . 1 .]" 1 4265 2 18 GLU HA 2 19 PRO QG 4.000 . 4.500 3.860 3.814 3.909 . 0 0 "[ . 1 .]" 1 4266 2 18 GLU HA 2 19 PRO QD 3.000 . 3.500 1.980 1.951 2.004 . 0 0 "[ . 1 .]" 1 4267 2 17 VAL QG 2 18 GLU HA 5.000 . 5.500 3.695 3.533 3.799 . 0 0 "[ . 1 .]" 1 4268 2 18 GLU HA 2 56 LEU QD 4.000 . 4.500 4.343 4.116 4.621 0.121 14 0 "[ . 1 .]" 1 4269 2 18 GLU QB 2 21 ASP HA 4.000 . 4.500 4.025 3.648 4.423 . 0 0 "[ . 1 .]" 1 4270 2 19 PRO HA 2 19 PRO QG 2.500 . 3.000 2.925 2.880 2.986 . 0 0 "[ . 1 .]" 1 4271 2 19 PRO HA 2 19 PRO QD 3.000 . 3.500 3.394 3.365 3.415 . 0 0 "[ . 1 .]" 1 4272 2 17 VAL QG 2 19 PRO HA 4.000 . 4.500 4.496 4.410 4.603 0.103 12 0 "[ . 1 .]" 1 4273 2 19 PRO QB 2 19 PRO QD 2.500 . 3.000 2.755 2.731 2.793 . 0 0 "[ . 1 .]" 1 4274 2 19 PRO QB 2 57 SER HA 4.000 . 4.500 3.837 3.545 4.211 . 0 0 "[ . 1 .]" 1 4275 2 19 PRO QB 2 57 SER QB 2.500 . 3.000 2.520 2.250 2.765 . 0 0 "[ . 1 .]" 1 4276 2 19 PRO QG 2 57 SER QB 4.000 . 4.500 4.306 4.038 4.551 0.051 13 0 "[ . 1 .]" 1 4277 2 18 GLU QB 2 19 PRO QD 3.000 . 3.500 2.208 2.131 2.305 . 0 0 "[ . 1 .]" 1 4278 2 18 GLU QG 2 19 PRO QD 3.000 . 3.500 3.343 3.203 3.709 0.209 4 0 "[ . 1 .]" 1 4279 2 19 PRO QG 2 56 LEU QD 6.000 . 6.500 4.917 4.611 5.089 . 0 0 "[ . 1 .]" 1 4280 2 20 SER HA 2 20 SER QB 2.500 . 3.000 2.274 2.184 2.386 . 0 0 "[ . 1 .]" 1 4281 2 20 SER HA 2 21 ASP QB 5.000 . 5.500 5.145 4.991 5.344 . 0 0 "[ . 1 .]" 1 4282 2 20 SER HA 2 55 THR HA 5.000 . 5.500 4.966 4.584 5.232 . 0 0 "[ . 1 .]" 1 4283 2 20 SER HA 2 55 THR MG 3.000 . 3.500 3.196 2.969 3.355 . 0 0 "[ . 1 .]" 1 4284 2 20 SER HA 2 55 THR HB 3.000 . 3.500 2.798 2.536 2.981 . 0 0 "[ . 1 .]" 1 4285 2 20 SER QB 2 55 THR MG 3.500 . 4.000 3.851 3.696 4.011 0.011 9 0 "[ . 1 .]" 1 4286 2 20 SER QB 2 55 THR HB 4.000 . 4.500 4.462 4.316 4.599 0.099 15 0 "[ . 1 .]" 1 4287 2 21 ASP HA 2 25 ASN QB 4.000 . 4.500 3.833 3.641 3.974 . 0 0 "[ . 1 .]" 1 4288 2 21 ASP HA 2 22 THR MG 3.500 . 4.000 3.502 3.376 3.616 . 0 0 "[ . 1 .]" 1 4289 2 21 ASP HA 2 26 VAL QG 5.500 2.300 6.000 5.002 4.804 5.154 . 0 0 "[ . 1 .]" 1 4290 2 21 ASP HA 2 56 LEU QD 4.500 . 5.000 4.560 4.296 4.689 . 0 0 "[ . 1 .]" 1 4291 2 17 VAL HA 2 21 ASP QB 5.000 . 5.500 3.894 3.678 4.170 . 0 0 "[ . 1 .]" 1 4292 2 21 ASP QB 2 25 ASN QB 4.000 . 4.500 3.213 2.339 3.910 . 0 0 "[ . 1 .]" 1 4293 2 17 VAL QG 2 21 ASP QB 4.000 . 4.500 3.329 3.188 3.469 . 0 0 "[ . 1 .]" 1 4294 2 17 VAL HB 2 21 ASP QB 3.000 . 3.500 2.722 2.554 2.936 . 0 0 "[ . 1 .]" 1 4295 2 21 ASP QB 2 26 VAL QG 4.000 . 4.500 3.031 2.802 3.335 . 0 0 "[ . 1 .]" 1 4296 2 21 ASP QB 2 56 LEU QD 3.000 . 3.500 2.171 2.014 2.339 . 0 0 "[ . 1 .]" 1 4297 2 22 THR HA 2 55 THR HA 3.000 2.200 3.500 2.082 2.045 2.111 0.155 1 0 "[ . 1 .]" 1 4298 2 22 THR HA 2 23 ILE MD 5.000 . 5.500 3.962 3.693 4.089 . 0 0 "[ . 1 .]" 1 4299 2 22 THR HA 2 22 THR MG 2.500 . 3.000 2.332 2.227 2.394 . 0 0 "[ . 1 .]" 1 4300 2 22 THR HA 2 55 THR HB 4.000 . 4.500 3.983 3.768 4.319 . 0 0 "[ . 1 .]" 1 4301 2 22 THR HA 2 22 THR HB 2.500 . 3.000 2.412 2.384 2.455 . 0 0 "[ . 1 .]" 1 4302 2 22 THR MG 2 54 ARG HA 5.000 . 5.500 4.872 4.121 5.186 . 0 0 "[ . 1 .]" 1 4303 2 22 THR MG 2 55 THR HB 4.500 . 5.000 4.262 4.136 4.376 . 0 0 "[ . 1 .]" 1 4304 2 23 ILE H 2 24 GLU HA 5.000 . 5.500 5.246 5.224 5.289 . 0 0 "[ . 1 .]" 1 4305 2 23 ILE H 2 23 ILE MD 5.000 . 5.500 2.997 2.789 3.139 . 0 0 "[ . 1 .]" 1 4306 2 23 ILE H 2 56 LEU QD 5.000 . 5.500 4.745 3.853 5.053 . 0 0 "[ . 1 .]" 1 4307 2 23 ILE HA 2 23 ILE MG 3.000 . 3.500 2.304 2.238 2.384 . 0 0 "[ . 1 .]" 1 4308 2 23 ILE HA 2 23 ILE MD 3.000 . 3.500 2.017 1.992 2.064 . 0 0 "[ . 1 .]" 1 4309 2 23 ILE HA 2 26 VAL HB 4.000 . 4.500 2.671 2.563 2.835 . 0 0 "[ . 1 .]" 1 4310 2 23 ILE HA 2 26 VAL QG 4.000 . 4.500 2.790 2.671 2.894 . 0 0 "[ . 1 .]" 1 4311 2 23 ILE HA 2 56 LEU QD 5.000 . 5.500 3.518 3.026 3.741 . 0 0 "[ . 1 .]" 1 4312 2 23 ILE MG 2 50 LEU QB 2.500 . 3.000 1.951 1.897 2.063 . 0 0 "[ . 1 .]" 1 4313 2 23 ILE QG 2 23 ILE MG 2.500 . 3.000 2.228 2.157 2.294 . 0 0 "[ . 1 .]" 1 4314 2 23 ILE MD 2 23 ILE MG 2.500 . 3.000 1.945 1.823 2.067 . 0 0 "[ . 1 .]" 1 4315 2 23 ILE MG 2 26 VAL HB 3.000 . 3.500 3.259 3.091 3.423 . 0 0 "[ . 1 .]" 1 4316 2 23 ILE MD 2 54 ARG HA 5.000 . 5.500 5.339 5.031 5.549 0.049 10 0 "[ . 1 .]" 1 4317 2 23 ILE MD 2 54 ARG QG 6.000 . 6.500 4.784 4.345 5.173 . 0 0 "[ . 1 .]" 1 4318 2 23 ILE MD 2 55 THR HB 6.000 . 6.500 5.448 5.064 5.897 . 0 0 "[ . 1 .]" 1 4319 2 22 THR HB 2 23 ILE MD 5.000 . 5.500 5.028 4.752 5.203 . 0 0 "[ . 1 .]" 1 4320 2 23 ILE MD 2 26 VAL HB 4.000 . 4.500 3.734 3.570 3.840 . 0 0 "[ . 1 .]" 1 4321 2 23 ILE MD 2 26 VAL QG 2.500 . 3.000 3.082 3.014 3.148 0.148 5 0 "[ . 1 .]" 1 4322 2 24 GLU HA 2 24 GLU QB 2.500 . 3.000 2.361 2.195 2.408 . 0 0 "[ . 1 .]" 1 4323 2 24 GLU HA 2 24 GLU QG 3.000 . 3.500 2.464 2.331 3.300 . 0 0 "[ . 1 .]" 1 4324 2 24 GLU HA 2 27 LYS QE 4.000 . 4.500 1.956 1.927 2.086 . 0 0 "[ . 1 .]" 1 4325 2 23 ILE MG 2 24 GLU HA 4.000 . 4.500 3.684 3.485 3.939 . 0 0 "[ . 1 .]" 1 4326 2 25 ASN HA 2 25 ASN QB 2.500 . 3.000 2.409 2.400 2.413 . 0 0 "[ . 1 .]" 1 4327 2 25 ASN HA 2 28 ALA MB 2.500 . 3.000 2.807 2.723 2.873 . 0 0 "[ . 1 .]" 1 4328 2 25 ASN HA 2 26 VAL QG 4.000 . 4.500 4.748 4.724 4.823 0.323 14 0 "[ . 1 .]" 1 4329 2 25 ASN QB 2 26 VAL HA 4.000 . 4.500 3.868 3.831 3.966 . 0 0 "[ . 1 .]" 1 4330 2 25 ASN QB 2 28 ALA MB 4.000 . 4.500 4.184 4.077 4.496 . 0 0 "[ . 1 .]" 1 4331 2 22 THR MG 2 25 ASN QB 5.000 . 5.500 4.092 3.843 4.199 . 0 0 "[ . 1 .]" 1 4332 2 25 ASN QB 2 26 VAL QG 4.000 . 4.500 3.090 2.940 3.279 . 0 0 "[ . 1 .]" 1 4333 2 25 ASN HA 2 28 ALA HA 5.500 . 6.000 5.486 5.395 5.554 . 0 0 "[ . 1 .]" 1 4334 2 23 ILE HA 2 26 VAL H 4.000 . 4.500 3.317 3.284 3.344 . 0 0 "[ . 1 .]" 1 4335 2 25 ASN HA 2 26 VAL H 4.000 . 4.500 3.523 3.513 3.533 . 0 0 "[ . 1 .]" 1 4336 2 25 ASN QB 2 26 VAL H 3.000 . 3.500 2.530 2.453 2.563 . 0 0 "[ . 1 .]" 1 4337 2 23 ILE MG 2 26 VAL H 5.000 . 5.500 4.397 4.330 4.451 . 0 0 "[ . 1 .]" 1 4338 2 23 ILE MD 2 26 VAL H 5.000 . 5.500 4.708 4.687 4.737 . 0 0 "[ . 1 .]" 1 4339 2 26 VAL H 2 26 VAL HB 4.000 . 4.500 2.373 2.359 2.382 . 0 0 "[ . 1 .]" 1 4340 2 26 VAL H 2 26 VAL QG 3.000 . 3.500 2.266 2.206 2.358 . 0 0 "[ . 1 .]" 1 4341 2 26 VAL H 2 56 LEU QD 4.000 . 4.500 4.360 4.039 4.519 0.019 4 0 "[ . 1 .]" 1 4342 2 26 VAL HA 2 29 LYS QG 4.000 . 4.500 3.258 2.944 3.967 . 0 0 "[ . 1 .]" 1 4343 2 26 VAL HA 2 29 LYS QD 4.000 . 4.500 2.196 1.957 2.374 . 0 0 "[ . 1 .]" 1 4344 2 26 VAL HA 2 29 LYS QE 3.000 . 3.500 3.536 3.409 3.695 0.195 4 0 "[ . 1 .]" 1 4345 2 17 VAL QG 2 26 VAL HA 5.000 . 5.500 2.845 2.556 3.120 . 0 0 "[ . 1 .]" 1 4346 2 15 LEU MD1 2 26 VAL HA 6.000 . 6.500 4.137 3.698 4.464 . 0 0 "[ . 1 .]" 1 4347 2 15 LEU MD2 2 26 VAL HA 6.000 . 6.500 5.739 5.237 6.402 . 0 0 "[ . 1 .]" 1 4348 2 26 VAL HA 2 26 VAL QG 2.500 . 3.000 2.066 1.967 2.097 . 0 0 "[ . 1 .]" 1 4349 2 26 VAL HA 2 56 LEU QD 4.000 . 4.500 4.323 4.241 4.481 . 0 0 "[ . 1 .]" 1 4350 2 25 ASN QB 2 26 VAL HB 4.000 . 4.500 4.575 4.541 4.608 0.108 7 0 "[ . 1 .]" 1 4351 2 26 VAL HB 2 27 LYS HA 4.000 . 4.500 4.419 4.390 4.452 . 0 0 "[ . 1 .]" 1 4352 2 26 VAL HB 2 56 LEU QD 3.000 . 3.500 3.637 3.435 3.728 0.228 13 0 "[ . 1 .]" 1 4353 2 17 VAL HA 2 26 VAL QG 5.000 . 5.500 4.549 4.315 4.784 . 0 0 "[ . 1 .]" 1 4354 2 17 VAL HB 2 26 VAL QG 4.000 . 4.500 2.989 2.771 3.207 . 0 0 "[ . 1 .]" 1 4355 2 26 VAL QG 2 56 LEU QD 2.500 . 3.000 1.844 1.756 1.883 0.044 14 0 "[ . 1 .]" 1 4356 2 26 VAL QG 2 56 LEU HG 3.000 . 3.500 2.903 2.599 3.657 0.157 5 0 "[ . 1 .]" 1 4357 2 25 ASN HA 2 27 LYS H 6.000 . 6.500 4.470 4.439 4.496 . 0 0 "[ . 1 .]" 1 4358 2 25 ASN QB 2 27 LYS H 6.000 . 6.500 4.712 4.690 4.736 . 0 0 "[ . 1 .]" 1 4359 2 26 VAL HA 2 27 LYS H 5.000 . 5.500 3.551 3.542 3.562 . 0 0 "[ . 1 .]" 1 4360 2 27 LYS H 2 27 LYS QD 5.000 . 5.500 4.271 4.237 4.300 . 0 0 "[ . 1 .]" 1 4361 2 27 LYS H 2 27 LYS QE 5.000 . 5.500 3.502 3.448 3.635 . 0 0 "[ . 1 .]" 1 4362 2 27 LYS H 2 28 ALA MB 5.000 . 5.500 4.316 4.281 4.348 . 0 0 "[ . 1 .]" 1 4363 2 26 VAL HB 2 27 LYS H 5.000 . 5.500 2.618 2.582 2.672 . 0 0 "[ . 1 .]" 1 4364 2 26 VAL QG 2 27 LYS H 4.000 . 4.500 3.108 3.079 3.142 . 0 0 "[ . 1 .]" 1 4365 2 27 LYS H 2 43 LEU QD 4.000 . 4.500 3.171 2.900 4.171 . 0 0 "[ . 1 .]" 1 4366 2 27 LYS HA 2 30 ILE HA 5.000 . 5.500 5.407 5.269 5.520 0.020 2 0 "[ . 1 .]" 1 4367 2 26 VAL QG 2 27 LYS HA 3.000 . 3.500 3.289 3.217 3.354 . 0 0 "[ . 1 .]" 1 4368 2 27 LYS HA 2 30 ILE MG 4.000 . 4.500 4.236 4.064 4.361 . 0 0 "[ . 1 .]" 1 4369 2 27 LYS HA 2 30 ILE MD 4.000 . 4.500 2.904 2.089 4.703 0.203 7 0 "[ . 1 .]" 1 4370 2 27 LYS HA 2 43 LEU QD 3.000 . 3.500 2.482 2.280 2.728 . 0 0 "[ . 1 .]" 1 4371 2 24 GLU HA 2 27 LYS QB 4.000 . 4.500 2.751 2.687 2.881 . 0 0 "[ . 1 .]" 1 4372 2 27 LYS QB 2 27 LYS QE 3.000 . 3.500 2.064 2.017 2.584 . 0 0 "[ . 1 .]" 1 4373 2 27 LYS QB 2 38 PRO HA 4.000 . 4.500 2.948 2.045 3.345 . 0 0 "[ . 1 .]" 1 4374 2 27 LYS QB 2 38 PRO QB 3.000 . 3.500 3.245 2.066 3.555 0.055 2 0 "[ . 1 .]" 1 4375 2 27 LYS HA 2 27 LYS QD 4.000 . 4.500 3.888 3.862 3.907 . 0 0 "[ . 1 .]" 1 4376 2 24 GLU QB 2 27 LYS QE 3.000 . 3.500 3.463 3.092 3.637 0.137 14 0 "[ . 1 .]" 1 4377 2 27 LYS HA 2 27 LYS QE 5.000 . 5.500 4.405 4.385 4.527 . 0 0 "[ . 1 .]" 1 4378 2 23 ILE MG 2 27 LYS QE 3.000 . 3.500 2.370 1.984 2.527 . 0 0 "[ . 1 .]" 1 4379 2 27 LYS QE 2 43 LEU QD 3.000 . 3.500 3.538 3.427 3.655 0.155 14 0 "[ . 1 .]" 1 4380 2 27 LYS QB 2 28 ALA HA 4.500 . 5.000 3.904 3.876 3.923 . 0 0 "[ . 1 .]" 1 4381 2 27 LYS HA 2 28 ALA HA 5.000 . 5.500 4.825 4.803 4.834 . 0 0 "[ . 1 .]" 1 4382 2 28 ALA H 2 28 ALA MB 3.000 . 3.500 2.177 2.115 2.223 . 0 0 "[ . 1 .]" 1 4383 2 28 ALA HA 2 31 GLN HA 4.500 . 5.000 5.099 5.070 5.174 0.174 10 0 "[ . 1 .]" 1 4384 2 28 ALA HA 2 31 GLN QB 3.000 . 3.500 2.544 2.493 2.617 . 0 0 "[ . 1 .]" 1 4385 2 28 ALA HA 2 31 GLN QG 4.000 . 4.500 4.504 4.187 4.644 0.144 7 0 "[ . 1 .]" 1 4386 2 24 GLU HA 2 28 ALA MB 4.500 . 5.000 4.932 4.866 5.035 0.035 7 0 "[ . 1 .]" 1 4387 2 28 ALA MB 2 29 LYS H 3.000 . 3.500 2.500 2.444 2.565 . 0 0 "[ . 1 .]" 1 4388 2 29 LYS H 2 29 LYS QG 4.000 . 4.500 2.268 2.099 2.543 . 0 0 "[ . 1 .]" 1 4389 2 29 LYS H 2 29 LYS QD 4.000 . 4.500 3.573 2.816 3.735 . 0 0 "[ . 1 .]" 1 4390 2 29 LYS H 2 29 LYS QE 4.000 . 4.500 4.361 4.087 4.694 0.194 11 0 "[ . 1 .]" 1 4391 2 29 LYS HA 2 29 LYS QG 3.000 . 3.500 2.289 2.208 2.353 . 0 0 "[ . 1 .]" 1 4392 2 29 LYS HA 2 29 LYS QD 4.000 . 4.500 3.942 3.868 4.005 . 0 0 "[ . 1 .]" 1 4393 2 29 LYS HA 2 29 LYS QE 4.000 . 4.500 4.696 4.507 4.784 0.284 10 0 "[ . 1 .]" 1 4394 2 29 LYS HA 2 32 ASP QB 3.000 . 3.500 3.031 2.783 3.453 . 0 0 "[ . 1 .]" 1 4395 2 15 LEU QD 2 29 LYS HA 3.000 . 3.500 3.509 3.356 3.662 0.162 12 0 "[ . 1 .]" 1 4396 2 26 VAL HA 2 29 LYS QB 4.000 . 4.500 2.833 2.702 2.901 . 0 0 "[ . 1 .]" 1 4397 2 29 LYS HA 2 29 LYS QB 2.500 . 3.000 2.407 2.387 2.429 . 0 0 "[ . 1 .]" 1 4398 2 29 LYS QB 2 29 LYS QD 3.000 . 3.500 2.119 2.090 2.140 . 0 0 "[ . 1 .]" 1 4399 2 29 LYS QB 2 29 LYS QE 3.000 . 3.500 3.597 3.509 3.625 0.125 5 0 "[ . 1 .]" 1 4400 2 15 LEU QD 2 29 LYS QB 2.500 . 3.000 1.905 1.792 1.988 0.008 13 0 "[ . 1 .]" 1 4401 2 26 VAL QG 2 29 LYS QB 5.000 . 5.500 3.248 3.161 3.356 . 0 0 "[ . 1 .]" 1 4402 2 29 LYS QE 2 29 LYS QG 2.500 . 3.000 2.206 2.093 2.263 . 0 0 "[ . 1 .]" 1 4403 2 17 VAL QG 2 29 LYS QG 3.000 . 3.500 3.604 3.501 3.755 0.255 14 0 "[ . 1 .]" 1 4404 2 26 VAL QG 2 29 LYS QG 4.000 . 4.500 4.090 3.894 4.502 0.002 13 0 "[ . 1 .]" 1 4405 2 17 VAL QG 2 29 LYS QD 2.500 . 3.000 1.896 1.834 1.983 . 0 0 "[ . 1 .]" 1 4406 2 15 LEU QD 2 29 LYS QD 3.000 . 3.500 2.998 2.731 3.274 . 0 0 "[ . 1 .]" 1 4407 2 26 VAL QG 2 29 LYS QD 2.500 . 3.000 2.936 2.793 3.038 0.038 10 0 "[ . 1 .]" 1 4408 2 17 VAL QG 2 29 LYS QE 2.500 . 3.000 2.146 1.957 3.014 0.014 14 0 "[ . 1 .]" 1 4409 2 17 VAL HB 2 29 LYS QE 4.000 . 4.500 3.455 3.117 4.370 . 0 0 "[ . 1 .]" 1 4410 2 26 VAL H 2 29 LYS QE 6.000 . 6.500 4.837 4.550 5.197 . 0 0 "[ . 1 .]" 1 4411 2 15 LEU MD1 2 30 ILE H 3.000 . 3.500 2.996 2.695 3.272 . 0 0 "[ . 1 .]" 1 4412 2 28 ALA MB 2 30 ILE H 3.500 . 4.000 4.393 4.374 4.435 0.435 9 0 "[ . 1 .]" 1 4413 2 26 VAL HA 2 30 ILE H 5.000 . 5.500 4.528 4.444 4.577 . 0 0 "[ . 1 .]" 1 4414 2 27 LYS HA 2 30 ILE H 5.000 . 5.500 3.361 3.285 3.420 . 0 0 "[ . 1 .]" 1 4415 2 29 LYS HA 2 30 ILE H 4.000 . 4.500 3.520 3.510 3.526 . 0 0 "[ . 1 .]" 1 4416 2 29 LYS QB 2 30 ILE H 5.000 . 5.500 2.589 2.543 2.650 . 0 0 "[ . 1 .]" 1 4417 2 29 LYS QD 2 30 ILE H 5.000 . 5.500 4.635 4.328 4.759 . 0 0 "[ . 1 .]" 1 4418 2 29 LYS QE 2 30 ILE H 6.000 . 6.500 6.106 5.946 6.276 . 0 0 "[ . 1 .]" 1 4419 2 15 LEU QD 2 30 ILE H 4.000 . 4.500 2.948 2.668 3.200 . 0 0 "[ . 1 .]" 1 4420 2 26 VAL QG 2 30 ILE H 4.000 . 4.500 4.083 4.026 4.129 . 0 0 "[ . 1 .]" 1 4421 2 30 ILE H 2 30 ILE MG 4.000 . 4.500 3.769 3.738 3.802 . 0 0 "[ . 1 .]" 1 4422 2 30 ILE H 2 30 ILE MD 4.000 . 4.500 3.606 3.454 3.872 . 0 0 "[ . 1 .]" 1 4423 2 30 ILE H 2 30 ILE HB 4.000 . 4.500 2.455 2.363 2.510 . 0 0 "[ . 1 .]" 1 4424 2 30 ILE H 2 30 ILE QG 4.000 . 4.500 2.352 2.265 2.529 . 0 0 "[ . 1 .]" 1 4425 2 30 ILE HA 2 33 LYS HA 5.000 . 5.500 5.435 5.060 5.697 0.197 5 0 "[ . 1 .]" 1 4426 2 30 ILE HA 2 33 LYS QB 4.000 . 4.500 2.646 2.122 3.034 . 0 0 "[ . 1 .]" 1 4427 2 30 ILE HA 2 33 LYS QG 4.000 . 4.500 4.072 3.099 4.575 0.075 7 0 "[ . 1 .]" 1 4428 2 30 ILE HA 2 33 LYS QD 5.000 . 5.500 4.594 4.242 5.241 . 0 0 "[ . 1 .]" 1 4429 2 13 ILE MD 2 30 ILE HA 5.000 . 5.500 4.240 3.878 5.691 0.191 9 0 "[ . 1 .]" 1 4430 2 13 ILE MG 2 30 ILE HA 5.000 . 5.500 4.229 3.559 4.526 . 0 0 "[ . 1 .]" 1 4431 2 15 LEU QD 2 30 ILE HA 4.000 . 4.500 2.346 2.013 2.556 . 0 0 "[ . 1 .]" 1 4432 2 15 LEU MD2 2 30 ILE HA 4.000 . 4.500 3.396 2.955 3.871 . 0 0 "[ . 1 .]" 1 4433 2 30 ILE HA 2 30 ILE MG 3.000 . 3.500 2.397 2.315 2.482 . 0 0 "[ . 1 .]" 1 4434 2 30 ILE HA 2 30 ILE MD 4.000 . 4.500 3.436 2.021 3.811 . 0 0 "[ . 1 .]" 1 4435 2 30 ILE QG 2 30 ILE MG 3.000 . 3.500 2.289 2.228 2.404 . 0 0 "[ . 1 .]" 1 4436 2 30 ILE QG 2 43 LEU QD 2.500 . 3.000 3.065 2.321 3.356 0.356 8 0 "[ . 1 .]" 1 4437 2 30 ILE MG 2 31 GLN QG 5.000 . 5.500 4.998 4.824 5.589 0.089 10 0 "[ . 1 .]" 1 4438 2 30 ILE MD 2 30 ILE MG 2.500 . 3.000 1.873 1.791 1.980 0.009 3 0 "[ . 1 .]" 1 4439 2 30 ILE HB 2 30 ILE MD 3.000 . 3.500 2.457 2.239 3.164 . 0 0 "[ . 1 .]" 1 4440 2 5 VAL QG 2 30 ILE HB 4.000 . 4.500 4.473 4.157 4.608 0.108 2 0 "[ . 1 .]" 1 4441 2 15 LEU QD 2 30 ILE HB 4.000 . 4.500 3.922 3.674 4.221 . 0 0 "[ . 1 .]" 1 4442 2 30 ILE HB 2 43 LEU QD 3.000 . 3.500 3.771 3.568 3.908 0.408 1 0 "[ . 1 .]" 1 4443 2 30 ILE HB 2 30 ILE QG 2.500 . 3.000 2.363 2.184 2.426 . 0 0 "[ . 1 .]" 1 4444 2 31 GLN HA 2 31 GLN QG 2.500 . 3.000 2.354 2.214 2.977 . 0 0 "[ . 1 .]" 1 4445 2 30 ILE MG 2 31 GLN HA 4.000 . 4.500 3.356 3.242 3.527 . 0 0 "[ . 1 .]" 1 4446 2 31 GLN HA 2 36 ILE MG 5.000 . 5.500 4.763 4.479 5.023 . 0 0 "[ . 1 .]" 1 4447 2 31 GLN QB 2 37 PRO HA 4.000 . 4.500 3.792 2.975 4.330 . 0 0 "[ . 1 .]" 1 4448 2 30 ILE MG 2 31 GLN QB 4.000 . 4.500 4.220 4.009 4.379 . 0 0 "[ . 1 .]" 1 4449 2 31 GLN QB 2 36 ILE HB 6.000 . 6.500 4.706 4.333 5.114 . 0 0 "[ . 1 .]" 1 4450 2 31 GLN QG 2 35 GLY QA 4.000 . 4.500 3.315 2.286 4.366 . 0 0 "[ . 1 .]" 1 4451 2 32 ASP HA 2 32 ASP QB 2.500 . 3.000 2.403 2.353 2.477 . 0 0 "[ . 1 .]" 1 4452 2 32 ASP QB 2 33 LYS HA 4.000 . 4.500 4.125 3.903 4.451 . 0 0 "[ . 1 .]" 1 4453 2 32 ASP QB 2 33 LYS QG 4.000 . 4.500 3.551 3.370 3.904 . 0 0 "[ . 1 .]" 1 4454 2 33 LYS HA 2 33 LYS QB 2.500 . 3.000 2.469 2.428 2.526 . 0 0 "[ . 1 .]" 1 4455 2 33 LYS HA 2 33 LYS QG 2.500 . 3.000 2.067 1.966 2.139 . 0 0 "[ . 1 .]" 1 4456 2 33 LYS HA 2 33 LYS QD 3.500 . 4.000 3.296 2.699 3.696 . 0 0 "[ . 1 .]" 1 4457 2 33 LYS HA 2 33 LYS QE 4.000 . 4.500 4.194 3.652 4.585 0.085 1 0 "[ . 1 .]" 1 4458 2 15 LEU QD 2 33 LYS HA 4.000 . 4.500 4.418 4.153 4.584 0.084 6 0 "[ . 1 .]" 1 4459 2 15 LEU HA 2 33 LYS QB 6.000 . 6.500 5.804 5.212 6.346 . 0 0 "[ . 1 .]" 1 4460 2 33 LYS QB 2 33 LYS QD 2.500 . 3.000 2.056 1.993 2.118 . 0 0 "[ . 1 .]" 1 4461 2 33 LYS QB 2 33 LYS QE 3.000 . 3.500 3.565 3.499 3.652 0.152 14 0 "[ . 1 .]" 1 4462 2 13 ILE MG 2 33 LYS QB 2.500 . 3.000 2.337 2.182 2.532 . 0 0 "[ . 1 .]" 1 4463 2 33 LYS QE 2 33 LYS QG 2.500 . 3.000 2.163 2.048 2.245 . 0 0 "[ . 1 .]" 1 4464 2 15 LEU QD 2 33 LYS QG 2.500 . 3.000 2.013 1.821 2.244 . 0 0 "[ . 1 .]" 1 4465 2 13 ILE MG 2 33 LYS QD 3.500 . 4.000 1.936 1.786 2.260 0.014 6 0 "[ . 1 .]" 1 4466 2 15 LEU QD 2 33 LYS QD 2.500 . 3.000 2.033 1.905 2.364 . 0 0 "[ . 1 .]" 1 4467 2 13 ILE MD 2 33 LYS QE 5.000 . 5.500 5.412 5.133 5.594 0.094 3 0 "[ . 1 .]" 1 4468 2 13 ILE MG 2 33 LYS QE 3.000 . 3.500 3.271 2.770 3.515 0.015 7 0 "[ . 1 .]" 1 4469 2 15 LEU QD 2 33 LYS QE 3.000 . 3.500 2.258 1.967 3.020 . 0 0 "[ . 1 .]" 1 4470 2 13 ILE QG 2 33 LYS QD 5.000 . 5.500 4.579 4.342 5.022 . 0 0 "[ . 1 .]" 1 4471 2 34 GLU HA 2 34 GLU QB 2.500 . 3.000 2.398 2.343 2.496 . 0 0 "[ . 1 .]" 1 4472 2 34 GLU HA 2 34 GLU QG 3.000 . 3.500 2.781 2.401 2.924 . 0 0 "[ . 1 .]" 1 4473 2 13 ILE MD 2 34 GLU HA 5.000 . 5.500 4.488 4.117 4.907 . 0 0 "[ . 1 .]" 1 4474 2 34 GLU HA 2 36 ILE MD 4.500 . 5.000 5.025 4.775 5.198 0.198 6 0 "[ . 1 .]" 1 4475 2 34 GLU HA 2 36 ILE HB 6.000 . 6.500 6.253 5.974 6.572 0.072 1 0 "[ . 1 .]" 1 4476 2 13 ILE MD 2 34 GLU QB 4.000 . 4.500 3.411 3.078 4.372 . 0 0 "[ . 1 .]" 1 4477 2 30 ILE MG 2 34 GLU QB 2.500 . 3.000 2.579 2.278 2.954 . 0 0 "[ . 1 .]" 1 4478 2 34 GLU QB 2 36 ILE MD 3.500 . 4.000 2.760 2.345 3.166 . 0 0 "[ . 1 .]" 1 4479 2 13 ILE MD 2 34 GLU QG 2.500 . 3.000 1.946 1.777 2.824 0.023 2 0 "[ . 1 .]" 1 4480 2 13 ILE MG 2 34 GLU QG 2.500 . 3.000 2.974 2.699 3.151 0.151 6 0 "[ . 1 .]" 1 4481 2 30 ILE MG 2 34 GLU QG 3.000 . 3.500 3.192 2.523 3.576 0.076 11 0 "[ . 1 .]" 1 4482 2 34 GLU QG 2 36 ILE MD 3.500 . 4.000 3.645 2.981 4.254 0.254 10 0 "[ . 1 .]" 1 4483 2 35 GLY QA 2 36 ILE HA 4.000 . 4.500 4.059 4.008 4.117 . 0 0 "[ . 1 .]" 1 4484 2 36 ILE HA 2 37 PRO QB 5.000 . 5.500 4.707 4.644 4.749 . 0 0 "[ . 1 .]" 1 4485 2 36 ILE HA 2 37 PRO QG 4.000 . 4.500 3.940 3.888 4.019 . 0 0 "[ . 1 .]" 1 4486 2 36 ILE HA 2 37 PRO QD 3.000 . 3.500 2.019 1.968 2.095 0.032 2 0 "[ . 1 .]" 1 4487 2 36 ILE HA 2 36 ILE MG 2.500 . 3.000 2.298 2.198 2.405 . 0 0 "[ . 1 .]" 1 4488 2 36 ILE HA 2 36 ILE MD 3.000 . 3.500 3.048 1.981 3.811 0.311 2 0 "[ . 1 .]" 1 4489 2 36 ILE HA 2 36 ILE HB 3.000 . 3.500 3.018 3.002 3.032 . 0 0 "[ . 1 .]" 1 4490 2 36 ILE MG 2 38 PRO HA 4.000 . 4.500 4.645 4.500 4.778 0.278 13 0 "[ . 1 .]" 1 4491 2 36 ILE MG 2 40 GLN HA 4.000 . 4.500 4.290 3.965 4.751 0.251 10 0 "[ . 1 .]" 1 4492 2 36 ILE MD 2 36 ILE MG 2.500 . 3.000 1.892 1.799 1.982 0.001 15 0 "[ . 1 .]" 1 4493 2 36 ILE MD 2 41 GLN QG 4.000 . 4.500 3.995 2.752 4.706 0.206 10 0 "[ . 1 .]" 1 4494 2 36 ILE HB 2 36 ILE MD 2.500 . 3.000 2.699 2.246 3.217 0.217 8 0 "[ . 1 .]" 1 4495 2 30 ILE HA 2 36 ILE HB 5.000 . 5.500 5.504 5.317 5.621 0.121 1 0 "[ . 1 .]" 1 4496 2 31 GLN HA 2 36 ILE HB 4.000 . 4.500 3.568 3.132 3.978 . 0 0 "[ . 1 .]" 1 4497 2 34 GLU QB 2 36 ILE HB 4.000 . 4.500 3.546 3.346 3.690 . 0 0 "[ . 1 .]" 1 4498 2 34 GLU QG 2 36 ILE HB 5.500 . 6.000 5.159 4.862 5.347 . 0 0 "[ . 1 .]" 1 4499 2 30 ILE MG 2 36 ILE HB 2.500 . 3.000 2.234 2.056 2.398 . 0 0 "[ . 1 .]" 1 4500 2 30 ILE MD 2 36 ILE HB 4.000 . 4.500 4.553 4.307 4.794 0.294 15 0 "[ . 1 .]" 1 4501 2 30 ILE HB 2 36 ILE HB 4.000 . 4.500 4.233 4.068 4.543 0.043 6 0 "[ . 1 .]" 1 4502 2 34 GLU HA 2 36 ILE QG 4.500 . 5.000 4.268 4.045 4.669 . 0 0 "[ . 1 .]" 1 4503 2 36 ILE HA 2 36 ILE QG 3.000 . 3.500 2.636 2.338 3.066 . 0 0 "[ . 1 .]" 1 4504 2 30 ILE MG 2 36 ILE QG 2.500 . 3.000 2.995 2.748 3.278 0.278 7 0 "[ . 1 .]" 1 4505 2 30 ILE MD 2 36 ILE QG 4.500 . 5.000 5.046 4.327 5.353 0.353 1 0 "[ . 1 .]" 1 4506 2 31 GLN HA 2 37 PRO HA 4.000 . 4.500 4.660 4.474 4.777 0.277 13 0 "[ . 1 .]" 1 4507 2 37 PRO HA 2 37 PRO QG 3.000 . 3.500 3.199 2.908 3.511 0.011 5 0 "[ . 1 .]" 1 4508 2 37 PRO HA 2 38 PRO QG 4.000 . 4.500 3.955 3.908 4.066 . 0 0 "[ . 1 .]" 1 4509 2 37 PRO HA 2 38 PRO QD 3.000 . 3.500 2.049 2.006 2.152 . 0 0 "[ . 1 .]" 1 4510 2 37 PRO QB 2 37 PRO QD 3.000 . 3.500 2.772 2.737 2.817 . 0 0 "[ . 1 .]" 1 4511 2 37 PRO QB 2 38 PRO QD 3.000 . 3.500 2.440 2.257 2.656 . 0 0 "[ . 1 .]" 1 4512 2 37 PRO QB 2 39 ASP QB 3.000 . 3.500 3.219 2.904 3.752 0.252 14 0 "[ . 1 .]" 1 4513 2 36 ILE MG 2 37 PRO QB 4.000 . 4.500 4.266 3.962 4.738 0.238 11 0 "[ . 1 .]" 1 4514 2 36 ILE MG 2 37 PRO QG 3.600 . 4.100 3.953 3.377 4.414 0.314 8 0 "[ . 1 .]" 1 4515 2 37 PRO QD 2 40 GLN QG 4.000 . 4.500 3.388 2.327 4.089 . 0 0 "[ . 1 .]" 1 4516 2 36 ILE MG 2 37 PRO QD 3.000 . 3.500 2.513 2.191 2.803 . 0 0 "[ . 1 .]" 1 4517 2 36 ILE MD 2 37 PRO QD 4.000 . 4.500 4.038 3.106 4.703 0.203 2 0 "[ . 1 .]" 1 4518 2 36 ILE HB 2 37 PRO QD 4.000 . 4.500 4.217 4.081 4.341 . 0 0 "[ . 1 .]" 1 4519 2 38 PRO HA 2 38 PRO QG 2.500 . 3.000 3.030 2.834 3.473 0.473 3 0 "[ . 1 .]" 1 4520 2 28 ALA HA 2 38 PRO QB 5.000 . 5.500 5.313 4.408 5.717 0.217 10 0 "[ . 1 .]" 1 4521 2 38 PRO QB 2 38 PRO QD 2.500 . 3.000 2.754 2.717 2.803 . 0 0 "[ . 1 .]" 1 4522 2 38 PRO QB 2 39 ASP QB 4.000 . 4.500 4.356 3.790 4.628 0.128 3 0 "[ . 1 .]" 1 4523 2 38 PRO HA 2 38 PRO QD 4.000 . 4.500 3.336 3.235 3.378 . 0 0 "[ . 1 .]" 1 4524 2 38 PRO QB 2 39 ASP H 5.000 . 5.500 2.790 2.487 3.390 . 0 0 "[ . 1 .]" 1 4525 2 39 ASP HA 2 39 ASP QB 2.500 . 3.000 2.390 2.186 2.417 . 0 0 "[ . 1 .]" 1 4526 2 40 GLN HA 2 40 GLN QB 2.500 . 3.000 2.411 2.250 2.525 . 0 0 "[ . 1 .]" 1 4527 2 40 GLN HA 2 40 GLN QG 2.500 . 3.000 2.307 2.079 2.776 . 0 0 "[ . 1 .]" 1 4528 2 40 GLN HA 2 72 ARG QB 3.500 . 4.000 2.905 2.099 3.891 . 0 0 "[ . 1 .]" 1 4529 2 40 GLN HA 2 72 ARG QG 3.500 . 4.000 2.736 2.064 4.009 0.009 7 0 "[ . 1 .]" 1 4530 2 40 GLN HA 2 72 ARG QD 4.000 . 4.500 3.088 2.086 4.508 0.008 10 0 "[ . 1 .]" 1 4531 2 40 GLN HA 2 71 LEU QD 4.000 . 4.500 4.518 3.876 4.793 0.293 3 0 "[ . 1 .]" 1 4532 2 36 ILE MG 2 40 GLN QB 3.000 . 3.500 2.250 1.917 3.249 . 0 0 "[ . 1 .]" 1 4533 2 36 ILE MD 2 40 GLN QB 4.000 . 4.500 4.212 3.663 4.635 0.135 7 0 "[ . 1 .]" 1 4534 2 40 GLN QB 2 71 LEU QD 4.500 . 5.000 3.359 2.428 4.037 . 0 0 "[ . 1 .]" 1 4535 2 40 GLN QG 2 72 ARG QB 4.000 . 4.500 2.557 2.064 4.029 . 0 0 "[ . 1 .]" 1 4536 2 40 GLN QG 2 72 ARG QG 4.500 . 5.000 3.320 2.047 4.803 . 0 0 "[ . 1 .]" 1 4537 2 40 GLN QG 2 72 ARG QD 5.000 . 5.500 3.898 2.465 5.439 . 0 0 "[ . 1 .]" 1 4538 2 36 ILE MG 2 40 GLN QG 3.000 . 3.500 3.227 2.536 3.736 0.236 9 0 "[ . 1 .]" 1 4539 2 40 GLN QB 2 41 GLN HA 5.000 . 5.500 4.228 3.928 4.869 . 0 0 "[ . 1 .]" 1 4540 2 41 GLN HA 2 71 LEU HA 5.000 . 5.500 3.615 2.447 4.675 . 0 0 "[ . 1 .]" 1 4541 2 41 GLN HA 2 69 LEU QD 3.000 . 3.500 2.535 2.032 3.519 0.019 7 0 "[ . 1 .]" 1 4542 2 41 GLN HA 2 71 LEU QD 3.000 . 3.500 2.816 2.196 3.387 . 0 0 "[ . 1 .]" 1 4543 2 41 GLN QB 2 69 LEU QD 2.500 . 3.000 2.607 1.872 3.173 0.173 6 0 "[ . 1 .]" 1 4544 2 41 GLN HA 2 41 GLN QG 2.500 . 3.000 2.654 2.075 3.278 0.278 7 0 "[ . 1 .]" 1 4545 2 36 ILE MG 2 41 GLN QG 2.500 . 3.000 2.152 1.788 3.031 0.031 1 0 "[ . 1 .]" 1 4546 2 42 ARG HA 2 42 ARG QB 2.500 . 3.000 2.406 2.358 2.522 . 0 0 "[ . 1 .]" 1 4547 2 42 ARG HA 2 42 ARG QD 4.000 . 4.500 3.956 3.770 4.186 . 0 0 "[ . 1 .]" 1 4548 2 42 ARG HA 2 43 LEU HA 6.000 . 6.500 4.414 4.377 4.449 . 0 0 "[ . 1 .]" 1 4549 2 42 ARG HA 2 70 VAL HB 4.500 . 5.000 4.918 4.643 5.102 0.102 7 0 "[ . 1 .]" 1 4550 2 42 ARG QB 2 42 ARG QD 3.000 . 3.500 2.183 2.112 2.301 . 0 0 "[ . 1 .]" 1 4551 2 42 ARG QB 2 44 ILE MD 3.000 . 3.500 3.185 2.765 3.653 0.153 15 0 "[ . 1 .]" 1 4552 2 42 ARG QB 2 70 VAL QG 4.000 . 4.500 2.912 2.683 3.234 . 0 0 "[ . 1 .]" 1 4553 2 42 ARG QB 2 44 ILE QG 5.000 . 5.500 3.213 2.950 3.934 . 0 0 "[ . 1 .]" 1 4554 2 42 ARG QD 2 70 VAL HB 5.000 . 5.500 3.141 2.098 4.263 . 0 0 "[ . 1 .]" 1 4555 2 43 LEU HA 2 69 LEU HA 4.000 . 4.500 3.047 2.918 3.229 . 0 0 "[ . 1 .]" 1 4556 2 43 LEU HA 2 43 LEU QD 3.000 . 3.500 2.059 1.989 2.220 . 0 0 "[ . 1 .]" 1 4557 2 43 LEU HA 2 43 LEU HG 4.000 . 4.500 3.120 2.366 3.646 . 0 0 "[ . 1 .]" 1 4558 2 43 LEU QB 2 43 LEU QD 2.500 . 3.000 1.939 1.924 1.999 . 0 0 "[ . 1 .]" 1 4559 2 23 ILE MG 2 43 LEU HG 3.500 . 4.000 4.015 3.798 4.230 0.230 10 0 "[ . 1 .]" 1 4560 2 44 ILE HA 2 49 GLN QG 6.000 . 6.500 4.110 3.194 5.089 . 0 0 "[ . 1 .]" 1 4561 2 44 ILE HA 2 49 GLN QB 5.000 . 5.500 4.200 3.791 4.533 . 0 0 "[ . 1 .]" 1 4562 2 42 ARG QD 2 44 ILE MD 4.000 . 4.500 3.598 2.010 4.512 0.012 5 0 "[ . 1 .]" 1 4563 2 44 ILE MD 2 44 ILE MG 2.500 . 3.000 2.096 1.882 2.175 . 0 0 "[ . 1 .]" 1 4564 2 44 ILE QG 2 44 ILE MG 3.000 . 3.500 2.203 2.148 2.263 . 0 0 "[ . 1 .]" 1 4565 2 44 ILE HB 2 44 ILE MD 3.000 . 3.500 2.220 2.167 2.336 . 0 0 "[ . 1 .]" 1 4566 2 42 ARG HA 2 44 ILE QG 5.000 . 5.500 4.541 4.385 4.773 . 0 0 "[ . 1 .]" 1 4567 2 44 ILE QG 2 49 GLN QB 4.000 . 4.500 2.663 2.193 3.007 . 0 0 "[ . 1 .]" 1 4568 2 44 ILE HA 2 45 PHE HA 4.000 . 4.500 4.407 4.361 4.424 . 0 0 "[ . 1 .]" 1 4569 2 45 PHE HA 2 50 LEU QD 4.000 . 4.500 3.949 3.097 4.284 . 0 0 "[ . 1 .]" 1 4570 2 44 ILE MG 2 45 PHE HA 4.000 . 4.500 3.806 3.487 4.225 . 0 0 "[ . 1 .]" 1 4571 2 45 PHE HA 2 61 ILE MD 5.000 . 5.500 5.069 4.417 5.412 . 0 0 "[ . 1 .]" 1 4572 2 45 PHE QB 2 50 LEU QD 4.000 . 4.500 2.089 1.927 2.493 . 0 0 "[ . 1 .]" 1 4573 2 45 PHE QB 2 61 ILE MD 5.000 . 5.500 2.873 2.624 3.442 . 0 0 "[ . 1 .]" 1 4574 2 45 PHE QB 2 67 LEU QD 4.000 . 4.500 2.730 1.890 3.697 . 0 0 "[ . 1 .]" 1 4575 2 45 PHE HA 2 45 PHE QD 4.000 . 4.500 2.529 2.196 2.738 . 0 0 "[ . 1 .]" 1 4576 2 45 PHE QD 2 60 ASN QB 5.000 . 5.500 4.863 4.533 5.424 . 0 0 "[ . 1 .]" 1 4577 2 45 PHE QD 2 61 ILE HA 4.000 . 4.500 4.494 4.091 4.615 0.115 15 0 "[ . 1 .]" 1 4578 2 45 PHE QD 2 65 SER HA 5.000 . 5.500 5.562 5.378 5.662 0.162 13 0 "[ . 1 .]" 1 4579 2 45 PHE QD 2 65 SER QB 5.000 . 5.500 4.037 3.343 4.832 . 0 0 "[ . 1 .]" 1 4580 2 45 PHE QD 2 67 LEU HA 5.000 . 5.500 2.827 2.276 4.233 . 0 0 "[ . 1 .]" 1 4581 2 45 PHE QD 2 50 LEU QD 3.000 . 3.500 3.455 3.085 3.596 0.096 8 0 "[ . 1 .]" 1 4582 2 45 PHE QD 2 67 LEU HG 4.000 . 4.500 2.646 2.017 4.602 0.102 15 0 "[ . 1 .]" 1 4583 2 45 PHE QD 2 61 ILE MD 4.000 . 4.500 3.404 3.070 3.622 . 0 0 "[ . 1 .]" 1 4584 2 45 PHE QD 2 61 ILE MG 4.000 . 4.500 3.839 2.882 4.265 . 0 0 "[ . 1 .]" 1 4585 2 45 PHE QD 2 67 LEU QD 2.500 . 3.000 2.082 1.835 2.492 . 0 0 "[ . 1 .]" 1 4586 2 45 PHE QE 2 60 ASN QB 4.000 . 4.500 3.728 3.133 4.562 0.062 10 0 "[ . 1 .]" 1 4587 2 45 PHE QE 2 61 ILE HA 4.000 . 4.500 3.437 2.721 3.720 . 0 0 "[ . 1 .]" 1 4588 2 45 PHE QE 2 65 SER HA 4.000 . 4.500 3.662 3.420 3.821 . 0 0 "[ . 1 .]" 1 4589 2 45 PHE QE 2 65 SER QB 4.000 . 4.500 2.744 1.863 3.871 . 0 0 "[ . 1 .]" 1 4590 2 45 PHE QE 2 61 ILE MD 4.000 . 4.500 4.435 4.153 4.544 0.044 12 0 "[ . 1 .]" 1 4591 2 45 PHE QE 2 61 ILE MG 4.000 . 4.500 3.614 2.621 4.149 . 0 0 "[ . 1 .]" 1 4592 2 45 PHE HZ 2 60 ASN QB 5.000 . 5.500 5.116 4.826 5.488 . 0 0 "[ . 1 .]" 1 4593 2 45 PHE HZ 2 61 ILE HA 4.000 . 4.500 3.718 3.486 3.840 . 0 0 "[ . 1 .]" 1 4594 2 45 PHE HZ 2 65 SER HA 4.000 . 4.500 4.559 4.512 4.630 0.130 11 0 "[ . 1 .]" 1 4595 2 45 PHE HZ 2 65 SER QB 4.000 . 4.500 3.669 3.130 4.173 . 0 0 "[ . 1 .]" 1 4596 2 45 PHE HZ 2 61 ILE HB 6.000 . 6.500 6.474 6.298 6.582 0.082 10 0 "[ . 1 .]" 1 4597 2 45 PHE HZ 2 61 ILE MG 4.000 . 4.500 4.382 4.178 4.562 0.062 11 0 "[ . 1 .]" 1 4598 2 48 ARG HA 2 48 ARG QB 2.500 . 3.000 2.346 2.181 2.373 . 0 0 "[ . 1 .]" 1 4599 2 48 ARG HA 2 48 ARG QG 3.000 . 3.500 2.454 2.314 3.296 . 0 0 "[ . 1 .]" 1 4600 2 48 ARG HA 2 48 ARG QD 3.500 . 4.000 3.956 2.031 4.228 0.228 9 0 "[ . 1 .]" 1 4601 2 44 ILE MG 2 48 ARG HA 4.000 . 4.500 3.371 3.165 3.650 . 0 0 "[ . 1 .]" 1 4602 2 44 ILE QG 2 48 ARG HA 5.000 . 5.500 4.959 4.540 5.233 . 0 0 "[ . 1 .]" 1 4603 2 48 ARG HA 2 50 LEU QD 6.000 . 6.500 5.393 4.784 5.814 . 0 0 "[ . 1 .]" 1 4604 2 48 ARG QB 2 50 LEU QD 5.000 . 5.500 3.914 3.364 4.891 . 0 0 "[ . 1 .]" 1 4605 2 48 ARG QG 2 50 LEU QD 4.000 . 4.500 3.618 2.991 4.037 . 0 0 "[ . 1 .]" 1 4606 2 48 ARG QD 2 50 LEU QD 4.000 . 4.500 4.300 3.725 4.632 0.132 2 0 "[ . 1 .]" 1 4607 2 44 ILE MG 2 49 GLN HA 5.000 . 5.500 2.880 2.270 3.131 . 0 0 "[ . 1 .]" 1 4608 2 49 GLN QB 2 51 GLU HA 5.000 . 5.500 5.139 4.942 5.285 . 0 0 "[ . 1 .]" 1 4609 2 44 ILE MD 2 49 GLN QB 3.000 . 3.500 3.388 2.937 3.551 0.051 5 0 "[ . 1 .]" 1 4610 2 49 GLN QG 2 51 GLU HA 3.500 . 4.000 3.902 3.611 4.139 0.139 15 0 "[ . 1 .]" 1 4611 2 44 ILE MD 2 49 GLN QG 4.000 . 4.500 4.084 3.526 4.774 0.274 15 0 "[ . 1 .]" 1 4612 2 44 ILE QG 2 49 GLN QG 5.000 . 5.500 3.023 2.158 4.156 . 0 0 "[ . 1 .]" 1 4613 2 50 LEU HA 2 50 LEU QD 3.000 . 3.500 2.088 1.918 2.199 . 0 0 "[ . 1 .]" 1 4614 2 23 ILE MG 2 50 LEU HA 4.000 . 4.500 4.081 3.910 4.253 . 0 0 "[ . 1 .]" 1 4615 2 23 ILE MD 2 50 LEU HA 4.000 . 4.500 3.938 3.743 4.085 . 0 0 "[ . 1 .]" 1 4616 2 50 LEU QB 2 50 LEU QD 2.500 . 3.000 1.910 1.891 1.977 . 0 0 "[ . 1 .]" 1 4617 2 23 ILE MD 2 50 LEU QB 3.000 . 3.500 2.123 1.991 2.390 . 0 0 "[ . 1 .]" 1 4618 2 23 ILE MG 2 50 LEU QD 2.500 . 3.000 2.605 2.381 3.032 0.032 15 0 "[ . 1 .]" 1 4619 2 23 ILE QG 2 50 LEU QD 4.000 . 4.500 3.203 2.470 3.485 . 0 0 "[ . 1 .]" 1 4620 2 23 ILE MD 2 50 LEU QD 4.000 . 4.500 1.982 1.791 2.228 0.009 3 0 "[ . 1 .]" 1 4621 2 50 LEU QD 2 67 LEU HG 4.000 . 4.500 3.395 2.394 4.515 0.015 11 0 "[ . 1 .]" 1 4622 2 26 VAL QG 2 50 LEU QD 6.000 . 6.500 3.554 3.320 4.298 . 0 0 "[ . 1 .]" 1 4623 2 43 LEU QD 2 50 LEU QD 4.000 . 4.500 2.858 2.355 3.904 . 0 0 "[ . 1 .]" 1 4624 2 50 LEU QD 2 56 LEU QD 5.000 . 5.500 2.967 2.388 3.569 . 0 0 "[ . 1 .]" 1 4625 2 50 LEU QD 2 61 ILE MD 4.000 . 4.500 1.977 1.777 2.185 0.023 10 0 "[ . 1 .]" 1 4626 2 50 LEU QD 2 61 ILE MG 5.000 . 5.500 3.922 3.527 4.358 . 0 0 "[ . 1 .]" 1 4627 2 50 LEU QD 2 67 LEU QD 4.000 . 4.500 2.074 1.892 2.464 . 0 0 "[ . 1 .]" 1 4628 2 51 GLU HA 2 51 GLU QG 3.000 . 3.500 2.565 2.166 3.375 . 0 0 "[ . 1 .]" 1 4629 2 51 GLU QG 2 54 ARG QG 3.500 . 4.000 3.477 2.174 4.329 0.329 15 0 "[ . 1 .]" 1 4630 2 51 GLU QG 2 59 TYR QE 6.000 . 6.500 4.595 3.524 5.670 . 0 0 "[ . 1 .]" 1 4631 2 23 ILE HA 2 52 ASP HA 5.000 . 5.500 5.485 5.120 5.680 0.180 15 0 "[ . 1 .]" 1 4632 2 23 ILE MG 2 52 ASP HA 4.000 . 4.500 3.361 2.967 3.710 . 0 0 "[ . 1 .]" 1 4633 2 23 ILE HB 2 52 ASP HA 3.000 . 3.500 2.484 2.118 2.662 . 0 0 "[ . 1 .]" 1 4634 2 23 ILE QG 2 52 ASP HA 4.000 . 4.500 3.556 3.370 3.745 . 0 0 "[ . 1 .]" 1 4635 2 23 ILE MD 2 52 ASP HA 5.000 . 5.500 4.999 4.798 5.151 . 0 0 "[ . 1 .]" 1 4636 2 52 ASP HA 2 59 TYR QE 6.000 . 6.500 6.390 6.025 6.602 0.102 15 0 "[ . 1 .]" 1 4637 2 54 ARG HA 2 54 ARG QG 2.500 . 3.000 2.708 2.007 2.845 . 0 0 "[ . 1 .]" 1 4638 2 54 ARG HA 2 54 ARG QD 3.000 . 3.500 2.262 1.998 2.987 . 0 0 "[ . 1 .]" 1 4639 2 54 ARG HA 2 58 ASP QB 4.000 . 4.500 3.988 3.671 4.277 . 0 0 "[ . 1 .]" 1 4640 2 54 ARG HA 2 55 THR MG 3.500 . 4.000 3.374 3.187 3.480 . 0 0 "[ . 1 .]" 1 4641 2 54 ARG QB 2 54 ARG QD 2.500 . 3.000 2.200 2.082 2.246 . 0 0 "[ . 1 .]" 1 4642 2 23 ILE MD 2 55 THR HA 5.000 . 5.500 3.746 3.265 4.349 . 0 0 "[ . 1 .]" 1 4643 2 55 THR HA 2 55 THR MG 3.000 . 3.500 2.338 2.263 2.420 . 0 0 "[ . 1 .]" 1 4644 2 22 THR MG 2 55 THR HA 3.500 . 4.000 3.441 2.803 3.738 . 0 0 "[ . 1 .]" 1 4645 2 22 THR HB 2 55 THR HA 4.000 . 4.500 4.203 3.908 4.311 . 0 0 "[ . 1 .]" 1 4646 2 22 THR HA 2 55 THR MG 3.000 . 3.500 2.938 2.425 3.555 0.055 10 0 "[ . 1 .]" 1 4647 2 54 ARG QD 2 55 THR MG 5.500 . 6.000 4.529 4.109 5.548 . 0 0 "[ . 1 .]" 1 4648 2 55 THR MG 2 57 SER QB 5.000 . 5.500 5.094 4.966 5.167 . 0 0 "[ . 1 .]" 1 4649 2 22 THR MG 2 55 THR MG 2.500 . 3.000 2.450 2.296 2.739 . 0 0 "[ . 1 .]" 1 4650 2 22 THR HB 2 55 THR MG 4.000 . 4.500 4.077 3.745 4.364 . 0 0 "[ . 1 .]" 1 4651 2 55 THR HA 2 55 THR HB 3.000 . 3.500 2.419 2.389 2.454 . 0 0 "[ . 1 .]" 1 4652 2 22 THR HB 2 55 THR HB 5.500 . 6.000 6.111 6.018 6.193 0.193 1 0 "[ . 1 .]" 1 4653 2 56 LEU H 2 56 LEU QD 3.000 . 3.500 3.026 2.185 3.205 . 0 0 "[ . 1 .]" 1 4654 2 56 LEU H 2 56 LEU HG 4.000 . 4.500 2.542 2.264 4.073 . 0 0 "[ . 1 .]" 1 4655 2 56 LEU HA 2 56 LEU QD 3.000 . 3.500 2.069 2.011 2.390 . 0 0 "[ . 1 .]" 1 4656 2 56 LEU HA 2 56 LEU HG 3.000 . 3.500 2.702 2.167 2.825 . 0 0 "[ . 1 .]" 1 4657 2 56 LEU HA 2 61 ILE HB 4.000 . 4.500 3.054 2.933 3.172 . 0 0 "[ . 1 .]" 1 4658 2 56 LEU HA 2 61 ILE MD 4.000 . 4.500 2.072 2.034 2.144 . 0 0 "[ . 1 .]" 1 4659 2 56 LEU HA 2 61 ILE MG 4.000 . 4.500 4.065 3.975 4.246 . 0 0 "[ . 1 .]" 1 4660 2 17 VAL QG 2 56 LEU QB 3.500 . 4.000 3.711 3.631 3.823 . 0 0 "[ . 1 .]" 1 4661 2 56 LEU QB 2 56 LEU QD 2.500 . 3.000 1.901 1.855 1.937 . 0 0 "[ . 1 .]" 1 4662 2 56 LEU QB 2 61 ILE HB 5.000 . 5.500 2.094 2.042 2.313 . 0 0 "[ . 1 .]" 1 4663 2 56 LEU QB 2 61 ILE MD 5.000 . 5.500 3.003 2.818 3.296 . 0 0 "[ . 1 .]" 1 4664 2 56 LEU QB 2 61 ILE MG 4.000 . 4.500 2.912 2.658 3.343 . 0 0 "[ . 1 .]" 1 4665 2 19 PRO HA 2 56 LEU QD 3.000 . 3.500 3.313 2.847 3.499 . 0 0 "[ . 1 .]" 1 4666 2 56 LEU QD 2 61 ILE HA 4.000 . 4.500 4.648 4.582 4.733 0.233 5 0 "[ . 1 .]" 1 4667 2 56 LEU QD 2 61 ILE HB 3.000 . 3.500 2.508 2.368 2.732 . 0 0 "[ . 1 .]" 1 4668 2 56 LEU QD 2 61 ILE MD 2.500 . 3.000 1.939 1.787 2.694 0.013 7 0 "[ . 1 .]" 1 4669 2 56 LEU QD 2 61 ILE MG 2.500 . 3.000 2.032 1.984 2.177 . 0 0 "[ . 1 .]" 1 4670 2 56 LEU QD 2 61 ILE QG 5.000 . 5.500 3.473 3.337 3.963 . 0 0 "[ . 1 .]" 1 4671 2 23 ILE MD 2 56 LEU HG 3.000 . 3.500 3.246 3.092 3.553 0.053 14 0 "[ . 1 .]" 1 4672 2 57 SER HA 2 57 SER QB 2.500 . 3.000 2.187 2.183 2.191 . 0 0 "[ . 1 .]" 1 4673 2 57 SER QB 2 60 ASN HA 4.000 . 4.500 4.536 4.475 4.588 0.088 14 0 "[ . 1 .]" 1 4674 2 58 ASP HA 2 58 ASP QB 2.500 . 3.000 2.401 2.395 2.408 . 0 0 "[ . 1 .]" 1 4675 2 59 TYR HA 2 60 ASN QB 4.000 . 4.500 4.046 3.893 4.148 . 0 0 "[ . 1 .]" 1 4676 2 59 TYR HA 2 61 ILE HA 6.000 . 6.500 6.464 6.409 6.528 0.028 12 0 "[ . 1 .]" 1 4677 2 50 LEU QD 2 59 TYR HA 4.000 . 4.500 4.449 4.298 4.572 0.072 3 0 "[ . 1 .]" 1 4678 2 59 TYR HA 2 61 ILE MD 4.000 . 4.500 4.548 4.495 4.613 0.113 11 0 "[ . 1 .]" 1 4679 2 50 LEU QD 2 59 TYR QB 5.000 . 5.500 2.622 2.417 2.736 . 0 0 "[ . 1 .]" 1 4680 2 59 TYR QB 2 61 ILE MD 4.000 . 4.500 1.982 1.950 2.024 . 0 0 "[ . 1 .]" 1 4681 2 59 TYR QB 2 61 ILE MG 5.000 . 5.500 4.285 4.245 4.372 . 0 0 "[ . 1 .]" 1 4682 2 48 ARG QB 2 59 TYR QD 6.000 . 6.500 3.548 3.092 5.091 . 0 0 "[ . 1 .]" 1 4683 2 48 ARG QG 2 59 TYR QD 5.000 . 5.500 3.679 2.481 4.199 . 0 0 "[ . 1 .]" 1 4684 2 48 ARG QD 2 59 TYR QD 4.000 . 4.500 3.282 2.700 4.583 0.083 2 0 "[ . 1 .]" 1 4685 2 54 ARG QB 2 59 TYR QD 6.000 . 6.500 3.189 3.113 3.257 . 0 0 "[ . 1 .]" 1 4686 2 54 ARG HA 2 59 TYR QD 5.000 . 5.500 5.592 5.484 5.707 0.207 8 0 "[ . 1 .]" 1 4687 2 54 ARG QG 2 59 TYR QD 4.000 . 4.500 4.558 3.342 4.721 0.221 14 0 "[ . 1 .]" 1 4688 2 54 ARG QD 2 59 TYR QD 4.000 . 4.500 4.600 4.264 4.841 0.341 15 0 "[ . 1 .]" 1 4689 2 56 LEU HA 2 59 TYR QD 4.000 . 4.500 3.632 3.461 3.731 . 0 0 "[ . 1 .]" 1 4690 2 58 ASP HA 2 59 TYR QD 4.000 . 4.500 4.588 4.516 4.655 0.155 15 0 "[ . 1 .]" 1 4691 2 58 ASP QB 2 59 TYR QD 4.000 . 4.500 2.222 2.058 2.376 . 0 0 "[ . 1 .]" 1 4692 2 59 TYR HA 2 59 TYR QD 3.000 . 3.500 3.014 2.977 3.041 . 0 0 "[ . 1 .]" 1 4693 2 50 LEU QD 2 59 TYR QD 4.000 . 4.500 2.465 2.286 2.549 . 0 0 "[ . 1 .]" 1 4694 2 23 ILE MG 2 59 TYR QD 5.000 . 5.500 5.627 5.435 5.695 0.195 9 0 "[ . 1 .]" 1 4695 2 23 ILE QG 2 59 TYR QD 5.000 . 5.500 4.208 3.996 4.411 . 0 0 "[ . 1 .]" 1 4696 2 23 ILE MD 2 59 TYR QD 4.000 . 4.500 3.224 3.032 3.380 . 0 0 "[ . 1 .]" 1 4697 2 56 LEU QD 2 59 TYR QD 4.000 . 4.500 4.481 4.407 4.653 0.153 14 0 "[ . 1 .]" 1 4698 2 59 TYR QD 2 61 ILE MD 4.000 . 4.500 3.346 3.246 3.413 . 0 0 "[ . 1 .]" 1 4699 2 48 ARG QB 2 59 TYR QE 5.000 . 5.500 3.695 3.252 4.136 . 0 0 "[ . 1 .]" 1 4700 2 48 ARG QG 2 59 TYR QE 4.000 . 4.500 2.461 1.860 2.736 . 0 0 "[ . 1 .]" 1 4701 2 48 ARG QD 2 59 TYR QE 3.000 . 3.500 2.672 2.184 3.570 0.070 2 0 "[ . 1 .]" 1 4702 2 50 LEU HA 2 59 TYR QE 5.000 . 5.500 2.941 2.638 3.360 . 0 0 "[ . 1 .]" 1 4703 2 50 LEU QB 2 59 TYR QE 5.000 . 5.500 4.039 3.725 4.385 . 0 0 "[ . 1 .]" 1 4704 2 54 ARG HA 2 59 TYR QE 4.000 . 4.500 4.355 4.298 4.396 . 0 0 "[ . 1 .]" 1 4705 2 54 ARG QB 2 59 TYR QE 4.000 . 4.500 1.831 1.809 1.857 . 0 0 "[ . 1 .]" 1 4706 2 54 ARG QG 2 59 TYR QE 3.000 . 3.500 2.495 1.901 2.650 . 0 0 "[ . 1 .]" 1 4707 2 54 ARG QD 2 59 TYR QE 3.000 . 3.500 3.208 2.946 3.331 . 0 0 "[ . 1 .]" 1 4708 2 56 LEU HA 2 59 TYR QE 5.000 . 5.500 5.470 5.303 5.553 0.053 10 0 "[ . 1 .]" 1 4709 2 58 ASP HA 2 59 TYR QE 5.000 . 5.500 5.714 5.661 5.770 0.270 7 0 "[ . 1 .]" 1 4710 2 58 ASP QB 2 59 TYR QE 4.000 . 4.500 2.959 2.886 3.012 . 0 0 "[ . 1 .]" 1 4711 2 59 TYR HA 2 59 TYR QE 4.000 . 4.500 4.517 4.490 4.541 0.041 6 0 "[ . 1 .]" 1 4712 2 50 LEU QD 2 59 TYR QE 4.000 . 4.500 2.709 2.310 3.055 . 0 0 "[ . 1 .]" 1 4713 2 23 ILE MG 2 59 TYR QE 5.000 . 5.500 5.100 4.761 5.437 . 0 0 "[ . 1 .]" 1 4714 2 23 ILE QG 2 59 TYR QE 4.000 . 4.500 3.411 3.058 3.672 . 0 0 "[ . 1 .]" 1 4715 2 23 ILE MD 2 59 TYR QE 4.000 . 4.500 3.505 3.253 3.899 . 0 0 "[ . 1 .]" 1 4716 2 56 LEU QD 2 59 TYR QE 5.000 . 5.500 5.595 5.563 5.644 0.144 10 0 "[ . 1 .]" 1 4717 2 59 TYR QE 2 61 ILE MD 4.000 . 4.500 4.750 4.707 4.814 0.314 7 0 "[ . 1 .]" 1 4718 2 60 ASN HA 2 60 ASN QB 2.500 . 3.000 2.392 2.351 2.443 . 0 0 "[ . 1 .]" 1 4719 2 60 ASN QB 2 61 ILE MD 5.000 . 5.500 5.500 5.449 5.553 0.053 10 0 "[ . 1 .]" 1 4720 2 61 ILE HA 2 62 GLN HA 5.000 . 5.500 4.428 4.401 4.476 . 0 0 "[ . 1 .]" 1 4721 2 61 ILE HA 2 62 GLN QG 5.000 . 5.500 3.975 3.800 4.103 . 0 0 "[ . 1 .]" 1 4722 2 61 ILE HA 2 61 ILE MD 4.000 . 4.500 3.836 3.816 3.850 . 0 0 "[ . 1 .]" 1 4723 2 61 ILE HA 2 61 ILE MG 3.000 . 3.500 2.380 2.338 2.419 . 0 0 "[ . 1 .]" 1 4724 2 3 ILE MD 2 61 ILE HB 4.000 . 4.500 4.690 4.621 4.765 0.265 12 0 "[ . 1 .]" 1 4725 2 3 ILE MG 2 61 ILE HB 4.000 . 4.500 4.127 3.970 4.243 . 0 0 "[ . 1 .]" 1 4726 2 56 LEU HG 2 61 ILE MD 4.000 . 4.500 3.617 1.938 3.929 . 0 0 "[ . 1 .]" 1 4727 2 61 ILE MD 2 61 ILE MG 2.500 . 3.000 2.085 1.912 2.200 . 0 0 "[ . 1 .]" 1 4728 2 61 ILE MG 2 63 LYS HA 4.000 . 4.500 4.691 4.615 4.782 0.282 12 0 "[ . 1 .]" 1 4729 2 56 LEU HG 2 61 ILE MG 4.000 . 4.500 4.374 2.674 4.694 0.194 10 0 "[ . 1 .]" 1 4730 2 61 ILE QG 2 61 ILE MG 3.000 . 3.500 2.208 2.125 2.250 . 0 0 "[ . 1 .]" 1 4731 2 59 TYR HA 2 61 ILE QG 6.000 . 6.500 4.131 4.070 4.274 . 0 0 "[ . 1 .]" 1 4732 2 59 TYR QB 2 61 ILE QG 6.000 . 6.500 2.076 2.003 2.226 . 0 0 "[ . 1 .]" 1 4733 2 62 GLN HA 2 62 GLN QB 2.500 . 3.000 2.337 2.181 2.408 . 0 0 "[ . 1 .]" 1 4734 2 62 GLN HA 2 62 GLN QG 2.500 . 3.000 2.666 2.327 3.285 0.285 15 0 "[ . 1 .]" 1 4735 2 62 GLN HA 2 63 LYS QB 4.000 . 4.500 4.408 4.380 4.465 . 0 0 "[ . 1 .]" 1 4736 2 62 GLN HA 2 63 LYS QG 5.500 . 6.000 5.715 5.140 5.806 . 0 0 "[ . 1 .]" 1 4737 2 3 ILE MG 2 62 GLN HA 5.000 . 5.500 4.615 4.436 4.905 . 0 0 "[ . 1 .]" 1 4738 2 61 ILE MG 2 62 GLN HA 5.000 . 5.500 3.999 3.839 4.160 . 0 0 "[ . 1 .]" 1 4739 2 61 ILE MG 2 62 GLN QG 5.000 . 5.500 4.630 4.021 5.035 . 0 0 "[ . 1 .]" 1 4740 2 1 MET QB 2 63 LYS HA 4.000 . 4.500 4.080 3.974 4.149 . 0 0 "[ . 1 .]" 1 4741 2 63 LYS HA 2 63 LYS QB 2.500 . 3.000 2.434 2.176 2.470 . 0 0 "[ . 1 .]" 1 4742 2 63 LYS HA 2 63 LYS QG 3.000 . 3.500 2.337 2.238 3.207 . 0 0 "[ . 1 .]" 1 4743 2 63 LYS HA 2 63 LYS QD 4.000 . 4.500 4.007 3.916 4.521 0.021 6 0 "[ . 1 .]" 1 4744 2 63 LYS HA 2 63 LYS QE 4.000 . 4.500 4.389 4.073 4.678 0.178 2 0 "[ . 1 .]" 1 4745 2 63 LYS HA 2 64 GLU QG 4.000 . 4.500 4.057 3.913 4.321 . 0 0 "[ . 1 .]" 1 4746 2 17 VAL QG 2 63 LYS HA 4.000 . 4.500 4.475 4.376 4.572 0.072 1 0 "[ . 1 .]" 1 4747 2 3 ILE MG 2 63 LYS HA 3.000 . 3.500 2.858 2.666 3.462 . 0 0 "[ . 1 .]" 1 4748 2 63 LYS QB 2 63 LYS QD 2.500 . 3.000 2.208 2.111 2.461 . 0 0 "[ . 1 .]" 1 4749 2 63 LYS QB 2 64 GLU QG 2.500 . 3.000 2.987 2.817 3.318 0.318 6 0 "[ . 1 .]" 1 4750 2 63 LYS QE 2 63 LYS QG 2.500 . 3.000 2.298 2.134 2.792 . 0 0 "[ . 1 .]" 1 4751 2 63 LYS QG 2 64 GLU HA 4.000 . 4.500 3.642 3.562 3.772 . 0 0 "[ . 1 .]" 1 4752 2 63 LYS QG 2 64 GLU QB 4.000 . 4.500 3.566 2.445 3.725 . 0 0 "[ . 1 .]" 1 4753 2 63 LYS QG 2 64 GLU QG 3.000 2.110 3.500 2.014 1.948 2.108 0.162 1 0 "[ . 1 .]" 1 4754 2 63 LYS QD 2 64 GLU HA 5.000 . 5.500 5.390 4.684 5.774 0.274 6 0 "[ . 1 .]" 1 4755 2 63 LYS QD 2 64 GLU QG 2.500 . 3.000 2.854 2.004 3.346 0.346 1 0 "[ . 1 .]" 1 4756 2 1 MET HA 2 63 LYS QE 6.000 . 6.500 3.477 2.853 4.518 . 0 0 "[ . 1 .]" 1 4757 2 63 LYS QB 2 63 LYS QE 3.000 . 3.500 2.823 1.855 3.639 0.139 2 0 "[ . 1 .]" 1 4758 2 63 LYS QE 2 64 GLU HA 6.000 . 6.500 5.343 4.901 6.480 . 0 0 "[ . 1 .]" 1 4759 2 63 LYS QE 2 64 GLU QG 3.000 . 3.500 2.978 2.029 3.826 0.326 12 0 "[ . 1 .]" 1 4760 2 64 GLU HA 2 64 GLU QG 3.000 . 3.500 2.344 2.313 2.367 . 0 0 "[ . 1 .]" 1 4761 2 3 ILE MG 2 64 GLU HA 5.000 . 5.500 4.206 4.075 4.308 . 0 0 "[ . 1 .]" 1 4762 2 65 SER HA 2 65 SER QB 2.500 . 3.000 2.363 2.189 2.460 . 0 0 "[ . 1 .]" 1 4763 2 3 ILE MG 2 65 SER HA 4.000 . 4.500 4.452 4.178 4.566 0.066 14 0 "[ . 1 .]" 1 4764 2 65 SER HA 2 66 THR MG 5.000 . 5.500 5.459 5.424 5.485 . 0 0 "[ . 1 .]" 1 4765 2 61 ILE MG 2 65 SER HA 4.000 . 4.500 4.378 4.099 4.569 0.069 7 0 "[ . 1 .]" 1 4766 2 65 SER HA 2 66 THR HB 5.000 . 5.500 4.677 4.607 4.738 . 0 0 "[ . 1 .]" 1 4767 2 65 SER HA 2 67 LEU QD 4.000 . 4.500 4.125 4.017 4.552 0.052 11 0 "[ . 1 .]" 1 4768 2 3 ILE MG 2 65 SER QB 4.000 . 4.500 2.294 1.940 3.106 . 0 0 "[ . 1 .]" 1 4769 2 61 ILE MD 2 65 SER QB 5.000 . 5.500 4.363 4.137 4.670 . 0 0 "[ . 1 .]" 1 4770 2 61 ILE MG 2 65 SER QB 3.000 . 3.500 2.041 1.923 2.403 . 0 0 "[ . 1 .]" 1 4771 2 65 SER QB 2 67 LEU QD 4.000 . 4.500 2.624 2.213 3.316 . 0 0 "[ . 1 .]" 1 4772 2 3 ILE MD 2 65 SER QB 6.000 . 6.500 4.015 3.678 4.740 . 0 0 "[ . 1 .]" 1 4773 2 5 VAL QG 2 66 THR HA 4.000 . 4.500 4.671 4.637 4.730 0.230 12 0 "[ . 1 .]" 1 4774 2 66 THR HA 2 66 THR MG 3.000 . 3.500 2.296 2.241 2.348 . 0 0 "[ . 1 .]" 1 4775 2 66 THR HA 2 67 LEU QD 4.000 . 4.500 3.393 3.078 4.242 . 0 0 "[ . 1 .]" 1 4776 2 6 LYS HA 2 66 THR MG 4.000 . 4.500 4.555 4.376 4.683 0.183 8 0 "[ . 1 .]" 1 4777 2 6 LYS QG 2 66 THR MG 5.000 . 5.500 3.897 1.969 4.246 . 0 0 "[ . 1 .]" 1 4778 2 6 LYS QD 2 66 THR MG 2.500 . 3.000 2.859 2.066 3.118 0.118 10 0 "[ . 1 .]" 1 4779 2 4 PHE QB 2 66 THR HB 5.000 . 5.500 4.527 4.436 4.642 . 0 0 "[ . 1 .]" 1 4780 2 4 PHE QD 2 66 THR HB 6.000 . 6.500 5.719 5.176 6.483 . 0 0 "[ . 1 .]" 1 4781 2 4 PHE H 2 66 THR HB 6.000 . 6.500 6.053 5.611 6.212 . 0 0 "[ . 1 .]" 1 4782 2 67 LEU HA 2 67 LEU HG 4.000 . 4.500 2.334 2.074 3.554 . 0 0 "[ . 1 .]" 1 4783 2 5 VAL QG 2 67 LEU HA 4.000 . 4.500 4.615 4.509 4.738 0.238 3 0 "[ . 1 .]" 1 4784 2 67 LEU HA 2 67 LEU QD 3.000 . 3.500 2.478 1.843 2.904 . 0 0 "[ . 1 .]" 1 4785 2 45 PHE HA 2 67 LEU QB 5.000 . 5.500 4.657 3.890 5.235 . 0 0 "[ . 1 .]" 1 4786 2 67 LEU QB 2 67 LEU QD 2.500 . 3.000 1.877 1.812 1.978 . 0 0 "[ . 1 .]" 1 4787 2 45 PHE HA 2 67 LEU HG 5.000 . 5.500 3.451 2.103 5.497 . 0 0 "[ . 1 .]" 1 4788 2 61 ILE MD 2 67 LEU HG 4.000 . 4.500 3.944 3.560 4.570 0.070 11 0 "[ . 1 .]" 1 4789 2 61 ILE MG 2 67 LEU HG 4.000 . 4.500 4.226 3.721 4.544 0.044 10 0 "[ . 1 .]" 1 4790 2 45 PHE HA 2 67 LEU QD 4.000 . 4.500 3.540 2.024 4.319 . 0 0 "[ . 1 .]" 1 4791 2 61 ILE QG 2 67 LEU QD 5.000 . 5.500 3.108 2.783 3.291 . 0 0 "[ . 1 .]" 1 4792 2 69 LEU HA 2 70 VAL HA 5.000 . 5.500 4.413 4.388 4.445 . 0 0 "[ . 1 .]" 1 4793 2 5 VAL QG 2 69 LEU HA 4.000 . 4.500 3.870 3.681 4.235 . 0 0 "[ . 1 .]" 1 4794 2 69 LEU HA 2 69 LEU QD 2.500 . 3.000 2.164 1.992 2.837 . 0 0 "[ . 1 .]" 1 4795 2 30 ILE MG 2 69 LEU HA 5.000 . 5.500 5.652 5.535 5.817 0.317 1 0 "[ . 1 .]" 1 4796 2 30 ILE MD 2 69 LEU HA 5.000 . 5.500 4.658 4.276 5.534 0.034 7 0 "[ . 1 .]" 1 4797 2 43 LEU QD 2 69 LEU HA 4.000 . 4.500 2.930 2.394 3.220 . 0 0 "[ . 1 .]" 1 4798 2 69 LEU HA 2 71 LEU QD 4.000 . 4.500 4.594 4.451 4.698 0.198 7 0 "[ . 1 .]" 1 4799 2 43 LEU HG 2 69 LEU HA 5.000 . 5.500 5.073 4.671 5.748 0.248 14 0 "[ . 1 .]" 1 4800 2 69 LEU HA 2 69 LEU HG 4.000 . 4.500 2.872 2.089 3.219 . 0 0 "[ . 1 .]" 1 4801 2 5 VAL QG 2 69 LEU QB 2.500 . 3.000 2.083 1.915 2.523 . 0 0 "[ . 1 .]" 1 4802 2 69 LEU QB 2 69 LEU QD 2.500 . 3.000 1.902 1.796 1.937 0.004 7 0 "[ . 1 .]" 1 4803 2 30 ILE MD 2 69 LEU QB 3.500 . 4.000 3.419 3.052 3.888 . 0 0 "[ . 1 .]" 1 4804 2 43 LEU QD 2 69 LEU QB 3.000 . 3.500 3.166 2.632 3.600 0.100 5 0 "[ . 1 .]" 1 4805 2 69 LEU QB 2 69 LEU HG 2.500 . 3.000 2.386 2.347 2.478 . 0 0 "[ . 1 .]" 1 4806 2 7 THR HB 2 69 LEU QD 4.000 . 4.500 3.616 3.423 4.269 . 0 0 "[ . 1 .]" 1 4807 2 70 VAL HA 2 70 VAL HB 3.000 . 3.500 3.031 3.026 3.037 . 0 0 "[ . 1 .]" 1 4808 2 70 VAL HA 2 70 VAL QG 2.500 . 3.000 2.037 2.008 2.080 . 0 0 "[ . 1 .]" 1 4809 2 69 LEU QD 2 70 VAL HA 5.000 . 5.500 4.023 3.509 4.319 . 0 0 "[ . 1 .]" 1 4810 2 44 ILE MD 2 70 VAL QG 3.000 . 3.500 2.346 2.032 3.153 . 0 0 "[ . 1 .]" 1 4811 2 71 LEU HA 2 71 LEU QB 2.500 . 3.000 2.320 2.302 2.346 . 0 0 "[ . 1 .]" 1 4812 2 36 ILE MG 2 71 LEU HA 4.000 . 4.500 3.881 3.448 4.222 . 0 0 "[ . 1 .]" 1 4813 2 36 ILE MD 2 71 LEU HA 4.000 . 4.500 4.615 4.530 4.873 0.373 7 0 "[ . 1 .]" 1 4814 2 71 LEU HA 2 71 LEU QD 2.500 . 3.000 2.015 1.985 2.071 . 0 0 "[ . 1 .]" 1 4815 2 71 LEU HA 2 71 LEU HG 4.000 . 4.500 3.157 3.039 3.238 . 0 0 "[ . 1 .]" 1 4816 2 71 LEU QB 2 71 LEU QD 2.500 . 3.000 1.921 1.900 1.954 . 0 0 "[ . 1 .]" 1 4817 2 71 LEU QB 2 71 LEU HG 2.500 . 3.000 2.363 2.353 2.375 . 0 0 "[ . 1 .]" 1 4818 2 70 VAL HA 2 71 LEU HG 3.000 . 3.500 3.424 3.334 3.577 0.077 7 0 "[ . 1 .]" 1 4819 2 72 ARG HA 2 72 ARG QB 2.500 . 3.000 2.367 2.180 2.404 . 0 0 "[ . 1 .]" 1 4820 2 72 ARG HA 2 72 ARG QG 3.000 . 3.500 2.530 2.281 3.257 . 0 0 "[ . 1 .]" 1 4821 2 72 ARG HA 2 72 ARG QD 4.000 . 4.500 3.555 2.023 4.504 0.004 6 0 "[ . 1 .]" 1 4822 2 72 ARG QB 2 72 ARG QD 2.500 . 3.000 2.308 2.124 2.842 . 0 0 "[ . 1 .]" 1 4823 2 73 LEU HA 2 73 LEU QD 3.000 . 3.500 2.283 1.975 3.009 . 0 0 "[ . 1 .]" 1 4824 2 73 LEU HA 2 73 LEU HG 3.000 . 3.500 2.627 2.101 3.142 . 0 0 "[ . 1 .]" 1 4825 2 74 ARG HA 2 74 ARG QB 2.500 . 3.000 2.400 2.339 2.522 . 0 0 "[ . 1 .]" 1 4826 2 74 ARG HA 2 74 ARG QG 2.500 . 3.000 2.480 2.137 2.927 . 0 0 "[ . 1 .]" 1 4827 2 74 ARG QG 2 75 GLY QA 5.000 . 5.500 4.762 3.125 5.617 0.117 13 0 "[ . 1 .]" 1 4828 2 74 ARG HA 2 74 ARG QD 3.000 . 3.500 2.716 1.999 3.816 0.316 7 0 "[ . 1 .]" 1 4829 2 74 ARG QB 2 74 ARG QD 2.500 . 3.000 2.300 2.092 2.699 . 0 0 "[ . 1 .]" 1 4830 2 73 LEU QB 2 75 GLY QA 5.000 . 5.500 5.447 3.842 5.889 0.389 10 0 "[ . 1 .]" 1 4831 2 74 ARG HA 2 75 GLY QA 4.000 . 4.500 3.992 3.897 4.295 . 0 0 "[ . 1 .]" 1 4832 2 74 ARG QB 2 75 GLY QA 6.000 . 6.500 3.984 3.567 4.342 . 0 0 "[ . 1 .]" 1 stop_ save_ save_distance_constraint_statistics_2 _Distance_constraint_stats_list.Sf_category distance_constraint_statistics _Distance_constraint_stats_list.Constraint_list_ID 2 _Distance_constraint_stats_list.Constraint_count 141 _Distance_constraint_stats_list.Viol_count 916 _Distance_constraint_stats_list.Viol_total 921.307 _Distance_constraint_stats_list.Viol_max 0.244 _Distance_constraint_stats_list.Viol_rms 0.0459 _Distance_constraint_stats_list.Viol_average_all_restraints 0.0290 _Distance_constraint_stats_list.Viol_average_violations_only 0.0671 _Distance_constraint_stats_list.Cutoff_violation_report 0.500 _Distance_constraint_stats_list.Details . loop_ _Distance_constraint_stats_per_res.Atom_entity_assembly_ID _Distance_constraint_stats_per_res.Atom_comp_index_ID _Distance_constraint_stats_per_res.Atom_comp_ID _Distance_constraint_stats_per_res.Total_violation _Distance_constraint_stats_per_res.Max_violation _Distance_constraint_stats_per_res.Max_violation_model_number _Distance_constraint_stats_per_res.Over_cutoff_viol_count _Distance_constraint_stats_per_res.Over_cutoff_viol_per_model 1 2 GLN 1.391 0.131 7 0 "[ . 1 .]" 1 3 ILE 2.031 0.125 12 0 "[ . 1 .]" 1 4 PHE 2.834 0.183 12 0 "[ . 1 .]" 1 5 VAL 1.380 0.124 8 0 "[ . 1 .]" 1 6 LYS 1.330 0.122 5 0 "[ . 1 .]" 1 7 THR 0.802 0.092 7 0 "[ . 1 .]" 1 11 LYS 0.802 0.092 7 0 "[ . 1 .]" 1 13 ILE 1.380 0.124 8 0 "[ . 1 .]" 1 15 LEU 2.031 0.125 12 0 "[ . 1 .]" 1 19 PRO 0.565 0.112 6 0 "[ . 1 .]" 1 21 ASP 1.272 0.137 6 0 "[ . 1 .]" 1 22 THR 1.934 0.149 7 0 "[ . 1 .]" 1 23 ILE 1.249 0.223 9 0 "[ . 1 .]" 1 24 GLU 0.488 0.078 4 0 "[ . 1 .]" 1 25 ASN 1.093 0.102 3 0 "[ . 1 .]" 1 26 VAL 4.374 0.207 4 0 "[ . 1 .]" 1 27 LYS 1.307 0.090 10 0 "[ . 1 .]" 1 28 ALA 0.971 0.078 4 0 "[ . 1 .]" 1 29 LYS 2.389 0.244 14 0 "[ . 1 .]" 1 30 ILE 3.757 0.207 4 0 "[ . 1 .]" 1 31 GLN 0.789 0.090 10 0 "[ . 1 .]" 1 32 ASP 0.483 0.071 2 0 "[ . 1 .]" 1 33 LYS 1.297 0.244 14 0 "[ . 1 .]" 1 34 GLU 1.318 0.181 8 0 "[ . 1 .]" 1 42 ARG 2.732 0.243 11 0 "[ . 1 .]" 1 43 LEU 1.838 0.239 9 0 "[ . 1 .]" 1 44 ILE 1.010 0.099 7 0 "[ . 1 .]" 1 45 PHE 0.589 0.083 8 0 "[ . 1 .]" 1 48 LYS 0.589 0.083 8 0 "[ . 1 .]" 1 50 LEU 1.838 0.239 9 0 "[ . 1 .]" 1 54 ARG 0.730 0.223 9 0 "[ . 1 .]" 1 56 LEU 1.272 0.137 6 0 "[ . 1 .]" 1 57 SER 0.565 0.112 6 0 "[ . 1 .]" 1 64 GLU 1.391 0.131 7 0 "[ . 1 .]" 1 65 SER 1.120 0.152 3 0 "[ . 1 .]" 1 67 LEU 2.264 0.183 12 0 "[ . 1 .]" 1 68 HIS 1.010 0.099 7 0 "[ . 1 .]" 1 69 LEU 0.780 0.122 5 0 "[ . 1 .]" 1 70 VAL 2.732 0.243 11 0 "[ . 1 .]" 2 2 GLN 1.537 0.163 12 0 "[ . 1 .]" 2 3 ILE 1.600 0.141 11 0 "[ . 1 .]" 2 4 PHE 2.972 0.206 9 0 "[ . 1 .]" 2 5 VAL 1.609 0.141 2 0 "[ . 1 .]" 2 6 LYS 1.080 0.084 7 0 "[ . 1 .]" 2 7 THR 1.061 0.123 2 0 "[ . 1 .]" 2 11 LYS 1.061 0.123 2 0 "[ . 1 .]" 2 13 ILE 1.609 0.141 2 0 "[ . 1 .]" 2 15 LEU 1.600 0.141 11 0 "[ . 1 .]" 2 19 PRO 0.624 0.086 10 0 "[ . 1 .]" 2 21 ASP 0.978 0.142 15 0 "[ . 1 .]" 2 22 THR 1.597 0.134 15 0 "[ . 1 .]" 2 23 ILE 1.017 0.109 3 0 "[ . 1 .]" 2 24 GLU 0.467 0.070 6 0 "[ . 1 .]" 2 25 ASN 0.673 0.100 11 0 "[ . 1 .]" 2 26 VAL 3.918 0.192 9 0 "[ . 1 .]" 2 27 LYS 1.457 0.109 3 0 "[ . 1 .]" 2 28 ALA 1.465 0.131 11 0 "[ . 1 .]" 2 29 LYS 1.989 0.206 3 0 "[ . 1 .]" 2 30 ILE 3.885 0.200 12 0 "[ . 1 .]" 2 31 GLN 0.793 0.086 6 0 "[ . 1 .]" 2 32 ASP 0.998 0.131 11 0 "[ . 1 .]" 2 33 LYS 1.316 0.206 3 0 "[ . 1 .]" 2 34 GLU 1.564 0.200 12 0 "[ . 1 .]" 2 42 ARG 2.763 0.200 9 0 "[ . 1 .]" 2 43 LEU 0.489 0.075 9 0 "[ . 1 .]" 2 44 ILE 1.472 0.112 10 0 "[ . 1 .]" 2 45 PHE 0.810 0.164 3 0 "[ . 1 .]" 2 48 ARG 0.810 0.164 3 0 "[ . 1 .]" 2 50 LEU 0.489 0.075 9 0 "[ . 1 .]" 2 54 ARG 0.354 0.076 11 0 "[ . 1 .]" 2 56 LEU 0.978 0.142 15 0 "[ . 1 .]" 2 57 SER 0.624 0.086 10 0 "[ . 1 .]" 2 64 GLU 1.537 0.163 12 0 "[ . 1 .]" 2 65 SER 0.907 0.140 3 0 "[ . 1 .]" 2 67 LEU 2.568 0.206 9 0 "[ . 1 .]" 2 68 HIS 1.472 0.112 10 0 "[ . 1 .]" 2 69 LEU 0.577 0.084 7 0 "[ . 1 .]" 2 70 VAL 2.763 0.200 9 0 "[ . 1 .]" 2 76 GLY 0.306 0.141 10 0 "[ . 1 .]" 3 28 VAL 0.916 0.114 10 0 "[ . 1 .]" 3 30 PHE 0.000 0.000 . 0 "[ . 1 .]" 3 32 ALA 0.000 0.000 . 0 "[ . 1 .]" 3 33 GLY 0.000 0.000 . 0 "[ . 1 .]" 3 36 SER 0.097 0.029 10 0 "[ . 1 .]" 3 38 LYS 0.000 0.000 . 0 "[ . 1 .]" 3 41 THR 0.000 0.000 . 0 "[ . 1 .]" 3 42 VAL 0.078 0.039 2 0 "[ . 1 .]" 3 43 THR 0.097 0.029 10 0 "[ . 1 .]" 3 49 GLY 0.000 0.000 . 0 "[ . 1 .]" 3 50 LEU 0.000 0.000 . 0 "[ . 1 .]" 3 51 VAL 0.000 0.000 . 0 "[ . 1 .]" 3 52 TYR 0.000 0.000 . 0 "[ . 1 .]" 3 53 ILE 0.916 0.114 10 0 "[ . 1 .]" 3 54 GLN 0.973 0.087 2 0 "[ . 1 .]" 3 62 HIS 0.973 0.087 2 0 "[ . 1 .]" 3 63 PHE 0.424 0.071 3 0 "[ . 1 .]" 3 64 CYS 0.000 0.000 . 0 "[ . 1 .]" 3 65 TRP 0.000 0.000 . 0 "[ . 1 .]" 3 66 LYS 0.000 0.000 . 0 "[ . 1 .]" 3 75 ASP 0.000 0.000 . 0 "[ . 1 .]" 3 77 LEU 0.424 0.071 3 0 "[ . 1 .]" 3 85 GLU 0.553 0.074 3 0 "[ . 1 .]" 3 87 LYS 1.034 0.099 11 0 "[ . 1 .]" 3 98 TYR 0.017 0.017 10 0 "[ . 1 .]" 3 99 VAL 1.034 0.099 11 0 "[ . 1 .]" 3 100 LEU 0.083 0.046 6 0 "[ . 1 .]" 3 101 LYS 0.553 0.074 3 0 "[ . 1 .]" 3 107 LYS 0.306 0.141 10 0 "[ . 1 .]" 3 109 LEU 0.083 0.046 6 0 "[ . 1 .]" 3 111 PHE 0.017 0.017 10 0 "[ . 1 .]" 3 112 TRP 0.000 0.000 . 0 "[ . 1 .]" 3 120 GLN 0.000 0.000 . 0 "[ . 1 .]" 3 121 ASP 0.000 0.000 . 0 "[ . 1 .]" 3 122 GLU 0.000 0.000 . 0 "[ . 1 .]" 3 123 GLU 0.048 0.031 11 0 "[ . 1 .]" 3 124 HIS 0.000 0.000 . 0 "[ . 1 .]" 3 125 CYS 0.280 0.059 6 0 "[ . 1 .]" 3 126 ARG 0.000 0.000 . 0 "[ . 1 .]" 3 127 LYS 0.057 0.031 11 0 "[ . 1 .]" 3 128 VAL 0.000 0.000 . 0 "[ . 1 .]" 3 129 ASN 0.280 0.059 6 0 "[ . 1 .]" 3 130 GLU 0.000 0.000 . 0 "[ . 1 .]" 3 131 TYR 0.008 0.008 11 0 "[ . 1 .]" 3 132 LEU 0.000 0.000 . 0 "[ . 1 .]" 3 133 ASN 0.000 0.000 . 0 "[ . 1 .]" 3 134 ASN 0.000 0.000 . 0 "[ . 1 .]" 4 13 PHE 0.078 0.039 2 0 "[ . 1 .]" stop_ loop_ _Distance_constraint_stats.Restraint_ID _Distance_constraint_stats.Atom_1_entity_assembly_ID _Distance_constraint_stats.Atom_1_comp_index_ID _Distance_constraint_stats.Atom_1_comp_ID _Distance_constraint_stats.Atom_1_ID _Distance_constraint_stats.Atom_2_entity_assembly_ID _Distance_constraint_stats.Atom_2_comp_index_ID _Distance_constraint_stats.Atom_2_comp_ID _Distance_constraint_stats.Atom_2_ID _Distance_constraint_stats.Node_1_distance_val _Distance_constraint_stats.Node_1_distance_lower_bound_val _Distance_constraint_stats.Node_1_distance_upper_bound_val _Distance_constraint_stats.Distance_average _Distance_constraint_stats.Distance_minimum _Distance_constraint_stats.Distance_maximum _Distance_constraint_stats.Max_violation _Distance_constraint_stats.Max_violation_model_number _Distance_constraint_stats.Over_cutoff_violation_count _Distance_constraint_stats.Over_cutoff_viol_per_model _Distance_constraint_stats.Distance_constraint_stats_ID 1 3 42 VAL O 4 13 PHE H 2.150 . 2.500 2.136 1.927 2.269 . 0 0 "[ . 1 .]" 2 2 3 42 VAL O 4 13 PHE N 2.900 2.500 3.300 3.075 2.879 3.229 . 0 0 "[ . 1 .]" 2 3 3 42 VAL H 4 13 PHE O 2.150 . 2.500 1.820 1.761 1.854 0.039 2 0 "[ . 1 .]" 2 4 3 42 VAL N 4 13 PHE O 2.900 2.500 3.300 2.776 2.712 2.826 . 0 0 "[ . 1 .]" 2 5 3 28 VAL O 3 53 ILE H 2.150 . 2.500 1.857 1.824 1.877 . 0 0 "[ . 1 .]" 2 6 3 28 VAL O 3 53 ILE N 2.900 2.500 3.300 2.780 2.751 2.803 . 0 0 "[ . 1 .]" 2 7 3 28 VAL H 3 53 ILE O 2.150 . 2.500 2.396 2.327 2.446 . 0 0 "[ . 1 .]" 2 8 3 28 VAL N 3 53 ILE O 2.900 2.500 3.300 3.360 3.289 3.414 0.114 10 0 "[ . 1 .]" 2 9 3 30 PHE O 3 51 VAL H 2.150 . 2.500 1.892 1.831 1.985 . 0 0 "[ . 1 .]" 2 10 3 30 PHE O 3 51 VAL N 2.900 2.500 3.300 2.781 2.713 2.892 . 0 0 "[ . 1 .]" 2 11 3 30 PHE H 3 51 VAL O 2.150 . 2.500 2.104 2.009 2.184 . 0 0 "[ . 1 .]" 2 12 3 30 PHE N 3 51 VAL O 2.900 2.500 3.300 2.999 2.917 3.069 . 0 0 "[ . 1 .]" 2 13 3 32 ALA O 3 49 GLY H 2.150 . 2.500 2.280 2.212 2.457 . 0 0 "[ . 1 .]" 2 14 3 32 ALA O 3 49 GLY N 2.900 2.500 3.300 3.010 2.940 3.118 . 0 0 "[ . 1 .]" 2 15 3 32 ALA H 3 49 GLY O 2.150 . 2.500 2.111 1.953 2.272 . 0 0 "[ . 1 .]" 2 16 3 32 ALA N 3 49 GLY O 2.900 2.500 3.300 2.982 2.826 3.144 . 0 0 "[ . 1 .]" 2 17 3 36 SER O 3 43 THR H 2.150 . 2.500 1.877 1.791 1.935 0.009 4 0 "[ . 1 .]" 2 18 3 36 SER O 3 43 THR N 2.900 2.500 3.300 2.841 2.738 2.906 . 0 0 "[ . 1 .]" 2 19 3 36 SER H 3 43 THR O 2.150 . 2.500 1.818 1.771 1.913 0.029 10 0 "[ . 1 .]" 2 20 3 36 SER N 3 43 THR O 2.900 2.500 3.300 2.764 2.714 2.877 . 0 0 "[ . 1 .]" 2 21 3 38 LYS O 3 41 THR H 2.150 . 2.500 2.171 2.090 2.249 . 0 0 "[ . 1 .]" 2 22 3 38 LYS O 3 41 THR N 2.900 2.500 3.300 3.099 3.030 3.173 . 0 0 "[ . 1 .]" 2 23 3 38 LYS H 3 41 THR O 2.150 . 2.500 1.913 1.847 1.985 . 0 0 "[ . 1 .]" 2 24 3 38 LYS N 3 41 THR O 2.900 2.500 3.300 2.865 2.794 2.931 . 0 0 "[ . 1 .]" 2 25 3 50 LEU O 3 66 LYS H 2.150 . 2.500 2.121 2.054 2.189 . 0 0 "[ . 1 .]" 2 26 3 50 LEU O 3 66 LYS N 2.900 2.500 3.300 3.070 3.003 3.145 . 0 0 "[ . 1 .]" 2 27 3 50 LEU H 3 66 LYS O 2.150 . 2.500 1.884 1.849 1.906 . 0 0 "[ . 1 .]" 2 28 3 50 LEU N 3 66 LYS O 2.900 2.500 3.300 2.667 2.615 2.721 . 0 0 "[ . 1 .]" 2 29 3 52 TYR O 3 64 CYS H 2.150 . 2.500 2.164 2.104 2.221 . 0 0 "[ . 1 .]" 2 30 3 52 TYR O 3 64 CYS N 2.900 2.500 3.300 3.104 3.036 3.164 . 0 0 "[ . 1 .]" 2 31 3 52 TYR H 3 64 CYS O 2.150 . 2.500 2.149 2.081 2.203 . 0 0 "[ . 1 .]" 2 32 3 52 TYR N 3 64 CYS O 2.900 2.500 3.300 3.112 3.052 3.162 . 0 0 "[ . 1 .]" 2 33 3 54 GLN O 3 62 HIS H 2.150 . 2.500 1.735 1.713 1.771 0.087 2 0 "[ . 1 .]" 2 34 3 54 GLN O 3 62 HIS N 2.900 2.500 3.300 2.671 2.639 2.700 . 0 0 "[ . 1 .]" 2 35 3 54 GLN H 3 62 HIS O 2.150 . 2.500 2.069 1.992 2.207 . 0 0 "[ . 1 .]" 2 36 3 54 GLN N 3 62 HIS O 2.900 2.500 3.300 3.012 2.932 3.154 . 0 0 "[ . 1 .]" 2 37 3 63 PHE O 3 77 LEU H 2.150 . 2.500 1.875 1.834 1.974 . 0 0 "[ . 1 .]" 2 38 3 63 PHE O 3 77 LEU N 2.900 2.500 3.300 2.840 2.805 2.888 . 0 0 "[ . 1 .]" 2 39 3 63 PHE H 3 77 LEU O 2.150 . 2.500 1.772 1.729 1.808 0.071 3 0 "[ . 1 .]" 2 40 3 63 PHE N 3 77 LEU O 2.900 2.500 3.300 2.707 2.661 2.737 . 0 0 "[ . 1 .]" 2 41 3 65 TRP O 3 75 ASP H 2.150 . 2.500 1.950 1.866 2.057 . 0 0 "[ . 1 .]" 2 42 3 65 TRP O 3 75 ASP N 2.900 2.500 3.300 2.871 2.768 2.962 . 0 0 "[ . 1 .]" 2 43 3 65 TRP H 3 75 ASP O 2.150 . 2.500 2.034 1.893 2.131 . 0 0 "[ . 1 .]" 2 44 3 65 TRP N 3 75 ASP O 2.900 2.500 3.300 2.918 2.812 3.041 . 0 0 "[ . 1 .]" 2 45 3 85 GLU O 3 101 LYS H 2.150 . 2.500 1.918 1.845 2.005 . 0 0 "[ . 1 .]" 2 46 3 85 GLU O 3 101 LYS N 2.900 2.500 3.300 2.888 2.808 2.967 . 0 0 "[ . 1 .]" 2 47 3 85 GLU H 3 101 LYS O 2.150 . 2.500 1.763 1.726 1.791 0.074 3 0 "[ . 1 .]" 2 48 3 85 GLU N 3 101 LYS O 2.900 2.500 3.300 2.655 2.622 2.688 . 0 0 "[ . 1 .]" 2 49 3 87 LYS O 3 99 VAL H 2.150 . 2.500 1.731 1.701 1.753 0.099 11 0 "[ . 1 .]" 2 50 3 87 LYS O 3 99 VAL N 2.900 2.500 3.300 2.686 2.655 2.721 . 0 0 "[ . 1 .]" 2 51 3 87 LYS H 3 99 VAL O 2.150 . 2.500 2.121 2.057 2.229 . 0 0 "[ . 1 .]" 2 52 3 87 LYS N 3 99 VAL O 2.900 2.500 3.300 3.091 3.025 3.190 . 0 0 "[ . 1 .]" 2 53 3 98 TYR O 3 111 PHE H 2.150 . 2.500 1.831 1.803 1.874 . 0 0 "[ . 1 .]" 2 54 3 98 TYR O 3 111 PHE N 2.900 2.500 3.300 2.796 2.763 2.837 . 0 0 "[ . 1 .]" 2 55 3 98 TYR H 3 111 PHE O 2.150 . 2.500 1.864 1.783 1.917 0.017 10 0 "[ . 1 .]" 2 56 3 98 TYR N 3 111 PHE O 2.900 2.500 3.300 2.813 2.740 2.870 . 0 0 "[ . 1 .]" 2 57 3 100 LEU O 3 109 LEU H 2.150 . 2.500 1.833 1.754 1.908 0.046 6 0 "[ . 1 .]" 2 58 3 100 LEU O 3 109 LEU N 2.900 2.500 3.300 2.776 2.691 2.856 . 0 0 "[ . 1 .]" 2 59 3 100 LEU H 3 109 LEU O 2.150 . 2.500 1.847 1.798 1.918 0.002 14 0 "[ . 1 .]" 2 60 3 100 LEU N 3 109 LEU O 2.900 2.500 3.300 2.761 2.726 2.834 . 0 0 "[ . 1 .]" 2 61 3 33 GLY H 3 112 TRP O 2.150 . 2.500 1.918 1.808 2.081 . 0 0 "[ . 1 .]" 2 62 3 33 GLY N 3 112 TRP O 2.900 2.500 3.300 2.853 2.732 3.037 . 0 0 "[ . 1 .]" 2 63 3 33 GLY O 3 112 TRP H 2.150 . 2.500 1.899 1.822 2.025 . 0 0 "[ . 1 .]" 2 64 3 33 GLY O 3 112 TRP N 2.900 2.500 3.300 2.828 2.759 2.931 . 0 0 "[ . 1 .]" 2 65 3 120 GLN O 3 124 HIS H 2.150 . 2.500 2.015 1.906 2.160 . 0 0 "[ . 1 .]" 2 66 3 120 GLN O 3 124 HIS N 2.900 2.500 3.300 2.949 2.839 3.109 . 0 0 "[ . 1 .]" 2 67 3 121 ASP O 3 125 CYS H 2.150 . 2.500 2.086 1.918 2.301 . 0 0 "[ . 1 .]" 2 68 3 121 ASP O 3 125 CYS N 2.900 2.500 3.300 2.986 2.815 3.220 . 0 0 "[ . 1 .]" 2 69 3 122 GLU O 3 126 ARG H 2.150 . 2.500 1.888 1.805 2.074 . 0 0 "[ . 1 .]" 2 70 3 122 GLU O 3 126 ARG N 2.900 2.500 3.300 2.804 2.721 2.989 . 0 0 "[ . 1 .]" 2 71 3 123 GLU O 3 127 LYS H 2.150 . 2.500 1.825 1.769 1.906 0.031 11 0 "[ . 1 .]" 2 72 3 123 GLU O 3 127 LYS N 2.900 2.500 3.300 2.753 2.693 2.842 . 0 0 "[ . 1 .]" 2 73 3 124 HIS O 3 128 VAL H 2.150 . 2.500 1.870 1.811 1.900 . 0 0 "[ . 1 .]" 2 74 3 124 HIS O 3 128 VAL N 2.900 2.500 3.300 2.774 2.660 2.822 . 0 0 "[ . 1 .]" 2 75 3 125 CYS O 3 129 ASN H 2.150 . 2.500 2.344 2.214 2.409 . 0 0 "[ . 1 .]" 2 76 3 125 CYS O 3 129 ASN N 2.900 2.500 3.300 3.294 3.177 3.359 0.059 6 0 "[ . 1 .]" 2 77 3 126 ARG O 3 130 GLU H 2.150 . 2.500 1.939 1.831 2.157 . 0 0 "[ . 1 .]" 2 78 3 126 ARG O 3 130 GLU N 2.900 2.500 3.300 2.816 2.702 3.012 . 0 0 "[ . 1 .]" 2 79 3 127 LYS O 3 131 TYR H 2.150 . 2.500 1.850 1.792 1.987 0.008 11 0 "[ . 1 .]" 2 80 3 127 LYS O 3 131 TYR N 2.900 2.500 3.300 2.708 2.649 2.796 . 0 0 "[ . 1 .]" 2 81 3 128 VAL O 3 132 LEU H 2.150 . 2.500 2.190 1.911 2.299 . 0 0 "[ . 1 .]" 2 82 3 128 VAL O 3 132 LEU N 2.900 2.500 3.300 3.040 2.744 3.177 . 0 0 "[ . 1 .]" 2 83 3 129 ASN O 3 133 ASN H 2.150 . 2.500 1.949 1.857 2.064 . 0 0 "[ . 1 .]" 2 84 3 129 ASN O 3 133 ASN N 2.900 2.500 3.300 2.716 2.627 2.777 . 0 0 "[ . 1 .]" 2 85 3 130 GLU O 3 134 ASN H 2.150 . 2.500 1.990 1.880 2.321 . 0 0 "[ . 1 .]" 2 86 3 130 GLU O 3 134 ASN N 2.900 2.500 3.300 2.652 2.556 2.930 . 0 0 "[ . 1 .]" 2 87 1 3 ILE N 1 15 LEU O 2.960 2.960 2.960 2.875 2.835 2.982 0.125 12 0 "[ . 1 .]" 2 88 1 4 PHE N 1 65 SER O 2.900 2.900 2.900 2.825 2.748 2.888 0.152 3 0 "[ . 1 .]" 2 89 1 6 LYS N 1 67 LEU O 2.890 2.890 2.890 2.857 2.812 2.906 0.078 3 0 "[ . 1 .]" 2 90 1 7 THR N 1 11 LYS O 2.890 2.890 2.890 2.850 2.798 2.943 0.092 7 0 "[ . 1 .]" 2 91 1 5 VAL O 1 13 ILE N 2.850 2.850 2.850 2.758 2.726 2.789 0.124 8 0 "[ . 1 .]" 2 92 1 3 ILE O 1 15 LEU N 2.860 2.860 2.860 2.825 2.777 2.922 0.083 3 0 "[ . 1 .]" 2 93 1 23 ILE N 1 54 ARG O 2.900 2.900 2.900 2.948 2.892 3.123 0.223 9 0 "[ . 1 .]" 2 94 1 22 THR O 1 26 VAL N 3.080 3.080 3.080 3.209 3.178 3.229 0.149 7 0 "[ . 1 .]" 2 95 1 23 ILE O 1 27 LYS N 2.930 2.930 2.930 2.926 2.840 2.987 0.090 10 0 "[ . 1 .]" 2 96 1 24 GLU O 1 28 ALA N 3.100 3.100 3.100 3.072 3.022 3.118 0.078 4 0 "[ . 1 .]" 2 97 1 25 ASN O 1 29 LYS N 3.090 3.090 3.090 3.163 3.125 3.192 0.102 3 0 "[ . 1 .]" 2 98 1 26 VAL O 1 30 ILE N 3.000 3.000 3.000 3.163 3.115 3.207 0.207 4 0 "[ . 1 .]" 2 99 1 27 LYS O 1 31 GLN N 2.990 2.990 2.990 2.944 2.900 3.016 0.090 10 0 "[ . 1 .]" 2 100 1 28 ALA O 1 32 ASP N 3.070 3.070 3.070 3.069 2.999 3.136 0.071 2 0 "[ . 1 .]" 2 101 1 29 LYS O 1 33 LYS N 3.130 3.130 3.130 3.115 2.886 3.229 0.244 14 0 "[ . 1 .]" 2 102 1 30 ILE O 1 34 GLU N 2.850 2.850 2.850 2.766 2.669 2.877 0.181 8 0 "[ . 1 .]" 2 103 1 42 ARG N 1 70 VAL O 2.920 2.920 2.920 3.060 2.923 3.163 0.243 11 0 "[ . 1 .]" 2 104 1 44 ILE N 1 68 HIS O 2.880 2.880 2.880 2.866 2.781 2.928 0.099 7 0 "[ . 1 .]" 2 105 1 45 PHE N 1 48 LYS O 2.910 2.910 2.910 2.927 2.851 2.993 0.083 8 0 "[ . 1 .]" 2 106 1 43 LEU O 1 50 LEU N 2.880 2.880 2.880 2.757 2.641 2.801 0.239 9 0 "[ . 1 .]" 2 107 1 21 ASP O 1 56 LEU N 2.910 2.910 2.910 2.995 2.925 3.047 0.137 6 0 "[ . 1 .]" 2 108 1 19 PRO O 1 57 SER N 2.980 2.980 2.980 2.958 2.868 3.039 0.112 6 0 "[ . 1 .]" 2 109 1 2 GLN O 1 64 GLU N 2.810 2.810 2.810 2.717 2.679 2.747 0.131 7 0 "[ . 1 .]" 2 110 1 4 PHE O 1 67 LEU N 2.860 2.860 2.860 2.746 2.677 2.814 0.183 12 0 "[ . 1 .]" 2 111 1 44 ILE O 1 68 HIS N 2.870 2.870 2.870 2.910 2.856 2.966 0.096 12 0 "[ . 1 .]" 2 112 1 6 LYS O 1 69 LEU N 2.920 2.920 2.920 2.970 2.907 3.042 0.122 5 0 "[ . 1 .]" 2 113 1 42 ARG O 1 70 VAL N 2.880 2.880 2.880 2.856 2.791 2.954 0.089 11 0 "[ . 1 .]" 2 114 2 3 ILE N 2 15 LEU O 2.960 2.960 2.960 2.896 2.819 2.956 0.141 11 0 "[ . 1 .]" 2 115 2 4 PHE N 2 65 SER O 2.900 2.900 2.900 2.840 2.760 2.890 0.140 3 0 "[ . 1 .]" 2 116 2 6 LYS N 2 67 LEU O 2.890 2.890 2.890 2.898 2.842 2.959 0.069 8 0 "[ . 1 .]" 2 117 2 7 THR N 2 11 LYS O 2.890 2.890 2.890 2.832 2.767 2.962 0.123 2 0 "[ . 1 .]" 2 118 2 5 VAL O 2 13 ILE N 2.850 2.850 2.850 2.743 2.709 2.767 0.141 2 0 "[ . 1 .]" 2 119 2 3 ILE O 2 15 LEU N 2.860 2.860 2.860 2.827 2.774 2.899 0.086 12 0 "[ . 1 .]" 2 120 2 23 ILE N 2 54 ARG O 2.900 2.900 2.900 2.901 2.847 2.976 0.076 11 0 "[ . 1 .]" 2 121 2 22 THR O 2 26 VAL N 3.080 3.080 3.080 3.186 3.147 3.214 0.134 15 0 "[ . 1 .]" 2 122 2 23 ILE O 2 27 LYS N 2.930 2.930 2.930 2.959 2.852 3.039 0.109 3 0 "[ . 1 .]" 2 123 2 24 GLU O 2 28 ALA N 3.100 3.100 3.100 3.075 3.030 3.143 0.070 6 0 "[ . 1 .]" 2 124 2 25 ASN O 2 29 LYS N 3.090 3.090 3.090 3.129 3.058 3.190 0.100 11 0 "[ . 1 .]" 2 125 2 26 VAL O 2 30 ILE N 3.000 3.000 3.000 3.155 3.089 3.192 0.192 9 0 "[ . 1 .]" 2 126 2 27 LYS O 2 31 GLN N 2.990 2.990 2.990 2.979 2.904 3.054 0.086 6 0 "[ . 1 .]" 2 127 2 28 ALA O 2 32 ASP N 3.070 3.070 3.070 3.017 2.939 3.130 0.131 11 0 "[ . 1 .]" 2 128 2 29 LYS O 2 33 LYS N 3.130 3.130 3.130 3.113 2.924 3.243 0.206 3 0 "[ . 1 .]" 2 129 2 30 ILE O 2 34 GLU N 2.850 2.850 2.850 2.751 2.650 2.887 0.200 12 0 "[ . 1 .]" 2 130 2 42 ARG N 2 70 VAL O 2.920 2.920 2.920 2.993 2.820 3.120 0.200 9 0 "[ . 1 .]" 2 131 2 44 ILE N 2 68 HIS O 2.880 2.880 2.880 2.935 2.888 2.992 0.112 10 0 "[ . 1 .]" 2 132 2 45 PHE N 2 48 ARG O 2.910 2.910 2.910 2.920 2.824 3.074 0.164 3 0 "[ . 1 .]" 2 133 2 43 LEU O 2 50 LEU N 2.880 2.880 2.880 2.884 2.843 2.955 0.075 9 0 "[ . 1 .]" 2 134 2 21 ASP O 2 56 LEU N 2.910 2.910 2.910 2.975 2.911 3.052 0.142 15 0 "[ . 1 .]" 2 135 2 19 PRO O 2 57 SER N 2.980 2.980 2.980 2.986 2.901 3.066 0.086 10 0 "[ . 1 .]" 2 136 2 2 GLN O 2 64 GLU N 2.810 2.810 2.810 2.708 2.647 2.744 0.163 12 0 "[ . 1 .]" 2 137 2 4 PHE O 2 67 LEU N 2.860 2.860 2.860 2.722 2.654 2.789 0.206 9 0 "[ . 1 .]" 2 138 2 44 ILE O 2 68 HIS N 2.870 2.870 2.870 2.836 2.778 2.919 0.092 10 0 "[ . 1 .]" 2 139 2 6 LYS O 2 69 LEU N 2.920 2.920 2.920 2.908 2.850 3.004 0.084 7 0 "[ . 1 .]" 2 140 2 42 ARG O 2 70 VAL N 2.880 2.880 2.880 2.965 2.882 3.064 0.184 3 0 "[ . 1 .]" 2 141 2 76 GLY O 3 107 LYS NZ 2.900 2.500 3.300 3.104 2.636 3.441 0.141 10 0 "[ . 1 .]" 2 stop_ save_
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