NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
543558 | 2lhn | 17858 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2lhn 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 837 _Distance_constraint_stats_list.Viol_count 3 _Distance_constraint_stats_list.Viol_total 0.843 _Distance_constraint_stats_list.Viol_max 0.022 _Distance_constraint_stats_list.Viol_rms 0.0002 _Distance_constraint_stats_list.Viol_average_all_restraints 0.0000 _Distance_constraint_stats_list.Viol_average_violations_only 0.0140 _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 GLY 0.000 0.000 . 0 "[ . 1 . 2]" 1 2 PRO 0.000 0.000 . 0 "[ . 1 . 2]" 1 3 LEU 0.000 0.000 . 0 "[ . 1 . 2]" 1 4 GLY 0.000 0.000 . 0 "[ . 1 . 2]" 1 5 SER 0.000 0.000 . 0 "[ . 1 . 2]" 1 6 GLU 0.000 0.000 . 0 "[ . 1 . 2]" 1 7 LYS 0.000 0.000 . 0 "[ . 1 . 2]" 1 8 SER 0.000 0.000 . 0 "[ . 1 . 2]" 1 9 LEU 0.000 0.000 . 0 "[ . 1 . 2]" 1 10 GLU 0.000 0.000 . 0 "[ . 1 . 2]" 1 11 GLN 0.000 0.000 . 0 "[ . 1 . 2]" 1 12 CYS 0.000 0.000 . 0 "[ . 1 . 2]" 1 13 LYS 0.000 0.000 . 0 "[ . 1 . 2]" 1 14 PHE 0.000 0.000 . 0 "[ . 1 . 2]" 1 15 GLY 0.000 0.000 . 0 "[ . 1 . 2]" 1 16 THR 0.000 0.000 . 0 "[ . 1 . 2]" 1 17 HIS 0.000 0.000 . 0 "[ . 1 . 2]" 1 18 CYS 0.000 0.000 . 0 "[ . 1 . 2]" 1 19 THR 0.000 0.000 . 0 "[ . 1 . 2]" 1 20 ASN 0.000 0.000 . 0 "[ . 1 . 2]" 1 21 LYS 0.000 0.000 . 0 "[ . 1 . 2]" 1 22 ARG 0.000 0.000 . 0 "[ . 1 . 2]" 1 23 CYS 0.000 0.000 . 0 "[ . 1 . 2]" 1 24 LYS 0.000 0.000 . 0 "[ . 1 . 2]" 1 25 TYR 0.000 0.000 . 0 "[ . 1 . 2]" 1 26 ARG 0.000 0.000 . 0 "[ . 1 . 2]" 1 27 HIS 0.000 0.000 . 0 "[ . 1 . 2]" 1 28 ALA 0.000 0.000 . 0 "[ . 1 . 2]" 1 29 ARG 0.000 0.000 . 0 "[ . 1 . 2]" 1 30 SER 0.000 0.000 . 0 "[ . 1 . 2]" 1 31 HIS 0.000 0.000 . 0 "[ . 1 . 2]" 1 32 ILE 0.000 0.000 . 0 "[ . 1 . 2]" 1 33 MET 0.000 0.000 . 0 "[ . 1 . 2]" 1 34 CYS 0.000 0.000 . 0 "[ . 1 . 2]" 1 35 ARG 0.000 0.000 . 0 "[ . 1 . 2]" 1 36 GLU 0.000 0.000 . 0 "[ . 1 . 2]" 1 37 GLY 0.000 0.000 . 0 "[ . 1 . 2]" 1 38 ALA 0.000 0.000 . 0 "[ . 1 . 2]" 1 39 ASN 0.000 0.000 . 0 "[ . 1 . 2]" 1 40 CYS 0.000 0.000 . 0 "[ . 1 . 2]" 1 41 THR 0.000 0.000 . 0 "[ . 1 . 2]" 1 42 ARG 0.000 0.000 . 0 "[ . 1 . 2]" 1 43 ILE 0.000 0.000 . 0 "[ . 1 . 2]" 1 44 ASP 0.000 0.000 . 0 "[ . 1 . 2]" 1 45 CYS 0.042 0.022 1 0 "[ . 1 . 2]" 1 46 LEU 0.000 0.000 . 0 "[ . 1 . 2]" 1 47 PHE 0.000 0.000 . 0 "[ . 1 . 2]" 1 48 GLY 0.000 0.000 . 0 "[ . 1 . 2]" 1 49 HIS 0.042 0.022 1 0 "[ . 1 . 2]" 1 50 PRO 0.000 0.000 . 0 "[ . 1 . 2]" 1 51 ILE 0.000 0.000 . 0 "[ . 1 . 2]" 1 52 ASN 0.000 0.000 . 0 "[ . 1 . 2]" 1 53 GLU 0.000 0.000 . 0 "[ . 1 . 2]" 1 54 ASP 0.000 0.000 . 0 "[ . 1 . 2]" 1 55 CYS 0.000 0.000 . 0 "[ . 1 . 2]" 1 56 ARG 0.000 0.000 . 0 "[ . 1 . 2]" 1 57 PHE 0.000 0.000 . 0 "[ . 1 . 2]" 1 58 GLY 0.000 0.000 . 0 "[ . 1 . 2]" 1 59 VAL 0.000 0.000 . 0 "[ . 1 . 2]" 1 60 ASN 0.000 0.000 . 0 "[ . 1 . 2]" 1 61 CYS 0.000 0.000 . 0 "[ . 1 . 2]" 1 62 LYS 0.000 0.000 . 0 "[ . 1 . 2]" 1 63 ASN 0.000 0.000 . 0 "[ . 1 . 2]" 1 64 ILE 0.000 0.000 . 0 "[ . 1 . 2]" 1 65 TYR 0.000 0.000 . 0 "[ . 1 . 2]" 1 66 CYS 0.000 0.000 . 0 "[ . 1 . 2]" 1 67 LEU 0.000 0.000 . 0 "[ . 1 . 2]" 1 68 PHE 0.000 0.000 . 0 "[ . 1 . 2]" 1 69 ARG 0.000 0.000 . 0 "[ . 1 . 2]" 1 70 HIS 0.000 0.000 . 0 "[ . 1 . 2]" 1 71 PRO 0.000 0.000 . 0 "[ . 1 . 2]" 1 72 PRO 0.000 0.000 . 0 "[ . 1 . 2]" 1 73 GLY 0.000 0.000 . 0 "[ . 1 . 2]" 1 74 ARG 0.000 0.000 . 0 "[ . 1 . 2]" 1 75 VAL 0.000 0.000 . 0 "[ . 1 . 2]" 1 76 LEU 0.000 0.000 . 0 "[ . 1 . 2]" 1 77 PRO 0.000 0.000 . 0 "[ . 1 . 2]" 1 78 GLU 0.000 0.000 . 0 "[ . 1 . 2]" 1 79 LYS 0.000 0.000 . 0 "[ . 1 . 2]" 1 80 LYS 0.000 0.000 . 0 "[ . 1 . 2]" stop_ loop_ _Distance_constraint_stats.Restraint_ID _Distance_constraint_stats.Atom_1_entity_assembly_ID _Distance_constraint_stats.Atom_1_comp_index_ID _Distance_constraint_stats.Atom_1_comp_ID _Distance_constraint_stats.Atom_1_ID _Distance_constraint_stats.Atom_2_entity_assembly_ID _Distance_constraint_stats.Atom_2_comp_index_ID _Distance_constraint_stats.Atom_2_comp_ID _Distance_constraint_stats.Atom_2_ID _Distance_constraint_stats.Node_1_distance_val _Distance_constraint_stats.Node_1_distance_lower_bound_val _Distance_constraint_stats.Node_1_distance_upper_bound_val _Distance_constraint_stats.Distance_average _Distance_constraint_stats.Distance_minimum _Distance_constraint_stats.Distance_maximum _Distance_constraint_stats.Max_violation _Distance_constraint_stats.Max_violation_model_number _Distance_constraint_stats.Over_cutoff_violation_count _Distance_constraint_stats.Over_cutoff_viol_per_model _Distance_constraint_stats.Distance_constraint_stats_ID 1 1 1 GLY QA 1 2 PRO QD 3.889 . 4.516 2.074 1.985 2.119 . 0 0 "[ . 1 . 2]" 1 2 1 2 PRO HA 1 3 LEU H 3.100 . 3.600 2.339 2.109 3.366 . 0 0 "[ . 1 . 2]" 1 3 1 2 PRO QB 1 3 LEU H 5.824 . 6.384 2.827 2.515 3.252 . 0 0 "[ . 1 . 2]" 1 4 1 2 PRO QD 1 3 LEU H 5.824 . 6.384 4.846 2.646 5.010 . 0 0 "[ . 1 . 2]" 1 5 1 2 PRO QG 1 3 LEU H 5.600 . 6.160 4.348 3.950 4.660 . 0 0 "[ . 1 . 2]" 1 6 1 3 LEU HA 1 4 GLY H 3.200 . 3.700 2.509 2.153 3.344 . 0 0 "[ . 1 . 2]" 1 7 1 4 GLY H 1 5 SER H 5.200 . 5.700 4.038 2.524 4.674 . 0 0 "[ . 1 . 2]" 1 8 1 4 GLY QA 1 5 SER H 5.264 . 5.824 2.383 2.127 2.928 . 0 0 "[ . 1 . 2]" 1 9 1 5 SER H 1 6 GLU H 5.000 . 5.500 3.477 1.877 4.659 . 0 0 "[ . 1 . 2]" 1 10 1 5 SER HA 1 6 GLU H 3.200 . 3.700 2.726 2.135 3.375 . 0 0 "[ . 1 . 2]" 1 11 1 5 SER QB 1 6 GLU H 5.712 . 6.272 3.468 2.418 4.091 . 0 0 "[ . 1 . 2]" 1 12 1 6 GLU H 1 7 LYS H 3.200 . 3.700 3.166 2.644 3.403 . 0 0 "[ . 1 . 2]" 1 13 1 6 GLU HA 1 7 LYS H 2.600 . 3.100 2.661 2.543 3.042 . 0 0 "[ . 1 . 2]" 1 14 1 6 GLU QB 1 7 LYS H 4.480 . 5.040 3.959 3.340 4.048 . 0 0 "[ . 1 . 2]" 1 15 1 6 GLU QB 1 43 ILE MD 6.492 . 7.249 3.668 3.483 3.940 . 0 0 "[ . 1 . 2]" 1 16 1 6 GLU QB 1 24 LYS HA 4.144 . 4.704 3.683 3.100 3.851 . 0 0 "[ . 1 . 2]" 1 17 1 6 GLU QB 1 25 TYR H 5.264 . 5.824 3.568 3.028 3.989 . 0 0 "[ . 1 . 2]" 1 18 1 6 GLU QB 1 26 ARG HA 5.040 . 5.600 3.424 2.296 4.565 . 0 0 "[ . 1 . 2]" 1 19 1 6 GLU QB 1 43 ILE MD 5.779 . 6.451 4.350 4.318 4.377 . 0 0 "[ . 1 . 2]" 1 20 1 6 GLU QG 1 7 LYS H 5.040 . 5.600 4.324 4.057 4.578 . 0 0 "[ . 1 . 2]" 1 21 1 7 LYS H 1 8 SER H 4.400 . 4.900 2.545 2.096 2.845 . 0 0 "[ . 1 . 2]" 1 22 1 7 LYS H 1 8 SER HA 4.800 . 5.300 5.005 4.727 5.154 . 0 0 "[ . 1 . 2]" 1 23 1 7 LYS H 1 43 ILE MD 6.840 . 7.440 4.435 3.166 4.739 . 0 0 "[ . 1 . 2]" 1 24 1 7 LYS H 1 43 ILE MG 7.440 . 8.040 4.232 1.867 4.689 . 0 0 "[ . 1 . 2]" 1 25 1 7 LYS HA 1 8 SER H 3.400 . 3.600 3.147 3.058 3.201 . 0 0 "[ . 1 . 2]" 1 26 1 7 LYS HA 1 8 SER QB 5.488 . 6.048 4.967 4.905 5.014 . 0 0 "[ . 1 . 2]" 1 27 1 7 LYS HA 1 43 ILE HB 5.105 . 5.666 4.001 3.888 4.085 . 0 0 "[ . 1 . 2]" 1 28 1 7 LYS HA 1 43 ILE MD 7.074 . 7.748 2.451 2.211 2.871 . 0 0 "[ . 1 . 2]" 1 29 1 7 LYS HA 1 43 ILE HB 4.500 . 5.000 4.514 4.261 4.634 . 0 0 "[ . 1 . 2]" 1 30 1 7 LYS HA 1 43 ILE MD 6.240 . 6.840 2.459 2.215 2.897 . 0 0 "[ . 1 . 2]" 1 31 1 7 LYS HA 1 43 ILE MG 5.880 . 6.480 2.492 2.151 2.798 . 0 0 "[ . 1 . 2]" 1 32 1 7 LYS QB 1 8 SER H 3.920 . 4.480 3.530 3.446 3.632 . 0 0 "[ . 1 . 2]" 1 33 1 7 LYS QB 1 8 SER HA 4.928 . 5.488 4.366 4.140 4.489 . 0 0 "[ . 1 . 2]" 1 34 1 7 LYS QB 1 43 ILE MD 6.720 . 7.392 3.966 3.676 4.526 . 0 0 "[ . 1 . 2]" 1 35 1 7 LYS QB 1 43 ILE MG 5.645 . 6.317 3.963 3.483 4.198 . 0 0 "[ . 1 . 2]" 1 36 1 7 LYS QE 1 43 ILE MG 6.451 . 7.123 4.138 2.609 4.824 . 0 0 "[ . 1 . 2]" 1 37 1 7 LYS QG 1 8 SER H 5.152 . 5.712 4.476 4.331 4.641 . 0 0 "[ . 1 . 2]" 1 38 1 7 LYS QG 1 43 ILE MG 6.989 . 7.661 3.204 2.400 4.389 . 0 0 "[ . 1 . 2]" 1 39 1 8 SER H 1 9 LEU H 4.500 . 5.000 4.551 4.433 4.593 . 0 0 "[ . 1 . 2]" 1 40 1 8 SER H 1 25 TYR QD 6.496 . 7.056 5.253 4.619 5.802 . 0 0 "[ . 1 . 2]" 1 41 1 8 SER H 1 43 ILE MD 6.120 . 6.720 3.482 3.001 3.762 . 0 0 "[ . 1 . 2]" 1 42 1 8 SER HA 1 9 LEU H 2.700 . 3.200 2.233 2.171 2.301 . 0 0 "[ . 1 . 2]" 1 43 1 8 SER HA 1 9 LEU QD 7.804 . 8.561 3.223 2.924 3.457 . 0 0 "[ . 1 . 2]" 1 44 1 8 SER HA 1 10 GLU H 5.195 . 5.756 3.646 3.507 3.844 . 0 0 "[ . 1 . 2]" 1 45 1 8 SER HA 1 43 ILE MD 6.480 . 7.080 3.766 3.262 4.052 . 0 0 "[ . 1 . 2]" 1 46 1 8 SER QB 1 9 LEU H 5.152 . 5.712 3.598 3.275 3.768 . 0 0 "[ . 1 . 2]" 1 47 1 8 SER QB 1 10 GLU H 5.376 . 5.936 3.314 2.768 3.754 . 0 0 "[ . 1 . 2]" 1 48 1 8 SER QB 1 25 TYR QD 5.943 . 6.616 2.820 2.245 3.370 . 0 0 "[ . 1 . 2]" 1 49 1 8 SER QB 1 25 TYR QE 6.576 . 7.250 3.520 2.843 4.071 . 0 0 "[ . 1 . 2]" 1 50 1 8 SER QB 1 25 TYR H 5.488 . 6.048 4.625 4.202 4.992 . 0 0 "[ . 1 . 2]" 1 51 1 8 SER QB 1 25 TYR HA 5.040 . 5.600 2.506 2.130 3.004 . 0 0 "[ . 1 . 2]" 1 52 1 8 SER QB 1 25 TYR QD 5.143 . 5.770 2.924 2.297 3.606 . 0 0 "[ . 1 . 2]" 1 53 1 8 SER QB 1 25 TYR QE 5.519 . 6.147 3.579 2.852 4.185 . 0 0 "[ . 1 . 2]" 1 54 1 9 LEU H 1 25 TYR QD 5.438 . 6.068 4.146 3.980 4.275 . 0 0 "[ . 1 . 2]" 1 55 1 9 LEU H 1 43 ILE MD 6.120 . 6.720 3.658 3.352 4.088 . 0 0 "[ . 1 . 2]" 1 56 1 9 LEU HA 1 10 GLU H 4.700 . 5.200 3.312 3.133 3.403 . 0 0 "[ . 1 . 2]" 1 57 1 9 LEU HA 1 43 ILE MD 5.640 . 6.240 2.581 2.166 3.107 . 0 0 "[ . 1 . 2]" 1 58 1 9 LEU HA 1 43 ILE MG 6.720 . 7.320 5.241 4.819 5.640 . 0 0 "[ . 1 . 2]" 1 59 1 9 LEU QB 1 10 GLU H 5.488 . 6.048 3.328 3.141 3.586 . 0 0 "[ . 1 . 2]" 1 60 1 9 LEU QD 1 10 GLU H 8.100 . 8.775 4.390 4.032 4.499 . 0 0 "[ . 1 . 2]" 1 61 1 9 LEU QD 1 10 GLU HA 7.965 . 8.640 5.135 4.729 5.476 . 0 0 "[ . 1 . 2]" 1 62 1 9 LEU QD 1 10 GLU QB 8.316 . 9.072 5.421 5.119 5.596 . 0 0 "[ . 1 . 2]" 1 63 1 9 LEU QD 1 26 ARG QD 7.862 . 8.618 3.171 2.395 4.623 . 0 0 "[ . 1 . 2]" 1 64 1 9 LEU QD 1 39 ASN HA 8.100 . 8.775 4.754 4.166 5.257 . 0 0 "[ . 1 . 2]" 1 65 1 9 LEU QD 1 40 CYS H 7.020 . 7.695 4.951 4.671 5.224 . 0 0 "[ . 1 . 2]" 1 66 1 9 LEU QD 1 41 THR H 7.965 . 8.640 3.984 3.810 4.311 . 0 0 "[ . 1 . 2]" 1 67 1 9 LEU QD 1 41 THR H 8.878 . 9.634 3.485 3.145 3.637 . 0 0 "[ . 1 . 2]" 1 68 1 9 LEU QD 1 41 THR HA 5.940 . 6.615 1.989 1.899 2.124 . 0 0 "[ . 1 . 2]" 1 69 1 9 LEU QD 1 41 THR HB 6.615 . 7.290 3.305 2.974 3.553 . 0 0 "[ . 1 . 2]" 1 70 1 9 LEU QD 1 41 THR MG 7.452 . 8.262 2.582 2.300 3.325 . 0 0 "[ . 1 . 2]" 1 71 1 9 LEU QD 1 42 ARG H 7.965 . 8.640 3.378 2.979 3.651 . 0 0 "[ . 1 . 2]" 1 72 1 9 LEU QD 1 42 ARG HA 7.020 . 7.695 4.117 3.654 4.281 . 0 0 "[ . 1 . 2]" 1 73 1 9 LEU QD 1 42 ARG HA 7.441 . 8.162 4.004 3.603 4.137 . 0 0 "[ . 1 . 2]" 1 74 1 9 LEU QD 1 42 ARG QB 8.618 . 9.374 4.453 4.006 4.663 . 0 0 "[ . 1 . 2]" 1 75 1 9 LEU QD 1 43 ILE H 8.100 . 8.775 3.860 3.324 4.118 . 0 0 "[ . 1 . 2]" 1 76 1 9 LEU QD 1 43 ILE HA 5.805 . 6.480 3.592 3.016 3.788 . 0 0 "[ . 1 . 2]" 1 77 1 9 LEU QD 1 43 ILE HB 6.615 . 7.290 4.802 4.400 4.926 . 0 0 "[ . 1 . 2]" 1 78 1 9 LEU QD 1 43 ILE MD 7.128 . 7.938 2.116 1.939 2.440 . 0 0 "[ . 1 . 2]" 1 79 1 9 LEU QD 1 43 ILE QG 7.409 . 8.165 2.970 2.552 3.142 . 0 0 "[ . 1 . 2]" 1 80 1 9 LEU QD 1 43 ILE MG 8.910 . 9.720 4.484 4.197 4.647 . 0 0 "[ . 1 . 2]" 1 81 1 9 LEU QD 1 45 CYS H 7.830 . 8.505 5.632 4.790 5.854 . 0 0 "[ . 1 . 2]" 1 82 1 9 LEU QD 1 45 CYS QB 9.072 . 9.828 5.131 4.343 5.439 . 0 0 "[ . 1 . 2]" 1 83 1 9 LEU HG 1 41 THR MG 6.840 . 7.440 4.909 3.857 5.353 . 0 0 "[ . 1 . 2]" 1 84 1 10 GLU H 1 25 TYR QD 5.438 . 6.068 3.431 3.116 3.745 . 0 0 "[ . 1 . 2]" 1 85 1 10 GLU H 1 25 TYR HA 4.600 . 5.100 4.490 4.167 4.636 . 0 0 "[ . 1 . 2]" 1 86 1 10 GLU H 1 25 TYR QD 5.600 . 6.160 3.639 3.194 4.140 . 0 0 "[ . 1 . 2]" 1 87 1 10 GLU H 1 25 TYR QE 6.048 . 6.608 4.853 4.339 5.404 . 0 0 "[ . 1 . 2]" 1 88 1 10 GLU HA 1 11 GLN H 2.600 . 3.100 2.367 2.200 2.610 . 0 0 "[ . 1 . 2]" 1 89 1 10 GLU QB 1 11 GLN H 3.472 . 4.032 2.826 2.226 3.271 . 0 0 "[ . 1 . 2]" 1 90 1 10 GLU QB 1 26 ARG H 5.670 . 6.300 3.898 3.527 4.182 . 0 0 "[ . 1 . 2]" 1 91 1 10 GLU QB 1 25 TYR QD 5.143 . 5.770 2.103 2.015 2.246 . 0 0 "[ . 1 . 2]" 1 92 1 10 GLU QB 1 25 TYR QE 4.892 . 5.519 3.007 2.485 3.417 . 0 0 "[ . 1 . 2]" 1 93 1 10 GLU QB 1 26 ARG H 5.040 . 5.600 4.542 4.491 4.608 . 0 0 "[ . 1 . 2]" 1 94 1 10 GLU QG 1 11 GLN H 3.808 . 4.368 2.673 1.743 3.457 . 0 0 "[ . 1 . 2]" 1 95 1 10 GLU QG 1 25 TYR QD 5.810 . 6.517 3.164 2.620 3.681 . 0 0 "[ . 1 . 2]" 1 96 1 10 GLU QG 1 25 TYR QD 6.523 . 7.150 3.621 2.660 4.219 . 0 0 "[ . 1 . 2]" 1 97 1 10 GLU QG 1 25 TYR QE 5.268 . 5.896 4.082 3.202 4.235 . 0 0 "[ . 1 . 2]" 1 98 1 11 GLN H 1 12 CYS H 5.000 . 5.500 4.463 4.272 4.567 . 0 0 "[ . 1 . 2]" 1 99 1 11 GLN H 1 25 TYR QD 4.816 . 5.376 4.282 4.063 4.399 . 0 0 "[ . 1 . 2]" 1 100 1 11 GLN H 1 51 ILE MD 6.720 . 7.320 4.225 2.960 4.793 . 0 0 "[ . 1 . 2]" 1 101 1 11 GLN H 1 51 ILE QG 5.824 . 6.384 3.462 2.851 5.230 . 0 0 "[ . 1 . 2]" 1 102 1 11 GLN H 1 51 ILE QG 7.194 . 7.848 3.310 2.760 4.503 . 0 0 "[ . 1 . 2]" 1 103 1 11 GLN H 1 51 ILE MG 6.480 . 7.080 4.463 3.685 4.982 . 0 0 "[ . 1 . 2]" 1 104 1 11 GLN HA 1 12 CYS H 2.900 . 3.400 2.130 2.073 2.180 . 0 0 "[ . 1 . 2]" 1 105 1 11 GLN HA 1 26 ARG H 4.400 . 4.900 2.446 2.265 2.729 . 0 0 "[ . 1 . 2]" 1 106 1 11 GLN HA 1 26 ARG QB 5.040 . 5.600 2.661 2.245 3.600 . 0 0 "[ . 1 . 2]" 1 107 1 11 GLN QB 1 12 CYS H 3.920 . 4.480 3.333 2.680 3.611 . 0 0 "[ . 1 . 2]" 1 108 1 11 GLN QB 1 28 ALA MB 7.526 . 8.198 4.878 4.489 5.519 . 0 0 "[ . 1 . 2]" 1 109 1 11 GLN QB 1 67 LEU QD 6.876 . 7.758 2.702 2.023 3.352 . 0 0 "[ . 1 . 2]" 1 110 1 11 GLN QB 1 38 ALA MB 7.476 . 8.232 3.162 2.263 3.813 . 0 0 "[ . 1 . 2]" 1 111 1 11 GLN QB 1 51 ILE MD 6.854 . 7.526 2.446 2.015 3.249 . 0 0 "[ . 1 . 2]" 1 112 1 11 GLN QB 1 51 ILE MD 7.294 . 8.051 1.989 1.832 2.356 . 0 0 "[ . 1 . 2]" 1 113 1 11 GLN QB 1 51 ILE QG 6.272 . 6.899 2.553 2.039 3.874 . 0 0 "[ . 1 . 2]" 1 114 1 11 GLN QB 1 51 ILE QG 7.040 . 7.747 2.275 1.992 2.770 . 0 0 "[ . 1 . 2]" 1 115 1 11 GLN QB 1 51 ILE MG 6.451 . 7.123 4.414 3.758 4.815 . 0 0 "[ . 1 . 2]" 1 116 1 11 GLN QB 1 67 LEU QD 6.804 . 7.560 3.310 2.568 3.784 . 0 0 "[ . 1 . 2]" 1 117 1 11 GLN QE 1 12 CYS H 5.712 . 6.272 4.123 2.657 4.978 . 0 0 "[ . 1 . 2]" 1 118 1 11 GLN QE 1 27 HIS H 5.600 . 6.160 4.355 3.388 5.107 . 0 0 "[ . 1 . 2]" 1 119 1 11 GLN QE 1 27 HIS HA 5.600 . 6.160 3.505 2.961 4.183 . 0 0 "[ . 1 . 2]" 1 120 1 11 GLN QE 1 28 ALA H 3.696 . 4.256 2.928 2.321 3.351 . 0 0 "[ . 1 . 2]" 1 121 1 11 GLN QE 1 28 ALA MB 6.720 . 7.392 2.530 1.994 3.013 . 0 0 "[ . 1 . 2]" 1 122 1 11 GLN QE 1 51 ILE MD 7.795 . 8.467 3.966 2.485 5.750 . 0 0 "[ . 1 . 2]" 1 123 1 11 GLN QG 1 12 CYS H 5.488 . 6.048 2.802 2.064 3.995 . 0 0 "[ . 1 . 2]" 1 124 1 11 GLN QG 1 51 ILE MD 8.232 . 8.989 3.202 2.308 4.014 . 0 0 "[ . 1 . 2]" 1 125 1 11 GLN QG 1 67 LEU QD 9.138 . 9.987 2.922 2.070 3.701 . 0 0 "[ . 1 . 2]" 1 126 1 11 GLN QG 1 26 ARG H 5.264 . 5.824 3.736 2.702 4.373 . 0 0 "[ . 1 . 2]" 1 127 1 11 GLN QG 1 26 ARG HA 5.152 . 5.712 4.377 3.953 4.769 . 0 0 "[ . 1 . 2]" 1 128 1 11 GLN QG 1 27 HIS H 5.600 . 6.160 4.274 3.610 5.070 . 0 0 "[ . 1 . 2]" 1 129 1 11 GLN QG 1 28 ALA MB 8.064 . 8.736 4.132 3.514 5.267 . 0 0 "[ . 1 . 2]" 1 130 1 11 GLN QG 1 51 ILE MD 7.123 . 7.795 3.293 2.314 4.380 . 0 0 "[ . 1 . 2]" 1 131 1 11 GLN QG 1 67 LEU QD 8.165 . 8.921 3.153 2.077 4.127 . 0 0 "[ . 1 . 2]" 1 132 1 12 CYS H 1 25 TYR H 4.900 . 5.400 5.054 4.984 5.155 . 0 0 "[ . 1 . 2]" 1 133 1 12 CYS H 1 25 TYR QB 5.264 . 5.824 2.472 2.335 2.687 . 0 0 "[ . 1 . 2]" 1 134 1 12 CYS H 1 25 TYR QD 6.160 . 6.720 4.454 4.016 4.722 . 0 0 "[ . 1 . 2]" 1 135 1 12 CYS H 1 26 ARG H 4.600 . 5.100 3.619 3.459 3.790 . 0 0 "[ . 1 . 2]" 1 136 1 12 CYS H 1 27 HIS HA 5.000 . 5.500 3.517 3.322 3.661 . 0 0 "[ . 1 . 2]" 1 137 1 12 CYS HA 1 13 LYS H 2.700 . 3.200 2.295 2.154 2.444 . 0 0 "[ . 1 . 2]" 1 138 1 12 CYS HA 1 13 LYS QB 5.152 . 5.712 4.317 3.811 4.574 . 0 0 "[ . 1 . 2]" 1 139 1 12 CYS HA 1 13 LYS QG 5.936 . 6.496 4.057 3.518 5.360 . 0 0 "[ . 1 . 2]" 1 140 1 12 CYS HA 1 14 PHE H 4.900 . 5.400 4.217 4.016 4.546 . 0 0 "[ . 1 . 2]" 1 141 1 12 CYS HA 1 15 GLY H 6.000 . 6.500 5.206 4.760 5.427 . 0 0 "[ . 1 . 2]" 1 142 1 12 CYS HA 1 25 TYR QD 6.048 . 6.608 3.891 2.782 4.521 . 0 0 "[ . 1 . 2]" 1 143 1 12 CYS HA 1 27 HIS HD2 4.800 . 5.300 5.033 5.000 5.109 . 0 0 "[ . 1 . 2]" 1 144 1 12 CYS QB 1 13 LYS H 5.824 . 6.384 3.322 2.964 3.825 . 0 0 "[ . 1 . 2]" 1 145 1 12 CYS QB 1 14 PHE H 5.712 . 6.272 3.232 2.871 3.686 . 0 0 "[ . 1 . 2]" 1 146 1 12 CYS QB 1 15 GLY H 4.032 . 4.592 3.022 2.620 3.597 . 0 0 "[ . 1 . 2]" 1 147 1 12 CYS QB 1 25 TYR QD 5.143 . 5.770 3.693 2.919 4.104 . 0 0 "[ . 1 . 2]" 1 148 1 12 CYS QB 1 26 ARG H 5.152 . 5.712 4.564 4.416 4.675 . 0 0 "[ . 1 . 2]" 1 149 1 12 CYS QB 1 27 HIS H 5.376 . 5.936 4.831 4.741 4.874 . 0 0 "[ . 1 . 2]" 1 150 1 12 CYS QB 1 27 HIS HA 5.152 . 5.712 3.041 2.860 3.355 . 0 0 "[ . 1 . 2]" 1 151 1 12 CYS QB 1 27 HIS HD2 4.032 . 4.592 2.194 2.130 2.335 . 0 0 "[ . 1 . 2]" 1 152 1 12 CYS QB 1 51 ILE MD 7.258 . 7.930 4.906 4.441 5.406 . 0 0 "[ . 1 . 2]" 1 153 1 13 LYS HA 1 14 PHE H 4.400 . 4.900 3.452 3.325 3.573 . 0 0 "[ . 1 . 2]" 1 154 1 13 LYS HA 1 51 ILE MD 5.640 . 6.240 3.045 2.045 4.384 . 0 0 "[ . 1 . 2]" 1 155 1 13 LYS HA 1 51 ILE MG 6.240 . 6.840 4.051 3.585 4.535 . 0 0 "[ . 1 . 2]" 1 156 1 13 LYS QB 1 14 PHE H 4.816 . 5.376 3.416 2.717 3.998 . 0 0 "[ . 1 . 2]" 1 157 1 13 LYS QB 1 14 PHE QD 6.147 . 6.774 3.554 2.416 4.760 . 0 0 "[ . 1 . 2]" 1 158 1 13 LYS QD 1 14 PHE QD 5.770 . 6.397 4.436 3.996 4.605 . 0 0 "[ . 1 . 2]" 1 159 1 13 LYS QE 1 14 PHE QD 5.645 . 6.272 4.486 4.317 4.541 . 0 0 "[ . 1 . 2]" 1 160 1 13 LYS QE 1 51 ILE MG 6.720 . 7.392 4.469 3.177 5.004 . 0 0 "[ . 1 . 2]" 1 161 1 13 LYS QG 1 14 PHE H 5.488 . 6.048 3.771 2.673 4.519 . 0 0 "[ . 1 . 2]" 1 162 1 13 LYS QG 1 51 ILE MG 6.854 . 7.526 3.896 2.329 5.119 . 0 0 "[ . 1 . 2]" 1 163 1 14 PHE H 1 15 GLY H 2.800 . 3.300 2.476 2.295 2.783 . 0 0 "[ . 1 . 2]" 1 164 1 14 PHE H 1 15 GLY QA 5.264 . 5.824 4.348 4.196 4.594 . 0 0 "[ . 1 . 2]" 1 165 1 14 PHE H 1 18 CYS HA 4.700 . 5.200 4.768 4.099 4.923 . 0 0 "[ . 1 . 2]" 1 166 1 14 PHE H 1 27 HIS HD2 4.900 . 5.400 4.187 3.796 4.595 . 0 0 "[ . 1 . 2]" 1 167 1 14 PHE HA 1 15 GLY H 4.500 . 5.000 3.379 3.220 3.470 . 0 0 "[ . 1 . 2]" 1 168 1 14 PHE QB 1 15 GLY H 5.264 . 5.824 3.411 3.233 3.634 . 0 0 "[ . 1 . 2]" 1 169 1 14 PHE QB 1 17 HIS H 5.600 . 6.160 3.767 3.556 4.203 . 0 0 "[ . 1 . 2]" 1 170 1 14 PHE QB 1 17 HIS HD2 5.152 . 5.712 3.069 2.668 3.466 . 0 0 "[ . 1 . 2]" 1 171 1 14 PHE QB 1 18 CYS H 4.368 . 4.928 3.126 2.921 3.611 . 0 0 "[ . 1 . 2]" 1 172 1 14 PHE QB 1 18 CYS HA 5.600 . 6.160 2.300 2.109 2.512 . 0 0 "[ . 1 . 2]" 1 173 1 14 PHE QB 1 18 CYS QB 5.268 . 5.896 2.381 2.221 3.088 . 0 0 "[ . 1 . 2]" 1 174 1 14 PHE QD 1 15 GLY H 5.600 . 6.160 4.758 4.623 4.911 . 0 0 "[ . 1 . 2]" 1 175 1 14 PHE QD 1 17 HIS QB 5.770 . 6.397 3.838 3.082 4.603 . 0 0 "[ . 1 . 2]" 1 176 1 14 PHE QD 1 17 HIS QB 6.546 . 7.252 3.405 3.028 4.035 . 0 0 "[ . 1 . 2]" 1 177 1 14 PHE QD 1 18 CYS HA 6.048 . 6.608 3.554 2.524 4.158 . 0 0 "[ . 1 . 2]" 1 178 1 14 PHE QD 1 18 CYS QB 5.896 . 6.523 4.008 3.373 4.680 . 0 0 "[ . 1 . 2]" 1 179 1 14 PHE QD 1 19 THR MG 8.333 . 9.005 5.006 4.060 6.023 . 0 0 "[ . 1 . 2]" 1 180 1 15 GLY H 1 27 HIS HD2 4.400 . 4.900 3.364 2.801 4.060 . 0 0 "[ . 1 . 2]" 1 181 1 15 GLY H 1 67 LEU QD 8.235 . 8.910 2.554 2.310 3.023 . 0 0 "[ . 1 . 2]" 1 182 1 15 GLY QA 1 16 THR MG 8.198 . 8.870 3.728 3.660 3.815 . 0 0 "[ . 1 . 2]" 1 183 1 15 GLY QA 1 27 HIS HD2 4.928 . 5.488 3.386 2.926 3.982 . 0 0 "[ . 1 . 2]" 1 184 1 15 GLY QA 1 28 ALA H 6.048 . 6.608 2.414 2.042 2.842 . 0 0 "[ . 1 . 2]" 1 185 1 15 GLY QA 1 28 ALA MB 7.123 . 7.795 2.820 2.293 3.249 . 0 0 "[ . 1 . 2]" 1 186 1 15 GLY QA 1 67 LEU QD 7.560 . 8.316 2.244 2.027 2.581 . 0 0 "[ . 1 . 2]" 1 187 1 16 THR H 1 17 HIS H 3.700 . 4.200 2.715 2.645 2.789 . 0 0 "[ . 1 . 2]" 1 188 1 16 THR HA 1 17 HIS H 3.700 . 4.200 3.488 3.444 3.521 . 0 0 "[ . 1 . 2]" 1 189 1 16 THR HA 1 18 CYS H 4.400 . 4.900 3.842 3.558 4.090 . 0 0 "[ . 1 . 2]" 1 190 1 16 THR MG 1 17 HIS H 6.960 . 7.560 4.204 4.091 4.305 . 0 0 "[ . 1 . 2]" 1 191 1 16 THR MG 1 27 HIS QB 7.661 . 8.333 4.882 3.979 5.614 . 0 0 "[ . 1 . 2]" 1 192 1 16 THR MG 1 28 ALA MB 7.200 . 7.920 3.870 2.477 4.637 . 0 0 "[ . 1 . 2]" 1 193 1 16 THR MG 1 29 ARG HA 5.160 . 5.760 2.188 2.041 2.422 . 0 0 "[ . 1 . 2]" 1 194 1 16 THR MG 1 29 ARG QB 6.720 . 7.392 3.450 2.518 4.124 . 0 0 "[ . 1 . 2]" 1 195 1 16 THR MG 1 29 ARG QB 7.506 . 8.262 2.875 2.114 3.772 . 0 0 "[ . 1 . 2]" 1 196 1 16 THR MG 1 29 ARG QD 6.989 . 7.661 3.880 2.093 5.199 . 0 0 "[ . 1 . 2]" 1 197 1 16 THR MG 1 29 ARG QG 7.123 . 7.795 3.209 2.165 4.645 . 0 0 "[ . 1 . 2]" 1 198 1 16 THR MG 1 67 LEU QD 10.044 . 10.854 4.748 3.939 5.208 . 0 0 "[ . 1 . 2]" 1 199 1 17 HIS H 1 18 CYS H 2.900 . 3.400 2.573 2.479 2.651 . 0 0 "[ . 1 . 2]" 1 200 1 17 HIS H 1 18 CYS HA 5.000 . 5.500 4.904 4.612 5.042 . 0 0 "[ . 1 . 2]" 1 201 1 17 HIS H 1 18 CYS QB 5.488 . 6.048 4.269 4.114 4.433 . 0 0 "[ . 1 . 2]" 1 202 1 17 HIS HA 1 18 CYS H 4.100 . 4.600 3.318 3.060 3.452 . 0 0 "[ . 1 . 2]" 1 203 1 17 HIS HA 1 19 THR MG 6.480 . 7.080 4.481 3.806 4.920 . 0 0 "[ . 1 . 2]" 1 204 1 17 HIS QB 1 18 CYS H 5.040 . 5.600 3.569 3.455 4.080 . 0 0 "[ . 1 . 2]" 1 205 1 17 HIS HD2 1 18 CYS HA 4.600 . 5.100 4.582 4.217 4.633 . 0 0 "[ . 1 . 2]" 1 206 1 17 HIS HD2 1 19 THR MG 7.440 . 8.040 4.284 3.718 5.151 . 0 0 "[ . 1 . 2]" 1 207 1 18 CYS H 1 19 THR H 5.200 . 5.700 4.630 4.588 4.685 . 0 0 "[ . 1 . 2]" 1 208 1 18 CYS H 1 19 THR MG 5.880 . 6.480 4.879 4.580 4.957 . 0 0 "[ . 1 . 2]" 1 209 1 18 CYS HA 1 19 THR H 3.100 . 3.600 2.236 2.161 2.315 . 0 0 "[ . 1 . 2]" 1 210 1 18 CYS HA 1 19 THR MG 6.840 . 7.440 3.411 3.194 3.800 . 0 0 "[ . 1 . 2]" 1 211 1 18 CYS HA 1 20 ASN H 4.400 . 4.900 4.165 3.947 4.332 . 0 0 "[ . 1 . 2]" 1 212 1 18 CYS HA 1 27 HIS HD2 4.800 . 5.300 4.948 4.879 4.987 . 0 0 "[ . 1 . 2]" 1 213 1 18 CYS QB 1 19 THR MG 7.661 . 8.333 4.786 4.676 4.947 . 0 0 "[ . 1 . 2]" 1 214 1 18 CYS QB 1 27 HIS HD2 4.256 . 4.816 2.399 2.253 2.513 . 0 0 "[ . 1 . 2]" 1 215 1 19 THR H 1 20 ASN H 3.200 . 3.700 2.545 2.125 2.797 . 0 0 "[ . 1 . 2]" 1 216 1 19 THR HA 1 20 ASN H 3.400 . 3.900 3.375 3.212 3.484 . 0 0 "[ . 1 . 2]" 1 217 1 19 THR MG 1 20 ASN H 6.600 . 7.200 4.355 4.242 4.516 . 0 0 "[ . 1 . 2]" 1 218 1 20 ASN H 1 23 CYS QB 5.376 . 5.936 4.058 3.492 5.096 . 0 0 "[ . 1 . 2]" 1 219 1 20 ASN HA 1 21 LYS H 3.400 . 3.900 2.156 2.109 2.241 . 0 0 "[ . 1 . 2]" 1 220 1 20 ASN QB 1 23 CYS H 4.592 . 5.152 3.886 3.709 4.118 . 0 0 "[ . 1 . 2]" 1 221 1 20 ASN QD 1 22 ARG H 5.824 . 6.384 3.263 2.307 3.813 . 0 0 "[ . 1 . 2]" 1 222 1 20 ASN QD 1 22 ARG QD 6.397 . 7.025 4.611 3.556 5.132 . 0 0 "[ . 1 . 2]" 1 223 1 20 ASN QD 1 23 CYS HA 5.152 . 5.712 2.875 2.244 3.451 . 0 0 "[ . 1 . 2]" 1 224 1 20 ASN QD 1 23 CYS QB 5.143 . 5.770 2.912 2.144 3.241 . 0 0 "[ . 1 . 2]" 1 225 1 20 ASN QD 1 24 LYS H 5.824 . 6.384 4.452 3.650 5.057 . 0 0 "[ . 1 . 2]" 1 226 1 21 LYS H 1 22 ARG QG 5.824 . 6.384 3.987 3.572 4.871 . 0 0 "[ . 1 . 2]" 1 227 1 21 LYS HA 1 22 ARG H 3.300 . 3.800 3.344 3.280 3.398 . 0 0 "[ . 1 . 2]" 1 228 1 21 LYS QB 1 22 ARG H 5.152 . 5.712 3.278 3.024 3.452 . 0 0 "[ . 1 . 2]" 1 229 1 22 ARG H 1 23 CYS H 2.900 . 3.400 2.444 2.051 2.907 . 0 0 "[ . 1 . 2]" 1 230 1 22 ARG H 1 23 CYS QB 5.376 . 5.936 3.824 3.393 4.598 . 0 0 "[ . 1 . 2]" 1 231 1 22 ARG HA 1 23 CYS H 3.200 . 3.700 3.026 2.752 3.229 . 0 0 "[ . 1 . 2]" 1 232 1 22 ARG QB 1 23 CYS H 5.040 . 5.600 3.730 3.360 4.028 . 0 0 "[ . 1 . 2]" 1 233 1 22 ARG QG 1 23 CYS H 5.488 . 6.048 4.296 3.280 4.754 . 0 0 "[ . 1 . 2]" 1 234 1 23 CYS H 1 24 LYS H 4.900 . 5.400 4.596 4.473 4.632 . 0 0 "[ . 1 . 2]" 1 235 1 23 CYS H 1 27 HIS CE1 4.500 . 5.000 4.696 4.197 4.848 . 0 0 "[ . 1 . 2]" 1 236 1 23 CYS HA 1 24 LYS H 2.700 . 3.200 2.157 1.977 2.254 . 0 0 "[ . 1 . 2]" 1 237 1 23 CYS HA 1 25 TYR H 4.400 . 4.900 4.218 3.690 4.442 . 0 0 "[ . 1 . 2]" 1 238 1 23 CYS HA 1 27 HIS CE1 4.800 . 5.300 5.106 5.044 5.229 . 0 0 "[ . 1 . 2]" 1 239 1 23 CYS QB 1 24 LYS H 5.376 . 5.936 3.391 2.812 3.669 . 0 0 "[ . 1 . 2]" 1 240 1 23 CYS QB 1 27 HIS CE1 3.584 . 4.144 2.634 2.420 3.294 . 0 0 "[ . 1 . 2]" 1 241 1 24 LYS H 1 25 TYR H 3.100 . 3.600 2.897 2.674 3.118 . 0 0 "[ . 1 . 2]" 1 242 1 24 LYS H 1 25 TYR QD 6.048 . 6.608 3.098 2.692 4.161 . 0 0 "[ . 1 . 2]" 1 243 1 24 LYS H 1 25 TYR QE 4.816 . 5.376 3.461 2.530 4.310 . 0 0 "[ . 1 . 2]" 1 244 1 24 LYS HA 1 25 TYR H 3.500 . 4.000 3.256 2.795 3.394 . 0 0 "[ . 1 . 2]" 1 245 1 24 LYS HA 1 25 TYR QE 5.600 . 6.160 5.114 5.072 5.157 . 0 0 "[ . 1 . 2]" 1 246 1 24 LYS QB 1 25 TYR H 5.040 . 5.600 3.544 3.146 4.062 . 0 0 "[ . 1 . 2]" 1 247 1 24 LYS QB 1 25 TYR QD 6.021 . 6.648 3.258 2.725 4.775 . 0 0 "[ . 1 . 2]" 1 248 1 24 LYS QB 1 25 TYR QE 5.645 . 6.272 2.697 2.316 4.461 . 0 0 "[ . 1 . 2]" 1 249 1 24 LYS QD 1 25 TYR QE 6.272 . 6.899 4.305 2.671 4.990 . 0 0 "[ . 1 . 2]" 1 250 1 24 LYS QE 1 25 TYR QE 5.394 . 6.021 3.278 2.383 4.298 . 0 0 "[ . 1 . 2]" 1 251 1 24 LYS QG 1 25 TYR H 5.264 . 5.824 4.463 3.922 4.728 . 0 0 "[ . 1 . 2]" 1 252 1 24 LYS QG 1 25 TYR QD 7.526 . 8.154 4.538 3.658 5.039 . 0 0 "[ . 1 . 2]" 1 253 1 24 LYS QG 1 25 TYR QE 5.770 . 6.397 3.933 2.752 4.493 . 0 0 "[ . 1 . 2]" 1 254 1 25 TYR H 1 26 ARG H 4.700 . 5.200 4.492 4.437 4.541 . 0 0 "[ . 1 . 2]" 1 255 1 25 TYR H 1 27 HIS CE1 3.800 . 4.300 3.790 3.569 4.040 . 0 0 "[ . 1 . 2]" 1 256 1 25 TYR HA 1 26 ARG H 3.100 . 3.600 2.422 2.310 2.527 . 0 0 "[ . 1 . 2]" 1 257 1 25 TYR QB 1 26 ARG H 3.472 . 4.032 2.486 2.248 2.818 . 0 0 "[ . 1 . 2]" 1 258 1 25 TYR QB 1 27 HIS CE1 4.704 . 5.264 4.152 3.891 4.292 . 0 0 "[ . 1 . 2]" 1 259 1 25 TYR QD 1 26 ARG H 5.152 . 5.712 3.942 3.621 4.418 . 0 0 "[ . 1 . 2]" 1 260 1 26 ARG H 1 27 HIS H 4.700 . 5.200 4.645 4.594 4.725 . 0 0 "[ . 1 . 2]" 1 261 1 26 ARG HA 1 27 HIS H 2.800 . 3.300 2.230 2.126 2.345 . 0 0 "[ . 1 . 2]" 1 262 1 26 ARG QB 1 27 HIS H 3.808 . 4.368 2.820 2.428 3.482 . 0 0 "[ . 1 . 2]" 1 263 1 26 ARG QB 1 67 LEU QD 9.138 . 9.987 4.809 4.497 5.166 . 0 0 "[ . 1 . 2]" 1 264 1 26 ARG QB 1 67 LEU QD 8.165 . 8.921 5.170 4.837 5.432 . 0 0 "[ . 1 . 2]" 1 265 1 26 ARG QD 1 43 ILE MD 7.526 . 8.198 2.501 2.010 3.511 . 0 0 "[ . 1 . 2]" 1 266 1 26 ARG QD 1 43 ILE MD 8.716 . 9.473 2.493 2.009 3.472 . 0 0 "[ . 1 . 2]" 1 267 1 27 HIS H 1 28 ALA H 4.600 . 5.100 4.368 4.174 4.456 . 0 0 "[ . 1 . 2]" 1 268 1 27 HIS HA 1 28 ALA H 2.800 . 3.300 2.215 2.183 2.250 . 0 0 "[ . 1 . 2]" 1 269 1 27 HIS HA 1 28 ALA MB 6.480 . 7.080 4.087 4.035 4.122 . 0 0 "[ . 1 . 2]" 1 270 1 27 HIS QB 1 28 ALA H 5.824 . 6.384 3.349 3.162 3.541 . 0 0 "[ . 1 . 2]" 1 271 1 27 HIS QB 1 28 ALA MB 7.795 . 8.467 4.582 4.420 4.733 . 0 0 "[ . 1 . 2]" 1 272 1 27 HIS QB 1 28 ALA MB 8.747 . 9.503 4.261 4.099 4.374 . 0 0 "[ . 1 . 2]" 1 273 1 27 HIS QB 1 28 ALA MB 8.747 . 9.503 3.304 2.820 3.840 . 0 0 "[ . 1 . 2]" 1 274 1 27 HIS QB 1 67 LEU QD 9.070 . 9.919 4.023 3.692 4.386 . 0 0 "[ . 1 . 2]" 1 275 1 27 HIS QB 1 67 LEU QD 8.014 . 8.770 4.706 4.075 5.167 . 0 0 "[ . 1 . 2]" 1 276 1 27 HIS HD2 1 28 ALA MB 7.320 . 7.920 5.916 5.530 6.182 . 0 0 "[ . 1 . 2]" 1 277 1 28 ALA H 1 29 ARG H 5.100 . 5.600 4.487 4.095 4.697 . 0 0 "[ . 1 . 2]" 1 278 1 28 ALA HA 1 29 ARG H 2.800 . 3.300 2.172 2.113 2.292 . 0 0 "[ . 1 . 2]" 1 279 1 28 ALA HA 1 30 SER H 4.500 . 5.000 3.578 3.350 3.908 . 0 0 "[ . 1 . 2]" 1 280 1 28 ALA HA 1 46 LEU HA 5.000 . 5.500 3.691 3.244 4.143 . 0 0 "[ . 1 . 2]" 1 281 1 28 ALA HA 1 46 LEU QD 7.695 . 8.370 5.105 4.395 5.714 . 0 0 "[ . 1 . 2]" 1 282 1 28 ALA MB 1 29 ARG H 4.920 . 5.520 3.208 2.677 3.584 . 0 0 "[ . 1 . 2]" 1 283 1 28 ALA MB 1 29 ARG HA 6.360 . 6.960 4.257 4.059 4.436 . 0 0 "[ . 1 . 2]" 1 284 1 28 ALA MB 1 29 ARG QB 8.368 . 9.125 4.192 4.041 4.357 . 0 0 "[ . 1 . 2]" 1 285 1 28 ALA MB 1 29 ARG QG 7.930 . 8.602 4.766 4.188 5.782 . 0 0 "[ . 1 . 2]" 1 286 1 28 ALA MB 1 29 ARG QG 8.368 . 9.125 4.121 3.849 4.561 . 0 0 "[ . 1 . 2]" 1 287 1 28 ALA MB 1 30 SER H 5.040 . 5.640 3.778 3.197 4.178 . 0 0 "[ . 1 . 2]" 1 288 1 28 ALA MB 1 46 LEU HA 6.840 . 7.440 5.076 4.684 5.509 . 0 0 "[ . 1 . 2]" 1 289 1 28 ALA MB 1 46 LEU QD 9.882 . 10.692 5.704 5.195 6.116 . 0 0 "[ . 1 . 2]" 1 290 1 28 ALA MB 1 47 PHE HA 7.200 . 7.800 4.136 3.564 4.886 . 0 0 "[ . 1 . 2]" 1 291 1 28 ALA MB 1 48 GLY H 7.080 . 7.680 3.617 3.278 4.107 . 0 0 "[ . 1 . 2]" 1 292 1 28 ALA MB 1 48 GLY QA 5.914 . 6.586 2.265 2.038 2.701 . 0 0 "[ . 1 . 2]" 1 293 1 28 ALA MB 1 49 HIS H 6.480 . 7.080 3.423 2.876 3.877 . 0 0 "[ . 1 . 2]" 1 294 1 28 ALA MB 1 66 CYS H 7.200 . 7.800 6.114 6.042 6.247 . 0 0 "[ . 1 . 2]" 1 295 1 28 ALA MB 1 67 LEU QB 7.392 . 8.064 4.576 4.351 4.858 . 0 0 "[ . 1 . 2]" 1 296 1 28 ALA MB 1 67 LEU QD 8.748 . 9.558 1.954 1.835 2.237 . 0 0 "[ . 1 . 2]" 1 297 1 29 ARG H 1 30 SER H 2.800 . 3.300 1.937 1.640 2.201 . 0 0 "[ . 1 . 2]" 1 298 1 29 ARG H 1 46 LEU QB 3.808 . 4.368 3.005 2.401 3.437 . 0 0 "[ . 1 . 2]" 1 299 1 29 ARG H 1 46 LEU QD 7.290 . 7.965 4.164 3.638 4.619 . 0 0 "[ . 1 . 2]" 1 300 1 29 ARG H 1 67 LEU QD 7.425 . 8.100 5.338 5.147 5.595 . 0 0 "[ . 1 . 2]" 1 301 1 29 ARG HA 1 30 SER H 4.600 . 5.100 3.412 3.199 3.538 . 0 0 "[ . 1 . 2]" 1 302 1 29 ARG HA 1 46 LEU QD 7.830 . 8.505 5.047 4.743 5.434 . 0 0 "[ . 1 . 2]" 1 303 1 29 ARG QB 1 46 LEU QD 7.371 . 8.221 2.512 2.091 2.943 . 0 0 "[ . 1 . 2]" 1 304 1 29 ARG QB 1 30 SER H 5.040 . 5.600 3.173 2.778 3.585 . 0 0 "[ . 1 . 2]" 1 305 1 29 ARG QB 1 46 LEU QB 6.021 . 6.648 2.346 2.136 2.842 . 0 0 "[ . 1 . 2]" 1 306 1 29 ARG QB 1 46 LEU QD 7.409 . 8.165 2.629 2.298 3.031 . 0 0 "[ . 1 . 2]" 1 307 1 29 ARG QD 1 46 LEU QD 7.106 . 7.862 3.240 2.079 4.705 . 0 0 "[ . 1 . 2]" 1 308 1 29 ARG QG 1 30 SER H 5.600 . 6.160 4.355 3.900 4.909 . 0 0 "[ . 1 . 2]" 1 309 1 29 ARG QG 1 46 LEU QD 6.502 . 7.258 3.440 2.174 4.302 . 0 0 "[ . 1 . 2]" 1 310 1 30 SER H 1 32 ILE H 5.000 . 5.500 4.647 4.248 4.993 . 0 0 "[ . 1 . 2]" 1 311 1 30 SER H 1 46 LEU QB 5.824 . 6.384 3.074 2.566 3.592 . 0 0 "[ . 1 . 2]" 1 312 1 30 SER H 1 46 LEU QD 7.965 . 8.640 4.395 3.953 4.781 . 0 0 "[ . 1 . 2]" 1 313 1 30 SER H 1 48 GLY H 5.100 . 5.600 5.078 4.886 5.210 . 0 0 "[ . 1 . 2]" 1 314 1 30 SER QB 1 32 ILE H 4.032 . 4.592 3.201 2.535 3.600 . 0 0 "[ . 1 . 2]" 1 315 1 30 SER QB 1 46 LEU QD 7.711 . 8.467 3.859 2.939 5.100 . 0 0 "[ . 1 . 2]" 1 316 1 30 SER QB 1 47 PHE HA 5.040 . 5.600 2.642 1.855 2.984 . 0 0 "[ . 1 . 2]" 1 317 1 30 SER QB 1 47 PHE QD 5.770 . 6.397 2.485 2.167 3.611 . 0 0 "[ . 1 . 2]" 1 318 1 30 SER QB 1 48 GLY H 5.376 . 5.936 4.625 4.278 4.899 . 0 0 "[ . 1 . 2]" 1 319 1 31 HIS HA 1 32 ILE H 3.700 . 4.200 3.067 2.707 3.528 . 0 0 "[ . 1 . 2]" 1 320 1 31 HIS HA 1 65 TYR QE 5.376 . 5.936 3.197 2.493 4.311 . 0 0 "[ . 1 . 2]" 1 321 1 31 HIS QB 1 65 TYR QE 5.645 . 6.272 2.795 2.561 4.003 . 0 0 "[ . 1 . 2]" 1 322 1 31 HIS HD2 1 32 ILE MD 6.240 . 6.840 4.827 3.761 5.219 . 0 0 "[ . 1 . 2]" 1 323 1 31 HIS HD2 1 65 TYR QE 4.928 . 5.488 4.342 2.922 4.443 . 0 0 "[ . 1 . 2]" 1 324 1 31 HIS HE1 1 32 ILE MD 5.280 . 5.880 2.602 2.213 3.934 . 0 0 "[ . 1 . 2]" 1 325 1 31 HIS HE1 1 32 ILE MG 5.760 . 6.360 4.863 4.816 4.934 . 0 0 "[ . 1 . 2]" 1 326 1 32 ILE H 1 33 MET H 4.900 . 5.400 4.450 4.205 4.687 . 0 0 "[ . 1 . 2]" 1 327 1 32 ILE H 1 47 PHE HA 3.500 . 4.000 3.649 3.537 3.780 . 0 0 "[ . 1 . 2]" 1 328 1 32 ILE H 1 47 PHE QD 5.936 . 6.496 3.594 2.746 4.897 . 0 0 "[ . 1 . 2]" 1 329 1 32 ILE HA 1 33 MET H 2.700 . 3.200 2.211 2.132 2.289 . 0 0 "[ . 1 . 2]" 1 330 1 32 ILE HA 1 33 MET QB 5.264 . 5.824 4.190 3.999 4.577 . 0 0 "[ . 1 . 2]" 1 331 1 32 ILE HB 1 47 PHE QD 4.480 . 5.040 2.744 2.388 3.456 . 0 0 "[ . 1 . 2]" 1 332 1 32 ILE HB 1 47 PHE QE 5.600 . 6.160 3.103 2.652 3.894 . 0 0 "[ . 1 . 2]" 1 333 1 32 ILE MD 1 48 GLY H 7.872 . 8.546 4.675 4.184 5.694 . 0 0 "[ . 1 . 2]" 1 334 1 32 ILE MD 1 33 MET H 5.760 . 6.360 4.707 3.902 4.952 . 0 0 "[ . 1 . 2]" 1 335 1 32 ILE MD 1 47 PHE QD 7.258 . 7.930 4.234 3.407 5.334 . 0 0 "[ . 1 . 2]" 1 336 1 32 ILE QG 1 33 MET H 5.712 . 6.272 4.264 3.573 4.944 . 0 0 "[ . 1 . 2]" 1 337 1 32 ILE MG 1 33 MET H 4.560 . 5.160 2.465 2.004 3.095 . 0 0 "[ . 1 . 2]" 1 338 1 32 ILE MG 1 33 MET HA 6.480 . 7.080 4.002 3.643 4.391 . 0 0 "[ . 1 . 2]" 1 339 1 32 ILE MG 1 33 MET QB 6.586 . 7.258 3.935 3.565 4.294 . 0 0 "[ . 1 . 2]" 1 340 1 32 ILE MG 1 33 MET QG 7.258 . 7.930 4.947 4.268 5.327 . 0 0 "[ . 1 . 2]" 1 341 1 32 ILE MG 1 34 CYS H 7.200 . 7.800 4.668 3.905 5.382 . 0 0 "[ . 1 . 2]" 1 342 1 32 ILE MG 1 34 CYS HA 7.440 . 8.040 3.810 2.663 4.808 . 0 0 "[ . 1 . 2]" 1 343 1 32 ILE MG 1 47 PHE HA 6.720 . 7.320 4.836 4.129 5.611 . 0 0 "[ . 1 . 2]" 1 344 1 32 ILE MG 1 47 PHE QD 6.182 . 6.854 3.409 2.709 4.338 . 0 0 "[ . 1 . 2]" 1 345 1 32 ILE MG 1 47 PHE QE 7.795 . 8.467 3.399 2.469 4.505 . 0 0 "[ . 1 . 2]" 1 346 1 32 ILE MG 1 48 GLY H 6.960 . 7.560 4.824 4.237 5.796 . 0 0 "[ . 1 . 2]" 1 347 1 33 MET H 1 34 CYS H 5.000 . 5.500 4.536 4.456 4.598 . 0 0 "[ . 1 . 2]" 1 348 1 33 MET H 1 34 CYS HA 5.100 . 5.600 5.161 4.905 5.226 . 0 0 "[ . 1 . 2]" 1 349 1 33 MET H 1 34 CYS HA 5.677 . 6.238 4.840 4.713 4.966 . 0 0 "[ . 1 . 2]" 1 350 1 33 MET HA 1 34 CYS H 2.800 . 3.300 2.180 2.086 2.305 . 0 0 "[ . 1 . 2]" 1 351 1 33 MET HA 1 34 CYS HA 4.800 . 5.300 4.105 3.916 4.243 . 0 0 "[ . 1 . 2]" 1 352 1 33 MET HA 1 48 GLY H 3.500 . 4.000 2.618 2.287 3.599 . 0 0 "[ . 1 . 2]" 1 353 1 33 MET HA 1 49 HIS H 5.200 . 5.700 5.204 5.062 5.272 . 0 0 "[ . 1 . 2]" 1 354 1 33 MET QB 1 34 CYS H 3.920 . 4.480 3.246 2.501 3.591 . 0 0 "[ . 1 . 2]" 1 355 1 33 MET QB 1 34 CYS HA 5.733 . 6.363 3.989 3.892 4.155 . 0 0 "[ . 1 . 2]" 1 356 1 33 MET QB 1 48 GLY H 5.824 . 6.384 4.511 4.027 5.010 . 0 0 "[ . 1 . 2]" 1 357 1 33 MET ME 1 34 CYS H 6.240 . 6.840 4.241 3.732 4.602 . 0 0 "[ . 1 . 2]" 1 358 1 33 MET ME 1 48 GLY H 6.960 . 7.560 4.469 3.750 5.004 . 0 0 "[ . 1 . 2]" 1 359 1 33 MET ME 1 49 HIS H 6.960 . 7.560 3.795 3.290 4.581 . 0 0 "[ . 1 . 2]" 1 360 1 33 MET ME 1 49 HIS HD2 7.080 . 7.680 5.845 5.550 5.986 . 0 0 "[ . 1 . 2]" 1 361 1 33 MET ME 1 50 PRO HA 5.400 . 6.000 2.991 2.340 4.173 . 0 0 "[ . 1 . 2]" 1 362 1 33 MET ME 1 50 PRO QD 6.586 . 7.258 3.021 2.235 4.357 . 0 0 "[ . 1 . 2]" 1 363 1 33 MET ME 1 51 ILE H 6.600 . 7.200 4.595 3.957 5.529 . 0 0 "[ . 1 . 2]" 1 364 1 33 MET ME 1 65 TYR H 6.720 . 7.320 5.195 4.463 5.678 . 0 0 "[ . 1 . 2]" 1 365 1 33 MET ME 1 65 TYR HA 6.120 . 6.720 2.984 2.262 3.673 . 0 0 "[ . 1 . 2]" 1 366 1 33 MET ME 1 65 TYR QD 7.258 . 7.930 5.215 4.714 5.476 . 0 0 "[ . 1 . 2]" 1 367 1 33 MET ME 1 66 CYS H 6.960 . 7.560 3.768 3.285 4.205 . 0 0 "[ . 1 . 2]" 1 368 1 33 MET ME 1 67 LEU QD 6.318 . 7.128 2.984 2.116 3.935 . 0 0 "[ . 1 . 2]" 1 369 1 33 MET QG 1 34 CYS H 5.292 . 5.922 2.551 2.092 3.043 . 0 0 "[ . 1 . 2]" 1 370 1 33 MET QG 1 48 GLY H 5.600 . 6.160 4.008 3.205 4.801 . 0 0 "[ . 1 . 2]" 1 371 1 33 MET QG 1 67 LEU QD 7.711 . 8.467 4.744 4.019 5.136 . 0 0 "[ . 1 . 2]" 1 372 1 33 MET QG 1 67 LEU QD 10.338 . 11.187 4.463 3.917 4.872 . 0 0 "[ . 1 . 2]" 1 373 1 33 MET QG 1 76 LEU QD 9.223 . 9.979 5.658 4.424 6.129 . 0 0 "[ . 1 . 2]" 1 374 1 34 CYS H 1 47 PHE QB 4.704 . 5.264 2.896 2.761 3.182 . 0 0 "[ . 1 . 2]" 1 375 1 34 CYS H 1 47 PHE QD 5.488 . 6.048 4.394 3.560 4.738 . 0 0 "[ . 1 . 2]" 1 376 1 34 CYS H 1 48 GLY H 4.200 . 4.700 3.810 3.603 4.105 . 0 0 "[ . 1 . 2]" 1 377 1 34 CYS H 1 48 GLY QA 5.600 . 6.160 3.783 3.600 4.019 . 0 0 "[ . 1 . 2]" 1 378 1 34 CYS H 1 49 HIS HD2 4.800 . 5.300 3.854 3.661 4.020 . 0 0 "[ . 1 . 2]" 1 379 1 34 CYS HA 1 35 ARG H 3.000 . 3.500 2.233 2.166 2.292 . 0 0 "[ . 1 . 2]" 1 380 1 34 CYS HA 1 35 ARG QB 5.040 . 5.600 4.272 4.167 4.421 . 0 0 "[ . 1 . 2]" 1 381 1 34 CYS HA 1 35 ARG QG 5.264 . 5.824 4.333 4.135 4.553 . 0 0 "[ . 1 . 2]" 1 382 1 34 CYS HA 1 36 GLU H 4.800 . 5.300 4.204 4.045 4.324 . 0 0 "[ . 1 . 2]" 1 383 1 34 CYS HA 1 37 GLY H 5.200 . 5.700 4.465 4.276 4.657 . 0 0 "[ . 1 . 2]" 1 384 1 34 CYS HA 1 47 PHE QB 4.816 . 5.376 2.944 2.615 3.377 . 0 0 "[ . 1 . 2]" 1 385 1 34 CYS HA 1 47 PHE QD 5.376 . 5.936 2.749 2.159 3.537 . 0 0 "[ . 1 . 2]" 1 386 1 34 CYS HA 1 49 HIS HD2 4.600 . 5.100 4.730 4.689 4.792 . 0 0 "[ . 1 . 2]" 1 387 1 34 CYS QB 1 35 ARG H 5.824 . 6.384 3.434 3.253 3.544 . 0 0 "[ . 1 . 2]" 1 388 1 34 CYS QB 1 36 GLU H 5.152 . 5.712 3.360 3.205 3.491 . 0 0 "[ . 1 . 2]" 1 389 1 34 CYS QB 1 37 GLY H 4.032 . 4.592 2.606 2.329 2.843 . 0 0 "[ . 1 . 2]" 1 390 1 34 CYS QB 1 47 PHE H 5.152 . 5.712 4.479 4.192 4.656 . 0 0 "[ . 1 . 2]" 1 391 1 34 CYS QB 1 47 PHE QB 6.272 . 6.899 2.186 2.058 2.328 . 0 0 "[ . 1 . 2]" 1 392 1 34 CYS QB 1 47 PHE QD 6.648 . 7.276 3.048 2.871 3.419 . 0 0 "[ . 1 . 2]" 1 393 1 34 CYS QB 1 47 PHE QE 6.272 . 6.899 5.015 4.977 5.058 . 0 0 "[ . 1 . 2]" 1 394 1 34 CYS QB 1 47 PHE QE 6.670 . 7.344 2.010 1.954 2.099 . 0 0 "[ . 1 . 2]" 1 395 1 34 CYS QB 1 49 HIS HD2 5.488 . 6.048 2.011 1.955 2.101 . 0 0 "[ . 1 . 2]" 1 396 1 35 ARG H 1 36 GLU H 3.200 . 3.700 2.729 2.603 2.823 . 0 0 "[ . 1 . 2]" 1 397 1 35 ARG H 1 47 PHE QD 5.488 . 6.048 3.876 3.221 4.624 . 0 0 "[ . 1 . 2]" 1 398 1 35 ARG HA 1 36 GLU H 3.300 . 3.800 3.443 3.412 3.467 . 0 0 "[ . 1 . 2]" 1 399 1 35 ARG HA 1 36 GLU HA 4.400 . 4.900 4.512 4.488 4.533 . 0 0 "[ . 1 . 2]" 1 400 1 35 ARG QB 1 36 GLU H 4.368 . 4.928 3.600 3.456 3.662 . 0 0 "[ . 1 . 2]" 1 401 1 35 ARG QB 1 36 GLU QG 5.519 . 6.147 4.058 3.877 4.207 . 0 0 "[ . 1 . 2]" 1 402 1 35 ARG QB 1 37 GLY H 5.600 . 6.160 4.959 4.890 5.015 . 0 0 "[ . 1 . 2]" 1 403 1 35 ARG QG 1 36 GLU H 4.816 . 5.376 2.365 2.005 2.474 . 0 0 "[ . 1 . 2]" 1 404 1 35 ARG QG 1 36 GLU HA 3.808 . 4.368 3.553 3.509 3.613 . 0 0 "[ . 1 . 2]" 1 405 1 35 ARG QG 1 36 GLU QG 5.394 . 6.021 2.150 2.107 2.327 . 0 0 "[ . 1 . 2]" 1 406 1 36 GLU H 1 37 GLY H 2.900 . 3.400 2.236 2.114 2.347 . 0 0 "[ . 1 . 2]" 1 407 1 36 GLU H 1 40 CYS H 5.520 . 6.081 4.396 4.269 4.460 . 0 0 "[ . 1 . 2]" 1 408 1 36 GLU H 1 40 CYS HA 4.800 . 5.300 4.911 4.856 5.003 . 0 0 "[ . 1 . 2]" 1 409 1 36 GLU H 1 40 CYS QB 5.264 . 5.824 3.402 3.097 3.629 . 0 0 "[ . 1 . 2]" 1 410 1 36 GLU H 1 49 HIS HD2 4.900 . 5.400 4.907 4.762 4.980 . 0 0 "[ . 1 . 2]" 1 411 1 36 GLU HA 1 37 GLY H 3.300 . 3.800 3.314 3.261 3.350 . 0 0 "[ . 1 . 2]" 1 412 1 36 GLU HA 1 39 ASN H 4.900 . 5.400 4.738 4.644 4.879 . 0 0 "[ . 1 . 2]" 1 413 1 36 GLU HA 1 39 ASN QB 5.712 . 6.272 3.850 3.677 4.087 . 0 0 "[ . 1 . 2]" 1 414 1 36 GLU HA 1 40 CYS H 5.000 . 5.500 4.822 4.429 5.013 . 0 0 "[ . 1 . 2]" 1 415 1 36 GLU QB 1 37 GLY H 4.816 . 5.376 3.380 3.277 3.495 . 0 0 "[ . 1 . 2]" 1 416 1 36 GLU QB 1 39 ASN H 5.264 . 5.824 3.594 3.145 3.911 . 0 0 "[ . 1 . 2]" 1 417 1 36 GLU QB 1 39 ASN QB 6.147 . 6.774 2.662 2.237 3.214 . 0 0 "[ . 1 . 2]" 1 418 1 36 GLU QB 1 40 CYS H 4.592 . 5.152 2.736 2.551 2.889 . 0 0 "[ . 1 . 2]" 1 419 1 36 GLU QB 1 40 CYS HA 4.704 . 5.264 2.343 2.203 2.504 . 0 0 "[ . 1 . 2]" 1 420 1 36 GLU QB 1 40 CYS QB 5.268 . 5.896 2.149 2.079 2.222 . 0 0 "[ . 1 . 2]" 1 421 1 36 GLU QB 1 41 THR H 5.488 . 6.048 4.223 4.015 4.400 . 0 0 "[ . 1 . 2]" 1 422 1 36 GLU QB 1 49 HIS HD2 5.936 . 6.496 5.006 4.627 5.318 . 0 0 "[ . 1 . 2]" 1 423 1 36 GLU QG 1 37 GLY H 5.040 . 5.600 4.541 4.507 4.594 . 0 0 "[ . 1 . 2]" 1 424 1 36 GLU QG 1 40 CYS H 5.264 . 5.824 4.641 4.408 4.749 . 0 0 "[ . 1 . 2]" 1 425 1 36 GLU QG 1 40 CYS HA 4.928 . 5.488 3.451 2.821 4.185 . 0 0 "[ . 1 . 2]" 1 426 1 36 GLU QG 1 40 CYS QB 5.519 . 6.147 3.974 3.645 4.319 . 0 0 "[ . 1 . 2]" 1 427 1 37 GLY H 1 38 ALA H 4.500 . 5.000 4.563 4.530 4.588 . 0 0 "[ . 1 . 2]" 1 428 1 37 GLY H 1 38 ALA MB 7.320 . 7.920 5.898 5.870 5.929 . 0 0 "[ . 1 . 2]" 1 429 1 37 GLY H 1 39 ASN H 5.100 . 5.600 4.584 4.409 4.743 . 0 0 "[ . 1 . 2]" 1 430 1 37 GLY H 1 40 CYS H 4.500 . 5.000 4.444 4.237 4.567 . 0 0 "[ . 1 . 2]" 1 431 1 37 GLY H 1 40 CYS QB 5.600 . 6.160 3.543 3.173 3.793 . 0 0 "[ . 1 . 2]" 1 432 1 37 GLY QA 1 38 ALA H 3.136 . 3.696 2.112 2.098 2.137 . 0 0 "[ . 1 . 2]" 1 433 1 37 GLY QA 1 38 ALA HA 5.376 . 5.936 4.015 3.994 4.032 . 0 0 "[ . 1 . 2]" 1 434 1 37 GLY QA 1 38 ALA MB 6.586 . 7.258 3.762 3.737 3.781 . 0 0 "[ . 1 . 2]" 1 435 1 37 GLY QA 1 39 ASN H 5.152 . 5.712 3.356 3.263 3.445 . 0 0 "[ . 1 . 2]" 1 436 1 37 GLY QA 1 49 HIS QB 6.147 . 6.774 4.451 4.052 4.796 . 0 0 "[ . 1 . 2]" 1 437 1 37 GLY QA 1 50 PRO QG 5.896 . 6.523 3.074 2.742 3.585 . 0 0 "[ . 1 . 2]" 1 438 1 38 ALA H 1 39 ASN H 3.100 . 3.600 2.699 2.544 2.829 . 0 0 "[ . 1 . 2]" 1 439 1 38 ALA H 1 50 PRO QD 5.600 . 6.160 2.812 2.582 3.110 . 0 0 "[ . 1 . 2]" 1 440 1 38 ALA H 1 50 PRO QG 5.264 . 5.824 2.726 2.467 3.293 . 0 0 "[ . 1 . 2]" 1 441 1 38 ALA HA 1 39 ASN H 3.500 . 4.000 3.355 3.254 3.423 . 0 0 "[ . 1 . 2]" 1 442 1 38 ALA HA 1 40 CYS H 4.700 . 5.200 3.547 3.283 3.758 . 0 0 "[ . 1 . 2]" 1 443 1 38 ALA HA 1 40 CYS QB 5.936 . 6.496 3.871 3.684 4.006 . 0 0 "[ . 1 . 2]" 1 444 1 38 ALA HA 1 49 HIS QB 5.712 . 6.272 3.106 2.553 3.845 . 0 0 "[ . 1 . 2]" 1 445 1 38 ALA HA 1 49 HIS HD2 4.700 . 5.200 4.584 4.418 4.728 . 0 0 "[ . 1 . 2]" 1 446 1 38 ALA HA 1 50 PRO QD 5.040 . 5.600 3.030 2.475 3.404 . 0 0 "[ . 1 . 2]" 1 447 1 38 ALA HA 1 50 PRO QG 5.600 . 6.160 4.071 3.830 4.628 . 0 0 "[ . 1 . 2]" 1 448 1 38 ALA MB 1 39 ASN H 4.920 . 5.520 3.368 3.234 3.515 . 0 0 "[ . 1 . 2]" 1 449 1 38 ALA MB 1 39 ASN HA 6.840 . 7.440 4.279 4.112 4.355 . 0 0 "[ . 1 . 2]" 1 450 1 38 ALA MB 1 39 ASN QB 7.526 . 8.198 4.767 4.051 5.036 . 0 0 "[ . 1 . 2]" 1 451 1 38 ALA MB 1 39 ASN QD 7.795 . 8.467 4.422 3.948 5.840 . 0 0 "[ . 1 . 2]" 1 452 1 38 ALA MB 1 40 CYS H 6.720 . 7.320 4.510 4.403 4.595 . 0 0 "[ . 1 . 2]" 1 453 1 38 ALA MB 1 49 HIS HA 7.440 . 8.040 4.617 4.124 5.080 . 0 0 "[ . 1 . 2]" 1 454 1 38 ALA MB 1 49 HIS QB 7.930 . 8.602 3.911 3.572 4.356 . 0 0 "[ . 1 . 2]" 1 455 1 38 ALA MB 1 49 HIS HD2 6.600 . 7.200 5.543 5.516 5.594 . 0 0 "[ . 1 . 2]" 1 456 1 38 ALA MB 1 50 PRO HA 6.480 . 7.080 4.764 4.615 4.981 . 0 0 "[ . 1 . 2]" 1 457 1 38 ALA MB 1 50 PRO QB 6.586 . 7.258 3.219 2.264 3.883 . 0 0 "[ . 1 . 2]" 1 458 1 38 ALA MB 1 50 PRO QD 7.123 . 7.795 2.640 2.156 3.071 . 0 0 "[ . 1 . 2]" 1 459 1 38 ALA MB 1 50 PRO QG 5.779 . 6.451 2.387 2.148 2.887 . 0 0 "[ . 1 . 2]" 1 460 1 39 ASN H 1 40 CYS H 2.700 . 3.200 2.276 2.160 2.385 . 0 0 "[ . 1 . 2]" 1 461 1 39 ASN H 1 40 CYS HA 4.700 . 5.200 4.792 4.736 4.825 . 0 0 "[ . 1 . 2]" 1 462 1 39 ASN H 1 40 CYS QB 5.376 . 5.936 3.880 3.788 3.959 . 0 0 "[ . 1 . 2]" 1 463 1 39 ASN HA 1 40 CYS H 4.400 . 4.900 3.409 3.375 3.446 . 0 0 "[ . 1 . 2]" 1 464 1 39 ASN QB 1 40 CYS H 3.696 . 4.256 3.239 3.023 3.342 . 0 0 "[ . 1 . 2]" 1 465 1 39 ASN QB 1 41 THR MG 7.930 . 8.602 4.784 4.431 5.385 . 0 0 "[ . 1 . 2]" 1 466 1 40 CYS H 1 41 THR H 4.700 . 5.200 4.593 4.536 4.665 . 0 0 "[ . 1 . 2]" 1 467 1 40 CYS HA 1 41 THR H 2.700 . 3.200 2.260 2.191 2.340 . 0 0 "[ . 1 . 2]" 1 468 1 40 CYS HA 1 41 THR MG 5.760 . 6.360 3.906 3.753 4.014 . 0 0 "[ . 1 . 2]" 1 469 1 40 CYS HA 1 42 ARG H 4.400 . 4.900 3.819 3.682 4.010 . 0 0 "[ . 1 . 2]" 1 470 1 40 CYS QB 1 41 THR H 5.488 . 6.048 3.839 3.625 3.951 . 0 0 "[ . 1 . 2]" 1 471 1 40 CYS QB 1 42 ARG H 5.600 . 6.160 3.678 3.522 3.778 . 0 0 "[ . 1 . 2]" 1 472 1 41 THR H 1 42 ARG H 2.900 . 3.400 2.683 2.400 2.766 . 0 0 "[ . 1 . 2]" 1 473 1 41 THR H 1 42 ARG HA 4.900 . 5.400 4.889 4.528 4.975 . 0 0 "[ . 1 . 2]" 1 474 1 41 THR H 1 42 ARG QB 5.264 . 5.824 3.938 3.527 4.129 . 0 0 "[ . 1 . 2]" 1 475 1 41 THR HA 1 42 ARG H 3.200 . 3.700 3.227 3.149 3.276 . 0 0 "[ . 1 . 2]" 1 476 1 41 THR HA 1 43 ILE MD 6.480 . 7.080 5.008 4.671 5.138 . 0 0 "[ . 1 . 2]" 1 477 1 41 THR MG 1 42 ARG H 6.480 . 7.080 4.422 4.393 4.469 . 0 0 "[ . 1 . 2]" 1 478 1 41 THR MG 1 42 ARG QB 8.333 . 9.005 5.427 5.258 5.560 . 0 0 "[ . 1 . 2]" 1 479 1 41 THR MG 1 43 ILE MD 8.496 . 9.216 5.896 5.645 5.934 . 0 0 "[ . 1 . 2]" 1 480 1 42 ARG H 1 43 ILE H 5.000 . 5.500 4.391 4.282 4.482 . 0 0 "[ . 1 . 2]" 1 481 1 42 ARG H 1 45 CYS QB 5.376 . 5.936 4.221 3.838 4.661 . 0 0 "[ . 1 . 2]" 1 482 1 42 ARG HA 1 43 ILE H 2.800 . 3.300 2.153 2.076 2.240 . 0 0 "[ . 1 . 2]" 1 483 1 42 ARG HA 1 43 ILE MD 6.120 . 6.720 4.804 4.527 5.101 . 0 0 "[ . 1 . 2]" 1 484 1 42 ARG HA 1 44 ASP H 4.800 . 5.300 3.500 3.210 3.751 . 0 0 "[ . 1 . 2]" 1 485 1 42 ARG QB 1 45 CYS H 4.964 . 5.594 2.376 2.081 2.809 . 0 0 "[ . 1 . 2]" 1 486 1 42 ARG QB 1 45 CYS HA 5.481 . 6.111 3.403 3.077 3.600 . 0 0 "[ . 1 . 2]" 1 487 1 42 ARG QB 1 46 LEU QD 8.713 . 9.562 4.888 4.803 4.961 . 0 0 "[ . 1 . 2]" 1 488 1 42 ARG QB 1 45 CYS H 4.368 . 4.928 3.330 2.978 3.678 . 0 0 "[ . 1 . 2]" 1 489 1 42 ARG QB 1 49 HIS CE1 4.592 . 5.152 4.261 4.185 4.338 . 0 0 "[ . 1 . 2]" 1 490 1 42 ARG QD 1 44 ASP H 5.824 . 6.384 4.378 3.889 4.694 . 0 0 "[ . 1 . 2]" 1 491 1 42 ARG QD 1 45 CYS H 5.040 . 5.600 4.122 3.304 4.570 . 0 0 "[ . 1 . 2]" 1 492 1 42 ARG QD 1 45 CYS HA 5.040 . 5.600 3.739 2.492 4.429 . 0 0 "[ . 1 . 2]" 1 493 1 42 ARG QG 1 43 ILE H 4.704 . 5.264 3.192 2.902 3.413 . 0 0 "[ . 1 . 2]" 1 494 1 42 ARG QG 1 44 ASP H 5.040 . 5.600 2.360 2.172 2.536 . 0 0 "[ . 1 . 2]" 1 495 1 42 ARG QG 1 45 CYS H 5.152 . 5.712 2.438 2.105 2.914 . 0 0 "[ . 1 . 2]" 1 496 1 42 ARG QG 1 45 CYS HA 4.928 . 5.488 3.587 3.201 3.819 . 0 0 "[ . 1 . 2]" 1 497 1 42 ARG QG 1 46 LEU QD 7.711 . 8.467 5.155 5.111 5.209 . 0 0 "[ . 1 . 2]" 1 498 1 43 ILE H 1 44 ASP H 3.700 . 4.200 2.553 2.326 2.747 . 0 0 "[ . 1 . 2]" 1 499 1 43 ILE H 1 45 CYS H 4.800 . 5.300 4.388 4.271 4.582 . 0 0 "[ . 1 . 2]" 1 500 1 43 ILE HA 1 44 ASP H 4.600 . 5.100 3.501 3.475 3.533 . 0 0 "[ . 1 . 2]" 1 501 1 43 ILE HA 1 45 CYS H 5.000 . 5.500 3.701 3.538 3.779 . 0 0 "[ . 1 . 2]" 1 502 1 43 ILE HB 1 44 ASP H 4.200 . 4.700 3.003 2.902 3.313 . 0 0 "[ . 1 . 2]" 1 503 1 43 ILE MD 1 44 ASP H 7.200 . 7.800 4.781 4.647 4.870 . 0 0 "[ . 1 . 2]" 1 504 1 43 ILE MD 1 45 CYS H 7.200 . 7.800 5.221 5.052 5.351 . 0 0 "[ . 1 . 2]" 1 505 1 43 ILE MD 1 45 CYS QB 7.392 . 8.064 5.474 5.292 5.556 . 0 0 "[ . 1 . 2]" 1 506 1 43 ILE QG 1 44 ASP H 5.600 . 6.160 4.299 4.158 4.532 . 0 0 "[ . 1 . 2]" 1 507 1 43 ILE MG 1 44 ASP H 4.560 . 5.160 3.583 3.383 3.760 . 0 0 "[ . 1 . 2]" 1 508 1 43 ILE MG 1 44 ASP HA 6.240 . 6.840 3.679 3.564 3.840 . 0 0 "[ . 1 . 2]" 1 509 1 43 ILE MG 1 44 ASP QB 6.720 . 7.392 4.207 3.724 4.836 . 0 0 "[ . 1 . 2]" 1 510 1 43 ILE MG 1 45 CYS H 6.600 . 7.200 4.750 4.640 4.933 . 0 0 "[ . 1 . 2]" 1 511 1 44 ASP H 1 45 CYS H 3.000 . 3.500 3.016 2.813 3.064 . 0 0 "[ . 1 . 2]" 1 512 1 44 ASP H 1 45 CYS HA 5.200 . 5.700 5.201 4.922 5.302 . 0 0 "[ . 1 . 2]" 1 513 1 44 ASP H 1 45 CYS QB 5.376 . 5.936 4.236 3.709 4.522 . 0 0 "[ . 1 . 2]" 1 514 1 44 ASP HA 1 45 CYS H 4.300 . 4.800 3.407 3.098 3.517 . 0 0 "[ . 1 . 2]" 1 515 1 44 ASP QB 1 45 CYS H 5.152 . 5.712 3.665 3.448 4.167 . 0 0 "[ . 1 . 2]" 1 516 1 44 ASP QB 1 46 LEU QD 8.921 . 9.677 4.429 3.634 4.947 . 0 0 "[ . 1 . 2]" 1 517 1 45 CYS H 1 46 LEU H 4.700 . 5.200 4.429 4.313 4.558 . 0 0 "[ . 1 . 2]" 1 518 1 45 CYS H 1 49 HIS CE1 3.900 . 4.400 4.306 4.149 4.422 0.022 1 0 "[ . 1 . 2]" 1 519 1 45 CYS HA 1 46 LEU H 2.600 . 3.100 2.071 2.009 2.184 . 0 0 "[ . 1 . 2]" 1 520 1 45 CYS HA 1 46 LEU QB 5.152 . 5.712 4.390 4.129 4.607 . 0 0 "[ . 1 . 2]" 1 521 1 45 CYS HA 1 46 LEU QD 7.695 . 8.370 3.260 2.537 3.883 . 0 0 "[ . 1 . 2]" 1 522 1 45 CYS HA 1 46 LEU HG 4.400 . 4.900 3.889 2.769 4.475 . 0 0 "[ . 1 . 2]" 1 523 1 45 CYS HA 1 47 PHE H 4.300 . 4.800 3.634 3.288 4.004 . 0 0 "[ . 1 . 2]" 1 524 1 45 CYS HA 1 49 HIS CE1 4.500 . 5.000 4.900 4.745 4.995 . 0 0 "[ . 1 . 2]" 1 525 1 45 CYS QB 1 46 LEU H 5.712 . 6.272 3.468 2.970 3.910 . 0 0 "[ . 1 . 2]" 1 526 1 45 CYS QB 1 47 PHE H 5.824 . 6.384 3.206 2.332 4.516 . 0 0 "[ . 1 . 2]" 1 527 1 45 CYS QB 1 49 HIS CE1 3.696 . 4.256 2.458 2.231 2.781 . 0 0 "[ . 1 . 2]" 1 528 1 46 LEU H 1 47 PHE QD 6.944 . 7.504 3.944 2.927 4.638 . 0 0 "[ . 1 . 2]" 1 529 1 46 LEU HA 1 47 PHE H 4.500 . 5.000 3.140 2.953 3.307 . 0 0 "[ . 1 . 2]" 1 530 1 46 LEU QB 1 47 PHE H 5.264 . 5.824 3.616 3.417 3.876 . 0 0 "[ . 1 . 2]" 1 531 1 46 LEU QB 1 47 PHE QB 7.025 . 7.652 5.042 4.722 5.275 . 0 0 "[ . 1 . 2]" 1 532 1 46 LEU QD 1 47 PHE H 7.830 . 8.505 4.211 4.022 4.313 . 0 0 "[ . 1 . 2]" 1 533 1 46 LEU QD 1 47 PHE QD 9.374 . 10.130 4.930 4.113 5.664 . 0 0 "[ . 1 . 2]" 1 534 1 46 LEU QD 1 47 PHE QE 9.072 . 9.828 5.131 3.927 6.016 . 0 0 "[ . 1 . 2]" 1 535 1 46 LEU HG 1 47 PHE H 4.900 . 5.400 4.821 4.486 4.949 . 0 0 "[ . 1 . 2]" 1 536 1 47 PHE H 1 48 GLY H 4.500 . 5.000 4.476 2.887 4.584 . 0 0 "[ . 1 . 2]" 1 537 1 47 PHE H 1 49 HIS CE1 4.000 . 4.500 4.143 3.958 4.261 . 0 0 "[ . 1 . 2]" 1 538 1 47 PHE HA 1 48 GLY H 3.900 . 4.400 2.389 2.258 3.432 . 0 0 "[ . 1 . 2]" 1 539 1 47 PHE QB 1 48 GLY H 4.816 . 5.376 2.450 2.189 2.569 . 0 0 "[ . 1 . 2]" 1 540 1 47 PHE QD 1 48 GLY H 6.048 . 6.608 3.922 3.632 4.327 . 0 0 "[ . 1 . 2]" 1 541 1 48 GLY H 1 49 HIS H 5.000 . 5.500 4.386 3.273 4.527 . 0 0 "[ . 1 . 2]" 1 542 1 48 GLY QA 1 49 HIS H 3.248 . 3.808 2.097 2.057 2.171 . 0 0 "[ . 1 . 2]" 1 543 1 48 GLY QA 1 49 HIS HA 5.242 . 5.872 2.026 1.947 2.089 . 0 0 "[ . 1 . 2]" 1 544 1 48 GLY QA 1 49 HIS QB 6.899 . 7.526 4.323 4.227 4.465 . 0 0 "[ . 1 . 2]" 1 545 1 48 GLY QA 1 49 HIS QB 7.775 . 8.482 2.936 2.545 3.215 . 0 0 "[ . 1 . 2]" 1 546 1 48 GLY QA 1 67 LEU QD 7.560 . 8.316 2.620 2.057 3.238 . 0 0 "[ . 1 . 2]" 1 547 1 49 HIS H 1 67 LEU QD 5.400 . 6.075 3.148 2.272 3.908 . 0 0 "[ . 1 . 2]" 1 548 1 49 HIS HA 1 50 PRO HA 5.000 . 5.500 4.416 4.334 4.496 . 0 0 "[ . 1 . 2]" 1 549 1 49 HIS HA 1 50 PRO QD 4.704 . 5.264 2.031 1.952 2.095 . 0 0 "[ . 1 . 2]" 1 550 1 49 HIS HA 1 50 PRO QG 4.704 . 5.264 3.932 3.606 4.041 . 0 0 "[ . 1 . 2]" 1 551 1 49 HIS QB 1 50 PRO QD 5.645 . 6.272 2.993 2.562 3.311 . 0 0 "[ . 1 . 2]" 1 552 1 49 HIS QB 1 50 PRO QG 5.770 . 6.397 4.591 4.371 4.661 . 0 0 "[ . 1 . 2]" 1 553 1 50 PRO HA 1 51 ILE H 2.800 . 3.300 2.315 2.211 2.435 . 0 0 "[ . 1 . 2]" 1 554 1 50 PRO HA 1 51 ILE HA 5.200 . 5.700 4.503 4.395 4.573 . 0 0 "[ . 1 . 2]" 1 555 1 50 PRO HA 1 51 ILE HB 4.900 . 5.400 4.493 4.319 4.702 . 0 0 "[ . 1 . 2]" 1 556 1 50 PRO HA 1 51 ILE MD 7.320 . 7.920 3.480 2.264 5.030 . 0 0 "[ . 1 . 2]" 1 557 1 50 PRO HA 1 51 ILE QG 4.928 . 5.488 3.904 3.150 4.469 . 0 0 "[ . 1 . 2]" 1 558 1 50 PRO HA 1 67 LEU QD 7.290 . 7.965 4.045 2.789 5.245 . 0 0 "[ . 1 . 2]" 1 559 1 50 PRO QB 1 51 ILE H 4.928 . 5.488 2.667 2.477 2.937 . 0 0 "[ . 1 . 2]" 1 560 1 50 PRO QB 1 51 ILE HA 5.600 . 6.160 4.300 4.003 4.529 . 0 0 "[ . 1 . 2]" 1 561 1 50 PRO QG 1 51 ILE H 5.376 . 5.936 4.313 4.116 4.484 . 0 0 "[ . 1 . 2]" 1 562 1 50 PRO QG 1 51 ILE H 6.010 . 6.640 4.032 3.906 4.147 . 0 0 "[ . 1 . 2]" 1 563 1 51 ILE H 1 52 ASN H 5.150 . 5.711 3.675 3.600 3.751 . 0 0 "[ . 1 . 2]" 1 564 1 51 ILE H 1 53 GLU QB 5.376 . 5.936 4.850 4.794 4.934 . 0 0 "[ . 1 . 2]" 1 565 1 51 ILE H 1 53 GLU QB 6.010 . 6.640 4.263 3.589 4.713 . 0 0 "[ . 1 . 2]" 1 566 1 51 ILE H 1 67 LEU QD 7.155 . 7.830 4.862 4.196 5.335 . 0 0 "[ . 1 . 2]" 1 567 1 51 ILE H 1 68 PHE HA 5.000 . 5.500 4.130 3.371 4.803 . 0 0 "[ . 1 . 2]" 1 568 1 51 ILE HA 1 52 ASN H 2.700 . 3.200 2.269 2.210 2.322 . 0 0 "[ . 1 . 2]" 1 569 1 51 ILE HA 1 52 ASN QB 5.824 . 6.384 4.251 4.032 4.476 . 0 0 "[ . 1 . 2]" 1 570 1 51 ILE HB 1 53 GLU H 5.100 . 5.600 4.078 3.720 4.530 . 0 0 "[ . 1 . 2]" 1 571 1 51 ILE HB 1 67 LEU HA 4.600 . 5.100 4.464 3.993 4.721 . 0 0 "[ . 1 . 2]" 1 572 1 51 ILE HB 1 68 PHE HA 4.500 . 5.000 3.229 2.379 3.823 . 0 0 "[ . 1 . 2]" 1 573 1 51 ILE HB 1 69 ARG HE 5.100 . 5.600 4.273 3.598 4.923 . 0 0 "[ . 1 . 2]" 1 574 1 51 ILE MD 1 52 ASN H 7.200 . 7.800 4.952 3.845 5.193 . 0 0 "[ . 1 . 2]" 1 575 1 51 ILE MD 1 67 LEU H 7.440 . 8.040 4.772 4.319 6.247 . 0 0 "[ . 1 . 2]" 1 576 1 51 ILE MD 1 67 LEU HA 6.960 . 7.560 3.131 2.059 4.476 . 0 0 "[ . 1 . 2]" 1 577 1 51 ILE MD 1 67 LEU QB 6.317 . 6.989 2.281 1.983 3.548 . 0 0 "[ . 1 . 2]" 1 578 1 51 ILE MD 1 67 LEU QD 8.424 . 9.234 2.326 2.012 3.044 . 0 0 "[ . 1 . 2]" 1 579 1 51 ILE MD 1 68 PHE H 7.440 . 8.040 4.379 3.300 6.218 . 0 0 "[ . 1 . 2]" 1 580 1 51 ILE MD 1 68 PHE QD 7.526 . 8.198 4.138 2.498 5.606 . 0 0 "[ . 1 . 2]" 1 581 1 51 ILE MD 1 69 ARG HE 6.120 . 6.720 5.138 4.705 5.222 . 0 0 "[ . 1 . 2]" 1 582 1 51 ILE QG 1 67 LEU QD 10.491 . 11.373 3.358 2.549 3.765 . 0 0 "[ . 1 . 2]" 1 583 1 51 ILE QG 1 67 LEU QD 7.106 . 7.862 3.442 2.568 3.923 . 0 0 "[ . 1 . 2]" 1 584 1 51 ILE MG 1 52 ASN H 4.440 . 5.040 2.426 2.232 2.650 . 0 0 "[ . 1 . 2]" 1 585 1 51 ILE MG 1 52 ASN HA 6.480 . 7.080 4.015 3.853 4.189 . 0 0 "[ . 1 . 2]" 1 586 1 51 ILE MG 1 53 GLU H 4.560 . 5.160 3.469 3.114 3.782 . 0 0 "[ . 1 . 2]" 1 587 1 51 ILE MG 1 53 GLU HA 6.480 . 7.080 4.206 3.968 4.599 . 0 0 "[ . 1 . 2]" 1 588 1 51 ILE MG 1 53 GLU QB 5.510 . 6.182 2.251 2.047 2.786 . 0 0 "[ . 1 . 2]" 1 589 1 51 ILE MG 1 53 GLU QG 5.914 . 6.586 3.278 2.344 4.002 . 0 0 "[ . 1 . 2]" 1 590 1 51 ILE MG 1 67 LEU QD 9.720 . 10.530 4.748 4.263 4.961 . 0 0 "[ . 1 . 2]" 1 591 1 51 ILE MG 1 68 PHE HA 7.200 . 7.800 4.164 3.658 4.521 . 0 0 "[ . 1 . 2]" 1 592 1 51 ILE MG 1 68 PHE QD 6.854 . 7.526 4.031 2.703 5.111 . 0 0 "[ . 1 . 2]" 1 593 1 51 ILE MG 1 69 ARG HE 5.520 . 6.120 4.656 4.617 4.699 . 0 0 "[ . 1 . 2]" 1 594 1 52 ASN H 1 53 GLU H 4.600 . 5.100 3.950 3.813 4.094 . 0 0 "[ . 1 . 2]" 1 595 1 52 ASN HA 1 53 GLU H 2.800 . 3.300 2.352 2.271 2.431 . 0 0 "[ . 1 . 2]" 1 596 1 52 ASN QB 1 53 GLU H 5.264 . 5.824 4.033 3.865 4.119 . 0 0 "[ . 1 . 2]" 1 597 1 53 GLU H 1 54 ASP H 4.600 . 5.100 4.352 4.271 4.423 . 0 0 "[ . 1 . 2]" 1 598 1 53 GLU H 1 68 PHE QB 5.600 . 6.160 4.620 4.138 5.005 . 0 0 "[ . 1 . 2]" 1 599 1 53 GLU H 1 69 ARG H 4.300 . 4.800 3.091 2.862 3.342 . 0 0 "[ . 1 . 2]" 1 600 1 53 GLU H 1 69 ARG QB 4.144 . 4.704 3.549 2.888 3.766 . 0 0 "[ . 1 . 2]" 1 601 1 53 GLU H 1 69 ARG HE 4.800 . 5.300 3.427 3.130 3.723 . 0 0 "[ . 1 . 2]" 1 602 1 53 GLU HA 1 54 ASP H 2.600 . 3.100 2.341 2.238 2.436 . 0 0 "[ . 1 . 2]" 1 603 1 53 GLU QB 1 54 ASP H 3.808 . 4.368 3.150 2.618 3.479 . 0 0 "[ . 1 . 2]" 1 604 1 53 GLU QB 1 55 CYS H 5.712 . 6.272 5.098 4.846 5.172 . 0 0 "[ . 1 . 2]" 1 605 1 53 GLU QB 1 68 PHE H 5.824 . 6.384 5.050 4.668 5.260 . 0 0 "[ . 1 . 2]" 1 606 1 53 GLU QG 1 54 ASP H 3.808 . 4.368 2.834 2.215 3.556 . 0 0 "[ . 1 . 2]" 1 607 1 54 ASP H 1 55 CYS H 4.800 . 5.300 4.435 4.308 4.598 . 0 0 "[ . 1 . 2]" 1 608 1 54 ASP HA 1 55 CYS H 2.800 . 3.300 2.145 2.068 2.207 . 0 0 "[ . 1 . 2]" 1 609 1 54 ASP HA 1 55 CYS QB 5.488 . 6.048 4.044 3.954 4.145 . 0 0 "[ . 1 . 2]" 1 610 1 54 ASP HA 1 68 PHE QB 5.488 . 6.048 3.496 3.239 3.806 . 0 0 "[ . 1 . 2]" 1 611 1 54 ASP HA 1 69 ARG H 4.400 . 4.900 3.438 3.148 3.936 . 0 0 "[ . 1 . 2]" 1 612 1 54 ASP HA 1 69 ARG QB 4.368 . 4.928 3.376 3.113 3.781 . 0 0 "[ . 1 . 2]" 1 613 1 54 ASP QB 1 55 CYS H 5.264 . 5.824 3.767 3.332 3.953 . 0 0 "[ . 1 . 2]" 1 614 1 55 CYS H 1 56 ARG H 5.100 . 5.600 4.583 4.549 4.617 . 0 0 "[ . 1 . 2]" 1 615 1 55 CYS H 1 58 GLY H 4.900 . 5.400 4.698 4.513 4.896 . 0 0 "[ . 1 . 2]" 1 616 1 55 CYS H 1 68 PHE HA 4.900 . 5.400 4.785 4.632 4.938 . 0 0 "[ . 1 . 2]" 1 617 1 55 CYS H 1 68 PHE QB 4.928 . 5.488 2.726 2.451 3.047 . 0 0 "[ . 1 . 2]" 1 618 1 55 CYS H 1 68 PHE QD 6.720 . 7.280 4.386 3.762 5.019 . 0 0 "[ . 1 . 2]" 1 619 1 55 CYS H 1 69 ARG H 4.500 . 5.000 3.649 3.441 3.966 . 0 0 "[ . 1 . 2]" 1 620 1 55 CYS H 1 69 ARG HA 4.900 . 5.400 4.904 4.794 4.968 . 0 0 "[ . 1 . 2]" 1 621 1 55 CYS H 1 69 ARG QB 5.152 . 5.712 4.140 3.899 4.399 . 0 0 "[ . 1 . 2]" 1 622 1 55 CYS H 1 70 HIS H 5.200 . 5.700 5.185 5.090 5.261 . 0 0 "[ . 1 . 2]" 1 623 1 55 CYS HA 1 56 ARG H 3.200 . 3.700 2.133 2.066 2.193 . 0 0 "[ . 1 . 2]" 1 624 1 55 CYS HA 1 57 PHE H 4.800 . 5.300 3.901 3.767 4.284 . 0 0 "[ . 1 . 2]" 1 625 1 55 CYS QB 1 58 GLY H 3.808 . 4.368 2.248 2.045 2.778 . 0 0 "[ . 1 . 2]" 1 626 1 55 CYS QB 1 68 PHE H 5.600 . 6.160 4.403 3.972 4.889 . 0 0 "[ . 1 . 2]" 1 627 1 55 CYS QB 1 68 PHE QB 5.519 . 6.147 2.199 2.112 2.335 . 0 0 "[ . 1 . 2]" 1 628 1 55 CYS QB 1 69 ARG H 5.600 . 6.160 4.142 3.927 4.372 . 0 0 "[ . 1 . 2]" 1 629 1 55 CYS QB 1 70 HIS HD2 4.032 . 4.592 2.471 2.237 2.625 . 0 0 "[ . 1 . 2]" 1 630 1 56 ARG H 1 57 PHE QB 5.264 . 5.824 4.508 4.110 4.745 . 0 0 "[ . 1 . 2]" 1 631 1 56 ARG HA 1 57 PHE H 4.200 . 4.700 3.426 3.273 3.575 . 0 0 "[ . 1 . 2]" 1 632 1 56 ARG QB 1 57 PHE H 5.376 . 5.936 3.380 2.658 3.949 . 0 0 "[ . 1 . 2]" 1 633 1 56 ARG QD 1 57 PHE QD 5.519 . 6.147 4.006 2.091 4.420 . 0 0 "[ . 1 . 2]" 1 634 1 56 ARG QG 1 57 PHE H 5.264 . 5.824 3.909 2.607 4.816 . 0 0 "[ . 1 . 2]" 1 635 1 56 ARG QG 1 57 PHE QD 5.519 . 6.147 3.914 2.297 4.417 . 0 0 "[ . 1 . 2]" 1 636 1 56 ARG QG 1 68 PHE QD 5.519 . 6.147 3.859 3.091 4.415 . 0 0 "[ . 1 . 2]" 1 637 1 57 PHE H 1 58 GLY H 2.900 . 3.400 2.061 1.904 2.631 . 0 0 "[ . 1 . 2]" 1 638 1 57 PHE HA 1 58 GLY H 4.100 . 4.600 3.548 3.463 3.604 . 0 0 "[ . 1 . 2]" 1 639 1 57 PHE HA 1 61 CYS H 4.900 . 5.400 4.633 4.392 4.895 . 0 0 "[ . 1 . 2]" 1 640 1 57 PHE QB 1 58 GLY H 5.600 . 6.160 3.004 2.844 3.261 . 0 0 "[ . 1 . 2]" 1 641 1 57 PHE QB 1 59 VAL H 6.514 . 7.144 4.515 4.372 4.655 . 0 0 "[ . 1 . 2]" 1 642 1 57 PHE QB 1 60 ASN H 5.264 . 5.824 3.439 3.240 3.573 . 0 0 "[ . 1 . 2]" 1 643 1 57 PHE QB 1 61 CYS H 3.472 . 4.032 2.595 2.466 2.695 . 0 0 "[ . 1 . 2]" 1 644 1 57 PHE QD 1 58 GLY H 5.600 . 6.160 4.635 4.440 4.769 . 0 0 "[ . 1 . 2]" 1 645 1 57 PHE QD 1 60 ASN HA 6.944 . 7.504 5.252 4.709 6.231 . 0 0 "[ . 1 . 2]" 1 646 1 57 PHE QD 1 61 CYS H 4.816 . 5.376 4.342 4.244 4.387 . 0 0 "[ . 1 . 2]" 1 647 1 57 PHE QD 1 61 CYS H 5.200 . 5.801 3.910 3.822 3.964 . 0 0 "[ . 1 . 2]" 1 648 1 58 GLY H 1 59 VAL H 4.300 . 4.800 4.422 4.398 4.441 . 0 0 "[ . 1 . 2]" 1 649 1 58 GLY H 1 59 VAL QG 8.370 . 8.640 5.211 5.189 5.247 . 0 0 "[ . 1 . 2]" 1 650 1 58 GLY H 1 60 ASN H 4.800 . 5.300 4.471 4.355 4.552 . 0 0 "[ . 1 . 2]" 1 651 1 58 GLY H 1 61 CYS H 5.200 . 5.700 4.224 4.061 4.437 . 0 0 "[ . 1 . 2]" 1 652 1 58 GLY H 1 61 CYS QB 5.488 . 6.048 3.153 2.859 3.520 . 0 0 "[ . 1 . 2]" 1 653 1 58 GLY H 1 70 HIS QB 5.600 . 6.160 5.035 5.020 5.059 . 0 0 "[ . 1 . 2]" 1 654 1 58 GLY QA 1 59 VAL H 3.024 . 3.584 2.107 2.070 2.123 . 0 0 "[ . 1 . 2]" 1 655 1 58 GLY QA 1 59 VAL QG 7.711 . 7.862 3.217 3.187 3.247 . 0 0 "[ . 1 . 2]" 1 656 1 58 GLY QA 1 59 VAL QG 8.696 . 9.545 3.090 2.978 3.177 . 0 0 "[ . 1 . 2]" 1 657 1 58 GLY QA 1 60 ASN H 5.488 . 6.048 3.534 3.487 3.602 . 0 0 "[ . 1 . 2]" 1 658 1 58 GLY QA 1 70 HIS HA 5.264 . 5.824 2.894 2.526 3.140 . 0 0 "[ . 1 . 2]" 1 659 1 58 GLY QA 1 70 HIS HD2 4.480 . 5.040 2.679 2.427 3.141 . 0 0 "[ . 1 . 2]" 1 660 1 59 VAL H 1 60 ASN H 3.000 . 3.500 2.573 2.489 2.659 . 0 0 "[ . 1 . 2]" 1 661 1 59 VAL H 1 60 ASN HA 5.200 . 5.700 5.197 5.152 5.273 . 0 0 "[ . 1 . 2]" 1 662 1 59 VAL H 1 60 ASN QB 5.824 . 6.384 4.676 4.618 4.777 . 0 0 "[ . 1 . 2]" 1 663 1 59 VAL H 1 60 ASN QD 4.032 . 4.592 3.325 3.222 3.431 . 0 0 "[ . 1 . 2]" 1 664 1 59 VAL H 1 61 CYS H 4.900 . 5.400 4.236 4.048 4.419 . 0 0 "[ . 1 . 2]" 1 665 1 59 VAL H 1 70 HIS QB 5.824 . 6.384 5.028 4.774 5.227 . 0 0 "[ . 1 . 2]" 1 666 1 59 VAL H 1 71 PRO QD 5.488 . 6.048 3.232 2.806 3.693 . 0 0 "[ . 1 . 2]" 1 667 1 59 VAL H 1 71 PRO QG 3.696 . 4.256 3.247 2.869 3.321 . 0 0 "[ . 1 . 2]" 1 668 1 59 VAL HA 1 60 ASN H 3.300 . 3.800 3.345 3.316 3.392 . 0 0 "[ . 1 . 2]" 1 669 1 59 VAL HA 1 61 CYS H 4.900 . 5.400 3.868 3.707 4.019 . 0 0 "[ . 1 . 2]" 1 670 1 59 VAL HA 1 71 PRO QD 6.509 . 6.832 3.486 3.285 3.904 . 0 0 "[ . 1 . 2]" 1 671 1 59 VAL HA 1 75 VAL H 4.800 . 5.300 4.178 3.683 4.829 . 0 0 "[ . 1 . 2]" 1 672 1 59 VAL HB 1 60 ASN H 5.400 . 5.900 4.245 4.105 4.329 . 0 0 "[ . 1 . 2]" 1 673 1 59 VAL HB 1 74 ARG HA 4.800 . 5.300 2.967 2.346 3.873 . 0 0 "[ . 1 . 2]" 1 674 1 59 VAL HB 1 75 VAL H 4.800 . 5.300 4.419 3.632 4.836 . 0 0 "[ . 1 . 2]" 1 675 1 59 VAL QG 1 60 ASN H 5.805 . 6.480 2.913 2.708 3.035 . 0 0 "[ . 1 . 2]" 1 676 1 59 VAL QG 1 60 ASN HA 6.885 . 7.560 3.679 3.550 3.815 . 0 0 "[ . 1 . 2]" 1 677 1 59 VAL QG 1 60 ASN QB 8.770 . 9.526 4.049 3.905 4.255 . 0 0 "[ . 1 . 2]" 1 678 1 59 VAL QG 1 60 ASN QD 7.409 . 8.165 2.735 2.443 3.044 . 0 0 "[ . 1 . 2]" 1 679 1 59 VAL QG 1 61 CYS H 7.290 . 7.965 4.426 4.324 4.535 . 0 0 "[ . 1 . 2]" 1 680 1 59 VAL QG 1 70 HIS HA 7.965 . 8.640 5.018 4.618 5.521 . 0 0 "[ . 1 . 2]" 1 681 1 59 VAL QG 1 71 PRO QB 7.258 . 8.014 2.327 2.104 3.364 . 0 0 "[ . 1 . 2]" 1 682 1 59 VAL QG 1 71 PRO QB 8.051 . 8.900 2.061 1.962 2.598 . 0 0 "[ . 1 . 2]" 1 683 1 59 VAL QG 1 71 PRO QD 7.258 . 8.014 2.702 2.344 3.554 . 0 0 "[ . 1 . 2]" 1 684 1 59 VAL QG 1 71 PRO QG 6.804 . 7.560 2.359 2.025 2.576 . 0 0 "[ . 1 . 2]" 1 685 1 59 VAL QG 1 72 PRO QB 8.051 . 8.900 2.396 2.174 2.960 . 0 0 "[ . 1 . 2]" 1 686 1 59 VAL QG 1 73 GLY H 8.370 . 9.045 5.077 4.608 5.860 . 0 0 "[ . 1 . 2]" 1 687 1 59 VAL QG 1 74 ARG H 5.535 . 6.210 3.696 3.263 4.112 . 0 0 "[ . 1 . 2]" 1 688 1 59 VAL QG 1 74 ARG HA 5.940 . 6.615 3.048 2.661 3.690 . 0 0 "[ . 1 . 2]" 1 689 1 59 VAL QG 1 74 ARG QB 7.106 . 7.862 2.402 2.174 2.985 . 0 0 "[ . 1 . 2]" 1 690 1 59 VAL QG 1 74 ARG QD 8.165 . 8.921 4.129 3.344 4.994 . 0 0 "[ . 1 . 2]" 1 691 1 60 ASN H 1 60 ASN QD 3.363 . 3.963 2.054 2.006 2.102 . 0 0 "[ . 1 . 2]" 1 692 1 60 ASN H 1 61 CYS H 2.800 . 3.300 2.272 2.165 2.375 . 0 0 "[ . 1 . 2]" 1 693 1 60 ASN H 1 61 CYS QB 5.824 . 6.384 3.749 3.649 3.891 . 0 0 "[ . 1 . 2]" 1 694 1 60 ASN HA 1 61 CYS H 4.200 . 4.700 3.439 3.386 3.492 . 0 0 "[ . 1 . 2]" 1 695 1 60 ASN QB 1 61 CYS H 4.144 . 4.704 3.081 2.889 3.329 . 0 0 "[ . 1 . 2]" 1 696 1 61 CYS HA 1 62 LYS H 3.000 . 3.500 2.181 2.104 2.213 . 0 0 "[ . 1 . 2]" 1 697 1 61 CYS HA 1 63 ASN H 4.800 . 5.300 3.785 3.563 4.239 . 0 0 "[ . 1 . 2]" 1 698 1 61 CYS HA 1 76 LEU QD 7.560 . 8.235 4.943 4.728 5.630 . 0 0 "[ . 1 . 2]" 1 699 1 61 CYS QB 1 70 HIS HD2 4.032 . 4.592 2.780 2.598 2.929 . 0 0 "[ . 1 . 2]" 1 700 1 61 CYS QB 1 76 LEU QD 8.770 . 9.526 3.643 3.154 4.801 . 0 0 "[ . 1 . 2]" 1 701 1 62 LYS H 1 63 ASN H 3.200 . 3.700 2.340 2.191 2.559 . 0 0 "[ . 1 . 2]" 1 702 1 62 LYS H 1 63 ASN QB 6.384 . 6.944 3.963 3.731 4.560 . 0 0 "[ . 1 . 2]" 1 703 1 62 LYS HA 1 63 ASN H 3.400 . 3.900 3.286 3.098 3.486 . 0 0 "[ . 1 . 2]" 1 704 1 62 LYS HA 1 76 LEU QD 5.940 . 6.615 2.289 2.082 2.925 . 0 0 "[ . 1 . 2]" 1 705 1 62 LYS QB 1 63 ASN H 5.376 . 5.936 3.502 3.135 3.711 . 0 0 "[ . 1 . 2]" 1 706 1 62 LYS QE 1 75 VAL QG 8.618 . 9.374 4.127 2.277 5.699 . 0 0 "[ . 1 . 2]" 1 707 1 62 LYS QE 1 76 LEU QD 8.921 . 9.677 4.907 2.459 5.889 . 0 0 "[ . 1 . 2]" 1 708 1 62 LYS QG 1 63 ASN H 5.712 . 6.272 4.503 4.166 4.893 . 0 0 "[ . 1 . 2]" 1 709 1 63 ASN H 1 64 ILE H 5.000 . 5.500 4.510 4.379 4.685 . 0 0 "[ . 1 . 2]" 1 710 1 63 ASN H 1 66 CYS QB 4.816 . 5.376 3.981 3.832 4.300 . 0 0 "[ . 1 . 2]" 1 711 1 63 ASN HA 1 64 ILE H 2.700 . 3.200 2.172 2.103 2.385 . 0 0 "[ . 1 . 2]" 1 712 1 63 ASN HA 1 64 ILE MD 6.240 . 6.840 3.942 3.306 5.307 . 0 0 "[ . 1 . 2]" 1 713 1 63 ASN HA 1 64 ILE MG 6.960 . 7.560 5.144 2.859 5.443 . 0 0 "[ . 1 . 2]" 1 714 1 63 ASN QB 1 64 ILE H 5.824 . 6.384 3.711 2.754 3.956 . 0 0 "[ . 1 . 2]" 1 715 1 63 ASN QD 1 65 TYR QB 6.523 . 7.150 4.636 3.015 5.210 . 0 0 "[ . 1 . 2]" 1 716 1 63 ASN QD 1 65 TYR QD 5.268 . 5.896 3.527 2.646 4.161 . 0 0 "[ . 1 . 2]" 1 717 1 63 ASN QD 1 65 TYR QE 5.394 . 6.021 3.573 2.719 4.300 . 0 0 "[ . 1 . 2]" 1 718 1 63 ASN QD 1 66 CYS QB 6.272 . 6.899 3.113 2.260 4.771 . 0 0 "[ . 1 . 2]" 1 719 1 64 ILE H 1 65 TYR H 3.100 . 3.600 2.611 1.985 2.989 . 0 0 "[ . 1 . 2]" 1 720 1 64 ILE H 1 66 CYS H 4.900 . 5.400 4.562 3.882 4.935 . 0 0 "[ . 1 . 2]" 1 721 1 64 ILE HA 1 65 TYR H 3.400 . 3.900 3.466 3.404 3.525 . 0 0 "[ . 1 . 2]" 1 722 1 64 ILE HA 1 66 CYS H 4.400 . 4.900 4.126 3.574 4.336 . 0 0 "[ . 1 . 2]" 1 723 1 64 ILE HA 1 76 LEU QD 5.940 . 6.615 2.328 2.063 2.688 . 0 0 "[ . 1 . 2]" 1 724 1 64 ILE HB 1 65 TYR H 4.700 . 5.200 3.091 2.781 4.455 . 0 0 "[ . 1 . 2]" 1 725 1 64 ILE HB 1 65 TYR QE 5.712 . 6.272 4.061 3.431 5.122 . 0 0 "[ . 1 . 2]" 1 726 1 64 ILE MD 1 77 PRO QD 7.088 . 7.822 2.355 2.085 3.802 . 0 0 "[ . 1 . 2]" 1 727 1 64 ILE MD 1 65 TYR H 6.160 . 6.834 3.650 2.475 3.771 . 0 0 "[ . 1 . 2]" 1 728 1 64 ILE MD 1 66 CYS H 7.940 . 8.614 4.724 4.436 4.918 . 0 0 "[ . 1 . 2]" 1 729 1 64 ILE MD 1 76 LEU QD 8.940 . 9.849 2.206 1.993 2.640 . 0 0 "[ . 1 . 2]" 1 730 1 64 ILE MD 1 77 PRO QD 7.305 . 8.061 2.414 2.029 3.457 . 0 0 "[ . 1 . 2]" 1 731 1 64 ILE MD 1 65 TYR H 6.120 . 6.720 4.509 4.083 4.675 . 0 0 "[ . 1 . 2]" 1 732 1 64 ILE MD 1 65 TYR QD 7.661 . 8.333 4.419 2.635 5.259 . 0 0 "[ . 1 . 2]" 1 733 1 64 ILE MD 1 65 TYR QE 6.989 . 7.661 4.758 2.530 5.229 . 0 0 "[ . 1 . 2]" 1 734 1 64 ILE MD 1 66 CYS H 7.080 . 7.680 5.811 5.307 6.036 . 0 0 "[ . 1 . 2]" 1 735 1 64 ILE MD 1 76 LEU QB 6.989 . 7.661 2.853 2.093 4.580 . 0 0 "[ . 1 . 2]" 1 736 1 64 ILE MD 1 76 LEU QD 7.776 . 8.586 2.618 2.002 4.307 . 0 0 "[ . 1 . 2]" 1 737 1 64 ILE MD 1 77 PRO QB 7.526 . 8.198 3.648 2.288 4.448 . 0 0 "[ . 1 . 2]" 1 738 1 64 ILE MD 1 77 PRO QD 6.451 . 7.123 2.587 2.097 4.010 . 0 0 "[ . 1 . 2]" 1 739 1 64 ILE MD 1 77 PRO QG 7.392 . 8.064 2.598 2.035 5.042 . 0 0 "[ . 1 . 2]" 1 740 1 64 ILE QG 1 65 TYR QD 6.267 . 7.000 3.160 2.490 3.670 . 0 0 "[ . 1 . 2]" 1 741 1 64 ILE QG 1 65 TYR H 5.488 . 6.048 3.842 2.999 4.109 . 0 0 "[ . 1 . 2]" 1 742 1 64 ILE QG 1 65 TYR QD 5.394 . 6.021 3.397 2.708 4.050 . 0 0 "[ . 1 . 2]" 1 743 1 64 ILE QG 1 65 TYR QE 4.767 . 5.394 3.647 2.797 3.821 . 0 0 "[ . 1 . 2]" 1 744 1 64 ILE QG 1 77 PRO QD 7.520 . 8.313 2.539 1.993 2.961 . 0 0 "[ . 1 . 2]" 1 745 1 64 ILE QG 1 77 PRO QD 5.896 . 6.523 3.866 2.149 4.721 . 0 0 "[ . 1 . 2]" 1 746 1 64 ILE MG 1 65 TYR H 4.680 . 5.280 3.884 2.486 4.010 . 0 0 "[ . 1 . 2]" 1 747 1 64 ILE MG 1 65 TYR HA 6.480 . 7.080 4.196 3.810 5.452 . 0 0 "[ . 1 . 2]" 1 748 1 64 ILE MG 1 65 TYR QB 6.720 . 7.392 4.114 3.800 5.145 . 0 0 "[ . 1 . 2]" 1 749 1 64 ILE MG 1 65 TYR QD 7.392 . 8.064 3.849 2.757 4.661 . 0 0 "[ . 1 . 2]" 1 750 1 64 ILE MG 1 65 TYR QE 7.526 . 8.198 5.027 2.489 5.504 . 0 0 "[ . 1 . 2]" 1 751 1 64 ILE MG 1 76 LEU HA 6.960 . 7.560 5.495 3.651 5.832 . 0 0 "[ . 1 . 2]" 1 752 1 64 ILE MG 1 76 LEU QB 6.317 . 6.989 3.396 2.181 4.692 . 0 0 "[ . 1 . 2]" 1 753 1 64 ILE MG 1 77 PRO QB 8.064 . 8.736 5.376 3.169 6.054 . 0 0 "[ . 1 . 2]" 1 754 1 64 ILE MG 1 77 PRO QD 7.392 . 8.064 4.250 2.035 4.778 . 0 0 "[ . 1 . 2]" 1 755 1 64 ILE MG 1 77 PRO QG 6.586 . 7.258 4.589 3.378 4.945 . 0 0 "[ . 1 . 2]" 1 756 1 64 ILE MG 1 77 PRO QG 7.476 . 8.232 4.311 2.203 4.791 . 0 0 "[ . 1 . 2]" 1 757 1 65 TYR H 1 66 CYS H 2.900 . 3.400 2.709 2.472 2.945 . 0 0 "[ . 1 . 2]" 1 758 1 65 TYR H 1 66 CYS QB 4.144 . 4.704 3.725 3.423 3.796 . 0 0 "[ . 1 . 2]" 1 759 1 65 TYR HA 1 66 CYS H 4.600 . 5.100 2.879 2.610 3.375 . 0 0 "[ . 1 . 2]" 1 760 1 65 TYR QB 1 66 CYS H 5.376 . 5.936 3.979 3.334 4.101 . 0 0 "[ . 1 . 2]" 1 761 1 65 TYR QB 1 67 LEU QD 8.921 . 9.677 4.035 3.267 5.218 . 0 0 "[ . 1 . 2]" 1 762 1 65 TYR QD 1 66 CYS H 6.160 . 6.720 4.537 4.322 4.815 . 0 0 "[ . 1 . 2]" 1 763 1 66 CYS H 1 67 LEU H 5.100 . 5.600 4.553 4.396 4.621 . 0 0 "[ . 1 . 2]" 1 764 1 66 CYS H 1 67 LEU QD 7.830 . 8.505 4.640 3.905 5.629 . 0 0 "[ . 1 . 2]" 1 765 1 66 CYS H 1 70 HIS CE1 4.500 . 5.000 4.700 4.652 4.825 . 0 0 "[ . 1 . 2]" 1 766 1 66 CYS HA 1 67 LEU H 2.800 . 3.300 2.203 2.052 2.288 . 0 0 "[ . 1 . 2]" 1 767 1 66 CYS HA 1 68 PHE H 4.600 . 5.100 4.245 3.884 4.478 . 0 0 "[ . 1 . 2]" 1 768 1 66 CYS QB 1 70 HIS CE1 3.696 . 4.256 2.854 2.701 3.013 . 0 0 "[ . 1 . 2]" 1 769 1 67 LEU H 1 67 LEU HG 3.800 . 4.300 2.515 2.238 3.818 . 0 0 "[ . 1 . 2]" 1 770 1 67 LEU H 1 68 PHE H 3.100 . 3.600 2.781 2.306 3.134 . 0 0 "[ . 1 . 2]" 1 771 1 67 LEU HA 1 68 PHE H 3.300 . 3.800 3.036 2.498 3.432 . 0 0 "[ . 1 . 2]" 1 772 1 67 LEU QB 1 68 PHE H 5.600 . 6.160 3.503 2.852 3.885 . 0 0 "[ . 1 . 2]" 1 773 1 67 LEU QD 1 68 PHE H 8.100 . 8.775 4.191 3.930 4.449 . 0 0 "[ . 1 . 2]" 1 774 1 68 PHE H 1 70 HIS CE1 4.500 . 5.000 4.500 4.249 4.647 . 0 0 "[ . 1 . 2]" 1 775 1 68 PHE HA 1 69 ARG H 3.200 . 3.700 2.317 2.250 2.395 . 0 0 "[ . 1 . 2]" 1 776 1 68 PHE QB 1 69 ARG H 3.920 . 4.480 2.720 2.454 2.865 . 0 0 "[ . 1 . 2]" 1 777 1 68 PHE QB 1 69 ARG H 3.893 . 4.523 2.620 2.381 2.761 . 0 0 "[ . 1 . 2]" 1 778 1 69 ARG HA 1 70 HIS H 2.600 . 3.100 2.329 2.229 2.453 . 0 0 "[ . 1 . 2]" 1 779 1 69 ARG QB 1 70 HIS H 3.584 . 4.144 2.585 2.357 3.040 . 0 0 "[ . 1 . 2]" 1 780 1 69 ARG QD 1 70 HIS H 5.998 . 6.628 3.850 3.513 4.156 . 0 0 "[ . 1 . 2]" 1 781 1 70 HIS H 1 71 PRO QD 5.376 . 5.936 4.393 4.299 4.455 . 0 0 "[ . 1 . 2]" 1 782 1 70 HIS HA 1 71 PRO QB 5.376 . 5.936 4.795 4.582 4.859 . 0 0 "[ . 1 . 2]" 1 783 1 70 HIS HA 1 71 PRO QD 4.480 . 5.040 2.023 1.987 2.186 . 0 0 "[ . 1 . 2]" 1 784 1 70 HIS HA 1 71 PRO QG 4.928 . 5.488 3.906 3.832 4.122 . 0 0 "[ . 1 . 2]" 1 785 1 70 HIS QB 1 71 PRO QD 5.645 . 6.272 2.554 2.199 2.904 . 0 0 "[ . 1 . 2]" 1 786 1 70 HIS HD2 1 71 PRO QD 4.704 . 5.264 3.630 3.326 3.783 . 0 0 "[ . 1 . 2]" 1 787 1 71 PRO HA 1 72 PRO QD 4.144 . 4.704 2.159 2.016 2.250 . 0 0 "[ . 1 . 2]" 1 788 1 71 PRO QB 1 72 PRO QD 5.268 . 5.896 2.283 2.184 2.475 . 0 0 "[ . 1 . 2]" 1 789 1 71 PRO QB 1 74 ARG QB 6.397 . 7.025 4.252 3.220 5.080 . 0 0 "[ . 1 . 2]" 1 790 1 71 PRO QD 1 72 PRO QD 5.770 . 6.397 4.617 4.602 4.634 . 0 0 "[ . 1 . 2]" 1 791 1 71 PRO QD 1 74 ARG QB 6.774 . 7.401 3.760 3.135 4.253 . 0 0 "[ . 1 . 2]" 1 792 1 72 PRO HA 1 73 GLY H 2.800 . 3.300 2.331 2.250 2.439 . 0 0 "[ . 1 . 2]" 1 793 1 72 PRO HA 1 74 ARG H 4.700 . 5.200 3.467 3.293 3.709 . 0 0 "[ . 1 . 2]" 1 794 1 72 PRO QB 1 73 GLY H 5.264 . 5.824 2.800 2.539 3.003 . 0 0 "[ . 1 . 2]" 1 795 1 72 PRO QG 1 73 GLY H 5.488 . 6.048 4.355 4.108 4.587 . 0 0 "[ . 1 . 2]" 1 796 1 73 GLY H 1 74 ARG H 3.100 . 3.600 2.651 2.543 2.818 . 0 0 "[ . 1 . 2]" 1 797 1 73 GLY QA 1 74 ARG H 4.704 . 5.264 2.907 2.837 2.971 . 0 0 "[ . 1 . 2]" 1 798 1 74 ARG H 1 75 VAL H 4.500 . 5.000 4.544 4.485 4.580 . 0 0 "[ . 1 . 2]" 1 799 1 74 ARG H 1 75 VAL HA 5.200 . 5.700 5.287 5.224 5.316 . 0 0 "[ . 1 . 2]" 1 800 1 74 ARG HA 1 75 VAL H 3.200 . 3.700 2.387 2.133 2.555 . 0 0 "[ . 1 . 2]" 1 801 1 74 ARG HA 1 75 VAL QG 6.750 . 7.425 3.537 3.248 3.857 . 0 0 "[ . 1 . 2]" 1 802 1 74 ARG HA 1 75 VAL QG 8.334 . 9.090 3.383 3.153 3.676 . 0 0 "[ . 1 . 2]" 1 803 1 74 ARG QB 1 75 VAL H 4.480 . 5.040 2.517 2.119 3.727 . 0 0 "[ . 1 . 2]" 1 804 1 74 ARG QB 1 76 LEU QD 7.106 . 7.862 3.972 3.308 4.366 . 0 0 "[ . 1 . 2]" 1 805 1 74 ARG QB 1 76 LEU QD 9.087 . 9.936 3.812 3.263 4.136 . 0 0 "[ . 1 . 2]" 1 806 1 74 ARG QD 1 75 VAL H 5.600 . 6.160 4.117 3.379 4.791 . 0 0 "[ . 1 . 2]" 1 807 1 74 ARG QD 1 76 LEU QD 7.711 . 8.467 2.964 2.268 3.651 . 0 0 "[ . 1 . 2]" 1 808 1 74 ARG HE 1 76 LEU QD 6.885 . 7.560 3.479 2.213 5.122 . 0 0 "[ . 1 . 2]" 1 809 1 74 ARG QG 1 75 VAL H 4.816 . 5.376 3.406 2.627 4.336 . 0 0 "[ . 1 . 2]" 1 810 1 75 VAL H 1 76 LEU H 4.400 . 4.900 4.350 4.232 4.507 . 0 0 "[ . 1 . 2]" 1 811 1 75 VAL H 1 76 LEU QD 7.965 . 8.640 4.379 4.161 4.733 . 0 0 "[ . 1 . 2]" 1 812 1 75 VAL HA 1 76 LEU H 2.900 . 3.400 2.128 2.047 2.227 . 0 0 "[ . 1 . 2]" 1 813 1 75 VAL HA 1 76 LEU QB 4.704 . 5.264 4.200 4.030 4.246 . 0 0 "[ . 1 . 2]" 1 814 1 75 VAL HA 1 76 LEU QD 7.155 . 7.830 4.491 4.299 4.624 . 0 0 "[ . 1 . 2]" 1 815 1 75 VAL HA 1 76 LEU HG 4.300 . 4.800 4.098 3.814 4.310 . 0 0 "[ . 1 . 2]" 1 816 1 75 VAL HB 1 76 LEU H 4.000 . 4.500 4.041 3.980 4.165 . 0 0 "[ . 1 . 2]" 1 817 1 75 VAL QG 1 76 LEU H 5.670 . 6.210 2.480 2.254 2.850 . 0 0 "[ . 1 . 2]" 1 818 1 75 VAL QG 1 76 LEU HA 7.965 . 8.640 3.565 3.400 3.796 . 0 0 "[ . 1 . 2]" 1 819 1 75 VAL QG 1 76 LEU QB 7.862 . 8.618 4.225 4.042 4.466 . 0 0 "[ . 1 . 2]" 1 820 1 75 VAL QG 1 76 LEU QB 8.338 . 9.147 3.904 3.756 4.045 . 0 0 "[ . 1 . 2]" 1 821 1 75 VAL QG 1 76 LEU HG 7.020 . 7.695 4.599 4.401 4.729 . 0 0 "[ . 1 . 2]" 1 822 1 75 VAL QG 1 77 PRO HA 7.425 . 8.100 4.381 3.997 4.943 . 0 0 "[ . 1 . 2]" 1 823 1 76 LEU H 1 77 PRO QD 5.376 . 5.936 4.336 3.699 4.441 . 0 0 "[ . 1 . 2]" 1 824 1 76 LEU HA 1 77 PRO QD 3.808 . 4.368 2.104 1.999 2.188 . 0 0 "[ . 1 . 2]" 1 825 1 76 LEU HA 1 77 PRO QG 4.704 . 5.264 4.034 3.868 4.127 . 0 0 "[ . 1 . 2]" 1 826 1 76 LEU QB 1 77 PRO QD 5.018 . 5.645 2.554 2.271 3.489 . 0 0 "[ . 1 . 2]" 1 827 1 76 LEU QD 1 77 PRO QB 8.165 . 8.921 5.004 4.547 5.436 . 0 0 "[ . 1 . 2]" 1 828 1 76 LEU QD 1 77 PRO QD 6.199 . 6.955 2.614 2.358 3.039 . 0 0 "[ . 1 . 2]" 1 829 1 76 LEU QD 1 77 PRO QG 7.106 . 7.862 4.062 3.846 4.514 . 0 0 "[ . 1 . 2]" 1 830 1 77 PRO HA 1 78 GLU H 2.400 . 2.900 2.260 2.108 2.392 . 0 0 "[ . 1 . 2]" 1 831 1 77 PRO QB 1 78 GLU H 4.256 . 4.816 3.014 2.686 3.932 . 0 0 "[ . 1 . 2]" 1 832 1 78 GLU HA 1 79 LYS H 2.500 . 3.000 2.332 2.193 2.634 . 0 0 "[ . 1 . 2]" 1 833 1 78 GLU QB 1 79 LYS H 4.704 . 5.264 3.294 2.369 3.955 . 0 0 "[ . 1 . 2]" 1 834 1 78 GLU QG 1 79 LYS H 5.376 . 5.936 3.702 2.307 4.482 . 0 0 "[ . 1 . 2]" 1 835 1 79 LYS H 1 80 LYS H 4.500 . 5.000 3.953 2.743 4.601 . 0 0 "[ . 1 . 2]" 1 836 1 79 LYS HA 1 80 LYS H 2.700 . 3.200 2.334 2.103 2.720 . 0 0 "[ . 1 . 2]" 1 837 1 79 LYS QB 1 80 LYS H 5.264 . 5.824 3.455 2.233 4.052 . 0 0 "[ . 1 . 2]" 1 stop_ save_
Contact the webmaster for help, if required. Friday, May 31, 2024 11:58:32 PM GMT (wattos1)