NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
496465 | 2l31 | 17158 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2l31 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 1871 _Distance_constraint_stats_list.Viol_count 0 _Distance_constraint_stats_list.Viol_total 0.000 _Distance_constraint_stats_list.Viol_max 0.000 _Distance_constraint_stats_list.Viol_rms 0.0000 _Distance_constraint_stats_list.Viol_average_all_restraints 0.0000 _Distance_constraint_stats_list.Viol_average_violations_only 0.0000 _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 3 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 4 ALA 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 5 GLU 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 7 THR 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 8 LEU 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 9 GLY 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 10 ASP 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 11 PHE 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 12 ALA 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 13 ALA 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 14 GLU 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 15 TYR 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 16 ALA 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 17 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 18 SER 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 19 ASN 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 20 ARG 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 21 SER 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 22 THR 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 23 CYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 24 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 25 GLY 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 26 CYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 27 MET 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 28 GLU 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 29 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 30 ILE 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 31 GLU 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 32 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 33 GLY 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 34 GLN 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 35 VAL 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 36 ARG 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 37 LEU 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 38 SER 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 39 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 40 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 41 MET 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 42 VAL 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 43 ASP 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 44 PRO 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 45 GLU 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 46 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 47 PRO 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 48 GLN 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 49 LEU 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 50 GLY 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 51 MET 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 52 ILE 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 53 ASP 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 54 ARG 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 55 TRP 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 56 TYR 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 57 HIS 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 58 PRO 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 59 GLY 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 60 CYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 61 PHE 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 62 VAL 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 63 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 64 ASN 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 65 ARG 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 66 GLU 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 67 GLU 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 68 LEU 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 69 GLY 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 70 PHE 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 71 ARG 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 72 PRO 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 73 GLU 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 74 TYR 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 75 SER 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 76 ALA 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 77 SER 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 78 GLN 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 79 LEU 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 80 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 81 GLY 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 82 PHE 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 83 SER 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 84 LEU 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 85 LEU 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 86 ALA 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 87 THR 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 88 GLU 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 89 ASP 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 90 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 91 GLU 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 92 ALA 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 93 LEU 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 94 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 95 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 96 GLN 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 97 LEU 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 98 PRO 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 99 GLY 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 100 VAL 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 101 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 102 SER 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 103 GLU 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 104 GLY 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 105 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 106 ARG 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 107 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 108 GLY 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 109 ASP 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 110 GLU 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 111 VAL 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 112 ASP 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 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 3 LYS QB 1 4 ALA H 5.488 . 6.048 3.201 2.517 4.068 . 0 0 "[ . 1 . 2 . 3]" 1 2 1 4 ALA HA 1 5 GLU H 3.100 . 3.600 2.368 2.166 2.840 . 0 0 "[ . 1 . 2 . 3]" 1 3 1 4 ALA HA 1 5 GLU QB 5.040 . 5.600 4.390 3.969 4.635 . 0 0 "[ . 1 . 2 . 3]" 1 4 1 4 ALA HA 1 5 GLU QG 5.600 . 6.160 3.969 3.265 4.910 . 0 0 "[ . 1 . 2 . 3]" 1 5 1 4 ALA MB 1 5 GLU H 5.280 . 5.880 2.995 2.405 3.767 . 0 0 "[ . 1 . 2 . 3]" 1 6 1 7 THR H 1 7 THR HB 3.400 . 3.900 2.692 2.508 2.975 . 0 0 "[ . 1 . 2 . 3]" 1 7 1 7 THR H 1 8 LEU H 4.700 . 5.200 4.623 4.449 4.708 . 0 0 "[ . 1 . 2 . 3]" 1 8 1 7 THR H 1 78 GLN HA 5.500 . 6.000 4.515 3.663 4.991 . 0 0 "[ . 1 . 2 . 3]" 1 9 1 7 THR H 1 78 GLN QB 6.160 . 6.720 5.065 4.530 5.574 . 0 0 "[ . 1 . 2 . 3]" 1 10 1 7 THR H 1 80 LYS HA 5.500 . 6.000 5.050 4.372 5.625 . 0 0 "[ . 1 . 2 . 3]" 1 11 1 7 THR H 1 80 LYS QG 6.160 . 6.720 5.019 4.591 5.527 . 0 0 "[ . 1 . 2 . 3]" 1 12 1 7 THR HA 1 8 LEU H 3.200 . 3.700 2.277 2.177 2.342 . 0 0 "[ . 1 . 2 . 3]" 1 13 1 7 THR HA 1 8 LEU QB 5.264 . 5.824 4.347 4.243 4.579 . 0 0 "[ . 1 . 2 . 3]" 1 14 1 7 THR HA 1 8 LEU QD 6.480 . 7.155 3.787 3.622 4.170 . 0 0 "[ . 1 . 2 . 3]" 1 15 1 7 THR HA 1 78 GLN H 5.200 . 5.700 5.014 4.758 5.262 . 0 0 "[ . 1 . 2 . 3]" 1 16 1 7 THR HA 1 78 GLN HA 3.600 . 4.100 2.418 2.061 2.799 . 0 0 "[ . 1 . 2 . 3]" 1 17 1 7 THR HA 1 78 GLN QB 4.928 . 5.488 2.676 2.232 3.221 . 0 0 "[ . 1 . 2 . 3]" 1 18 1 7 THR HA 1 79 LEU H 4.900 . 5.400 4.432 4.157 4.824 . 0 0 "[ . 1 . 2 . 3]" 1 19 1 7 THR HA 1 80 LYS H 5.500 . 6.000 4.935 4.584 5.504 . 0 0 "[ . 1 . 2 . 3]" 1 20 1 7 THR HB 1 8 LEU H 3.800 . 4.300 3.852 3.787 3.911 . 0 0 "[ . 1 . 2 . 3]" 1 21 1 7 THR HB 1 8 LEU HA 5.400 . 5.900 4.900 4.741 5.024 . 0 0 "[ . 1 . 2 . 3]" 1 22 1 7 THR HB 1 9 GLY H 3.800 . 4.300 2.930 2.692 3.323 . 0 0 "[ . 1 . 2 . 3]" 1 23 1 7 THR HB 1 80 LYS HA 4.200 . 4.700 4.241 4.153 4.298 . 0 0 "[ . 1 . 2 . 3]" 1 24 1 7 THR MG 1 8 LEU H 4.200 . 4.800 2.208 2.143 2.397 . 0 0 "[ . 1 . 2 . 3]" 1 25 1 7 THR MG 1 8 LEU HA 6.600 . 7.200 4.131 4.065 4.377 . 0 0 "[ . 1 . 2 . 3]" 1 26 1 7 THR MG 1 8 LEU QD 8.910 . 9.720 2.231 2.128 2.544 . 0 0 "[ . 1 . 2 . 3]" 1 27 1 7 THR MG 1 9 GLY H 6.600 . 7.200 1.772 1.690 2.132 . 0 0 "[ . 1 . 2 . 3]" 1 28 1 7 THR MG 1 10 ASP H 6.600 . 7.200 2.931 2.639 3.531 . 0 0 "[ . 1 . 2 . 3]" 1 29 1 7 THR MG 1 11 PHE QD 6.989 . 7.661 3.644 3.128 4.005 . 0 0 "[ . 1 . 2 . 3]" 1 30 1 7 THR MG 1 12 ALA H 6.600 . 7.200 5.325 5.115 5.657 . 0 0 "[ . 1 . 2 . 3]" 1 31 1 7 THR MG 1 12 ALA HA 6.240 . 6.840 3.976 3.781 4.155 . 0 0 "[ . 1 . 2 . 3]" 1 32 1 7 THR MG 1 13 ALA H 6.600 . 7.200 5.485 5.279 5.559 . 0 0 "[ . 1 . 2 . 3]" 1 33 1 7 THR MG 1 78 GLN QB 5.779 . 6.451 3.588 3.340 3.866 . 0 0 "[ . 1 . 2 . 3]" 1 34 1 7 THR MG 1 79 LEU HA 3.480 . 4.080 2.598 2.470 2.867 . 0 0 "[ . 1 . 2 . 3]" 1 35 1 7 THR MG 1 79 LEU QB 5.510 . 6.182 4.154 4.073 4.183 . 0 0 "[ . 1 . 2 . 3]" 1 36 1 7 THR MG 1 79 LEU HG 5.880 . 6.480 4.926 4.737 4.976 . 0 0 "[ . 1 . 2 . 3]" 1 37 1 7 THR MG 1 80 LYS H 4.800 . 5.400 2.221 2.131 2.452 . 0 0 "[ . 1 . 2 . 3]" 1 38 1 7 THR MG 1 80 LYS HA 4.080 . 4.680 3.003 2.355 3.181 . 0 0 "[ . 1 . 2 . 3]" 1 39 1 7 THR MG 1 80 LYS QB 6.451 . 7.123 3.547 3.343 3.610 . 0 0 "[ . 1 . 2 . 3]" 1 40 1 7 THR MG 1 80 LYS QE 5.779 . 6.451 3.691 2.834 4.155 . 0 0 "[ . 1 . 2 . 3]" 1 41 1 7 THR MG 1 80 LYS QG 5.376 . 6.048 1.925 1.902 1.969 . 0 0 "[ . 1 . 2 . 3]" 1 42 1 7 THR MG 1 81 GLY H 6.000 . 6.600 4.837 4.113 5.012 . 0 0 "[ . 1 . 2 . 3]" 1 43 1 8 LEU H 1 8 LEU HG 4.300 . 4.800 3.840 2.521 4.001 . 0 0 "[ . 1 . 2 . 3]" 1 44 1 8 LEU H 1 9 GLY H 5.500 . 6.000 2.730 2.656 2.830 . 0 0 "[ . 1 . 2 . 3]" 1 45 1 8 LEU H 1 10 ASP H 5.500 . 6.000 4.239 4.104 4.552 . 0 0 "[ . 1 . 2 . 3]" 1 46 1 8 LEU H 1 11 PHE H 5.500 . 6.000 4.872 4.695 5.050 . 0 0 "[ . 1 . 2 . 3]" 1 47 1 8 LEU H 1 78 GLN H 5.200 . 5.700 5.363 5.285 5.462 . 0 0 "[ . 1 . 2 . 3]" 1 48 1 8 LEU H 1 78 GLN HA 4.600 . 5.100 3.698 3.121 4.039 . 0 0 "[ . 1 . 2 . 3]" 1 49 1 8 LEU H 1 78 GLN QB 5.712 . 6.272 2.133 1.983 2.371 . 0 0 "[ . 1 . 2 . 3]" 1 50 1 8 LEU H 1 79 LEU H 5.500 . 6.000 5.330 5.100 5.492 . 0 0 "[ . 1 . 2 . 3]" 1 51 1 8 LEU H 1 79 LEU HA 5.500 . 6.000 4.708 4.341 4.885 . 0 0 "[ . 1 . 2 . 3]" 1 52 1 8 LEU H 1 80 LYS H 5.500 . 6.000 5.530 5.472 5.585 . 0 0 "[ . 1 . 2 . 3]" 1 53 1 8 LEU HA 1 9 GLY H 3.600 . 4.100 3.402 3.322 3.490 . 0 0 "[ . 1 . 2 . 3]" 1 54 1 8 LEU HA 1 9 GLY QA 5.824 . 6.384 4.270 4.139 4.324 . 0 0 "[ . 1 . 2 . 3]" 1 55 1 8 LEU QB 1 9 GLY H 5.376 . 5.936 3.859 3.731 3.970 . 0 0 "[ . 1 . 2 . 3]" 1 56 1 8 LEU QB 1 10 ASP H 6.160 . 6.720 4.511 4.240 4.871 . 0 0 "[ . 1 . 2 . 3]" 1 57 1 8 LEU QB 1 11 PHE QE 6.523 . 7.150 4.196 4.008 4.341 . 0 0 "[ . 1 . 2 . 3]" 1 58 1 8 LEU QB 1 74 TYR QD 5.770 . 6.397 3.066 2.547 3.898 . 0 0 "[ . 1 . 2 . 3]" 1 59 1 8 LEU QB 1 74 TYR QE 5.896 . 6.523 4.109 3.203 4.686 . 0 0 "[ . 1 . 2 . 3]" 1 60 1 8 LEU QD 1 9 GLY H 5.805 . 6.480 2.290 1.967 2.610 . 0 0 "[ . 1 . 2 . 3]" 1 61 1 8 LEU QD 1 10 ASP H 6.750 . 7.425 1.944 1.815 2.215 . 0 0 "[ . 1 . 2 . 3]" 1 62 1 8 LEU QD 1 10 ASP HA 7.020 . 7.695 4.019 3.809 4.400 . 0 0 "[ . 1 . 2 . 3]" 1 63 1 8 LEU QD 1 11 PHE H 6.750 . 7.425 2.422 2.202 2.710 . 0 0 "[ . 1 . 2 . 3]" 1 64 1 8 LEU QD 1 11 PHE QB 7.862 . 8.618 3.773 3.685 3.895 . 0 0 "[ . 1 . 2 . 3]" 1 65 1 8 LEU QD 1 11 PHE QD 6.048 . 6.804 2.702 2.497 2.778 . 0 0 "[ . 1 . 2 . 3]" 1 66 1 8 LEU QD 1 11 PHE QE 8.165 . 8.921 2.285 2.118 2.515 . 0 0 "[ . 1 . 2 . 3]" 1 67 1 8 LEU QD 1 11 PHE HZ 7.425 . 8.100 2.373 2.252 2.490 . 0 0 "[ . 1 . 2 . 3]" 1 68 1 8 LEU QD 1 70 PHE QD 7.258 . 8.014 4.452 4.119 4.621 . 0 0 "[ . 1 . 2 . 3]" 1 69 1 8 LEU QD 1 70 PHE QE 6.653 . 7.409 4.345 4.167 4.421 . 0 0 "[ . 1 . 2 . 3]" 1 70 1 8 LEU QD 1 74 TYR H 7.425 . 8.100 4.977 4.769 5.530 . 0 0 "[ . 1 . 2 . 3]" 1 71 1 8 LEU QD 1 74 TYR QB 7.711 . 8.467 2.325 2.123 3.083 . 0 0 "[ . 1 . 2 . 3]" 1 72 1 8 LEU QD 1 74 TYR QD 6.804 . 7.560 2.782 2.619 2.979 . 0 0 "[ . 1 . 2 . 3]" 1 73 1 8 LEU QD 1 74 TYR QE 6.804 . 7.560 3.213 2.905 3.526 . 0 0 "[ . 1 . 2 . 3]" 1 74 1 8 LEU QD 1 78 GLN QB 6.804 . 7.560 2.730 2.210 3.496 . 0 0 "[ . 1 . 2 . 3]" 1 75 1 8 LEU QD 1 79 LEU QD 7.108 . 8.019 3.898 3.047 4.014 . 0 0 "[ . 1 . 2 . 3]" 1 76 1 8 LEU QD 1 80 LYS H 7.425 . 8.100 4.593 4.312 4.925 . 0 0 "[ . 1 . 2 . 3]" 1 77 1 8 LEU HG 1 9 GLY H 5.500 . 6.000 3.698 3.313 4.401 . 0 0 "[ . 1 . 2 . 3]" 1 78 1 8 LEU HG 1 11 PHE H 5.500 . 6.000 4.461 4.119 4.922 . 0 0 "[ . 1 . 2 . 3]" 1 79 1 9 GLY H 1 10 ASP H 4.300 . 4.800 2.569 2.421 2.648 . 0 0 "[ . 1 . 2 . 3]" 1 80 1 9 GLY H 1 10 ASP HA 5.200 . 5.700 5.222 4.960 5.260 . 0 0 "[ . 1 . 2 . 3]" 1 81 1 9 GLY H 1 10 ASP QB 6.160 . 6.720 4.577 4.287 5.222 . 0 0 "[ . 1 . 2 . 3]" 1 82 1 9 GLY H 1 11 PHE H 5.200 . 5.700 3.868 3.644 3.982 . 0 0 "[ . 1 . 2 . 3]" 1 83 1 9 GLY H 1 11 PHE QD 6.160 . 6.720 5.424 5.093 5.512 . 0 0 "[ . 1 . 2 . 3]" 1 84 1 9 GLY QA 1 11 PHE H 6.160 . 6.720 4.278 4.143 4.395 . 0 0 "[ . 1 . 2 . 3]" 1 85 1 10 ASP H 1 11 PHE H 3.700 . 4.200 1.975 1.840 2.118 . 0 0 "[ . 1 . 2 . 3]" 1 86 1 10 ASP H 1 11 PHE HA 5.500 . 6.000 4.670 4.442 4.850 . 0 0 "[ . 1 . 2 . 3]" 1 87 1 10 ASP H 1 11 PHE QB 6.160 . 6.720 4.889 4.813 5.059 . 0 0 "[ . 1 . 2 . 3]" 1 88 1 10 ASP H 1 11 PHE QD 5.936 . 6.496 4.397 4.164 4.520 . 0 0 "[ . 1 . 2 . 3]" 1 89 1 10 ASP H 1 11 PHE QE 6.160 . 6.720 5.232 5.049 5.499 . 0 0 "[ . 1 . 2 . 3]" 1 90 1 10 ASP H 1 40 LYS H 5.500 . 6.000 5.576 5.515 5.634 . 0 0 "[ . 1 . 2 . 3]" 1 91 1 10 ASP H 1 40 LYS QB 5.712 . 6.272 5.102 4.887 5.205 . 0 0 "[ . 1 . 2 . 3]" 1 92 1 10 ASP H 1 40 LYS QE 6.160 . 6.720 4.694 4.353 5.088 . 0 0 "[ . 1 . 2 . 3]" 1 93 1 10 ASP H 1 79 LEU QD 7.425 . 8.100 5.542 5.435 5.594 . 0 0 "[ . 1 . 2 . 3]" 1 94 1 10 ASP HA 1 40 LYS H 4.200 . 4.700 3.640 3.490 3.796 . 0 0 "[ . 1 . 2 . 3]" 1 95 1 10 ASP HA 1 40 LYS QB 3.808 . 4.368 2.831 2.377 3.064 . 0 0 "[ . 1 . 2 . 3]" 1 96 1 10 ASP HA 1 40 LYS QE 5.488 . 6.048 2.164 1.934 2.528 . 0 0 "[ . 1 . 2 . 3]" 1 97 1 10 ASP QB 1 11 PHE H 5.264 . 5.824 3.293 2.884 4.094 . 0 0 "[ . 1 . 2 . 3]" 1 98 1 10 ASP QB 1 11 PHE QB 6.021 . 6.648 4.032 3.782 4.780 . 0 0 "[ . 1 . 2 . 3]" 1 99 1 10 ASP QB 1 11 PHE QD 6.648 . 7.276 3.403 2.940 4.856 . 0 0 "[ . 1 . 2 . 3]" 1 100 1 10 ASP QB 1 39 LYS QD 5.770 . 6.397 4.181 2.897 4.658 . 0 0 "[ . 1 . 2 . 3]" 1 101 1 10 ASP QB 1 39 LYS QG 6.021 . 6.648 4.086 3.289 4.864 . 0 0 "[ . 1 . 2 . 3]" 1 102 1 10 ASP QB 1 40 LYS H 5.040 . 5.600 4.299 3.463 4.639 . 0 0 "[ . 1 . 2 . 3]" 1 103 1 10 ASP QB 1 40 LYS QB 6.021 . 6.648 4.470 2.959 4.804 . 0 0 "[ . 1 . 2 . 3]" 1 104 1 10 ASP QB 1 40 LYS QE 5.018 . 5.645 3.722 2.107 4.015 . 0 0 "[ . 1 . 2 . 3]" 1 105 1 11 PHE H 1 11 PHE QD 4.816 . 5.376 3.160 2.856 3.283 . 0 0 "[ . 1 . 2 . 3]" 1 106 1 11 PHE H 1 11 PHE QE 5.824 . 6.384 4.666 4.462 4.820 . 0 0 "[ . 1 . 2 . 3]" 1 107 1 11 PHE H 1 12 ALA H 4.700 . 5.200 4.428 4.380 4.477 . 0 0 "[ . 1 . 2 . 3]" 1 108 1 11 PHE H 1 12 ALA HA 5.500 . 6.000 4.942 4.799 5.078 . 0 0 "[ . 1 . 2 . 3]" 1 109 1 11 PHE H 1 12 ALA MB 6.240 . 6.840 4.759 4.636 4.967 . 0 0 "[ . 1 . 2 . 3]" 1 110 1 11 PHE H 1 40 LYS H 5.500 . 6.000 4.639 4.505 4.836 . 0 0 "[ . 1 . 2 . 3]" 1 111 1 11 PHE H 1 79 LEU QD 6.345 . 7.020 4.087 4.024 4.421 . 0 0 "[ . 1 . 2 . 3]" 1 112 1 11 PHE H 1 80 LYS H 5.400 . 5.900 4.221 3.930 4.493 . 0 0 "[ . 1 . 2 . 3]" 1 113 1 11 PHE H 1 80 LYS QE 6.160 . 6.720 4.233 3.109 4.768 . 0 0 "[ . 1 . 2 . 3]" 1 114 1 11 PHE HA 1 12 ALA H 3.300 . 3.800 2.292 2.252 2.315 . 0 0 "[ . 1 . 2 . 3]" 1 115 1 11 PHE HA 1 12 ALA HA 5.100 . 5.600 4.429 4.386 4.456 . 0 0 "[ . 1 . 2 . 3]" 1 116 1 11 PHE HA 1 12 ALA MB 4.800 . 5.400 3.585 3.510 3.856 . 0 0 "[ . 1 . 2 . 3]" 1 117 1 11 PHE HA 1 38 SER H 4.600 . 5.100 4.630 4.436 4.670 . 0 0 "[ . 1 . 2 . 3]" 1 118 1 11 PHE HA 1 39 LYS H 5.100 . 5.600 4.759 4.476 4.887 . 0 0 "[ . 1 . 2 . 3]" 1 119 1 11 PHE HA 1 39 LYS HA 4.000 . 4.500 2.339 2.172 2.616 . 0 0 "[ . 1 . 2 . 3]" 1 120 1 11 PHE HA 1 40 LYS H 4.500 . 5.000 2.952 2.770 3.201 . 0 0 "[ . 1 . 2 . 3]" 1 121 1 11 PHE HA 1 79 LEU QD 6.345 . 7.020 3.735 3.632 4.753 . 0 0 "[ . 1 . 2 . 3]" 1 122 1 11 PHE QB 1 12 ALA H 5.040 . 5.600 2.539 2.426 2.846 . 0 0 "[ . 1 . 2 . 3]" 1 123 1 11 PHE QB 1 12 ALA HA 5.488 . 6.048 4.477 4.404 4.541 . 0 0 "[ . 1 . 2 . 3]" 1 124 1 11 PHE QB 1 38 SER H 6.160 . 6.720 3.962 3.784 4.062 . 0 0 "[ . 1 . 2 . 3]" 1 125 1 11 PHE QB 1 39 LYS H 6.160 . 6.720 4.434 4.351 4.595 . 0 0 "[ . 1 . 2 . 3]" 1 126 1 11 PHE QB 1 39 LYS QD 5.645 . 6.272 3.492 2.361 4.052 . 0 0 "[ . 1 . 2 . 3]" 1 127 1 11 PHE QB 1 40 LYS H 6.160 . 6.720 3.627 3.502 3.797 . 0 0 "[ . 1 . 2 . 3]" 1 128 1 11 PHE QB 1 70 PHE QD 6.774 . 7.401 5.392 5.304 5.431 . 0 0 "[ . 1 . 2 . 3]" 1 129 1 11 PHE QB 1 79 LEU QD 5.594 . 6.350 2.114 2.039 3.023 . 0 0 "[ . 1 . 2 . 3]" 1 130 1 11 PHE QB 1 80 LYS H 6.160 . 6.720 4.938 4.727 5.061 . 0 0 "[ . 1 . 2 . 3]" 1 131 1 11 PHE QD 1 12 ALA H 5.376 . 5.936 4.283 4.161 4.569 . 0 0 "[ . 1 . 2 . 3]" 1 132 1 11 PHE QD 1 13 ALA MB 7.392 . 8.064 5.491 5.429 5.536 . 0 0 "[ . 1 . 2 . 3]" 1 133 1 11 PHE QD 1 39 LYS HA 5.936 . 6.496 3.899 3.731 4.235 . 0 0 "[ . 1 . 2 . 3]" 1 134 1 11 PHE QD 1 70 PHE QE 6.523 . 7.150 3.524 3.431 3.697 . 0 0 "[ . 1 . 2 . 3]" 1 135 1 11 PHE QD 1 79 LEU QD 5.897 . 6.653 2.055 2.020 2.139 . 0 0 "[ . 1 . 2 . 3]" 1 136 1 11 PHE QD 1 79 LEU HG 5.488 . 6.048 2.769 2.175 3.232 . 0 0 "[ . 1 . 2 . 3]" 1 137 1 11 PHE QD 1 80 LYS H 6.160 . 6.720 4.005 3.634 4.170 . 0 0 "[ . 1 . 2 . 3]" 1 138 1 11 PHE QE 1 70 PHE QD 6.147 . 6.774 3.413 3.042 3.588 . 0 0 "[ . 1 . 2 . 3]" 1 139 1 11 PHE QE 1 70 PHE QE 6.272 . 6.899 2.922 2.720 3.160 . 0 0 "[ . 1 . 2 . 3]" 1 140 1 11 PHE QE 1 78 GLN HA 6.048 . 6.608 5.024 4.376 5.379 . 0 0 "[ . 1 . 2 . 3]" 1 141 1 11 PHE QE 1 79 LEU QB 6.899 . 7.526 4.948 4.703 5.031 . 0 0 "[ . 1 . 2 . 3]" 1 142 1 11 PHE QE 1 79 LEU QD 7.862 . 8.618 3.474 2.160 3.603 . 0 0 "[ . 1 . 2 . 3]" 1 143 1 11 PHE QE 1 79 LEU HG 5.264 . 5.824 3.288 3.133 3.871 . 0 0 "[ . 1 . 2 . 3]" 1 144 1 11 PHE HZ 1 70 PHE QD 6.160 . 6.720 3.197 3.005 3.395 . 0 0 "[ . 1 . 2 . 3]" 1 145 1 11 PHE HZ 1 78 GLN QB 5.936 . 6.496 4.300 3.495 4.750 . 0 0 "[ . 1 . 2 . 3]" 1 146 1 11 PHE HZ 1 79 LEU QD 7.290 . 7.965 4.778 3.760 4.918 . 0 0 "[ . 1 . 2 . 3]" 1 147 1 11 PHE HZ 1 79 LEU HG 5.400 . 5.900 5.354 4.860 5.599 . 0 0 "[ . 1 . 2 . 3]" 1 148 1 12 ALA H 1 13 ALA H 4.900 . 5.400 4.499 4.458 4.591 . 0 0 "[ . 1 . 2 . 3]" 1 149 1 12 ALA H 1 37 LEU HA 4.600 . 5.100 4.622 4.537 4.642 . 0 0 "[ . 1 . 2 . 3]" 1 150 1 12 ALA H 1 37 LEU QB 6.160 . 6.720 4.247 4.154 4.475 . 0 0 "[ . 1 . 2 . 3]" 1 151 1 12 ALA H 1 37 LEU QD 7.425 . 8.100 4.890 4.773 5.088 . 0 0 "[ . 1 . 2 . 3]" 1 152 1 12 ALA H 1 38 SER H 3.900 . 4.400 2.680 2.559 2.725 . 0 0 "[ . 1 . 2 . 3]" 1 153 1 12 ALA H 1 38 SER QB 5.488 . 6.048 4.062 3.100 4.460 . 0 0 "[ . 1 . 2 . 3]" 1 154 1 12 ALA H 1 39 LYS HA 5.000 . 5.500 3.719 3.543 3.906 . 0 0 "[ . 1 . 2 . 3]" 1 155 1 12 ALA H 1 40 LYS H 5.400 . 5.900 4.898 4.659 5.159 . 0 0 "[ . 1 . 2 . 3]" 1 156 1 12 ALA H 1 79 LEU HA 5.300 . 5.800 4.672 4.501 5.024 . 0 0 "[ . 1 . 2 . 3]" 1 157 1 12 ALA H 1 79 LEU QD 5.670 . 6.345 2.835 2.723 3.785 . 0 0 "[ . 1 . 2 . 3]" 1 158 1 12 ALA H 1 80 LYS H 4.900 . 5.400 4.367 4.229 4.452 . 0 0 "[ . 1 . 2 . 3]" 1 159 1 12 ALA H 1 80 LYS QE 6.160 . 6.720 4.281 3.093 4.624 . 0 0 "[ . 1 . 2 . 3]" 1 160 1 12 ALA H 1 80 LYS QG 6.160 . 6.720 4.769 4.450 4.973 . 0 0 "[ . 1 . 2 . 3]" 1 161 1 12 ALA HA 1 13 ALA H 3.300 . 3.800 2.308 2.287 2.332 . 0 0 "[ . 1 . 2 . 3]" 1 162 1 12 ALA HA 1 13 ALA MB 5.400 . 6.000 3.797 3.741 3.947 . 0 0 "[ . 1 . 2 . 3]" 1 163 1 12 ALA HA 1 79 LEU HA 4.300 . 4.800 3.380 3.240 3.642 . 0 0 "[ . 1 . 2 . 3]" 1 164 1 12 ALA HA 1 79 LEU QB 5.936 . 6.496 2.875 2.648 3.062 . 0 0 "[ . 1 . 2 . 3]" 1 165 1 12 ALA HA 1 79 LEU QD 6.210 . 6.885 3.149 3.016 3.961 . 0 0 "[ . 1 . 2 . 3]" 1 166 1 12 ALA HA 1 80 LYS H 3.700 . 4.200 2.079 1.972 2.155 . 0 0 "[ . 1 . 2 . 3]" 1 167 1 12 ALA HA 1 80 LYS HA 5.000 . 5.500 4.145 4.044 4.215 . 0 0 "[ . 1 . 2 . 3]" 1 168 1 12 ALA HA 1 80 LYS QB 4.480 . 5.040 2.365 2.120 2.488 . 0 0 "[ . 1 . 2 . 3]" 1 169 1 12 ALA HA 1 80 LYS QE 5.936 . 6.496 3.571 2.945 3.843 . 0 0 "[ . 1 . 2 . 3]" 1 170 1 12 ALA HA 1 80 LYS QG 5.824 . 6.384 3.108 2.632 3.316 . 0 0 "[ . 1 . 2 . 3]" 1 171 1 12 ALA MB 1 13 ALA H 3.720 . 4.320 2.578 2.462 2.658 . 0 0 "[ . 1 . 2 . 3]" 1 172 1 12 ALA MB 1 13 ALA MB 6.048 . 6.768 4.190 4.161 4.212 . 0 0 "[ . 1 . 2 . 3]" 1 173 1 12 ALA MB 1 38 SER H 4.920 . 5.520 3.241 2.708 3.404 . 0 0 "[ . 1 . 2 . 3]" 1 174 1 12 ALA MB 1 38 SER QB 6.048 . 6.720 3.379 2.105 3.895 . 0 0 "[ . 1 . 2 . 3]" 1 175 1 12 ALA MB 1 55 TRP HH2 5.760 . 6.360 3.872 2.947 4.196 . 0 0 "[ . 1 . 2 . 3]" 1 176 1 12 ALA MB 1 55 TRP HZ2 6.480 . 7.080 5.167 4.542 5.405 . 0 0 "[ . 1 . 2 . 3]" 1 177 1 12 ALA MB 1 79 LEU QD 7.614 . 8.424 3.833 3.778 4.363 . 0 0 "[ . 1 . 2 . 3]" 1 178 1 12 ALA MB 1 80 LYS H 4.320 . 4.920 3.468 3.394 3.644 . 0 0 "[ . 1 . 2 . 3]" 1 179 1 12 ALA MB 1 80 LYS HA 6.240 . 6.840 4.669 4.617 4.716 . 0 0 "[ . 1 . 2 . 3]" 1 180 1 12 ALA MB 1 80 LYS QB 4.704 . 5.376 2.188 2.137 2.222 . 0 0 "[ . 1 . 2 . 3]" 1 181 1 12 ALA MB 1 80 LYS QE 4.704 . 5.376 2.031 1.852 2.298 . 0 0 "[ . 1 . 2 . 3]" 1 182 1 12 ALA MB 1 80 LYS QG 4.570 . 5.242 3.091 2.653 3.413 . 0 0 "[ . 1 . 2 . 3]" 1 183 1 12 ALA MB 1 81 GLY H 6.600 . 7.200 5.391 5.206 5.503 . 0 0 "[ . 1 . 2 . 3]" 1 184 1 13 ALA H 1 14 GLU HA 5.500 . 6.000 5.128 5.016 5.197 . 0 0 "[ . 1 . 2 . 3]" 1 185 1 13 ALA H 1 37 LEU HA 5.400 . 5.900 4.722 4.578 4.775 . 0 0 "[ . 1 . 2 . 3]" 1 186 1 13 ALA H 1 37 LEU QB 6.160 . 6.720 5.530 5.495 5.567 . 0 0 "[ . 1 . 2 . 3]" 1 187 1 13 ALA H 1 37 LEU QD 7.155 . 7.830 4.182 4.112 4.260 . 0 0 "[ . 1 . 2 . 3]" 1 188 1 13 ALA H 1 38 SER H 5.000 . 5.500 4.870 4.737 5.002 . 0 0 "[ . 1 . 2 . 3]" 1 189 1 13 ALA H 1 79 LEU HA 5.200 . 5.700 4.823 4.670 4.950 . 0 0 "[ . 1 . 2 . 3]" 1 190 1 13 ALA H 1 79 LEU QB 5.376 . 5.936 3.018 2.952 3.076 . 0 0 "[ . 1 . 2 . 3]" 1 191 1 13 ALA H 1 79 LEU QD 6.075 . 6.750 3.762 3.604 4.088 . 0 0 "[ . 1 . 2 . 3]" 1 192 1 13 ALA H 1 80 LYS H 4.100 . 4.600 3.793 3.551 3.935 . 0 0 "[ . 1 . 2 . 3]" 1 193 1 13 ALA H 1 80 LYS HA 5.500 . 6.000 4.748 4.616 4.819 . 0 0 "[ . 1 . 2 . 3]" 1 194 1 13 ALA H 1 80 LYS QB 5.040 . 5.600 3.221 2.798 3.388 . 0 0 "[ . 1 . 2 . 3]" 1 195 1 13 ALA H 1 80 LYS QE 6.160 . 6.720 4.940 4.673 5.585 . 0 0 "[ . 1 . 2 . 3]" 1 196 1 13 ALA H 1 81 GLY H 5.500 . 6.000 4.964 4.884 5.067 . 0 0 "[ . 1 . 2 . 3]" 1 197 1 13 ALA H 1 81 GLY QA 5.936 . 6.496 3.958 3.770 4.175 . 0 0 "[ . 1 . 2 . 3]" 1 198 1 13 ALA H 1 82 PHE H 5.000 . 5.500 4.253 4.009 4.498 . 0 0 "[ . 1 . 2 . 3]" 1 199 1 13 ALA H 1 82 PHE HA 4.900 . 5.400 4.931 4.688 4.998 . 0 0 "[ . 1 . 2 . 3]" 1 200 1 13 ALA H 1 82 PHE QB 6.160 . 6.720 4.686 4.459 4.864 . 0 0 "[ . 1 . 2 . 3]" 1 201 1 13 ALA H 1 85 LEU QD 7.425 . 8.100 4.619 4.245 4.939 . 0 0 "[ . 1 . 2 . 3]" 1 202 1 13 ALA HA 1 14 GLU H 3.100 . 3.600 2.241 2.199 2.328 . 0 0 "[ . 1 . 2 . 3]" 1 203 1 13 ALA HA 1 35 VAL QG 6.750 . 7.425 3.883 3.558 5.056 . 0 0 "[ . 1 . 2 . 3]" 1 204 1 13 ALA HA 1 36 ARG H 5.500 . 6.000 4.614 4.498 4.696 . 0 0 "[ . 1 . 2 . 3]" 1 205 1 13 ALA HA 1 37 LEU H 4.800 . 5.300 4.860 4.837 4.900 . 0 0 "[ . 1 . 2 . 3]" 1 206 1 13 ALA HA 1 37 LEU HA 3.900 . 4.400 2.320 2.274 2.416 . 0 0 "[ . 1 . 2 . 3]" 1 207 1 13 ALA HA 1 37 LEU QB 5.376 . 5.936 3.781 3.726 3.838 . 0 0 "[ . 1 . 2 . 3]" 1 208 1 13 ALA HA 1 37 LEU QD 4.725 . 5.400 2.244 2.134 2.406 . 0 0 "[ . 1 . 2 . 3]" 1 209 1 13 ALA HA 1 38 SER H 4.400 . 4.900 3.814 3.669 3.910 . 0 0 "[ . 1 . 2 . 3]" 1 210 1 13 ALA HA 1 55 TRP HZ3 5.100 . 5.600 3.884 3.689 4.254 . 0 0 "[ . 1 . 2 . 3]" 1 211 1 13 ALA HA 1 79 LEU QD 7.425 . 8.100 3.534 3.485 3.626 . 0 0 "[ . 1 . 2 . 3]" 1 212 1 13 ALA HA 1 85 LEU QD 7.155 . 7.830 3.921 3.747 4.079 . 0 0 "[ . 1 . 2 . 3]" 1 213 1 13 ALA MB 1 14 GLU H 4.800 . 5.400 3.043 2.864 3.316 . 0 0 "[ . 1 . 2 . 3]" 1 214 1 13 ALA MB 1 14 GLU HA 5.640 . 6.240 4.112 3.939 4.243 . 0 0 "[ . 1 . 2 . 3]" 1 215 1 13 ALA MB 1 35 VAL QG 6.480 . 7.290 3.087 2.902 3.990 . 0 0 "[ . 1 . 2 . 3]" 1 216 1 13 ALA MB 1 36 ARG H 6.600 . 7.200 4.842 4.654 5.183 . 0 0 "[ . 1 . 2 . 3]" 1 217 1 13 ALA MB 1 37 LEU HA 5.880 . 6.480 3.581 3.483 3.660 . 0 0 "[ . 1 . 2 . 3]" 1 218 1 13 ALA MB 1 37 LEU QB 4.973 . 5.645 3.803 3.783 3.822 . 0 0 "[ . 1 . 2 . 3]" 1 219 1 13 ALA MB 1 37 LEU QD 5.184 . 5.994 1.911 1.883 1.941 . 0 0 "[ . 1 . 2 . 3]" 1 220 1 13 ALA MB 1 37 LEU HG 5.040 . 5.640 3.982 3.930 4.053 . 0 0 "[ . 1 . 2 . 3]" 1 221 1 13 ALA MB 1 38 SER H 6.600 . 7.200 4.556 4.456 4.625 . 0 0 "[ . 1 . 2 . 3]" 1 222 1 13 ALA MB 1 79 LEU H 5.880 . 6.480 4.697 4.383 4.910 . 0 0 "[ . 1 . 2 . 3]" 1 223 1 13 ALA MB 1 79 LEU HA 6.000 . 6.600 4.449 4.358 4.534 . 0 0 "[ . 1 . 2 . 3]" 1 224 1 13 ALA MB 1 79 LEU QD 5.508 . 6.318 2.085 2.041 2.154 . 0 0 "[ . 1 . 2 . 3]" 1 225 1 13 ALA MB 1 80 LYS H 5.520 . 6.120 4.593 4.457 4.643 . 0 0 "[ . 1 . 2 . 3]" 1 226 1 13 ALA MB 1 80 LYS QB 7.392 . 8.064 4.800 4.492 4.947 . 0 0 "[ . 1 . 2 . 3]" 1 227 1 13 ALA MB 1 82 PHE H 5.520 . 6.120 3.371 3.070 3.685 . 0 0 "[ . 1 . 2 . 3]" 1 228 1 13 ALA MB 1 82 PHE HA 4.920 . 5.520 2.557 2.359 2.708 . 0 0 "[ . 1 . 2 . 3]" 1 229 1 13 ALA MB 1 82 PHE QB 6.586 . 7.258 2.790 2.367 3.109 . 0 0 "[ . 1 . 2 . 3]" 1 230 1 13 ALA MB 1 82 PHE QD 6.048 . 6.720 3.550 3.159 3.726 . 0 0 "[ . 1 . 2 . 3]" 1 231 1 13 ALA MB 1 85 LEU QD 6.318 . 7.128 2.281 2.070 2.493 . 0 0 "[ . 1 . 2 . 3]" 1 232 1 13 ALA MB 1 85 LEU HG 6.240 . 6.840 4.140 3.421 4.836 . 0 0 "[ . 1 . 2 . 3]" 1 233 1 13 ALA MB 1 93 LEU QD 6.318 . 7.128 2.785 2.556 3.102 . 0 0 "[ . 1 . 2 . 3]" 1 234 1 14 GLU H 1 14 GLU QG 4.816 . 5.376 3.535 2.566 4.299 . 0 0 "[ . 1 . 2 . 3]" 1 235 1 14 GLU H 1 15 TYR H 4.700 . 5.200 4.395 4.336 4.475 . 0 0 "[ . 1 . 2 . 3]" 1 236 1 14 GLU H 1 15 TYR HA 5.500 . 6.000 4.720 4.566 4.925 . 0 0 "[ . 1 . 2 . 3]" 1 237 1 14 GLU H 1 15 TYR QD 6.160 . 6.720 5.545 5.175 5.731 . 0 0 "[ . 1 . 2 . 3]" 1 238 1 14 GLU H 1 35 VAL HA 4.900 . 5.400 4.424 4.194 4.613 . 0 0 "[ . 1 . 2 . 3]" 1 239 1 14 GLU H 1 35 VAL QG 6.345 . 7.020 3.103 2.799 4.236 . 0 0 "[ . 1 . 2 . 3]" 1 240 1 14 GLU H 1 36 ARG H 4.000 . 4.500 2.958 2.880 3.050 . 0 0 "[ . 1 . 2 . 3]" 1 241 1 14 GLU H 1 36 ARG HA 5.500 . 6.000 4.959 4.906 5.056 . 0 0 "[ . 1 . 2 . 3]" 1 242 1 14 GLU H 1 36 ARG QG 5.936 . 6.496 3.366 3.097 3.536 . 0 0 "[ . 1 . 2 . 3]" 1 243 1 14 GLU H 1 37 LEU H 5.300 . 5.800 5.128 5.048 5.222 . 0 0 "[ . 1 . 2 . 3]" 1 244 1 14 GLU H 1 37 LEU HA 4.300 . 4.800 3.660 3.557 3.756 . 0 0 "[ . 1 . 2 . 3]" 1 245 1 14 GLU H 1 37 LEU QB 6.160 . 6.720 5.291 5.200 5.397 . 0 0 "[ . 1 . 2 . 3]" 1 246 1 14 GLU H 1 37 LEU QD 4.725 . 5.400 3.107 2.999 3.273 . 0 0 "[ . 1 . 2 . 3]" 1 247 1 14 GLU H 1 55 TRP HE3 5.500 . 6.000 5.518 5.318 5.571 . 0 0 "[ . 1 . 2 . 3]" 1 248 1 14 GLU H 1 55 TRP HZ3 5.500 . 6.000 3.740 3.345 3.905 . 0 0 "[ . 1 . 2 . 3]" 1 249 1 14 GLU H 1 85 LEU QD 6.210 . 6.885 3.227 3.038 3.383 . 0 0 "[ . 1 . 2 . 3]" 1 250 1 14 GLU HA 1 15 TYR H 3.200 . 3.700 2.507 2.390 2.634 . 0 0 "[ . 1 . 2 . 3]" 1 251 1 14 GLU HA 1 15 TYR QD 5.600 . 6.160 4.385 3.654 4.897 . 0 0 "[ . 1 . 2 . 3]" 1 252 1 14 GLU HA 1 36 ARG H 5.500 . 6.000 4.810 4.753 4.854 . 0 0 "[ . 1 . 2 . 3]" 1 253 1 14 GLU HA 1 37 LEU QD 7.155 . 7.830 5.189 5.068 5.314 . 0 0 "[ . 1 . 2 . 3]" 1 254 1 14 GLU HA 1 85 LEU QD 4.725 . 5.400 2.391 2.150 2.736 . 0 0 "[ . 1 . 2 . 3]" 1 255 1 14 GLU QB 1 15 TYR H 4.144 . 4.704 2.887 2.217 3.656 . 0 0 "[ . 1 . 2 . 3]" 1 256 1 14 GLU QB 1 55 TRP HH2 5.936 . 6.496 3.561 2.685 4.529 . 0 0 "[ . 1 . 2 . 3]" 1 257 1 14 GLU QB 1 55 TRP HZ3 6.160 . 6.720 3.672 2.644 4.718 . 0 0 "[ . 1 . 2 . 3]" 1 258 1 14 GLU QB 1 85 LEU QD 7.106 . 7.862 3.883 3.566 4.169 . 0 0 "[ . 1 . 2 . 3]" 1 259 1 14 GLU QG 1 15 TYR H 5.376 . 5.936 2.853 1.792 4.129 . 0 0 "[ . 1 . 2 . 3]" 1 260 1 14 GLU QG 1 36 ARG H 6.160 . 6.720 4.611 3.476 5.422 . 0 0 "[ . 1 . 2 . 3]" 1 261 1 14 GLU QG 1 55 TRP HH2 5.488 . 6.048 3.668 2.600 4.917 . 0 0 "[ . 1 . 2 . 3]" 1 262 1 15 TYR H 1 15 TYR QD 4.256 . 4.816 2.989 2.470 3.390 . 0 0 "[ . 1 . 2 . 3]" 1 263 1 15 TYR H 1 15 TYR QE 5.376 . 5.936 4.817 4.575 4.939 . 0 0 "[ . 1 . 2 . 3]" 1 264 1 15 TYR H 1 16 ALA H 4.600 . 5.100 4.584 4.512 4.631 . 0 0 "[ . 1 . 2 . 3]" 1 265 1 15 TYR H 1 35 VAL QG 7.425 . 8.100 4.477 4.086 4.791 . 0 0 "[ . 1 . 2 . 3]" 1 266 1 15 TYR H 1 36 ARG H 5.500 . 6.000 4.782 4.591 4.893 . 0 0 "[ . 1 . 2 . 3]" 1 267 1 15 TYR H 1 36 ARG QG 6.160 . 6.720 4.572 3.986 5.123 . 0 0 "[ . 1 . 2 . 3]" 1 268 1 15 TYR H 1 85 LEU QD 5.400 . 6.075 3.276 2.783 4.021 . 0 0 "[ . 1 . 2 . 3]" 1 269 1 15 TYR H 1 85 LEU HG 5.300 . 5.800 5.020 4.278 5.358 . 0 0 "[ . 1 . 2 . 3]" 1 270 1 15 TYR HA 1 15 TYR QD 4.032 . 4.592 2.399 2.142 2.947 . 0 0 "[ . 1 . 2 . 3]" 1 271 1 15 TYR HA 1 15 TYR QE 5.376 . 5.936 4.499 4.241 4.686 . 0 0 "[ . 1 . 2 . 3]" 1 272 1 15 TYR HA 1 16 ALA H 3.200 . 3.700 2.162 2.107 2.224 . 0 0 "[ . 1 . 2 . 3]" 1 273 1 15 TYR HA 1 16 ALA HA 4.800 . 5.300 4.349 4.261 4.415 . 0 0 "[ . 1 . 2 . 3]" 1 274 1 15 TYR HA 1 16 ALA MB 4.680 . 5.280 3.900 3.826 3.936 . 0 0 "[ . 1 . 2 . 3]" 1 275 1 15 TYR HA 1 33 GLY H 5.500 . 6.000 5.458 5.208 5.578 . 0 0 "[ . 1 . 2 . 3]" 1 276 1 15 TYR HA 1 34 GLN H 5.500 . 6.000 4.719 4.416 5.202 . 0 0 "[ . 1 . 2 . 3]" 1 277 1 15 TYR HA 1 34 GLN HE21 5.500 . 6.000 5.547 5.290 5.803 . 0 0 "[ . 1 . 2 . 3]" 1 278 1 15 TYR HA 1 35 VAL HA 3.700 . 4.200 2.290 2.032 2.446 . 0 0 "[ . 1 . 2 . 3]" 1 279 1 15 TYR HA 1 35 VAL QG 6.345 . 7.020 3.417 3.229 3.771 . 0 0 "[ . 1 . 2 . 3]" 1 280 1 15 TYR HA 1 36 ARG H 4.700 . 5.200 3.169 2.867 3.451 . 0 0 "[ . 1 . 2 . 3]" 1 281 1 15 TYR QB 1 16 ALA H 4.592 . 5.152 2.932 2.678 3.218 . 0 0 "[ . 1 . 2 . 3]" 1 282 1 15 TYR QB 1 33 GLY H 6.160 . 6.720 4.153 3.922 4.429 . 0 0 "[ . 1 . 2 . 3]" 1 283 1 15 TYR QB 1 33 GLY QA 5.519 . 6.147 3.288 3.012 3.713 . 0 0 "[ . 1 . 2 . 3]" 1 284 1 15 TYR QB 1 35 VAL HA 5.376 . 5.936 4.191 3.865 4.443 . 0 0 "[ . 1 . 2 . 3]" 1 285 1 15 TYR QB 1 85 LEU QD 8.316 . 9.072 4.225 3.662 4.905 . 0 0 "[ . 1 . 2 . 3]" 1 286 1 15 TYR QD 1 16 ALA H 4.592 . 5.152 3.842 3.348 4.130 . 0 0 "[ . 1 . 2 . 3]" 1 287 1 15 TYR QD 1 34 GLN HA 5.712 . 6.272 3.506 2.580 4.515 . 0 0 "[ . 1 . 2 . 3]" 1 288 1 15 TYR QD 1 35 VAL H 5.376 . 5.936 3.731 3.158 4.677 . 0 0 "[ . 1 . 2 . 3]" 1 289 1 15 TYR QD 1 35 VAL HA 4.592 . 5.152 2.764 2.385 3.389 . 0 0 "[ . 1 . 2 . 3]" 1 290 1 15 TYR QD 1 35 VAL HB 5.600 . 6.160 4.721 3.180 5.016 . 0 0 "[ . 1 . 2 . 3]" 1 291 1 15 TYR QD 1 35 VAL QG 5.292 . 6.048 2.639 2.241 3.473 . 0 0 "[ . 1 . 2 . 3]" 1 292 1 15 TYR QD 1 36 ARG H 6.048 . 6.608 4.521 4.223 5.122 . 0 0 "[ . 1 . 2 . 3]" 1 293 1 15 TYR QD 1 85 LEU HA 5.264 . 5.824 4.156 3.351 4.721 . 0 0 "[ . 1 . 2 . 3]" 1 294 1 15 TYR QD 1 85 LEU QD 6.048 . 6.804 2.966 2.077 3.778 . 0 0 "[ . 1 . 2 . 3]" 1 295 1 15 TYR QD 1 85 LEU HG 5.712 . 6.272 4.434 2.656 5.197 . 0 0 "[ . 1 . 2 . 3]" 1 296 1 15 TYR QD 1 86 ALA H 6.160 . 6.720 4.917 4.094 5.108 . 0 0 "[ . 1 . 2 . 3]" 1 297 1 15 TYR QD 1 86 ALA MB 7.123 . 7.795 5.271 4.741 5.341 . 0 0 "[ . 1 . 2 . 3]" 1 298 1 15 TYR QE 1 35 VAL H 5.600 . 6.160 4.266 3.644 5.023 . 0 0 "[ . 1 . 2 . 3]" 1 299 1 15 TYR QE 1 35 VAL HA 5.824 . 6.384 4.246 3.858 4.669 . 0 0 "[ . 1 . 2 . 3]" 1 300 1 15 TYR QE 1 35 VAL HB 6.160 . 6.720 4.920 2.486 5.540 . 0 0 "[ . 1 . 2 . 3]" 1 301 1 15 TYR QE 1 35 VAL QG 4.990 . 5.746 2.430 2.080 3.318 . 0 0 "[ . 1 . 2 . 3]" 1 302 1 15 TYR QE 1 85 LEU HA 4.032 . 4.592 2.755 2.068 3.593 . 0 0 "[ . 1 . 2 . 3]" 1 303 1 15 TYR QE 1 85 LEU QB 6.523 . 7.150 3.310 2.731 3.864 . 0 0 "[ . 1 . 2 . 3]" 1 304 1 15 TYR QE 1 85 LEU QD 5.443 . 6.199 2.828 2.267 3.603 . 0 0 "[ . 1 . 2 . 3]" 1 305 1 15 TYR QE 1 85 LEU HG 5.488 . 6.048 3.903 2.481 4.967 . 0 0 "[ . 1 . 2 . 3]" 1 306 1 15 TYR QE 1 86 ALA H 4.592 . 5.152 2.844 2.518 3.141 . 0 0 "[ . 1 . 2 . 3]" 1 307 1 15 TYR QE 1 86 ALA HA 6.160 . 6.720 5.077 4.693 5.395 . 0 0 "[ . 1 . 2 . 3]" 1 308 1 15 TYR QE 1 86 ALA MB 5.645 . 6.317 3.520 3.217 3.654 . 0 0 "[ . 1 . 2 . 3]" 1 309 1 15 TYR QE 1 89 ASP H 6.160 . 6.720 5.521 5.252 5.588 . 0 0 "[ . 1 . 2 . 3]" 1 310 1 16 ALA H 1 17 LYS HA 5.500 . 6.000 5.466 5.304 5.581 . 0 0 "[ . 1 . 2 . 3]" 1 311 1 16 ALA H 1 30 ILE MG 5.880 . 6.480 4.398 4.150 4.612 . 0 0 "[ . 1 . 2 . 3]" 1 312 1 16 ALA H 1 32 LYS HA 4.700 . 5.200 4.651 4.204 4.751 . 0 0 "[ . 1 . 2 . 3]" 1 313 1 16 ALA H 1 33 GLY H 4.400 . 4.900 3.820 3.562 4.005 . 0 0 "[ . 1 . 2 . 3]" 1 314 1 16 ALA H 1 33 GLY QA 5.264 . 5.824 4.303 3.989 4.598 . 0 0 "[ . 1 . 2 . 3]" 1 315 1 16 ALA H 1 34 GLN H 4.300 . 4.800 3.307 3.112 3.767 . 0 0 "[ . 1 . 2 . 3]" 1 316 1 16 ALA H 1 34 GLN HA 5.400 . 5.900 4.535 4.403 4.742 . 0 0 "[ . 1 . 2 . 3]" 1 317 1 16 ALA H 1 34 GLN QB 6.160 . 6.720 5.216 5.146 5.296 . 0 0 "[ . 1 . 2 . 3]" 1 318 1 16 ALA H 1 34 GLN QG 6.160 . 6.720 4.938 4.780 5.076 . 0 0 "[ . 1 . 2 . 3]" 1 319 1 16 ALA H 1 35 VAL H 5.100 . 5.600 4.810 4.709 4.938 . 0 0 "[ . 1 . 2 . 3]" 1 320 1 16 ALA H 1 35 VAL HA 4.200 . 4.700 3.398 3.147 3.638 . 0 0 "[ . 1 . 2 . 3]" 1 321 1 16 ALA H 1 35 VAL QG 7.020 . 7.695 4.523 4.407 4.691 . 0 0 "[ . 1 . 2 . 3]" 1 322 1 16 ALA H 1 36 ARG HA 5.500 . 6.000 5.535 5.399 5.592 . 0 0 "[ . 1 . 2 . 3]" 1 323 1 16 ALA H 1 36 ARG QD 6.160 . 6.720 4.194 3.901 4.551 . 0 0 "[ . 1 . 2 . 3]" 1 324 1 16 ALA H 1 36 ARG QG 6.160 . 6.720 3.060 2.807 3.308 . 0 0 "[ . 1 . 2 . 3]" 1 325 1 16 ALA HA 1 30 ILE MG 6.360 . 6.960 3.978 3.671 4.318 . 0 0 "[ . 1 . 2 . 3]" 1 326 1 16 ALA HA 1 33 GLY H 5.500 . 6.000 4.654 4.452 4.791 . 0 0 "[ . 1 . 2 . 3]" 1 327 1 16 ALA HA 1 34 GLN HE21 5.100 . 5.600 5.115 4.948 5.206 . 0 0 "[ . 1 . 2 . 3]" 1 328 1 16 ALA HA 1 36 ARG QD 4.704 . 5.264 2.331 2.081 2.709 . 0 0 "[ . 1 . 2 . 3]" 1 329 1 16 ALA HA 1 36 ARG QG 5.376 . 5.936 2.599 2.364 3.149 . 0 0 "[ . 1 . 2 . 3]" 1 330 1 16 ALA MB 1 17 LYS HA 5.520 . 6.120 4.562 4.413 4.614 . 0 0 "[ . 1 . 2 . 3]" 1 331 1 16 ALA MB 1 18 SER H 5.160 . 5.760 3.384 3.090 3.677 . 0 0 "[ . 1 . 2 . 3]" 1 332 1 16 ALA MB 1 30 ILE MD 6.480 . 7.200 4.363 4.176 4.520 . 0 0 "[ . 1 . 2 . 3]" 1 333 1 16 ALA MB 1 30 ILE MG 4.752 . 5.472 2.207 2.069 2.402 . 0 0 "[ . 1 . 2 . 3]" 1 334 1 16 ALA MB 1 31 GLU H 6.120 . 6.720 4.406 4.216 4.599 . 0 0 "[ . 1 . 2 . 3]" 1 335 1 16 ALA MB 1 32 LYS H 5.880 . 6.480 4.132 4.000 4.287 . 0 0 "[ . 1 . 2 . 3]" 1 336 1 16 ALA MB 1 32 LYS HA 4.320 . 4.920 2.309 2.074 2.702 . 0 0 "[ . 1 . 2 . 3]" 1 337 1 16 ALA MB 1 32 LYS QE 7.392 . 8.064 5.360 4.940 5.498 . 0 0 "[ . 1 . 2 . 3]" 1 338 1 16 ALA MB 1 33 GLY H 4.320 . 4.920 2.641 2.330 2.850 . 0 0 "[ . 1 . 2 . 3]" 1 339 1 16 ALA MB 1 34 GLN H 4.920 . 5.520 2.553 2.346 3.096 . 0 0 "[ . 1 . 2 . 3]" 1 340 1 16 ALA MB 1 34 GLN QB 6.720 . 7.392 4.662 4.507 4.871 . 0 0 "[ . 1 . 2 . 3]" 1 341 1 16 ALA MB 1 34 GLN HE21 4.200 . 4.800 2.411 2.296 2.498 . 0 0 "[ . 1 . 2 . 3]" 1 342 1 16 ALA MB 1 34 GLN HE22 6.600 . 7.200 3.046 2.744 3.267 . 0 0 "[ . 1 . 2 . 3]" 1 343 1 16 ALA MB 1 34 GLN QG 7.392 . 8.064 3.615 3.445 3.836 . 0 0 "[ . 1 . 2 . 3]" 1 344 1 16 ALA MB 1 35 VAL H 6.600 . 7.200 5.116 4.986 5.316 . 0 0 "[ . 1 . 2 . 3]" 1 345 1 16 ALA MB 1 35 VAL HA 5.760 . 6.360 4.425 4.227 4.711 . 0 0 "[ . 1 . 2 . 3]" 1 346 1 16 ALA MB 1 36 ARG QD 5.914 . 6.586 2.492 2.218 3.406 . 0 0 "[ . 1 . 2 . 3]" 1 347 1 17 LYS HA 1 18 SER HA 4.800 . 5.300 4.571 4.446 4.666 . 0 0 "[ . 1 . 2 . 3]" 1 348 1 17 LYS HA 1 32 LYS QD 5.824 . 6.384 4.854 2.752 5.209 . 0 0 "[ . 1 . 2 . 3]" 1 349 1 17 LYS HA 1 32 LYS QE 4.704 . 5.264 3.437 2.745 3.780 . 0 0 "[ . 1 . 2 . 3]" 1 350 1 17 LYS HA 1 32 LYS QG 5.376 . 5.936 3.625 3.198 4.841 . 0 0 "[ . 1 . 2 . 3]" 1 351 1 17 LYS QB 1 18 SER H 5.824 . 6.384 3.054 2.743 3.774 . 0 0 "[ . 1 . 2 . 3]" 1 352 1 17 LYS QB 1 18 SER HA 5.712 . 6.272 4.646 4.386 5.020 . 0 0 "[ . 1 . 2 . 3]" 1 353 1 17 LYS QB 1 32 LYS QE 6.397 . 7.025 4.552 4.208 5.084 . 0 0 "[ . 1 . 2 . 3]" 1 354 1 18 SER H 1 20 ARG H 4.600 . 5.100 4.310 4.061 4.629 . 0 0 "[ . 1 . 2 . 3]" 1 355 1 18 SER H 1 20 ARG QB 5.936 . 6.496 5.196 4.815 5.348 . 0 0 "[ . 1 . 2 . 3]" 1 356 1 18 SER H 1 30 ILE MG 6.600 . 7.200 5.368 5.106 5.524 . 0 0 "[ . 1 . 2 . 3]" 1 357 1 18 SER H 1 32 LYS HA 5.100 . 5.600 4.095 3.690 4.377 . 0 0 "[ . 1 . 2 . 3]" 1 358 1 18 SER H 1 32 LYS QE 6.160 . 6.720 4.698 4.392 4.930 . 0 0 "[ . 1 . 2 . 3]" 1 359 1 18 SER H 1 32 LYS QG 6.160 . 6.720 3.771 3.372 5.513 . 0 0 "[ . 1 . 2 . 3]" 1 360 1 18 SER H 1 33 GLY H 5.200 . 5.700 4.943 4.565 5.217 . 0 0 "[ . 1 . 2 . 3]" 1 361 1 18 SER HA 1 20 ARG H 5.500 . 6.000 4.014 3.695 4.455 . 0 0 "[ . 1 . 2 . 3]" 1 362 1 18 SER HA 1 20 ARG QG 5.936 . 6.496 4.587 4.210 5.048 . 0 0 "[ . 1 . 2 . 3]" 1 363 1 18 SER HA 1 32 LYS QB 4.816 . 5.376 3.168 2.540 3.771 . 0 0 "[ . 1 . 2 . 3]" 1 364 1 18 SER HA 1 32 LYS QE 3.920 . 4.480 3.349 2.892 3.512 . 0 0 "[ . 1 . 2 . 3]" 1 365 1 18 SER HA 1 32 LYS QG 5.152 . 5.712 2.879 2.174 4.340 . 0 0 "[ . 1 . 2 . 3]" 1 366 1 18 SER QB 1 20 ARG H 5.376 . 5.936 2.758 2.179 3.429 . 0 0 "[ . 1 . 2 . 3]" 1 367 1 18 SER QB 1 20 ARG HA 5.712 . 6.272 4.886 4.475 5.124 . 0 0 "[ . 1 . 2 . 3]" 1 368 1 18 SER QB 1 20 ARG QB 6.272 . 6.899 2.872 2.475 3.644 . 0 0 "[ . 1 . 2 . 3]" 1 369 1 18 SER QB 1 20 ARG QD 6.147 . 6.774 4.391 3.122 4.932 . 0 0 "[ . 1 . 2 . 3]" 1 370 1 18 SER QB 1 20 ARG QG 5.519 . 6.147 2.745 2.271 3.659 . 0 0 "[ . 1 . 2 . 3]" 1 371 1 19 ASN HA 1 21 SER H 5.400 . 5.900 3.707 3.223 4.109 . 0 0 "[ . 1 . 2 . 3]" 1 372 1 19 ASN HA 1 31 GLU H 5.500 . 6.000 5.429 5.006 5.540 . 0 0 "[ . 1 . 2 . 3]" 1 373 1 19 ASN HA 1 31 GLU HA 4.000 . 4.500 3.681 2.759 4.042 . 0 0 "[ . 1 . 2 . 3]" 1 374 1 19 ASN HA 1 32 LYS H 4.200 . 4.700 3.482 2.872 3.945 . 0 0 "[ . 1 . 2 . 3]" 1 375 1 19 ASN QB 1 20 ARG H 6.160 . 6.720 3.730 3.291 4.014 . 0 0 "[ . 1 . 2 . 3]" 1 376 1 19 ASN QB 1 20 ARG HA 5.264 . 5.824 4.645 4.240 4.801 . 0 0 "[ . 1 . 2 . 3]" 1 377 1 19 ASN QB 1 20 ARG QG 5.645 . 6.272 4.090 3.576 4.462 . 0 0 "[ . 1 . 2 . 3]" 1 378 1 19 ASN QB 1 31 GLU HA 4.928 . 5.488 3.860 3.365 4.402 . 0 0 "[ . 1 . 2 . 3]" 1 379 1 19 ASN QB 1 32 LYS H 4.704 . 5.264 3.084 2.700 4.194 . 0 0 "[ . 1 . 2 . 3]" 1 380 1 19 ASN QB 1 32 LYS QB 5.645 . 6.272 2.630 2.203 4.483 . 0 0 "[ . 1 . 2 . 3]" 1 381 1 19 ASN HD21 1 31 GLU HA 5.500 . 6.000 2.566 2.172 3.719 . 0 0 "[ . 1 . 2 . 3]" 1 382 1 19 ASN HD21 1 31 GLU QG 6.160 . 6.720 4.482 3.926 5.407 . 0 0 "[ . 1 . 2 . 3]" 1 383 1 19 ASN HD21 1 32 LYS H 5.500 . 6.000 3.053 2.205 3.511 . 0 0 "[ . 1 . 2 . 3]" 1 384 1 19 ASN HD21 1 32 LYS HA 5.500 . 6.000 5.068 4.689 5.549 . 0 0 "[ . 1 . 2 . 3]" 1 385 1 19 ASN HD21 1 32 LYS QB 6.160 . 6.720 3.942 2.532 4.514 . 0 0 "[ . 1 . 2 . 3]" 1 386 1 19 ASN HD22 1 31 GLU HA 5.500 . 6.000 2.899 2.273 3.754 . 0 0 "[ . 1 . 2 . 3]" 1 387 1 19 ASN HD22 1 31 GLU QB 6.160 . 6.720 4.336 3.173 5.492 . 0 0 "[ . 1 . 2 . 3]" 1 388 1 19 ASN HD22 1 32 LYS H 5.300 . 5.800 3.704 2.360 4.771 . 0 0 "[ . 1 . 2 . 3]" 1 389 1 19 ASN HD22 1 32 LYS QB 6.160 . 6.720 4.729 2.585 5.511 . 0 0 "[ . 1 . 2 . 3]" 1 390 1 20 ARG H 1 20 ARG QD 5.712 . 6.272 3.854 3.273 4.627 . 0 0 "[ . 1 . 2 . 3]" 1 391 1 20 ARG H 1 20 ARG QG 4.032 . 4.592 2.626 2.322 3.133 . 0 0 "[ . 1 . 2 . 3]" 1 392 1 20 ARG H 1 21 SER H 4.200 . 4.700 2.363 1.923 2.871 . 0 0 "[ . 1 . 2 . 3]" 1 393 1 20 ARG HA 1 20 ARG QD 4.256 . 4.816 2.521 2.085 3.901 . 0 0 "[ . 1 . 2 . 3]" 1 394 1 20 ARG HA 1 20 ARG QG 3.584 . 4.144 2.912 2.248 3.131 . 0 0 "[ . 1 . 2 . 3]" 1 395 1 20 ARG QB 1 21 SER H 6.160 . 6.720 3.091 2.817 3.775 . 0 0 "[ . 1 . 2 . 3]" 1 396 1 20 ARG QD 1 21 SER H 6.160 . 6.720 5.063 4.745 5.526 . 0 0 "[ . 1 . 2 . 3]" 1 397 1 20 ARG QG 1 21 SER H 5.376 . 5.936 4.390 4.233 4.692 . 0 0 "[ . 1 . 2 . 3]" 1 398 1 21 SER H 1 22 THR H 5.200 . 5.700 4.669 4.445 4.756 . 0 0 "[ . 1 . 2 . 3]" 1 399 1 21 SER H 1 30 ILE H 5.500 . 6.000 4.673 3.835 4.925 . 0 0 "[ . 1 . 2 . 3]" 1 400 1 21 SER H 1 30 ILE HB 5.500 . 6.000 4.220 3.773 4.628 . 0 0 "[ . 1 . 2 . 3]" 1 401 1 21 SER H 1 30 ILE MD 6.600 . 7.200 5.173 4.916 5.459 . 0 0 "[ . 1 . 2 . 3]" 1 402 1 21 SER H 1 30 ILE MG 6.600 . 7.200 4.744 4.321 5.400 . 0 0 "[ . 1 . 2 . 3]" 1 403 1 21 SER HA 1 22 THR H 3.300 . 3.800 2.317 2.176 2.496 . 0 0 "[ . 1 . 2 . 3]" 1 404 1 21 SER QB 1 22 THR H 4.704 . 5.264 2.789 2.384 3.480 . 0 0 "[ . 1 . 2 . 3]" 1 405 1 21 SER QB 1 30 ILE H 6.160 . 6.720 4.022 3.365 4.748 . 0 0 "[ . 1 . 2 . 3]" 1 406 1 21 SER QB 1 30 ILE MD 6.048 . 6.720 2.616 2.228 3.206 . 0 0 "[ . 1 . 2 . 3]" 1 407 1 21 SER QB 1 30 ILE MG 6.989 . 7.661 3.246 2.512 4.325 . 0 0 "[ . 1 . 2 . 3]" 1 408 1 21 SER QB 1 55 TRP HD1 5.376 . 5.936 4.030 3.353 4.824 . 0 0 "[ . 1 . 2 . 3]" 1 409 1 21 SER QB 1 55 TRP HE1 6.160 . 6.720 4.790 3.831 5.543 . 0 0 "[ . 1 . 2 . 3]" 1 410 1 21 SER QB 1 55 TRP HE3 6.160 . 6.720 4.831 4.067 5.527 . 0 0 "[ . 1 . 2 . 3]" 1 411 1 22 THR H 1 22 THR HB 3.500 . 4.000 2.793 2.670 2.931 . 0 0 "[ . 1 . 2 . 3]" 1 412 1 22 THR H 1 23 CYS H 4.700 . 5.200 4.337 4.231 4.388 . 0 0 "[ . 1 . 2 . 3]" 1 413 1 22 THR H 1 24 LYS H 5.500 . 6.000 5.554 5.496 5.641 . 0 0 "[ . 1 . 2 . 3]" 1 414 1 22 THR H 1 30 ILE H 5.300 . 5.800 4.296 4.137 4.441 . 0 0 "[ . 1 . 2 . 3]" 1 415 1 22 THR H 1 30 ILE HB 5.500 . 6.000 4.249 3.935 4.445 . 0 0 "[ . 1 . 2 . 3]" 1 416 1 22 THR H 1 30 ILE MD 6.600 . 7.200 3.146 2.943 3.320 . 0 0 "[ . 1 . 2 . 3]" 1 417 1 22 THR H 1 30 ILE MG 6.600 . 7.200 5.319 4.994 5.534 . 0 0 "[ . 1 . 2 . 3]" 1 418 1 22 THR H 1 55 TRP QB 6.160 . 6.720 3.197 2.887 3.588 . 0 0 "[ . 1 . 2 . 3]" 1 419 1 22 THR H 1 55 TRP HD1 5.500 . 6.000 4.138 3.496 4.703 . 0 0 "[ . 1 . 2 . 3]" 1 420 1 22 THR HA 1 22 THR MG 3.480 . 4.080 2.437 2.383 2.498 . 0 0 "[ . 1 . 2 . 3]" 1 421 1 22 THR HA 1 23 CYS H 3.400 . 3.900 2.145 2.110 2.192 . 0 0 "[ . 1 . 2 . 3]" 1 422 1 22 THR HA 1 23 CYS QB 5.040 . 5.600 3.850 3.787 3.908 . 0 0 "[ . 1 . 2 . 3]" 1 423 1 22 THR HA 1 28 GLU H 5.000 . 5.500 4.782 4.579 4.961 . 0 0 "[ . 1 . 2 . 3]" 1 424 1 22 THR HA 1 29 LYS H 5.100 . 5.600 4.691 4.560 4.796 . 0 0 "[ . 1 . 2 . 3]" 1 425 1 22 THR HA 1 29 LYS QB 4.928 . 5.488 3.733 3.554 3.940 . 0 0 "[ . 1 . 2 . 3]" 1 426 1 22 THR HA 1 30 ILE H 3.400 . 3.900 2.286 2.231 2.338 . 0 0 "[ . 1 . 2 . 3]" 1 427 1 22 THR HA 1 30 ILE HB 4.800 . 5.300 3.634 3.508 3.840 . 0 0 "[ . 1 . 2 . 3]" 1 428 1 22 THR HA 1 30 ILE MD 4.800 . 5.400 3.286 3.166 3.435 . 0 0 "[ . 1 . 2 . 3]" 1 429 1 22 THR HA 1 30 ILE QG 5.600 . 6.160 2.947 2.835 3.087 . 0 0 "[ . 1 . 2 . 3]" 1 430 1 22 THR HA 1 30 ILE MG 6.480 . 7.080 4.981 4.901 5.091 . 0 0 "[ . 1 . 2 . 3]" 1 431 1 22 THR HB 1 23 CYS H 4.600 . 5.100 4.004 3.930 4.086 . 0 0 "[ . 1 . 2 . 3]" 1 432 1 22 THR HB 1 24 LYS H 5.300 . 5.800 5.360 5.299 5.431 . 0 0 "[ . 1 . 2 . 3]" 1 433 1 22 THR HB 1 27 MET ME 5.400 . 6.000 4.042 3.450 4.517 . 0 0 "[ . 1 . 2 . 3]" 1 434 1 22 THR HB 1 29 LYS HA 4.400 . 4.900 4.434 4.308 4.514 . 0 0 "[ . 1 . 2 . 3]" 1 435 1 22 THR HB 1 29 LYS QB 6.160 . 6.720 5.414 5.004 5.618 . 0 0 "[ . 1 . 2 . 3]" 1 436 1 22 THR HB 1 30 ILE H 5.100 . 5.600 5.165 5.101 5.210 . 0 0 "[ . 1 . 2 . 3]" 1 437 1 22 THR MG 1 23 CYS H 4.200 . 4.800 2.554 2.488 2.647 . 0 0 "[ . 1 . 2 . 3]" 1 438 1 22 THR MG 1 23 CYS HA 6.600 . 7.200 4.223 4.130 4.334 . 0 0 "[ . 1 . 2 . 3]" 1 439 1 22 THR MG 1 23 CYS QB 6.317 . 6.989 3.639 3.548 3.712 . 0 0 "[ . 1 . 2 . 3]" 1 440 1 22 THR MG 1 24 LYS H 6.600 . 7.200 4.542 4.306 4.759 . 0 0 "[ . 1 . 2 . 3]" 1 441 1 22 THR MG 1 24 LYS HA 5.520 . 6.120 4.224 3.914 4.503 . 0 0 "[ . 1 . 2 . 3]" 1 442 1 22 THR MG 1 26 CYS H 6.480 . 7.080 5.317 5.092 5.418 . 0 0 "[ . 1 . 2 . 3]" 1 443 1 22 THR MG 1 27 MET H 5.280 . 5.880 4.139 3.889 4.318 . 0 0 "[ . 1 . 2 . 3]" 1 444 1 22 THR MG 1 27 MET QB 7.123 . 7.795 4.223 3.704 4.617 . 0 0 "[ . 1 . 2 . 3]" 1 445 1 22 THR MG 1 27 MET ME 4.608 . 5.328 2.672 2.192 3.215 . 0 0 "[ . 1 . 2 . 3]" 1 446 1 22 THR MG 1 27 MET QG 6.451 . 7.123 4.077 3.006 4.835 . 0 0 "[ . 1 . 2 . 3]" 1 447 1 22 THR MG 1 28 GLU H 4.800 . 5.400 3.021 2.814 3.143 . 0 0 "[ . 1 . 2 . 3]" 1 448 1 22 THR MG 1 28 GLU QB 7.123 . 7.795 4.303 4.184 4.387 . 0 0 "[ . 1 . 2 . 3]" 1 449 1 22 THR MG 1 29 LYS H 4.800 . 5.400 3.531 3.390 3.697 . 0 0 "[ . 1 . 2 . 3]" 1 450 1 22 THR MG 1 29 LYS HA 4.200 . 4.800 2.513 2.285 2.809 . 0 0 "[ . 1 . 2 . 3]" 1 451 1 22 THR MG 1 29 LYS QB 5.107 . 5.779 3.596 3.185 3.813 . 0 0 "[ . 1 . 2 . 3]" 1 452 1 22 THR MG 1 30 ILE H 5.760 . 6.360 4.029 3.919 4.207 . 0 0 "[ . 1 . 2 . 3]" 1 453 1 22 THR MG 1 57 HIS HE1 6.240 . 6.840 5.168 5.001 5.216 . 0 0 "[ . 1 . 2 . 3]" 1 454 1 23 CYS H 1 24 LYS H 5.000 . 5.500 4.384 4.335 4.428 . 0 0 "[ . 1 . 2 . 3]" 1 455 1 23 CYS H 1 25 GLY H 5.500 . 6.000 5.259 5.205 5.318 . 0 0 "[ . 1 . 2 . 3]" 1 456 1 23 CYS H 1 27 MET ME 6.600 . 7.200 4.797 4.380 5.240 . 0 0 "[ . 1 . 2 . 3]" 1 457 1 23 CYS H 1 28 GLU H 4.200 . 4.700 3.209 3.096 3.312 . 0 0 "[ . 1 . 2 . 3]" 1 458 1 23 CYS H 1 28 GLU HA 5.100 . 5.600 4.827 4.706 4.936 . 0 0 "[ . 1 . 2 . 3]" 1 459 1 23 CYS H 1 28 GLU QB 5.936 . 6.496 4.616 4.373 5.346 . 0 0 "[ . 1 . 2 . 3]" 1 460 1 23 CYS H 1 30 ILE H 4.500 . 5.000 3.523 3.460 3.630 . 0 0 "[ . 1 . 2 . 3]" 1 461 1 23 CYS H 1 30 ILE HA 5.300 . 5.800 4.642 4.492 4.738 . 0 0 "[ . 1 . 2 . 3]" 1 462 1 23 CYS H 1 30 ILE HB 5.300 . 5.800 4.484 4.300 4.646 . 0 0 "[ . 1 . 2 . 3]" 1 463 1 23 CYS H 1 30 ILE MD 5.280 . 5.880 3.109 3.039 3.185 . 0 0 "[ . 1 . 2 . 3]" 1 464 1 23 CYS H 1 30 ILE QG 5.600 . 6.160 2.432 2.359 2.546 . 0 0 "[ . 1 . 2 . 3]" 1 465 1 23 CYS H 1 30 ILE MG 6.360 . 6.960 5.192 5.123 5.263 . 0 0 "[ . 1 . 2 . 3]" 1 466 1 23 CYS H 1 56 TYR HA 5.500 . 6.000 5.030 4.875 5.159 . 0 0 "[ . 1 . 2 . 3]" 1 467 1 23 CYS H 1 57 HIS H 5.500 . 6.000 5.516 5.409 5.546 . 0 0 "[ . 1 . 2 . 3]" 1 468 1 23 CYS H 1 57 HIS HE1 5.000 . 5.500 3.999 3.896 4.102 . 0 0 "[ . 1 . 2 . 3]" 1 469 1 23 CYS HA 1 24 LYS H 3.500 . 4.000 2.135 2.078 2.185 . 0 0 "[ . 1 . 2 . 3]" 1 470 1 23 CYS HA 1 25 GLY H 4.600 . 5.100 3.319 3.229 3.432 . 0 0 "[ . 1 . 2 . 3]" 1 471 1 23 CYS HA 1 28 GLU H 5.500 . 6.000 4.963 4.884 5.025 . 0 0 "[ . 1 . 2 . 3]" 1 472 1 23 CYS HA 1 30 ILE H 5.500 . 6.000 5.599 5.561 5.636 . 0 0 "[ . 1 . 2 . 3]" 1 473 1 23 CYS HA 1 30 ILE MD 4.560 . 5.160 2.184 2.116 2.255 . 0 0 "[ . 1 . 2 . 3]" 1 474 1 23 CYS HA 1 55 TRP H 5.500 . 6.000 5.023 4.786 5.222 . 0 0 "[ . 1 . 2 . 3]" 1 475 1 23 CYS HA 1 56 TYR HA 4.000 . 4.500 2.441 2.264 2.579 . 0 0 "[ . 1 . 2 . 3]" 1 476 1 23 CYS HA 1 56 TYR QD 6.160 . 6.720 4.379 4.107 4.528 . 0 0 "[ . 1 . 2 . 3]" 1 477 1 23 CYS HA 1 57 HIS H 4.500 . 5.000 3.870 3.768 3.950 . 0 0 "[ . 1 . 2 . 3]" 1 478 1 23 CYS HA 1 57 HIS HE1 5.500 . 6.000 5.516 5.438 5.553 . 0 0 "[ . 1 . 2 . 3]" 1 479 1 23 CYS QB 1 24 LYS H 5.264 . 5.824 3.909 3.862 3.952 . 0 0 "[ . 1 . 2 . 3]" 1 480 1 23 CYS QB 1 25 GLY H 5.712 . 6.272 3.785 3.718 3.869 . 0 0 "[ . 1 . 2 . 3]" 1 481 1 23 CYS QB 1 26 CYS H 6.160 . 6.720 3.411 3.227 3.544 . 0 0 "[ . 1 . 2 . 3]" 1 482 1 23 CYS QB 1 27 MET H 5.600 . 6.160 3.695 3.510 3.890 . 0 0 "[ . 1 . 2 . 3]" 1 483 1 23 CYS QB 1 28 GLU H 4.704 . 5.264 2.588 2.400 2.738 . 0 0 "[ . 1 . 2 . 3]" 1 484 1 23 CYS QB 1 28 GLU QB 6.147 . 6.774 3.758 3.385 4.874 . 0 0 "[ . 1 . 2 . 3]" 1 485 1 23 CYS QB 1 28 GLU QG 6.648 . 7.276 4.690 3.479 5.045 . 0 0 "[ . 1 . 2 . 3]" 1 486 1 23 CYS QB 1 30 ILE H 6.160 . 6.720 4.426 4.373 4.496 . 0 0 "[ . 1 . 2 . 3]" 1 487 1 23 CYS QB 1 30 ILE MD 5.376 . 6.048 2.322 2.243 2.450 . 0 0 "[ . 1 . 2 . 3]" 1 488 1 23 CYS QB 1 30 ILE QG 6.272 . 6.899 2.183 2.094 2.279 . 0 0 "[ . 1 . 2 . 3]" 1 489 1 23 CYS QB 1 56 TYR HA 5.376 . 5.936 3.108 2.965 3.299 . 0 0 "[ . 1 . 2 . 3]" 1 490 1 23 CYS QB 1 57 HIS H 5.040 . 5.600 2.901 2.782 3.043 . 0 0 "[ . 1 . 2 . 3]" 1 491 1 23 CYS QB 1 57 HIS HA 5.712 . 6.272 4.043 3.885 4.271 . 0 0 "[ . 1 . 2 . 3]" 1 492 1 23 CYS QB 1 57 HIS HE1 4.928 . 5.488 2.684 2.618 2.747 . 0 0 "[ . 1 . 2 . 3]" 1 493 1 24 LYS H 1 24 LYS QE 6.160 . 6.720 4.124 2.459 4.616 . 0 0 "[ . 1 . 2 . 3]" 1 494 1 24 LYS H 1 25 GLY H 4.000 . 4.500 2.578 2.522 2.659 . 0 0 "[ . 1 . 2 . 3]" 1 495 1 24 LYS H 1 26 CYS H 5.400 . 5.900 4.567 4.498 4.681 . 0 0 "[ . 1 . 2 . 3]" 1 496 1 24 LYS H 1 30 ILE MD 4.800 . 5.400 3.906 3.818 4.022 . 0 0 "[ . 1 . 2 . 3]" 1 497 1 24 LYS H 1 54 ARG QB 6.160 . 6.720 5.575 5.508 5.657 . 0 0 "[ . 1 . 2 . 3]" 1 498 1 24 LYS H 1 55 TRP H 5.500 . 6.000 4.182 3.881 4.438 . 0 0 "[ . 1 . 2 . 3]" 1 499 1 24 LYS H 1 55 TRP HA 5.500 . 6.000 4.922 4.796 5.002 . 0 0 "[ . 1 . 2 . 3]" 1 500 1 24 LYS H 1 55 TRP QB 6.160 . 6.720 3.926 3.628 4.143 . 0 0 "[ . 1 . 2 . 3]" 1 501 1 24 LYS H 1 56 TYR H 5.500 . 6.000 4.699 4.617 4.775 . 0 0 "[ . 1 . 2 . 3]" 1 502 1 24 LYS H 1 56 TYR HA 4.200 . 4.700 3.178 3.105 3.247 . 0 0 "[ . 1 . 2 . 3]" 1 503 1 24 LYS H 1 56 TYR QD 5.712 . 6.272 3.820 3.565 4.016 . 0 0 "[ . 1 . 2 . 3]" 1 504 1 24 LYS H 1 56 TYR QE 6.160 . 6.720 4.222 3.967 4.422 . 0 0 "[ . 1 . 2 . 3]" 1 505 1 24 LYS H 1 57 HIS H 5.100 . 5.600 5.135 5.104 5.184 . 0 0 "[ . 1 . 2 . 3]" 1 506 1 24 LYS HA 1 25 GLY QA 5.712 . 6.272 4.440 4.401 4.474 . 0 0 "[ . 1 . 2 . 3]" 1 507 1 24 LYS HA 1 26 CYS H 5.500 . 6.000 4.141 3.948 4.511 . 0 0 "[ . 1 . 2 . 3]" 1 508 1 24 LYS HA 1 27 MET H 5.000 . 5.500 3.402 3.306 3.558 . 0 0 "[ . 1 . 2 . 3]" 1 509 1 24 LYS HA 1 27 MET ME 4.920 . 5.520 2.062 1.971 2.158 . 0 0 "[ . 1 . 2 . 3]" 1 510 1 24 LYS HA 1 27 MET QG 5.712 . 6.272 4.338 3.210 5.157 . 0 0 "[ . 1 . 2 . 3]" 1 511 1 24 LYS HA 1 56 TYR QD 6.048 . 6.608 5.228 5.084 5.415 . 0 0 "[ . 1 . 2 . 3]" 1 512 1 24 LYS HA 1 56 TYR QE 5.712 . 6.272 4.675 4.508 4.875 . 0 0 "[ . 1 . 2 . 3]" 1 513 1 24 LYS QB 1 25 GLY H 5.488 . 6.048 3.275 3.142 3.384 . 0 0 "[ . 1 . 2 . 3]" 1 514 1 24 LYS QB 1 25 GLY QA 6.021 . 6.648 3.999 3.890 4.132 . 0 0 "[ . 1 . 2 . 3]" 1 515 1 24 LYS QB 1 27 MET H 6.160 . 6.720 5.149 5.078 5.272 . 0 0 "[ . 1 . 2 . 3]" 1 516 1 24 LYS QB 1 27 MET ME 5.914 . 6.586 3.615 3.128 3.863 . 0 0 "[ . 1 . 2 . 3]" 1 517 1 24 LYS QB 1 54 ARG HA 5.488 . 6.048 4.288 3.752 4.782 . 0 0 "[ . 1 . 2 . 3]" 1 518 1 24 LYS QB 1 54 ARG QG 4.767 . 5.394 2.211 2.036 2.362 . 0 0 "[ . 1 . 2 . 3]" 1 519 1 24 LYS QB 1 55 TRP H 6.160 . 6.720 3.998 3.658 4.283 . 0 0 "[ . 1 . 2 . 3]" 1 520 1 24 LYS QB 1 56 TYR H 6.160 . 6.720 5.536 5.497 5.571 . 0 0 "[ . 1 . 2 . 3]" 1 521 1 24 LYS QB 1 56 TYR QE 6.147 . 6.774 2.861 2.626 3.221 . 0 0 "[ . 1 . 2 . 3]" 1 522 1 24 LYS QE 1 54 ARG HA 4.368 . 4.928 3.411 2.558 3.954 . 0 0 "[ . 1 . 2 . 3]" 1 523 1 24 LYS QE 1 55 TRP HD1 5.376 . 5.936 4.287 3.948 4.796 . 0 0 "[ . 1 . 2 . 3]" 1 524 1 24 LYS QG 1 25 GLY H 6.160 . 6.720 4.704 4.232 4.898 . 0 0 "[ . 1 . 2 . 3]" 1 525 1 24 LYS QG 1 27 MET ME 5.107 . 5.779 2.880 2.230 3.821 . 0 0 "[ . 1 . 2 . 3]" 1 526 1 24 LYS QG 1 54 ARG QD 6.523 . 7.150 2.989 2.213 4.112 . 0 0 "[ . 1 . 2 . 3]" 1 527 1 24 LYS QG 1 54 ARG QG 6.021 . 6.648 2.142 1.934 2.306 . 0 0 "[ . 1 . 2 . 3]" 1 528 1 24 LYS QG 1 55 TRP H 6.160 . 6.720 3.839 2.458 5.014 . 0 0 "[ . 1 . 2 . 3]" 1 529 1 24 LYS QG 1 56 TYR QD 6.899 . 7.526 5.385 4.861 5.561 . 0 0 "[ . 1 . 2 . 3]" 1 530 1 25 GLY H 1 26 CYS H 3.600 . 4.100 2.617 2.505 2.668 . 0 0 "[ . 1 . 2 . 3]" 1 531 1 25 GLY H 1 26 CYS HA 5.200 . 5.700 5.256 5.191 5.278 . 0 0 "[ . 1 . 2 . 3]" 1 532 1 25 GLY H 1 27 MET H 4.300 . 4.800 3.771 3.694 3.869 . 0 0 "[ . 1 . 2 . 3]" 1 533 1 25 GLY H 1 27 MET ME 5.640 . 6.240 4.622 4.291 4.709 . 0 0 "[ . 1 . 2 . 3]" 1 534 1 25 GLY H 1 28 GLU H 5.500 . 6.000 5.380 5.217 5.519 . 0 0 "[ . 1 . 2 . 3]" 1 535 1 25 GLY H 1 54 ARG QG 6.048 . 6.608 5.463 5.393 5.522 . 0 0 "[ . 1 . 2 . 3]" 1 536 1 25 GLY H 1 56 TYR H 5.500 . 6.000 5.665 5.624 5.721 . 0 0 "[ . 1 . 2 . 3]" 1 537 1 25 GLY H 1 56 TYR HA 5.100 . 5.600 3.036 2.966 3.163 . 0 0 "[ . 1 . 2 . 3]" 1 538 1 25 GLY H 1 56 TYR QB 6.160 . 6.720 4.059 3.928 4.249 . 0 0 "[ . 1 . 2 . 3]" 1 539 1 25 GLY H 1 56 TYR QD 4.928 . 5.488 2.284 2.071 2.506 . 0 0 "[ . 1 . 2 . 3]" 1 540 1 25 GLY H 1 56 TYR QE 4.928 . 5.488 3.220 3.000 3.435 . 0 0 "[ . 1 . 2 . 3]" 1 541 1 25 GLY H 1 57 HIS H 5.200 . 5.700 4.200 4.076 4.343 . 0 0 "[ . 1 . 2 . 3]" 1 542 1 25 GLY H 1 60 CYS QB 5.152 . 5.712 3.774 3.656 3.885 . 0 0 "[ . 1 . 2 . 3]" 1 543 1 25 GLY H 1 64 ASN HD22 5.500 . 6.000 4.290 4.121 4.435 . 0 0 "[ . 1 . 2 . 3]" 1 544 1 25 GLY H 1 68 LEU QD 7.425 . 8.100 5.470 5.218 5.540 . 0 0 "[ . 1 . 2 . 3]" 1 545 1 25 GLY QA 1 26 CYS HA 5.712 . 6.272 4.080 4.030 4.099 . 0 0 "[ . 1 . 2 . 3]" 1 546 1 25 GLY QA 1 27 MET H 5.712 . 6.272 4.282 4.183 4.365 . 0 0 "[ . 1 . 2 . 3]" 1 547 1 25 GLY QA 1 56 TYR QD 5.645 . 6.272 2.175 2.082 2.275 . 0 0 "[ . 1 . 2 . 3]" 1 548 1 25 GLY QA 1 56 TYR QE 5.268 . 5.896 2.580 2.273 2.972 . 0 0 "[ . 1 . 2 . 3]" 1 549 1 25 GLY QA 1 57 HIS H 6.160 . 6.720 4.298 4.108 4.504 . 0 0 "[ . 1 . 2 . 3]" 1 550 1 25 GLY QA 1 60 CYS QB 5.394 . 6.021 2.201 2.071 2.401 . 0 0 "[ . 1 . 2 . 3]" 1 551 1 25 GLY QA 1 64 ASN HD22 5.376 . 5.936 2.540 2.428 2.815 . 0 0 "[ . 1 . 2 . 3]" 1 552 1 25 GLY QA 1 68 LEU QD 7.258 . 8.014 4.461 4.164 4.567 . 0 0 "[ . 1 . 2 . 3]" 1 553 1 26 CYS H 1 27 MET H 3.400 . 3.900 2.044 1.896 2.385 . 0 0 "[ . 1 . 2 . 3]" 1 554 1 26 CYS H 1 27 MET ME 5.280 . 5.880 4.429 4.411 4.448 . 0 0 "[ . 1 . 2 . 3]" 1 555 1 26 CYS H 1 28 GLU H 4.600 . 5.100 3.806 3.690 3.974 . 0 0 "[ . 1 . 2 . 3]" 1 556 1 26 CYS H 1 28 GLU QG 6.160 . 6.720 5.408 5.010 5.524 . 0 0 "[ . 1 . 2 . 3]" 1 557 1 26 CYS H 1 56 TYR HA 5.500 . 6.000 4.876 4.780 4.985 . 0 0 "[ . 1 . 2 . 3]" 1 558 1 26 CYS H 1 56 TYR QD 6.048 . 6.608 4.369 4.204 4.531 . 0 0 "[ . 1 . 2 . 3]" 1 559 1 26 CYS H 1 57 HIS H 5.500 . 6.000 4.998 4.843 5.135 . 0 0 "[ . 1 . 2 . 3]" 1 560 1 26 CYS H 1 60 CYS QB 5.264 . 5.824 3.815 3.592 3.944 . 0 0 "[ . 1 . 2 . 3]" 1 561 1 26 CYS H 1 64 ASN HD22 5.500 . 6.000 5.619 5.581 5.661 . 0 0 "[ . 1 . 2 . 3]" 1 562 1 26 CYS HA 1 27 MET HA 5.200 . 5.700 5.133 5.079 5.158 . 0 0 "[ . 1 . 2 . 3]" 1 563 1 26 CYS HA 1 28 GLU H 5.400 . 5.900 5.214 5.108 5.361 . 0 0 "[ . 1 . 2 . 3]" 1 564 1 26 CYS HA 1 60 CYS QB 5.712 . 6.272 5.084 4.977 5.134 . 0 0 "[ . 1 . 2 . 3]" 1 565 1 26 CYS QB 1 27 MET H 4.928 . 5.488 3.960 3.909 4.022 . 0 0 "[ . 1 . 2 . 3]" 1 566 1 26 CYS QB 1 28 GLU H 5.488 . 6.048 4.681 4.551 4.781 . 0 0 "[ . 1 . 2 . 3]" 1 567 1 26 CYS QB 1 28 GLU QB 6.147 . 6.774 4.449 4.214 4.902 . 0 0 "[ . 1 . 2 . 3]" 1 568 1 26 CYS QB 1 28 GLU QG 6.021 . 6.648 3.869 3.536 4.182 . 0 0 "[ . 1 . 2 . 3]" 1 569 1 26 CYS QB 1 63 LYS QE 4.265 . 4.892 3.146 2.880 3.400 . 0 0 "[ . 1 . 2 . 3]" 1 570 1 27 MET H 1 27 MET ME 4.560 . 5.160 2.978 2.807 3.112 . 0 0 "[ . 1 . 2 . 3]" 1 571 1 27 MET H 1 28 GLU H 3.800 . 4.300 2.756 2.720 2.822 . 0 0 "[ . 1 . 2 . 3]" 1 572 1 27 MET H 1 28 GLU HA 5.500 . 6.000 5.391 5.351 5.420 . 0 0 "[ . 1 . 2 . 3]" 1 573 1 27 MET HA 1 27 MET ME 4.080 . 4.680 2.055 1.954 2.305 . 0 0 "[ . 1 . 2 . 3]" 1 574 1 27 MET QB 1 27 MET ME 4.301 . 4.973 2.627 2.197 3.219 . 0 0 "[ . 1 . 2 . 3]" 1 575 1 27 MET QG 1 28 GLU H 5.600 . 6.160 4.525 4.234 4.833 . 0 0 "[ . 1 . 2 . 3]" 1 576 1 28 GLU H 1 28 GLU QG 4.256 . 4.816 3.284 2.932 3.461 . 0 0 "[ . 1 . 2 . 3]" 1 577 1 28 GLU H 1 29 LYS H 4.600 . 5.100 4.427 4.387 4.455 . 0 0 "[ . 1 . 2 . 3]" 1 578 1 28 GLU H 1 30 ILE MD 6.600 . 7.200 5.600 5.580 5.625 . 0 0 "[ . 1 . 2 . 3]" 1 579 1 28 GLU H 1 57 HIS HE1 4.400 . 4.900 3.829 3.732 3.911 . 0 0 "[ . 1 . 2 . 3]" 1 580 1 28 GLU HA 1 29 LYS H 3.300 . 3.800 2.342 2.251 2.491 . 0 0 "[ . 1 . 2 . 3]" 1 581 1 28 GLU HA 1 29 LYS QG 4.704 . 5.264 3.981 3.449 4.258 . 0 0 "[ . 1 . 2 . 3]" 1 582 1 28 GLU QG 1 29 LYS H 4.592 . 5.152 3.826 3.083 4.213 . 0 0 "[ . 1 . 2 . 3]" 1 583 1 28 GLU QG 1 57 HIS HE1 5.040 . 5.600 4.038 2.114 4.521 . 0 0 "[ . 1 . 2 . 3]" 1 584 1 29 LYS H 1 29 LYS QG 4.704 . 5.264 2.193 1.885 2.590 . 0 0 "[ . 1 . 2 . 3]" 1 585 1 29 LYS H 1 30 ILE H 4.700 . 5.200 4.608 4.568 4.635 . 0 0 "[ . 1 . 2 . 3]" 1 586 1 29 LYS H 1 30 ILE HA 5.500 . 6.000 5.565 5.526 5.616 . 0 0 "[ . 1 . 2 . 3]" 1 587 1 29 LYS H 1 30 ILE QG 6.160 . 6.720 5.455 5.402 5.511 . 0 0 "[ . 1 . 2 . 3]" 1 588 1 29 LYS H 1 57 HIS HE1 4.800 . 5.300 4.722 4.431 4.875 . 0 0 "[ . 1 . 2 . 3]" 1 589 1 29 LYS HA 1 30 ILE HB 4.800 . 5.300 4.343 4.238 4.508 . 0 0 "[ . 1 . 2 . 3]" 1 590 1 29 LYS HA 1 30 ILE MD 6.480 . 7.080 4.665 4.499 4.850 . 0 0 "[ . 1 . 2 . 3]" 1 591 1 29 LYS HA 1 57 HIS HE1 5.000 . 5.500 5.042 5.003 5.066 . 0 0 "[ . 1 . 2 . 3]" 1 592 1 29 LYS QB 1 30 ILE H 5.152 . 5.712 2.893 2.696 3.039 . 0 0 "[ . 1 . 2 . 3]" 1 593 1 29 LYS QB 1 30 ILE HB 6.160 . 6.720 4.774 4.543 5.017 . 0 0 "[ . 1 . 2 . 3]" 1 594 1 29 LYS QG 1 30 ILE H 5.600 . 6.160 4.113 3.828 4.605 . 0 0 "[ . 1 . 2 . 3]" 1 595 1 30 ILE H 1 30 ILE HB 4.000 . 4.500 2.275 2.212 2.403 . 0 0 "[ . 1 . 2 . 3]" 1 596 1 30 ILE H 1 30 ILE MD 5.280 . 5.880 3.476 3.356 3.629 . 0 0 "[ . 1 . 2 . 3]" 1 597 1 30 ILE H 1 31 GLU H 5.400 . 5.900 4.582 4.471 4.678 . 0 0 "[ . 1 . 2 . 3]" 1 598 1 30 ILE HA 1 31 GLU H 3.300 . 3.800 2.164 2.116 2.236 . 0 0 "[ . 1 . 2 . 3]" 1 599 1 30 ILE HA 1 31 GLU QB 6.160 . 6.720 4.439 4.295 4.597 . 0 0 "[ . 1 . 2 . 3]" 1 600 1 30 ILE HA 1 31 GLU QG 5.936 . 6.496 3.676 3.459 3.868 . 0 0 "[ . 1 . 2 . 3]" 1 601 1 30 ILE HA 1 57 HIS HD2 4.500 . 5.000 3.415 3.086 3.709 . 0 0 "[ . 1 . 2 . 3]" 1 602 1 30 ILE HA 1 57 HIS HE1 5.500 . 6.000 3.976 3.881 4.082 . 0 0 "[ . 1 . 2 . 3]" 1 603 1 30 ILE HB 1 31 GLU H 5.200 . 5.700 4.330 4.209 4.430 . 0 0 "[ . 1 . 2 . 3]" 1 604 1 30 ILE HB 1 34 GLN HE21 5.500 . 6.000 5.305 5.027 5.458 . 0 0 "[ . 1 . 2 . 3]" 1 605 1 30 ILE MD 1 31 GLU H 6.600 . 7.200 5.164 5.024 5.314 . 0 0 "[ . 1 . 2 . 3]" 1 606 1 30 ILE MD 1 34 GLN HE22 6.600 . 7.200 4.672 4.345 4.779 . 0 0 "[ . 1 . 2 . 3]" 1 607 1 30 ILE MD 1 36 ARG HA 5.880 . 6.480 3.788 3.486 4.132 . 0 0 "[ . 1 . 2 . 3]" 1 608 1 30 ILE MD 1 36 ARG QB 7.392 . 8.064 2.495 2.364 2.649 . 0 0 "[ . 1 . 2 . 3]" 1 609 1 30 ILE MD 1 36 ARG QD 6.854 . 7.526 3.285 2.720 3.632 . 0 0 "[ . 1 . 2 . 3]" 1 610 1 30 ILE MD 1 55 TRP H 6.360 . 6.960 4.746 4.585 4.968 . 0 0 "[ . 1 . 2 . 3]" 1 611 1 30 ILE MD 1 55 TRP QB 5.510 . 6.182 2.219 2.109 2.400 . 0 0 "[ . 1 . 2 . 3]" 1 612 1 30 ILE MD 1 55 TRP HD1 6.120 . 6.720 4.778 4.615 4.992 . 0 0 "[ . 1 . 2 . 3]" 1 613 1 30 ILE MD 1 55 TRP HE3 5.520 . 6.120 3.716 3.363 3.999 . 0 0 "[ . 1 . 2 . 3]" 1 614 1 30 ILE MD 1 56 TYR H 5.400 . 6.000 3.052 2.928 3.285 . 0 0 "[ . 1 . 2 . 3]" 1 615 1 30 ILE MD 1 56 TYR HA 5.160 . 5.760 2.966 2.782 3.229 . 0 0 "[ . 1 . 2 . 3]" 1 616 1 30 ILE MD 1 57 HIS H 5.400 . 6.000 3.585 3.440 3.901 . 0 0 "[ . 1 . 2 . 3]" 1 617 1 30 ILE MD 1 57 HIS HA 6.240 . 6.840 3.654 3.495 3.956 . 0 0 "[ . 1 . 2 . 3]" 1 618 1 30 ILE MD 1 57 HIS HD2 5.640 . 6.240 4.441 4.352 4.618 . 0 0 "[ . 1 . 2 . 3]" 1 619 1 30 ILE MD 1 57 HIS HE1 6.120 . 6.720 4.937 4.833 5.030 . 0 0 "[ . 1 . 2 . 3]" 1 620 1 30 ILE QG 1 31 GLU H 5.600 . 6.160 3.909 3.754 4.050 . 0 0 "[ . 1 . 2 . 3]" 1 621 1 30 ILE QG 1 57 HIS H 6.160 . 6.720 3.948 3.722 4.156 . 0 0 "[ . 1 . 2 . 3]" 1 622 1 30 ILE QG 1 57 HIS HD2 5.600 . 6.160 2.952 2.811 3.143 . 0 0 "[ . 1 . 2 . 3]" 1 623 1 30 ILE QG 1 57 HIS HE1 6.160 . 6.720 3.584 3.471 3.659 . 0 0 "[ . 1 . 2 . 3]" 1 624 1 30 ILE MG 1 31 GLU H 4.200 . 4.800 2.775 2.524 3.010 . 0 0 "[ . 1 . 2 . 3]" 1 625 1 30 ILE MG 1 31 GLU QG 6.586 . 7.258 4.496 4.076 4.707 . 0 0 "[ . 1 . 2 . 3]" 1 626 1 30 ILE MG 1 32 LYS H 6.600 . 7.200 4.866 4.675 5.115 . 0 0 "[ . 1 . 2 . 3]" 1 627 1 30 ILE MG 1 33 GLY H 6.600 . 7.200 5.482 5.210 5.572 . 0 0 "[ . 1 . 2 . 3]" 1 628 1 30 ILE MG 1 34 GLN H 5.880 . 6.480 4.733 4.501 4.916 . 0 0 "[ . 1 . 2 . 3]" 1 629 1 30 ILE MG 1 34 GLN QB 7.392 . 8.064 5.277 5.115 5.377 . 0 0 "[ . 1 . 2 . 3]" 1 630 1 30 ILE MG 1 34 GLN HE21 4.560 . 5.160 2.555 2.378 2.662 . 0 0 "[ . 1 . 2 . 3]" 1 631 1 30 ILE MG 1 34 GLN HE22 6.600 . 7.200 2.287 1.924 2.432 . 0 0 "[ . 1 . 2 . 3]" 1 632 1 30 ILE MG 1 34 GLN QG 7.123 . 7.795 4.063 3.865 4.200 . 0 0 "[ . 1 . 2 . 3]" 1 633 1 30 ILE MG 1 36 ARG HA 5.280 . 5.880 3.527 3.254 3.909 . 0 0 "[ . 1 . 2 . 3]" 1 634 1 30 ILE MG 1 36 ARG QB 4.973 . 5.645 2.030 1.929 2.168 . 0 0 "[ . 1 . 2 . 3]" 1 635 1 30 ILE MG 1 36 ARG QD 6.720 . 7.392 2.668 2.181 3.314 . 0 0 "[ . 1 . 2 . 3]" 1 636 1 30 ILE MG 1 55 TRP HE3 6.360 . 6.960 4.747 4.382 5.147 . 0 0 "[ . 1 . 2 . 3]" 1 637 1 30 ILE MG 1 57 HIS HD2 4.920 . 5.520 3.207 2.743 3.473 . 0 0 "[ . 1 . 2 . 3]" 1 638 1 30 ILE MG 1 57 HIS HE1 6.600 . 7.200 5.464 5.222 5.539 . 0 0 "[ . 1 . 2 . 3]" 1 639 1 31 GLU H 1 31 GLU QG 4.368 . 4.928 2.301 2.146 2.508 . 0 0 "[ . 1 . 2 . 3]" 1 640 1 31 GLU H 1 32 LYS H 4.500 . 5.000 4.594 4.567 4.608 . 0 0 "[ . 1 . 2 . 3]" 1 641 1 31 GLU H 1 34 GLN HE21 4.700 . 5.200 3.404 3.227 3.720 . 0 0 "[ . 1 . 2 . 3]" 1 642 1 31 GLU H 1 34 GLN HE22 5.000 . 5.500 3.980 3.549 4.495 . 0 0 "[ . 1 . 2 . 3]" 1 643 1 31 GLU H 1 34 GLN QG 4.480 . 5.040 3.744 3.413 3.972 . 0 0 "[ . 1 . 2 . 3]" 1 644 1 31 GLU H 1 57 HIS HE1 5.500 . 6.000 5.519 5.380 5.586 . 0 0 "[ . 1 . 2 . 3]" 1 645 1 31 GLU HA 1 32 LYS H 3.200 . 3.700 2.151 2.114 2.192 . 0 0 "[ . 1 . 2 . 3]" 1 646 1 31 GLU HA 1 32 LYS HA 4.500 . 5.000 4.402 4.341 4.469 . 0 0 "[ . 1 . 2 . 3]" 1 647 1 31 GLU QB 1 32 LYS H 4.368 . 4.928 2.923 2.687 3.067 . 0 0 "[ . 1 . 2 . 3]" 1 648 1 31 GLU QB 1 34 GLN HE21 6.048 . 6.608 3.313 3.164 3.638 . 0 0 "[ . 1 . 2 . 3]" 1 649 1 31 GLU QB 1 34 GLN QG 5.770 . 6.397 2.188 2.036 2.307 . 0 0 "[ . 1 . 2 . 3]" 1 650 1 31 GLU QG 1 32 LYS H 5.152 . 5.712 4.430 4.149 4.573 . 0 0 "[ . 1 . 2 . 3]" 1 651 1 31 GLU QG 1 34 GLN QG 4.516 . 5.143 3.644 3.609 3.675 . 0 0 "[ . 1 . 2 . 3]" 1 652 1 32 LYS H 1 32 LYS QD 5.152 . 5.712 4.388 3.930 4.487 . 0 0 "[ . 1 . 2 . 3]" 1 653 1 32 LYS H 1 33 GLY H 4.700 . 5.200 4.644 4.584 4.678 . 0 0 "[ . 1 . 2 . 3]" 1 654 1 32 LYS H 1 34 GLN QG 5.488 . 6.048 4.581 4.363 4.733 . 0 0 "[ . 1 . 2 . 3]" 1 655 1 32 LYS HA 1 32 LYS QE 5.712 . 6.272 4.537 4.002 4.658 . 0 0 "[ . 1 . 2 . 3]" 1 656 1 32 LYS HA 1 33 GLY H 3.300 . 3.800 2.195 2.109 2.230 . 0 0 "[ . 1 . 2 . 3]" 1 657 1 32 LYS HA 1 33 GLY QA 5.152 . 5.712 3.983 3.907 4.010 . 0 0 "[ . 1 . 2 . 3]" 1 658 1 32 LYS HA 1 34 GLN H 4.200 . 4.700 3.631 3.233 3.881 . 0 0 "[ . 1 . 2 . 3]" 1 659 1 32 LYS QB 1 33 GLY H 5.264 . 5.824 3.567 2.671 3.763 . 0 0 "[ . 1 . 2 . 3]" 1 660 1 32 LYS QD 1 33 GLY H 4.928 . 5.488 4.077 2.277 4.480 . 0 0 "[ . 1 . 2 . 3]" 1 661 1 32 LYS QD 1 33 GLY QA 6.523 . 7.150 4.371 2.691 4.856 . 0 0 "[ . 1 . 2 . 3]" 1 662 1 32 LYS QE 1 33 GLY H 4.928 . 5.488 4.114 3.353 4.399 . 0 0 "[ . 1 . 2 . 3]" 1 663 1 32 LYS QG 1 33 GLY H 5.040 . 5.600 2.538 2.332 4.271 . 0 0 "[ . 1 . 2 . 3]" 1 664 1 33 GLY H 1 34 GLN H 3.800 . 4.300 2.835 2.571 3.109 . 0 0 "[ . 1 . 2 . 3]" 1 665 1 33 GLY H 1 34 GLN HA 5.500 . 6.000 5.336 5.115 5.490 . 0 0 "[ . 1 . 2 . 3]" 1 666 1 33 GLY QA 1 34 GLN QG 6.397 . 7.025 4.483 4.337 4.611 . 0 0 "[ . 1 . 2 . 3]" 1 667 1 34 GLN H 1 34 GLN HE21 3.800 . 4.300 2.918 2.733 3.050 . 0 0 "[ . 1 . 2 . 3]" 1 668 1 34 GLN H 1 34 GLN HE22 5.500 . 6.000 4.247 3.933 4.519 . 0 0 "[ . 1 . 2 . 3]" 1 669 1 34 GLN H 1 34 GLN QG 4.032 . 4.592 2.415 2.111 2.501 . 0 0 "[ . 1 . 2 . 3]" 1 670 1 34 GLN H 1 35 VAL H 4.700 . 5.200 4.483 4.451 4.604 . 0 0 "[ . 1 . 2 . 3]" 1 671 1 34 GLN H 1 35 VAL QG 7.425 . 8.100 5.348 5.104 5.523 . 0 0 "[ . 1 . 2 . 3]" 1 672 1 34 GLN HA 1 34 GLN HE21 4.900 . 5.400 4.675 4.521 4.741 . 0 0 "[ . 1 . 2 . 3]" 1 673 1 34 GLN HA 1 34 GLN HE22 5.300 . 5.800 5.139 4.923 5.320 . 0 0 "[ . 1 . 2 . 3]" 1 674 1 34 GLN HA 1 35 VAL H 3.100 . 3.600 2.520 2.419 2.594 . 0 0 "[ . 1 . 2 . 3]" 1 675 1 34 GLN HA 1 35 VAL HA 4.500 . 5.000 4.229 3.964 4.275 . 0 0 "[ . 1 . 2 . 3]" 1 676 1 34 GLN HA 1 35 VAL HB 5.200 . 5.700 4.972 4.333 5.495 . 0 0 "[ . 1 . 2 . 3]" 1 677 1 34 GLN HA 1 35 VAL QG 5.670 . 6.345 3.638 3.253 4.210 . 0 0 "[ . 1 . 2 . 3]" 1 678 1 34 GLN QB 1 35 VAL H 4.592 . 5.152 2.400 2.334 2.520 . 0 0 "[ . 1 . 2 . 3]" 1 679 1 34 GLN HE21 1 36 ARG QB 5.488 . 6.048 3.862 3.569 4.207 . 0 0 "[ . 1 . 2 . 3]" 1 680 1 34 GLN HE22 1 35 VAL QG 7.425 . 8.100 4.580 4.077 4.837 . 0 0 "[ . 1 . 2 . 3]" 1 681 1 34 GLN HE22 1 36 ARG QB 5.488 . 6.048 3.044 2.717 3.524 . 0 0 "[ . 1 . 2 . 3]" 1 682 1 34 GLN HE22 1 36 ARG QD 6.048 . 6.608 4.900 4.490 5.430 . 0 0 "[ . 1 . 2 . 3]" 1 683 1 34 GLN HE22 1 57 HIS HA 5.500 . 6.000 4.314 4.197 4.417 . 0 0 "[ . 1 . 2 . 3]" 1 684 1 34 GLN HE22 1 57 HIS HD2 5.500 . 6.000 3.778 3.508 4.067 . 0 0 "[ . 1 . 2 . 3]" 1 685 1 34 GLN QG 1 57 HIS HD2 6.160 . 6.720 4.899 4.494 5.217 . 0 0 "[ . 1 . 2 . 3]" 1 686 1 35 VAL H 1 35 VAL HB 3.400 . 3.900 2.529 2.402 3.552 . 0 0 "[ . 1 . 2 . 3]" 1 687 1 35 VAL H 1 85 LEU QD 7.425 . 8.100 4.988 4.389 5.511 . 0 0 "[ . 1 . 2 . 3]" 1 688 1 35 VAL H 1 93 LEU QD 7.425 . 8.100 5.441 5.152 5.532 . 0 0 "[ . 1 . 2 . 3]" 1 689 1 35 VAL HA 1 36 ARG H 3.500 . 4.000 2.193 2.138 2.266 . 0 0 "[ . 1 . 2 . 3]" 1 690 1 35 VAL HA 1 36 ARG QG 5.488 . 6.048 3.976 3.732 4.235 . 0 0 "[ . 1 . 2 . 3]" 1 691 1 35 VAL HA 1 85 LEU QD 7.020 . 7.695 3.666 3.154 4.283 . 0 0 "[ . 1 . 2 . 3]" 1 692 1 35 VAL QG 1 36 ARG H 5.535 . 6.210 2.429 2.285 3.244 . 0 0 "[ . 1 . 2 . 3]" 1 693 1 35 VAL QG 1 36 ARG HA 5.940 . 6.615 3.304 3.077 3.740 . 0 0 "[ . 1 . 2 . 3]" 1 694 1 35 VAL QG 1 37 LEU H 7.020 . 7.695 4.039 3.830 4.623 . 0 0 "[ . 1 . 2 . 3]" 1 695 1 35 VAL QG 1 37 LEU QB 8.316 . 9.072 4.450 4.254 5.108 . 0 0 "[ . 1 . 2 . 3]" 1 696 1 35 VAL QG 1 37 LEU QD 5.468 . 6.379 2.047 1.890 2.587 . 0 0 "[ . 1 . 2 . 3]" 1 697 1 35 VAL QG 1 37 LEU HG 6.750 . 7.425 4.230 4.001 4.874 . 0 0 "[ . 1 . 2 . 3]" 1 698 1 35 VAL QG 1 58 PRO QB 5.897 . 6.653 3.112 2.189 3.616 . 0 0 "[ . 1 . 2 . 3]" 1 699 1 35 VAL QG 1 58 PRO QD 7.862 . 8.618 3.540 2.513 3.940 . 0 0 "[ . 1 . 2 . 3]" 1 700 1 35 VAL QG 1 58 PRO QG 6.502 . 7.258 2.715 2.264 3.764 . 0 0 "[ . 1 . 2 . 3]" 1 701 1 35 VAL QG 1 85 LEU QD 6.561 . 7.472 2.006 1.845 2.290 . 0 0 "[ . 1 . 2 . 3]" 1 702 1 35 VAL QG 1 86 ALA H 6.210 . 6.885 4.577 4.371 4.658 . 0 0 "[ . 1 . 2 . 3]" 1 703 1 35 VAL QG 1 86 ALA MB 7.614 . 8.424 4.676 4.510 4.742 . 0 0 "[ . 1 . 2 . 3]" 1 704 1 35 VAL QG 1 89 ASP H 7.425 . 8.100 5.025 4.930 5.139 . 0 0 "[ . 1 . 2 . 3]" 1 705 1 35 VAL QG 1 89 ASP HA 6.750 . 7.425 3.951 3.808 4.098 . 0 0 "[ . 1 . 2 . 3]" 1 706 1 35 VAL QG 1 89 ASP QB 5.594 . 6.350 2.272 2.155 2.481 . 0 0 "[ . 1 . 2 . 3]" 1 707 1 35 VAL QG 1 92 ALA MB 8.910 . 9.720 4.503 4.139 4.865 . 0 0 "[ . 1 . 2 . 3]" 1 708 1 35 VAL QG 1 93 LEU H 7.155 . 7.830 5.095 4.865 5.324 . 0 0 "[ . 1 . 2 . 3]" 1 709 1 35 VAL QG 1 93 LEU QD 5.468 . 6.379 2.065 1.912 2.185 . 0 0 "[ . 1 . 2 . 3]" 1 710 1 36 ARG H 1 37 LEU QD 7.425 . 8.100 3.452 3.362 3.612 . 0 0 "[ . 1 . 2 . 3]" 1 711 1 36 ARG H 1 85 LEU QD 7.425 . 8.100 4.066 3.708 4.444 . 0 0 "[ . 1 . 2 . 3]" 1 712 1 36 ARG HA 1 37 LEU H 3.500 . 4.000 2.192 2.157 2.260 . 0 0 "[ . 1 . 2 . 3]" 1 713 1 36 ARG HA 1 37 LEU QD 6.345 . 7.020 2.765 2.631 2.927 . 0 0 "[ . 1 . 2 . 3]" 1 714 1 36 ARG HA 1 55 TRP HE3 4.500 . 5.000 4.322 4.106 4.519 . 0 0 "[ . 1 . 2 . 3]" 1 715 1 36 ARG HA 1 57 HIS HA 4.800 . 5.300 3.592 3.421 3.720 . 0 0 "[ . 1 . 2 . 3]" 1 716 1 36 ARG HA 1 57 HIS HD2 5.500 . 6.000 5.327 5.028 5.541 . 0 0 "[ . 1 . 2 . 3]" 1 717 1 36 ARG HA 1 58 PRO QD 5.376 . 5.936 3.075 2.833 3.339 . 0 0 "[ . 1 . 2 . 3]" 1 718 1 36 ARG HA 1 58 PRO QG 5.600 . 6.160 4.157 3.476 5.021 . 0 0 "[ . 1 . 2 . 3]" 1 719 1 36 ARG QB 1 37 LEU H 5.152 . 5.712 2.919 2.734 3.099 . 0 0 "[ . 1 . 2 . 3]" 1 720 1 36 ARG QB 1 55 TRP HZ3 6.160 . 6.720 3.770 3.479 4.054 . 0 0 "[ . 1 . 2 . 3]" 1 721 1 36 ARG QB 1 57 HIS HD2 6.160 . 6.720 5.211 4.894 5.508 . 0 0 "[ . 1 . 2 . 3]" 1 722 1 36 ARG QD 1 55 TRP HE3 5.376 . 5.936 2.846 2.475 3.181 . 0 0 "[ . 1 . 2 . 3]" 1 723 1 36 ARG QG 1 55 TRP HE3 6.160 . 6.720 3.007 2.752 3.214 . 0 0 "[ . 1 . 2 . 3]" 1 724 1 36 ARG QG 1 55 TRP HH2 5.824 . 6.384 3.882 3.646 4.097 . 0 0 "[ . 1 . 2 . 3]" 1 725 1 36 ARG QG 1 55 TRP HZ3 6.160 . 6.720 2.327 2.213 2.603 . 0 0 "[ . 1 . 2 . 3]" 1 726 1 37 LEU H 1 37 LEU HG 4.300 . 4.800 4.349 4.336 4.370 . 0 0 "[ . 1 . 2 . 3]" 1 727 1 37 LEU H 1 38 SER H 4.800 . 5.300 4.536 4.511 4.558 . 0 0 "[ . 1 . 2 . 3]" 1 728 1 37 LEU H 1 55 TRP QB 6.048 . 6.608 4.599 4.495 4.701 . 0 0 "[ . 1 . 2 . 3]" 1 729 1 37 LEU H 1 55 TRP HE3 5.100 . 5.600 3.425 3.298 3.572 . 0 0 "[ . 1 . 2 . 3]" 1 730 1 37 LEU H 1 55 TRP HZ3 5.500 . 6.000 4.474 4.265 4.669 . 0 0 "[ . 1 . 2 . 3]" 1 731 1 37 LEU H 1 56 TYR H 4.600 . 5.100 3.135 2.985 3.294 . 0 0 "[ . 1 . 2 . 3]" 1 732 1 37 LEU H 1 56 TYR QB 6.160 . 6.720 3.594 3.296 3.850 . 0 0 "[ . 1 . 2 . 3]" 1 733 1 37 LEU H 1 57 HIS H 5.500 . 6.000 5.151 5.042 5.259 . 0 0 "[ . 1 . 2 . 3]" 1 734 1 37 LEU H 1 57 HIS HA 5.500 . 6.000 4.174 3.983 4.347 . 0 0 "[ . 1 . 2 . 3]" 1 735 1 37 LEU H 1 58 PRO HA 5.300 . 5.800 5.009 4.845 5.086 . 0 0 "[ . 1 . 2 . 3]" 1 736 1 37 LEU H 1 58 PRO QD 6.160 . 6.720 4.235 3.950 4.527 . 0 0 "[ . 1 . 2 . 3]" 1 737 1 37 LEU H 1 61 PHE QB 6.160 . 6.720 4.396 4.283 4.506 . 0 0 "[ . 1 . 2 . 3]" 1 738 1 37 LEU H 1 61 PHE QD 6.160 . 6.720 5.343 5.223 5.466 . 0 0 "[ . 1 . 2 . 3]" 1 739 1 37 LEU HA 1 38 SER H 3.300 . 3.800 2.334 2.266 2.375 . 0 0 "[ . 1 . 2 . 3]" 1 740 1 37 LEU HA 1 55 TRP HE3 5.200 . 5.700 3.892 3.689 4.071 . 0 0 "[ . 1 . 2 . 3]" 1 741 1 37 LEU HA 1 55 TRP HZ3 5.100 . 5.600 3.340 3.018 3.668 . 0 0 "[ . 1 . 2 . 3]" 1 742 1 37 LEU HA 1 79 LEU QD 5.535 . 6.210 3.607 3.528 3.858 . 0 0 "[ . 1 . 2 . 3]" 1 743 1 37 LEU QB 1 38 SER H 4.928 . 5.488 2.596 2.547 2.671 . 0 0 "[ . 1 . 2 . 3]" 1 744 1 37 LEU QB 1 56 TYR H 6.160 . 6.720 3.878 3.787 3.974 . 0 0 "[ . 1 . 2 . 3]" 1 745 1 37 LEU QB 1 57 HIS H 6.160 . 6.720 5.584 5.535 5.634 . 0 0 "[ . 1 . 2 . 3]" 1 746 1 37 LEU QB 1 61 PHE QD 6.021 . 6.648 3.502 3.384 3.611 . 0 0 "[ . 1 . 2 . 3]" 1 747 1 37 LEU QB 1 79 LEU QB 6.272 . 6.899 4.676 4.540 4.876 . 0 0 "[ . 1 . 2 . 3]" 1 748 1 37 LEU QD 1 38 SER H 5.400 . 6.075 3.687 3.612 3.749 . 0 0 "[ . 1 . 2 . 3]" 1 749 1 37 LEU QD 1 55 TRP HZ3 7.425 . 8.100 4.500 4.288 4.721 . 0 0 "[ . 1 . 2 . 3]" 1 750 1 37 LEU QD 1 57 HIS H 7.425 . 8.100 4.731 4.639 4.837 . 0 0 "[ . 1 . 2 . 3]" 1 751 1 37 LEU QD 1 58 PRO HA 4.320 . 4.995 1.958 1.910 2.018 . 0 0 "[ . 1 . 2 . 3]" 1 752 1 37 LEU QD 1 58 PRO QB 5.746 . 6.502 2.822 2.509 3.042 . 0 0 "[ . 1 . 2 . 3]" 1 753 1 37 LEU QD 1 58 PRO QD 7.862 . 8.618 3.090 2.771 3.315 . 0 0 "[ . 1 . 2 . 3]" 1 754 1 37 LEU QD 1 58 PRO QG 6.955 . 7.711 3.047 2.423 4.021 . 0 0 "[ . 1 . 2 . 3]" 1 755 1 37 LEU QD 1 59 GLY H 7.425 . 8.100 4.548 4.484 4.620 . 0 0 "[ . 1 . 2 . 3]" 1 756 1 37 LEU QD 1 60 CYS H 6.885 . 7.560 5.021 4.544 5.125 . 0 0 "[ . 1 . 2 . 3]" 1 757 1 37 LEU QD 1 61 PHE H 5.400 . 6.075 3.718 3.629 3.770 . 0 0 "[ . 1 . 2 . 3]" 1 758 1 37 LEU QD 1 61 PHE HA 6.750 . 7.425 4.965 4.860 5.025 . 0 0 "[ . 1 . 2 . 3]" 1 759 1 37 LEU QD 1 61 PHE QB 6.804 . 7.560 2.632 2.511 2.701 . 0 0 "[ . 1 . 2 . 3]" 1 760 1 37 LEU QD 1 61 PHE QD 5.746 . 6.502 2.400 2.337 2.495 . 0 0 "[ . 1 . 2 . 3]" 1 761 1 37 LEU QD 1 61 PHE QE 6.955 . 7.711 2.784 2.678 2.896 . 0 0 "[ . 1 . 2 . 3]" 1 762 1 37 LEU QD 1 62 VAL H 6.210 . 6.885 4.638 4.607 4.663 . 0 0 "[ . 1 . 2 . 3]" 1 763 1 37 LEU QD 1 62 VAL QG 8.566 . 9.477 4.135 4.025 4.308 . 0 0 "[ . 1 . 2 . 3]" 1 764 1 37 LEU QD 1 76 ALA MB 7.938 . 8.748 4.224 4.038 4.440 . 0 0 "[ . 1 . 2 . 3]" 1 765 1 37 LEU QD 1 79 LEU QB 8.316 . 9.072 3.470 3.366 3.607 . 0 0 "[ . 1 . 2 . 3]" 1 766 1 37 LEU QD 1 79 LEU QD 6.561 . 7.472 2.069 2.009 2.210 . 0 0 "[ . 1 . 2 . 3]" 1 767 1 37 LEU QD 1 79 LEU HG 7.425 . 8.100 4.592 4.413 4.672 . 0 0 "[ . 1 . 2 . 3]" 1 768 1 37 LEU QD 1 93 LEU HA 7.155 . 7.830 4.828 4.620 5.108 . 0 0 "[ . 1 . 2 . 3]" 1 769 1 37 LEU QD 1 93 LEU QD 6.196 . 7.108 2.011 1.891 2.215 . 0 0 "[ . 1 . 2 . 3]" 1 770 1 37 LEU HG 1 58 PRO HA 4.400 . 4.900 4.088 3.959 4.266 . 0 0 "[ . 1 . 2 . 3]" 1 771 1 37 LEU HG 1 61 PHE QD 6.048 . 6.608 3.360 3.266 3.421 . 0 0 "[ . 1 . 2 . 3]" 1 772 1 37 LEU HG 1 61 PHE QE 6.160 . 6.720 3.384 3.291 3.478 . 0 0 "[ . 1 . 2 . 3]" 1 773 1 37 LEU HG 1 79 LEU HG 5.400 . 5.900 5.506 5.463 5.563 . 0 0 "[ . 1 . 2 . 3]" 1 774 1 38 SER H 1 39 LYS H 5.000 . 5.500 4.439 4.401 4.553 . 0 0 "[ . 1 . 2 . 3]" 1 775 1 38 SER H 1 55 TRP HA 5.500 . 6.000 4.727 4.654 4.870 . 0 0 "[ . 1 . 2 . 3]" 1 776 1 38 SER H 1 55 TRP HE3 5.200 . 5.700 4.302 4.054 4.506 . 0 0 "[ . 1 . 2 . 3]" 1 777 1 38 SER H 1 55 TRP HZ3 5.100 . 5.600 3.966 3.464 4.278 . 0 0 "[ . 1 . 2 . 3]" 1 778 1 38 SER H 1 56 TYR H 5.500 . 6.000 5.010 4.958 5.079 . 0 0 "[ . 1 . 2 . 3]" 1 779 1 38 SER H 1 79 LEU QD 7.425 . 8.100 3.363 3.165 3.923 . 0 0 "[ . 1 . 2 . 3]" 1 780 1 38 SER HA 1 39 LYS H 3.400 . 3.900 2.276 2.186 2.384 . 0 0 "[ . 1 . 2 . 3]" 1 781 1 38 SER HA 1 39 LYS QB 5.376 . 5.936 4.118 3.932 4.475 . 0 0 "[ . 1 . 2 . 3]" 1 782 1 38 SER HA 1 53 ASP HA 5.500 . 6.000 5.393 4.920 5.578 . 0 0 "[ . 1 . 2 . 3]" 1 783 1 38 SER HA 1 54 ARG H 4.800 . 5.300 4.727 4.319 4.842 . 0 0 "[ . 1 . 2 . 3]" 1 784 1 38 SER HA 1 54 ARG QB 5.600 . 6.160 4.427 4.204 4.616 . 0 0 "[ . 1 . 2 . 3]" 1 785 1 38 SER HA 1 55 TRP H 5.500 . 6.000 4.698 4.464 4.793 . 0 0 "[ . 1 . 2 . 3]" 1 786 1 38 SER HA 1 55 TRP HA 4.100 . 4.600 2.441 2.300 2.562 . 0 0 "[ . 1 . 2 . 3]" 1 787 1 38 SER HA 1 55 TRP HE3 4.700 . 5.200 3.986 3.455 4.196 . 0 0 "[ . 1 . 2 . 3]" 1 788 1 38 SER HA 1 56 TYR H 4.500 . 5.000 3.495 3.378 3.670 . 0 0 "[ . 1 . 2 . 3]" 1 789 1 38 SER QB 1 39 LYS H 4.032 . 4.592 2.682 2.391 3.550 . 0 0 "[ . 1 . 2 . 3]" 1 790 1 38 SER QB 1 39 LYS HA 5.712 . 6.272 4.358 3.997 4.654 . 0 0 "[ . 1 . 2 . 3]" 1 791 1 38 SER QB 1 53 ASP HA 4.928 . 5.488 3.434 2.878 4.400 . 0 0 "[ . 1 . 2 . 3]" 1 792 1 38 SER QB 1 53 ASP QB 5.268 . 5.896 2.877 2.176 3.701 . 0 0 "[ . 1 . 2 . 3]" 1 793 1 38 SER QB 1 54 ARG H 5.040 . 5.600 3.592 3.176 4.558 . 0 0 "[ . 1 . 2 . 3]" 1 794 1 38 SER QB 1 55 TRP H 5.488 . 6.048 4.204 3.768 4.897 . 0 0 "[ . 1 . 2 . 3]" 1 795 1 38 SER QB 1 55 TRP HA 5.040 . 5.600 2.649 2.221 3.477 . 0 0 "[ . 1 . 2 . 3]" 1 796 1 38 SER QB 1 55 TRP HD1 6.160 . 6.720 4.603 4.197 5.358 . 0 0 "[ . 1 . 2 . 3]" 1 797 1 38 SER QB 1 55 TRP HE1 5.712 . 6.272 4.458 4.003 4.904 . 0 0 "[ . 1 . 2 . 3]" 1 798 1 38 SER QB 1 55 TRP HE3 4.928 . 5.488 2.919 2.693 3.394 . 0 0 "[ . 1 . 2 . 3]" 1 799 1 38 SER QB 1 55 TRP HZ2 5.488 . 6.048 4.190 3.619 4.502 . 0 0 "[ . 1 . 2 . 3]" 1 800 1 38 SER QB 1 55 TRP HZ3 5.600 . 6.160 3.442 2.967 3.749 . 0 0 "[ . 1 . 2 . 3]" 1 801 1 38 SER QB 1 56 TYR H 6.160 . 6.720 4.157 3.842 4.852 . 0 0 "[ . 1 . 2 . 3]" 1 802 1 39 LYS H 1 40 LYS H 5.200 . 5.700 4.411 4.296 4.475 . 0 0 "[ . 1 . 2 . 3]" 1 803 1 39 LYS H 1 41 MET QG 6.160 . 6.720 5.143 4.718 5.493 . 0 0 "[ . 1 . 2 . 3]" 1 804 1 39 LYS H 1 53 ASP HA 4.800 . 5.300 4.127 3.673 4.367 . 0 0 "[ . 1 . 2 . 3]" 1 805 1 39 LYS H 1 53 ASP QB 6.160 . 6.720 4.872 4.319 5.264 . 0 0 "[ . 1 . 2 . 3]" 1 806 1 39 LYS H 1 54 ARG H 4.200 . 4.700 3.107 2.920 3.218 . 0 0 "[ . 1 . 2 . 3]" 1 807 1 39 LYS H 1 54 ARG HA 4.900 . 5.400 4.634 4.499 4.784 . 0 0 "[ . 1 . 2 . 3]" 1 808 1 39 LYS H 1 54 ARG QB 5.600 . 6.160 3.032 2.789 3.318 . 0 0 "[ . 1 . 2 . 3]" 1 809 1 39 LYS H 1 54 ARG QG 5.600 . 6.160 4.810 4.613 5.033 . 0 0 "[ . 1 . 2 . 3]" 1 810 1 39 LYS H 1 55 TRP H 5.300 . 5.800 5.021 4.850 5.189 . 0 0 "[ . 1 . 2 . 3]" 1 811 1 39 LYS H 1 55 TRP HA 4.600 . 5.100 3.995 3.828 4.134 . 0 0 "[ . 1 . 2 . 3]" 1 812 1 39 LYS H 1 56 TYR H 5.500 . 6.000 5.409 5.262 5.505 . 0 0 "[ . 1 . 2 . 3]" 1 813 1 39 LYS H 1 56 TYR QD 6.048 . 6.608 3.350 3.205 3.574 . 0 0 "[ . 1 . 2 . 3]" 1 814 1 39 LYS HA 1 40 LYS H 3.500 . 4.000 2.159 2.090 2.219 . 0 0 "[ . 1 . 2 . 3]" 1 815 1 39 LYS HA 1 40 LYS QB 4.816 . 5.376 4.054 3.936 4.186 . 0 0 "[ . 1 . 2 . 3]" 1 816 1 39 LYS HA 1 54 ARG H 5.500 . 6.000 4.914 4.797 5.005 . 0 0 "[ . 1 . 2 . 3]" 1 817 1 39 LYS QD 1 40 LYS H 6.160 . 6.720 4.084 2.624 4.743 . 0 0 "[ . 1 . 2 . 3]" 1 818 1 39 LYS QD 1 68 LEU HA 6.048 . 6.608 2.623 2.139 3.427 . 0 0 "[ . 1 . 2 . 3]" 1 819 1 39 LYS QD 1 68 LEU QD 5.897 . 6.653 2.331 2.047 3.046 . 0 0 "[ . 1 . 2 . 3]" 1 820 1 39 LYS QE 1 40 LYS H 6.160 . 6.720 4.699 3.461 5.180 . 0 0 "[ . 1 . 2 . 3]" 1 821 1 39 LYS QE 1 41 MET QB 6.021 . 6.648 2.203 1.942 2.707 . 0 0 "[ . 1 . 2 . 3]" 1 822 1 39 LYS QE 1 41 MET ME 5.242 . 5.914 3.708 3.341 3.934 . 0 0 "[ . 1 . 2 . 3]" 1 823 1 39 LYS QE 1 41 MET QG 6.899 . 7.526 3.332 3.054 3.666 . 0 0 "[ . 1 . 2 . 3]" 1 824 1 39 LYS QE 1 68 LEU HA 5.712 . 6.272 2.866 2.541 3.620 . 0 0 "[ . 1 . 2 . 3]" 1 825 1 39 LYS QE 1 68 LEU QD 6.955 . 7.711 3.413 2.953 3.922 . 0 0 "[ . 1 . 2 . 3]" 1 826 1 39 LYS QE 1 69 GLY H 6.160 . 6.720 5.356 4.992 5.569 . 0 0 "[ . 1 . 2 . 3]" 1 827 1 39 LYS QG 1 40 LYS H 4.368 . 4.928 2.682 2.258 3.121 . 0 0 "[ . 1 . 2 . 3]" 1 828 1 39 LYS QG 1 40 LYS QB 5.645 . 6.272 4.162 3.605 4.545 . 0 0 "[ . 1 . 2 . 3]" 1 829 1 39 LYS QG 1 41 MET H 5.152 . 5.712 3.911 3.556 4.185 . 0 0 "[ . 1 . 2 . 3]" 1 830 1 39 LYS QG 1 41 MET QB 5.519 . 6.147 2.707 2.492 3.223 . 0 0 "[ . 1 . 2 . 3]" 1 831 1 39 LYS QG 1 41 MET ME 4.570 . 5.242 3.216 2.549 3.428 . 0 0 "[ . 1 . 2 . 3]" 1 832 1 39 LYS QG 1 41 MET QG 5.896 . 6.523 2.488 2.188 2.976 . 0 0 "[ . 1 . 2 . 3]" 1 833 1 39 LYS QG 1 54 ARG H 5.936 . 6.496 4.556 4.316 4.812 . 0 0 "[ . 1 . 2 . 3]" 1 834 1 39 LYS QG 1 68 LEU QD 8.316 . 9.072 3.172 2.192 3.690 . 0 0 "[ . 1 . 2 . 3]" 1 835 1 40 LYS H 1 40 LYS QD 5.040 . 5.600 4.528 4.484 4.677 . 0 0 "[ . 1 . 2 . 3]" 1 836 1 40 LYS H 1 40 LYS QE 6.160 . 6.720 3.538 3.335 4.161 . 0 0 "[ . 1 . 2 . 3]" 1 837 1 40 LYS H 1 41 MET H 5.000 . 5.500 4.374 4.313 4.549 . 0 0 "[ . 1 . 2 . 3]" 1 838 1 40 LYS H 1 53 ASP HA 5.500 . 6.000 4.639 4.211 5.138 . 0 0 "[ . 1 . 2 . 3]" 1 839 1 40 LYS H 1 54 ARG H 5.500 . 6.000 5.012 4.878 5.106 . 0 0 "[ . 1 . 2 . 3]" 1 840 1 40 LYS QB 1 40 LYS QE 3.889 . 4.516 1.947 1.882 2.063 . 0 0 "[ . 1 . 2 . 3]" 1 841 1 40 LYS QB 1 41 MET H 4.704 . 5.264 3.910 3.795 3.965 . 0 0 "[ . 1 . 2 . 3]" 1 842 1 40 LYS QB 1 41 MET HA 5.488 . 6.048 4.859 4.413 4.922 . 0 0 "[ . 1 . 2 . 3]" 1 843 1 40 LYS QB 1 51 MET QB 5.519 . 6.147 4.373 4.253 4.416 . 0 0 "[ . 1 . 2 . 3]" 1 844 1 40 LYS QB 1 51 MET ME 6.317 . 6.989 4.605 3.720 4.705 . 0 0 "[ . 1 . 2 . 3]" 1 845 1 40 LYS QD 1 41 MET H 5.264 . 5.824 3.688 3.443 4.695 . 0 0 "[ . 1 . 2 . 3]" 1 846 1 40 LYS QD 1 51 MET QB 5.268 . 5.896 2.496 2.176 2.985 . 0 0 "[ . 1 . 2 . 3]" 1 847 1 40 LYS QD 1 51 MET ME 3.763 . 4.435 2.260 1.981 2.866 . 0 0 "[ . 1 . 2 . 3]" 1 848 1 40 LYS QD 1 51 MET QG 5.770 . 6.397 3.659 2.428 4.187 . 0 0 "[ . 1 . 2 . 3]" 1 849 1 40 LYS QD 1 52 ILE H 5.600 . 6.160 4.930 4.698 5.178 . 0 0 "[ . 1 . 2 . 3]" 1 850 1 40 LYS QE 1 41 MET H 6.160 . 6.720 4.816 3.984 5.021 . 0 0 "[ . 1 . 2 . 3]" 1 851 1 40 LYS QE 1 41 MET HA 4.928 . 5.488 4.301 2.924 4.482 . 0 0 "[ . 1 . 2 . 3]" 1 852 1 40 LYS QE 1 51 MET ME 5.779 . 6.451 3.394 1.988 3.795 . 0 0 "[ . 1 . 2 . 3]" 1 853 1 40 LYS QG 1 41 MET H 4.480 . 5.040 3.221 2.727 3.395 . 0 0 "[ . 1 . 2 . 3]" 1 854 1 40 LYS QG 1 51 MET H 6.160 . 6.720 5.585 5.505 5.643 . 0 0 "[ . 1 . 2 . 3]" 1 855 1 40 LYS QG 1 51 MET QB 5.018 . 5.645 2.491 2.293 2.571 . 0 0 "[ . 1 . 2 . 3]" 1 856 1 40 LYS QG 1 51 MET QG 6.397 . 7.025 4.361 3.391 4.543 . 0 0 "[ . 1 . 2 . 3]" 1 857 1 40 LYS QG 1 52 ILE H 5.488 . 6.048 4.189 3.362 4.610 . 0 0 "[ . 1 . 2 . 3]" 1 858 1 40 LYS QG 1 53 ASP HA 4.928 . 5.488 4.427 4.292 4.474 . 0 0 "[ . 1 . 2 . 3]" 1 859 1 41 MET H 1 41 MET QG 4.592 . 5.152 2.654 2.566 2.797 . 0 0 "[ . 1 . 2 . 3]" 1 860 1 41 MET H 1 42 VAL H 4.800 . 5.300 4.348 4.327 4.377 . 0 0 "[ . 1 . 2 . 3]" 1 861 1 41 MET H 1 42 VAL HA 5.500 . 6.000 4.911 4.775 5.032 . 0 0 "[ . 1 . 2 . 3]" 1 862 1 41 MET H 1 51 MET HA 4.500 . 5.000 3.755 3.645 3.884 . 0 0 "[ . 1 . 2 . 3]" 1 863 1 41 MET H 1 51 MET ME 4.680 . 5.280 3.895 3.584 3.942 . 0 0 "[ . 1 . 2 . 3]" 1 864 1 41 MET H 1 52 ILE H 3.900 . 4.400 2.672 2.359 2.857 . 0 0 "[ . 1 . 2 . 3]" 1 865 1 41 MET H 1 52 ILE HA 4.600 . 5.100 4.653 4.607 4.744 . 0 0 "[ . 1 . 2 . 3]" 1 866 1 41 MET H 1 52 ILE MD 6.000 . 6.600 4.104 2.756 5.052 . 0 0 "[ . 1 . 2 . 3]" 1 867 1 41 MET H 1 52 ILE QG 5.600 . 6.160 3.824 3.096 4.556 . 0 0 "[ . 1 . 2 . 3]" 1 868 1 41 MET H 1 53 ASP H 5.500 . 6.000 5.188 5.088 5.378 . 0 0 "[ . 1 . 2 . 3]" 1 869 1 41 MET H 1 53 ASP HA 4.500 . 5.000 4.139 3.962 4.509 . 0 0 "[ . 1 . 2 . 3]" 1 870 1 41 MET H 1 54 ARG H 4.800 . 5.300 4.072 3.861 4.493 . 0 0 "[ . 1 . 2 . 3]" 1 871 1 41 MET H 1 54 ARG QB 6.160 . 6.720 4.375 3.928 4.684 . 0 0 "[ . 1 . 2 . 3]" 1 872 1 41 MET H 1 54 ARG QD 6.160 . 6.720 5.297 4.564 5.543 . 0 0 "[ . 1 . 2 . 3]" 1 873 1 41 MET HA 1 42 VAL H 2.900 . 3.400 2.310 2.268 2.349 . 0 0 "[ . 1 . 2 . 3]" 1 874 1 41 MET HA 1 42 VAL HA 4.400 . 4.900 4.473 4.446 4.501 . 0 0 "[ . 1 . 2 . 3]" 1 875 1 41 MET HA 1 42 VAL HB 5.000 . 5.500 4.822 4.722 5.000 . 0 0 "[ . 1 . 2 . 3]" 1 876 1 41 MET HA 1 42 VAL QG 5.265 . 5.940 3.835 3.766 3.908 . 0 0 "[ . 1 . 2 . 3]" 1 877 1 41 MET HA 1 51 MET HA 5.100 . 5.600 3.872 3.742 4.097 . 0 0 "[ . 1 . 2 . 3]" 1 878 1 41 MET HA 1 51 MET ME 3.600 . 4.200 1.994 1.917 2.228 . 0 0 "[ . 1 . 2 . 3]" 1 879 1 41 MET HA 1 51 MET QG 5.376 . 5.936 4.147 4.032 4.795 . 0 0 "[ . 1 . 2 . 3]" 1 880 1 41 MET HA 1 52 ILE H 5.000 . 5.500 4.344 4.137 4.467 . 0 0 "[ . 1 . 2 . 3]" 1 881 1 41 MET QB 1 42 VAL H 4.144 . 4.704 2.887 2.726 3.005 . 0 0 "[ . 1 . 2 . 3]" 1 882 1 41 MET ME 1 43 ASP HA 4.440 . 5.040 3.622 3.125 3.749 . 0 0 "[ . 1 . 2 . 3]" 1 883 1 41 MET ME 1 44 PRO QD 5.107 . 5.779 3.049 2.287 3.617 . 0 0 "[ . 1 . 2 . 3]" 1 884 1 41 MET ME 1 52 ILE H 6.600 . 7.200 5.493 5.307 5.598 . 0 0 "[ . 1 . 2 . 3]" 1 885 1 41 MET ME 1 52 ILE MD 7.200 . 7.920 3.526 2.681 4.297 . 0 0 "[ . 1 . 2 . 3]" 1 886 1 41 MET ME 1 54 ARG QB 4.838 . 5.510 2.460 2.184 3.045 . 0 0 "[ . 1 . 2 . 3]" 1 887 1 41 MET ME 1 54 ARG QD 4.973 . 5.645 2.386 1.875 3.317 . 0 0 "[ . 1 . 2 . 3]" 1 888 1 41 MET ME 1 54 ARG QG 4.838 . 5.510 2.927 2.161 3.657 . 0 0 "[ . 1 . 2 . 3]" 1 889 1 41 MET QG 1 42 VAL H 4.928 . 5.488 3.995 3.838 4.114 . 0 0 "[ . 1 . 2 . 3]" 1 890 1 41 MET QG 1 42 VAL HA 5.600 . 6.160 4.483 4.352 4.583 . 0 0 "[ . 1 . 2 . 3]" 1 891 1 41 MET QG 1 43 ASP H 6.160 . 6.720 4.602 4.350 4.749 . 0 0 "[ . 1 . 2 . 3]" 1 892 1 41 MET QG 1 52 ILE MD 6.854 . 7.526 3.499 2.442 4.398 . 0 0 "[ . 1 . 2 . 3]" 1 893 1 41 MET QG 1 54 ARG H 6.160 . 6.720 4.041 3.765 4.530 . 0 0 "[ . 1 . 2 . 3]" 1 894 1 41 MET QG 1 54 ARG QB 6.272 . 6.899 3.182 2.947 3.458 . 0 0 "[ . 1 . 2 . 3]" 1 895 1 41 MET QG 1 54 ARG QD 5.519 . 6.147 3.526 2.869 4.200 . 0 0 "[ . 1 . 2 . 3]" 1 896 1 42 VAL H 1 42 VAL HB 3.200 . 3.700 2.629 2.568 2.833 . 0 0 "[ . 1 . 2 . 3]" 1 897 1 42 VAL H 1 42 VAL QG 4.050 . 4.725 2.046 1.930 2.118 . 0 0 "[ . 1 . 2 . 3]" 1 898 1 42 VAL H 1 43 ASP H 4.600 . 5.100 4.606 4.555 4.625 . 0 0 "[ . 1 . 2 . 3]" 1 899 1 42 VAL H 1 51 MET H 4.800 . 5.300 5.016 4.966 5.068 . 0 0 "[ . 1 . 2 . 3]" 1 900 1 42 VAL H 1 51 MET HA 4.700 . 5.200 3.148 3.071 3.209 . 0 0 "[ . 1 . 2 . 3]" 1 901 1 42 VAL H 1 51 MET ME 4.560 . 5.160 2.277 2.179 2.436 . 0 0 "[ . 1 . 2 . 3]" 1 902 1 42 VAL H 1 51 MET QG 5.040 . 5.600 3.226 2.996 4.553 . 0 0 "[ . 1 . 2 . 3]" 1 903 1 42 VAL H 1 52 ILE H 5.300 . 5.800 4.428 4.347 4.514 . 0 0 "[ . 1 . 2 . 3]" 1 904 1 42 VAL HA 1 43 ASP H 3.000 . 3.500 2.184 2.143 2.223 . 0 0 "[ . 1 . 2 . 3]" 1 905 1 42 VAL HA 1 43 ASP HA 5.000 . 5.500 4.389 4.269 4.462 . 0 0 "[ . 1 . 2 . 3]" 1 906 1 42 VAL HA 1 43 ASP QB 4.928 . 5.488 4.062 3.972 4.143 . 0 0 "[ . 1 . 2 . 3]" 1 907 1 42 VAL HA 1 50 GLY H 4.600 . 5.100 4.624 4.508 4.724 . 0 0 "[ . 1 . 2 . 3]" 1 908 1 42 VAL HA 1 51 MET HA 3.500 . 4.000 2.133 2.045 2.234 . 0 0 "[ . 1 . 2 . 3]" 1 909 1 42 VAL HA 1 51 MET ME 4.800 . 5.400 4.048 4.013 4.089 . 0 0 "[ . 1 . 2 . 3]" 1 910 1 42 VAL HA 1 51 MET QG 5.712 . 6.272 3.543 3.273 4.809 . 0 0 "[ . 1 . 2 . 3]" 1 911 1 42 VAL HA 1 52 ILE H 4.000 . 4.500 3.371 3.080 3.708 . 0 0 "[ . 1 . 2 . 3]" 1 912 1 42 VAL HA 1 52 ILE QG 5.040 . 5.600 3.745 3.333 4.032 . 0 0 "[ . 1 . 2 . 3]" 1 913 1 42 VAL HA 1 52 ILE MG 5.520 . 6.120 4.482 4.029 4.657 . 0 0 "[ . 1 . 2 . 3]" 1 914 1 42 VAL HB 1 43 ASP H 4.200 . 4.700 4.178 3.991 4.231 . 0 0 "[ . 1 . 2 . 3]" 1 915 1 42 VAL HB 1 47 PRO QB 5.376 . 5.936 4.805 4.709 4.873 . 0 0 "[ . 1 . 2 . 3]" 1 916 1 42 VAL QG 1 43 ASP H 4.455 . 5.130 2.623 2.522 2.727 . 0 0 "[ . 1 . 2 . 3]" 1 917 1 42 VAL QG 1 43 ASP QB 7.258 . 8.014 3.709 3.586 3.863 . 0 0 "[ . 1 . 2 . 3]" 1 918 1 42 VAL QG 1 44 PRO HA 5.265 . 5.940 3.865 3.630 3.943 . 0 0 "[ . 1 . 2 . 3]" 1 919 1 42 VAL QG 1 46 LYS H 6.480 . 7.155 4.686 4.497 4.849 . 0 0 "[ . 1 . 2 . 3]" 1 920 1 42 VAL QG 1 47 PRO HA 4.050 . 4.725 2.068 1.973 2.149 . 0 0 "[ . 1 . 2 . 3]" 1 921 1 42 VAL QG 1 47 PRO QB 4.990 . 5.746 2.504 2.242 2.774 . 0 0 "[ . 1 . 2 . 3]" 1 922 1 42 VAL QG 1 47 PRO QD 7.409 . 8.165 4.072 3.878 4.518 . 0 0 "[ . 1 . 2 . 3]" 1 923 1 42 VAL QG 1 47 PRO QG 6.502 . 7.258 4.044 3.195 4.301 . 0 0 "[ . 1 . 2 . 3]" 1 924 1 42 VAL QG 1 48 GLN H 6.885 . 7.560 4.670 4.519 4.800 . 0 0 "[ . 1 . 2 . 3]" 1 925 1 42 VAL QG 1 49 LEU H 6.615 . 7.290 4.362 4.125 4.580 . 0 0 "[ . 1 . 2 . 3]" 1 926 1 42 VAL QG 1 50 GLY H 5.940 . 6.615 2.963 2.740 3.050 . 0 0 "[ . 1 . 2 . 3]" 1 927 1 42 VAL QG 1 50 GLY QA 5.897 . 6.653 2.307 2.133 2.644 . 0 0 "[ . 1 . 2 . 3]" 1 928 1 42 VAL QG 1 51 MET H 5.400 . 6.075 3.312 2.837 4.036 . 0 0 "[ . 1 . 2 . 3]" 1 929 1 42 VAL QG 1 51 MET HA 4.860 . 5.535 3.189 2.885 3.636 . 0 0 "[ . 1 . 2 . 3]" 1 930 1 42 VAL QG 1 51 MET ME 4.698 . 5.508 2.438 2.147 2.912 . 0 0 "[ . 1 . 2 . 3]" 1 931 1 42 VAL QG 1 51 MET QG 5.443 . 6.199 2.594 2.060 3.740 . 0 0 "[ . 1 . 2 . 3]" 1 932 1 43 ASP H 1 44 PRO QD 5.376 . 5.936 4.376 4.325 4.423 . 0 0 "[ . 1 . 2 . 3]" 1 933 1 43 ASP H 1 45 GLU H 5.500 . 6.000 5.529 5.488 5.577 . 0 0 "[ . 1 . 2 . 3]" 1 934 1 43 ASP H 1 46 LYS H 5.000 . 5.500 4.832 4.700 5.008 . 0 0 "[ . 1 . 2 . 3]" 1 935 1 43 ASP H 1 47 PRO HA 4.600 . 5.100 3.728 3.403 4.190 . 0 0 "[ . 1 . 2 . 3]" 1 936 1 43 ASP H 1 49 LEU H 5.500 . 6.000 5.181 4.974 5.474 . 0 0 "[ . 1 . 2 . 3]" 1 937 1 43 ASP H 1 49 LEU QD 7.425 . 8.100 3.710 2.856 4.714 . 0 0 "[ . 1 . 2 . 3]" 1 938 1 43 ASP H 1 50 GLY H 5.500 . 6.000 4.566 4.331 4.788 . 0 0 "[ . 1 . 2 . 3]" 1 939 1 43 ASP H 1 51 MET H 5.500 . 6.000 5.443 5.153 5.577 . 0 0 "[ . 1 . 2 . 3]" 1 940 1 43 ASP H 1 51 MET HA 4.500 . 5.000 3.818 3.616 4.035 . 0 0 "[ . 1 . 2 . 3]" 1 941 1 43 ASP H 1 52 ILE H 5.200 . 5.700 4.023 3.717 4.406 . 0 0 "[ . 1 . 2 . 3]" 1 942 1 43 ASP H 1 52 ILE MD 5.280 . 5.880 4.011 3.674 4.275 . 0 0 "[ . 1 . 2 . 3]" 1 943 1 43 ASP H 1 52 ILE QG 5.600 . 6.160 2.970 2.779 3.158 . 0 0 "[ . 1 . 2 . 3]" 1 944 1 43 ASP H 1 52 ILE MG 5.880 . 6.480 3.975 3.266 4.272 . 0 0 "[ . 1 . 2 . 3]" 1 945 1 43 ASP HA 1 44 PRO HA 4.800 . 5.300 4.447 4.392 4.536 . 0 0 "[ . 1 . 2 . 3]" 1 946 1 43 ASP HA 1 44 PRO QD 3.472 . 4.032 2.049 2.030 2.058 . 0 0 "[ . 1 . 2 . 3]" 1 947 1 43 ASP HA 1 44 PRO QG 4.368 . 4.928 3.967 3.946 3.980 . 0 0 "[ . 1 . 2 . 3]" 1 948 1 43 ASP HA 1 45 GLU H 4.400 . 4.900 3.952 3.772 4.088 . 0 0 "[ . 1 . 2 . 3]" 1 949 1 43 ASP HA 1 52 ILE MD 5.520 . 6.120 3.359 2.643 4.050 . 0 0 "[ . 1 . 2 . 3]" 1 950 1 43 ASP QB 1 44 PRO QD 5.645 . 6.272 3.554 3.438 3.694 . 0 0 "[ . 1 . 2 . 3]" 1 951 1 43 ASP QB 1 45 GLU H 5.488 . 6.048 3.722 3.620 3.842 . 0 0 "[ . 1 . 2 . 3]" 1 952 1 43 ASP QB 1 46 LYS H 4.704 . 5.264 2.866 2.631 3.063 . 0 0 "[ . 1 . 2 . 3]" 1 953 1 43 ASP QB 1 46 LYS QB 6.272 . 6.899 2.370 2.190 3.990 . 0 0 "[ . 1 . 2 . 3]" 1 954 1 43 ASP QB 1 46 LYS QG 6.523 . 7.150 4.026 2.383 4.433 . 0 0 "[ . 1 . 2 . 3]" 1 955 1 43 ASP QB 1 49 LEU QD 7.711 . 8.467 2.432 2.081 3.468 . 0 0 "[ . 1 . 2 . 3]" 1 956 1 43 ASP QB 1 50 GLY H 6.160 . 6.720 5.068 4.659 5.406 . 0 0 "[ . 1 . 2 . 3]" 1 957 1 43 ASP QB 1 52 ILE H 6.160 . 6.720 4.477 4.161 4.816 . 0 0 "[ . 1 . 2 . 3]" 1 958 1 43 ASP QB 1 52 ILE MD 4.838 . 5.510 2.533 2.201 3.119 . 0 0 "[ . 1 . 2 . 3]" 1 959 1 43 ASP QB 1 52 ILE QG 6.397 . 7.025 2.272 2.022 2.677 . 0 0 "[ . 1 . 2 . 3]" 1 960 1 43 ASP QB 1 52 ILE MG 6.720 . 7.392 3.376 2.486 3.906 . 0 0 "[ . 1 . 2 . 3]" 1 961 1 44 PRO HA 1 46 LYS H 4.000 . 4.500 4.045 3.941 4.093 . 0 0 "[ . 1 . 2 . 3]" 1 962 1 44 PRO HA 1 47 PRO QB 4.592 . 5.152 4.022 3.619 4.158 . 0 0 "[ . 1 . 2 . 3]" 1 963 1 44 PRO HA 1 47 PRO QD 4.592 . 5.152 3.693 3.431 4.093 . 0 0 "[ . 1 . 2 . 3]" 1 964 1 44 PRO QB 1 45 GLU H 4.256 . 4.816 3.644 3.623 3.678 . 0 0 "[ . 1 . 2 . 3]" 1 965 1 44 PRO QB 1 45 GLU QG 5.018 . 5.645 3.570 3.373 3.812 . 0 0 "[ . 1 . 2 . 3]" 1 966 1 44 PRO QB 1 46 LYS H 6.048 . 6.608 4.994 4.931 5.039 . 0 0 "[ . 1 . 2 . 3]" 1 967 1 44 PRO QD 1 45 GLU H 4.480 . 5.040 2.898 2.775 3.000 . 0 0 "[ . 1 . 2 . 3]" 1 968 1 44 PRO QD 1 45 GLU QB 6.648 . 7.276 4.426 4.248 4.602 . 0 0 "[ . 1 . 2 . 3]" 1 969 1 44 PRO QD 1 45 GLU QG 6.899 . 7.526 4.020 3.745 4.189 . 0 0 "[ . 1 . 2 . 3]" 1 970 1 44 PRO QD 1 46 LYS H 5.600 . 6.160 4.244 4.168 4.338 . 0 0 "[ . 1 . 2 . 3]" 1 971 1 44 PRO QD 1 52 ILE MD 6.854 . 7.526 4.140 3.472 4.718 . 0 0 "[ . 1 . 2 . 3]" 1 972 1 44 PRO QG 1 45 GLU H 3.808 . 4.368 2.864 2.832 2.906 . 0 0 "[ . 1 . 2 . 3]" 1 973 1 44 PRO QG 1 45 GLU QG 4.390 . 5.018 2.641 2.463 2.765 . 0 0 "[ . 1 . 2 . 3]" 1 974 1 45 GLU H 1 45 GLU QB 3.472 . 4.032 2.472 2.411 2.510 . 0 0 "[ . 1 . 2 . 3]" 1 975 1 45 GLU H 1 45 GLU QG 4.032 . 4.592 2.739 2.616 2.842 . 0 0 "[ . 1 . 2 . 3]" 1 976 1 45 GLU H 1 46 LYS H 3.000 . 3.500 2.091 2.013 2.187 . 0 0 "[ . 1 . 2 . 3]" 1 977 1 45 GLU H 1 46 LYS HA 4.900 . 5.400 4.901 4.851 4.959 . 0 0 "[ . 1 . 2 . 3]" 1 978 1 45 GLU H 1 46 LYS QG 5.264 . 5.824 4.159 3.749 4.629 . 0 0 "[ . 1 . 2 . 3]" 1 979 1 45 GLU H 1 47 PRO QD 5.600 . 6.160 3.913 3.672 4.132 . 0 0 "[ . 1 . 2 . 3]" 1 980 1 45 GLU HA 1 46 LYS HA 5.000 . 5.500 4.644 4.546 4.722 . 0 0 "[ . 1 . 2 . 3]" 1 981 1 45 GLU HA 1 46 LYS QG 5.824 . 6.384 4.426 4.266 4.811 . 0 0 "[ . 1 . 2 . 3]" 1 982 1 45 GLU HA 1 47 PRO QD 5.264 . 5.824 3.572 3.259 3.814 . 0 0 "[ . 1 . 2 . 3]" 1 983 1 45 GLU QB 1 46 LYS H 4.144 . 4.704 3.214 3.060 3.343 . 0 0 "[ . 1 . 2 . 3]" 1 984 1 45 GLU QB 1 46 LYS HA 5.824 . 6.384 4.497 4.411 4.659 . 0 0 "[ . 1 . 2 . 3]" 1 985 1 45 GLU QB 1 46 LYS QG 5.519 . 6.147 2.849 2.617 3.092 . 0 0 "[ . 1 . 2 . 3]" 1 986 1 45 GLU QG 1 46 LYS H 5.376 . 5.936 4.324 4.247 4.392 . 0 0 "[ . 1 . 2 . 3]" 1 987 1 45 GLU QG 1 46 LYS QG 6.648 . 7.276 4.802 4.423 5.054 . 0 0 "[ . 1 . 2 . 3]" 1 988 1 46 LYS H 1 46 LYS QD 5.600 . 6.160 4.857 4.101 5.054 . 0 0 "[ . 1 . 2 . 3]" 1 989 1 46 LYS H 1 46 LYS QE 4.928 . 5.488 4.340 4.160 4.502 . 0 0 "[ . 1 . 2 . 3]" 1 990 1 46 LYS H 1 46 LYS QG 4.480 . 5.040 3.218 2.573 3.421 . 0 0 "[ . 1 . 2 . 3]" 1 991 1 46 LYS H 1 47 PRO HA 4.600 . 5.100 4.250 4.126 4.411 . 0 0 "[ . 1 . 2 . 3]" 1 992 1 46 LYS H 1 47 PRO QD 4.256 . 4.816 2.658 2.601 2.928 . 0 0 "[ . 1 . 2 . 3]" 1 993 1 46 LYS H 1 47 PRO QG 5.152 . 5.712 4.569 3.877 4.662 . 0 0 "[ . 1 . 2 . 3]" 1 994 1 46 LYS H 1 48 GLN H 5.200 . 5.700 5.101 4.959 5.222 . 0 0 "[ . 1 . 2 . 3]" 1 995 1 46 LYS H 1 49 LEU QD 7.020 . 7.695 4.493 3.981 5.210 . 0 0 "[ . 1 . 2 . 3]" 1 996 1 46 LYS HA 1 47 PRO QD 3.584 . 4.144 2.370 2.279 2.505 . 0 0 "[ . 1 . 2 . 3]" 1 997 1 46 LYS HA 1 48 GLN H 4.300 . 4.800 3.277 3.050 3.436 . 0 0 "[ . 1 . 2 . 3]" 1 998 1 46 LYS HA 1 49 LEU H 5.400 . 5.900 4.343 4.064 4.819 . 0 0 "[ . 1 . 2 . 3]" 1 999 1 46 LYS HA 1 49 LEU QD 7.425 . 8.100 4.465 4.165 4.854 . 0 0 "[ . 1 . 2 . 3]" 1 1000 1 46 LYS QB 1 47 PRO QD 6.147 . 6.774 3.907 3.811 3.954 . 0 0 "[ . 1 . 2 . 3]" 1 1001 1 46 LYS QB 1 48 GLN H 5.824 . 6.384 3.887 3.529 4.215 . 0 0 "[ . 1 . 2 . 3]" 1 1002 1 46 LYS QB 1 49 LEU H 5.152 . 5.712 3.255 3.091 3.508 . 0 0 "[ . 1 . 2 . 3]" 1 1003 1 46 LYS QB 1 49 LEU QD 6.502 . 7.258 2.277 2.078 3.241 . 0 0 "[ . 1 . 2 . 3]" 1 1004 1 46 LYS QB 1 50 GLY H 6.160 . 6.720 5.279 4.814 5.589 . 0 0 "[ . 1 . 2 . 3]" 1 1005 1 46 LYS QD 1 49 LEU H 5.600 . 6.160 5.073 4.760 5.136 . 0 0 "[ . 1 . 2 . 3]" 1 1006 1 46 LYS QD 1 49 LEU QD 6.350 . 7.106 2.733 2.128 3.549 . 0 0 "[ . 1 . 2 . 3]" 1 1007 1 46 LYS QE 1 49 LEU QD 6.804 . 7.560 2.687 1.945 4.523 . 0 0 "[ . 1 . 2 . 3]" 1 1008 1 46 LYS QG 1 47 PRO QD 6.147 . 6.774 4.222 4.090 4.489 . 0 0 "[ . 1 . 2 . 3]" 1 1009 1 46 LYS QG 1 49 LEU QD 6.653 . 7.409 3.541 2.284 3.852 . 0 0 "[ . 1 . 2 . 3]" 1 1010 1 47 PRO HA 1 49 LEU H 4.200 . 4.700 3.796 3.646 3.929 . 0 0 "[ . 1 . 2 . 3]" 1 1011 1 47 PRO HA 1 50 GLY H 4.300 . 4.800 3.508 3.181 3.900 . 0 0 "[ . 1 . 2 . 3]" 1 1012 1 47 PRO QB 1 48 GLN H 4.928 . 5.488 3.582 3.191 3.829 . 0 0 "[ . 1 . 2 . 3]" 1 1013 1 47 PRO QD 1 48 GLN H 4.704 . 5.264 2.980 2.750 3.176 . 0 0 "[ . 1 . 2 . 3]" 1 1014 1 47 PRO QG 1 48 GLN H 5.600 . 6.160 3.066 2.721 4.386 . 0 0 "[ . 1 . 2 . 3]" 1 1015 1 48 GLN H 1 49 LEU H 3.300 . 3.800 2.719 2.322 2.910 . 0 0 "[ . 1 . 2 . 3]" 1 1016 1 48 GLN H 1 49 LEU QD 6.480 . 7.155 4.827 4.415 4.952 . 0 0 "[ . 1 . 2 . 3]" 1 1017 1 48 GLN H 1 50 GLY H 4.800 . 5.300 4.274 3.929 4.431 . 0 0 "[ . 1 . 2 . 3]" 1 1018 1 48 GLN HA 1 50 GLY H 4.300 . 4.800 3.898 3.697 4.187 . 0 0 "[ . 1 . 2 . 3]" 1 1019 1 48 GLN QB 1 49 LEU QD 6.955 . 7.711 4.366 3.933 4.625 . 0 0 "[ . 1 . 2 . 3]" 1 1020 1 49 LEU H 1 49 LEU QD 4.725 . 5.400 3.163 2.528 3.531 . 0 0 "[ . 1 . 2 . 3]" 1 1021 1 49 LEU H 1 49 LEU HG 4.100 . 4.600 2.764 2.080 4.237 . 0 0 "[ . 1 . 2 . 3]" 1 1022 1 49 LEU H 1 50 GLY H 3.200 . 3.700 2.681 2.493 2.813 . 0 0 "[ . 1 . 2 . 3]" 1 1023 1 49 LEU H 1 50 GLY QA 5.488 . 6.048 4.586 4.414 4.696 . 0 0 "[ . 1 . 2 . 3]" 1 1024 1 49 LEU H 1 52 ILE MG 6.360 . 6.960 5.317 5.228 5.387 . 0 0 "[ . 1 . 2 . 3]" 1 1025 1 49 LEU HA 1 50 GLY QA 5.600 . 6.160 4.444 4.108 4.502 . 0 0 "[ . 1 . 2 . 3]" 1 1026 1 49 LEU QB 1 50 GLY H 4.816 . 5.376 2.932 2.666 4.005 . 0 0 "[ . 1 . 2 . 3]" 1 1027 1 49 LEU QB 1 52 ILE MG 4.704 . 5.376 2.775 2.307 3.516 . 0 0 "[ . 1 . 2 . 3]" 1 1028 1 49 LEU QD 1 50 GLY H 6.345 . 7.020 4.051 2.562 4.248 . 0 0 "[ . 1 . 2 . 3]" 1 1029 1 49 LEU QD 1 51 MET H 7.425 . 8.100 5.576 4.826 5.677 . 0 0 "[ . 1 . 2 . 3]" 1 1030 1 49 LEU QD 1 52 ILE MG 4.374 . 5.184 2.030 1.948 2.177 . 0 0 "[ . 1 . 2 . 3]" 1 1031 1 50 GLY H 1 51 MET H 4.500 . 5.000 4.561 4.521 4.619 . 0 0 "[ . 1 . 2 . 3]" 1 1032 1 50 GLY QA 1 51 MET H 3.584 . 4.144 2.177 2.115 2.243 . 0 0 "[ . 1 . 2 . 3]" 1 1033 1 50 GLY QA 1 51 MET QB 6.147 . 6.774 4.314 4.213 4.430 . 0 0 "[ . 1 . 2 . 3]" 1 1034 1 50 GLY QA 1 51 MET QG 6.021 . 6.648 3.263 3.109 3.499 . 0 0 "[ . 1 . 2 . 3]" 1 1035 1 51 MET H 1 51 MET QG 4.256 . 4.816 1.950 1.812 2.033 . 0 0 "[ . 1 . 2 . 3]" 1 1036 1 51 MET H 1 52 ILE H 4.800 . 5.300 4.555 4.480 4.608 . 0 0 "[ . 1 . 2 . 3]" 1 1037 1 51 MET H 1 52 ILE HA 5.500 . 6.000 5.582 5.541 5.648 . 0 0 "[ . 1 . 2 . 3]" 1 1038 1 51 MET HA 1 51 MET ME 3.960 . 4.560 3.313 3.105 3.351 . 0 0 "[ . 1 . 2 . 3]" 1 1039 1 51 MET HA 1 52 ILE H 3.000 . 3.500 2.158 2.107 2.204 . 0 0 "[ . 1 . 2 . 3]" 1 1040 1 51 MET HA 1 52 ILE HA 4.700 . 5.200 4.444 4.420 4.458 . 0 0 "[ . 1 . 2 . 3]" 1 1041 1 51 MET HA 1 52 ILE QG 5.040 . 5.600 3.735 3.509 3.874 . 0 0 "[ . 1 . 2 . 3]" 1 1042 1 51 MET HA 1 52 ILE MG 5.160 . 5.760 4.046 3.899 4.138 . 0 0 "[ . 1 . 2 . 3]" 1 1043 1 51 MET QB 1 51 MET ME 4.032 . 4.704 2.327 2.207 2.383 . 0 0 "[ . 1 . 2 . 3]" 1 1044 1 51 MET QB 1 52 ILE H 5.040 . 5.600 3.108 2.757 3.338 . 0 0 "[ . 1 . 2 . 3]" 1 1045 1 51 MET QG 1 52 ILE H 5.712 . 6.272 4.464 4.226 4.872 . 0 0 "[ . 1 . 2 . 3]" 1 1046 1 52 ILE H 1 52 ILE HB 4.000 . 4.500 3.791 3.689 3.907 . 0 0 "[ . 1 . 2 . 3]" 1 1047 1 52 ILE H 1 52 ILE MD 4.800 . 5.400 3.356 2.469 4.016 . 0 0 "[ . 1 . 2 . 3]" 1 1048 1 52 ILE H 1 52 ILE QG 4.368 . 4.928 2.332 2.154 2.696 . 0 0 "[ . 1 . 2 . 3]" 1 1049 1 52 ILE H 1 52 ILE MG 4.320 . 4.920 3.162 2.799 3.481 . 0 0 "[ . 1 . 2 . 3]" 1 1050 1 52 ILE H 1 53 ASP H 4.500 . 5.000 4.457 4.376 4.533 . 0 0 "[ . 1 . 2 . 3]" 1 1051 1 52 ILE HA 1 52 ILE MG 3.480 . 4.080 2.213 2.169 2.251 . 0 0 "[ . 1 . 2 . 3]" 1 1052 1 52 ILE HA 1 53 ASP H 2.900 . 3.400 2.319 2.233 2.436 . 0 0 "[ . 1 . 2 . 3]" 1 1053 1 52 ILE HA 1 53 ASP HA 4.600 . 5.100 4.422 4.364 4.488 . 0 0 "[ . 1 . 2 . 3]" 1 1054 1 52 ILE HA 1 53 ASP QB 5.040 . 5.600 4.382 4.198 4.482 . 0 0 "[ . 1 . 2 . 3]" 1 1055 1 52 ILE HA 1 54 ARG H 5.500 . 6.000 5.291 5.049 5.534 . 0 0 "[ . 1 . 2 . 3]" 1 1056 1 52 ILE HB 1 52 ILE MD 3.480 . 4.080 2.325 2.231 2.428 . 0 0 "[ . 1 . 2 . 3]" 1 1057 1 52 ILE HB 1 53 ASP H 3.300 . 3.800 2.351 2.248 2.615 . 0 0 "[ . 1 . 2 . 3]" 1 1058 1 52 ILE MD 1 53 ASP H 4.800 . 5.400 3.813 3.339 4.059 . 0 0 "[ . 1 . 2 . 3]" 1 1059 1 52 ILE MD 1 54 ARG H 5.760 . 6.360 3.583 2.826 4.472 . 0 0 "[ . 1 . 2 . 3]" 1 1060 1 52 ILE MD 1 54 ARG QD 5.779 . 6.451 2.146 1.925 2.420 . 0 0 "[ . 1 . 2 . 3]" 1 1061 1 52 ILE MD 1 54 ARG QG 6.182 . 6.854 3.091 2.173 4.275 . 0 0 "[ . 1 . 2 . 3]" 1 1062 1 52 ILE MD 1 55 TRP H 6.600 . 7.200 5.016 4.286 5.531 . 0 0 "[ . 1 . 2 . 3]" 1 1063 1 52 ILE QG 1 53 ASP H 5.040 . 5.600 4.023 3.704 4.491 . 0 0 "[ . 1 . 2 . 3]" 1 1064 1 52 ILE QG 1 54 ARG QD 6.774 . 7.401 3.312 2.656 3.754 . 0 0 "[ . 1 . 2 . 3]" 1 1065 1 52 ILE MG 1 53 ASP H 3.960 . 4.560 3.369 3.306 3.446 . 0 0 "[ . 1 . 2 . 3]" 1 1066 1 52 ILE MG 1 54 ARG QD 6.720 . 7.392 5.032 4.952 5.092 . 0 0 "[ . 1 . 2 . 3]" 1 1067 1 53 ASP H 1 54 ARG H 3.900 . 4.400 3.973 3.901 4.062 . 0 0 "[ . 1 . 2 . 3]" 1 1068 1 53 ASP HA 1 54 ARG H 3.400 . 3.900 2.208 2.085 2.310 . 0 0 "[ . 1 . 2 . 3]" 1 1069 1 53 ASP QB 1 54 ARG H 4.816 . 5.376 3.762 3.654 3.846 . 0 0 "[ . 1 . 2 . 3]" 1 1070 1 53 ASP QB 1 55 TRP HD1 5.376 . 5.936 4.480 3.743 4.834 . 0 0 "[ . 1 . 2 . 3]" 1 1071 1 53 ASP QB 1 55 TRP HE1 4.480 . 5.040 3.339 2.672 3.721 . 0 0 "[ . 1 . 2 . 3]" 1 1072 1 53 ASP QB 1 55 TRP HZ2 5.712 . 6.272 3.682 3.096 4.037 . 0 0 "[ . 1 . 2 . 3]" 1 1073 1 54 ARG H 1 54 ARG QD 5.600 . 6.160 3.928 3.474 4.390 . 0 0 "[ . 1 . 2 . 3]" 1 1074 1 54 ARG H 1 55 TRP HA 5.500 . 6.000 5.239 5.012 5.331 . 0 0 "[ . 1 . 2 . 3]" 1 1075 1 54 ARG HA 1 54 ARG QD 4.480 . 5.040 3.112 2.144 3.913 . 0 0 "[ . 1 . 2 . 3]" 1 1076 1 54 ARG HA 1 55 TRP H 3.300 . 3.800 2.222 2.180 2.291 . 0 0 "[ . 1 . 2 . 3]" 1 1077 1 54 ARG HA 1 55 TRP HA 5.000 . 5.500 4.455 4.379 4.515 . 0 0 "[ . 1 . 2 . 3]" 1 1078 1 54 ARG HA 1 55 TRP QB 5.488 . 6.048 4.466 4.406 4.564 . 0 0 "[ . 1 . 2 . 3]" 1 1079 1 54 ARG HA 1 55 TRP HD1 5.500 . 6.000 4.177 3.850 4.684 . 0 0 "[ . 1 . 2 . 3]" 1 1080 1 54 ARG HA 1 56 TYR QE 5.376 . 5.936 4.811 4.748 4.878 . 0 0 "[ . 1 . 2 . 3]" 1 1081 1 54 ARG QB 1 55 TRP H 5.040 . 5.600 3.888 3.717 3.963 . 0 0 "[ . 1 . 2 . 3]" 1 1082 1 54 ARG QB 1 56 TYR QE 5.394 . 6.021 2.377 2.263 2.617 . 0 0 "[ . 1 . 2 . 3]" 1 1083 1 54 ARG QD 1 56 TYR QE 6.272 . 6.899 4.492 3.694 5.032 . 0 0 "[ . 1 . 2 . 3]" 1 1084 1 54 ARG QG 1 55 TRP H 4.816 . 5.376 3.422 2.976 3.948 . 0 0 "[ . 1 . 2 . 3]" 1 1085 1 54 ARG QG 1 56 TYR QE 5.143 . 5.770 3.404 3.142 3.634 . 0 0 "[ . 1 . 2 . 3]" 1 1086 1 55 TRP H 1 55 TRP HD1 4.100 . 4.600 2.857 2.729 3.124 . 0 0 "[ . 1 . 2 . 3]" 1 1087 1 55 TRP H 1 55 TRP HE1 5.500 . 6.000 4.940 4.689 5.180 . 0 0 "[ . 1 . 2 . 3]" 1 1088 1 55 TRP H 1 56 TYR H 4.900 . 5.400 4.616 4.575 4.648 . 0 0 "[ . 1 . 2 . 3]" 1 1089 1 55 TRP H 1 56 TYR QE 6.160 . 6.720 5.008 4.751 5.228 . 0 0 "[ . 1 . 2 . 3]" 1 1090 1 55 TRP HA 1 55 TRP HE1 5.500 . 6.000 5.472 5.276 5.537 . 0 0 "[ . 1 . 2 . 3]" 1 1091 1 55 TRP HA 1 55 TRP HE3 4.200 . 4.700 2.985 2.699 3.204 . 0 0 "[ . 1 . 2 . 3]" 1 1092 1 55 TRP HA 1 56 TYR QD 5.376 . 5.936 3.337 3.085 3.547 . 0 0 "[ . 1 . 2 . 3]" 1 1093 1 55 TRP QB 1 56 TYR H 4.928 . 5.488 2.592 2.530 2.705 . 0 0 "[ . 1 . 2 . 3]" 1 1094 1 55 TRP HE3 1 56 TYR H 4.800 . 5.300 3.148 2.996 3.287 . 0 0 "[ . 1 . 2 . 3]" 1 1095 1 55 TRP HZ3 1 56 TYR H 5.500 . 6.000 5.373 5.229 5.513 . 0 0 "[ . 1 . 2 . 3]" 1 1096 1 56 TYR H 1 56 TYR QD 5.040 . 5.600 3.179 2.961 3.321 . 0 0 "[ . 1 . 2 . 3]" 1 1097 1 56 TYR H 1 57 HIS H 5.200 . 5.700 4.377 4.363 4.396 . 0 0 "[ . 1 . 2 . 3]" 1 1098 1 56 TYR HA 1 56 TYR QE 5.488 . 6.048 4.646 4.572 4.732 . 0 0 "[ . 1 . 2 . 3]" 1 1099 1 56 TYR HA 1 57 HIS H 3.500 . 4.000 2.262 2.222 2.301 . 0 0 "[ . 1 . 2 . 3]" 1 1100 1 56 TYR HA 1 57 HIS QB 5.488 . 6.048 4.519 4.416 4.596 . 0 0 "[ . 1 . 2 . 3]" 1 1101 1 56 TYR HA 1 60 CYS QB 5.376 . 5.936 3.651 3.494 3.785 . 0 0 "[ . 1 . 2 . 3]" 1 1102 1 56 TYR HA 1 61 PHE H 5.300 . 5.800 4.995 4.869 5.183 . 0 0 "[ . 1 . 2 . 3]" 1 1103 1 56 TYR QB 1 57 HIS H 5.488 . 6.048 2.673 2.561 2.781 . 0 0 "[ . 1 . 2 . 3]" 1 1104 1 56 TYR QB 1 60 CYS H 6.160 . 6.720 4.522 4.109 4.757 . 0 0 "[ . 1 . 2 . 3]" 1 1105 1 56 TYR QB 1 61 PHE H 5.040 . 5.600 2.797 2.585 3.025 . 0 0 "[ . 1 . 2 . 3]" 1 1106 1 56 TYR QB 1 61 PHE HA 4.928 . 5.488 3.041 2.919 3.244 . 0 0 "[ . 1 . 2 . 3]" 1 1107 1 56 TYR QB 1 61 PHE QB 5.018 . 5.645 2.156 2.066 2.261 . 0 0 "[ . 1 . 2 . 3]" 1 1108 1 56 TYR QB 1 61 PHE QD 5.896 . 6.523 3.968 3.819 4.085 . 0 0 "[ . 1 . 2 . 3]" 1 1109 1 56 TYR QB 1 62 VAL H 6.160 . 6.720 5.035 4.883 5.227 . 0 0 "[ . 1 . 2 . 3]" 1 1110 1 56 TYR QD 1 57 HIS H 5.040 . 5.600 3.827 3.665 3.997 . 0 0 "[ . 1 . 2 . 3]" 1 1111 1 56 TYR QD 1 61 PHE QB 6.648 . 7.276 3.432 3.034 3.637 . 0 0 "[ . 1 . 2 . 3]" 1 1112 1 56 TYR QD 1 64 ASN HD22 6.048 . 6.608 2.473 2.156 2.790 . 0 0 "[ . 1 . 2 . 3]" 1 1113 1 56 TYR QD 1 68 LEU QD 7.258 . 8.014 3.101 3.000 3.243 . 0 0 "[ . 1 . 2 . 3]" 1 1114 1 56 TYR QE 1 68 LEU QD 6.199 . 6.955 2.562 2.385 2.694 . 0 0 "[ . 1 . 2 . 3]" 1 1115 1 57 HIS H 1 57 HIS HD2 5.500 . 6.000 4.719 4.665 4.760 . 0 0 "[ . 1 . 2 . 3]" 1 1116 1 57 HIS H 1 58 PRO QD 6.160 . 6.720 4.524 4.506 4.537 . 0 0 "[ . 1 . 2 . 3]" 1 1117 1 57 HIS H 1 59 GLY H 5.400 . 5.900 5.041 4.925 5.134 . 0 0 "[ . 1 . 2 . 3]" 1 1118 1 57 HIS H 1 60 CYS H 4.600 . 5.100 3.844 3.669 3.952 . 0 0 "[ . 1 . 2 . 3]" 1 1119 1 57 HIS H 1 60 CYS HA 5.500 . 6.000 5.354 5.265 5.430 . 0 0 "[ . 1 . 2 . 3]" 1 1120 1 57 HIS H 1 60 CYS QB 5.152 . 5.712 2.362 2.270 2.440 . 0 0 "[ . 1 . 2 . 3]" 1 1121 1 57 HIS H 1 61 PHE H 4.600 . 5.100 3.857 3.794 3.956 . 0 0 "[ . 1 . 2 . 3]" 1 1122 1 57 HIS H 1 61 PHE QB 6.160 . 6.720 4.363 4.279 4.466 . 0 0 "[ . 1 . 2 . 3]" 1 1123 1 57 HIS H 1 61 PHE QD 6.160 . 6.720 5.515 5.493 5.539 . 0 0 "[ . 1 . 2 . 3]" 1 1124 1 57 HIS HA 1 57 HIS HD2 4.200 . 4.700 2.716 2.639 2.763 . 0 0 "[ . 1 . 2 . 3]" 1 1125 1 57 HIS HA 1 57 HIS HE1 5.500 . 6.000 5.622 5.592 5.647 . 0 0 "[ . 1 . 2 . 3]" 1 1126 1 57 HIS HA 1 58 PRO QD 4.256 . 4.816 2.120 2.055 2.244 . 0 0 "[ . 1 . 2 . 3]" 1 1127 1 57 HIS HA 1 58 PRO QG 5.152 . 5.712 4.034 3.939 4.185 . 0 0 "[ . 1 . 2 . 3]" 1 1128 1 57 HIS HA 1 59 GLY H 4.900 . 5.400 4.221 4.030 4.333 . 0 0 "[ . 1 . 2 . 3]" 1 1129 1 57 HIS HA 1 60 CYS H 4.700 . 5.200 4.634 4.406 4.725 . 0 0 "[ . 1 . 2 . 3]" 1 1130 1 57 HIS HA 1 61 PHE H 5.500 . 6.000 5.080 4.981 5.230 . 0 0 "[ . 1 . 2 . 3]" 1 1131 1 57 HIS QB 1 58 PRO QD 5.519 . 6.147 2.256 2.141 2.375 . 0 0 "[ . 1 . 2 . 3]" 1 1132 1 57 HIS QB 1 59 GLY H 4.816 . 5.376 2.343 2.142 2.457 . 0 0 "[ . 1 . 2 . 3]" 1 1133 1 57 HIS QB 1 60 CYS H 4.368 . 4.928 2.212 2.104 2.506 . 0 0 "[ . 1 . 2 . 3]" 1 1134 1 57 HIS QB 1 60 CYS HA 5.600 . 6.160 4.359 4.275 4.434 . 0 0 "[ . 1 . 2 . 3]" 1 1135 1 57 HIS QB 1 60 CYS QB 6.147 . 6.774 2.562 2.460 2.662 . 0 0 "[ . 1 . 2 . 3]" 1 1136 1 57 HIS QB 1 61 PHE H 5.600 . 6.160 3.831 3.745 3.938 . 0 0 "[ . 1 . 2 . 3]" 1 1137 1 57 HIS HD2 1 58 PRO QD 5.488 . 6.048 2.858 2.589 3.087 . 0 0 "[ . 1 . 2 . 3]" 1 1138 1 57 HIS HD2 1 58 PRO QG 6.048 . 6.608 4.627 4.265 4.933 . 0 0 "[ . 1 . 2 . 3]" 1 1139 1 57 HIS HD2 1 59 GLY H 5.500 . 6.000 5.103 4.847 5.245 . 0 0 "[ . 1 . 2 . 3]" 1 1140 1 58 PRO HA 1 60 CYS H 5.100 . 5.600 4.692 4.069 4.849 . 0 0 "[ . 1 . 2 . 3]" 1 1141 1 58 PRO HA 1 61 PHE H 4.500 . 5.000 4.084 3.961 4.171 . 0 0 "[ . 1 . 2 . 3]" 1 1142 1 58 PRO HA 1 61 PHE QB 4.704 . 5.264 4.018 3.907 4.097 . 0 0 "[ . 1 . 2 . 3]" 1 1143 1 58 PRO HA 1 61 PHE QD 5.824 . 6.384 2.293 2.231 2.365 . 0 0 "[ . 1 . 2 . 3]" 1 1144 1 58 PRO HA 1 61 PHE QE 6.160 . 6.720 2.806 2.640 2.962 . 0 0 "[ . 1 . 2 . 3]" 1 1145 1 58 PRO HA 1 62 VAL H 4.700 . 5.200 4.718 4.641 4.760 . 0 0 "[ . 1 . 2 . 3]" 1 1146 1 58 PRO HA 1 62 VAL QG 5.940 . 6.615 4.087 3.951 4.196 . 0 0 "[ . 1 . 2 . 3]" 1 1147 1 58 PRO HA 1 93 LEU QD 5.130 . 5.805 3.251 2.897 3.769 . 0 0 "[ . 1 . 2 . 3]" 1 1148 1 58 PRO QB 1 59 GLY H 4.704 . 5.264 3.161 2.865 3.578 . 0 0 "[ . 1 . 2 . 3]" 1 1149 1 58 PRO QB 1 60 CYS H 6.160 . 6.720 5.186 4.723 5.500 . 0 0 "[ . 1 . 2 . 3]" 1 1150 1 58 PRO QB 1 93 LEU QD 6.653 . 7.409 2.617 2.276 2.882 . 0 0 "[ . 1 . 2 . 3]" 1 1151 1 58 PRO QD 1 59 GLY H 5.600 . 6.160 2.943 2.758 3.156 . 0 0 "[ . 1 . 2 . 3]" 1 1152 1 58 PRO QD 1 60 CYS H 5.936 . 6.496 4.533 4.403 4.642 . 0 0 "[ . 1 . 2 . 3]" 1 1153 1 58 PRO QG 1 59 GLY H 5.824 . 6.384 3.609 2.705 4.216 . 0 0 "[ . 1 . 2 . 3]" 1 1154 1 58 PRO QG 1 93 LEU QD 6.653 . 7.409 3.666 3.170 4.395 . 0 0 "[ . 1 . 2 . 3]" 1 1155 1 59 GLY H 1 60 CYS H 4.000 . 4.500 2.477 2.451 2.518 . 0 0 "[ . 1 . 2 . 3]" 1 1156 1 59 GLY H 1 60 CYS HA 5.200 . 5.700 5.090 5.040 5.155 . 0 0 "[ . 1 . 2 . 3]" 1 1157 1 59 GLY H 1 61 PHE H 5.100 . 5.600 4.240 4.189 4.351 . 0 0 "[ . 1 . 2 . 3]" 1 1158 1 59 GLY H 1 61 PHE QB 6.160 . 6.720 5.540 5.513 5.596 . 0 0 "[ . 1 . 2 . 3]" 1 1159 1 59 GLY H 1 61 PHE QE 6.160 . 6.720 5.479 5.387 5.508 . 0 0 "[ . 1 . 2 . 3]" 1 1160 1 59 GLY H 1 62 VAL H 5.500 . 6.000 5.244 5.099 5.380 . 0 0 "[ . 1 . 2 . 3]" 1 1161 1 59 GLY H 1 62 VAL QG 7.020 . 7.695 4.897 3.963 5.054 . 0 0 "[ . 1 . 2 . 3]" 1 1162 1 59 GLY QA 1 61 PHE H 6.160 . 6.720 4.407 4.344 4.537 . 0 0 "[ . 1 . 2 . 3]" 1 1163 1 59 GLY QA 1 61 PHE QE 6.272 . 6.899 4.959 4.837 4.998 . 0 0 "[ . 1 . 2 . 3]" 1 1164 1 59 GLY QA 1 62 VAL H 5.712 . 6.272 4.045 3.874 4.244 . 0 0 "[ . 1 . 2 . 3]" 1 1165 1 59 GLY QA 1 62 VAL HB 5.040 . 5.600 3.622 3.237 4.630 . 0 0 "[ . 1 . 2 . 3]" 1 1166 1 59 GLY QA 1 62 VAL QG 6.653 . 7.409 3.336 2.075 3.536 . 0 0 "[ . 1 . 2 . 3]" 1 1167 1 59 GLY QA 1 63 LYS H 5.376 . 5.936 4.481 4.287 4.826 . 0 0 "[ . 1 . 2 . 3]" 1 1168 1 60 CYS H 1 61 PHE H 3.600 . 4.100 2.799 2.257 2.917 . 0 0 "[ . 1 . 2 . 3]" 1 1169 1 60 CYS H 1 61 PHE QB 5.600 . 6.160 4.681 4.103 4.813 . 0 0 "[ . 1 . 2 . 3]" 1 1170 1 60 CYS H 1 61 PHE QD 6.160 . 6.720 4.294 3.590 4.455 . 0 0 "[ . 1 . 2 . 3]" 1 1171 1 60 CYS H 1 62 VAL H 4.400 . 4.900 4.323 3.768 4.429 . 0 0 "[ . 1 . 2 . 3]" 1 1172 1 60 CYS H 1 62 VAL QG 7.425 . 8.100 4.897 3.320 5.129 . 0 0 "[ . 1 . 2 . 3]" 1 1173 1 60 CYS H 1 63 LYS H 5.500 . 6.000 4.721 4.476 4.948 . 0 0 "[ . 1 . 2 . 3]" 1 1174 1 60 CYS H 1 63 LYS QB 6.160 . 6.720 4.684 4.364 5.248 . 0 0 "[ . 1 . 2 . 3]" 1 1175 1 60 CYS HA 1 61 PHE QD 6.160 . 6.720 5.541 5.405 5.581 . 0 0 "[ . 1 . 2 . 3]" 1 1176 1 60 CYS HA 1 62 VAL H 5.200 . 5.700 4.215 4.033 4.284 . 0 0 "[ . 1 . 2 . 3]" 1 1177 1 60 CYS HA 1 63 LYS H 4.000 . 4.500 2.957 2.799 3.110 . 0 0 "[ . 1 . 2 . 3]" 1 1178 1 60 CYS HA 1 63 LYS QB 4.032 . 4.592 2.240 2.061 2.513 . 0 0 "[ . 1 . 2 . 3]" 1 1179 1 60 CYS HA 1 63 LYS QE 5.488 . 6.048 2.291 1.992 2.649 . 0 0 "[ . 1 . 2 . 3]" 1 1180 1 60 CYS HA 1 64 ASN H 5.200 . 5.700 4.183 3.982 4.627 . 0 0 "[ . 1 . 2 . 3]" 1 1181 1 60 CYS HA 1 64 ASN HD22 5.300 . 5.800 4.499 4.357 4.682 . 0 0 "[ . 1 . 2 . 3]" 1 1182 1 60 CYS QB 1 61 PHE H 5.264 . 5.824 2.687 2.636 2.758 . 0 0 "[ . 1 . 2 . 3]" 1 1183 1 60 CYS QB 1 61 PHE QD 6.774 . 7.401 4.853 4.796 4.918 . 0 0 "[ . 1 . 2 . 3]" 1 1184 1 60 CYS QB 1 63 LYS H 6.160 . 6.720 4.509 4.358 4.612 . 0 0 "[ . 1 . 2 . 3]" 1 1185 1 60 CYS QB 1 63 LYS QB 5.896 . 6.523 3.561 3.478 3.707 . 0 0 "[ . 1 . 2 . 3]" 1 1186 1 60 CYS QB 1 64 ASN HD21 6.160 . 6.720 4.569 4.410 4.730 . 0 0 "[ . 1 . 2 . 3]" 1 1187 1 60 CYS QB 1 64 ASN HD22 5.936 . 6.496 3.126 2.978 3.312 . 0 0 "[ . 1 . 2 . 3]" 1 1188 1 61 PHE H 1 61 PHE QD 4.928 . 5.488 2.563 2.500 2.626 . 0 0 "[ . 1 . 2 . 3]" 1 1189 1 61 PHE H 1 62 VAL H 3.900 . 4.400 2.774 2.714 2.794 . 0 0 "[ . 1 . 2 . 3]" 1 1190 1 61 PHE H 1 62 VAL QG 7.425 . 8.100 4.097 3.477 4.247 . 0 0 "[ . 1 . 2 . 3]" 1 1191 1 61 PHE H 1 63 LYS H 5.100 . 5.600 4.165 4.016 4.251 . 0 0 "[ . 1 . 2 . 3]" 1 1192 1 61 PHE H 1 63 LYS QB 6.160 . 6.720 4.850 4.653 5.206 . 0 0 "[ . 1 . 2 . 3]" 1 1193 1 61 PHE H 1 64 ASN H 5.500 . 6.000 4.962 4.883 5.152 . 0 0 "[ . 1 . 2 . 3]" 1 1194 1 61 PHE H 1 64 ASN HD22 5.500 . 6.000 4.335 4.226 4.517 . 0 0 "[ . 1 . 2 . 3]" 1 1195 1 61 PHE H 1 68 LEU QD 6.480 . 7.155 4.638 4.402 4.817 . 0 0 "[ . 1 . 2 . 3]" 1 1196 1 61 PHE HA 1 62 VAL QG 7.425 . 8.100 4.798 4.446 4.869 . 0 0 "[ . 1 . 2 . 3]" 1 1197 1 61 PHE HA 1 63 LYS QB 6.160 . 6.720 4.916 4.798 5.115 . 0 0 "[ . 1 . 2 . 3]" 1 1198 1 61 PHE HA 1 64 ASN H 4.200 . 4.700 3.471 3.392 3.570 . 0 0 "[ . 1 . 2 . 3]" 1 1199 1 61 PHE HA 1 64 ASN HD21 5.500 . 6.000 2.506 2.384 2.615 . 0 0 "[ . 1 . 2 . 3]" 1 1200 1 61 PHE HA 1 64 ASN HD22 5.500 . 6.000 2.768 2.604 2.890 . 0 0 "[ . 1 . 2 . 3]" 1 1201 1 61 PHE QB 1 62 VAL H 5.152 . 5.712 3.508 3.452 3.549 . 0 0 "[ . 1 . 2 . 3]" 1 1202 1 61 PHE QB 1 62 VAL QG 7.711 . 8.467 4.211 4.052 4.344 . 0 0 "[ . 1 . 2 . 3]" 1 1203 1 61 PHE QB 1 68 LEU QD 8.014 . 8.770 2.488 2.223 2.746 . 0 0 "[ . 1 . 2 . 3]" 1 1204 1 61 PHE QD 1 62 VAL H 4.928 . 5.488 2.687 2.610 2.755 . 0 0 "[ . 1 . 2 . 3]" 1 1205 1 61 PHE QD 1 62 VAL HA 4.928 . 5.488 4.245 4.133 4.381 . 0 0 "[ . 1 . 2 . 3]" 1 1206 1 61 PHE QD 1 62 VAL QG 5.897 . 6.653 2.850 2.758 2.923 . 0 0 "[ . 1 . 2 . 3]" 1 1207 1 61 PHE QD 1 63 LYS H 6.160 . 6.720 5.060 4.981 5.178 . 0 0 "[ . 1 . 2 . 3]" 1 1208 1 61 PHE QD 1 64 ASN HD21 5.936 . 6.496 5.364 5.309 5.403 . 0 0 "[ . 1 . 2 . 3]" 1 1209 1 61 PHE QD 1 65 ARG H 6.160 . 6.720 5.542 5.492 5.604 . 0 0 "[ . 1 . 2 . 3]" 1 1210 1 61 PHE QD 1 68 LEU QD 5.746 . 6.502 2.846 2.559 3.200 . 0 0 "[ . 1 . 2 . 3]" 1 1211 1 61 PHE QD 1 79 LEU QD 7.560 . 8.316 3.484 3.296 3.688 . 0 0 "[ . 1 . 2 . 3]" 1 1212 1 61 PHE QD 1 97 LEU QD 5.897 . 6.653 3.454 3.018 3.697 . 0 0 "[ . 1 . 2 . 3]" 1 1213 1 61 PHE QE 1 62 VAL H 6.160 . 6.720 3.951 3.856 4.033 . 0 0 "[ . 1 . 2 . 3]" 1 1214 1 61 PHE QE 1 62 VAL HA 5.376 . 5.936 4.577 4.458 4.804 . 0 0 "[ . 1 . 2 . 3]" 1 1215 1 61 PHE QE 1 97 LEU QD 7.106 . 7.862 2.345 2.113 2.794 . 0 0 "[ . 1 . 2 . 3]" 1 1216 1 62 VAL H 1 62 VAL HB 3.700 . 4.200 2.660 2.415 3.602 . 0 0 "[ . 1 . 2 . 3]" 1 1217 1 62 VAL H 1 63 LYS H 3.700 . 4.200 2.720 2.636 2.846 . 0 0 "[ . 1 . 2 . 3]" 1 1218 1 62 VAL H 1 64 ASN H 5.200 . 5.700 4.280 4.144 4.381 . 0 0 "[ . 1 . 2 . 3]" 1 1219 1 62 VAL H 1 68 LEU QD 7.425 . 8.100 4.837 4.700 5.013 . 0 0 "[ . 1 . 2 . 3]" 1 1220 1 62 VAL H 1 97 LEU QD 6.345 . 7.020 4.266 3.540 4.589 . 0 0 "[ . 1 . 2 . 3]" 1 1221 1 62 VAL HA 1 63 LYS HA 4.800 . 5.300 4.846 4.797 4.872 . 0 0 "[ . 1 . 2 . 3]" 1 1222 1 62 VAL HA 1 65 ARG H 4.200 . 4.700 3.302 3.123 3.679 . 0 0 "[ . 1 . 2 . 3]" 1 1223 1 62 VAL HA 1 65 ARG QB 5.040 . 5.600 2.181 2.063 2.529 . 0 0 "[ . 1 . 2 . 3]" 1 1224 1 62 VAL HA 1 97 LEU QB 5.600 . 6.160 3.806 3.411 4.564 . 0 0 "[ . 1 . 2 . 3]" 1 1225 1 62 VAL HA 1 97 LEU QD 4.860 . 5.535 2.470 2.076 2.692 . 0 0 "[ . 1 . 2 . 3]" 1 1226 1 62 VAL HB 1 63 LYS H 3.700 . 4.200 2.763 2.519 3.747 . 0 0 "[ . 1 . 2 . 3]" 1 1227 1 62 VAL QG 1 63 LYS H 4.725 . 5.400 3.299 2.352 3.385 . 0 0 "[ . 1 . 2 . 3]" 1 1228 1 62 VAL QG 1 63 LYS HA 4.995 . 5.670 3.664 3.469 3.735 . 0 0 "[ . 1 . 2 . 3]" 1 1229 1 62 VAL QG 1 63 LYS QB 6.804 . 7.560 4.226 2.754 4.549 . 0 0 "[ . 1 . 2 . 3]" 1 1230 1 62 VAL QG 1 64 ASN H 7.425 . 8.100 4.683 4.298 4.823 . 0 0 "[ . 1 . 2 . 3]" 1 1231 1 62 VAL QG 1 65 ARG H 6.615 . 7.290 4.155 3.942 4.515 . 0 0 "[ . 1 . 2 . 3]" 1 1232 1 62 VAL QG 1 96 GLN H 6.075 . 6.750 4.409 4.212 4.564 . 0 0 "[ . 1 . 2 . 3]" 1 1233 1 62 VAL QG 1 96 GLN HA 5.130 . 5.805 3.585 3.173 3.789 . 0 0 "[ . 1 . 2 . 3]" 1 1234 1 62 VAL QG 1 96 GLN QB 5.141 . 5.897 2.029 1.899 2.556 . 0 0 "[ . 1 . 2 . 3]" 1 1235 1 62 VAL QG 1 97 LEU H 6.615 . 7.290 3.753 3.497 4.225 . 0 0 "[ . 1 . 2 . 3]" 1 1236 1 62 VAL QG 1 97 LEU QB 7.409 . 8.165 2.261 1.942 3.254 . 0 0 "[ . 1 . 2 . 3]" 1 1237 1 62 VAL QG 1 97 LEU QD 6.379 . 7.290 2.167 1.875 2.527 . 0 0 "[ . 1 . 2 . 3]" 1 1238 1 62 VAL QG 1 97 LEU HG 5.805 . 6.480 4.037 2.569 4.312 . 0 0 "[ . 1 . 2 . 3]" 1 1239 1 63 LYS H 1 63 LYS QB 3.360 . 3.920 2.228 2.043 2.414 . 0 0 "[ . 1 . 2 . 3]" 1 1240 1 63 LYS H 1 63 LYS QE 6.048 . 6.608 4.155 3.801 4.366 . 0 0 "[ . 1 . 2 . 3]" 1 1241 1 63 LYS H 1 64 ASN H 3.500 . 4.000 2.787 2.483 2.882 . 0 0 "[ . 1 . 2 . 3]" 1 1242 1 63 LYS H 1 64 ASN HA 5.500 . 6.000 5.443 5.199 5.526 . 0 0 "[ . 1 . 2 . 3]" 1 1243 1 63 LYS H 1 65 ARG H 4.500 . 5.000 4.047 3.707 4.206 . 0 0 "[ . 1 . 2 . 3]" 1 1244 1 63 LYS H 1 65 ARG QB 5.600 . 6.160 4.795 4.496 4.925 . 0 0 "[ . 1 . 2 . 3]" 1 1245 1 63 LYS H 1 68 LEU QD 7.425 . 8.100 5.463 5.121 5.528 . 0 0 "[ . 1 . 2 . 3]" 1 1246 1 63 LYS HA 1 64 ASN HA 4.900 . 5.400 4.626 4.549 4.655 . 0 0 "[ . 1 . 2 . 3]" 1 1247 1 63 LYS HA 1 65 ARG H 4.600 . 5.100 4.057 3.949 4.192 . 0 0 "[ . 1 . 2 . 3]" 1 1248 1 63 LYS QB 1 64 ASN H 3.920 . 4.480 2.781 2.667 3.204 . 0 0 "[ . 1 . 2 . 3]" 1 1249 1 63 LYS QB 1 64 ASN HD22 5.264 . 5.824 4.406 4.001 4.695 . 0 0 "[ . 1 . 2 . 3]" 1 1250 1 63 LYS QE 1 64 ASN H 6.160 . 6.720 4.528 4.072 4.756 . 0 0 "[ . 1 . 2 . 3]" 1 1251 1 63 LYS QE 1 64 ASN HD22 6.160 . 6.720 4.787 3.931 5.491 . 0 0 "[ . 1 . 2 . 3]" 1 1252 1 64 ASN H 1 64 ASN HD21 3.800 . 4.300 3.217 3.106 3.348 . 0 0 "[ . 1 . 2 . 3]" 1 1253 1 64 ASN H 1 64 ASN HD22 4.500 . 5.000 3.520 3.422 3.713 . 0 0 "[ . 1 . 2 . 3]" 1 1254 1 64 ASN H 1 65 ARG QB 6.160 . 6.720 4.333 4.052 4.452 . 0 0 "[ . 1 . 2 . 3]" 1 1255 1 64 ASN H 1 66 GLU H 5.400 . 5.900 5.129 4.941 5.408 . 0 0 "[ . 1 . 2 . 3]" 1 1256 1 64 ASN H 1 68 LEU H 5.500 . 6.000 5.646 5.577 5.684 . 0 0 "[ . 1 . 2 . 3]" 1 1257 1 64 ASN H 1 68 LEU QD 6.750 . 7.425 4.050 3.918 4.195 . 0 0 "[ . 1 . 2 . 3]" 1 1258 1 64 ASN HA 1 64 ASN HD21 4.600 . 5.100 4.355 4.257 4.459 . 0 0 "[ . 1 . 2 . 3]" 1 1259 1 64 ASN HA 1 64 ASN HD22 5.100 . 5.600 5.155 5.127 5.174 . 0 0 "[ . 1 . 2 . 3]" 1 1260 1 64 ASN HA 1 65 ARG HA 5.000 . 5.500 4.854 4.736 4.967 . 0 0 "[ . 1 . 2 . 3]" 1 1261 1 64 ASN HA 1 66 GLU H 4.600 . 5.100 3.618 3.426 3.957 . 0 0 "[ . 1 . 2 . 3]" 1 1262 1 64 ASN HA 1 66 GLU QG 5.152 . 5.712 3.530 3.098 4.134 . 0 0 "[ . 1 . 2 . 3]" 1 1263 1 64 ASN HA 1 67 GLU H 4.200 . 4.700 3.233 3.141 3.374 . 0 0 "[ . 1 . 2 . 3]" 1 1264 1 64 ASN HA 1 67 GLU HA 5.500 . 6.000 5.618 5.577 5.660 . 0 0 "[ . 1 . 2 . 3]" 1 1265 1 64 ASN HA 1 67 GLU QB 4.592 . 5.152 3.183 3.023 3.635 . 0 0 "[ . 1 . 2 . 3]" 1 1266 1 64 ASN HA 1 68 LEU H 5.400 . 5.900 4.350 4.278 4.418 . 0 0 "[ . 1 . 2 . 3]" 1 1267 1 64 ASN HA 1 68 LEU QD 6.480 . 7.155 4.697 4.544 4.810 . 0 0 "[ . 1 . 2 . 3]" 1 1268 1 64 ASN HA 1 68 LEU HG 5.000 . 5.500 4.570 4.397 4.759 . 0 0 "[ . 1 . 2 . 3]" 1 1269 1 64 ASN QB 1 65 ARG H 4.704 . 5.264 4.045 3.948 4.104 . 0 0 "[ . 1 . 2 . 3]" 1 1270 1 64 ASN QB 1 65 ARG HA 5.264 . 5.824 4.640 4.232 4.762 . 0 0 "[ . 1 . 2 . 3]" 1 1271 1 64 ASN QB 1 66 GLU H 6.160 . 6.720 4.782 4.652 5.026 . 0 0 "[ . 1 . 2 . 3]" 1 1272 1 64 ASN QB 1 67 GLU H 5.712 . 6.272 3.620 3.475 3.912 . 0 0 "[ . 1 . 2 . 3]" 1 1273 1 64 ASN QB 1 67 GLU QB 5.394 . 6.021 2.335 2.202 2.646 . 0 0 "[ . 1 . 2 . 3]" 1 1274 1 64 ASN QB 1 67 GLU QG 5.645 . 6.272 3.643 2.419 4.015 . 0 0 "[ . 1 . 2 . 3]" 1 1275 1 64 ASN QB 1 68 LEU H 4.592 . 5.152 3.388 3.209 3.471 . 0 0 "[ . 1 . 2 . 3]" 1 1276 1 64 ASN QB 1 68 LEU QD 6.048 . 6.804 3.037 2.684 3.388 . 0 0 "[ . 1 . 2 . 3]" 1 1277 1 64 ASN QB 1 68 LEU HG 5.600 . 6.160 2.610 2.342 2.940 . 0 0 "[ . 1 . 2 . 3]" 1 1278 1 64 ASN HD21 1 65 ARG HA 4.900 . 5.400 4.829 4.522 5.033 . 0 0 "[ . 1 . 2 . 3]" 1 1279 1 64 ASN HD21 1 68 LEU H 5.500 . 6.000 4.727 4.433 5.135 . 0 0 "[ . 1 . 2 . 3]" 1 1280 1 64 ASN HD21 1 68 LEU QB 5.824 . 6.384 4.502 4.192 4.794 . 0 0 "[ . 1 . 2 . 3]" 1 1281 1 64 ASN HD21 1 68 LEU QD 5.670 . 6.345 2.171 1.985 2.366 . 0 0 "[ . 1 . 2 . 3]" 1 1282 1 64 ASN HD22 1 68 LEU QD 7.425 . 8.100 3.259 3.026 3.540 . 0 0 "[ . 1 . 2 . 3]" 1 1283 1 64 ASN HD22 1 68 LEU HG 5.500 . 6.000 4.507 4.252 4.910 . 0 0 "[ . 1 . 2 . 3]" 1 1284 1 65 ARG H 1 65 ARG QG 4.816 . 5.376 2.879 2.470 3.974 . 0 0 "[ . 1 . 2 . 3]" 1 1285 1 65 ARG H 1 66 GLU H 3.800 . 4.300 3.006 2.912 3.243 . 0 0 "[ . 1 . 2 . 3]" 1 1286 1 65 ARG H 1 66 GLU HA 5.500 . 6.000 5.584 5.541 5.680 . 0 0 "[ . 1 . 2 . 3]" 1 1287 1 65 ARG H 1 67 GLU H 5.100 . 5.600 4.301 4.244 4.365 . 0 0 "[ . 1 . 2 . 3]" 1 1288 1 65 ARG H 1 68 LEU H 5.000 . 5.500 4.646 4.590 4.734 . 0 0 "[ . 1 . 2 . 3]" 1 1289 1 65 ARG H 1 68 LEU QD 5.535 . 6.210 4.013 3.816 4.124 . 0 0 "[ . 1 . 2 . 3]" 1 1290 1 65 ARG H 1 68 LEU HG 5.500 . 6.000 4.587 4.263 4.870 . 0 0 "[ . 1 . 2 . 3]" 1 1291 1 65 ARG H 1 70 PHE QB 5.824 . 6.384 5.201 5.042 5.254 . 0 0 "[ . 1 . 2 . 3]" 1 1292 1 65 ARG H 1 97 LEU QD 7.425 . 8.100 4.324 3.945 4.660 . 0 0 "[ . 1 . 2 . 3]" 1 1293 1 65 ARG HA 1 67 GLU H 5.200 . 5.700 4.231 3.971 4.434 . 0 0 "[ . 1 . 2 . 3]" 1 1294 1 65 ARG HA 1 68 LEU H 4.400 . 4.900 3.397 3.063 3.794 . 0 0 "[ . 1 . 2 . 3]" 1 1295 1 65 ARG HA 1 68 LEU QB 5.488 . 6.048 2.416 2.232 2.978 . 0 0 "[ . 1 . 2 . 3]" 1 1296 1 65 ARG HA 1 68 LEU QD 4.860 . 5.535 2.745 2.395 3.048 . 0 0 "[ . 1 . 2 . 3]" 1 1297 1 65 ARG HA 1 68 LEU HG 4.200 . 4.700 3.490 3.013 3.820 . 0 0 "[ . 1 . 2 . 3]" 1 1298 1 65 ARG HA 1 69 GLY H 5.200 . 5.700 4.150 3.965 4.697 . 0 0 "[ . 1 . 2 . 3]" 1 1299 1 65 ARG HA 1 70 PHE H 4.400 . 4.900 3.811 3.723 4.035 . 0 0 "[ . 1 . 2 . 3]" 1 1300 1 65 ARG HA 1 70 PHE QB 5.488 . 6.048 3.430 3.115 3.595 . 0 0 "[ . 1 . 2 . 3]" 1 1301 1 65 ARG HA 1 70 PHE QD 6.160 . 6.720 2.397 2.253 2.678 . 0 0 "[ . 1 . 2 . 3]" 1 1302 1 65 ARG HA 1 97 LEU QD 7.290 . 7.965 3.782 3.026 4.248 . 0 0 "[ . 1 . 2 . 3]" 1 1303 1 65 ARG QB 1 66 GLU H 4.592 . 5.152 3.388 2.325 3.650 . 0 0 "[ . 1 . 2 . 3]" 1 1304 1 65 ARG QB 1 70 PHE QB 6.397 . 7.025 2.354 2.073 3.649 . 0 0 "[ . 1 . 2 . 3]" 1 1305 1 65 ARG QB 1 70 PHE QD 6.899 . 7.526 2.923 2.357 4.226 . 0 0 "[ . 1 . 2 . 3]" 1 1306 1 65 ARG QD 1 66 GLU H 5.500 . 6.000 3.881 1.984 4.334 . 0 0 "[ . 1 . 2 . 3]" 1 1307 1 65 ARG QD 1 66 GLU QB 5.770 . 6.397 4.362 2.873 4.639 . 0 0 "[ . 1 . 2 . 3]" 1 1308 1 65 ARG QD 1 66 GLU QG 6.160 . 6.720 4.682 2.917 4.935 . 0 0 "[ . 1 . 2 . 3]" 1 1309 1 65 ARG QD 1 70 PHE QD 6.648 . 6.720 4.746 4.427 4.983 . 0 0 "[ . 1 . 2 . 3]" 1 1310 1 65 ARG QD 1 97 LEU QD 7.106 . 7.862 2.276 1.940 3.782 . 0 0 "[ . 1 . 2 . 3]" 1 1311 1 65 ARG QG 1 66 GLU H 5.152 . 5.712 2.360 1.986 3.210 . 0 0 "[ . 1 . 2 . 3]" 1 1312 1 65 ARG QG 1 69 GLY H . . 6.000 4.973 4.906 5.008 . 0 0 "[ . 1 . 2 . 3]" 1 1313 1 65 ARG QG 1 70 PHE H 6.160 . 6.720 4.143 3.618 4.416 . 0 0 "[ . 1 . 2 . 3]" 1 1314 1 65 ARG QG 1 70 PHE QB 5.394 . 6.021 2.748 1.871 3.352 . 0 0 "[ . 1 . 2 . 3]" 1 1315 1 65 ARG QG 1 70 PHE QD 6.523 . 7.150 4.103 3.144 4.527 . 0 0 "[ . 1 . 2 . 3]" 1 1316 1 66 GLU H 1 66 GLU QB 3.472 . 4.032 2.625 2.548 2.702 . 0 0 "[ . 1 . 2 . 3]" 1 1317 1 66 GLU H 1 66 GLU QG 4.032 . 4.592 1.981 1.857 2.922 . 0 0 "[ . 1 . 2 . 3]" 1 1318 1 66 GLU H 1 68 LEU QD 7.425 . 8.100 5.190 5.047 5.373 . 0 0 "[ . 1 . 2 . 3]" 1 1319 1 66 GLU H 1 69 GLY H 4.800 . 5.300 4.529 4.421 4.834 . 0 0 "[ . 1 . 2 . 3]" 1 1320 1 66 GLU H 1 70 PHE H 5.500 . 6.000 4.897 4.801 5.038 . 0 0 "[ . 1 . 2 . 3]" 1 1321 1 66 GLU HA 1 69 GLY H 3.600 . 4.100 3.157 2.923 3.517 . 0 0 "[ . 1 . 2 . 3]" 1 1322 1 66 GLU HA 1 70 PHE H 4.500 . 5.000 3.464 3.144 3.742 . 0 0 "[ . 1 . 2 . 3]" 1 1323 1 66 GLU QG 1 67 GLU H 3.808 . 4.368 2.632 2.422 2.943 . 0 0 "[ . 1 . 2 . 3]" 1 1324 1 66 GLU QG 1 67 GLU QB 4.892 . 5.519 3.434 3.067 3.984 . 0 0 "[ . 1 . 2 . 3]" 1 1325 1 66 GLU QG 1 69 GLY H 6.160 . 6.720 5.171 5.033 5.342 . 0 0 "[ . 1 . 2 . 3]" 1 1326 1 67 GLU H 1 67 GLU QB 3.248 . 3.808 2.316 2.265 2.621 . 0 0 "[ . 1 . 2 . 3]" 1 1327 1 67 GLU H 1 68 LEU H 3.600 . 4.100 2.358 2.293 2.456 . 0 0 "[ . 1 . 2 . 3]" 1 1328 1 67 GLU H 1 68 LEU HA 5.300 . 5.800 5.075 4.995 5.168 . 0 0 "[ . 1 . 2 . 3]" 1 1329 1 67 GLU H 1 68 LEU QB 5.936 . 6.496 4.365 4.254 4.479 . 0 0 "[ . 1 . 2 . 3]" 1 1330 1 67 GLU H 1 68 LEU QD 7.290 . 7.965 4.549 4.264 4.719 . 0 0 "[ . 1 . 2 . 3]" 1 1331 1 67 GLU H 1 68 LEU HG 4.700 . 5.200 4.177 3.979 4.402 . 0 0 "[ . 1 . 2 . 3]" 1 1332 1 67 GLU H 1 69 GLY H 4.600 . 5.100 3.678 3.571 3.808 . 0 0 "[ . 1 . 2 . 3]" 1 1333 1 67 GLU H 1 70 PHE H 5.500 . 6.000 5.201 5.054 5.384 . 0 0 "[ . 1 . 2 . 3]" 1 1334 1 67 GLU QB 1 68 LEU H 4.256 . 4.816 2.649 2.482 2.734 . 0 0 "[ . 1 . 2 . 3]" 1 1335 1 67 GLU QB 1 68 LEU QD 8.014 . 8.770 3.615 2.793 4.016 . 0 0 "[ . 1 . 2 . 3]" 1 1336 1 67 GLU QB 1 68 LEU HG 5.264 . 5.824 3.459 3.199 3.659 . 0 0 "[ . 1 . 2 . 3]" 1 1337 1 67 GLU QG 1 68 LEU H 4.704 . 5.264 3.815 3.748 3.898 . 0 0 "[ . 1 . 2 . 3]" 1 1338 1 67 GLU QG 1 68 LEU QD 6.502 . 7.258 3.667 3.129 4.351 . 0 0 "[ . 1 . 2 . 3]" 1 1339 1 67 GLU QG 1 68 LEU HG 5.152 . 5.712 4.512 4.272 4.648 . 0 0 "[ . 1 . 2 . 3]" 1 1340 1 68 LEU H 1 68 LEU QD 4.725 . 5.400 3.056 2.813 3.170 . 0 0 "[ . 1 . 2 . 3]" 1 1341 1 68 LEU H 1 68 LEU HG 3.500 . 4.000 2.312 2.250 2.375 . 0 0 "[ . 1 . 2 . 3]" 1 1342 1 68 LEU H 1 69 GLY QA 5.936 . 6.496 4.586 4.530 4.616 . 0 0 "[ . 1 . 2 . 3]" 1 1343 1 68 LEU H 1 70 PHE H 4.600 . 5.100 4.338 4.082 4.425 . 0 0 "[ . 1 . 2 . 3]" 1 1344 1 68 LEU H 1 70 PHE QB 6.160 . 6.720 5.384 5.017 5.486 . 0 0 "[ . 1 . 2 . 3]" 1 1345 1 68 LEU HA 1 68 LEU QD 4.050 . 4.725 2.141 2.110 2.209 . 0 0 "[ . 1 . 2 . 3]" 1 1346 1 68 LEU QB 1 69 GLY H 4.928 . 5.488 3.023 2.783 3.267 . 0 0 "[ . 1 . 2 . 3]" 1 1347 1 68 LEU QB 1 70 PHE H 5.040 . 5.600 3.354 3.082 3.594 . 0 0 "[ . 1 . 2 . 3]" 1 1348 1 68 LEU QD 1 69 GLY H 7.020 . 7.695 4.343 4.259 4.434 . 0 0 "[ . 1 . 2 . 3]" 1 1349 1 68 LEU QD 1 70 PHE H 7.020 . 7.695 4.815 4.587 5.046 . 0 0 "[ . 1 . 2 . 3]" 1 1350 1 69 GLY H 1 70 PHE H 3.300 . 3.800 2.327 2.158 2.517 . 0 0 "[ . 1 . 2 . 3]" 1 1351 1 69 GLY H 1 70 PHE QB 5.376 . 5.936 4.178 4.014 4.352 . 0 0 "[ . 1 . 2 . 3]" 1 1352 1 70 PHE H 1 70 PHE QD 5.152 . 5.712 2.450 2.303 2.690 . 0 0 "[ . 1 . 2 . 3]" 1 1353 1 70 PHE H 1 71 ARG H 5.100 . 5.600 4.602 4.488 4.649 . 0 0 "[ . 1 . 2 . 3]" 1 1354 1 70 PHE H 1 97 LEU QD 7.425 . 8.100 4.736 4.503 4.964 . 0 0 "[ . 1 . 2 . 3]" 1 1355 1 70 PHE HA 1 70 PHE QE 5.936 . 6.496 4.646 4.575 4.754 . 0 0 "[ . 1 . 2 . 3]" 1 1356 1 70 PHE HA 1 71 ARG H 3.400 . 3.900 2.139 2.093 2.228 . 0 0 "[ . 1 . 2 . 3]" 1 1357 1 70 PHE HA 1 74 TYR QE 4.480 . 5.040 3.028 2.162 4.100 . 0 0 "[ . 1 . 2 . 3]" 1 1358 1 70 PHE QB 1 71 ARG H 4.928 . 5.488 2.996 2.672 3.426 . 0 0 "[ . 1 . 2 . 3]" 1 1359 1 70 PHE QD 1 76 ALA H 6.160 . 6.720 4.143 3.646 5.421 . 0 0 "[ . 1 . 2 . 3]" 1 1360 1 70 PHE QD 1 76 ALA MB 7.392 . 8.064 4.914 4.554 5.506 . 0 0 "[ . 1 . 2 . 3]" 1 1361 1 70 PHE QD 1 79 LEU QD 7.409 . 8.165 4.599 3.902 4.737 . 0 0 "[ . 1 . 2 . 3]" 1 1362 1 70 PHE QD 1 97 LEU QB 6.899 . 7.526 4.942 4.007 5.247 . 0 0 "[ . 1 . 2 . 3]" 1 1363 1 70 PHE QD 1 97 LEU QD 6.653 . 7.409 2.693 2.389 2.902 . 0 0 "[ . 1 . 2 . 3]" 1 1364 1 70 PHE QE 1 75 SER H 6.160 . 6.720 5.503 5.292 5.555 . 0 0 "[ . 1 . 2 . 3]" 1 1365 1 70 PHE QE 1 75 SER HA 5.040 . 5.600 3.453 3.044 4.525 . 0 0 "[ . 1 . 2 . 3]" 1 1366 1 70 PHE QE 1 76 ALA H 5.600 . 6.160 3.596 3.196 4.435 . 0 0 "[ . 1 . 2 . 3]" 1 1367 1 70 PHE QE 1 76 ALA HA 5.040 . 5.600 2.629 2.145 3.115 . 0 0 "[ . 1 . 2 . 3]" 1 1368 1 70 PHE QE 1 76 ALA MB 6.317 . 6.989 3.755 3.427 4.199 . 0 0 "[ . 1 . 2 . 3]" 1 1369 1 70 PHE QE 1 77 SER H 6.160 . 6.720 5.162 4.766 5.498 . 0 0 "[ . 1 . 2 . 3]" 1 1370 1 70 PHE QE 1 78 GLN H 6.160 . 6.720 4.574 3.757 4.971 . 0 0 "[ . 1 . 2 . 3]" 1 1371 1 70 PHE QE 1 79 LEU H 6.160 . 6.720 5.246 4.631 5.560 . 0 0 "[ . 1 . 2 . 3]" 1 1372 1 70 PHE QE 1 79 LEU QD 6.804 . 7.560 2.994 2.002 3.136 . 0 0 "[ . 1 . 2 . 3]" 1 1373 1 70 PHE QE 1 79 LEU HG 6.048 . 6.608 3.309 2.955 4.157 . 0 0 "[ . 1 . 2 . 3]" 1 1374 1 70 PHE QE 1 97 LEU QD 6.502 . 7.258 3.020 2.677 3.257 . 0 0 "[ . 1 . 2 . 3]" 1 1375 1 71 ARG H 1 71 ARG QD 4.816 . 5.376 4.244 3.197 4.374 . 0 0 "[ . 1 . 2 . 3]" 1 1376 1 71 ARG H 1 72 PRO QD 6.160 . 6.720 4.406 4.346 4.474 . 0 0 "[ . 1 . 2 . 3]" 1 1377 1 71 ARG H 1 73 GLU H 5.500 . 6.000 4.785 4.560 4.969 . 0 0 "[ . 1 . 2 . 3]" 1 1378 1 71 ARG H 1 73 GLU QG 5.712 . 6.272 4.540 4.266 5.183 . 0 0 "[ . 1 . 2 . 3]" 1 1379 1 71 ARG H 1 74 TYR H 4.900 . 5.400 3.609 3.188 3.872 . 0 0 "[ . 1 . 2 . 3]" 1 1380 1 71 ARG H 1 74 TYR QD 4.928 . 5.488 2.123 1.946 2.453 . 0 0 "[ . 1 . 2 . 3]" 1 1381 1 71 ARG H 1 74 TYR QE 4.816 . 5.376 2.508 2.087 4.031 . 0 0 "[ . 1 . 2 . 3]" 1 1382 1 71 ARG HA 1 72 PRO QB 5.712 . 6.272 4.873 4.706 4.983 . 0 0 "[ . 1 . 2 . 3]" 1 1383 1 71 ARG HA 1 72 PRO QD 4.032 . 4.592 2.096 2.009 2.255 . 0 0 "[ . 1 . 2 . 3]" 1 1384 1 71 ARG HA 1 72 PRO QG 5.040 . 5.600 3.943 3.821 4.180 . 0 0 "[ . 1 . 2 . 3]" 1 1385 1 71 ARG HA 1 73 GLU H 4.900 . 5.400 4.469 4.283 4.692 . 0 0 "[ . 1 . 2 . 3]" 1 1386 1 71 ARG HA 1 74 TYR H 5.500 . 6.000 4.930 4.696 5.096 . 0 0 "[ . 1 . 2 . 3]" 1 1387 1 71 ARG HA 1 74 TYR QE 6.160 . 6.720 4.473 4.311 5.251 . 0 0 "[ . 1 . 2 . 3]" 1 1388 1 71 ARG QB 1 72 PRO QD 5.645 . 6.272 2.237 2.060 2.378 . 0 0 "[ . 1 . 2 . 3]" 1 1389 1 71 ARG QB 1 73 GLU H 4.816 . 5.376 2.864 2.476 3.201 . 0 0 "[ . 1 . 2 . 3]" 1 1390 1 71 ARG QB 1 74 TYR H 5.488 . 6.048 3.537 3.044 3.917 . 0 0 "[ . 1 . 2 . 3]" 1 1391 1 71 ARG QB 1 74 TYR QD 6.523 . 7.150 3.344 2.875 3.802 . 0 0 "[ . 1 . 2 . 3]" 1 1392 1 71 ARG QB 1 74 TYR QE 6.899 . 7.526 2.594 2.292 3.043 . 0 0 "[ . 1 . 2 . 3]" 1 1393 1 71 ARG QD 1 72 PRO QD 6.272 . 6.899 4.110 2.888 4.741 . 0 0 "[ . 1 . 2 . 3]" 1 1394 1 71 ARG QD 1 73 GLU H 6.160 . 6.720 5.022 3.957 5.534 . 0 0 "[ . 1 . 2 . 3]" 1 1395 1 71 ARG QD 1 74 TYR QE 6.774 . 7.401 3.148 2.229 4.574 . 0 0 "[ . 1 . 2 . 3]" 1 1396 1 71 ARG QG 1 72 PRO QD 6.021 . 6.648 3.361 3.004 4.007 . 0 0 "[ . 1 . 2 . 3]" 1 1397 1 71 ARG QG 1 74 TYR QE 5.770 . 6.397 2.852 2.270 4.148 . 0 0 "[ . 1 . 2 . 3]" 1 1398 1 72 PRO HA 1 74 TYR H 4.800 . 5.300 3.795 3.615 3.960 . 0 0 "[ . 1 . 2 . 3]" 1 1399 1 72 PRO HA 1 99 GLY QA 4.704 . 5.264 2.590 2.134 3.900 . 0 0 "[ . 1 . 2 . 3]" 1 1400 1 72 PRO HA 1 100 VAL QG 6.345 . 7.020 4.143 3.517 4.765 . 0 0 "[ . 1 . 2 . 3]" 1 1401 1 72 PRO QB 1 73 GLU H 4.704 . 5.264 2.922 2.684 3.430 . 0 0 "[ . 1 . 2 . 3]" 1 1402 1 72 PRO QB 1 99 GLY QA 5.394 . 6.021 3.014 2.296 4.332 . 0 0 "[ . 1 . 2 . 3]" 1 1403 1 72 PRO QB 1 100 VAL H 6.160 . 6.720 3.415 3.003 4.185 . 0 0 "[ . 1 . 2 . 3]" 1 1404 1 72 PRO QB 1 100 VAL HA 5.600 . 6.160 4.191 2.255 5.112 . 0 0 "[ . 1 . 2 . 3]" 1 1405 1 72 PRO QB 1 100 VAL QG 6.502 . 7.258 2.861 2.091 4.362 . 0 0 "[ . 1 . 2 . 3]" 1 1406 1 72 PRO QD 1 73 GLU H 4.928 . 5.488 2.940 2.830 3.075 . 0 0 "[ . 1 . 2 . 3]" 1 1407 1 72 PRO QD 1 74 TYR QE 6.899 . 7.526 5.501 5.326 5.580 . 0 0 "[ . 1 . 2 . 3]" 1 1408 1 72 PRO QG 1 73 GLU H 4.704 . 5.264 4.054 2.651 4.220 . 0 0 "[ . 1 . 2 . 3]" 1 1409 1 73 GLU H 1 73 GLU QG 4.144 . 4.704 2.120 1.831 2.664 . 0 0 "[ . 1 . 2 . 3]" 1 1410 1 73 GLU H 1 74 TYR H 3.500 . 4.000 2.724 2.363 2.841 . 0 0 "[ . 1 . 2 . 3]" 1 1411 1 73 GLU H 1 74 TYR QD 6.048 . 6.608 4.770 4.555 4.940 . 0 0 "[ . 1 . 2 . 3]" 1 1412 1 73 GLU H 1 74 TYR QE 6.160 . 6.720 5.304 5.008 5.448 . 0 0 "[ . 1 . 2 . 3]" 1 1413 1 73 GLU H 1 75 SER H 5.500 . 6.000 5.092 4.753 5.701 . 0 0 "[ . 1 . 2 . 3]" 1 1414 1 73 GLU H 1 99 GLY QA 6.160 . 6.720 4.900 4.721 5.318 . 0 0 "[ . 1 . 2 . 3]" 1 1415 1 73 GLU H 1 100 VAL H 5.000 . 5.500 4.750 4.382 5.072 . 0 0 "[ . 1 . 2 . 3]" 1 1416 1 73 GLU H 1 100 VAL QG 6.615 . 7.290 3.805 3.339 4.598 . 0 0 "[ . 1 . 2 . 3]" 1 1417 1 73 GLU HA 1 74 TYR HA 4.600 . 5.100 4.503 4.444 4.627 . 0 0 "[ . 1 . 2 . 3]" 1 1418 1 73 GLU HA 1 99 GLY QA 5.712 . 6.272 4.465 3.600 4.957 . 0 0 "[ . 1 . 2 . 3]" 1 1419 1 73 GLU HA 1 100 VAL H 3.400 . 3.900 3.395 3.082 3.505 . 0 0 "[ . 1 . 2 . 3]" 1 1420 1 73 GLU HA 1 100 VAL QG 4.995 . 5.670 2.521 2.085 3.325 . 0 0 "[ . 1 . 2 . 3]" 1 1421 1 73 GLU QB 1 100 VAL H 6.160 . 6.720 4.992 4.599 5.346 . 0 0 "[ . 1 . 2 . 3]" 1 1422 1 73 GLU QB 1 100 VAL QG 8.316 . 9.072 3.269 2.718 4.030 . 0 0 "[ . 1 . 2 . 3]" 1 1423 1 73 GLU QG 1 74 TYR H 5.712 . 6.272 2.974 2.627 4.006 . 0 0 "[ . 1 . 2 . 3]" 1 1424 1 73 GLU QG 1 74 TYR QD 5.896 . 6.523 2.999 2.291 4.644 . 0 0 "[ . 1 . 2 . 3]" 1 1425 1 73 GLU QG 1 74 TYR QE 6.147 . 6.774 3.337 2.667 4.313 . 0 0 "[ . 1 . 2 . 3]" 1 1426 1 74 TYR H 1 74 TYR QD 4.704 . 5.264 2.968 2.600 3.486 . 0 0 "[ . 1 . 2 . 3]" 1 1427 1 74 TYR H 1 75 SER H 4.300 . 4.800 2.931 2.568 3.812 . 0 0 "[ . 1 . 2 . 3]" 1 1428 1 74 TYR H 1 75 SER QB 6.160 . 6.720 4.555 3.731 5.273 . 0 0 "[ . 1 . 2 . 3]" 1 1429 1 74 TYR H 1 99 GLY QA 5.936 . 6.496 4.483 4.020 5.223 . 0 0 "[ . 1 . 2 . 3]" 1 1430 1 74 TYR H 1 100 VAL H 5.400 . 5.900 4.920 4.453 5.353 . 0 0 "[ . 1 . 2 . 3]" 1 1431 1 74 TYR H 1 100 VAL QG 6.480 . 7.155 4.601 3.350 4.860 . 0 0 "[ . 1 . 2 . 3]" 1 1432 1 74 TYR HA 1 75 SER H 3.400 . 3.900 2.439 2.026 2.757 . 0 0 "[ . 1 . 2 . 3]" 1 1433 1 74 TYR HA 1 75 SER HA 4.700 . 5.200 4.608 4.466 4.703 . 0 0 "[ . 1 . 2 . 3]" 1 1434 1 74 TYR HA 1 75 SER QB 5.712 . 6.272 4.467 3.772 4.773 . 0 0 "[ . 1 . 2 . 3]" 1 1435 1 74 TYR HA 1 78 GLN H 5.500 . 6.000 4.465 3.905 5.224 . 0 0 "[ . 1 . 2 . 3]" 1 1436 1 74 TYR QB 1 75 SER H 5.152 . 5.712 3.946 3.634 4.103 . 0 0 "[ . 1 . 2 . 3]" 1 1437 1 74 TYR QD 1 75 SER H 4.928 . 5.488 4.434 4.307 4.553 . 0 0 "[ . 1 . 2 . 3]" 1 1438 1 75 SER H 1 76 ALA H 4.500 . 5.000 4.512 4.387 4.597 . 0 0 "[ . 1 . 2 . 3]" 1 1439 1 75 SER H 1 77 SER H 5.000 . 5.500 4.449 4.201 4.754 . 0 0 "[ . 1 . 2 . 3]" 1 1440 1 75 SER H 1 77 SER QB 6.160 . 6.720 5.020 4.188 5.540 . 0 0 "[ . 1 . 2 . 3]" 1 1441 1 75 SER H 1 78 GLN H 4.700 . 5.200 4.538 3.951 4.750 . 0 0 "[ . 1 . 2 . 3]" 1 1442 1 75 SER H 1 78 GLN QB 6.160 . 6.720 4.257 3.439 4.672 . 0 0 "[ . 1 . 2 . 3]" 1 1443 1 75 SER H 1 99 GLY H 4.800 . 5.300 4.871 4.522 4.952 . 0 0 "[ . 1 . 2 . 3]" 1 1444 1 75 SER H 1 99 GLY QA 6.160 . 6.720 3.187 2.593 4.352 . 0 0 "[ . 1 . 2 . 3]" 1 1445 1 75 SER H 1 100 VAL QG 7.425 . 8.100 4.770 1.916 5.420 . 0 0 "[ . 1 . 2 . 3]" 1 1446 1 75 SER HA 1 76 ALA H 3.200 . 3.700 2.684 2.362 2.983 . 0 0 "[ . 1 . 2 . 3]" 1 1447 1 75 SER HA 1 76 ALA MB 5.400 . 6.000 4.332 4.131 4.508 . 0 0 "[ . 1 . 2 . 3]" 1 1448 1 75 SER HA 1 77 SER H 4.700 . 5.200 4.457 4.039 4.706 . 0 0 "[ . 1 . 2 . 3]" 1 1449 1 75 SER HA 1 99 GLY QA 5.488 . 6.048 4.258 2.831 4.904 . 0 0 "[ . 1 . 2 . 3]" 1 1450 1 75 SER QB 1 76 ALA H 4.480 . 5.040 2.163 1.848 3.171 . 0 0 "[ . 1 . 2 . 3]" 1 1451 1 75 SER QB 1 77 SER H 4.592 . 5.152 3.142 2.329 3.684 . 0 0 "[ . 1 . 2 . 3]" 1 1452 1 75 SER QB 1 78 GLN H 5.600 . 6.160 4.554 3.516 4.992 . 0 0 "[ . 1 . 2 . 3]" 1 1453 1 75 SER QB 1 98 PRO HA 5.040 . 5.600 3.252 2.780 4.292 . 0 0 "[ . 1 . 2 . 3]" 1 1454 1 75 SER QB 1 99 GLY H 3.696 . 4.256 2.788 2.439 3.021 . 0 0 "[ . 1 . 2 . 3]" 1 1455 1 75 SER QB 1 99 GLY QA 5.268 . 5.896 2.248 2.040 3.611 . 0 0 "[ . 1 . 2 . 3]" 1 1456 1 76 ALA H 1 77 SER H 3.900 . 4.400 3.021 2.755 3.309 . 0 0 "[ . 1 . 2 . 3]" 1 1457 1 76 ALA H 1 78 GLN H 5.400 . 5.900 4.493 4.322 4.648 . 0 0 "[ . 1 . 2 . 3]" 1 1458 1 76 ALA H 1 79 LEU QD 6.615 . 7.290 4.364 3.843 4.844 . 0 0 "[ . 1 . 2 . 3]" 1 1459 1 76 ALA H 1 94 LYS HA 4.900 . 5.400 4.073 3.005 4.704 . 0 0 "[ . 1 . 2 . 3]" 1 1460 1 76 ALA H 1 97 LEU QD 5.940 . 6.615 3.132 2.147 3.905 . 0 0 "[ . 1 . 2 . 3]" 1 1461 1 76 ALA HA 1 77 SER HA 4.800 . 5.300 4.847 4.813 4.883 . 0 0 "[ . 1 . 2 . 3]" 1 1462 1 76 ALA HA 1 78 GLN H 4.800 . 5.300 3.646 3.458 3.864 . 0 0 "[ . 1 . 2 . 3]" 1 1463 1 76 ALA HA 1 79 LEU H 4.400 . 4.900 3.926 3.697 4.412 . 0 0 "[ . 1 . 2 . 3]" 1 1464 1 76 ALA HA 1 79 LEU QB 5.488 . 6.048 3.975 3.752 4.393 . 0 0 "[ . 1 . 2 . 3]" 1 1465 1 76 ALA HA 1 79 LEU QD 4.860 . 5.535 2.302 1.960 2.699 . 0 0 "[ . 1 . 2 . 3]" 1 1466 1 76 ALA HA 1 79 LEU HG 4.300 . 4.800 2.763 2.417 4.357 . 0 0 "[ . 1 . 2 . 3]" 1 1467 1 76 ALA HA 1 97 LEU QD 5.940 . 6.615 3.794 3.027 4.220 . 0 0 "[ . 1 . 2 . 3]" 1 1468 1 76 ALA MB 1 77 SER H 4.440 . 5.040 3.006 2.903 3.163 . 0 0 "[ . 1 . 2 . 3]" 1 1469 1 76 ALA MB 1 77 SER HA 5.760 . 6.360 4.071 3.966 4.173 . 0 0 "[ . 1 . 2 . 3]" 1 1470 1 76 ALA MB 1 77 SER QB 6.989 . 7.661 4.503 4.064 4.792 . 0 0 "[ . 1 . 2 . 3]" 1 1471 1 76 ALA MB 1 78 GLN H 6.000 . 6.600 4.438 4.332 4.607 . 0 0 "[ . 1 . 2 . 3]" 1 1472 1 76 ALA MB 1 79 LEU H 6.600 . 7.200 4.674 4.473 5.149 . 0 0 "[ . 1 . 2 . 3]" 1 1473 1 76 ALA MB 1 79 LEU QD 5.832 . 6.642 2.387 2.184 2.799 . 0 0 "[ . 1 . 2 . 3]" 1 1474 1 76 ALA MB 1 82 PHE QB 7.258 . 7.930 4.619 4.145 5.005 . 0 0 "[ . 1 . 2 . 3]" 1 1475 1 76 ALA MB 1 82 PHE QD 5.914 . 6.586 3.446 2.900 3.929 . 0 0 "[ . 1 . 2 . 3]" 1 1476 1 76 ALA MB 1 82 PHE QE 5.779 . 6.451 3.224 2.504 3.712 . 0 0 "[ . 1 . 2 . 3]" 1 1477 1 76 ALA MB 1 93 LEU H 5.880 . 6.480 4.817 4.503 4.974 . 0 0 "[ . 1 . 2 . 3]" 1 1478 1 76 ALA MB 1 93 LEU HA 5.160 . 5.760 3.810 3.685 3.922 . 0 0 "[ . 1 . 2 . 3]" 1 1479 1 76 ALA MB 1 93 LEU QB 5.107 . 5.779 2.120 2.026 2.204 . 0 0 "[ . 1 . 2 . 3]" 1 1480 1 76 ALA MB 1 93 LEU QD 6.804 . 7.614 2.901 2.766 3.072 . 0 0 "[ . 1 . 2 . 3]" 1 1481 1 76 ALA MB 1 93 LEU HG 6.600 . 7.200 4.635 3.497 4.851 . 0 0 "[ . 1 . 2 . 3]" 1 1482 1 76 ALA MB 1 94 LYS H 5.400 . 6.000 3.614 3.233 3.871 . 0 0 "[ . 1 . 2 . 3]" 1 1483 1 76 ALA MB 1 94 LYS HA 3.960 . 4.560 2.755 2.417 3.017 . 0 0 "[ . 1 . 2 . 3]" 1 1484 1 76 ALA MB 1 94 LYS QB 6.720 . 7.392 4.167 3.770 4.517 . 0 0 "[ . 1 . 2 . 3]" 1 1485 1 76 ALA MB 1 94 LYS QE 7.392 . 8.064 5.146 4.384 5.510 . 0 0 "[ . 1 . 2 . 3]" 1 1486 1 76 ALA MB 1 94 LYS QG 4.838 . 5.510 2.854 2.235 3.344 . 0 0 "[ . 1 . 2 . 3]" 1 1487 1 76 ALA MB 1 95 LYS H 6.600 . 7.200 5.242 4.979 5.461 . 0 0 "[ . 1 . 2 . 3]" 1 1488 1 76 ALA MB 1 96 GLN H 6.600 . 7.200 5.025 4.822 5.267 . 0 0 "[ . 1 . 2 . 3]" 1 1489 1 76 ALA MB 1 97 LEU H 5.640 . 6.240 3.901 3.600 4.704 . 0 0 "[ . 1 . 2 . 3]" 1 1490 1 76 ALA MB 1 97 LEU QD 6.642 . 7.452 2.853 2.042 3.465 . 0 0 "[ . 1 . 2 . 3]" 1 1491 1 76 ALA MB 1 97 LEU HG 4.680 . 5.280 3.151 2.334 3.924 . 0 0 "[ . 1 . 2 . 3]" 1 1492 1 77 SER H 1 78 GLN H 3.500 . 4.000 2.680 2.648 2.777 . 0 0 "[ . 1 . 2 . 3]" 1 1493 1 77 SER H 1 78 GLN HA 5.200 . 5.700 5.295 5.228 5.344 . 0 0 "[ . 1 . 2 . 3]" 1 1494 1 77 SER H 1 79 LEU H 5.000 . 5.500 4.536 4.371 4.715 . 0 0 "[ . 1 . 2 . 3]" 1 1495 1 77 SER H 1 79 LEU QD 7.425 . 8.100 4.664 3.658 4.875 . 0 0 "[ . 1 . 2 . 3]" 1 1496 1 77 SER H 1 82 PHE QD 6.160 . 6.720 5.224 4.843 5.483 . 0 0 "[ . 1 . 2 . 3]" 1 1497 1 77 SER H 1 82 PHE QE 6.160 . 6.720 4.795 4.378 5.201 . 0 0 "[ . 1 . 2 . 3]" 1 1498 1 77 SER H 1 94 LYS HA 5.400 . 5.900 4.822 4.497 5.107 . 0 0 "[ . 1 . 2 . 3]" 1 1499 1 77 SER H 1 97 LEU QD 7.425 . 8.100 5.320 4.478 5.567 . 0 0 "[ . 1 . 2 . 3]" 1 1500 1 77 SER HA 1 79 LEU H 4.500 . 5.000 3.754 3.383 3.929 . 0 0 "[ . 1 . 2 . 3]" 1 1501 1 77 SER HA 1 79 LEU QD 7.425 . 8.100 4.707 4.068 4.864 . 0 0 "[ . 1 . 2 . 3]" 1 1502 1 77 SER HA 1 82 PHE QB 5.488 . 6.048 3.659 2.949 4.052 . 0 0 "[ . 1 . 2 . 3]" 1 1503 1 77 SER HA 1 82 PHE QD 4.480 . 5.040 3.242 2.915 3.543 . 0 0 "[ . 1 . 2 . 3]" 1 1504 1 77 SER HA 1 82 PHE QE 5.264 . 5.824 3.198 3.034 3.588 . 0 0 "[ . 1 . 2 . 3]" 1 1505 1 77 SER QB 1 78 GLN H 5.488 . 6.048 3.375 2.837 3.915 . 0 0 "[ . 1 . 2 . 3]" 1 1506 1 77 SER QB 1 82 PHE QD 6.147 . 6.774 4.262 3.434 4.749 . 0 0 "[ . 1 . 2 . 3]" 1 1507 1 77 SER QB 1 82 PHE QE 6.272 . 6.899 3.615 2.894 4.486 . 0 0 "[ . 1 . 2 . 3]" 1 1508 1 77 SER QB 1 94 LYS QG 6.648 . 7.276 3.534 2.484 4.452 . 0 0 "[ . 1 . 2 . 3]" 1 1509 1 78 GLN H 1 78 GLN QG 4.368 . 4.928 2.946 2.370 3.807 . 0 0 "[ . 1 . 2 . 3]" 1 1510 1 78 GLN H 1 79 LEU H 3.400 . 3.900 2.767 2.465 2.972 . 0 0 "[ . 1 . 2 . 3]" 1 1511 1 78 GLN H 1 79 LEU HA 5.200 . 5.700 5.063 4.796 5.235 . 0 0 "[ . 1 . 2 . 3]" 1 1512 1 78 GLN H 1 79 LEU QB 6.160 . 6.720 4.637 4.360 4.809 . 0 0 "[ . 1 . 2 . 3]" 1 1513 1 78 GLN H 1 79 LEU QD 7.425 . 8.100 4.351 2.556 4.539 . 0 0 "[ . 1 . 2 . 3]" 1 1514 1 78 GLN H 1 79 LEU HG 5.500 . 6.000 4.226 3.849 5.405 . 0 0 "[ . 1 . 2 . 3]" 1 1515 1 78 GLN H 1 82 PHE QB 6.160 . 6.720 5.026 4.672 5.347 . 0 0 "[ . 1 . 2 . 3]" 1 1516 1 78 GLN QB 1 79 LEU H 5.376 . 5.936 3.817 3.635 3.880 . 0 0 "[ . 1 . 2 . 3]" 1 1517 1 78 GLN QB 1 79 LEU HA 5.040 . 5.600 4.531 4.367 4.603 . 0 0 "[ . 1 . 2 . 3]" 1 1518 1 79 LEU H 1 79 LEU HG 4.100 . 4.600 2.976 2.876 4.121 . 0 0 "[ . 1 . 2 . 3]" 1 1519 1 79 LEU H 1 80 LYS H 4.600 . 5.100 4.576 4.522 4.623 . 0 0 "[ . 1 . 2 . 3]" 1 1520 1 79 LEU H 1 82 PHE H 5.000 . 5.500 4.694 4.442 4.995 . 0 0 "[ . 1 . 2 . 3]" 1 1521 1 79 LEU H 1 82 PHE QB 5.376 . 5.936 3.073 2.764 3.388 . 0 0 "[ . 1 . 2 . 3]" 1 1522 1 79 LEU H 1 82 PHE QD 6.160 . 6.720 4.343 4.121 4.567 . 0 0 "[ . 1 . 2 . 3]" 1 1523 1 79 LEU HA 1 80 LYS H 3.300 . 3.800 2.199 2.150 2.235 . 0 0 "[ . 1 . 2 . 3]" 1 1524 1 79 LEU HA 1 80 LYS QG 4.256 . 4.816 3.895 3.852 3.931 . 0 0 "[ . 1 . 2 . 3]" 1 1525 1 79 LEU QB 1 80 LYS H 5.040 . 5.600 3.085 2.865 3.180 . 0 0 "[ . 1 . 2 . 3]" 1 1526 1 79 LEU QB 1 82 PHE H 5.376 . 5.936 3.588 3.381 3.749 . 0 0 "[ . 1 . 2 . 3]" 1 1527 1 79 LEU QB 1 82 PHE QB 6.147 . 6.774 2.148 2.077 2.288 . 0 0 "[ . 1 . 2 . 3]" 1 1528 1 79 LEU QB 1 82 PHE QD 6.523 . 7.150 3.469 3.292 3.722 . 0 0 "[ . 1 . 2 . 3]" 1 1529 1 79 LEU QD 1 80 LYS H 5.265 . 5.940 3.469 3.345 4.019 . 0 0 "[ . 1 . 2 . 3]" 1 1530 1 79 LEU QD 1 82 PHE H 7.425 . 8.100 4.897 4.680 5.043 . 0 0 "[ . 1 . 2 . 3]" 1 1531 1 79 LEU QD 1 82 PHE QB 8.165 . 8.921 3.277 2.986 3.389 . 0 0 "[ . 1 . 2 . 3]" 1 1532 1 79 LEU QD 1 82 PHE QD 6.199 . 6.955 3.139 2.980 3.671 . 0 0 "[ . 1 . 2 . 3]" 1 1533 1 79 LEU QD 1 97 LEU QD 7.108 . 8.019 3.747 3.212 3.950 . 0 0 "[ . 1 . 2 . 3]" 1 1534 1 80 LYS H 1 80 LYS QE 6.160 . 6.720 3.849 3.415 4.004 . 0 0 "[ . 1 . 2 . 3]" 1 1535 1 80 LYS H 1 81 GLY H 4.600 . 5.100 4.627 4.568 4.668 . 0 0 "[ . 1 . 2 . 3]" 1 1536 1 80 LYS H 1 82 PHE H 5.500 . 6.000 4.708 4.622 4.828 . 0 0 "[ . 1 . 2 . 3]" 1 1537 1 80 LYS HA 1 82 PHE H 4.500 . 5.000 3.682 3.558 3.858 . 0 0 "[ . 1 . 2 . 3]" 1 1538 1 80 LYS HA 1 82 PHE QB 5.712 . 6.272 4.716 4.538 4.932 . 0 0 "[ . 1 . 2 . 3]" 1 1539 1 80 LYS QB 1 81 GLY H 6.160 . 6.720 3.040 2.707 3.292 . 0 0 "[ . 1 . 2 . 3]" 1 1540 1 80 LYS QG 1 81 GLY H 6.160 . 6.720 4.182 4.047 4.293 . 0 0 "[ . 1 . 2 . 3]" 1 1541 1 81 GLY H 1 82 PHE H 4.400 . 4.900 2.898 2.753 3.034 . 0 0 "[ . 1 . 2 . 3]" 1 1542 1 81 GLY H 1 82 PHE QB 6.160 . 6.720 4.466 4.334 4.601 . 0 0 "[ . 1 . 2 . 3]" 1 1543 1 81 GLY H 1 83 SER H 5.500 . 6.000 4.363 4.066 4.753 . 0 0 "[ . 1 . 2 . 3]" 1 1544 1 81 GLY H 1 84 LEU QD 7.425 . 8.100 4.412 3.677 5.346 . 0 0 "[ . 1 . 2 . 3]" 1 1545 1 81 GLY QA 1 83 SER H 6.160 . 6.720 3.776 3.557 3.956 . 0 0 "[ . 1 . 2 . 3]" 1 1546 1 81 GLY QA 1 84 LEU H 5.152 . 5.712 3.297 3.073 3.467 . 0 0 "[ . 1 . 2 . 3]" 1 1547 1 81 GLY QA 1 84 LEU QB 5.770 . 6.397 3.067 2.508 3.276 . 0 0 "[ . 1 . 2 . 3]" 1 1548 1 81 GLY QA 1 84 LEU QD 6.502 . 7.258 2.665 2.350 3.436 . 0 0 "[ . 1 . 2 . 3]" 1 1549 1 82 PHE H 1 82 PHE QD 4.480 . 5.040 4.045 3.927 4.083 . 0 0 "[ . 1 . 2 . 3]" 1 1550 1 82 PHE H 1 83 SER H 3.800 . 4.300 2.820 2.698 2.982 . 0 0 "[ . 1 . 2 . 3]" 1 1551 1 82 PHE H 1 83 SER QB 5.376 . 5.936 4.813 4.670 4.854 . 0 0 "[ . 1 . 2 . 3]" 1 1552 1 82 PHE H 1 84 LEU H 5.000 . 5.500 4.242 4.047 4.361 . 0 0 "[ . 1 . 2 . 3]" 1 1553 1 82 PHE H 1 84 LEU QB 6.048 . 6.608 5.285 4.855 5.409 . 0 0 "[ . 1 . 2 . 3]" 1 1554 1 82 PHE H 1 85 LEU H 5.500 . 6.000 5.508 5.253 5.578 . 0 0 "[ . 1 . 2 . 3]" 1 1555 1 82 PHE H 1 85 LEU QD 7.290 . 7.965 4.365 3.919 4.720 . 0 0 "[ . 1 . 2 . 3]" 1 1556 1 82 PHE HA 1 85 LEU H 4.300 . 4.800 3.810 3.692 3.933 . 0 0 "[ . 1 . 2 . 3]" 1 1557 1 82 PHE HA 1 85 LEU QB 5.712 . 6.272 3.730 3.425 4.059 . 0 0 "[ . 1 . 2 . 3]" 1 1558 1 82 PHE HA 1 85 LEU QD 5.265 . 5.940 2.336 2.130 2.510 . 0 0 "[ . 1 . 2 . 3]" 1 1559 1 82 PHE HA 1 93 LEU QD 7.020 . 7.695 3.888 3.585 4.158 . 0 0 "[ . 1 . 2 . 3]" 1 1560 1 82 PHE QB 1 83 SER H 4.592 . 5.152 2.646 2.491 2.848 . 0 0 "[ . 1 . 2 . 3]" 1 1561 1 82 PHE QB 1 83 SER QB 6.147 . 6.774 4.446 4.119 4.773 . 0 0 "[ . 1 . 2 . 3]" 1 1562 1 82 PHE QB 1 84 LEU H 6.160 . 6.720 4.714 4.570 4.835 . 0 0 "[ . 1 . 2 . 3]" 1 1563 1 82 PHE QB 1 85 LEU QD 8.316 . 9.072 3.664 3.425 3.861 . 0 0 "[ . 1 . 2 . 3]" 1 1564 1 82 PHE QD 1 83 SER H 4.704 . 5.264 2.767 2.626 2.967 . 0 0 "[ . 1 . 2 . 3]" 1 1565 1 82 PHE QD 1 83 SER HA 4.928 . 5.488 3.151 2.850 3.406 . 0 0 "[ . 1 . 2 . 3]" 1 1566 1 82 PHE QD 1 83 SER QB 5.519 . 6.147 3.630 2.980 4.140 . 0 0 "[ . 1 . 2 . 3]" 1 1567 1 82 PHE QD 1 84 LEU H 6.160 . 6.720 5.059 4.906 5.176 . 0 0 "[ . 1 . 2 . 3]" 1 1568 1 82 PHE QD 1 85 LEU H 6.160 . 6.720 5.340 5.222 5.431 . 0 0 "[ . 1 . 2 . 3]" 1 1569 1 82 PHE QD 1 85 LEU QD 6.653 . 7.409 3.265 2.777 3.577 . 0 0 "[ . 1 . 2 . 3]" 1 1570 1 82 PHE QD 1 90 LYS HA 5.488 . 6.048 3.729 3.602 3.851 . 0 0 "[ . 1 . 2 . 3]" 1 1571 1 82 PHE QD 1 90 LYS QE 6.899 . 7.526 3.880 3.422 4.902 . 0 0 "[ . 1 . 2 . 3]" 1 1572 1 82 PHE QD 1 90 LYS QG 6.147 . 6.774 3.484 3.266 3.794 . 0 0 "[ . 1 . 2 . 3]" 1 1573 1 82 PHE QD 1 93 LEU QB 6.648 . 7.276 3.241 3.049 3.448 . 0 0 "[ . 1 . 2 . 3]" 1 1574 1 82 PHE QD 1 93 LEU QD 6.048 . 6.804 2.373 2.223 2.624 . 0 0 "[ . 1 . 2 . 3]" 1 1575 1 82 PHE QD 1 94 LYS H 6.160 . 6.720 5.532 5.509 5.550 . 0 0 "[ . 1 . 2 . 3]" 1 1576 1 82 PHE QD 1 94 LYS QG 6.397 . 7.025 4.629 4.455 4.760 . 0 0 "[ . 1 . 2 . 3]" 1 1577 1 82 PHE QE 1 90 LYS H 6.160 . 6.720 5.221 5.082 5.379 . 0 0 "[ . 1 . 2 . 3]" 1 1578 1 82 PHE QE 1 90 LYS HA 4.704 . 5.264 2.528 2.364 2.709 . 0 0 "[ . 1 . 2 . 3]" 1 1579 1 82 PHE QE 1 90 LYS QB 6.021 . 6.648 3.299 2.978 3.515 . 0 0 "[ . 1 . 2 . 3]" 1 1580 1 82 PHE QE 1 90 LYS QE 6.899 . 7.526 3.355 2.788 5.037 . 0 0 "[ . 1 . 2 . 3]" 1 1581 1 82 PHE QE 1 90 LYS QG 6.899 . 7.526 3.309 3.005 3.554 . 0 0 "[ . 1 . 2 . 3]" 1 1582 1 82 PHE QE 1 91 GLU H 6.160 . 6.720 5.280 5.166 5.416 . 0 0 "[ . 1 . 2 . 3]" 1 1583 1 82 PHE QE 1 93 LEU QB 5.394 . 6.021 2.261 2.188 2.456 . 0 0 "[ . 1 . 2 . 3]" 1 1584 1 82 PHE QE 1 93 LEU QD 6.350 . 7.106 2.952 2.820 3.212 . 0 0 "[ . 1 . 2 . 3]" 1 1585 1 82 PHE QE 1 94 LYS QB 6.523 . 7.150 4.501 4.375 4.591 . 0 0 "[ . 1 . 2 . 3]" 1 1586 1 82 PHE QE 1 94 LYS QE 6.899 . 7.526 3.956 3.513 5.030 . 0 0 "[ . 1 . 2 . 3]" 1 1587 1 82 PHE QE 1 94 LYS QG 5.394 . 6.021 2.715 2.604 2.843 . 0 0 "[ . 1 . 2 . 3]" 1 1588 1 83 SER H 1 83 SER QB 3.696 . 4.256 2.444 2.252 2.526 . 0 0 "[ . 1 . 2 . 3]" 1 1589 1 83 SER H 1 84 LEU H 3.700 . 4.200 2.834 2.742 2.922 . 0 0 "[ . 1 . 2 . 3]" 1 1590 1 83 SER H 1 84 LEU HA 5.500 . 6.000 5.446 5.351 5.510 . 0 0 "[ . 1 . 2 . 3]" 1 1591 1 83 SER H 1 84 LEU QB 6.048 . 6.608 4.758 4.302 5.017 . 0 0 "[ . 1 . 2 . 3]" 1 1592 1 83 SER H 1 84 LEU QD 7.020 . 7.695 4.349 3.596 5.232 . 0 0 "[ . 1 . 2 . 3]" 1 1593 1 83 SER H 1 85 LEU H 4.600 . 5.100 4.412 4.343 4.484 . 0 0 "[ . 1 . 2 . 3]" 1 1594 1 83 SER H 1 90 LYS QD 6.160 . 6.720 4.894 4.653 5.065 . 0 0 "[ . 1 . 2 . 3]" 1 1595 1 83 SER H 1 90 LYS QE 6.160 . 6.720 4.643 4.470 5.096 . 0 0 "[ . 1 . 2 . 3]" 1 1596 1 83 SER H 1 90 LYS QG 6.048 . 6.608 4.697 4.284 4.900 . 0 0 "[ . 1 . 2 . 3]" 1 1597 1 83 SER HA 1 85 LEU H 4.700 . 5.200 3.945 3.677 4.105 . 0 0 "[ . 1 . 2 . 3]" 1 1598 1 83 SER HA 1 90 LYS QB 5.152 . 5.712 4.579 4.298 4.653 . 0 0 "[ . 1 . 2 . 3]" 1 1599 1 83 SER HA 1 90 LYS QD 5.376 . 5.936 2.887 2.361 3.044 . 0 0 "[ . 1 . 2 . 3]" 1 1600 1 83 SER HA 1 90 LYS QE 4.368 . 4.928 2.160 1.983 2.607 . 0 0 "[ . 1 . 2 . 3]" 1 1601 1 83 SER QB 1 84 LEU H 4.480 . 5.040 3.251 2.927 3.717 . 0 0 "[ . 1 . 2 . 3]" 1 1602 1 83 SER QB 1 84 LEU QD 6.804 . 7.560 3.228 2.190 4.506 . 0 0 "[ . 1 . 2 . 3]" 1 1603 1 83 SER QB 1 85 LEU H 5.824 . 6.384 4.837 4.705 5.065 . 0 0 "[ . 1 . 2 . 3]" 1 1604 1 83 SER QB 1 90 LYS QE 5.645 . 6.272 3.760 3.551 4.146 . 0 0 "[ . 1 . 2 . 3]" 1 1605 1 84 LEU H 1 84 LEU QB 3.584 . 4.144 2.340 2.074 2.520 . 0 0 "[ . 1 . 2 . 3]" 1 1606 1 84 LEU H 1 84 LEU QD 4.590 . 5.265 2.966 2.402 3.479 . 0 0 "[ . 1 . 2 . 3]" 1 1607 1 84 LEU H 1 85 LEU H 3.500 . 4.000 2.505 2.433 2.648 . 0 0 "[ . 1 . 2 . 3]" 1 1608 1 84 LEU H 1 85 LEU HA 5.500 . 6.000 5.104 5.025 5.247 . 0 0 "[ . 1 . 2 . 3]" 1 1609 1 84 LEU H 1 85 LEU QB 5.824 . 6.384 4.507 4.334 4.772 . 0 0 "[ . 1 . 2 . 3]" 1 1610 1 84 LEU H 1 85 LEU QD 7.290 . 7.965 3.987 3.328 4.516 . 0 0 "[ . 1 . 2 . 3]" 1 1611 1 84 LEU H 1 90 LYS QE 6.160 . 6.720 5.063 3.820 5.329 . 0 0 "[ . 1 . 2 . 3]" 1 1612 1 84 LEU HA 1 84 LEU QD 3.780 . 4.455 2.277 2.047 2.729 . 0 0 "[ . 1 . 2 . 3]" 1 1613 1 84 LEU QB 1 85 LEU H 5.824 . 6.384 3.324 3.163 3.427 . 0 0 "[ . 1 . 2 . 3]" 1 1614 1 84 LEU QD 1 85 LEU H 6.885 . 7.560 4.335 4.093 4.465 . 0 0 "[ . 1 . 2 . 3]" 1 1615 1 84 LEU QD 1 85 LEU QD 9.477 . 10.388 4.517 3.992 4.943 . 0 0 "[ . 1 . 2 . 3]" 1 1616 1 85 LEU H 1 85 LEU QD 4.860 . 5.535 2.855 2.323 3.231 . 0 0 "[ . 1 . 2 . 3]" 1 1617 1 85 LEU H 1 86 ALA H 4.700 . 5.200 4.650 4.513 4.694 . 0 0 "[ . 1 . 2 . 3]" 1 1618 1 85 LEU H 1 90 LYS QD 5.040 . 5.600 2.875 2.633 4.488 . 0 0 "[ . 1 . 2 . 3]" 1 1619 1 85 LEU H 1 90 LYS QE 5.152 . 5.712 4.535 2.670 4.633 . 0 0 "[ . 1 . 2 . 3]" 1 1620 1 85 LEU H 1 90 LYS QG 5.040 . 5.600 3.541 3.385 3.744 . 0 0 "[ . 1 . 2 . 3]" 1 1621 1 85 LEU HA 1 86 ALA H 3.600 . 4.100 2.469 2.404 2.653 . 0 0 "[ . 1 . 2 . 3]" 1 1622 1 85 LEU HA 1 86 ALA HA 4.800 . 5.300 4.458 4.430 4.531 . 0 0 "[ . 1 . 2 . 3]" 1 1623 1 85 LEU HA 1 86 ALA MB 5.040 . 5.640 4.180 4.124 4.224 . 0 0 "[ . 1 . 2 . 3]" 1 1624 1 85 LEU QB 1 86 ALA H 4.816 . 5.376 2.372 1.986 2.518 . 0 0 "[ . 1 . 2 . 3]" 1 1625 1 85 LEU QB 1 89 ASP H 6.160 . 6.720 4.259 4.099 4.368 . 0 0 "[ . 1 . 2 . 3]" 1 1626 1 85 LEU QB 1 89 ASP QB 6.147 . 6.774 2.401 2.268 2.627 . 0 0 "[ . 1 . 2 . 3]" 1 1627 1 85 LEU QB 1 90 LYS H 5.264 . 5.824 3.490 3.341 3.681 . 0 0 "[ . 1 . 2 . 3]" 1 1628 1 85 LEU QB 1 90 LYS QD 5.645 . 6.272 2.828 2.276 4.021 . 0 0 "[ . 1 . 2 . 3]" 1 1629 1 85 LEU QB 1 90 LYS QG 6.397 . 7.025 2.173 2.098 2.595 . 0 0 "[ . 1 . 2 . 3]" 1 1630 1 85 LEU QD 1 86 ALA H 5.400 . 6.075 3.592 3.286 3.913 . 0 0 "[ . 1 . 2 . 3]" 1 1631 1 85 LEU QD 1 86 ALA MB 7.776 . 8.586 4.467 4.268 4.665 . 0 0 "[ . 1 . 2 . 3]" 1 1632 1 85 LEU QD 1 89 ASP H 7.425 . 8.100 4.935 4.742 5.072 . 0 0 "[ . 1 . 2 . 3]" 1 1633 1 85 LEU QD 1 89 ASP HA 7.290 . 7.965 4.638 4.433 4.887 . 0 0 "[ . 1 . 2 . 3]" 1 1634 1 85 LEU QD 1 89 ASP QB 6.502 . 7.258 2.497 2.245 2.745 . 0 0 "[ . 1 . 2 . 3]" 1 1635 1 85 LEU QD 1 90 LYS H 7.155 . 7.830 4.167 3.902 4.354 . 0 0 "[ . 1 . 2 . 3]" 1 1636 1 85 LEU QD 1 90 LYS HA 6.075 . 6.750 3.738 3.379 3.973 . 0 0 "[ . 1 . 2 . 3]" 1 1637 1 85 LEU QD 1 90 LYS QD 8.316 . 9.072 3.979 3.520 4.704 . 0 0 "[ . 1 . 2 . 3]" 1 1638 1 85 LEU QD 1 90 LYS QG 7.862 . 8.618 3.057 2.593 3.345 . 0 0 "[ . 1 . 2 . 3]" 1 1639 1 85 LEU QD 1 93 LEU H 7.425 . 8.100 5.175 4.964 5.478 . 0 0 "[ . 1 . 2 . 3]" 1 1640 1 85 LEU QD 1 93 LEU QD 6.196 . 7.108 2.143 2.022 2.336 . 0 0 "[ . 1 . 2 . 3]" 1 1641 1 85 LEU QD 1 93 LEU HG 7.425 . 8.100 3.899 3.600 4.720 . 0 0 "[ . 1 . 2 . 3]" 1 1642 1 86 ALA H 1 89 ASP H 5.000 . 5.500 4.303 4.121 4.428 . 0 0 "[ . 1 . 2 . 3]" 1 1643 1 86 ALA H 1 89 ASP QB 5.488 . 6.048 3.140 2.897 3.420 . 0 0 "[ . 1 . 2 . 3]" 1 1644 1 86 ALA H 1 90 LYS H 5.500 . 6.000 4.735 4.497 5.052 . 0 0 "[ . 1 . 2 . 3]" 1 1645 1 86 ALA H 1 90 LYS QD 6.160 . 6.720 4.430 4.050 5.620 . 0 0 "[ . 1 . 2 . 3]" 1 1646 1 86 ALA HA 1 87 THR HA 4.700 . 5.200 4.345 4.298 4.389 . 0 0 "[ . 1 . 2 . 3]" 1 1647 1 86 ALA HA 1 88 GLU H 4.900 . 5.400 4.397 4.325 4.507 . 0 0 "[ . 1 . 2 . 3]" 1 1648 1 86 ALA HA 1 88 GLU QG 5.712 . 6.272 4.690 4.544 4.818 . 0 0 "[ . 1 . 2 . 3]" 1 1649 1 86 ALA HA 1 89 ASP H 5.500 . 6.000 4.723 4.628 4.820 . 0 0 "[ . 1 . 2 . 3]" 1 1650 1 86 ALA HA 1 90 LYS QD 5.712 . 6.272 3.964 3.827 5.092 . 0 0 "[ . 1 . 2 . 3]" 1 1651 1 86 ALA MB 1 87 THR H 5.040 . 5.640 2.812 2.766 2.916 . 0 0 "[ . 1 . 2 . 3]" 1 1652 1 86 ALA MB 1 87 THR HA 5.760 . 6.360 4.571 4.535 4.603 . 0 0 "[ . 1 . 2 . 3]" 1 1653 1 86 ALA MB 1 87 THR HB 6.240 . 6.840 4.421 4.313 4.619 . 0 0 "[ . 1 . 2 . 3]" 1 1654 1 86 ALA MB 1 88 GLU H 4.560 . 5.160 3.007 2.887 3.180 . 0 0 "[ . 1 . 2 . 3]" 1 1655 1 86 ALA MB 1 88 GLU QB 5.779 . 6.451 4.170 4.001 4.293 . 0 0 "[ . 1 . 2 . 3]" 1 1656 1 86 ALA MB 1 88 GLU QG 5.645 . 6.317 2.438 2.321 2.579 . 0 0 "[ . 1 . 2 . 3]" 1 1657 1 86 ALA MB 1 89 ASP H 4.320 . 4.920 2.906 2.718 3.073 . 0 0 "[ . 1 . 2 . 3]" 1 1658 1 86 ALA MB 1 89 ASP QB 5.914 . 6.586 3.093 2.912 3.347 . 0 0 "[ . 1 . 2 . 3]" 1 1659 1 86 ALA MB 1 90 LYS H 5.400 . 6.000 4.313 4.202 4.509 . 0 0 "[ . 1 . 2 . 3]" 1 1660 1 87 THR H 1 88 GLU H 5.200 . 5.700 2.953 2.853 3.014 . 0 0 "[ . 1 . 2 . 3]" 1 1661 1 87 THR H 1 89 ASP H 5.500 . 6.000 4.357 4.218 4.423 . 0 0 "[ . 1 . 2 . 3]" 1 1662 1 87 THR H 1 89 ASP QB 6.160 . 6.720 5.435 5.346 5.499 . 0 0 "[ . 1 . 2 . 3]" 1 1663 1 87 THR H 1 90 LYS H 5.500 . 6.000 4.787 4.709 4.827 . 0 0 "[ . 1 . 2 . 3]" 1 1664 1 87 THR H 1 90 LYS QE 6.160 . 6.720 5.207 3.367 5.517 . 0 0 "[ . 1 . 2 . 3]" 1 1665 1 87 THR HA 1 89 ASP H 4.800 . 5.300 4.206 3.850 4.313 . 0 0 "[ . 1 . 2 . 3]" 1 1666 1 87 THR HA 1 90 LYS QB 4.480 . 5.040 2.325 2.220 2.387 . 0 0 "[ . 1 . 2 . 3]" 1 1667 1 87 THR HA 1 90 LYS QD 5.040 . 5.600 2.446 2.086 2.572 . 0 0 "[ . 1 . 2 . 3]" 1 1668 1 87 THR HA 1 90 LYS QE 4.816 . 5.376 3.238 2.441 3.528 . 0 0 "[ . 1 . 2 . 3]" 1 1669 1 87 THR HA 1 91 GLU QG 5.824 . 6.384 4.122 3.789 4.752 . 0 0 "[ . 1 . 2 . 3]" 1 1670 1 87 THR HB 1 88 GLU H 3.500 . 4.000 2.654 2.563 2.895 . 0 0 "[ . 1 . 2 . 3]" 1 1671 1 87 THR HB 1 88 GLU QB 5.040 . 5.600 4.151 4.053 4.517 . 0 0 "[ . 1 . 2 . 3]" 1 1672 1 87 THR HB 1 89 ASP H 5.000 . 5.500 5.057 5.035 5.111 . 0 0 "[ . 1 . 2 . 3]" 1 1673 1 87 THR MG 1 88 GLU H 4.560 . 5.160 3.723 3.635 3.776 . 0 0 "[ . 1 . 2 . 3]" 1 1674 1 87 THR MG 1 88 GLU HA 5.400 . 6.000 3.854 3.695 3.980 . 0 0 "[ . 1 . 2 . 3]" 1 1675 1 87 THR MG 1 89 ASP H 6.480 . 7.080 5.123 4.986 5.182 . 0 0 "[ . 1 . 2 . 3]" 1 1676 1 87 THR MG 1 90 LYS QE 6.182 . 6.854 3.714 2.697 4.199 . 0 0 "[ . 1 . 2 . 3]" 1 1677 1 87 THR MG 1 91 GLU H 4.800 . 5.400 3.943 3.705 4.013 . 0 0 "[ . 1 . 2 . 3]" 1 1678 1 87 THR MG 1 91 GLU QG 4.570 . 5.242 2.685 2.420 3.431 . 0 0 "[ . 1 . 2 . 3]" 1 1679 1 88 GLU H 1 88 GLU QB 3.584 . 4.144 2.498 2.437 2.518 . 0 0 "[ . 1 . 2 . 3]" 1 1680 1 88 GLU H 1 88 GLU QG 4.256 . 4.816 2.125 2.098 2.211 . 0 0 "[ . 1 . 2 . 3]" 1 1681 1 88 GLU H 1 89 ASP H 3.500 . 4.000 2.776 2.742 2.825 . 0 0 "[ . 1 . 2 . 3]" 1 1682 1 88 GLU H 1 89 ASP QB 5.936 . 6.496 4.825 4.764 4.925 . 0 0 "[ . 1 . 2 . 3]" 1 1683 1 88 GLU H 1 90 LYS H 4.500 . 5.000 4.236 4.171 4.276 . 0 0 "[ . 1 . 2 . 3]" 1 1684 1 88 GLU H 1 90 LYS QD 6.160 . 6.720 5.225 4.933 5.447 . 0 0 "[ . 1 . 2 . 3]" 1 1685 1 88 GLU H 1 91 GLU H 5.500 . 6.000 4.802 4.721 4.918 . 0 0 "[ . 1 . 2 . 3]" 1 1686 1 88 GLU H 1 91 GLU QG 5.600 . 6.160 4.951 4.354 5.061 . 0 0 "[ . 1 . 2 . 3]" 1 1687 1 88 GLU HA 1 90 LYS H 5.000 . 5.500 4.590 4.527 4.643 . 0 0 "[ . 1 . 2 . 3]" 1 1688 1 88 GLU HA 1 91 GLU H 4.000 . 4.500 3.598 3.483 3.761 . 0 0 "[ . 1 . 2 . 3]" 1 1689 1 88 GLU HA 1 91 GLU QG 4.256 . 4.816 3.436 2.206 3.773 . 0 0 "[ . 1 . 2 . 3]" 1 1690 1 88 GLU HA 1 92 ALA H 4.400 . 4.900 3.981 3.912 4.196 . 0 0 "[ . 1 . 2 . 3]" 1 1691 1 88 GLU QB 1 89 ASP H 4.256 . 4.816 3.657 3.632 3.672 . 0 0 "[ . 1 . 2 . 3]" 1 1692 1 88 GLU QB 1 89 ASP HA 6.048 . 6.608 4.604 4.582 4.645 . 0 0 "[ . 1 . 2 . 3]" 1 1693 1 88 GLU QG 1 89 ASP H 4.368 . 4.928 2.501 2.457 2.531 . 0 0 "[ . 1 . 2 . 3]" 1 1694 1 88 GLU QG 1 89 ASP HA 5.600 . 6.160 3.776 3.749 3.815 . 0 0 "[ . 1 . 2 . 3]" 1 1695 1 88 GLU QG 1 92 ALA H 6.160 . 6.720 5.314 5.208 5.507 . 0 0 "[ . 1 . 2 . 3]" 1 1696 1 89 ASP H 1 90 LYS H 3.300 . 3.800 2.423 2.375 2.469 . 0 0 "[ . 1 . 2 . 3]" 1 1697 1 89 ASP H 1 90 LYS QB 5.376 . 5.936 4.296 4.227 4.411 . 0 0 "[ . 1 . 2 . 3]" 1 1698 1 89 ASP H 1 90 LYS QG 6.160 . 6.720 4.428 4.043 5.154 . 0 0 "[ . 1 . 2 . 3]" 1 1699 1 89 ASP H 1 91 GLU H 4.500 . 5.000 4.000 3.910 4.143 . 0 0 "[ . 1 . 2 . 3]" 1 1700 1 89 ASP H 1 92 ALA H 5.000 . 5.500 4.531 4.452 4.633 . 0 0 "[ . 1 . 2 . 3]" 1 1701 1 89 ASP HA 1 91 GLU H 5.400 . 5.900 4.396 4.108 4.550 . 0 0 "[ . 1 . 2 . 3]" 1 1702 1 89 ASP HA 1 92 ALA H 3.900 . 4.400 3.152 2.934 3.287 . 0 0 "[ . 1 . 2 . 3]" 1 1703 1 89 ASP HA 1 92 ALA HA 5.200 . 5.700 5.071 4.882 5.221 . 0 0 "[ . 1 . 2 . 3]" 1 1704 1 89 ASP HA 1 92 ALA MB 3.960 . 4.560 2.291 2.184 2.389 . 0 0 "[ . 1 . 2 . 3]" 1 1705 1 89 ASP HA 1 93 LEU H 4.600 . 5.100 3.771 3.468 3.966 . 0 0 "[ . 1 . 2 . 3]" 1 1706 1 89 ASP HA 1 93 LEU QD 7.020 . 7.695 4.191 2.909 4.625 . 0 0 "[ . 1 . 2 . 3]" 1 1707 1 89 ASP QB 1 90 LYS H 4.816 . 5.376 2.711 2.572 2.880 . 0 0 "[ . 1 . 2 . 3]" 1 1708 1 89 ASP QB 1 90 LYS QG 6.272 . 6.899 3.574 3.359 4.277 . 0 0 "[ . 1 . 2 . 3]" 1 1709 1 89 ASP QB 1 91 GLU H 5.824 . 6.384 4.849 4.779 4.943 . 0 0 "[ . 1 . 2 . 3]" 1 1710 1 89 ASP QB 1 92 ALA H 6.160 . 6.720 4.779 4.622 4.886 . 0 0 "[ . 1 . 2 . 3]" 1 1711 1 89 ASP QB 1 92 ALA MB 6.182 . 6.854 3.940 3.715 4.075 . 0 0 "[ . 1 . 2 . 3]" 1 1712 1 89 ASP QB 1 93 LEU H 6.160 . 6.720 4.492 4.268 4.593 . 0 0 "[ . 1 . 2 . 3]" 1 1713 1 89 ASP QB 1 93 LEU QD 8.014 . 8.770 3.132 2.396 3.551 . 0 0 "[ . 1 . 2 . 3]" 1 1714 1 90 LYS H 1 90 LYS QD 5.040 . 5.600 3.342 2.604 3.755 . 0 0 "[ . 1 . 2 . 3]" 1 1715 1 90 LYS H 1 92 ALA H 5.500 . 6.000 4.220 4.101 4.327 . 0 0 "[ . 1 . 2 . 3]" 1 1716 1 90 LYS H 1 93 LEU H 5.200 . 5.700 4.855 4.759 4.931 . 0 0 "[ . 1 . 2 . 3]" 1 1717 1 90 LYS H 1 93 LEU QD 6.615 . 7.290 4.430 4.219 4.578 . 0 0 "[ . 1 . 2 . 3]" 1 1718 1 90 LYS HA 1 90 LYS QE 5.712 . 6.272 4.327 4.162 4.664 . 0 0 "[ . 1 . 2 . 3]" 1 1719 1 90 LYS HA 1 92 ALA H 5.300 . 5.800 4.692 4.470 4.811 . 0 0 "[ . 1 . 2 . 3]" 1 1720 1 90 LYS HA 1 93 LEU H 4.700 . 5.200 3.766 3.607 4.046 . 0 0 "[ . 1 . 2 . 3]" 1 1721 1 90 LYS HA 1 93 LEU QB 5.488 . 6.048 3.100 2.927 3.490 . 0 0 "[ . 1 . 2 . 3]" 1 1722 1 90 LYS HA 1 93 LEU QD 6.345 . 7.020 2.951 2.720 3.507 . 0 0 "[ . 1 . 2 . 3]" 1 1723 1 90 LYS HA 1 94 LYS H 4.700 . 5.200 4.344 4.177 4.505 . 0 0 "[ . 1 . 2 . 3]" 1 1724 1 90 LYS QB 1 91 GLU H 3.920 . 4.480 2.628 2.417 2.788 . 0 0 "[ . 1 . 2 . 3]" 1 1725 1 90 LYS QB 1 92 ALA H 5.600 . 6.160 4.883 4.712 5.014 . 0 0 "[ . 1 . 2 . 3]" 1 1726 1 90 LYS QB 1 93 LEU H 6.160 . 6.720 5.228 5.002 5.464 . 0 0 "[ . 1 . 2 . 3]" 1 1727 1 90 LYS QB 1 93 LEU QD 8.316 . 9.072 4.644 4.440 4.910 . 0 0 "[ . 1 . 2 . 3]" 1 1728 1 90 LYS QE 1 91 GLU H 6.160 . 6.720 5.005 4.843 5.470 . 0 0 "[ . 1 . 2 . 3]" 1 1729 1 90 LYS QG 1 91 GLU H 5.936 . 6.496 4.281 4.063 4.529 . 0 0 "[ . 1 . 2 . 3]" 1 1730 1 90 LYS QG 1 93 LEU QD 6.350 . 7.106 3.721 3.442 4.162 . 0 0 "[ . 1 . 2 . 3]" 1 1731 1 91 GLU H 1 91 GLU QG 3.360 . 3.920 2.440 2.201 2.556 . 0 0 "[ . 1 . 2 . 3]" 1 1732 1 91 GLU H 1 92 ALA H 3.500 . 4.000 2.770 2.685 2.826 . 0 0 "[ . 1 . 2 . 3]" 1 1733 1 91 GLU H 1 92 ALA HA 5.400 . 5.900 5.360 5.284 5.395 . 0 0 "[ . 1 . 2 . 3]" 1 1734 1 91 GLU H 1 92 ALA MB 5.280 . 5.880 4.404 4.345 4.423 . 0 0 "[ . 1 . 2 . 3]" 1 1735 1 91 GLU H 1 93 LEU H 4.700 . 5.200 4.379 4.244 4.491 . 0 0 "[ . 1 . 2 . 3]" 1 1736 1 91 GLU H 1 93 LEU QD 7.425 . 8.100 5.408 5.124 5.527 . 0 0 "[ . 1 . 2 . 3]" 1 1737 1 91 GLU HA 1 93 LEU H 5.000 . 5.500 4.589 4.425 4.703 . 0 0 "[ . 1 . 2 . 3]" 1 1738 1 91 GLU HA 1 94 LYS H 4.200 . 4.700 3.737 3.479 4.018 . 0 0 "[ . 1 . 2 . 3]" 1 1739 1 91 GLU HA 1 94 LYS QB 4.256 . 4.816 2.925 2.498 3.142 . 0 0 "[ . 1 . 2 . 3]" 1 1740 1 91 GLU HA 1 94 LYS QE 4.704 . 5.264 2.675 2.212 4.264 . 0 0 "[ . 1 . 2 . 3]" 1 1741 1 91 GLU HA 1 94 LYS QG 5.376 . 5.936 4.069 3.921 4.484 . 0 0 "[ . 1 . 2 . 3]" 1 1742 1 91 GLU HA 1 95 LYS H 4.800 . 5.300 4.020 3.873 4.158 . 0 0 "[ . 1 . 2 . 3]" 1 1743 1 91 GLU QB 1 92 ALA H 4.144 . 4.704 2.617 2.410 3.631 . 0 0 "[ . 1 . 2 . 3]" 1 1744 1 91 GLU QB 1 92 ALA MB 6.854 . 7.526 3.829 3.527 4.644 . 0 0 "[ . 1 . 2 . 3]" 1 1745 1 91 GLU QG 1 92 ALA H 4.704 . 5.264 4.098 2.349 4.262 . 0 0 "[ . 1 . 2 . 3]" 1 1746 1 91 GLU QG 1 94 LYS QE 6.397 . 7.025 4.243 3.706 5.104 . 0 0 "[ . 1 . 2 . 3]" 1 1747 1 92 ALA H 1 92 ALA MB 3.360 . 3.960 2.208 2.186 2.242 . 0 0 "[ . 1 . 2 . 3]" 1 1748 1 92 ALA H 1 93 LEU H 3.500 . 4.000 2.906 2.717 2.979 . 0 0 "[ . 1 . 2 . 3]" 1 1749 1 92 ALA H 1 93 LEU QD 7.425 . 8.100 4.981 4.173 5.195 . 0 0 "[ . 1 . 2 . 3]" 1 1750 1 92 ALA H 1 94 LYS H 4.500 . 5.000 4.465 4.299 4.546 . 0 0 "[ . 1 . 2 . 3]" 1 1751 1 92 ALA H 1 95 LYS H 5.500 . 6.000 4.656 4.584 4.717 . 0 0 "[ . 1 . 2 . 3]" 1 1752 1 92 ALA H 1 95 LYS QG 6.160 . 6.720 4.966 3.966 5.485 . 0 0 "[ . 1 . 2 . 3]" 1 1753 1 92 ALA HA 1 95 LYS H 3.900 . 4.400 3.296 3.193 3.360 . 0 0 "[ . 1 . 2 . 3]" 1 1754 1 92 ALA HA 1 95 LYS QB 3.472 . 4.032 2.246 2.135 2.514 . 0 0 "[ . 1 . 2 . 3]" 1 1755 1 92 ALA HA 1 95 LYS QE 5.376 . 5.936 3.873 2.113 4.820 . 0 0 "[ . 1 . 2 . 3]" 1 1756 1 92 ALA MB 1 93 LEU H 3.840 . 4.440 2.700 2.586 2.806 . 0 0 "[ . 1 . 2 . 3]" 1 1757 1 92 ALA MB 1 93 LEU QD 7.128 . 7.938 3.801 2.778 4.020 . 0 0 "[ . 1 . 2 . 3]" 1 1758 1 92 ALA MB 1 95 LYS H 5.400 . 6.000 4.547 4.485 4.587 . 0 0 "[ . 1 . 2 . 3]" 1 1759 1 92 ALA MB 1 95 LYS QB 5.107 . 5.779 3.738 3.593 3.812 . 0 0 "[ . 1 . 2 . 3]" 1 1760 1 92 ALA MB 1 95 LYS QE 7.392 . 8.064 4.647 3.169 5.500 . 0 0 "[ . 1 . 2 . 3]" 1 1761 1 93 LEU H 1 93 LEU HG 3.900 . 4.400 2.610 2.377 4.001 . 0 0 "[ . 1 . 2 . 3]" 1 1762 1 93 LEU H 1 94 LYS H 3.500 . 4.000 2.750 2.655 2.799 . 0 0 "[ . 1 . 2 . 3]" 1 1763 1 93 LEU H 1 94 LYS HA 5.400 . 5.900 5.416 5.341 5.445 . 0 0 "[ . 1 . 2 . 3]" 1 1764 1 93 LEU H 1 94 LYS QG 5.936 . 6.496 4.648 4.534 4.852 . 0 0 "[ . 1 . 2 . 3]" 1 1765 1 93 LEU H 1 95 LYS QB 5.824 . 6.384 4.871 4.747 5.185 . 0 0 "[ . 1 . 2 . 3]" 1 1766 1 93 LEU HA 1 93 LEU QD 3.915 . 4.590 2.147 2.076 2.432 . 0 0 "[ . 1 . 2 . 3]" 1 1767 1 93 LEU QB 1 94 LYS H 4.480 . 5.040 2.631 2.537 2.816 . 0 0 "[ . 1 . 2 . 3]" 1 1768 1 93 LEU QB 1 94 LYS QG 5.645 . 6.272 3.480 3.293 3.660 . 0 0 "[ . 1 . 2 . 3]" 1 1769 1 93 LEU QB 1 95 LYS H 5.600 . 6.160 4.740 4.674 4.861 . 0 0 "[ . 1 . 2 . 3]" 1 1770 1 93 LEU QD 1 94 LYS H 5.940 . 6.615 4.163 4.088 4.284 . 0 0 "[ . 1 . 2 . 3]" 1 1771 1 93 LEU QD 1 95 LYS H 7.425 . 8.100 5.528 5.334 5.563 . 0 0 "[ . 1 . 2 . 3]" 1 1772 1 93 LEU QD 1 96 GLN H 7.020 . 7.695 5.030 4.628 5.236 . 0 0 "[ . 1 . 2 . 3]" 1 1773 1 94 LYS H 1 94 LYS QB 3.472 . 4.032 2.370 2.282 2.419 . 0 0 "[ . 1 . 2 . 3]" 1 1774 1 94 LYS H 1 94 LYS QE 5.824 . 6.384 3.749 3.373 4.736 . 0 0 "[ . 1 . 2 . 3]" 1 1775 1 94 LYS H 1 94 LYS QG 4.256 . 4.816 2.423 2.323 2.554 . 0 0 "[ . 1 . 2 . 3]" 1 1776 1 94 LYS H 1 95 LYS H 3.500 . 4.000 2.668 2.596 2.735 . 0 0 "[ . 1 . 2 . 3]" 1 1777 1 94 LYS H 1 95 LYS HA 5.200 . 5.700 5.292 5.223 5.341 . 0 0 "[ . 1 . 2 . 3]" 1 1778 1 94 LYS H 1 96 GLN H 4.600 . 5.100 4.180 4.005 4.258 . 0 0 "[ . 1 . 2 . 3]" 1 1779 1 94 LYS H 1 97 LEU H 4.900 . 5.400 4.738 4.575 5.056 . 0 0 "[ . 1 . 2 . 3]" 1 1780 1 94 LYS H 1 98 PRO HA 5.500 . 6.000 5.560 5.259 5.794 . 0 0 "[ . 1 . 2 . 3]" 1 1781 1 94 LYS HA 1 96 GLN H 5.300 . 5.800 4.079 3.841 4.209 . 0 0 "[ . 1 . 2 . 3]" 1 1782 1 94 LYS HA 1 97 LEU H 4.500 . 5.000 3.266 3.139 3.432 . 0 0 "[ . 1 . 2 . 3]" 1 1783 1 94 LYS HA 1 98 PRO HA 4.700 . 5.200 2.790 2.475 3.164 . 0 0 "[ . 1 . 2 . 3]" 1 1784 1 94 LYS HA 1 99 GLY H 5.500 . 6.000 4.711 4.355 5.088 . 0 0 "[ . 1 . 2 . 3]" 1 1785 1 94 LYS QE 1 95 LYS H 5.824 . 6.384 4.371 4.113 5.033 . 0 0 "[ . 1 . 2 . 3]" 1 1786 1 94 LYS QG 1 95 LYS H 5.376 . 5.936 4.232 4.159 4.326 . 0 0 "[ . 1 . 2 . 3]" 1 1787 1 95 LYS H 1 95 LYS QB 3.248 . 3.808 2.356 2.283 2.683 . 0 0 "[ . 1 . 2 . 3]" 1 1788 1 95 LYS H 1 95 LYS QG 4.480 . 5.040 2.532 2.378 2.710 . 0 0 "[ . 1 . 2 . 3]" 1 1789 1 95 LYS H 1 98 PRO HA 5.500 . 6.000 5.530 5.223 5.630 . 0 0 "[ . 1 . 2 . 3]" 1 1790 1 95 LYS H 1 98 PRO QB 5.376 . 5.936 4.821 4.484 4.886 . 0 0 "[ . 1 . 2 . 3]" 1 1791 1 95 LYS HA 1 95 LYS QE 6.048 . 6.608 4.378 3.317 4.860 . 0 0 "[ . 1 . 2 . 3]" 1 1792 1 95 LYS HA 1 97 LEU H 4.800 . 5.300 4.565 4.209 4.814 . 0 0 "[ . 1 . 2 . 3]" 1 1793 1 95 LYS HA 1 98 PRO QB 5.600 . 6.160 3.708 2.971 4.174 . 0 0 "[ . 1 . 2 . 3]" 1 1794 1 95 LYS QB 1 96 GLN H 4.144 . 4.704 3.047 2.934 3.305 . 0 0 "[ . 1 . 2 . 3]" 1 1795 1 95 LYS QG 1 96 GLN H 5.264 . 5.824 4.460 4.376 4.534 . 0 0 "[ . 1 . 2 . 3]" 1 1796 1 96 GLN H 1 97 LEU H 3.300 . 3.800 2.341 2.162 2.736 . 0 0 "[ . 1 . 2 . 3]" 1 1797 1 96 GLN H 1 97 LEU HA 5.100 . 5.600 4.997 4.807 5.148 . 0 0 "[ . 1 . 2 . 3]" 1 1798 1 96 GLN H 1 97 LEU QD 7.425 . 8.100 5.141 3.687 5.579 . 0 0 "[ . 1 . 2 . 3]" 1 1799 1 96 GLN H 1 98 PRO QD 5.600 . 6.160 4.217 3.721 4.509 . 0 0 "[ . 1 . 2 . 3]" 1 1800 1 96 GLN H 1 98 PRO QG 5.712 . 6.272 5.142 5.120 5.174 . 0 0 "[ . 1 . 2 . 3]" 1 1801 1 96 GLN HA 1 98 PRO QD 5.488 . 6.048 4.030 3.471 4.477 . 0 0 "[ . 1 . 2 . 3]" 1 1802 1 96 GLN QB 1 97 LEU H 4.368 . 4.928 2.766 2.516 3.113 . 0 0 "[ . 1 . 2 . 3]" 1 1803 1 96 GLN QB 1 97 LEU QB 6.397 . 7.025 3.468 2.995 4.100 . 0 0 "[ . 1 . 2 . 3]" 1 1804 1 96 GLN QB 1 97 LEU QD 7.106 . 7.862 3.883 2.282 4.502 . 0 0 "[ . 1 . 2 . 3]" 1 1805 1 97 LEU H 1 98 PRO HA 4.500 . 5.000 4.373 3.816 4.513 . 0 0 "[ . 1 . 2 . 3]" 1 1806 1 97 LEU H 1 98 PRO QB 5.600 . 6.160 4.705 4.208 4.939 . 0 0 "[ . 1 . 2 . 3]" 1 1807 1 97 LEU H 1 98 PRO QD 5.040 . 5.600 3.072 2.561 3.395 . 0 0 "[ . 1 . 2 . 3]" 1 1808 1 97 LEU HA 1 98 PRO QD 3.472 . 4.032 2.218 2.063 2.371 . 0 0 "[ . 1 . 2 . 3]" 1 1809 1 98 PRO HA 1 99 GLY H 3.200 . 3.700 2.342 2.241 2.443 . 0 0 "[ . 1 . 2 . 3]" 1 1810 1 98 PRO HA 1 99 GLY QA 5.264 . 5.824 4.000 3.905 4.074 . 0 0 "[ . 1 . 2 . 3]" 1 1811 1 98 PRO QB 1 99 GLY H 4.256 . 4.816 2.949 2.790 3.177 . 0 0 "[ . 1 . 2 . 3]" 1 1812 1 98 PRO QG 1 99 GLY H 6.160 . 6.720 4.594 4.404 4.825 . 0 0 "[ . 1 . 2 . 3]" 1 1813 1 99 GLY H 1 100 VAL H 4.200 . 4.700 4.271 3.853 4.432 . 0 0 "[ . 1 . 2 . 3]" 1 1814 1 99 GLY H 1 100 VAL QG 7.425 . 8.100 5.205 3.527 5.593 . 0 0 "[ . 1 . 2 . 3]" 1 1815 1 99 GLY QA 1 100 VAL H 3.920 . 4.480 2.146 2.024 2.203 . 0 0 "[ . 1 . 2 . 3]" 1 1816 1 99 GLY QA 1 100 VAL HA 5.488 . 6.048 4.001 3.877 4.099 . 0 0 "[ . 1 . 2 . 3]" 1 1817 1 99 GLY QA 1 100 VAL HB 5.264 . 5.824 4.230 3.719 4.531 . 0 0 "[ . 1 . 2 . 3]" 1 1818 1 99 GLY QA 1 100 VAL QG 6.804 . 7.560 3.409 2.910 3.681 . 0 0 "[ . 1 . 2 . 3]" 1 1819 1 100 VAL H 1 100 VAL HB 3.400 . 3.900 2.732 2.132 3.529 . 0 0 "[ . 1 . 2 . 3]" 1 1820 1 100 VAL H 1 101 LYS H 4.500 . 5.000 4.412 2.926 4.601 . 0 0 "[ . 1 . 2 . 3]" 1 1821 1 100 VAL HA 1 101 LYS H 3.000 . 3.500 2.144 2.020 2.530 . 0 0 "[ . 1 . 2 . 3]" 1 1822 1 100 VAL HA 1 101 LYS QG 5.936 . 6.496 4.947 3.626 5.445 . 0 0 "[ . 1 . 2 . 3]" 1 1823 1 100 VAL HA 1 102 SER H 5.500 . 6.000 4.105 2.898 4.981 . 0 0 "[ . 1 . 2 . 3]" 1 1824 1 100 VAL HB 1 101 LYS H 4.200 . 4.700 4.094 3.857 4.386 . 0 0 "[ . 1 . 2 . 3]" 1 1825 1 100 VAL HB 1 102 SER H 4.700 . 5.200 4.364 3.287 4.854 . 0 0 "[ . 1 . 2 . 3]" 1 1826 1 100 VAL QG 1 101 LYS H 5.535 . 6.210 2.499 1.906 3.720 . 0 0 "[ . 1 . 2 . 3]" 1 1827 1 100 VAL QG 1 101 LYS HA 6.075 . 6.750 3.867 3.376 4.473 . 0 0 "[ . 1 . 2 . 3]" 1 1828 1 100 VAL QG 1 101 LYS QG 7.258 . 8.014 4.509 2.759 4.903 . 0 0 "[ . 1 . 2 . 3]" 1 1829 1 100 VAL QG 1 102 SER H 7.425 . 8.100 2.366 1.789 3.596 . 0 0 "[ . 1 . 2 . 3]" 1 1830 1 100 VAL QG 1 102 SER HA 6.615 . 7.290 3.754 2.289 4.938 . 0 0 "[ . 1 . 2 . 3]" 1 1831 1 100 VAL QG 1 102 SER QB 5.443 . 6.199 3.163 2.391 3.747 . 0 0 "[ . 1 . 2 . 3]" 1 1832 1 101 LYS H 1 103 GLU H 5.500 . 6.000 4.964 3.846 5.585 . 0 0 "[ . 1 . 2 . 3]" 1 1833 1 101 LYS HA 1 103 GLU H 5.100 . 5.600 3.649 2.931 5.214 . 0 0 "[ . 1 . 2 . 3]" 1 1834 1 101 LYS QB 1 102 SER H 6.160 . 6.720 3.717 2.515 4.109 . 0 0 "[ . 1 . 2 . 3]" 1 1835 1 101 LYS QG 1 103 GLU QB 6.397 . 7.025 4.765 3.389 5.138 . 0 0 "[ . 1 . 2 . 3]" 1 1836 1 101 LYS QG 1 104 GLY QA 6.147 . 6.774 3.798 2.455 4.918 . 0 0 "[ . 1 . 2 . 3]" 1 1837 1 101 LYS QG 1 105 LYS H 6.160 . 6.720 4.759 2.933 5.535 . 0 0 "[ . 1 . 2 . 3]" 1 1838 1 101 LYS QG 1 106 ARG H 6.160 . 6.720 4.391 2.430 5.515 . 0 0 "[ . 1 . 2 . 3]" 1 1839 1 102 SER QB 1 103 GLU H 6.160 . 6.720 3.260 2.408 3.965 . 0 0 "[ . 1 . 2 . 3]" 1 1840 1 103 GLU HA 1 104 GLY QA 4.928 . 5.488 4.218 3.777 4.478 . 0 0 "[ . 1 . 2 . 3]" 1 1841 1 103 GLU QB 1 104 GLY H 6.160 . 6.720 3.246 2.327 4.075 . 0 0 "[ . 1 . 2 . 3]" 1 1842 1 103 GLU QB 1 104 GLY QA 6.147 . 6.774 4.272 3.880 4.714 . 0 0 "[ . 1 . 2 . 3]" 1 1843 1 103 GLU QG 1 105 LYS H 5.600 . 6.160 4.137 1.816 5.081 . 0 0 "[ . 1 . 2 . 3]" 1 1844 1 104 GLY H 1 106 ARG H 5.500 . 6.000 4.450 3.486 5.509 . 0 0 "[ . 1 . 2 . 3]" 1 1845 1 105 LYS H 1 106 ARG HA 5.000 . 5.500 4.877 4.057 5.172 . 0 0 "[ . 1 . 2 . 3]" 1 1846 1 105 LYS HA 1 106 ARG H 3.600 . 4.100 3.370 2.410 3.556 . 0 0 "[ . 1 . 2 . 3]" 1 1847 1 105 LYS QB 1 106 ARG H 5.152 . 5.712 3.182 2.026 4.050 . 0 0 "[ . 1 . 2 . 3]" 1 1848 1 106 ARG H 1 107 LYS H 5.500 . 6.000 3.280 2.289 4.623 . 0 0 "[ . 1 . 2 . 3]" 1 1849 1 106 ARG QB 1 107 LYS H 5.376 . 5.936 3.420 2.216 4.089 . 0 0 "[ . 1 . 2 . 3]" 1 1850 1 107 LYS HA 1 108 GLY QA 5.040 . 5.600 4.105 3.852 4.491 . 0 0 "[ . 1 . 2 . 3]" 1 1851 1 107 LYS HA 1 109 ASP H 5.500 . 6.000 4.312 3.168 5.611 . 0 0 "[ . 1 . 2 . 3]" 1 1852 1 107 LYS QB 1 108 GLY H 6.160 . 6.720 3.027 2.156 3.883 . 0 0 "[ . 1 . 2 . 3]" 1 1853 1 107 LYS QB 1 109 ASP H 6.160 . 6.720 4.390 2.292 5.561 . 0 0 "[ . 1 . 2 . 3]" 1 1854 1 108 GLY H 1 110 GLU H 5.200 . 5.700 4.069 2.272 5.252 . 0 0 "[ . 1 . 2 . 3]" 1 1855 1 108 GLY QA 1 109 ASP HA 5.712 . 6.272 4.241 4.034 4.611 . 0 0 "[ . 1 . 2 . 3]" 1 1856 1 108 GLY QA 1 109 ASP QB 5.143 . 5.770 3.975 3.499 4.207 . 0 0 "[ . 1 . 2 . 3]" 1 1857 1 108 GLY QA 1 110 GLU H 6.160 . 6.720 3.661 3.118 4.290 . 0 0 "[ . 1 . 2 . 3]" 1 1858 1 108 GLY QA 1 110 GLU QG 6.523 . 7.150 4.668 2.886 5.241 . 0 0 "[ . 1 . 2 . 3]" 1 1859 1 109 ASP H 1 110 GLU H 4.200 . 4.700 2.779 1.965 3.463 . 0 0 "[ . 1 . 2 . 3]" 1 1860 1 109 ASP H 1 110 GLU HA 5.500 . 6.000 5.246 4.426 5.626 . 0 0 "[ . 1 . 2 . 3]" 1 1861 1 109 ASP HA 1 110 GLU HA 4.500 . 5.000 4.561 4.421 4.696 . 0 0 "[ . 1 . 2 . 3]" 1 1862 1 109 ASP QB 1 110 GLU H 5.264 . 5.824 3.607 2.792 4.017 . 0 0 "[ . 1 . 2 . 3]" 1 1863 1 110 GLU H 1 111 VAL H 5.000 . 5.500 3.442 1.903 4.615 . 0 0 "[ . 1 . 2 . 3]" 1 1864 1 110 GLU H 1 112 ASP QB 5.488 . 6.048 4.548 3.430 4.945 . 0 0 "[ . 1 . 2 . 3]" 1 1865 1 110 GLU HA 1 111 VAL H 3.400 . 3.900 2.856 2.212 3.504 . 0 0 "[ . 1 . 2 . 3]" 1 1866 1 110 GLU HA 1 112 ASP H 4.900 . 5.400 4.078 3.395 4.940 . 0 0 "[ . 1 . 2 . 3]" 1 1867 1 110 GLU QB 1 111 VAL H 5.712 . 6.272 2.932 2.200 3.903 . 0 0 "[ . 1 . 2 . 3]" 1 1868 1 110 GLU QB 1 112 ASP H 6.160 . 6.720 4.524 2.078 5.334 . 0 0 "[ . 1 . 2 . 3]" 1 1869 1 110 GLU QG 1 111 VAL H 5.936 . 6.496 3.992 2.494 4.545 . 0 0 "[ . 1 . 2 . 3]" 1 1870 1 111 VAL HA 1 112 ASP H 3.200 . 3.700 2.868 2.280 3.286 . 0 0 "[ . 1 . 2 . 3]" 1 1871 1 111 VAL HB 1 112 ASP H 5.500 . 6.000 4.403 4.139 4.575 . 0 0 "[ . 1 . 2 . 3]" 1 stop_ save_
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