NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
432341 | 2js1 | 15350 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2js1 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 1754 _Distance_constraint_stats_list.Viol_count 3858 _Distance_constraint_stats_list.Viol_total 10908.795 _Distance_constraint_stats_list.Viol_max 0.495 _Distance_constraint_stats_list.Viol_rms 0.0576 _Distance_constraint_stats_list.Viol_average_all_restraints 0.0155 _Distance_constraint_stats_list.Viol_average_violations_only 0.1414 _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 2 SER 0.000 0.000 . 0 "[ . 1 . 2]" 1 3 GLU 2.822 0.458 20 0 "[ . 1 . 2]" 1 4 LEU 6.220 0.466 12 0 "[ . 1 . 2]" 1 6 SER 0.239 0.239 13 0 "[ . 1 . 2]" 1 7 VAL 3.282 0.232 7 0 "[ . 1 . 2]" 1 8 PRO 1.668 0.193 2 0 "[ . 1 . 2]" 1 9 TYR 6.201 0.466 12 0 "[ . 1 . 2]" 1 10 PHE 9.683 0.417 11 0 "[ . 1 . 2]" 1 11 ILE 16.579 0.490 16 0 "[ . 1 . 2]" 1 12 GLU 7.569 0.458 13 0 "[ . 1 . 2]" 1 13 ASN 2.229 0.272 20 0 "[ . 1 . 2]" 1 14 LEU 14.398 0.490 16 0 "[ . 1 . 2]" 1 15 LYS 6.371 0.225 19 0 "[ . 1 . 2]" 1 16 GLN 5.592 0.278 14 0 "[ . 1 . 2]" 1 17 HIS 3.623 0.271 4 0 "[ . 1 . 2]" 1 18 ILE 12.251 0.434 4 0 "[ . 1 . 2]" 1 19 GLU 5.871 0.450 15 0 "[ . 1 . 2]" 1 20 MET 4.236 0.238 10 0 "[ . 1 . 2]" 1 21 ASN 4.516 0.354 16 0 "[ . 1 . 2]" 1 22 GLN 8.818 0.415 13 0 "[ . 1 . 2]" 1 23 SER 3.760 0.415 13 0 "[ . 1 . 2]" 1 24 GLU 5.444 0.378 9 0 "[ . 1 . 2]" 1 25 ASP 5.696 0.374 4 0 "[ . 1 . 2]" 1 26 LYS 12.546 0.450 15 0 "[ . 1 . 2]" 1 27 ILE 12.829 0.433 17 0 "[ . 1 . 2]" 1 28 HIS 1.444 0.173 15 0 "[ . 1 . 2]" 1 29 ALA 3.104 0.293 14 0 "[ . 1 . 2]" 1 30 MET 25.542 0.494 14 0 "[ . 1 . 2]" 1 31 ASN 0.686 0.201 14 0 "[ . 1 . 2]" 1 32 SER 0.249 0.108 20 0 "[ . 1 . 2]" 1 33 TYR 21.328 0.434 5 0 "[ . 1 . 2]" 1 34 TYR 5.710 0.455 17 0 "[ . 1 . 2]" 1 35 ARG 0.000 0.000 . 0 "[ . 1 . 2]" 1 36 SER 0.000 0.000 . 0 "[ . 1 . 2]" 1 37 VAL 17.996 0.490 18 0 "[ . 1 . 2]" 1 38 VAL 6.376 0.378 8 0 "[ . 1 . 2]" 1 39 SER 1.029 0.259 10 0 "[ . 1 . 2]" 1 40 THR 1.876 0.259 10 0 "[ . 1 . 2]" 1 41 LEU 5.419 0.422 14 0 "[ . 1 . 2]" 1 42 VAL 10.739 0.490 8 0 "[ . 1 . 2]" 1 43 GLN 1.620 0.343 9 0 "[ . 1 . 2]" 1 44 ASP 7.874 0.490 8 0 "[ . 1 . 2]" 1 45 GLN 4.461 0.478 9 0 "[ . 1 . 2]" 1 46 LEU 6.704 0.430 17 0 "[ . 1 . 2]" 1 47 THR 14.737 0.489 13 0 "[ . 1 . 2]" 1 48 LYS 15.977 0.491 12 0 "[ . 1 . 2]" 1 49 ASN 5.538 0.426 8 0 "[ . 1 . 2]" 1 50 ALA 2.343 0.495 7 0 "[ . 1 . 2]" 1 51 VAL 7.796 0.342 12 0 "[ . 1 . 2]" 1 52 VAL 10.660 0.495 7 0 "[ . 1 . 2]" 1 53 LEU 7.557 0.430 6 0 "[ . 1 . 2]" 1 54 LYS 3.579 0.294 7 0 "[ . 1 . 2]" 1 55 ARG 2.634 0.276 4 0 "[ . 1 . 2]" 1 56 ILE 14.302 0.456 9 0 "[ . 1 . 2]" 1 57 GLN 5.005 0.288 8 0 "[ . 1 . 2]" 1 58 HIS 2.864 0.294 16 0 "[ . 1 . 2]" 1 59 LEU 10.800 0.490 18 0 "[ . 1 . 2]" 1 60 ASP 0.156 0.085 11 0 "[ . 1 . 2]" 1 61 GLU 4.549 0.301 13 0 "[ . 1 . 2]" 1 62 ALA 11.949 0.480 8 0 "[ . 1 . 2]" 1 63 TYR 4.016 0.343 2 0 "[ . 1 . 2]" 1 64 ASN 2.221 0.225 12 0 "[ . 1 . 2]" 1 65 LYS 0.000 0.000 . 0 "[ . 1 . 2]" 1 66 VAL 12.955 0.494 14 0 "[ . 1 . 2]" 1 67 LYS 23.799 0.493 20 0 "[ . 1 . 2]" 1 68 ARG 16.235 0.488 6 0 "[ . 1 . 2]" 1 69 GLY 9.790 0.486 2 0 "[ . 1 . 2]" 1 70 GLU 10.874 0.494 15 0 "[ . 1 . 2]" 1 71 SER 5.028 0.449 9 0 "[ . 1 . 2]" 1 72 LYS 4.453 0.449 9 0 "[ . 1 . 2]" 1 73 LEU 5.930 0.447 18 0 "[ . 1 . 2]" 1 74 GLU 7.097 0.447 18 0 "[ . 1 . 2]" 1 75 HIS 1.334 0.270 18 0 "[ . 1 . 2]" 2 2 SER 0.041 0.041 7 0 "[ . 1 . 2]" 2 3 GLU 2.252 0.484 3 0 "[ . 1 . 2]" 2 4 LEU 6.377 0.484 3 0 "[ . 1 . 2]" 2 6 SER 0.688 0.413 13 0 "[ . 1 . 2]" 2 7 VAL 3.315 0.223 4 0 "[ . 1 . 2]" 2 8 PRO 1.672 0.260 13 0 "[ . 1 . 2]" 2 9 TYR 7.362 0.353 9 0 "[ . 1 . 2]" 2 10 PHE 8.441 0.346 15 0 "[ . 1 . 2]" 2 11 ILE 17.368 0.488 13 0 "[ . 1 . 2]" 2 12 GLU 9.189 0.488 13 0 "[ . 1 . 2]" 2 13 ASN 2.113 0.249 2 0 "[ . 1 . 2]" 2 14 LEU 15.652 0.454 13 0 "[ . 1 . 2]" 2 15 LYS 4.635 0.227 9 0 "[ . 1 . 2]" 2 16 GLN 7.160 0.407 3 0 "[ . 1 . 2]" 2 17 HIS 4.270 0.358 2 0 "[ . 1 . 2]" 2 18 ILE 10.164 0.302 15 0 "[ . 1 . 2]" 2 19 GLU 5.725 0.380 19 0 "[ . 1 . 2]" 2 20 MET 3.825 0.299 3 0 "[ . 1 . 2]" 2 21 ASN 7.828 0.495 8 0 "[ . 1 . 2]" 2 22 GLN 12.265 0.495 8 0 "[ . 1 . 2]" 2 23 SER 0.403 0.218 9 0 "[ . 1 . 2]" 2 24 GLU 4.761 0.358 2 0 "[ . 1 . 2]" 2 25 ASP 5.293 0.329 2 0 "[ . 1 . 2]" 2 26 LYS 13.453 0.380 19 0 "[ . 1 . 2]" 2 27 ILE 10.291 0.412 18 0 "[ . 1 . 2]" 2 28 HIS 1.976 0.216 17 0 "[ . 1 . 2]" 2 29 ALA 3.690 0.296 14 0 "[ . 1 . 2]" 2 30 MET 23.506 0.488 16 0 "[ . 1 . 2]" 2 31 ASN 0.553 0.177 6 0 "[ . 1 . 2]" 2 32 SER 0.149 0.070 8 0 "[ . 1 . 2]" 2 33 TYR 22.844 0.431 11 0 "[ . 1 . 2]" 2 34 TYR 6.598 0.493 15 0 "[ . 1 . 2]" 2 35 ARG 0.000 0.000 . 0 "[ . 1 . 2]" 2 36 SER 0.000 0.000 . 0 "[ . 1 . 2]" 2 37 VAL 16.639 0.493 15 0 "[ . 1 . 2]" 2 38 VAL 6.465 0.273 2 0 "[ . 1 . 2]" 2 39 SER 0.807 0.145 8 0 "[ . 1 . 2]" 2 40 THR 2.971 0.485 8 0 "[ . 1 . 2]" 2 41 LEU 4.901 0.369 11 0 "[ . 1 . 2]" 2 42 VAL 9.057 0.464 7 0 "[ . 1 . 2]" 2 43 GLN 1.773 0.485 8 0 "[ . 1 . 2]" 2 44 ASP 6.876 0.493 20 0 "[ . 1 . 2]" 2 45 GLN 4.032 0.493 10 0 "[ . 1 . 2]" 2 46 LEU 5.968 0.493 20 0 "[ . 1 . 2]" 2 47 THR 13.242 0.437 20 0 "[ . 1 . 2]" 2 48 LYS 14.394 0.401 18 0 "[ . 1 . 2]" 2 49 ASN 5.526 0.401 18 0 "[ . 1 . 2]" 2 50 ALA 2.087 0.491 7 0 "[ . 1 . 2]" 2 51 VAL 7.471 0.367 14 0 "[ . 1 . 2]" 2 52 VAL 12.266 0.491 7 0 "[ . 1 . 2]" 2 53 LEU 8.315 0.382 7 0 "[ . 1 . 2]" 2 54 LYS 5.660 0.489 8 0 "[ . 1 . 2]" 2 55 ARG 2.925 0.323 5 0 "[ . 1 . 2]" 2 56 ILE 14.515 0.417 3 0 "[ . 1 . 2]" 2 57 GLN 6.273 0.323 5 0 "[ . 1 . 2]" 2 58 HIS 3.357 0.350 7 0 "[ . 1 . 2]" 2 59 LEU 11.040 0.417 3 0 "[ . 1 . 2]" 2 60 ASP 0.588 0.210 1 0 "[ . 1 . 2]" 2 61 GLU 4.403 0.362 12 0 "[ . 1 . 2]" 2 62 ALA 11.922 0.451 8 0 "[ . 1 . 2]" 2 63 TYR 5.529 0.294 2 0 "[ . 1 . 2]" 2 64 ASN 2.555 0.234 16 0 "[ . 1 . 2]" 2 65 LYS 0.004 0.004 18 0 "[ . 1 . 2]" 2 66 VAL 13.714 0.488 16 0 "[ . 1 . 2]" 2 67 LYS 24.650 0.490 12 0 "[ . 1 . 2]" 2 68 ARG 18.232 0.486 13 0 "[ . 1 . 2]" 2 69 GLY 12.746 0.447 4 0 "[ . 1 . 2]" 2 70 GLU 13.186 0.490 12 0 "[ . 1 . 2]" 2 71 SER 6.789 0.486 14 0 "[ . 1 . 2]" 2 72 LYS 5.850 0.486 14 0 "[ . 1 . 2]" 2 73 LEU 8.250 0.460 19 0 "[ . 1 . 2]" 2 74 GLU 7.621 0.460 19 0 "[ . 1 . 2]" 2 75 HIS 1.692 0.286 19 0 "[ . 1 . 2]" stop_ loop_ _Distance_constraint_stats.Restraint_ID _Distance_constraint_stats.Atom_1_entity_assembly_ID _Distance_constraint_stats.Atom_1_comp_index_ID _Distance_constraint_stats.Atom_1_comp_ID _Distance_constraint_stats.Atom_1_ID _Distance_constraint_stats.Atom_2_entity_assembly_ID _Distance_constraint_stats.Atom_2_comp_index_ID _Distance_constraint_stats.Atom_2_comp_ID _Distance_constraint_stats.Atom_2_ID _Distance_constraint_stats.Node_1_distance_val _Distance_constraint_stats.Node_1_distance_lower_bound_val _Distance_constraint_stats.Node_1_distance_upper_bound_val _Distance_constraint_stats.Distance_average _Distance_constraint_stats.Distance_minimum _Distance_constraint_stats.Distance_maximum _Distance_constraint_stats.Max_violation _Distance_constraint_stats.Max_violation_model_number _Distance_constraint_stats.Over_cutoff_violation_count _Distance_constraint_stats.Over_cutoff_viol_per_model _Distance_constraint_stats.Distance_constraint_stats_ID 1 1 2 SER QB 1 3 GLU H 4.450 . 4.450 2.973 1.842 4.059 . 0 0 "[ . 1 . 2]" 1 2 1 2 SER HB2 1 3 GLU H 5.080 . 5.080 3.497 2.227 4.662 . 0 0 "[ . 1 . 2]" 1 3 1 2 SER HB3 1 3 GLU H 5.080 . 5.080 3.607 1.850 4.594 . 0 0 "[ . 1 . 2]" 1 4 1 3 GLU H 1 4 LEU H 6.000 . 6.000 3.928 3.076 4.639 . 0 0 "[ . 1 . 2]" 1 5 1 3 GLU HA 1 4 LEU H 3.440 . 3.440 2.370 2.119 2.740 . 0 0 "[ . 1 . 2]" 1 6 1 3 GLU HA 1 4 LEU HA 4.610 . 4.610 4.482 4.286 4.701 0.091 18 0 "[ . 1 . 2]" 1 7 1 3 GLU HA 1 4 LEU QB 4.470 . 4.470 4.410 3.762 4.772 0.302 12 0 "[ . 1 . 2]" 1 8 1 3 GLU QG 1 4 LEU H 5.840 . 5.840 3.982 1.762 4.713 0.098 18 0 "[ . 1 . 2]" 1 9 1 3 GLU QG 1 4 LEU QD 5.790 . 5.790 4.737 2.686 6.248 0.458 20 0 "[ . 1 . 2]" 1 10 1 4 LEU H 1 4 LEU QB 3.570 . 3.570 2.930 2.372 3.383 . 0 0 "[ . 1 . 2]" 1 11 1 4 LEU H 1 4 LEU QD 4.500 . 4.500 2.886 1.667 4.129 0.133 12 0 "[ . 1 . 2]" 1 12 1 4 LEU H 1 4 LEU HG 4.880 . 4.880 3.247 1.876 4.777 . 0 0 "[ . 1 . 2]" 1 13 1 4 LEU H 1 6 SER H 6.000 . 6.000 4.529 2.696 6.239 0.239 13 0 "[ . 1 . 2]" 1 14 1 4 LEU H 1 9 TYR QD 5.000 . 5.000 4.655 2.971 5.256 0.256 12 0 "[ . 1 . 2]" 1 15 1 4 LEU H 1 9 TYR QE 5.260 . 5.260 5.083 3.984 5.726 0.466 12 0 "[ . 1 . 2]" 1 16 1 4 LEU HA 1 4 LEU MD1 4.340 . 4.340 3.500 2.122 4.120 . 0 0 "[ . 1 . 2]" 1 17 1 4 LEU HA 1 4 LEU QD 3.680 . 3.680 2.506 2.042 3.460 . 0 0 "[ . 1 . 2]" 1 18 1 4 LEU HA 1 4 LEU MD2 4.340 . 4.340 2.839 2.148 4.021 . 0 0 "[ . 1 . 2]" 1 19 1 4 LEU HA 1 6 SER H 6.000 . 6.000 4.100 3.398 4.866 . 0 0 "[ . 1 . 2]" 1 20 1 4 LEU HA 1 9 TYR QD 5.060 . 5.060 2.981 2.324 3.946 . 0 0 "[ . 1 . 2]" 1 21 1 4 LEU HA 1 9 TYR QE 4.820 . 4.820 4.033 3.337 4.969 0.149 12 0 "[ . 1 . 2]" 1 22 1 4 LEU QB 1 4 LEU QD 2.800 . 2.800 1.944 1.922 2.041 . 0 0 "[ . 1 . 2]" 1 23 1 4 LEU QD 1 9 TYR QD 4.370 . 4.370 3.178 2.417 4.155 . 0 0 "[ . 1 . 2]" 1 24 1 4 LEU QD 1 9 TYR QE 4.060 . 4.060 3.205 2.204 4.331 0.271 13 0 "[ . 1 . 2]" 1 25 1 4 LEU QD 1 10 PHE QE 4.150 . 4.150 2.941 2.141 4.219 0.069 19 0 "[ . 1 . 2]" 1 26 1 4 LEU MD1 1 9 TYR QD 5.590 . 5.590 4.338 2.441 5.196 . 0 0 "[ . 1 . 2]" 1 27 1 4 LEU MD1 1 9 TYR QE 4.750 . 4.750 4.208 2.220 4.827 0.077 9 0 "[ . 1 . 2]" 1 28 1 4 LEU MD1 1 10 PHE QD 6.000 . 6.000 4.896 3.098 5.936 . 0 0 "[ . 1 . 2]" 1 29 1 4 LEU MD1 1 10 PHE QE 4.980 . 4.980 3.715 2.248 4.712 . 0 0 "[ . 1 . 2]" 1 30 1 4 LEU MD2 1 9 TYR QD 5.590 . 5.590 3.674 2.424 5.035 . 0 0 "[ . 1 . 2]" 1 31 1 4 LEU MD2 1 9 TYR QE 4.750 . 4.750 3.698 2.284 4.927 0.177 13 0 "[ . 1 . 2]" 1 32 1 4 LEU MD2 1 10 PHE QD 6.000 . 6.000 4.440 2.486 6.093 0.093 11 0 "[ . 1 . 2]" 1 33 1 4 LEU MD2 1 10 PHE QE 4.980 . 4.980 3.640 2.182 5.018 0.038 11 0 "[ . 1 . 2]" 1 34 1 6 SER H 1 7 VAL H 6.000 . 6.000 4.459 2.594 4.662 . 0 0 "[ . 1 . 2]" 1 35 1 7 VAL H 1 7 VAL HB 4.070 . 4.070 2.770 2.246 3.324 . 0 0 "[ . 1 . 2]" 1 36 1 7 VAL H 1 7 VAL QG 4.200 . 4.200 1.950 1.670 2.554 0.130 18 0 "[ . 1 . 2]" 1 37 1 7 VAL H 1 10 PHE H 6.000 . 6.000 5.499 5.327 5.723 . 0 0 "[ . 1 . 2]" 1 38 1 7 VAL HA 1 9 TYR H 3.730 . 3.730 3.758 3.614 3.868 0.138 14 0 "[ . 1 . 2]" 1 39 1 7 VAL HB 1 8 PRO HA 4.840 . 4.840 4.192 3.872 4.732 . 0 0 "[ . 1 . 2]" 1 40 1 7 VAL HB 1 9 TYR H 4.790 . 4.790 4.876 4.753 5.022 0.232 7 0 "[ . 1 . 2]" 1 41 1 7 VAL QG 1 10 PHE H 5.690 . 5.690 4.070 3.708 4.442 . 0 0 "[ . 1 . 2]" 1 42 1 7 VAL QG 1 61 GLU H 5.920 . 5.920 5.290 4.799 5.907 . 0 0 "[ . 1 . 2]" 1 43 1 7 VAL QG 1 61 GLU QG 3.630 . 3.630 3.120 2.230 3.572 . 0 0 "[ . 1 . 2]" 1 44 1 7 VAL QG 1 62 ALA H 5.920 . 5.920 4.818 4.187 5.489 . 0 0 "[ . 1 . 2]" 1 45 1 7 VAL MG1 1 61 GLU HG2 6.000 . 6.000 3.590 3.051 4.243 . 0 0 "[ . 1 . 2]" 1 46 1 7 VAL MG1 1 61 GLU HG3 6.000 . 6.000 3.597 2.269 4.183 . 0 0 "[ . 1 . 2]" 1 47 1 7 VAL MG2 1 61 GLU HG2 6.000 . 6.000 5.524 4.333 6.121 0.121 15 0 "[ . 1 . 2]" 1 48 1 7 VAL MG2 1 61 GLU HG3 6.000 . 6.000 5.539 4.452 6.022 0.022 17 0 "[ . 1 . 2]" 1 49 1 8 PRO HA 1 10 PHE H 4.850 . 4.850 4.322 4.023 4.510 . 0 0 "[ . 1 . 2]" 1 50 1 8 PRO HA 1 11 ILE H 4.270 . 4.270 3.412 3.264 3.593 . 0 0 "[ . 1 . 2]" 1 51 1 8 PRO HA 1 11 ILE HB 3.590 . 3.590 2.934 2.359 3.288 . 0 0 "[ . 1 . 2]" 1 52 1 8 PRO HA 1 11 ILE MD 4.620 . 4.620 2.565 2.292 3.087 . 0 0 "[ . 1 . 2]" 1 53 1 8 PRO HA 1 11 ILE MG 4.480 . 4.480 4.260 3.719 4.595 0.115 15 0 "[ . 1 . 2]" 1 54 1 8 PRO HA 1 12 GLU H 4.130 . 4.130 4.050 3.281 4.323 0.193 2 0 "[ . 1 . 2]" 1 55 1 8 PRO QB 1 9 TYR H 4.110 . 4.110 2.989 2.762 3.441 . 0 0 "[ . 1 . 2]" 1 56 1 8 PRO QB 1 11 ILE H 5.500 . 5.500 4.880 4.726 5.220 . 0 0 "[ . 1 . 2]" 1 57 1 8 PRO QB 1 11 ILE MG 5.140 . 5.140 4.994 4.692 5.224 0.084 18 0 "[ . 1 . 2]" 1 58 1 9 TYR H 1 9 TYR QD 5.300 . 5.300 4.184 4.152 4.227 . 0 0 "[ . 1 . 2]" 1 59 1 9 TYR H 1 10 PHE H 4.240 . 4.240 2.677 2.460 2.774 . 0 0 "[ . 1 . 2]" 1 60 1 9 TYR QD 1 10 PHE H 4.680 . 4.680 3.524 3.094 3.954 . 0 0 "[ . 1 . 2]" 1 61 1 9 TYR QD 1 10 PHE QE 4.690 . 4.690 3.614 2.638 4.454 . 0 0 "[ . 1 . 2]" 1 62 1 9 TYR QD 1 10 PHE HZ 6.000 . 6.000 5.772 5.054 6.268 0.268 4 0 "[ . 1 . 2]" 1 63 1 9 TYR QE 1 10 PHE QD 5.150 . 5.150 4.389 3.761 4.950 . 0 0 "[ . 1 . 2]" 1 64 1 9 TYR QE 1 10 PHE QE 4.700 . 4.700 4.427 2.387 4.811 0.111 11 0 "[ . 1 . 2]" 1 65 1 10 PHE H 1 11 ILE H 4.310 . 4.310 2.695 2.336 2.894 . 0 0 "[ . 1 . 2]" 1 66 1 10 PHE H 1 12 GLU H 5.630 . 5.630 4.200 3.789 4.386 . 0 0 "[ . 1 . 2]" 1 67 1 10 PHE QB 1 37 VAL QG 5.180 . 5.180 4.351 3.766 5.142 . 0 0 "[ . 1 . 2]" 1 68 1 10 PHE QB 1 59 LEU QD 4.400 . 4.400 3.272 2.676 4.157 . 0 0 "[ . 1 . 2]" 1 69 1 10 PHE QB 1 62 ALA H 5.810 . 5.810 5.841 5.330 6.154 0.344 4 0 "[ . 1 . 2]" 1 70 1 10 PHE QB 1 62 ALA MB 4.940 . 4.940 3.364 2.933 3.672 . 0 0 "[ . 1 . 2]" 1 71 1 10 PHE QD 1 33 TYR QE 5.320 . 5.320 2.529 2.285 3.011 . 0 0 "[ . 1 . 2]" 1 72 1 10 PHE QD 1 37 VAL HB 6.000 . 6.000 5.091 4.351 6.139 0.139 11 0 "[ . 1 . 2]" 1 73 1 10 PHE QD 1 37 VAL QG 3.820 . 3.820 2.899 2.229 3.640 . 0 0 "[ . 1 . 2]" 1 74 1 10 PHE QD 1 59 LEU HB2 6.000 . 6.000 5.352 4.849 5.935 . 0 0 "[ . 1 . 2]" 1 75 1 10 PHE QE 1 37 VAL MG1 4.110 . 4.110 2.359 2.100 3.803 . 0 0 "[ . 1 . 2]" 1 76 1 10 PHE QE 1 37 VAL QG 3.510 . 3.510 2.096 1.881 2.994 . 0 0 "[ . 1 . 2]" 1 77 1 10 PHE QE 1 37 VAL MG2 4.110 . 4.110 2.378 2.124 3.133 . 0 0 "[ . 1 . 2]" 1 78 1 10 PHE QE 1 59 LEU QD 3.820 . 3.820 3.322 2.658 4.090 0.270 11 0 "[ . 1 . 2]" 1 79 1 10 PHE HZ 1 37 VAL MG1 4.310 . 4.310 3.783 3.354 4.015 . 0 0 "[ . 1 . 2]" 1 80 1 10 PHE HZ 1 37 VAL QG 3.150 . 3.150 3.419 3.235 3.567 0.417 11 0 "[ . 1 . 2]" 1 81 1 10 PHE HZ 1 37 VAL MG2 4.310 . 4.310 3.968 3.677 4.649 0.339 18 0 "[ . 1 . 2]" 1 82 1 11 ILE H 1 11 ILE HB 3.370 . 3.370 2.522 2.380 2.626 . 0 0 "[ . 1 . 2]" 1 83 1 11 ILE H 1 11 ILE MD 4.030 . 4.030 3.458 3.102 3.610 . 0 0 "[ . 1 . 2]" 1 84 1 11 ILE H 1 11 ILE QG 4.150 . 4.150 2.016 1.841 2.301 . 0 0 "[ . 1 . 2]" 1 85 1 11 ILE H 1 11 ILE MG 4.120 . 4.120 3.751 3.734 3.803 . 0 0 "[ . 1 . 2]" 1 86 1 11 ILE H 1 12 GLU H 4.100 . 4.100 2.657 2.591 2.773 . 0 0 "[ . 1 . 2]" 1 87 1 11 ILE H 1 13 ASN H 6.000 . 6.000 4.049 3.780 4.334 . 0 0 "[ . 1 . 2]" 1 88 1 11 ILE H 1 61 GLU QG 5.810 . 5.810 5.808 5.556 6.069 0.259 8 0 "[ . 1 . 2]" 1 89 1 11 ILE H 1 62 ALA HA 5.830 . 5.830 5.484 5.053 5.890 0.060 12 0 "[ . 1 . 2]" 1 90 1 11 ILE H 1 62 ALA MB 4.380 . 4.380 4.111 3.568 4.348 . 0 0 "[ . 1 . 2]" 1 91 1 11 ILE HA 1 14 LEU MD1 4.200 . 4.200 2.224 2.052 2.389 . 0 0 "[ . 1 . 2]" 1 92 1 11 ILE HA 1 14 LEU MD2 4.200 . 4.200 3.864 3.032 4.229 0.029 13 0 "[ . 1 . 2]" 1 93 1 11 ILE HA 1 15 LYS H 5.520 . 5.520 4.605 4.117 5.019 . 0 0 "[ . 1 . 2]" 1 94 1 11 ILE HA 1 62 ALA MB 6.000 . 6.000 3.064 2.687 3.325 . 0 0 "[ . 1 . 2]" 1 95 1 11 ILE HB 1 11 ILE MD 2.980 . 2.980 2.330 2.279 2.386 . 0 0 "[ . 1 . 2]" 1 96 1 11 ILE HB 1 12 GLU H 3.020 . 3.020 2.503 2.310 2.790 . 0 0 "[ . 1 . 2]" 1 97 1 11 ILE HB 1 61 GLU QG 5.810 . 5.810 5.827 5.416 6.111 0.301 13 0 "[ . 1 . 2]" 1 98 1 11 ILE MD 1 14 LEU QD 4.100 . 4.100 4.173 3.924 4.590 0.490 16 0 "[ . 1 . 2]" 1 99 1 11 ILE MD 1 61 GLU H 5.890 . 5.890 5.809 5.382 6.112 0.222 13 0 "[ . 1 . 2]" 1 100 1 11 ILE MD 1 61 GLU QB 4.400 . 4.400 4.113 3.591 4.407 0.007 20 0 "[ . 1 . 2]" 1 101 1 11 ILE MD 1 61 GLU QG 4.070 . 4.070 2.541 2.231 3.138 . 0 0 "[ . 1 . 2]" 1 102 1 11 ILE MD 1 62 ALA HA 4.490 . 4.490 2.583 2.338 2.829 . 0 0 "[ . 1 . 2]" 1 103 1 11 ILE MD 1 62 ALA MB 3.560 . 3.560 3.204 2.824 3.450 . 0 0 "[ . 1 . 2]" 1 104 1 11 ILE MD 1 63 TYR H 5.650 . 5.650 5.573 5.394 5.740 0.090 12 0 "[ . 1 . 2]" 1 105 1 11 ILE MD 1 64 ASN H 6.000 . 6.000 6.012 5.672 6.225 0.225 12 0 "[ . 1 . 2]" 1 106 1 11 ILE QG 1 13 ASN H 5.810 . 5.810 5.245 5.064 5.450 . 0 0 "[ . 1 . 2]" 1 107 1 11 ILE QG 1 61 GLU QG 4.170 . 4.170 3.565 3.093 3.869 . 0 0 "[ . 1 . 2]" 1 108 1 11 ILE QG 1 62 ALA H 3.890 . 3.890 4.233 3.937 4.370 0.480 8 0 "[ . 1 . 2]" 1 109 1 11 ILE QG 1 62 ALA HA 3.480 . 3.480 2.292 2.155 2.464 . 0 0 "[ . 1 . 2]" 1 110 1 11 ILE MG 1 12 GLU H 3.790 . 3.790 3.444 3.149 3.588 . 0 0 "[ . 1 . 2]" 1 111 1 11 ILE MG 1 12 GLU QG 4.760 . 4.760 4.369 3.908 4.956 0.196 16 0 "[ . 1 . 2]" 1 112 1 11 ILE MG 1 13 ASN H 6.000 . 6.000 4.609 4.416 4.885 . 0 0 "[ . 1 . 2]" 1 113 1 11 ILE MG 1 14 LEU H 6.000 . 6.000 4.010 3.769 4.200 . 0 0 "[ . 1 . 2]" 1 114 1 11 ILE MG 1 14 LEU HA 6.000 . 6.000 5.575 5.333 5.987 . 0 0 "[ . 1 . 2]" 1 115 1 11 ILE MG 1 14 LEU QD 3.520 . 3.520 2.613 2.242 3.173 . 0 0 "[ . 1 . 2]" 1 116 1 11 ILE MG 1 62 ALA HA 4.500 . 4.500 3.265 2.361 3.925 . 0 0 "[ . 1 . 2]" 1 117 1 11 ILE MG 1 62 ALA MB 3.410 . 3.410 3.385 3.026 3.764 0.354 5 0 "[ . 1 . 2]" 1 118 1 12 GLU H 1 12 GLU QB 3.320 . 3.320 2.322 2.096 2.433 . 0 0 "[ . 1 . 2]" 1 119 1 12 GLU H 1 12 GLU QG 3.700 . 3.700 2.716 2.192 3.911 0.211 7 0 "[ . 1 . 2]" 1 120 1 12 GLU H 1 13 ASN H 3.370 . 3.370 2.796 2.745 2.904 . 0 0 "[ . 1 . 2]" 1 121 1 12 GLU H 1 13 ASN QB 5.030 . 5.030 4.752 4.519 4.987 . 0 0 "[ . 1 . 2]" 1 122 1 12 GLU H 1 14 LEU H 5.650 . 5.650 4.303 4.184 4.438 . 0 0 "[ . 1 . 2]" 1 123 1 12 GLU H 1 14 LEU QD 4.620 . 4.620 4.801 4.341 5.078 0.458 13 0 "[ . 1 . 2]" 1 124 1 12 GLU HA 1 12 GLU QG 3.350 . 3.350 2.482 2.271 3.431 0.081 16 0 "[ . 1 . 2]" 1 125 1 12 GLU QG 1 13 ASN H 5.810 . 5.810 4.174 2.337 4.727 . 0 0 "[ . 1 . 2]" 1 126 1 13 ASN H 1 14 LEU H 4.080 . 4.080 2.527 2.439 2.753 . 0 0 "[ . 1 . 2]" 1 127 1 13 ASN H 1 14 LEU QD 5.380 . 5.380 3.992 3.113 4.401 . 0 0 "[ . 1 . 2]" 1 128 1 13 ASN H 1 15 LYS H 5.010 . 5.010 4.080 3.979 4.318 . 0 0 "[ . 1 . 2]" 1 129 1 13 ASN H 1 33 TYR QE 5.630 . 5.630 5.723 5.332 5.902 0.272 20 0 "[ . 1 . 2]" 1 130 1 13 ASN QB 1 15 LYS H 5.810 . 5.810 4.764 4.654 4.903 . 0 0 "[ . 1 . 2]" 1 131 1 13 ASN QB 1 33 TYR QE 4.450 . 4.450 3.374 3.047 4.252 . 0 0 "[ . 1 . 2]" 1 132 1 14 LEU H 1 14 LEU QB 3.540 . 3.540 2.535 2.308 2.659 . 0 0 "[ . 1 . 2]" 1 133 1 14 LEU H 1 14 LEU MD1 3.960 . 3.960 3.126 1.724 3.490 0.076 16 0 "[ . 1 . 2]" 1 134 1 14 LEU H 1 14 LEU QD 3.380 . 3.380 2.579 1.722 2.889 0.078 16 0 "[ . 1 . 2]" 1 135 1 14 LEU H 1 14 LEU MD2 3.960 . 3.960 3.130 2.706 4.103 0.143 4 0 "[ . 1 . 2]" 1 136 1 14 LEU H 1 14 LEU HG 3.830 . 3.830 2.160 1.762 3.703 0.038 18 0 "[ . 1 . 2]" 1 137 1 14 LEU H 1 15 LYS H 4.240 . 4.240 2.555 2.478 2.696 . 0 0 "[ . 1 . 2]" 1 138 1 14 LEU H 1 15 LYS HA 5.960 . 5.960 5.159 5.084 5.286 . 0 0 "[ . 1 . 2]" 1 139 1 14 LEU H 1 16 GLN H 5.850 . 5.850 4.104 3.807 4.314 . 0 0 "[ . 1 . 2]" 1 140 1 14 LEU H 1 33 TYR QB 5.810 . 5.810 5.813 5.419 6.020 0.210 2 0 "[ . 1 . 2]" 1 141 1 14 LEU H 1 33 TYR QE 6.000 . 6.000 5.482 5.113 5.843 . 0 0 "[ . 1 . 2]" 1 142 1 14 LEU HA 1 18 ILE MD 6.000 . 6.000 5.351 5.111 5.769 . 0 0 "[ . 1 . 2]" 1 143 1 14 LEU HA 1 18 ILE QG 6.000 . 6.000 5.259 4.789 6.039 0.039 15 0 "[ . 1 . 2]" 1 144 1 14 LEU HA 1 29 ALA MB 4.230 . 4.230 3.713 3.144 4.145 . 0 0 "[ . 1 . 2]" 1 145 1 14 LEU HA 1 33 TYR QB 5.690 . 5.690 4.427 3.936 4.780 . 0 0 "[ . 1 . 2]" 1 146 1 14 LEU QB 1 18 ILE MD 4.850 . 4.850 3.933 3.695 4.320 . 0 0 "[ . 1 . 2]" 1 147 1 14 LEU QB 1 18 ILE MG 3.940 . 3.940 3.734 3.536 3.912 . 0 0 "[ . 1 . 2]" 1 148 1 14 LEU QD 1 15 LYS H 3.800 . 3.800 3.905 3.555 4.016 0.216 12 0 "[ . 1 . 2]" 1 149 1 14 LEU QD 1 17 HIS H 5.920 . 5.920 4.805 4.584 5.378 . 0 0 "[ . 1 . 2]" 1 150 1 14 LEU QD 1 29 ALA H 5.920 . 5.920 5.627 5.135 6.137 0.217 16 0 "[ . 1 . 2]" 1 151 1 14 LEU QD 1 29 ALA MB 5.920 . 5.920 3.354 2.442 4.059 . 0 0 "[ . 1 . 2]" 1 152 1 14 LEU QD 1 30 MET H 5.920 . 5.920 4.076 3.498 4.477 . 0 0 "[ . 1 . 2]" 1 153 1 14 LEU QD 1 30 MET HA 4.690 . 4.690 2.684 2.180 3.298 . 0 0 "[ . 1 . 2]" 1 154 1 14 LEU QD 1 33 TYR H 5.920 . 5.920 4.319 3.986 4.805 . 0 0 "[ . 1 . 2]" 1 155 1 14 LEU QD 1 33 TYR QB 5.070 . 5.070 2.441 2.136 2.991 . 0 0 "[ . 1 . 2]" 1 156 1 14 LEU QD 1 33 TYR QD 3.780 . 3.780 2.459 2.204 2.603 . 0 0 "[ . 1 . 2]" 1 157 1 14 LEU QD 1 33 TYR QE 3.890 . 3.890 2.984 2.324 3.347 . 0 0 "[ . 1 . 2]" 1 158 1 14 LEU QD 1 34 TYR H 5.870 . 5.870 4.183 3.613 4.852 . 0 0 "[ . 1 . 2]" 1 159 1 14 LEU QD 1 59 LEU QD 4.520 . 4.520 3.535 2.951 3.951 . 0 0 "[ . 1 . 2]" 1 160 1 14 LEU QD 1 61 GLU QG 5.730 . 5.730 5.322 5.126 5.476 . 0 0 "[ . 1 . 2]" 1 161 1 14 LEU QD 1 62 ALA HA 3.880 . 3.880 3.647 3.486 3.918 0.038 15 0 "[ . 1 . 2]" 1 162 1 14 LEU QD 1 62 ALA MB 2.930 . 2.930 2.157 1.999 2.244 . 0 0 "[ . 1 . 2]" 1 163 1 14 LEU QD 1 63 TYR H 5.440 . 5.440 4.027 3.562 4.508 . 0 0 "[ . 1 . 2]" 1 164 1 14 LEU QD 1 63 TYR HA 4.160 . 4.160 3.339 2.711 4.171 0.011 2 0 "[ . 1 . 2]" 1 165 1 14 LEU QD 1 66 VAL H 5.920 . 5.920 3.971 3.551 4.246 . 0 0 "[ . 1 . 2]" 1 166 1 14 LEU QD 1 66 VAL HB 3.940 . 3.940 3.875 2.443 4.090 0.150 12 0 "[ . 1 . 2]" 1 167 1 14 LEU MD1 1 62 ALA H 6.000 . 6.000 5.201 4.789 6.246 0.246 19 0 "[ . 1 . 2]" 1 168 1 14 LEU MD1 1 62 ALA MB 3.910 . 3.910 2.253 2.006 3.110 . 0 0 "[ . 1 . 2]" 1 169 1 14 LEU MD2 1 62 ALA MB 3.910 . 3.910 3.693 2.148 4.074 0.164 15 0 "[ . 1 . 2]" 1 170 1 14 LEU HG 1 33 TYR QD 6.000 . 6.000 4.424 3.144 4.893 . 0 0 "[ . 1 . 2]" 1 171 1 14 LEU HG 1 33 TYR QE 4.770 . 4.770 4.592 3.764 4.920 0.150 15 0 "[ . 1 . 2]" 1 172 1 15 LYS H 1 15 LYS QB 3.390 . 3.390 2.364 2.176 2.546 . 0 0 "[ . 1 . 2]" 1 173 1 15 LYS H 1 16 GLN H 3.390 . 3.390 2.720 2.621 2.815 . 0 0 "[ . 1 . 2]" 1 174 1 15 LYS H 1 18 ILE MD 4.400 . 4.400 4.467 4.323 4.625 0.225 19 0 "[ . 1 . 2]" 1 175 1 15 LYS H 1 18 ILE MG 5.060 . 5.060 5.112 4.472 5.270 0.210 12 0 "[ . 1 . 2]" 1 176 1 15 LYS HA 1 18 ILE H 4.440 . 4.440 3.599 3.365 3.745 . 0 0 "[ . 1 . 2]" 1 177 1 15 LYS HA 1 18 ILE MD 3.940 . 3.940 2.416 2.321 2.530 . 0 0 "[ . 1 . 2]" 1 178 1 15 LYS HA 1 18 ILE QG 3.480 . 3.480 2.260 2.198 2.313 . 0 0 "[ . 1 . 2]" 1 179 1 15 LYS HA 1 18 ILE MG 5.280 . 5.280 3.645 2.726 3.920 . 0 0 "[ . 1 . 2]" 1 180 1 15 LYS QB 1 16 GLN H 3.150 . 3.150 2.660 2.517 2.887 . 0 0 "[ . 1 . 2]" 1 181 1 16 GLN H 1 20 MET H 6.000 . 6.000 5.390 4.995 5.877 . 0 0 "[ . 1 . 2]" 1 182 1 16 GLN HA 1 16 GLN QG 3.170 . 3.170 2.332 2.311 2.370 . 0 0 "[ . 1 . 2]" 1 183 1 16 GLN HA 1 20 MET ME 4.710 . 4.710 3.357 3.000 4.050 . 0 0 "[ . 1 . 2]" 1 184 1 16 GLN HA 1 22 GLN H 6.000 . 6.000 6.182 6.047 6.278 0.278 14 0 "[ . 1 . 2]" 1 185 1 16 GLN QG 1 17 HIS HA 4.440 . 4.440 3.726 3.575 3.944 . 0 0 "[ . 1 . 2]" 1 186 1 16 GLN QG 1 18 ILE H 5.810 . 5.810 5.541 5.300 5.833 0.023 15 0 "[ . 1 . 2]" 1 187 1 16 GLN QG 1 20 MET H 4.500 . 4.500 3.703 3.418 4.517 0.017 15 0 "[ . 1 . 2]" 1 188 1 16 GLN QG 1 21 ASN H 4.450 . 4.450 4.251 3.353 4.608 0.158 18 0 "[ . 1 . 2]" 1 189 1 16 GLN QG 1 22 GLN H 4.060 . 4.060 3.825 3.542 4.126 0.066 8 0 "[ . 1 . 2]" 1 190 1 16 GLN HG2 1 17 HIS H 6.000 . 6.000 4.002 3.803 4.201 . 0 0 "[ . 1 . 2]" 1 191 1 16 GLN HG2 1 21 ASN H 5.170 . 5.170 4.550 3.482 5.010 . 0 0 "[ . 1 . 2]" 1 192 1 16 GLN HG3 1 17 HIS H 6.000 . 6.000 4.806 4.653 4.996 . 0 0 "[ . 1 . 2]" 1 193 1 16 GLN HG3 1 21 ASN H 5.170 . 5.170 5.137 4.374 5.382 0.212 18 0 "[ . 1 . 2]" 1 194 1 17 HIS H 1 19 GLU H 4.010 . 4.010 3.954 3.774 4.065 0.055 1 0 "[ . 1 . 2]" 1 195 1 17 HIS H 1 20 MET ME 6.000 . 6.000 6.022 5.698 6.238 0.238 10 0 "[ . 1 . 2]" 1 196 1 17 HIS H 1 24 GLU HB3 6.000 . 6.000 5.588 5.237 5.797 . 0 0 "[ . 1 . 2]" 1 197 1 17 HIS H 1 24 GLU HG2 6.000 . 6.000 5.925 5.534 6.271 0.271 4 0 "[ . 1 . 2]" 1 198 1 17 HIS HA 1 19 GLU H 6.000 . 6.000 4.727 4.341 4.884 . 0 0 "[ . 1 . 2]" 1 199 1 17 HIS HA 1 20 MET H 6.000 . 6.000 4.056 3.300 4.224 . 0 0 "[ . 1 . 2]" 1 200 1 17 HIS HA 1 20 MET QG 5.810 . 5.810 5.596 3.675 5.980 0.170 7 0 "[ . 1 . 2]" 1 201 1 17 HIS HA 1 25 ASP H 6.000 . 6.000 4.886 4.487 6.005 0.005 4 0 "[ . 1 . 2]" 1 202 1 17 HIS QB 1 18 ILE MG 4.060 . 4.060 2.817 2.696 2.947 . 0 0 "[ . 1 . 2]" 1 203 1 17 HIS QB 1 19 GLU H 4.750 . 4.750 4.520 4.406 4.579 . 0 0 "[ . 1 . 2]" 1 204 1 18 ILE H 1 18 ILE MD 4.990 . 4.990 3.453 3.394 3.698 . 0 0 "[ . 1 . 2]" 1 205 1 18 ILE H 1 18 ILE QG 3.550 . 3.550 2.042 1.852 2.690 . 0 0 "[ . 1 . 2]" 1 206 1 18 ILE H 1 18 ILE MG 4.430 . 4.430 2.113 1.777 2.227 0.023 15 0 "[ . 1 . 2]" 1 207 1 18 ILE H 1 19 GLU H 3.540 . 3.540 2.565 2.502 2.791 . 0 0 "[ . 1 . 2]" 1 208 1 18 ILE H 1 20 MET H 5.930 . 5.930 4.253 3.893 4.483 . 0 0 "[ . 1 . 2]" 1 209 1 18 ILE H 1 25 ASP H 6.000 . 6.000 6.019 5.835 6.374 0.374 4 0 "[ . 1 . 2]" 1 210 1 18 ILE H 1 29 ALA MB 4.930 . 4.930 3.771 3.476 4.286 . 0 0 "[ . 1 . 2]" 1 211 1 18 ILE HA 1 18 ILE MD 4.490 . 4.490 4.164 4.130 4.198 . 0 0 "[ . 1 . 2]" 1 212 1 18 ILE HA 1 26 LYS QB 4.180 . 4.180 4.253 4.114 4.614 0.434 4 0 "[ . 1 . 2]" 1 213 1 18 ILE HA 1 26 LYS QG 4.770 . 4.770 3.388 3.015 3.591 . 0 0 "[ . 1 . 2]" 1 214 1 18 ILE HB 1 19 GLU HA 4.760 . 4.760 4.568 4.422 4.868 0.108 15 0 "[ . 1 . 2]" 1 215 1 18 ILE MD 1 19 GLU HA 6.000 . 6.000 4.689 4.540 4.774 . 0 0 "[ . 1 . 2]" 1 216 1 18 ILE MD 1 26 LYS HA 4.870 . 4.870 4.985 4.182 5.223 0.353 18 0 "[ . 1 . 2]" 1 217 1 18 ILE MD 1 26 LYS QG 4.130 . 4.130 4.231 4.087 4.505 0.375 18 0 "[ . 1 . 2]" 1 218 1 18 ILE MD 1 29 ALA MB 4.550 . 4.550 4.475 4.063 4.677 0.127 15 0 "[ . 1 . 2]" 1 219 1 18 ILE MD 1 69 GLY H 6.000 . 6.000 5.373 4.766 6.138 0.138 8 0 "[ . 1 . 2]" 1 220 1 18 ILE MD 1 70 GLU QG 4.940 . 4.940 3.891 2.606 4.948 0.008 7 0 "[ . 1 . 2]" 1 221 1 18 ILE QG 1 18 ILE MG . . 3.190 2.348 2.281 2.403 . 0 0 "[ . 1 . 2]" 1 222 1 18 ILE QG 1 29 ALA MB 5.350 . 5.350 4.716 4.280 5.440 0.090 15 0 "[ . 1 . 2]" 1 223 1 18 ILE MG 1 19 GLU H 4.720 . 4.720 3.747 3.486 3.871 . 0 0 "[ . 1 . 2]" 1 224 1 18 ILE MG 1 24 GLU QG 5.290 . 5.290 5.066 4.770 5.348 0.058 4 0 "[ . 1 . 2]" 1 225 1 18 ILE MG 1 26 LYS HA 3.550 . 3.550 2.364 2.144 2.801 . 0 0 "[ . 1 . 2]" 1 226 1 18 ILE MG 1 26 LYS QG 3.370 . 3.370 2.982 2.765 3.359 . 0 0 "[ . 1 . 2]" 1 227 1 18 ILE MG 1 29 ALA MB 3.620 . 3.620 2.561 2.183 3.000 . 0 0 "[ . 1 . 2]" 1 228 1 18 ILE MG 1 30 MET H 5.680 . 5.680 4.647 4.201 5.612 . 0 0 "[ . 1 . 2]" 1 229 1 19 GLU H 1 19 GLU QG 4.650 . 4.650 3.761 2.212 4.077 . 0 0 "[ . 1 . 2]" 1 230 1 19 GLU H 1 20 MET ME 5.850 . 5.850 5.781 5.536 6.078 0.228 14 0 "[ . 1 . 2]" 1 231 1 19 GLU H 1 26 LYS QG 5.810 . 5.810 6.040 5.717 6.260 0.450 15 0 "[ . 1 . 2]" 1 232 1 19 GLU HA 1 19 GLU QG 3.550 . 3.550 2.627 2.323 2.873 . 0 0 "[ . 1 . 2]" 1 233 1 20 MET H 1 21 ASN HA 6.000 . 6.000 4.780 4.362 5.103 . 0 0 "[ . 1 . 2]" 1 234 1 20 MET H 1 21 ASN QB 5.810 . 5.810 5.109 4.024 5.930 0.120 17 0 "[ . 1 . 2]" 1 235 1 20 MET HA 1 20 MET QG 3.330 . 3.330 2.413 2.204 3.308 . 0 0 "[ . 1 . 2]" 1 236 1 20 MET QB 1 21 ASN H 3.280 . 3.280 1.901 1.684 2.201 0.116 18 0 "[ . 1 . 2]" 1 237 1 20 MET QB 1 22 GLN H 4.310 . 4.310 3.052 2.530 3.778 . 0 0 "[ . 1 . 2]" 1 238 1 21 ASN H 1 21 ASN QB 3.280 . 3.280 2.914 2.684 3.309 0.029 11 0 "[ . 1 . 2]" 1 239 1 21 ASN H 1 22 GLN H 3.900 . 3.900 2.520 2.180 3.021 . 0 0 "[ . 1 . 2]" 1 240 1 21 ASN H 1 22 GLN HA 4.480 . 4.480 4.167 3.910 4.834 0.354 16 0 "[ . 1 . 2]" 1 241 1 21 ASN H 1 22 GLN QB 4.160 . 4.160 4.025 3.832 4.334 0.174 7 0 "[ . 1 . 2]" 1 242 1 21 ASN HA 1 22 GLN H 3.420 . 3.420 2.683 2.430 2.877 . 0 0 "[ . 1 . 2]" 1 243 1 21 ASN HA 1 22 GLN QB 5.810 . 5.810 4.481 4.374 4.700 . 0 0 "[ . 1 . 2]" 1 244 1 21 ASN HA 1 23 SER H 4.540 . 4.540 3.694 3.371 4.282 . 0 0 "[ . 1 . 2]" 1 245 1 21 ASN HA 1 24 GLU H 6.000 . 6.000 3.747 3.350 4.625 . 0 0 "[ . 1 . 2]" 1 246 1 21 ASN HA 1 24 GLU HB2 6.000 . 6.000 5.084 3.959 6.312 0.312 15 0 "[ . 1 . 2]" 1 247 1 21 ASN QB 1 24 GLU H 5.810 . 5.810 4.701 3.727 5.840 0.030 15 0 "[ . 1 . 2]" 1 248 1 22 GLN H 1 22 GLN QB 3.340 . 3.340 2.243 2.168 2.415 . 0 0 "[ . 1 . 2]" 1 249 1 22 GLN H 1 22 GLN QG 4.880 . 4.880 3.898 2.087 4.081 . 0 0 "[ . 1 . 2]" 1 250 1 22 GLN H 1 24 GLU H 4.710 . 4.710 4.597 3.702 4.844 0.134 20 0 "[ . 1 . 2]" 1 251 1 22 GLN HA 1 22 GLN QG 3.320 . 3.320 2.517 2.319 2.809 . 0 0 "[ . 1 . 2]" 1 252 1 22 GLN HA 1 23 SER H 3.550 . 3.550 3.426 2.645 3.568 0.018 15 0 "[ . 1 . 2]" 1 253 1 22 GLN QB 1 23 SER H 3.590 . 3.590 2.608 2.045 3.931 0.341 13 0 "[ . 1 . 2]" 1 254 1 22 GLN HB2 1 23 SER H 4.160 . 4.160 3.756 2.081 4.575 0.415 13 0 "[ . 1 . 2]" 1 255 1 22 GLN HB3 1 23 SER H 4.160 . 4.160 2.733 2.249 4.284 0.124 13 0 "[ . 1 . 2]" 1 256 1 22 GLN QG 1 23 SER H 4.370 . 4.370 3.822 3.454 4.425 0.055 1 0 "[ . 1 . 2]" 1 257 1 23 SER H 1 24 GLU H 3.390 . 3.390 2.716 1.685 3.040 0.115 4 0 "[ . 1 . 2]" 1 258 1 23 SER H 1 24 GLU HA 5.600 . 5.600 4.793 4.373 5.224 . 0 0 "[ . 1 . 2]" 1 259 1 23 SER H 1 24 GLU HB2 4.220 . 4.220 3.643 3.353 4.598 0.378 9 0 "[ . 1 . 2]" 1 260 1 24 GLU H 1 24 GLU HB2 3.590 . 3.590 3.198 2.593 3.313 . 0 0 "[ . 1 . 2]" 1 261 1 24 GLU H 1 24 GLU QG 4.410 . 4.410 4.367 4.145 4.411 0.001 15 0 "[ . 1 . 2]" 1 262 1 24 GLU H 1 25 ASP H 4.410 . 4.410 4.013 3.920 4.397 . 0 0 "[ . 1 . 2]" 1 263 1 24 GLU HA 1 24 GLU QG 3.570 . 3.570 2.563 2.407 2.634 . 0 0 "[ . 1 . 2]" 1 264 1 24 GLU HA 1 25 ASP HB3 6.000 . 6.000 5.758 5.609 5.830 . 0 0 "[ . 1 . 2]" 1 265 1 24 GLU HB2 1 25 ASP H 3.750 . 3.750 3.300 3.242 3.683 . 0 0 "[ . 1 . 2]" 1 266 1 24 GLU HB3 1 25 ASP H 6.000 . 6.000 1.890 1.831 2.231 . 0 0 "[ . 1 . 2]" 1 267 1 24 GLU HB3 1 29 ALA MB 5.100 . 5.100 3.483 2.148 4.239 . 0 0 "[ . 1 . 2]" 1 268 1 24 GLU QG 1 29 ALA H 4.360 . 4.360 4.384 4.121 4.653 0.293 14 0 "[ . 1 . 2]" 1 269 1 24 GLU QG 1 29 ALA MB 3.650 . 3.650 2.569 2.276 3.027 . 0 0 "[ . 1 . 2]" 1 270 1 24 GLU QG 1 32 SER H 5.050 . 5.050 4.705 4.126 5.052 0.002 15 0 "[ . 1 . 2]" 1 271 1 24 GLU QG 1 33 TYR H 4.310 . 4.310 4.267 3.771 4.532 0.222 17 0 "[ . 1 . 2]" 1 272 1 25 ASP H 1 26 LYS HA 6.000 . 6.000 4.873 4.825 4.986 . 0 0 "[ . 1 . 2]" 1 273 1 25 ASP H 1 28 HIS H 6.000 . 6.000 5.890 4.640 6.127 0.127 16 0 "[ . 1 . 2]" 1 274 1 25 ASP H 1 29 ALA MB 3.800 . 3.800 2.956 2.630 3.596 . 0 0 "[ . 1 . 2]" 1 275 1 25 ASP HA 1 26 LYS QB 5.300 . 5.300 4.314 4.202 4.919 . 0 0 "[ . 1 . 2]" 1 276 1 25 ASP HB2 1 28 HIS H 3.710 . 3.710 3.725 2.947 3.883 0.173 15 0 "[ . 1 . 2]" 1 277 1 25 ASP HB2 1 29 ALA H 4.460 . 4.460 3.723 2.998 4.035 . 0 0 "[ . 1 . 2]" 1 278 1 25 ASP HB2 1 30 MET H 5.830 . 5.830 5.980 5.635 6.164 0.334 13 0 "[ . 1 . 2]" 1 279 1 25 ASP HB3 1 26 LYS H 4.390 . 4.390 1.888 1.794 2.332 0.006 11 0 "[ . 1 . 2]" 1 280 1 26 LYS H 1 26 LYS HB2 4.060 . 4.060 2.585 2.503 2.707 . 0 0 "[ . 1 . 2]" 1 281 1 26 LYS H 1 26 LYS QB 3.560 . 3.560 2.307 2.267 2.464 . 0 0 "[ . 1 . 2]" 1 282 1 26 LYS H 1 26 LYS HB3 4.060 . 4.060 2.627 2.542 3.689 . 0 0 "[ . 1 . 2]" 1 283 1 26 LYS H 1 26 LYS HG2 5.140 . 5.140 4.458 3.944 4.507 . 0 0 "[ . 1 . 2]" 1 284 1 26 LYS H 1 26 LYS QG 4.420 . 4.420 3.928 2.746 4.028 . 0 0 "[ . 1 . 2]" 1 285 1 26 LYS H 1 26 LYS HG3 5.140 . 5.140 4.390 2.802 4.535 . 0 0 "[ . 1 . 2]" 1 286 1 26 LYS H 1 27 ILE H 3.810 . 3.810 3.461 2.931 3.552 . 0 0 "[ . 1 . 2]" 1 287 1 26 LYS H 1 27 ILE MG 6.000 . 6.000 4.807 4.069 6.260 0.260 11 0 "[ . 1 . 2]" 1 288 1 26 LYS HA 1 26 LYS QG 3.650 . 3.650 2.314 2.292 2.346 . 0 0 "[ . 1 . 2]" 1 289 1 26 LYS HA 1 29 ALA H 4.980 . 4.980 4.538 3.959 4.796 . 0 0 "[ . 1 . 2]" 1 290 1 26 LYS HA 1 29 ALA MB 3.650 . 3.650 3.609 3.108 3.710 0.060 6 0 "[ . 1 . 2]" 1 291 1 26 LYS QB 1 27 ILE QG 5.610 . 5.610 4.661 2.643 5.335 . 0 0 "[ . 1 . 2]" 1 292 1 26 LYS QB 1 29 ALA H 5.810 . 5.810 4.856 4.541 5.119 . 0 0 "[ . 1 . 2]" 1 293 1 26 LYS QG 1 27 ILE H 4.410 . 4.410 2.213 2.040 3.837 . 0 0 "[ . 1 . 2]" 1 294 1 26 LYS QG 1 29 ALA H 5.810 . 5.810 5.105 4.967 5.408 . 0 0 "[ . 1 . 2]" 1 295 1 26 LYS HG2 1 27 ILE H 5.130 . 5.130 2.264 2.056 4.505 . 0 0 "[ . 1 . 2]" 1 296 1 26 LYS HG3 1 27 ILE H 5.130 . 5.130 3.543 3.429 4.156 . 0 0 "[ . 1 . 2]" 1 297 1 27 ILE H 1 27 ILE MD 5.000 . 5.000 4.028 2.667 4.307 . 0 0 "[ . 1 . 2]" 1 298 1 27 ILE H 1 27 ILE MG 3.910 . 3.910 2.558 1.880 3.780 . 0 0 "[ . 1 . 2]" 1 299 1 27 ILE H 1 28 HIS H 3.960 . 3.960 2.630 2.554 2.715 . 0 0 "[ . 1 . 2]" 1 300 1 27 ILE H 1 29 ALA H 5.650 . 5.650 4.094 3.940 4.247 . 0 0 "[ . 1 . 2]" 1 301 1 27 ILE HA 1 27 ILE MD 3.320 . 3.320 3.134 2.099 3.720 0.400 3 0 "[ . 1 . 2]" 1 302 1 27 ILE HA 1 66 VAL QG 5.340 . 5.340 2.857 2.394 3.575 . 0 0 "[ . 1 . 2]" 1 303 1 27 ILE HA 1 67 LYS QD 4.950 . 4.950 4.925 3.720 5.383 0.433 17 0 "[ . 1 . 2]" 1 304 1 27 ILE HB 1 27 ILE MD 3.280 . 3.280 2.477 2.264 3.233 . 0 0 "[ . 1 . 2]" 1 305 1 27 ILE HB 1 29 ALA H 6.000 . 6.000 5.027 4.563 5.295 . 0 0 "[ . 1 . 2]" 1 306 1 27 ILE MD 1 63 TYR QE 6.000 . 6.000 5.356 4.213 6.299 0.299 8 0 "[ . 1 . 2]" 1 307 1 27 ILE MD 1 67 LYS H 6.000 . 6.000 4.725 3.647 5.257 . 0 0 "[ . 1 . 2]" 1 308 1 27 ILE MD 1 67 LYS HA 4.100 . 4.100 2.880 2.151 3.329 . 0 0 "[ . 1 . 2]" 1 309 1 27 ILE MD 1 67 LYS HB3 6.000 . 6.000 3.659 2.852 4.578 . 0 0 "[ . 1 . 2]" 1 310 1 27 ILE MD 1 67 LYS QD 2.680 . 2.680 2.231 2.039 2.712 0.032 15 0 "[ . 1 . 2]" 1 311 1 27 ILE MD 1 67 LYS HG3 4.930 . 4.930 4.318 3.560 4.985 0.055 16 0 "[ . 1 . 2]" 1 312 1 27 ILE MD 1 68 ARG H 6.000 . 6.000 5.795 4.973 6.247 0.247 7 0 "[ . 1 . 2]" 1 313 1 27 ILE MD 1 69 GLY H 6.000 . 6.000 5.926 5.238 6.313 0.313 9 0 "[ . 1 . 2]" 1 314 1 27 ILE MD 1 70 GLU H 5.250 . 5.250 4.857 4.171 5.282 0.032 17 0 "[ . 1 . 2]" 1 315 1 27 ILE MD 1 70 GLU QB 5.400 . 5.400 3.045 2.192 4.020 . 0 0 "[ . 1 . 2]" 1 316 1 27 ILE MD 1 70 GLU QG 5.810 . 5.810 2.627 2.094 4.365 . 0 0 "[ . 1 . 2]" 1 317 1 27 ILE MD 1 71 SER H 4.980 . 4.980 4.522 3.640 5.148 0.168 8 0 "[ . 1 . 2]" 1 318 1 27 ILE QG 1 27 ILE MG 3.170 . 3.170 2.260 2.118 2.513 . 0 0 "[ . 1 . 2]" 1 319 1 27 ILE QG 1 71 SER H 5.810 . 5.810 5.785 5.277 6.077 0.267 8 0 "[ . 1 . 2]" 1 320 1 27 ILE MG 1 28 HIS H 6.000 . 6.000 2.450 1.828 3.945 . 0 0 "[ . 1 . 2]" 1 321 1 27 ILE MG 1 29 ALA H 6.000 . 6.000 4.097 3.938 4.819 . 0 0 "[ . 1 . 2]" 1 322 1 27 ILE MG 1 29 ALA MB 5.400 . 5.400 5.012 4.739 5.522 0.122 4 0 "[ . 1 . 2]" 1 323 1 27 ILE MG 1 30 MET H 6.000 . 6.000 5.057 4.086 5.843 . 0 0 "[ . 1 . 2]" 1 324 1 27 ILE MG 1 31 ASN H 5.860 . 5.860 5.254 4.378 5.852 . 0 0 "[ . 1 . 2]" 1 325 1 27 ILE MG 1 67 LYS QD 5.750 . 5.750 3.895 1.938 5.044 . 0 0 "[ . 1 . 2]" 1 326 1 28 HIS H 1 29 ALA H 4.150 . 4.150 2.799 2.388 2.979 . 0 0 "[ . 1 . 2]" 1 327 1 28 HIS H 1 30 MET H 5.610 . 5.610 4.973 4.554 5.380 . 0 0 "[ . 1 . 2]" 1 328 1 29 ALA H 1 30 MET H 3.640 . 3.640 2.592 2.438 2.857 . 0 0 "[ . 1 . 2]" 1 329 1 29 ALA H 1 31 ASN H 6.000 . 6.000 4.090 3.798 4.525 . 0 0 "[ . 1 . 2]" 1 330 1 29 ALA H 1 66 VAL QG 4.130 . 4.130 3.980 3.594 4.297 0.167 4 0 "[ . 1 . 2]" 1 331 1 29 ALA MB 1 30 MET HA 6.000 . 6.000 3.783 3.747 3.822 . 0 0 "[ . 1 . 2]" 1 332 1 29 ALA MB 1 31 ASN H 6.000 . 6.000 4.539 4.247 4.729 . 0 0 "[ . 1 . 2]" 1 333 1 29 ALA MB 1 33 TYR H 6.000 . 6.000 4.446 4.286 4.822 . 0 0 "[ . 1 . 2]" 1 334 1 29 ALA MB 1 33 TYR QB 4.280 . 4.280 3.866 3.573 4.359 0.079 20 0 "[ . 1 . 2]" 1 335 1 29 ALA MB 1 66 VAL HB 5.610 . 5.610 5.228 4.677 5.555 . 0 0 "[ . 1 . 2]" 1 336 1 30 MET H 1 31 ASN H 4.010 . 4.010 2.717 2.636 2.773 . 0 0 "[ . 1 . 2]" 1 337 1 30 MET H 1 32 SER H 4.480 . 4.480 4.374 4.110 4.588 0.108 20 0 "[ . 1 . 2]" 1 338 1 30 MET H 1 33 TYR QB 4.410 . 4.410 4.594 4.447 4.738 0.328 20 0 "[ . 1 . 2]" 1 339 1 30 MET H 1 33 TYR QD 6.000 . 6.000 6.242 5.462 6.434 0.434 5 0 "[ . 1 . 2]" 1 340 1 30 MET H 1 66 VAL HB 4.480 . 4.480 4.749 4.614 4.933 0.453 14 0 "[ . 1 . 2]" 1 341 1 30 MET H 1 66 VAL MG1 3.880 . 3.880 3.115 2.660 3.559 . 0 0 "[ . 1 . 2]" 1 342 1 30 MET H 1 66 VAL MG2 3.960 . 3.960 3.896 3.225 4.454 0.494 14 0 "[ . 1 . 2]" 1 343 1 30 MET H 1 67 LYS QD 5.770 . 5.770 6.087 5.903 6.263 0.493 20 0 "[ . 1 . 2]" 1 344 1 30 MET HA 1 33 TYR H 4.440 . 4.440 3.559 3.332 3.846 . 0 0 "[ . 1 . 2]" 1 345 1 30 MET HA 1 33 TYR QB 5.810 . 5.810 2.488 2.328 2.718 . 0 0 "[ . 1 . 2]" 1 346 1 30 MET HA 1 34 TYR H 3.890 . 3.890 3.177 2.377 3.880 . 0 0 "[ . 1 . 2]" 1 347 1 30 MET HA 1 66 VAL MG1 5.200 . 5.200 4.370 3.641 4.966 . 0 0 "[ . 1 . 2]" 1 348 1 30 MET HA 1 66 VAL QG 4.120 . 4.120 3.507 3.076 4.266 0.146 14 0 "[ . 1 . 2]" 1 349 1 30 MET HA 1 66 VAL MG2 5.200 . 5.200 3.708 3.208 4.647 . 0 0 "[ . 1 . 2]" 1 350 1 30 MET ME 1 31 ASN H 5.730 . 5.730 3.137 2.258 5.299 . 0 0 "[ . 1 . 2]" 1 351 1 31 ASN H 1 32 SER H 4.390 . 4.390 2.894 2.826 3.044 . 0 0 "[ . 1 . 2]" 1 352 1 31 ASN H 1 33 TYR H 6.000 . 6.000 4.447 4.320 4.626 . 0 0 "[ . 1 . 2]" 1 353 1 31 ASN H 1 33 TYR QB 5.030 . 5.030 5.045 4.914 5.231 0.201 14 0 "[ . 1 . 2]" 1 354 1 32 SER H 1 33 TYR H 3.910 . 3.910 2.737 2.517 2.853 . 0 0 "[ . 1 . 2]" 1 355 1 32 SER H 1 33 TYR QB 5.810 . 5.810 4.435 4.201 4.568 . 0 0 "[ . 1 . 2]" 1 356 1 32 SER H 1 34 TYR H 6.000 . 6.000 4.024 3.753 4.299 . 0 0 "[ . 1 . 2]" 1 357 1 33 TYR H 1 33 TYR HB2 3.880 . 3.880 2.589 2.486 2.987 . 0 0 "[ . 1 . 2]" 1 358 1 33 TYR H 1 33 TYR QB 3.300 . 3.300 2.237 2.125 2.261 . 0 0 "[ . 1 . 2]" 1 359 1 33 TYR H 1 33 TYR HB3 3.880 . 3.880 2.469 2.175 2.558 . 0 0 "[ . 1 . 2]" 1 360 1 33 TYR H 1 33 TYR QD 4.910 . 4.910 4.143 3.810 4.181 . 0 0 "[ . 1 . 2]" 1 361 1 33 TYR H 1 34 TYR H 3.850 . 3.850 2.718 2.537 2.817 . 0 0 "[ . 1 . 2]" 1 362 1 33 TYR H 1 37 VAL H 6.000 . 6.000 6.098 5.988 6.263 0.263 14 0 "[ . 1 . 2]" 1 363 1 33 TYR QB 1 34 TYR H 4.050 . 4.050 2.536 2.286 3.108 . 0 0 "[ . 1 . 2]" 1 364 1 33 TYR QB 1 35 ARG H 5.720 . 5.720 4.902 4.611 5.403 . 0 0 "[ . 1 . 2]" 1 365 1 33 TYR QD 1 34 TYR H 4.360 . 4.360 3.113 2.802 3.694 . 0 0 "[ . 1 . 2]" 1 366 1 33 TYR QD 1 37 VAL H 6.000 . 6.000 4.554 4.407 4.791 . 0 0 "[ . 1 . 2]" 1 367 1 33 TYR QD 1 37 VAL QG 4.430 . 4.430 3.157 2.970 3.314 . 0 0 "[ . 1 . 2]" 1 368 1 33 TYR QD 1 38 VAL H 6.000 . 6.000 6.008 5.745 6.198 0.198 17 0 "[ . 1 . 2]" 1 369 1 33 TYR QD 1 59 LEU QD 4.170 . 4.170 3.276 2.399 3.672 . 0 0 "[ . 1 . 2]" 1 370 1 33 TYR QD 1 62 ALA MB 6.000 . 6.000 4.398 3.895 4.888 . 0 0 "[ . 1 . 2]" 1 371 1 33 TYR QE 1 34 TYR H 5.840 . 5.840 5.306 4.914 5.826 . 0 0 "[ . 1 . 2]" 1 372 1 33 TYR QE 1 37 VAL H 6.000 . 6.000 4.972 4.723 5.248 . 0 0 "[ . 1 . 2]" 1 373 1 33 TYR QE 1 37 VAL QG 3.920 . 3.920 2.353 2.234 2.656 . 0 0 "[ . 1 . 2]" 1 374 1 33 TYR QE 1 38 VAL H 6.000 . 6.000 6.131 5.845 6.272 0.272 12 0 "[ . 1 . 2]" 1 375 1 33 TYR QE 1 59 LEU QD 3.350 . 3.350 2.397 2.086 2.779 . 0 0 "[ . 1 . 2]" 1 376 1 33 TYR QE 1 59 LEU HG 4.780 . 4.780 4.373 3.177 4.818 0.038 18 0 "[ . 1 . 2]" 1 377 1 34 TYR H 1 34 TYR QD 4.870 . 4.870 4.171 4.049 4.204 . 0 0 "[ . 1 . 2]" 1 378 1 34 TYR H 1 35 ARG H 4.150 . 4.150 2.789 2.659 2.925 . 0 0 "[ . 1 . 2]" 1 379 1 34 TYR H 1 36 SER H 6.000 . 6.000 3.846 3.510 4.111 . 0 0 "[ . 1 . 2]" 1 380 1 34 TYR H 1 38 VAL QG 5.630 . 5.630 5.417 5.103 5.620 . 0 0 "[ . 1 . 2]" 1 381 1 34 TYR HA 1 34 TYR QD 4.440 . 4.440 2.901 2.476 3.086 . 0 0 "[ . 1 . 2]" 1 382 1 34 TYR HA 1 34 TYR QE 5.410 . 5.410 4.574 4.397 4.685 . 0 0 "[ . 1 . 2]" 1 383 1 34 TYR QB 1 38 VAL QG 5.380 . 5.380 4.046 3.767 4.420 . 0 0 "[ . 1 . 2]" 1 384 1 34 TYR QD 1 38 VAL QG 5.600 . 5.600 2.838 2.322 3.207 . 0 0 "[ . 1 . 2]" 1 385 1 34 TYR QD 1 59 LEU MD1 6.000 . 6.000 3.440 2.082 4.320 . 0 0 "[ . 1 . 2]" 1 386 1 34 TYR QD 1 59 LEU QD 5.130 . 5.130 2.499 2.079 2.789 . 0 0 "[ . 1 . 2]" 1 387 1 34 TYR QD 1 59 LEU MD2 6.000 . 6.000 2.918 2.282 4.716 . 0 0 "[ . 1 . 2]" 1 388 1 34 TYR QD 1 63 TYR H 5.780 . 5.780 3.799 3.099 4.731 . 0 0 "[ . 1 . 2]" 1 389 1 34 TYR QD 1 63 TYR HA 4.430 . 4.430 4.573 4.358 4.773 0.343 2 0 "[ . 1 . 2]" 1 390 1 34 TYR QD 1 63 TYR QB 4.170 . 4.170 2.786 2.564 3.186 . 0 0 "[ . 1 . 2]" 1 391 1 34 TYR QE 1 37 VAL QG 5.110 . 5.110 5.199 4.585 5.565 0.455 17 0 "[ . 1 . 2]" 1 392 1 34 TYR QE 1 38 VAL H 6.000 . 6.000 5.242 4.753 5.591 . 0 0 "[ . 1 . 2]" 1 393 1 34 TYR QE 1 38 VAL QG 4.340 . 4.340 2.427 2.232 2.776 . 0 0 "[ . 1 . 2]" 1 394 1 34 TYR QE 1 60 ASP H 5.400 . 5.400 3.630 3.039 4.527 . 0 0 "[ . 1 . 2]" 1 395 1 34 TYR QE 1 60 ASP QB 5.340 . 5.340 4.140 3.326 5.204 . 0 0 "[ . 1 . 2]" 1 396 1 34 TYR QE 1 63 TYR H 6.000 . 6.000 4.453 3.880 4.983 . 0 0 "[ . 1 . 2]" 1 397 1 34 TYR QE 1 63 TYR QB 4.230 . 4.230 3.493 3.073 3.784 . 0 0 "[ . 1 . 2]" 1 398 1 35 ARG H 1 35 ARG QB 3.140 . 3.140 2.317 2.223 2.491 . 0 0 "[ . 1 . 2]" 1 399 1 35 ARG H 1 36 SER H 4.080 . 4.080 2.561 2.412 2.683 . 0 0 "[ . 1 . 2]" 1 400 1 36 SER H 1 37 VAL H 3.700 . 3.700 2.651 2.572 2.728 . 0 0 "[ . 1 . 2]" 1 401 1 36 SER H 1 37 VAL QG 4.850 . 4.850 4.102 3.478 4.302 . 0 0 "[ . 1 . 2]" 1 402 1 36 SER H 1 38 VAL H 5.920 . 5.920 4.314 3.998 4.572 . 0 0 "[ . 1 . 2]" 1 403 1 37 VAL H 1 37 VAL HB 3.770 . 3.770 2.542 2.303 3.645 . 0 0 "[ . 1 . 2]" 1 404 1 37 VAL H 1 37 VAL QG 3.400 . 3.400 2.203 1.784 2.419 0.016 18 0 "[ . 1 . 2]" 1 405 1 37 VAL H 1 38 VAL H 3.550 . 3.550 2.719 2.508 2.896 . 0 0 "[ . 1 . 2]" 1 406 1 37 VAL H 1 38 VAL QG 4.650 . 4.650 3.930 3.459 4.198 . 0 0 "[ . 1 . 2]" 1 407 1 37 VAL H 1 59 LEU MD1 5.390 . 5.390 5.206 3.681 5.598 0.208 14 0 "[ . 1 . 2]" 1 408 1 37 VAL H 1 59 LEU QD 4.490 . 4.490 4.071 3.622 4.728 0.238 7 0 "[ . 1 . 2]" 1 409 1 37 VAL H 1 59 LEU MD2 5.390 . 5.390 4.421 3.942 5.553 0.163 12 0 "[ . 1 . 2]" 1 410 1 37 VAL HA 1 37 VAL MG1 3.530 . 3.530 2.424 2.297 2.546 . 0 0 "[ . 1 . 2]" 1 411 1 37 VAL HA 1 37 VAL QG 2.770 . 2.770 2.121 2.076 2.346 . 0 0 "[ . 1 . 2]" 1 412 1 37 VAL HA 1 37 VAL MG2 3.530 . 3.530 2.393 2.260 3.215 . 0 0 "[ . 1 . 2]" 1 413 1 37 VAL HA 1 40 THR HB 6.000 . 6.000 2.828 2.401 3.510 . 0 0 "[ . 1 . 2]" 1 414 1 37 VAL HA 1 40 THR MG 5.520 . 5.520 4.225 3.778 4.914 . 0 0 "[ . 1 . 2]" 1 415 1 37 VAL HA 1 41 LEU HG 6.000 . 6.000 4.518 3.477 6.422 0.422 14 0 "[ . 1 . 2]" 1 416 1 37 VAL HB 1 38 VAL H 4.580 . 4.580 2.453 2.048 3.757 . 0 0 "[ . 1 . 2]" 1 417 1 37 VAL HB 1 38 VAL QG 4.930 . 4.930 3.369 2.857 4.465 . 0 0 "[ . 1 . 2]" 1 418 1 37 VAL HB 1 59 LEU QD 4.410 . 4.410 2.545 2.132 3.778 . 0 0 "[ . 1 . 2]" 1 419 1 37 VAL QG 1 38 VAL H 3.190 . 3.190 2.789 1.810 3.142 . 0 0 "[ . 1 . 2]" 1 420 1 37 VAL QG 1 38 VAL HA 3.470 . 3.470 3.158 2.921 3.419 . 0 0 "[ . 1 . 2]" 1 421 1 37 VAL QG 1 40 THR HB 5.240 . 5.240 3.684 3.205 4.317 . 0 0 "[ . 1 . 2]" 1 422 1 37 VAL QG 1 40 THR MG 4.870 . 4.870 4.296 3.838 4.912 0.042 19 0 "[ . 1 . 2]" 1 423 1 37 VAL QG 1 41 LEU H 3.850 . 3.850 3.637 3.366 4.248 0.398 3 0 "[ . 1 . 2]" 1 424 1 37 VAL QG 1 41 LEU QB 3.950 . 3.950 3.239 2.038 3.900 . 0 0 "[ . 1 . 2]" 1 425 1 37 VAL QG 1 41 LEU QD 2.990 . 2.990 2.146 1.908 2.937 . 0 0 "[ . 1 . 2]" 1 426 1 37 VAL QG 1 42 VAL H 5.250 . 5.250 5.261 4.798 5.664 0.414 3 0 "[ . 1 . 2]" 1 427 1 37 VAL QG 1 56 ILE HA 5.510 . 5.510 4.779 4.214 5.249 . 0 0 "[ . 1 . 2]" 1 428 1 37 VAL QG 1 59 LEU H 5.520 . 5.520 5.613 5.254 6.010 0.490 18 0 "[ . 1 . 2]" 1 429 1 37 VAL QG 1 59 LEU QD 3.180 . 3.180 2.045 1.812 2.319 . 0 0 "[ . 1 . 2]" 1 430 1 37 VAL MG1 1 38 VAL H 4.630 . 4.630 3.086 2.578 3.761 . 0 0 "[ . 1 . 2]" 1 431 1 37 VAL MG1 1 40 THR HB 6.000 . 6.000 3.896 3.312 4.620 . 0 0 "[ . 1 . 2]" 1 432 1 37 VAL MG2 1 38 VAL H 4.630 . 4.630 3.590 1.815 3.896 . 0 0 "[ . 1 . 2]" 1 433 1 37 VAL MG2 1 40 THR HB 6.000 . 6.000 4.571 4.115 5.183 . 0 0 "[ . 1 . 2]" 1 434 1 38 VAL H 1 38 VAL QG 3.110 . 3.110 2.062 1.750 2.295 0.050 19 0 "[ . 1 . 2]" 1 435 1 38 VAL H 1 39 SER H 3.870 . 3.870 2.893 2.788 2.980 . 0 0 "[ . 1 . 2]" 1 436 1 38 VAL H 1 39 SER QB 5.040 . 5.040 4.872 4.590 5.143 0.103 6 0 "[ . 1 . 2]" 1 437 1 38 VAL H 1 40 THR H 5.930 . 5.930 4.268 3.766 4.770 . 0 0 "[ . 1 . 2]" 1 438 1 38 VAL H 1 40 THR HB 6.000 . 6.000 5.375 4.821 6.119 0.119 19 0 "[ . 1 . 2]" 1 439 1 38 VAL H 1 41 LEU H 6.000 . 6.000 4.613 4.413 4.734 . 0 0 "[ . 1 . 2]" 1 440 1 38 VAL H 1 41 LEU QD 5.180 . 5.180 4.287 3.757 5.421 0.241 11 0 "[ . 1 . 2]" 1 441 1 38 VAL HA 1 41 LEU H 6.000 . 6.000 3.488 3.228 3.809 . 0 0 "[ . 1 . 2]" 1 442 1 38 VAL HA 1 41 LEU QD 4.410 . 4.410 3.040 2.277 4.183 . 0 0 "[ . 1 . 2]" 1 443 1 38 VAL HA 1 41 LEU HG 4.150 . 4.150 3.931 3.140 4.528 0.378 8 0 "[ . 1 . 2]" 1 444 1 38 VAL HA 1 42 VAL QG 5.920 . 5.920 3.375 2.584 4.581 . 0 0 "[ . 1 . 2]" 1 445 1 38 VAL HA 1 56 ILE MG 6.000 . 6.000 4.791 4.171 5.737 . 0 0 "[ . 1 . 2]" 1 446 1 38 VAL QG 1 39 SER H 5.920 . 5.920 2.703 1.761 3.154 0.039 6 0 "[ . 1 . 2]" 1 447 1 38 VAL QG 1 59 LEU HB2 5.570 . 5.570 4.456 3.829 5.811 0.241 8 0 "[ . 1 . 2]" 1 448 1 38 VAL QG 1 59 LEU QD 3.420 . 3.420 2.588 1.941 3.530 0.110 8 0 "[ . 1 . 2]" 1 449 1 39 SER H 1 39 SER QB 3.320 . 3.320 2.422 2.210 2.616 . 0 0 "[ . 1 . 2]" 1 450 1 39 SER H 1 40 THR H 3.980 . 3.980 2.754 2.544 3.005 . 0 0 "[ . 1 . 2]" 1 451 1 39 SER H 1 40 THR HB 6.000 . 6.000 4.998 4.828 5.300 . 0 0 "[ . 1 . 2]" 1 452 1 39 SER H 1 41 LEU H 6.000 . 6.000 4.237 3.904 4.505 . 0 0 "[ . 1 . 2]" 1 453 1 39 SER H 1 42 VAL HB 5.600 . 5.600 5.199 4.800 5.768 0.168 8 0 "[ . 1 . 2]" 1 454 1 39 SER H 1 42 VAL QG 5.920 . 5.920 4.573 4.061 4.817 . 0 0 "[ . 1 . 2]" 1 455 1 39 SER HA 1 42 VAL QG 5.920 . 5.920 3.484 2.127 4.058 . 0 0 "[ . 1 . 2]" 1 456 1 39 SER QB 1 40 THR H 3.300 . 3.300 2.806 2.231 3.559 0.259 10 0 "[ . 1 . 2]" 1 457 1 39 SER QB 1 40 THR MG 5.810 . 5.810 5.196 4.827 5.619 . 0 0 "[ . 1 . 2]" 1 458 1 39 SER QB 1 41 LEU H 5.780 . 5.780 4.906 4.397 5.377 . 0 0 "[ . 1 . 2]" 1 459 1 39 SER QB 1 42 VAL H 5.810 . 5.810 5.132 4.850 5.437 . 0 0 "[ . 1 . 2]" 1 460 1 40 THR H 1 40 THR MG 3.990 . 3.990 3.764 3.741 3.801 . 0 0 "[ . 1 . 2]" 1 461 1 40 THR H 1 41 LEU H 3.760 . 3.760 2.570 2.344 2.758 . 0 0 "[ . 1 . 2]" 1 462 1 40 THR H 1 41 LEU QB 5.330 . 5.330 4.437 4.057 4.750 . 0 0 "[ . 1 . 2]" 1 463 1 40 THR H 1 41 LEU QD 5.350 . 5.350 4.753 3.590 5.531 0.181 14 0 "[ . 1 . 2]" 1 464 1 40 THR H 1 42 VAL H 5.530 . 5.530 4.019 3.685 4.279 . 0 0 "[ . 1 . 2]" 1 465 1 40 THR H 1 42 VAL QG 5.560 . 5.560 4.897 3.850 5.252 . 0 0 "[ . 1 . 2]" 1 466 1 40 THR H 1 43 GLN QB 5.840 . 5.840 4.615 4.253 5.045 . 0 0 "[ . 1 . 2]" 1 467 1 40 THR HA 1 40 THR MG 3.550 . 3.550 2.323 2.281 2.403 . 0 0 "[ . 1 . 2]" 1 468 1 40 THR HB 1 41 LEU H 6.000 . 6.000 2.505 2.339 2.805 . 0 0 "[ . 1 . 2]" 1 469 1 40 THR HB 1 41 LEU QD 5.920 . 5.920 3.835 2.508 5.321 . 0 0 "[ . 1 . 2]" 1 470 1 40 THR MG 1 41 LEU H 4.550 . 4.550 3.409 3.150 3.628 . 0 0 "[ . 1 . 2]" 1 471 1 40 THR MG 1 41 LEU QB 4.600 . 4.600 4.624 4.349 4.783 0.183 1 0 "[ . 1 . 2]" 1 472 1 40 THR MG 1 41 LEU QD 5.100 . 5.100 3.420 2.587 4.803 . 0 0 "[ . 1 . 2]" 1 473 1 40 THR MG 1 42 VAL H 6.000 . 6.000 4.983 4.588 5.187 . 0 0 "[ . 1 . 2]" 1 474 1 40 THR MG 1 43 GLN H 6.000 . 6.000 4.505 3.990 4.793 . 0 0 "[ . 1 . 2]" 1 475 1 40 THR MG 1 43 GLN QB 5.810 . 5.810 3.837 2.935 4.478 . 0 0 "[ . 1 . 2]" 1 476 1 40 THR MG 1 43 GLN QG 5.810 . 5.810 5.101 4.027 5.798 . 0 0 "[ . 1 . 2]" 1 477 1 40 THR MG 1 44 ASP H 6.000 . 6.000 4.210 3.088 5.095 . 0 0 "[ . 1 . 2]" 1 478 1 41 LEU H 1 41 LEU QB 3.060 . 3.060 2.330 2.138 2.475 . 0 0 "[ . 1 . 2]" 1 479 1 41 LEU H 1 41 LEU QD 3.850 . 3.850 3.092 2.074 3.763 . 0 0 "[ . 1 . 2]" 1 480 1 41 LEU H 1 42 VAL H 3.550 . 3.550 2.698 2.576 2.816 . 0 0 "[ . 1 . 2]" 1 481 1 41 LEU H 1 43 GLN H 5.540 . 5.540 4.053 3.868 4.261 . 0 0 "[ . 1 . 2]" 1 482 1 41 LEU HA 1 41 LEU QD 3.950 . 3.950 2.122 1.972 2.315 . 0 0 "[ . 1 . 2]" 1 483 1 41 LEU HA 1 43 GLN H 4.560 . 4.560 3.972 3.366 4.679 0.119 14 0 "[ . 1 . 2]" 1 484 1 41 LEU HA 1 44 ASP H 5.420 . 5.420 3.680 2.939 5.549 0.129 9 0 "[ . 1 . 2]" 1 485 1 41 LEU QD 1 42 VAL H 4.310 . 4.310 3.981 3.481 4.235 . 0 0 "[ . 1 . 2]" 1 486 1 41 LEU QD 1 52 VAL HA 5.920 . 5.920 3.526 2.441 4.662 . 0 0 "[ . 1 . 2]" 1 487 1 41 LEU QD 1 55 ARG H 5.100 . 5.100 4.582 3.631 5.314 0.214 3 0 "[ . 1 . 2]" 1 488 1 41 LEU QD 1 55 ARG HA 4.810 . 4.810 4.424 3.756 4.914 0.104 11 0 "[ . 1 . 2]" 1 489 1 41 LEU QD 1 56 ILE H 5.920 . 5.920 4.189 3.072 5.179 . 0 0 "[ . 1 . 2]" 1 490 1 41 LEU HG 1 59 LEU QD 5.920 . 5.920 4.918 3.701 6.059 0.139 14 0 "[ . 1 . 2]" 1 491 1 42 VAL H 1 42 VAL MG1 4.090 . 4.090 3.584 2.336 3.849 . 0 0 "[ . 1 . 2]" 1 492 1 42 VAL H 1 42 VAL QG 3.520 . 3.520 2.276 2.093 2.533 . 0 0 "[ . 1 . 2]" 1 493 1 42 VAL H 1 42 VAL MG2 4.090 . 4.090 2.495 2.103 3.754 . 0 0 "[ . 1 . 2]" 1 494 1 42 VAL H 1 43 GLN H 3.930 . 3.930 2.609 2.104 2.983 . 0 0 "[ . 1 . 2]" 1 495 1 42 VAL H 1 44 ASP H 5.160 . 5.160 4.130 3.520 5.349 0.189 9 0 "[ . 1 . 2]" 1 496 1 42 VAL H 1 44 ASP QB 5.810 . 5.810 5.240 4.708 6.012 0.202 3 0 "[ . 1 . 2]" 1 497 1 42 VAL HA 1 42 VAL QG 3.120 . 3.120 2.109 2.059 2.235 . 0 0 "[ . 1 . 2]" 1 498 1 42 VAL HA 1 52 VAL QG 4.500 . 4.500 3.096 2.311 3.591 . 0 0 "[ . 1 . 2]" 1 499 1 42 VAL HB 1 43 GLN H 4.210 . 4.210 3.489 2.692 4.237 0.027 18 0 "[ . 1 . 2]" 1 500 1 42 VAL HB 1 44 ASP H 5.640 . 5.640 5.381 4.701 5.831 0.191 18 0 "[ . 1 . 2]" 1 501 1 42 VAL HB 1 52 VAL QG 5.920 . 5.920 5.080 4.212 5.511 . 0 0 "[ . 1 . 2]" 1 502 1 42 VAL HB 1 56 ILE MD 5.860 . 5.860 4.763 3.007 5.739 . 0 0 "[ . 1 . 2]" 1 503 1 42 VAL QG 1 43 GLN H 3.960 . 3.960 3.364 2.163 3.781 . 0 0 "[ . 1 . 2]" 1 504 1 42 VAL QG 1 43 GLN QB 5.730 . 5.730 3.904 2.761 4.576 . 0 0 "[ . 1 . 2]" 1 505 1 42 VAL QG 1 43 GLN QG 5.730 . 5.730 4.304 2.060 5.274 . 0 0 "[ . 1 . 2]" 1 506 1 42 VAL QG 1 44 ASP H 4.470 . 4.470 4.515 4.013 4.960 0.490 8 0 "[ . 1 . 2]" 1 507 1 42 VAL QG 1 44 ASP QB 5.730 . 5.730 5.590 4.990 6.005 0.275 15 0 "[ . 1 . 2]" 1 508 1 42 VAL QG 1 52 VAL H 5.920 . 5.920 5.873 5.373 6.106 0.186 5 0 "[ . 1 . 2]" 1 509 1 42 VAL QG 1 56 ILE QG 5.660 . 5.660 3.612 2.832 4.379 . 0 0 "[ . 1 . 2]" 1 510 1 42 VAL QG 2 56 ILE MD 5.770 . 5.770 4.867 3.537 5.978 0.208 1 0 "[ . 1 . 2]" 1 511 1 42 VAL QG 2 57 GLN HA 4.870 . 4.870 4.641 3.723 5.088 0.218 19 0 "[ . 1 . 2]" 1 512 1 42 VAL QG 2 57 GLN QG 3.670 . 3.670 3.498 2.592 3.935 0.265 13 0 "[ . 1 . 2]" 1 513 1 42 VAL MG1 1 43 GLN H 5.190 . 5.190 3.655 2.172 4.231 . 0 0 "[ . 1 . 2]" 1 514 1 42 VAL MG2 1 43 GLN H 5.190 . 5.190 4.090 3.852 4.285 . 0 0 "[ . 1 . 2]" 1 515 1 43 GLN H 1 44 ASP H 3.370 . 3.370 2.164 1.525 3.713 0.343 9 0 "[ . 1 . 2]" 1 516 1 43 GLN H 1 44 ASP QB 5.330 . 5.330 4.018 3.461 4.844 . 0 0 "[ . 1 . 2]" 1 517 1 43 GLN HA 1 43 GLN QB 2.440 . 2.440 2.406 2.342 2.476 0.036 11 0 "[ . 1 . 2]" 1 518 1 43 GLN HA 1 43 GLN QG 3.550 . 3.550 2.376 2.274 2.754 . 0 0 "[ . 1 . 2]" 1 519 1 44 ASP H 1 44 ASP QB 3.230 . 3.230 2.614 2.217 3.204 . 0 0 "[ . 1 . 2]" 1 520 1 44 ASP H 1 45 GLN H 4.680 . 4.680 3.554 1.736 4.589 0.064 4 0 "[ . 1 . 2]" 1 521 1 44 ASP QB 1 46 LEU H 5.870 . 5.870 5.024 3.059 6.290 0.420 1 0 "[ . 1 . 2]" 1 522 1 45 GLN H 1 45 GLN QG 4.730 . 4.730 3.671 2.162 4.359 . 0 0 "[ . 1 . 2]" 1 523 1 45 GLN H 1 46 LEU QB 5.810 . 5.810 4.567 3.338 5.641 . 0 0 "[ . 1 . 2]" 1 524 1 45 GLN H 1 46 LEU HG 6.000 . 6.000 4.845 2.803 6.219 0.219 19 0 "[ . 1 . 2]" 1 525 1 45 GLN HA 1 45 GLN QG 3.710 . 3.710 2.708 2.291 3.330 . 0 0 "[ . 1 . 2]" 1 526 1 45 GLN QG 1 46 LEU H 4.210 . 4.210 3.054 1.910 4.432 0.222 5 0 "[ . 1 . 2]" 1 527 1 45 GLN QG 1 46 LEU HA 4.400 . 4.400 3.945 3.252 4.590 0.190 5 0 "[ . 1 . 2]" 1 528 1 45 GLN QG 1 46 LEU QB 5.610 . 5.610 4.688 4.120 5.738 0.128 5 0 "[ . 1 . 2]" 1 529 1 45 GLN QG 1 46 LEU HG 5.810 . 5.810 5.272 4.489 6.015 0.205 10 0 "[ . 1 . 2]" 1 530 1 45 GLN QG 1 47 THR H 3.730 . 3.730 2.410 1.787 3.686 0.013 11 0 "[ . 1 . 2]" 1 531 1 45 GLN QG 1 48 LYS H 5.810 . 5.810 4.238 3.403 5.318 . 0 0 "[ . 1 . 2]" 1 532 1 45 GLN QG 1 51 VAL QG 4.150 . 4.150 3.377 2.077 4.241 0.091 19 0 "[ . 1 . 2]" 1 533 1 45 GLN QG 1 52 VAL H 5.840 . 5.840 5.688 4.616 6.318 0.478 9 0 "[ . 1 . 2]" 1 534 1 46 LEU H 1 46 LEU HA 2.930 . 2.930 2.503 2.273 2.962 0.032 4 0 "[ . 1 . 2]" 1 535 1 46 LEU H 1 46 LEU QB 3.080 . 3.080 2.929 2.288 3.230 0.150 6 0 "[ . 1 . 2]" 1 536 1 46 LEU H 1 46 LEU MD1 4.910 . 4.910 3.928 1.854 4.904 . 0 0 "[ . 1 . 2]" 1 537 1 46 LEU H 1 46 LEU MD2 4.910 . 4.910 4.008 3.434 5.001 0.091 11 0 "[ . 1 . 2]" 1 538 1 46 LEU H 1 46 LEU HG 5.360 . 5.360 3.202 2.341 4.660 . 0 0 "[ . 1 . 2]" 1 539 1 46 LEU H 1 47 THR H 3.230 . 3.230 2.875 1.743 3.555 0.325 17 0 "[ . 1 . 2]" 1 540 1 46 LEU H 1 47 THR HA 5.530 . 5.530 5.020 3.886 5.651 0.121 17 0 "[ . 1 . 2]" 1 541 1 46 LEU H 1 47 THR HB 5.290 . 5.290 4.887 3.634 5.327 0.037 18 0 "[ . 1 . 2]" 1 542 1 46 LEU H 1 47 THR MG 6.000 . 6.000 4.574 3.273 6.245 0.245 19 0 "[ . 1 . 2]" 1 543 1 46 LEU HA 1 46 LEU QD 3.780 . 3.780 2.315 2.210 3.079 . 0 0 "[ . 1 . 2]" 1 544 1 46 LEU HA 1 47 THR H 3.550 . 3.550 2.714 2.152 3.000 . 0 0 "[ . 1 . 2]" 1 545 1 46 LEU HA 1 48 LYS H 3.660 . 3.660 3.443 3.195 3.675 0.015 13 0 "[ . 1 . 2]" 1 546 1 46 LEU HA 1 52 VAL H 5.690 . 5.690 5.516 4.655 6.120 0.430 17 0 "[ . 1 . 2]" 1 547 1 46 LEU QB 1 46 LEU QD 2.440 . 2.440 1.934 1.922 1.944 . 0 0 "[ . 1 . 2]" 1 548 1 46 LEU QB 1 47 THR HA 5.810 . 5.810 4.401 4.174 4.582 . 0 0 "[ . 1 . 2]" 1 549 1 46 LEU HB2 1 46 LEU MD1 3.280 . 3.280 2.271 2.242 2.327 . 0 0 "[ . 1 . 2]" 1 550 1 46 LEU HB2 1 46 LEU MD2 3.280 . 3.280 3.122 2.670 3.231 . 0 0 "[ . 1 . 2]" 1 551 1 46 LEU HB3 1 46 LEU MD1 3.280 . 3.280 2.636 2.357 3.172 . 0 0 "[ . 1 . 2]" 1 552 1 46 LEU HB3 1 46 LEU MD2 3.280 . 3.280 2.274 2.235 2.341 . 0 0 "[ . 1 . 2]" 1 553 1 46 LEU QD 1 48 LYS H 5.470 . 5.470 4.498 3.143 5.166 . 0 0 "[ . 1 . 2]" 1 554 1 46 LEU HG 1 48 LYS H 6.000 . 6.000 5.730 3.428 6.225 0.225 15 0 "[ . 1 . 2]" 1 555 1 47 THR H 1 47 THR HB 3.740 . 3.740 2.636 2.310 3.436 . 0 0 "[ . 1 . 2]" 1 556 1 47 THR H 1 47 THR MG 4.210 . 4.210 2.379 1.806 3.740 . 0 0 "[ . 1 . 2]" 1 557 1 47 THR H 1 48 LYS H 5.370 . 5.370 2.437 1.666 2.939 0.134 17 0 "[ . 1 . 2]" 1 558 1 47 THR H 1 51 VAL MG1 4.920 . 4.920 4.193 3.826 5.262 0.342 12 0 "[ . 1 . 2]" 1 559 1 47 THR H 1 51 VAL QG 3.720 . 3.720 3.792 3.037 3.996 0.276 1 0 "[ . 1 . 2]" 1 560 1 47 THR H 1 51 VAL MG2 4.920 . 4.920 4.744 3.067 5.175 0.255 3 0 "[ . 1 . 2]" 1 561 1 47 THR HA 1 47 THR MG 3.590 . 3.590 3.016 2.418 3.215 . 0 0 "[ . 1 . 2]" 1 562 1 47 THR HA 1 48 LYS H 3.280 . 3.280 3.490 3.449 3.564 0.284 16 0 "[ . 1 . 2]" 1 563 1 47 THR HA 1 48 LYS QB 5.810 . 5.810 4.386 4.300 4.520 . 0 0 "[ . 1 . 2]" 1 564 1 47 THR HA 1 51 VAL QG 4.870 . 4.870 4.812 4.097 5.128 0.258 10 0 "[ . 1 . 2]" 1 565 1 47 THR HB 1 48 LYS H 6.000 . 6.000 3.692 2.565 4.114 . 0 0 "[ . 1 . 2]" 1 566 1 47 THR HB 1 51 VAL QG 4.450 . 4.450 3.631 2.114 4.283 . 0 0 "[ . 1 . 2]" 1 567 1 47 THR HB 1 52 VAL QG 5.520 . 5.520 4.914 3.487 5.685 0.165 17 0 "[ . 1 . 2]" 1 568 1 47 THR MG 1 48 LYS H 3.950 . 3.950 2.454 1.973 3.425 . 0 0 "[ . 1 . 2]" 1 569 1 47 THR MG 1 48 LYS QB 3.720 . 3.720 2.568 2.373 2.738 . 0 0 "[ . 1 . 2]" 1 570 1 47 THR MG 1 50 ALA H 6.000 . 6.000 5.731 5.061 6.302 0.302 11 0 "[ . 1 . 2]" 1 571 1 47 THR MG 1 51 VAL H 6.000 . 6.000 4.255 4.031 4.796 . 0 0 "[ . 1 . 2]" 1 572 1 47 THR MG 1 51 VAL MG1 2.790 . 2.790 2.322 2.075 3.107 0.317 19 0 "[ . 1 . 2]" 1 573 1 47 THR MG 1 51 VAL QG 2.410 . 2.410 1.968 1.802 2.170 . 0 0 "[ . 1 . 2]" 1 574 1 47 THR MG 1 51 VAL MG2 2.790 . 2.790 2.186 1.909 2.367 . 0 0 "[ . 1 . 2]" 1 575 1 47 THR MG 1 52 VAL H 4.990 . 4.990 4.501 3.806 5.479 0.489 13 0 "[ . 1 . 2]" 1 576 1 48 LYS H 1 48 LYS QB 3.410 . 3.410 2.897 2.789 2.987 . 0 0 "[ . 1 . 2]" 1 577 1 48 LYS H 1 48 LYS QG 4.080 . 4.080 4.221 4.091 4.323 0.243 6 0 "[ . 1 . 2]" 1 578 1 48 LYS H 1 49 ASN H 4.560 . 4.560 4.118 4.028 4.200 . 0 0 "[ . 1 . 2]" 1 579 1 48 LYS H 1 51 VAL H 6.000 . 6.000 4.329 4.028 4.486 . 0 0 "[ . 1 . 2]" 1 580 1 48 LYS H 1 51 VAL HB 6.000 . 6.000 3.277 2.641 5.605 . 0 0 "[ . 1 . 2]" 1 581 1 48 LYS H 1 51 VAL MG1 5.550 . 5.550 3.836 3.572 3.989 . 0 0 "[ . 1 . 2]" 1 582 1 48 LYS H 1 51 VAL QG 4.660 . 4.660 3.273 1.925 3.576 . 0 0 "[ . 1 . 2]" 1 583 1 48 LYS H 1 51 VAL MG2 5.550 . 5.550 3.678 1.931 4.058 . 0 0 "[ . 1 . 2]" 1 584 1 48 LYS H 1 52 VAL QG 4.730 . 4.730 3.001 2.383 3.416 . 0 0 "[ . 1 . 2]" 1 585 1 48 LYS HA 1 49 ASN H 3.110 . 3.110 2.186 2.143 2.244 . 0 0 "[ . 1 . 2]" 1 586 1 48 LYS HA 1 51 VAL H 5.240 . 5.240 4.545 4.428 4.949 . 0 0 "[ . 1 . 2]" 1 587 1 48 LYS QB 1 49 ASN H 3.640 . 3.640 3.678 3.554 3.767 0.127 10 0 "[ . 1 . 2]" 1 588 1 48 LYS QB 1 50 ALA H 3.960 . 3.960 3.424 2.831 3.660 . 0 0 "[ . 1 . 2]" 1 589 1 48 LYS QB 1 50 ALA MB 4.570 . 4.570 3.403 2.854 3.753 . 0 0 "[ . 1 . 2]" 1 590 1 48 LYS QB 1 51 VAL QG 3.020 . 3.020 2.126 2.026 2.278 . 0 0 "[ . 1 . 2]" 1 591 1 48 LYS QE 1 48 LYS QG 2.380 . 2.380 2.200 2.099 2.299 . 0 0 "[ . 1 . 2]" 1 592 1 48 LYS QE 1 49 ASN H 5.810 . 5.810 3.983 3.528 4.710 . 0 0 "[ . 1 . 2]" 1 593 1 48 LYS QE 1 49 ASN HA 5.810 . 5.810 6.013 5.858 6.236 0.426 8 0 "[ . 1 . 2]" 1 594 1 48 LYS QE 1 50 ALA H 4.160 . 4.160 3.518 2.838 4.176 0.016 13 0 "[ . 1 . 2]" 1 595 1 48 LYS QE 1 50 ALA MB 4.620 . 4.620 3.146 2.096 4.285 . 0 0 "[ . 1 . 2]" 1 596 1 48 LYS HE2 1 50 ALA MB 5.270 . 5.270 3.584 2.112 4.947 . 0 0 "[ . 1 . 2]" 1 597 1 48 LYS HE3 1 50 ALA MB 5.270 . 5.270 3.867 2.125 5.174 . 0 0 "[ . 1 . 2]" 1 598 1 48 LYS QG 1 49 ASN H 3.830 . 3.830 2.447 2.127 2.682 . 0 0 "[ . 1 . 2]" 1 599 1 48 LYS QG 1 50 ALA H 4.760 . 4.760 1.830 1.625 2.160 0.175 12 0 "[ . 1 . 2]" 1 600 1 48 LYS QG 1 50 ALA HA 4.540 . 4.540 4.183 3.791 4.507 . 0 0 "[ . 1 . 2]" 1 601 1 48 LYS QG 1 51 VAL H 4.240 . 4.240 2.665 1.793 3.314 0.007 8 0 "[ . 1 . 2]" 1 602 1 48 LYS QG 1 51 VAL QG 3.370 . 3.370 3.222 2.854 3.538 0.168 12 0 "[ . 1 . 2]" 1 603 1 48 LYS QG 1 52 VAL H 4.790 . 4.790 4.719 4.150 5.281 0.491 12 0 "[ . 1 . 2]" 1 604 1 49 ASN H 1 49 ASN HB2 4.140 . 4.140 2.890 2.467 3.607 . 0 0 "[ . 1 . 2]" 1 605 1 49 ASN H 1 49 ASN QB 3.530 . 3.530 2.535 2.427 2.679 . 0 0 "[ . 1 . 2]" 1 606 1 49 ASN H 1 49 ASN HB3 4.140 . 4.140 3.298 2.495 3.603 . 0 0 "[ . 1 . 2]" 1 607 1 49 ASN H 1 50 ALA H 4.180 . 4.180 2.808 2.672 2.900 . 0 0 "[ . 1 . 2]" 1 608 1 49 ASN H 1 50 ALA HA 5.700 . 5.700 5.391 5.195 5.470 . 0 0 "[ . 1 . 2]" 1 609 1 49 ASN HA 1 50 ALA MB 6.000 . 6.000 5.031 4.911 5.061 . 0 0 "[ . 1 . 2]" 1 610 1 49 ASN HA 1 52 VAL H 4.980 . 4.980 3.811 3.631 4.223 . 0 0 "[ . 1 . 2]" 1 611 1 49 ASN HA 1 52 VAL QG 5.150 . 5.150 2.170 2.038 3.242 . 0 0 "[ . 1 . 2]" 1 612 1 49 ASN HA 1 53 LEU H 5.240 . 5.240 3.939 3.368 4.373 . 0 0 "[ . 1 . 2]" 1 613 1 49 ASN HA 1 53 LEU QB 4.670 . 4.670 4.276 3.630 4.751 0.081 4 0 "[ . 1 . 2]" 1 614 1 49 ASN HA 2 53 LEU MD1 5.270 . 5.270 4.212 2.478 5.175 . 0 0 "[ . 1 . 2]" 1 615 1 49 ASN HA 2 53 LEU QD 4.190 . 4.190 3.038 2.472 3.779 . 0 0 "[ . 1 . 2]" 1 616 1 49 ASN HA 2 53 LEU MD2 5.270 . 5.270 3.522 2.526 5.303 0.033 10 0 "[ . 1 . 2]" 1 617 1 49 ASN QB 1 50 ALA H 3.560 . 3.560 2.878 2.403 3.753 0.193 12 0 "[ . 1 . 2]" 1 618 1 49 ASN QB 1 50 ALA MB 5.090 . 5.090 4.039 3.724 4.805 . 0 0 "[ . 1 . 2]" 1 619 1 49 ASN QB 1 51 VAL H 5.810 . 5.810 5.042 4.727 5.563 . 0 0 "[ . 1 . 2]" 1 620 1 49 ASN QB 1 52 VAL QG 4.890 . 4.890 3.491 3.054 4.615 . 0 0 "[ . 1 . 2]" 1 621 1 49 ASN QB 1 53 LEU H 5.810 . 5.810 4.608 4.195 5.103 . 0 0 "[ . 1 . 2]" 1 622 1 49 ASN QB 1 53 LEU QD 4.190 . 4.190 3.754 2.479 4.210 0.020 12 0 "[ . 1 . 2]" 1 623 1 49 ASN QB 2 53 LEU QD 4.120 . 4.120 2.631 2.043 3.366 . 0 0 "[ . 1 . 2]" 1 624 1 50 ALA H 1 50 ALA MB 3.440 . 3.440 2.235 2.062 2.286 . 0 0 "[ . 1 . 2]" 1 625 1 50 ALA H 1 51 VAL H 3.870 . 3.870 2.698 2.596 2.798 . 0 0 "[ . 1 . 2]" 1 626 1 50 ALA H 1 51 VAL HA 6.000 . 6.000 5.309 5.205 5.401 . 0 0 "[ . 1 . 2]" 1 627 1 50 ALA H 1 51 VAL QG 4.910 . 4.910 4.177 3.435 4.425 . 0 0 "[ . 1 . 2]" 1 628 1 50 ALA H 1 52 VAL H 4.980 . 4.980 4.282 3.930 4.787 . 0 0 "[ . 1 . 2]" 1 629 1 50 ALA H 1 52 VAL QG 4.380 . 4.380 3.935 3.602 4.875 0.495 7 0 "[ . 1 . 2]" 1 630 1 50 ALA MB 1 51 VAL H 4.610 . 4.610 2.357 2.133 2.645 . 0 0 "[ . 1 . 2]" 1 631 1 50 ALA MB 1 51 VAL HB 6.000 . 6.000 4.536 4.362 5.154 . 0 0 "[ . 1 . 2]" 1 632 1 50 ALA MB 1 51 VAL QG 3.620 . 3.620 3.117 2.819 3.306 . 0 0 "[ . 1 . 2]" 1 633 1 50 ALA MB 1 53 LEU H 5.440 . 5.440 4.521 4.254 4.780 . 0 0 "[ . 1 . 2]" 1 634 1 51 VAL H 1 51 VAL MG1 3.870 . 3.870 3.503 1.874 3.794 . 0 0 "[ . 1 . 2]" 1 635 1 51 VAL H 1 51 VAL QG 3.210 . 3.210 2.223 1.778 2.361 0.022 12 0 "[ . 1 . 2]" 1 636 1 51 VAL H 1 51 VAL MG2 3.870 . 3.870 2.304 2.211 2.385 . 0 0 "[ . 1 . 2]" 1 637 1 51 VAL H 1 52 VAL H 4.130 . 4.130 2.894 2.791 3.124 . 0 0 "[ . 1 . 2]" 1 638 1 51 VAL H 1 52 VAL QG 4.770 . 4.770 3.644 3.556 4.010 . 0 0 "[ . 1 . 2]" 1 639 1 51 VAL H 1 53 LEU H 5.250 . 5.250 4.105 3.961 4.261 . 0 0 "[ . 1 . 2]" 1 640 1 51 VAL H 1 54 LYS H 6.000 . 6.000 4.798 4.575 5.181 . 0 0 "[ . 1 . 2]" 1 641 1 51 VAL HA 1 51 VAL MG1 3.270 . 3.270 2.507 2.315 2.589 . 0 0 "[ . 1 . 2]" 1 642 1 51 VAL HA 1 51 VAL QG 2.780 . 2.780 2.170 2.121 2.375 . 0 0 "[ . 1 . 2]" 1 643 1 51 VAL HA 1 51 VAL MG2 3.270 . 3.270 2.454 2.268 3.247 . 0 0 "[ . 1 . 2]" 1 644 1 51 VAL HA 1 54 LYS H 4.330 . 4.330 3.917 3.196 4.441 0.111 20 0 "[ . 1 . 2]" 1 645 1 51 VAL HA 1 54 LYS QB 4.850 . 4.850 3.552 2.343 4.464 . 0 0 "[ . 1 . 2]" 1 646 1 51 VAL HB 1 52 VAL QG 4.560 . 4.560 3.155 2.879 4.037 . 0 0 "[ . 1 . 2]" 1 647 1 51 VAL QG 1 52 VAL H 3.460 . 3.460 2.736 1.639 3.065 0.161 12 0 "[ . 1 . 2]" 1 648 1 51 VAL QG 1 52 VAL HA 5.920 . 5.920 3.205 2.930 3.551 . 0 0 "[ . 1 . 2]" 1 649 1 51 VAL QG 1 54 LYS H 5.920 . 5.920 4.683 4.212 5.057 . 0 0 "[ . 1 . 2]" 1 650 1 51 VAL QG 1 54 LYS QE 5.920 . 5.920 4.081 2.495 5.174 . 0 0 "[ . 1 . 2]" 1 651 1 51 VAL QG 1 54 LYS QG 5.060 . 5.060 4.050 3.365 4.730 . 0 0 "[ . 1 . 2]" 1 652 1 52 VAL H 1 52 VAL HB 3.700 . 3.700 3.573 2.605 3.655 . 0 0 "[ . 1 . 2]" 1 653 1 52 VAL H 1 52 VAL QG 3.630 . 3.630 1.750 1.703 1.923 0.097 18 0 "[ . 1 . 2]" 1 654 1 52 VAL H 1 53 LEU H 4.080 . 4.080 2.541 2.347 2.834 . 0 0 "[ . 1 . 2]" 1 655 1 52 VAL H 1 53 LEU HA 6.000 . 6.000 5.163 4.994 5.395 . 0 0 "[ . 1 . 2]" 1 656 1 52 VAL H 1 53 LEU QB 5.140 . 5.140 4.293 4.105 4.546 . 0 0 "[ . 1 . 2]" 1 657 1 52 VAL H 1 54 LYS H 4.420 . 4.420 4.262 4.009 4.535 0.115 9 0 "[ . 1 . 2]" 1 658 1 52 VAL H 1 54 LYS QD 5.600 . 5.600 5.125 4.781 5.427 . 0 0 "[ . 1 . 2]" 1 659 1 52 VAL HA 1 52 VAL MG1 3.450 . 3.450 2.331 2.277 2.430 . 0 0 "[ . 1 . 2]" 1 660 1 52 VAL HA 1 52 VAL QG 3.020 . 3.020 2.269 2.093 2.360 . 0 0 "[ . 1 . 2]" 1 661 1 52 VAL HA 1 52 VAL MG2 3.450 . 3.450 3.156 2.424 3.205 . 0 0 "[ . 1 . 2]" 1 662 1 52 VAL HA 1 55 ARG H 4.360 . 4.360 3.561 3.374 3.965 . 0 0 "[ . 1 . 2]" 1 663 1 52 VAL HA 1 56 ILE H 5.380 . 5.380 4.409 3.648 5.122 . 0 0 "[ . 1 . 2]" 1 664 1 52 VAL HB 1 53 LEU H 4.560 . 4.560 3.673 2.571 3.968 . 0 0 "[ . 1 . 2]" 1 665 1 52 VAL HB 2 53 LEU QD 5.270 . 5.270 4.615 3.637 5.362 0.092 5 0 "[ . 1 . 2]" 1 666 1 52 VAL QG 1 53 LEU H 3.440 . 3.440 2.085 1.784 3.224 0.016 20 0 "[ . 1 . 2]" 1 667 1 52 VAL QG 1 53 LEU HA 3.630 . 3.630 3.212 3.024 3.539 . 0 0 "[ . 1 . 2]" 1 668 1 52 VAL QG 1 53 LEU QB 3.960 . 3.960 3.082 2.821 4.164 0.204 7 0 "[ . 1 . 2]" 1 669 1 52 VAL QG 1 54 LYS H 4.780 . 4.780 4.201 3.952 4.641 . 0 0 "[ . 1 . 2]" 1 670 1 52 VAL QG 1 54 LYS QD 5.340 . 5.340 5.250 4.755 5.496 0.156 18 0 "[ . 1 . 2]" 1 671 1 52 VAL QG 1 55 ARG H 4.810 . 4.810 4.557 4.260 4.760 . 0 0 "[ . 1 . 2]" 1 672 1 52 VAL QG 1 56 ILE HB 5.920 . 5.920 5.032 4.653 5.538 . 0 0 "[ . 1 . 2]" 1 673 1 53 LEU H 1 53 LEU QB 3.190 . 3.190 2.216 2.068 2.287 . 0 0 "[ . 1 . 2]" 1 674 1 53 LEU H 1 53 LEU MD1 4.530 . 4.530 4.128 3.494 4.343 . 0 0 "[ . 1 . 2]" 1 675 1 53 LEU H 1 53 LEU QD 3.880 . 3.880 3.544 2.801 3.772 . 0 0 "[ . 1 . 2]" 1 676 1 53 LEU H 1 53 LEU MD2 4.530 . 4.530 3.957 2.847 4.303 . 0 0 "[ . 1 . 2]" 1 677 1 53 LEU H 1 54 LYS H 3.790 . 3.790 2.756 2.448 3.004 . 0 0 "[ . 1 . 2]" 1 678 1 53 LEU H 1 54 LYS QD 5.390 . 5.390 5.238 3.789 5.684 0.294 7 0 "[ . 1 . 2]" 1 679 1 53 LEU H 1 56 ILE HB 6.000 . 6.000 5.311 5.020 5.793 . 0 0 "[ . 1 . 2]" 1 680 1 53 LEU H 1 56 ILE QG 4.640 . 4.640 4.607 4.020 4.954 0.314 1 0 "[ . 1 . 2]" 1 681 1 53 LEU HA 1 53 LEU MD1 4.210 . 4.210 2.547 2.133 3.799 . 0 0 "[ . 1 . 2]" 1 682 1 53 LEU HA 1 53 LEU QD 3.450 . 3.450 2.247 1.949 3.067 . 0 0 "[ . 1 . 2]" 1 683 1 53 LEU HA 1 53 LEU MD2 4.210 . 4.210 3.132 2.178 3.886 . 0 0 "[ . 1 . 2]" 1 684 1 53 LEU HA 1 56 ILE H 4.510 . 4.510 3.292 2.975 3.628 . 0 0 "[ . 1 . 2]" 1 685 1 53 LEU HA 1 56 ILE MD 4.440 . 4.440 3.336 2.148 4.853 0.413 17 0 "[ . 1 . 2]" 1 686 1 53 LEU HA 1 56 ILE MG 6.000 . 6.000 4.066 3.839 4.310 . 0 0 "[ . 1 . 2]" 1 687 1 53 LEU QB 1 53 LEU QD 2.670 . 2.670 1.955 1.914 2.040 . 0 0 "[ . 1 . 2]" 1 688 1 53 LEU QD 1 54 LYS H 5.270 . 5.270 3.621 2.479 4.179 . 0 0 "[ . 1 . 2]" 1 689 1 53 LEU QD 1 56 ILE HA 5.920 . 5.920 5.254 4.526 5.856 . 0 0 "[ . 1 . 2]" 1 690 1 53 LEU QD 1 56 ILE HB 4.140 . 4.140 2.828 2.172 3.785 . 0 0 "[ . 1 . 2]" 1 691 1 53 LEU QD 1 56 ILE QG 3.970 . 3.970 3.762 2.404 4.400 0.430 6 0 "[ . 1 . 2]" 1 692 1 53 LEU QD 1 57 GLN HA 4.800 . 4.800 4.462 4.125 4.865 0.065 4 0 "[ . 1 . 2]" 1 693 1 53 LEU QD 1 57 GLN QG 3.700 . 3.700 2.253 1.930 2.862 . 0 0 "[ . 1 . 2]" 1 694 1 53 LEU QD 2 49 ASN HA 4.190 . 4.190 3.101 2.412 3.796 . 0 0 "[ . 1 . 2]" 1 695 1 53 LEU QD 2 49 ASN QB 4.120 . 4.120 2.493 1.953 3.229 . 0 0 "[ . 1 . 2]" 1 696 1 53 LEU QD 2 52 VAL HB 5.270 . 5.270 4.580 3.788 5.455 0.185 17 0 "[ . 1 . 2]" 1 697 1 53 LEU MD1 1 56 ILE HB 5.170 . 5.170 3.234 2.186 5.411 0.241 4 0 "[ . 1 . 2]" 1 698 1 53 LEU MD1 2 49 ASN HA 5.270 . 5.270 4.070 2.462 5.161 . 0 0 "[ . 1 . 2]" 1 699 1 53 LEU MD2 1 56 ILE HB 5.170 . 5.170 4.323 2.633 5.490 0.320 17 0 "[ . 1 . 2]" 1 700 1 53 LEU MD2 2 49 ASN HA 5.270 . 5.270 3.661 2.423 5.127 . 0 0 "[ . 1 . 2]" 1 701 1 54 LYS H 1 54 LYS QG 3.730 . 3.730 2.468 1.876 3.436 . 0 0 "[ . 1 . 2]" 1 702 1 54 LYS H 1 55 ARG H 4.110 . 4.110 2.752 2.629 2.873 . 0 0 "[ . 1 . 2]" 1 703 1 54 LYS H 1 56 ILE H 5.090 . 5.090 4.166 4.042 4.354 . 0 0 "[ . 1 . 2]" 1 704 1 54 LYS H 1 56 ILE QG 5.810 . 5.810 5.178 4.665 5.670 . 0 0 "[ . 1 . 2]" 1 705 1 54 LYS H 1 57 GLN H 5.820 . 5.820 4.835 4.701 5.030 . 0 0 "[ . 1 . 2]" 1 706 1 54 LYS H 1 57 GLN QG 4.900 . 4.900 4.824 4.700 4.980 0.080 16 0 "[ . 1 . 2]" 1 707 1 54 LYS HA 1 54 LYS QG 3.630 . 3.630 2.923 2.299 3.392 . 0 0 "[ . 1 . 2]" 1 708 1 54 LYS HA 1 57 GLN H 4.490 . 4.490 3.626 3.474 3.890 . 0 0 "[ . 1 . 2]" 1 709 1 54 LYS HA 1 57 GLN QG 5.810 . 5.810 3.512 3.192 3.937 . 0 0 "[ . 1 . 2]" 1 710 1 54 LYS QD 1 54 LYS QE 2.050 . 2.050 2.065 1.995 2.109 0.059 16 0 "[ . 1 . 2]" 1 711 1 54 LYS HD2 1 54 LYS QE 2.360 . 2.360 2.333 2.203 2.474 0.114 10 0 "[ . 1 . 2]" 1 712 1 54 LYS HD3 1 54 LYS QE 2.360 . 2.360 2.316 2.197 2.439 0.079 20 0 "[ . 1 . 2]" 1 713 1 54 LYS QE 1 54 LYS QG 2.950 . 2.950 2.374 2.115 2.923 . 0 0 "[ . 1 . 2]" 1 714 1 54 LYS QG 1 55 ARG H 5.810 . 5.810 2.837 1.791 4.551 0.009 17 0 "[ . 1 . 2]" 1 715 1 55 ARG H 1 56 ILE H 3.650 . 3.650 2.609 2.446 2.699 . 0 0 "[ . 1 . 2]" 1 716 1 55 ARG H 1 57 GLN H 6.000 . 6.000 4.304 4.149 4.474 . 0 0 "[ . 1 . 2]" 1 717 1 55 ARG H 1 57 GLN QG 5.310 . 5.310 5.398 5.274 5.586 0.276 4 0 "[ . 1 . 2]" 1 718 1 55 ARG H 1 58 HIS H 5.640 . 5.640 4.763 4.616 4.879 . 0 0 "[ . 1 . 2]" 1 719 1 55 ARG HA 1 57 GLN H 4.840 . 4.840 4.712 4.510 4.924 0.084 4 0 "[ . 1 . 2]" 1 720 1 56 ILE H 1 56 ILE MD 5.190 . 5.190 3.315 2.593 3.849 . 0 0 "[ . 1 . 2]" 1 721 1 56 ILE H 1 57 GLN H 4.260 . 4.260 2.716 2.611 2.809 . 0 0 "[ . 1 . 2]" 1 722 1 56 ILE HA 1 59 LEU QD 5.920 . 5.920 3.505 3.124 4.165 . 0 0 "[ . 1 . 2]" 1 723 1 56 ILE HB 1 56 ILE MD 3.480 . 3.480 2.758 2.253 3.261 . 0 0 "[ . 1 . 2]" 1 724 1 56 ILE HB 1 59 LEU H 6.000 . 6.000 5.385 5.149 5.528 . 0 0 "[ . 1 . 2]" 1 725 1 56 ILE MD 1 57 GLN H 4.520 . 4.520 4.450 4.200 4.808 0.288 8 0 "[ . 1 . 2]" 1 726 1 56 ILE MD 1 58 HIS H 6.000 . 6.000 5.957 5.402 6.294 0.294 16 0 "[ . 1 . 2]" 1 727 1 56 ILE MD 1 59 LEU H 6.000 . 6.000 5.604 4.710 6.456 0.456 9 0 "[ . 1 . 2]" 1 728 1 56 ILE MD 2 42 VAL QG 5.770 . 5.770 5.039 3.226 5.903 0.133 18 0 "[ . 1 . 2]" 1 729 1 56 ILE QG 1 57 GLN H 4.040 . 4.040 3.955 3.655 4.165 0.125 6 0 "[ . 1 . 2]" 1 730 1 56 ILE MG 1 57 GLN H 6.000 . 6.000 3.243 3.080 3.520 . 0 0 "[ . 1 . 2]" 1 731 1 56 ILE MG 1 57 GLN HA 6.000 . 6.000 3.367 3.225 3.742 . 0 0 "[ . 1 . 2]" 1 732 1 56 ILE MG 1 57 GLN QG 5.810 . 5.810 3.587 3.304 3.971 . 0 0 "[ . 1 . 2]" 1 733 1 56 ILE MG 1 59 LEU QD 4.290 . 4.290 3.844 3.375 4.533 0.243 2 0 "[ . 1 . 2]" 1 734 1 56 ILE MG 1 60 ASP H 6.000 . 6.000 4.405 3.864 4.757 . 0 0 "[ . 1 . 2]" 1 735 1 57 GLN HA 2 42 VAL QG 4.870 . 4.870 4.659 3.827 5.086 0.216 16 0 "[ . 1 . 2]" 1 736 1 57 GLN QG 2 42 VAL QG 3.670 . 3.670 3.578 3.011 3.829 0.159 6 0 "[ . 1 . 2]" 1 737 1 58 HIS H 1 59 LEU H 3.730 . 3.730 2.546 2.462 2.647 . 0 0 "[ . 1 . 2]" 1 738 1 58 HIS H 1 59 LEU HB2 4.800 . 4.800 4.732 4.372 4.888 0.088 17 0 "[ . 1 . 2]" 1 739 1 58 HIS HA 1 61 GLU H 4.140 . 4.140 3.661 3.392 3.869 . 0 0 "[ . 1 . 2]" 1 740 1 59 LEU H 1 59 LEU MD1 4.980 . 4.980 4.036 3.899 4.274 . 0 0 "[ . 1 . 2]" 1 741 1 59 LEU H 1 59 LEU QD 4.160 . 4.160 3.632 3.281 3.789 . 0 0 "[ . 1 . 2]" 1 742 1 59 LEU H 1 59 LEU MD2 4.980 . 4.980 4.185 3.412 4.374 . 0 0 "[ . 1 . 2]" 1 743 1 59 LEU H 1 60 ASP H 3.820 . 3.820 2.716 2.470 2.804 . 0 0 "[ . 1 . 2]" 1 744 1 59 LEU H 1 61 GLU H 6.000 . 6.000 4.360 4.141 4.718 . 0 0 "[ . 1 . 2]" 1 745 1 59 LEU HA 1 59 LEU QD 3.810 . 3.810 2.151 2.012 2.270 . 0 0 "[ . 1 . 2]" 1 746 1 59 LEU HA 1 62 ALA MB 6.000 . 6.000 3.179 2.587 3.614 . 0 0 "[ . 1 . 2]" 1 747 1 59 LEU HB2 1 61 GLU QG 5.810 . 5.810 5.671 5.320 6.082 0.272 4 0 "[ . 1 . 2]" 1 748 1 59 LEU QD 1 60 ASP H 4.820 . 4.820 4.024 3.556 4.211 . 0 0 "[ . 1 . 2]" 1 749 1 59 LEU QD 1 62 ALA MB 4.090 . 4.090 2.218 2.016 2.610 . 0 0 "[ . 1 . 2]" 1 750 1 59 LEU MD1 1 60 ASP H 6.000 . 6.000 4.550 3.670 4.803 . 0 0 "[ . 1 . 2]" 1 751 1 59 LEU MD2 1 60 ASP H 6.000 . 6.000 4.573 3.861 4.789 . 0 0 "[ . 1 . 2]" 1 752 1 59 LEU HG 1 60 ASP H 6.000 . 6.000 4.399 3.924 5.271 . 0 0 "[ . 1 . 2]" 1 753 1 59 LEU HG 1 63 TYR H 6.000 . 6.000 4.299 3.596 6.004 0.004 2 0 "[ . 1 . 2]" 1 754 1 60 ASP H 1 61 GLU HA 5.500 . 5.500 5.334 5.232 5.476 . 0 0 "[ . 1 . 2]" 1 755 1 60 ASP H 1 61 GLU QB 5.780 . 5.780 4.666 4.489 4.787 . 0 0 "[ . 1 . 2]" 1 756 1 60 ASP H 1 61 GLU QG 5.810 . 5.810 4.556 4.255 4.909 . 0 0 "[ . 1 . 2]" 1 757 1 60 ASP QB 1 61 GLU QG 5.610 . 5.610 5.040 4.719 5.390 . 0 0 "[ . 1 . 2]" 1 758 1 60 ASP QB 1 62 ALA H 5.810 . 5.810 4.745 4.416 5.141 . 0 0 "[ . 1 . 2]" 1 759 1 60 ASP QB 1 63 TYR H 5.810 . 5.810 5.071 4.594 5.350 . 0 0 "[ . 1 . 2]" 1 760 1 60 ASP QB 1 63 TYR QD 5.180 . 5.180 3.458 2.717 4.228 . 0 0 "[ . 1 . 2]" 1 761 1 60 ASP QB 1 63 TYR QE 5.060 . 5.060 4.280 2.616 5.145 0.085 11 0 "[ . 1 . 2]" 1 762 1 61 GLU H 1 61 GLU QB 3.410 . 3.410 2.257 2.176 2.347 . 0 0 "[ . 1 . 2]" 1 763 1 61 GLU H 1 61 GLU QG 3.490 . 3.490 2.604 2.324 2.879 . 0 0 "[ . 1 . 2]" 1 764 1 61 GLU H 1 62 ALA HA 6.000 . 6.000 5.275 5.108 5.347 . 0 0 "[ . 1 . 2]" 1 765 1 61 GLU HA 1 61 GLU QG 3.560 . 3.560 3.317 3.290 3.337 . 0 0 "[ . 1 . 2]" 1 766 1 61 GLU HA 1 63 TYR H 6.000 . 6.000 4.906 4.567 5.035 . 0 0 "[ . 1 . 2]" 1 767 1 61 GLU QB 1 62 ALA H 4.030 . 4.030 3.479 3.369 3.665 . 0 0 "[ . 1 . 2]" 1 768 1 61 GLU QG 1 62 ALA H 4.100 . 4.100 2.043 1.824 2.454 . 0 0 "[ . 1 . 2]" 1 769 1 61 GLU QG 1 65 LYS QB 5.610 . 5.610 4.203 3.597 5.083 . 0 0 "[ . 1 . 2]" 1 770 1 62 ALA H 1 63 TYR H 3.730 . 3.730 2.705 2.434 2.864 . 0 0 "[ . 1 . 2]" 1 771 1 62 ALA H 1 63 TYR QB 5.810 . 5.810 4.318 4.076 4.740 . 0 0 "[ . 1 . 2]" 1 772 1 62 ALA H 1 65 LYS QB 5.320 . 5.320 4.756 4.362 5.274 . 0 0 "[ . 1 . 2]" 1 773 1 62 ALA HA 1 65 LYS QB 5.410 . 5.410 2.631 2.219 2.894 . 0 0 "[ . 1 . 2]" 1 774 1 62 ALA MB 1 63 TYR H 4.210 . 4.210 2.207 2.052 2.552 . 0 0 "[ . 1 . 2]" 1 775 1 63 TYR H 1 63 TYR QD 4.560 . 4.560 3.600 2.797 3.970 . 0 0 "[ . 1 . 2]" 1 776 1 63 TYR H 1 63 TYR QE 6.000 . 6.000 5.710 4.835 6.061 0.061 15 0 "[ . 1 . 2]" 1 777 1 63 TYR H 1 64 ASN H 4.250 . 4.250 2.804 2.717 2.897 . 0 0 "[ . 1 . 2]" 1 778 1 63 TYR H 1 64 ASN HA 6.000 . 6.000 5.394 5.325 5.473 . 0 0 "[ . 1 . 2]" 1 779 1 63 TYR H 1 64 ASN QB 5.810 . 5.810 4.595 4.462 5.194 . 0 0 "[ . 1 . 2]" 1 780 1 63 TYR H 1 65 LYS QB 5.810 . 5.810 4.902 4.523 5.119 . 0 0 "[ . 1 . 2]" 1 781 1 63 TYR H 1 66 VAL HB 6.000 . 6.000 5.658 5.214 5.973 . 0 0 "[ . 1 . 2]" 1 782 1 63 TYR QB 1 64 ASN H 3.570 . 3.570 3.001 2.743 3.354 . 0 0 "[ . 1 . 2]" 1 783 1 63 TYR QD 1 64 ASN H 4.230 . 4.230 2.598 2.171 2.998 . 0 0 "[ . 1 . 2]" 1 784 1 63 TYR QE 1 64 ASN H 4.380 . 4.380 4.139 3.798 4.439 0.059 15 0 "[ . 1 . 2]" 1 785 1 63 TYR QE 1 67 LYS QD 4.830 . 4.830 2.811 2.345 4.369 . 0 0 "[ . 1 . 2]" 1 786 1 63 TYR QE 1 67 LYS HG3 3.950 . 3.950 2.925 2.473 3.930 . 0 0 "[ . 1 . 2]" 1 787 1 64 ASN H 1 66 VAL HB 6.000 . 6.000 5.370 5.060 5.912 . 0 0 "[ . 1 . 2]" 1 788 1 64 ASN H 1 68 ARG H 6.000 . 6.000 5.977 5.639 6.168 0.168 7 0 "[ . 1 . 2]" 1 789 1 64 ASN HA 1 67 LYS H 3.840 . 3.840 3.575 3.393 3.855 0.015 18 0 "[ . 1 . 2]" 1 790 1 64 ASN HA 1 68 ARG H 4.040 . 4.040 3.915 3.489 4.141 0.101 12 0 "[ . 1 . 2]" 1 791 1 65 LYS H 1 66 VAL H 3.410 . 3.410 2.638 2.454 2.767 . 0 0 "[ . 1 . 2]" 1 792 1 65 LYS H 1 66 VAL QG 5.610 . 5.610 3.981 3.499 4.211 . 0 0 "[ . 1 . 2]" 1 793 1 65 LYS H 1 67 LYS H 4.710 . 4.710 4.360 4.052 4.683 . 0 0 "[ . 1 . 2]" 1 794 1 65 LYS HA 1 67 LYS H 6.000 . 6.000 4.623 4.300 4.940 . 0 0 "[ . 1 . 2]" 1 795 1 66 VAL H 1 66 VAL HB 4.170 . 4.170 2.491 2.227 2.653 . 0 0 "[ . 1 . 2]" 1 796 1 66 VAL H 1 66 VAL MG1 3.700 . 3.700 3.709 2.699 3.785 0.085 17 0 "[ . 1 . 2]" 1 797 1 66 VAL H 1 66 VAL QG 3.100 . 3.100 2.141 1.886 2.630 . 0 0 "[ . 1 . 2]" 1 798 1 66 VAL H 1 66 VAL MG2 3.700 . 3.700 2.202 1.891 3.640 . 0 0 "[ . 1 . 2]" 1 799 1 66 VAL H 1 67 LYS HG3 4.660 . 4.660 4.807 4.524 5.145 0.485 15 0 "[ . 1 . 2]" 1 800 1 66 VAL HA 1 66 VAL QG 2.950 . 2.950 2.097 2.074 2.212 . 0 0 "[ . 1 . 2]" 1 801 1 66 VAL HA 1 66 VAL MG2 3.430 . 3.430 2.315 2.255 2.416 . 0 0 "[ . 1 . 2]" 1 802 1 66 VAL HA 1 68 ARG H 6.000 . 6.000 4.645 4.457 4.915 . 0 0 "[ . 1 . 2]" 1 803 1 66 VAL HB 1 67 LYS HA 6.000 . 6.000 4.361 4.104 5.472 . 0 0 "[ . 1 . 2]" 1 804 1 66 VAL QG 1 67 LYS H 3.710 . 3.710 2.998 1.864 3.187 . 0 0 "[ . 1 . 2]" 1 805 1 66 VAL QG 1 67 LYS HA 4.230 . 4.230 3.304 2.844 3.581 . 0 0 "[ . 1 . 2]" 1 806 1 66 VAL QG 1 69 GLY H 5.920 . 5.920 4.290 4.157 4.411 . 0 0 "[ . 1 . 2]" 1 807 1 66 VAL QG 1 70 GLU QG 3.120 . 3.120 2.885 2.100 3.614 0.494 15 0 "[ . 1 . 2]" 1 808 1 67 LYS H 1 67 LYS HB2 3.660 . 3.660 2.500 2.381 2.631 . 0 0 "[ . 1 . 2]" 1 809 1 67 LYS H 1 68 ARG H 3.610 . 3.610 2.660 2.594 2.794 . 0 0 "[ . 1 . 2]" 1 810 1 67 LYS H 1 68 ARG HB3 6.000 . 6.000 5.337 4.889 6.142 0.142 2 0 "[ . 1 . 2]" 1 811 1 67 LYS H 1 69 GLY H 5.150 . 5.150 3.837 3.618 4.005 . 0 0 "[ . 1 . 2]" 1 812 1 67 LYS H 1 70 GLU QB 5.490 . 5.490 5.138 4.462 5.849 0.359 6 0 "[ . 1 . 2]" 1 813 1 67 LYS H 1 70 GLU QG 5.810 . 5.810 4.388 3.963 4.841 . 0 0 "[ . 1 . 2]" 1 814 1 67 LYS HA 1 67 LYS QD 4.810 . 4.810 3.015 2.319 3.709 . 0 0 "[ . 1 . 2]" 1 815 1 67 LYS HA 1 67 LYS HG3 3.440 . 3.440 3.611 3.448 3.718 0.278 12 0 "[ . 1 . 2]" 1 816 1 67 LYS HA 1 70 GLU H 4.290 . 4.290 3.334 2.929 4.325 0.035 15 0 "[ . 1 . 2]" 1 817 1 67 LYS HB2 1 68 ARG H 4.150 . 4.150 2.404 2.282 2.477 . 0 0 "[ . 1 . 2]" 1 818 1 67 LYS HB2 1 68 ARG QD 5.810 . 5.810 5.429 4.708 6.041 0.231 4 0 "[ . 1 . 2]" 1 819 1 67 LYS QD 1 70 GLU H 5.810 . 5.810 5.958 5.467 6.228 0.418 5 0 "[ . 1 . 2]" 1 820 1 67 LYS HG3 1 68 ARG H 4.520 . 4.520 4.284 3.910 4.524 0.004 2 0 "[ . 1 . 2]" 1 821 1 67 LYS HG3 1 69 GLY H 6.000 . 6.000 6.100 5.651 6.293 0.293 14 0 "[ . 1 . 2]" 1 822 1 68 ARG H 1 68 ARG QD 4.990 . 4.990 4.213 3.705 4.683 . 0 0 "[ . 1 . 2]" 1 823 1 68 ARG H 1 68 ARG QG 3.640 . 3.640 3.517 2.400 4.064 0.424 12 0 "[ . 1 . 2]" 1 824 1 68 ARG H 1 69 GLY H 2.930 . 2.930 2.605 2.380 2.730 . 0 0 "[ . 1 . 2]" 1 825 1 68 ARG H 1 69 GLY QA 4.330 . 4.330 4.482 4.267 4.599 0.269 17 0 "[ . 1 . 2]" 1 826 1 68 ARG H 1 70 GLU H 4.880 . 4.880 4.116 3.841 4.994 0.114 15 0 "[ . 1 . 2]" 1 827 1 68 ARG H 1 70 GLU QB 5.810 . 5.810 5.363 4.711 6.298 0.488 6 0 "[ . 1 . 2]" 1 828 1 68 ARG H 1 70 GLU HG2 6.000 . 6.000 5.424 4.385 5.846 . 0 0 "[ . 1 . 2]" 1 829 1 68 ARG H 1 70 GLU HG3 6.000 . 6.000 5.666 4.423 6.460 0.460 9 0 "[ . 1 . 2]" 1 830 1 68 ARG HA 1 68 ARG QG 3.030 . 3.030 2.356 2.273 2.533 . 0 0 "[ . 1 . 2]" 1 831 1 68 ARG HB3 1 68 ARG QD 3.390 . 3.390 2.754 2.308 3.283 . 0 0 "[ . 1 . 2]" 1 832 1 68 ARG HB3 1 69 GLY H 3.520 . 3.520 3.377 2.878 4.006 0.486 2 0 "[ . 1 . 2]" 1 833 1 68 ARG HB3 1 69 GLY QA 4.460 . 4.460 4.044 3.890 4.317 . 0 0 "[ . 1 . 2]" 1 834 1 68 ARG QG 1 69 GLY H 4.680 . 4.680 4.234 3.923 4.440 . 0 0 "[ . 1 . 2]" 1 835 1 69 GLY H 1 69 GLY QA 2.580 . 2.580 2.260 2.215 2.349 . 0 0 "[ . 1 . 2]" 1 836 1 69 GLY H 1 70 GLU H 3.330 . 3.330 2.268 2.019 2.705 . 0 0 "[ . 1 . 2]" 1 837 1 69 GLY H 1 70 GLU HA 5.040 . 5.040 4.922 4.543 5.106 0.066 6 0 "[ . 1 . 2]" 1 838 1 69 GLY H 1 70 GLU QB 5.810 . 5.810 4.307 3.893 4.771 . 0 0 "[ . 1 . 2]" 1 839 1 69 GLY H 1 70 GLU QG 4.750 . 4.750 3.638 2.901 4.320 . 0 0 "[ . 1 . 2]" 1 840 1 69 GLY QA 1 70 GLU H 3.100 . 3.100 2.790 2.308 2.901 . 0 0 "[ . 1 . 2]" 1 841 1 69 GLY QA 1 70 GLU HA 5.240 . 5.240 4.067 4.017 4.149 . 0 0 "[ . 1 . 2]" 1 842 1 70 GLU H 1 70 GLU QB 3.050 . 3.050 2.442 2.161 2.775 . 0 0 "[ . 1 . 2]" 1 843 1 70 GLU H 1 70 GLU QG 3.810 . 3.810 2.388 1.890 2.949 . 0 0 "[ . 1 . 2]" 1 844 1 70 GLU HA 1 70 GLU QB 2.600 . 2.600 2.324 2.181 2.558 . 0 0 "[ . 1 . 2]" 1 845 1 70 GLU HA 1 70 GLU QG 3.080 . 3.080 2.960 2.451 3.423 0.343 2 0 "[ . 1 . 2]" 1 846 1 70 GLU HB2 1 71 SER H 4.130 . 4.130 2.981 1.809 4.016 . 0 0 "[ . 1 . 2]" 1 847 1 70 GLU HB3 1 71 SER H 4.130 . 4.130 2.657 1.804 3.982 . 0 0 "[ . 1 . 2]" 1 848 1 71 SER H 1 71 SER QB 3.060 . 3.060 2.820 2.239 3.228 0.168 3 0 "[ . 1 . 2]" 1 849 1 71 SER H 1 72 LYS QG 5.810 . 5.810 4.904 3.462 6.199 0.389 15 0 "[ . 1 . 2]" 1 850 1 71 SER HA 1 72 LYS H 3.070 . 3.070 2.527 2.119 3.519 0.449 9 0 "[ . 1 . 2]" 1 851 1 71 SER HA 1 72 LYS QB 4.870 . 4.870 4.393 4.013 5.255 0.385 18 0 "[ . 1 . 2]" 1 852 1 71 SER QB 1 72 LYS H 3.890 . 3.890 3.165 1.749 4.047 0.157 13 0 "[ . 1 . 2]" 1 853 1 71 SER QB 1 73 LEU H 5.610 . 5.610 4.530 2.407 5.704 0.094 12 0 "[ . 1 . 2]" 1 854 1 72 LYS H 1 72 LYS HB2 4.020 . 4.020 3.073 2.381 3.977 . 0 0 "[ . 1 . 2]" 1 855 1 72 LYS H 1 72 LYS QB 3.480 . 3.480 2.808 2.318 3.463 . 0 0 "[ . 1 . 2]" 1 856 1 72 LYS H 1 72 LYS HB3 4.020 . 4.020 3.578 2.646 4.089 0.069 9 0 "[ . 1 . 2]" 1 857 1 72 LYS H 1 72 LYS QG 4.160 . 4.160 2.599 1.837 4.356 0.196 20 0 "[ . 1 . 2]" 1 858 1 72 LYS H 1 74 GLU HG2 6.000 . 6.000 5.194 3.402 6.194 0.194 20 0 "[ . 1 . 2]" 1 859 1 72 LYS H 1 74 GLU HG3 6.000 . 6.000 5.202 3.181 6.419 0.419 18 0 "[ . 1 . 2]" 1 860 1 72 LYS HA 1 72 LYS QG 3.610 . 3.610 2.684 2.268 3.312 . 0 0 "[ . 1 . 2]" 1 861 1 72 LYS HA 1 73 LEU H 3.570 . 3.570 3.084 2.112 3.568 . 0 0 "[ . 1 . 2]" 1 862 1 72 LYS QB 1 73 LEU H 3.900 . 3.900 2.899 1.729 4.034 0.134 16 0 "[ . 1 . 2]" 1 863 1 72 LYS QB 1 73 LEU QD 5.730 . 5.730 3.915 2.058 5.573 . 0 0 "[ . 1 . 2]" 1 864 1 73 LEU H 1 73 LEU QB 3.000 . 3.000 2.697 2.215 3.366 0.366 9 0 "[ . 1 . 2]" 1 865 1 73 LEU H 1 73 LEU QD 4.530 . 4.530 3.127 1.793 4.152 0.007 4 0 "[ . 1 . 2]" 1 866 1 73 LEU H 1 73 LEU HG 4.490 . 4.490 3.576 1.836 4.628 0.138 11 0 "[ . 1 . 2]" 1 867 1 73 LEU H 1 74 GLU QG 5.810 . 5.810 3.941 2.535 4.981 . 0 0 "[ . 1 . 2]" 1 868 1 73 LEU HA 1 73 LEU QD 3.480 . 3.480 2.356 2.036 3.427 . 0 0 "[ . 1 . 2]" 1 869 1 73 LEU HA 1 73 LEU HG 3.510 . 3.510 2.879 2.346 3.644 0.134 4 0 "[ . 1 . 2]" 1 870 1 73 LEU HA 1 74 GLU H 3.220 . 3.220 2.893 2.209 3.556 0.336 4 0 "[ . 1 . 2]" 1 871 1 73 LEU HA 1 74 GLU QB 5.340 . 5.340 4.750 4.062 5.540 0.200 6 0 "[ . 1 . 2]" 1 872 1 73 LEU QB 1 73 LEU QD 2.700 . 2.700 1.941 1.915 2.029 . 0 0 "[ . 1 . 2]" 1 873 1 73 LEU QB 1 74 GLU H 4.120 . 4.120 3.289 1.772 4.045 0.028 9 0 "[ . 1 . 2]" 1 874 1 73 LEU QB 1 74 GLU QG 5.100 . 5.100 4.235 2.697 5.194 0.094 12 0 "[ . 1 . 2]" 1 875 1 73 LEU QD 1 74 GLU H 4.670 . 4.670 3.731 1.862 4.445 . 0 0 "[ . 1 . 2]" 1 876 1 73 LEU QD 1 75 HIS H 5.800 . 5.800 4.485 2.136 5.431 . 0 0 "[ . 1 . 2]" 1 877 1 73 LEU QD 1 75 HIS QB 5.730 . 5.730 4.952 2.256 6.000 0.270 18 0 "[ . 1 . 2]" 1 878 1 73 LEU HG 1 74 GLU H 4.460 . 4.460 4.247 3.649 4.907 0.447 18 0 "[ . 1 . 2]" 1 879 1 74 GLU H 1 74 GLU QB 3.190 . 3.190 2.891 2.364 3.436 0.246 1 0 "[ . 1 . 2]" 1 880 1 74 GLU H 1 74 GLU QG 3.710 . 3.710 2.395 1.750 3.328 0.050 19 0 "[ . 1 . 2]" 1 881 1 74 GLU HA 1 74 GLU HG2 4.110 . 4.110 2.979 2.421 3.754 . 0 0 "[ . 1 . 2]" 1 882 1 74 GLU HA 1 74 GLU QG 3.530 . 3.530 2.771 2.337 3.316 . 0 0 "[ . 1 . 2]" 1 883 1 74 GLU HA 1 74 GLU HG3 4.110 . 4.110 3.383 2.933 3.757 . 0 0 "[ . 1 . 2]" 1 884 1 74 GLU HA 1 75 HIS H 3.370 . 3.370 3.008 2.172 3.563 0.193 8 0 "[ . 1 . 2]" 1 885 1 74 GLU QB 1 75 HIS HA 5.810 . 5.810 4.513 3.882 5.507 . 0 0 "[ . 1 . 2]" 1 886 2 2 SER QB 2 3 GLU H 4.450 . 4.450 3.113 1.759 3.995 0.041 7 0 "[ . 1 . 2]" 1 887 2 2 SER HB2 2 3 GLU H 5.080 . 5.080 3.593 1.965 4.459 . 0 0 "[ . 1 . 2]" 1 888 2 2 SER HB3 2 3 GLU H 5.080 . 5.080 3.702 1.985 4.511 . 0 0 "[ . 1 . 2]" 1 889 2 3 GLU H 2 4 LEU H 6.000 . 6.000 4.048 2.925 4.641 . 0 0 "[ . 1 . 2]" 1 890 2 3 GLU HA 2 4 LEU H 3.440 . 3.440 2.375 2.165 3.245 . 0 0 "[ . 1 . 2]" 1 891 2 3 GLU HA 2 4 LEU HA 4.610 . 4.610 4.495 4.264 5.094 0.484 3 0 "[ . 1 . 2]" 1 892 2 3 GLU HA 2 4 LEU QB 4.470 . 4.470 4.349 3.912 4.807 0.337 10 0 "[ . 1 . 2]" 1 893 2 3 GLU QG 2 4 LEU H 5.840 . 5.840 3.869 2.289 4.761 . 0 0 "[ . 1 . 2]" 1 894 2 3 GLU QG 2 4 LEU QD 5.790 . 5.790 4.748 2.281 5.850 0.060 14 0 "[ . 1 . 2]" 1 895 2 4 LEU H 2 4 LEU QB 3.570 . 3.570 2.829 2.202 3.403 . 0 0 "[ . 1 . 2]" 1 896 2 4 LEU H 2 4 LEU QD 4.500 . 4.500 2.802 1.768 4.136 0.032 9 0 "[ . 1 . 2]" 1 897 2 4 LEU H 2 4 LEU HG 4.880 . 4.880 3.394 1.861 4.680 . 0 0 "[ . 1 . 2]" 1 898 2 4 LEU H 2 6 SER H 6.000 . 6.000 4.718 2.905 6.413 0.413 13 0 "[ . 1 . 2]" 1 899 2 4 LEU H 2 9 TYR QD 5.000 . 5.000 4.790 2.483 5.353 0.353 9 0 "[ . 1 . 2]" 1 900 2 4 LEU H 2 9 TYR QE 5.260 . 5.260 5.068 1.847 5.556 0.296 18 0 "[ . 1 . 2]" 1 901 2 4 LEU HA 2 4 LEU MD1 4.340 . 4.340 3.191 2.153 4.104 . 0 0 "[ . 1 . 2]" 1 902 2 4 LEU HA 2 4 LEU QD 3.680 . 3.680 2.347 2.004 3.376 . 0 0 "[ . 1 . 2]" 1 903 2 4 LEU HA 2 4 LEU MD2 4.340 . 4.340 2.841 2.162 4.128 . 0 0 "[ . 1 . 2]" 1 904 2 4 LEU HA 2 6 SER H 6.000 . 6.000 4.152 3.440 5.156 . 0 0 "[ . 1 . 2]" 1 905 2 4 LEU HA 2 9 TYR QD 5.060 . 5.060 3.048 2.356 3.898 . 0 0 "[ . 1 . 2]" 1 906 2 4 LEU HA 2 9 TYR QE 4.820 . 4.820 4.040 2.713 4.760 . 0 0 "[ . 1 . 2]" 1 907 2 4 LEU QB 2 4 LEU QD 2.800 . 2.800 1.951 1.919 2.030 . 0 0 "[ . 1 . 2]" 1 908 2 4 LEU QD 2 9 TYR QD 4.370 . 4.370 3.010 2.248 4.325 . 0 0 "[ . 1 . 2]" 1 909 2 4 LEU QD 2 9 TYR QE 4.060 . 4.060 2.992 2.137 4.336 0.276 17 0 "[ . 1 . 2]" 1 910 2 4 LEU QD 2 10 PHE QE 4.150 . 4.150 2.839 2.162 4.074 . 0 0 "[ . 1 . 2]" 1 911 2 4 LEU MD1 2 9 TYR QD 5.590 . 5.590 4.007 2.256 5.592 0.002 17 0 "[ . 1 . 2]" 1 912 2 4 LEU MD1 2 9 TYR QE 4.750 . 4.750 3.914 2.279 5.028 0.278 18 0 "[ . 1 . 2]" 1 913 2 4 LEU MD1 2 10 PHE QD 6.000 . 6.000 4.473 2.695 6.038 0.038 17 0 "[ . 1 . 2]" 1 914 2 4 LEU MD1 2 10 PHE QE 4.980 . 4.980 3.462 2.174 4.615 . 0 0 "[ . 1 . 2]" 1 915 2 4 LEU MD2 2 9 TYR QD 5.590 . 5.590 3.725 2.268 4.911 . 0 0 "[ . 1 . 2]" 1 916 2 4 LEU MD2 2 9 TYR QE 4.750 . 4.750 3.626 2.141 4.852 0.102 16 0 "[ . 1 . 2]" 1 917 2 4 LEU MD2 2 10 PHE QD 6.000 . 6.000 4.419 2.703 5.780 . 0 0 "[ . 1 . 2]" 1 918 2 4 LEU MD2 2 10 PHE QE 4.980 . 4.980 3.533 2.272 4.990 0.010 8 0 "[ . 1 . 2]" 1 919 2 6 SER H 2 7 VAL H 6.000 . 6.000 4.297 2.500 4.672 . 0 0 "[ . 1 . 2]" 1 920 2 7 VAL H 2 7 VAL HB 4.070 . 4.070 2.722 2.263 3.072 . 0 0 "[ . 1 . 2]" 1 921 2 7 VAL H 2 7 VAL QG 4.200 . 4.200 1.985 1.732 2.544 0.068 2 0 "[ . 1 . 2]" 1 922 2 7 VAL H 2 10 PHE H 6.000 . 6.000 5.508 5.092 5.696 . 0 0 "[ . 1 . 2]" 1 923 2 7 VAL HA 2 9 TYR H 3.730 . 3.730 3.745 3.441 3.946 0.216 4 0 "[ . 1 . 2]" 1 924 2 7 VAL HB 2 8 PRO HA 4.840 . 4.840 4.247 3.936 4.715 . 0 0 "[ . 1 . 2]" 1 925 2 7 VAL HB 2 9 TYR H 4.790 . 4.790 4.853 4.612 5.013 0.223 4 0 "[ . 1 . 2]" 1 926 2 7 VAL QG 2 10 PHE H 5.690 . 5.690 4.083 3.689 4.648 . 0 0 "[ . 1 . 2]" 1 927 2 7 VAL QG 2 61 GLU H 5.920 . 5.920 5.312 4.558 5.916 . 0 0 "[ . 1 . 2]" 1 928 2 7 VAL QG 2 61 GLU QG 3.630 . 3.630 3.101 2.539 3.578 . 0 0 "[ . 1 . 2]" 1 929 2 7 VAL QG 2 62 ALA H 5.920 . 5.920 4.810 4.319 5.245 . 0 0 "[ . 1 . 2]" 1 930 2 7 VAL MG1 2 61 GLU HG2 6.000 . 6.000 3.632 3.058 4.274 . 0 0 "[ . 1 . 2]" 1 931 2 7 VAL MG1 2 61 GLU HG3 6.000 . 6.000 3.532 2.637 4.059 . 0 0 "[ . 1 . 2]" 1 932 2 7 VAL MG2 2 61 GLU HG2 6.000 . 6.000 5.429 3.813 5.970 . 0 0 "[ . 1 . 2]" 1 933 2 7 VAL MG2 2 61 GLU HG3 6.000 . 6.000 5.418 3.818 6.138 0.138 9 0 "[ . 1 . 2]" 1 934 2 8 PRO HA 2 10 PHE H 4.850 . 4.850 4.330 4.110 5.049 0.199 13 0 "[ . 1 . 2]" 1 935 2 8 PRO HA 2 11 ILE H 4.270 . 4.270 3.421 3.242 4.080 . 0 0 "[ . 1 . 2]" 1 936 2 8 PRO HA 2 11 ILE HB 3.590 . 3.590 2.930 2.381 3.273 . 0 0 "[ . 1 . 2]" 1 937 2 8 PRO HA 2 11 ILE MD 4.620 . 4.620 2.541 2.332 3.314 . 0 0 "[ . 1 . 2]" 1 938 2 8 PRO HA 2 11 ILE MG 4.480 . 4.480 4.268 3.772 4.485 0.005 20 0 "[ . 1 . 2]" 1 939 2 8 PRO HA 2 12 GLU H 4.130 . 4.130 4.049 3.436 4.389 0.259 2 0 "[ . 1 . 2]" 1 940 2 8 PRO QB 2 9 TYR H 4.110 . 4.110 3.072 2.694 3.407 . 0 0 "[ . 1 . 2]" 1 941 2 8 PRO QB 2 11 ILE H 5.500 . 5.500 4.899 4.658 5.473 . 0 0 "[ . 1 . 2]" 1 942 2 8 PRO QB 2 11 ILE MG 5.140 . 5.140 4.988 4.630 5.400 0.260 13 0 "[ . 1 . 2]" 1 943 2 9 TYR H 2 9 TYR QD 5.300 . 5.300 4.186 4.164 4.230 . 0 0 "[ . 1 . 2]" 1 944 2 9 TYR H 2 10 PHE H 4.240 . 4.240 2.671 2.515 2.771 . 0 0 "[ . 1 . 2]" 1 945 2 9 TYR QD 2 10 PHE H 4.680 . 4.680 3.476 3.050 3.858 . 0 0 "[ . 1 . 2]" 1 946 2 9 TYR QD 2 10 PHE QE 4.690 . 4.690 3.682 2.368 4.282 . 0 0 "[ . 1 . 2]" 1 947 2 9 TYR QD 2 10 PHE HZ 6.000 . 6.000 5.747 4.772 6.315 0.315 14 0 "[ . 1 . 2]" 1 948 2 9 TYR QE 2 10 PHE QD 5.150 . 5.150 4.309 3.443 4.773 . 0 0 "[ . 1 . 2]" 1 949 2 9 TYR QE 2 10 PHE QE 4.700 . 4.700 4.352 2.405 4.844 0.144 2 0 "[ . 1 . 2]" 1 950 2 10 PHE H 2 11 ILE H 4.310 . 4.310 2.697 2.572 2.988 . 0 0 "[ . 1 . 2]" 1 951 2 10 PHE H 2 12 GLU H 5.630 . 5.630 4.197 4.013 4.382 . 0 0 "[ . 1 . 2]" 1 952 2 10 PHE QB 2 37 VAL QG 5.180 . 5.180 4.356 3.837 4.982 . 0 0 "[ . 1 . 2]" 1 953 2 10 PHE QB 2 59 LEU QD 4.400 . 4.400 3.240 2.268 4.104 . 0 0 "[ . 1 . 2]" 1 954 2 10 PHE QB 2 62 ALA H 5.810 . 5.810 5.771 4.735 6.074 0.264 14 0 "[ . 1 . 2]" 1 955 2 10 PHE QB 2 62 ALA MB 4.940 . 4.940 3.306 2.599 3.677 . 0 0 "[ . 1 . 2]" 1 956 2 10 PHE QD 2 33 TYR QE 5.320 . 5.320 2.552 2.297 3.024 . 0 0 "[ . 1 . 2]" 1 957 2 10 PHE QD 2 37 VAL HB 6.000 . 6.000 5.120 4.547 5.709 . 0 0 "[ . 1 . 2]" 1 958 2 10 PHE QD 2 37 VAL QG 3.820 . 3.820 2.883 2.352 3.611 . 0 0 "[ . 1 . 2]" 1 959 2 10 PHE QD 2 59 LEU HB2 6.000 . 6.000 5.415 4.663 6.077 0.077 11 0 "[ . 1 . 2]" 1 960 2 10 PHE QE 2 37 VAL MG1 4.110 . 4.110 2.329 2.061 3.218 . 0 0 "[ . 1 . 2]" 1 961 2 10 PHE QE 2 37 VAL QG 3.510 . 3.510 2.076 1.870 2.617 . 0 0 "[ . 1 . 2]" 1 962 2 10 PHE QE 2 37 VAL MG2 4.110 . 4.110 2.368 2.122 2.857 . 0 0 "[ . 1 . 2]" 1 963 2 10 PHE QE 2 59 LEU QD 3.820 . 3.820 3.205 2.295 3.962 0.142 18 0 "[ . 1 . 2]" 1 964 2 10 PHE HZ 2 37 VAL MG1 4.310 . 4.310 3.716 3.223 3.981 . 0 0 "[ . 1 . 2]" 1 965 2 10 PHE HZ 2 37 VAL QG 3.150 . 3.150 3.380 3.151 3.496 0.346 15 0 "[ . 1 . 2]" 1 966 2 10 PHE HZ 2 37 VAL MG2 4.310 . 4.310 3.976 3.672 4.611 0.301 20 0 "[ . 1 . 2]" 1 967 2 11 ILE H 2 11 ILE HB 3.370 . 3.370 2.517 2.325 2.643 . 0 0 "[ . 1 . 2]" 1 968 2 11 ILE H 2 11 ILE MD 4.030 . 4.030 3.471 3.418 3.538 . 0 0 "[ . 1 . 2]" 1 969 2 11 ILE H 2 11 ILE QG 4.150 . 4.150 2.026 1.817 2.384 . 0 0 "[ . 1 . 2]" 1 970 2 11 ILE H 2 11 ILE MG 4.120 . 4.120 3.747 3.720 3.760 . 0 0 "[ . 1 . 2]" 1 971 2 11 ILE H 2 12 GLU H 4.100 . 4.100 2.658 2.571 2.757 . 0 0 "[ . 1 . 2]" 1 972 2 11 ILE H 2 13 ASN H 6.000 . 6.000 4.052 3.926 4.167 . 0 0 "[ . 1 . 2]" 1 973 2 11 ILE H 2 61 GLU QG 5.810 . 5.810 5.810 5.569 6.106 0.296 12 0 "[ . 1 . 2]" 1 974 2 11 ILE H 2 62 ALA HA 5.830 . 5.830 5.456 5.150 5.730 . 0 0 "[ . 1 . 2]" 1 975 2 11 ILE H 2 62 ALA MB 4.380 . 4.380 4.007 3.427 4.218 . 0 0 "[ . 1 . 2]" 1 976 2 11 ILE HA 2 14 LEU MD1 4.200 . 4.200 2.232 2.061 2.323 . 0 0 "[ . 1 . 2]" 1 977 2 11 ILE HA 2 14 LEU MD2 4.200 . 4.200 3.849 3.077 4.236 0.036 7 0 "[ . 1 . 2]" 1 978 2 11 ILE HA 2 15 LYS H 5.520 . 5.520 4.481 3.989 4.889 . 0 0 "[ . 1 . 2]" 1 979 2 11 ILE HA 2 62 ALA MB 6.000 . 6.000 2.980 2.608 3.238 . 0 0 "[ . 1 . 2]" 1 980 2 11 ILE HB 2 11 ILE MD 2.980 . 2.980 2.329 2.267 2.369 . 0 0 "[ . 1 . 2]" 1 981 2 11 ILE HB 2 12 GLU H 3.020 . 3.020 2.510 2.378 2.636 . 0 0 "[ . 1 . 2]" 1 982 2 11 ILE HB 2 61 GLU QG 5.810 . 5.810 5.859 5.554 6.172 0.362 12 0 "[ . 1 . 2]" 1 983 2 11 ILE MD 2 14 LEU QD 4.100 . 4.100 4.248 4.053 4.444 0.344 4 0 "[ . 1 . 2]" 1 984 2 11 ILE MD 2 61 GLU H 5.890 . 5.890 5.834 5.562 6.184 0.294 13 0 "[ . 1 . 2]" 1 985 2 11 ILE MD 2 61 GLU QB 4.400 . 4.400 4.137 3.884 4.433 0.033 16 0 "[ . 1 . 2]" 1 986 2 11 ILE MD 2 61 GLU QG 4.070 . 4.070 2.583 2.261 3.151 . 0 0 "[ . 1 . 2]" 1 987 2 11 ILE MD 2 62 ALA HA 4.490 . 4.490 2.536 2.291 2.841 . 0 0 "[ . 1 . 2]" 1 988 2 11 ILE MD 2 62 ALA MB 3.560 . 3.560 3.128 2.781 3.290 . 0 0 "[ . 1 . 2]" 1 989 2 11 ILE MD 2 63 TYR H 5.650 . 5.650 5.532 5.353 5.756 0.106 18 0 "[ . 1 . 2]" 1 990 2 11 ILE MD 2 64 ASN H 6.000 . 6.000 5.983 5.651 6.145 0.145 7 0 "[ . 1 . 2]" 1 991 2 11 ILE QG 2 13 ASN H 5.810 . 5.810 5.234 5.108 5.334 . 0 0 "[ . 1 . 2]" 1 992 2 11 ILE QG 2 61 GLU QG 4.170 . 4.170 3.588 3.332 3.838 . 0 0 "[ . 1 . 2]" 1 993 2 11 ILE QG 2 62 ALA H 3.890 . 3.890 4.193 3.986 4.341 0.451 8 0 "[ . 1 . 2]" 1 994 2 11 ILE QG 2 62 ALA HA 3.480 . 3.480 2.280 2.141 2.421 . 0 0 "[ . 1 . 2]" 1 995 2 11 ILE MG 2 12 GLU H 3.790 . 3.790 3.422 3.060 3.574 . 0 0 "[ . 1 . 2]" 1 996 2 11 ILE MG 2 12 GLU QG 4.760 . 4.760 4.546 4.033 5.248 0.488 13 0 "[ . 1 . 2]" 1 997 2 11 ILE MG 2 13 ASN H 6.000 . 6.000 4.577 4.420 4.802 . 0 0 "[ . 1 . 2]" 1 998 2 11 ILE MG 2 14 LEU H 6.000 . 6.000 4.003 3.808 4.230 . 0 0 "[ . 1 . 2]" 1 999 2 11 ILE MG 2 14 LEU HA 6.000 . 6.000 5.560 5.393 5.884 . 0 0 "[ . 1 . 2]" 1 1000 2 11 ILE MG 2 14 LEU QD 3.520 . 3.520 2.768 2.330 3.276 . 0 0 "[ . 1 . 2]" 1 1001 2 11 ILE MG 2 62 ALA HA 4.500 . 4.500 3.295 2.426 4.147 . 0 0 "[ . 1 . 2]" 1 1002 2 11 ILE MG 2 62 ALA MB 3.410 . 3.410 3.332 2.664 3.775 0.365 13 0 "[ . 1 . 2]" 1 1003 2 12 GLU H 2 12 GLU QB 3.320 . 3.320 2.282 2.113 2.467 . 0 0 "[ . 1 . 2]" 1 1004 2 12 GLU H 2 12 GLU QG 3.700 . 3.700 3.019 2.143 3.950 0.250 5 0 "[ . 1 . 2]" 1 1005 2 12 GLU H 2 13 ASN H 3.370 . 3.370 2.801 2.723 2.896 . 0 0 "[ . 1 . 2]" 1 1006 2 12 GLU H 2 13 ASN QB 5.030 . 5.030 4.770 4.532 5.017 . 0 0 "[ . 1 . 2]" 1 1007 2 12 GLU H 2 14 LEU H 5.650 . 5.650 4.327 4.208 4.461 . 0 0 "[ . 1 . 2]" 1 1008 2 12 GLU H 2 14 LEU QD 4.620 . 4.620 4.767 4.255 5.074 0.454 13 0 "[ . 1 . 2]" 1 1009 2 12 GLU HA 2 12 GLU QG 3.350 . 3.350 2.441 2.277 3.488 0.138 13 0 "[ . 1 . 2]" 1 1010 2 12 GLU QG 2 13 ASN H 5.810 . 5.810 4.137 2.437 4.739 . 0 0 "[ . 1 . 2]" 1 1011 2 13 ASN H 2 14 LEU H 4.080 . 4.080 2.523 2.430 2.695 . 0 0 "[ . 1 . 2]" 1 1012 2 13 ASN H 2 14 LEU QD 5.380 . 5.380 3.850 3.158 4.325 . 0 0 "[ . 1 . 2]" 1 1013 2 13 ASN H 2 15 LYS H 5.010 . 5.010 4.031 3.883 4.149 . 0 0 "[ . 1 . 2]" 1 1014 2 13 ASN H 2 33 TYR QE 5.630 . 5.630 5.721 5.474 5.879 0.249 2 0 "[ . 1 . 2]" 1 1015 2 13 ASN QB 2 15 LYS H 5.810 . 5.810 4.736 4.622 4.857 . 0 0 "[ . 1 . 2]" 1 1016 2 13 ASN QB 2 33 TYR QE 4.450 . 4.450 3.341 2.817 3.584 . 0 0 "[ . 1 . 2]" 1 1017 2 14 LEU H 2 14 LEU QB 3.540 . 3.540 2.504 2.328 2.631 . 0 0 "[ . 1 . 2]" 1 1018 2 14 LEU H 2 14 LEU MD1 3.960 . 3.960 2.879 1.725 3.516 0.075 14 0 "[ . 1 . 2]" 1 1019 2 14 LEU H 2 14 LEU QD 3.380 . 3.380 2.431 1.722 2.900 0.078 14 0 "[ . 1 . 2]" 1 1020 2 14 LEU H 2 14 LEU MD2 3.960 . 3.960 3.276 2.729 4.080 0.120 6 0 "[ . 1 . 2]" 1 1021 2 14 LEU H 2 14 LEU HG 3.830 . 3.830 2.406 1.780 3.679 0.020 8 0 "[ . 1 . 2]" 1 1022 2 14 LEU H 2 15 LYS H 4.240 . 4.240 2.543 2.476 2.699 . 0 0 "[ . 1 . 2]" 1 1023 2 14 LEU H 2 15 LYS HA 5.960 . 5.960 5.151 5.081 5.300 . 0 0 "[ . 1 . 2]" 1 1024 2 14 LEU H 2 16 GLN H 5.850 . 5.850 4.098 3.775 4.299 . 0 0 "[ . 1 . 2]" 1 1025 2 14 LEU H 2 33 TYR QB 5.810 . 5.810 5.777 5.361 6.038 0.228 8 0 "[ . 1 . 2]" 1 1026 2 14 LEU H 2 33 TYR QE 6.000 . 6.000 5.450 5.166 5.687 . 0 0 "[ . 1 . 2]" 1 1027 2 14 LEU HA 2 18 ILE MD 6.000 . 6.000 5.191 4.851 5.685 . 0 0 "[ . 1 . 2]" 1 1028 2 14 LEU HA 2 18 ILE QG 6.000 . 6.000 5.129 4.772 6.057 0.057 14 0 "[ . 1 . 2]" 1 1029 2 14 LEU HA 2 29 ALA MB 4.230 . 4.230 3.696 3.113 4.030 . 0 0 "[ . 1 . 2]" 1 1030 2 14 LEU HA 2 33 TYR QB 5.690 . 5.690 4.403 3.896 4.728 . 0 0 "[ . 1 . 2]" 1 1031 2 14 LEU QB 2 18 ILE MD 4.850 . 4.850 3.803 3.400 4.219 . 0 0 "[ . 1 . 2]" 1 1032 2 14 LEU QB 2 18 ILE MG 3.940 . 3.940 3.640 3.348 3.945 0.005 12 0 "[ . 1 . 2]" 1 1033 2 14 LEU QD 2 15 LYS H 3.800 . 3.800 3.857 3.573 4.027 0.227 9 0 "[ . 1 . 2]" 1 1034 2 14 LEU QD 2 17 HIS H 5.920 . 5.920 4.851 4.606 5.231 . 0 0 "[ . 1 . 2]" 1 1035 2 14 LEU QD 2 29 ALA H 5.920 . 5.920 5.693 5.335 6.216 0.296 14 0 "[ . 1 . 2]" 1 1036 2 14 LEU QD 2 29 ALA MB 5.920 . 5.920 3.427 2.902 4.123 . 0 0 "[ . 1 . 2]" 1 1037 2 14 LEU QD 2 30 MET H 5.920 . 5.920 4.027 3.485 4.586 . 0 0 "[ . 1 . 2]" 1 1038 2 14 LEU QD 2 30 MET HA 4.690 . 4.690 2.571 2.041 3.197 . 0 0 "[ . 1 . 2]" 1 1039 2 14 LEU QD 2 33 TYR H 5.920 . 5.920 4.346 3.885 5.026 . 0 0 "[ . 1 . 2]" 1 1040 2 14 LEU QD 2 33 TYR QB 5.070 . 5.070 2.483 2.124 3.136 . 0 0 "[ . 1 . 2]" 1 1041 2 14 LEU QD 2 33 TYR QD 3.780 . 3.780 2.424 2.171 2.582 . 0 0 "[ . 1 . 2]" 1 1042 2 14 LEU QD 2 33 TYR QE 3.890 . 3.890 2.931 2.385 3.371 . 0 0 "[ . 1 . 2]" 1 1043 2 14 LEU QD 2 34 TYR H 5.870 . 5.870 4.150 3.727 4.675 . 0 0 "[ . 1 . 2]" 1 1044 2 14 LEU QD 2 59 LEU QD 4.520 . 4.520 3.403 2.433 3.789 . 0 0 "[ . 1 . 2]" 1 1045 2 14 LEU QD 2 61 GLU QG 5.730 . 5.730 5.354 5.141 5.586 . 0 0 "[ . 1 . 2]" 1 1046 2 14 LEU QD 2 62 ALA HA 3.880 . 3.880 3.721 3.383 3.960 0.080 5 0 "[ . 1 . 2]" 1 1047 2 14 LEU QD 2 62 ALA MB 2.930 . 2.930 2.174 1.994 2.339 . 0 0 "[ . 1 . 2]" 1 1048 2 14 LEU QD 2 63 TYR H 5.440 . 5.440 3.918 3.504 4.364 . 0 0 "[ . 1 . 2]" 1 1049 2 14 LEU QD 2 63 TYR HA 4.160 . 4.160 3.173 2.606 3.727 . 0 0 "[ . 1 . 2]" 1 1050 2 14 LEU QD 2 66 VAL H 5.920 . 5.920 4.032 3.556 4.507 . 0 0 "[ . 1 . 2]" 1 1051 2 14 LEU QD 2 66 VAL HB 3.940 . 3.940 3.949 3.797 4.078 0.138 17 0 "[ . 1 . 2]" 1 1052 2 14 LEU MD1 2 62 ALA H 6.000 . 6.000 5.318 4.632 6.299 0.299 10 0 "[ . 1 . 2]" 1 1053 2 14 LEU MD1 2 62 ALA MB 3.910 . 3.910 2.356 2.001 3.180 . 0 0 "[ . 1 . 2]" 1 1054 2 14 LEU MD2 2 62 ALA MB 3.910 . 3.910 3.521 2.279 4.165 0.255 2 0 "[ . 1 . 2]" 1 1055 2 14 LEU HG 2 33 TYR QD 6.000 . 6.000 4.225 3.158 4.929 . 0 0 "[ . 1 . 2]" 1 1056 2 14 LEU HG 2 33 TYR QE 4.770 . 4.770 4.565 4.067 4.808 0.038 2 0 "[ . 1 . 2]" 1 1057 2 15 LYS H 2 15 LYS QB 3.390 . 3.390 2.286 2.202 2.517 . 0 0 "[ . 1 . 2]" 1 1058 2 15 LYS H 2 16 GLN H 3.390 . 3.390 2.705 2.576 2.774 . 0 0 "[ . 1 . 2]" 1 1059 2 15 LYS H 2 18 ILE MD 4.400 . 4.400 4.413 4.267 4.543 0.143 17 0 "[ . 1 . 2]" 1 1060 2 15 LYS H 2 18 ILE MG 5.060 . 5.060 5.086 4.561 5.258 0.198 12 0 "[ . 1 . 2]" 1 1061 2 15 LYS HA 2 18 ILE H 4.440 . 4.440 3.651 3.294 3.863 . 0 0 "[ . 1 . 2]" 1 1062 2 15 LYS HA 2 18 ILE MD 3.940 . 3.940 2.398 2.239 2.551 . 0 0 "[ . 1 . 2]" 1 1063 2 15 LYS HA 2 18 ILE QG 3.480 . 3.480 2.278 2.141 2.677 . 0 0 "[ . 1 . 2]" 1 1064 2 15 LYS HA 2 18 ILE MG 5.280 . 5.280 3.705 2.877 3.979 . 0 0 "[ . 1 . 2]" 1 1065 2 15 LYS QB 2 16 GLN H 3.150 . 3.150 2.643 2.396 2.931 . 0 0 "[ . 1 . 2]" 1 1066 2 16 GLN H 2 20 MET H 6.000 . 6.000 5.259 5.003 5.634 . 0 0 "[ . 1 . 2]" 1 1067 2 16 GLN HA 2 16 GLN QG 3.170 . 3.170 2.373 2.304 3.232 0.062 9 0 "[ . 1 . 2]" 1 1068 2 16 GLN HA 2 20 MET ME 4.710 . 4.710 3.384 3.071 4.092 . 0 0 "[ . 1 . 2]" 1 1069 2 16 GLN HA 2 22 GLN H 6.000 . 6.000 6.267 6.113 6.407 0.407 3 0 "[ . 1 . 2]" 1 1070 2 16 GLN QG 2 17 HIS HA 4.440 . 4.440 3.738 2.932 3.917 . 0 0 "[ . 1 . 2]" 1 1071 2 16 GLN QG 2 18 ILE H 5.810 . 5.810 5.505 4.573 5.843 0.033 2 0 "[ . 1 . 2]" 1 1072 2 16 GLN QG 2 20 MET H 4.500 . 4.500 3.633 3.263 4.163 . 0 0 "[ . 1 . 2]" 1 1073 2 16 GLN QG 2 21 ASN H 4.450 . 4.450 4.037 3.321 4.541 0.091 15 0 "[ . 1 . 2]" 1 1074 2 16 GLN QG 2 22 GLN H 4.060 . 4.060 3.958 3.533 4.165 0.105 14 0 "[ . 1 . 2]" 1 1075 2 16 GLN HG2 2 17 HIS H 6.000 . 6.000 3.945 2.228 4.167 . 0 0 "[ . 1 . 2]" 1 1076 2 16 GLN HG2 2 21 ASN H 5.170 . 5.170 4.316 3.459 4.940 . 0 0 "[ . 1 . 2]" 1 1077 2 16 GLN HG3 2 17 HIS H 6.000 . 6.000 4.773 3.331 4.964 . 0 0 "[ . 1 . 2]" 1 1078 2 16 GLN HG3 2 21 ASN H 5.170 . 5.170 5.002 3.714 5.332 0.162 4 0 "[ . 1 . 2]" 1 1079 2 17 HIS H 2 19 GLU H 4.010 . 4.010 3.943 3.742 4.074 0.064 7 0 "[ . 1 . 2]" 1 1080 2 17 HIS H 2 20 MET ME 6.000 . 6.000 6.085 5.593 6.299 0.299 3 0 "[ . 1 . 2]" 1 1081 2 17 HIS H 2 24 GLU HB3 6.000 . 6.000 5.635 5.300 5.877 . 0 0 "[ . 1 . 2]" 1 1082 2 17 HIS H 2 24 GLU HG2 6.000 . 6.000 5.910 5.379 6.358 0.358 2 0 "[ . 1 . 2]" 1 1083 2 17 HIS HA 2 19 GLU H 6.000 . 6.000 4.700 4.306 4.901 . 0 0 "[ . 1 . 2]" 1 1084 2 17 HIS HA 2 20 MET H 6.000 . 6.000 4.075 3.673 4.327 . 0 0 "[ . 1 . 2]" 1 1085 2 17 HIS HA 2 20 MET QG 5.810 . 5.810 5.612 5.004 6.098 0.288 4 0 "[ . 1 . 2]" 1 1086 2 17 HIS HA 2 25 ASP H 6.000 . 6.000 4.887 4.455 6.329 0.329 2 0 "[ . 1 . 2]" 1 1087 2 17 HIS QB 2 18 ILE MG 4.060 . 4.060 2.830 2.700 2.911 . 0 0 "[ . 1 . 2]" 1 1088 2 17 HIS QB 2 19 GLU H 4.750 . 4.750 4.511 4.359 4.604 . 0 0 "[ . 1 . 2]" 1 1089 2 18 ILE H 2 18 ILE MD 4.990 . 4.990 3.436 3.396 3.651 . 0 0 "[ . 1 . 2]" 1 1090 2 18 ILE H 2 18 ILE QG 3.550 . 3.550 2.017 1.855 2.662 . 0 0 "[ . 1 . 2]" 1 1091 2 18 ILE H 2 18 ILE MG 4.430 . 4.430 2.122 1.781 2.235 0.019 2 0 "[ . 1 . 2]" 1 1092 2 18 ILE H 2 19 GLU H 3.540 . 3.540 2.552 2.452 2.800 . 0 0 "[ . 1 . 2]" 1 1093 2 18 ILE H 2 20 MET H 5.930 . 5.930 4.254 3.801 4.587 . 0 0 "[ . 1 . 2]" 1 1094 2 18 ILE H 2 25 ASP H 6.000 . 6.000 5.965 5.776 6.088 0.088 17 0 "[ . 1 . 2]" 1 1095 2 18 ILE H 2 29 ALA MB 4.930 . 4.930 3.741 3.351 4.031 . 0 0 "[ . 1 . 2]" 1 1096 2 18 ILE HA 2 18 ILE MD 4.490 . 4.490 4.163 4.133 4.189 . 0 0 "[ . 1 . 2]" 1 1097 2 18 ILE HA 2 26 LYS QB 4.180 . 4.180 4.262 4.083 4.417 0.237 5 0 "[ . 1 . 2]" 1 1098 2 18 ILE HA 2 26 LYS QG 4.770 . 4.770 3.472 3.115 3.871 . 0 0 "[ . 1 . 2]" 1 1099 2 18 ILE HB 2 19 GLU HA 4.760 . 4.760 4.566 4.433 4.835 0.075 2 0 "[ . 1 . 2]" 1 1100 2 18 ILE MD 2 19 GLU HA 6.000 . 6.000 4.744 4.624 4.834 . 0 0 "[ . 1 . 2]" 1 1101 2 18 ILE MD 2 26 LYS HA 4.870 . 4.870 4.986 4.798 5.172 0.302 15 0 "[ . 1 . 2]" 1 1102 2 18 ILE MD 2 26 LYS QG 4.130 . 4.130 4.222 4.079 4.391 0.261 15 0 "[ . 1 . 2]" 1 1103 2 18 ILE MD 2 29 ALA MB 4.550 . 4.550 4.394 4.012 4.710 0.160 2 0 "[ . 1 . 2]" 1 1104 2 18 ILE MD 2 69 GLY H 6.000 . 6.000 5.413 4.682 6.210 0.210 16 0 "[ . 1 . 2]" 1 1105 2 18 ILE MD 2 70 GLU QG 4.940 . 4.940 3.524 2.146 4.801 . 0 0 "[ . 1 . 2]" 1 1106 2 18 ILE QG 2 18 ILE MG . . 3.190 2.351 2.293 2.425 . 0 0 "[ . 1 . 2]" 1 1107 2 18 ILE QG 2 29 ALA MB 5.350 . 5.350 4.653 4.356 5.344 . 0 0 "[ . 1 . 2]" 1 1108 2 18 ILE MG 2 19 GLU H 4.720 . 4.720 3.761 3.528 3.854 . 0 0 "[ . 1 . 2]" 1 1109 2 18 ILE MG 2 24 GLU QG 5.290 . 5.290 4.930 4.366 5.291 0.001 15 0 "[ . 1 . 2]" 1 1110 2 18 ILE MG 2 26 LYS HA 3.550 . 3.550 2.419 2.292 2.827 . 0 0 "[ . 1 . 2]" 1 1111 2 18 ILE MG 2 26 LYS QG 3.370 . 3.370 3.047 2.732 3.389 0.019 8 0 "[ . 1 . 2]" 1 1112 2 18 ILE MG 2 29 ALA MB 3.620 . 3.620 2.455 1.983 2.884 . 0 0 "[ . 1 . 2]" 1 1113 2 18 ILE MG 2 30 MET H 5.680 . 5.680 4.471 3.923 5.042 . 0 0 "[ . 1 . 2]" 1 1114 2 19 GLU H 2 19 GLU QG 4.650 . 4.650 3.763 2.333 4.074 . 0 0 "[ . 1 . 2]" 1 1115 2 19 GLU H 2 20 MET ME 5.850 . 5.850 5.658 5.041 6.055 0.205 19 0 "[ . 1 . 2]" 1 1116 2 19 GLU H 2 26 LYS QG 5.810 . 5.810 6.062 5.916 6.190 0.380 19 0 "[ . 1 . 2]" 1 1117 2 19 GLU HA 2 19 GLU QG 3.550 . 3.550 2.497 2.321 2.840 . 0 0 "[ . 1 . 2]" 1 1118 2 20 MET H 2 21 ASN HA 6.000 . 6.000 4.817 4.348 5.134 . 0 0 "[ . 1 . 2]" 1 1119 2 20 MET H 2 21 ASN QB 5.810 . 5.810 4.973 4.032 5.787 . 0 0 "[ . 1 . 2]" 1 1120 2 20 MET HA 2 20 MET QG 3.330 . 3.330 2.450 2.229 3.137 . 0 0 "[ . 1 . 2]" 1 1121 2 20 MET QB 2 21 ASN H 3.280 . 3.280 1.977 1.718 2.204 0.082 2 0 "[ . 1 . 2]" 1 1122 2 20 MET QB 2 22 GLN H 4.310 . 4.310 2.836 2.461 3.744 . 0 0 "[ . 1 . 2]" 1 1123 2 21 ASN H 2 21 ASN QB 3.280 . 3.280 3.138 2.787 3.494 0.214 20 0 "[ . 1 . 2]" 1 1124 2 21 ASN H 2 22 GLN H 3.900 . 3.900 2.409 2.095 2.899 . 0 0 "[ . 1 . 2]" 1 1125 2 21 ASN H 2 22 GLN HA 4.480 . 4.480 4.320 3.894 4.975 0.495 8 0 "[ . 1 . 2]" 1 1126 2 21 ASN H 2 22 GLN QB 4.160 . 4.160 4.152 3.752 4.652 0.492 9 0 "[ . 1 . 2]" 1 1127 2 21 ASN HA 2 22 GLN H 3.420 . 3.420 2.737 2.420 2.875 . 0 0 "[ . 1 . 2]" 1 1128 2 21 ASN HA 2 22 GLN QB 5.810 . 5.810 4.543 4.347 5.015 . 0 0 "[ . 1 . 2]" 1 1129 2 21 ASN HA 2 23 SER H 4.540 . 4.540 3.637 3.228 4.510 . 0 0 "[ . 1 . 2]" 1 1130 2 21 ASN HA 2 24 GLU H 6.000 . 6.000 3.729 3.293 5.023 . 0 0 "[ . 1 . 2]" 1 1131 2 21 ASN HA 2 24 GLU HB2 6.000 . 6.000 4.873 3.981 6.320 0.320 2 0 "[ . 1 . 2]" 1 1132 2 21 ASN QB 2 24 GLU H 5.810 . 5.810 4.498 3.743 5.421 . 0 0 "[ . 1 . 2]" 1 1133 2 22 GLN H 2 22 GLN QB 3.340 . 3.340 2.299 2.175 2.486 . 0 0 "[ . 1 . 2]" 1 1134 2 22 GLN H 2 22 GLN QG 4.880 . 4.880 3.337 2.006 4.064 . 0 0 "[ . 1 . 2]" 1 1135 2 22 GLN H 2 24 GLU H 4.710 . 4.710 4.676 3.787 4.883 0.173 2 0 "[ . 1 . 2]" 1 1136 2 22 GLN HA 2 22 GLN QG 3.320 . 3.320 2.468 2.297 3.316 . 0 0 "[ . 1 . 2]" 1 1137 2 22 GLN HA 2 23 SER H 3.550 . 3.550 3.543 3.506 3.571 0.021 18 0 "[ . 1 . 2]" 1 1138 2 22 GLN QB 2 23 SER H 3.590 . 3.590 2.474 1.902 3.389 . 0 0 "[ . 1 . 2]" 1 1139 2 22 GLN HB2 2 23 SER H 4.160 . 4.160 3.385 2.449 3.880 . 0 0 "[ . 1 . 2]" 1 1140 2 22 GLN HB3 2 23 SER H 4.160 . 4.160 2.819 1.910 3.916 . 0 0 "[ . 1 . 2]" 1 1141 2 22 GLN QG 2 23 SER H 4.370 . 4.370 3.687 2.014 4.421 0.051 19 0 "[ . 1 . 2]" 1 1142 2 23 SER H 2 24 GLU H 3.390 . 3.390 2.698 1.582 3.212 0.218 9 0 "[ . 1 . 2]" 1 1143 2 23 SER H 2 24 GLU HA 5.600 . 5.600 4.696 4.305 4.872 . 0 0 "[ . 1 . 2]" 1 1144 2 23 SER H 2 24 GLU HB2 4.220 . 4.220 3.487 3.344 3.689 . 0 0 "[ . 1 . 2]" 1 1145 2 24 GLU H 2 24 GLU HB2 3.590 . 3.590 3.165 2.292 3.324 . 0 0 "[ . 1 . 2]" 1 1146 2 24 GLU H 2 24 GLU QG 4.410 . 4.410 4.357 4.069 4.451 0.041 2 0 "[ . 1 . 2]" 1 1147 2 24 GLU H 2 25 ASP H 4.410 . 4.410 3.982 3.848 4.156 . 0 0 "[ . 1 . 2]" 1 1148 2 24 GLU HA 2 24 GLU QG 3.570 . 3.570 2.585 2.476 2.658 . 0 0 "[ . 1 . 2]" 1 1149 2 24 GLU HA 2 25 ASP HB3 6.000 . 6.000 5.778 5.733 5.920 . 0 0 "[ . 1 . 2]" 1 1150 2 24 GLU HB2 2 25 ASP H 3.750 . 3.750 3.277 3.231 3.375 . 0 0 "[ . 1 . 2]" 1 1151 2 24 GLU HB3 2 25 ASP H 6.000 . 6.000 1.859 1.792 2.038 0.008 14 0 "[ . 1 . 2]" 1 1152 2 24 GLU HB3 2 29 ALA MB 5.100 . 5.100 3.504 3.035 3.943 . 0 0 "[ . 1 . 2]" 1 1153 2 24 GLU QG 2 29 ALA H 4.360 . 4.360 4.305 3.998 4.574 0.214 16 0 "[ . 1 . 2]" 1 1154 2 24 GLU QG 2 29 ALA MB 3.650 . 3.650 2.506 2.177 2.993 . 0 0 "[ . 1 . 2]" 1 1155 2 24 GLU QG 2 32 SER H 5.050 . 5.050 4.831 4.236 5.120 0.070 8 0 "[ . 1 . 2]" 1 1156 2 24 GLU QG 2 33 TYR H 4.310 . 4.310 4.375 4.125 4.592 0.282 5 0 "[ . 1 . 2]" 1 1157 2 25 ASP H 2 26 LYS HA 6.000 . 6.000 4.810 4.299 4.949 . 0 0 "[ . 1 . 2]" 1 1158 2 25 ASP H 2 28 HIS H 6.000 . 6.000 5.994 5.855 6.155 0.155 14 0 "[ . 1 . 2]" 1 1159 2 25 ASP H 2 29 ALA MB 3.800 . 3.800 2.914 2.449 3.315 . 0 0 "[ . 1 . 2]" 1 1160 2 25 ASP HA 2 26 LYS QB 5.300 . 5.300 4.253 4.073 4.318 . 0 0 "[ . 1 . 2]" 1 1161 2 25 ASP HB2 2 28 HIS H 3.710 . 3.710 3.760 3.578 3.926 0.216 17 0 "[ . 1 . 2]" 1 1162 2 25 ASP HB2 2 29 ALA H 4.460 . 4.460 3.538 2.909 3.912 . 0 0 "[ . 1 . 2]" 1 1163 2 25 ASP HB2 2 30 MET H 5.830 . 5.830 5.924 5.497 6.122 0.292 18 0 "[ . 1 . 2]" 1 1164 2 25 ASP HB3 2 26 LYS H 4.390 . 4.390 1.886 1.768 2.318 0.032 20 0 "[ . 1 . 2]" 1 1165 2 26 LYS H 2 26 LYS HB2 4.060 . 4.060 2.656 2.510 3.411 . 0 0 "[ . 1 . 2]" 1 1166 2 26 LYS H 2 26 LYS QB 3.560 . 3.560 2.335 2.274 2.868 . 0 0 "[ . 1 . 2]" 1 1167 2 26 LYS H 2 26 LYS HB3 4.060 . 4.060 2.593 2.519 3.084 . 0 0 "[ . 1 . 2]" 1 1168 2 26 LYS H 2 26 LYS HG2 5.140 . 5.140 4.481 4.440 4.588 . 0 0 "[ . 1 . 2]" 1 1169 2 26 LYS H 2 26 LYS QG 4.420 . 4.420 4.002 3.972 4.176 . 0 0 "[ . 1 . 2]" 1 1170 2 26 LYS H 2 26 LYS HG3 5.140 . 5.140 4.505 4.424 4.805 . 0 0 "[ . 1 . 2]" 1 1171 2 26 LYS H 2 27 ILE H 3.810 . 3.810 3.442 3.293 3.571 . 0 0 "[ . 1 . 2]" 1 1172 2 26 LYS H 2 27 ILE MG 6.000 . 6.000 5.522 4.104 6.313 0.313 17 0 "[ . 1 . 2]" 1 1173 2 26 LYS HA 2 26 LYS QG 3.650 . 3.650 2.314 2.292 2.341 . 0 0 "[ . 1 . 2]" 1 1174 2 26 LYS HA 2 29 ALA H 4.980 . 4.980 4.406 4.071 4.722 . 0 0 "[ . 1 . 2]" 1 1175 2 26 LYS HA 2 29 ALA MB 3.650 . 3.650 3.533 3.097 3.824 0.174 18 0 "[ . 1 . 2]" 1 1176 2 26 LYS QB 2 27 ILE QG 5.610 . 5.610 3.850 2.852 5.301 . 0 0 "[ . 1 . 2]" 1 1177 2 26 LYS QB 2 29 ALA H 5.810 . 5.810 4.746 4.427 5.015 . 0 0 "[ . 1 . 2]" 1 1178 2 26 LYS QG 2 27 ILE H 4.410 . 4.410 2.168 2.042 2.316 . 0 0 "[ . 1 . 2]" 1 1179 2 26 LYS QG 2 29 ALA H 5.810 . 5.810 5.023 4.889 5.195 . 0 0 "[ . 1 . 2]" 1 1180 2 26 LYS HG2 2 27 ILE H 5.130 . 5.130 2.187 2.057 2.343 . 0 0 "[ . 1 . 2]" 1 1181 2 26 LYS HG3 2 27 ILE H 5.130 . 5.130 3.547 3.448 3.645 . 0 0 "[ . 1 . 2]" 1 1182 2 27 ILE H 2 27 ILE MD 5.000 . 5.000 3.718 2.946 4.283 . 0 0 "[ . 1 . 2]" 1 1183 2 27 ILE H 2 27 ILE MG 3.910 . 3.910 3.219 1.911 3.769 . 0 0 "[ . 1 . 2]" 1 1184 2 27 ILE H 2 28 HIS H 3.960 . 3.960 2.645 2.572 2.727 . 0 0 "[ . 1 . 2]" 1 1185 2 27 ILE H 2 29 ALA H 5.650 . 5.650 4.030 3.842 4.228 . 0 0 "[ . 1 . 2]" 1 1186 2 27 ILE HA 2 27 ILE MD 3.320 . 3.320 2.727 2.121 3.732 0.412 18 0 "[ . 1 . 2]" 1 1187 2 27 ILE HA 2 66 VAL QG 5.340 . 5.340 2.798 2.239 3.445 . 0 0 "[ . 1 . 2]" 1 1188 2 27 ILE HA 2 67 LYS QD 4.950 . 4.950 4.668 3.999 5.275 0.325 13 0 "[ . 1 . 2]" 1 1189 2 27 ILE HB 2 27 ILE MD 3.280 . 3.280 2.881 2.294 3.255 . 0 0 "[ . 1 . 2]" 1 1190 2 27 ILE HB 2 29 ALA H 6.000 . 6.000 4.848 4.538 5.413 . 0 0 "[ . 1 . 2]" 1 1191 2 27 ILE MD 2 63 TYR QE 6.000 . 6.000 5.580 4.598 6.294 0.294 2 0 "[ . 1 . 2]" 1 1192 2 27 ILE MD 2 67 LYS H 6.000 . 6.000 4.695 4.072 5.293 . 0 0 "[ . 1 . 2]" 1 1193 2 27 ILE MD 2 67 LYS HA 4.100 . 4.100 2.904 2.384 3.308 . 0 0 "[ . 1 . 2]" 1 1194 2 27 ILE MD 2 67 LYS HB3 6.000 . 6.000 3.922 3.361 4.678 . 0 0 "[ . 1 . 2]" 1 1195 2 27 ILE MD 2 67 LYS QD 2.680 . 2.680 2.474 1.886 2.879 0.199 12 0 "[ . 1 . 2]" 1 1196 2 27 ILE MD 2 67 LYS HG3 4.930 . 4.930 4.460 3.873 5.087 0.157 17 0 "[ . 1 . 2]" 1 1197 2 27 ILE MD 2 68 ARG H 6.000 . 6.000 5.794 5.263 6.165 0.165 7 0 "[ . 1 . 2]" 1 1198 2 27 ILE MD 2 69 GLY H 6.000 . 6.000 5.807 4.383 6.234 0.234 19 0 "[ . 1 . 2]" 1 1199 2 27 ILE MD 2 70 GLU H 5.250 . 5.250 4.701 4.235 5.236 . 0 0 "[ . 1 . 2]" 1 1200 2 27 ILE MD 2 70 GLU QB 5.400 . 5.400 2.994 2.242 5.274 . 0 0 "[ . 1 . 2]" 1 1201 2 27 ILE MD 2 70 GLU QG 5.810 . 5.810 2.661 2.016 4.931 . 0 0 "[ . 1 . 2]" 1 1202 2 27 ILE MD 2 71 SER H 4.980 . 4.980 4.441 3.627 4.982 0.002 15 0 "[ . 1 . 2]" 1 1203 2 27 ILE QG 2 27 ILE MG 3.170 . 3.170 2.333 2.096 2.516 . 0 0 "[ . 1 . 2]" 1 1204 2 27 ILE QG 2 71 SER H 5.810 . 5.810 5.785 5.005 6.154 0.344 20 0 "[ . 1 . 2]" 1 1205 2 27 ILE MG 2 28 HIS H 6.000 . 6.000 3.002 1.970 3.674 . 0 0 "[ . 1 . 2]" 1 1206 2 27 ILE MG 2 29 ALA H 6.000 . 6.000 4.166 3.927 4.618 . 0 0 "[ . 1 . 2]" 1 1207 2 27 ILE MG 2 29 ALA MB 5.400 . 5.400 4.972 4.808 5.137 . 0 0 "[ . 1 . 2]" 1 1208 2 27 ILE MG 2 30 MET H 6.000 . 6.000 4.660 3.942 5.358 . 0 0 "[ . 1 . 2]" 1 1209 2 27 ILE MG 2 31 ASN H 5.860 . 5.860 4.895 4.304 5.595 . 0 0 "[ . 1 . 2]" 1 1210 2 27 ILE MG 2 67 LYS QD 5.750 . 5.750 3.011 1.916 5.356 . 0 0 "[ . 1 . 2]" 1 1211 2 28 HIS H 2 29 ALA H 4.150 . 4.150 2.748 2.526 2.932 . 0 0 "[ . 1 . 2]" 1 1212 2 28 HIS H 2 30 MET H 5.610 . 5.610 4.914 4.473 5.296 . 0 0 "[ . 1 . 2]" 1 1213 2 29 ALA H 2 30 MET H 3.640 . 3.640 2.684 2.471 2.927 . 0 0 "[ . 1 . 2]" 1 1214 2 29 ALA H 2 31 ASN H 6.000 . 6.000 4.166 3.868 4.558 . 0 0 "[ . 1 . 2]" 1 1215 2 29 ALA H 2 66 VAL QG 4.130 . 4.130 4.100 3.444 4.420 0.290 4 0 "[ . 1 . 2]" 1 1216 2 29 ALA MB 2 30 MET HA 6.000 . 6.000 3.786 3.743 3.851 . 0 0 "[ . 1 . 2]" 1 1217 2 29 ALA MB 2 31 ASN H 6.000 . 6.000 4.543 4.372 4.764 . 0 0 "[ . 1 . 2]" 1 1218 2 29 ALA MB 2 33 TYR H 6.000 . 6.000 4.430 4.250 4.668 . 0 0 "[ . 1 . 2]" 1 1219 2 29 ALA MB 2 33 TYR QB 4.280 . 4.280 3.849 3.607 4.152 . 0 0 "[ . 1 . 2]" 1 1220 2 29 ALA MB 2 66 VAL HB 5.610 . 5.610 5.284 5.051 5.429 . 0 0 "[ . 1 . 2]" 1 1221 2 30 MET H 2 31 ASN H 4.010 . 4.010 2.720 2.585 2.809 . 0 0 "[ . 1 . 2]" 1 1222 2 30 MET H 2 32 SER H 4.480 . 4.480 4.345 4.035 4.514 0.034 20 0 "[ . 1 . 2]" 1 1223 2 30 MET H 2 33 TYR QB 4.410 . 4.410 4.596 4.484 4.669 0.259 20 0 "[ . 1 . 2]" 1 1224 2 30 MET H 2 33 TYR QD 6.000 . 6.000 6.321 6.185 6.431 0.431 11 0 "[ . 1 . 2]" 1 1225 2 30 MET H 2 66 VAL HB 4.480 . 4.480 4.782 4.457 4.968 0.488 16 0 "[ . 1 . 2]" 1 1226 2 30 MET H 2 66 VAL MG1 3.880 . 3.880 3.157 2.601 3.595 . 0 0 "[ . 1 . 2]" 1 1227 2 30 MET H 2 66 VAL MG2 3.960 . 3.960 3.891 3.583 4.038 0.078 5 0 "[ . 1 . 2]" 1 1228 2 30 MET H 2 67 LYS QD 5.770 . 5.770 5.971 5.246 6.166 0.396 2 0 "[ . 1 . 2]" 1 1229 2 30 MET HA 2 33 TYR H 4.440 . 4.440 3.586 3.408 3.785 . 0 0 "[ . 1 . 2]" 1 1230 2 30 MET HA 2 33 TYR QB 5.810 . 5.810 2.526 2.352 2.801 . 0 0 "[ . 1 . 2]" 1 1231 2 30 MET HA 2 34 TYR H 3.890 . 3.890 3.251 2.793 3.884 . 0 0 "[ . 1 . 2]" 1 1232 2 30 MET HA 2 66 VAL MG1 5.200 . 5.200 4.403 3.839 5.218 0.018 16 0 "[ . 1 . 2]" 1 1233 2 30 MET HA 2 66 VAL QG 4.120 . 4.120 3.467 2.961 4.120 . 0 0 "[ . 1 . 2]" 1 1234 2 30 MET HA 2 66 VAL MG2 5.200 . 5.200 3.632 3.080 4.315 . 0 0 "[ . 1 . 2]" 1 1235 2 30 MET ME 2 31 ASN H 5.730 . 5.730 2.952 2.598 3.460 . 0 0 "[ . 1 . 2]" 1 1236 2 31 ASN H 2 32 SER H 4.390 . 4.390 2.867 2.716 2.972 . 0 0 "[ . 1 . 2]" 1 1237 2 31 ASN H 2 33 TYR H 6.000 . 6.000 4.394 4.184 4.534 . 0 0 "[ . 1 . 2]" 1 1238 2 31 ASN H 2 33 TYR QB 5.030 . 5.030 5.031 4.897 5.207 0.177 6 0 "[ . 1 . 2]" 1 1239 2 32 SER H 2 33 TYR H 3.910 . 3.910 2.730 2.610 2.826 . 0 0 "[ . 1 . 2]" 1 1240 2 32 SER H 2 33 TYR QB 5.810 . 5.810 4.442 4.302 4.580 . 0 0 "[ . 1 . 2]" 1 1241 2 32 SER H 2 34 TYR H 6.000 . 6.000 4.030 3.670 4.241 . 0 0 "[ . 1 . 2]" 1 1242 2 33 TYR H 2 33 TYR HB2 3.880 . 3.880 2.568 2.494 2.660 . 0 0 "[ . 1 . 2]" 1 1243 2 33 TYR H 2 33 TYR QB 3.300 . 3.300 2.246 2.236 2.255 . 0 0 "[ . 1 . 2]" 1 1244 2 33 TYR H 2 33 TYR HB3 3.880 . 3.880 2.483 2.417 2.564 . 0 0 "[ . 1 . 2]" 1 1245 2 33 TYR H 2 33 TYR QD 4.910 . 4.910 4.167 4.149 4.177 . 0 0 "[ . 1 . 2]" 1 1246 2 33 TYR H 2 34 TYR H 3.850 . 3.850 2.690 2.489 2.815 . 0 0 "[ . 1 . 2]" 1 1247 2 33 TYR H 2 37 VAL H 6.000 . 6.000 6.106 5.883 6.382 0.382 2 0 "[ . 1 . 2]" 1 1248 2 33 TYR QB 2 34 TYR H 4.050 . 4.050 2.541 2.317 3.031 . 0 0 "[ . 1 . 2]" 1 1249 2 33 TYR QB 2 35 ARG H 5.720 . 5.720 4.879 4.621 5.313 . 0 0 "[ . 1 . 2]" 1 1250 2 33 TYR QD 2 34 TYR H 4.360 . 4.360 3.217 2.761 3.822 . 0 0 "[ . 1 . 2]" 1 1251 2 33 TYR QD 2 37 VAL H 6.000 . 6.000 4.551 4.367 4.629 . 0 0 "[ . 1 . 2]" 1 1252 2 33 TYR QD 2 37 VAL QG 4.430 . 4.430 3.157 3.017 3.350 . 0 0 "[ . 1 . 2]" 1 1253 2 33 TYR QD 2 38 VAL H 6.000 . 6.000 6.033 5.712 6.224 0.224 17 0 "[ . 1 . 2]" 1 1254 2 33 TYR QD 2 59 LEU QD 4.170 . 4.170 3.149 2.285 3.478 . 0 0 "[ . 1 . 2]" 1 1255 2 33 TYR QD 2 62 ALA MB 6.000 . 6.000 4.469 4.152 5.020 . 0 0 "[ . 1 . 2]" 1 1256 2 33 TYR QE 2 34 TYR H 5.840 . 5.840 5.400 5.043 5.900 0.060 15 0 "[ . 1 . 2]" 1 1257 2 33 TYR QE 2 37 VAL H 6.000 . 6.000 4.939 4.655 5.150 . 0 0 "[ . 1 . 2]" 1 1258 2 33 TYR QE 2 37 VAL QG 3.920 . 3.920 2.332 2.192 2.516 . 0 0 "[ . 1 . 2]" 1 1259 2 33 TYR QE 2 38 VAL H 6.000 . 6.000 6.145 5.760 6.273 0.273 2 0 "[ . 1 . 2]" 1 1260 2 33 TYR QE 2 59 LEU QD 3.350 . 3.350 2.446 2.051 3.123 . 0 0 "[ . 1 . 2]" 1 1261 2 33 TYR QE 2 59 LEU HG 4.780 . 4.780 4.451 3.547 4.984 0.204 2 0 "[ . 1 . 2]" 1 1262 2 34 TYR H 2 34 TYR QD 4.870 . 4.870 4.189 4.154 4.213 . 0 0 "[ . 1 . 2]" 1 1263 2 34 TYR H 2 35 ARG H 4.150 . 4.150 2.777 2.631 2.943 . 0 0 "[ . 1 . 2]" 1 1264 2 34 TYR H 2 36 SER H 6.000 . 6.000 3.857 3.519 4.064 . 0 0 "[ . 1 . 2]" 1 1265 2 34 TYR H 2 38 VAL QG 5.630 . 5.630 5.367 5.085 5.684 0.054 13 0 "[ . 1 . 2]" 1 1266 2 34 TYR HA 2 34 TYR QD 4.440 . 4.440 2.956 2.678 3.091 . 0 0 "[ . 1 . 2]" 1 1267 2 34 TYR HA 2 34 TYR QE 5.410 . 5.410 4.598 4.486 4.680 . 0 0 "[ . 1 . 2]" 1 1268 2 34 TYR QB 2 38 VAL QG 5.380 . 5.380 4.030 3.858 4.283 . 0 0 "[ . 1 . 2]" 1 1269 2 34 TYR QD 2 38 VAL QG 5.600 . 5.600 2.769 2.389 3.213 . 0 0 "[ . 1 . 2]" 1 1270 2 34 TYR QD 2 59 LEU MD1 6.000 . 6.000 3.306 2.119 4.083 . 0 0 "[ . 1 . 2]" 1 1271 2 34 TYR QD 2 59 LEU QD 5.130 . 5.130 2.489 2.116 2.932 . 0 0 "[ . 1 . 2]" 1 1272 2 34 TYR QD 2 59 LEU MD2 6.000 . 6.000 3.179 2.163 4.810 . 0 0 "[ . 1 . 2]" 1 1273 2 34 TYR QD 2 63 TYR H 5.780 . 5.780 3.897 3.277 4.918 . 0 0 "[ . 1 . 2]" 1 1274 2 34 TYR QD 2 63 TYR HA 4.430 . 4.430 4.598 4.447 4.717 0.287 17 0 "[ . 1 . 2]" 1 1275 2 34 TYR QD 2 63 TYR QB 4.170 . 4.170 2.762 2.463 3.170 . 0 0 "[ . 1 . 2]" 1 1276 2 34 TYR QE 2 37 VAL QG 5.110 . 5.110 5.211 4.760 5.603 0.493 15 0 "[ . 1 . 2]" 1 1277 2 34 TYR QE 2 38 VAL H 6.000 . 6.000 5.205 4.664 5.714 . 0 0 "[ . 1 . 2]" 1 1278 2 34 TYR QE 2 38 VAL QG 4.340 . 4.340 2.375 2.197 2.625 . 0 0 "[ . 1 . 2]" 1 1279 2 34 TYR QE 2 60 ASP H 5.400 . 5.400 3.626 2.957 4.597 . 0 0 "[ . 1 . 2]" 1 1280 2 34 TYR QE 2 60 ASP QB 5.340 . 5.340 4.156 3.450 5.530 0.190 11 0 "[ . 1 . 2]" 1 1281 2 34 TYR QE 2 63 TYR H 6.000 . 6.000 4.607 4.147 5.405 . 0 0 "[ . 1 . 2]" 1 1282 2 34 TYR QE 2 63 TYR QB 4.230 . 4.230 3.537 3.202 3.838 . 0 0 "[ . 1 . 2]" 1 1283 2 35 ARG H 2 35 ARG QB 3.140 . 3.140 2.308 2.234 2.519 . 0 0 "[ . 1 . 2]" 1 1284 2 35 ARG H 2 36 SER H 4.080 . 4.080 2.552 2.478 2.635 . 0 0 "[ . 1 . 2]" 1 1285 2 36 SER H 2 37 VAL H 3.700 . 3.700 2.643 2.536 2.705 . 0 0 "[ . 1 . 2]" 1 1286 2 36 SER H 2 37 VAL QG 4.850 . 4.850 4.086 3.421 4.325 . 0 0 "[ . 1 . 2]" 1 1287 2 36 SER H 2 38 VAL H 5.920 . 5.920 4.359 3.887 4.690 . 0 0 "[ . 1 . 2]" 1 1288 2 37 VAL H 2 37 VAL HB 3.770 . 3.770 2.541 2.340 3.616 . 0 0 "[ . 1 . 2]" 1 1289 2 37 VAL H 2 37 VAL QG 3.400 . 3.400 2.203 1.773 2.413 0.027 11 0 "[ . 1 . 2]" 1 1290 2 37 VAL H 2 38 VAL H 3.550 . 3.550 2.755 2.497 2.951 . 0 0 "[ . 1 . 2]" 1 1291 2 37 VAL H 2 38 VAL QG 4.650 . 4.650 3.835 3.445 4.203 . 0 0 "[ . 1 . 2]" 1 1292 2 37 VAL H 2 59 LEU MD1 5.390 . 5.390 5.088 4.190 5.504 0.114 2 0 "[ . 1 . 2]" 1 1293 2 37 VAL H 2 59 LEU QD 4.490 . 4.490 4.129 3.785 4.644 0.154 9 0 "[ . 1 . 2]" 1 1294 2 37 VAL H 2 59 LEU MD2 5.390 . 5.390 4.628 3.891 5.564 0.174 12 0 "[ . 1 . 2]" 1 1295 2 37 VAL HA 2 37 VAL MG1 3.530 . 3.530 2.426 2.337 2.505 . 0 0 "[ . 1 . 2]" 1 1296 2 37 VAL HA 2 37 VAL QG 2.770 . 2.770 2.117 2.073 2.342 . 0 0 "[ . 1 . 2]" 1 1297 2 37 VAL HA 2 37 VAL MG2 3.530 . 3.530 2.382 2.233 3.209 . 0 0 "[ . 1 . 2]" 1 1298 2 37 VAL HA 2 40 THR HB 6.000 . 6.000 2.842 2.384 3.533 . 0 0 "[ . 1 . 2]" 1 1299 2 37 VAL HA 2 40 THR MG 5.520 . 5.520 4.217 3.726 4.925 . 0 0 "[ . 1 . 2]" 1 1300 2 37 VAL HA 2 41 LEU HG 6.000 . 6.000 4.554 3.484 6.344 0.344 13 0 "[ . 1 . 2]" 1 1301 2 37 VAL HB 2 38 VAL H 4.580 . 4.580 2.406 2.043 3.718 . 0 0 "[ . 1 . 2]" 1 1302 2 37 VAL HB 2 38 VAL QG 4.930 . 4.930 3.333 2.907 4.388 . 0 0 "[ . 1 . 2]" 1 1303 2 37 VAL HB 2 59 LEU QD 4.410 . 4.410 2.612 2.181 3.757 . 0 0 "[ . 1 . 2]" 1 1304 2 37 VAL QG 2 38 VAL H 3.190 . 3.190 2.744 1.790 3.189 0.010 20 0 "[ . 1 . 2]" 1 1305 2 37 VAL QG 2 38 VAL HA 3.470 . 3.470 3.128 2.962 3.409 . 0 0 "[ . 1 . 2]" 1 1306 2 37 VAL QG 2 40 THR HB 5.240 . 5.240 3.664 3.126 4.399 . 0 0 "[ . 1 . 2]" 1 1307 2 37 VAL QG 2 40 THR MG 4.870 . 4.870 4.300 3.842 4.909 0.039 13 0 "[ . 1 . 2]" 1 1308 2 37 VAL QG 2 41 LEU H 3.850 . 3.850 3.609 3.345 4.219 0.369 11 0 "[ . 1 . 2]" 1 1309 2 37 VAL QG 2 41 LEU QB 3.950 . 3.950 3.266 2.046 3.953 0.003 20 0 "[ . 1 . 2]" 1 1310 2 37 VAL QG 2 41 LEU QD 2.990 . 2.990 2.019 1.904 2.510 . 0 0 "[ . 1 . 2]" 1 1311 2 37 VAL QG 2 42 VAL H 5.250 . 5.250 5.243 4.810 5.549 0.299 11 0 "[ . 1 . 2]" 1 1312 2 37 VAL QG 2 56 ILE HA 5.510 . 5.510 4.623 3.992 4.991 . 0 0 "[ . 1 . 2]" 1 1313 2 37 VAL QG 2 59 LEU H 5.520 . 5.520 5.516 5.031 5.759 0.239 20 0 "[ . 1 . 2]" 1 1314 2 37 VAL QG 2 59 LEU QD 3.180 . 3.180 2.026 1.845 2.219 . 0 0 "[ . 1 . 2]" 1 1315 2 37 VAL MG1 2 38 VAL H 4.630 . 4.630 3.032 2.629 3.778 . 0 0 "[ . 1 . 2]" 1 1316 2 37 VAL MG1 2 40 THR HB 6.000 . 6.000 3.870 3.219 4.737 . 0 0 "[ . 1 . 2]" 1 1317 2 37 VAL MG2 2 38 VAL H 4.630 . 4.630 3.575 1.795 3.881 0.005 20 0 "[ . 1 . 2]" 1 1318 2 37 VAL MG2 2 40 THR HB 6.000 . 6.000 4.569 4.157 5.218 . 0 0 "[ . 1 . 2]" 1 1319 2 38 VAL H 2 38 VAL QG 3.110 . 3.110 2.021 1.777 2.434 0.023 6 0 "[ . 1 . 2]" 1 1320 2 38 VAL H 2 39 SER H 3.870 . 3.870 2.905 2.802 2.973 . 0 0 "[ . 1 . 2]" 1 1321 2 38 VAL H 2 39 SER QB 5.040 . 5.040 4.860 4.571 5.185 0.145 8 0 "[ . 1 . 2]" 1 1322 2 38 VAL H 2 40 THR H 5.930 . 5.930 4.272 3.800 4.821 . 0 0 "[ . 1 . 2]" 1 1323 2 38 VAL H 2 40 THR HB 6.000 . 6.000 5.399 4.867 6.082 0.082 13 0 "[ . 1 . 2]" 1 1324 2 38 VAL H 2 41 LEU H 6.000 . 6.000 4.637 4.520 4.724 . 0 0 "[ . 1 . 2]" 1 1325 2 38 VAL H 2 41 LEU QD 5.180 . 5.180 4.157 3.548 4.716 . 0 0 "[ . 1 . 2]" 1 1326 2 38 VAL HA 2 41 LEU H 6.000 . 6.000 3.534 3.368 3.853 . 0 0 "[ . 1 . 2]" 1 1327 2 38 VAL HA 2 41 LEU QD 4.410 . 4.410 3.014 2.317 3.872 . 0 0 "[ . 1 . 2]" 1 1328 2 38 VAL HA 2 41 LEU HG 4.150 . 4.150 3.878 3.400 4.257 0.107 4 0 "[ . 1 . 2]" 1 1329 2 38 VAL HA 2 42 VAL QG 5.920 . 5.920 3.301 2.448 4.152 . 0 0 "[ . 1 . 2]" 1 1330 2 38 VAL HA 2 56 ILE MG 6.000 . 6.000 4.643 4.168 5.309 . 0 0 "[ . 1 . 2]" 1 1331 2 38 VAL QG 2 39 SER H 5.920 . 5.920 2.512 1.754 3.296 0.046 12 0 "[ . 1 . 2]" 1 1332 2 38 VAL QG 2 59 LEU HB2 5.570 . 5.570 4.374 3.534 5.759 0.189 16 0 "[ . 1 . 2]" 1 1333 2 38 VAL QG 2 59 LEU QD 3.420 . 3.420 2.751 2.030 3.631 0.211 12 0 "[ . 1 . 2]" 1 1334 2 39 SER H 2 39 SER QB 3.320 . 3.320 2.385 2.195 2.556 . 0 0 "[ . 1 . 2]" 1 1335 2 39 SER H 2 40 THR H 3.980 . 3.980 2.736 2.580 3.117 . 0 0 "[ . 1 . 2]" 1 1336 2 39 SER H 2 40 THR HB 6.000 . 6.000 5.009 4.749 5.405 . 0 0 "[ . 1 . 2]" 1 1337 2 39 SER H 2 41 LEU H 6.000 . 6.000 4.264 4.065 4.508 . 0 0 "[ . 1 . 2]" 1 1338 2 39 SER H 2 42 VAL HB 5.600 . 5.600 5.140 4.740 5.517 . 0 0 "[ . 1 . 2]" 1 1339 2 39 SER H 2 42 VAL QG 5.920 . 5.920 4.581 4.020 4.916 . 0 0 "[ . 1 . 2]" 1 1340 2 39 SER HA 2 42 VAL QG 5.920 . 5.920 3.538 2.206 3.992 . 0 0 "[ . 1 . 2]" 1 1341 2 39 SER QB 2 40 THR H 3.300 . 3.300 2.907 2.530 3.360 0.060 19 0 "[ . 1 . 2]" 1 1342 2 39 SER QB 2 40 THR MG 5.810 . 5.810 5.271 4.982 5.563 . 0 0 "[ . 1 . 2]" 1 1343 2 39 SER QB 2 41 LEU H 5.780 . 5.780 5.013 4.777 5.256 . 0 0 "[ . 1 . 2]" 1 1344 2 39 SER QB 2 42 VAL H 5.810 . 5.810 5.169 4.953 5.402 . 0 0 "[ . 1 . 2]" 1 1345 2 40 THR H 2 40 THR MG 3.990 . 3.990 3.762 3.749 3.787 . 0 0 "[ . 1 . 2]" 1 1346 2 40 THR H 2 41 LEU H 3.760 . 3.760 2.581 2.441 2.679 . 0 0 "[ . 1 . 2]" 1 1347 2 40 THR H 2 41 LEU QB 5.330 . 5.330 4.429 4.170 4.710 . 0 0 "[ . 1 . 2]" 1 1348 2 40 THR H 2 41 LEU QD 5.350 . 5.350 4.566 3.667 5.491 0.141 13 0 "[ . 1 . 2]" 1 1349 2 40 THR H 2 42 VAL H 5.530 . 5.530 3.998 3.700 4.274 . 0 0 "[ . 1 . 2]" 1 1350 2 40 THR H 2 42 VAL QG 5.560 . 5.560 4.945 4.011 5.219 . 0 0 "[ . 1 . 2]" 1 1351 2 40 THR H 2 43 GLN QB 5.840 . 5.840 4.714 4.332 6.325 0.485 8 0 "[ . 1 . 2]" 1 1352 2 40 THR HA 2 40 THR MG 3.550 . 3.550 2.311 2.275 2.406 . 0 0 "[ . 1 . 2]" 1 1353 2 40 THR HB 2 41 LEU H 6.000 . 6.000 2.452 2.351 2.563 . 0 0 "[ . 1 . 2]" 1 1354 2 40 THR HB 2 41 LEU QD 5.920 . 5.920 3.586 2.386 4.946 . 0 0 "[ . 1 . 2]" 1 1355 2 40 THR MG 2 41 LEU H 4.550 . 4.550 3.412 3.105 3.557 . 0 0 "[ . 1 . 2]" 1 1356 2 40 THR MG 2 41 LEU QB 4.600 . 4.600 4.661 4.301 4.835 0.235 10 0 "[ . 1 . 2]" 1 1357 2 40 THR MG 2 41 LEU QD 5.100 . 5.100 3.349 2.644 4.613 . 0 0 "[ . 1 . 2]" 1 1358 2 40 THR MG 2 42 VAL H 6.000 . 6.000 4.969 4.748 5.261 . 0 0 "[ . 1 . 2]" 1 1359 2 40 THR MG 2 43 GLN H 6.000 . 6.000 4.488 4.122 4.743 . 0 0 "[ . 1 . 2]" 1 1360 2 40 THR MG 2 43 GLN QB 5.810 . 5.810 3.929 3.008 4.988 . 0 0 "[ . 1 . 2]" 1 1361 2 40 THR MG 2 43 GLN QG 5.810 . 5.810 4.922 3.511 5.680 . 0 0 "[ . 1 . 2]" 1 1362 2 40 THR MG 2 44 ASP H 6.000 . 6.000 4.316 3.551 4.937 . 0 0 "[ . 1 . 2]" 1 1363 2 41 LEU H 2 41 LEU QB 3.060 . 3.060 2.330 2.095 2.553 . 0 0 "[ . 1 . 2]" 1 1364 2 41 LEU H 2 41 LEU QD 3.850 . 3.850 2.905 1.985 3.713 . 0 0 "[ . 1 . 2]" 1 1365 2 41 LEU H 2 42 VAL H 3.550 . 3.550 2.713 2.607 2.804 . 0 0 "[ . 1 . 2]" 1 1366 2 41 LEU H 2 43 GLN H 5.540 . 5.540 3.986 3.707 4.245 . 0 0 "[ . 1 . 2]" 1 1367 2 41 LEU HA 2 41 LEU QD 3.950 . 3.950 2.111 1.994 2.182 . 0 0 "[ . 1 . 2]" 1 1368 2 41 LEU HA 2 43 GLN H 4.560 . 4.560 4.141 3.367 4.656 0.096 19 0 "[ . 1 . 2]" 1 1369 2 41 LEU HA 2 44 ASP H 5.420 . 5.420 3.794 2.918 5.465 0.045 10 0 "[ . 1 . 2]" 1 1370 2 41 LEU QD 2 42 VAL H 4.310 . 4.310 4.020 3.874 4.177 . 0 0 "[ . 1 . 2]" 1 1371 2 41 LEU QD 2 52 VAL HA 5.920 . 5.920 3.701 2.568 5.127 . 0 0 "[ . 1 . 2]" 1 1372 2 41 LEU QD 2 55 ARG H 5.100 . 5.100 4.611 3.675 5.268 0.168 20 0 "[ . 1 . 2]" 1 1373 2 41 LEU QD 2 55 ARG HA 4.810 . 4.810 4.400 3.753 4.949 0.139 17 0 "[ . 1 . 2]" 1 1374 2 41 LEU QD 2 56 ILE H 5.920 . 5.920 4.248 3.366 5.259 . 0 0 "[ . 1 . 2]" 1 1375 2 41 LEU HG 2 59 LEU QD 5.920 . 5.920 4.936 3.951 5.841 . 0 0 "[ . 1 . 2]" 1 1376 2 42 VAL H 2 42 VAL MG1 4.090 . 4.090 3.703 2.370 3.832 . 0 0 "[ . 1 . 2]" 1 1377 2 42 VAL H 2 42 VAL QG 3.520 . 3.520 2.279 2.104 2.466 . 0 0 "[ . 1 . 2]" 1 1378 2 42 VAL H 2 42 VAL MG2 4.090 . 4.090 2.367 2.114 3.728 . 0 0 "[ . 1 . 2]" 1 1379 2 42 VAL H 2 43 GLN H 3.930 . 3.930 2.492 2.235 2.820 . 0 0 "[ . 1 . 2]" 1 1380 2 42 VAL H 2 44 ASP H 5.160 . 5.160 4.166 3.611 5.361 0.201 7 0 "[ . 1 . 2]" 1 1381 2 42 VAL H 2 44 ASP QB 5.810 . 5.810 5.086 4.590 5.540 . 0 0 "[ . 1 . 2]" 1 1382 2 42 VAL HA 2 42 VAL QG 3.120 . 3.120 2.113 2.076 2.227 . 0 0 "[ . 1 . 2]" 1 1383 2 42 VAL HA 2 52 VAL QG 4.500 . 4.500 2.974 2.219 3.482 . 0 0 "[ . 1 . 2]" 1 1384 2 42 VAL HB 2 43 GLN H 4.210 . 4.210 3.117 2.652 4.001 . 0 0 "[ . 1 . 2]" 1 1385 2 42 VAL HB 2 44 ASP H 5.640 . 5.640 5.249 4.724 5.939 0.299 7 0 "[ . 1 . 2]" 1 1386 2 42 VAL HB 2 52 VAL QG 5.920 . 5.920 5.019 4.055 5.584 . 0 0 "[ . 1 . 2]" 1 1387 2 42 VAL HB 2 56 ILE MD 5.860 . 5.860 4.980 3.186 5.749 . 0 0 "[ . 1 . 2]" 1 1388 2 42 VAL QG 2 43 GLN H 3.960 . 3.960 3.362 2.377 3.762 . 0 0 "[ . 1 . 2]" 1 1389 2 42 VAL QG 2 43 GLN QB 5.730 . 5.730 3.860 3.180 4.586 . 0 0 "[ . 1 . 2]" 1 1390 2 42 VAL QG 2 43 GLN QG 5.730 . 5.730 4.473 2.095 5.297 . 0 0 "[ . 1 . 2]" 1 1391 2 42 VAL QG 2 44 ASP H 4.470 . 4.470 4.532 4.071 4.934 0.464 7 0 "[ . 1 . 2]" 1 1392 2 42 VAL QG 2 44 ASP QB 5.730 . 5.730 5.505 4.877 5.818 0.088 12 0 "[ . 1 . 2]" 1 1393 2 42 VAL QG 2 52 VAL H 5.920 . 5.920 5.877 5.431 6.142 0.222 11 0 "[ . 1 . 2]" 1 1394 2 42 VAL QG 2 56 ILE QG 5.660 . 5.660 3.523 2.896 4.388 . 0 0 "[ . 1 . 2]" 1 1395 2 42 VAL MG1 2 43 GLN H 5.190 . 5.190 3.637 2.393 4.204 . 0 0 "[ . 1 . 2]" 1 1396 2 42 VAL MG2 2 43 GLN H 5.190 . 5.190 4.020 3.840 4.261 . 0 0 "[ . 1 . 2]" 1 1397 2 43 GLN H 2 44 ASP H 3.370 . 3.370 2.478 1.662 3.676 0.306 10 0 "[ . 1 . 2]" 1 1398 2 43 GLN H 2 44 ASP QB 5.330 . 5.330 4.100 3.498 4.757 . 0 0 "[ . 1 . 2]" 1 1399 2 43 GLN HA 2 43 GLN QB 2.440 . 2.440 2.388 2.187 2.483 0.043 12 0 "[ . 1 . 2]" 1 1400 2 43 GLN HA 2 43 GLN QG 3.550 . 3.550 2.483 2.280 3.393 . 0 0 "[ . 1 . 2]" 1 1401 2 44 ASP H 2 44 ASP QB 3.230 . 3.230 2.586 2.233 3.018 . 0 0 "[ . 1 . 2]" 1 1402 2 44 ASP H 2 45 GLN H 4.680 . 4.680 3.287 1.674 4.497 0.126 12 0 "[ . 1 . 2]" 1 1403 2 44 ASP QB 2 46 LEU H 5.870 . 5.870 5.136 2.869 6.363 0.493 20 0 "[ . 1 . 2]" 1 1404 2 45 GLN H 2 45 GLN QG 4.730 . 4.730 3.308 1.835 4.350 . 0 0 "[ . 1 . 2]" 1 1405 2 45 GLN H 2 46 LEU QB 5.810 . 5.810 4.680 3.991 6.082 0.272 2 0 "[ . 1 . 2]" 1 1406 2 45 GLN H 2 46 LEU HG 6.000 . 6.000 5.176 2.773 6.493 0.493 10 0 "[ . 1 . 2]" 1 1407 2 45 GLN HA 2 45 GLN QG 3.710 . 3.710 2.826 2.286 3.358 . 0 0 "[ . 1 . 2]" 1 1408 2 45 GLN QG 2 46 LEU H 4.210 . 4.210 3.020 1.804 4.277 0.067 4 0 "[ . 1 . 2]" 1 1409 2 45 GLN QG 2 46 LEU HA 4.400 . 4.400 3.843 3.238 4.515 0.115 12 0 "[ . 1 . 2]" 1 1410 2 45 GLN QG 2 46 LEU QB 5.610 . 5.610 4.744 4.092 5.625 0.015 4 0 "[ . 1 . 2]" 1 1411 2 45 GLN QG 2 46 LEU HG 5.810 . 5.810 5.344 4.100 6.023 0.213 1 0 "[ . 1 . 2]" 1 1412 2 45 GLN QG 2 47 THR H 3.730 . 3.730 2.652 1.923 3.957 0.227 14 0 "[ . 1 . 2]" 1 1413 2 45 GLN QG 2 48 LYS H 5.810 . 5.810 4.332 3.668 5.385 . 0 0 "[ . 1 . 2]" 1 1414 2 45 GLN QG 2 51 VAL QG 4.150 . 4.150 3.369 2.175 4.115 . 0 0 "[ . 1 . 2]" 1 1415 2 45 GLN QG 2 52 VAL H 5.840 . 5.840 5.585 4.076 6.326 0.486 1 0 "[ . 1 . 2]" 1 1416 2 46 LEU H 2 46 LEU HA 2.930 . 2.930 2.688 2.274 2.975 0.045 2 0 "[ . 1 . 2]" 1 1417 2 46 LEU H 2 46 LEU QB 3.080 . 3.080 2.747 2.221 3.191 0.111 19 0 "[ . 1 . 2]" 1 1418 2 46 LEU H 2 46 LEU MD1 4.910 . 4.910 4.003 1.831 4.986 0.076 9 0 "[ . 1 . 2]" 1 1419 2 46 LEU H 2 46 LEU MD2 4.910 . 4.910 4.075 1.986 4.889 . 0 0 "[ . 1 . 2]" 1 1420 2 46 LEU H 2 46 LEU HG 5.360 . 5.360 3.605 2.072 4.647 . 0 0 "[ . 1 . 2]" 1 1421 2 46 LEU H 2 47 THR H 3.230 . 3.230 2.851 1.703 3.429 0.199 11 0 "[ . 1 . 2]" 1 1422 2 46 LEU H 2 47 THR HA 5.530 . 5.530 4.774 3.980 5.473 . 0 0 "[ . 1 . 2]" 1 1423 2 46 LEU H 2 47 THR HB 5.290 . 5.290 4.755 3.749 5.322 0.032 1 0 "[ . 1 . 2]" 1 1424 2 46 LEU H 2 47 THR MG 6.000 . 6.000 4.129 2.862 5.052 . 0 0 "[ . 1 . 2]" 1 1425 2 46 LEU HA 2 46 LEU QD 3.780 . 3.780 2.401 2.223 3.371 . 0 0 "[ . 1 . 2]" 1 1426 2 46 LEU HA 2 47 THR H 3.550 . 3.550 2.712 2.212 2.979 . 0 0 "[ . 1 . 2]" 1 1427 2 46 LEU HA 2 48 LYS H 3.660 . 3.660 3.408 2.967 3.726 0.066 9 0 "[ . 1 . 2]" 1 1428 2 46 LEU HA 2 52 VAL H 5.690 . 5.690 5.558 4.627 5.919 0.229 11 0 "[ . 1 . 2]" 1 1429 2 46 LEU QB 2 46 LEU QD 2.440 . 2.440 1.933 1.921 1.950 . 0 0 "[ . 1 . 2]" 1 1430 2 46 LEU QB 2 47 THR HA 5.810 . 5.810 4.437 4.281 4.851 . 0 0 "[ . 1 . 2]" 1 1431 2 46 LEU HB2 2 46 LEU MD1 3.280 . 3.280 2.284 2.232 2.365 . 0 0 "[ . 1 . 2]" 1 1432 2 46 LEU HB2 2 46 LEU MD2 3.280 . 3.280 3.109 2.421 3.220 . 0 0 "[ . 1 . 2]" 1 1433 2 46 LEU HB3 2 46 LEU MD1 3.280 . 3.280 2.604 2.341 3.220 . 0 0 "[ . 1 . 2]" 1 1434 2 46 LEU HB3 2 46 LEU MD2 3.280 . 3.280 2.288 2.236 2.379 . 0 0 "[ . 1 . 2]" 1 1435 2 46 LEU QD 2 48 LYS H 5.470 . 5.470 4.239 2.825 5.521 0.051 4 0 "[ . 1 . 2]" 1 1436 2 46 LEU HG 2 48 LYS H 6.000 . 6.000 5.562 4.063 6.096 0.096 19 0 "[ . 1 . 2]" 1 1437 2 47 THR H 2 47 THR HB 3.740 . 3.740 2.732 2.431 3.374 . 0 0 "[ . 1 . 2]" 1 1438 2 47 THR H 2 47 THR MG 4.210 . 4.210 1.981 1.747 3.739 0.053 9 0 "[ . 1 . 2]" 1 1439 2 47 THR H 2 48 LYS H 5.370 . 5.370 2.439 1.674 2.768 0.126 11 0 "[ . 1 . 2]" 1 1440 2 47 THR H 2 51 VAL MG1 4.920 . 4.920 4.289 3.922 5.235 0.315 5 0 "[ . 1 . 2]" 1 1441 2 47 THR H 2 51 VAL QG 3.720 . 3.720 3.862 3.255 4.087 0.367 14 0 "[ . 1 . 2]" 1 1442 2 47 THR H 2 51 VAL MG2 4.920 . 4.920 4.730 3.299 5.090 0.170 4 0 "[ . 1 . 2]" 1 1443 2 47 THR HA 2 47 THR MG 3.590 . 3.590 3.152 2.375 3.208 . 0 0 "[ . 1 . 2]" 1 1444 2 47 THR HA 2 48 LYS H 3.280 . 3.280 3.485 3.406 3.534 0.254 9 0 "[ . 1 . 2]" 1 1445 2 47 THR HA 2 48 LYS QB 5.810 . 5.810 4.416 4.313 4.624 . 0 0 "[ . 1 . 2]" 1 1446 2 47 THR HA 2 51 VAL QG 4.870 . 4.870 4.888 4.441 5.141 0.271 1 0 "[ . 1 . 2]" 1 1447 2 47 THR HB 2 48 LYS H 6.000 . 6.000 3.982 2.635 4.165 . 0 0 "[ . 1 . 2]" 1 1448 2 47 THR HB 2 51 VAL QG 4.450 . 4.450 3.999 2.321 4.308 . 0 0 "[ . 1 . 2]" 1 1449 2 47 THR HB 2 52 VAL QG 5.520 . 5.520 5.371 3.571 5.742 0.222 15 0 "[ . 1 . 2]" 1 1450 2 47 THR MG 2 48 LYS H 3.950 . 3.950 2.230 1.826 3.397 . 0 0 "[ . 1 . 2]" 1 1451 2 47 THR MG 2 48 LYS QB 3.720 . 3.720 2.679 2.443 3.261 . 0 0 "[ . 1 . 2]" 1 1452 2 47 THR MG 2 50 ALA H 6.000 . 6.000 5.693 5.087 6.132 0.132 20 0 "[ . 1 . 2]" 1 1453 2 47 THR MG 2 51 VAL H 6.000 . 6.000 4.226 3.974 4.743 . 0 0 "[ . 1 . 2]" 1 1454 2 47 THR MG 2 51 VAL MG1 2.790 . 2.790 2.231 2.072 2.806 0.016 20 0 "[ . 1 . 2]" 1 1455 2 47 THR MG 2 51 VAL QG 2.410 . 2.410 1.955 1.819 2.131 . 0 0 "[ . 1 . 2]" 1 1456 2 47 THR MG 2 51 VAL MG2 2.790 . 2.790 2.218 1.899 2.513 . 0 0 "[ . 1 . 2]" 1 1457 2 47 THR MG 2 52 VAL H 4.990 . 4.990 4.378 3.865 5.427 0.437 20 0 "[ . 1 . 2]" 1 1458 2 48 LYS H 2 48 LYS QB 3.410 . 3.410 2.885 2.696 2.997 . 0 0 "[ . 1 . 2]" 1 1459 2 48 LYS H 2 48 LYS QG 4.080 . 4.080 4.254 4.097 4.326 0.246 8 0 "[ . 1 . 2]" 1 1460 2 48 LYS H 2 49 ASN H 4.560 . 4.560 4.097 3.864 4.210 . 0 0 "[ . 1 . 2]" 1 1461 2 48 LYS H 2 51 VAL H 6.000 . 6.000 4.352 4.127 4.787 . 0 0 "[ . 1 . 2]" 1 1462 2 48 LYS H 2 51 VAL HB 6.000 . 6.000 3.328 2.707 5.640 . 0 0 "[ . 1 . 2]" 1 1463 2 48 LYS H 2 51 VAL MG1 5.550 . 5.550 3.904 3.656 4.188 . 0 0 "[ . 1 . 2]" 1 1464 2 48 LYS H 2 51 VAL QG 4.660 . 4.660 3.298 1.974 3.621 . 0 0 "[ . 1 . 2]" 1 1465 2 48 LYS H 2 51 VAL MG2 5.550 . 5.550 3.655 1.983 4.101 . 0 0 "[ . 1 . 2]" 1 1466 2 48 LYS H 2 52 VAL QG 4.730 . 4.730 3.165 2.479 3.563 . 0 0 "[ . 1 . 2]" 1 1467 2 48 LYS HA 2 49 ASN H 3.110 . 3.110 2.182 2.135 2.261 . 0 0 "[ . 1 . 2]" 1 1468 2 48 LYS HA 2 51 VAL H 5.240 . 5.240 4.532 4.374 4.800 . 0 0 "[ . 1 . 2]" 1 1469 2 48 LYS QB 2 49 ASN H 3.640 . 3.640 3.705 3.542 3.897 0.257 15 0 "[ . 1 . 2]" 1 1470 2 48 LYS QB 2 50 ALA H 3.960 . 3.960 3.401 2.888 3.880 . 0 0 "[ . 1 . 2]" 1 1471 2 48 LYS QB 2 50 ALA MB 4.570 . 4.570 3.370 2.943 3.763 . 0 0 "[ . 1 . 2]" 1 1472 2 48 LYS QB 2 51 VAL QG 3.020 . 3.020 2.106 1.930 2.224 . 0 0 "[ . 1 . 2]" 1 1473 2 48 LYS QE 2 48 LYS QG 2.380 . 2.380 2.177 2.110 2.364 . 0 0 "[ . 1 . 2]" 1 1474 2 48 LYS QE 2 49 ASN H 5.810 . 5.810 3.862 3.472 4.556 . 0 0 "[ . 1 . 2]" 1 1475 2 48 LYS QE 2 49 ASN HA 5.810 . 5.810 5.939 5.496 6.211 0.401 18 0 "[ . 1 . 2]" 1 1476 2 48 LYS QE 2 50 ALA H 4.160 . 4.160 3.424 2.697 3.773 . 0 0 "[ . 1 . 2]" 1 1477 2 48 LYS QE 2 50 ALA MB 4.620 . 4.620 3.074 2.089 3.652 . 0 0 "[ . 1 . 2]" 1 1478 2 48 LYS HE2 2 50 ALA MB 5.270 . 5.270 3.287 2.104 4.345 . 0 0 "[ . 1 . 2]" 1 1479 2 48 LYS HE3 2 50 ALA MB 5.270 . 5.270 4.025 3.276 4.893 . 0 0 "[ . 1 . 2]" 1 1480 2 48 LYS QG 2 49 ASN H 3.830 . 3.830 2.577 2.176 3.082 . 0 0 "[ . 1 . 2]" 1 1481 2 48 LYS QG 2 50 ALA H 4.760 . 4.760 1.837 1.700 2.172 0.100 18 0 "[ . 1 . 2]" 1 1482 2 48 LYS QG 2 50 ALA HA 4.540 . 4.540 4.205 3.799 4.513 . 0 0 "[ . 1 . 2]" 1 1483 2 48 LYS QG 2 51 VAL H 4.240 . 4.240 2.702 1.824 3.184 . 0 0 "[ . 1 . 2]" 1 1484 2 48 LYS QG 2 51 VAL QG 3.370 . 3.370 3.160 2.729 3.581 0.211 20 0 "[ . 1 . 2]" 1 1485 2 48 LYS QG 2 52 VAL H 4.790 . 4.790 4.750 4.321 5.064 0.274 17 0 "[ . 1 . 2]" 1 1486 2 49 ASN H 2 49 ASN HB2 4.140 . 4.140 3.012 2.455 3.614 . 0 0 "[ . 1 . 2]" 1 1487 2 49 ASN H 2 49 ASN QB 3.530 . 3.530 2.554 2.415 2.621 . 0 0 "[ . 1 . 2]" 1 1488 2 49 ASN H 2 49 ASN HB3 4.140 . 4.140 3.197 2.551 3.608 . 0 0 "[ . 1 . 2]" 1 1489 2 49 ASN H 2 50 ALA H 4.180 . 4.180 2.799 2.682 2.918 . 0 0 "[ . 1 . 2]" 1 1490 2 49 ASN H 2 50 ALA HA 5.700 . 5.700 5.386 5.293 5.487 . 0 0 "[ . 1 . 2]" 1 1491 2 49 ASN HA 2 50 ALA MB 6.000 . 6.000 5.026 4.980 5.060 . 0 0 "[ . 1 . 2]" 1 1492 2 49 ASN HA 2 52 VAL H 4.980 . 4.980 3.762 3.422 3.941 . 0 0 "[ . 1 . 2]" 1 1493 2 49 ASN HA 2 52 VAL QG 5.150 . 5.150 2.256 2.031 3.099 . 0 0 "[ . 1 . 2]" 1 1494 2 49 ASN HA 2 53 LEU H 5.240 . 5.240 4.057 3.571 4.409 . 0 0 "[ . 1 . 2]" 1 1495 2 49 ASN HA 2 53 LEU QB 4.670 . 4.670 4.446 3.915 4.850 0.180 13 0 "[ . 1 . 2]" 1 1496 2 49 ASN QB 2 50 ALA H 3.560 . 3.560 2.986 2.475 3.716 0.156 15 0 "[ . 1 . 2]" 1 1497 2 49 ASN QB 2 50 ALA MB 5.090 . 5.090 4.117 3.752 4.708 . 0 0 "[ . 1 . 2]" 1 1498 2 49 ASN QB 2 51 VAL H 5.810 . 5.810 5.094 4.654 5.693 . 0 0 "[ . 1 . 2]" 1 1499 2 49 ASN QB 2 52 VAL QG 4.890 . 4.890 3.552 3.202 4.456 . 0 0 "[ . 1 . 2]" 1 1500 2 49 ASN QB 2 53 LEU H 5.810 . 5.810 4.662 4.259 4.986 . 0 0 "[ . 1 . 2]" 1 1501 2 49 ASN QB 2 53 LEU QD 4.190 . 4.190 3.843 2.598 4.402 0.212 11 0 "[ . 1 . 2]" 1 1502 2 50 ALA H 2 50 ALA MB 3.440 . 3.440 2.252 2.203 2.298 . 0 0 "[ . 1 . 2]" 1 1503 2 50 ALA H 2 51 VAL H 3.870 . 3.870 2.686 2.576 2.786 . 0 0 "[ . 1 . 2]" 1 1504 2 50 ALA H 2 51 VAL HA 6.000 . 6.000 5.295 5.212 5.391 . 0 0 "[ . 1 . 2]" 1 1505 2 50 ALA H 2 51 VAL QG 4.910 . 4.910 4.168 3.395 4.412 . 0 0 "[ . 1 . 2]" 1 1506 2 50 ALA H 2 52 VAL H 4.980 . 4.980 4.209 3.893 4.794 . 0 0 "[ . 1 . 2]" 1 1507 2 50 ALA H 2 52 VAL QG 4.380 . 4.380 3.986 3.519 4.871 0.491 7 0 "[ . 1 . 2]" 1 1508 2 50 ALA MB 2 51 VAL H 4.610 . 4.610 2.337 2.069 2.585 . 0 0 "[ . 1 . 2]" 1 1509 2 50 ALA MB 2 51 VAL HB 6.000 . 6.000 4.524 4.348 5.132 . 0 0 "[ . 1 . 2]" 1 1510 2 50 ALA MB 2 51 VAL QG 3.620 . 3.620 3.114 2.756 3.297 . 0 0 "[ . 1 . 2]" 1 1511 2 50 ALA MB 2 53 LEU H 5.440 . 5.440 4.452 4.226 4.658 . 0 0 "[ . 1 . 2]" 1 1512 2 51 VAL H 2 51 VAL MG1 3.870 . 3.870 3.494 1.875 3.797 . 0 0 "[ . 1 . 2]" 1 1513 2 51 VAL H 2 51 VAL QG 3.210 . 3.210 2.234 1.806 2.415 . 0 0 "[ . 1 . 2]" 1 1514 2 51 VAL H 2 51 VAL MG2 3.870 . 3.870 2.328 2.196 2.445 . 0 0 "[ . 1 . 2]" 1 1515 2 51 VAL H 2 52 VAL H 4.130 . 4.130 2.867 2.658 3.006 . 0 0 "[ . 1 . 2]" 1 1516 2 51 VAL H 2 52 VAL QG 4.770 . 4.770 3.663 3.473 3.952 . 0 0 "[ . 1 . 2]" 1 1517 2 51 VAL H 2 53 LEU H 5.250 . 5.250 4.092 3.883 4.255 . 0 0 "[ . 1 . 2]" 1 1518 2 51 VAL H 2 54 LYS H 6.000 . 6.000 4.874 4.568 5.127 . 0 0 "[ . 1 . 2]" 1 1519 2 51 VAL HA 2 51 VAL MG1 3.270 . 3.270 2.516 2.351 2.595 . 0 0 "[ . 1 . 2]" 1 1520 2 51 VAL HA 2 51 VAL QG 2.780 . 2.780 2.179 2.125 2.418 . 0 0 "[ . 1 . 2]" 1 1521 2 51 VAL HA 2 51 VAL MG2 3.270 . 3.270 2.456 2.295 3.249 . 0 0 "[ . 1 . 2]" 1 1522 2 51 VAL HA 2 54 LYS H 4.330 . 4.330 3.911 3.332 4.299 . 0 0 "[ . 1 . 2]" 1 1523 2 51 VAL HA 2 54 LYS QB 4.850 . 4.850 3.650 2.703 4.471 . 0 0 "[ . 1 . 2]" 1 1524 2 51 VAL HB 2 52 VAL QG 4.560 . 4.560 3.183 2.927 3.981 . 0 0 "[ . 1 . 2]" 1 1525 2 51 VAL QG 2 52 VAL H 3.460 . 3.460 2.784 1.710 3.265 0.090 17 0 "[ . 1 . 2]" 1 1526 2 51 VAL QG 2 52 VAL HA 5.920 . 5.920 3.230 2.943 3.528 . 0 0 "[ . 1 . 2]" 1 1527 2 51 VAL QG 2 54 LYS H 5.920 . 5.920 4.680 4.209 4.991 . 0 0 "[ . 1 . 2]" 1 1528 2 51 VAL QG 2 54 LYS QE 5.920 . 5.920 3.761 2.242 5.529 . 0 0 "[ . 1 . 2]" 1 1529 2 51 VAL QG 2 54 LYS QG 5.060 . 5.060 3.931 3.312 4.753 . 0 0 "[ . 1 . 2]" 1 1530 2 52 VAL H 2 52 VAL HB 3.700 . 3.700 3.467 2.532 3.645 . 0 0 "[ . 1 . 2]" 1 1531 2 52 VAL H 2 52 VAL QG 3.630 . 3.630 1.784 1.685 2.131 0.115 18 0 "[ . 1 . 2]" 1 1532 2 52 VAL H 2 53 LEU H 4.080 . 4.080 2.496 2.386 2.780 . 0 0 "[ . 1 . 2]" 1 1533 2 52 VAL H 2 53 LEU HA 6.000 . 6.000 5.118 5.018 5.362 . 0 0 "[ . 1 . 2]" 1 1534 2 52 VAL H 2 53 LEU QB 5.140 . 5.140 4.249 4.110 4.558 . 0 0 "[ . 1 . 2]" 1 1535 2 52 VAL H 2 54 LYS H 4.420 . 4.420 4.238 3.976 4.909 0.489 8 0 "[ . 1 . 2]" 1 1536 2 52 VAL H 2 54 LYS QD 5.600 . 5.600 5.209 4.811 5.536 . 0 0 "[ . 1 . 2]" 1 1537 2 52 VAL HA 2 52 VAL MG1 3.450 . 3.450 2.322 2.285 2.396 . 0 0 "[ . 1 . 2]" 1 1538 2 52 VAL HA 2 52 VAL QG 3.020 . 3.020 2.244 2.088 2.331 . 0 0 "[ . 1 . 2]" 1 1539 2 52 VAL HA 2 52 VAL MG2 3.450 . 3.450 3.074 2.386 3.206 . 0 0 "[ . 1 . 2]" 1 1540 2 52 VAL HA 2 55 ARG H 4.360 . 4.360 3.537 3.353 3.802 . 0 0 "[ . 1 . 2]" 1 1541 2 52 VAL HA 2 56 ILE H 5.380 . 5.380 4.406 3.933 5.056 . 0 0 "[ . 1 . 2]" 1 1542 2 52 VAL HB 2 53 LEU H 4.560 . 4.560 3.569 2.555 3.865 . 0 0 "[ . 1 . 2]" 1 1543 2 52 VAL QG 2 53 LEU H 3.440 . 3.440 2.246 1.908 3.222 . 0 0 "[ . 1 . 2]" 1 1544 2 52 VAL QG 2 53 LEU HA 3.630 . 3.630 3.273 3.058 3.746 0.116 14 0 "[ . 1 . 2]" 1 1545 2 52 VAL QG 2 53 LEU QB 3.960 . 3.960 3.243 2.915 4.264 0.304 14 0 "[ . 1 . 2]" 1 1546 2 52 VAL QG 2 54 LYS H 4.780 . 4.780 4.281 4.024 4.820 0.040 10 0 "[ . 1 . 2]" 1 1547 2 52 VAL QG 2 54 LYS QD 5.340 . 5.340 5.387 5.060 5.676 0.336 10 0 "[ . 1 . 2]" 1 1548 2 52 VAL QG 2 55 ARG H 4.810 . 4.810 4.564 4.308 4.791 . 0 0 "[ . 1 . 2]" 1 1549 2 52 VAL QG 2 56 ILE HB 5.920 . 5.920 4.940 4.144 5.805 . 0 0 "[ . 1 . 2]" 1 1550 2 53 LEU H 2 53 LEU QB 3.190 . 3.190 2.214 2.109 2.272 . 0 0 "[ . 1 . 2]" 1 1551 2 53 LEU H 2 53 LEU MD1 4.530 . 4.530 4.030 3.515 4.245 . 0 0 "[ . 1 . 2]" 1 1552 2 53 LEU H 2 53 LEU QD 3.880 . 3.880 3.586 3.290 3.763 . 0 0 "[ . 1 . 2]" 1 1553 2 53 LEU H 2 53 LEU MD2 4.530 . 4.530 4.097 3.431 4.378 . 0 0 "[ . 1 . 2]" 1 1554 2 53 LEU H 2 54 LYS H 3.790 . 3.790 2.754 2.578 3.013 . 0 0 "[ . 1 . 2]" 1 1555 2 53 LEU H 2 54 LYS QD 5.390 . 5.390 5.213 4.107 5.601 0.211 3 0 "[ . 1 . 2]" 1 1556 2 53 LEU H 2 56 ILE HB 6.000 . 6.000 5.283 5.035 5.858 . 0 0 "[ . 1 . 2]" 1 1557 2 53 LEU H 2 56 ILE QG 4.640 . 4.640 4.654 4.208 4.974 0.334 15 0 "[ . 1 . 2]" 1 1558 2 53 LEU HA 2 53 LEU MD1 4.210 . 4.210 2.513 2.120 3.802 . 0 0 "[ . 1 . 2]" 1 1559 2 53 LEU HA 2 53 LEU QD 3.450 . 3.450 2.138 1.997 2.313 . 0 0 "[ . 1 . 2]" 1 1560 2 53 LEU HA 2 53 LEU MD2 4.210 . 4.210 3.190 2.186 3.848 . 0 0 "[ . 1 . 2]" 1 1561 2 53 LEU HA 2 56 ILE H 4.510 . 4.510 3.322 3.041 3.586 . 0 0 "[ . 1 . 2]" 1 1562 2 53 LEU HA 2 56 ILE MD 4.440 . 4.440 3.102 2.258 4.510 0.070 10 0 "[ . 1 . 2]" 1 1563 2 53 LEU HA 2 56 ILE MG 6.000 . 6.000 4.059 3.824 4.296 . 0 0 "[ . 1 . 2]" 1 1564 2 53 LEU QB 2 53 LEU QD 2.670 . 2.670 1.954 1.914 2.028 . 0 0 "[ . 1 . 2]" 1 1565 2 53 LEU QD 2 54 LYS H 5.270 . 5.270 3.773 3.207 4.328 . 0 0 "[ . 1 . 2]" 1 1566 2 53 LEU QD 2 56 ILE HA 5.920 . 5.920 5.200 4.957 5.696 . 0 0 "[ . 1 . 2]" 1 1567 2 53 LEU QD 2 56 ILE HB 4.140 . 4.140 2.705 2.316 3.383 . 0 0 "[ . 1 . 2]" 1 1568 2 53 LEU QD 2 56 ILE QG 3.970 . 3.970 3.749 2.570 4.352 0.382 7 0 "[ . 1 . 2]" 1 1569 2 53 LEU QD 2 57 GLN HA 4.800 . 4.800 4.464 3.974 4.973 0.173 6 0 "[ . 1 . 2]" 1 1570 2 53 LEU QD 2 57 GLN QG 3.700 . 3.700 2.336 1.922 2.937 . 0 0 "[ . 1 . 2]" 1 1571 2 53 LEU MD1 2 56 ILE HB 5.170 . 5.170 3.243 2.320 5.414 0.244 7 0 "[ . 1 . 2]" 1 1572 2 53 LEU MD2 2 56 ILE HB 5.170 . 5.170 4.376 2.662 5.362 0.192 14 0 "[ . 1 . 2]" 1 1573 2 54 LYS H 2 54 LYS QG 3.730 . 3.730 2.296 1.718 3.047 0.082 5 0 "[ . 1 . 2]" 1 1574 2 54 LYS H 2 55 ARG H 4.110 . 4.110 2.756 2.633 2.835 . 0 0 "[ . 1 . 2]" 1 1575 2 54 LYS H 2 56 ILE H 5.090 . 5.090 4.165 3.980 4.308 . 0 0 "[ . 1 . 2]" 1 1576 2 54 LYS H 2 56 ILE QG 5.810 . 5.810 5.205 4.584 5.679 . 0 0 "[ . 1 . 2]" 1 1577 2 54 LYS H 2 57 GLN H 5.820 . 5.820 4.818 4.620 4.940 . 0 0 "[ . 1 . 2]" 1 1578 2 54 LYS H 2 57 GLN QG 4.900 . 4.900 4.834 4.664 4.975 0.075 5 0 "[ . 1 . 2]" 1 1579 2 54 LYS HA 2 54 LYS QG 3.630 . 3.630 2.908 2.292 3.320 . 0 0 "[ . 1 . 2]" 1 1580 2 54 LYS HA 2 57 GLN H 4.490 . 4.490 3.652 3.338 3.911 . 0 0 "[ . 1 . 2]" 1 1581 2 54 LYS HA 2 57 GLN QG 5.810 . 5.810 3.577 3.177 3.944 . 0 0 "[ . 1 . 2]" 1 1582 2 54 LYS QD 2 54 LYS QE 2.050 . 2.050 2.061 2.001 2.109 0.059 16 0 "[ . 1 . 2]" 1 1583 2 54 LYS HD2 2 54 LYS QE 2.360 . 2.360 2.352 2.202 2.505 0.145 5 0 "[ . 1 . 2]" 1 1584 2 54 LYS HD3 2 54 LYS QE 2.360 . 2.360 2.293 2.196 2.469 0.109 8 0 "[ . 1 . 2]" 1 1585 2 54 LYS QE 2 54 LYS QG 2.950 . 2.950 2.355 2.077 2.920 . 0 0 "[ . 1 . 2]" 1 1586 2 54 LYS QG 2 55 ARG H 5.810 . 5.810 2.985 1.814 4.232 . 0 0 "[ . 1 . 2]" 1 1587 2 55 ARG H 2 56 ILE H 3.650 . 3.650 2.620 2.538 2.699 . 0 0 "[ . 1 . 2]" 1 1588 2 55 ARG H 2 57 GLN H 6.000 . 6.000 4.309 4.193 4.432 . 0 0 "[ . 1 . 2]" 1 1589 2 55 ARG H 2 57 GLN QG 5.310 . 5.310 5.415 5.259 5.633 0.323 5 0 "[ . 1 . 2]" 1 1590 2 55 ARG H 2 58 HIS H 5.640 . 5.640 4.766 4.604 4.951 . 0 0 "[ . 1 . 2]" 1 1591 2 55 ARG HA 2 57 GLN H 4.840 . 4.840 4.723 4.592 4.872 0.032 14 0 "[ . 1 . 2]" 1 1592 2 56 ILE H 2 56 ILE MD 5.190 . 5.190 3.344 2.675 3.854 . 0 0 "[ . 1 . 2]" 1 1593 2 56 ILE H 2 57 GLN H 4.260 . 4.260 2.714 2.543 2.806 . 0 0 "[ . 1 . 2]" 1 1594 2 56 ILE HA 2 59 LEU QD 5.920 . 5.920 3.458 2.600 4.209 . 0 0 "[ . 1 . 2]" 1 1595 2 56 ILE HB 2 56 ILE MD 3.480 . 3.480 2.665 2.253 3.239 . 0 0 "[ . 1 . 2]" 1 1596 2 56 ILE HB 2 59 LEU H 6.000 . 6.000 5.385 5.128 5.755 . 0 0 "[ . 1 . 2]" 1 1597 2 56 ILE MD 2 57 GLN H 4.520 . 4.520 4.411 4.192 4.764 0.244 1 0 "[ . 1 . 2]" 1 1598 2 56 ILE MD 2 58 HIS H 6.000 . 6.000 6.022 5.126 6.350 0.350 7 0 "[ . 1 . 2]" 1 1599 2 56 ILE MD 2 59 LEU H 6.000 . 6.000 5.806 4.779 6.417 0.417 3 0 "[ . 1 . 2]" 1 1600 2 56 ILE QG 2 57 GLN H 4.040 . 4.040 3.959 3.703 4.135 0.095 3 0 "[ . 1 . 2]" 1 1601 2 56 ILE MG 2 57 GLN H 6.000 . 6.000 3.242 3.013 3.576 . 0 0 "[ . 1 . 2]" 1 1602 2 56 ILE MG 2 57 GLN HA 6.000 . 6.000 3.376 3.149 3.744 . 0 0 "[ . 1 . 2]" 1 1603 2 56 ILE MG 2 57 GLN QG 5.810 . 5.810 3.565 3.195 3.957 . 0 0 "[ . 1 . 2]" 1 1604 2 56 ILE MG 2 59 LEU QD 4.290 . 4.290 3.869 3.141 4.518 0.228 9 0 "[ . 1 . 2]" 1 1605 2 56 ILE MG 2 60 ASP H 6.000 . 6.000 4.478 3.923 5.257 . 0 0 "[ . 1 . 2]" 1 1606 2 58 HIS H 2 59 LEU H 3.730 . 3.730 2.553 2.470 2.716 . 0 0 "[ . 1 . 2]" 1 1607 2 58 HIS H 2 59 LEU HB2 4.800 . 4.800 4.688 4.306 4.906 0.106 1 0 "[ . 1 . 2]" 1 1608 2 58 HIS HA 2 61 GLU H 4.140 . 4.140 3.661 3.486 3.921 . 0 0 "[ . 1 . 2]" 1 1609 2 59 LEU H 2 59 LEU MD1 4.980 . 4.980 4.052 3.416 4.304 . 0 0 "[ . 1 . 2]" 1 1610 2 59 LEU H 2 59 LEU QD 4.160 . 4.160 3.514 2.549 3.784 . 0 0 "[ . 1 . 2]" 1 1611 2 59 LEU H 2 59 LEU MD2 4.980 . 4.980 3.985 2.570 4.322 . 0 0 "[ . 1 . 2]" 1 1612 2 59 LEU H 2 60 ASP H 3.820 . 3.820 2.718 2.425 2.825 . 0 0 "[ . 1 . 2]" 1 1613 2 59 LEU H 2 61 GLU H 6.000 . 6.000 4.384 4.103 4.744 . 0 0 "[ . 1 . 2]" 1 1614 2 59 LEU HA 2 59 LEU QD 3.810 . 3.810 2.180 1.987 3.052 . 0 0 "[ . 1 . 2]" 1 1615 2 59 LEU HA 2 62 ALA MB 6.000 . 6.000 3.121 2.232 3.606 . 0 0 "[ . 1 . 2]" 1 1616 2 59 LEU HB2 2 61 GLU QG 5.810 . 5.810 5.699 5.305 6.138 0.328 3 0 "[ . 1 . 2]" 1 1617 2 59 LEU QD 2 60 ASP H 4.820 . 4.820 3.969 3.425 4.291 . 0 0 "[ . 1 . 2]" 1 1618 2 59 LEU QD 2 62 ALA MB 4.090 . 4.090 2.302 2.065 2.982 . 0 0 "[ . 1 . 2]" 1 1619 2 59 LEU MD1 2 60 ASP H 6.000 . 6.000 4.542 3.529 5.049 . 0 0 "[ . 1 . 2]" 1 1620 2 59 LEU MD2 2 60 ASP H 6.000 . 6.000 4.495 3.484 4.823 . 0 0 "[ . 1 . 2]" 1 1621 2 59 LEU HG 2 60 ASP H 6.000 . 6.000 4.555 3.978 5.580 . 0 0 "[ . 1 . 2]" 1 1622 2 59 LEU HG 2 63 TYR H 6.000 . 6.000 4.627 3.626 6.152 0.152 11 0 "[ . 1 . 2]" 1 1623 2 60 ASP H 2 61 GLU HA 5.500 . 5.500 5.339 5.232 5.439 . 0 0 "[ . 1 . 2]" 1 1624 2 60 ASP H 2 61 GLU QB 5.780 . 5.780 4.692 4.543 4.977 . 0 0 "[ . 1 . 2]" 1 1625 2 60 ASP H 2 61 GLU QG 5.810 . 5.810 4.503 3.879 4.964 . 0 0 "[ . 1 . 2]" 1 1626 2 60 ASP QB 2 61 GLU QG 5.610 . 5.610 4.872 3.970 5.297 . 0 0 "[ . 1 . 2]" 1 1627 2 60 ASP QB 2 62 ALA H 5.810 . 5.810 4.701 4.298 5.134 . 0 0 "[ . 1 . 2]" 1 1628 2 60 ASP QB 2 63 TYR H 5.810 . 5.810 5.122 4.825 5.355 . 0 0 "[ . 1 . 2]" 1 1629 2 60 ASP QB 2 63 TYR QD 5.180 . 5.180 3.636 2.842 4.162 . 0 0 "[ . 1 . 2]" 1 1630 2 60 ASP QB 2 63 TYR QE 5.060 . 5.060 4.627 3.652 5.270 0.210 1 0 "[ . 1 . 2]" 1 1631 2 61 GLU H 2 61 GLU QB 3.410 . 3.410 2.272 2.169 2.448 . 0 0 "[ . 1 . 2]" 1 1632 2 61 GLU H 2 61 GLU QG 3.490 . 3.490 2.560 2.085 2.902 . 0 0 "[ . 1 . 2]" 1 1633 2 61 GLU H 2 62 ALA HA 6.000 . 6.000 5.283 5.209 5.373 . 0 0 "[ . 1 . 2]" 1 1634 2 61 GLU HA 2 61 GLU QG 3.560 . 3.560 3.316 3.287 3.332 . 0 0 "[ . 1 . 2]" 1 1635 2 61 GLU HA 2 63 TYR H 6.000 . 6.000 4.914 4.764 5.152 . 0 0 "[ . 1 . 2]" 1 1636 2 61 GLU QB 2 62 ALA H 4.030 . 4.030 3.468 3.363 3.586 . 0 0 "[ . 1 . 2]" 1 1637 2 61 GLU QG 2 62 ALA H 4.100 . 4.100 2.018 1.842 2.314 . 0 0 "[ . 1 . 2]" 1 1638 2 61 GLU QG 2 65 LYS QB 5.610 . 5.610 4.328 3.947 4.843 . 0 0 "[ . 1 . 2]" 1 1639 2 62 ALA H 2 63 TYR H 3.730 . 3.730 2.699 2.576 2.865 . 0 0 "[ . 1 . 2]" 1 1640 2 62 ALA H 2 63 TYR QB 5.810 . 5.810 4.283 4.182 4.479 . 0 0 "[ . 1 . 2]" 1 1641 2 62 ALA H 2 65 LYS QB 5.320 . 5.320 4.784 4.559 5.017 . 0 0 "[ . 1 . 2]" 1 1642 2 62 ALA HA 2 65 LYS QB 5.410 . 5.410 2.576 2.355 2.798 . 0 0 "[ . 1 . 2]" 1 1643 2 62 ALA MB 2 63 TYR H 4.210 . 4.210 2.221 2.015 2.419 . 0 0 "[ . 1 . 2]" 1 1644 2 63 TYR H 2 63 TYR QD 4.560 . 4.560 3.685 3.429 3.870 . 0 0 "[ . 1 . 2]" 1 1645 2 63 TYR H 2 63 TYR QE 6.000 . 6.000 5.780 5.515 5.906 . 0 0 "[ . 1 . 2]" 1 1646 2 63 TYR H 2 64 ASN H 4.250 . 4.250 2.822 2.757 2.890 . 0 0 "[ . 1 . 2]" 1 1647 2 63 TYR H 2 64 ASN HA 6.000 . 6.000 5.411 5.364 5.459 . 0 0 "[ . 1 . 2]" 1 1648 2 63 TYR H 2 64 ASN QB 5.810 . 5.810 4.594 4.530 4.725 . 0 0 "[ . 1 . 2]" 1 1649 2 63 TYR H 2 65 LYS QB 5.810 . 5.810 4.882 4.686 5.049 . 0 0 "[ . 1 . 2]" 1 1650 2 63 TYR H 2 66 VAL HB 6.000 . 6.000 5.743 5.154 6.100 0.100 13 0 "[ . 1 . 2]" 1 1651 2 63 TYR QB 2 64 ASN H 3.570 . 3.570 2.983 2.876 3.117 . 0 0 "[ . 1 . 2]" 1 1652 2 63 TYR QD 2 64 ASN H 4.230 . 4.230 2.686 2.234 3.032 . 0 0 "[ . 1 . 2]" 1 1653 2 63 TYR QE 2 64 ASN H 4.380 . 4.380 4.206 3.873 4.459 0.079 15 0 "[ . 1 . 2]" 1 1654 2 63 TYR QE 2 67 LYS QD 4.830 . 4.830 2.836 2.348 3.849 . 0 0 "[ . 1 . 2]" 1 1655 2 63 TYR QE 2 67 LYS HG3 3.950 . 3.950 2.792 2.413 3.836 . 0 0 "[ . 1 . 2]" 1 1656 2 64 ASN H 2 66 VAL HB 6.000 . 6.000 5.348 5.041 5.571 . 0 0 "[ . 1 . 2]" 1 1657 2 64 ASN H 2 68 ARG H 6.000 . 6.000 5.964 5.667 6.205 0.205 16 0 "[ . 1 . 2]" 1 1658 2 64 ASN HA 2 67 LYS H 3.840 . 3.840 3.495 3.239 3.711 . 0 0 "[ . 1 . 2]" 1 1659 2 64 ASN HA 2 68 ARG H 4.040 . 4.040 3.879 3.442 4.274 0.234 16 0 "[ . 1 . 2]" 1 1660 2 65 LYS H 2 66 VAL H 3.410 . 3.410 2.654 2.571 2.762 . 0 0 "[ . 1 . 2]" 1 1661 2 65 LYS H 2 66 VAL QG 5.610 . 5.610 3.979 3.836 4.084 . 0 0 "[ . 1 . 2]" 1 1662 2 65 LYS H 2 67 LYS H 4.710 . 4.710 4.373 4.173 4.714 0.004 18 0 "[ . 1 . 2]" 1 1663 2 65 LYS HA 2 67 LYS H 6.000 . 6.000 4.579 4.317 4.928 . 0 0 "[ . 1 . 2]" 1 1664 2 66 VAL H 2 66 VAL HB 4.170 . 4.170 2.494 2.427 2.552 . 0 0 "[ . 1 . 2]" 1 1665 2 66 VAL H 2 66 VAL MG1 3.700 . 3.700 3.760 3.746 3.770 0.070 8 0 "[ . 1 . 2]" 1 1666 2 66 VAL H 2 66 VAL QG 3.100 . 3.100 2.128 2.028 2.263 . 0 0 "[ . 1 . 2]" 1 1667 2 66 VAL H 2 66 VAL MG2 3.700 . 3.700 2.140 2.036 2.282 . 0 0 "[ . 1 . 2]" 1 1668 2 66 VAL H 2 67 LYS HG3 4.660 . 4.660 4.847 4.604 5.118 0.458 16 0 "[ . 1 . 2]" 1 1669 2 66 VAL HA 2 66 VAL QG 2.950 . 2.950 2.082 2.056 2.126 . 0 0 "[ . 1 . 2]" 1 1670 2 66 VAL HA 2 66 VAL MG2 3.430 . 3.430 2.301 2.272 2.355 . 0 0 "[ . 1 . 2]" 1 1671 2 66 VAL HA 2 68 ARG H 6.000 . 6.000 4.659 4.141 5.011 . 0 0 "[ . 1 . 2]" 1 1672 2 66 VAL HB 2 67 LYS HA 6.000 . 6.000 4.344 4.254 4.449 . 0 0 "[ . 1 . 2]" 1 1673 2 66 VAL QG 2 67 LYS H 3.710 . 3.710 3.088 2.857 3.251 . 0 0 "[ . 1 . 2]" 1 1674 2 66 VAL QG 2 67 LYS HA 4.230 . 4.230 3.356 3.205 3.545 . 0 0 "[ . 1 . 2]" 1 1675 2 66 VAL QG 2 69 GLY H 5.920 . 5.920 4.429 4.136 4.819 . 0 0 "[ . 1 . 2]" 1 1676 2 66 VAL QG 2 70 GLU QG 3.120 . 3.120 2.879 2.032 3.262 0.142 11 0 "[ . 1 . 2]" 1 1677 2 67 LYS H 2 67 LYS HB2 3.660 . 3.660 2.493 2.401 2.767 . 0 0 "[ . 1 . 2]" 1 1678 2 67 LYS H 2 68 ARG H 3.610 . 3.610 2.601 2.427 2.727 . 0 0 "[ . 1 . 2]" 1 1679 2 67 LYS H 2 68 ARG HB3 6.000 . 6.000 5.421 4.762 6.098 0.098 5 0 "[ . 1 . 2]" 1 1680 2 67 LYS H 2 69 GLY H 5.150 . 5.150 3.886 3.567 4.460 . 0 0 "[ . 1 . 2]" 1 1681 2 67 LYS H 2 70 GLU QB 5.490 . 5.490 5.115 4.424 5.743 0.253 13 0 "[ . 1 . 2]" 1 1682 2 67 LYS H 2 70 GLU QG 5.810 . 5.810 4.490 3.832 5.280 . 0 0 "[ . 1 . 2]" 1 1683 2 67 LYS HA 2 67 LYS QD 4.810 . 4.810 2.938 2.313 3.703 . 0 0 "[ . 1 . 2]" 1 1684 2 67 LYS HA 2 67 LYS HG3 3.440 . 3.440 3.618 3.345 3.817 0.377 16 0 "[ . 1 . 2]" 1 1685 2 67 LYS HA 2 70 GLU H 4.290 . 4.290 3.502 2.842 4.584 0.294 16 0 "[ . 1 . 2]" 1 1686 2 67 LYS HB2 2 68 ARG H 4.150 . 4.150 2.430 2.267 2.959 . 0 0 "[ . 1 . 2]" 1 1687 2 67 LYS HB2 2 68 ARG QD 5.810 . 5.810 5.474 4.728 6.288 0.478 1 0 "[ . 1 . 2]" 1 1688 2 67 LYS QD 2 70 GLU H 5.810 . 5.810 5.983 5.638 6.300 0.490 12 0 "[ . 1 . 2]" 1 1689 2 67 LYS HG3 2 68 ARG H 4.520 . 4.520 4.316 4.078 4.660 0.140 16 0 "[ . 1 . 2]" 1 1690 2 67 LYS HG3 2 69 GLY H 6.000 . 6.000 6.175 5.867 6.418 0.418 4 0 "[ . 1 . 2]" 1 1691 2 68 ARG H 2 68 ARG QD 4.990 . 4.990 4.239 3.674 4.617 . 0 0 "[ . 1 . 2]" 1 1692 2 68 ARG H 2 68 ARG QG 3.640 . 3.640 3.315 2.292 4.076 0.436 4 0 "[ . 1 . 2]" 1 1693 2 68 ARG H 2 69 GLY H 2.930 . 2.930 2.638 2.345 2.891 . 0 0 "[ . 1 . 2]" 1 1694 2 68 ARG H 2 69 GLY QA 4.330 . 4.330 4.519 4.244 4.777 0.447 4 0 "[ . 1 . 2]" 1 1695 2 68 ARG H 2 70 GLU H 4.880 . 4.880 4.207 3.718 4.928 0.048 4 0 "[ . 1 . 2]" 1 1696 2 68 ARG H 2 70 GLU QB 5.810 . 5.810 5.333 4.032 6.296 0.486 13 0 "[ . 1 . 2]" 1 1697 2 68 ARG H 2 70 GLU HG2 6.000 . 6.000 5.501 4.677 6.091 0.091 16 0 "[ . 1 . 2]" 1 1698 2 68 ARG H 2 70 GLU HG3 6.000 . 6.000 5.634 4.444 6.470 0.470 1 0 "[ . 1 . 2]" 1 1699 2 68 ARG HA 2 68 ARG QG 3.030 . 3.030 2.442 2.261 2.960 . 0 0 "[ . 1 . 2]" 1 1700 2 68 ARG HB3 2 68 ARG QD 3.390 . 3.390 2.706 2.266 3.441 0.051 4 0 "[ . 1 . 2]" 1 1701 2 68 ARG HB3 2 69 GLY H 3.520 . 3.520 3.385 2.707 3.910 0.390 3 0 "[ . 1 . 2]" 1 1702 2 68 ARG HB3 2 69 GLY QA 4.460 . 4.460 4.085 3.823 4.541 0.081 16 0 "[ . 1 . 2]" 1 1703 2 68 ARG QG 2 69 GLY H 4.680 . 4.680 4.181 3.767 4.537 . 0 0 "[ . 1 . 2]" 1 1704 2 69 GLY H 2 69 GLY QA 2.580 . 2.580 2.252 2.196 2.464 . 0 0 "[ . 1 . 2]" 1 1705 2 69 GLY H 2 70 GLU H 3.330 . 3.330 2.381 2.037 2.708 . 0 0 "[ . 1 . 2]" 1 1706 2 69 GLY H 2 70 GLU HA 5.040 . 5.040 4.995 4.423 5.209 0.169 10 0 "[ . 1 . 2]" 1 1707 2 69 GLY H 2 70 GLU QB 5.810 . 5.810 4.347 3.673 4.795 . 0 0 "[ . 1 . 2]" 1 1708 2 69 GLY H 2 70 GLU QG 4.750 . 4.750 3.761 3.001 5.028 0.278 16 0 "[ . 1 . 2]" 1 1709 2 69 GLY QA 2 70 GLU H 3.100 . 3.100 2.730 2.400 2.911 . 0 0 "[ . 1 . 2]" 1 1710 2 69 GLY QA 2 70 GLU HA 5.240 . 5.240 4.052 4.002 4.190 . 0 0 "[ . 1 . 2]" 1 1711 2 70 GLU H 2 70 GLU QB 3.050 . 3.050 2.392 1.943 2.566 . 0 0 "[ . 1 . 2]" 1 1712 2 70 GLU H 2 70 GLU QG 3.810 . 3.810 2.441 1.857 3.446 . 0 0 "[ . 1 . 2]" 1 1713 2 70 GLU HA 2 70 GLU QB 2.600 . 2.600 2.309 2.176 2.448 . 0 0 "[ . 1 . 2]" 1 1714 2 70 GLU HA 2 70 GLU QG 3.080 . 3.080 2.995 2.587 3.416 0.336 15 0 "[ . 1 . 2]" 1 1715 2 70 GLU HB2 2 71 SER H 4.130 . 4.130 2.911 1.848 4.324 0.194 16 0 "[ . 1 . 2]" 1 1716 2 70 GLU HB3 2 71 SER H 4.130 . 4.130 3.038 1.817 4.158 0.028 1 0 "[ . 1 . 2]" 1 1717 2 71 SER H 2 71 SER QB 3.060 . 3.060 2.727 2.266 3.102 0.042 7 0 "[ . 1 . 2]" 1 1718 2 71 SER H 2 72 LYS QG 5.810 . 5.810 5.114 3.659 6.141 0.331 6 0 "[ . 1 . 2]" 1 1719 2 71 SER HA 2 72 LYS H 3.070 . 3.070 2.802 2.168 3.556 0.486 14 0 "[ . 1 . 2]" 1 1720 2 71 SER HA 2 72 LYS QB 4.870 . 4.870 4.609 4.058 5.277 0.407 10 0 "[ . 1 . 2]" 1 1721 2 71 SER QB 2 72 LYS H 3.890 . 3.890 2.780 1.840 4.016 0.126 6 0 "[ . 1 . 2]" 1 1722 2 71 SER QB 2 73 LEU H 5.610 . 5.610 4.139 2.439 6.044 0.434 17 0 "[ . 1 . 2]" 1 1723 2 72 LYS H 2 72 LYS HB2 4.020 . 4.020 3.011 2.323 3.624 . 0 0 "[ . 1 . 2]" 1 1724 2 72 LYS H 2 72 LYS QB 3.480 . 3.480 2.857 2.295 3.385 . 0 0 "[ . 1 . 2]" 1 1725 2 72 LYS H 2 72 LYS HB3 4.020 . 4.020 3.747 2.989 4.066 0.046 19 0 "[ . 1 . 2]" 1 1726 2 72 LYS H 2 72 LYS QG 4.160 . 4.160 2.780 2.044 4.177 0.017 6 0 "[ . 1 . 2]" 1 1727 2 72 LYS H 2 74 GLU HG2 6.000 . 6.000 5.296 3.191 6.177 0.177 19 0 "[ . 1 . 2]" 1 1728 2 72 LYS H 2 74 GLU HG3 6.000 . 6.000 5.273 4.379 6.218 0.218 17 0 "[ . 1 . 2]" 1 1729 2 72 LYS HA 2 72 LYS QG 3.610 . 3.610 2.414 2.202 3.035 . 0 0 "[ . 1 . 2]" 1 1730 2 72 LYS HA 2 73 LEU H 3.570 . 3.570 3.177 2.210 3.572 0.002 9 0 "[ . 1 . 2]" 1 1731 2 72 LYS QB 2 73 LEU H 3.900 . 3.900 2.780 1.720 3.884 0.080 5 0 "[ . 1 . 2]" 1 1732 2 72 LYS QB 2 73 LEU QD 5.730 . 5.730 3.775 2.138 5.242 . 0 0 "[ . 1 . 2]" 1 1733 2 73 LEU H 2 73 LEU QB 3.000 . 3.000 2.578 2.143 3.179 0.179 9 0 "[ . 1 . 2]" 1 1734 2 73 LEU H 2 73 LEU QD 4.530 . 4.530 3.100 1.747 4.125 0.053 18 0 "[ . 1 . 2]" 1 1735 2 73 LEU H 2 73 LEU HG 4.490 . 4.490 3.589 1.984 4.725 0.235 10 0 "[ . 1 . 2]" 1 1736 2 73 LEU H 2 74 GLU QG 5.810 . 5.810 3.960 2.579 5.106 . 0 0 "[ . 1 . 2]" 1 1737 2 73 LEU HA 2 73 LEU QD 3.480 . 3.480 2.470 1.966 3.448 . 0 0 "[ . 1 . 2]" 1 1738 2 73 LEU HA 2 73 LEU HG 3.510 . 3.510 3.060 2.365 3.657 0.147 7 0 "[ . 1 . 2]" 1 1739 2 73 LEU HA 2 74 GLU H 3.220 . 3.220 2.901 2.133 3.551 0.331 11 0 "[ . 1 . 2]" 1 1740 2 73 LEU HA 2 74 GLU QB 5.340 . 5.340 4.637 4.109 5.618 0.278 14 0 "[ . 1 . 2]" 1 1741 2 73 LEU QB 2 73 LEU QD 2.700 . 2.700 1.949 1.915 2.027 . 0 0 "[ . 1 . 2]" 1 1742 2 73 LEU QB 2 74 GLU H 4.120 . 4.120 3.024 1.722 4.043 0.078 3 0 "[ . 1 . 2]" 1 1743 2 73 LEU QB 2 74 GLU QG 5.100 . 5.100 4.388 3.269 5.290 0.190 4 0 "[ . 1 . 2]" 1 1744 2 73 LEU QD 2 74 GLU H 4.670 . 4.670 3.421 1.936 4.466 . 0 0 "[ . 1 . 2]" 1 1745 2 73 LEU QD 2 75 HIS H 5.800 . 5.800 4.075 1.726 6.020 0.220 1 0 "[ . 1 . 2]" 1 1746 2 73 LEU QD 2 75 HIS QB 5.730 . 5.730 4.308 2.165 6.016 0.286 19 0 "[ . 1 . 2]" 1 1747 2 73 LEU HG 2 74 GLU H 4.460 . 4.460 3.884 2.030 4.920 0.460 19 0 "[ . 1 . 2]" 1 1748 2 74 GLU H 2 74 GLU QB 3.190 . 3.190 2.831 2.392 3.407 0.217 16 0 "[ . 1 . 2]" 1 1749 2 74 GLU H 2 74 GLU QG 3.710 . 3.710 2.528 1.774 3.182 0.026 19 0 "[ . 1 . 2]" 1 1750 2 74 GLU HA 2 74 GLU HG2 4.110 . 4.110 2.796 2.419 3.782 . 0 0 "[ . 1 . 2]" 1 1751 2 74 GLU HA 2 74 GLU QG 3.530 . 3.530 2.653 2.341 3.343 . 0 0 "[ . 1 . 2]" 1 1752 2 74 GLU HA 2 74 GLU HG3 4.110 . 4.110 3.377 2.942 3.741 . 0 0 "[ . 1 . 2]" 1 1753 2 74 GLU HA 2 75 HIS H 3.370 . 3.370 2.960 2.230 3.555 0.185 17 0 "[ . 1 . 2]" 1 1754 2 74 GLU QB 2 75 HIS HA 5.810 . 5.810 4.443 3.718 5.158 . 0 0 "[ . 1 . 2]" 1 stop_ save_
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