NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
604862 | 2n04 | 25514 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2n04 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 2848 _Distance_constraint_stats_list.Viol_count 5279 _Distance_constraint_stats_list.Viol_total 9082.288 _Distance_constraint_stats_list.Viol_max 1.058 _Distance_constraint_stats_list.Viol_rms 0.0392 _Distance_constraint_stats_list.Viol_average_all_restraints 0.0080 _Distance_constraint_stats_list.Viol_average_violations_only 0.0860 _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 6 MET 0.000 0.000 . 0 "[ . 1 . 2]" 1 7 ALA 0.424 0.086 8 0 "[ . 1 . 2]" 1 8 ASP 4.409 0.243 11 0 "[ . 1 . 2]" 1 9 GLN 1.435 0.243 11 0 "[ . 1 . 2]" 1 10 ARG 10.888 0.941 12 4 "[ -. 1 + * *]" 1 11 GLN 9.953 0.507 1 1 "[+ . 1 . 2]" 1 12 ARG 4.439 0.270 12 0 "[ . 1 . 2]" 1 13 SER 11.736 0.447 8 0 "[ . 1 . 2]" 1 14 LEU 6.208 0.317 15 0 "[ . 1 . 2]" 1 16 THR 0.504 0.116 9 0 "[ . 1 . 2]" 1 17 SER 2.058 0.147 18 0 "[ . 1 . 2]" 1 18 GLY 4.211 0.158 17 0 "[ . 1 . 2]" 1 19 GLU 4.908 0.245 11 0 "[ . 1 . 2]" 1 20 SER 4.829 0.435 16 0 "[ . 1 . 2]" 1 21 LEU 9.186 0.276 2 0 "[ . 1 . 2]" 1 22 TYR 2.741 0.123 10 0 "[ . 1 . 2]" 1 23 HIS 9.047 0.435 16 0 "[ . 1 . 2]" 1 24 VAL 12.765 0.352 8 0 "[ . 1 . 2]" 1 25 LEU 15.992 0.352 8 0 "[ . 1 . 2]" 1 26 GLY 0.853 0.071 3 0 "[ . 1 . 2]" 1 27 LEU 16.221 0.252 8 0 "[ . 1 . 2]" 1 28 ASP 14.766 0.962 19 3 "[ - . 1 . +*]" 1 29 LYS 17.824 0.962 19 3 "[ * . 1 . +-]" 1 30 ASN 8.950 0.368 4 0 "[ . 1 . 2]" 1 31 ALA 16.556 0.265 13 0 "[ . 1 . 2]" 1 32 THR 9.081 0.164 9 0 "[ . 1 . 2]" 1 33 SER 5.242 0.215 15 0 "[ . 1 . 2]" 1 34 ASP 4.454 0.215 15 0 "[ . 1 . 2]" 1 35 ASP 17.121 0.265 13 0 "[ . 1 . 2]" 1 36 ILE 18.615 0.597 14 3 "[ - 1 *+. 2]" 1 37 LYS 7.619 0.215 15 0 "[ . 1 . 2]" 1 38 LYS 6.938 0.321 1 0 "[ . 1 . 2]" 1 39 SER 3.215 0.117 12 0 "[ . 1 . 2]" 1 40 TYR 4.859 0.321 1 0 "[ . 1 . 2]" 1 41 ARG 20.732 0.321 1 0 "[ . 1 . 2]" 1 42 LYS 3.554 0.147 10 0 "[ . 1 . 2]" 1 43 LEU 23.535 0.374 7 0 "[ . 1 . 2]" 1 44 ALA 17.594 0.414 8 0 "[ . 1 . 2]" 1 45 LEU 8.597 0.282 14 0 "[ . 1 . 2]" 1 46 LYS 23.746 0.711 2 2 "[ + -. 1 . 2]" 1 47 TYR 19.714 0.476 3 0 "[ . 1 . 2]" 1 48 HIS 2.304 0.157 19 0 "[ . 1 . 2]" 1 49 PRO 6.403 0.156 20 0 "[ . 1 . 2]" 1 50 ASP 1.708 0.156 20 0 "[ . 1 . 2]" 1 51 LYS 12.738 0.515 13 1 "[ . 1 + . 2]" 1 52 ASN 17.002 0.515 13 1 "[ . 1 + . 2]" 1 53 PRO 8.030 0.152 20 0 "[ . 1 . 2]" 1 54 ASP 16.194 0.433 2 0 "[ . 1 . 2]" 1 55 ASN 5.745 0.398 16 0 "[ . 1 . 2]" 1 56 PRO 4.774 0.198 10 0 "[ . 1 . 2]" 1 57 GLU 13.326 0.889 4 3 "[ +. * 1 .- 2]" 1 58 ALA 8.258 0.515 13 1 "[ . 1 + . 2]" 1 59 ALA 5.465 0.176 17 0 "[ . 1 . 2]" 1 60 ASP 4.340 0.164 6 0 "[ . 1 . 2]" 1 61 LYS 10.585 0.513 13 1 "[ . 1 + . 2]" 1 62 PHE 8.133 0.203 6 0 "[ . 1 . 2]" 1 63 LYS 10.669 0.203 6 0 "[ . 1 . 2]" 1 64 GLU 5.693 0.143 5 0 "[ . 1 . 2]" 1 65 ILE 21.540 0.414 8 0 "[ . 1 . 2]" 1 66 ASN 9.993 0.414 8 0 "[ . 1 . 2]" 1 67 ASN 16.956 0.414 8 0 "[ . 1 . 2]" 1 68 ALA 10.780 0.222 5 0 "[ . 1 . 2]" 1 69 HIS 1.808 0.195 4 0 "[ . 1 . 2]" 1 70 ALA 1.710 0.195 4 0 "[ . 1 . 2]" 1 71 ILE 18.108 0.267 12 0 "[ . 1 . 2]" 1 72 LEU 14.109 0.593 19 3 "[ - . 1 . +*]" 1 73 THR 3.075 0.126 3 0 "[ . 1 . 2]" 1 74 ASP 1.486 0.092 10 0 "[ . 1 . 2]" 1 75 ALA 3.832 0.163 4 0 "[ . 1 . 2]" 1 76 THR 5.818 0.106 15 0 "[ . 1 . 2]" 1 77 LYS 14.764 0.211 7 0 "[ . 1 . 2]" 1 78 ARG 13.698 0.352 8 0 "[ . 1 . 2]" 1 79 ASN 13.137 0.203 19 0 "[ . 1 . 2]" 1 80 ILE 24.769 0.409 9 0 "[ . 1 . 2]" 1 81 TYR 2.912 0.276 2 0 "[ . 1 . 2]" 1 82 ASP 6.187 0.167 9 0 "[ . 1 . 2]" 1 83 LYS 9.339 0.457 6 0 "[ . 1 . 2]" 1 84 TYR 4.147 0.206 6 0 "[ . 1 . 2]" 1 85 GLY 3.565 0.158 17 0 "[ . 1 . 2]" 1 86 SER 3.594 0.319 18 0 "[ . 1 . 2]" 1 87 LEU 9.237 1.058 7 2 "[- . + 1 . 2]" 1 88 GLY 10.560 0.345 16 0 "[ . 1 . 2]" 1 89 LEU 30.282 0.632 6 3 "[ -.+ 1 * . 2]" 1 90 TYR 10.258 0.679 6 3 "[ -.+ 1 * . 2]" 1 91 VAL 5.709 1.058 7 1 "[ . + 1 . 2]" 1 92 ALA 6.336 0.913 9 3 "[ .- +1* . 2]" 1 93 GLU 19.670 0.976 4 3 "[ +.* 1 * . 2]" 1 94 GLN 6.939 0.602 4 1 "[ +. 1 . 2]" 1 95 PHE 1.151 0.085 1 0 "[ . 1 . 2]" 1 96 GLY 2.088 0.185 9 0 "[ . 1 . 2]" 1 97 GLU 12.719 0.913 9 3 "[ .- +1* . 2]" 1 98 GLU 9.324 0.312 6 0 "[ . 1 . 2]" 1 99 ASN 13.338 0.312 6 0 "[ . 1 . 2]" 1 100 VAL 6.883 0.316 8 0 "[ . 1 . 2]" 1 101 ASN 15.148 0.412 12 0 "[ . 1 . 2]" 1 102 THR 12.059 0.828 8 1 "[ . + 1 . 2]" 1 103 TYR 0.801 0.110 4 0 "[ . 1 . 2]" 1 104 PHE 0.179 0.054 19 0 "[ . 1 . 2]" 1 105 VAL 3.105 0.433 5 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 6 MET HA 1 6 MET QB 2.319 . 2.991 2.341 2.163 2.459 . 0 0 "[ . 1 . 2]" 1 2 1 6 MET HA 1 6 MET QG 2.850 . 3.865 2.718 2.354 3.422 . 0 0 "[ . 1 . 2]" 1 3 1 7 ALA HA 1 7 ALA MB 2.038 . 2.557 2.130 2.126 2.140 . 0 0 "[ . 1 . 2]" 1 4 1 7 ALA HA 1 8 ASP H 2.022 . 2.533 2.310 2.108 2.614 0.081 2 0 "[ . 1 . 2]" 1 5 1 7 ALA MB 1 8 ASP H 2.465 . 3.224 2.714 1.991 3.310 0.086 8 0 "[ . 1 . 2]" 1 6 1 7 ALA MB 1 9 GLN H 4.025 . 6.050 5.507 5.346 5.846 . 0 0 "[ . 1 . 2]" 1 7 1 7 ALA MB 1 11 GLN HA 3.316 . 7.500 5.563 2.934 7.571 0.071 9 0 "[ . 1 . 2]" 1 8 1 8 ASP H 1 8 ASP HA 2.543 . 3.351 2.862 2.744 2.936 . 0 0 "[ . 1 . 2]" 1 9 1 8 ASP H 1 8 ASP QB 2.240 . 2.867 2.406 2.192 2.767 . 0 0 "[ . 1 . 2]" 1 10 1 8 ASP H 1 8 ASP HB2 2.395 . 3.112 2.386 2.080 2.687 . 0 0 "[ . 1 . 2]" 1 11 1 8 ASP H 1 8 ASP HB3 2.328 . 3.005 2.569 2.333 2.774 . 0 0 "[ . 1 . 2]" 1 12 1 8 ASP HA 1 8 ASP HB2 2.174 . 2.765 2.568 2.402 3.007 0.242 3 0 "[ . 1 . 2]" 1 13 1 8 ASP HA 1 8 ASP QB 1.943 . 2.415 2.325 2.174 2.476 0.061 4 0 "[ . 1 . 2]" 1 14 1 8 ASP HA 1 8 ASP HB3 2.215 . 2.828 2.754 2.445 3.006 0.178 1 0 "[ . 1 . 2]" 1 15 1 8 ASP HA 1 9 GLN H 1.923 . 2.385 2.325 2.170 2.555 0.170 16 0 "[ . 1 . 2]" 1 16 1 8 ASP HA 1 9 GLN QB 3.225 . 4.525 4.312 4.148 4.426 . 0 0 "[ . 1 . 2]" 1 17 1 8 ASP HA 1 9 GLN QG 3.022 . 4.164 3.888 3.497 4.209 0.045 1 0 "[ . 1 . 2]" 1 18 1 8 ASP QB 1 9 GLN H 2.492 . 3.268 2.933 2.215 3.511 0.243 11 0 "[ . 1 . 2]" 1 19 1 8 ASP QB 1 10 ARG H 3.850 . 5.703 2.848 2.079 3.722 . 0 0 "[ . 1 . 2]" 1 20 1 9 GLN H 1 9 GLN HA 2.487 . 3.260 2.879 2.790 2.940 . 0 0 "[ . 1 . 2]" 1 21 1 9 GLN H 1 9 GLN HA 1.962 . 7.500 2.713 2.670 2.798 . 0 0 "[ . 1 . 2]" 1 22 1 9 GLN H 1 9 GLN QB 2.611 . 3.067 2.542 2.237 2.940 . 0 0 "[ . 1 . 2]" 1 23 1 9 GLN H 1 9 GLN QB 2.564 . 3.386 2.489 2.213 2.805 . 0 0 "[ . 1 . 2]" 1 24 1 9 GLN H 1 9 GLN QG 2.439 . 3.183 2.201 1.772 2.870 . 0 0 "[ . 1 . 2]" 1 25 1 9 GLN H 1 10 ARG QG 4.183 . 6.370 4.352 3.012 5.120 . 0 0 "[ . 1 . 2]" 1 26 1 9 GLN HA 1 9 GLN QB 2.234 . 2.706 2.241 2.160 2.449 . 0 0 "[ . 1 . 2]" 1 27 1 9 GLN HA 1 9 GLN QB 2.087 . 2.631 2.020 1.920 2.126 . 0 0 "[ . 1 . 2]" 1 28 1 9 GLN HA 1 9 GLN QG 2.207 . 7.500 3.118 2.360 3.420 . 0 0 "[ . 1 . 2]" 1 29 1 9 GLN HA 1 10 ARG H 2.018 . 7.500 2.706 2.626 2.779 . 0 0 "[ . 1 . 2]" 1 30 1 9 GLN QB 1 9 GLN QG 2.095 . 2.644 2.066 1.987 2.085 . 0 0 "[ . 1 . 2]" 1 31 1 9 GLN QB 1 9 GLN QG 1.858 . 2.290 1.990 1.912 2.017 . 0 0 "[ . 1 . 2]" 1 32 1 9 GLN QB 1 10 ARG H 3.014 . 4.150 3.594 3.240 3.855 . 0 0 "[ . 1 . 2]" 1 33 1 9 GLN HE21 1 9 GLN QG 2.541 . 3.348 2.314 2.153 2.794 . 0 0 "[ . 1 . 2]" 1 34 1 9 GLN QG 1 10 ARG H 3.332 . 4.720 3.225 2.309 4.674 . 0 0 "[ . 1 . 2]" 1 35 1 10 ARG H 1 10 ARG HA 1.894 . 7.500 2.721 2.625 2.797 . 0 0 "[ . 1 . 2]" 1 36 1 10 ARG H 1 10 ARG HB2 2.144 . 2.719 2.275 2.071 2.549 . 0 0 "[ . 1 . 2]" 1 37 1 10 ARG H 1 10 ARG HB3 2.307 . 2.972 3.115 2.900 3.327 0.355 11 0 "[ . 1 . 2]" 1 38 1 10 ARG H 1 10 ARG QD 2.752 . 7.500 3.759 1.718 4.574 0.082 9 0 "[ . 1 . 2]" 1 39 1 10 ARG H 1 10 ARG QG 2.307 . 2.972 2.870 1.979 3.234 0.262 16 0 "[ . 1 . 2]" 1 40 1 10 ARG HA 1 10 ARG HB2 2.243 . 7.500 2.983 2.939 3.020 . 0 0 "[ . 1 . 2]" 1 41 1 10 ARG HA 1 10 ARG QB 1.990 . 2.485 2.439 2.333 2.495 0.010 15 0 "[ . 1 . 2]" 1 42 1 10 ARG HA 1 10 ARG HB3 2.220 . 2.836 2.591 2.429 2.698 . 0 0 "[ . 1 . 2]" 1 43 1 10 ARG HA 1 10 ARG HD2 2.266 . 2.908 2.909 1.815 3.849 0.941 12 4 "[ -. 1 + * *]" 1 44 1 10 ARG HA 1 10 ARG QG 2.034 . 2.551 2.577 2.344 2.764 0.213 4 0 "[ . 1 . 2]" 1 45 1 10 ARG QB 1 10 ARG HG2 1.554 . 1.856 1.757 1.753 1.762 . 0 0 "[ . 1 . 2]" 1 46 1 10 ARG HB3 1 10 ARG QD 1.899 . 2.350 2.262 2.039 2.529 0.179 14 0 "[ . 1 . 2]" 1 47 1 10 ARG QD 1 10 ARG HG3 1.659 . 2.003 1.891 1.839 1.964 . 0 0 "[ . 1 . 2]" 1 48 1 11 GLN H 1 11 GLN HA 1.991 . 2.486 2.400 2.236 2.854 0.368 2 0 "[ . 1 . 2]" 1 49 1 11 GLN H 1 11 GLN HB3 2.505 . 7.500 3.949 3.543 4.125 . 0 0 "[ . 1 . 2]" 1 50 1 11 GLN H 1 11 GLN QG 2.381 . 3.089 2.737 1.822 3.230 0.141 11 0 "[ . 1 . 2]" 1 51 1 11 GLN HA 1 11 GLN QB 2.169 . 2.757 2.337 2.263 2.417 . 0 0 "[ . 1 . 2]" 1 52 1 11 GLN HA 1 11 GLN HB3 2.170 . 2.759 2.438 2.344 2.546 . 0 0 "[ . 1 . 2]" 1 53 1 11 GLN HA 1 11 GLN QG 2.156 . 3.037 2.656 2.190 3.096 0.059 9 0 "[ . 1 . 2]" 1 54 1 11 GLN HA 1 12 ARG H 1.939 . 2.409 2.170 2.064 2.443 0.034 3 0 "[ . 1 . 2]" 1 55 1 11 GLN HA 1 12 ARG QG 2.731 . 3.663 3.404 2.996 3.704 0.041 10 0 "[ . 1 . 2]" 1 56 1 11 GLN HA 1 14 LEU QD 3.184 . 7.500 4.812 4.306 5.246 . 0 0 "[ . 1 . 2]" 1 57 1 11 GLN HA 1 87 LEU QD 3.281 . 4.626 2.192 1.429 2.856 0.507 1 1 "[+ . 1 . 2]" 1 58 1 11 GLN QB 1 11 GLN HG2 2.043 . 2.565 2.106 2.082 2.122 . 0 0 "[ . 1 . 2]" 1 59 1 11 GLN HB2 1 16 THR MG 2.319 . 2.991 2.354 2.059 2.666 . 0 0 "[ . 1 . 2]" 1 60 1 11 GLN HB3 1 12 ARG H 2.695 . 3.603 3.327 2.391 3.794 0.191 1 0 "[ . 1 . 2]" 1 61 1 11 GLN HB3 1 14 LEU QD 3.038 . 4.191 3.389 2.906 4.142 . 0 0 "[ . 1 . 2]" 1 62 1 11 GLN HB3 1 86 SER H 3.901 . 5.803 5.060 4.878 5.342 . 0 0 "[ . 1 . 2]" 1 63 1 11 GLN HB3 1 88 GLY H 3.206 . 4.491 4.361 4.062 4.560 0.069 15 0 "[ . 1 . 2]" 1 64 1 11 GLN HE21 1 11 GLN QG 2.318 . 2.990 2.171 2.123 2.291 . 0 0 "[ . 1 . 2]" 1 65 1 11 GLN HE21 1 84 TYR H 4.119 . 6.240 5.477 4.732 6.201 . 0 0 "[ . 1 . 2]" 1 66 1 11 GLN HE22 1 11 GLN QG 2.637 . 3.506 3.215 3.189 3.324 . 0 0 "[ . 1 . 2]" 1 67 1 11 GLN HE22 1 83 LYS H 3.231 . 7.500 7.232 5.888 7.670 0.170 10 0 "[ . 1 . 2]" 1 68 1 11 GLN HE22 1 84 TYR H 2.812 . 7.500 5.469 4.353 6.005 . 0 0 "[ . 1 . 2]" 1 69 1 11 GLN HE22 1 85 GLY H 3.395 . 4.836 3.799 2.282 4.894 0.058 17 0 "[ . 1 . 2]" 1 70 1 11 GLN HE22 1 88 GLY H 3.390 . 7.500 4.760 3.288 5.869 . 0 0 "[ . 1 . 2]" 1 71 1 11 GLN QG 1 12 ARG H 2.698 . 7.500 4.345 3.761 4.820 . 0 0 "[ . 1 . 2]" 1 72 1 11 GLN QG 1 12 ARG QG 3.086 . 7.500 5.313 4.681 5.969 . 0 0 "[ . 1 . 2]" 1 73 1 11 GLN QG 1 13 SER H 3.514 . 5.057 4.941 4.502 5.187 0.130 1 0 "[ . 1 . 2]" 1 74 1 11 GLN QG 1 14 LEU QD 2.972 . 4.705 3.666 2.798 4.377 . 0 0 "[ . 1 . 2]" 1 75 1 11 GLN QG 1 83 LYS H 3.810 . 7.500 6.865 6.476 7.146 . 0 0 "[ . 1 . 2]" 1 76 1 11 GLN QG 1 84 TYR H 3.046 . 7.500 6.554 5.853 7.260 . 0 0 "[ . 1 . 2]" 1 77 1 11 GLN QG 1 84 TYR HA 2.745 . 7.500 4.130 3.465 4.837 . 0 0 "[ . 1 . 2]" 1 78 1 11 GLN QG 1 85 GLY H 3.622 . 5.261 3.941 3.332 4.882 . 0 0 "[ . 1 . 2]" 1 79 1 11 GLN QG 1 87 LEU QD 3.151 . 3.852 2.429 1.758 2.994 0.152 11 0 "[ . 1 . 2]" 1 80 1 11 GLN QG 1 88 GLY H 3.132 . 4.358 3.483 2.965 3.884 . 0 0 "[ . 1 . 2]" 1 81 1 11 GLN QG 1 88 GLY HA2 3.240 . 7.500 5.356 4.615 6.070 . 0 0 "[ . 1 . 2]" 1 82 1 11 GLN QG 1 88 GLY HA3 3.171 . 7.500 5.108 4.471 5.816 . 0 0 "[ . 1 . 2]" 1 83 1 11 GLN QG 1 89 LEU H 3.847 . 5.697 5.477 5.149 5.568 . 0 0 "[ . 1 . 2]" 1 84 1 11 GLN QG 1 91 VAL QG 3.339 . 7.500 5.767 5.150 6.354 . 0 0 "[ . 1 . 2]" 1 85 1 12 ARG H 1 12 ARG HA 2.265 . 2.907 2.904 2.839 2.938 0.031 16 0 "[ . 1 . 2]" 1 86 1 12 ARG H 1 12 ARG HB2 2.431 . 7.500 3.616 3.533 3.715 . 0 0 "[ . 1 . 2]" 1 87 1 12 ARG H 1 12 ARG QB 2.156 . 7.500 2.911 2.718 3.155 . 0 0 "[ . 1 . 2]" 1 88 1 12 ARG H 1 12 ARG HB3 2.429 . 3.166 3.079 2.820 3.436 0.270 12 0 "[ . 1 . 2]" 1 89 1 12 ARG H 1 12 ARG QD 3.343 . 4.740 2.742 1.954 3.262 . 0 0 "[ . 1 . 2]" 1 90 1 12 ARG H 1 12 ARG HG3 2.263 . 2.903 1.847 1.598 2.329 0.025 6 0 "[ . 1 . 2]" 1 91 1 12 ARG H 1 13 SER H 2.738 . 3.675 2.384 1.857 2.786 . 0 0 "[ . 1 . 2]" 1 92 1 12 ARG HA 1 12 ARG HB2 2.217 . 2.831 2.568 2.511 2.629 . 0 0 "[ . 1 . 2]" 1 93 1 12 ARG HA 1 12 ARG QB 2.019 . 2.528 2.159 2.143 2.169 . 0 0 "[ . 1 . 2]" 1 94 1 12 ARG HA 1 12 ARG HB3 2.188 . 2.787 2.324 2.273 2.371 . 0 0 "[ . 1 . 2]" 1 95 1 12 ARG HA 1 12 ARG QD 2.397 . 7.500 3.743 3.603 3.875 . 0 0 "[ . 1 . 2]" 1 96 1 12 ARG HA 1 12 ARG QG 2.109 . 7.500 3.405 3.365 3.469 . 0 0 "[ . 1 . 2]" 1 97 1 12 ARG HA 1 13 SER H 1.950 . 7.500 3.292 3.129 3.446 . 0 0 "[ . 1 . 2]" 1 98 1 12 ARG HA 1 14 LEU H 3.162 . 7.500 5.586 4.084 6.119 . 0 0 "[ . 1 . 2]" 1 99 1 12 ARG HB2 1 13 SER H 2.501 . 7.500 4.161 4.004 4.320 . 0 0 "[ . 1 . 2]" 1 100 1 12 ARG HB3 1 13 SER H 2.712 . 7.500 4.511 4.343 4.570 . 0 0 "[ . 1 . 2]" 1 101 1 12 ARG QD 1 13 SER H 2.971 . 4.074 2.613 2.171 3.142 . 0 0 "[ . 1 . 2]" 1 102 1 12 ARG QD 1 13 SER HA 3.120 . 4.337 3.046 2.726 3.421 . 0 0 "[ . 1 . 2]" 1 103 1 12 ARG QD 1 14 LEU QD 2.531 . 7.500 4.585 4.337 5.180 . 0 0 "[ . 1 . 2]" 1 104 1 12 ARG QD 1 87 LEU QD 3.099 . 4.300 3.002 2.523 3.744 . 0 0 "[ . 1 . 2]" 1 105 1 12 ARG QD 1 87 LEU QD 2.612 . 3.465 2.937 2.510 3.332 . 0 0 "[ . 1 . 2]" 1 106 1 12 ARG QG 1 13 SER H 2.622 . 3.481 3.526 2.936 3.718 0.237 12 0 "[ . 1 . 2]" 1 107 1 13 SER H 1 13 SER HA 2.302 . 2.964 2.909 2.888 2.943 . 0 0 "[ . 1 . 2]" 1 108 1 13 SER H 1 13 SER HB2 2.323 . 2.998 2.811 2.169 3.439 0.441 12 0 "[ . 1 . 2]" 1 109 1 13 SER H 1 13 SER HB3 2.390 . 3.104 3.109 2.563 3.551 0.447 8 0 "[ . 1 . 2]" 1 110 1 13 SER H 1 14 LEU H 2.716 . 7.500 2.757 2.106 3.115 . 0 0 "[ . 1 . 2]" 1 111 1 13 SER H 1 14 LEU QD 3.879 . 5.760 3.351 3.172 3.666 . 0 0 "[ . 1 . 2]" 1 112 1 13 SER HA 1 13 SER QB 2.001 . 2.501 2.309 2.145 2.414 . 0 0 "[ . 1 . 2]" 1 113 1 13 SER HA 1 13 SER HB3 2.060 . 2.591 2.607 2.269 3.026 0.435 20 0 "[ . 1 . 2]" 1 114 1 13 SER HA 1 14 LEU H 1.966 . 7.500 3.524 3.403 3.587 . 0 0 "[ . 1 . 2]" 1 115 1 13 SER HA 1 14 LEU QD 2.846 . 4.224 4.005 3.749 4.236 0.012 15 0 "[ . 1 . 2]" 1 116 1 13 SER HB2 1 14 LEU H 2.699 . 3.610 2.624 1.768 3.428 0.020 1 0 "[ . 1 . 2]" 1 117 1 13 SER HB3 1 14 LEU H 2.548 . 3.360 2.775 1.775 3.654 0.294 19 0 "[ . 1 . 2]" 1 118 1 14 LEU H 1 14 LEU HA 2.754 . 3.702 2.911 2.879 2.928 . 0 0 "[ . 1 . 2]" 1 119 1 14 LEU H 1 14 LEU HB2 2.711 . 3.630 3.680 3.613 3.840 0.210 6 0 "[ . 1 . 2]" 1 120 1 14 LEU H 1 14 LEU HB3 2.950 . 4.038 3.115 2.919 3.448 . 0 0 "[ . 1 . 2]" 1 121 1 14 LEU H 1 14 LEU QD 2.561 . 3.101 1.694 1.563 2.937 0.178 7 0 "[ . 1 . 2]" 1 122 1 14 LEU H 1 14 LEU HG 2.364 . 7.500 3.712 1.944 4.091 . 0 0 "[ . 1 . 2]" 1 123 1 14 LEU H 1 87 LEU QD 3.079 . 4.264 2.986 2.633 3.671 . 0 0 "[ . 1 . 2]" 1 124 1 14 LEU HA 1 14 LEU HB2 2.683 . 3.583 2.524 2.490 2.556 . 0 0 "[ . 1 . 2]" 1 125 1 14 LEU HA 1 14 LEU HB3 2.706 . 3.621 2.349 2.340 2.363 . 0 0 "[ . 1 . 2]" 1 126 1 14 LEU HA 1 14 LEU QD 2.274 . 7.500 3.111 3.070 3.385 . 0 0 "[ . 1 . 2]" 1 127 1 14 LEU HA 1 14 LEU HG 2.720 . 7.500 4.244 3.479 4.288 . 0 0 "[ . 1 . 2]" 1 128 1 14 LEU HA 1 86 SER HB3 3.240 . 7.500 6.268 6.067 6.578 . 0 0 "[ . 1 . 2]" 1 129 1 14 LEU HB2 1 14 LEU QD 2.370 . 3.072 2.460 2.069 2.504 . 0 0 "[ . 1 . 2]" 1 130 1 14 LEU HB2 1 14 LEU HG 2.958 . 4.051 2.323 2.279 2.927 . 0 0 "[ . 1 . 2]" 1 131 1 14 LEU HB2 1 86 SER HB3 3.223 . 4.522 3.894 3.674 4.032 . 0 0 "[ . 1 . 2]" 1 132 1 14 LEU HB2 1 87 LEU H 3.449 . 7.500 5.540 5.244 5.719 . 0 0 "[ . 1 . 2]" 1 133 1 14 LEU HB2 1 87 LEU HA 3.155 . 7.500 5.321 4.962 5.452 . 0 0 "[ . 1 . 2]" 1 134 1 14 LEU HB2 1 87 LEU QD 2.994 . 7.500 5.213 4.935 5.638 . 0 0 "[ . 1 . 2]" 1 135 1 14 LEU HB3 1 14 LEU QD 2.797 . 3.775 2.165 2.105 2.191 . 0 0 "[ . 1 . 2]" 1 136 1 14 LEU HB3 1 14 LEU HG 2.870 . 3.899 2.590 2.558 2.696 . 0 0 "[ . 1 . 2]" 1 137 1 14 LEU HB3 1 86 SER HB3 3.424 . 4.890 4.908 4.618 5.207 0.317 15 0 "[ . 1 . 2]" 1 138 1 14 LEU HB3 1 87 LEU H 3.323 . 7.500 6.138 6.019 6.289 . 0 0 "[ . 1 . 2]" 1 139 1 14 LEU HB3 1 87 LEU HA 3.106 . 7.500 5.086 4.942 5.198 . 0 0 "[ . 1 . 2]" 1 140 1 14 LEU HB3 1 87 LEU QD 2.455 . 7.500 4.644 4.391 5.140 . 0 0 "[ . 1 . 2]" 1 141 1 14 LEU QD 1 14 LEU HG 2.122 . 2.685 1.887 1.877 1.889 . 0 0 "[ . 1 . 2]" 1 142 1 14 LEU QD 1 16 THR H 3.175 . 4.435 3.301 3.140 3.561 . 0 0 "[ . 1 . 2]" 1 143 1 14 LEU QD 1 16 THR MG 3.284 . 4.342 2.423 2.010 2.667 . 0 0 "[ . 1 . 2]" 1 144 1 14 LEU QD 1 89 LEU H 3.635 . 5.287 4.226 4.164 4.307 . 0 0 "[ . 1 . 2]" 1 145 1 14 LEU QD 1 90 TYR H 2.876 . 3.910 3.673 3.549 3.712 . 0 0 "[ . 1 . 2]" 1 146 1 14 LEU QD 1 86 SER H 3.249 . 4.568 3.542 3.361 3.662 . 0 0 "[ . 1 . 2]" 1 147 1 14 LEU QD 1 86 SER HA 3.228 . 4.530 3.752 3.581 3.869 . 0 0 "[ . 1 . 2]" 1 148 1 14 LEU QD 1 86 SER HB2 1.938 . 2.407 1.807 1.631 1.956 . 0 0 "[ . 1 . 2]" 1 149 1 14 LEU QD 1 86 SER HB3 2.380 . 3.088 2.762 2.417 2.950 . 0 0 "[ . 1 . 2]" 1 150 1 14 LEU QD 1 87 LEU H 3.038 . 4.192 1.920 1.842 2.024 0.042 12 0 "[ . 1 . 2]" 1 151 1 14 LEU QD 1 87 LEU HA 2.343 . 2.980 1.635 1.572 1.742 0.085 3 0 "[ . 1 . 2]" 1 152 1 14 LEU QD 1 87 LEU HB3 2.917 . 3.734 2.987 2.872 3.211 . 0 0 "[ . 1 . 2]" 1 153 1 14 LEU QD 1 87 LEU QD 2.071 . 2.607 2.015 1.804 2.461 . 0 0 "[ . 1 . 2]" 1 154 1 14 LEU QD 1 87 LEU HG 3.265 . 4.597 3.656 2.132 3.809 . 0 0 "[ . 1 . 2]" 1 155 1 14 LEU QD 1 88 GLY H 3.506 . 5.043 3.933 3.888 3.981 . 0 0 "[ . 1 . 2]" 1 156 1 14 LEU QD 1 88 GLY H 3.395 . 4.836 3.579 3.533 3.620 . 0 0 "[ . 1 . 2]" 1 157 1 14 LEU QD 1 90 TYR H 2.947 . 4.032 3.774 3.623 3.827 . 0 0 "[ . 1 . 2]" 1 158 1 14 LEU QD 1 90 TYR HB2 2.966 . 4.066 3.026 2.665 3.224 . 0 0 "[ . 1 . 2]" 1 159 1 14 LEU QD 1 90 TYR HB3 2.615 . 3.470 2.444 2.374 2.525 . 0 0 "[ . 1 . 2]" 1 160 1 14 LEU QD 1 90 TYR QD 2.525 . 3.322 2.864 2.726 3.042 . 0 0 "[ . 1 . 2]" 1 161 1 14 LEU QD 1 90 TYR QE 2.942 . 4.024 3.742 3.550 3.931 . 0 0 "[ . 1 . 2]" 1 162 1 14 LEU HG 1 87 LEU H 3.461 . 4.958 4.079 3.839 4.342 . 0 0 "[ . 1 . 2]" 1 163 1 14 LEU HG 1 87 LEU QD 3.025 . 7.500 4.143 2.850 4.677 . 0 0 "[ . 1 . 2]" 1 164 1 16 THR H 1 16 THR HA 2.935 . 4.012 2.865 2.845 2.901 . 0 0 "[ . 1 . 2]" 1 165 1 16 THR H 1 16 THR HB 3.247 . 4.565 3.427 3.212 3.568 . 0 0 "[ . 1 . 2]" 1 166 1 16 THR H 1 16 THR MG 2.489 . 3.263 3.062 2.668 3.379 0.116 9 0 "[ . 1 . 2]" 1 167 1 16 THR H 1 17 SER H 2.553 . 7.500 3.970 3.757 4.112 . 0 0 "[ . 1 . 2]" 1 168 1 16 THR H 1 17 SER HA 3.209 . 7.500 5.456 5.329 5.547 . 0 0 "[ . 1 . 2]" 1 169 1 16 THR H 1 17 SER QB 3.151 . 7.500 5.246 4.922 5.597 . 0 0 "[ . 1 . 2]" 1 170 1 16 THR H 1 18 GLY H 3.413 . 7.500 6.473 6.187 6.727 . 0 0 "[ . 1 . 2]" 1 171 1 16 THR H 1 87 LEU QD 4.086 . 6.173 5.715 5.495 5.836 . 0 0 "[ . 1 . 2]" 1 172 1 16 THR HA 1 16 THR HB 2.403 . 3.125 2.708 2.588 2.854 . 0 0 "[ . 1 . 2]" 1 173 1 16 THR HA 1 16 THR MG 2.137 . 2.708 2.127 2.097 2.165 . 0 0 "[ . 1 . 2]" 1 174 1 16 THR HA 1 17 SER H 3.044 . 4.202 2.268 2.208 2.368 . 0 0 "[ . 1 . 2]" 1 175 1 16 THR HA 1 18 GLY H 3.790 . 5.586 4.311 4.068 4.591 . 0 0 "[ . 1 . 2]" 1 176 1 16 THR HA 1 18 GLY HA3 3.620 . 7.500 5.833 5.676 6.116 . 0 0 "[ . 1 . 2]" 1 177 1 16 THR HA 1 85 GLY H 3.691 . 5.394 4.451 4.182 4.709 . 0 0 "[ . 1 . 2]" 1 178 1 16 THR HA 1 85 GLY HA2 3.342 . 4.738 4.637 4.448 4.811 0.073 8 0 "[ . 1 . 2]" 1 179 1 16 THR HA 1 85 GLY HA3 2.765 . 3.721 3.055 2.913 3.264 . 0 0 "[ . 1 . 2]" 1 180 1 16 THR HA 1 86 SER H 3.192 . 4.465 2.025 1.899 2.338 0.020 6 0 "[ . 1 . 2]" 1 181 1 16 THR HA 1 87 LEU H 3.018 . 4.156 3.150 2.882 3.447 . 0 0 "[ . 1 . 2]" 1 182 1 16 THR HB 1 16 THR MG 2.029 . 2.544 2.131 2.125 2.134 . 0 0 "[ . 1 . 2]" 1 183 1 16 THR HB 1 17 SER H 3.268 . 4.603 4.116 3.986 4.215 . 0 0 "[ . 1 . 2]" 1 184 1 16 THR HB 1 85 GLY HA3 3.323 . 4.704 2.960 2.512 3.513 . 0 0 "[ . 1 . 2]" 1 185 1 16 THR HB 1 87 LEU H 3.622 . 5.262 4.446 4.137 4.717 . 0 0 "[ . 1 . 2]" 1 186 1 16 THR HB 1 87 LEU QD 3.046 . 7.500 5.839 5.342 6.268 . 0 0 "[ . 1 . 2]" 1 187 1 16 THR MG 1 17 SER H 2.852 . 7.500 3.944 3.743 4.106 . 0 0 "[ . 1 . 2]" 1 188 1 16 THR MG 1 18 GLY H 3.309 . 7.500 4.601 3.999 5.069 . 0 0 "[ . 1 . 2]" 1 189 1 16 THR MG 1 19 GLU QG 3.314 . 7.500 6.989 6.490 7.198 . 0 0 "[ . 1 . 2]" 1 190 1 16 THR MG 1 85 GLY H 3.506 . 5.043 2.404 1.969 2.911 0.000 10 0 "[ . 1 . 2]" 1 191 1 16 THR MG 1 85 GLY HA2 3.029 . 4.176 3.628 3.204 4.201 0.025 16 0 "[ . 1 . 2]" 1 192 1 16 THR MG 1 85 GLY HA3 2.900 . 3.951 2.335 1.810 2.892 0.039 8 0 "[ . 1 . 2]" 1 193 1 16 THR MG 1 86 SER H 3.169 . 4.424 2.451 2.057 3.029 . 0 0 "[ . 1 . 2]" 1 194 1 16 THR MG 1 87 LEU H 2.536 . 3.340 1.856 1.709 2.101 0.023 20 0 "[ . 1 . 2]" 1 195 1 16 THR MG 1 87 LEU HA 2.609 . 7.500 3.986 3.702 4.264 . 0 0 "[ . 1 . 2]" 1 196 1 16 THR MG 1 87 LEU HB3 3.110 . 4.319 2.608 2.259 2.913 . 0 0 "[ . 1 . 2]" 1 197 1 16 THR MG 1 87 LEU QD 2.000 . 7.500 3.448 3.052 3.737 . 0 0 "[ . 1 . 2]" 1 198 1 16 THR MG 1 87 LEU HG 2.679 . 7.500 4.555 4.093 4.901 . 0 0 "[ . 1 . 2]" 1 199 1 16 THR MG 1 88 GLY H 2.901 . 3.953 3.327 2.940 3.644 . 0 0 "[ . 1 . 2]" 1 200 1 17 SER H 1 17 SER HA 2.513 . 3.302 2.922 2.908 2.937 . 0 0 "[ . 1 . 2]" 1 201 1 17 SER H 1 17 SER QB 2.591 . 3.430 2.951 2.660 3.211 . 0 0 "[ . 1 . 2]" 1 202 1 17 SER H 1 18 GLY H 2.685 . 3.586 3.459 3.387 3.590 0.004 9 0 "[ . 1 . 2]" 1 203 1 17 SER H 1 18 GLY HA2 3.389 . 4.824 4.366 4.241 4.498 . 0 0 "[ . 1 . 2]" 1 204 1 17 SER H 1 18 GLY HA3 3.437 . 7.500 5.064 4.917 5.206 . 0 0 "[ . 1 . 2]" 1 205 1 17 SER H 1 19 GLU H 3.470 . 4.975 4.975 4.811 5.064 0.089 10 0 "[ . 1 . 2]" 1 206 1 17 SER H 1 85 GLY HA2 3.542 . 5.110 5.158 4.959 5.257 0.147 18 0 "[ . 1 . 2]" 1 207 1 17 SER H 1 85 GLY HA3 3.286 . 4.635 3.897 3.705 4.072 . 0 0 "[ . 1 . 2]" 1 208 1 17 SER H 1 86 SER H 3.776 . 5.559 2.821 2.657 3.107 . 0 0 "[ . 1 . 2]" 1 209 1 17 SER HA 1 17 SER QB 2.034 . 2.551 2.252 2.178 2.357 . 0 0 "[ . 1 . 2]" 1 210 1 17 SER HA 1 18 GLY H 2.889 . 3.932 2.324 2.262 2.404 . 0 0 "[ . 1 . 2]" 1 211 1 17 SER HA 1 18 GLY HA2 3.270 . 4.606 4.524 4.481 4.558 . 0 0 "[ . 1 . 2]" 1 212 1 17 SER HA 1 18 GLY HA3 3.152 . 4.394 4.409 4.360 4.439 0.045 4 0 "[ . 1 . 2]" 1 213 1 17 SER HA 1 19 GLU H 3.403 . 4.850 3.072 2.965 3.159 . 0 0 "[ . 1 . 2]" 1 214 1 17 SER HA 1 19 GLU QG 3.390 . 4.493 2.924 2.778 3.045 . 0 0 "[ . 1 . 2]" 1 215 1 17 SER HA 1 85 GLY H 3.686 . 7.500 5.989 5.670 6.441 . 0 0 "[ . 1 . 2]" 1 216 1 17 SER QB 1 18 GLY H 3.005 . 7.500 3.852 3.783 3.931 . 0 0 "[ . 1 . 2]" 1 217 1 17 SER QB 1 18 GLY H 3.264 . 4.595 3.796 3.714 3.877 . 0 0 "[ . 1 . 2]" 1 218 1 17 SER QB 1 18 GLY HA2 3.426 . 7.500 4.723 4.534 4.890 . 0 0 "[ . 1 . 2]" 1 219 1 17 SER QB 1 19 GLU H 3.042 . 4.199 3.346 3.094 3.615 . 0 0 "[ . 1 . 2]" 1 220 1 17 SER QB 1 19 GLU HA 2.681 . 7.500 5.513 5.293 5.693 . 0 0 "[ . 1 . 2]" 1 221 1 17 SER QB 1 19 GLU QB 3.002 . 7.500 4.367 4.032 4.688 . 0 0 "[ . 1 . 2]" 1 222 1 17 SER QB 1 19 GLU QG 2.650 . 3.528 2.395 2.004 2.794 . 0 0 "[ . 1 . 2]" 1 223 1 18 GLY H 1 18 GLY HA2 2.916 . 3.979 2.845 2.809 2.883 . 0 0 "[ . 1 . 2]" 1 224 1 18 GLY H 1 18 GLY HA3 2.860 . 3.882 2.303 2.295 2.311 . 0 0 "[ . 1 . 2]" 1 225 1 18 GLY H 1 19 GLU H 2.987 . 4.102 2.594 2.488 2.707 . 0 0 "[ . 1 . 2]" 1 226 1 18 GLY H 1 19 GLU HA 3.420 . 7.500 5.038 4.805 5.184 . 0 0 "[ . 1 . 2]" 1 227 1 18 GLY H 1 19 GLU QB 4.075 . 6.151 4.666 4.515 4.770 . 0 0 "[ . 1 . 2]" 1 228 1 18 GLY H 1 20 SER H 3.568 . 5.159 4.454 4.234 4.759 . 0 0 "[ . 1 . 2]" 1 229 1 18 GLY H 1 21 LEU H 3.866 . 5.734 5.603 5.393 5.757 0.023 13 0 "[ . 1 . 2]" 1 230 1 18 GLY H 1 85 GLY H 3.348 . 4.749 4.830 4.784 4.907 0.158 17 0 "[ . 1 . 2]" 1 231 1 18 GLY H 1 85 GLY HA2 3.168 . 4.423 3.197 2.821 3.482 . 0 0 "[ . 1 . 2]" 1 232 1 18 GLY H 1 85 GLY HA3 3.213 . 4.504 2.840 2.700 2.967 . 0 0 "[ . 1 . 2]" 1 233 1 18 GLY H 1 86 SER H 3.381 . 4.810 3.568 3.082 3.950 . 0 0 "[ . 1 . 2]" 1 234 1 18 GLY HA2 1 19 GLU H 3.311 . 4.681 3.332 3.179 3.392 . 0 0 "[ . 1 . 2]" 1 235 1 18 GLY HA2 1 19 GLU HA 3.314 . 4.687 4.773 4.674 4.817 0.130 9 0 "[ . 1 . 2]" 1 236 1 18 GLY HA2 1 85 GLY H 3.262 . 7.500 6.562 6.396 6.725 . 0 0 "[ . 1 . 2]" 1 237 1 18 GLY HA2 1 85 GLY HA2 3.107 . 4.313 4.041 3.658 4.348 0.035 13 0 "[ . 1 . 2]" 1 238 1 18 GLY HA2 1 85 GLY HA3 3.174 . 4.434 4.439 4.270 4.500 0.066 13 0 "[ . 1 . 2]" 1 239 1 18 GLY HA2 1 86 SER H 3.682 . 5.376 4.111 3.655 4.675 . 0 0 "[ . 1 . 2]" 1 240 1 18 GLY HA3 1 19 GLU H 3.173 . 4.432 3.134 3.033 3.313 . 0 0 "[ . 1 . 2]" 1 241 1 18 GLY HA3 1 19 GLU HA 3.211 . 4.499 4.392 4.354 4.436 . 0 0 "[ . 1 . 2]" 1 242 1 18 GLY HA3 1 82 ASP HA 3.187 . 7.500 6.365 6.010 6.897 . 0 0 "[ . 1 . 2]" 1 243 1 18 GLY HA3 1 85 GLY H 3.309 . 7.500 5.629 5.449 5.838 . 0 0 "[ . 1 . 2]" 1 244 1 18 GLY HA3 1 85 GLY HA2 3.149 . 4.389 3.025 2.712 3.320 . 0 0 "[ . 1 . 2]" 1 245 1 18 GLY HA3 1 85 GLY HA3 3.162 . 4.411 3.824 3.662 4.001 . 0 0 "[ . 1 . 2]" 1 246 1 18 GLY HA3 1 86 SER H 3.576 . 5.175 4.356 3.825 4.734 . 0 0 "[ . 1 . 2]" 1 247 1 19 GLU H 1 19 GLU HA 2.844 . 3.855 2.816 2.783 2.911 . 0 0 "[ . 1 . 2]" 1 248 1 19 GLU H 1 19 GLU HB2 3.035 . 4.186 3.564 3.545 3.596 . 0 0 "[ . 1 . 2]" 1 249 1 19 GLU H 1 19 GLU QB 2.759 . 3.710 2.608 2.528 2.803 . 0 0 "[ . 1 . 2]" 1 250 1 19 GLU H 1 19 GLU HB3 3.035 . 4.187 2.684 2.587 2.937 . 0 0 "[ . 1 . 2]" 1 251 1 19 GLU H 1 19 GLU QG 2.942 . 4.024 1.860 1.755 1.997 0.160 18 0 "[ . 1 . 2]" 1 252 1 19 GLU H 1 20 SER H 2.755 . 3.704 2.594 2.119 2.728 . 0 0 "[ . 1 . 2]" 1 253 1 19 GLU H 1 20 SER HA 3.184 . 7.500 5.175 4.766 5.287 . 0 0 "[ . 1 . 2]" 1 254 1 19 GLU H 1 20 SER HB2 3.515 . 5.060 4.843 4.540 5.042 . 0 0 "[ . 1 . 2]" 1 255 1 19 GLU H 1 20 SER HB3 3.545 . 5.116 4.990 4.806 5.361 0.245 11 0 "[ . 1 . 2]" 1 256 1 19 GLU H 1 21 LEU H 3.895 . 5.792 4.122 3.737 4.234 . 0 0 "[ . 1 . 2]" 1 257 1 19 GLU H 1 85 GLY HA2 3.944 . 5.888 5.456 4.975 5.703 . 0 0 "[ . 1 . 2]" 1 258 1 19 GLU H 1 85 GLY HA3 3.730 . 5.469 5.419 5.185 5.521 0.052 15 0 "[ . 1 . 2]" 1 259 1 19 GLU HA 1 19 GLU HB2 2.826 . 3.824 2.520 2.462 2.609 . 0 0 "[ . 1 . 2]" 1 260 1 19 GLU HA 1 19 GLU HB3 2.818 . 3.810 2.385 2.301 2.430 . 0 0 "[ . 1 . 2]" 1 261 1 19 GLU HA 1 19 GLU QG 2.491 . 7.500 3.345 3.320 3.442 . 0 0 "[ . 1 . 2]" 1 262 1 19 GLU HA 1 20 SER H 2.916 . 3.979 3.417 3.319 3.472 . 0 0 "[ . 1 . 2]" 1 263 1 19 GLU HA 1 20 SER HA 2.842 . 7.500 4.660 4.618 4.702 . 0 0 "[ . 1 . 2]" 1 264 1 19 GLU HA 1 20 SER HB2 2.897 . 7.500 5.672 5.538 6.075 . 0 0 "[ . 1 . 2]" 1 265 1 19 GLU HA 1 20 SER HB3 2.951 . 7.500 5.903 5.736 6.297 . 0 0 "[ . 1 . 2]" 1 266 1 19 GLU HA 1 21 LEU MD1 2.874 . 7.500 4.957 4.690 5.269 . 0 0 "[ . 1 . 2]" 1 267 1 19 GLU HA 1 21 LEU MD2 2.996 . 7.500 4.567 4.138 4.823 . 0 0 "[ . 1 . 2]" 1 268 1 19 GLU HA 1 82 ASP HA 3.156 . 7.500 7.538 7.394 7.614 0.114 8 0 "[ . 1 . 2]" 1 269 1 19 GLU HB2 1 20 SER H 3.053 . 4.218 3.973 3.786 4.161 . 0 0 "[ . 1 . 2]" 1 270 1 19 GLU HB2 1 20 SER HA 3.250 . 4.571 4.479 4.337 4.605 0.034 16 0 "[ . 1 . 2]" 1 271 1 19 GLU HB3 1 20 SER H 3.288 . 4.639 4.238 4.138 4.373 . 0 0 "[ . 1 . 2]" 1 272 1 19 GLU QG 1 20 SER H 3.289 . 4.641 2.686 2.309 3.384 . 0 0 "[ . 1 . 2]" 1 273 1 20 SER H 1 20 SER HA 2.744 . 3.686 2.898 2.882 2.908 . 0 0 "[ . 1 . 2]" 1 274 1 20 SER H 1 20 SER HB2 2.969 . 4.071 2.675 2.493 2.942 . 0 0 "[ . 1 . 2]" 1 275 1 20 SER H 1 20 SER HB3 3.079 . 4.264 2.607 2.401 3.485 . 0 0 "[ . 1 . 2]" 1 276 1 20 SER H 1 21 LEU H 3.644 . 5.304 2.393 2.281 2.485 . 0 0 "[ . 1 . 2]" 1 277 1 20 SER H 1 21 LEU MD1 3.647 . 5.309 3.685 3.505 3.876 . 0 0 "[ . 1 . 2]" 1 278 1 20 SER H 1 23 HIS QB 3.672 . 5.357 5.326 5.232 5.417 0.060 11 0 "[ . 1 . 2]" 1 279 1 20 SER HA 1 20 SER HB2 2.634 . 3.501 2.516 2.414 2.943 . 0 0 "[ . 1 . 2]" 1 280 1 20 SER HA 1 21 LEU H 3.385 . 4.817 3.310 3.269 3.333 . 0 0 "[ . 1 . 2]" 1 281 1 20 SER HA 1 22 TYR H 3.363 . 4.777 4.366 4.118 4.502 . 0 0 "[ . 1 . 2]" 1 282 1 20 SER HA 1 23 HIS H 2.860 . 3.882 3.523 3.395 3.674 . 0 0 "[ . 1 . 2]" 1 283 1 20 SER HA 1 23 HIS HA 3.372 . 7.500 5.657 5.469 5.862 . 0 0 "[ . 1 . 2]" 1 284 1 20 SER HA 1 23 HIS QB 2.457 . 3.212 2.948 2.684 3.107 . 0 0 "[ . 1 . 2]" 1 285 1 20 SER HA 1 23 HIS HD2 3.347 . 7.500 6.301 5.491 6.698 . 0 0 "[ . 1 . 2]" 1 286 1 20 SER HB2 1 23 HIS QB 2.935 . 4.011 4.220 4.049 4.446 0.435 16 0 "[ . 1 . 2]" 1 287 1 20 SER HB3 1 23 HIS QB 3.176 . 4.437 4.242 3.398 4.462 0.025 20 0 "[ . 1 . 2]" 1 288 1 21 LEU H 1 21 LEU HB2 3.054 . 4.220 2.114 2.091 2.151 . 0 0 "[ . 1 . 2]" 1 289 1 21 LEU H 1 21 LEU HB3 3.262 . 4.592 3.432 3.408 3.469 . 0 0 "[ . 1 . 2]" 1 290 1 21 LEU H 1 21 LEU MD1 2.527 . 3.325 2.571 2.458 2.657 . 0 0 "[ . 1 . 2]" 1 291 1 21 LEU H 1 21 LEU MD2 2.758 . 3.709 3.487 3.360 3.596 . 0 0 "[ . 1 . 2]" 1 292 1 21 LEU H 1 21 LEU HG 2.942 . 7.500 4.310 4.267 4.335 . 0 0 "[ . 1 . 2]" 1 293 1 21 LEU H 1 22 TYR H 3.064 . 4.238 3.193 3.068 3.248 . 0 0 "[ . 1 . 2]" 1 294 1 21 LEU H 1 22 TYR HA 3.710 . 5.431 5.193 5.165 5.214 . 0 0 "[ . 1 . 2]" 1 295 1 21 LEU H 1 23 HIS H 3.614 . 5.247 4.215 4.052 4.353 . 0 0 "[ . 1 . 2]" 1 296 1 21 LEU H 1 24 VAL MG2 3.037 . 4.190 3.530 3.434 3.719 . 0 0 "[ . 1 . 2]" 1 297 1 21 LEU H 1 68 ALA MB 3.261 . 4.590 4.571 4.459 4.615 0.025 15 0 "[ . 1 . 2]" 1 298 1 21 LEU H 1 71 ILE MG 3.374 . 4.797 4.801 4.709 4.862 0.065 2 0 "[ . 1 . 2]" 1 299 1 21 LEU H 1 72 LEU QD 3.252 . 7.500 4.899 4.807 5.058 . 0 0 "[ . 1 . 2]" 1 300 1 21 LEU HA 1 21 LEU HB3 2.851 . 3.867 2.781 2.750 2.809 . 0 0 "[ . 1 . 2]" 1 301 1 21 LEU HA 1 21 LEU MD1 2.049 . 2.574 1.665 1.625 1.716 . 0 0 "[ . 1 . 2]" 1 302 1 21 LEU HA 1 21 LEU MD2 2.610 . 7.500 3.700 3.686 3.719 . 0 0 "[ . 1 . 2]" 1 303 1 21 LEU HA 1 22 TYR H 3.153 . 4.396 3.579 3.533 3.589 . 0 0 "[ . 1 . 2]" 1 304 1 21 LEU HA 1 24 VAL H 2.919 . 3.984 3.461 3.400 3.531 . 0 0 "[ . 1 . 2]" 1 305 1 21 LEU HA 1 24 VAL HB 2.862 . 3.886 2.755 2.635 2.843 . 0 0 "[ . 1 . 2]" 1 306 1 21 LEU HA 1 24 VAL MG1 2.443 . 7.500 3.803 3.707 3.941 . 0 0 "[ . 1 . 2]" 1 307 1 21 LEU HA 1 24 VAL MG2 2.146 . 2.722 2.340 2.196 2.445 . 0 0 "[ . 1 . 2]" 1 308 1 21 LEU HA 1 72 LEU QD 2.943 . 7.500 3.754 3.681 3.833 . 0 0 "[ . 1 . 2]" 1 309 1 21 LEU HA 1 68 ALA HA 2.941 . 4.022 4.063 3.943 4.127 0.105 2 0 "[ . 1 . 2]" 1 310 1 21 LEU HA 1 68 ALA MB 2.628 . 3.491 2.302 2.154 2.353 . 0 0 "[ . 1 . 2]" 1 311 1 21 LEU HA 1 72 LEU QD 2.879 . 3.915 3.805 3.726 3.891 . 0 0 "[ . 1 . 2]" 1 312 1 21 LEU HB2 1 21 LEU MD1 3.100 . 4.301 2.620 2.581 2.665 . 0 0 "[ . 1 . 2]" 1 313 1 21 LEU HB2 1 21 LEU MD1 2.115 . 2.674 2.304 2.230 2.362 . 0 0 "[ . 1 . 2]" 1 314 1 21 LEU HB2 1 21 LEU MD2 2.316 . 2.986 2.136 2.113 2.162 . 0 0 "[ . 1 . 2]" 1 315 1 21 LEU HB2 1 21 LEU HG 2.986 . 4.100 2.471 2.256 2.606 . 0 0 "[ . 1 . 2]" 1 316 1 21 LEU HB2 1 22 TYR H 3.129 . 4.353 2.832 2.704 2.900 . 0 0 "[ . 1 . 2]" 1 317 1 21 LEU HB2 1 72 LEU QD 2.633 . 7.500 3.240 3.148 3.335 . 0 0 "[ . 1 . 2]" 1 318 1 21 LEU HB2 1 68 ALA HA 3.394 . 4.834 4.854 4.682 4.903 0.069 10 0 "[ . 1 . 2]" 1 319 1 21 LEU HB2 1 72 LEU QD 2.847 . 3.860 3.297 3.193 3.400 . 0 0 "[ . 1 . 2]" 1 320 1 21 LEU HB2 1 72 LEU QD 3.435 . 4.910 3.551 3.390 3.783 . 0 0 "[ . 1 . 2]" 1 321 1 21 LEU HB3 1 21 LEU MD1 2.456 . 3.210 3.158 3.133 3.177 . 0 0 "[ . 1 . 2]" 1 322 1 21 LEU HB3 1 21 LEU MD2 2.431 . 3.170 2.563 2.520 2.614 . 0 0 "[ . 1 . 2]" 1 323 1 21 LEU HB3 1 22 TYR H 3.355 . 4.762 2.638 2.567 2.685 . 0 0 "[ . 1 . 2]" 1 324 1 21 LEU HB3 1 72 LEU HA 3.037 . 4.190 3.616 3.540 3.710 . 0 0 "[ . 1 . 2]" 1 325 1 21 LEU HB3 1 68 ALA HA 3.176 . 4.437 3.952 3.741 4.019 . 0 0 "[ . 1 . 2]" 1 326 1 21 LEU HB3 1 68 ALA MB 2.580 . 3.412 3.028 2.943 3.152 . 0 0 "[ . 1 . 2]" 1 327 1 21 LEU HB3 1 71 ILE MG 2.832 . 7.500 4.791 4.414 5.030 . 0 0 "[ . 1 . 2]" 1 328 1 21 LEU HB3 1 72 LEU QD 2.396 . 3.114 2.180 2.017 2.395 . 0 0 "[ . 1 . 2]" 1 329 1 21 LEU MD1 1 21 LEU MD2 1.937 . 2.406 2.082 2.072 2.087 . 0 0 "[ . 1 . 2]" 1 330 1 21 LEU MD1 1 21 LEU HG 2.049 . 2.574 2.127 2.124 2.129 . 0 0 "[ . 1 . 2]" 1 331 1 21 LEU MD1 1 22 TYR H 2.967 . 7.500 4.411 4.365 4.448 . 0 0 "[ . 1 . 2]" 1 332 1 21 LEU MD1 1 24 VAL H 3.551 . 5.127 4.658 4.604 4.705 . 0 0 "[ . 1 . 2]" 1 333 1 21 LEU MD1 1 24 VAL HB 2.667 . 3.556 3.623 3.575 3.668 0.112 19 0 "[ . 1 . 2]" 1 334 1 21 LEU MD1 1 24 VAL MG1 2.346 . 7.500 3.697 3.611 3.831 . 0 0 "[ . 1 . 2]" 1 335 1 21 LEU MD1 1 24 VAL MG2 2.262 . 2.902 2.556 2.421 2.650 . 0 0 "[ . 1 . 2]" 1 336 1 21 LEU MD1 1 64 GLU HA 3.286 . 4.635 4.611 4.384 4.705 0.070 12 0 "[ . 1 . 2]" 1 337 1 21 LEU MD1 1 67 ASN HA 3.174 . 7.500 4.788 4.264 4.964 . 0 0 "[ . 1 . 2]" 1 338 1 21 LEU MD1 1 67 ASN HB3 2.748 . 3.692 2.850 2.384 3.064 . 0 0 "[ . 1 . 2]" 1 339 1 21 LEU MD1 1 67 ASN HD21 2.260 . 2.898 1.803 1.578 2.918 0.044 15 0 "[ . 1 . 2]" 1 340 1 21 LEU MD1 1 67 ASN HD22 2.568 . 3.393 2.498 2.291 2.995 . 0 0 "[ . 1 . 2]" 1 341 1 21 LEU MD1 1 67 ASN HD22 2.599 . 3.444 2.305 2.219 2.435 . 0 0 "[ . 1 . 2]" 1 342 1 21 LEU MD1 1 68 ALA H 3.029 . 4.176 3.302 3.068 3.405 . 0 0 "[ . 1 . 2]" 1 343 1 21 LEU MD1 1 68 ALA HA 2.192 . 2.793 2.856 2.821 2.928 0.135 15 0 "[ . 1 . 2]" 1 344 1 21 LEU MD1 1 68 ALA MB 2.039 . 2.559 2.252 2.192 2.334 . 0 0 "[ . 1 . 2]" 1 345 1 21 LEU MD1 1 69 HIS H 3.100 . 7.500 5.113 4.916 5.205 . 0 0 "[ . 1 . 2]" 1 346 1 21 LEU MD1 1 69 HIS H 4.075 . 6.151 4.080 4.002 4.161 . 0 0 "[ . 1 . 2]" 1 347 1 21 LEU MD1 1 71 ILE H 3.255 . 7.500 5.428 5.302 5.512 . 0 0 "[ . 1 . 2]" 1 348 1 21 LEU MD1 1 71 ILE MG 2.684 . 3.585 3.478 3.411 3.565 . 0 0 "[ . 1 . 2]" 1 349 1 21 LEU MD1 1 72 LEU QD 3.066 . 4.241 3.845 3.755 3.952 . 0 0 "[ . 1 . 2]" 1 350 1 21 LEU MD2 1 21 LEU HG 2.152 . 2.731 2.121 2.116 2.125 . 0 0 "[ . 1 . 2]" 1 351 1 21 LEU MD2 1 22 TYR H 3.154 . 4.397 4.413 4.332 4.445 0.048 10 0 "[ . 1 . 2]" 1 352 1 21 LEU MD2 1 24 VAL MG2 2.902 . 7.500 4.844 4.721 4.925 . 0 0 "[ . 1 . 2]" 1 353 1 21 LEU MD2 1 67 ASN HD21 2.781 . 3.748 2.969 2.760 3.475 . 0 0 "[ . 1 . 2]" 1 354 1 21 LEU MD2 1 67 ASN HD22 2.845 . 3.857 2.876 2.608 3.034 . 0 0 "[ . 1 . 2]" 1 355 1 21 LEU MD2 1 68 ALA H 3.539 . 5.104 4.924 4.736 5.014 . 0 0 "[ . 1 . 2]" 1 356 1 21 LEU MD2 1 68 ALA HA 2.418 . 3.149 3.094 2.946 3.177 0.028 16 0 "[ . 1 . 2]" 1 357 1 21 LEU MD2 1 68 ALA MB 2.465 . 7.500 3.577 3.463 3.657 . 0 0 "[ . 1 . 2]" 1 358 1 21 LEU MD2 1 69 HIS H 4.019 . 6.038 4.460 4.349 4.568 . 0 0 "[ . 1 . 2]" 1 359 1 21 LEU MD2 1 71 ILE H 3.013 . 7.500 4.360 4.230 4.461 . 0 0 "[ . 1 . 2]" 1 360 1 21 LEU MD2 1 71 ILE H 3.183 . 4.449 3.746 3.649 3.829 . 0 0 "[ . 1 . 2]" 1 361 1 21 LEU MD2 1 71 ILE HA 3.275 . 4.615 4.369 4.307 4.427 . 0 0 "[ . 1 . 2]" 1 362 1 21 LEU MD2 1 71 ILE HA 3.170 . 4.426 3.226 3.079 3.418 . 0 0 "[ . 1 . 2]" 1 363 1 21 LEU MD2 1 71 ILE HB 2.989 . 4.106 2.083 1.967 2.256 . 0 0 "[ . 1 . 2]" 1 364 1 21 LEU MD2 1 71 ILE MD 2.129 . 7.500 3.134 2.917 3.261 . 0 0 "[ . 1 . 2]" 1 365 1 21 LEU MD2 1 71 ILE HG12 3.208 . 4.494 3.203 3.073 3.277 . 0 0 "[ . 1 . 2]" 1 366 1 21 LEU MD2 1 71 ILE HG13 3.268 . 4.603 1.886 1.828 1.920 0.105 13 0 "[ . 1 . 2]" 1 367 1 21 LEU MD2 1 71 ILE MG 2.212 . 2.823 2.067 1.894 2.265 . 0 0 "[ . 1 . 2]" 1 368 1 21 LEU MD2 1 72 LEU H 3.060 . 4.231 4.285 4.242 4.331 0.100 15 0 "[ . 1 . 2]" 1 369 1 21 LEU MD2 1 72 LEU H 2.779 . 3.745 2.429 2.267 2.529 . 0 0 "[ . 1 . 2]" 1 370 1 21 LEU MD2 1 77 LYS HB3 3.109 . 4.317 4.149 3.969 4.454 0.137 6 0 "[ . 1 . 2]" 1 371 1 21 LEU MD2 1 81 TYR HB3 3.126 . 4.347 4.144 3.810 4.623 0.276 2 0 "[ . 1 . 2]" 1 372 1 21 LEU MD2 1 89 LEU HB2 3.523 . 5.075 4.729 4.365 5.114 0.039 6 0 "[ . 1 . 2]" 1 373 1 21 LEU MD2 1 89 LEU MD1 2.344 . 3.031 2.208 1.962 2.606 . 0 0 "[ . 1 . 2]" 1 374 1 21 LEU HG 1 22 TYR H 3.344 . 4.741 4.764 4.708 4.795 0.054 3 0 "[ . 1 . 2]" 1 375 1 21 LEU HG 1 67 ASN HD21 3.111 . 4.321 2.924 2.787 3.105 . 0 0 "[ . 1 . 2]" 1 376 1 21 LEU HG 1 89 LEU MD1 2.643 . 3.516 3.156 3.083 3.361 . 0 0 "[ . 1 . 2]" 1 377 1 22 TYR H 1 22 TYR HA 2.713 . 3.633 2.807 2.784 2.827 . 0 0 "[ . 1 . 2]" 1 378 1 22 TYR H 1 22 TYR HB2 2.634 . 3.501 3.557 2.777 3.624 0.123 10 0 "[ . 1 . 2]" 1 379 1 22 TYR H 1 23 HIS H 2.600 . 3.445 2.668 2.572 2.753 . 0 0 "[ . 1 . 2]" 1 380 1 22 TYR H 1 23 HIS QB 2.918 . 7.500 4.452 4.359 4.656 . 0 0 "[ . 1 . 2]" 1 381 1 22 TYR H 1 24 VAL HB 3.881 . 5.764 5.025 4.921 5.132 . 0 0 "[ . 1 . 2]" 1 382 1 22 TYR H 1 25 LEU MD1 3.338 . 4.731 4.498 4.260 4.724 . 0 0 "[ . 1 . 2]" 1 383 1 22 TYR H 1 72 LEU QD 2.954 . 5.683 3.519 3.427 3.609 . 0 0 "[ . 1 . 2]" 1 384 1 22 TYR HA 1 22 TYR QB 2.509 . 3.296 2.178 2.155 2.263 . 0 0 "[ . 1 . 2]" 1 385 1 22 TYR HA 1 23 HIS H 2.910 . 3.969 3.465 3.407 3.513 . 0 0 "[ . 1 . 2]" 1 386 1 22 TYR HA 1 23 HIS HA 3.100 . 4.301 4.244 4.188 4.273 . 0 0 "[ . 1 . 2]" 1 387 1 22 TYR HA 1 25 LEU H 2.809 . 3.795 3.324 3.239 3.383 . 0 0 "[ . 1 . 2]" 1 388 1 22 TYR HA 1 25 LEU MD1 2.441 . 3.186 2.739 2.430 3.028 . 0 0 "[ . 1 . 2]" 1 389 1 22 TYR HA 1 27 LEU H 3.184 . 4.451 3.107 2.820 3.995 . 0 0 "[ . 1 . 2]" 1 390 1 22 TYR HA 1 72 LEU QD 2.333 . 3.013 2.668 2.461 2.792 . 0 0 "[ . 1 . 2]" 1 391 1 22 TYR HB2 1 23 HIS HB2 3.193 . 7.500 4.777 4.533 5.316 . 0 0 "[ . 1 . 2]" 1 392 1 22 TYR QB 1 23 HIS H 2.763 . 3.717 3.522 2.958 3.653 . 0 0 "[ . 1 . 2]" 1 393 1 22 TYR QB 1 23 HIS HA 3.147 . 7.500 4.320 4.011 4.591 . 0 0 "[ . 1 . 2]" 1 394 1 22 TYR QB 1 36 ILE MD 2.973 . 7.500 5.805 5.506 6.449 . 0 0 "[ . 1 . 2]" 1 395 1 22 TYR QB 1 72 LEU QD 3.306 . 4.099 3.170 3.011 3.409 . 0 0 "[ . 1 . 2]" 1 396 1 22 TYR HB2 1 23 HIS H 3.315 . 4.689 3.836 3.026 4.083 . 0 0 "[ . 1 . 2]" 1 397 1 23 HIS H 1 23 HIS HA 2.764 . 3.719 2.893 2.863 2.916 . 0 0 "[ . 1 . 2]" 1 398 1 23 HIS H 1 23 HIS HA 2.331 . 3.010 2.784 2.753 2.816 . 0 0 "[ . 1 . 2]" 1 399 1 23 HIS H 1 23 HIS QB 2.188 . 2.786 2.291 2.245 2.384 . 0 0 "[ . 1 . 2]" 1 400 1 23 HIS H 1 23 HIS HD2 3.642 . 5.300 5.031 3.548 5.312 0.012 7 0 "[ . 1 . 2]" 1 401 1 23 HIS H 1 24 VAL HB 3.537 . 5.100 4.351 4.217 4.482 . 0 0 "[ . 1 . 2]" 1 402 1 23 HIS H 1 24 VAL MG2 3.163 . 4.413 3.623 3.486 3.739 . 0 0 "[ . 1 . 2]" 1 403 1 23 HIS HA 1 23 HIS QB 2.181 . 2.776 2.394 2.340 2.450 . 0 0 "[ . 1 . 2]" 1 404 1 23 HIS HA 1 23 HIS HD2 2.649 . 3.526 3.208 2.408 3.588 0.062 3 0 "[ . 1 . 2]" 1 405 1 23 HIS HA 1 24 VAL H 2.550 . 3.363 3.403 3.372 3.433 0.070 8 0 "[ . 1 . 2]" 1 406 1 23 HIS HA 1 24 VAL HA 3.333 . 7.500 4.837 4.782 4.882 . 0 0 "[ . 1 . 2]" 1 407 1 23 HIS HA 1 24 VAL MG1 3.290 . 7.500 6.040 6.006 6.085 . 0 0 "[ . 1 . 2]" 1 408 1 23 HIS HA 1 24 VAL MG2 3.218 . 7.500 5.051 5.018 5.087 . 0 0 "[ . 1 . 2]" 1 409 1 23 HIS HA 1 25 LEU H 2.931 . 4.005 4.152 4.088 4.197 0.192 10 0 "[ . 1 . 2]" 1 410 1 23 HIS HA 1 25 LEU MD1 3.211 . 7.500 4.643 4.533 4.767 . 0 0 "[ . 1 . 2]" 1 411 1 23 HIS HA 1 26 GLY H 3.021 . 4.162 3.633 3.473 3.745 . 0 0 "[ . 1 . 2]" 1 412 1 23 HIS HA 1 26 GLY HA2 2.875 . 3.908 3.596 3.330 3.773 . 0 0 "[ . 1 . 2]" 1 413 1 23 HIS HA 1 27 LEU H 2.834 . 7.500 4.920 4.436 5.985 . 0 0 "[ . 1 . 2]" 1 414 1 23 HIS QB 1 23 HIS HD2 2.851 . 3.867 2.912 2.709 3.295 . 0 0 "[ . 1 . 2]" 1 415 1 23 HIS QB 1 24 VAL H 2.634 . 3.501 2.893 2.750 3.047 . 0 0 "[ . 1 . 2]" 1 416 1 23 HIS QB 1 24 VAL HA 2.924 . 3.993 4.000 3.859 4.063 0.070 17 0 "[ . 1 . 2]" 1 417 1 23 HIS QB 1 24 VAL HB 3.178 . 7.500 4.960 4.884 5.046 . 0 0 "[ . 1 . 2]" 1 418 1 23 HIS QB 1 24 VAL MG1 3.162 . 7.500 5.368 5.285 5.438 . 0 0 "[ . 1 . 2]" 1 419 1 23 HIS QB 1 24 VAL MG2 2.667 . 3.556 3.501 3.412 3.588 0.032 17 0 "[ . 1 . 2]" 1 420 1 23 HIS QB 1 26 GLY H 3.660 . 5.335 5.202 5.068 5.315 . 0 0 "[ . 1 . 2]" 1 421 1 24 VAL H 1 24 VAL HA 2.293 . 2.950 2.777 2.755 2.819 . 0 0 "[ . 1 . 2]" 1 422 1 24 VAL H 1 24 VAL HB 2.381 . 3.089 2.372 2.326 2.427 . 0 0 "[ . 1 . 2]" 1 423 1 24 VAL H 1 24 VAL MG1 2.567 . 7.500 3.708 3.690 3.730 . 0 0 "[ . 1 . 2]" 1 424 1 24 VAL H 1 24 VAL MG1 2.266 . 2.908 2.980 2.933 3.039 0.131 16 0 "[ . 1 . 2]" 1 425 1 24 VAL H 1 24 VAL MG2 1.965 . 2.448 2.246 2.174 2.328 . 0 0 "[ . 1 . 2]" 1 426 1 24 VAL H 1 25 LEU H 2.642 . 3.514 2.738 2.618 2.812 . 0 0 "[ . 1 . 2]" 1 427 1 24 VAL H 1 25 LEU HG 3.074 . 4.255 4.289 4.257 4.323 0.068 11 0 "[ . 1 . 2]" 1 428 1 24 VAL H 1 65 ILE MG 2.999 . 7.500 4.208 4.125 4.272 . 0 0 "[ . 1 . 2]" 1 429 1 24 VAL H 1 72 LEU QD 2.865 . 7.500 4.308 4.222 4.415 . 0 0 "[ . 1 . 2]" 1 430 1 24 VAL H 1 68 ALA MB 3.354 . 4.760 4.074 3.845 4.191 . 0 0 "[ . 1 . 2]" 1 431 1 24 VAL HA 1 24 VAL HB 2.367 . 3.068 3.020 3.013 3.025 . 0 0 "[ . 1 . 2]" 1 432 1 24 VAL HA 1 24 VAL MG1 2.192 . 2.793 2.521 2.504 2.550 . 0 0 "[ . 1 . 2]" 1 433 1 24 VAL HA 1 24 VAL MG2 1.888 . 2.334 2.280 2.264 2.302 . 0 0 "[ . 1 . 2]" 1 434 1 24 VAL HA 1 25 LEU H 2.729 . 3.660 3.528 3.515 3.539 . 0 0 "[ . 1 . 2]" 1 435 1 24 VAL HA 1 25 LEU HG 3.142 . 7.500 4.687 4.568 4.821 . 0 0 "[ . 1 . 2]" 1 436 1 24 VAL HB 1 24 VAL MG1 2.005 . 2.507 2.123 2.118 2.127 . 0 0 "[ . 1 . 2]" 1 437 1 24 VAL HB 1 24 VAL MG2 1.924 . 2.387 2.125 2.122 2.128 . 0 0 "[ . 1 . 2]" 1 438 1 24 VAL HB 1 25 LEU H 2.711 . 3.630 2.711 2.661 2.768 . 0 0 "[ . 1 . 2]" 1 439 1 24 VAL HB 1 25 LEU MD1 2.790 . 3.763 3.218 3.043 3.385 . 0 0 "[ . 1 . 2]" 1 440 1 24 VAL HB 1 25 LEU MD2 3.160 . 4.408 4.058 3.994 4.196 . 0 0 "[ . 1 . 2]" 1 441 1 24 VAL HB 1 25 LEU HG 2.936 . 4.013 2.650 2.593 2.766 . 0 0 "[ . 1 . 2]" 1 442 1 24 VAL HB 1 26 GLY H 4.039 . 6.078 4.511 4.447 4.579 . 0 0 "[ . 1 . 2]" 1 443 1 24 VAL HB 1 72 LEU QD 3.254 . 4.577 4.068 4.020 4.099 . 0 0 "[ . 1 . 2]" 1 444 1 24 VAL HB 1 65 ILE HA 3.067 . 4.243 3.893 3.750 4.061 . 0 0 "[ . 1 . 2]" 1 445 1 24 VAL HB 1 68 ALA MB 2.553 . 3.368 2.465 2.343 2.568 . 0 0 "[ . 1 . 2]" 1 446 1 24 VAL MG1 1 24 VAL MG2 1.878 . 2.319 2.062 2.047 2.075 . 0 0 "[ . 1 . 2]" 1 447 1 24 VAL MG1 1 25 LEU H 2.505 . 3.289 3.077 3.017 3.149 . 0 0 "[ . 1 . 2]" 1 448 1 24 VAL MG1 1 25 LEU HA 2.755 . 3.704 3.492 3.425 3.621 . 0 0 "[ . 1 . 2]" 1 449 1 24 VAL MG1 1 25 LEU HA 2.619 . 3.476 3.290 3.249 3.346 . 0 0 "[ . 1 . 2]" 1 450 1 24 VAL MG1 1 65 ILE HG13 2.859 . 3.881 4.103 3.987 4.233 0.352 8 0 "[ . 1 . 2]" 1 451 1 24 VAL MG1 1 67 ASN H 3.617 . 5.252 3.946 3.862 4.081 . 0 0 "[ . 1 . 2]" 1 452 1 24 VAL MG1 1 68 ALA MB 2.089 . 2.635 1.927 1.838 2.005 . 0 0 "[ . 1 . 2]" 1 453 1 24 VAL MG1 1 25 LEU HG 2.383 . 3.093 2.427 2.293 2.619 . 0 0 "[ . 1 . 2]" 1 454 1 24 VAL MG1 1 64 GLU H 3.009 . 7.500 4.359 4.252 4.476 . 0 0 "[ . 1 . 2]" 1 455 1 24 VAL MG1 1 64 GLU HA 2.780 . 3.746 3.811 3.769 3.889 0.143 5 0 "[ . 1 . 2]" 1 456 1 24 VAL MG1 1 64 GLU HB2 2.962 . 4.059 2.615 2.467 2.736 . 0 0 "[ . 1 . 2]" 1 457 1 24 VAL MG1 1 64 GLU HG3 2.756 . 3.705 2.183 1.991 2.551 . 0 0 "[ . 1 . 2]" 1 458 1 24 VAL MG1 1 65 ILE HA 2.047 . 2.571 1.816 1.708 1.937 . 0 0 "[ . 1 . 2]" 1 459 1 24 VAL MG1 1 65 ILE HB 2.542 . 3.350 3.206 3.023 3.380 0.030 1 0 "[ . 1 . 2]" 1 460 1 24 VAL MG1 1 66 ASN H 2.763 . 3.717 3.709 3.656 3.771 0.054 4 0 "[ . 1 . 2]" 1 461 1 24 VAL MG1 1 68 ALA H 2.914 . 3.975 3.141 3.078 3.222 . 0 0 "[ . 1 . 2]" 1 462 1 24 VAL MG1 1 68 ALA MB 2.109 . 2.665 2.557 2.442 2.697 0.032 4 0 "[ . 1 . 2]" 1 463 1 24 VAL MG2 1 25 LEU H 2.464 . 7.500 3.982 3.961 4.013 . 0 0 "[ . 1 . 2]" 1 464 1 24 VAL MG2 1 25 LEU HA 3.014 . 7.500 5.483 5.463 5.517 . 0 0 "[ . 1 . 2]" 1 465 1 24 VAL MG2 1 25 LEU HG 2.618 . 7.500 4.215 4.152 4.333 . 0 0 "[ . 1 . 2]" 1 466 1 24 VAL MG2 1 26 GLY H 3.648 . 5.312 5.352 5.319 5.383 0.071 3 0 "[ . 1 . 2]" 1 467 1 24 VAL MG2 1 64 GLU H 3.421 . 7.500 5.242 5.094 5.421 . 0 0 "[ . 1 . 2]" 1 468 1 24 VAL MG2 1 64 GLU HA 3.206 . 4.490 4.082 3.930 4.341 . 0 0 "[ . 1 . 2]" 1 469 1 24 VAL MG2 1 64 GLU HG3 2.703 . 3.617 3.378 3.217 3.633 0.016 2 0 "[ . 1 . 2]" 1 470 1 24 VAL MG2 1 65 ILE H 3.250 . 4.570 4.619 4.560 4.678 0.108 15 0 "[ . 1 . 2]" 1 471 1 24 VAL MG2 1 65 ILE HA 2.631 . 7.500 4.024 3.917 4.131 . 0 0 "[ . 1 . 2]" 1 472 1 24 VAL MG2 1 67 ASN HB3 2.859 . 7.500 4.137 3.898 4.339 . 0 0 "[ . 1 . 2]" 1 473 1 24 VAL MG2 1 68 ALA H 3.369 . 4.788 3.823 3.749 3.971 . 0 0 "[ . 1 . 2]" 1 474 1 25 LEU H 1 25 LEU HA 2.852 . 3.869 2.944 2.941 2.948 . 0 0 "[ . 1 . 2]" 1 475 1 25 LEU H 1 25 LEU QB 3.239 . 4.550 3.181 3.144 3.201 . 0 0 "[ . 1 . 2]" 1 476 1 25 LEU H 1 25 LEU MD1 2.494 . 3.272 1.755 1.707 1.853 0.009 3 0 "[ . 1 . 2]" 1 477 1 25 LEU H 1 25 LEU MD2 2.687 . 7.500 3.891 3.866 3.926 . 0 0 "[ . 1 . 2]" 1 478 1 25 LEU H 1 25 LEU HG 2.394 . 3.111 2.434 2.363 2.506 . 0 0 "[ . 1 . 2]" 1 479 1 25 LEU H 1 26 GLY H 2.509 . 3.296 1.896 1.870 1.919 . 0 0 "[ . 1 . 2]" 1 480 1 25 LEU H 1 26 GLY HA2 3.448 . 4.934 4.201 4.159 4.237 . 0 0 "[ . 1 . 2]" 1 481 1 25 LEU H 1 26 GLY HA3 3.112 . 7.500 4.629 4.599 4.656 . 0 0 "[ . 1 . 2]" 1 482 1 25 LEU H 1 27 LEU H 3.082 . 4.269 3.675 3.463 3.853 . 0 0 "[ . 1 . 2]" 1 483 1 25 LEU H 1 27 LEU MD2 2.970 . 7.500 6.840 6.681 7.006 . 0 0 "[ . 1 . 2]" 1 484 1 25 LEU H 1 43 LEU MD1 3.079 . 7.500 4.595 4.095 4.937 . 0 0 "[ . 1 . 2]" 1 485 1 25 LEU H 1 65 ILE HA 2.633 . 7.500 5.233 5.052 5.513 . 0 0 "[ . 1 . 2]" 1 486 1 25 LEU H 1 68 ALA MB 2.982 . 4.094 3.784 3.590 3.919 . 0 0 "[ . 1 . 2]" 1 487 1 25 LEU H 1 72 LEU QD 3.056 . 7.500 4.234 4.165 4.273 . 0 0 "[ . 1 . 2]" 1 488 1 25 LEU HA 1 25 LEU QB 3.439 . 4.918 2.127 2.124 2.132 . 0 0 "[ . 1 . 2]" 1 489 1 25 LEU HA 1 25 LEU MD1 2.130 . 7.500 3.537 3.501 3.605 . 0 0 "[ . 1 . 2]" 1 490 1 25 LEU HA 1 25 LEU MD2 2.701 . 7.500 4.021 3.934 4.055 . 0 0 "[ . 1 . 2]" 1 491 1 25 LEU HA 1 25 LEU HG 3.284 . 4.632 3.451 3.310 3.515 . 0 0 "[ . 1 . 2]" 1 492 1 25 LEU HA 1 26 GLY H 3.115 . 4.328 3.465 3.432 3.493 . 0 0 "[ . 1 . 2]" 1 493 1 25 LEU HA 1 27 LEU H 3.965 . 5.930 5.230 4.473 5.572 . 0 0 "[ . 1 . 2]" 1 494 1 25 LEU HA 1 72 LEU QD 3.408 . 7.500 5.378 5.316 5.437 . 0 0 "[ . 1 . 2]" 1 495 1 25 LEU HA 1 43 LEU MD1 2.270 . 2.914 2.578 1.881 2.964 0.050 15 0 "[ . 1 . 2]" 1 496 1 25 LEU HA 1 43 LEU MD1 2.117 . 2.677 2.462 1.874 2.783 0.106 13 0 "[ . 1 . 2]" 1 497 1 25 LEU HA 1 68 ALA MB 3.641 . 5.299 4.814 4.723 4.917 . 0 0 "[ . 1 . 2]" 1 498 1 25 LEU QB 1 25 LEU MD2 2.084 . 2.627 1.875 1.873 1.878 . 0 0 "[ . 1 . 2]" 1 499 1 25 LEU QB 1 26 GLY H 2.881 . 3.919 3.191 3.093 3.280 . 0 0 "[ . 1 . 2]" 1 500 1 25 LEU QB 1 40 TYR H 3.155 . 4.399 4.079 3.939 4.359 . 0 0 "[ . 1 . 2]" 1 501 1 25 LEU HB2 1 39 SER HB2 2.686 . 7.500 3.928 3.701 4.087 . 0 0 "[ . 1 . 2]" 1 502 1 25 LEU HB3 1 69 HIS H 3.922 . 5.844 4.737 4.600 4.990 . 0 0 "[ . 1 . 2]" 1 503 1 25 LEU MD1 1 26 GLY H 2.763 . 3.717 1.862 1.781 2.050 0.028 17 0 "[ . 1 . 2]" 1 504 1 25 LEU MD1 1 26 GLY HA2 3.250 . 4.570 3.789 3.653 4.010 . 0 0 "[ . 1 . 2]" 1 505 1 25 LEU MD1 1 26 GLY HA3 3.324 . 4.705 3.940 3.843 4.126 . 0 0 "[ . 1 . 2]" 1 506 1 25 LEU MD1 1 27 LEU H 2.457 . 3.212 2.163 1.802 2.388 . 0 0 "[ . 1 . 2]" 1 507 1 25 LEU MD1 1 28 ASP HB2 3.797 . 5.599 4.723 3.951 4.958 . 0 0 "[ . 1 . 2]" 1 508 1 25 LEU MD1 1 28 ASP HB3 3.587 . 5.195 4.120 3.879 4.491 . 0 0 "[ . 1 . 2]" 1 509 1 25 LEU MD1 1 40 TYR H 2.877 . 7.500 5.150 4.863 5.528 . 0 0 "[ . 1 . 2]" 1 510 1 25 LEU MD1 1 69 HIS H 2.916 . 7.500 4.651 4.555 4.781 . 0 0 "[ . 1 . 2]" 1 511 1 25 LEU MD1 1 68 ALA H 2.983 . 4.095 4.282 4.248 4.317 0.222 5 0 "[ . 1 . 2]" 1 512 1 25 LEU MD1 1 68 ALA HA 3.347 . 4.748 4.567 4.353 4.760 0.012 7 0 "[ . 1 . 2]" 1 513 1 25 LEU MD1 1 68 ALA MB 2.254 . 2.889 2.279 2.042 2.509 . 0 0 "[ . 1 . 2]" 1 514 1 25 LEU MD1 1 69 HIS HA 2.948 . 7.500 4.749 4.533 5.070 . 0 0 "[ . 1 . 2]" 1 515 1 25 LEU MD1 1 70 ALA H 3.459 . 4.955 4.950 4.609 5.046 0.091 16 0 "[ . 1 . 2]" 1 516 1 25 LEU MD1 1 72 LEU H 3.468 . 4.972 4.876 4.774 4.956 . 0 0 "[ . 1 . 2]" 1 517 1 25 LEU MD1 1 72 LEU QD 2.751 . 3.697 1.761 1.728 1.777 0.145 15 0 "[ . 1 . 2]" 1 518 1 25 LEU MD2 1 27 LEU HB3 2.939 . 4.019 3.705 3.272 4.022 0.003 17 0 "[ . 1 . 2]" 1 519 1 25 LEU MD2 1 40 TYR H 2.990 . 4.107 3.247 3.110 3.411 . 0 0 "[ . 1 . 2]" 1 520 1 25 LEU MD2 1 40 TYR H 3.212 . 4.501 3.327 3.190 3.516 . 0 0 "[ . 1 . 2]" 1 521 1 25 LEU MD2 1 40 TYR HA 3.011 . 4.144 2.547 2.252 2.878 . 0 0 "[ . 1 . 2]" 1 522 1 25 LEU MD2 1 40 TYR HB2 3.181 . 4.446 2.350 2.089 2.587 . 0 0 "[ . 1 . 2]" 1 523 1 25 LEU MD2 1 41 ARG H 3.560 . 5.144 4.516 4.431 4.618 . 0 0 "[ . 1 . 2]" 1 524 1 25 LEU MD2 1 65 ILE HA 2.637 . 3.506 3.214 3.027 3.357 . 0 0 "[ . 1 . 2]" 1 525 1 25 LEU MD2 1 68 ALA HA 3.150 . 4.391 3.991 3.916 4.078 . 0 0 "[ . 1 . 2]" 1 526 1 25 LEU MD2 1 68 ALA MB 2.364 . 3.063 1.997 1.876 2.083 . 0 0 "[ . 1 . 2]" 1 527 1 25 LEU MD2 1 69 HIS H 2.917 . 3.981 3.262 3.072 3.531 . 0 0 "[ . 1 . 2]" 1 528 1 25 LEU MD2 1 69 HIS HA 2.517 . 3.309 2.672 2.505 2.980 . 0 0 "[ . 1 . 2]" 1 529 1 25 LEU MD2 1 69 HIS QB 2.853 . 3.871 3.615 3.383 3.874 0.003 16 0 "[ . 1 . 2]" 1 530 1 25 LEU MD2 1 70 ALA H 3.462 . 4.960 4.572 4.455 4.694 . 0 0 "[ . 1 . 2]" 1 531 1 25 LEU MD2 1 72 LEU H 3.512 . 5.054 4.944 4.724 5.069 0.015 16 0 "[ . 1 . 2]" 1 532 1 25 LEU MD2 1 72 LEU QD . . 2.694 2.296 2.006 2.582 . 0 0 "[ . 1 . 2]" 1 533 1 25 LEU MD2 1 94 GLN QE 3.125 . 7.500 6.672 6.380 6.907 . 0 0 "[ . 1 . 2]" 1 534 1 25 LEU HG 1 68 ALA MB 2.463 . 3.221 2.213 2.002 2.416 . 0 0 "[ . 1 . 2]" 1 535 1 26 GLY H 1 26 GLY HA2 2.553 . 3.368 2.375 2.335 2.392 . 0 0 "[ . 1 . 2]" 1 536 1 26 GLY H 1 26 GLY QA 2.296 . 2.955 2.279 2.244 2.292 . 0 0 "[ . 1 . 2]" 1 537 1 26 GLY H 1 26 GLY HA3 2.580 . 3.412 2.931 2.903 2.941 . 0 0 "[ . 1 . 2]" 1 538 1 26 GLY H 1 27 LEU H 2.432 . 3.171 2.315 2.197 2.511 . 0 0 "[ . 1 . 2]" 1 539 1 26 GLY H 1 27 LEU HB3 4.014 . 6.028 4.998 4.907 5.158 . 0 0 "[ . 1 . 2]" 1 540 1 26 GLY QA 1 27 LEU H 2.659 . 3.543 2.707 2.586 2.916 . 0 0 "[ . 1 . 2]" 1 541 1 26 GLY HA2 1 27 LEU H 3.005 . 4.134 2.844 2.656 3.390 . 0 0 "[ . 1 . 2]" 1 542 1 26 GLY HA3 1 27 LEU H 3.021 . 4.162 3.495 3.157 3.566 . 0 0 "[ . 1 . 2]" 1 543 1 27 LEU H 1 27 LEU HA 2.782 . 3.750 2.883 2.836 2.950 . 0 0 "[ . 1 . 2]" 1 544 1 27 LEU H 1 27 LEU HB2 2.491 . 3.267 3.037 2.395 3.223 . 0 0 "[ . 1 . 2]" 1 545 1 27 LEU H 1 27 LEU HB3 2.849 . 3.864 3.177 2.860 3.322 . 0 0 "[ . 1 . 2]" 1 546 1 27 LEU H 1 27 LEU MD2 2.558 . 7.500 4.086 3.838 4.160 . 0 0 "[ . 1 . 2]" 1 547 1 27 LEU H 1 27 LEU HG 2.985 . 7.500 5.039 4.774 5.144 . 0 0 "[ . 1 . 2]" 1 548 1 27 LEU HA 1 27 LEU MD1 1.989 . 2.483 1.808 1.777 1.859 . 0 0 "[ . 1 . 2]" 1 549 1 27 LEU HA 1 27 LEU MD2 2.550 . 3.363 3.423 3.379 3.462 0.099 17 0 "[ . 1 . 2]" 1 550 1 27 LEU HA 1 27 LEU HG 2.987 . 4.102 3.419 3.373 3.466 . 0 0 "[ . 1 . 2]" 1 551 1 27 LEU HA 1 28 ASP H 2.369 . 3.070 2.347 2.300 2.391 . 0 0 "[ . 1 . 2]" 1 552 1 27 LEU HA 1 28 ASP HB2 3.331 . 7.500 5.519 4.341 5.764 . 0 0 "[ . 1 . 2]" 1 553 1 27 LEU HA 1 28 ASP HB3 3.212 . 7.500 4.594 4.253 4.803 . 0 0 "[ . 1 . 2]" 1 554 1 27 LEU HA 1 31 ALA MB 2.563 . 7.500 4.473 4.325 4.603 . 0 0 "[ . 1 . 2]" 1 555 1 27 LEU HB2 1 27 LEU MD2 2.688 . 3.591 2.153 2.128 2.165 . 0 0 "[ . 1 . 2]" 1 556 1 27 LEU HB2 1 28 ASP H 3.113 . 4.325 4.158 4.117 4.199 . 0 0 "[ . 1 . 2]" 1 557 1 27 LEU HB2 1 28 ASP HA 3.339 . 7.500 5.537 5.468 5.594 . 0 0 "[ . 1 . 2]" 1 558 1 27 LEU HB2 1 72 LEU QD 2.524 . 3.321 3.384 3.344 3.427 0.106 7 0 "[ . 1 . 2]" 1 559 1 27 LEU HB3 1 27 LEU QD 2.675 . 3.569 2.575 2.559 2.595 . 0 0 "[ . 1 . 2]" 1 560 1 27 LEU HB3 1 27 LEU MD2 2.295 . 2.953 2.765 2.728 2.806 . 0 0 "[ . 1 . 2]" 1 561 1 27 LEU HB3 1 28 ASP H 2.530 . 3.330 3.399 3.338 3.456 0.126 9 0 "[ . 1 . 2]" 1 562 1 27 LEU HB3 1 28 ASP HA 3.296 . 4.654 4.043 3.964 4.122 . 0 0 "[ . 1 . 2]" 1 563 1 27 LEU HB3 1 39 SER HB2 2.696 . 3.605 3.550 3.444 3.640 0.035 13 0 "[ . 1 . 2]" 1 564 1 27 LEU HB3 1 39 SER HB3 2.741 . 3.680 3.390 3.229 3.628 . 0 0 "[ . 1 . 2]" 1 565 1 27 LEU HB3 1 72 LEU QD 2.656 . 3.979 2.059 1.996 2.099 . 0 0 "[ . 1 . 2]" 1 566 1 27 LEU HB3 1 73 THR H 3.479 . 7.500 6.955 6.796 7.084 . 0 0 "[ . 1 . 2]" 1 567 1 27 LEU QD 1 31 ALA MB 1.974 . 2.461 1.689 1.621 1.738 . 0 0 "[ . 1 . 2]" 1 568 1 27 LEU QD 1 32 THR H 3.228 . 4.531 4.421 4.224 4.527 . 0 0 "[ . 1 . 2]" 1 569 1 27 LEU MD1 1 27 LEU HG 1.846 . 2.272 1.915 1.849 1.986 . 0 0 "[ . 1 . 2]" 1 570 1 27 LEU MD1 1 28 ASP H 2.247 . 2.878 1.613 1.529 1.747 0.087 13 0 "[ . 1 . 2]" 1 571 1 27 LEU MD1 1 28 ASP HA 3.245 . 4.561 4.056 3.956 4.176 . 0 0 "[ . 1 . 2]" 1 572 1 27 LEU MD1 1 30 ASN HD21 2.703 . 3.616 3.555 3.358 3.674 0.058 1 0 "[ . 1 . 2]" 1 573 1 27 LEU MD1 1 31 ALA H 2.831 . 3.833 2.741 2.494 2.917 . 0 0 "[ . 1 . 2]" 1 574 1 27 LEU MD1 1 31 ALA MB 1.904 . 2.357 1.740 1.655 1.803 . 0 0 "[ . 1 . 2]" 1 575 1 27 LEU MD1 1 35 ASP QB 2.569 . 3.394 3.473 3.389 3.540 0.146 16 0 "[ . 1 . 2]" 1 576 1 27 LEU MD1 1 36 ILE H 2.745 . 7.500 4.558 4.407 4.643 . 0 0 "[ . 1 . 2]" 1 577 1 27 LEU MD1 1 36 ILE HA 2.630 . 7.500 3.945 3.789 4.056 . 0 0 "[ . 1 . 2]" 1 578 1 27 LEU MD2 1 28 ASP H 2.672 . 7.500 4.198 4.134 4.269 . 0 0 "[ . 1 . 2]" 1 579 1 27 LEU MD2 1 30 ASN HD21 3.194 . 7.500 6.225 6.027 6.353 . 0 0 "[ . 1 . 2]" 1 580 1 27 LEU MD2 1 31 ALA H 3.076 . 4.259 4.258 4.170 4.307 0.048 19 0 "[ . 1 . 2]" 1 581 1 27 LEU MD2 1 31 ALA HA 2.603 . 3.450 3.572 3.474 3.636 0.186 1 0 "[ . 1 . 2]" 1 582 1 27 LEU MD2 1 31 ALA MB 1.957 . 2.436 2.049 1.924 2.119 . 0 0 "[ . 1 . 2]" 1 583 1 27 LEU MD2 1 32 THR H 3.143 . 7.500 4.861 4.582 4.990 . 0 0 "[ . 1 . 2]" 1 584 1 27 LEU MD2 1 35 ASP H 3.198 . 4.477 4.556 4.497 4.613 0.136 8 0 "[ . 1 . 2]" 1 585 1 27 LEU MD2 1 35 ASP HA 2.903 . 3.956 3.809 3.752 3.898 . 0 0 "[ . 1 . 2]" 1 586 1 27 LEU MD2 1 35 ASP QB 2.865 . 3.891 2.181 1.962 2.620 . 0 0 "[ . 1 . 2]" 1 587 1 27 LEU MD2 1 36 ILE H 2.834 . 3.838 3.144 3.074 3.220 . 0 0 "[ . 1 . 2]" 1 588 1 27 LEU MD2 1 36 ILE H 2.516 . 3.307 2.768 2.661 2.849 . 0 0 "[ . 1 . 2]" 1 589 1 27 LEU MD2 1 36 ILE HA 2.266 . 2.908 2.010 1.813 2.133 . 0 0 "[ . 1 . 2]" 1 590 1 27 LEU MD2 1 38 LYS H 3.854 . 5.710 4.547 4.246 4.798 . 0 0 "[ . 1 . 2]" 1 591 1 27 LEU MD2 1 39 SER H 2.811 . 3.799 3.080 2.887 3.275 . 0 0 "[ . 1 . 2]" 1 592 1 27 LEU MD2 1 39 SER HA 3.015 . 4.151 3.799 3.675 3.918 . 0 0 "[ . 1 . 2]" 1 593 1 27 LEU MD2 1 39 SER HB2 2.316 . 2.986 1.680 1.616 1.737 0.030 20 0 "[ . 1 . 2]" 1 594 1 27 LEU MD2 1 39 SER HB3 2.353 . 3.045 2.477 2.404 2.560 . 0 0 "[ . 1 . 2]" 1 595 1 27 LEU MD2 1 40 TYR H 3.270 . 4.606 4.535 4.301 4.671 0.065 19 0 "[ . 1 . 2]" 1 596 1 27 LEU MD2 1 40 TYR H 2.702 . 7.500 3.871 3.620 4.031 . 0 0 "[ . 1 . 2]" 1 597 1 27 LEU MD2 1 42 LYS QE 3.452 . 4.942 4.792 4.386 5.019 0.077 18 0 "[ . 1 . 2]" 1 598 1 27 LEU MD2 1 72 LEU QD 2.964 . 4.062 3.693 3.583 3.795 . 0 0 "[ . 1 . 2]" 1 599 1 27 LEU MD2 1 73 THR H 2.772 . 7.500 7.199 7.070 7.305 . 0 0 "[ . 1 . 2]" 1 600 1 27 LEU HG 1 28 ASP H 2.546 . 3.357 3.080 2.932 3.192 . 0 0 "[ . 1 . 2]" 1 601 1 27 LEU HG 1 36 ILE H 2.724 . 3.651 3.868 3.818 3.903 0.252 8 0 "[ . 1 . 2]" 1 602 1 27 LEU HG 1 39 SER HB2 2.984 . 4.097 4.061 3.935 4.132 0.035 5 0 "[ . 1 . 2]" 1 603 1 27 LEU HG 1 39 SER QB 2.637 . 7.500 3.718 3.655 3.749 . 0 0 "[ . 1 . 2]" 1 604 1 27 LEU HG 1 39 SER HB3 3.081 . 4.267 4.314 4.223 4.372 0.105 8 0 "[ . 1 . 2]" 1 605 1 28 ASP H 1 28 ASP HA 2.547 . 3.358 2.793 2.758 2.822 . 0 0 "[ . 1 . 2]" 1 606 1 28 ASP H 1 28 ASP HB2 2.626 . 7.500 3.993 3.417 4.114 . 0 0 "[ . 1 . 2]" 1 607 1 28 ASP H 1 28 ASP HB3 2.630 . 7.500 3.532 3.267 3.629 . 0 0 "[ . 1 . 2]" 1 608 1 28 ASP H 1 29 LYS H 3.140 . 4.373 3.584 3.536 3.686 . 0 0 "[ . 1 . 2]" 1 609 1 28 ASP H 1 30 ASN H 3.228 . 4.531 2.765 2.689 2.822 . 0 0 "[ . 1 . 2]" 1 610 1 28 ASP H 1 31 ALA H 3.444 . 4.927 3.603 3.493 3.853 . 0 0 "[ . 1 . 2]" 1 611 1 28 ASP H 1 31 ALA HA 3.613 . 7.500 6.107 5.938 6.273 . 0 0 "[ . 1 . 2]" 1 612 1 28 ASP H 1 31 ALA MB 2.517 . 7.500 3.879 3.614 4.099 . 0 0 "[ . 1 . 2]" 1 613 1 28 ASP H 1 73 THR H 3.630 . 7.500 7.568 7.533 7.626 0.126 3 0 "[ . 1 . 2]" 1 614 1 28 ASP HA 1 28 ASP HB2 2.205 . 2.813 2.449 2.220 2.573 . 0 0 "[ . 1 . 2]" 1 615 1 28 ASP HA 1 28 ASP HB3 2.196 . 2.799 2.543 2.400 2.985 0.186 20 0 "[ . 1 . 2]" 1 616 1 28 ASP HA 1 29 LYS H 2.193 . 2.794 2.115 2.058 2.147 . 0 0 "[ . 1 . 2]" 1 617 1 28 ASP HA 1 29 LYS HA 2.918 . 7.500 4.319 4.269 4.340 . 0 0 "[ . 1 . 2]" 1 618 1 28 ASP HA 1 29 LYS HB3 2.925 . 7.500 4.351 4.199 4.439 . 0 0 "[ . 1 . 2]" 1 619 1 28 ASP HA 1 29 LYS HD2 3.305 . 7.500 6.538 6.459 6.708 . 0 0 "[ . 1 . 2]" 1 620 1 28 ASP HA 1 29 LYS QG 3.019 . 4.159 3.774 3.700 3.927 . 0 0 "[ . 1 . 2]" 1 621 1 28 ASP HA 1 30 ASN H 2.936 . 4.014 3.920 3.766 3.973 . 0 0 "[ . 1 . 2]" 1 622 1 28 ASP HA 1 30 ASN HD22 3.283 . 7.500 6.230 6.112 6.365 . 0 0 "[ . 1 . 2]" 1 623 1 28 ASP HA 1 31 ALA MB 3.207 . 7.500 5.128 4.777 5.304 . 0 0 "[ . 1 . 2]" 1 624 1 28 ASP HA 1 72 LEU HB3 2.671 . 3.563 1.791 1.586 1.907 0.193 9 0 "[ . 1 . 2]" 1 625 1 28 ASP HA 1 73 THR H 3.190 . 7.500 5.633 5.364 5.829 . 0 0 "[ . 1 . 2]" 1 626 1 28 ASP HB2 1 29 LYS H 2.368 . 7.500 3.797 3.641 4.487 . 0 0 "[ . 1 . 2]" 1 627 1 28 ASP HB2 1 29 LYS HA 3.361 . 7.500 5.471 5.233 6.391 . 0 0 "[ . 1 . 2]" 1 628 1 28 ASP HB2 1 29 LYS HA 2.830 . 7.500 4.884 4.785 5.240 . 0 0 "[ . 1 . 2]" 1 629 1 28 ASP HB2 1 29 LYS QB 3.187 . 4.457 4.348 3.987 5.419 0.962 19 3 "[ - . 1 . +*]" 1 630 1 28 ASP HB2 1 29 LYS HG3 2.899 . 3.949 3.389 3.030 4.606 0.657 19 3 "[ * . 1 . +-]" 1 631 1 28 ASP HB2 1 30 ASN H 2.849 . 7.500 4.885 4.665 5.290 . 0 0 "[ . 1 . 2]" 1 632 1 28 ASP HB3 1 29 LYS H 2.372 . 7.500 4.356 4.175 4.503 . 0 0 "[ . 1 . 2]" 1 633 1 28 ASP HB3 1 29 LYS HA 2.936 . 7.500 6.253 5.605 6.409 . 0 0 "[ . 1 . 2]" 1 634 1 28 ASP HB3 1 29 LYS HG3 3.104 . 4.308 4.327 3.093 4.621 0.313 16 0 "[ . 1 . 2]" 1 635 1 28 ASP HB3 1 30 ASN H 2.841 . 7.500 5.155 4.214 5.371 . 0 0 "[ . 1 . 2]" 1 636 1 28 ASP HB3 1 72 LEU HB3 2.984 . 4.097 4.135 3.897 4.690 0.593 19 3 "[ - . 1 . +*]" 1 637 1 29 LYS H 1 29 LYS HA 2.478 . 3.246 2.256 2.247 2.263 . 0 0 "[ . 1 . 2]" 1 638 1 29 LYS H 1 29 LYS HB3 2.408 . 3.133 2.990 2.957 3.020 . 0 0 "[ . 1 . 2]" 1 639 1 29 LYS H 1 29 LYS QD 2.879 . 7.500 4.690 4.522 4.805 . 0 0 "[ . 1 . 2]" 1 640 1 29 LYS H 1 29 LYS HG3 2.442 . 7.500 3.435 3.359 3.592 . 0 0 "[ . 1 . 2]" 1 641 1 29 LYS H 1 30 ASN H 2.676 . 3.571 3.036 2.971 3.114 . 0 0 "[ . 1 . 2]" 1 642 1 29 LYS H 1 30 ASN HA 3.345 . 7.500 5.525 5.480 5.590 . 0 0 "[ . 1 . 2]" 1 643 1 29 LYS H 1 31 ALA H 3.241 . 4.554 3.913 3.786 4.068 . 0 0 "[ . 1 . 2]" 1 644 1 29 LYS H 1 31 ALA MB 3.746 . 5.500 4.491 4.141 4.634 . 0 0 "[ . 1 . 2]" 1 645 1 29 LYS H 1 36 ILE MD 2.868 . 3.896 2.377 2.195 2.477 . 0 0 "[ . 1 . 2]" 1 646 1 29 LYS H 1 72 LEU HB2 2.466 . 3.226 3.152 3.005 3.280 0.054 9 0 "[ . 1 . 2]" 1 647 1 29 LYS H 1 72 LEU HB3 2.251 . 2.885 2.026 1.781 2.328 . 0 0 "[ . 1 . 2]" 1 648 1 29 LYS H 1 73 THR H 3.826 . 5.655 4.709 4.513 4.940 . 0 0 "[ . 1 . 2]" 1 649 1 29 LYS HA 1 29 LYS QB 2.184 . 2.780 2.162 2.160 2.168 . 0 0 "[ . 1 . 2]" 1 650 1 29 LYS HA 1 29 LYS QE 3.167 . 4.421 4.319 3.866 4.451 0.030 12 0 "[ . 1 . 2]" 1 651 1 29 LYS HA 1 29 LYS QG 2.411 . 7.500 3.369 3.345 3.412 . 0 0 "[ . 1 . 2]" 1 652 1 29 LYS HA 1 30 ASN H 2.438 . 3.181 3.215 3.163 3.243 0.062 11 0 "[ . 1 . 2]" 1 653 1 29 LYS HA 1 30 ASN HA 3.221 . 7.500 4.525 4.473 4.574 . 0 0 "[ . 1 . 2]" 1 654 1 29 LYS HA 1 30 ASN HD21 2.873 . 7.500 5.591 5.452 5.740 . 0 0 "[ . 1 . 2]" 1 655 1 29 LYS HA 1 31 ALA H 3.060 . 4.230 3.863 3.644 4.079 . 0 0 "[ . 1 . 2]" 1 656 1 29 LYS HA 1 31 ALA MB 2.938 . 7.500 4.847 4.587 5.031 . 0 0 "[ . 1 . 2]" 1 657 1 29 LYS HA 1 73 THR H 2.886 . 7.500 5.242 4.985 5.608 . 0 0 "[ . 1 . 2]" 1 658 1 29 LYS HB2 1 29 LYS HG2 2.034 . 2.551 2.325 2.302 2.344 . 0 0 "[ . 1 . 2]" 1 659 1 29 LYS QB 1 29 LYS QE 2.993 . 3.465 3.239 2.773 3.364 . 0 0 "[ . 1 . 2]" 1 660 1 29 LYS QB 1 30 ASN H 2.812 . 7.500 3.943 3.902 3.964 . 0 0 "[ . 1 . 2]" 1 661 1 29 LYS QB 1 30 ASN H 2.682 . 7.500 3.759 3.720 3.822 . 0 0 "[ . 1 . 2]" 1 662 1 29 LYS QB 1 30 ASN HA 3.380 . 4.808 4.520 4.444 4.636 . 0 0 "[ . 1 . 2]" 1 663 1 29 LYS QB 1 30 ASN HD21 3.259 . 7.500 5.265 5.063 5.472 . 0 0 "[ . 1 . 2]" 1 664 1 29 LYS QB 1 73 THR H 3.286 . 7.500 5.584 5.210 5.946 . 0 0 "[ . 1 . 2]" 1 665 1 29 LYS HB2 1 31 ALA H 3.160 . 4.408 4.497 4.368 4.549 0.141 18 0 "[ . 1 . 2]" 1 666 1 29 LYS QD 1 29 LYS HG3 2.127 . 2.693 2.090 2.087 2.107 . 0 0 "[ . 1 . 2]" 1 667 1 29 LYS QD 1 29 LYS QE 2.350 . 3.040 2.037 2.000 2.089 . 0 0 "[ . 1 . 2]" 1 668 1 29 LYS QD 1 29 LYS QG 2.051 . 2.577 1.942 1.929 1.957 . 0 0 "[ . 1 . 2]" 1 669 1 29 LYS QD 1 30 ASN H 3.243 . 4.558 4.497 4.365 4.672 0.114 1 0 "[ . 1 . 2]" 1 670 1 29 LYS QD 1 30 ASN HA 3.167 . 4.421 4.176 4.002 4.504 0.083 1 0 "[ . 1 . 2]" 1 671 1 29 LYS QE 1 29 LYS QG 2.521 . 3.316 2.200 2.082 2.304 . 0 0 "[ . 1 . 2]" 1 672 1 29 LYS QE 1 29 LYS HG3 2.355 . 3.048 2.238 2.127 2.345 . 0 0 "[ . 1 . 2]" 1 673 1 29 LYS QE 1 30 ASN HA 2.524 . 3.320 2.827 2.398 3.056 . 0 0 "[ . 1 . 2]" 1 674 1 29 LYS QE 1 30 ASN HD21 3.029 . 4.176 2.951 2.683 3.165 . 0 0 "[ . 1 . 2]" 1 675 1 29 LYS QG 1 73 THR H 3.019 . 7.500 6.944 6.573 7.336 . 0 0 "[ . 1 . 2]" 1 676 1 29 LYS HG3 1 30 ASN H 2.724 . 3.651 3.211 3.130 3.304 . 0 0 "[ . 1 . 2]" 1 677 1 29 LYS HG3 1 30 ASN HA 3.052 . 4.217 4.507 4.426 4.585 0.368 4 0 "[ . 1 . 2]" 1 678 1 29 LYS HG3 1 30 ASN HD21 2.878 . 3.913 3.515 3.251 3.792 . 0 0 "[ . 1 . 2]" 1 679 1 29 LYS HG3 1 31 ALA H 3.637 . 5.290 4.797 4.749 4.883 . 0 0 "[ . 1 . 2]" 1 680 1 30 ASN H 1 30 ASN HB2 2.232 . 2.855 2.388 2.322 2.460 . 0 0 "[ . 1 . 2]" 1 681 1 30 ASN H 1 30 ASN HD21 3.387 . 4.821 2.750 2.552 2.877 . 0 0 "[ . 1 . 2]" 1 682 1 30 ASN H 1 31 ALA MB 2.905 . 3.960 3.730 3.553 3.840 . 0 0 "[ . 1 . 2]" 1 683 1 30 ASN H 1 36 ILE MD 3.070 . 4.248 3.117 2.988 3.423 . 0 0 "[ . 1 . 2]" 1 684 1 30 ASN HA 1 30 ASN QB 2.010 . 2.515 2.440 2.412 2.463 . 0 0 "[ . 1 . 2]" 1 685 1 30 ASN HA 1 30 ASN HD21 2.996 . 4.118 3.854 3.704 4.000 . 0 0 "[ . 1 . 2]" 1 686 1 30 ASN HA 1 30 ASN HD22 3.213 . 4.504 4.295 4.173 4.420 . 0 0 "[ . 1 . 2]" 1 687 1 30 ASN HA 1 31 ALA H 2.613 . 3.467 3.410 3.367 3.451 . 0 0 "[ . 1 . 2]" 1 688 1 30 ASN HA 1 31 ALA MB 2.985 . 7.500 4.914 4.842 4.955 . 0 0 "[ . 1 . 2]" 1 689 1 30 ASN QB 1 31 ALA HA 2.888 . 3.930 3.958 3.909 4.012 0.082 9 0 "[ . 1 . 2]" 1 690 1 30 ASN HB2 1 30 ASN HD21 2.474 . 3.239 2.197 2.165 2.242 . 0 0 "[ . 1 . 2]" 1 691 1 30 ASN HB2 1 31 ALA H 2.802 . 3.783 2.840 2.701 3.089 . 0 0 "[ . 1 . 2]" 1 692 1 30 ASN HB2 1 31 ALA MB 2.249 . 7.500 3.866 3.747 3.940 . 0 0 "[ . 1 . 2]" 1 693 1 30 ASN HB2 1 32 THR H 2.891 . 7.500 6.692 6.545 6.879 . 0 0 "[ . 1 . 2]" 1 694 1 30 ASN HD21 1 31 ALA H 3.513 . 5.056 4.304 4.106 4.543 . 0 0 "[ . 1 . 2]" 1 695 1 30 ASN HD21 1 31 ALA MB 2.576 . 7.500 5.328 5.110 5.491 . 0 0 "[ . 1 . 2]" 1 696 1 30 ASN HD21 1 36 ILE MD 2.577 . 7.500 5.152 5.014 5.657 . 0 0 "[ . 1 . 2]" 1 697 1 30 ASN HD21 1 36 ILE MG 3.394 . 7.500 7.558 7.529 7.597 0.097 5 0 "[ . 1 . 2]" 1 698 1 30 ASN HD21 1 72 LEU QD 2.748 . 7.500 5.626 5.499 5.780 . 0 0 "[ . 1 . 2]" 1 699 1 31 ALA H 1 31 ALA HA 2.432 . 3.172 2.904 2.875 2.933 . 0 0 "[ . 1 . 2]" 1 700 1 31 ALA H 1 31 ALA MB 1.993 . 2.489 2.201 2.059 2.314 . 0 0 "[ . 1 . 2]" 1 701 1 31 ALA H 1 32 THR H 3.052 . 7.500 4.485 4.435 4.520 . 0 0 "[ . 1 . 2]" 1 702 1 31 ALA H 1 32 THR MG 3.252 . 7.500 5.293 5.115 5.378 . 0 0 "[ . 1 . 2]" 1 703 1 31 ALA H 1 36 ILE MD 3.358 . 4.767 2.462 2.286 2.789 . 0 0 "[ . 1 . 2]" 1 704 1 31 ALA H 1 73 THR H 3.755 . 7.500 7.307 7.099 7.485 . 0 0 "[ . 1 . 2]" 1 705 1 31 ALA HA 1 31 ALA MB 1.994 . 2.491 2.115 2.098 2.123 . 0 0 "[ . 1 . 2]" 1 706 1 31 ALA HA 1 32 THR H 2.210 . 2.821 2.288 2.234 2.388 . 0 0 "[ . 1 . 2]" 1 707 1 31 ALA HA 1 32 THR HA 3.118 . 4.333 4.315 4.290 4.371 0.038 9 0 "[ . 1 . 2]" 1 708 1 31 ALA HA 1 32 THR MG 2.367 . 3.067 3.185 3.140 3.228 0.161 13 0 "[ . 1 . 2]" 1 709 1 31 ALA HA 1 33 SER H 3.714 . 5.438 4.992 4.951 5.022 . 0 0 "[ . 1 . 2]" 1 710 1 31 ALA HA 1 35 ASP H 3.220 . 4.516 4.707 4.633 4.781 0.265 13 0 "[ . 1 . 2]" 1 711 1 31 ALA HA 1 36 ILE H 3.074 . 4.255 3.434 3.422 3.448 . 0 0 "[ . 1 . 2]" 1 712 1 31 ALA HA 1 36 ILE HA 3.286 . 4.636 4.710 4.673 4.739 0.103 6 0 "[ . 1 . 2]" 1 713 1 31 ALA HA 1 35 ASP QB 2.847 . 3.860 3.150 2.913 3.388 . 0 0 "[ . 1 . 2]" 1 714 1 31 ALA HA 1 36 ILE H 3.385 . 4.818 4.589 4.482 4.778 . 0 0 "[ . 1 . 2]" 1 715 1 31 ALA HA 1 36 ILE MD 3.020 . 4.160 4.179 4.124 4.283 0.123 14 0 "[ . 1 . 2]" 1 716 1 31 ALA MB 1 32 THR H 2.269 . 2.912 2.359 2.192 2.491 . 0 0 "[ . 1 . 2]" 1 717 1 31 ALA MB 1 32 THR HA 3.086 . 4.276 4.152 4.055 4.213 . 0 0 "[ . 1 . 2]" 1 718 1 31 ALA MB 1 32 THR MG 2.666 . 7.500 3.804 3.738 3.876 . 0 0 "[ . 1 . 2]" 1 719 1 31 ALA MB 1 33 SER H 3.785 . 5.576 4.894 4.675 4.954 . 0 0 "[ . 1 . 2]" 1 720 1 31 ALA MB 1 33 SER HA 3.424 . 7.500 5.117 4.999 5.272 . 0 0 "[ . 1 . 2]" 1 721 1 31 ALA MB 1 34 ASP H 3.462 . 4.960 4.239 4.105 4.345 . 0 0 "[ . 1 . 2]" 1 722 1 31 ALA MB 1 35 ASP H 2.506 . 3.291 2.971 2.839 3.146 . 0 0 "[ . 1 . 2]" 1 723 1 31 ALA MB 1 35 ASP QB 2.355 . 3.048 1.558 1.527 1.612 0.135 6 0 "[ . 1 . 2]" 1 724 1 31 ALA MB 1 36 ILE H 2.578 . 3.409 2.111 1.939 2.254 . 0 0 "[ . 1 . 2]" 1 725 1 31 ALA MB 1 36 ILE HA 2.526 . 3.324 3.034 2.941 3.245 . 0 0 "[ . 1 . 2]" 1 726 1 31 ALA MB 1 36 ILE HB 2.836 . 3.841 3.848 3.482 3.936 0.095 10 0 "[ . 1 . 2]" 1 727 1 31 ALA MB 1 36 ILE MD 2.052 . 2.578 1.950 1.789 2.461 . 0 0 "[ . 1 . 2]" 1 728 1 31 ALA MB 1 36 ILE MG 2.226 . 7.500 3.867 3.813 3.977 . 0 0 "[ . 1 . 2]" 1 729 1 31 ALA MB 1 39 SER HB2 2.958 . 4.052 3.999 3.942 4.067 0.015 13 0 "[ . 1 . 2]" 1 730 1 31 ALA MB 1 72 LEU QD 3.115 . 4.328 4.201 4.058 4.272 . 0 0 "[ . 1 . 2]" 1 731 1 31 ALA MB 1 73 THR H 2.563 . 7.500 6.257 6.121 6.393 . 0 0 "[ . 1 . 2]" 1 732 1 32 THR H 1 32 THR HA 2.339 . 3.023 2.418 2.402 2.448 . 0 0 "[ . 1 . 2]" 1 733 1 32 THR H 1 32 THR HB 3.219 . 4.514 3.600 3.555 3.666 . 0 0 "[ . 1 . 2]" 1 734 1 32 THR H 1 32 THR MG 2.002 . 2.503 1.958 1.824 2.120 . 0 0 "[ . 1 . 2]" 1 735 1 32 THR H 1 34 ASP QB 3.088 . 4.280 3.811 3.668 3.907 . 0 0 "[ . 1 . 2]" 1 736 1 32 THR H 1 34 ASP H 3.394 . 4.834 3.385 3.204 3.611 . 0 0 "[ . 1 . 2]" 1 737 1 32 THR H 1 35 ASP H 2.943 . 4.026 2.920 2.745 3.120 . 0 0 "[ . 1 . 2]" 1 738 1 32 THR H 1 35 ASP HA 3.190 . 7.500 5.200 4.824 5.449 . 0 0 "[ . 1 . 2]" 1 739 1 32 THR H 1 35 ASP QB 2.887 . 3.929 2.702 2.343 3.050 . 0 0 "[ . 1 . 2]" 1 740 1 32 THR H 1 36 ILE H 3.642 . 5.300 3.678 3.436 4.013 . 0 0 "[ . 1 . 2]" 1 741 1 32 THR H 1 36 ILE HB 3.805 . 5.615 5.621 5.399 5.700 0.085 1 0 "[ . 1 . 2]" 1 742 1 32 THR H 1 36 ILE MD 2.981 . 7.500 4.567 4.310 4.689 . 0 0 "[ . 1 . 2]" 1 743 1 32 THR HA 1 32 THR HB 2.345 . 3.032 2.399 2.367 2.431 . 0 0 "[ . 1 . 2]" 1 744 1 32 THR HA 1 32 THR MG 2.076 . 2.615 2.497 2.436 2.530 . 0 0 "[ . 1 . 2]" 1 745 1 32 THR HA 1 33 SER H 2.593 . 3.433 2.595 2.569 2.624 . 0 0 "[ . 1 . 2]" 1 746 1 32 THR HA 1 33 SER HA 2.925 . 7.500 4.364 4.348 4.399 . 0 0 "[ . 1 . 2]" 1 747 1 32 THR HA 1 34 ASP H 3.193 . 4.467 3.948 3.901 4.007 . 0 0 "[ . 1 . 2]" 1 748 1 32 THR HA 1 34 ASP H 2.937 . 4.015 3.803 3.757 3.835 . 0 0 "[ . 1 . 2]" 1 749 1 32 THR HA 1 34 ASP QB 3.338 . 7.500 5.195 5.124 5.274 . 0 0 "[ . 1 . 2]" 1 750 1 32 THR HA 1 35 ASP H 3.391 . 4.829 4.641 4.461 4.720 . 0 0 "[ . 1 . 2]" 1 751 1 32 THR HA 1 36 ILE MD 3.429 . 4.899 4.768 3.991 4.980 0.081 18 0 "[ . 1 . 2]" 1 752 1 32 THR HA 1 73 THR HB 3.292 . 4.646 4.462 4.012 4.715 0.069 4 0 "[ . 1 . 2]" 1 753 1 32 THR HB 1 32 THR MG 1.944 . 2.416 2.136 2.133 2.139 . 0 0 "[ . 1 . 2]" 1 754 1 32 THR HB 1 33 SER H 2.464 . 3.223 2.283 2.212 2.365 . 0 0 "[ . 1 . 2]" 1 755 1 32 THR HB 1 33 SER HA 2.559 . 7.500 4.831 4.726 4.928 . 0 0 "[ . 1 . 2]" 1 756 1 32 THR MG 1 33 SER H 2.704 . 7.500 3.809 3.733 3.862 . 0 0 "[ . 1 . 2]" 1 757 1 32 THR MG 1 33 SER HA 2.998 . 7.500 5.621 5.600 5.644 . 0 0 "[ . 1 . 2]" 1 758 1 32 THR MG 1 33 SER QB 3.324 . 7.500 5.228 4.984 5.473 . 0 0 "[ . 1 . 2]" 1 759 1 32 THR MG 1 34 ASP H 2.602 . 7.500 3.878 3.839 3.920 . 0 0 "[ . 1 . 2]" 1 760 1 32 THR MG 1 34 ASP QB 2.734 . 3.668 3.711 3.628 3.760 0.092 16 0 "[ . 1 . 2]" 1 761 1 32 THR MG 1 35 ASP H 2.820 . 3.814 3.921 3.843 3.978 0.164 9 0 "[ . 1 . 2]" 1 762 1 32 THR MG 1 35 ASP QB 2.860 . 3.882 3.888 3.769 3.960 0.078 19 0 "[ . 1 . 2]" 1 763 1 33 SER H 1 33 SER HA 2.366 . 3.066 2.802 2.783 2.816 . 0 0 "[ . 1 . 2]" 1 764 1 33 SER H 1 33 SER QB 2.928 . 4.000 2.498 2.247 2.739 . 0 0 "[ . 1 . 2]" 1 765 1 33 SER H 1 34 ASP H 2.807 . 3.792 2.623 2.546 2.666 . 0 0 "[ . 1 . 2]" 1 766 1 33 SER H 1 34 ASP HA 3.499 . 7.500 5.196 5.145 5.232 . 0 0 "[ . 1 . 2]" 1 767 1 33 SER H 1 34 ASP QB 3.374 . 4.797 4.416 4.289 4.681 . 0 0 "[ . 1 . 2]" 1 768 1 33 SER H 1 35 ASP H 3.804 . 5.613 4.641 4.453 4.710 . 0 0 "[ . 1 . 2]" 1 769 1 33 SER H 1 73 THR MG 3.297 . 4.656 4.394 3.970 4.671 0.015 14 0 "[ . 1 . 2]" 1 770 1 33 SER HA 1 33 SER QB 2.091 . 2.637 2.297 2.177 2.411 . 0 0 "[ . 1 . 2]" 1 771 1 33 SER HA 1 34 ASP H 2.558 . 3.376 3.340 3.310 3.395 0.019 19 0 "[ . 1 . 2]" 1 772 1 33 SER HA 1 34 ASP H 2.340 . 3.024 3.191 3.079 3.239 0.215 15 0 "[ . 1 . 2]" 1 773 1 33 SER HA 1 34 ASP HA 3.025 . 7.500 4.664 4.624 4.736 . 0 0 "[ . 1 . 2]" 1 774 1 33 SER HA 1 34 ASP QB 2.831 . 7.500 5.116 5.062 5.292 . 0 0 "[ . 1 . 2]" 1 775 1 33 SER HA 1 35 ASP H 3.260 . 4.589 4.655 4.493 4.723 0.134 20 0 "[ . 1 . 2]" 1 776 1 33 SER HA 1 36 ILE H 3.833 . 5.670 4.236 3.947 4.465 . 0 0 "[ . 1 . 2]" 1 777 1 33 SER HA 1 36 ILE HB 2.771 . 3.731 3.098 2.686 3.453 . 0 0 "[ . 1 . 2]" 1 778 1 33 SER HA 1 36 ILE MD 2.702 . 7.500 4.817 3.434 5.224 . 0 0 "[ . 1 . 2]" 1 779 1 33 SER HA 1 37 LYS H 3.366 . 4.782 4.130 3.525 4.597 . 0 0 "[ . 1 . 2]" 1 780 1 33 SER HA 1 37 LYS QE 2.920 . 3.986 3.066 2.716 3.811 . 0 0 "[ . 1 . 2]" 1 781 1 33 SER HA 1 37 LYS HG2 2.767 . 3.724 3.351 2.589 3.756 0.032 14 0 "[ . 1 . 2]" 1 782 1 33 SER HA 1 73 THR MG 2.442 . 3.188 2.239 1.787 2.588 . 0 0 "[ . 1 . 2]" 1 783 1 33 SER HA 1 74 ASP H 3.705 . 5.421 4.957 4.848 5.057 . 0 0 "[ . 1 . 2]" 1 784 1 33 SER QB 1 34 ASP H 2.745 . 3.687 3.377 3.094 3.725 0.038 14 0 "[ . 1 . 2]" 1 785 1 33 SER QB 1 35 ASP H 3.638 . 5.293 5.127 4.999 5.274 . 0 0 "[ . 1 . 2]" 1 786 1 33 SER QB 1 73 THR MG 2.630 . 3.495 3.375 2.998 3.559 0.064 4 0 "[ . 1 . 2]" 1 787 1 34 ASP H 1 34 ASP HA 2.277 . 2.925 2.878 2.856 2.899 . 0 0 "[ . 1 . 2]" 1 788 1 34 ASP H 1 34 ASP QB 2.179 . 2.759 2.300 2.244 2.350 . 0 0 "[ . 1 . 2]" 1 789 1 34 ASP H 1 35 ASP H 2.690 . 3.594 2.616 2.507 2.715 . 0 0 "[ . 1 . 2]" 1 790 1 34 ASP H 1 35 ASP H 2.405 . 3.128 2.304 2.247 2.352 . 0 0 "[ . 1 . 2]" 1 791 1 34 ASP H 1 36 ILE HB 3.650 . 5.315 5.032 4.929 5.158 . 0 0 "[ . 1 . 2]" 1 792 1 34 ASP H 1 36 ILE MD 3.600 . 5.220 4.679 4.423 4.923 . 0 0 "[ . 1 . 2]" 1 793 1 34 ASP HA 1 34 ASP QB 2.110 . 2.667 2.363 2.293 2.447 . 0 0 "[ . 1 . 2]" 1 794 1 34 ASP HA 1 35 ASP H 2.487 . 3.260 2.777 2.760 2.798 . 0 0 "[ . 1 . 2]" 1 795 1 34 ASP HA 1 37 LYS H 3.034 . 4.184 3.726 3.570 4.028 . 0 0 "[ . 1 . 2]" 1 796 1 34 ASP HA 1 38 LYS HG2 3.102 . 4.305 2.751 2.357 3.261 . 0 0 "[ . 1 . 2]" 1 797 1 34 ASP HA 1 36 ILE MD 3.279 . 7.500 6.107 5.722 6.436 . 0 0 "[ . 1 . 2]" 1 798 1 34 ASP HA 1 37 LYS QD 3.009 . 7.500 5.808 5.343 6.358 . 0 0 "[ . 1 . 2]" 1 799 1 34 ASP HA 1 37 LYS QG 3.264 . 4.596 3.716 3.227 4.283 . 0 0 "[ . 1 . 2]" 1 800 1 34 ASP HA 1 38 LYS H 3.029 . 7.500 4.667 4.260 5.024 . 0 0 "[ . 1 . 2]" 1 801 1 34 ASP HA 1 38 LYS QE 2.992 . 4.111 3.632 3.148 4.154 0.043 16 0 "[ . 1 . 2]" 1 802 1 34 ASP QB 1 35 ASP H 2.442 . 3.187 2.451 2.359 2.550 . 0 0 "[ . 1 . 2]" 1 803 1 34 ASP QB 1 35 ASP QB 2.560 . 7.500 3.850 3.490 4.342 . 0 0 "[ . 1 . 2]" 1 804 1 34 ASP QB 1 36 ILE H 3.124 . 7.500 4.764 4.630 4.850 . 0 0 "[ . 1 . 2]" 1 805 1 35 ASP H 1 35 ASP HA 2.664 . 3.551 2.884 2.862 2.913 . 0 0 "[ . 1 . 2]" 1 806 1 35 ASP H 1 35 ASP QB 2.721 . 3.646 2.288 2.187 2.528 . 0 0 "[ . 1 . 2]" 1 807 1 35 ASP H 1 36 ILE H 2.943 . 4.025 2.563 2.491 2.654 . 0 0 "[ . 1 . 2]" 1 808 1 35 ASP H 1 36 ILE HB 3.081 . 7.500 4.401 4.314 4.519 . 0 0 "[ . 1 . 2]" 1 809 1 35 ASP H 1 36 ILE MD 2.984 . 7.500 4.544 4.401 4.628 . 0 0 "[ . 1 . 2]" 1 810 1 35 ASP H 1 37 LYS H 3.915 . 5.831 4.131 4.000 4.331 . 0 0 "[ . 1 . 2]" 1 811 1 35 ASP H 1 38 LYS H 4.131 . 6.264 4.867 4.727 5.084 . 0 0 "[ . 1 . 2]" 1 812 1 35 ASP HA 1 35 ASP QB 2.623 . 3.483 2.449 2.327 2.518 . 0 0 "[ . 1 . 2]" 1 813 1 35 ASP HA 1 36 ILE H 2.792 . 3.767 3.310 3.248 3.381 . 0 0 "[ . 1 . 2]" 1 814 1 35 ASP HA 1 38 LYS H 2.988 . 4.104 3.268 3.048 3.675 . 0 0 "[ . 1 . 2]" 1 815 1 35 ASP HA 1 38 LYS HB2 2.547 . 3.358 2.811 2.485 3.240 . 0 0 "[ . 1 . 2]" 1 816 1 35 ASP HA 1 38 LYS QD 2.684 . 7.500 4.679 4.294 5.256 . 0 0 "[ . 1 . 2]" 1 817 1 35 ASP HA 1 38 LYS QE 3.160 . 7.500 4.578 4.012 5.103 . 0 0 "[ . 1 . 2]" 1 818 1 35 ASP HA 1 38 LYS HG3 3.407 . 4.858 3.074 2.444 3.840 . 0 0 "[ . 1 . 2]" 1 819 1 35 ASP QB 1 36 ILE H 3.085 . 4.275 2.583 2.408 2.711 . 0 0 "[ . 1 . 2]" 1 820 1 35 ASP QB 1 36 ILE MD 3.151 . 4.392 4.072 3.879 4.462 0.070 13 0 "[ . 1 . 2]" 1 821 1 36 ILE H 1 36 ILE HA 2.601 . 3.446 2.709 2.687 2.751 . 0 0 "[ . 1 . 2]" 1 822 1 36 ILE H 1 36 ILE HB 2.660 . 3.545 2.624 2.340 2.715 . 0 0 "[ . 1 . 2]" 1 823 1 36 ILE H 1 36 ILE MD 2.289 . 7.500 3.216 3.130 3.307 . 0 0 "[ . 1 . 2]" 1 824 1 36 ILE H 1 36 ILE MD 2.364 . 3.063 3.043 2.984 3.094 0.031 13 0 "[ . 1 . 2]" 1 825 1 36 ILE H 1 37 LYS HA 3.051 . 4.214 4.192 4.064 4.281 0.067 10 0 "[ . 1 . 2]" 1 826 1 36 ILE H 1 72 LEU QD 3.352 . 7.500 5.143 5.000 5.271 . 0 0 "[ . 1 . 2]" 1 827 1 36 ILE HA 1 36 ILE HB 2.766 . 3.722 3.017 2.978 3.025 . 0 0 "[ . 1 . 2]" 1 828 1 36 ILE HA 1 36 ILE MD 2.411 . 3.138 2.420 2.143 3.735 0.597 14 3 "[ - 1 *+. 2]" 1 829 1 36 ILE HA 1 36 ILE MD 2.263 . 2.903 2.099 2.011 2.493 . 0 0 "[ . 1 . 2]" 1 830 1 36 ILE HA 1 36 ILE MG 2.187 . 2.785 2.423 2.387 2.534 . 0 0 "[ . 1 . 2]" 1 831 1 36 ILE HA 1 37 LYS H 3.486 . 5.005 3.558 3.534 3.584 . 0 0 "[ . 1 . 2]" 1 832 1 36 ILE HA 1 39 SER H 3.405 . 4.854 3.746 3.440 3.842 . 0 0 "[ . 1 . 2]" 1 833 1 36 ILE HA 1 39 SER HB2 3.149 . 4.389 3.334 2.971 3.575 . 0 0 "[ . 1 . 2]" 1 834 1 36 ILE HA 1 39 SER QB 2.735 . 3.670 2.855 2.508 3.061 . 0 0 "[ . 1 . 2]" 1 835 1 36 ILE HA 1 39 SER HB3 3.074 . 4.256 3.107 2.692 3.391 . 0 0 "[ . 1 . 2]" 1 836 1 36 ILE HA 1 40 TYR H 3.524 . 5.076 3.889 3.799 3.990 . 0 0 "[ . 1 . 2]" 1 837 1 36 ILE HA 1 72 LEU QD 2.820 . 3.814 3.064 2.944 3.151 . 0 0 "[ . 1 . 2]" 1 838 1 36 ILE HB 1 36 ILE MD 2.246 . 7.500 3.087 2.304 3.231 . 0 0 "[ . 1 . 2]" 1 839 1 36 ILE HB 1 36 ILE MG 2.233 . 2.856 2.128 2.124 2.135 . 0 0 "[ . 1 . 2]" 1 840 1 36 ILE HB 1 37 LYS H 2.338 . 3.021 2.539 2.368 2.870 . 0 0 "[ . 1 . 2]" 1 841 1 36 ILE HB 1 73 THR MG 2.863 . 3.888 2.406 2.214 2.662 . 0 0 "[ . 1 . 2]" 1 842 1 36 ILE HB 1 74 ASP H 3.981 . 5.962 5.975 5.802 6.054 0.092 10 0 "[ . 1 . 2]" 1 843 1 36 ILE MD 1 39 SER H 3.325 . 4.707 4.543 4.427 4.645 . 0 0 "[ . 1 . 2]" 1 844 1 36 ILE MD 1 72 LEU QD 2.133 . 2.702 1.648 1.614 1.774 . 0 0 "[ . 1 . 2]" 1 845 1 36 ILE MD 1 72 LEU HG 3.168 . 4.422 2.680 2.566 2.770 . 0 0 "[ . 1 . 2]" 1 846 1 36 ILE MD 1 37 LYS QE 3.367 . 4.784 4.817 4.501 4.899 0.115 6 0 "[ . 1 . 2]" 1 847 1 36 ILE MD 1 71 ILE HA 2.971 . 7.500 6.936 6.549 7.102 . 0 0 "[ . 1 . 2]" 1 848 1 36 ILE MD 1 72 LEU HA 2.814 . 7.500 4.042 3.869 4.181 . 0 0 "[ . 1 . 2]" 1 849 1 36 ILE MD 1 72 LEU HB2 2.557 . 3.374 1.741 1.679 1.868 0.061 19 0 "[ . 1 . 2]" 1 850 1 36 ILE MD 1 72 LEU HB3 2.498 . 3.278 2.312 2.094 2.629 . 0 0 "[ . 1 . 2]" 1 851 1 36 ILE MD 1 72 LEU QD 2.628 . 3.136 2.306 2.087 3.035 . 0 0 "[ . 1 . 2]" 1 852 1 36 ILE MD 1 73 THR H 2.842 . 3.851 3.574 2.828 3.856 0.005 17 0 "[ . 1 . 2]" 1 853 1 36 ILE MD 1 73 THR HB 2.268 . 2.911 2.778 1.629 3.011 0.100 7 0 "[ . 1 . 2]" 1 854 1 36 ILE MG 1 37 LYS H 2.308 . 7.500 3.337 3.153 3.504 . 0 0 "[ . 1 . 2]" 1 855 1 36 ILE MG 1 37 LYS HA 2.301 . 7.500 3.242 3.061 3.410 . 0 0 "[ . 1 . 2]" 1 856 1 36 ILE MG 1 37 LYS QE 2.855 . 3.874 2.857 2.708 3.220 . 0 0 "[ . 1 . 2]" 1 857 1 36 ILE MG 1 37 LYS QG 3.212 . 4.501 3.763 3.472 3.978 . 0 0 "[ . 1 . 2]" 1 858 1 36 ILE MG 1 38 LYS H 3.320 . 7.500 5.004 4.858 5.195 . 0 0 "[ . 1 . 2]" 1 859 1 36 ILE MG 1 40 TYR H 3.118 . 7.500 4.549 4.327 4.719 . 0 0 "[ . 1 . 2]" 1 860 1 36 ILE MG 1 40 TYR QB 3.051 . 4.215 4.093 3.866 4.283 0.068 20 0 "[ . 1 . 2]" 1 861 1 36 ILE MG 1 68 ALA HA 2.951 . 7.500 4.203 4.118 4.346 . 0 0 "[ . 1 . 2]" 1 862 1 36 ILE MG 1 69 HIS HA 2.626 . 3.488 3.463 3.257 3.556 0.068 3 0 "[ . 1 . 2]" 1 863 1 36 ILE MG 1 69 HIS QB 2.870 . 7.500 4.801 4.417 4.894 . 0 0 "[ . 1 . 2]" 1 864 1 36 ILE MG 1 71 ILE H 3.471 . 4.977 4.656 4.474 4.870 . 0 0 "[ . 1 . 2]" 1 865 1 36 ILE MG 1 72 LEU H 2.978 . 4.087 3.235 3.012 3.408 . 0 0 "[ . 1 . 2]" 1 866 1 36 ILE MG 1 72 LEU H 2.906 . 3.961 3.043 2.872 3.165 . 0 0 "[ . 1 . 2]" 1 867 1 36 ILE MG 1 72 LEU HB2 2.652 . 3.531 1.912 1.765 2.061 0.008 5 0 "[ . 1 . 2]" 1 868 1 36 ILE MG 1 72 LEU QD 2.887 . 3.215 1.698 1.652 1.870 0.194 5 0 "[ . 1 . 2]" 1 869 1 36 ILE MG 1 72 LEU HG 2.519 . 3.312 2.755 2.629 2.867 . 0 0 "[ . 1 . 2]" 1 870 1 36 ILE MG 1 73 THR H 2.975 . 4.081 2.628 2.469 2.766 . 0 0 "[ . 1 . 2]" 1 871 1 36 ILE MG 1 74 ASP H 3.555 . 5.134 4.239 4.103 4.470 . 0 0 "[ . 1 . 2]" 1 872 1 37 LYS H 1 37 LYS HA 2.584 . 3.419 2.841 2.820 2.852 . 0 0 "[ . 1 . 2]" 1 873 1 37 LYS H 1 37 LYS QB 2.485 . 3.257 2.516 2.418 2.566 . 0 0 "[ . 1 . 2]" 1 874 1 37 LYS H 1 37 LYS QD 2.682 . 3.581 3.181 3.033 3.431 . 0 0 "[ . 1 . 2]" 1 875 1 37 LYS H 1 37 LYS QE 3.456 . 4.949 3.569 3.281 4.130 . 0 0 "[ . 1 . 2]" 1 876 1 37 LYS H 1 37 LYS HG2 2.444 . 3.191 2.165 2.035 2.418 . 0 0 "[ . 1 . 2]" 1 877 1 37 LYS H 1 38 LYS H 2.746 . 3.688 2.589 2.539 2.668 . 0 0 "[ . 1 . 2]" 1 878 1 37 LYS H 1 38 LYS H 2.434 . 3.175 2.307 2.247 2.385 . 0 0 "[ . 1 . 2]" 1 879 1 37 LYS H 1 38 LYS HG2 2.770 . 7.500 4.020 3.807 4.177 . 0 0 "[ . 1 . 2]" 1 880 1 37 LYS H 1 40 TYR H 4.199 . 6.403 4.885 4.736 5.040 . 0 0 "[ . 1 . 2]" 1 881 1 37 LYS HA 1 37 LYS QB 2.316 . 2.987 2.338 2.313 2.391 . 0 0 "[ . 1 . 2]" 1 882 1 37 LYS HA 1 37 LYS QD 2.775 . 3.738 1.830 1.789 1.888 0.023 6 0 "[ . 1 . 2]" 1 883 1 37 LYS HA 1 37 LYS QE 2.681 . 3.579 3.696 3.646 3.749 0.170 8 0 "[ . 1 . 2]" 1 884 1 37 LYS HA 1 37 LYS QG 2.480 . 3.249 3.033 2.930 3.077 . 0 0 "[ . 1 . 2]" 1 885 1 37 LYS HA 1 38 LYS H 2.802 . 3.783 3.532 3.507 3.557 . 0 0 "[ . 1 . 2]" 1 886 1 37 LYS HA 1 41 ARG H 3.153 . 4.395 4.087 3.950 4.205 . 0 0 "[ . 1 . 2]" 1 887 1 37 LYS HA 1 40 TYR H 2.999 . 4.123 3.436 3.308 3.539 . 0 0 "[ . 1 . 2]" 1 888 1 37 LYS HA 1 40 TYR HB3 2.968 . 4.069 2.827 2.601 3.060 . 0 0 "[ . 1 . 2]" 1 889 1 37 LYS HA 1 41 ARG H 3.154 . 4.397 4.317 4.096 4.477 0.080 19 0 "[ . 1 . 2]" 1 890 1 37 LYS HA 1 41 ARG HG3 2.608 . 7.500 4.118 3.798 4.434 . 0 0 "[ . 1 . 2]" 1 891 1 37 LYS HB2 1 37 LYS HG2 2.493 . 3.270 2.011 2.004 2.018 . 0 0 "[ . 1 . 2]" 1 892 1 37 LYS QB 1 37 LYS HD3 2.503 . 3.286 2.467 2.446 2.483 . 0 0 "[ . 1 . 2]" 1 893 1 37 LYS HB3 1 38 LYS H 2.179 . 2.772 2.565 2.502 2.713 . 0 0 "[ . 1 . 2]" 1 894 1 37 LYS QD 1 37 LYS QE 2.378 . 3.085 2.029 1.993 2.084 . 0 0 "[ . 1 . 2]" 1 895 1 37 LYS HE2 1 37 LYS HG2 2.698 . 3.608 2.655 2.195 2.942 . 0 0 "[ . 1 . 2]" 1 896 1 37 LYS QE 1 73 THR HB 3.125 . 4.345 4.267 4.130 4.372 0.027 13 0 "[ . 1 . 2]" 1 897 1 37 LYS QE 1 73 THR MG 2.484 . 3.255 1.968 1.830 2.134 . 0 0 "[ . 1 . 2]" 1 898 1 37 LYS QE 1 74 ASP H 3.787 . 5.579 4.749 4.169 5.317 . 0 0 "[ . 1 . 2]" 1 899 1 37 LYS QG 1 38 LYS H 3.395 . 4.836 3.951 3.754 4.142 . 0 0 "[ . 1 . 2]" 1 900 1 37 LYS QG 1 38 LYS HG2 2.421 . 7.500 4.851 4.619 5.114 . 0 0 "[ . 1 . 2]" 1 901 1 37 LYS QG 1 73 THR MG 2.377 . 7.500 3.428 2.883 3.788 . 0 0 "[ . 1 . 2]" 1 902 1 38 LYS H 1 38 LYS HA 2.472 . 3.236 2.829 2.766 2.867 . 0 0 "[ . 1 . 2]" 1 903 1 38 LYS H 1 38 LYS QB 2.378 . 3.085 2.552 2.490 2.689 . 0 0 "[ . 1 . 2]" 1 904 1 38 LYS H 1 38 LYS HD3 2.621 . 3.480 3.276 3.024 3.491 0.011 14 0 "[ . 1 . 2]" 1 905 1 38 LYS H 1 38 LYS QE 3.325 . 4.707 3.899 3.559 4.109 . 0 0 "[ . 1 . 2]" 1 906 1 38 LYS H 1 38 LYS HG2 2.484 . 3.255 2.019 1.839 2.177 . 0 0 "[ . 1 . 2]" 1 907 1 38 LYS H 1 38 LYS HG3 2.815 . 3.805 3.528 3.403 3.675 . 0 0 "[ . 1 . 2]" 1 908 1 38 LYS H 1 39 SER H 2.568 . 3.392 2.595 2.456 2.803 . 0 0 "[ . 1 . 2]" 1 909 1 38 LYS H 1 39 SER HA 4.169 . 6.341 5.214 5.103 5.378 . 0 0 "[ . 1 . 2]" 1 910 1 38 LYS H 1 39 SER HA 3.242 . 4.556 4.449 4.252 4.598 0.042 18 0 "[ . 1 . 2]" 1 911 1 38 LYS H 1 39 SER HB2 3.307 . 7.500 4.809 4.681 5.000 . 0 0 "[ . 1 . 2]" 1 912 1 38 LYS H 1 39 SER HB3 3.372 . 7.500 4.892 4.678 5.164 . 0 0 "[ . 1 . 2]" 1 913 1 38 LYS H 1 40 TYR H 3.330 . 4.716 4.023 3.860 4.262 . 0 0 "[ . 1 . 2]" 1 914 1 38 LYS H 1 40 TYR H 3.302 . 4.665 3.870 3.738 4.055 . 0 0 "[ . 1 . 2]" 1 915 1 38 LYS H 1 41 ARG H 3.465 . 4.965 3.712 3.605 3.797 . 0 0 "[ . 1 . 2]" 1 916 1 38 LYS HA 1 38 LYS HB3 2.152 . 2.731 2.032 2.015 2.046 . 0 0 "[ . 1 . 2]" 1 917 1 38 LYS HA 1 38 LYS HD3 2.284 . 3.436 2.193 2.031 2.364 . 0 0 "[ . 1 . 2]" 1 918 1 38 LYS HA 1 38 LYS QE 3.041 . 4.197 3.916 3.728 4.148 . 0 0 "[ . 1 . 2]" 1 919 1 38 LYS HA 1 38 LYS HG2 2.602 . 3.448 3.187 3.028 3.310 . 0 0 "[ . 1 . 2]" 1 920 1 38 LYS HA 1 38 LYS HG3 2.532 . 7.500 3.821 3.752 3.917 . 0 0 "[ . 1 . 2]" 1 921 1 38 LYS HA 1 39 SER H 2.837 . 3.843 3.519 3.491 3.534 . 0 0 "[ . 1 . 2]" 1 922 1 38 LYS HA 1 40 TYR H 3.420 . 4.882 4.025 3.820 4.363 . 0 0 "[ . 1 . 2]" 1 923 1 38 LYS HA 1 41 ARG H 2.902 . 3.955 3.072 2.847 3.365 . 0 0 "[ . 1 . 2]" 1 924 1 38 LYS HA 1 41 ARG HA 3.053 . 7.500 4.326 4.263 4.405 . 0 0 "[ . 1 . 2]" 1 925 1 38 LYS HA 1 41 ARG HB2 2.944 . 4.028 2.392 2.285 2.491 . 0 0 "[ . 1 . 2]" 1 926 1 38 LYS HA 1 41 ARG HB3 2.880 . 3.917 4.024 3.926 4.086 0.169 10 0 "[ . 1 . 2]" 1 927 1 38 LYS HA 1 41 ARG QD 2.869 . 3.898 2.929 2.560 3.433 . 0 0 "[ . 1 . 2]" 1 928 1 38 LYS HA 1 41 ARG HG2 2.930 . 7.500 4.443 3.986 4.790 . 0 0 "[ . 1 . 2]" 1 929 1 38 LYS HA 1 41 ARG HG3 2.894 . 3.941 2.921 2.358 3.306 . 0 0 "[ . 1 . 2]" 1 930 1 38 LYS QB 1 39 SER HB2 2.928 . 4.000 3.711 3.556 3.823 . 0 0 "[ . 1 . 2]" 1 931 1 38 LYS HB2 1 38 LYS HG2 2.185 . 2.782 2.207 2.173 2.233 . 0 0 "[ . 1 . 2]" 1 932 1 38 LYS QB 1 38 LYS HG3 2.391 . 3.106 2.158 2.151 2.163 . 0 0 "[ . 1 . 2]" 1 933 1 38 LYS QB 1 39 SER HA 2.423 . 7.500 3.817 3.679 3.942 . 0 0 "[ . 1 . 2]" 1 934 1 38 LYS QB 1 40 TYR H 2.842 . 3.851 4.026 3.885 4.172 0.321 1 0 "[ . 1 . 2]" 1 935 1 38 LYS HB2 1 39 SER H 2.394 . 3.110 2.534 2.272 2.659 . 0 0 "[ . 1 . 2]" 1 936 1 38 LYS QD 1 38 LYS QE 1.787 . 2.186 1.887 1.846 1.946 . 0 0 "[ . 1 . 2]" 1 937 1 38 LYS QD 1 42 LYS H 2.754 . 7.500 4.784 4.309 5.217 . 0 0 "[ . 1 . 2]" 1 938 1 38 LYS QD 1 39 SER HA 2.718 . 7.500 6.115 5.932 6.220 . 0 0 "[ . 1 . 2]" 1 939 1 38 LYS QD 1 42 LYS H 2.744 . 7.500 4.912 4.380 5.402 . 0 0 "[ . 1 . 2]" 1 940 1 38 LYS HD3 1 39 SER H 2.826 . 3.824 3.863 3.652 3.941 0.117 12 0 "[ . 1 . 2]" 1 941 1 38 LYS QE 1 38 LYS HG2 2.428 . 3.165 2.440 2.373 2.519 . 0 0 "[ . 1 . 2]" 1 942 1 38 LYS QE 1 38 LYS HG3 2.513 . 3.302 2.670 2.318 3.033 . 0 0 "[ . 1 . 2]" 1 943 1 38 LYS HG3 1 39 SER H 3.204 . 7.500 4.762 4.546 4.932 . 0 0 "[ . 1 . 2]" 1 944 1 39 SER H 1 39 SER HA 2.561 . 3.381 2.780 2.758 2.801 . 0 0 "[ . 1 . 2]" 1 945 1 39 SER H 1 39 SER HB2 2.308 . 2.974 2.403 2.321 2.449 . 0 0 "[ . 1 . 2]" 1 946 1 39 SER H 1 39 SER HB3 2.411 . 3.138 2.676 2.613 2.752 . 0 0 "[ . 1 . 2]" 1 947 1 39 SER H 1 40 TYR H 2.646 . 3.521 2.687 2.603 2.813 . 0 0 "[ . 1 . 2]" 1 948 1 39 SER H 1 41 ARG H 3.457 . 4.950 4.147 4.044 4.307 . 0 0 "[ . 1 . 2]" 1 949 1 39 SER H 1 42 LYS QE 3.354 . 4.760 4.040 3.395 4.726 . 0 0 "[ . 1 . 2]" 1 950 1 39 SER HA 1 39 SER QB 2.202 . 2.808 2.403 2.375 2.431 . 0 0 "[ . 1 . 2]" 1 951 1 39 SER HA 1 40 TYR H 2.945 . 4.029 3.490 3.453 3.537 . 0 0 "[ . 1 . 2]" 1 952 1 39 SER HA 1 42 LYS H 3.009 . 7.500 4.500 3.978 5.036 . 0 0 "[ . 1 . 2]" 1 953 1 39 SER HA 1 42 LYS QE 3.050 . 4.213 2.409 1.882 2.880 0.005 19 0 "[ . 1 . 2]" 1 954 1 39 SER HA 1 42 LYS HG2 3.188 . 4.459 3.144 2.435 3.711 . 0 0 "[ . 1 . 2]" 1 955 1 39 SER HA 1 42 LYS HG3 3.072 . 4.252 4.026 3.649 4.314 0.062 4 0 "[ . 1 . 2]" 1 956 1 39 SER HA 1 43 LEU MD1 2.737 . 7.500 4.629 4.044 5.147 . 0 0 "[ . 1 . 2]" 1 957 1 39 SER HB2 1 40 TYR H 2.836 . 3.842 3.854 3.744 3.901 0.059 14 0 "[ . 1 . 2]" 1 958 1 39 SER HB2 1 42 LYS QE 3.242 . 4.556 4.249 3.689 4.575 0.019 11 0 "[ . 1 . 2]" 1 959 1 39 SER HB2 1 72 LEU QD 3.201 . 4.482 4.359 4.322 4.405 . 0 0 "[ . 1 . 2]" 1 960 1 39 SER HB3 1 40 TYR H 2.561 . 3.381 2.726 2.514 2.866 . 0 0 "[ . 1 . 2]" 1 961 1 39 SER HB3 1 42 LYS QE 3.191 . 7.500 5.083 4.393 5.523 . 0 0 "[ . 1 . 2]" 1 962 1 40 TYR H 1 40 TYR HA 2.714 . 3.635 2.868 2.845 2.884 . 0 0 "[ . 1 . 2]" 1 963 1 40 TYR H 1 40 TYR HB3 2.674 . 3.568 2.210 2.140 2.265 . 0 0 "[ . 1 . 2]" 1 964 1 40 TYR H 1 41 ARG H 2.738 . 3.675 2.469 2.399 2.550 . 0 0 "[ . 1 . 2]" 1 965 1 40 TYR H 1 41 ARG HA 3.395 . 7.500 5.072 5.027 5.124 . 0 0 "[ . 1 . 2]" 1 966 1 40 TYR H 1 41 ARG HG3 3.453 . 4.943 4.097 3.937 4.321 . 0 0 "[ . 1 . 2]" 1 967 1 40 TYR H 1 42 LYS H 3.748 . 5.504 4.630 4.289 4.892 . 0 0 "[ . 1 . 2]" 1 968 1 40 TYR H 1 42 LYS QE 2.636 . 7.500 5.109 4.559 5.519 . 0 0 "[ . 1 . 2]" 1 969 1 40 TYR H 1 69 HIS HB2 3.587 . 5.195 5.183 4.989 5.255 0.060 5 0 "[ . 1 . 2]" 1 970 1 40 TYR HA 1 40 TYR HB2 2.385 . 3.096 2.016 1.995 2.055 . 0 0 "[ . 1 . 2]" 1 971 1 40 TYR HA 1 41 ARG H 2.915 . 3.977 3.512 3.477 3.550 . 0 0 "[ . 1 . 2]" 1 972 1 40 TYR HA 1 41 ARG HA 3.191 . 4.464 4.348 4.274 4.404 . 0 0 "[ . 1 . 2]" 1 973 1 40 TYR HA 1 42 LYS H 3.333 . 4.722 4.524 4.321 4.663 . 0 0 "[ . 1 . 2]" 1 974 1 40 TYR HA 1 43 LEU QB 2.597 . 3.440 3.206 2.883 3.403 . 0 0 "[ . 1 . 2]" 1 975 1 40 TYR HA 1 43 LEU MD1 2.688 . 3.591 1.917 1.714 2.120 0.071 19 0 "[ . 1 . 2]" 1 976 1 40 TYR HA 1 43 LEU MD1 2.207 . 2.816 1.777 1.665 1.879 . 0 0 "[ . 1 . 2]" 1 977 1 40 TYR HA 1 65 ILE HB 3.392 . 4.830 3.266 3.012 3.460 . 0 0 "[ . 1 . 2]" 1 978 1 40 TYR HB2 1 94 GLN HE21 3.001 . 7.500 5.985 5.493 6.412 . 0 0 "[ . 1 . 2]" 1 979 1 40 TYR HB2 1 65 ILE HA 3.057 . 4.225 3.675 3.552 3.803 . 0 0 "[ . 1 . 2]" 1 980 1 40 TYR HB2 1 65 ILE MG 3.147 . 7.500 5.550 4.891 6.033 . 0 0 "[ . 1 . 2]" 1 981 1 40 TYR HB3 1 41 ARG H 2.983 . 4.095 2.689 2.423 2.928 . 0 0 "[ . 1 . 2]" 1 982 1 41 ARG H 1 41 ARG HA 2.497 . 3.276 2.786 2.745 2.820 . 0 0 "[ . 1 . 2]" 1 983 1 41 ARG H 1 41 ARG HB2 2.666 . 3.554 2.451 2.367 2.528 . 0 0 "[ . 1 . 2]" 1 984 1 41 ARG H 1 41 ARG HB3 2.619 . 7.500 3.584 3.562 3.608 . 0 0 "[ . 1 . 2]" 1 985 1 41 ARG H 1 41 ARG HB3 2.195 . 7.500 3.050 2.851 3.115 . 0 0 "[ . 1 . 2]" 1 986 1 41 ARG H 1 41 ARG QD 2.966 . 4.066 3.992 3.901 4.113 0.047 19 0 "[ . 1 . 2]" 1 987 1 41 ARG H 1 41 ARG HG2 2.640 . 3.511 3.306 2.993 3.416 . 0 0 "[ . 1 . 2]" 1 988 1 41 ARG H 1 41 ARG HG3 2.737 . 3.674 2.331 2.254 2.455 . 0 0 "[ . 1 . 2]" 1 989 1 41 ARG H 1 42 LYS H 2.698 . 3.608 2.945 2.738 3.151 . 0 0 "[ . 1 . 2]" 1 990 1 41 ARG H 1 42 LYS QE 2.856 . 7.500 5.270 4.680 5.699 . 0 0 "[ . 1 . 2]" 1 991 1 41 ARG H 1 43 LEU MD1 3.076 . 4.259 4.487 4.414 4.540 0.281 5 0 "[ . 1 . 2]" 1 992 1 41 ARG H 1 43 LEU MD1 2.947 . 4.032 3.877 3.789 3.979 . 0 0 "[ . 1 . 2]" 1 993 1 41 ARG H 1 44 ALA MB 3.113 . 4.324 4.246 4.082 4.438 0.114 8 0 "[ . 1 . 2]" 1 994 1 41 ARG H 1 45 LEU MD1 3.585 . 5.191 5.188 5.156 5.216 0.025 3 0 "[ . 1 . 2]" 1 995 1 41 ARG HA 1 41 ARG HB2 2.642 . 3.515 3.003 2.991 3.012 . 0 0 "[ . 1 . 2]" 1 996 1 41 ARG HA 1 41 ARG HB3 2.597 . 3.440 2.493 2.470 2.537 . 0 0 "[ . 1 . 2]" 1 997 1 41 ARG HA 1 41 ARG QD 2.781 . 3.748 3.846 3.786 3.943 0.195 19 0 "[ . 1 . 2]" 1 998 1 41 ARG HA 1 41 ARG HG2 2.172 . 2.762 2.359 2.227 2.446 . 0 0 "[ . 1 . 2]" 1 999 1 41 ARG HA 1 41 ARG HG3 2.453 . 3.205 3.123 3.023 3.293 0.088 19 0 "[ . 1 . 2]" 1 1000 1 41 ARG HA 1 42 LYS H 2.833 . 3.836 3.564 3.543 3.587 . 0 0 "[ . 1 . 2]" 1 1001 1 41 ARG HA 1 43 LEU H 3.479 . 4.992 3.950 3.788 4.085 . 0 0 "[ . 1 . 2]" 1 1002 1 41 ARG HA 1 44 ALA H 2.964 . 4.062 3.228 3.047 3.383 . 0 0 "[ . 1 . 2]" 1 1003 1 41 ARG HA 1 44 ALA MB 2.280 . 2.930 2.379 2.227 2.524 . 0 0 "[ . 1 . 2]" 1 1004 1 41 ARG HA 1 45 LEU H 3.337 . 4.729 3.987 3.918 4.079 . 0 0 "[ . 1 . 2]" 1 1005 1 41 ARG HA 1 45 LEU MD1 2.903 . 3.956 3.275 3.192 3.367 . 0 0 "[ . 1 . 2]" 1 1006 1 41 ARG HA 1 66 ASN HA 2.985 . 7.500 5.172 4.972 5.379 . 0 0 "[ . 1 . 2]" 1 1007 1 41 ARG HA 1 94 GLN QE 2.932 . 7.500 7.526 7.044 7.651 0.151 13 0 "[ . 1 . 2]" 1 1008 1 41 ARG QB 1 45 LEU H 3.133 . 4.360 4.554 4.436 4.642 0.282 14 0 "[ . 1 . 2]" 1 1009 1 41 ARG HB2 1 42 LYS H 2.937 . 4.015 2.257 2.097 2.440 . 0 0 "[ . 1 . 2]" 1 1010 1 41 ARG HB3 1 41 ARG QD 2.741 . 3.680 2.291 2.195 2.375 . 0 0 "[ . 1 . 2]" 1 1011 1 41 ARG HB3 1 41 ARG HD2 2.153 . 2.732 2.239 2.163 2.379 . 0 0 "[ . 1 . 2]" 1 1012 1 41 ARG HB3 1 41 ARG HG3 2.638 . 3.508 2.992 2.943 3.001 . 0 0 "[ . 1 . 2]" 1 1013 1 41 ARG HB3 1 42 LYS H 2.876 . 3.910 3.157 2.923 3.436 . 0 0 "[ . 1 . 2]" 1 1014 1 41 ARG HB3 1 42 LYS H 2.080 . 2.621 2.442 2.383 2.514 . 0 0 "[ . 1 . 2]" 1 1015 1 41 ARG HB3 1 45 LEU MD1 2.699 . 3.609 3.011 2.873 3.083 . 0 0 "[ . 1 . 2]" 1 1016 1 41 ARG QD 1 41 ARG HG2 2.386 . 3.097 2.333 2.273 2.419 . 0 0 "[ . 1 . 2]" 1 1017 1 41 ARG QD 1 41 ARG HG3 2.338 . 3.022 2.341 2.156 2.406 . 0 0 "[ . 1 . 2]" 1 1018 1 41 ARG QD 1 42 LYS H 3.289 . 4.641 4.441 4.218 4.736 0.095 19 0 "[ . 1 . 2]" 1 1019 1 41 ARG QD 1 45 LEU MD1 3.075 . 4.257 4.225 4.063 4.327 0.070 13 0 "[ . 1 . 2]" 1 1020 1 41 ARG HG2 1 42 LYS H 3.053 . 7.500 4.763 4.685 4.841 . 0 0 "[ . 1 . 2]" 1 1021 1 41 ARG HG2 1 45 LEU MD1 3.159 . 4.406 4.408 4.252 4.498 0.092 3 0 "[ . 1 . 2]" 1 1022 1 41 ARG HG2 1 94 GLN QE 2.923 . 7.500 7.237 6.783 7.576 0.076 7 0 "[ . 1 . 2]" 1 1023 1 41 ARG HG3 1 42 LYS H 3.039 . 4.194 4.254 4.161 4.341 0.147 10 0 "[ . 1 . 2]" 1 1024 1 42 LYS H 1 42 LYS HA 2.419 . 3.151 2.801 2.782 2.818 . 0 0 "[ . 1 . 2]" 1 1025 1 42 LYS H 1 42 LYS HB3 2.385 . 3.096 2.550 2.454 2.628 . 0 0 "[ . 1 . 2]" 1 1026 1 42 LYS H 1 42 LYS QE 3.620 . 5.258 3.942 3.190 4.421 . 0 0 "[ . 1 . 2]" 1 1027 1 42 LYS H 1 42 LYS HG2 2.885 . 3.925 2.113 1.978 2.270 . 0 0 "[ . 1 . 2]" 1 1028 1 42 LYS H 1 42 LYS HG3 2.577 . 3.407 3.352 3.111 3.502 0.095 19 0 "[ . 1 . 2]" 1 1029 1 42 LYS H 1 43 LEU H 2.606 . 3.455 2.663 2.591 2.764 . 0 0 "[ . 1 . 2]" 1 1030 1 42 LYS H 1 43 LEU MD1 3.378 . 7.500 4.964 4.588 5.274 . 0 0 "[ . 1 . 2]" 1 1031 1 42 LYS H 1 43 LEU MD1 2.831 . 7.500 4.286 4.113 4.422 . 0 0 "[ . 1 . 2]" 1 1032 1 42 LYS H 1 44 ALA H 3.336 . 4.727 4.017 3.869 4.164 . 0 0 "[ . 1 . 2]" 1 1033 1 42 LYS H 1 45 LEU H 3.840 . 5.683 5.343 5.242 5.441 . 0 0 "[ . 1 . 2]" 1 1034 1 42 LYS H 1 45 LEU MD1 3.145 . 4.382 4.024 3.843 4.101 . 0 0 "[ . 1 . 2]" 1 1035 1 42 LYS H 1 45 LEU QD 3.470 . 4.975 3.764 3.642 3.849 . 0 0 "[ . 1 . 2]" 1 1036 1 42 LYS H 1 45 LEU MD2 3.364 . 4.778 4.531 4.328 4.662 . 0 0 "[ . 1 . 2]" 1 1037 1 42 LYS HA 1 42 LYS HG2 2.571 . 7.500 3.734 3.679 3.773 . 0 0 "[ . 1 . 2]" 1 1038 1 42 LYS HA 1 42 LYS HG3 2.478 . 7.500 3.782 3.729 3.834 . 0 0 "[ . 1 . 2]" 1 1039 1 42 LYS HA 1 43 LEU H 2.848 . 3.862 3.398 3.343 3.440 . 0 0 "[ . 1 . 2]" 1 1040 1 42 LYS HA 1 43 LEU H 2.775 . 3.738 2.757 2.737 2.779 . 0 0 "[ . 1 . 2]" 1 1041 1 42 LYS HA 1 44 ALA H 2.796 . 3.773 3.288 3.193 3.372 . 0 0 "[ . 1 . 2]" 1 1042 1 42 LYS HA 1 44 ALA H 3.364 . 4.779 4.173 3.893 4.425 . 0 0 "[ . 1 . 2]" 1 1043 1 42 LYS HA 1 45 LEU H 2.777 . 3.741 3.403 3.349 3.433 . 0 0 "[ . 1 . 2]" 1 1044 1 42 LYS HA 1 45 LEU H 3.065 . 4.239 4.175 3.976 4.309 0.070 18 0 "[ . 1 . 2]" 1 1045 1 42 LYS HA 1 45 LEU MD1 2.122 . 2.685 2.726 2.391 2.801 0.116 18 0 "[ . 1 . 2]" 1 1046 1 42 LYS HA 1 45 LEU MD2 1.934 . 2.402 2.300 2.050 2.458 0.056 18 0 "[ . 1 . 2]" 1 1047 1 42 LYS HA 1 45 LEU HG 2.511 . 7.500 4.455 4.162 4.658 . 0 0 "[ . 1 . 2]" 1 1048 1 42 LYS QB 1 42 LYS HG2 2.318 . 2.990 2.359 2.304 2.397 . 0 0 "[ . 1 . 2]" 1 1049 1 42 LYS QB 1 42 LYS HG3 2.332 . 3.012 2.328 2.289 2.380 . 0 0 "[ . 1 . 2]" 1 1050 1 42 LYS QB 1 46 LYS H 3.416 . 7.500 4.606 4.210 4.976 . 0 0 "[ . 1 . 2]" 1 1051 1 42 LYS QE 1 42 LYS HG2 2.630 . 3.494 2.380 2.277 2.500 . 0 0 "[ . 1 . 2]" 1 1052 1 42 LYS QE 1 42 LYS HG3 2.621 . 3.479 2.840 2.357 3.418 . 0 0 "[ . 1 . 2]" 1 1053 1 42 LYS HG2 1 43 LEU H 3.144 . 4.380 2.950 2.641 3.145 . 0 0 "[ . 1 . 2]" 1 1054 1 42 LYS HG3 1 43 LEU H 3.198 . 4.477 2.903 2.656 3.264 . 0 0 "[ . 1 . 2]" 1 1055 1 42 LYS HG3 1 43 LEU H 2.474 . 3.239 2.112 1.955 2.404 . 0 0 "[ . 1 . 2]" 1 1056 1 43 LEU H 1 43 LEU HA 2.791 . 3.765 2.916 2.903 2.934 . 0 0 "[ . 1 . 2]" 1 1057 1 43 LEU H 1 43 LEU QB . . 2.550 2.181 1.985 2.526 . 0 0 "[ . 1 . 2]" 1 1058 1 43 LEU H 1 43 LEU MD1 2.551 . 3.364 3.216 3.027 3.360 . 0 0 "[ . 1 . 2]" 1 1059 1 43 LEU H 1 43 LEU MD1 2.314 . 2.983 3.058 2.920 3.154 0.171 2 0 "[ . 1 . 2]" 1 1060 1 43 LEU H 1 43 LEU MD2 2.290 . 7.500 3.599 3.467 3.709 . 0 0 "[ . 1 . 2]" 1 1061 1 43 LEU H 1 44 ALA H 2.656 . 3.538 2.151 2.076 2.195 . 0 0 "[ . 1 . 2]" 1 1062 1 43 LEU H 1 44 ALA HA 3.187 . 7.500 4.787 4.761 4.825 . 0 0 "[ . 1 . 2]" 1 1063 1 43 LEU H 1 44 ALA MB 2.792 . 3.767 3.832 3.786 3.851 0.084 11 0 "[ . 1 . 2]" 1 1064 1 43 LEU H 1 45 LEU H 3.532 . 5.092 4.422 4.266 4.522 . 0 0 "[ . 1 . 2]" 1 1065 1 43 LEU H 1 45 LEU MD1 3.352 . 4.756 4.302 4.102 4.377 . 0 0 "[ . 1 . 2]" 1 1066 1 43 LEU H 1 45 LEU QD 3.114 . 4.326 3.762 3.620 3.854 . 0 0 "[ . 1 . 2]" 1 1067 1 43 LEU H 1 45 LEU MD2 3.319 . 4.696 4.156 3.974 4.334 . 0 0 "[ . 1 . 2]" 1 1068 1 43 LEU H 1 65 ILE MG 3.026 . 7.500 5.744 5.007 6.256 . 0 0 "[ . 1 . 2]" 1 1069 1 43 LEU HA 1 43 LEU QB 2.523 . 3.319 2.250 2.178 2.370 . 0 0 "[ . 1 . 2]" 1 1070 1 43 LEU HA 1 43 LEU MD1 2.541 . 7.500 3.699 3.544 3.928 . 0 0 "[ . 1 . 2]" 1 1071 1 43 LEU HA 1 43 LEU MD2 2.133 . 2.702 2.530 2.260 2.705 0.003 15 0 "[ . 1 . 2]" 1 1072 1 43 LEU HA 1 44 ALA H 2.926 . 3.996 3.444 3.393 3.508 . 0 0 "[ . 1 . 2]" 1 1073 1 43 LEU HA 1 46 LYS H 2.585 . 3.420 3.057 2.950 3.178 . 0 0 "[ . 1 . 2]" 1 1074 1 43 LEU HA 1 46 LYS HA 3.027 . 7.500 4.300 4.183 4.413 . 0 0 "[ . 1 . 2]" 1 1075 1 43 LEU HA 1 46 LYS HD3 3.201 . 4.482 3.384 1.878 4.422 0.042 1 0 "[ . 1 . 2]" 1 1076 1 43 LEU HA 1 46 LYS QE 3.079 . 4.264 3.561 2.123 4.118 . 0 0 "[ . 1 . 2]" 1 1077 1 43 LEU HA 1 46 LYS HG2 3.265 . 4.598 3.959 2.367 4.754 0.156 10 0 "[ . 1 . 2]" 1 1078 1 43 LEU QB 1 43 LEU MD1 2.065 . 2.598 2.073 1.960 2.201 . 0 0 "[ . 1 . 2]" 1 1079 1 43 LEU QB 1 43 LEU MD2 2.404 . 3.126 2.294 2.118 2.459 . 0 0 "[ . 1 . 2]" 1 1080 1 43 LEU QB 1 44 ALA H 3.080 . 3.465 2.877 2.396 3.245 . 0 0 "[ . 1 . 2]" 1 1081 1 43 LEU QB 1 44 ALA H 2.751 . 3.697 2.814 2.385 3.123 . 0 0 "[ . 1 . 2]" 1 1082 1 43 LEU QB 1 44 ALA MB 2.515 . 7.500 4.046 3.636 4.364 . 0 0 "[ . 1 . 2]" 1 1083 1 43 LEU QB 1 65 ILE MD 3.068 . 7.500 3.239 1.753 4.227 0.047 16 0 "[ . 1 . 2]" 1 1084 1 43 LEU QD 1 48 HIS H 3.510 . 5.050 4.920 4.607 5.204 0.154 20 0 "[ . 1 . 2]" 1 1085 1 43 LEU MD1 1 44 ALA H 2.996 . 4.118 3.324 2.719 4.024 . 0 0 "[ . 1 . 2]" 1 1086 1 43 LEU MD1 1 47 TYR HB2 3.283 . 4.630 3.640 3.451 3.933 . 0 0 "[ . 1 . 2]" 1 1087 1 43 LEU MD1 1 46 LYS H 3.667 . 5.847 5.332 4.675 6.169 0.322 3 0 "[ . 1 . 2]" 1 1088 1 43 LEU MD1 1 47 TYR QD 3.107 . 4.314 3.669 3.294 4.225 . 0 0 "[ . 1 . 2]" 1 1089 1 43 LEU MD1 1 47 TYR QE 2.970 . 4.073 4.105 3.770 4.217 0.144 13 0 "[ . 1 . 2]" 1 1090 1 43 LEU MD1 1 65 ILE HA 3.089 . 4.282 3.553 3.183 4.028 . 0 0 "[ . 1 . 2]" 1 1091 1 43 LEU MD1 1 65 ILE HB 2.461 . 3.218 1.812 1.663 2.059 0.041 10 0 "[ . 1 . 2]" 1 1092 1 43 LEU MD1 1 65 ILE HG13 2.599 . 3.443 2.954 2.838 3.132 . 0 0 "[ . 1 . 2]" 1 1093 1 43 LEU MD1 1 94 GLN QE 3.280 . 7.500 7.543 7.140 7.756 0.256 19 0 "[ . 1 . 2]" 1 1094 1 43 LEU MD2 1 44 ALA H 2.561 . 7.500 4.024 3.785 4.318 . 0 0 "[ . 1 . 2]" 1 1095 1 43 LEU MD2 1 46 LYS H 2.724 . 3.651 3.749 3.666 3.904 0.253 3 0 "[ . 1 . 2]" 1 1096 1 43 LEU MD2 1 47 TYR H 2.899 . 3.950 4.038 3.778 4.324 0.374 7 0 "[ . 1 . 2]" 1 1097 1 43 LEU MD2 1 46 LYS H 2.710 . 7.500 4.812 4.296 5.604 . 0 0 "[ . 1 . 2]" 1 1098 1 43 LEU MD2 1 46 LYS HD2 2.576 . 3.405 2.589 1.985 3.424 0.019 4 0 "[ . 1 . 2]" 1 1099 1 43 LEU MD2 1 46 LYS HD3 2.744 . 3.685 3.103 1.951 3.853 0.168 6 0 "[ . 1 . 2]" 1 1100 1 43 LEU MD2 1 47 TYR QD 2.350 . 3.041 2.336 1.900 3.062 0.021 18 0 "[ . 1 . 2]" 1 1101 1 43 LEU MD2 1 47 TYR QE 2.129 . 2.696 1.977 1.718 2.084 . 0 0 "[ . 1 . 2]" 1 1102 1 44 ALA H 1 44 ALA HA 2.524 . 3.320 2.819 2.747 2.873 . 0 0 "[ . 1 . 2]" 1 1103 1 44 ALA H 1 44 ALA MB 2.019 . 2.528 2.229 2.179 2.272 . 0 0 "[ . 1 . 2]" 1 1104 1 44 ALA H 1 45 LEU H 2.563 . 3.384 2.857 2.697 3.047 . 0 0 "[ . 1 . 2]" 1 1105 1 44 ALA H 1 45 LEU HB2 3.234 . 7.500 6.408 6.188 6.608 . 0 0 "[ . 1 . 2]" 1 1106 1 44 ALA H 1 45 LEU HB2 2.900 . 7.500 4.685 4.406 4.838 . 0 0 "[ . 1 . 2]" 1 1107 1 44 ALA H 1 45 LEU MD1 3.214 . 4.505 3.469 3.358 3.593 . 0 0 "[ . 1 . 2]" 1 1108 1 44 ALA H 1 45 LEU QD 2.731 . 3.663 3.180 2.979 3.377 . 0 0 "[ . 1 . 2]" 1 1109 1 44 ALA H 1 45 LEU MD2 3.185 . 4.453 3.712 3.307 4.103 . 0 0 "[ . 1 . 2]" 1 1110 1 44 ALA H 1 45 LEU HG 3.306 . 7.500 6.199 5.927 6.463 . 0 0 "[ . 1 . 2]" 1 1111 1 44 ALA H 1 46 LYS H 3.199 . 4.478 3.565 3.366 3.924 . 0 0 "[ . 1 . 2]" 1 1112 1 44 ALA H 1 47 TYR QD 3.658 . 5.331 4.955 4.553 5.201 . 0 0 "[ . 1 . 2]" 1 1113 1 44 ALA H 1 65 ILE MD 2.659 . 3.543 3.329 2.836 3.602 0.059 11 0 "[ . 1 . 2]" 1 1114 1 44 ALA H 1 65 ILE MG 2.913 . 7.500 5.274 4.851 5.584 . 0 0 "[ . 1 . 2]" 1 1115 1 44 ALA HA 1 44 ALA MB 1.956 . 2.434 2.118 2.107 2.124 . 0 0 "[ . 1 . 2]" 1 1116 1 44 ALA HA 1 45 LEU H 2.939 . 4.018 3.608 3.585 3.626 . 0 0 "[ . 1 . 2]" 1 1117 1 44 ALA HA 1 46 LYS H 2.780 . 3.746 3.771 3.678 3.918 0.172 3 0 "[ . 1 . 2]" 1 1118 1 44 ALA HA 1 47 TYR H 2.809 . 3.796 3.092 3.036 3.174 . 0 0 "[ . 1 . 2]" 1 1119 1 44 ALA HA 1 47 TYR H 3.026 . 4.170 3.514 3.388 3.733 . 0 0 "[ . 1 . 2]" 1 1120 1 44 ALA HA 1 47 TYR HB2 3.157 . 4.403 3.394 3.162 3.635 . 0 0 "[ . 1 . 2]" 1 1121 1 44 ALA HA 1 47 TYR QD 2.692 . 7.500 4.039 3.683 4.669 . 0 0 "[ . 1 . 2]" 1 1122 1 44 ALA HA 1 65 ILE MG 2.436 . 7.500 3.503 3.289 3.753 . 0 0 "[ . 1 . 2]" 1 1123 1 44 ALA HA 1 66 ASN HA 3.229 . 4.532 4.635 4.571 4.670 0.138 9 0 "[ . 1 . 2]" 1 1124 1 44 ALA HA 1 65 ILE MD 2.239 . 2.866 1.790 1.545 2.314 0.067 10 0 "[ . 1 . 2]" 1 1125 1 44 ALA MB 1 45 LEU H 2.252 . 2.886 2.219 2.101 2.322 . 0 0 "[ . 1 . 2]" 1 1126 1 44 ALA MB 1 45 LEU HA 2.533 . 7.500 3.789 3.633 3.863 . 0 0 "[ . 1 . 2]" 1 1127 1 44 ALA MB 1 45 LEU HB3 2.587 . 7.500 3.993 3.939 4.095 . 0 0 "[ . 1 . 2]" 1 1128 1 44 ALA MB 1 46 LYS H 2.918 . 3.983 3.940 3.855 4.102 0.119 2 0 "[ . 1 . 2]" 1 1129 1 44 ALA MB 1 47 TYR H 3.122 . 7.500 4.505 4.376 4.672 . 0 0 "[ . 1 . 2]" 1 1130 1 44 ALA MB 1 66 ASN HA 2.722 . 3.648 3.905 3.722 4.062 0.414 8 0 "[ . 1 . 2]" 1 1131 1 44 ALA MB 1 66 ASN HD21 3.625 . 7.500 6.127 5.840 6.299 . 0 0 "[ . 1 . 2]" 1 1132 1 44 ALA MB 1 66 ASN HA 3.317 . 4.692 4.365 4.054 4.733 0.041 7 0 "[ . 1 . 2]" 1 1133 1 44 ALA MB 1 69 HIS QB 3.048 . 7.500 4.892 4.557 5.326 . 0 0 "[ . 1 . 2]" 1 1134 1 44 ALA MB 1 94 GLN HE22 2.727 . 7.500 6.075 5.501 6.347 . 0 0 "[ . 1 . 2]" 1 1135 1 45 LEU H 1 45 LEU HA 2.390 . 3.104 2.845 2.818 2.873 . 0 0 "[ . 1 . 2]" 1 1136 1 45 LEU H 1 45 LEU HB2 2.146 . 7.500 3.668 3.641 3.690 . 0 0 "[ . 1 . 2]" 1 1137 1 45 LEU H 1 45 LEU HB3 2.319 . 2.991 2.980 2.943 3.012 0.021 14 0 "[ . 1 . 2]" 1 1138 1 45 LEU H 1 45 LEU MD2 2.369 . 3.071 2.253 2.081 2.432 . 0 0 "[ . 1 . 2]" 1 1139 1 45 LEU H 1 45 LEU HG 2.428 . 7.500 3.783 3.741 3.850 . 0 0 "[ . 1 . 2]" 1 1140 1 45 LEU H 1 46 LYS H 2.503 . 3.286 2.606 2.481 2.836 . 0 0 "[ . 1 . 2]" 1 1141 1 45 LEU H 1 46 LYS HA 3.394 . 7.500 5.139 5.017 5.282 . 0 0 "[ . 1 . 2]" 1 1142 1 45 LEU H 1 47 TYR H 3.308 . 4.676 4.261 4.155 4.423 . 0 0 "[ . 1 . 2]" 1 1143 1 45 LEU HA 1 45 LEU HB2 2.207 . 2.816 2.551 2.511 2.577 . 0 0 "[ . 1 . 2]" 1 1144 1 45 LEU HA 1 45 LEU HB3 2.118 . 2.679 2.305 2.277 2.345 . 0 0 "[ . 1 . 2]" 1 1145 1 45 LEU HA 1 45 LEU QD 2.087 . 7.500 3.098 3.084 3.122 . 0 0 "[ . 1 . 2]" 1 1146 1 45 LEU HA 1 45 LEU HG 2.564 . 7.500 4.284 4.273 4.292 . 0 0 "[ . 1 . 2]" 1 1147 1 45 LEU HA 1 46 LYS H 2.393 . 3.109 2.895 2.705 3.035 . 0 0 "[ . 1 . 2]" 1 1148 1 45 LEU HA 1 46 LYS HA 2.927 . 7.500 4.638 4.477 4.843 . 0 0 "[ . 1 . 2]" 1 1149 1 45 LEU HA 1 47 TYR H 2.913 . 3.974 3.851 3.529 4.188 0.214 1 0 "[ . 1 . 2]" 1 1150 1 45 LEU HA 1 48 HIS H 2.927 . 3.998 3.219 2.881 3.557 . 0 0 "[ . 1 . 2]" 1 1151 1 45 LEU HA 1 48 HIS HA 3.060 . 4.231 4.004 3.811 4.239 0.008 18 0 "[ . 1 . 2]" 1 1152 1 45 LEU HA 1 48 HIS QB 2.876 . 3.677 2.060 1.749 2.448 0.093 9 0 "[ . 1 . 2]" 1 1153 1 45 LEU HA 1 48 HIS HD2 2.893 . 7.500 5.077 4.252 6.233 . 0 0 "[ . 1 . 2]" 1 1154 1 45 LEU HA 1 52 ASN HD22 3.657 . 5.329 4.881 4.455 5.177 . 0 0 "[ . 1 . 2]" 1 1155 1 45 LEU HB2 1 45 LEU MD1 2.229 . 7.500 3.162 3.135 3.185 . 0 0 "[ . 1 . 2]" 1 1156 1 45 LEU HB2 1 46 LYS H 2.515 . 7.500 3.908 3.805 4.012 . 0 0 "[ . 1 . 2]" 1 1157 1 45 LEU HB2 1 46 LYS H 2.704 . 7.500 3.917 3.806 4.054 . 0 0 "[ . 1 . 2]" 1 1158 1 45 LEU HB2 1 48 HIS H 3.178 . 4.441 4.327 4.178 4.469 0.028 1 0 "[ . 1 . 2]" 1 1159 1 45 LEU HB3 1 45 LEU MD1 2.069 . 2.604 2.266 2.207 2.316 . 0 0 "[ . 1 . 2]" 1 1160 1 45 LEU HB3 1 45 LEU HG 2.280 . 2.930 2.546 2.513 2.579 . 0 0 "[ . 1 . 2]" 1 1161 1 45 LEU HB3 1 46 LYS H 2.653 . 7.500 4.268 4.177 4.361 . 0 0 "[ . 1 . 2]" 1 1162 1 45 LEU QD 1 45 LEU HG 2.065 . 2.598 1.885 1.882 1.888 . 0 0 "[ . 1 . 2]" 1 1163 1 45 LEU MD1 1 45 LEU HG 1.816 . 2.228 2.112 2.106 2.117 . 0 0 "[ . 1 . 2]" 1 1164 1 45 LEU MD1 1 46 LYS H 2.666 . 7.500 3.687 3.551 3.976 . 0 0 "[ . 1 . 2]" 1 1165 1 45 LEU MD1 1 47 TYR H 3.455 . 7.500 5.343 5.213 5.500 . 0 0 "[ . 1 . 2]" 1 1166 1 45 LEU MD2 1 45 LEU HG 1.830 . 2.249 2.121 2.115 2.124 . 0 0 "[ . 1 . 2]" 1 1167 1 45 LEU MD2 1 46 LYS H 2.547 . 3.358 2.187 2.025 2.340 . 0 0 "[ . 1 . 2]" 1 1168 1 45 LEU MD2 1 47 TYR H 3.161 . 4.410 3.301 3.150 3.433 . 0 0 "[ . 1 . 2]" 1 1169 1 45 LEU MD2 1 48 HIS H 3.447 . 4.932 4.254 4.065 4.493 . 0 0 "[ . 1 . 2]" 1 1170 1 45 LEU MD2 1 48 HIS HA 3.492 . 7.500 6.861 6.600 7.170 . 0 0 "[ . 1 . 2]" 1 1171 1 45 LEU MD2 1 48 HIS QB 2.881 . 7.500 4.658 4.350 5.020 . 0 0 "[ . 1 . 2]" 1 1172 1 45 LEU MD2 1 51 LYS HD3 2.711 . 7.500 4.162 3.224 5.023 . 0 0 "[ . 1 . 2]" 1 1173 1 45 LEU MD2 1 51 LYS QE 2.700 . 3.611 3.618 3.258 3.738 0.127 3 0 "[ . 1 . 2]" 1 1174 1 45 LEU HG 1 46 LYS H 2.881 . 7.500 4.855 4.708 4.998 . 0 0 "[ . 1 . 2]" 1 1175 1 45 LEU HG 1 46 LYS HA 3.093 . 7.500 5.641 5.566 5.736 . 0 0 "[ . 1 . 2]" 1 1176 1 46 LYS H 1 46 LYS HA 2.432 . 3.171 2.893 2.806 2.940 . 0 0 "[ . 1 . 2]" 1 1177 1 46 LYS H 1 46 LYS HB3 2.218 . 2.833 2.348 2.044 2.986 0.153 3 0 "[ . 1 . 2]" 1 1178 1 46 LYS H 1 46 LYS HD2 3.302 . 4.665 4.211 3.215 4.705 0.040 1 0 "[ . 1 . 2]" 1 1179 1 46 LYS H 1 46 LYS HD2 3.281 . 4.626 4.150 3.171 4.643 0.017 1 0 "[ . 1 . 2]" 1 1180 1 46 LYS H 1 46 LYS HD3 3.166 . 4.419 4.317 3.790 4.529 0.110 12 0 "[ . 1 . 2]" 1 1181 1 46 LYS H 1 46 LYS QE 3.217 . 7.500 5.464 4.384 5.798 . 0 0 "[ . 1 . 2]" 1 1182 1 46 LYS H 1 46 LYS QG 3.033 . 4.183 3.567 1.875 4.070 0.008 2 0 "[ . 1 . 2]" 1 1183 1 46 LYS H 1 47 TYR H 2.600 . 3.445 2.304 2.199 2.600 . 0 0 "[ . 1 . 2]" 1 1184 1 46 LYS H 1 47 TYR H 2.328 . 3.006 2.044 1.871 2.300 . 0 0 "[ . 1 . 2]" 1 1185 1 46 LYS H 1 47 TYR HB2 4.043 . 6.086 4.362 4.228 4.663 . 0 0 "[ . 1 . 2]" 1 1186 1 46 LYS H 1 47 TYR HB2 3.266 . 4.600 3.536 3.289 3.706 . 0 0 "[ . 1 . 2]" 1 1187 1 46 LYS H 1 47 TYR QD 3.069 . 4.247 4.305 4.232 4.365 0.118 12 0 "[ . 1 . 2]" 1 1188 1 46 LYS H 1 65 ILE MD 3.027 . 4.172 3.978 3.836 4.199 0.027 20 0 "[ . 1 . 2]" 1 1189 1 46 LYS HA 1 46 LYS HB2 2.376 . 3.082 2.360 2.252 2.498 . 0 0 "[ . 1 . 2]" 1 1190 1 46 LYS HA 1 46 LYS HD2 3.015 . 4.152 4.502 4.207 4.863 0.711 2 2 "[ + -. 1 . 2]" 1 1191 1 46 LYS HA 1 46 LYS HD3 2.995 . 7.500 4.208 3.893 4.728 . 0 0 "[ . 1 . 2]" 1 1192 1 46 LYS HA 1 46 LYS QE 3.090 . 7.500 5.250 4.837 5.532 . 0 0 "[ . 1 . 2]" 1 1193 1 46 LYS HA 1 46 LYS HG3 2.682 . 3.581 3.432 2.881 3.702 0.121 10 0 "[ . 1 . 2]" 1 1194 1 46 LYS HA 1 47 TYR HA 3.482 . 4.997 4.565 4.415 4.661 . 0 0 "[ . 1 . 2]" 1 1195 1 46 LYS HA 1 48 HIS H 3.427 . 4.895 3.842 3.354 4.296 . 0 0 "[ . 1 . 2]" 1 1196 1 46 LYS HA 1 52 ASN HD22 3.167 . 4.421 3.445 2.368 4.341 . 0 0 "[ . 1 . 2]" 1 1197 1 46 LYS HB3 1 46 LYS HD2 2.773 . 3.735 2.667 1.917 4.157 0.422 2 0 "[ . 1 . 2]" 1 1198 1 46 LYS HB3 1 46 LYS HD3 3.003 . 4.130 2.766 2.061 3.516 . 0 0 "[ . 1 . 2]" 1 1199 1 46 LYS HB3 1 47 TYR H 2.548 . 3.359 2.996 2.517 3.835 0.476 3 0 "[ . 1 . 2]" 1 1200 1 46 LYS HB3 1 47 TYR HB2 3.159 . 4.406 4.067 3.802 4.486 0.080 2 0 "[ . 1 . 2]" 1 1201 1 46 LYS HD2 1 46 LYS QE 2.463 . 3.221 2.235 2.153 2.420 . 0 0 "[ . 1 . 2]" 1 1202 1 46 LYS HD2 1 46 LYS HG3 2.501 . 3.283 2.445 2.218 2.635 . 0 0 "[ . 1 . 2]" 1 1203 1 46 LYS HD2 1 47 TYR H 3.456 . 4.949 4.274 2.739 5.201 0.252 4 0 "[ . 1 . 2]" 1 1204 1 46 LYS HD2 1 47 TYR QD 3.269 . 4.605 3.002 1.968 4.235 . 0 0 "[ . 1 . 2]" 1 1205 1 46 LYS HD2 1 47 TYR QE 2.822 . 3.817 3.137 2.609 4.222 0.405 4 0 "[ . 1 . 2]" 1 1206 1 46 LYS HD3 1 46 LYS QE 2.448 . 2.743 2.274 2.138 2.392 . 0 0 "[ . 1 . 2]" 1 1207 1 46 LYS HD3 1 46 LYS QG 2.537 . 3.341 2.334 2.203 2.516 . 0 0 "[ . 1 . 2]" 1 1208 1 46 LYS HD3 1 47 TYR H 3.582 . 5.186 3.807 3.366 4.246 . 0 0 "[ . 1 . 2]" 1 1209 1 46 LYS HD3 1 47 TYR QE 3.067 . 4.243 3.025 2.177 3.990 . 0 0 "[ . 1 . 2]" 1 1210 1 46 LYS QE 1 46 LYS HG2 2.435 . 3.176 2.745 2.265 3.150 . 0 0 "[ . 1 . 2]" 1 1211 1 46 LYS QE 1 46 LYS QG 2.444 . 7.500 2.319 2.140 2.446 . 0 0 "[ . 1 . 2]" 1 1212 1 46 LYS QE 1 47 TYR QD 2.762 . 3.715 3.451 2.724 3.674 . 0 0 "[ . 1 . 2]" 1 1213 1 46 LYS QE 1 47 TYR QE 2.687 . 3.130 2.249 1.973 2.522 . 0 0 "[ . 1 . 2]" 1 1214 1 46 LYS QG 1 47 TYR H 3.278 . 4.621 3.709 3.058 4.317 . 0 0 "[ . 1 . 2]" 1 1215 1 46 LYS QG 1 47 TYR QE 3.205 . 7.500 4.191 3.258 4.606 . 0 0 "[ . 1 . 2]" 1 1216 1 46 LYS HG3 1 47 TYR QD 3.167 . 4.420 4.388 3.385 4.890 0.470 18 0 "[ . 1 . 2]" 1 1217 1 47 TYR H 1 47 TYR HA 2.711 . 3.630 2.947 2.928 2.959 . 0 0 "[ . 1 . 2]" 1 1218 1 47 TYR H 1 47 TYR HB2 2.686 . 3.588 2.361 2.265 2.463 . 0 0 "[ . 1 . 2]" 1 1219 1 47 TYR H 1 47 TYR HB3 2.783 . 3.751 3.590 3.537 3.668 . 0 0 "[ . 1 . 2]" 1 1220 1 47 TYR H 1 47 TYR QD 2.548 . 3.359 3.142 2.697 3.387 0.028 18 0 "[ . 1 . 2]" 1 1221 1 47 TYR H 1 47 TYR QE 3.522 . 7.500 5.216 4.880 5.355 . 0 0 "[ . 1 . 2]" 1 1222 1 47 TYR H 1 48 HIS H 2.659 . 3.543 2.291 2.020 2.565 . 0 0 "[ . 1 . 2]" 1 1223 1 47 TYR H 1 48 HIS QB 3.540 . 5.106 3.810 3.691 3.977 . 0 0 "[ . 1 . 2]" 1 1224 1 47 TYR H 1 48 HIS QB 3.393 . 4.832 3.627 3.492 3.765 . 0 0 "[ . 1 . 2]" 1 1225 1 47 TYR H 1 62 PHE HB2 3.413 . 4.869 4.263 4.092 4.365 . 0 0 "[ . 1 . 2]" 1 1226 1 47 TYR H 1 62 PHE HA 3.061 . 7.500 5.029 4.886 5.157 . 0 0 "[ . 1 . 2]" 1 1227 1 47 TYR H 1 65 ILE MD 2.724 . 3.652 3.455 3.236 3.630 . 0 0 "[ . 1 . 2]" 1 1228 1 47 TYR HA 1 47 TYR HB2 2.678 . 3.575 2.991 2.979 3.003 . 0 0 "[ . 1 . 2]" 1 1229 1 47 TYR HA 1 47 TYR HB3 2.636 . 3.504 2.624 2.590 2.656 . 0 0 "[ . 1 . 2]" 1 1230 1 47 TYR HA 1 47 TYR QD 2.170 . 2.759 2.814 2.594 2.946 0.187 13 0 "[ . 1 . 2]" 1 1231 1 47 TYR HA 1 48 HIS H 2.171 . 7.500 3.195 3.065 3.375 . 0 0 "[ . 1 . 2]" 1 1232 1 47 TYR HA 1 52 ASN HD21 2.693 . 7.500 3.666 3.516 3.793 . 0 0 "[ . 1 . 2]" 1 1233 1 47 TYR HA 1 52 ASN HD22 2.750 . 3.696 3.667 3.417 3.764 0.068 3 0 "[ . 1 . 2]" 1 1234 1 47 TYR HA 1 58 ALA MB 2.638 . 3.508 2.892 2.331 3.197 . 0 0 "[ . 1 . 2]" 1 1235 1 47 TYR HA 1 65 ILE MD 3.156 . 7.500 4.602 4.475 4.763 . 0 0 "[ . 1 . 2]" 1 1236 1 47 TYR HB2 1 47 TYR QD 2.650 . 3.528 2.340 2.299 2.385 . 0 0 "[ . 1 . 2]" 1 1237 1 47 TYR HB2 1 47 TYR QE 3.399 . 4.843 4.392 4.381 4.410 . 0 0 "[ . 1 . 2]" 1 1238 1 47 TYR HB2 1 62 PHE H 3.471 . 4.977 4.132 3.905 4.323 . 0 0 "[ . 1 . 2]" 1 1239 1 47 TYR HB2 1 62 PHE HA 3.214 . 4.505 3.040 2.894 3.202 . 0 0 "[ . 1 . 2]" 1 1240 1 47 TYR HB2 1 65 ILE MD 2.764 . 3.719 2.151 2.064 2.326 . 0 0 "[ . 1 . 2]" 1 1241 1 47 TYR HB3 1 47 TYR QD 2.614 . 3.468 2.448 2.366 2.537 . 0 0 "[ . 1 . 2]" 1 1242 1 47 TYR HB3 1 47 TYR QE 3.345 . 4.744 4.426 4.394 4.457 . 0 0 "[ . 1 . 2]" 1 1243 1 47 TYR HB3 1 48 HIS H 3.313 . 4.685 4.153 3.963 4.258 . 0 0 "[ . 1 . 2]" 1 1244 1 47 TYR HB3 1 52 ASN HD22 3.940 . 5.881 5.077 4.907 5.214 . 0 0 "[ . 1 . 2]" 1 1245 1 47 TYR HB3 1 58 ALA MB 2.915 . 3.977 3.150 3.023 3.333 . 0 0 "[ . 1 . 2]" 1 1246 1 47 TYR HB3 1 61 LYS HB2 3.280 . 4.625 2.640 2.486 2.862 . 0 0 "[ . 1 . 2]" 1 1247 1 47 TYR HB3 1 62 PHE H 3.205 . 4.489 2.956 2.710 3.133 . 0 0 "[ . 1 . 2]" 1 1248 1 47 TYR HB3 1 62 PHE HA 2.921 . 3.988 3.253 3.073 3.516 . 0 0 "[ . 1 . 2]" 1 1249 1 47 TYR HB3 1 62 PHE HB2 3.288 . 4.639 2.519 2.320 2.699 . 0 0 "[ . 1 . 2]" 1 1250 1 47 TYR HB3 1 62 PHE HB3 3.384 . 4.816 3.970 3.704 4.116 . 0 0 "[ . 1 . 2]" 1 1251 1 47 TYR HB3 1 65 ILE MD 2.431 . 3.170 3.114 3.006 3.224 0.054 20 0 "[ . 1 . 2]" 1 1252 1 47 TYR QD 1 58 ALA HA 2.527 . 3.325 2.344 1.892 2.603 . 0 0 "[ . 1 . 2]" 1 1253 1 47 TYR QD 1 58 ALA MB 2.264 . 2.905 2.825 2.360 2.966 0.061 16 0 "[ . 1 . 2]" 1 1254 1 47 TYR QD 1 61 LYS H 3.761 . 5.530 4.459 4.332 4.595 . 0 0 "[ . 1 . 2]" 1 1255 1 47 TYR QD 1 61 LYS HB2 3.134 . 4.362 2.286 2.158 2.468 . 0 0 "[ . 1 . 2]" 1 1256 1 47 TYR QD 1 61 LYS HB3 3.128 . 4.351 3.117 2.793 3.475 . 0 0 "[ . 1 . 2]" 1 1257 1 47 TYR QD 1 61 LYS HD2 3.267 . 4.601 4.671 4.493 4.780 0.179 18 0 "[ . 1 . 2]" 1 1258 1 47 TYR QD 1 61 LYS HD3 3.245 . 4.561 4.332 3.812 4.541 . 0 0 "[ . 1 . 2]" 1 1259 1 47 TYR QD 1 61 LYS HG2 3.063 . 4.236 3.822 3.618 4.058 . 0 0 "[ . 1 . 2]" 1 1260 1 47 TYR QD 1 61 LYS HG3 3.084 . 4.273 2.549 2.380 2.765 . 0 0 "[ . 1 . 2]" 1 1261 1 47 TYR QD 1 62 PHE H 2.899 . 3.949 4.076 4.029 4.120 0.171 6 0 "[ . 1 . 2]" 1 1262 1 47 TYR QD 1 62 PHE HA 2.551 . 7.500 4.365 4.093 4.559 . 0 0 "[ . 1 . 2]" 1 1263 1 47 TYR QD 1 63 LYS H 3.161 . 7.500 5.733 5.620 5.835 . 0 0 "[ . 1 . 2]" 1 1264 1 47 TYR QD 1 65 ILE MD 2.195 . 2.797 2.492 2.141 2.775 . 0 0 "[ . 1 . 2]" 1 1265 1 47 TYR QD 1 65 ILE MG 2.655 . 3.536 3.320 2.883 3.557 0.021 4 0 "[ . 1 . 2]" 1 1266 1 47 TYR QE 1 58 ALA HA 2.963 . 4.060 3.964 3.425 4.169 0.109 16 0 "[ . 1 . 2]" 1 1267 1 47 TYR QE 1 58 ALA MB 2.809 . 7.500 4.437 3.951 4.595 . 0 0 "[ . 1 . 2]" 1 1268 1 47 TYR QE 1 61 LYS HB2 3.286 . 4.635 3.588 3.492 3.779 . 0 0 "[ . 1 . 2]" 1 1269 1 47 TYR QE 1 61 LYS HB3 3.417 . 4.877 3.270 2.894 3.516 . 0 0 "[ . 1 . 2]" 1 1270 1 47 TYR QE 1 61 LYS HD2 3.001 . 4.127 3.529 3.300 3.722 . 0 0 "[ . 1 . 2]" 1 1271 1 47 TYR QE 1 61 LYS HD3 3.002 . 4.128 3.310 2.442 3.754 . 0 0 "[ . 1 . 2]" 1 1272 1 47 TYR QE 1 61 LYS HG2 2.995 . 4.116 4.150 4.041 4.332 0.216 7 0 "[ . 1 . 2]" 1 1273 1 47 TYR QE 1 61 LYS HG3 2.928 . 4.000 2.450 2.302 2.714 . 0 0 "[ . 1 . 2]" 1 1274 1 47 TYR QE 1 65 ILE MD 2.520 . 7.500 3.901 3.577 4.105 . 0 0 "[ . 1 . 2]" 1 1275 1 47 TYR QE 1 65 ILE MG 2.903 . 3.957 3.696 3.034 3.975 0.018 13 0 "[ . 1 . 2]" 1 1276 1 48 HIS H 1 48 HIS HA 2.600 . 3.445 2.840 2.793 2.881 . 0 0 "[ . 1 . 2]" 1 1277 1 48 HIS H 1 48 HIS QB 2.445 . 3.192 2.133 2.053 2.205 . 0 0 "[ . 1 . 2]" 1 1278 1 48 HIS H 1 49 PRO HD2 3.104 . 7.500 4.640 4.502 4.690 . 0 0 "[ . 1 . 2]" 1 1279 1 48 HIS H 1 49 PRO HD2 3.236 . 4.545 4.322 4.213 4.393 . 0 0 "[ . 1 . 2]" 1 1280 1 48 HIS H 1 49 PRO HD3 3.180 . 7.500 4.823 4.737 4.893 . 0 0 "[ . 1 . 2]" 1 1281 1 48 HIS H 1 49 PRO QG 3.068 . 7.500 6.016 5.947 6.048 . 0 0 "[ . 1 . 2]" 1 1282 1 48 HIS H 1 51 LYS H 3.835 . 5.673 4.682 4.497 4.863 . 0 0 "[ . 1 . 2]" 1 1283 1 48 HIS H 1 51 LYS H 3.514 . 5.057 4.401 4.241 4.588 . 0 0 "[ . 1 . 2]" 1 1284 1 48 HIS H 1 51 LYS QB 3.420 . 7.500 4.020 3.779 4.738 . 0 0 "[ . 1 . 2]" 1 1285 1 48 HIS H 1 51 LYS QD 2.984 . 4.097 3.967 3.547 4.113 0.016 9 0 "[ . 1 . 2]" 1 1286 1 48 HIS H 1 51 LYS QD 2.900 . 3.952 3.733 3.437 3.865 . 0 0 "[ . 1 . 2]" 1 1287 1 48 HIS H 1 51 LYS HG2 3.365 . 7.500 5.846 5.213 6.139 . 0 0 "[ . 1 . 2]" 1 1288 1 48 HIS H 1 51 LYS HG3 3.232 . 4.538 4.205 3.568 4.567 0.029 18 0 "[ . 1 . 2]" 1 1289 1 48 HIS H 1 52 ASN HD21 3.306 . 4.672 3.255 2.895 3.553 . 0 0 "[ . 1 . 2]" 1 1290 1 48 HIS H 1 52 ASN HD22 2.695 . 3.603 3.452 2.963 3.682 0.079 20 0 "[ . 1 . 2]" 1 1291 1 48 HIS HA 1 48 HIS HD2 3.065 . 4.239 2.440 2.056 3.333 . 0 0 "[ . 1 . 2]" 1 1292 1 48 HIS HA 1 49 PRO HA 3.145 . 4.381 4.335 4.316 4.356 . 0 0 "[ . 1 . 2]" 1 1293 1 48 HIS HA 1 49 PRO HB2 3.315 . 7.500 5.439 5.362 5.477 . 0 0 "[ . 1 . 2]" 1 1294 1 48 HIS HA 1 49 PRO HB3 3.067 . 7.500 4.562 4.484 4.640 . 0 0 "[ . 1 . 2]" 1 1295 1 48 HIS HA 1 49 PRO HD2 2.526 . 3.324 1.868 1.781 1.926 . 0 0 "[ . 1 . 2]" 1 1296 1 48 HIS HA 1 49 PRO HD3 2.535 . 3.338 2.633 2.570 2.754 . 0 0 "[ . 1 . 2]" 1 1297 1 48 HIS HA 1 49 PRO QG 2.608 . 7.500 3.736 3.647 3.786 . 0 0 "[ . 1 . 2]" 1 1298 1 48 HIS HA 1 51 LYS H 3.591 . 5.203 4.277 4.231 4.440 . 0 0 "[ . 1 . 2]" 1 1299 1 48 HIS HA 1 58 ALA MB 3.311 . 4.681 4.356 4.162 4.644 . 0 0 "[ . 1 . 2]" 1 1300 1 48 HIS QB 1 48 HIS HD2 3.017 . 4.155 3.156 2.921 3.286 . 0 0 "[ . 1 . 2]" 1 1301 1 48 HIS QB 1 49 PRO HD2 3.221 . 4.518 3.741 3.690 3.810 . 0 0 "[ . 1 . 2]" 1 1302 1 48 HIS QB 1 49 PRO HD2 3.186 . 4.455 3.630 3.583 3.685 . 0 0 "[ . 1 . 2]" 1 1303 1 48 HIS QB 1 49 PRO HD3 3.257 . 7.500 4.492 4.445 4.557 . 0 0 "[ . 1 . 2]" 1 1304 1 48 HIS QB 1 51 LYS HG2 2.710 . 3.628 3.199 2.827 3.397 . 0 0 "[ . 1 . 2]" 1 1305 1 48 HIS QB 1 51 LYS H 3.250 . 4.570 2.544 2.352 2.890 . 0 0 "[ . 1 . 2]" 1 1306 1 48 HIS QB 1 51 LYS QB 3.010 . 4.143 3.116 2.856 3.852 . 0 0 "[ . 1 . 2]" 1 1307 1 48 HIS QB 1 51 LYS QD 2.597 . 3.440 2.946 2.454 3.136 . 0 0 "[ . 1 . 2]" 1 1308 1 48 HIS QB 1 51 LYS HG2 3.252 . 4.574 3.516 3.102 3.870 . 0 0 "[ . 1 . 2]" 1 1309 1 48 HIS QB 1 51 LYS HG3 3.193 . 3.682 1.933 1.761 2.201 0.157 19 0 "[ . 1 . 2]" 1 1310 1 48 HIS QB 1 52 ASN HD21 2.888 . 3.930 3.151 3.077 3.213 . 0 0 "[ . 1 . 2]" 1 1311 1 48 HIS HD2 1 49 PRO HA 3.117 . 7.500 4.875 4.485 5.158 . 0 0 "[ . 1 . 2]" 1 1312 1 48 HIS HD2 1 49 PRO HD2 3.231 . 4.536 2.386 2.030 2.855 . 0 0 "[ . 1 . 2]" 1 1313 1 48 HIS HD2 1 49 PRO HD3 3.374 . 4.797 3.939 3.549 4.452 . 0 0 "[ . 1 . 2]" 1 1314 1 48 HIS HD2 1 49 PRO HG2 3.002 . 4.129 3.775 2.803 4.199 0.070 16 0 "[ . 1 . 2]" 1 1315 1 48 HIS HD2 1 59 ALA HA 2.975 . 7.500 5.357 4.696 6.459 . 0 0 "[ . 1 . 2]" 1 1316 1 48 HIS HD2 1 62 PHE HB3 2.813 . 7.500 4.904 3.957 6.665 . 0 0 "[ . 1 . 2]" 1 1317 1 49 PRO HA 1 49 PRO HB3 2.175 . 2.767 2.271 2.262 2.280 . 0 0 "[ . 1 . 2]" 1 1318 1 49 PRO HA 1 49 PRO HD2 3.098 . 4.298 4.071 4.052 4.081 . 0 0 "[ . 1 . 2]" 1 1319 1 49 PRO HA 1 49 PRO HD3 3.153 . 4.396 3.369 3.288 3.423 . 0 0 "[ . 1 . 2]" 1 1320 1 49 PRO HA 1 50 ASP H 2.944 . 4.027 3.489 3.451 3.517 . 0 0 "[ . 1 . 2]" 1 1321 1 49 PRO HA 1 50 ASP HA 2.964 . 4.062 3.909 3.799 4.092 0.030 20 0 "[ . 1 . 2]" 1 1322 1 49 PRO HA 1 51 LYS H 3.360 . 4.771 3.865 3.735 4.021 . 0 0 "[ . 1 . 2]" 1 1323 1 49 PRO HA 1 52 ASN H 2.570 . 3.396 2.776 2.648 2.860 . 0 0 "[ . 1 . 2]" 1 1324 1 49 PRO HA 1 52 ASN HA 3.288 . 4.640 4.596 4.402 4.657 0.017 2 0 "[ . 1 . 2]" 1 1325 1 49 PRO HA 1 52 ASN HB2 2.552 . 3.366 2.679 2.252 2.842 . 0 0 "[ . 1 . 2]" 1 1326 1 49 PRO HA 1 52 ASN HB3 2.950 . 7.500 4.185 3.821 4.338 . 0 0 "[ . 1 . 2]" 1 1327 1 49 PRO HA 1 52 ASN HB3 2.722 . 3.648 3.495 3.391 3.610 . 0 0 "[ . 1 . 2]" 1 1328 1 49 PRO HA 1 52 ASN HD21 3.074 . 4.255 3.631 3.275 3.870 . 0 0 "[ . 1 . 2]" 1 1329 1 49 PRO HA 1 55 ASN H 2.959 . 4.054 4.125 4.075 4.190 0.136 11 0 "[ . 1 . 2]" 1 1330 1 49 PRO HB2 1 49 PRO HD2 2.841 . 7.500 4.057 4.046 4.073 . 0 0 "[ . 1 . 2]" 1 1331 1 49 PRO HB2 1 51 LYS H 3.399 . 4.843 4.703 4.601 4.805 . 0 0 "[ . 1 . 2]" 1 1332 1 49 PRO HB2 1 52 ASN H 3.725 . 5.459 4.470 4.339 4.546 . 0 0 "[ . 1 . 2]" 1 1333 1 49 PRO HB2 1 50 ASP H 3.032 . 4.181 3.314 3.190 3.469 . 0 0 "[ . 1 . 2]" 1 1334 1 49 PRO HB2 1 50 ASP HA 3.021 . 4.162 4.159 4.099 4.193 0.031 14 0 "[ . 1 . 2]" 1 1335 1 49 PRO HB2 1 50 ASP HA 3.349 . 4.751 3.768 3.724 3.818 . 0 0 "[ . 1 . 2]" 1 1336 1 49 PRO HB2 1 51 LYS H 3.283 . 4.630 4.378 4.253 4.494 . 0 0 "[ . 1 . 2]" 1 1337 1 49 PRO HB2 1 59 ALA H 3.419 . 7.500 5.343 4.872 5.607 . 0 0 "[ . 1 . 2]" 1 1338 1 49 PRO HB3 1 49 PRO HD2 2.880 . 3.917 3.897 3.874 3.918 0.001 16 0 "[ . 1 . 2]" 1 1339 1 49 PRO HB3 1 49 PRO HD3 3.257 . 4.583 2.949 2.897 2.982 . 0 0 "[ . 1 . 2]" 1 1340 1 49 PRO HB3 1 49 PRO HG3 2.285 . 2.938 2.323 2.318 2.331 . 0 0 "[ . 1 . 2]" 1 1341 1 49 PRO HB3 1 50 ASP H 3.239 . 4.551 4.214 4.159 4.286 . 0 0 "[ . 1 . 2]" 1 1342 1 49 PRO HB3 1 53 PRO HA 3.312 . 4.683 4.757 4.723 4.794 0.111 20 0 "[ . 1 . 2]" 1 1343 1 49 PRO HB3 1 55 ASN H 3.437 . 4.914 4.533 4.365 4.792 . 0 0 "[ . 1 . 2]" 1 1344 1 49 PRO HB3 1 58 ALA MB 2.674 . 3.568 3.205 2.830 3.556 . 0 0 "[ . 1 . 2]" 1 1345 1 49 PRO HD2 1 49 PRO HG2 2.277 . 2.925 2.319 2.314 2.330 . 0 0 "[ . 1 . 2]" 1 1346 1 49 PRO HD2 1 50 ASP H 3.554 . 5.133 3.054 2.991 3.170 . 0 0 "[ . 1 . 2]" 1 1347 1 49 PRO HD2 1 51 LYS H 3.374 . 4.797 4.121 4.046 4.215 . 0 0 "[ . 1 . 2]" 1 1348 1 49 PRO HD3 1 49 PRO HG3 2.479 . 3.247 2.329 2.322 2.338 . 0 0 "[ . 1 . 2]" 1 1349 1 49 PRO HD3 1 50 ASP H 3.664 . 5.342 4.045 3.984 4.102 . 0 0 "[ . 1 . 2]" 1 1350 1 49 PRO HD3 1 62 PHE HB2 3.407 . 4.858 3.428 3.143 3.872 . 0 0 "[ . 1 . 2]" 1 1351 1 49 PRO HG2 1 51 LYS H 3.246 . 4.563 4.608 4.587 4.644 0.081 11 0 "[ . 1 . 2]" 1 1352 1 49 PRO QG 1 55 ASN H 2.878 . 7.500 6.245 6.083 6.507 . 0 0 "[ . 1 . 2]" 1 1353 1 49 PRO HG2 1 50 ASP H 2.816 . 3.807 2.640 2.549 2.796 . 0 0 "[ . 1 . 2]" 1 1354 1 49 PRO HG2 1 50 ASP HA 3.038 . 7.500 4.557 4.489 4.670 . 0 0 "[ . 1 . 2]" 1 1355 1 49 PRO HG2 1 50 ASP QB 2.834 . 3.838 3.914 3.852 3.994 0.156 20 0 "[ . 1 . 2]" 1 1356 1 49 PRO HG3 1 59 ALA H 2.895 . 3.943 3.957 3.711 4.013 0.070 11 0 "[ . 1 . 2]" 1 1357 1 50 ASP H 1 50 ASP HA 2.436 . 3.178 2.794 2.760 2.843 . 0 0 "[ . 1 . 2]" 1 1358 1 50 ASP H 1 50 ASP QB 2.459 . 3.215 2.227 2.200 2.253 . 0 0 "[ . 1 . 2]" 1 1359 1 50 ASP H 1 51 LYS H 2.749 . 3.694 2.655 2.470 2.760 . 0 0 "[ . 1 . 2]" 1 1360 1 50 ASP H 1 51 LYS QD 3.552 . 7.500 5.878 5.456 6.077 . 0 0 "[ . 1 . 2]" 1 1361 1 50 ASP H 1 52 ASN H 3.372 . 4.794 3.699 3.600 3.763 . 0 0 "[ . 1 . 2]" 1 1362 1 50 ASP H 1 52 ASN HD21 3.756 . 5.520 4.885 4.625 5.112 . 0 0 "[ . 1 . 2]" 1 1363 1 50 ASP HA 1 50 ASP QB 1.969 . 2.454 2.350 2.315 2.393 . 0 0 "[ . 1 . 2]" 1 1364 1 50 ASP HA 1 51 LYS H 2.503 . 7.500 3.492 3.439 3.522 . 0 0 "[ . 1 . 2]" 1 1365 1 50 ASP HA 1 51 LYS H 2.438 . 3.181 2.790 2.781 2.798 . 0 0 "[ . 1 . 2]" 1 1366 1 50 ASP HA 1 52 ASN H 2.554 . 3.369 3.240 3.191 3.286 . 0 0 "[ . 1 . 2]" 1 1367 1 50 ASP HB3 1 51 LYS H 2.577 . 3.407 2.799 2.656 3.013 . 0 0 "[ . 1 . 2]" 1 1368 1 50 ASP HB3 1 52 ASN H 2.638 . 7.500 3.680 3.645 3.710 . 0 0 "[ . 1 . 2]" 1 1369 1 51 LYS H 1 51 LYS HA 2.313 . 2.982 2.764 2.751 2.779 . 0 0 "[ . 1 . 2]" 1 1370 1 51 LYS H 1 51 LYS QB 2.587 . 3.358 2.630 2.539 2.863 . 0 0 "[ . 1 . 2]" 1 1371 1 51 LYS H 1 51 LYS QD 2.571 . 7.500 4.100 3.884 4.224 . 0 0 "[ . 1 . 2]" 1 1372 1 51 LYS H 1 51 LYS HG2 2.596 . 3.439 3.240 2.760 3.451 0.012 3 0 "[ . 1 . 2]" 1 1373 1 51 LYS H 1 51 LYS HG3 2.631 . 3.496 2.389 2.126 2.539 . 0 0 "[ . 1 . 2]" 1 1374 1 51 LYS H 1 53 PRO HG2 3.235 . 7.500 4.940 4.855 5.020 . 0 0 "[ . 1 . 2]" 1 1375 1 51 LYS H 1 52 ASN HA 4.083 . 6.166 4.821 4.732 4.918 . 0 0 "[ . 1 . 2]" 1 1376 1 51 LYS H 1 52 ASN HD22 3.559 . 5.142 4.427 4.246 4.599 . 0 0 "[ . 1 . 2]" 1 1377 1 51 LYS H 1 53 PRO HD3 4.072 . 6.145 4.573 4.482 4.699 . 0 0 "[ . 1 . 2]" 1 1378 1 51 LYS HA 1 51 LYS QB 2.291 . 2.947 2.293 2.205 2.328 . 0 0 "[ . 1 . 2]" 1 1379 1 51 LYS HA 1 51 LYS QD 2.135 . 7.500 4.112 3.872 4.330 . 0 0 "[ . 1 . 2]" 1 1380 1 51 LYS HA 1 51 LYS HG2 2.447 . 3.195 2.678 2.565 2.979 . 0 0 "[ . 1 . 2]" 1 1381 1 51 LYS HA 1 51 LYS HG3 2.505 . 7.500 3.437 3.291 3.651 . 0 0 "[ . 1 . 2]" 1 1382 1 51 LYS HA 1 52 ASN HA 2.836 . 7.500 4.080 4.069 4.097 . 0 0 "[ . 1 . 2]" 1 1383 1 51 LYS HA 1 52 ASN HD22 3.385 . 7.500 5.273 5.165 5.380 . 0 0 "[ . 1 . 2]" 1 1384 1 51 LYS HA 1 53 PRO HD2 2.695 . 7.500 3.792 3.782 3.800 . 0 0 "[ . 1 . 2]" 1 1385 1 51 LYS HA 1 53 PRO HD3 2.655 . 3.536 3.183 3.156 3.233 . 0 0 "[ . 1 . 2]" 1 1386 1 51 LYS HA 1 53 PRO HD2 3.186 . 4.455 4.493 4.470 4.519 0.064 4 0 "[ . 1 . 2]" 1 1387 1 51 LYS HA 1 53 PRO HD3 3.085 . 4.275 3.718 3.623 3.844 . 0 0 "[ . 1 . 2]" 1 1388 1 51 LYS QB 1 51 LYS HD2 2.318 . 2.990 2.885 2.414 3.304 0.314 19 0 "[ . 1 . 2]" 1 1389 1 51 LYS QB 1 51 LYS HG3 2.671 . 3.563 2.269 2.228 2.330 . 0 0 "[ . 1 . 2]" 1 1390 1 51 LYS QB 1 52 ASN H 2.833 . 3.953 3.099 2.950 3.222 . 0 0 "[ . 1 . 2]" 1 1391 1 51 LYS QB 1 52 ASN HA 3.405 . 4.855 4.180 3.918 4.261 . 0 0 "[ . 1 . 2]" 1 1392 1 51 LYS QB 1 52 ASN HD21 3.011 . 4.229 2.649 2.537 2.707 . 0 0 "[ . 1 . 2]" 1 1393 1 51 LYS QB 1 52 ASN HD22 2.966 . 4.066 2.529 2.426 2.642 . 0 0 "[ . 1 . 2]" 1 1394 1 51 LYS QD 1 51 LYS HE2 2.100 . 2.651 2.120 2.090 2.128 . 0 0 "[ . 1 . 2]" 1 1395 1 51 LYS QD 1 51 LYS HG2 2.134 . 2.703 2.358 2.170 2.416 . 0 0 "[ . 1 . 2]" 1 1396 1 51 LYS QD 1 51 LYS HG3 1.995 . 2.492 2.231 2.160 2.319 . 0 0 "[ . 1 . 2]" 1 1397 1 51 LYS QD 1 52 ASN HD21 3.231 . 4.536 4.478 4.221 4.608 0.072 11 0 "[ . 1 . 2]" 1 1398 1 51 LYS QD 1 52 ASN HD22 2.980 . 4.090 3.940 3.692 4.168 0.078 11 0 "[ . 1 . 2]" 1 1399 1 51 LYS HD2 1 52 ASN HD21 3.025 . 4.169 3.703 3.415 3.912 . 0 0 "[ . 1 . 2]" 1 1400 1 51 LYS HD2 1 52 ASN HD22 2.964 . 4.062 4.192 3.710 4.577 0.515 13 1 "[ . 1 + . 2]" 1 1401 1 51 LYS QE 1 51 LYS HG2 2.804 . 3.786 2.834 2.336 3.400 . 0 0 "[ . 1 . 2]" 1 1402 1 51 LYS QE 1 51 LYS HG3 2.777 . 3.741 2.993 2.445 3.497 . 0 0 "[ . 1 . 2]" 1 1403 1 51 LYS HG2 1 52 ASN H 3.571 . 5.165 4.822 4.526 4.980 . 0 0 "[ . 1 . 2]" 1 1404 1 51 LYS HG2 1 52 ASN HD22 3.341 . 7.500 5.471 4.899 5.611 . 0 0 "[ . 1 . 2]" 1 1405 1 51 LYS HG3 1 52 ASN H 3.512 . 5.054 4.157 3.708 4.344 . 0 0 "[ . 1 . 2]" 1 1406 1 51 LYS HG3 1 52 ASN HD21 3.852 . 5.706 4.153 3.158 4.403 . 0 0 "[ . 1 . 2]" 1 1407 1 51 LYS HG3 1 52 ASN HD22 3.202 . 4.484 4.469 3.488 4.618 0.134 17 0 "[ . 1 . 2]" 1 1408 1 52 ASN H 1 52 ASN HA 2.550 . 3.363 2.931 2.925 2.934 . 0 0 "[ . 1 . 2]" 1 1409 1 52 ASN H 1 52 ASN HB2 2.660 . 3.545 2.801 2.729 2.861 . 0 0 "[ . 1 . 2]" 1 1410 1 52 ASN H 1 52 ASN HB3 2.846 . 3.859 3.843 3.795 3.875 0.016 3 0 "[ . 1 . 2]" 1 1411 1 52 ASN H 1 52 ASN HD22 3.199 . 4.478 4.026 3.929 4.159 . 0 0 "[ . 1 . 2]" 1 1412 1 52 ASN H 1 53 PRO HA 3.358 . 4.768 4.502 4.397 4.638 . 0 0 "[ . 1 . 2]" 1 1413 1 52 ASN H 1 53 PRO HD2 2.766 . 3.722 3.798 3.761 3.845 0.123 17 0 "[ . 1 . 2]" 1 1414 1 52 ASN H 1 53 PRO HD3 2.755 . 3.704 3.261 3.128 3.407 . 0 0 "[ . 1 . 2]" 1 1415 1 52 ASN HA 1 52 ASN HB2 2.475 . 3.240 3.027 3.023 3.034 . 0 0 "[ . 1 . 2]" 1 1416 1 52 ASN HA 1 52 ASN HB3 2.334 . 3.015 2.409 2.384 2.433 . 0 0 "[ . 1 . 2]" 1 1417 1 52 ASN HA 1 52 ASN HD21 2.913 . 3.974 3.937 3.888 3.975 0.001 6 0 "[ . 1 . 2]" 1 1418 1 52 ASN HA 1 52 ASN HD22 3.387 . 4.821 4.466 4.407 4.498 . 0 0 "[ . 1 . 2]" 1 1419 1 52 ASN HA 1 53 PRO HA 3.100 . 7.500 4.649 4.633 4.665 . 0 0 "[ . 1 . 2]" 1 1420 1 52 ASN HA 1 53 PRO HB2 3.361 . 7.500 5.493 5.455 5.540 . 0 0 "[ . 1 . 2]" 1 1421 1 52 ASN HA 1 53 PRO HB3 3.455 . 7.500 5.241 5.222 5.264 . 0 0 "[ . 1 . 2]" 1 1422 1 52 ASN HA 1 53 PRO HD2 2.225 . 2.844 1.953 1.910 1.995 . 0 0 "[ . 1 . 2]" 1 1423 1 52 ASN HA 1 53 PRO HD3 2.356 . 3.050 3.026 2.995 3.049 . 0 0 "[ . 1 . 2]" 1 1424 1 52 ASN HA 1 53 PRO QG 2.553 . 7.500 3.770 3.719 3.827 . 0 0 "[ . 1 . 2]" 1 1425 1 52 ASN HA 1 54 ASP H 3.280 . 7.500 6.310 6.272 6.351 . 0 0 "[ . 1 . 2]" 1 1426 1 52 ASN HA 1 54 ASP H 3.583 . 5.188 4.937 4.910 4.980 . 0 0 "[ . 1 . 2]" 1 1427 1 52 ASN HA 1 55 ASN HB2 3.040 . 7.500 5.015 4.659 5.235 . 0 0 "[ . 1 . 2]" 1 1428 1 52 ASN HA 1 58 ALA MB 2.789 . 7.500 5.330 4.988 5.503 . 0 0 "[ . 1 . 2]" 1 1429 1 52 ASN HB2 1 52 ASN HD21 2.634 . 3.501 2.271 2.229 2.298 . 0 0 "[ . 1 . 2]" 1 1430 1 52 ASN HB2 1 52 ASN HD22 2.796 . 3.773 3.498 3.484 3.510 . 0 0 "[ . 1 . 2]" 1 1431 1 52 ASN HB2 1 53 PRO HD2 3.194 . 7.500 4.719 4.700 4.740 . 0 0 "[ . 1 . 2]" 1 1432 1 52 ASN HB2 1 53 PRO HD3 3.352 . 7.500 5.078 5.024 5.124 . 0 0 "[ . 1 . 2]" 1 1433 1 52 ASN HB2 1 55 ASN H 3.268 . 7.500 4.811 4.709 4.879 . 0 0 "[ . 1 . 2]" 1 1434 1 52 ASN HB2 1 55 ASN HB2 3.019 . 4.158 4.186 4.148 4.218 0.060 1 0 "[ . 1 . 2]" 1 1435 1 52 ASN HB2 1 55 ASN HB3 3.208 . 4.495 3.212 3.094 3.308 . 0 0 "[ . 1 . 2]" 1 1436 1 52 ASN HB2 1 55 ASN QD 3.668 . 5.350 3.984 3.566 4.359 . 0 0 "[ . 1 . 2]" 1 1437 1 52 ASN HB2 1 55 ASN QD 3.629 . 5.275 3.764 1.995 4.091 . 0 0 "[ . 1 . 2]" 1 1438 1 52 ASN HB2 1 58 ALA MB 2.355 . 3.049 2.960 2.632 3.113 0.064 17 0 "[ . 1 . 2]" 1 1439 1 52 ASN HB3 1 52 ASN HD21 2.715 . 3.636 3.481 3.454 3.498 . 0 0 "[ . 1 . 2]" 1 1440 1 52 ASN HB3 1 52 ASN HD22 2.935 . 4.012 4.058 4.052 4.065 0.053 11 0 "[ . 1 . 2]" 1 1441 1 52 ASN HB3 1 53 PRO HA 2.802 . 7.500 4.160 4.105 4.235 . 0 0 "[ . 1 . 2]" 1 1442 1 52 ASN HB3 1 53 PRO HD2 2.969 . 4.071 4.174 4.138 4.223 0.152 20 0 "[ . 1 . 2]" 1 1443 1 52 ASN HB3 1 53 PRO HD3 3.132 . 7.500 5.128 5.094 5.149 . 0 0 "[ . 1 . 2]" 1 1444 1 52 ASN HB3 1 53 PRO HG2 3.152 . 4.394 4.341 4.205 4.471 0.077 19 0 "[ . 1 . 2]" 1 1445 1 53 PRO HA 1 53 PRO HB3 2.127 . 2.693 2.294 2.284 2.314 . 0 0 "[ . 1 . 2]" 1 1446 1 53 PRO HA 1 53 PRO HD2 2.773 . 7.500 4.086 4.077 4.095 . 0 0 "[ . 1 . 2]" 1 1447 1 53 PRO HA 1 53 PRO HD3 2.723 . 3.650 3.462 3.405 3.533 . 0 0 "[ . 1 . 2]" 1 1448 1 53 PRO HA 1 54 ASP H 2.084 . 2.627 2.286 2.253 2.328 . 0 0 "[ . 1 . 2]" 1 1449 1 53 PRO HA 1 54 ASP H 1.989 . 2.484 2.030 2.013 2.047 . 0 0 "[ . 1 . 2]" 1 1450 1 53 PRO HA 1 55 ASN H 2.200 . 2.805 2.769 2.737 2.816 0.011 10 0 "[ . 1 . 2]" 1 1451 1 53 PRO HA 1 54 ASP HB3 3.134 . 7.500 4.891 4.765 4.998 . 0 0 "[ . 1 . 2]" 1 1452 1 53 PRO HA 1 55 ASN H 2.677 . 3.573 3.119 3.070 3.163 . 0 0 "[ . 1 . 2]" 1 1453 1 53 PRO HB2 1 53 PRO HD2 2.859 . 7.500 4.079 4.072 4.087 . 0 0 "[ . 1 . 2]" 1 1454 1 53 PRO HB2 1 53 PRO HD3 2.825 . 3.823 3.851 3.839 3.861 0.038 16 0 "[ . 1 . 2]" 1 1455 1 53 PRO HB2 1 55 ASN H 3.184 . 4.452 4.487 4.413 4.525 0.073 4 0 "[ . 1 . 2]" 1 1456 1 53 PRO HB2 1 54 ASP H 2.453 . 3.205 2.865 2.820 2.914 . 0 0 "[ . 1 . 2]" 1 1457 1 53 PRO HB2 1 54 ASP HA 2.891 . 7.500 4.449 4.396 4.510 . 0 0 "[ . 1 . 2]" 1 1458 1 53 PRO HB2 1 54 ASP HB2 3.490 . 5.012 3.477 3.338 3.638 . 0 0 "[ . 1 . 2]" 1 1459 1 53 PRO HB2 1 54 ASP HB3 3.274 . 4.614 4.124 3.991 4.235 . 0 0 "[ . 1 . 2]" 1 1460 1 53 PRO HB3 1 53 PRO HD2 2.839 . 3.847 3.849 3.838 3.857 0.010 3 0 "[ . 1 . 2]" 1 1461 1 53 PRO HB3 1 53 PRO HD3 2.814 . 3.804 2.866 2.844 2.884 . 0 0 "[ . 1 . 2]" 1 1462 1 53 PRO HB3 1 53 PRO HG3 2.291 . 2.947 2.338 2.333 2.341 . 0 0 "[ . 1 . 2]" 1 1463 1 53 PRO HB3 1 54 ASP H 2.748 . 3.692 3.531 3.497 3.590 . 0 0 "[ . 1 . 2]" 1 1464 1 53 PRO HB3 1 54 ASP HA 3.247 . 7.500 5.601 5.549 5.696 . 0 0 "[ . 1 . 2]" 1 1465 1 53 PRO HB3 1 55 ASN H 3.574 . 5.170 5.202 5.176 5.232 0.062 11 0 "[ . 1 . 2]" 1 1466 1 53 PRO HD2 1 53 PRO QG 2.170 . 2.759 2.201 2.199 2.205 . 0 0 "[ . 1 . 2]" 1 1467 1 53 PRO HD2 1 54 ASP H 3.135 . 7.500 5.692 5.641 5.734 . 0 0 "[ . 1 . 2]" 1 1468 1 53 PRO HD3 1 53 PRO HG3 2.203 . 2.810 2.324 2.317 2.330 . 0 0 "[ . 1 . 2]" 1 1469 1 53 PRO HD3 1 54 ASP H 3.268 . 7.500 5.457 5.419 5.506 . 0 0 "[ . 1 . 2]" 1 1470 1 53 PRO QG 1 54 ASP H 2.801 . 7.500 4.336 4.268 4.386 . 0 0 "[ . 1 . 2]" 1 1471 1 54 ASP H 1 54 ASP HA 2.075 . 2.613 2.271 2.261 2.285 . 0 0 "[ . 1 . 2]" 1 1472 1 54 ASP H 1 54 ASP HB3 2.522 . 3.317 3.682 3.599 3.750 0.433 2 0 "[ . 1 . 2]" 1 1473 1 54 ASP H 1 55 ASN H 2.309 . 2.976 2.538 2.489 2.599 . 0 0 "[ . 1 . 2]" 1 1474 1 54 ASP HA 1 54 ASP HB2 2.084 . 2.627 2.350 2.118 2.420 . 0 0 "[ . 1 . 2]" 1 1475 1 54 ASP HA 1 54 ASP HB3 2.082 . 2.624 3.025 3.014 3.032 0.408 20 0 "[ . 1 . 2]" 1 1476 1 54 ASP HA 1 55 ASN H 2.304 . 7.500 3.101 3.032 3.224 . 0 0 "[ . 1 . 2]" 1 1477 1 54 ASP HA 1 55 ASN HA 3.126 . 7.500 4.434 4.387 4.508 . 0 0 "[ . 1 . 2]" 1 1478 1 54 ASP HB2 1 55 ASN H 2.502 . 7.500 4.449 4.381 4.503 . 0 0 "[ . 1 . 2]" 1 1479 1 54 ASP HB2 1 55 ASN QD 2.480 . 7.500 7.460 7.374 7.898 0.398 16 0 "[ . 1 . 2]" 1 1480 1 54 ASP HB3 1 55 ASN H 2.892 . 7.500 3.844 3.644 3.938 . 0 0 "[ . 1 . 2]" 1 1481 1 54 ASP HB3 1 55 ASN HA 3.363 . 7.500 4.757 4.561 4.910 . 0 0 "[ . 1 . 2]" 1 1482 1 55 ASN H 1 55 ASN HA 2.483 . 3.254 2.939 2.934 2.945 . 0 0 "[ . 1 . 2]" 1 1483 1 55 ASN H 1 55 ASN HB2 2.397 . 3.115 2.977 2.694 3.041 . 0 0 "[ . 1 . 2]" 1 1484 1 55 ASN H 1 55 ASN HB3 2.241 . 2.869 2.871 2.784 2.968 0.099 16 0 "[ . 1 . 2]" 1 1485 1 55 ASN H 1 55 ASN QD 3.730 . 5.469 4.897 4.693 4.943 . 0 0 "[ . 1 . 2]" 1 1486 1 55 ASN H 1 56 PRO HD2 3.056 . 7.500 4.738 4.493 4.914 . 0 0 "[ . 1 . 2]" 1 1487 1 55 ASN H 1 56 PRO HD3 3.016 . 4.153 3.412 3.179 3.565 . 0 0 "[ . 1 . 2]" 1 1488 1 55 ASN H 1 56 PRO HG3 3.308 . 4.676 4.732 4.684 4.779 0.103 10 0 "[ . 1 . 2]" 1 1489 1 55 ASN H 1 58 ALA H 3.905 . 5.811 5.022 4.809 5.149 . 0 0 "[ . 1 . 2]" 1 1490 1 55 ASN H 1 58 ALA MB 2.931 . 7.500 4.506 4.367 4.659 . 0 0 "[ . 1 . 2]" 1 1491 1 55 ASN HA 1 55 ASN HB3 2.531 . 3.332 3.012 2.970 3.021 . 0 0 "[ . 1 . 2]" 1 1492 1 55 ASN HA 1 55 ASN QD 3.711 . 4.955 3.794 3.364 3.926 . 0 0 "[ . 1 . 2]" 1 1493 1 55 ASN HA 1 56 PRO HA 2.970 . 7.500 4.578 4.537 4.627 . 0 0 "[ . 1 . 2]" 1 1494 1 55 ASN HA 1 56 PRO HB2 2.982 . 7.500 5.163 5.113 5.255 . 0 0 "[ . 1 . 2]" 1 1495 1 55 ASN HA 1 56 PRO HB3 2.986 . 7.500 5.497 5.400 5.579 . 0 0 "[ . 1 . 2]" 1 1496 1 55 ASN HA 1 56 PRO HD2 2.176 . 2.768 2.513 2.441 2.585 . 0 0 "[ . 1 . 2]" 1 1497 1 55 ASN HA 1 56 PRO HD3 2.219 . 2.835 2.133 1.975 2.362 . 0 0 "[ . 1 . 2]" 1 1498 1 55 ASN HA 1 56 PRO HG2 2.648 . 7.500 4.482 4.394 4.569 . 0 0 "[ . 1 . 2]" 1 1499 1 55 ASN HA 1 56 PRO HG3 2.656 . 7.500 4.302 4.153 4.503 . 0 0 "[ . 1 . 2]" 1 1500 1 55 ASN HA 1 57 GLU H 3.028 . 4.174 3.317 3.146 3.434 . 0 0 "[ . 1 . 2]" 1 1501 1 55 ASN HB2 1 55 ASN QD 2.859 . 3.881 2.330 2.202 3.256 . 0 0 "[ . 1 . 2]" 1 1502 1 55 ASN HB2 1 56 PRO HD2 3.163 . 7.500 5.039 4.971 5.180 . 0 0 "[ . 1 . 2]" 1 1503 1 55 ASN HB2 1 56 PRO HD3 3.191 . 7.500 4.506 4.423 4.604 . 0 0 "[ . 1 . 2]" 1 1504 1 55 ASN HB2 1 58 ALA H 3.359 . 4.770 4.549 4.381 4.853 0.083 16 0 "[ . 1 . 2]" 1 1505 1 55 ASN HB2 1 58 ALA MB 2.433 . 7.500 3.642 3.515 3.870 . 0 0 "[ . 1 . 2]" 1 1506 1 55 ASN HB3 1 55 ASN QD 2.638 . 3.508 2.679 2.203 2.771 . 0 0 "[ . 1 . 2]" 1 1507 1 55 ASN HB3 1 56 PRO HD2 2.893 . 7.500 5.081 4.989 5.138 . 0 0 "[ . 1 . 2]" 1 1508 1 55 ASN HB3 1 56 PRO HD3 2.938 . 7.500 4.688 4.620 4.740 . 0 0 "[ . 1 . 2]" 1 1509 1 55 ASN HB3 1 57 GLU H 3.583 . 5.188 4.750 4.428 4.874 . 0 0 "[ . 1 . 2]" 1 1510 1 55 ASN HB3 1 58 ALA H 3.080 . 4.266 3.453 3.307 3.628 . 0 0 "[ . 1 . 2]" 1 1511 1 55 ASN HB3 1 58 ALA MB 2.175 . 2.767 2.423 2.288 2.580 . 0 0 "[ . 1 . 2]" 1 1512 1 55 ASN QD 1 57 GLU QB 3.356 . 4.764 3.608 3.392 3.899 . 0 0 "[ . 1 . 2]" 1 1513 1 55 ASN QD 1 58 ALA H 3.367 . 4.784 3.503 2.065 3.754 . 0 0 "[ . 1 . 2]" 1 1514 1 55 ASN QD 1 58 ALA HA 4.153 . 6.024 4.069 3.062 4.459 . 0 0 "[ . 1 . 2]" 1 1515 1 55 ASN QD 1 58 ALA MB 2.744 . 3.685 2.539 1.712 2.798 0.139 16 0 "[ . 1 . 2]" 1 1516 1 56 PRO HA 1 56 PRO HB3 2.010 . 2.515 2.265 2.256 2.269 . 0 0 "[ . 1 . 2]" 1 1517 1 56 PRO HA 1 56 PRO HD2 2.722 . 7.500 3.918 3.889 3.952 . 0 0 "[ . 1 . 2]" 1 1518 1 56 PRO HA 1 56 PRO HD3 2.666 . 7.500 3.898 3.824 3.939 . 0 0 "[ . 1 . 2]" 1 1519 1 56 PRO HA 1 57 GLU H 2.664 . 3.551 3.476 3.440 3.507 . 0 0 "[ . 1 . 2]" 1 1520 1 56 PRO HA 1 58 ALA H 3.408 . 4.860 4.094 3.848 4.257 . 0 0 "[ . 1 . 2]" 1 1521 1 56 PRO HA 1 59 ALA H 2.679 . 3.576 3.407 3.231 3.582 0.006 12 0 "[ . 1 . 2]" 1 1522 1 56 PRO HA 1 59 ALA MB 2.079 . 7.500 3.116 2.727 3.497 . 0 0 "[ . 1 . 2]" 1 1523 1 56 PRO HB2 1 56 PRO HD2 2.520 . 3.314 3.074 3.027 3.157 . 0 0 "[ . 1 . 2]" 1 1524 1 56 PRO HB2 1 56 PRO HD3 2.485 . 7.500 3.953 3.936 3.973 . 0 0 "[ . 1 . 2]" 1 1525 1 56 PRO HB2 1 57 GLU H 2.681 . 3.580 2.983 2.823 3.192 . 0 0 "[ . 1 . 2]" 1 1526 1 56 PRO HB2 1 57 GLU H 2.015 . 2.522 2.382 1.991 2.453 . 0 0 "[ . 1 . 2]" 1 1527 1 56 PRO HB2 1 57 GLU HA 3.141 . 4.374 3.960 3.887 4.048 . 0 0 "[ . 1 . 2]" 1 1528 1 56 PRO HB2 1 60 ASP H 3.293 . 4.648 4.413 4.276 4.533 . 0 0 "[ . 1 . 2]" 1 1529 1 56 PRO HB2 1 58 ALA H 3.186 . 4.455 4.302 4.189 4.387 . 0 0 "[ . 1 . 2]" 1 1530 1 56 PRO HB2 1 60 ASP H 3.323 . 4.704 4.391 4.191 4.516 . 0 0 "[ . 1 . 2]" 1 1531 1 56 PRO HB3 1 56 PRO HD2 2.606 . 7.500 3.900 3.875 3.936 . 0 0 "[ . 1 . 2]" 1 1532 1 56 PRO HB3 1 56 PRO HD3 2.559 . 7.500 4.001 3.966 4.022 . 0 0 "[ . 1 . 2]" 1 1533 1 56 PRO HB3 1 56 PRO HG2 2.340 . 3.025 2.723 2.709 2.734 . 0 0 "[ . 1 . 2]" 1 1534 1 56 PRO HB3 1 56 PRO HG3 2.289 . 2.944 2.284 2.270 2.294 . 0 0 "[ . 1 . 2]" 1 1535 1 56 PRO HB3 1 57 GLU H 2.772 . 7.500 4.145 4.068 4.249 . 0 0 "[ . 1 . 2]" 1 1536 1 56 PRO HB3 1 57 GLU HA 3.526 . 7.500 5.361 5.296 5.451 . 0 0 "[ . 1 . 2]" 1 1537 1 56 PRO HB3 1 60 ASP H 3.816 . 5.636 5.039 4.427 5.266 . 0 0 "[ . 1 . 2]" 1 1538 1 56 PRO HB3 1 59 ALA MB 2.724 . 7.500 4.365 4.061 4.708 . 0 0 "[ . 1 . 2]" 1 1539 1 56 PRO HD2 1 56 PRO HG2 2.265 . 2.906 2.301 2.284 2.313 . 0 0 "[ . 1 . 2]" 1 1540 1 56 PRO HD2 1 56 PRO HG3 2.319 . 2.991 2.984 2.971 2.992 0.001 17 0 "[ . 1 . 2]" 1 1541 1 56 PRO HD2 1 57 GLU H 2.614 . 3.468 2.127 2.043 2.289 . 0 0 "[ . 1 . 2]" 1 1542 1 56 PRO HD2 1 58 ALA H 3.472 . 4.978 4.325 4.222 4.455 . 0 0 "[ . 1 . 2]" 1 1543 1 56 PRO HD3 1 56 PRO HG2 2.327 . 3.004 2.682 2.665 2.708 . 0 0 "[ . 1 . 2]" 1 1544 1 56 PRO HD3 1 56 PRO QG 2.255 . 2.891 2.177 2.172 2.181 . 0 0 "[ . 1 . 2]" 1 1545 1 56 PRO HD3 1 56 PRO HG3 2.295 . 2.953 2.303 2.289 2.313 . 0 0 "[ . 1 . 2]" 1 1546 1 56 PRO HD3 1 57 GLU H 2.859 . 3.881 3.512 3.424 3.631 . 0 0 "[ . 1 . 2]" 1 1547 1 56 PRO HD3 1 58 ALA H 3.671 . 5.356 5.088 4.996 5.183 . 0 0 "[ . 1 . 2]" 1 1548 1 56 PRO HG2 1 57 GLU H 2.701 . 3.613 3.724 3.682 3.811 0.198 10 0 "[ . 1 . 2]" 1 1549 1 56 PRO HG2 1 57 GLU HA 3.565 . 7.500 5.650 5.576 5.735 . 0 0 "[ . 1 . 2]" 1 1550 1 56 PRO HG3 1 57 GLU H 2.813 . 7.500 4.332 4.298 4.397 . 0 0 "[ . 1 . 2]" 1 1551 1 57 GLU H 1 57 GLU HA 2.306 . 2.971 2.808 2.772 2.825 . 0 0 "[ . 1 . 2]" 1 1552 1 57 GLU H 1 57 GLU QB 2.311 . 2.979 2.513 2.011 2.603 . 0 0 "[ . 1 . 2]" 1 1553 1 57 GLU H 1 57 GLU HG2 2.368 . 3.069 2.912 1.742 3.185 0.116 15 0 "[ . 1 . 2]" 1 1554 1 57 GLU H 1 57 GLU HG3 2.434 . 3.174 2.234 1.826 3.505 0.331 10 0 "[ . 1 . 2]" 1 1555 1 57 GLU H 1 58 ALA H 2.296 . 2.955 2.613 2.518 2.730 . 0 0 "[ . 1 . 2]" 1 1556 1 57 GLU H 1 58 ALA MB 2.732 . 7.500 4.289 4.194 4.396 . 0 0 "[ . 1 . 2]" 1 1557 1 57 GLU H 1 58 ALA MB 2.759 . 7.500 4.033 3.966 4.087 . 0 0 "[ . 1 . 2]" 1 1558 1 57 GLU HA 1 57 GLU QB 2.085 . 2.629 2.305 2.148 2.346 . 0 0 "[ . 1 . 2]" 1 1559 1 57 GLU HA 1 57 GLU HG2 2.267 . 7.500 2.772 2.530 3.989 . 0 0 "[ . 1 . 2]" 1 1560 1 57 GLU HA 1 57 GLU QG 2.288 . 2.942 2.606 2.452 3.201 0.259 16 0 "[ . 1 . 2]" 1 1561 1 57 GLU HA 1 57 GLU HG3 2.285 . 2.937 3.293 3.127 3.826 0.889 4 3 "[ +. * 1 .- 2]" 1 1562 1 57 GLU HA 1 58 ALA H 2.630 . 3.494 3.498 3.428 3.525 0.031 18 0 "[ . 1 . 2]" 1 1563 1 57 GLU HA 1 58 ALA MB 3.042 . 4.199 4.163 3.921 4.262 0.063 4 0 "[ . 1 . 2]" 1 1564 1 57 GLU HA 1 60 ASP H 2.613 . 3.466 3.016 2.870 3.115 . 0 0 "[ . 1 . 2]" 1 1565 1 57 GLU HA 1 61 LYS H 3.227 . 4.529 3.915 3.769 4.008 . 0 0 "[ . 1 . 2]" 1 1566 1 57 GLU HA 1 60 ASP HB2 2.700 . 3.611 3.384 2.797 3.670 0.059 14 0 "[ . 1 . 2]" 1 1567 1 57 GLU HA 1 60 ASP QB 2.567 . 3.390 2.778 2.255 3.106 . 0 0 "[ . 1 . 2]" 1 1568 1 57 GLU HA 1 60 ASP HB3 2.718 . 3.642 2.963 2.379 3.351 . 0 0 "[ . 1 . 2]" 1 1569 1 57 GLU QB 1 58 ALA H 2.379 . 3.086 2.692 2.472 3.578 0.492 16 0 "[ . 1 . 2]" 1 1570 1 57 GLU QB 1 61 LYS H 3.431 . 4.903 4.499 4.288 4.863 . 0 0 "[ . 1 . 2]" 1 1571 1 57 GLU QB 1 61 LYS HB3 3.368 . 7.500 6.118 5.818 6.586 . 0 0 "[ . 1 . 2]" 1 1572 1 57 GLU QB 1 61 LYS HG2 3.132 . 4.358 3.631 3.363 3.982 . 0 0 "[ . 1 . 2]" 1 1573 1 57 GLU QB 1 61 LYS HG3 3.218 . 4.513 4.081 3.805 4.578 0.065 10 0 "[ . 1 . 2]" 1 1574 1 57 GLU QG 1 58 ALA H 2.796 . 3.774 3.681 2.176 3.903 0.129 3 0 "[ . 1 . 2]" 1 1575 1 57 GLU QG 1 61 LYS HG2 3.325 . 7.500 5.309 2.958 5.688 . 0 0 "[ . 1 . 2]" 1 1576 1 57 GLU HG2 1 58 ALA H 2.778 . 7.500 4.560 2.700 4.918 . 0 0 "[ . 1 . 2]" 1 1577 1 57 GLU HG2 1 60 ASP HB3 3.015 . 7.500 5.212 4.674 5.841 . 0 0 "[ . 1 . 2]" 1 1578 1 57 GLU HG3 1 58 ALA H 2.788 . 7.500 3.938 2.295 4.791 . 0 0 "[ . 1 . 2]" 1 1579 1 57 GLU HG3 1 60 ASP HB3 2.984 . 7.500 5.998 4.801 6.520 . 0 0 "[ . 1 . 2]" 1 1580 1 58 ALA H 1 58 ALA HA 2.457 . 3.212 2.796 2.772 2.826 . 0 0 "[ . 1 . 2]" 1 1581 1 58 ALA H 1 58 ALA MB 2.009 . 2.513 2.242 2.224 2.260 . 0 0 "[ . 1 . 2]" 1 1582 1 58 ALA HA 1 58 ALA MB 1.959 . 2.439 2.125 2.121 2.131 . 0 0 "[ . 1 . 2]" 1 1583 1 58 ALA HA 1 59 ALA H 2.706 . 3.621 3.527 3.499 3.555 . 0 0 "[ . 1 . 2]" 1 1584 1 58 ALA HA 1 60 ASP H 3.299 . 4.660 4.040 3.862 4.192 . 0 0 "[ . 1 . 2]" 1 1585 1 58 ALA HA 1 60 ASP HB3 3.185 . 4.453 4.370 4.240 4.527 0.074 7 0 "[ . 1 . 2]" 1 1586 1 58 ALA HA 1 61 LYS H 2.646 . 3.521 3.227 3.120 3.313 . 0 0 "[ . 1 . 2]" 1 1587 1 58 ALA HA 1 61 LYS HB2 2.790 . 3.763 2.620 2.328 2.891 . 0 0 "[ . 1 . 2]" 1 1588 1 58 ALA HA 1 61 LYS HD3 2.530 . 7.500 4.950 4.599 5.066 . 0 0 "[ . 1 . 2]" 1 1589 1 58 ALA HA 1 61 LYS HG3 2.490 . 3.265 2.505 2.180 2.626 . 0 0 "[ . 1 . 2]" 1 1590 1 58 ALA HA 1 62 PHE H 3.194 . 4.469 3.759 3.621 3.878 . 0 0 "[ . 1 . 2]" 1 1591 1 58 ALA MB 1 59 ALA H 2.360 . 3.056 2.646 2.448 2.788 . 0 0 "[ . 1 . 2]" 1 1592 1 58 ALA MB 1 59 ALA H 1.967 . 2.451 2.117 2.066 2.155 . 0 0 "[ . 1 . 2]" 1 1593 1 58 ALA MB 1 61 LYS H 2.767 . 7.500 4.024 3.958 4.119 . 0 0 "[ . 1 . 2]" 1 1594 1 58 ALA MB 1 62 PHE H 2.966 . 4.066 3.893 3.834 3.966 . 0 0 "[ . 1 . 2]" 1 1595 1 58 ALA MB 1 61 LYS HG3 2.901 . 3.953 3.967 3.689 4.030 0.077 5 0 "[ . 1 . 2]" 1 1596 1 58 ALA MB 1 62 PHE H 3.202 . 4.484 4.233 4.165 4.372 . 0 0 "[ . 1 . 2]" 1 1597 1 59 ALA H 1 59 ALA HA 2.423 . 3.157 2.803 2.777 2.823 . 0 0 "[ . 1 . 2]" 1 1598 1 59 ALA H 1 59 ALA MB 1.885 . 2.329 2.230 2.210 2.251 . 0 0 "[ . 1 . 2]" 1 1599 1 59 ALA H 1 60 ASP H 2.362 . 3.059 2.649 2.568 2.742 . 0 0 "[ . 1 . 2]" 1 1600 1 59 ALA H 1 60 ASP H 2.284 . 2.936 2.332 2.219 2.425 . 0 0 "[ . 1 . 2]" 1 1601 1 59 ALA H 1 60 ASP QB 3.091 . 7.500 4.362 4.304 4.460 . 0 0 "[ . 1 . 2]" 1 1602 1 59 ALA HA 1 59 ALA MB 1.851 . 2.279 2.129 2.124 2.135 . 0 0 "[ . 1 . 2]" 1 1603 1 59 ALA HA 1 60 ASP H 2.796 . 3.773 3.503 3.465 3.522 . 0 0 "[ . 1 . 2]" 1 1604 1 59 ALA HA 1 62 PHE H 2.806 . 3.790 3.448 3.361 3.523 . 0 0 "[ . 1 . 2]" 1 1605 1 59 ALA HA 1 62 PHE HB2 2.814 . 3.804 3.414 3.291 3.512 . 0 0 "[ . 1 . 2]" 1 1606 1 59 ALA HA 1 62 PHE HB3 2.687 . 3.589 2.429 2.331 2.549 . 0 0 "[ . 1 . 2]" 1 1607 1 59 ALA HA 1 63 LYS H 3.129 . 7.500 4.398 4.147 4.462 . 0 0 "[ . 1 . 2]" 1 1608 1 59 ALA MB 1 60 ASP H 2.105 . 2.659 2.467 2.309 2.682 0.023 15 0 "[ . 1 . 2]" 1 1609 1 59 ALA MB 1 60 ASP HB2 2.764 . 3.719 3.839 3.795 3.883 0.164 6 0 "[ . 1 . 2]" 1 1610 1 59 ALA MB 1 60 ASP QB 2.709 . 3.626 3.638 3.605 3.664 0.038 8 0 "[ . 1 . 2]" 1 1611 1 59 ALA MB 1 60 ASP HB3 3.078 . 7.500 4.512 4.407 4.635 . 0 0 "[ . 1 . 2]" 1 1612 1 59 ALA MB 1 62 PHE H 2.961 . 7.500 4.547 4.475 4.619 . 0 0 "[ . 1 . 2]" 1 1613 1 59 ALA MB 1 62 PHE HB2 2.979 . 7.500 4.910 4.812 4.991 . 0 0 "[ . 1 . 2]" 1 1614 1 59 ALA MB 1 62 PHE HB3 2.864 . 3.889 3.915 3.827 3.995 0.106 6 0 "[ . 1 . 2]" 1 1615 1 59 ALA MB 1 63 LYS H 3.413 . 4.869 4.843 4.629 4.894 0.025 6 0 "[ . 1 . 2]" 1 1616 1 59 ALA MB 1 63 LYS QE 2.944 . 4.028 4.084 3.958 4.204 0.176 17 0 "[ . 1 . 2]" 1 1617 1 60 ASP H 1 60 ASP HA 2.369 . 3.071 2.839 2.804 2.890 . 0 0 "[ . 1 . 2]" 1 1618 1 60 ASP H 1 60 ASP HB2 2.307 . 2.972 2.501 2.381 2.601 . 0 0 "[ . 1 . 2]" 1 1619 1 60 ASP H 1 60 ASP QB 2.205 . 2.813 2.220 2.193 2.246 . 0 0 "[ . 1 . 2]" 1 1620 1 60 ASP H 1 60 ASP HB3 2.339 . 3.023 2.490 2.401 2.600 . 0 0 "[ . 1 . 2]" 1 1621 1 60 ASP H 1 61 LYS H 2.490 . 3.265 2.592 2.423 2.754 . 0 0 "[ . 1 . 2]" 1 1622 1 60 ASP H 1 61 LYS HB2 3.337 . 4.729 4.482 4.335 4.699 . 0 0 "[ . 1 . 2]" 1 1623 1 60 ASP H 1 61 LYS HG2 3.424 . 4.890 4.000 3.783 4.360 . 0 0 "[ . 1 . 2]" 1 1624 1 60 ASP H 1 62 PHE H 3.473 . 4.981 3.921 3.762 4.053 . 0 0 "[ . 1 . 2]" 1 1625 1 60 ASP HA 1 60 ASP HB2 2.226 . 2.845 2.473 2.419 2.533 . 0 0 "[ . 1 . 2]" 1 1626 1 60 ASP HA 1 60 ASP HB3 2.359 . 3.055 3.026 3.022 3.029 . 0 0 "[ . 1 . 2]" 1 1627 1 60 ASP HA 1 61 LYS H 2.900 . 3.952 3.544 3.512 3.577 . 0 0 "[ . 1 . 2]" 1 1628 1 60 ASP HA 1 61 LYS HA 2.873 . 7.500 4.820 4.776 4.856 . 0 0 "[ . 1 . 2]" 1 1629 1 60 ASP HA 1 62 PHE H 3.198 . 4.476 4.424 4.318 4.500 0.024 5 0 "[ . 1 . 2]" 1 1630 1 60 ASP HA 1 63 LYS H 2.663 . 3.549 3.354 3.123 3.491 . 0 0 "[ . 1 . 2]" 1 1631 1 60 ASP HA 1 63 LYS HB3 2.176 . 2.768 2.259 1.848 2.441 . 0 0 "[ . 1 . 2]" 1 1632 1 60 ASP HA 1 63 LYS QE 2.338 . 3.021 1.937 1.628 3.022 0.027 3 0 "[ . 1 . 2]" 1 1633 1 60 ASP HA 1 63 LYS HG2 2.831 . 3.833 3.897 3.836 3.976 0.143 10 0 "[ . 1 . 2]" 1 1634 1 60 ASP HA 1 63 LYS HG3 3.142 . 7.500 4.863 4.322 5.052 . 0 0 "[ . 1 . 2]" 1 1635 1 60 ASP HB2 1 61 LYS H 2.541 . 7.500 3.799 3.726 3.884 . 0 0 "[ . 1 . 2]" 1 1636 1 60 ASP HB3 1 61 LYS H 2.489 . 3.263 2.502 2.326 2.624 . 0 0 "[ . 1 . 2]" 1 1637 1 60 ASP HB3 1 62 PHE H 3.653 . 5.321 4.291 4.201 4.444 . 0 0 "[ . 1 . 2]" 1 1638 1 61 LYS H 1 61 LYS HA 2.460 . 3.216 2.807 2.777 2.834 . 0 0 "[ . 1 . 2]" 1 1639 1 61 LYS H 1 61 LYS HB2 2.628 . 3.491 2.655 2.494 2.730 . 0 0 "[ . 1 . 2]" 1 1640 1 61 LYS H 1 61 LYS HB2 2.358 . 3.053 2.544 2.438 2.610 . 0 0 "[ . 1 . 2]" 1 1641 1 61 LYS H 1 61 LYS HB3 2.545 . 7.500 3.566 3.552 3.582 . 0 0 "[ . 1 . 2]" 1 1642 1 61 LYS H 1 61 LYS HB3 2.440 . 7.500 3.405 3.370 3.456 . 0 0 "[ . 1 . 2]" 1 1643 1 61 LYS H 1 61 LYS HD2 3.019 . 4.158 4.330 4.208 4.671 0.513 13 1 "[ . 1 + . 2]" 1 1644 1 61 LYS H 1 61 LYS HD3 3.022 . 7.500 4.322 4.172 4.617 . 0 0 "[ . 1 . 2]" 1 1645 1 61 LYS H 1 61 LYS QE 2.815 . 3.805 3.056 2.735 3.828 0.023 1 0 "[ . 1 . 2]" 1 1646 1 61 LYS H 1 61 LYS HG3 2.539 . 3.345 3.285 2.990 3.441 0.096 13 0 "[ . 1 . 2]" 1 1647 1 61 LYS H 1 62 PHE H 2.596 . 3.438 2.675 2.573 2.787 . 0 0 "[ . 1 . 2]" 1 1648 1 61 LYS H 1 62 PHE H 2.655 . 3.536 2.333 2.281 2.386 . 0 0 "[ . 1 . 2]" 1 1649 1 61 LYS H 1 62 PHE HB2 3.874 . 5.750 5.138 5.036 5.259 . 0 0 "[ . 1 . 2]" 1 1650 1 61 LYS H 1 62 PHE HB3 3.755 . 5.518 4.786 4.701 4.896 . 0 0 "[ . 1 . 2]" 1 1651 1 61 LYS HA 1 61 LYS HB2 2.310 . 2.977 3.008 2.999 3.015 0.038 11 0 "[ . 1 . 2]" 1 1652 1 61 LYS HA 1 61 LYS HB3 2.489 . 3.264 2.393 2.352 2.468 . 0 0 "[ . 1 . 2]" 1 1653 1 61 LYS HA 1 61 LYS HD2 2.582 . 7.500 4.087 3.904 4.208 . 0 0 "[ . 1 . 2]" 1 1654 1 61 LYS HA 1 61 LYS QE 2.880 . 3.916 1.859 1.786 2.137 0.058 4 0 "[ . 1 . 2]" 1 1655 1 61 LYS HA 1 61 LYS HG2 2.520 . 3.314 3.050 2.788 3.168 . 0 0 "[ . 1 . 2]" 1 1656 1 61 LYS HA 1 62 PHE H 3.060 . 4.230 3.530 3.519 3.543 . 0 0 "[ . 1 . 2]" 1 1657 1 61 LYS HA 1 64 GLU H 2.584 . 3.419 3.060 2.972 3.101 . 0 0 "[ . 1 . 2]" 1 1658 1 61 LYS HA 1 64 GLU QB 2.543 . 7.500 4.037 3.894 4.187 . 0 0 "[ . 1 . 2]" 1 1659 1 61 LYS HA 1 64 GLU HG3 2.662 . 3.548 3.019 2.778 3.232 . 0 0 "[ . 1 . 2]" 1 1660 1 61 LYS HB2 1 61 LYS QE 2.943 . 4.026 3.727 3.513 3.950 . 0 0 "[ . 1 . 2]" 1 1661 1 61 LYS HB2 1 62 PHE H 2.810 . 3.797 2.405 2.308 2.487 . 0 0 "[ . 1 . 2]" 1 1662 1 61 LYS HB3 1 61 LYS HE3 3.003 . 4.130 3.859 2.261 4.489 0.359 16 0 "[ . 1 . 2]" 1 1663 1 61 LYS HB3 1 61 LYS HG2 2.391 . 3.105 2.987 2.934 3.001 . 0 0 "[ . 1 . 2]" 1 1664 1 61 LYS HB3 1 61 LYS HG3 2.300 . 2.961 2.554 2.490 2.696 . 0 0 "[ . 1 . 2]" 1 1665 1 61 LYS HB3 1 62 PHE H 2.849 . 3.864 3.657 3.438 3.769 . 0 0 "[ . 1 . 2]" 1 1666 1 61 LYS HB3 1 64 GLU HG3 3.118 . 4.333 4.237 4.038 4.351 0.018 10 0 "[ . 1 . 2]" 1 1667 1 61 LYS QD 1 61 LYS HG2 2.307 . 2.972 2.424 2.320 2.510 . 0 0 "[ . 1 . 2]" 1 1668 1 61 LYS QD 1 61 LYS HG3 2.309 . 2.976 2.154 2.141 2.168 . 0 0 "[ . 1 . 2]" 1 1669 1 61 LYS HD2 1 61 LYS QE 2.294 . 2.952 2.345 2.305 2.415 . 0 0 "[ . 1 . 2]" 1 1670 1 61 LYS HD3 1 61 LYS QE 2.265 . 2.906 2.313 2.165 2.391 . 0 0 "[ . 1 . 2]" 1 1671 1 61 LYS HD3 1 61 LYS QG 2.328 . 3.005 2.433 2.333 2.508 . 0 0 "[ . 1 . 2]" 1 1672 1 61 LYS QE 1 61 LYS HG2 2.469 . 3.231 2.390 2.186 2.942 . 0 0 "[ . 1 . 2]" 1 1673 1 61 LYS QE 1 61 LYS HG3 2.391 . 7.500 3.314 3.156 3.513 . 0 0 "[ . 1 . 2]" 1 1674 1 61 LYS QE 1 62 PHE H 3.459 . 4.955 4.716 4.552 4.970 0.015 13 0 "[ . 1 . 2]" 1 1675 1 61 LYS QE 1 64 GLU HG2 3.103 . 4.307 3.102 2.880 3.396 . 0 0 "[ . 1 . 2]" 1 1676 1 61 LYS QE 1 64 GLU HG3 3.048 . 7.500 3.914 3.265 4.401 . 0 0 "[ . 1 . 2]" 1 1677 1 61 LYS QE 1 65 ILE MD 2.936 . 7.500 5.739 4.952 6.246 . 0 0 "[ . 1 . 2]" 1 1678 1 61 LYS QE 1 65 ILE MG 3.049 . 7.500 4.676 3.706 5.231 . 0 0 "[ . 1 . 2]" 1 1679 1 61 LYS HG2 1 62 PHE H 3.160 . 4.408 3.948 3.820 4.141 . 0 0 "[ . 1 . 2]" 1 1680 1 61 LYS HG3 1 62 PHE H 3.199 . 4.478 4.469 4.344 4.582 0.104 13 0 "[ . 1 . 2]" 1 1681 1 62 PHE H 1 62 PHE HA 2.657 . 3.540 2.811 2.799 2.827 . 0 0 "[ . 1 . 2]" 1 1682 1 62 PHE H 1 62 PHE HB2 2.640 . 3.512 2.593 2.517 2.637 . 0 0 "[ . 1 . 2]" 1 1683 1 62 PHE H 1 62 PHE HB3 2.630 . 3.494 2.474 2.419 2.517 . 0 0 "[ . 1 . 2]" 1 1684 1 62 PHE H 1 63 LYS H 2.693 . 3.599 2.572 2.515 2.610 . 0 0 "[ . 1 . 2]" 1 1685 1 62 PHE H 1 63 LYS HA 3.474 . 7.500 5.169 5.102 5.216 . 0 0 "[ . 1 . 2]" 1 1686 1 62 PHE H 1 63 LYS HB3 3.008 . 4.139 4.298 4.236 4.342 0.203 6 0 "[ . 1 . 2]" 1 1687 1 62 PHE H 1 64 GLU H 3.511 . 5.052 4.338 4.248 4.427 . 0 0 "[ . 1 . 2]" 1 1688 1 62 PHE H 1 65 ILE MD 3.127 . 4.349 3.835 3.710 3.916 . 0 0 "[ . 1 . 2]" 1 1689 1 62 PHE HA 1 62 PHE HB2 2.721 . 3.646 2.435 2.414 2.458 . 0 0 "[ . 1 . 2]" 1 1690 1 62 PHE HA 1 62 PHE HB3 2.775 . 3.738 3.032 3.027 3.036 . 0 0 "[ . 1 . 2]" 1 1691 1 62 PHE HA 1 63 LYS H 3.035 . 4.187 3.399 3.371 3.425 . 0 0 "[ . 1 . 2]" 1 1692 1 62 PHE HA 1 65 ILE H 2.937 . 4.015 3.196 3.144 3.254 . 0 0 "[ . 1 . 2]" 1 1693 1 62 PHE HA 1 66 ASN HA 3.204 . 4.487 4.538 4.439 4.626 0.139 19 0 "[ . 1 . 2]" 1 1694 1 62 PHE HA 1 65 ILE H 3.046 . 4.206 3.664 3.535 3.820 . 0 0 "[ . 1 . 2]" 1 1695 1 62 PHE HA 1 65 ILE HB 2.868 . 7.500 4.567 4.476 4.700 . 0 0 "[ . 1 . 2]" 1 1696 1 62 PHE HA 1 65 ILE MD 2.250 . 2.883 1.721 1.647 1.796 . 0 0 "[ . 1 . 2]" 1 1697 1 62 PHE HA 1 65 ILE HG12 2.909 . 3.967 1.932 1.818 2.110 0.033 10 0 "[ . 1 . 2]" 1 1698 1 62 PHE HA 1 65 ILE HG13 2.958 . 4.052 2.912 2.789 3.012 . 0 0 "[ . 1 . 2]" 1 1699 1 62 PHE HA 1 65 ILE MG 2.479 . 7.500 3.501 3.345 3.631 . 0 0 "[ . 1 . 2]" 1 1700 1 62 PHE HA 1 66 ASN H 3.195 . 4.471 3.827 3.698 3.958 . 0 0 "[ . 1 . 2]" 1 1701 1 62 PHE HB2 1 63 LYS H 2.921 . 7.500 4.117 4.063 4.181 . 0 0 "[ . 1 . 2]" 1 1702 1 62 PHE HB2 1 63 LYS QB 3.324 . 7.500 5.389 5.325 5.451 . 0 0 "[ . 1 . 2]" 1 1703 1 62 PHE HB2 1 65 ILE MD 3.169 . 4.425 3.152 3.054 3.285 . 0 0 "[ . 1 . 2]" 1 1704 1 62 PHE HB3 1 63 LYS H 2.775 . 3.738 3.039 2.924 3.145 . 0 0 "[ . 1 . 2]" 1 1705 1 62 PHE HB3 1 63 LYS QB 3.123 . 4.342 4.036 3.941 4.125 . 0 0 "[ . 1 . 2]" 1 1706 1 62 PHE HB3 1 65 ILE MD 3.304 . 4.668 4.151 4.094 4.227 . 0 0 "[ . 1 . 2]" 1 1707 1 63 LYS H 1 63 LYS HA 2.420 . 3.152 2.871 2.842 2.889 . 0 0 "[ . 1 . 2]" 1 1708 1 63 LYS H 1 63 LYS HB3 2.132 . 2.700 2.060 2.018 2.101 . 0 0 "[ . 1 . 2]" 1 1709 1 63 LYS H 1 63 LYS QD 2.957 . 7.500 4.694 4.128 4.823 . 0 0 "[ . 1 . 2]" 1 1710 1 63 LYS H 1 63 LYS HG2 2.814 . 3.804 3.860 3.723 3.954 0.150 7 0 "[ . 1 . 2]" 1 1711 1 63 LYS H 1 63 LYS HG3 2.665 . 7.500 4.450 4.390 4.540 . 0 0 "[ . 1 . 2]" 1 1712 1 63 LYS H 1 64 GLU H 2.511 . 3.299 2.465 2.355 2.603 . 0 0 "[ . 1 . 2]" 1 1713 1 63 LYS H 1 64 GLU HA 2.754 . 7.500 4.098 4.003 4.220 . 0 0 "[ . 1 . 2]" 1 1714 1 63 LYS H 1 64 GLU QB 3.354 . 4.760 4.266 4.167 4.373 . 0 0 "[ . 1 . 2]" 1 1715 1 63 LYS H 1 64 GLU HG2 2.892 . 3.938 3.729 3.590 3.936 . 0 0 "[ . 1 . 2]" 1 1716 1 63 LYS H 1 64 GLU HG3 3.007 . 7.500 4.790 4.575 5.015 . 0 0 "[ . 1 . 2]" 1 1717 1 63 LYS H 1 65 ILE H 3.458 . 4.953 3.839 3.703 3.967 . 0 0 "[ . 1 . 2]" 1 1718 1 63 LYS H 1 65 ILE MD 3.225 . 4.525 4.575 4.537 4.629 0.104 3 0 "[ . 1 . 2]" 1 1719 1 63 LYS H 1 66 ASN QB 2.884 . 7.500 4.307 4.246 4.363 . 0 0 "[ . 1 . 2]" 1 1720 1 63 LYS HA 1 63 LYS HB2 2.056 . 2.584 2.260 2.229 2.290 . 0 0 "[ . 1 . 2]" 1 1721 1 63 LYS HA 1 63 LYS HG3 2.536 . 3.340 2.983 2.876 3.175 . 0 0 "[ . 1 . 2]" 1 1722 1 63 LYS HA 1 64 GLU H 2.791 . 3.765 3.560 3.533 3.583 . 0 0 "[ . 1 . 2]" 1 1723 1 63 LYS HA 1 66 ASN H 2.680 . 3.578 3.407 3.324 3.490 . 0 0 "[ . 1 . 2]" 1 1724 1 63 LYS HA 1 66 ASN QB 2.308 . 2.974 2.264 2.177 2.363 . 0 0 "[ . 1 . 2]" 1 1725 1 63 LYS HA 1 66 ASN HD21 3.322 . 4.701 4.006 3.795 4.300 . 0 0 "[ . 1 . 2]" 1 1726 1 63 LYS HA 1 67 ASN H 3.343 . 4.740 4.561 4.335 4.748 0.008 11 0 "[ . 1 . 2]" 1 1727 1 63 LYS HB2 1 66 ASN HB2 2.932 . 4.006 4.022 3.927 4.107 0.101 15 0 "[ . 1 . 2]" 1 1728 1 63 LYS QB 1 63 LYS HG3 2.233 . 2.857 2.370 2.252 2.422 . 0 0 "[ . 1 . 2]" 1 1729 1 63 LYS QB 1 64 GLU HA 3.011 . 7.500 4.681 4.589 4.729 . 0 0 "[ . 1 . 2]" 1 1730 1 63 LYS QB 1 66 ASN H 3.826 . 5.656 4.895 4.848 4.950 . 0 0 "[ . 1 . 2]" 1 1731 1 63 LYS HB3 1 63 LYS HG2 2.201 . 2.807 2.399 2.330 2.552 . 0 0 "[ . 1 . 2]" 1 1732 1 63 LYS HB3 1 64 GLU H 2.365 . 3.064 2.988 2.857 3.071 0.007 18 0 "[ . 1 . 2]" 1 1733 1 63 LYS QE 1 63 LYS HG2 2.566 . 3.389 2.735 2.304 3.425 0.036 13 0 "[ . 1 . 2]" 1 1734 1 63 LYS HG2 1 64 GLU H 3.083 . 4.271 3.018 2.743 3.258 . 0 0 "[ . 1 . 2]" 1 1735 1 63 LYS HG2 1 64 GLU HA 3.091 . 4.285 3.478 3.157 3.702 . 0 0 "[ . 1 . 2]" 1 1736 1 63 LYS HG3 1 64 GLU H 3.187 . 4.457 4.114 3.798 4.368 . 0 0 "[ . 1 . 2]" 1 1737 1 63 LYS HG3 1 64 GLU H 3.231 . 4.536 3.984 3.730 4.210 . 0 0 "[ . 1 . 2]" 1 1738 1 64 GLU H 1 64 GLU HA 2.453 . 3.205 2.873 2.844 2.891 . 0 0 "[ . 1 . 2]" 1 1739 1 64 GLU H 1 64 GLU HB3 2.273 . 2.919 2.848 2.744 2.939 0.020 5 0 "[ . 1 . 2]" 1 1740 1 64 GLU H 1 64 GLU HG2 2.525 . 3.322 1.955 1.822 2.058 . 0 0 "[ . 1 . 2]" 1 1741 1 64 GLU H 1 64 GLU HG3 2.322 . 2.996 2.923 2.787 3.018 0.022 16 0 "[ . 1 . 2]" 1 1742 1 64 GLU H 1 65 ILE H 2.739 . 3.677 2.506 2.435 2.616 . 0 0 "[ . 1 . 2]" 1 1743 1 64 GLU H 1 65 ILE HA 3.343 . 7.500 5.147 5.088 5.241 . 0 0 "[ . 1 . 2]" 1 1744 1 64 GLU H 1 65 ILE HB 3.491 . 7.500 6.122 6.027 6.223 . 0 0 "[ . 1 . 2]" 1 1745 1 64 GLU H 1 65 ILE MD 3.813 . 5.631 5.000 4.887 5.071 . 0 0 "[ . 1 . 2]" 1 1746 1 64 GLU H 1 65 ILE MG 3.046 . 4.206 3.964 3.877 4.071 . 0 0 "[ . 1 . 2]" 1 1747 1 64 GLU H 1 66 ASN H 3.649 . 5.313 3.799 3.679 3.889 . 0 0 "[ . 1 . 2]" 1 1748 1 64 GLU H 1 66 ASN QB 3.341 . 4.736 4.380 4.237 4.556 . 0 0 "[ . 1 . 2]" 1 1749 1 64 GLU H 1 67 ASN H 3.976 . 5.952 4.692 4.546 4.773 . 0 0 "[ . 1 . 2]" 1 1750 1 64 GLU HA 1 64 GLU QB 2.338 . 3.021 2.173 2.166 2.182 . 0 0 "[ . 1 . 2]" 1 1751 1 64 GLU HA 1 64 GLU HG2 2.417 . 7.500 3.719 3.652 3.768 . 0 0 "[ . 1 . 2]" 1 1752 1 64 GLU HA 1 64 GLU HG3 2.393 . 7.500 3.782 3.731 3.834 . 0 0 "[ . 1 . 2]" 1 1753 1 64 GLU HA 1 65 ILE H 2.944 . 4.027 3.523 3.509 3.533 . 0 0 "[ . 1 . 2]" 1 1754 1 64 GLU HA 1 65 ILE MG 3.463 . 4.962 4.894 4.834 4.956 . 0 0 "[ . 1 . 2]" 1 1755 1 64 GLU HA 1 66 ASN H 2.702 . 3.615 3.171 2.975 3.302 . 0 0 "[ . 1 . 2]" 1 1756 1 64 GLU HA 1 66 ASN HA 3.188 . 7.500 4.916 4.700 5.039 . 0 0 "[ . 1 . 2]" 1 1757 1 64 GLU HA 1 67 ASN H 2.925 . 3.994 3.281 3.048 3.441 . 0 0 "[ . 1 . 2]" 1 1758 1 64 GLU HA 1 67 ASN HB3 2.364 . 3.063 3.084 2.831 3.169 0.106 4 0 "[ . 1 . 2]" 1 1759 1 64 GLU HA 1 67 ASN HD21 3.543 . 5.112 4.916 4.680 5.070 . 0 0 "[ . 1 . 2]" 1 1760 1 64 GLU HA 1 67 ASN HD22 3.405 . 7.500 6.064 5.747 6.273 . 0 0 "[ . 1 . 2]" 1 1761 1 64 GLU HA 1 68 ALA H 3.332 . 4.720 4.317 4.195 4.471 . 0 0 "[ . 1 . 2]" 1 1762 1 64 GLU QB 1 65 ILE MD 3.044 . 7.500 5.810 5.749 5.897 . 0 0 "[ . 1 . 2]" 1 1763 1 64 GLU QB 1 65 ILE MG 3.094 . 4.290 3.879 3.848 3.919 . 0 0 "[ . 1 . 2]" 1 1764 1 64 GLU QB 1 67 ASN QB 3.234 . 4.541 3.761 3.555 3.905 . 0 0 "[ . 1 . 2]" 1 1765 1 64 GLU HB2 1 65 ILE H 2.811 . 3.799 3.662 3.591 3.713 . 0 0 "[ . 1 . 2]" 1 1766 1 64 GLU HB2 1 65 ILE MG 2.921 . 3.988 4.085 4.051 4.117 0.129 8 0 "[ . 1 . 2]" 1 1767 1 64 GLU HB3 1 64 GLU HG3 2.618 . 3.475 3.008 3.003 3.011 . 0 0 "[ . 1 . 2]" 1 1768 1 64 GLU HG2 1 65 ILE H 2.948 . 4.035 2.945 2.830 3.051 . 0 0 "[ . 1 . 2]" 1 1769 1 64 GLU HG3 1 65 ILE H 3.037 . 4.190 2.248 2.053 2.432 . 0 0 "[ . 1 . 2]" 1 1770 1 64 GLU HG3 1 65 ILE HA 3.423 . 4.888 3.777 3.575 3.980 . 0 0 "[ . 1 . 2]" 1 1771 1 64 GLU HG3 1 65 ILE MG 3.020 . 4.160 2.218 2.068 2.398 . 0 0 "[ . 1 . 2]" 1 1772 1 64 GLU HG3 1 66 ASN H 3.433 . 4.906 4.393 4.245 4.567 . 0 0 "[ . 1 . 2]" 1 1773 1 65 ILE H 1 65 ILE HA 2.959 . 4.054 2.850 2.843 2.860 . 0 0 "[ . 1 . 2]" 1 1774 1 65 ILE H 1 65 ILE HA 2.620 . 3.478 2.704 2.658 2.726 . 0 0 "[ . 1 . 2]" 1 1775 1 65 ILE H 1 65 ILE HB 2.742 . 3.682 3.641 3.627 3.654 . 0 0 "[ . 1 . 2]" 1 1776 1 65 ILE H 1 65 ILE MD 2.487 . 7.500 3.552 3.487 3.610 . 0 0 "[ . 1 . 2]" 1 1777 1 65 ILE H 1 65 ILE HG12 2.909 . 3.967 2.082 2.036 2.153 . 0 0 "[ . 1 . 2]" 1 1778 1 65 ILE H 1 65 ILE HG13 2.866 . 3.893 3.367 3.279 3.486 . 0 0 "[ . 1 . 2]" 1 1779 1 65 ILE H 1 65 ILE MG 2.392 . 3.107 2.114 2.045 2.178 . 0 0 "[ . 1 . 2]" 1 1780 1 65 ILE H 1 66 ASN H 2.788 . 3.760 2.461 2.427 2.491 . 0 0 "[ . 1 . 2]" 1 1781 1 65 ILE H 1 66 ASN QB 2.983 . 4.095 4.125 4.075 4.172 0.077 15 0 "[ . 1 . 2]" 1 1782 1 65 ILE H 1 67 ASN QB 4.017 . 6.035 4.669 4.546 4.776 . 0 0 "[ . 1 . 2]" 1 1783 1 65 ILE HA 1 65 ILE HB 2.656 . 3.538 2.428 2.401 2.447 . 0 0 "[ . 1 . 2]" 1 1784 1 65 ILE HA 1 65 ILE HG12 3.052 . 4.216 3.700 3.683 3.715 . 0 0 "[ . 1 . 2]" 1 1785 1 65 ILE HA 1 65 ILE HG13 2.809 . 3.795 3.741 3.713 3.774 . 0 0 "[ . 1 . 2]" 1 1786 1 65 ILE HA 1 65 ILE MG 2.167 . 2.754 2.378 2.355 2.404 . 0 0 "[ . 1 . 2]" 1 1787 1 65 ILE HA 1 66 ASN H 3.204 . 4.487 3.482 3.469 3.499 . 0 0 "[ . 1 . 2]" 1 1788 1 65 ILE HA 1 66 ASN H 2.913 . 3.974 3.168 3.115 3.259 . 0 0 "[ . 1 . 2]" 1 1789 1 65 ILE HA 1 66 ASN HA 3.140 . 4.373 4.274 4.239 4.296 . 0 0 "[ . 1 . 2]" 1 1790 1 65 ILE HA 1 67 ASN H 3.501 . 5.033 3.649 3.518 3.925 . 0 0 "[ . 1 . 2]" 1 1791 1 65 ILE HA 1 67 ASN HB3 2.974 . 4.080 3.636 3.494 3.709 . 0 0 "[ . 1 . 2]" 1 1792 1 65 ILE HA 1 67 ASN HB3 3.294 . 4.651 3.969 3.662 4.169 . 0 0 "[ . 1 . 2]" 1 1793 1 65 ILE HA 1 68 ALA H 2.977 . 4.085 3.218 3.117 3.317 . 0 0 "[ . 1 . 2]" 1 1794 1 65 ILE HA 1 68 ALA MB 2.572 . 3.399 2.764 2.334 3.080 . 0 0 "[ . 1 . 2]" 1 1795 1 65 ILE HB 1 65 ILE MD 2.147 . 2.723 2.500 2.472 2.532 . 0 0 "[ . 1 . 2]" 1 1796 1 65 ILE HB 1 65 ILE MG 2.102 . 2.654 2.123 2.121 2.126 . 0 0 "[ . 1 . 2]" 1 1797 1 65 ILE HB 1 66 ASN H 2.897 . 3.946 3.862 3.786 3.941 . 0 0 "[ . 1 . 2]" 1 1798 1 65 ILE MD 1 65 ILE HG12 2.253 . 2.887 2.115 2.112 2.118 . 0 0 "[ . 1 . 2]" 1 1799 1 65 ILE MD 1 65 ILE HG13 2.230 . 2.852 2.118 2.115 2.119 . 0 0 "[ . 1 . 2]" 1 1800 1 65 ILE MD 1 66 ASN H 2.686 . 7.500 3.851 3.756 3.920 . 0 0 "[ . 1 . 2]" 1 1801 1 65 ILE MD 1 66 ASN HA 3.049 . 7.500 4.829 4.699 4.940 . 0 0 "[ . 1 . 2]" 1 1802 1 65 ILE MD 1 66 ASN QB 3.321 . 4.700 4.435 4.137 4.609 . 0 0 "[ . 1 . 2]" 1 1803 1 65 ILE HG12 1 65 ILE MG 2.391 . 3.106 2.465 2.430 2.515 . 0 0 "[ . 1 . 2]" 1 1804 1 65 ILE HG12 1 66 ASN H 3.090 . 4.284 2.403 2.326 2.462 . 0 0 "[ . 1 . 2]" 1 1805 1 65 ILE HG12 1 66 ASN QB 3.372 . 4.793 3.814 3.634 3.956 . 0 0 "[ . 1 . 2]" 1 1806 1 65 ILE HG13 1 65 ILE MG 2.401 . 3.122 3.187 3.178 3.192 0.070 16 0 "[ . 1 . 2]" 1 1807 1 65 ILE HG13 1 66 ASN H 2.967 . 4.067 2.491 2.312 2.692 . 0 0 "[ . 1 . 2]" 1 1808 1 65 ILE HG13 1 66 ASN QB 3.000 . 4.125 3.525 3.182 3.797 . 0 0 "[ . 1 . 2]" 1 1809 1 65 ILE MG 1 66 ASN H 2.526 . 7.500 3.824 3.793 3.858 . 0 0 "[ . 1 . 2]" 1 1810 1 65 ILE MG 1 66 ASN QB 2.693 . 7.500 5.130 5.054 5.185 . 0 0 "[ . 1 . 2]" 1 1811 1 66 ASN H 1 66 ASN HA 2.777 . 3.741 2.784 2.759 2.815 . 0 0 "[ . 1 . 2]" 1 1812 1 66 ASN H 1 66 ASN HA 2.124 . 2.688 2.518 2.478 2.540 . 0 0 "[ . 1 . 2]" 1 1813 1 66 ASN H 1 66 ASN QB 2.007 . 2.511 2.212 2.193 2.242 . 0 0 "[ . 1 . 2]" 1 1814 1 66 ASN H 1 66 ASN HD21 3.204 . 4.487 4.454 4.300 4.552 0.065 19 0 "[ . 1 . 2]" 1 1815 1 66 ASN H 1 94 GLN QE 4.090 . 6.181 5.491 5.024 5.917 . 0 0 "[ . 1 . 2]" 1 1816 1 66 ASN HA 1 69 HIS HB2 3.204 . 4.487 3.226 3.006 3.425 . 0 0 "[ . 1 . 2]" 1 1817 1 66 ASN HA 1 94 GLN HE21 2.776 . 3.739 3.232 2.701 3.627 . 0 0 "[ . 1 . 2]" 1 1818 1 66 ASN HA 1 66 ASN QB 2.133 . 2.702 2.341 2.289 2.380 . 0 0 "[ . 1 . 2]" 1 1819 1 66 ASN HA 1 66 ASN HD21 3.805 . 5.615 3.210 2.962 3.612 . 0 0 "[ . 1 . 2]" 1 1820 1 66 ASN HA 1 67 ASN H 2.441 . 3.186 2.736 2.688 2.753 . 0 0 "[ . 1 . 2]" 1 1821 1 66 ASN HA 1 69 HIS H 3.039 . 4.193 3.656 3.568 3.738 . 0 0 "[ . 1 . 2]" 1 1822 1 66 ASN HA 1 69 HIS HA 3.226 . 7.500 5.339 5.141 5.547 . 0 0 "[ . 1 . 2]" 1 1823 1 66 ASN HA 1 70 ALA HA 3.242 . 7.500 7.240 7.060 7.426 . 0 0 "[ . 1 . 2]" 1 1824 1 66 ASN QB 1 67 ASN HB2 2.715 . 7.500 3.904 3.798 4.029 . 0 0 "[ . 1 . 2]" 1 1825 1 66 ASN QB 1 66 ASN HD21 2.396 . 3.114 2.206 2.121 2.248 . 0 0 "[ . 1 . 2]" 1 1826 1 66 ASN QB 1 67 ASN H 2.388 . 3.101 2.820 2.485 2.982 . 0 0 "[ . 1 . 2]" 1 1827 1 66 ASN HB3 1 68 ALA H 2.941 . 7.500 4.170 4.094 4.260 . 0 0 "[ . 1 . 2]" 1 1828 1 66 ASN QD 1 94 GLN H 3.146 . 7.500 4.713 4.436 4.967 . 0 0 "[ . 1 . 2]" 1 1829 1 66 ASN QD 1 93 GLU HB3 3.380 . 4.808 4.568 3.978 4.859 0.051 17 0 "[ . 1 . 2]" 1 1830 1 66 ASN HD21 1 67 ASN H 3.169 . 4.424 3.653 3.228 4.225 . 0 0 "[ . 1 . 2]" 1 1831 1 66 ASN HD21 1 67 ASN HA 3.242 . 4.556 3.395 3.064 4.050 . 0 0 "[ . 1 . 2]" 1 1832 1 66 ASN HD21 1 71 ILE MD 3.418 . 7.500 5.261 5.034 5.406 . 0 0 "[ . 1 . 2]" 1 1833 1 67 ASN H 1 67 ASN QB 2.046 . 2.569 2.242 2.133 2.277 . 0 0 "[ . 1 . 2]" 1 1834 1 67 ASN H 1 67 ASN HD21 3.011 . 4.144 4.105 3.894 4.167 0.023 18 0 "[ . 1 . 2]" 1 1835 1 67 ASN H 1 67 ASN HD22 3.870 . 5.742 5.712 5.604 5.742 . 0 0 "[ . 1 . 2]" 1 1836 1 67 ASN H 1 67 ASN HD22 3.045 . 7.500 5.034 4.907 5.096 . 0 0 "[ . 1 . 2]" 1 1837 1 67 ASN H 1 68 ALA H 2.470 . 3.233 2.636 2.523 2.948 . 0 0 "[ . 1 . 2]" 1 1838 1 67 ASN H 1 68 ALA H 2.353 . 3.045 2.369 2.312 2.553 . 0 0 "[ . 1 . 2]" 1 1839 1 67 ASN H 1 68 ALA MB 2.883 . 7.500 4.297 4.204 4.579 . 0 0 "[ . 1 . 2]" 1 1840 1 67 ASN HA 1 67 ASN QB 2.051 . 2.577 2.420 2.398 2.454 . 0 0 "[ . 1 . 2]" 1 1841 1 67 ASN HA 1 67 ASN HD21 2.460 . 7.500 3.462 2.262 3.730 . 0 0 "[ . 1 . 2]" 1 1842 1 67 ASN HA 1 67 ASN HD22 3.259 . 4.586 4.074 3.499 4.226 . 0 0 "[ . 1 . 2]" 1 1843 1 67 ASN HA 1 68 ALA H 2.860 . 3.882 3.581 3.570 3.599 . 0 0 "[ . 1 . 2]" 1 1844 1 67 ASN HA 1 68 ALA MB 2.219 . 7.500 3.882 3.773 4.053 . 0 0 "[ . 1 . 2]" 1 1845 1 67 ASN HA 1 70 ALA H 2.816 . 7.500 4.861 4.659 5.050 . 0 0 "[ . 1 . 2]" 1 1846 1 67 ASN HA 1 70 ALA MB 2.134 . 7.500 5.491 5.282 5.754 . 0 0 "[ . 1 . 2]" 1 1847 1 67 ASN HA 1 71 ILE H 3.195 . 7.500 5.619 5.499 5.728 . 0 0 "[ . 1 . 2]" 1 1848 1 67 ASN HA 1 71 ILE MD 2.802 . 3.783 3.384 3.215 3.519 . 0 0 "[ . 1 . 2]" 1 1849 1 67 ASN HA 1 89 LEU MD2 2.521 . 7.500 4.383 4.238 4.457 . 0 0 "[ . 1 . 2]" 1 1850 1 67 ASN HA 1 93 GLU H 3.102 . 4.305 4.190 4.042 4.368 0.063 6 0 "[ . 1 . 2]" 1 1851 1 67 ASN HA 1 94 GLN H 3.986 . 5.972 4.332 4.176 4.509 . 0 0 "[ . 1 . 2]" 1 1852 1 67 ASN QB 1 71 ILE MD 2.723 . 7.500 4.077 4.041 4.121 . 0 0 "[ . 1 . 2]" 1 1853 1 67 ASN HB3 1 67 ASN HD21 2.042 . 2.563 2.348 2.241 2.875 0.312 13 0 "[ . 1 . 2]" 1 1854 1 67 ASN HB3 1 68 ALA H 2.363 . 3.061 2.107 1.920 2.236 . 0 0 "[ . 1 . 2]" 1 1855 1 67 ASN HB3 1 68 ALA HA 3.270 . 4.606 3.815 3.664 3.895 . 0 0 "[ . 1 . 2]" 1 1856 1 67 ASN HB3 1 68 ALA MB 2.655 . 3.536 3.457 3.277 3.547 0.011 15 0 "[ . 1 . 2]" 1 1857 1 67 ASN HB3 1 71 ILE MD 3.014 . 4.149 4.381 4.341 4.416 0.267 12 0 "[ . 1 . 2]" 1 1858 1 67 ASN HD21 1 71 ILE MD 2.413 . 3.141 2.859 1.842 3.112 . 0 0 "[ . 1 . 2]" 1 1859 1 67 ASN HD21 1 89 LEU HB2 3.267 . 4.601 2.585 2.492 2.666 . 0 0 "[ . 1 . 2]" 1 1860 1 67 ASN HD21 1 89 LEU HB3 3.190 . 4.462 3.179 2.777 3.330 . 0 0 "[ . 1 . 2]" 1 1861 1 67 ASN HD21 1 89 LEU MD1 3.048 . 4.209 2.739 2.492 2.895 . 0 0 "[ . 1 . 2]" 1 1862 1 67 ASN HD22 1 68 ALA MB 3.219 . 7.500 4.896 4.696 5.352 . 0 0 "[ . 1 . 2]" 1 1863 1 67 ASN HD22 1 71 ILE MD 2.345 . 3.033 2.785 2.503 2.985 . 0 0 "[ . 1 . 2]" 1 1864 1 67 ASN HD22 1 71 ILE HG12 3.036 . 4.188 4.236 4.178 4.285 0.097 18 0 "[ . 1 . 2]" 1 1865 1 67 ASN HD22 1 71 ILE MG 3.024 . 4.167 3.833 3.680 3.957 . 0 0 "[ . 1 . 2]" 1 1866 1 67 ASN HD22 1 78 ARG QD 2.980 . 7.500 6.760 6.364 7.168 . 0 0 "[ . 1 . 2]" 1 1867 1 67 ASN HD22 1 82 ASP H 3.401 . 7.500 7.254 7.069 7.435 . 0 0 "[ . 1 . 2]" 1 1868 1 67 ASN HD22 1 81 TYR H 3.404 . 7.500 6.484 6.120 6.735 . 0 0 "[ . 1 . 2]" 1 1869 1 67 ASN HD22 1 81 TYR HA 2.817 . 7.500 5.050 4.707 5.340 . 0 0 "[ . 1 . 2]" 1 1870 1 67 ASN HD22 1 86 SER H 4.118 . 6.238 4.981 4.852 5.170 . 0 0 "[ . 1 . 2]" 1 1871 1 67 ASN HD22 1 87 LEU H 4.109 . 6.220 6.239 6.079 6.354 0.134 13 0 "[ . 1 . 2]" 1 1872 1 67 ASN HD22 1 89 LEU H 3.627 . 5.271 4.598 4.503 4.805 . 0 0 "[ . 1 . 2]" 1 1873 1 68 ALA H 1 68 ALA HA 2.543 . 3.352 2.803 2.785 2.815 . 0 0 "[ . 1 . 2]" 1 1874 1 68 ALA H 1 68 ALA MB 2.143 . 2.717 2.217 2.206 2.230 . 0 0 "[ . 1 . 2]" 1 1875 1 68 ALA H 1 69 HIS HA 3.801 . 5.607 5.085 5.040 5.146 . 0 0 "[ . 1 . 2]" 1 1876 1 68 ALA HA 1 68 ALA MB 2.072 . 2.609 2.123 2.120 2.126 . 0 0 "[ . 1 . 2]" 1 1877 1 68 ALA HA 1 69 HIS H 3.074 . 4.255 3.359 3.338 3.386 . 0 0 "[ . 1 . 2]" 1 1878 1 68 ALA HA 1 70 ALA H 3.572 . 5.167 4.374 4.127 4.509 . 0 0 "[ . 1 . 2]" 1 1879 1 68 ALA HA 1 71 ILE H 3.216 . 4.509 3.526 3.381 3.603 . 0 0 "[ . 1 . 2]" 1 1880 1 68 ALA HA 1 71 ILE HB 3.165 . 4.417 3.132 3.070 3.211 . 0 0 "[ . 1 . 2]" 1 1881 1 68 ALA HA 1 71 ILE MD 2.475 . 3.241 3.337 3.268 3.421 0.180 6 0 "[ . 1 . 2]" 1 1882 1 68 ALA HA 1 71 ILE HG13 3.089 . 4.281 2.370 2.247 2.530 . 0 0 "[ . 1 . 2]" 1 1883 1 68 ALA HA 1 72 LEU QD 3.314 . 4.687 3.180 3.041 3.299 . 0 0 "[ . 1 . 2]" 1 1884 1 68 ALA HA 1 89 LEU MD1 3.003 . 4.130 3.685 3.598 3.787 . 0 0 "[ . 1 . 2]" 1 1885 1 68 ALA MB 1 69 HIS HB2 3.210 . 4.498 3.720 3.616 4.034 . 0 0 "[ . 1 . 2]" 1 1886 1 68 ALA MB 1 69 HIS H 2.381 . 3.090 3.049 3.023 3.100 0.010 4 0 "[ . 1 . 2]" 1 1887 1 68 ALA MB 1 69 HIS HA 2.738 . 3.675 3.693 3.606 3.742 0.067 7 0 "[ . 1 . 2]" 1 1888 1 68 ALA MB 1 69 HIS QB 2.754 . 7.500 4.348 4.323 4.378 . 0 0 "[ . 1 . 2]" 1 1889 1 68 ALA MB 1 72 LEU QD 3.117 . 4.331 2.120 1.985 2.303 . 0 0 "[ . 1 . 2]" 1 1890 1 68 ALA MB 1 94 GLN QE 3.418 . 7.500 6.780 6.466 7.097 . 0 0 "[ . 1 . 2]" 1 1891 1 69 HIS H 1 69 HIS HA 2.499 . 3.279 2.700 2.669 2.747 . 0 0 "[ . 1 . 2]" 1 1892 1 69 HIS H 1 69 HIS QB 2.384 . 3.094 2.115 1.986 2.181 . 0 0 "[ . 1 . 2]" 1 1893 1 69 HIS H 1 72 LEU H 3.474 . 4.983 4.364 4.247 4.471 . 0 0 "[ . 1 . 2]" 1 1894 1 69 HIS H 1 71 ILE H 3.764 . 5.535 4.308 4.235 4.377 . 0 0 "[ . 1 . 2]" 1 1895 1 69 HIS H 1 94 GLN QE 3.224 . 7.500 4.976 4.603 5.357 . 0 0 "[ . 1 . 2]" 1 1896 1 69 HIS HA 1 69 HIS HB2 2.413 . 3.141 2.292 2.227 2.333 . 0 0 "[ . 1 . 2]" 1 1897 1 69 HIS HA 1 70 ALA H 2.472 . 3.236 2.799 2.790 2.805 . 0 0 "[ . 1 . 2]" 1 1898 1 69 HIS HA 1 72 LEU H 3.310 . 4.679 4.156 3.997 4.357 . 0 0 "[ . 1 . 2]" 1 1899 1 69 HIS HA 1 72 LEU H 3.202 . 7.500 5.302 5.150 5.437 . 0 0 "[ . 1 . 2]" 1 1900 1 69 HIS HA 1 72 LEU HB2 3.410 . 7.500 5.896 5.589 6.183 . 0 0 "[ . 1 . 2]" 1 1901 1 69 HIS HA 1 72 LEU QD 3.209 . 4.337 4.023 3.748 4.226 . 0 0 "[ . 1 . 2]" 1 1902 1 69 HIS QB 1 94 GLN HE22 3.087 . 4.278 3.457 3.074 3.821 . 0 0 "[ . 1 . 2]" 1 1903 1 69 HIS QB 1 70 ALA HA 3.304 . 4.669 4.580 4.488 4.700 0.031 6 0 "[ . 1 . 2]" 1 1904 1 69 HIS HB3 1 70 ALA H 2.546 . 3.356 2.711 2.482 3.551 0.195 4 0 "[ . 1 . 2]" 1 1905 1 69 HIS HB3 1 70 ALA MB 2.569 . 7.500 4.058 3.855 4.818 . 0 0 "[ . 1 . 2]" 1 1906 1 69 HIS HB3 1 71 ILE H 3.972 . 5.944 4.814 4.592 5.563 . 0 0 "[ . 1 . 2]" 1 1907 1 70 ALA H 1 70 ALA HA 2.445 . 3.192 2.918 2.913 2.924 . 0 0 "[ . 1 . 2]" 1 1908 1 70 ALA H 1 70 ALA MB 1.959 . 2.439 2.314 2.298 2.327 . 0 0 "[ . 1 . 2]" 1 1909 1 70 ALA H 1 71 ILE H 2.665 . 3.553 2.327 2.283 2.352 . 0 0 "[ . 1 . 2]" 1 1910 1 70 ALA H 1 71 ILE HA 3.457 . 4.951 4.842 4.798 4.882 . 0 0 "[ . 1 . 2]" 1 1911 1 70 ALA H 1 71 ILE MD 3.634 . 5.285 3.065 2.840 3.168 . 0 0 "[ . 1 . 2]" 1 1912 1 70 ALA H 1 71 ILE HG13 3.514 . 5.058 4.824 4.668 4.894 . 0 0 "[ . 1 . 2]" 1 1913 1 70 ALA H 1 71 ILE MG 3.804 . 5.613 4.605 4.525 4.676 . 0 0 "[ . 1 . 2]" 1 1914 1 70 ALA H 1 72 LEU H 3.634 . 5.285 4.536 4.407 4.665 . 0 0 "[ . 1 . 2]" 1 1915 1 70 ALA H 1 74 ASP H 4.258 . 6.524 5.153 5.080 5.243 . 0 0 "[ . 1 . 2]" 1 1916 1 70 ALA H 1 94 GLN QE 4.003 . 6.006 5.044 4.734 5.416 . 0 0 "[ . 1 . 2]" 1 1917 1 70 ALA HA 1 70 ALA MB 1.870 . 2.307 2.121 2.118 2.123 . 0 0 "[ . 1 . 2]" 1 1918 1 70 ALA HA 1 71 ILE H 2.871 . 3.902 3.494 3.473 3.513 . 0 0 "[ . 1 . 2]" 1 1919 1 70 ALA HA 1 74 ASP H 3.231 . 4.536 3.371 3.276 3.462 . 0 0 "[ . 1 . 2]" 1 1920 1 70 ALA HA 1 72 LEU HG 2.904 . 7.500 5.152 4.966 5.353 . 0 0 "[ . 1 . 2]" 1 1921 1 70 ALA HA 1 73 THR H 3.355 . 4.762 4.129 3.938 4.331 . 0 0 "[ . 1 . 2]" 1 1922 1 70 ALA HA 1 73 THR MG 2.625 . 3.486 3.106 2.926 3.314 . 0 0 "[ . 1 . 2]" 1 1923 1 70 ALA MB 1 71 ILE H 2.238 . 2.864 2.732 2.584 2.832 . 0 0 "[ . 1 . 2]" 1 1924 1 70 ALA MB 1 71 ILE HA 2.385 . 3.096 3.129 3.107 3.142 0.046 20 0 "[ . 1 . 2]" 1 1925 1 70 ALA MB 1 74 ASP H 3.050 . 4.213 3.865 3.726 4.012 . 0 0 "[ . 1 . 2]" 1 1926 1 70 ALA MB 1 71 ILE MD 2.702 . 3.615 2.541 2.234 2.711 . 0 0 "[ . 1 . 2]" 1 1927 1 70 ALA MB 1 71 ILE MG 2.971 . 7.500 4.362 4.182 4.529 . 0 0 "[ . 1 . 2]" 1 1928 1 70 ALA MB 1 72 LEU H 3.180 . 7.500 4.624 4.528 4.757 . 0 0 "[ . 1 . 2]" 1 1929 1 70 ALA MB 1 73 THR H 3.244 . 7.500 4.756 4.593 4.958 . 0 0 "[ . 1 . 2]" 1 1930 1 70 ALA MB 1 77 LYS QE 3.532 . 5.091 2.770 2.404 3.598 . 0 0 "[ . 1 . 2]" 1 1931 1 71 ILE H 1 71 ILE HA 2.744 . 3.685 2.757 2.728 2.807 . 0 0 "[ . 1 . 2]" 1 1932 1 71 ILE H 1 71 ILE HB 2.785 . 3.755 3.152 3.113 3.181 . 0 0 "[ . 1 . 2]" 1 1933 1 71 ILE H 1 71 ILE MD 2.372 . 3.076 2.033 1.937 2.117 . 0 0 "[ . 1 . 2]" 1 1934 1 71 ILE H 1 71 ILE HG12 2.142 . 2.716 1.646 1.587 1.711 . 0 0 "[ . 1 . 2]" 1 1935 1 71 ILE H 1 71 ILE HG13 2.749 . 3.694 3.218 3.153 3.265 . 0 0 "[ . 1 . 2]" 1 1936 1 71 ILE H 1 71 ILE MG 2.527 . 7.500 3.532 3.489 3.590 . 0 0 "[ . 1 . 2]" 1 1937 1 71 ILE H 1 71 ILE MG 2.679 . 3.576 3.331 3.297 3.377 . 0 0 "[ . 1 . 2]" 1 1938 1 71 ILE H 1 72 LEU H 2.861 . 3.884 2.851 2.699 2.983 . 0 0 "[ . 1 . 2]" 1 1939 1 71 ILE H 1 72 LEU QD 3.307 . 4.674 4.082 3.975 4.204 . 0 0 "[ . 1 . 2]" 1 1940 1 71 ILE H 1 73 THR H 3.735 . 5.479 4.596 4.515 4.686 . 0 0 "[ . 1 . 2]" 1 1941 1 71 ILE HA 1 71 ILE MD 2.210 . 2.820 2.624 2.547 2.680 . 0 0 "[ . 1 . 2]" 1 1942 1 71 ILE HA 1 71 ILE HG12 2.857 . 3.877 3.475 3.441 3.497 . 0 0 "[ . 1 . 2]" 1 1943 1 71 ILE HA 1 71 ILE HG13 2.677 . 7.500 4.004 3.971 4.035 . 0 0 "[ . 1 . 2]" 1 1944 1 71 ILE HA 1 71 ILE MG 2.513 . 3.303 2.104 2.088 2.123 . 0 0 "[ . 1 . 2]" 1 1945 1 71 ILE HA 1 71 ILE MG 2.319 . 2.991 1.777 1.722 1.857 . 0 0 "[ . 1 . 2]" 1 1946 1 71 ILE HA 1 72 LEU H 3.140 . 4.372 3.509 3.482 3.538 . 0 0 "[ . 1 . 2]" 1 1947 1 71 ILE HA 1 72 LEU QD 2.790 . 7.500 3.569 3.367 3.700 . 0 0 "[ . 1 . 2]" 1 1948 1 71 ILE HA 1 74 ASP H 3.244 . 4.559 3.553 3.375 3.673 . 0 0 "[ . 1 . 2]" 1 1949 1 71 ILE HA 1 74 ASP HB2 3.165 . 4.417 3.565 3.421 3.703 . 0 0 "[ . 1 . 2]" 1 1950 1 71 ILE HA 1 74 ASP HB3 3.177 . 4.439 3.003 2.757 3.220 . 0 0 "[ . 1 . 2]" 1 1951 1 71 ILE HA 1 77 LYS H 3.469 . 4.974 4.117 3.997 4.205 . 0 0 "[ . 1 . 2]" 1 1952 1 71 ILE HA 1 77 LYS HB2 3.144 . 4.380 2.032 1.866 2.142 0.042 11 0 "[ . 1 . 2]" 1 1953 1 71 ILE HA 1 77 LYS HB3 3.236 . 4.545 2.355 1.948 2.524 . 0 0 "[ . 1 . 2]" 1 1954 1 71 ILE HA 1 77 LYS QD 3.038 . 4.192 4.054 3.881 4.230 0.038 7 0 "[ . 1 . 2]" 1 1955 1 71 ILE HA 1 77 LYS HD3 2.626 . 3.488 3.474 3.130 3.549 0.061 4 0 "[ . 1 . 2]" 1 1956 1 71 ILE HA 1 77 LYS HE2 3.142 . 4.376 4.448 4.400 4.505 0.129 14 0 "[ . 1 . 2]" 1 1957 1 71 ILE HA 1 77 LYS HG2 3.393 . 4.832 3.681 3.250 3.769 . 0 0 "[ . 1 . 2]" 1 1958 1 71 ILE HA 1 77 LYS HG3 3.259 . 4.587 4.538 4.126 4.632 0.045 10 0 "[ . 1 . 2]" 1 1959 1 71 ILE HA 1 78 ARG H 3.333 . 4.721 3.266 3.103 3.457 . 0 0 "[ . 1 . 2]" 1 1960 1 71 ILE HA 1 89 LEU QD 2.953 . 4.043 3.672 3.560 3.737 . 0 0 "[ . 1 . 2]" 1 1961 1 71 ILE HB 1 71 ILE MD 2.927 . 3.998 3.236 3.226 3.244 . 0 0 "[ . 1 . 2]" 1 1962 1 71 ILE HB 1 71 ILE HG13 2.978 . 4.087 2.415 2.397 2.431 . 0 0 "[ . 1 . 2]" 1 1963 1 71 ILE HB 1 71 ILE MG 2.024 . 2.536 2.119 2.115 2.125 . 0 0 "[ . 1 . 2]" 1 1964 1 71 ILE HB 1 72 LEU H 3.024 . 4.167 2.763 2.485 2.981 . 0 0 "[ . 1 . 2]" 1 1965 1 71 ILE HB 1 72 LEU H 2.362 . 3.059 1.806 1.755 1.852 . 0 0 "[ . 1 . 2]" 1 1966 1 71 ILE HB 1 78 ARG H 3.110 . 4.319 4.366 4.311 4.429 0.110 7 0 "[ . 1 . 2]" 1 1967 1 71 ILE HB 1 78 ARG QD 3.389 . 4.825 3.184 3.033 3.335 . 0 0 "[ . 1 . 2]" 1 1968 1 71 ILE HB 1 81 TYR H 3.906 . 5.813 5.088 4.846 5.300 . 0 0 "[ . 1 . 2]" 1 1969 1 71 ILE MD 1 71 ILE HG12 1.858 . 2.289 2.107 2.103 2.108 . 0 0 "[ . 1 . 2]" 1 1970 1 71 ILE MD 1 71 ILE HG13 2.049 . 2.574 2.108 2.104 2.111 . 0 0 "[ . 1 . 2]" 1 1971 1 71 ILE MD 1 71 ILE MG 1.996 . 2.494 1.991 1.945 2.031 . 0 0 "[ . 1 . 2]" 1 1972 1 71 ILE MD 1 72 LEU H 2.779 . 7.500 4.253 4.157 4.299 . 0 0 "[ . 1 . 2]" 1 1973 1 71 ILE MD 1 74 ASP H 3.273 . 7.500 5.320 5.259 5.401 . 0 0 "[ . 1 . 2]" 1 1974 1 71 ILE MD 1 74 ASP HB2 3.203 . 4.485 4.392 4.249 4.523 0.038 18 0 "[ . 1 . 2]" 1 1975 1 71 ILE MD 1 77 LYS H 3.343 . 4.740 4.839 4.768 4.909 0.169 6 0 "[ . 1 . 2]" 1 1976 1 71 ILE MD 1 77 LYS HA 2.909 . 3.967 3.495 3.383 3.678 . 0 0 "[ . 1 . 2]" 1 1977 1 71 ILE MD 1 77 LYS HB2 2.852 . 3.869 3.003 2.899 3.144 . 0 0 "[ . 1 . 2]" 1 1978 1 71 ILE MD 1 77 LYS HB3 2.498 . 3.278 1.935 1.851 1.994 . 0 0 "[ . 1 . 2]" 1 1979 1 71 ILE MD 1 77 LYS HE2 2.573 . 7.500 3.524 3.315 3.705 . 0 0 "[ . 1 . 2]" 1 1980 1 71 ILE MD 1 77 LYS HG2 2.327 . 3.004 2.523 2.360 2.731 . 0 0 "[ . 1 . 2]" 1 1981 1 71 ILE MD 1 89 LEU HA 3.068 . 4.245 3.670 3.485 4.112 . 0 0 "[ . 1 . 2]" 1 1982 1 71 ILE MD 1 89 LEU MD1 2.513 . 3.303 1.907 1.709 2.056 0.014 6 0 "[ . 1 . 2]" 1 1983 1 71 ILE MD 1 89 LEU MD2 1.967 . 2.451 1.576 1.457 1.865 0.026 19 0 "[ . 1 . 2]" 1 1984 1 71 ILE MD 1 93 GLU HB2 2.912 . 3.972 2.462 2.234 2.898 . 0 0 "[ . 1 . 2]" 1 1985 1 71 ILE MD 1 93 GLU HB3 3.009 . 4.141 2.574 2.375 2.976 . 0 0 "[ . 1 . 2]" 1 1986 1 71 ILE HG12 1 71 ILE MG 2.800 . 3.780 3.197 3.190 3.204 . 0 0 "[ . 1 . 2]" 1 1987 1 71 ILE HG13 1 71 ILE MG 2.358 . 3.053 2.381 2.339 2.415 . 0 0 "[ . 1 . 2]" 1 1988 1 71 ILE HG13 1 72 LEU H 3.281 . 4.627 4.442 4.257 4.637 0.010 3 0 "[ . 1 . 2]" 1 1989 1 71 ILE MG 1 72 LEU H 2.603 . 7.500 4.026 3.864 4.153 . 0 0 "[ . 1 . 2]" 1 1990 1 71 ILE MG 1 74 ASP H 3.320 . 4.698 4.403 4.263 4.487 . 0 0 "[ . 1 . 2]" 1 1991 1 71 ILE MG 1 73 THR H 3.207 . 7.500 5.269 5.082 5.423 . 0 0 "[ . 1 . 2]" 1 1992 1 71 ILE MG 1 74 ASP H 3.179 . 7.500 4.835 4.646 4.930 . 0 0 "[ . 1 . 2]" 1 1993 1 71 ILE MG 1 74 ASP HB3 3.175 . 4.435 4.393 4.145 4.500 0.065 6 0 "[ . 1 . 2]" 1 1994 1 71 ILE MG 1 77 LYS H 3.087 . 4.278 4.394 4.374 4.435 0.157 7 0 "[ . 1 . 2]" 1 1995 1 71 ILE MG 1 77 LYS HA 3.290 . 4.643 3.589 3.462 3.702 . 0 0 "[ . 1 . 2]" 1 1996 1 71 ILE MG 1 77 LYS HA 2.757 . 3.707 3.220 3.068 3.358 . 0 0 "[ . 1 . 2]" 1 1997 1 71 ILE MG 1 77 LYS HB2 2.690 . 3.595 2.921 2.816 3.033 . 0 0 "[ . 1 . 2]" 1 1998 1 71 ILE MG 1 77 LYS HB3 2.412 . 3.139 1.985 1.810 2.153 . 0 0 "[ . 1 . 2]" 1 1999 1 71 ILE MG 1 77 LYS HD3 2.441 . 7.500 3.922 3.796 4.061 . 0 0 "[ . 1 . 2]" 1 2000 1 71 ILE MG 1 77 LYS HG3 2.738 . 7.500 4.208 3.987 4.378 . 0 0 "[ . 1 . 2]" 1 2001 1 71 ILE MG 1 78 ARG H 3.076 . 4.259 3.065 2.931 3.180 . 0 0 "[ . 1 . 2]" 1 2002 1 71 ILE MG 1 78 ARG HA 2.428 . 3.165 1.954 1.863 2.252 . 0 0 "[ . 1 . 2]" 1 2003 1 71 ILE MG 1 78 ARG QD 3.084 . 4.167 1.919 1.821 2.057 0.074 11 0 "[ . 1 . 2]" 1 2004 1 71 ILE MG 1 79 ASN H 3.789 . 5.583 4.366 4.290 4.573 . 0 0 "[ . 1 . 2]" 1 2005 1 71 ILE MG 1 79 ASN HA 3.420 . 7.500 5.424 5.353 5.561 . 0 0 "[ . 1 . 2]" 1 2006 1 71 ILE MG 1 81 TYR H 3.162 . 4.412 3.323 3.227 3.406 . 0 0 "[ . 1 . 2]" 1 2007 1 71 ILE MG 1 81 TYR HA 3.165 . 4.417 3.646 3.364 3.846 . 0 0 "[ . 1 . 2]" 1 2008 1 71 ILE MG 1 81 TYR QB 2.553 . 3.368 1.877 1.769 1.990 . 0 0 "[ . 1 . 2]" 1 2009 1 71 ILE MG 1 82 ASP H 3.484 . 5.001 4.978 4.854 5.058 0.057 14 0 "[ . 1 . 2]" 1 2010 1 71 ILE MG 1 89 LEU HA 3.191 . 7.500 5.066 4.785 5.481 . 0 0 "[ . 1 . 2]" 1 2011 1 71 ILE MG 1 89 LEU HB2 3.179 . 4.442 4.295 4.118 4.505 0.063 13 0 "[ . 1 . 2]" 1 2012 1 71 ILE MG 1 89 LEU MD1 2.375 . 3.080 2.103 1.957 2.319 . 0 0 "[ . 1 . 2]" 1 2013 1 71 ILE MG 1 89 LEU QD 2.028 . 2.542 1.950 1.822 2.129 . 0 0 "[ . 1 . 2]" 1 2014 1 72 LEU H 1 72 LEU HA 2.874 . 3.906 2.789 2.751 2.828 . 0 0 "[ . 1 . 2]" 1 2015 1 72 LEU H 1 72 LEU HB2 2.914 . 3.975 2.751 2.690 2.887 . 0 0 "[ . 1 . 2]" 1 2016 1 72 LEU H 1 72 LEU HB3 3.365 . 4.780 3.537 3.520 3.556 . 0 0 "[ . 1 . 2]" 1 2017 1 72 LEU H 1 72 LEU QD 2.610 . 3.419 2.443 2.275 2.547 . 0 0 "[ . 1 . 2]" 1 2018 1 72 LEU H 1 72 LEU HG 3.061 . 4.232 1.832 1.790 1.870 0.100 11 0 "[ . 1 . 2]" 1 2019 1 72 LEU H 1 73 THR H 2.970 . 4.072 2.713 2.590 2.827 . 0 0 "[ . 1 . 2]" 1 2020 1 72 LEU H 1 73 THR MG 3.124 . 4.344 3.709 3.614 3.831 . 0 0 "[ . 1 . 2]" 1 2021 1 72 LEU H 1 74 ASP H 3.685 . 5.382 3.833 3.668 3.957 . 0 0 "[ . 1 . 2]" 1 2022 1 72 LEU HA 1 72 LEU HB2 2.905 . 3.960 2.997 2.987 3.005 . 0 0 "[ . 1 . 2]" 1 2023 1 72 LEU HA 1 72 LEU QD 2.159 . 2.741 2.117 2.017 2.237 . 0 0 "[ . 1 . 2]" 1 2024 1 72 LEU HA 1 72 LEU HG 3.079 . 4.264 3.387 3.330 3.449 . 0 0 "[ . 1 . 2]" 1 2025 1 72 LEU HA 1 73 THR H 3.389 . 4.824 3.498 3.460 3.519 . 0 0 "[ . 1 . 2]" 1 2026 1 72 LEU HA 1 74 ASP H 3.374 . 4.797 4.608 4.392 4.756 . 0 0 "[ . 1 . 2]" 1 2027 1 72 LEU HA 1 78 ARG H 3.415 . 7.500 6.498 6.257 6.714 . 0 0 "[ . 1 . 2]" 1 2028 1 72 LEU HA 1 78 ARG QD 2.875 . 3.908 1.997 1.790 2.301 0.052 5 0 "[ . 1 . 2]" 1 2029 1 72 LEU HA 1 78 ARG QB 2.942 . 7.500 4.863 4.601 5.667 . 0 0 "[ . 1 . 2]" 1 2030 1 72 LEU HB2 1 72 LEU QD 2.443 . 3.133 2.262 2.225 2.294 . 0 0 "[ . 1 . 2]" 1 2031 1 72 LEU HB2 1 73 THR H 3.468 . 4.972 2.634 2.523 2.839 . 0 0 "[ . 1 . 2]" 1 2032 1 72 LEU HB2 1 74 ASP H 3.528 . 5.084 4.616 4.501 4.701 . 0 0 "[ . 1 . 2]" 1 2033 1 72 LEU HB3 1 72 LEU QD 3.222 . 4.204 2.142 2.132 2.150 . 0 0 "[ . 1 . 2]" 1 2034 1 72 LEU MD1 1 72 LEU MD2 2.074 . 2.612 2.090 2.078 2.104 . 0 0 "[ . 1 . 2]" 1 2035 1 72 LEU QD 1 72 LEU HG . . 2.717 1.884 1.881 1.888 . 0 0 "[ . 1 . 2]" 1 2036 1 72 LEU QD 1 73 THR H 2.803 . 7.500 3.918 3.852 3.988 . 0 0 "[ . 1 . 2]" 1 2037 1 72 LEU QD 1 73 THR HA 3.366 . 7.500 5.195 5.147 5.247 . 0 0 "[ . 1 . 2]" 1 2038 1 72 LEU QD 1 73 THR MG 3.214 . 4.505 4.043 3.958 4.155 . 0 0 "[ . 1 . 2]" 1 2039 1 72 LEU QD 1 74 ASP H 3.088 . 7.500 5.070 4.961 5.161 . 0 0 "[ . 1 . 2]" 1 2040 1 72 LEU QD 1 78 ARG H 3.192 . 7.500 6.511 6.329 6.636 . 0 0 "[ . 1 . 2]" 1 2041 1 72 LEU QD 1 78 ARG QD 2.901 . 3.953 3.728 3.463 3.904 . 0 0 "[ . 1 . 2]" 1 2042 1 72 LEU HG 1 73 THR H 2.909 . 3.967 3.849 3.721 3.952 . 0 0 "[ . 1 . 2]" 1 2043 1 73 THR H 1 73 THR HA 2.704 . 3.618 2.937 2.926 2.945 . 0 0 "[ . 1 . 2]" 1 2044 1 73 THR H 1 73 THR HA 2.806 . 3.790 2.672 2.643 2.705 . 0 0 "[ . 1 . 2]" 1 2045 1 73 THR H 1 73 THR HB 3.139 . 4.370 3.072 3.011 3.157 . 0 0 "[ . 1 . 2]" 1 2046 1 73 THR H 1 73 THR MG 2.459 . 3.215 1.836 1.732 1.920 . 0 0 "[ . 1 . 2]" 1 2047 1 73 THR H 1 74 ASP H 2.580 . 3.412 2.019 1.884 2.158 . 0 0 "[ . 1 . 2]" 1 2048 1 73 THR H 1 74 ASP HB2 3.526 . 5.080 3.998 3.798 4.197 . 0 0 "[ . 1 . 2]" 1 2049 1 73 THR H 1 74 ASP HB3 3.720 . 5.450 4.452 4.323 4.629 . 0 0 "[ . 1 . 2]" 1 2050 1 73 THR HA 1 73 THR HB 2.229 . 2.850 2.380 2.357 2.405 . 0 0 "[ . 1 . 2]" 1 2051 1 73 THR HA 1 74 ASP H 2.891 . 3.936 3.297 3.237 3.319 . 0 0 "[ . 1 . 2]" 1 2052 1 73 THR HA 1 73 THR MG 2.124 . 7.500 3.187 3.181 3.194 . 0 0 "[ . 1 . 2]" 1 2053 1 73 THR HA 1 74 ASP H 2.738 . 3.675 3.432 3.339 3.470 . 0 0 "[ . 1 . 2]" 1 2054 1 73 THR HA 1 74 ASP HA 2.851 . 7.500 4.644 4.599 4.685 . 0 0 "[ . 1 . 2]" 1 2055 1 73 THR HB 1 73 THR MG 1.994 . 2.491 2.128 2.127 2.131 . 0 0 "[ . 1 . 2]" 1 2056 1 73 THR HB 1 74 ASP H 3.276 . 4.617 4.262 4.210 4.349 . 0 0 "[ . 1 . 2]" 1 2057 1 73 THR MG 1 74 ASP H 2.995 . 4.116 2.548 2.426 2.795 . 0 0 "[ . 1 . 2]" 1 2058 1 74 ASP H 1 74 ASP HA 2.618 . 3.475 2.915 2.898 2.931 . 0 0 "[ . 1 . 2]" 1 2059 1 74 ASP H 1 74 ASP HB2 2.522 . 3.317 2.605 2.467 2.758 . 0 0 "[ . 1 . 2]" 1 2060 1 74 ASP H 1 74 ASP HB3 2.516 . 3.307 2.661 2.561 2.717 . 0 0 "[ . 1 . 2]" 1 2061 1 74 ASP H 1 75 ALA H 3.227 . 4.529 4.409 4.339 4.510 . 0 0 "[ . 1 . 2]" 1 2062 1 74 ASP H 1 75 ALA MB 2.906 . 7.500 5.595 5.534 5.686 . 0 0 "[ . 1 . 2]" 1 2063 1 74 ASP H 1 77 LYS H 3.602 . 5.224 5.141 4.978 5.223 . 0 0 "[ . 1 . 2]" 1 2064 1 74 ASP H 1 77 LYS HB2 3.270 . 4.607 4.141 3.918 4.239 . 0 0 "[ . 1 . 2]" 1 2065 1 74 ASP H 1 77 LYS HB3 3.084 . 4.273 4.087 3.971 4.308 0.035 11 0 "[ . 1 . 2]" 1 2066 1 74 ASP H 1 77 LYS HD3 3.024 . 7.500 4.682 4.499 4.856 . 0 0 "[ . 1 . 2]" 1 2067 1 74 ASP H 1 78 ARG H 3.541 . 5.108 4.759 4.638 4.958 . 0 0 "[ . 1 . 2]" 1 2068 1 74 ASP HA 1 74 ASP HB2 2.605 . 3.454 2.552 2.486 2.594 . 0 0 "[ . 1 . 2]" 1 2069 1 74 ASP HA 1 74 ASP HB3 2.466 . 3.226 3.013 3.005 3.020 . 0 0 "[ . 1 . 2]" 1 2070 1 74 ASP HA 1 75 ALA H 2.197 . 2.800 2.125 2.104 2.145 . 0 0 "[ . 1 . 2]" 1 2071 1 74 ASP HA 1 75 ALA HA 2.811 . 7.500 4.375 4.334 4.410 . 0 0 "[ . 1 . 2]" 1 2072 1 74 ASP HA 1 75 ALA MB 2.298 . 7.500 3.984 3.958 4.008 . 0 0 "[ . 1 . 2]" 1 2073 1 74 ASP HA 1 76 THR H 2.783 . 3.751 3.726 3.632 3.824 0.073 7 0 "[ . 1 . 2]" 1 2074 1 74 ASP HA 1 77 LYS H 3.320 . 4.698 4.618 4.512 4.738 0.040 8 0 "[ . 1 . 2]" 1 2075 1 74 ASP HB2 1 75 ALA H 3.259 . 4.587 4.383 4.235 4.467 . 0 0 "[ . 1 . 2]" 1 2076 1 74 ASP HB2 1 75 ALA MB 2.982 . 7.500 5.217 5.013 5.343 . 0 0 "[ . 1 . 2]" 1 2077 1 74 ASP HB2 1 76 THR H 3.832 . 5.667 4.801 4.685 4.951 . 0 0 "[ . 1 . 2]" 1 2078 1 74 ASP HB2 1 77 LYS H 3.190 . 4.462 4.260 4.194 4.317 . 0 0 "[ . 1 . 2]" 1 2079 1 74 ASP HB3 1 75 ALA H 3.022 . 4.163 4.145 4.051 4.205 0.042 9 0 "[ . 1 . 2]" 1 2080 1 74 ASP HB3 1 76 THR H 3.934 . 5.869 3.960 3.832 4.104 . 0 0 "[ . 1 . 2]" 1 2081 1 74 ASP HB3 1 77 LYS H 3.244 . 4.560 2.787 2.599 2.921 . 0 0 "[ . 1 . 2]" 1 2082 1 74 ASP HB3 1 77 LYS HB2 3.071 . 4.250 2.125 1.876 2.311 0.016 19 0 "[ . 1 . 2]" 1 2083 1 74 ASP HB3 1 77 LYS HD3 2.937 . 4.015 2.387 2.085 2.741 . 0 0 "[ . 1 . 2]" 1 2084 1 74 ASP HB3 1 77 LYS HG2 3.381 . 4.810 3.646 3.192 3.844 . 0 0 "[ . 1 . 2]" 1 2085 1 74 ASP HB3 1 78 ARG H 3.631 . 5.279 3.608 3.469 3.745 . 0 0 "[ . 1 . 2]" 1 2086 1 75 ALA H 1 75 ALA HA 2.411 . 3.138 2.837 2.810 2.870 . 0 0 "[ . 1 . 2]" 1 2087 1 75 ALA H 1 75 ALA MB 1.922 . 2.384 2.240 2.226 2.256 . 0 0 "[ . 1 . 2]" 1 2088 1 75 ALA H 1 76 THR H 2.599 . 3.444 2.591 2.468 2.670 . 0 0 "[ . 1 . 2]" 1 2089 1 75 ALA H 1 76 THR HB 3.313 . 7.500 4.897 4.718 4.984 . 0 0 "[ . 1 . 2]" 1 2090 1 75 ALA H 1 76 THR MG 3.623 . 7.500 5.878 5.765 5.943 . 0 0 "[ . 1 . 2]" 1 2091 1 75 ALA H 1 77 LYS H 3.561 . 5.146 4.506 4.378 4.578 . 0 0 "[ . 1 . 2]" 1 2092 1 75 ALA H 1 78 ARG H 4.148 . 6.299 4.702 4.639 4.780 . 0 0 "[ . 1 . 2]" 1 2093 1 75 ALA H 1 78 ARG QB 3.661 . 5.336 4.574 4.472 4.744 . 0 0 "[ . 1 . 2]" 1 2094 1 75 ALA HA 1 75 ALA MB 1.805 . 2.212 2.125 2.122 2.127 . 0 0 "[ . 1 . 2]" 1 2095 1 75 ALA HA 1 76 THR H 2.779 . 3.744 3.486 3.456 3.511 . 0 0 "[ . 1 . 2]" 1 2096 1 75 ALA HA 1 78 ARG H 2.856 . 3.876 3.108 3.054 3.190 . 0 0 "[ . 1 . 2]" 1 2097 1 75 ALA HA 1 79 ASN H 2.980 . 4.090 3.548 3.510 3.590 . 0 0 "[ . 1 . 2]" 1 2098 1 75 ALA HA 1 79 ASN HB2 2.900 . 7.500 4.349 4.318 4.390 . 0 0 "[ . 1 . 2]" 1 2099 1 75 ALA HA 1 78 ARG H 2.777 . 3.741 3.446 3.343 3.613 . 0 0 "[ . 1 . 2]" 1 2100 1 75 ALA HA 1 78 ARG HA 2.949 . 7.500 4.300 4.127 4.445 . 0 0 "[ . 1 . 2]" 1 2101 1 75 ALA HA 1 78 ARG HB2 2.579 . 3.410 2.991 2.276 3.318 . 0 0 "[ . 1 . 2]" 1 2102 1 75 ALA HA 1 78 ARG QB 3.212 . 4.501 2.497 2.260 2.645 . 0 0 "[ . 1 . 2]" 1 2103 1 75 ALA HA 1 78 ARG QD 3.082 . 7.500 4.905 4.478 5.190 . 0 0 "[ . 1 . 2]" 1 2104 1 75 ALA HA 1 79 ASN H 2.984 . 4.097 4.056 3.960 4.119 0.022 16 0 "[ . 1 . 2]" 1 2105 1 75 ALA HA 1 79 ASN HB2 3.347 . 4.747 4.837 4.767 4.910 0.163 4 0 "[ . 1 . 2]" 1 2106 1 75 ALA MB 1 76 THR H 2.198 . 2.802 2.793 2.680 2.844 0.042 4 0 "[ . 1 . 2]" 1 2107 1 75 ALA MB 1 76 THR HA 2.842 . 3.851 3.858 3.811 3.890 0.039 19 0 "[ . 1 . 2]" 1 2108 1 75 ALA MB 1 76 THR HB 2.743 . 7.500 4.835 4.742 4.917 . 0 0 "[ . 1 . 2]" 1 2109 1 75 ALA MB 1 78 ARG H 2.943 . 7.500 4.616 4.556 4.713 . 0 0 "[ . 1 . 2]" 1 2110 1 75 ALA MB 1 79 ASN H 3.005 . 7.500 4.578 4.472 4.662 . 0 0 "[ . 1 . 2]" 1 2111 1 75 ALA MB 1 79 ASN HB2 3.231 . 4.536 4.406 4.306 4.526 . 0 0 "[ . 1 . 2]" 1 2112 1 75 ALA MB 1 79 ASN HD21 3.255 . 4.579 3.700 2.937 3.921 . 0 0 "[ . 1 . 2]" 1 2113 1 75 ALA MB 1 79 ASN HD22 3.059 . 4.229 4.112 3.495 4.304 0.075 12 0 "[ . 1 . 2]" 1 2114 1 75 ALA MB 1 80 ILE H 3.740 . 5.488 4.702 4.297 5.012 . 0 0 "[ . 1 . 2]" 1 2115 1 76 THR H 1 76 THR HA 2.270 . 2.914 2.842 2.824 2.868 . 0 0 "[ . 1 . 2]" 1 2116 1 76 THR H 1 76 THR HB 2.292 . 2.949 2.523 2.470 2.585 . 0 0 "[ . 1 . 2]" 1 2117 1 76 THR H 1 76 THR MG 2.321 . 7.500 3.764 3.756 3.776 . 0 0 "[ . 1 . 2]" 1 2118 1 76 THR H 1 77 LYS H 2.453 . 3.205 2.688 2.607 2.758 . 0 0 "[ . 1 . 2]" 1 2119 1 76 THR H 1 77 LYS HB2 3.554 . 5.133 4.658 4.527 4.750 . 0 0 "[ . 1 . 2]" 1 2120 1 76 THR H 1 78 ARG H 3.338 . 4.731 3.831 3.716 3.948 . 0 0 "[ . 1 . 2]" 1 2121 1 76 THR H 1 79 ASN H 4.236 . 6.479 4.435 4.327 4.495 . 0 0 "[ . 1 . 2]" 1 2122 1 76 THR H 1 80 ILE MD 3.895 . 5.791 5.218 5.168 5.278 . 0 0 "[ . 1 . 2]" 1 2123 1 76 THR HA 1 76 THR HB 2.383 . 3.093 3.021 3.017 3.025 . 0 0 "[ . 1 . 2]" 1 2124 1 76 THR HA 1 76 THR MG 2.019 . 2.529 2.375 2.307 2.415 . 0 0 "[ . 1 . 2]" 1 2125 1 76 THR HA 1 77 LYS H 2.826 . 3.824 3.574 3.561 3.594 . 0 0 "[ . 1 . 2]" 1 2126 1 76 THR HA 1 78 ARG H 3.415 . 4.873 4.394 4.259 4.471 . 0 0 "[ . 1 . 2]" 1 2127 1 76 THR HA 1 79 ASN H 2.953 . 4.043 3.338 3.216 3.405 . 0 0 "[ . 1 . 2]" 1 2128 1 76 THR HA 1 79 ASN HA 2.895 . 3.942 3.979 3.923 4.016 0.074 3 0 "[ . 1 . 2]" 1 2129 1 76 THR HA 1 79 ASN HB2 2.589 . 3.427 2.309 2.121 2.410 . 0 0 "[ . 1 . 2]" 1 2130 1 76 THR HA 1 79 ASN HB3 2.747 . 3.691 3.567 3.354 3.665 . 0 0 "[ . 1 . 2]" 1 2131 1 76 THR HA 1 79 ASN HD21 3.299 . 4.660 2.842 2.540 3.091 . 0 0 "[ . 1 . 2]" 1 2132 1 76 THR HA 1 80 ILE MD 3.098 . 4.298 3.659 3.533 3.751 . 0 0 "[ . 1 . 2]" 1 2133 1 76 THR HB 1 76 THR MG 1.894 . 2.342 2.130 2.124 2.134 . 0 0 "[ . 1 . 2]" 1 2134 1 76 THR HB 1 77 LYS H 2.513 . 3.302 2.383 2.299 2.469 . 0 0 "[ . 1 . 2]" 1 2135 1 76 THR HB 1 77 LYS HA 3.265 . 4.597 4.261 4.179 4.422 . 0 0 "[ . 1 . 2]" 1 2136 1 76 THR HB 1 77 LYS QD 2.974 . 4.080 2.378 2.204 2.678 . 0 0 "[ . 1 . 2]" 1 2137 1 76 THR HB 1 77 LYS QE 3.387 . 4.821 3.950 3.197 4.322 . 0 0 "[ . 1 . 2]" 1 2138 1 76 THR HB 1 78 ARG H 3.358 . 4.768 4.780 4.715 4.832 0.064 11 0 "[ . 1 . 2]" 1 2139 1 76 THR HB 1 80 ILE MD 3.082 . 4.269 4.299 4.210 4.331 0.062 5 0 "[ . 1 . 2]" 1 2140 1 76 THR MG 1 77 LYS H 2.446 . 3.194 3.250 3.210 3.281 0.087 2 0 "[ . 1 . 2]" 1 2141 1 76 THR MG 1 77 LYS HA 2.665 . 3.552 3.370 3.293 3.447 . 0 0 "[ . 1 . 2]" 1 2142 1 76 THR MG 1 77 LYS QD 2.739 . 3.677 2.772 2.607 3.027 . 0 0 "[ . 1 . 2]" 1 2143 1 76 THR MG 1 77 LYS QE 2.746 . 3.689 3.681 3.222 3.781 0.092 9 0 "[ . 1 . 2]" 1 2144 1 76 THR MG 1 78 ARG H 3.211 . 4.499 4.459 4.423 4.496 . 0 0 "[ . 1 . 2]" 1 2145 1 76 THR MG 1 78 ARG H 3.159 . 7.500 4.925 4.875 4.952 . 0 0 "[ . 1 . 2]" 1 2146 1 76 THR MG 1 78 ARG HA 3.224 . 7.500 5.352 5.217 5.429 . 0 0 "[ . 1 . 2]" 1 2147 1 76 THR MG 1 79 ASN H 3.156 . 4.401 4.425 4.356 4.456 0.055 11 0 "[ . 1 . 2]" 1 2148 1 76 THR MG 1 79 ASN HA 2.972 . 7.500 5.017 4.970 5.067 . 0 0 "[ . 1 . 2]" 1 2149 1 76 THR MG 1 79 ASN HB2 2.994 . 4.114 3.737 3.614 3.854 . 0 0 "[ . 1 . 2]" 1 2150 1 76 THR MG 1 79 ASN HB3 2.979 . 4.088 4.090 3.877 4.194 0.106 15 0 "[ . 1 . 2]" 1 2151 1 76 THR MG 1 79 ASN HD21 3.381 . 4.810 4.336 3.967 4.843 0.033 19 0 "[ . 1 . 2]" 1 2152 1 76 THR MG 1 79 ASN HD22 3.875 . 5.752 5.719 5.392 5.812 0.060 2 0 "[ . 1 . 2]" 1 2153 1 76 THR MG 1 80 ILE H 3.125 . 4.346 4.147 4.003 4.334 . 0 0 "[ . 1 . 2]" 1 2154 1 76 THR MG 1 80 ILE H 2.727 . 3.657 3.340 3.287 3.437 . 0 0 "[ . 1 . 2]" 1 2155 1 76 THR MG 1 80 ILE HB 2.399 . 7.500 4.425 4.186 4.586 . 0 0 "[ . 1 . 2]" 1 2156 1 76 THR MG 1 80 ILE MD 2.237 . 2.862 2.289 2.152 2.380 . 0 0 "[ . 1 . 2]" 1 2157 1 76 THR MG 1 80 ILE MD 2.024 . 2.536 1.801 1.772 1.817 . 0 0 "[ . 1 . 2]" 1 2158 1 76 THR MG 1 97 GLU QG 2.526 . 7.500 4.550 2.677 5.301 . 0 0 "[ . 1 . 2]" 1 2159 1 77 LYS H 1 77 LYS HA 2.817 . 3.809 2.802 2.787 2.813 . 0 0 "[ . 1 . 2]" 1 2160 1 77 LYS H 1 77 LYS HB2 2.900 . 3.951 2.329 2.285 2.377 . 0 0 "[ . 1 . 2]" 1 2161 1 77 LYS H 1 77 LYS HB3 3.262 . 4.592 3.559 3.535 3.580 . 0 0 "[ . 1 . 2]" 1 2162 1 77 LYS H 1 77 LYS HD2 2.501 . 3.283 2.093 1.910 2.519 . 0 0 "[ . 1 . 2]" 1 2163 1 77 LYS H 1 77 LYS QE 3.244 . 4.559 4.031 3.786 4.159 . 0 0 "[ . 1 . 2]" 1 2164 1 77 LYS H 1 77 LYS HG3 3.029 . 4.176 3.663 3.554 3.817 . 0 0 "[ . 1 . 2]" 1 2165 1 77 LYS H 1 78 ARG H 2.816 . 3.807 2.647 2.600 2.694 . 0 0 "[ . 1 . 2]" 1 2166 1 77 LYS H 1 78 ARG HA 3.966 . 5.932 5.253 5.211 5.294 . 0 0 "[ . 1 . 2]" 1 2167 1 77 LYS H 1 79 ASN H 3.663 . 5.340 3.861 3.785 3.916 . 0 0 "[ . 1 . 2]" 1 2168 1 77 LYS H 1 79 ASN HA 3.393 . 7.500 6.035 5.869 6.215 . 0 0 "[ . 1 . 2]" 1 2169 1 77 LYS H 1 80 ILE H 4.091 . 6.183 4.643 4.594 4.709 . 0 0 "[ . 1 . 2]" 1 2170 1 77 LYS H 1 80 ILE HB 3.398 . 4.842 4.991 4.928 5.053 0.211 7 0 "[ . 1 . 2]" 1 2171 1 77 LYS H 1 80 ILE MD 3.087 . 4.278 4.235 4.164 4.278 . 3 0 "[ . 1 . 2]" 1 2172 1 77 LYS H 1 80 ILE MD 3.207 . 4.492 3.923 3.843 3.980 . 0 0 "[ . 1 . 2]" 1 2173 1 77 LYS H 1 81 TYR H 4.177 . 6.358 5.605 5.555 5.662 . 0 0 "[ . 1 . 2]" 1 2174 1 77 LYS HA 1 77 LYS HD2 3.018 . 4.156 2.696 2.432 2.845 . 0 0 "[ . 1 . 2]" 1 2175 1 77 LYS HA 1 77 LYS HB2 2.848 . 3.862 3.008 3.000 3.018 . 0 0 "[ . 1 . 2]" 1 2176 1 77 LYS HA 1 77 LYS HB3 2.809 . 3.796 2.575 2.539 2.611 . 0 0 "[ . 1 . 2]" 1 2177 1 77 LYS HA 1 77 LYS QD 2.601 . 3.446 2.689 2.458 2.821 . 0 0 "[ . 1 . 2]" 1 2178 1 77 LYS HA 1 77 LYS QE 3.047 . 4.208 4.065 3.888 4.240 0.032 1 0 "[ . 1 . 2]" 1 2179 1 77 LYS HA 1 77 LYS HG3 2.624 . 3.485 2.421 2.335 2.620 . 0 0 "[ . 1 . 2]" 1 2180 1 77 LYS HA 1 77 LYS HG3 2.878 . 3.913 2.121 1.974 2.244 . 0 0 "[ . 1 . 2]" 1 2181 1 77 LYS HA 1 78 ARG H 3.221 . 4.518 3.538 3.513 3.557 . 0 0 "[ . 1 . 2]" 1 2182 1 77 LYS HA 1 80 ILE H 3.050 . 4.213 3.052 2.925 3.154 . 0 0 "[ . 1 . 2]" 1 2183 1 77 LYS HA 1 80 ILE HB 3.041 . 4.197 2.552 2.444 2.648 . 0 0 "[ . 1 . 2]" 1 2184 1 77 LYS HA 1 80 ILE MD 2.238 . 2.864 2.791 2.653 2.908 0.044 11 0 "[ . 1 . 2]" 1 2185 1 77 LYS HA 1 80 ILE MG 2.620 . 3.478 3.100 3.031 3.158 . 0 0 "[ . 1 . 2]" 1 2186 1 77 LYS HA 1 89 LEU MD2 2.223 . 2.841 2.646 2.361 2.841 . 16 0 "[ . 1 . 2]" 1 2187 1 77 LYS HB2 1 77 LYS HD3 2.546 . 3.356 2.481 2.397 2.556 . 0 0 "[ . 1 . 2]" 1 2188 1 77 LYS HB2 1 77 LYS HD3 2.810 . 3.797 2.205 2.179 2.247 . 0 0 "[ . 1 . 2]" 1 2189 1 77 LYS HB2 1 77 LYS QE 3.414 . 4.871 4.002 3.920 4.222 . 0 0 "[ . 1 . 2]" 1 2190 1 77 LYS HB2 1 77 LYS HG2 2.906 . 3.962 2.473 2.373 2.514 . 0 0 "[ . 1 . 2]" 1 2191 1 77 LYS HB2 1 78 ARG H 3.144 . 4.379 2.817 2.741 2.895 . 0 0 "[ . 1 . 2]" 1 2192 1 77 LYS HB2 1 89 LEU MD2 3.253 . 4.576 3.668 3.481 3.853 . 0 0 "[ . 1 . 2]" 1 2193 1 77 LYS HB3 1 77 LYS QE 3.167 . 4.421 3.974 3.903 4.111 . 0 0 "[ . 1 . 2]" 1 2194 1 77 LYS HB3 1 80 ILE H 3.588 . 5.197 4.336 4.218 4.406 . 0 0 "[ . 1 . 2]" 1 2195 1 77 LYS HB3 1 81 TYR H 3.547 . 5.120 4.151 4.104 4.178 . 0 0 "[ . 1 . 2]" 1 2196 1 77 LYS HB3 1 80 ILE MG 2.892 . 3.938 4.046 3.992 4.145 0.207 17 0 "[ . 1 . 2]" 1 2197 1 77 LYS HB3 1 89 LEU MD2 3.054 . 4.220 2.171 2.025 2.365 . 0 0 "[ . 1 . 2]" 1 2198 1 77 LYS QD 1 79 ASN HA 3.112 . 7.500 7.305 7.187 7.418 . 0 0 "[ . 1 . 2]" 1 2199 1 77 LYS QD 1 80 ILE H 3.929 . 5.859 5.027 4.876 5.192 . 0 0 "[ . 1 . 2]" 1 2200 1 77 LYS QD 1 93 GLU HB2 2.952 . 4.041 3.947 3.764 4.123 0.082 18 0 "[ . 1 . 2]" 1 2201 1 77 LYS QE 1 77 LYS HG2 2.705 . 3.620 2.438 2.310 2.892 . 0 0 "[ . 1 . 2]" 1 2202 1 77 LYS QE 1 77 LYS HG3 2.671 . 3.563 2.435 2.360 2.522 . 0 0 "[ . 1 . 2]" 1 2203 1 77 LYS QE 1 89 LEU MD2 2.287 . 2.941 2.813 2.563 3.060 0.119 6 0 "[ . 1 . 2]" 1 2204 1 77 LYS QE 1 89 LEU HA 3.387 . 4.821 4.657 4.505 4.817 . 0 0 "[ . 1 . 2]" 1 2205 1 77 LYS QE 1 92 ALA MB 2.834 . 3.838 3.605 3.121 3.954 0.116 13 0 "[ . 1 . 2]" 1 2206 1 77 LYS HE3 1 80 ILE HB 3.249 . 4.569 4.052 3.982 4.121 . 0 0 "[ . 1 . 2]" 1 2207 1 77 LYS HG2 1 89 LEU MD2 2.995 . 4.116 3.520 3.108 3.967 . 0 0 "[ . 1 . 2]" 1 2208 1 77 LYS HG3 1 78 ARG H 3.574 . 5.171 5.097 5.052 5.172 0.001 19 0 "[ . 1 . 2]" 1 2209 1 77 LYS HG3 1 89 LEU MD2 2.954 . 4.045 2.877 2.482 3.233 . 0 0 "[ . 1 . 2]" 1 2210 1 78 ARG H 1 78 ARG HA 2.744 . 3.685 2.837 2.821 2.848 . 0 0 "[ . 1 . 2]" 1 2211 1 78 ARG H 1 78 ARG HB2 2.506 . 3.291 2.280 2.237 2.395 . 0 0 "[ . 1 . 2]" 1 2212 1 78 ARG H 1 78 ARG QD 3.283 . 4.266 3.830 3.582 3.922 . 0 0 "[ . 1 . 2]" 1 2213 1 78 ARG H 1 79 ASN H 2.733 . 3.667 2.506 2.464 2.589 . 0 0 "[ . 1 . 2]" 1 2214 1 78 ARG H 1 79 ASN HA 3.292 . 7.500 5.149 5.115 5.211 . 0 0 "[ . 1 . 2]" 1 2215 1 78 ARG H 1 79 ASN HB2 3.122 . 4.340 4.275 4.212 4.362 0.022 11 0 "[ . 1 . 2]" 1 2216 1 78 ARG H 1 79 ASN HB2 3.103 . 4.307 4.084 3.952 4.177 . 0 0 "[ . 1 . 2]" 1 2217 1 78 ARG H 1 79 ASN HB3 3.150 . 7.500 5.684 5.603 5.842 . 0 0 "[ . 1 . 2]" 1 2218 1 78 ARG H 1 80 ILE H 3.682 . 5.377 4.067 3.909 4.136 . 0 0 "[ . 1 . 2]" 1 2219 1 78 ARG H 1 80 ILE HB 2.700 . 7.500 5.242 5.142 5.336 . 0 0 "[ . 1 . 2]" 1 2220 1 78 ARG H 1 80 ILE MD 3.425 . 4.891 4.100 4.006 4.179 . 0 0 "[ . 1 . 2]" 1 2221 1 78 ARG H 1 81 TYR H 3.959 . 5.918 4.444 4.381 4.513 . 0 0 "[ . 1 . 2]" 1 2222 1 78 ARG H 1 89 LEU MD2 3.309 . 4.678 4.388 4.231 4.475 . 0 0 "[ . 1 . 2]" 1 2223 1 78 ARG HA 1 78 ARG QB 2.575 . 3.404 2.462 2.423 2.485 . 0 0 "[ . 1 . 2]" 1 2224 1 78 ARG HA 1 78 ARG QD 3.051 . 4.062 2.034 1.797 2.376 0.091 5 0 "[ . 1 . 2]" 1 2225 1 78 ARG HA 1 79 ASN H 2.950 . 4.038 3.445 3.421 3.482 . 0 0 "[ . 1 . 2]" 1 2226 1 78 ARG HA 1 79 ASN HA 3.442 . 4.923 4.735 4.700 4.783 . 0 0 "[ . 1 . 2]" 1 2227 1 78 ARG HA 1 79 ASN HA 2.932 . 4.006 4.186 4.141 4.209 0.203 19 0 "[ . 1 . 2]" 1 2228 1 78 ARG HA 1 79 ASN HB2 2.961 . 7.500 4.734 4.668 4.791 . 0 0 "[ . 1 . 2]" 1 2229 1 78 ARG HA 1 81 TYR H 2.876 . 3.910 2.894 2.774 3.030 . 0 0 "[ . 1 . 2]" 1 2230 1 78 ARG HA 1 81 TYR HA 3.044 . 7.500 4.218 4.085 4.361 . 0 0 "[ . 1 . 2]" 1 2231 1 78 ARG HA 1 82 ASP H 3.104 . 4.308 3.751 3.655 3.865 . 0 0 "[ . 1 . 2]" 1 2232 1 78 ARG HA 1 80 ILE HB 2.725 . 7.500 5.290 5.103 5.523 . 0 0 "[ . 1 . 2]" 1 2233 1 78 ARG HA 1 81 TYR H 2.996 . 4.118 3.088 2.913 3.311 . 0 0 "[ . 1 . 2]" 1 2234 1 78 ARG HA 1 81 TYR QB 2.663 . 3.550 1.876 1.765 2.074 0.011 20 0 "[ . 1 . 2]" 1 2235 1 78 ARG HA 1 82 ASP H 3.189 . 4.460 4.329 4.221 4.423 . 0 0 "[ . 1 . 2]" 1 2236 1 78 ARG HA 1 89 LEU QD 3.009 . 4.141 3.575 3.491 3.811 . 0 0 "[ . 1 . 2]" 1 2237 1 78 ARG QB 1 78 ARG QD 2.681 . 3.579 2.347 2.205 2.850 . 0 0 "[ . 1 . 2]" 1 2238 1 78 ARG QB 1 79 ASN H 2.734 . 3.668 2.821 2.644 2.919 . 0 0 "[ . 1 . 2]" 1 2239 1 78 ARG QB 1 79 ASN HB2 3.043 . 4.201 4.260 4.154 4.311 0.110 2 0 "[ . 1 . 2]" 1 2240 1 78 ARG QB 1 79 ASN HB3 3.128 . 7.500 5.515 5.381 5.572 . 0 0 "[ . 1 . 2]" 1 2241 1 78 ARG QB 1 82 ASP H 3.642 . 5.300 5.376 4.942 5.467 0.167 9 0 "[ . 1 . 2]" 1 2242 1 78 ARG HB2 1 78 ARG QD 2.681 . 3.579 2.428 2.242 3.497 . 0 0 "[ . 1 . 2]" 1 2243 1 78 ARG HB3 1 79 ASN HA 3.036 . 4.188 4.131 4.026 4.242 0.054 11 0 "[ . 1 . 2]" 1 2244 1 78 ARG QD 1 79 ASN H 3.517 . 7.500 4.882 4.700 5.077 . 0 0 "[ . 1 . 2]" 1 2245 1 78 ARG QD 1 79 ASN HA 2.649 . 7.500 5.279 5.000 5.588 . 0 0 "[ . 1 . 2]" 1 2246 1 79 ASN H 1 79 ASN HA 2.353 . 3.045 2.846 2.824 2.867 . 0 0 "[ . 1 . 2]" 1 2247 1 79 ASN H 1 79 ASN HB2 2.168 . 2.756 2.058 2.024 2.082 . 0 0 "[ . 1 . 2]" 1 2248 1 79 ASN H 1 79 ASN HB3 2.112 . 7.500 3.289 3.220 3.406 . 0 0 "[ . 1 . 2]" 1 2249 1 79 ASN H 1 79 ASN HD22 4.073 . 6.147 5.008 4.557 5.173 . 0 0 "[ . 1 . 2]" 1 2250 1 79 ASN H 1 80 ILE H 2.820 . 3.814 2.505 2.412 2.605 . 0 0 "[ . 1 . 2]" 1 2251 1 79 ASN H 1 80 ILE HB 2.702 . 7.500 4.583 4.496 4.719 . 0 0 "[ . 1 . 2]" 1 2252 1 79 ASN H 1 80 ILE MD 3.098 . 4.298 3.756 3.671 3.842 . 0 0 "[ . 1 . 2]" 1 2253 1 79 ASN H 1 81 TYR H 3.501 . 5.033 3.752 3.646 3.875 . 0 0 "[ . 1 . 2]" 1 2254 1 79 ASN HA 1 83 LYS HD2 3.475 . 4.985 5.019 4.800 5.133 0.148 20 0 "[ . 1 . 2]" 1 2255 1 79 ASN HA 1 79 ASN HD21 4.167 . 6.338 4.085 3.366 4.281 . 0 0 "[ . 1 . 2]" 1 2256 1 79 ASN HA 1 80 ILE H 2.827 . 3.826 3.510 3.459 3.536 . 0 0 "[ . 1 . 2]" 1 2257 1 79 ASN HA 1 80 ILE HB 2.852 . 7.500 5.752 5.717 5.775 . 0 0 "[ . 1 . 2]" 1 2258 1 79 ASN HA 1 80 ILE MD 3.113 . 4.325 4.401 4.354 4.460 0.135 12 0 "[ . 1 . 2]" 1 2259 1 79 ASN HA 1 80 ILE MG 3.044 . 4.203 4.205 4.128 4.258 0.055 13 0 "[ . 1 . 2]" 1 2260 1 79 ASN HA 1 81 TYR H 3.768 . 5.543 4.186 4.092 4.275 . 0 0 "[ . 1 . 2]" 1 2261 1 79 ASN QB 1 80 ILE H 2.722 . 3.648 2.780 2.689 2.983 . 0 0 "[ . 1 . 2]" 1 2262 1 79 ASN HB2 1 79 ASN HD21 2.706 . 3.622 2.206 2.149 2.254 . 0 0 "[ . 1 . 2]" 1 2263 1 79 ASN HB2 1 79 ASN HD22 2.873 . 3.905 3.460 3.419 3.483 . 0 0 "[ . 1 . 2]" 1 2264 1 79 ASN HB2 1 80 ILE H 2.579 . 3.410 3.141 2.964 3.350 . 0 0 "[ . 1 . 2]" 1 2265 1 79 ASN HB2 1 80 ILE HB 2.739 . 7.500 5.295 5.126 5.464 . 0 0 "[ . 1 . 2]" 1 2266 1 79 ASN HB2 1 80 ILE MD 2.879 . 3.915 3.321 3.173 3.463 . 0 0 "[ . 1 . 2]" 1 2267 1 79 ASN HB2 1 81 TYR H 3.244 . 7.500 5.161 5.016 5.275 . 0 0 "[ . 1 . 2]" 1 2268 1 79 ASN HB3 1 79 ASN HD21 2.664 . 3.551 2.991 2.866 3.403 . 0 0 "[ . 1 . 2]" 1 2269 1 79 ASN HB3 1 79 ASN HD22 2.839 . 3.847 3.817 3.762 4.002 0.155 19 0 "[ . 1 . 2]" 1 2270 1 79 ASN HB3 1 80 ILE H 2.550 . 3.363 3.110 2.980 3.365 0.002 15 0 "[ . 1 . 2]" 1 2271 1 79 ASN HB3 1 80 ILE HB 2.719 . 7.500 5.107 4.955 5.381 . 0 0 "[ . 1 . 2]" 1 2272 1 79 ASN HB3 1 80 ILE MD 2.713 . 3.633 2.640 2.479 2.877 . 0 0 "[ . 1 . 2]" 1 2273 1 79 ASN HB3 1 81 TYR H 3.336 . 7.500 5.217 5.117 5.369 . 0 0 "[ . 1 . 2]" 1 2274 1 79 ASN HD21 1 80 ILE MD 3.492 . 5.016 4.741 4.541 5.039 0.023 2 0 "[ . 1 . 2]" 1 2275 1 79 ASN HD22 1 80 ILE MD 3.566 . 7.500 5.803 5.669 5.953 . 0 0 "[ . 1 . 2]" 1 2276 1 80 ILE H 1 80 ILE HA 2.674 . 3.568 2.861 2.847 2.890 . 0 0 "[ . 1 . 2]" 1 2277 1 80 ILE H 1 80 ILE HB 2.380 . 3.088 2.343 2.308 2.365 . 0 0 "[ . 1 . 2]" 1 2278 1 80 ILE H 1 80 ILE MD 2.385 . 3.096 2.206 2.134 2.346 . 0 0 "[ . 1 . 2]" 1 2279 1 80 ILE H 1 80 ILE QG 3.009 . 4.141 3.523 3.482 3.609 . 0 0 "[ . 1 . 2]" 1 2280 1 80 ILE H 1 80 ILE MG 2.528 . 7.500 3.718 3.695 3.739 . 0 0 "[ . 1 . 2]" 1 2281 1 80 ILE H 1 81 TYR H 2.838 . 3.845 2.446 2.273 2.501 . 0 0 "[ . 1 . 2]" 1 2282 1 80 ILE H 1 89 LEU MD2 2.823 . 3.819 3.513 3.312 3.656 . 0 0 "[ . 1 . 2]" 1 2283 1 80 ILE HA 1 80 ILE HB 2.439 . 3.182 3.014 3.008 3.019 . 0 0 "[ . 1 . 2]" 1 2284 1 80 ILE HA 1 80 ILE MD 2.342 . 3.028 2.630 2.538 2.672 . 0 0 "[ . 1 . 2]" 1 2285 1 80 ILE HA 1 80 ILE HG13 2.613 . 3.467 2.352 2.335 2.377 . 0 0 "[ . 1 . 2]" 1 2286 1 80 ILE HA 1 80 ILE MG 2.173 . 2.763 2.321 2.232 2.372 . 0 0 "[ . 1 . 2]" 1 2287 1 80 ILE HA 1 81 TYR H 3.168 . 4.423 3.505 3.482 3.530 . 0 0 "[ . 1 . 2]" 1 2288 1 80 ILE HA 1 83 LYS H 2.914 . 3.976 3.375 3.185 3.515 . 0 0 "[ . 1 . 2]" 1 2289 1 80 ILE HA 1 83 LYS HB2 2.609 . 3.460 2.837 2.689 2.930 . 0 0 "[ . 1 . 2]" 1 2290 1 80 ILE HA 1 83 LYS HB3 3.222 . 4.520 4.518 4.363 4.626 0.106 6 0 "[ . 1 . 2]" 1 2291 1 80 ILE HA 1 83 LYS HD3 3.011 . 4.144 3.603 2.429 4.481 0.337 6 0 "[ . 1 . 2]" 1 2292 1 80 ILE HA 1 84 TYR H 3.200 . 4.480 3.365 3.182 3.449 . 0 0 "[ . 1 . 2]" 1 2293 1 80 ILE HB 1 80 ILE MD 1.930 . 2.396 2.414 2.402 2.432 0.036 1 0 "[ . 1 . 2]" 1 2294 1 80 ILE HB 1 80 ILE MD 2.374 . 3.079 2.003 1.993 2.014 . 0 0 "[ . 1 . 2]" 1 2295 1 80 ILE HB 1 80 ILE QG 2.580 . 3.412 2.390 2.375 2.399 . 0 0 "[ . 1 . 2]" 1 2296 1 80 ILE HB 1 80 ILE MG 2.070 . 2.605 2.139 2.128 2.152 . 0 0 "[ . 1 . 2]" 1 2297 1 80 ILE HB 1 81 TYR H 2.700 . 3.611 2.835 2.760 2.902 . 0 0 "[ . 1 . 2]" 1 2298 1 80 ILE HB 1 82 ASP H 3.361 . 7.500 5.317 5.185 5.490 . 0 0 "[ . 1 . 2]" 1 2299 1 80 ILE HB 1 89 LEU H 2.704 . 7.500 4.227 4.161 4.288 . 0 0 "[ . 1 . 2]" 1 2300 1 80 ILE HB 1 89 LEU MD2 1.770 . 2.162 2.187 2.024 2.250 0.088 9 0 "[ . 1 . 2]" 1 2301 1 80 ILE MD 1 92 ALA MB 2.004 . 7.500 2.509 2.349 2.687 . 0 0 "[ . 1 . 2]" 1 2302 1 80 ILE MD 1 81 TYR H 2.860 . 7.500 4.047 4.010 4.085 . 0 0 "[ . 1 . 2]" 1 2303 1 80 ILE MD 1 83 LYS H 3.191 . 7.500 5.475 5.276 5.637 . 0 0 "[ . 1 . 2]" 1 2304 1 80 ILE MD 1 89 LEU HA 2.978 . 7.500 5.297 5.136 5.559 . 0 0 "[ . 1 . 2]" 1 2305 1 80 ILE MD 1 92 ALA MB 2.154 . 7.500 3.237 3.009 3.551 . 0 0 "[ . 1 . 2]" 1 2306 1 80 ILE MD 1 97 GLU H 3.399 . 4.843 4.241 3.939 4.700 . 0 0 "[ . 1 . 2]" 1 2307 1 80 ILE MD 1 97 GLU QG 2.373 . 3.077 2.569 1.927 3.073 . 0 0 "[ . 1 . 2]" 1 2308 1 80 ILE QG 1 80 ILE MG 2.398 . 3.117 2.090 2.056 2.105 . 0 0 "[ . 1 . 2]" 1 2309 1 80 ILE QG 1 81 TYR H 3.445 . 4.929 4.572 4.530 4.610 . 0 0 "[ . 1 . 2]" 1 2310 1 80 ILE MG 1 81 TYR H 2.644 . 3.518 3.173 3.059 3.241 . 0 0 "[ . 1 . 2]" 1 2311 1 80 ILE MG 1 82 ASP H 3.018 . 4.156 3.701 3.568 3.807 . 0 0 "[ . 1 . 2]" 1 2312 1 80 ILE MG 1 83 LYS H 2.828 . 3.827 3.897 3.867 3.937 0.110 18 0 "[ . 1 . 2]" 1 2313 1 80 ILE MG 1 84 TYR H 2.812 . 3.800 2.624 2.573 2.682 . 0 0 "[ . 1 . 2]" 1 2314 1 80 ILE MG 1 84 TYR HA 3.001 . 4.126 4.200 4.157 4.255 0.129 4 0 "[ . 1 . 2]" 1 2315 1 80 ILE MG 1 84 TYR HB2 2.541 . 3.348 1.893 1.753 1.989 . 0 0 "[ . 1 . 2]" 1 2316 1 80 ILE MG 1 85 GLY H 3.346 . 4.746 4.500 4.415 4.651 . 0 0 "[ . 1 . 2]" 1 2317 1 80 ILE MG 1 88 GLY H 2.866 . 3.893 4.107 4.013 4.238 0.345 16 0 "[ . 1 . 2]" 1 2318 1 80 ILE MG 1 88 GLY HA2 2.735 . 3.670 3.673 3.452 3.738 0.068 15 0 "[ . 1 . 2]" 1 2319 1 80 ILE MG 1 88 GLY HA3 3.107 . 4.314 2.614 2.444 2.719 . 0 0 "[ . 1 . 2]" 1 2320 1 80 ILE MG 1 89 LEU H 2.734 . 3.668 3.174 3.038 3.301 . 0 0 "[ . 1 . 2]" 1 2321 1 80 ILE MG 1 89 LEU H 2.467 . 3.228 2.824 2.762 2.887 . 0 0 "[ . 1 . 2]" 1 2322 1 80 ILE MG 1 89 LEU HA 2.515 . 3.306 2.895 2.709 3.122 . 0 0 "[ . 1 . 2]" 1 2323 1 80 ILE MG 1 89 LEU HB2 2.627 . 3.490 3.534 3.306 3.899 0.409 9 0 "[ . 1 . 2]" 1 2324 1 80 ILE MG 1 92 ALA H 2.846 . 3.858 3.659 3.552 3.748 . 0 0 "[ . 1 . 2]" 1 2325 1 80 ILE MG 1 92 ALA MB 2.384 . 3.094 2.616 2.451 2.792 . 0 0 "[ . 1 . 2]" 1 2326 1 80 ILE MG 1 97 GLU QG 2.656 . 3.538 3.491 3.088 3.668 0.130 9 0 "[ . 1 . 2]" 1 2327 1 80 ILE MG 1 101 ASN HD21 3.387 . 4.821 4.334 3.876 4.947 0.126 5 0 "[ . 1 . 2]" 1 2328 1 80 ILE MG 1 101 ASN HD22 3.352 . 4.756 4.353 3.741 4.757 0.001 15 0 "[ . 1 . 2]" 1 2329 1 81 TYR H 1 81 TYR HA 2.793 . 3.768 2.727 2.694 2.755 . 0 0 "[ . 1 . 2]" 1 2330 1 81 TYR H 1 81 TYR HB2 2.541 . 3.348 2.824 2.594 2.981 . 0 0 "[ . 1 . 2]" 1 2331 1 81 TYR H 1 83 LYS H 3.822 . 5.648 4.108 4.052 4.159 . 0 0 "[ . 1 . 2]" 1 2332 1 81 TYR H 1 89 LEU QD 2.548 . 3.359 2.321 2.176 2.588 . 0 0 "[ . 1 . 2]" 1 2333 1 81 TYR H 1 89 LEU MD2 2.636 . 3.505 2.378 2.200 2.798 . 0 0 "[ . 1 . 2]" 1 2334 1 81 TYR HA 1 82 ASP H 2.822 . 3.817 3.537 3.507 3.573 . 0 0 "[ . 1 . 2]" 1 2335 1 81 TYR HA 1 84 TYR H 2.914 . 3.975 3.328 3.280 3.386 . 0 0 "[ . 1 . 2]" 1 2336 1 81 TYR HA 1 85 GLY H 2.868 . 7.500 4.863 4.594 5.129 . 0 0 "[ . 1 . 2]" 1 2337 1 81 TYR HA 1 85 GLY H 2.744 . 7.500 5.156 4.818 5.474 . 0 0 "[ . 1 . 2]" 1 2338 1 81 TYR HA 1 89 LEU MD1 2.789 . 3.761 2.140 1.944 2.294 . 0 0 "[ . 1 . 2]" 1 2339 1 81 TYR QB 1 82 ASP H 2.603 . 3.450 2.784 2.497 3.027 . 0 0 "[ . 1 . 2]" 1 2340 1 81 TYR QB 1 83 LYS H 3.167 . 4.421 4.168 4.094 4.246 . 0 0 "[ . 1 . 2]" 1 2341 1 81 TYR QB 1 89 LEU MD1 2.637 . 3.506 1.964 1.756 2.417 0.012 8 0 "[ . 1 . 2]" 1 2342 1 82 ASP H 1 82 ASP HA 2.407 . 3.131 2.848 2.818 2.877 . 0 0 "[ . 1 . 2]" 1 2343 1 82 ASP H 1 82 ASP QB 2.485 . 3.257 2.274 2.204 2.512 . 0 0 "[ . 1 . 2]" 1 2344 1 82 ASP H 1 83 LYS H 2.677 . 3.572 2.594 2.476 2.657 . 0 0 "[ . 1 . 2]" 1 2345 1 82 ASP H 1 83 LYS HB2 3.383 . 4.813 4.793 4.680 4.840 0.027 3 0 "[ . 1 . 2]" 1 2346 1 82 ASP H 1 84 TYR H 3.566 . 5.156 4.512 4.358 4.618 . 0 0 "[ . 1 . 2]" 1 2347 1 82 ASP HA 1 82 ASP QB 2.291 . 2.947 2.360 2.175 2.481 . 0 0 "[ . 1 . 2]" 1 2348 1 82 ASP HA 1 83 LYS H 2.687 . 3.590 3.392 3.317 3.449 . 0 0 "[ . 1 . 2]" 1 2349 1 82 ASP HA 1 84 TYR H 3.247 . 7.500 5.347 5.248 5.455 . 0 0 "[ . 1 . 2]" 1 2350 1 82 ASP QB 1 83 LYS H 2.855 . 3.874 3.179 2.980 3.861 . 0 0 "[ . 1 . 2]" 1 2351 1 83 LYS H 1 83 LYS HA 2.446 . 3.194 2.948 2.939 2.954 . 0 0 "[ . 1 . 2]" 1 2352 1 83 LYS H 1 83 LYS HB2 2.428 . 3.165 2.539 2.499 2.611 . 0 0 "[ . 1 . 2]" 1 2353 1 83 LYS H 1 83 LYS HB3 2.503 . 7.500 3.695 3.662 3.728 . 0 0 "[ . 1 . 2]" 1 2354 1 83 LYS H 1 83 LYS QD 2.955 . 4.047 3.882 3.727 4.089 0.042 2 0 "[ . 1 . 2]" 1 2355 1 83 LYS H 1 83 LYS HG2 2.920 . 3.985 3.910 3.783 4.001 0.016 6 0 "[ . 1 . 2]" 1 2356 1 83 LYS H 1 83 LYS HG3 2.723 . 3.650 2.671 2.511 2.795 . 0 0 "[ . 1 . 2]" 1 2357 1 83 LYS H 1 84 TYR H 2.511 . 3.299 2.284 2.208 2.395 . 0 0 "[ . 1 . 2]" 1 2358 1 83 LYS H 1 84 TYR HA 3.047 . 7.500 4.741 4.608 4.851 . 0 0 "[ . 1 . 2]" 1 2359 1 83 LYS H 1 85 GLY H 3.039 . 7.500 5.664 5.320 6.083 . 0 0 "[ . 1 . 2]" 1 2360 1 83 LYS HA 1 83 LYS HB2 2.346 . 3.034 3.027 3.024 3.030 . 0 0 "[ . 1 . 2]" 1 2361 1 83 LYS HA 1 83 LYS HB3 2.329 . 3.007 2.462 2.434 2.485 . 0 0 "[ . 1 . 2]" 1 2362 1 83 LYS HA 1 83 LYS QD 2.714 . 7.500 4.165 4.060 4.288 . 0 0 "[ . 1 . 2]" 1 2363 1 83 LYS HA 1 83 LYS HG2 2.466 . 3.226 2.693 2.587 2.780 . 0 0 "[ . 1 . 2]" 1 2364 1 83 LYS HA 1 83 LYS HG3 2.498 . 3.278 3.026 2.880 3.151 . 0 0 "[ . 1 . 2]" 1 2365 1 83 LYS HA 1 84 TYR H 2.825 . 3.823 3.532 3.522 3.546 . 0 0 "[ . 1 . 2]" 1 2366 1 83 LYS HB2 1 83 LYS QD 2.578 . 3.409 2.347 2.267 2.441 . 0 0 "[ . 1 . 2]" 1 2367 1 83 LYS HB2 1 83 LYS QE 3.053 . 4.218 3.407 2.576 4.154 . 0 0 "[ . 1 . 2]" 1 2368 1 83 LYS HB2 1 83 LYS HG2 2.626 . 3.488 3.003 2.995 3.010 . 0 0 "[ . 1 . 2]" 1 2369 1 83 LYS HB2 1 83 LYS HG3 2.505 . 3.289 2.507 2.440 2.546 . 0 0 "[ . 1 . 2]" 1 2370 1 83 LYS HB2 1 84 TYR H 2.754 . 3.702 2.079 2.007 2.242 . 0 0 "[ . 1 . 2]" 1 2371 1 83 LYS HB3 1 83 LYS QD 2.539 . 3.345 2.711 2.422 3.075 . 0 0 "[ . 1 . 2]" 1 2372 1 83 LYS HB3 1 83 LYS QE 3.022 . 4.164 3.126 1.914 4.236 0.072 3 0 "[ . 1 . 2]" 1 2373 1 83 LYS HB3 1 83 LYS HG2 2.526 . 3.323 2.381 2.347 2.443 . 0 0 "[ . 1 . 2]" 1 2374 1 83 LYS HB3 1 83 LYS HG3 2.417 . 3.147 3.006 2.997 3.012 . 0 0 "[ . 1 . 2]" 1 2375 1 83 LYS HB3 1 84 TYR H 2.807 . 3.792 3.242 3.186 3.371 . 0 0 "[ . 1 . 2]" 1 2376 1 83 LYS HD2 1 83 LYS HE2 2.208 . 2.818 2.215 2.034 2.281 . 0 0 "[ . 1 . 2]" 1 2377 1 83 LYS QD 1 83 LYS HG2 2.234 . 2.858 2.354 2.316 2.379 . 0 0 "[ . 1 . 2]" 1 2378 1 83 LYS QD 1 83 LYS HG3 2.305 . 2.969 2.263 2.174 2.374 . 0 0 "[ . 1 . 2]" 1 2379 1 83 LYS QD 1 84 TYR H 3.337 . 4.729 4.120 3.966 4.346 . 0 0 "[ . 1 . 2]" 1 2380 1 83 LYS QE 1 83 LYS HG2 2.615 . 3.470 2.482 2.348 2.965 . 0 0 "[ . 1 . 2]" 1 2381 1 83 LYS QE 1 83 LYS HG3 2.620 . 3.478 2.912 2.382 3.503 0.025 11 0 "[ . 1 . 2]" 1 2382 1 83 LYS HE2 1 83 LYS HG2 2.498 . 3.278 2.997 2.452 3.735 0.457 6 0 "[ . 1 . 2]" 1 2383 1 83 LYS HG2 1 84 TYR H 3.273 . 7.500 4.738 4.692 4.834 . 0 0 "[ . 1 . 2]" 1 2384 1 83 LYS HG3 1 84 TYR H 3.169 . 4.424 4.016 3.913 4.099 . 0 0 "[ . 1 . 2]" 1 2385 1 84 TYR H 1 84 TYR HA 2.762 . 3.716 2.939 2.932 2.946 . 0 0 "[ . 1 . 2]" 1 2386 1 84 TYR H 1 84 TYR HB2 2.983 . 4.095 2.593 2.461 2.770 . 0 0 "[ . 1 . 2]" 1 2387 1 84 TYR H 1 85 GLY H 2.636 . 7.500 4.320 4.243 4.442 . 0 0 "[ . 1 . 2]" 1 2388 1 84 TYR H 1 85 GLY HA2 3.538 . 5.103 4.941 4.840 5.059 . 0 0 "[ . 1 . 2]" 1 2389 1 84 TYR H 1 85 GLY HA3 3.547 . 7.500 5.891 5.795 6.014 . 0 0 "[ . 1 . 2]" 1 2390 1 84 TYR H 1 88 GLY H 3.826 . 5.656 5.049 4.925 5.181 . 0 0 "[ . 1 . 2]" 1 2391 1 84 TYR HA 1 84 TYR QB 2.663 . 3.549 2.335 2.268 2.382 . 0 0 "[ . 1 . 2]" 1 2392 1 84 TYR HA 1 85 GLY H 3.086 . 4.276 2.191 2.148 2.229 . 0 0 "[ . 1 . 2]" 1 2393 1 84 TYR HA 1 88 GLY H 3.324 . 4.705 4.110 3.807 4.359 . 0 0 "[ . 1 . 2]" 1 2394 1 84 TYR HA 1 88 GLY HA2 3.138 . 7.500 5.810 5.706 5.865 . 0 0 "[ . 1 . 2]" 1 2395 1 84 TYR HA 1 88 GLY HA3 3.070 . 4.248 4.351 4.300 4.400 0.152 18 0 "[ . 1 . 2]" 1 2396 1 84 TYR QB 1 85 GLY H 3.224 . 4.523 3.311 3.045 3.433 . 0 0 "[ . 1 . 2]" 1 2397 1 84 TYR QB 1 88 GLY HA2 3.228 . 4.531 3.142 3.060 3.219 . 0 0 "[ . 1 . 2]" 1 2398 1 84 TYR QB 1 88 GLY HA3 3.223 . 7.500 1.794 1.751 1.843 0.049 7 0 "[ . 1 . 2]" 1 2399 1 84 TYR QB 1 89 LEU H 3.487 . 5.007 3.345 3.012 3.535 . 0 0 "[ . 1 . 2]" 1 2400 1 84 TYR HB3 1 88 GLY H 3.154 . 4.397 2.125 1.705 2.507 0.206 6 0 "[ . 1 . 2]" 1 2401 1 85 GLY H 1 85 GLY HA2 2.820 . 3.814 2.847 2.826 2.859 . 0 0 "[ . 1 . 2]" 1 2402 1 85 GLY H 1 85 GLY HA3 2.832 . 3.835 2.300 2.285 2.311 . 0 0 "[ . 1 . 2]" 1 2403 1 85 GLY H 1 86 SER H 3.417 . 4.876 3.983 3.785 4.162 . 0 0 "[ . 1 . 2]" 1 2404 1 85 GLY HA2 1 86 SER H 3.111 . 4.321 3.124 3.011 3.273 . 0 0 "[ . 1 . 2]" 1 2405 1 85 GLY HA2 1 87 LEU H 3.775 . 5.557 4.596 4.492 4.672 . 0 0 "[ . 1 . 2]" 1 2406 1 85 GLY HA2 1 89 LEU H 3.796 . 5.597 4.531 4.377 4.760 . 0 0 "[ . 1 . 2]" 1 2407 1 85 GLY HA3 1 86 SER H 2.832 . 3.834 2.132 2.084 2.204 . 0 0 "[ . 1 . 2]" 1 2408 1 86 SER H 1 86 SER HB2 3.125 . 4.346 2.578 2.461 2.674 . 0 0 "[ . 1 . 2]" 1 2409 1 86 SER H 1 86 SER HB3 3.221 . 4.518 3.550 3.523 3.572 . 0 0 "[ . 1 . 2]" 1 2410 1 86 SER H 1 87 LEU H 3.198 . 4.477 2.935 2.803 3.016 . 0 0 "[ . 1 . 2]" 1 2411 1 86 SER H 1 87 LEU HB2 3.821 . 5.646 5.460 5.089 5.595 . 0 0 "[ . 1 . 2]" 1 2412 1 86 SER H 1 87 LEU QD 3.666 . 7.500 5.873 5.765 5.949 . 0 0 "[ . 1 . 2]" 1 2413 1 86 SER H 1 88 GLY H 4.139 . 6.281 5.052 4.869 5.167 . 0 0 "[ . 1 . 2]" 1 2414 1 86 SER H 1 89 LEU MD1 3.675 . 5.363 4.142 3.926 4.455 . 0 0 "[ . 1 . 2]" 1 2415 1 86 SER HA 1 86 SER HB2 2.864 . 3.889 3.026 3.019 3.029 . 0 0 "[ . 1 . 2]" 1 2416 1 86 SER HA 1 86 SER HB3 2.888 . 3.930 2.456 2.413 2.500 . 0 0 "[ . 1 . 2]" 1 2417 1 86 SER HA 1 87 LEU H 3.225 . 4.525 3.572 3.530 3.597 . 0 0 "[ . 1 . 2]" 1 2418 1 86 SER HA 1 89 LEU H 3.034 . 4.184 3.589 3.398 3.687 . 0 0 "[ . 1 . 2]" 1 2419 1 86 SER HA 1 89 LEU H 3.024 . 4.167 3.852 3.595 3.969 . 0 0 "[ . 1 . 2]" 1 2420 1 86 SER HA 1 89 LEU HB2 3.070 . 4.248 2.714 2.485 2.880 . 0 0 "[ . 1 . 2]" 1 2421 1 86 SER HA 1 89 LEU HB3 2.977 . 4.085 4.214 4.051 4.404 0.319 18 0 "[ . 1 . 2]" 1 2422 1 86 SER HA 1 89 LEU HB3 3.129 . 4.353 3.827 3.711 3.928 . 0 0 "[ . 1 . 2]" 1 2423 1 86 SER HA 1 89 LEU MD1 2.573 . 3.401 3.147 2.789 3.421 0.020 6 0 "[ . 1 . 2]" 1 2424 1 86 SER HB2 1 87 LEU H 3.155 . 4.399 2.791 2.678 2.987 . 0 0 "[ . 1 . 2]" 1 2425 1 86 SER HB3 1 87 LEU H 3.214 . 4.505 3.856 3.725 4.012 . 0 0 "[ . 1 . 2]" 1 2426 1 87 LEU H 1 87 LEU HA 2.814 . 3.804 2.819 2.789 2.849 . 0 0 "[ . 1 . 2]" 1 2427 1 87 LEU H 1 87 LEU HB2 2.781 . 3.747 2.660 2.265 2.736 . 0 0 "[ . 1 . 2]" 1 2428 1 87 LEU H 1 87 LEU HB3 2.824 . 3.821 2.547 2.433 2.947 . 0 0 "[ . 1 . 2]" 1 2429 1 87 LEU H 1 87 LEU QD 2.626 . 7.500 3.771 3.724 3.816 . 0 0 "[ . 1 . 2]" 1 2430 1 87 LEU H 1 87 LEU HG 3.172 . 4.430 4.461 4.222 4.489 0.059 6 0 "[ . 1 . 2]" 1 2431 1 87 LEU H 1 88 GLY H 2.996 . 4.118 2.961 2.880 3.064 . 0 0 "[ . 1 . 2]" 1 2432 1 87 LEU H 1 89 LEU H 3.944 . 5.888 3.974 3.785 4.080 . 0 0 "[ . 1 . 2]" 1 2433 1 87 LEU H 1 90 TYR QD 3.987 . 5.974 5.491 5.206 5.798 . 0 0 "[ . 1 . 2]" 1 2434 1 87 LEU HA 1 87 LEU HB2 2.887 . 3.929 2.415 2.363 2.645 . 0 0 "[ . 1 . 2]" 1 2435 1 87 LEU HA 1 87 LEU QD 2.072 . 2.609 2.003 1.903 2.204 . 0 0 "[ . 1 . 2]" 1 2436 1 87 LEU HA 1 87 LEU HG 3.141 . 4.374 3.194 2.626 3.378 . 0 0 "[ . 1 . 2]" 1 2437 1 87 LEU HA 1 88 GLY H 3.181 . 4.446 3.577 3.559 3.595 . 0 0 "[ . 1 . 2]" 1 2438 1 87 LEU HA 1 90 TYR H 3.207 . 4.493 3.431 3.270 3.524 . 0 0 "[ . 1 . 2]" 1 2439 1 87 LEU HA 1 90 TYR H 2.542 . 3.350 2.641 2.580 2.665 . 0 0 "[ . 1 . 2]" 1 2440 1 87 LEU HA 1 91 VAL H 3.130 . 4.354 3.360 3.342 3.380 . 0 0 "[ . 1 . 2]" 1 2441 1 87 LEU HA 1 91 VAL QG 3.273 . 3.671 3.728 3.682 3.762 0.091 2 0 "[ . 1 . 2]" 1 2442 1 87 LEU HA 1 90 TYR HB2 3.100 . 4.301 3.933 3.363 4.133 . 0 0 "[ . 1 . 2]" 1 2443 1 87 LEU HA 1 90 TYR HB3 3.089 . 4.282 2.432 2.122 2.552 . 0 0 "[ . 1 . 2]" 1 2444 1 87 LEU HA 1 90 TYR QD 3.173 . 4.432 2.906 2.573 3.290 . 0 0 "[ . 1 . 2]" 1 2445 1 87 LEU HA 1 91 VAL H 3.491 . 5.015 4.306 4.200 4.406 . 0 0 "[ . 1 . 2]" 1 2446 1 87 LEU HB2 1 87 LEU QD 2.366 . 3.066 2.139 2.110 2.383 . 0 0 "[ . 1 . 2]" 1 2447 1 87 LEU HB2 1 88 GLY H 3.164 . 4.415 3.711 3.347 3.808 . 0 0 "[ . 1 . 2]" 1 2448 1 87 LEU HB2 1 89 LEU H 3.678 . 5.369 4.180 4.094 4.265 . 0 0 "[ . 1 . 2]" 1 2449 1 87 LEU HB2 1 90 TYR H 3.609 . 5.237 4.657 4.534 4.736 . 0 0 "[ . 1 . 2]" 1 2450 1 87 LEU HB3 1 87 LEU QD 2.357 . 2.988 2.307 2.105 2.340 . 0 0 "[ . 1 . 2]" 1 2451 1 87 LEU HB3 1 88 GLY H 2.993 . 4.113 2.241 2.122 2.365 . 0 0 "[ . 1 . 2]" 1 2452 1 87 LEU HB3 1 90 TYR H 3.402 . 4.849 4.576 4.489 4.694 . 0 0 "[ . 1 . 2]" 1 2453 1 87 LEU QD 1 88 GLY H 2.951 . 3.841 3.506 3.273 3.611 . 0 0 "[ . 1 . 2]" 1 2454 1 87 LEU QD 1 90 TYR HA 3.116 . 4.330 4.391 4.321 4.490 0.160 2 0 "[ . 1 . 2]" 1 2455 1 87 LEU QD 1 90 TYR HB2 3.188 . 4.458 4.422 3.736 4.540 0.082 6 0 "[ . 1 . 2]" 1 2456 1 87 LEU QD 1 90 TYR HB3 2.536 . 3.340 3.193 2.559 3.323 . 0 0 "[ . 1 . 2]" 1 2457 1 87 LEU QD 1 90 TYR QD 2.337 . 3.020 1.954 1.751 2.158 0.049 4 0 "[ . 1 . 2]" 1 2458 1 87 LEU QD 1 90 TYR QE 2.713 . 3.633 2.754 2.305 3.145 . 0 0 "[ . 1 . 2]" 1 2459 1 87 LEU QD 1 91 VAL H 2.862 . 3.886 3.843 3.514 3.948 0.062 17 0 "[ . 1 . 2]" 1 2460 1 87 LEU QD 1 91 VAL HB 3.053 . 4.218 3.936 3.628 4.157 . 0 0 "[ . 1 . 2]" 1 2461 1 87 LEU QD 1 91 VAL QG 2.253 . 2.888 2.813 2.296 2.890 0.002 2 0 "[ . 1 . 2]" 1 2462 1 87 LEU QD 1 101 ASN HD21 3.727 . 5.464 4.645 3.818 5.387 . 0 0 "[ . 1 . 2]" 1 2463 1 87 LEU QD 1 105 VAL H 3.947 . 5.895 5.228 3.404 5.950 0.055 15 0 "[ . 1 . 2]" 1 2464 1 87 LEU HG 1 88 GLY H 3.345 . 4.743 3.169 2.930 4.812 0.069 7 0 "[ . 1 . 2]" 1 2465 1 87 LEU HG 1 90 TYR QD 3.116 . 4.330 3.833 3.427 4.346 0.016 12 0 "[ . 1 . 2]" 1 2466 1 87 LEU HG 1 91 VAL QG 2.687 . 3.589 3.303 2.932 4.647 1.058 7 1 "[ . + 1 . 2]" 1 2467 1 87 LEU HG 1 101 ASN HD22 3.007 . 7.500 4.295 3.501 7.059 . 0 0 "[ . 1 . 2]" 1 2468 1 88 GLY H 1 88 GLY QA 2.640 . 3.511 2.181 2.170 2.189 . 0 0 "[ . 1 . 2]" 1 2469 1 88 GLY H 1 88 GLY HA3 2.990 . 4.108 2.283 2.273 2.293 . 0 0 "[ . 1 . 2]" 1 2470 1 88 GLY H 1 89 LEU H 2.898 . 3.948 2.705 2.633 2.838 . 0 0 "[ . 1 . 2]" 1 2471 1 88 GLY H 1 90 TYR H 3.770 . 5.547 4.288 4.215 4.355 . 0 0 "[ . 1 . 2]" 1 2472 1 88 GLY H 1 90 TYR QD 3.259 . 7.500 5.138 4.876 5.372 . 0 0 "[ . 1 . 2]" 1 2473 1 88 GLY H 1 91 VAL QG 3.053 . 4.218 4.117 4.003 4.189 . 0 0 "[ . 1 . 2]" 1 2474 1 88 GLY H 1 101 ASN HD22 3.399 . 4.844 4.837 4.402 4.958 0.114 1 0 "[ . 1 . 2]" 1 2475 1 88 GLY HA2 1 89 LEU H 3.439 . 4.918 3.495 3.466 3.521 . 0 0 "[ . 1 . 2]" 1 2476 1 88 GLY HA2 1 90 TYR QD 3.222 . 4.520 4.615 4.483 4.680 0.160 1 0 "[ . 1 . 2]" 1 2477 1 88 GLY HA2 1 91 VAL HB 3.511 . 7.500 5.136 4.957 5.296 . 0 0 "[ . 1 . 2]" 1 2478 1 88 GLY HA2 1 91 VAL QG 3.271 . 4.036 2.411 2.298 2.517 . 0 0 "[ . 1 . 2]" 1 2479 1 88 GLY HA3 1 89 LEU H 3.108 . 4.315 2.854 2.820 2.910 . 0 0 "[ . 1 . 2]" 1 2480 1 88 GLY HA3 1 89 LEU HB2 3.345 . 7.500 5.161 5.056 5.243 . 0 0 "[ . 1 . 2]" 1 2481 1 88 GLY HA3 1 91 VAL H 3.457 . 4.951 4.467 4.409 4.535 . 0 0 "[ . 1 . 2]" 1 2482 1 88 GLY HA3 1 91 VAL QG 2.644 . 3.518 2.907 2.868 2.954 . 0 0 "[ . 1 . 2]" 1 2483 1 88 GLY HA3 1 101 ASN HD22 3.326 . 4.709 3.594 2.712 4.182 . 0 0 "[ . 1 . 2]" 1 2484 1 89 LEU H 1 89 LEU HA 2.927 . 3.998 2.860 2.842 2.874 . 0 0 "[ . 1 . 2]" 1 2485 1 89 LEU H 1 89 LEU HB2 2.721 . 3.646 2.373 2.280 2.434 . 0 0 "[ . 1 . 2]" 1 2486 1 89 LEU H 1 89 LEU HB3 2.816 . 3.808 3.565 3.533 3.589 . 0 0 "[ . 1 . 2]" 1 2487 1 89 LEU H 1 89 LEU MD1 2.638 . 7.500 3.626 3.548 3.689 . 0 0 "[ . 1 . 2]" 1 2488 1 89 LEU H 1 89 LEU MD2 2.241 . 7.500 3.219 3.137 3.314 . 0 0 "[ . 1 . 2]" 1 2489 1 89 LEU H 1 90 TYR HA 2.850 . 7.500 4.128 3.999 4.216 . 0 0 "[ . 1 . 2]" 1 2490 1 89 LEU H 1 90 TYR HB3 3.855 . 5.712 4.291 4.199 4.357 . 0 0 "[ . 1 . 2]" 1 2491 1 89 LEU H 1 90 TYR QD 3.942 . 5.884 5.184 4.833 5.433 . 0 0 "[ . 1 . 2]" 1 2492 1 89 LEU H 1 91 VAL H 3.757 . 5.522 4.125 4.049 4.202 . 0 0 "[ . 1 . 2]" 1 2493 1 89 LEU H 1 91 VAL H 3.381 . 4.810 3.621 3.557 3.687 . 0 0 "[ . 1 . 2]" 1 2494 1 89 LEU H 1 91 VAL QG 3.597 . 5.214 4.088 3.994 4.161 . 0 0 "[ . 1 . 2]" 1 2495 1 89 LEU H 1 92 ALA H 4.049 . 6.098 4.406 4.340 4.461 . 0 0 "[ . 1 . 2]" 1 2496 1 89 LEU HA 1 89 LEU HB2 2.649 . 3.526 2.997 2.984 3.003 . 0 0 "[ . 1 . 2]" 1 2497 1 89 LEU HA 1 89 LEU HB3 2.572 . 3.399 2.502 2.462 2.567 . 0 0 "[ . 1 . 2]" 1 2498 1 89 LEU HA 1 89 LEU MD1 2.699 . 7.500 3.818 3.789 3.850 . 0 0 "[ . 1 . 2]" 1 2499 1 89 LEU HA 1 89 LEU MD2 1.908 . 2.363 1.923 1.839 2.055 . 0 0 "[ . 1 . 2]" 1 2500 1 89 LEU HA 1 90 TYR H 3.124 . 4.344 3.560 3.540 3.585 . 0 0 "[ . 1 . 2]" 1 2501 1 89 LEU HA 1 92 ALA H 3.051 . 4.214 3.027 2.807 3.184 . 0 0 "[ . 1 . 2]" 1 2502 1 89 LEU HA 1 92 ALA MB 2.380 . 3.088 2.323 2.050 2.496 . 0 0 "[ . 1 . 2]" 1 2503 1 89 LEU HA 1 93 GLU H 2.716 . 3.638 2.783 2.568 2.933 . 0 0 "[ . 1 . 2]" 1 2504 1 89 LEU HA 1 93 GLU HB3 2.776 . 3.739 3.046 2.874 3.309 . 0 0 "[ . 1 . 2]" 1 2505 1 89 LEU HB2 1 89 LEU MD1 2.381 . 3.089 2.332 2.276 2.378 . 0 0 "[ . 1 . 2]" 1 2506 1 89 LEU HB2 1 90 TYR H 2.786 . 3.756 2.632 2.525 2.724 . 0 0 "[ . 1 . 2]" 1 2507 1 89 LEU HB2 1 90 TYR HA 3.193 . 4.467 4.383 4.303 4.532 0.065 13 0 "[ . 1 . 2]" 1 2508 1 89 LEU HB2 1 90 TYR HA 2.589 . 3.427 3.569 3.412 4.059 0.632 6 3 "[ -.+ 1 * . 2]" 1 2509 1 89 LEU HB2 1 93 GLU HB3 3.025 . 4.169 4.290 4.134 4.349 0.180 14 0 "[ . 1 . 2]" 1 2510 1 89 LEU HB3 1 89 LEU MD1 2.380 . 3.088 2.370 2.310 2.448 . 0 0 "[ . 1 . 2]" 1 2511 1 89 LEU HB3 1 89 LEU QD 2.405 . 3.128 2.084 2.040 2.114 . 0 0 "[ . 1 . 2]" 1 2512 1 89 LEU HB3 1 90 TYR H 2.971 . 4.074 3.552 3.414 3.661 . 0 0 "[ . 1 . 2]" 1 2513 1 89 LEU HB3 1 93 GLU HB3 2.940 . 4.021 2.728 2.588 2.815 . 0 0 "[ . 1 . 2]" 1 2514 1 89 LEU QD 1 93 GLU HG2 3.085 . 4.275 4.241 3.930 4.576 0.301 4 0 "[ . 1 . 2]" 1 2515 1 89 LEU MD2 1 92 ALA H 2.780 . 7.500 4.179 4.097 4.265 . 0 0 "[ . 1 . 2]" 1 2516 1 89 LEU MD2 1 92 ALA MB 2.163 . 2.748 2.782 2.570 2.849 0.101 20 0 "[ . 1 . 2]" 1 2517 1 89 LEU MD2 1 93 GLU H 3.067 . 4.242 3.800 3.363 3.994 . 0 0 "[ . 1 . 2]" 1 2518 1 90 TYR H 1 90 TYR HA 2.601 . 3.447 2.747 2.702 2.770 . 0 0 "[ . 1 . 2]" 1 2519 1 90 TYR H 1 90 TYR HB2 2.615 . 3.470 3.086 2.946 3.261 . 0 0 "[ . 1 . 2]" 1 2520 1 90 TYR H 1 90 TYR HB3 2.582 . 3.415 2.082 2.046 2.155 . 0 0 "[ . 1 . 2]" 1 2521 1 90 TYR H 1 90 TYR QD 2.866 . 3.893 3.658 3.420 3.890 . 0 0 "[ . 1 . 2]" 1 2522 1 90 TYR H 1 91 VAL H 2.819 . 3.812 2.827 2.761 2.932 . 0 0 "[ . 1 . 2]" 1 2523 1 90 TYR H 1 91 VAL QG 2.910 . 3.968 3.744 3.621 3.829 . 0 0 "[ . 1 . 2]" 1 2524 1 90 TYR H 1 92 ALA H 3.559 . 5.142 4.134 3.931 4.315 . 0 0 "[ . 1 . 2]" 1 2525 1 90 TYR HA 1 90 TYR HB2 2.490 . 3.265 2.255 2.239 2.280 . 0 0 "[ . 1 . 2]" 1 2526 1 90 TYR HA 1 90 TYR HB3 2.521 . 3.316 2.902 2.843 2.944 . 0 0 "[ . 1 . 2]" 1 2527 1 90 TYR HA 1 91 VAL H 2.901 . 3.953 3.507 3.487 3.526 . 0 0 "[ . 1 . 2]" 1 2528 1 90 TYR HA 1 91 VAL HA 3.385 . 4.818 4.579 4.554 4.593 . 0 0 "[ . 1 . 2]" 1 2529 1 90 TYR HA 1 91 VAL QG 3.139 . 7.500 4.633 4.575 4.663 . 0 0 "[ . 1 . 2]" 1 2530 1 90 TYR HA 1 93 GLU HG2 3.235 . 4.543 3.593 3.039 3.864 . 0 0 "[ . 1 . 2]" 1 2531 1 90 TYR HA 1 93 GLU HG3 2.889 . 3.933 3.803 3.560 4.612 0.679 6 3 "[ *.+ 1 - . 2]" 1 2532 1 90 TYR HA 1 94 GLN HG2 3.271 . 4.609 3.684 3.300 4.034 . 0 0 "[ . 1 . 2]" 1 2533 1 90 TYR HB2 1 90 TYR QD 2.717 . 3.640 2.388 2.360 2.423 . 0 0 "[ . 1 . 2]" 1 2534 1 90 TYR HB2 1 90 TYR QE 3.455 . 4.947 4.409 4.392 4.425 . 0 0 "[ . 1 . 2]" 1 2535 1 90 TYR HB2 1 91 VAL H 3.108 . 4.315 4.126 4.011 4.196 . 0 0 "[ . 1 . 2]" 1 2536 1 90 TYR HB2 1 91 VAL QG 2.914 . 7.500 4.850 4.639 4.966 . 0 0 "[ . 1 . 2]" 1 2537 1 90 TYR HB3 1 90 TYR QD 2.777 . 3.741 2.405 2.376 2.433 . 0 0 "[ . 1 . 2]" 1 2538 1 90 TYR HB3 1 90 TYR QE 3.434 . 4.908 4.419 4.403 4.430 . 0 0 "[ . 1 . 2]" 1 2539 1 90 TYR HB3 1 91 VAL H 3.291 . 4.645 3.060 2.819 3.283 . 0 0 "[ . 1 . 2]" 1 2540 1 90 TYR HB3 1 92 ALA MB 3.007 . 7.500 4.847 4.818 4.879 . 0 0 "[ . 1 . 2]" 1 2541 1 90 TYR HB3 1 93 GLU H 3.512 . 5.054 4.460 4.337 4.612 . 0 0 "[ . 1 . 2]" 1 2542 1 90 TYR HB3 1 91 VAL QG 3.332 . 4.720 3.713 3.356 3.931 . 0 0 "[ . 1 . 2]" 1 2543 1 90 TYR QD 1 91 VAL H 3.019 . 4.158 2.544 2.447 2.584 . 0 0 "[ . 1 . 2]" 1 2544 1 90 TYR QD 1 91 VAL HA 2.458 . 7.500 3.902 3.697 4.049 . 0 0 "[ . 1 . 2]" 1 2545 1 90 TYR QD 1 91 VAL HB 2.920 . 3.986 3.032 2.671 3.295 . 0 0 "[ . 1 . 2]" 1 2546 1 90 TYR QD 1 91 VAL QG 2.231 . 2.853 2.288 2.054 2.410 . 0 0 "[ . 1 . 2]" 1 2547 1 90 TYR QD 1 92 ALA H 3.359 . 4.770 4.782 4.654 4.812 0.042 3 0 "[ . 1 . 2]" 1 2548 1 90 TYR QE 1 91 VAL H 3.991 . 5.982 4.316 4.159 4.451 . 0 0 "[ . 1 . 2]" 1 2549 1 90 TYR QE 1 91 VAL HA 3.327 . 4.711 4.227 4.077 4.364 . 0 0 "[ . 1 . 2]" 1 2550 1 90 TYR QE 1 91 VAL QG 2.735 . 3.670 3.236 3.006 3.378 . 0 0 "[ . 1 . 2]" 1 2551 1 91 VAL H 1 91 VAL HA 2.693 . 3.599 2.902 2.898 2.906 . 0 0 "[ . 1 . 2]" 1 2552 1 91 VAL H 1 91 VAL HB 2.711 . 3.630 3.005 2.980 3.060 . 0 0 "[ . 1 . 2]" 1 2553 1 91 VAL H 1 91 VAL QG 2.228 . 2.848 1.766 1.716 1.801 0.084 16 0 "[ . 1 . 2]" 1 2554 1 91 VAL H 1 92 ALA H 2.811 . 3.799 2.394 2.361 2.477 . 0 0 "[ . 1 . 2]" 1 2555 1 91 VAL H 1 92 ALA MB 3.014 . 4.149 4.161 4.118 4.199 0.050 17 0 "[ . 1 . 2]" 1 2556 1 91 VAL H 1 93 GLU H 3.785 . 5.576 4.010 3.925 4.081 . 0 0 "[ . 1 . 2]" 1 2557 1 91 VAL HA 1 91 VAL HB 2.691 . 3.596 2.327 2.311 2.339 . 0 0 "[ . 1 . 2]" 1 2558 1 91 VAL HA 1 91 VAL QG 2.237 . 2.862 2.455 2.434 2.486 . 0 0 "[ . 1 . 2]" 1 2559 1 91 VAL HA 1 92 ALA H 3.024 . 4.167 3.554 3.522 3.607 . 0 0 "[ . 1 . 2]" 1 2560 1 91 VAL HA 1 92 ALA HA 3.060 . 7.500 4.709 4.661 4.756 . 0 0 "[ . 1 . 2]" 1 2561 1 91 VAL HA 1 92 ALA MB 3.106 . 7.500 4.454 4.379 4.524 . 0 0 "[ . 1 . 2]" 1 2562 1 91 VAL HA 1 94 GLN H 3.007 . 4.137 3.919 3.791 4.068 . 0 0 "[ . 1 . 2]" 1 2563 1 91 VAL HA 1 94 GLN HB2 2.739 . 3.677 3.188 3.081 3.341 . 0 0 "[ . 1 . 2]" 1 2564 1 91 VAL HA 1 94 GLN QE 3.600 . 7.500 6.704 6.600 6.797 . 0 0 "[ . 1 . 2]" 1 2565 1 91 VAL HA 1 94 GLN HG2 3.236 . 7.500 4.964 4.815 5.125 . 0 0 "[ . 1 . 2]" 1 2566 1 91 VAL HA 1 94 GLN HG3 3.220 . 4.516 4.622 4.568 4.703 0.187 1 0 "[ . 1 . 2]" 1 2567 1 91 VAL HA 1 95 PHE H 3.339 . 4.733 3.938 3.677 4.466 . 0 0 "[ . 1 . 2]" 1 2568 1 91 VAL HA 1 95 PHE H 3.018 . 4.157 3.427 3.323 3.619 . 0 0 "[ . 1 . 2]" 1 2569 1 91 VAL HB 1 91 VAL QG 2.175 . 2.767 1.891 1.888 1.893 . 0 0 "[ . 1 . 2]" 1 2570 1 91 VAL HB 1 92 ALA H 2.663 . 7.500 3.838 3.703 4.050 . 0 0 "[ . 1 . 2]" 1 2571 1 91 VAL HB 1 95 PHE H 3.828 . 5.660 4.589 4.398 5.319 . 0 0 "[ . 1 . 2]" 1 2572 1 91 VAL QG 1 92 ALA H 2.642 . 3.515 2.186 1.987 2.340 . 0 0 "[ . 1 . 2]" 1 2573 1 91 VAL QG 1 92 ALA HA 2.208 . 4.724 3.043 2.988 3.088 . 0 0 "[ . 1 . 2]" 1 2574 1 91 VAL QG 1 92 ALA MB 2.719 . 3.643 2.910 2.846 2.973 . 0 0 "[ . 1 . 2]" 1 2575 1 91 VAL QG 1 93 GLU H 3.085 . 5.330 4.142 4.078 4.216 . 0 0 "[ . 1 . 2]" 1 2576 1 91 VAL QG 1 94 GLN H 3.466 . 4.967 4.539 4.467 4.595 . 0 0 "[ . 1 . 2]" 1 2577 1 91 VAL QG 1 95 PHE H 3.199 . 4.478 4.020 3.889 4.307 . 0 0 "[ . 1 . 2]" 1 2578 1 91 VAL QG 1 95 PHE HA 3.260 . 7.500 5.468 5.288 5.683 . 0 0 "[ . 1 . 2]" 1 2579 1 91 VAL QG 1 95 PHE HB2 2.335 . 7.500 3.108 2.882 3.362 . 0 0 "[ . 1 . 2]" 1 2580 1 91 VAL QG 1 95 PHE HB3 3.244 . 4.559 4.338 4.109 4.570 0.011 2 0 "[ . 1 . 2]" 1 2581 1 91 VAL QG 1 96 GLY H 3.855 . 5.713 3.633 3.323 4.136 . 0 0 "[ . 1 . 2]" 1 2582 1 91 VAL QG 1 97 GLU QB 3.037 . 7.500 4.226 3.407 4.675 . 0 0 "[ . 1 . 2]" 1 2583 1 91 VAL QG 1 100 VAL H 3.808 . 5.621 3.996 3.711 4.209 . 0 0 "[ . 1 . 2]" 1 2584 1 91 VAL QG 1 100 VAL H 3.134 . 4.361 3.737 3.266 3.987 . 0 0 "[ . 1 . 2]" 1 2585 1 91 VAL QG 1 100 VAL MG1 2.212 . 7.500 3.322 2.895 3.659 . 0 0 "[ . 1 . 2]" 1 2586 1 91 VAL QG 1 101 ASN H 2.545 . 3.354 3.005 2.571 3.303 . 0 0 "[ . 1 . 2]" 1 2587 1 91 VAL QG 1 101 ASN HA 3.456 . 4.949 2.614 2.095 3.191 . 0 0 "[ . 1 . 2]" 1 2588 1 91 VAL QG 1 101 ASN QB 3.121 . 4.338 2.621 2.040 3.571 . 0 0 "[ . 1 . 2]" 1 2589 1 91 VAL QG 1 101 ASN HD22 2.676 . 3.571 2.732 1.743 3.087 0.188 10 0 "[ . 1 . 2]" 1 2590 1 91 VAL QG 1 102 THR HA 3.049 . 7.500 5.677 5.177 6.126 . 0 0 "[ . 1 . 2]" 1 2591 1 91 VAL QG 1 103 TYR H 2.942 . 7.500 4.927 4.281 5.437 . 0 0 "[ . 1 . 2]" 1 2592 1 91 VAL QG 1 103 TYR HB2 2.858 . 7.500 6.338 5.684 6.936 . 0 0 "[ . 1 . 2]" 1 2593 1 91 VAL QG 1 103 TYR HB3 2.825 . 7.500 5.343 4.693 6.251 . 0 0 "[ . 1 . 2]" 1 2594 1 91 VAL QG 1 104 PHE QB 2.815 . 7.500 3.458 2.429 4.193 . 0 0 "[ . 1 . 2]" 1 2595 1 92 ALA H 1 92 ALA HA 2.628 . 3.491 2.873 2.820 2.896 . 0 0 "[ . 1 . 2]" 1 2596 1 92 ALA H 1 92 ALA MB 2.098 . 2.648 2.282 2.229 2.314 . 0 0 "[ . 1 . 2]" 1 2597 1 92 ALA H 1 93 GLU H 2.662 . 3.548 2.537 2.434 2.715 . 0 0 "[ . 1 . 2]" 1 2598 1 92 ALA H 1 93 GLU HA 3.371 . 7.500 5.147 5.085 5.270 . 0 0 "[ . 1 . 2]" 1 2599 1 92 ALA H 1 93 GLU HA 3.359 . 4.770 4.329 4.061 4.498 . 0 0 "[ . 1 . 2]" 1 2600 1 92 ALA H 1 97 GLU QG 3.850 . 5.703 5.406 4.886 5.962 0.259 10 0 "[ . 1 . 2]" 1 2601 1 92 ALA H 1 101 ASN HD21 3.793 . 5.591 3.980 3.315 4.554 . 0 0 "[ . 1 . 2]" 1 2602 1 92 ALA H 1 101 ASN HD22 4.297 . 6.605 4.719 3.084 5.087 . 0 0 "[ . 1 . 2]" 1 2603 1 92 ALA HA 1 101 ASN HB2 3.091 . 4.286 3.799 3.197 4.344 0.058 3 0 "[ . 1 . 2]" 1 2604 1 92 ALA HA 1 92 ALA MB 1.975 . 2.462 2.117 2.112 2.120 . 0 0 "[ . 1 . 2]" 1 2605 1 92 ALA HA 1 93 GLU H 2.916 . 3.979 3.527 3.502 3.563 . 0 0 "[ . 1 . 2]" 1 2606 1 92 ALA HA 1 95 PHE H 3.121 . 4.338 3.152 3.063 3.208 . 0 0 "[ . 1 . 2]" 1 2607 1 92 ALA HA 1 95 PHE H 3.430 . 4.900 3.541 3.409 3.695 . 0 0 "[ . 1 . 2]" 1 2608 1 92 ALA HA 1 96 GLY H 2.372 . 3.075 2.197 2.092 2.292 . 0 0 "[ . 1 . 2]" 1 2609 1 92 ALA HA 1 97 GLU HA 2.739 . 3.677 3.003 2.694 3.266 . 0 0 "[ . 1 . 2]" 1 2610 1 92 ALA HA 1 97 GLU HB2 2.908 . 3.965 3.663 3.234 4.878 0.913 9 3 "[ .- +1* . 2]" 1 2611 1 92 ALA HA 1 97 GLU QG 2.802 . 7.500 4.572 3.360 5.089 . 0 0 "[ . 1 . 2]" 1 2612 1 92 ALA HA 1 100 VAL MG2 2.910 . 3.969 3.349 2.667 3.879 . 0 0 "[ . 1 . 2]" 1 2613 1 92 ALA MB 1 93 GLU H 2.283 . 2.934 2.671 2.505 2.760 . 0 0 "[ . 1 . 2]" 1 2614 1 92 ALA MB 1 95 PHE H 3.506 . 5.043 4.110 4.022 4.161 . 0 0 "[ . 1 . 2]" 1 2615 1 92 ALA MB 1 96 GLY H 3.087 . 4.278 3.787 3.666 3.896 . 0 0 "[ . 1 . 2]" 1 2616 1 92 ALA MB 1 96 GLY QA 3.284 . 4.632 3.321 3.041 3.461 . 0 0 "[ . 1 . 2]" 1 2617 1 92 ALA MB 1 97 GLU H 3.981 . 5.962 2.319 2.122 2.634 . 0 0 "[ . 1 . 2]" 1 2618 1 92 ALA MB 1 97 GLU HA 2.521 . 3.316 2.652 2.309 3.130 . 0 0 "[ . 1 . 2]" 1 2619 1 92 ALA MB 1 97 GLU HB2 2.348 . 3.037 1.941 1.578 3.315 0.278 11 0 "[ . 1 . 2]" 1 2620 1 92 ALA MB 1 97 GLU QG 2.380 . 3.088 2.848 1.756 3.229 0.141 10 0 "[ . 1 . 2]" 1 2621 1 92 ALA MB 1 100 VAL H 4.047 . 6.094 5.791 5.315 6.151 0.057 11 0 "[ . 1 . 2]" 1 2622 1 93 GLU H 1 93 GLU HA 2.339 . 3.023 2.862 2.844 2.874 . 0 0 "[ . 1 . 2]" 1 2623 1 93 GLU H 1 93 GLU HB2 2.216 . 2.830 2.918 2.796 3.349 0.519 4 1 "[ +. 1 . 2]" 1 2624 1 93 GLU H 1 93 GLU HB3 2.399 . 3.119 2.238 2.173 2.344 . 0 0 "[ . 1 . 2]" 1 2625 1 93 GLU H 1 93 GLU HG2 2.351 . 7.500 3.565 2.570 3.823 . 0 0 "[ . 1 . 2]" 1 2626 1 93 GLU H 1 93 GLU HG3 2.416 . 3.146 3.147 2.928 4.122 0.976 4 2 "[ +. 1 - . 2]" 1 2627 1 93 GLU H 1 96 GLY H 3.174 . 4.433 3.617 3.477 3.688 . 0 0 "[ . 1 . 2]" 1 2628 1 93 GLU H 1 95 PHE H 3.400 . 4.845 4.001 3.917 4.099 . 0 0 "[ . 1 . 2]" 1 2629 1 93 GLU HA 1 93 GLU HB2 2.105 . 2.659 2.274 2.252 2.316 . 0 0 "[ . 1 . 2]" 1 2630 1 93 GLU HA 1 93 GLU HB3 2.296 . 2.955 2.697 2.631 2.738 . 0 0 "[ . 1 . 2]" 1 2631 1 93 GLU HA 1 93 GLU HG2 2.288 . 7.500 4.169 3.560 4.254 . 0 0 "[ . 1 . 2]" 1 2632 1 93 GLU HA 1 93 GLU HG3 2.259 . 7.500 3.644 3.516 3.783 . 0 0 "[ . 1 . 2]" 1 2633 1 93 GLU HA 1 94 GLN H 2.693 . 3.600 3.450 3.379 3.493 . 0 0 "[ . 1 . 2]" 1 2634 1 93 GLU HA 1 95 PHE H 3.292 . 4.646 4.599 4.281 4.713 0.067 4 0 "[ . 1 . 2]" 1 2635 1 93 GLU HB3 1 93 GLU HG3 2.115 . 2.674 2.691 2.618 2.988 0.314 13 0 "[ . 1 . 2]" 1 2636 1 93 GLU HB3 1 94 GLN H 2.669 . 7.500 3.663 3.568 3.845 . 0 0 "[ . 1 . 2]" 1 2637 1 93 GLU HB3 1 94 GLN HE21 3.132 . 7.500 5.533 5.247 5.956 . 0 0 "[ . 1 . 2]" 1 2638 1 93 GLU HB3 1 95 PHE H 3.985 . 5.970 5.488 5.297 5.732 . 0 0 "[ . 1 . 2]" 1 2639 1 93 GLU HG2 1 94 GLN H 2.993 . 4.113 3.740 2.462 4.117 0.004 12 0 "[ . 1 . 2]" 1 2640 1 93 GLU HG2 1 94 GLN HA 3.177 . 7.500 4.826 3.492 5.170 . 0 0 "[ . 1 . 2]" 1 2641 1 93 GLU HG2 1 94 GLN HE21 3.238 . 4.548 3.578 2.950 4.117 . 0 0 "[ . 1 . 2]" 1 2642 1 93 GLU HG3 1 94 GLN H 2.559 . 3.378 2.475 2.156 3.980 0.602 4 1 "[ +. 1 . 2]" 1 2643 1 93 GLU HG3 1 94 GLN HA 2.966 . 4.065 3.393 3.151 4.129 0.064 4 0 "[ . 1 . 2]" 1 2644 1 93 GLU HG3 1 94 GLN HE21 2.937 . 4.015 3.108 2.708 3.501 . 0 0 "[ . 1 . 2]" 1 2645 1 94 GLN H 1 94 GLN HA 2.398 . 3.117 2.889 2.870 2.922 . 0 0 "[ . 1 . 2]" 1 2646 1 94 GLN H 1 94 GLN HB2 2.439 . 3.182 2.327 2.228 2.407 . 0 0 "[ . 1 . 2]" 1 2647 1 94 GLN H 1 94 GLN QE 3.458 . 4.953 4.540 4.447 4.701 . 0 0 "[ . 1 . 2]" 1 2648 1 94 GLN H 1 94 GLN HG2 2.630 . 3.495 2.670 2.544 2.824 . 0 0 "[ . 1 . 2]" 1 2649 1 94 GLN H 1 94 GLN HG3 2.677 . 7.500 3.770 3.647 3.925 . 0 0 "[ . 1 . 2]" 1 2650 1 94 GLN H 1 95 PHE H 2.620 . 3.478 2.399 2.222 2.488 . 0 0 "[ . 1 . 2]" 1 2651 1 94 GLN H 1 95 PHE H 2.687 . 3.589 1.938 1.861 2.004 . 0 0 "[ . 1 . 2]" 1 2652 1 94 GLN H 1 95 PHE HB2 4.003 . 6.006 4.805 4.610 4.954 . 0 0 "[ . 1 . 2]" 1 2653 1 94 GLN HA 1 94 GLN QB 2.318 . 2.990 2.414 2.382 2.452 . 0 0 "[ . 1 . 2]" 1 2654 1 94 GLN HA 1 94 GLN HE21 3.933 . 5.866 3.877 3.689 4.001 . 0 0 "[ . 1 . 2]" 1 2655 1 94 GLN HA 1 94 GLN QE 2.979 . 4.088 3.537 3.394 3.633 . 0 0 "[ . 1 . 2]" 1 2656 1 94 GLN HA 1 94 GLN HG2 2.573 . 3.401 2.799 2.711 2.926 . 0 0 "[ . 1 . 2]" 1 2657 1 94 GLN HA 1 94 GLN HG3 2.658 . 7.500 3.711 3.666 3.756 . 0 0 "[ . 1 . 2]" 1 2658 1 94 GLN HA 1 95 PHE H 2.825 . 3.823 3.539 3.465 3.559 . 0 0 "[ . 1 . 2]" 1 2659 1 94 GLN QB 1 94 GLN HE21 3.387 . 4.821 4.005 3.970 4.032 . 0 0 "[ . 1 . 2]" 1 2660 1 94 GLN QB 1 94 GLN HG2 2.514 . 3.304 2.394 2.361 2.419 . 0 0 "[ . 1 . 2]" 1 2661 1 94 GLN QB 1 94 GLN HG3 2.555 . 3.371 2.151 2.143 2.156 . 0 0 "[ . 1 . 2]" 1 2662 1 94 GLN HB2 1 95 PHE H 3.101 . 4.303 2.834 2.698 3.144 . 0 0 "[ . 1 . 2]" 1 2663 1 94 GLN HB2 1 96 GLY H 3.329 . 4.715 4.266 4.068 4.419 . 0 0 "[ . 1 . 2]" 1 2664 1 94 GLN HE21 1 94 GLN HG2 2.654 . 3.535 2.247 2.202 2.281 . 0 0 "[ . 1 . 2]" 1 2665 1 94 GLN HE21 1 94 GLN HG3 2.551 . 3.364 2.961 2.931 2.986 . 0 0 "[ . 1 . 2]" 1 2666 1 94 GLN HG2 1 95 PHE H 3.373 . 4.795 4.555 4.400 4.672 . 0 0 "[ . 1 . 2]" 1 2667 1 94 GLN HG3 1 95 PHE H 3.380 . 7.500 5.078 4.959 5.357 . 0 0 "[ . 1 . 2]" 1 2668 1 95 PHE H 1 95 PHE HB2 3.035 . 4.187 2.633 2.487 2.704 . 0 0 "[ . 1 . 2]" 1 2669 1 95 PHE H 1 95 PHE HB3 2.917 . 3.981 3.780 3.695 3.825 . 0 0 "[ . 1 . 2]" 1 2670 1 95 PHE H 1 96 GLY H 2.470 . 3.232 2.050 1.933 2.116 . 0 0 "[ . 1 . 2]" 1 2671 1 95 PHE H 1 99 ASN QD 3.067 . 7.500 5.043 4.742 5.396 . 0 0 "[ . 1 . 2]" 1 2672 1 95 PHE HA 1 95 PHE HB3 2.677 . 3.573 2.493 2.435 2.537 . 0 0 "[ . 1 . 2]" 1 2673 1 95 PHE HA 1 96 GLY H 2.939 . 4.019 3.556 3.497 3.576 . 0 0 "[ . 1 . 2]" 1 2674 1 95 PHE HB2 1 96 GLY H 3.065 . 4.239 2.669 2.576 3.071 . 0 0 "[ . 1 . 2]" 1 2675 1 95 PHE HB2 1 100 VAL MG2 2.627 . 3.490 1.750 1.679 2.043 0.085 1 0 "[ . 1 . 2]" 1 2676 1 95 PHE HB2 1 101 ASN H 4.032 . 6.064 4.356 4.212 4.612 . 0 0 "[ . 1 . 2]" 1 2677 1 95 PHE HB3 1 96 GLY H 3.081 . 4.268 3.636 3.557 3.950 . 0 0 "[ . 1 . 2]" 1 2678 1 95 PHE HB3 1 99 ASN HB2 3.093 . 7.500 5.755 5.320 6.165 . 0 0 "[ . 1 . 2]" 1 2679 1 95 PHE HB3 1 99 ASN HB3 3.224 . 7.500 6.179 5.328 6.756 . 0 0 "[ . 1 . 2]" 1 2680 1 95 PHE HB3 1 99 ASN QD 2.495 . 3.273 3.000 1.916 3.293 0.045 2 0 "[ . 1 . 2]" 1 2681 1 95 PHE HB3 1 100 VAL MG1 3.310 . 4.680 2.770 2.270 3.278 . 0 0 "[ . 1 . 2]" 1 2682 1 95 PHE HB3 1 100 VAL MG2 2.864 . 3.889 2.487 2.265 2.775 . 0 0 "[ . 1 . 2]" 1 2683 1 96 GLY H 1 96 GLY QA 2.535 . 3.339 2.390 2.353 2.423 . 0 0 "[ . 1 . 2]" 1 2684 1 96 GLY H 1 97 GLU H 2.971 . 4.074 3.711 3.464 3.965 . 0 0 "[ . 1 . 2]" 1 2685 1 96 GLY H 1 97 GLU QB 3.434 . 4.908 5.002 4.918 5.093 0.185 9 0 "[ . 1 . 2]" 1 2686 1 96 GLY H 1 97 GLU QG 4.014 . 6.028 5.061 4.501 5.314 . 0 0 "[ . 1 . 2]" 1 2687 1 96 GLY H 1 99 ASN QD 3.225 . 4.525 3.761 3.574 4.073 . 0 0 "[ . 1 . 2]" 1 2688 1 96 GLY QA 1 97 GLU H 2.771 . 3.363 2.072 2.036 2.108 . 0 0 "[ . 1 . 2]" 1 2689 1 96 GLY QA 1 99 ASN H 3.392 . 4.830 3.309 3.194 3.513 . 0 0 "[ . 1 . 2]" 1 2690 1 96 GLY QA 1 100 VAL H 3.570 . 5.163 3.727 3.553 3.830 . 0 0 "[ . 1 . 2]" 1 2691 1 96 GLY QA 1 97 GLU HA 3.398 . 4.842 3.703 3.517 3.891 . 0 0 "[ . 1 . 2]" 1 2692 1 96 GLY QA 1 97 GLU QB 3.271 . 4.150 3.863 3.734 4.225 0.075 9 0 "[ . 1 . 2]" 1 2693 1 96 GLY QA 1 98 GLU HG2 3.484 . 5.001 3.014 2.693 3.323 . 0 0 "[ . 1 . 2]" 1 2694 1 96 GLY QA 1 98 GLU HG3 3.228 . 4.530 3.946 3.599 4.201 . 0 0 "[ . 1 . 2]" 1 2695 1 96 GLY QA 1 99 ASN H 3.443 . 4.925 3.486 3.287 3.710 . 0 0 "[ . 1 . 2]" 1 2696 1 96 GLY QA 1 99 ASN H 3.236 . 4.380 2.227 1.921 2.660 0.006 18 0 "[ . 1 . 2]" 1 2697 1 96 GLY QA 1 99 ASN QD 3.357 . 4.765 2.258 1.932 2.755 0.056 18 0 "[ . 1 . 2]" 1 2698 1 96 GLY QA 1 100 VAL MG2 2.496 . 3.275 3.176 3.072 3.277 0.002 6 0 "[ . 1 . 2]" 1 2699 1 97 GLU H 1 97 GLU HA 2.738 . 3.675 2.802 2.731 2.855 . 0 0 "[ . 1 . 2]" 1 2700 1 97 GLU H 1 97 GLU HB2 2.501 . 3.283 2.582 2.255 3.573 0.290 6 0 "[ . 1 . 2]" 1 2701 1 97 GLU H 1 97 GLU QG 2.476 . 7.500 3.637 1.664 4.033 0.136 11 0 "[ . 1 . 2]" 1 2702 1 97 GLU H 1 98 GLU H 3.558 . 5.140 2.592 2.351 2.848 . 0 0 "[ . 1 . 2]" 1 2703 1 97 GLU H 1 99 ASN H 4.082 . 6.164 4.362 4.168 4.638 . 0 0 "[ . 1 . 2]" 1 2704 1 97 GLU HA 1 97 GLU QB 2.244 . 2.873 2.329 2.103 2.419 . 0 0 "[ . 1 . 2]" 1 2705 1 97 GLU HA 1 97 GLU QG 2.352 . 3.043 2.707 2.358 3.339 0.296 6 0 "[ . 1 . 2]" 1 2706 1 97 GLU HA 1 98 GLU H 3.085 . 4.275 3.445 3.282 3.505 . 0 0 "[ . 1 . 2]" 1 2707 1 97 GLU HA 1 98 GLU HA 3.324 . 4.705 4.778 4.670 4.855 0.150 19 0 "[ . 1 . 2]" 1 2708 1 97 GLU HA 1 99 ASN H 3.200 . 4.480 3.982 3.739 4.179 . 0 0 "[ . 1 . 2]" 1 2709 1 97 GLU HA 1 100 VAL H 3.349 . 4.751 4.210 3.840 4.521 . 0 0 "[ . 1 . 2]" 1 2710 1 97 GLU HA 1 100 VAL MG2 2.625 . 3.486 3.381 2.861 3.637 0.151 16 0 "[ . 1 . 2]" 1 2711 1 97 GLU HA 1 101 ASN H 3.381 . 4.810 2.835 2.501 3.231 . 0 0 "[ . 1 . 2]" 1 2712 1 97 GLU HB3 1 98 GLU H 3.225 . 4.525 2.778 2.539 3.410 . 0 0 "[ . 1 . 2]" 1 2713 1 97 GLU HB3 1 102 THR H 3.781 . 5.568 4.826 4.605 5.038 . 0 0 "[ . 1 . 2]" 1 2714 1 98 GLU H 1 98 GLU HA 2.470 . 3.233 2.792 2.739 2.869 . 0 0 "[ . 1 . 2]" 1 2715 1 98 GLU H 1 98 GLU HB2 2.677 . 3.573 3.563 3.513 3.587 0.014 1 0 "[ . 1 . 2]" 1 2716 1 98 GLU H 1 98 GLU HB3 2.727 . 3.657 2.609 2.490 2.767 . 0 0 "[ . 1 . 2]" 1 2717 1 98 GLU H 1 98 GLU HG2 2.636 . 3.504 1.985 1.793 2.329 . 0 0 "[ . 1 . 2]" 1 2718 1 98 GLU H 1 98 GLU HG3 2.728 . 3.658 3.213 3.010 3.549 . 0 0 "[ . 1 . 2]" 1 2719 1 98 GLU H 1 99 ASN H 2.888 . 3.931 2.732 2.457 2.896 . 0 0 "[ . 1 . 2]" 1 2720 1 98 GLU H 1 100 VAL H 4.174 . 6.352 4.635 4.371 4.928 . 0 0 "[ . 1 . 2]" 1 2721 1 98 GLU HA 1 98 GLU QB 1.971 . 2.457 2.176 2.169 2.182 . 0 0 "[ . 1 . 2]" 1 2722 1 98 GLU HA 1 98 GLU HB3 2.273 . 2.919 2.398 2.311 2.447 . 0 0 "[ . 1 . 2]" 1 2723 1 98 GLU HA 1 98 GLU HG2 2.338 . 7.500 3.690 3.533 3.750 . 0 0 "[ . 1 . 2]" 1 2724 1 98 GLU HA 1 98 GLU QG 2.381 . 7.500 3.339 3.319 3.391 . 0 0 "[ . 1 . 2]" 1 2725 1 98 GLU HA 1 98 GLU HG3 2.510 . 7.500 3.829 3.750 4.211 . 0 0 "[ . 1 . 2]" 1 2726 1 98 GLU HA 1 99 ASN H 2.494 . 7.500 3.531 3.492 3.565 . 0 0 "[ . 1 . 2]" 1 2727 1 98 GLU HA 1 99 ASN HA 3.214 . 4.505 4.526 4.512 4.543 0.038 13 0 "[ . 1 . 2]" 1 2728 1 98 GLU HA 1 100 VAL H 3.108 . 7.500 5.439 5.060 5.754 . 0 0 "[ . 1 . 2]" 1 2729 1 98 GLU HA 1 101 ASN QB 3.319 . 4.696 4.662 4.449 4.817 0.121 14 0 "[ . 1 . 2]" 1 2730 1 98 GLU QB 1 99 ASN H 2.730 . 3.661 3.488 3.159 3.579 . 0 0 "[ . 1 . 2]" 1 2731 1 98 GLU QB 1 99 ASN QD 4.079 . 5.353 4.052 3.891 4.271 . 0 0 "[ . 1 . 2]" 1 2732 1 98 GLU HB2 1 99 ASN H 2.924 . 7.500 3.782 3.302 3.948 . 0 0 "[ . 1 . 2]" 1 2733 1 98 GLU HB3 1 99 ASN H 2.911 . 3.970 4.099 4.027 4.180 0.210 17 0 "[ . 1 . 2]" 1 2734 1 98 GLU HB3 1 99 ASN HA 2.970 . 7.500 5.565 5.456 5.654 . 0 0 "[ . 1 . 2]" 1 2735 1 98 GLU QG 1 99 ASN H 3.107 . 4.314 2.253 1.849 2.457 0.051 19 0 "[ . 1 . 2]" 1 2736 1 98 GLU QG 1 99 ASN QD 3.652 . 4.632 2.629 1.950 3.512 0.035 10 0 "[ . 1 . 2]" 1 2737 1 98 GLU HG2 1 99 ASN H 2.653 . 3.533 2.687 1.860 2.899 . 0 0 "[ . 1 . 2]" 1 2738 1 98 GLU HG2 1 99 ASN HA 3.370 . 4.789 4.938 4.111 5.101 0.312 6 0 "[ . 1 . 2]" 1 2739 1 98 GLU HG2 1 99 ASN QD 2.928 . 4.000 3.146 2.620 3.982 . 0 0 "[ . 1 . 2]" 1 2740 1 98 GLU HG3 1 99 ASN HA 3.479 . 7.500 3.804 3.584 4.921 . 0 0 "[ . 1 . 2]" 1 2741 1 98 GLU HG3 1 99 ASN QD 2.916 . 3.979 2.900 2.009 4.026 0.047 2 0 "[ . 1 . 2]" 1 2742 1 99 ASN H 1 99 ASN HA 2.428 . 3.165 2.920 2.907 2.933 . 0 0 "[ . 1 . 2]" 1 2743 1 99 ASN H 1 99 ASN HB2 2.789 . 3.761 3.673 3.477 3.750 . 0 0 "[ . 1 . 2]" 1 2744 1 99 ASN H 1 99 ASN HB2 2.356 . 7.500 2.865 2.210 3.092 . 0 0 "[ . 1 . 2]" 1 2745 1 99 ASN H 1 99 ASN HB3 2.706 . 3.621 2.978 2.444 3.413 . 0 0 "[ . 1 . 2]" 1 2746 1 99 ASN H 1 99 ASN QD 3.582 . 5.185 2.522 2.269 2.932 . 0 0 "[ . 1 . 2]" 1 2747 1 99 ASN H 1 101 ASN H 3.819 . 5.643 3.530 3.318 3.824 . 0 0 "[ . 1 . 2]" 1 2748 1 99 ASN H 1 100 VAL H 2.640 . 3.511 2.405 2.262 2.570 . 0 0 "[ . 1 . 2]" 1 2749 1 99 ASN H 1 100 VAL MG1 3.155 . 4.399 4.023 3.881 4.400 0.001 8 0 "[ . 1 . 2]" 1 2750 1 99 ASN H 1 100 VAL MG2 3.587 . 5.195 3.413 3.214 3.575 . 0 0 "[ . 1 . 2]" 1 2751 1 99 ASN H 1 101 ASN H 4.080 . 6.161 3.676 3.558 3.944 . 0 0 "[ . 1 . 2]" 1 2752 1 99 ASN HA 1 99 ASN HB2 2.341 . 3.026 2.485 2.253 2.735 . 0 0 "[ . 1 . 2]" 1 2753 1 99 ASN HA 1 99 ASN HB3 2.477 . 3.244 2.434 2.244 2.726 . 0 0 "[ . 1 . 2]" 1 2754 1 99 ASN HA 1 99 ASN QD 3.972 . 5.782 3.955 3.865 4.092 . 0 0 "[ . 1 . 2]" 1 2755 1 99 ASN HA 1 100 VAL H 2.642 . 3.515 3.555 3.531 3.571 0.056 11 0 "[ . 1 . 2]" 1 2756 1 99 ASN HA 1 100 VAL MG2 3.316 . 4.691 4.788 4.749 4.858 0.167 9 0 "[ . 1 . 2]" 1 2757 1 99 ASN HA 1 101 ASN H 3.672 . 5.357 4.953 4.715 5.210 . 0 0 "[ . 1 . 2]" 1 2758 1 99 ASN HA 1 102 THR H 3.113 . 4.324 4.343 4.211 4.456 0.132 6 0 "[ . 1 . 2]" 1 2759 1 99 ASN HA 1 102 THR HB 3.008 . 4.139 4.137 2.919 4.257 0.118 5 0 "[ . 1 . 2]" 1 2760 1 99 ASN HA 1 102 THR MG 2.687 . 3.590 2.851 2.663 3.692 0.102 8 0 "[ . 1 . 2]" 1 2761 1 99 ASN HB2 1 99 ASN QD 2.691 . 3.939 3.021 2.235 3.296 . 0 0 "[ . 1 . 2]" 1 2762 1 99 ASN HB2 1 100 VAL H 3.397 . 4.840 3.348 2.674 3.816 . 0 0 "[ . 1 . 2]" 1 2763 1 99 ASN HB2 1 100 VAL MG1 3.212 . 4.502 3.432 2.705 3.952 . 0 0 "[ . 1 . 2]" 1 2764 1 99 ASN HB3 1 99 ASN QD 2.396 . 3.114 2.491 2.130 3.308 0.194 13 0 "[ . 1 . 2]" 1 2765 1 99 ASN HB3 1 100 VAL H 3.379 . 4.806 3.855 3.524 4.136 . 0 0 "[ . 1 . 2]" 1 2766 1 99 ASN HB3 1 100 VAL MG1 3.444 . 4.927 4.217 3.975 4.607 . 0 0 "[ . 1 . 2]" 1 2767 1 99 ASN QD 1 100 VAL MG2 2.214 . 2.827 2.522 1.741 2.865 0.038 6 0 "[ . 1 . 2]" 1 2768 1 100 VAL H 1 101 ASN HB2 3.039 . 4.194 4.050 3.916 4.195 0.001 19 0 "[ . 1 . 2]" 1 2769 1 100 VAL H 1 100 VAL HA 2.871 . 3.902 2.904 2.866 2.914 . 0 0 "[ . 1 . 2]" 1 2770 1 100 VAL H 1 100 VAL HB 2.291 . 7.500 3.581 3.539 3.632 . 0 0 "[ . 1 . 2]" 1 2771 1 100 VAL H 1 100 VAL MG1 2.614 . 3.468 2.869 2.587 3.005 . 0 0 "[ . 1 . 2]" 1 2772 1 100 VAL H 1 100 VAL MG2 2.373 . 3.077 1.735 1.657 1.799 0.012 7 0 "[ . 1 . 2]" 1 2773 1 100 VAL H 1 101 ASN H 2.650 . 3.528 2.380 2.306 2.500 . 0 0 "[ . 1 . 2]" 1 2774 1 100 VAL HA 1 100 VAL HB 2.355 . 3.048 2.604 2.547 2.647 . 0 0 "[ . 1 . 2]" 1 2775 1 100 VAL HA 1 101 ASN H 2.810 . 3.797 3.527 3.490 3.548 . 0 0 "[ . 1 . 2]" 1 2776 1 100 VAL HA 1 101 ASN HA 3.412 . 4.867 4.748 4.702 4.834 . 0 0 "[ . 1 . 2]" 1 2777 1 100 VAL HA 1 102 THR H 3.720 . 5.450 4.039 3.845 4.364 . 0 0 "[ . 1 . 2]" 1 2778 1 100 VAL HA 1 103 TYR H 3.562 . 5.148 3.451 2.996 3.652 . 0 0 "[ . 1 . 2]" 1 2779 1 100 VAL HA 1 103 TYR HB2 3.107 . 4.314 3.555 2.786 4.186 . 0 0 "[ . 1 . 2]" 1 2780 1 100 VAL HA 1 103 TYR HB3 3.225 . 4.525 2.945 2.362 4.127 . 0 0 "[ . 1 . 2]" 1 2781 1 100 VAL HB 1 100 VAL MG1 2.264 . 2.905 2.132 2.124 2.134 . 0 0 "[ . 1 . 2]" 1 2782 1 100 VAL HB 1 100 VAL MG2 2.194 . 2.796 2.128 2.123 2.131 . 0 0 "[ . 1 . 2]" 1 2783 1 100 VAL HB 1 101 ASN H 2.390 . 7.500 3.505 3.228 3.776 . 0 0 "[ . 1 . 2]" 1 2784 1 100 VAL HB 1 101 ASN HA 3.220 . 4.516 4.121 3.974 4.321 . 0 0 "[ . 1 . 2]" 1 2785 1 100 VAL HB 1 101 ASN QB 2.951 . 7.500 4.792 4.575 5.077 . 0 0 "[ . 1 . 2]" 1 2786 1 100 VAL MG1 1 101 ASN H 2.743 . 3.683 3.742 3.646 3.999 0.316 8 0 "[ . 1 . 2]" 1 2787 1 100 VAL MG1 1 101 ASN HA 3.113 . 7.500 4.721 4.609 5.008 . 0 0 "[ . 1 . 2]" 1 2788 1 100 VAL MG1 1 101 ASN HB2 2.737 . 7.500 4.498 4.388 4.754 . 0 0 "[ . 1 . 2]" 1 2789 1 100 VAL MG1 1 103 TYR HB3 3.288 . 4.640 3.576 3.331 4.152 . 0 0 "[ . 1 . 2]" 1 2790 1 100 VAL MG2 1 101 ASN H 2.229 . 2.850 2.102 1.849 2.376 . 0 0 "[ . 1 . 2]" 1 2791 1 100 VAL MG2 1 101 ASN HA 2.668 . 7.500 3.726 3.582 3.941 . 0 0 "[ . 1 . 2]" 1 2792 1 100 VAL MG2 1 101 ASN QB 2.506 . 3.291 3.196 2.991 3.427 0.136 10 0 "[ . 1 . 2]" 1 2793 1 100 VAL MG2 1 101 ASN HD22 2.960 . 7.500 5.818 4.620 6.372 . 0 0 "[ . 1 . 2]" 1 2794 1 100 VAL MG2 1 102 THR H 3.163 . 4.414 4.218 4.072 4.384 . 0 0 "[ . 1 . 2]" 1 2795 1 100 VAL MG2 1 103 TYR H 3.436 . 4.912 4.934 4.756 5.022 0.110 4 0 "[ . 1 . 2]" 1 2796 1 100 VAL MG2 1 104 PHE H 3.568 . 5.159 4.772 4.416 5.097 . 0 0 "[ . 1 . 2]" 1 2797 1 101 ASN H 1 101 ASN HA 2.395 . 3.112 2.843 2.800 2.872 . 0 0 "[ . 1 . 2]" 1 2798 1 101 ASN H 1 101 ASN QB 2.061 . 2.592 2.248 2.120 2.304 . 0 0 "[ . 1 . 2]" 1 2799 1 101 ASN H 1 102 THR H 2.512 . 3.301 2.508 2.402 2.636 . 0 0 "[ . 1 . 2]" 1 2800 1 101 ASN H 1 102 THR HA 3.199 . 7.500 5.120 5.053 5.262 . 0 0 "[ . 1 . 2]" 1 2801 1 101 ASN H 1 102 THR HA 3.454 . 4.945 4.258 4.147 4.318 . 0 0 "[ . 1 . 2]" 1 2802 1 101 ASN H 1 102 THR HB 3.255 . 4.579 4.555 4.397 4.644 0.065 10 0 "[ . 1 . 2]" 1 2803 1 101 ASN H 1 103 TYR H 3.906 . 5.813 3.912 3.775 4.100 . 0 0 "[ . 1 . 2]" 1 2804 1 101 ASN HA 1 101 ASN HD21 2.594 . 3.435 2.692 1.733 3.178 0.020 16 0 "[ . 1 . 2]" 1 2805 1 101 ASN HA 1 102 THR H 2.788 . 3.760 3.459 3.396 3.508 . 0 0 "[ . 1 . 2]" 1 2806 1 101 ASN HA 1 102 THR HA 3.190 . 7.500 4.712 4.606 4.856 . 0 0 "[ . 1 . 2]" 1 2807 1 101 ASN HA 1 103 TYR H 3.519 . 5.067 3.649 3.347 4.065 . 0 0 "[ . 1 . 2]" 1 2808 1 101 ASN HA 1 104 PHE H 2.987 . 4.103 3.287 2.952 3.562 . 0 0 "[ . 1 . 2]" 1 2809 1 101 ASN HA 1 104 PHE H 2.942 . 4.024 2.641 2.181 2.743 . 0 0 "[ . 1 . 2]" 1 2810 1 101 ASN HA 1 104 PHE QB 3.281 . 4.134 2.892 2.288 3.160 . 0 0 "[ . 1 . 2]" 1 2811 1 101 ASN QB 1 102 THR HA 2.692 . 3.598 3.891 3.697 4.010 0.412 12 0 "[ . 1 . 2]" 1 2812 1 101 ASN QB 1 101 ASN HD22 2.557 . 3.375 3.333 3.269 3.482 0.107 16 0 "[ . 1 . 2]" 1 2813 1 101 ASN QB 1 102 THR H 2.552 . 3.366 2.814 2.372 3.033 . 0 0 "[ . 1 . 2]" 1 2814 1 101 ASN QB 1 102 THR HA 2.885 . 3.926 3.992 3.854 4.089 0.163 12 0 "[ . 1 . 2]" 1 2815 1 101 ASN QB 1 102 THR HB 3.052 . 4.216 4.110 3.921 4.336 0.120 8 0 "[ . 1 . 2]" 1 2816 1 101 ASN QB 1 103 TYR H 3.668 . 5.350 4.465 4.294 4.574 . 0 0 "[ . 1 . 2]" 1 2817 1 101 ASN HB2 1 102 THR MG 2.519 . 7.500 5.737 4.879 6.484 . 0 0 "[ . 1 . 2]" 1 2818 1 101 ASN HB3 1 101 ASN HD21 2.495 . 3.273 3.254 2.198 3.537 0.264 15 0 "[ . 1 . 2]" 1 2819 1 102 THR H 1 102 THR HA 2.280 . 2.930 2.846 2.767 2.890 . 0 0 "[ . 1 . 2]" 1 2820 1 102 THR H 1 102 THR HA 2.265 . 2.906 2.247 2.144 2.345 . 0 0 "[ . 1 . 2]" 1 2821 1 102 THR H 1 102 THR HB 2.284 . 2.936 2.355 2.221 2.481 . 0 0 "[ . 1 . 2]" 1 2822 1 102 THR H 1 102 THR MG 2.200 . 2.805 2.530 2.319 3.633 0.828 8 1 "[ . + 1 . 2]" 1 2823 1 102 THR H 1 103 TYR QB 3.151 . 4.392 4.153 3.892 4.414 0.022 8 0 "[ . 1 . 2]" 1 2824 1 102 THR HA 1 102 THR MG 2.163 . 7.500 3.150 2.546 3.203 . 0 0 "[ . 1 . 2]" 1 2825 1 102 THR HA 1 103 TYR H 2.491 . 3.267 2.756 2.728 2.772 . 0 0 "[ . 1 . 2]" 1 2826 1 102 THR HB 1 102 THR MG 1.775 . 2.169 2.131 2.120 2.136 . 0 0 "[ . 1 . 2]" 1 2827 1 102 THR HB 1 103 TYR QB 3.089 . 7.500 5.147 4.200 5.649 . 0 0 "[ . 1 . 2]" 1 2828 1 102 THR MG 1 103 TYR H 3.087 . 4.279 2.766 2.544 3.388 . 0 0 "[ . 1 . 2]" 1 2829 1 103 TYR H 1 103 TYR HA 2.731 . 3.663 2.924 2.863 2.945 . 0 0 "[ . 1 . 2]" 1 2830 1 103 TYR H 1 103 TYR HB2 2.567 . 3.391 2.813 2.325 2.997 . 0 0 "[ . 1 . 2]" 1 2831 1 103 TYR H 1 103 TYR QB 2.385 . 3.096 2.330 2.213 2.409 . 0 0 "[ . 1 . 2]" 1 2832 1 103 TYR H 1 103 TYR HB3 2.579 . 3.410 2.532 2.325 3.430 0.020 5 0 "[ . 1 . 2]" 1 2833 1 103 TYR HA 1 103 TYR HB2 2.422 . 3.155 2.479 2.387 2.931 . 0 0 "[ . 1 . 2]" 1 2834 1 103 TYR HA 1 103 TYR HB3 2.456 . 3.210 3.013 2.752 3.033 . 0 0 "[ . 1 . 2]" 1 2835 1 103 TYR HA 1 104 PHE H 3.077 . 4.261 3.464 3.230 3.555 . 0 0 "[ . 1 . 2]" 1 2836 1 103 TYR HB3 1 104 PHE H 2.680 . 3.578 2.270 2.153 2.489 . 0 0 "[ . 1 . 2]" 1 2837 1 104 PHE H 1 104 PHE QB 2.692 . 3.598 2.432 2.276 2.838 . 0 0 "[ . 1 . 2]" 1 2838 1 104 PHE HA 1 104 PHE QB 2.223 . 2.841 2.305 2.148 2.444 . 0 0 "[ . 1 . 2]" 1 2839 1 104 PHE HA 1 105 VAL H 2.229 . 2.850 2.590 2.362 2.904 0.054 19 0 "[ . 1 . 2]" 1 2840 1 104 PHE HA 1 105 VAL HA 2.803 . 7.500 4.334 4.187 4.585 . 0 0 "[ . 1 . 2]" 1 2841 1 104 PHE HA 1 105 VAL QG 2.931 . 4.005 3.672 2.983 4.014 0.009 17 0 "[ . 1 . 2]" 1 2842 1 104 PHE QB 1 105 VAL H 2.875 . 3.621 2.013 1.795 2.273 0.047 13 0 "[ . 1 . 2]" 1 2843 1 104 PHE QB 1 105 VAL QG 3.088 . 4.280 3.133 2.462 3.754 . 0 0 "[ . 1 . 2]" 1 2844 1 105 VAL H 1 105 VAL HB 2.268 . 2.911 2.862 2.589 3.344 0.433 5 0 "[ . 1 . 2]" 1 2845 1 105 VAL H 1 105 VAL QG 2.175 . 2.766 1.882 1.629 2.390 0.171 7 0 "[ . 1 . 2]" 1 2846 1 105 VAL HA 1 105 VAL HB 2.130 . 2.697 2.498 2.356 2.983 0.286 19 0 "[ . 1 . 2]" 1 2847 1 105 VAL HA 1 105 VAL QG 2.044 . 2.566 2.326 2.116 2.419 . 0 0 "[ . 1 . 2]" 1 2848 1 105 VAL HB 1 105 VAL QG 2.032 . 2.527 1.892 1.888 1.895 . 0 0 "[ . 1 . 2]" 1 stop_ save_
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