NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
643681 | 6soe | 34429 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_6soe 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 2571 _Distance_constraint_stats_list.Viol_count 2835 _Distance_constraint_stats_list.Viol_total 7597.750 _Distance_constraint_stats_list.Viol_max 0.973 _Distance_constraint_stats_list.Viol_rms 0.0355 _Distance_constraint_stats_list.Viol_average_all_restraints 0.0047 _Distance_constraint_stats_list.Viol_average_violations_only 0.1072 _Distance_constraint_stats_list.Cutoff_violation_report 0.500 _Distance_constraint_stats_list.Details ; Description of the tags in this list: * 1 * Administrative tag * 2 * Administrative tag * 3 * Administrative tag * 4 * ID of the restraint list. * 5 * Number of restraints in list. * 6 * Number of violated restraints (each model violation is used). * 7 * Sum of violations in Angstrom. * 8 * Maximum violation of a restraint without averaging in any way. * 9 * Rms of violations over all restraints. * 10 * Average violation over all restraints. * 11 * Average violation over violated restraints. This violation is averaged over only those models in which the restraint is violated. These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998). * 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table. * 13 * This tag Description of the tags in the per residue table below: * 1 * Chain identifier (can be absent if none defined) * 2 * Residue number * 3 * Residue name * 4 * Maximum violation in ensemble of models (without any averaging) * 5 * Model number with the maximum violation * 6 * Number of models with a violation above cutoff * 7 * List of models (1 character per model) with a violation above cutoff. An '*' marks a violation above the cutoff. A '+' indicates the largest violation above the cutoff and a '-' marks the smallest violation over cutoff. For models 5, 15, 25,... a ' ' is replaced by a '.'. For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1. * 8 * Administrative tag * 9 * Administrative tag Description of the tags in the per restraint table below: * 1 * Restraint ID within restraint list. First node, FIRST member, first atom's: * 2 * Chain identifier (can be absent if none defined) * 3 * Residue number * 4 * Residue name * 5 * Name of (pseudo-)atom First node, SECOND member, first atom's: * 6 * Chain identifier (can be absent if none defined) * 7 * Residue number * 8 * Residue name * 9 * Name of (pseudo-)atom FIRST node's: * 10 * Target distance value (Angstrom) * 11 * Lower bound distance (Angstrom) * 12 * Upper bound distance (Angstrom) * 13 * Average distance in ensemble of models * 14 * Minimum distance in ensemble of models * 15 * Maximum distance in ensemble of models * 16 * Maximum violation (without any averaging) * 17 * Model number with the maximum violation * 18 * Number of models with a violation above cutoff * 19 * List of models with a violation above cutoff. See description above. * 20 * Administrative tag * 21 * Administrative tag ; loop_ _Distance_constraint_stats_per_res.Atom_entity_assembly_ID _Distance_constraint_stats_per_res.Atom_comp_index_ID _Distance_constraint_stats_per_res.Atom_comp_ID _Distance_constraint_stats_per_res.Total_violation _Distance_constraint_stats_per_res.Max_violation _Distance_constraint_stats_per_res.Max_violation_model_number _Distance_constraint_stats_per_res.Over_cutoff_viol_count _Distance_constraint_stats_per_res.Over_cutoff_viol_per_model 1 2 ALA 0.000 0.000 . 0 "[ . 1 . 2 .]" 1 3 MET 0.328 0.205 22 0 "[ . 1 . 2 .]" 1 4 ALA 6.088 0.344 23 0 "[ . 1 . 2 .]" 1 5 GLN 4.658 0.371 25 0 "[ . 1 . 2 .]" 1 6 ARG 7.880 0.873 23 1 "[ . 1 . 2 + .]" 1 7 LYS 16.222 0.424 23 0 "[ . 1 . 2 .]" 1 8 GLY 8.894 0.630 17 11 "[* * . -*1 **.*+ *2 ** .]" 1 9 ALA 11.527 0.630 17 11 "[* * . -*1 **.*+ *2 ** .]" 1 10 GLY 1.955 0.302 15 0 "[ . 1 . 2 .]" 1 11 ARG 2.036 0.290 14 0 "[ . 1 . 2 .]" 1 12 VAL 6.583 0.538 11 2 "[ - . 1+ . 2 .]" 1 13 VAL 12.536 0.160 19 0 "[ . 1 . 2 .]" 1 14 HIS 3.288 0.257 8 0 "[ . 1 . 2 .]" 1 15 ILE 11.980 0.174 24 0 "[ . 1 . 2 .]" 1 16 CYS 6.502 0.499 13 0 "[ . 1 . 2 .]" 1 17 ASN 8.668 0.499 13 0 "[ . 1 . 2 .]" 1 18 LEU 16.658 0.328 7 0 "[ . 1 . 2 .]" 1 19 PRO 5.711 0.508 17 1 "[ . 1 . + 2 .]" 1 20 GLU 11.711 0.973 18 7 "[* * * - 1* . + 2* .]" 1 21 GLY 0.000 0.000 . 0 "[ . 1 . 2 .]" 1 22 SER 5.624 0.591 4 2 "[ +. 1 . - 2 .]" 1 23 CYS 0.445 0.258 12 0 "[ . 1 . 2 .]" 1 24 THR 1.055 0.258 12 0 "[ . 1 . 2 .]" 1 25 GLU 12.793 0.955 16 9 "[* * - 1*** .+ 2* *]" 1 26 ASN 0.413 0.362 25 0 "[ . 1 . 2 .]" 1 27 ASP 3.480 0.186 19 0 "[ . 1 . 2 .]" 1 28 VAL 16.062 0.330 12 0 "[ . 1 . 2 .]" 1 29 ILE 9.676 0.648 25 1 "[ . 1 . 2 +]" 1 30 ASN 0.225 0.085 20 0 "[ . 1 . 2 .]" 1 31 LEU 5.375 0.330 12 0 "[ . 1 . 2 .]" 1 32 GLY 0.000 0.000 . 0 "[ . 1 . 2 .]" 1 33 LEU 22.238 0.424 23 0 "[ . 1 . 2 .]" 1 34 PRO 7.722 0.332 11 0 "[ . 1 . 2 .]" 1 35 PHE 1.884 0.109 5 0 "[ . 1 . 2 .]" 1 36 GLY 14.032 0.464 9 0 "[ . 1 . 2 .]" 1 37 LYS 9.968 0.390 8 0 "[ . 1 . 2 .]" 1 38 VAL 7.770 0.271 8 0 "[ . 1 . 2 .]" 1 39 THR 9.900 0.973 18 3 "[* . 1 . + 2- .]" 1 40 ASN 12.981 0.882 3 6 "[ + * - 1 * * * .]" 1 41 TYR 2.835 0.390 20 0 "[ . 1 . 2 .]" 1 42 ILE 4.999 0.511 7 1 "[ . + 1 . 2 .]" 1 43 LEU 18.871 0.240 21 0 "[ . 1 . 2 .]" 1 44 MET 10.204 0.773 5 5 "[* + - 1* . 2* .]" 1 45 LYS 2.925 0.154 1 0 "[ . 1 . 2 .]" 1 46 SER 0.000 0.000 . 0 "[ . 1 . 2 .]" 1 47 THR 3.966 0.955 16 3 "[ . 1 - .+ 2* .]" 1 48 ASN 5.689 0.973 18 3 "[* . 1 . + 2- .]" 1 49 GLN 7.127 0.930 6 2 "[ .+ -1 . 2 .]" 1 50 ALA 4.487 0.142 12 0 "[ . 1 . 2 .]" 1 51 PHE 1.255 0.060 9 0 "[ . 1 . 2 .]" 1 52 LEU 5.588 0.153 11 0 "[ . 1 . 2 .]" 1 53 GLU 16.413 0.424 23 0 "[ . 1 . 2 .]" 1 54 MET 11.749 0.232 7 0 "[ . 1 . 2 .]" 1 55 ALA 1.015 0.133 22 0 "[ . 1 . 2 .]" 1 56 TYR 4.790 0.955 16 4 "[ . 1 * .+ 2* - .]" 1 57 THR 4.278 0.366 4 0 "[ . 1 . 2 .]" 1 58 GLU 20.508 0.631 24 7 "[ -*. **1 * . *2 +.]" 1 59 ALA 8.456 0.631 24 3 "[ . - 1 * . 2 +.]" 1 60 ALA 4.086 0.239 2 0 "[ . 1 . 2 .]" 1 61 GLN 9.837 0.955 16 3 "[ . 1 * .+ 2* .]" 1 62 ALA 3.338 0.625 9 2 "[ . +1 . 2 -.]" 1 63 MET 9.087 0.355 17 0 "[ . 1 . 2 .]" 1 64 VAL 12.770 0.811 16 1 "[ . 1 .+ 2 .]" 1 65 GLN 22.949 0.955 16 6 "[ *. - 1 * .+ 2* * .]" 1 66 TYR 14.417 0.511 1 1 "[+ . 1 . 2 .]" 1 67 TYR 7.495 0.355 17 0 "[ . 1 . 2 .]" 1 68 GLN 9.380 0.551 23 2 "[ . - 1 . 2 + .]" 1 69 GLU 10.484 0.551 23 2 "[ . - 1 . 2 + .]" 1 70 LYS 5.219 0.511 1 1 "[+ . 1 . 2 .]" 1 71 PRO 8.113 0.165 21 0 "[ . 1 . 2 .]" 1 72 ALA 1.619 0.082 15 0 "[ . 1 . 2 .]" 1 73 ILE 4.002 0.099 8 0 "[ . 1 . 2 .]" 1 74 ILE 18.077 0.735 3 10 "[ +*.* *1 * **- 2 * *.]" 1 75 ASN 0.301 0.122 11 0 "[ . 1 . 2 .]" 1 76 GLY 0.088 0.088 2 0 "[ . 1 . 2 .]" 1 77 GLU 17.092 0.908 23 10 "[ * .* *1 ** * -* 2 +*.]" 1 78 LYS 4.752 0.139 24 0 "[ . 1 . 2 .]" 1 79 LEU 8.176 0.239 2 0 "[ . 1 . 2 .]" 1 80 LEU 5.204 0.137 11 0 "[ . 1 . 2 .]" 1 81 ILE 25.813 0.591 4 1 "[ +. 1 . 2 .]" 1 82 ARG 10.382 0.947 10 4 "[ - . + . ** .]" 1 83 MET 16.100 0.947 10 4 "[ - . + . ** .]" 1 84 SER 2.168 0.514 2 1 "[ + . 1 . 2 .]" 1 85 THR 0.521 0.091 13 0 "[ . 1 . 2 .]" 1 86 ARG 1.823 0.930 6 2 "[ .+ -1 . 2 .]" 1 87 TYR 5.804 0.773 5 5 "[* + - 1* . 2* .]" 1 88 LYS 2.803 0.538 11 1 "[ . 1+ . 2 .]" 1 89 GLU 4.438 0.232 7 0 "[ . 1 . 2 .]" 1 90 LEU 17.925 0.882 3 6 "[ + * - 1 * * * .]" 1 91 GLN 3.491 0.245 4 0 "[ . 1 . 2 .]" 1 92 LEU 4.750 0.511 7 1 "[ . + 1 . 2 .]" 1 93 LYS 7.237 0.405 6 0 "[ . 1 . 2 .]" 1 94 LYS 3.418 0.239 2 0 "[ . 1 . 2 .]" 1 95 PRO 0.054 0.043 7 0 "[ . 1 . 2 .]" 1 96 GLY 0.000 0.000 . 0 "[ . 1 . 2 .]" 1 97 LYS 6.973 0.271 8 0 "[ . 1 . 2 .]" 1 98 ASN 0.000 0.000 . 0 "[ . 1 . 2 .]" 1 99 VAL 0.643 0.117 13 0 "[ . 1 . 2 .]" 1 100 ALA 3.606 0.233 6 0 "[ . 1 . 2 .]" 1 101 ALA 2.968 0.189 9 0 "[ . 1 . 2 .]" 1 102 ILE 1.558 0.189 9 0 "[ . 1 . 2 .]" 1 103 ILE 3.066 0.151 1 0 "[ . 1 . 2 .]" 1 104 GLN 3.644 0.973 18 3 "[* . 1 . + 2- .]" 1 105 ASP 2.013 0.380 1 0 "[ . 1 . 2 .]" 1 106 ILE 7.030 0.591 4 1 "[ +. 1 . 2 .]" 1 107 HIS 3.451 0.877 23 1 "[ . 1 . 2 + .]" 1 108 SER 2.725 0.591 4 1 "[ +. 1 . 2 .]" 1 109 GLN 6.052 0.973 18 3 "[* . 1 . + 2- .]" 1 110 ARG 7.577 0.631 1 5 "[+** . 1 * . - 2 .]" 1 111 GLU 5.457 0.973 18 3 "[* . 1 . + 2- .]" 1 112 ARG 4.737 0.859 16 3 "[ .- 1 .+ *2 .]" stop_ loop_ _Distance_constraint_stats.Restraint_ID _Distance_constraint_stats.Atom_1_entity_assembly_ID _Distance_constraint_stats.Atom_1_comp_index_ID _Distance_constraint_stats.Atom_1_comp_ID _Distance_constraint_stats.Atom_1_ID _Distance_constraint_stats.Atom_2_entity_assembly_ID _Distance_constraint_stats.Atom_2_comp_index_ID _Distance_constraint_stats.Atom_2_comp_ID _Distance_constraint_stats.Atom_2_ID _Distance_constraint_stats.Node_1_distance_val _Distance_constraint_stats.Node_1_distance_lower_bound_val _Distance_constraint_stats.Node_1_distance_upper_bound_val _Distance_constraint_stats.Distance_average _Distance_constraint_stats.Distance_minimum _Distance_constraint_stats.Distance_maximum _Distance_constraint_stats.Max_violation _Distance_constraint_stats.Max_violation_model_number _Distance_constraint_stats.Over_cutoff_violation_count _Distance_constraint_stats.Over_cutoff_viol_per_model _Distance_constraint_stats.Distance_constraint_stats_ID 1 1 2 ALA HA 1 2 ALA MB 1.615 . 1.941 1.689 1.684 1.693 . 0 0 "[ . 1 . 2 .]" 1 2 1 2 ALA HA 1 3 MET QB 4.044 . 6.088 3.979 3.577 4.581 . 0 0 "[ . 1 . 2 .]" 1 3 1 2 ALA MB 1 3 MET HA 3.835 . 5.674 3.818 3.551 4.218 . 0 0 "[ . 1 . 2 .]" 1 4 1 2 ALA MB 1 3 MET HA 3.674 . 5.361 3.186 2.970 3.430 . 0 0 "[ . 1 . 2 .]" 1 5 1 3 MET H 1 3 MET QB 3.268 . 4.603 2.339 2.108 2.943 . 0 0 "[ . 1 . 2 .]" 1 6 1 3 MET H 1 3 MET HB2 3.292 . 4.646 2.418 2.138 3.053 . 0 0 "[ . 1 . 2 .]" 1 7 1 3 MET HA 1 3 MET HB3 2.714 . 3.634 2.567 2.398 3.026 . 0 0 "[ . 1 . 2 .]" 1 8 1 3 MET HA 1 4 ALA H 2.960 . 4.055 2.969 2.143 3.552 . 0 0 "[ . 1 . 2 .]" 1 9 1 3 MET HA 1 89 GLU QB 4.583 . 7.208 6.022 4.741 6.283 . 0 0 "[ . 1 . 2 .]" 1 10 1 3 MET HB2 1 3 MET HG2 2.343 . 3.029 1.962 1.918 2.021 . 0 0 "[ . 1 . 2 .]" 1 11 1 3 MET HB3 1 40 ASN H 4.566 . 7.172 6.558 4.368 7.377 0.205 22 0 "[ . 1 . 2 .]" 1 12 1 3 MET HB3 1 3 MET HG3 2.796 . 3.773 2.202 2.099 2.347 . 0 0 "[ . 1 . 2 .]" 1 13 1 3 MET HB3 1 4 ALA H 5.057 . 8.253 3.758 2.150 4.428 . 0 0 "[ . 1 . 2 .]" 1 14 1 3 MET ME 1 3 MET HG3 2.849 . 3.864 2.447 2.191 2.821 . 0 0 "[ . 1 . 2 .]" 1 15 1 4 ALA H 1 4 ALA HA 2.907 . 3.963 2.345 2.055 2.686 . 0 0 "[ . 1 . 2 .]" 1 16 1 4 ALA H 1 4 ALA HA 2.632 . 3.498 1.981 1.838 2.207 . 0 0 "[ . 1 . 2 .]" 1 17 1 4 ALA H 1 4 ALA MB 2.679 . 3.576 2.509 2.230 2.937 . 0 0 "[ . 1 . 2 .]" 1 18 1 4 ALA H 1 4 ALA MB 2.641 . 3.513 1.996 1.706 2.567 0.063 25 0 "[ . 1 . 2 .]" 1 19 1 4 ALA HA 1 5 GLN H 2.431 . 3.170 2.565 2.099 3.154 . 0 0 "[ . 1 . 2 .]" 1 20 1 4 ALA HA 1 5 GLN QB 3.391 . 4.828 3.722 3.601 3.870 . 0 0 "[ . 1 . 2 .]" 1 21 1 4 ALA HA 1 5 GLN QB 3.465 . 4.966 4.470 4.063 5.120 0.154 11 0 "[ . 1 . 2 .]" 1 22 1 4 ALA HA 1 5 GLN QG 3.241 . 4.554 3.656 2.658 3.975 . 0 0 "[ . 1 . 2 .]" 1 23 1 4 ALA HA 1 39 THR MG 2.753 . 3.700 3.175 2.046 3.887 0.187 10 0 "[ . 1 . 2 .]" 1 24 1 4 ALA HA 1 40 ASN H 5.020 . 8.170 5.602 4.562 6.649 . 0 0 "[ . 1 . 2 .]" 1 25 1 4 ALA MB 1 5 GLN H 2.728 . 3.658 2.343 1.753 3.684 0.045 25 0 "[ . 1 . 2 .]" 1 26 1 4 ALA MB 1 5 GLN QB 2.878 . 3.913 1.917 1.727 2.171 0.116 15 0 "[ . 1 . 2 .]" 1 27 1 4 ALA MB 1 6 ARG QG 3.113 . 4.324 3.832 2.154 4.668 0.344 23 0 "[ . 1 . 2 .]" 1 28 1 4 ALA MB 1 6 ARG QG 2.018 . 2.527 2.547 1.847 2.766 0.239 2 0 "[ . 1 . 2 .]" 1 29 1 4 ALA MB 1 55 ALA H 4.996 . 8.116 5.054 4.159 5.624 . 0 0 "[ . 1 . 2 .]" 1 30 1 4 ALA MB 1 40 ASN HB2 3.327 . 4.711 3.920 2.919 4.848 0.137 11 0 "[ . 1 . 2 .]" 1 31 1 4 ALA MB 1 40 ASN HA 3.740 . 5.489 5.255 4.297 5.679 0.190 11 0 "[ . 1 . 2 .]" 1 32 1 5 GLN H 1 5 GLN QB 2.778 . 3.743 2.509 2.118 3.120 . 0 0 "[ . 1 . 2 .]" 1 33 1 5 GLN H 1 5 GLN HB3 4.011 . 6.022 3.866 3.564 4.132 . 0 0 "[ . 1 . 2 .]" 1 34 1 5 GLN H 1 5 GLN HG3 3.469 . 4.974 3.492 2.198 4.612 . 0 0 "[ . 1 . 2 .]" 1 35 1 5 GLN H 1 7 LYS QE 4.361 . 6.738 6.288 3.569 6.897 0.159 3 0 "[ . 1 . 2 .]" 1 36 1 5 GLN H 1 40 ASN QD 3.549 . 5.123 4.321 3.028 5.002 . 0 0 "[ . 1 . 2 .]" 1 37 1 5 GLN H 1 53 GLU HG3 4.190 . 6.385 3.800 3.318 4.186 . 0 0 "[ . 1 . 2 .]" 1 38 1 5 GLN H 1 55 ALA MB 4.366 . 6.749 4.869 3.559 6.559 . 0 0 "[ . 1 . 2 .]" 1 39 1 5 GLN HA 1 5 GLN QB 2.927 . 3.998 2.020 1.963 2.079 . 0 0 "[ . 1 . 2 .]" 1 40 1 5 GLN HA 1 5 GLN QG 2.925 . 3.994 2.148 1.973 2.434 . 0 0 "[ . 1 . 2 .]" 1 41 1 5 GLN HA 1 6 ARG H 2.943 . 4.026 2.284 2.038 2.783 . 0 0 "[ . 1 . 2 .]" 1 42 1 5 GLN QB 1 56 TYR H 3.808 . 5.621 4.723 4.025 4.991 . 0 0 "[ . 1 . 2 .]" 1 43 1 5 GLN QB 1 6 ARG H 2.809 . 3.795 2.456 1.748 3.077 0.075 24 0 "[ . 1 . 2 .]" 1 44 1 5 GLN QB 1 8 GLY QA 3.949 . 5.898 4.506 2.269 6.129 0.231 20 0 "[ . 1 . 2 .]" 1 45 1 5 GLN QB 1 9 ALA H 3.669 . 5.351 4.861 3.452 5.700 0.349 5 0 "[ . 1 . 2 .]" 1 46 1 5 GLN QB 1 10 GLY HA3 3.157 . 4.403 3.609 2.081 4.067 . 0 0 "[ . 1 . 2 .]" 1 47 1 5 GLN QB 1 40 ASN HA 5.012 . 8.152 7.871 7.335 8.523 0.371 25 0 "[ . 1 . 2 .]" 1 48 1 5 GLN QB 1 56 TYR QD 5.029 . 8.191 6.748 4.733 7.740 . 0 0 "[ . 1 . 2 .]" 1 49 1 5 GLN QG 1 7 LYS QG 4.187 . 6.379 4.410 3.189 5.317 . 0 0 "[ . 1 . 2 .]" 1 50 1 5 GLN QG 1 91 GLN QE 5.944 . 10.361 7.247 2.639 9.749 . 0 0 "[ . 1 . 2 .]" 1 51 1 6 ARG H 1 6 ARG HA 2.308 . 2.974 1.936 1.777 2.101 . 0 0 "[ . 1 . 2 .]" 1 52 1 6 ARG H 1 6 ARG HA 2.323 . 2.997 2.071 1.847 2.352 . 0 0 "[ . 1 . 2 .]" 1 53 1 6 ARG H 1 6 ARG QB 3.154 . 4.397 2.953 2.355 3.429 . 0 0 "[ . 1 . 2 .]" 1 54 1 6 ARG H 1 6 ARG QB 3.240 . 4.553 2.173 1.743 2.584 0.184 23 0 "[ . 1 . 2 .]" 1 55 1 6 ARG H 1 6 ARG QG 3.084 . 4.273 2.145 1.840 2.599 0.055 21 0 "[ . 1 . 2 .]" 1 56 1 6 ARG H 1 6 ARG QG 3.214 . 4.505 2.483 1.920 2.794 0.003 21 0 "[ . 1 . 2 .]" 1 57 1 6 ARG H 1 54 MET QB 5.430 . 9.115 6.247 5.130 7.650 . 0 0 "[ . 1 . 2 .]" 1 58 1 6 ARG H 1 39 THR MG 3.176 . 4.437 2.594 2.360 2.951 . 0 0 "[ . 1 . 2 .]" 1 59 1 6 ARG H 1 107 HIS HB2 5.778 . 9.952 7.793 5.569 9.122 . 0 0 "[ . 1 . 2 .]" 1 60 1 6 ARG HA 1 6 ARG QB 2.130 . 2.697 2.124 2.082 2.143 . 0 0 "[ . 1 . 2 .]" 1 61 1 6 ARG HA 1 6 ARG QB 3.069 . 4.247 2.114 2.092 2.142 . 0 0 "[ . 1 . 2 .]" 1 62 1 6 ARG HA 1 6 ARG QB 2.818 . 3.810 2.005 1.980 2.029 . 0 0 "[ . 1 . 2 .]" 1 63 1 6 ARG HA 1 6 ARG QB 3.236 . 4.545 2.157 2.123 2.192 . 0 0 "[ . 1 . 2 .]" 1 64 1 6 ARG HA 1 6 ARG QG 2.634 . 3.501 2.104 1.830 2.561 . 0 0 "[ . 1 . 2 .]" 1 65 1 6 ARG QB 1 6 ARG QD 3.187 . 4.457 2.025 1.890 2.227 0.027 4 0 "[ . 1 . 2 .]" 1 66 1 6 ARG QB 1 6 ARG QD 2.995 . 4.116 1.976 1.842 2.203 0.032 21 0 "[ . 1 . 2 .]" 1 67 1 6 ARG QB 1 6 ARG QD 3.019 . 4.158 2.212 1.982 2.634 . 0 0 "[ . 1 . 2 .]" 1 68 1 6 ARG QB 1 6 ARG QD 2.852 . 3.869 2.163 1.950 2.443 . 0 0 "[ . 1 . 2 .]" 1 69 1 6 ARG QB 1 6 ARG QG 1.952 . 2.428 1.809 1.747 1.905 . 0 0 "[ . 1 . 2 .]" 1 70 1 6 ARG QB 1 6 ARG QG 1.639 . 1.975 1.915 1.841 1.960 . 0 0 "[ . 1 . 2 .]" 1 71 1 6 ARG QB 1 7 LYS H 2.021 . 2.532 2.336 1.765 2.767 0.235 18 0 "[ . 1 . 2 .]" 1 72 1 6 ARG QB 1 7 LYS H 2.877 . 3.912 2.061 1.636 2.584 0.206 6 0 "[ . 1 . 2 .]" 1 73 1 6 ARG QB 1 7 LYS H 2.826 . 3.825 2.123 1.719 2.625 0.108 23 0 "[ . 1 . 2 .]" 1 74 1 6 ARG QB 1 8 GLY H 3.496 . 5.024 3.449 2.794 3.801 . 0 0 "[ . 1 . 2 .]" 1 75 1 6 ARG QB 1 8 GLY H 4.496 . 7.023 3.040 2.675 3.267 . 0 0 "[ . 1 . 2 .]" 1 76 1 6 ARG QB 1 54 MET H 4.444 . 6.913 6.554 5.274 6.881 . 0 0 "[ . 1 . 2 .]" 1 77 1 6 ARG QB 1 107 HIS HB3 4.381 . 6.780 5.398 2.974 7.653 0.873 23 1 "[ . 1 . 2 + .]" 1 78 1 6 ARG QD 1 39 THR H 5.670 . 9.689 6.800 5.949 7.373 . 0 0 "[ . 1 . 2 .]" 1 79 1 6 ARG QG 1 7 LYS H 2.996 . 4.118 3.023 2.205 3.321 . 0 0 "[ . 1 . 2 .]" 1 80 1 6 ARG QG 1 10 GLY HA3 5.448 . 9.157 5.910 2.266 8.440 . 0 0 "[ . 1 . 2 .]" 1 81 1 6 ARG QG 1 55 ALA HA 3.911 . 5.823 3.414 2.489 3.857 . 0 0 "[ . 1 . 2 .]" 1 82 1 6 ARG QG 1 57 THR MG 4.871 . 7.837 7.457 4.655 8.022 0.185 11 0 "[ . 1 . 2 .]" 1 83 1 7 LYS H 1 7 LYS QB 2.963 . 4.060 2.212 2.090 2.550 . 0 0 "[ . 1 . 2 .]" 1 84 1 7 LYS H 1 7 LYS QD 3.507 . 5.044 2.311 2.072 2.429 . 0 0 "[ . 1 . 2 .]" 1 85 1 7 LYS H 1 7 LYS QD 3.858 . 5.719 3.357 1.970 3.818 0.027 8 0 "[ . 1 . 2 .]" 1 86 1 7 LYS H 1 7 LYS QG 2.687 . 3.589 2.024 1.774 2.538 0.011 19 0 "[ . 1 . 2 .]" 1 87 1 7 LYS HA 1 7 LYS QG 2.759 . 3.710 2.405 2.135 2.629 . 0 0 "[ . 1 . 2 .]" 1 88 1 7 LYS HA 1 8 GLY H 3.660 . 5.334 2.878 2.138 3.510 . 0 0 "[ . 1 . 2 .]" 1 89 1 7 LYS QB 1 8 GLY QA 4.784 . 7.644 3.997 3.299 4.318 . 0 0 "[ . 1 . 2 .]" 1 90 1 7 LYS QB 1 10 GLY H 3.412 . 4.868 3.785 2.360 4.829 . 0 0 "[ . 1 . 2 .]" 1 91 1 7 LYS QB 1 10 GLY HA2 3.893 . 5.788 4.568 2.489 5.863 0.075 11 0 "[ . 1 . 2 .]" 1 92 1 7 LYS QB 1 10 GLY HA3 4.668 . 7.392 4.224 2.573 4.695 . 0 0 "[ . 1 . 2 .]" 1 93 1 7 LYS QB 1 56 TYR HB2 3.519 . 5.067 3.400 3.118 3.669 . 0 0 "[ . 1 . 2 .]" 1 94 1 7 LYS QB 1 37 LYS H 4.296 . 6.603 6.812 6.430 6.993 0.390 8 0 "[ . 1 . 2 .]" 1 95 1 7 LYS QB 1 59 ALA MB 3.761 . 5.529 5.606 5.139 5.953 0.424 23 0 "[ . 1 . 2 .]" 1 96 1 7 LYS QB 1 56 TYR H 3.430 . 4.900 4.021 3.833 4.239 . 0 0 "[ . 1 . 2 .]" 1 97 1 7 LYS QB 1 56 TYR H 3.723 . 5.455 4.327 3.990 4.571 . 0 0 "[ . 1 . 2 .]" 1 98 1 7 LYS QB 1 55 ALA H 3.775 . 5.556 4.940 4.411 5.238 . 0 0 "[ . 1 . 2 .]" 1 99 1 7 LYS QB 1 56 TYR H 3.664 . 5.342 3.442 2.392 4.703 . 0 0 "[ . 1 . 2 .]" 1 100 1 7 LYS QB 1 57 THR HA 4.859 . 7.811 5.418 3.784 6.444 . 0 0 "[ . 1 . 2 .]" 1 101 1 7 LYS QB 1 59 ALA H 4.774 . 7.623 6.577 5.781 7.735 0.112 12 0 "[ . 1 . 2 .]" 1 102 1 7 LYS QD 1 7 LYS QG 1.930 . 2.395 1.712 1.691 1.740 . 0 0 "[ . 1 . 2 .]" 1 103 1 7 LYS QD 1 7 LYS QG 1.908 . 2.363 1.844 1.820 1.864 . 0 0 "[ . 1 . 2 .]" 1 104 1 7 LYS QD 1 7 LYS QG 1.849 . 2.276 1.709 1.688 1.742 . 0 0 "[ . 1 . 2 .]" 1 105 1 7 LYS QD 1 107 HIS HA 3.196 . 4.473 3.728 2.356 4.111 . 0 0 "[ . 1 . 2 .]" 1 106 1 7 LYS QD 1 107 HIS HD2 3.011 . 4.145 3.932 2.518 4.197 0.052 11 0 "[ . 1 . 2 .]" 1 107 1 7 LYS QD 1 56 TYR QE 4.220 . 6.446 2.638 2.104 3.297 . 0 0 "[ . 1 . 2 .]" 1 108 1 7 LYS QD 1 56 TYR HB2 5.278 . 8.760 5.034 4.059 5.982 . 0 0 "[ . 1 . 2 .]" 1 109 1 7 LYS QD 1 56 TYR QE 4.166 . 6.336 3.575 2.405 4.952 . 0 0 "[ . 1 . 2 .]" 1 110 1 7 LYS HD3 1 8 GLY H 4.677 . 7.412 5.310 3.651 6.831 . 0 0 "[ . 1 . 2 .]" 1 111 1 7 LYS QE 1 7 LYS QG 2.871 . 3.901 1.947 1.820 2.160 0.021 4 0 "[ . 1 . 2 .]" 1 112 1 7 LYS QE 1 11 ARG H 5.592 . 9.501 7.048 3.101 9.358 . 0 0 "[ . 1 . 2 .]" 1 113 1 7 LYS QG 1 8 GLY QA 4.369 . 6.755 3.296 3.010 3.607 . 0 0 "[ . 1 . 2 .]" 1 114 1 7 LYS QG 1 56 TYR HB2 3.728 . 5.465 3.459 2.039 4.091 . 0 0 "[ . 1 . 2 .]" 1 115 1 7 LYS QG 1 38 VAL H 4.285 . 6.580 6.696 5.376 6.851 0.271 8 0 "[ . 1 . 2 .]" 1 116 1 8 GLY QA 1 9 ALA H 2.638 . 3.508 2.639 2.240 2.857 . 0 0 "[ . 1 . 2 .]" 1 117 1 8 GLY QA 1 9 ALA H 2.325 . 3.000 2.404 2.155 2.521 . 0 0 "[ . 1 . 2 .]" 1 118 1 8 GLY QA 1 9 ALA MB 4.308 . 6.628 3.325 3.026 3.661 . 0 0 "[ . 1 . 2 .]" 1 119 1 8 GLY QA 1 10 GLY H 4.710 . 7.482 4.474 2.992 5.379 . 0 0 "[ . 1 . 2 .]" 1 120 1 8 GLY HA3 1 9 ALA H 2.278 . 2.927 3.173 2.268 3.557 0.630 17 11 "[* * . -*1 **.*+ *2 ** .]" 1 121 1 8 GLY HA3 1 9 ALA MB 3.982 . 5.964 4.142 3.773 4.457 . 0 0 "[ . 1 . 2 .]" 1 122 1 9 ALA H 1 9 ALA HA 2.874 . 3.907 2.783 2.259 2.949 . 0 0 "[ . 1 . 2 .]" 1 123 1 9 ALA H 1 9 ALA HA 3.372 . 4.793 2.704 2.241 2.846 . 0 0 "[ . 1 . 2 .]" 1 124 1 9 ALA H 1 9 ALA MB 2.459 . 3.215 2.690 2.248 2.983 . 0 0 "[ . 1 . 2 .]" 1 125 1 9 ALA H 1 9 ALA MB 2.723 . 3.650 1.959 1.778 2.352 0.018 4 0 "[ . 1 . 2 .]" 1 126 1 9 ALA H 1 10 GLY H 2.348 . 3.037 2.674 1.582 3.207 0.170 23 0 "[ . 1 . 2 .]" 1 127 1 9 ALA H 1 10 GLY H 2.196 . 2.799 2.335 1.572 2.536 0.021 22 0 "[ . 1 . 2 .]" 1 128 1 9 ALA H 1 91 GLN QG 5.375 . 8.986 8.430 6.290 9.102 0.116 23 0 "[ . 1 . 2 .]" 1 129 1 9 ALA H 1 57 THR HB 2.331 . 3.010 2.419 2.157 2.554 . 0 0 "[ . 1 . 2 .]" 1 130 1 9 ALA HA 1 9 ALA MB 2.023 . 2.534 2.129 2.120 2.140 . 0 0 "[ . 1 . 2 .]" 1 131 1 9 ALA HA 1 10 GLY H 3.052 . 4.216 3.500 3.279 3.580 . 0 0 "[ . 1 . 2 .]" 1 132 1 9 ALA MB 1 10 GLY H 2.309 . 2.975 2.255 1.790 3.160 0.185 7 0 "[ . 1 . 2 .]" 1 133 1 9 ALA MB 1 10 GLY HA3 4.290 . 6.590 4.224 4.018 4.726 . 0 0 "[ . 1 . 2 .]" 1 134 1 9 ALA MB 1 61 GLN HE21 4.003 . 6.006 5.402 4.693 6.022 0.016 16 0 "[ . 1 . 2 .]" 1 135 1 9 ALA MB 1 61 GLN HE22 4.038 . 6.076 5.826 5.215 6.171 0.095 12 0 "[ . 1 . 2 .]" 1 136 1 10 GLY H 1 10 GLY HA2 1.968 . 2.452 2.371 2.291 2.754 0.302 15 0 "[ . 1 . 2 .]" 1 137 1 10 GLY H 1 10 GLY HA2 2.275 . 2.922 2.211 1.970 2.660 . 0 0 "[ . 1 . 2 .]" 1 138 1 10 GLY H 1 10 GLY HA3 2.510 . 3.297 2.796 2.293 2.937 . 0 0 "[ . 1 . 2 .]" 1 139 1 10 GLY H 1 57 THR MG 4.069 . 6.138 4.452 2.936 6.182 0.044 23 0 "[ . 1 . 2 .]" 1 140 1 10 GLY HA2 1 11 ARG H 2.461 . 3.218 2.405 2.130 3.280 0.062 23 0 "[ . 1 . 2 .]" 1 141 1 10 GLY HA2 1 12 VAL H 4.902 . 7.905 6.232 5.779 6.451 . 0 0 "[ . 1 . 2 .]" 1 142 1 10 GLY HA3 1 11 ARG H 3.294 . 4.650 3.142 2.658 3.557 . 0 0 "[ . 1 . 2 .]" 1 143 1 10 GLY HA3 1 12 VAL H 4.679 . 7.415 6.343 5.957 6.689 . 0 0 "[ . 1 . 2 .]" 1 144 1 10 GLY HA3 1 88 LYS QB 4.596 . 7.237 5.609 2.309 6.871 . 0 0 "[ . 1 . 2 .]" 1 145 1 10 GLY HA3 1 83 MET ME 3.815 . 5.634 4.915 4.354 5.545 . 0 0 "[ . 1 . 2 .]" 1 146 1 10 GLY HA3 1 89 GLU QB 4.363 . 6.742 3.906 3.099 4.441 . 0 0 "[ . 1 . 2 .]" 1 147 1 11 ARG H 1 11 ARG HA 2.536 . 3.340 2.914 2.880 2.940 . 0 0 "[ . 1 . 2 .]" 1 148 1 11 ARG H 1 11 ARG HB2 2.501 . 3.283 2.742 2.400 2.922 . 0 0 "[ . 1 . 2 .]" 1 149 1 11 ARG H 1 11 ARG QG 2.736 . 3.671 2.303 2.043 2.435 . 0 0 "[ . 1 . 2 .]" 1 150 1 11 ARG H 1 11 ARG QG 2.745 . 3.687 2.344 2.181 2.499 . 0 0 "[ . 1 . 2 .]" 1 151 1 11 ARG H 1 11 ARG HG3 3.319 . 4.696 3.395 2.818 3.799 . 0 0 "[ . 1 . 2 .]" 1 152 1 11 ARG H 1 12 VAL H 3.724 . 5.457 4.336 4.163 4.532 . 0 0 "[ . 1 . 2 .]" 1 153 1 11 ARG H 1 12 VAL HB 4.543 . 7.123 4.931 3.717 6.256 . 0 0 "[ . 1 . 2 .]" 1 154 1 11 ARG H 1 12 VAL MG2 4.117 . 6.235 4.597 4.013 5.274 . 0 0 "[ . 1 . 2 .]" 1 155 1 11 ARG H 1 54 MET H 3.789 . 5.583 3.650 2.755 5.284 . 0 0 "[ . 1 . 2 .]" 1 156 1 11 ARG H 1 60 ALA MB 3.178 . 4.440 2.370 2.125 2.969 . 0 0 "[ . 1 . 2 .]" 1 157 1 11 ARG HA 1 11 ARG HB2 3.581 . 5.184 2.254 2.135 2.302 . 0 0 "[ . 1 . 2 .]" 1 158 1 11 ARG HA 1 11 ARG HB3 2.700 . 3.612 2.531 2.470 2.571 . 0 0 "[ . 1 . 2 .]" 1 159 1 11 ARG HA 1 11 ARG HB3 2.497 . 3.277 2.220 2.181 2.251 . 0 0 "[ . 1 . 2 .]" 1 160 1 11 ARG HA 1 11 ARG QG 2.898 . 3.948 2.367 2.246 2.516 . 0 0 "[ . 1 . 2 .]" 1 161 1 11 ARG HA 1 11 ARG HG3 3.092 . 4.287 3.119 2.974 3.333 . 0 0 "[ . 1 . 2 .]" 1 162 1 11 ARG HA 1 12 VAL H 2.967 . 4.067 2.237 2.165 2.369 . 0 0 "[ . 1 . 2 .]" 1 163 1 11 ARG HA 1 57 THR HA 3.407 . 4.858 4.252 4.102 4.422 . 0 0 "[ . 1 . 2 .]" 1 164 1 11 ARG HA 1 60 ALA MB 4.051 . 6.102 4.529 4.165 5.102 . 0 0 "[ . 1 . 2 .]" 1 165 1 11 ARG HB2 1 11 ARG HD3 2.389 . 3.102 2.952 2.438 3.185 0.083 15 0 "[ . 1 . 2 .]" 1 166 1 11 ARG HB2 1 12 VAL H 3.842 . 5.687 3.957 3.674 4.109 . 0 0 "[ . 1 . 2 .]" 1 167 1 11 ARG HB2 1 54 MET HA 4.139 . 6.281 5.952 5.586 6.285 0.004 14 0 "[ . 1 . 2 .]" 1 168 1 11 ARG HB2 1 54 MET H 3.574 . 5.170 4.708 4.029 5.195 0.025 14 0 "[ . 1 . 2 .]" 1 169 1 11 ARG HB2 1 58 GLU H 4.045 . 6.091 6.044 5.713 6.381 0.290 14 0 "[ . 1 . 2 .]" 1 170 1 11 ARG HB2 1 60 ALA HA 3.819 . 5.642 5.079 4.572 5.673 0.031 14 0 "[ . 1 . 2 .]" 1 171 1 11 ARG HB2 1 60 ALA MB 2.171 . 2.760 2.301 1.962 2.834 0.074 14 0 "[ . 1 . 2 .]" 1 172 1 11 ARG HB3 1 12 VAL MG2 3.941 . 5.883 3.090 2.178 4.333 . 0 0 "[ . 1 . 2 .]" 1 173 1 11 ARG HB3 1 64 VAL H 5.280 . 8.764 6.096 5.973 6.278 . 0 0 "[ . 1 . 2 .]" 1 174 1 11 ARG QD 1 11 ARG QG 2.780 . 3.746 1.827 1.781 1.862 0.033 8 0 "[ . 1 . 2 .]" 1 175 1 11 ARG QD 1 88 LYS QD 3.569 . 5.161 4.887 3.622 5.220 0.059 9 0 "[ . 1 . 2 .]" 1 176 1 11 ARG QG 1 12 VAL H 4.659 . 7.373 3.663 3.457 3.957 . 0 0 "[ . 1 . 2 .]" 1 177 1 11 ARG QG 1 61 GLN HE22 4.082 . 6.165 3.090 2.182 3.847 . 0 0 "[ . 1 . 2 .]" 1 178 1 11 ARG QG 1 89 GLU H 4.025 . 6.050 4.202 4.114 4.315 . 0 0 "[ . 1 . 2 .]" 1 179 1 11 ARG QG 1 83 MET H 5.197 . 8.573 6.782 6.494 6.969 . 0 0 "[ . 1 . 2 .]" 1 180 1 11 ARG QG 1 89 GLU H 5.119 . 8.395 5.710 5.411 5.968 . 0 0 "[ . 1 . 2 .]" 1 181 1 11 ARG QG 1 84 SER H 5.143 . 8.449 4.987 4.825 5.175 . 0 0 "[ . 1 . 2 .]" 1 182 1 11 ARG QG 1 61 GLN HE21 3.599 . 5.218 2.580 1.983 3.092 . 0 0 "[ . 1 . 2 .]" 1 183 1 12 VAL H 1 12 VAL HA 2.763 . 3.717 2.477 2.368 2.583 . 0 0 "[ . 1 . 2 .]" 1 184 1 12 VAL H 1 12 VAL HB 2.635 . 3.503 2.517 2.457 2.636 . 0 0 "[ . 1 . 2 .]" 1 185 1 12 VAL H 1 12 VAL MG1 3.806 . 5.617 3.794 3.770 3.834 . 0 0 "[ . 1 . 2 .]" 1 186 1 12 VAL H 1 12 VAL MG2 2.921 . 3.988 2.639 2.376 2.995 . 0 0 "[ . 1 . 2 .]" 1 187 1 12 VAL H 1 54 MET QG 4.353 . 6.721 5.268 4.803 5.715 . 0 0 "[ . 1 . 2 .]" 1 188 1 12 VAL H 1 60 ALA MB 3.987 . 5.974 3.727 3.564 3.959 . 0 0 "[ . 1 . 2 .]" 1 189 1 12 VAL H 1 83 MET HA 4.715 . 7.494 5.275 4.825 5.628 . 0 0 "[ . 1 . 2 .]" 1 190 1 12 VAL H 1 83 MET ME 3.778 . 5.562 4.036 3.729 4.359 . 0 0 "[ . 1 . 2 .]" 1 191 1 12 VAL H 1 84 SER HB2 3.683 . 5.378 4.980 3.329 5.558 0.180 5 0 "[ . 1 . 2 .]" 1 192 1 12 VAL H 1 88 LYS HE3 5.428 . 9.111 7.636 5.315 9.649 0.538 11 1 "[ . 1+ . 2 .]" 1 193 1 12 VAL HA 1 12 VAL MG1 2.501 . 3.283 2.454 2.402 2.496 . 0 0 "[ . 1 . 2 .]" 1 194 1 12 VAL HA 1 12 VAL MG2 2.231 . 2.853 2.315 2.269 2.345 . 0 0 "[ . 1 . 2 .]" 1 195 1 12 VAL HA 1 13 VAL H 2.154 . 2.734 2.148 2.088 2.240 . 0 0 "[ . 1 . 2 .]" 1 196 1 12 VAL HA 1 52 LEU H 3.502 . 5.035 3.310 2.989 3.579 . 0 0 "[ . 1 . 2 .]" 1 197 1 12 VAL HA 1 54 MET H 3.475 . 4.984 3.528 3.134 3.937 . 0 0 "[ . 1 . 2 .]" 1 198 1 12 VAL HA 1 84 SER H 4.688 . 7.436 5.152 4.926 5.505 . 0 0 "[ . 1 . 2 .]" 1 199 1 12 VAL HB 1 83 MET ME 3.037 . 4.190 4.268 4.180 4.401 0.211 10 0 "[ . 1 . 2 .]" 1 200 1 12 VAL HB 1 12 VAL MG1 2.091 . 2.637 2.131 2.129 2.135 . 0 0 "[ . 1 . 2 .]" 1 201 1 12 VAL HB 1 12 VAL MG2 2.047 . 2.571 2.124 2.118 2.128 . 0 0 "[ . 1 . 2 .]" 1 202 1 12 VAL HB 1 13 VAL H 4.163 . 6.329 4.123 4.087 4.158 . 0 0 "[ . 1 . 2 .]" 1 203 1 12 VAL HB 1 13 VAL MG2 3.815 . 5.634 3.861 3.712 4.003 . 0 0 "[ . 1 . 2 .]" 1 204 1 12 VAL HB 1 42 ILE H 5.570 . 9.447 6.506 5.748 6.895 . 0 0 "[ . 1 . 2 .]" 1 205 1 12 VAL HB 1 84 SER HB2 2.928 . 4.000 2.281 2.067 2.569 . 0 0 "[ . 1 . 2 .]" 1 206 1 12 VAL HB 1 87 TYR H 3.658 . 5.330 3.198 3.022 3.415 . 0 0 "[ . 1 . 2 .]" 1 207 1 12 VAL HB 1 84 SER HB2 2.936 . 4.013 2.293 2.071 2.600 . 0 0 "[ . 1 . 2 .]" 1 208 1 12 VAL HB 1 89 GLU H 3.958 . 5.916 4.744 4.416 5.022 . 0 0 "[ . 1 . 2 .]" 1 209 1 12 VAL HB 1 90 LEU H 3.848 . 5.699 5.617 5.267 5.778 0.079 14 0 "[ . 1 . 2 .]" 1 210 1 12 VAL HB 1 90 LEU MD2 3.782 . 5.570 3.937 3.776 4.207 . 0 0 "[ . 1 . 2 .]" 1 211 1 12 VAL MG1 1 54 MET ME 2.402 . 3.123 3.050 2.962 3.142 0.019 16 0 "[ . 1 . 2 .]" 1 212 1 12 VAL MG1 1 12 VAL MG2 1.852 . 2.281 2.071 2.049 2.080 . 0 0 "[ . 1 . 2 .]" 1 213 1 12 VAL MG1 1 12 VAL MG2 1.998 . 2.497 1.867 1.856 1.871 . 0 0 "[ . 1 . 2 .]" 1 214 1 12 VAL MG1 1 13 VAL H 2.386 . 3.098 2.516 2.381 2.588 . 0 0 "[ . 1 . 2 .]" 1 215 1 12 VAL MG1 1 13 VAL HA 2.458 . 3.213 1.950 1.828 2.088 . 0 0 "[ . 1 . 2 .]" 1 216 1 12 VAL MG1 1 61 GLN H 4.416 . 6.853 6.571 6.297 6.786 . 0 0 "[ . 1 . 2 .]" 1 217 1 12 VAL MG1 1 90 LEU MD1 2.123 . 2.686 2.126 1.957 2.234 . 0 0 "[ . 1 . 2 .]" 1 218 1 12 VAL MG1 1 89 GLU H 4.605 . 7.256 4.645 4.437 4.843 . 0 0 "[ . 1 . 2 .]" 1 219 1 12 VAL MG1 1 84 SER HB2 1.892 . 2.339 1.898 1.807 1.995 . 0 0 "[ . 1 . 2 .]" 1 220 1 12 VAL MG1 1 84 SER HB2 2.252 . 2.886 2.140 1.948 2.388 . 0 0 "[ . 1 . 2 .]" 1 221 1 12 VAL MG1 1 52 LEU HB2 2.897 . 3.946 2.107 1.870 2.373 . 0 0 "[ . 1 . 2 .]" 1 222 1 12 VAL MG1 1 90 LEU HG 3.279 . 4.623 2.591 2.379 2.895 . 0 0 "[ . 1 . 2 .]" 1 223 1 12 VAL MG1 1 60 ALA HA 4.449 . 6.924 5.982 5.854 6.134 . 0 0 "[ . 1 . 2 .]" 1 224 1 12 VAL MG1 1 54 MET H 5.068 . 8.279 4.240 4.111 4.363 . 0 0 "[ . 1 . 2 .]" 1 225 1 12 VAL MG1 1 87 TYR QD 4.048 . 6.096 3.240 2.886 3.408 . 0 0 "[ . 1 . 2 .]" 1 226 1 12 VAL MG1 1 51 PHE HB2 3.376 . 4.800 3.210 3.110 3.410 . 0 0 "[ . 1 . 2 .]" 1 227 1 12 VAL MG1 1 87 TYR QE 3.608 . 5.235 4.696 4.403 4.952 . 0 0 "[ . 1 . 2 .]" 1 228 1 12 VAL MG1 1 90 LEU MD2 2.214 . 2.827 1.982 1.839 2.227 . 0 0 "[ . 1 . 2 .]" 1 229 1 12 VAL MG1 1 51 PHE HA 3.259 . 4.586 3.049 2.912 3.375 . 0 0 "[ . 1 . 2 .]" 1 230 1 12 VAL MG1 1 51 PHE HB3 2.906 . 3.962 2.051 1.921 2.344 . 0 0 "[ . 1 . 2 .]" 1 231 1 12 VAL MG1 1 51 PHE QD 2.976 . 4.083 2.571 2.321 2.954 . 0 0 "[ . 1 . 2 .]" 1 232 1 12 VAL MG1 1 51 PHE QE 3.913 . 5.827 4.364 4.070 4.704 . 0 0 "[ . 1 . 2 .]" 1 233 1 12 VAL MG1 1 52 LEU H 2.270 . 2.914 2.530 2.375 2.815 . 0 0 "[ . 1 . 2 .]" 1 234 1 12 VAL MG1 1 53 GLU HA 2.818 . 3.811 2.632 2.344 3.074 . 0 0 "[ . 1 . 2 .]" 1 235 1 12 VAL MG1 1 84 SER H 3.648 . 5.312 3.839 3.701 4.119 . 0 0 "[ . 1 . 2 .]" 1 236 1 12 VAL MG1 1 84 SER HB3 2.631 . 3.496 2.915 2.345 4.010 0.514 2 1 "[ + . 1 . 2 .]" 1 237 1 12 VAL MG1 1 87 TYR QD 3.760 . 5.527 3.595 3.025 3.990 . 0 0 "[ . 1 . 2 .]" 1 238 1 12 VAL MG1 1 89 GLU H 4.342 . 6.698 5.216 4.923 5.432 . 0 0 "[ . 1 . 2 .]" 1 239 1 12 VAL MG1 1 90 LEU MD2 2.185 . 2.782 2.192 1.954 2.779 . 0 0 "[ . 1 . 2 .]" 1 240 1 12 VAL MG2 1 13 VAL H 3.598 . 5.216 3.862 3.739 3.932 . 0 0 "[ . 1 . 2 .]" 1 241 1 12 VAL MG2 1 39 THR H 4.306 . 6.624 4.162 4.064 4.263 . 0 0 "[ . 1 . 2 .]" 1 242 1 12 VAL MG2 1 42 ILE H 3.984 . 5.968 4.469 4.420 4.521 . 0 0 "[ . 1 . 2 .]" 1 243 1 12 VAL MG2 1 90 LEU HG 1.899 . 2.350 1.643 1.580 1.773 . 0 0 "[ . 1 . 2 .]" 1 244 1 12 VAL MG2 1 51 PHE QE 4.765 . 7.604 4.820 4.616 5.055 . 0 0 "[ . 1 . 2 .]" 1 245 1 12 VAL MG2 1 90 LEU HG 1.617 . 1.944 1.805 1.733 1.920 . 0 0 "[ . 1 . 2 .]" 1 246 1 12 VAL MG2 1 53 GLU HG3 3.452 . 4.941 3.031 2.170 4.452 . 0 0 "[ . 1 . 2 .]" 1 247 1 12 VAL MG2 1 90 LEU HG 1.622 . 1.951 1.649 1.575 1.852 . 0 0 "[ . 1 . 2 .]" 1 248 1 12 VAL MG2 1 60 ALA MB 2.755 . 3.704 3.375 3.293 3.496 . 0 0 "[ . 1 . 2 .]" 1 249 1 12 VAL MG2 1 89 GLU QB 3.850 . 5.703 3.388 3.291 3.557 . 0 0 "[ . 1 . 2 .]" 1 250 1 12 VAL MG2 1 89 GLU HA 2.107 . 2.662 1.808 1.711 1.904 . 0 0 "[ . 1 . 2 .]" 1 251 1 12 VAL MG2 1 40 ASN H 4.775 . 7.625 3.872 3.668 4.160 . 0 0 "[ . 1 . 2 .]" 1 252 1 12 VAL MG2 1 42 ILE HB 3.748 . 5.504 5.563 5.441 5.633 0.129 10 0 "[ . 1 . 2 .]" 1 253 1 12 VAL MG2 1 53 GLU QB 1.871 . 2.309 2.058 1.968 2.095 . 0 0 "[ . 1 . 2 .]" 1 254 1 12 VAL MG2 1 53 GLU QB 2.139 . 2.711 1.986 1.893 2.059 . 0 0 "[ . 1 . 2 .]" 1 255 1 12 VAL MG2 1 51 PHE QD 3.914 . 5.829 3.991 3.744 4.264 . 0 0 "[ . 1 . 2 .]" 1 256 1 12 VAL MG2 1 90 LEU MD1 2.694 . 3.601 2.876 2.756 3.007 . 0 0 "[ . 1 . 2 .]" 1 257 1 12 VAL MG2 1 53 GLU H 4.165 . 6.334 4.547 4.259 4.817 . 0 0 "[ . 1 . 2 .]" 1 258 1 12 VAL MG2 1 53 GLU HA 2.253 . 2.888 2.747 2.329 2.950 0.062 10 0 "[ . 1 . 2 .]" 1 259 1 12 VAL MG2 1 53 GLU QB 3.029 . 4.176 2.863 2.341 3.290 . 0 0 "[ . 1 . 2 .]" 1 260 1 12 VAL MG2 1 53 GLU QB 2.426 . 3.162 2.250 2.087 2.340 . 0 0 "[ . 1 . 2 .]" 1 261 1 12 VAL MG2 1 54 MET H 4.691 . 7.442 4.072 3.606 4.323 . 0 0 "[ . 1 . 2 .]" 1 262 1 12 VAL MG2 1 54 MET H 3.453 . 4.944 2.981 2.847 3.115 . 0 0 "[ . 1 . 2 .]" 1 263 1 12 VAL MG2 1 54 MET QB 3.973 . 5.946 2.871 2.567 3.240 . 0 0 "[ . 1 . 2 .]" 1 264 1 12 VAL MG2 1 84 SER H 5.020 . 8.170 5.554 5.343 5.880 . 0 0 "[ . 1 . 2 .]" 1 265 1 12 VAL MG2 1 84 SER HB2 3.446 . 4.931 3.374 3.181 3.606 . 0 0 "[ . 1 . 2 .]" 1 266 1 12 VAL MG2 1 87 TYR H 4.739 . 7.546 4.088 3.904 4.394 . 0 0 "[ . 1 . 2 .]" 1 267 1 12 VAL MG2 1 87 TYR QD 4.473 . 6.974 3.518 3.163 3.925 . 0 0 "[ . 1 . 2 .]" 1 268 1 12 VAL MG2 1 87 TYR QE 4.395 . 6.810 4.688 3.956 5.242 . 0 0 "[ . 1 . 2 .]" 1 269 1 12 VAL MG2 1 87 TYR HB3 3.664 . 5.342 2.321 2.130 2.669 . 0 0 "[ . 1 . 2 .]" 1 270 1 12 VAL MG2 1 89 GLU H 3.467 . 4.969 3.082 2.854 3.292 . 0 0 "[ . 1 . 2 .]" 1 271 1 12 VAL MG2 1 89 GLU HA 2.032 . 2.548 2.141 1.878 2.492 . 0 0 "[ . 1 . 2 .]" 1 272 1 12 VAL MG2 1 90 LEU H 2.749 . 3.693 2.773 2.533 2.932 . 0 0 "[ . 1 . 2 .]" 1 273 1 12 VAL MG2 1 90 LEU HA 3.682 . 5.376 3.449 3.221 3.651 . 0 0 "[ . 1 . 2 .]" 1 274 1 12 VAL MG2 1 90 LEU MD1 2.652 . 3.531 3.152 2.999 3.378 . 0 0 "[ . 1 . 2 .]" 1 275 1 12 VAL MG2 1 90 LEU MD2 2.405 . 3.128 2.447 2.159 2.604 . 0 0 "[ . 1 . 2 .]" 1 276 1 12 VAL MG2 1 90 LEU HG 1.934 . 2.402 1.957 1.836 2.189 . 0 0 "[ . 1 . 2 .]" 1 277 1 12 VAL MG2 1 91 GLN HA 5.019 . 8.168 6.607 6.351 6.829 . 0 0 "[ . 1 . 2 .]" 1 278 1 13 VAL H 1 13 VAL HB 2.564 . 3.385 2.528 2.480 2.582 . 0 0 "[ . 1 . 2 .]" 1 279 1 13 VAL H 1 13 VAL HB 2.337 . 3.020 2.437 2.392 2.514 . 0 0 "[ . 1 . 2 .]" 1 280 1 13 VAL H 1 13 VAL MG1 3.137 . 4.367 3.787 3.763 3.815 . 0 0 "[ . 1 . 2 .]" 1 281 1 13 VAL H 1 13 VAL MG1 3.262 . 4.592 3.688 3.642 3.743 . 0 0 "[ . 1 . 2 .]" 1 282 1 13 VAL H 1 13 VAL MG2 2.349 . 3.039 2.515 2.342 2.641 . 0 0 "[ . 1 . 2 .]" 1 283 1 13 VAL H 1 14 HIS H 4.831 . 7.748 4.473 4.447 4.502 . 0 0 "[ . 1 . 2 .]" 1 284 1 13 VAL H 1 52 LEU H 2.840 . 3.848 2.979 2.710 3.459 . 0 0 "[ . 1 . 2 .]" 1 285 1 13 VAL H 1 52 LEU HB2 3.665 . 5.344 4.778 4.541 5.366 0.022 10 0 "[ . 1 . 2 .]" 1 286 1 13 VAL H 1 52 LEU HB3 3.453 . 4.943 3.460 3.236 4.020 . 0 0 "[ . 1 . 2 .]" 1 287 1 13 VAL H 1 54 MET H 5.381 . 9.000 4.578 4.091 4.874 . 0 0 "[ . 1 . 2 .]" 1 288 1 13 VAL HA 1 13 VAL MG1 2.542 . 3.350 2.400 2.347 2.446 . 0 0 "[ . 1 . 2 .]" 1 289 1 13 VAL HA 1 13 VAL MG2 2.046 . 2.569 2.387 2.322 2.471 . 0 0 "[ . 1 . 2 .]" 1 290 1 13 VAL HA 1 13 VAL MG2 1.762 . 2.150 1.991 1.972 2.015 . 0 0 "[ . 1 . 2 .]" 1 291 1 13 VAL HA 1 14 HIS H 2.134 . 2.703 2.203 2.126 2.242 . 0 0 "[ . 1 . 2 .]" 1 292 1 13 VAL HA 1 15 ILE MD 3.865 . 5.732 3.590 2.916 3.766 . 0 0 "[ . 1 . 2 .]" 1 293 1 13 VAL HA 1 83 MET ME 2.766 . 3.722 3.134 2.871 3.749 0.027 14 0 "[ . 1 . 2 .]" 1 294 1 13 VAL HA 1 84 SER H 2.002 . 2.503 2.456 2.259 2.582 0.079 19 0 "[ . 1 . 2 .]" 1 295 1 13 VAL HB 1 13 VAL MG1 1.654 . 1.996 2.111 2.107 2.114 0.118 14 0 "[ . 1 . 2 .]" 1 296 1 13 VAL HB 1 13 VAL MG1 1.507 . 1.791 1.676 1.621 1.733 . 0 0 "[ . 1 . 2 .]" 1 297 1 13 VAL HB 1 13 VAL MG1 1.535 . 1.829 1.769 1.716 1.833 0.004 12 0 "[ . 1 . 2 .]" 1 298 1 13 VAL HB 1 13 VAL MG2 2.182 . 2.777 2.126 2.123 2.130 . 0 0 "[ . 1 . 2 .]" 1 299 1 13 VAL HB 1 13 VAL MG2 2.004 . 2.506 1.916 1.825 1.952 . 0 0 "[ . 1 . 2 .]" 1 300 1 13 VAL HB 1 14 HIS H 3.594 . 5.208 4.097 4.017 4.184 . 0 0 "[ . 1 . 2 .]" 1 301 1 13 VAL HB 1 15 ILE MD 2.375 . 3.080 2.916 2.654 3.136 0.056 1 0 "[ . 1 . 2 .]" 1 302 1 13 VAL HB 1 15 ILE MG 3.907 . 5.815 4.235 4.061 4.364 . 0 0 "[ . 1 . 2 .]" 1 303 1 13 VAL HB 1 42 ILE H 4.584 . 7.210 5.341 4.936 5.588 . 0 0 "[ . 1 . 2 .]" 1 304 1 13 VAL HB 1 28 VAL HA 4.123 . 6.247 6.286 6.107 6.407 0.160 25 0 "[ . 1 . 2 .]" 1 305 1 13 VAL HB 1 67 TYR QD 3.524 . 5.076 3.766 3.573 3.892 . 0 0 "[ . 1 . 2 .]" 1 306 1 13 VAL HB 1 81 ILE MG 2.385 . 3.096 2.475 2.175 2.652 . 0 0 "[ . 1 . 2 .]" 1 307 1 13 VAL HB 1 81 ILE MG 2.089 . 2.635 2.655 2.194 2.751 0.116 11 0 "[ . 1 . 2 .]" 1 308 1 13 VAL HB 1 81 ILE MD 3.144 . 4.379 3.971 3.811 4.164 . 0 0 "[ . 1 . 2 .]" 1 309 1 13 VAL HB 1 32 GLY HA2 3.661 . 5.336 3.487 2.978 3.801 . 0 0 "[ . 1 . 2 .]" 1 310 1 13 VAL HB 1 52 LEU H 3.624 . 5.266 3.385 3.201 3.547 . 0 0 "[ . 1 . 2 .]" 1 311 1 13 VAL HB 1 67 TYR QD 4.154 . 6.310 4.010 3.910 4.054 . 0 0 "[ . 1 . 2 .]" 1 312 1 13 VAL HB 1 67 TYR QE 3.148 . 4.387 4.379 4.186 4.488 0.101 23 0 "[ . 1 . 2 .]" 1 313 1 13 VAL HB 1 81 ILE MG 2.518 . 3.310 3.333 3.226 3.427 0.117 3 0 "[ . 1 . 2 .]" 1 314 1 13 VAL HB 1 82 ARG H 4.742 . 7.553 5.068 4.872 5.244 . 0 0 "[ . 1 . 2 .]" 1 315 1 13 VAL MG1 1 13 VAL MG2 1.662 . 2.007 2.068 2.061 2.078 0.071 23 0 "[ . 1 . 2 .]" 1 316 1 13 VAL MG1 1 14 HIS H 2.392 . 3.107 2.532 2.453 2.686 . 0 0 "[ . 1 . 2 .]" 1 317 1 13 VAL MG1 1 81 ILE MG 1.289 . 1.497 1.536 1.504 1.566 0.069 14 0 "[ . 1 . 2 .]" 1 318 1 13 VAL MG1 1 82 ARG H 3.365 . 4.780 2.615 2.339 2.842 . 0 0 "[ . 1 . 2 .]" 1 319 1 13 VAL MG1 1 64 VAL HA 2.704 . 3.618 2.967 2.705 3.149 . 0 0 "[ . 1 . 2 .]" 1 320 1 13 VAL MG1 1 64 VAL HA 2.888 . 3.931 2.940 2.690 3.108 . 0 0 "[ . 1 . 2 .]" 1 321 1 13 VAL MG1 1 64 VAL H 3.315 . 4.688 2.737 2.554 3.030 . 0 0 "[ . 1 . 2 .]" 1 322 1 13 VAL MG1 1 64 VAL H 3.066 . 4.241 2.745 2.560 3.047 . 0 0 "[ . 1 . 2 .]" 1 323 1 13 VAL MG1 1 32 GLY HA2 3.508 . 5.046 3.352 3.152 3.503 . 0 0 "[ . 1 . 2 .]" 1 324 1 13 VAL MG1 1 82 ARG QD 3.365 . 4.780 3.679 3.383 3.905 . 0 0 "[ . 1 . 2 .]" 1 325 1 13 VAL MG1 1 35 PHE H 4.580 . 7.202 6.304 6.182 6.494 . 0 0 "[ . 1 . 2 .]" 1 326 1 13 VAL MG1 1 82 ARG H 2.711 . 3.630 2.682 2.378 2.935 . 0 0 "[ . 1 . 2 .]" 1 327 1 13 VAL MG1 1 87 TYR H 5.306 . 8.825 7.272 7.008 7.737 . 0 0 "[ . 1 . 2 .]" 1 328 1 13 VAL MG1 1 52 LEU H 3.707 . 5.425 3.868 3.744 3.934 . 0 0 "[ . 1 . 2 .]" 1 329 1 13 VAL MG1 1 83 MET HG2 2.815 . 3.805 3.810 3.666 3.898 0.093 17 0 "[ . 1 . 2 .]" 1 330 1 13 VAL MG1 1 63 MET H 4.397 . 6.814 6.118 5.865 6.345 . 0 0 "[ . 1 . 2 .]" 1 331 1 13 VAL MG1 1 81 ILE HA 2.381 . 3.090 2.430 2.386 2.493 . 0 0 "[ . 1 . 2 .]" 1 332 1 13 VAL MG1 1 81 ILE H 3.938 . 5.877 5.367 5.202 5.536 . 0 0 "[ . 1 . 2 .]" 1 333 1 13 VAL MG1 1 81 ILE HA 3.247 . 4.565 3.463 3.220 3.766 . 0 0 "[ . 1 . 2 .]" 1 334 1 13 VAL MG1 1 82 ARG H 3.090 . 4.284 2.743 2.401 3.059 . 0 0 "[ . 1 . 2 .]" 1 335 1 13 VAL MG1 1 83 MET HA 2.917 . 3.981 3.138 2.948 3.410 . 0 0 "[ . 1 . 2 .]" 1 336 1 13 VAL MG2 1 54 MET QB 4.142 . 6.286 3.430 3.112 3.597 . 0 0 "[ . 1 . 2 .]" 1 337 1 13 VAL MG2 1 14 HIS H 3.843 . 5.689 3.988 3.841 4.114 . 0 0 "[ . 1 . 2 .]" 1 338 1 13 VAL MG2 1 81 ILE MG 2.788 . 3.760 3.088 2.927 3.249 . 0 0 "[ . 1 . 2 .]" 1 339 1 13 VAL MG2 1 16 CYS H 4.816 . 7.715 7.483 7.205 7.620 . 0 0 "[ . 1 . 2 .]" 1 340 1 13 VAL MG2 1 67 TYR QD 3.768 . 5.543 4.160 4.032 4.295 . 0 0 "[ . 1 . 2 .]" 1 341 1 13 VAL MG2 1 54 MET ME 1.628 . 1.959 1.683 1.643 1.699 . 0 0 "[ . 1 . 2 .]" 1 342 1 13 VAL MG2 1 64 VAL H 3.676 . 5.365 3.471 3.408 3.549 . 0 0 "[ . 1 . 2 .]" 1 343 1 13 VAL MG2 1 67 TYR QE 3.967 . 5.935 4.228 4.146 4.303 . 0 0 "[ . 1 . 2 .]" 1 344 1 13 VAL MG2 1 63 MET H 4.037 . 6.074 4.845 4.679 5.027 . 0 0 "[ . 1 . 2 .]" 1 345 1 13 VAL MG2 1 82 ARG QG 3.203 . 4.485 4.530 4.376 4.645 0.160 19 0 "[ . 1 . 2 .]" 1 346 1 13 VAL MG2 1 63 MET ME 3.539 . 5.105 3.225 3.038 3.583 . 0 0 "[ . 1 . 2 .]" 1 347 1 13 VAL MG2 1 51 PHE H 4.840 . 7.768 6.416 6.218 6.534 . 0 0 "[ . 1 . 2 .]" 1 348 1 13 VAL MG2 1 54 MET H 4.480 . 6.989 4.076 3.729 4.311 . 0 0 "[ . 1 . 2 .]" 1 349 1 13 VAL MG2 1 52 LEU H 4.088 . 6.177 4.525 4.345 4.696 . 0 0 "[ . 1 . 2 .]" 1 350 1 13 VAL MG2 1 52 LEU HB2 3.713 . 5.437 4.381 4.221 4.503 . 0 0 "[ . 1 . 2 .]" 1 351 1 13 VAL MG2 1 64 VAL MG2 1.551 . 1.852 1.783 1.724 1.837 . 0 0 "[ . 1 . 2 .]" 1 352 1 13 VAL MG2 1 54 MET ME 1.823 . 2.238 2.185 1.986 2.277 0.039 7 0 "[ . 1 . 2 .]" 1 353 1 13 VAL MG2 1 54 MET QG 3.286 . 4.635 2.679 2.073 3.423 . 0 0 "[ . 1 . 2 .]" 1 354 1 13 VAL MG2 1 60 ALA H 3.833 . 5.670 4.835 4.558 5.031 . 0 0 "[ . 1 . 2 .]" 1 355 1 13 VAL MG2 1 60 ALA HA 2.296 . 2.955 2.788 2.493 2.973 0.018 9 0 "[ . 1 . 2 .]" 1 356 1 13 VAL MG2 1 63 MET QG 2.801 . 3.782 2.399 2.257 2.853 . 0 0 "[ . 1 . 2 .]" 1 357 1 13 VAL MG2 1 82 ARG H 4.143 . 6.289 5.036 4.582 5.435 . 0 0 "[ . 1 . 2 .]" 1 358 1 13 VAL MG2 1 83 MET ME 2.811 . 3.798 1.895 1.804 2.064 0.020 10 0 "[ . 1 . 2 .]" 1 359 1 13 VAL MG2 1 84 SER H 4.076 . 6.153 3.865 3.574 4.081 . 0 0 "[ . 1 . 2 .]" 1 360 1 14 HIS H 1 14 HIS HB2 2.848 . 3.862 3.572 2.737 3.834 . 0 0 "[ . 1 . 2 .]" 1 361 1 14 HIS H 1 14 HIS HB3 2.885 . 3.925 2.713 2.320 3.036 . 0 0 "[ . 1 . 2 .]" 1 362 1 14 HIS H 1 15 ILE H 4.211 . 6.428 4.404 4.279 4.466 . 0 0 "[ . 1 . 2 .]" 1 363 1 14 HIS H 1 81 ILE MG 3.897 . 5.795 4.483 4.222 4.725 . 0 0 "[ . 1 . 2 .]" 1 364 1 14 HIS H 1 82 ARG H 2.994 . 4.114 3.493 3.253 3.693 . 0 0 "[ . 1 . 2 .]" 1 365 1 14 HIS H 1 82 ARG QG 3.980 . 5.960 4.069 3.272 5.914 . 0 0 "[ . 1 . 2 .]" 1 366 1 14 HIS H 1 83 MET H 4.435 . 6.893 4.793 4.651 5.137 . 0 0 "[ . 1 . 2 .]" 1 367 1 14 HIS H 1 83 MET HA 3.628 . 5.273 3.515 3.377 3.889 . 0 0 "[ . 1 . 2 .]" 1 368 1 14 HIS H 1 84 SER H 3.022 . 4.164 3.250 3.058 3.521 . 0 0 "[ . 1 . 2 .]" 1 369 1 14 HIS H 1 84 SER HB2 4.239 . 6.486 3.281 2.576 4.814 . 0 0 "[ . 1 . 2 .]" 1 370 1 14 HIS H 1 84 SER HB3 3.539 . 5.105 4.272 3.000 5.021 . 0 0 "[ . 1 . 2 .]" 1 371 1 14 HIS HA 1 14 HIS HD2 3.037 . 4.190 3.811 2.349 4.332 0.142 2 0 "[ . 1 . 2 .]" 1 372 1 14 HIS HA 1 15 ILE H 2.477 . 3.244 2.143 2.099 2.177 . 0 0 "[ . 1 . 2 .]" 1 373 1 14 HIS HA 1 51 PHE HA 3.096 . 4.294 2.438 2.236 2.839 . 0 0 "[ . 1 . 2 .]" 1 374 1 14 HIS HA 1 51 PHE QD 4.069 . 6.138 3.165 2.839 3.444 . 0 0 "[ . 1 . 2 .]" 1 375 1 14 HIS HA 1 52 LEU H 3.744 . 5.497 3.458 3.010 4.026 . 0 0 "[ . 1 . 2 .]" 1 376 1 14 HIS HB2 1 14 HIS HD2 3.195 . 4.471 2.994 2.823 3.436 . 0 0 "[ . 1 . 2 .]" 1 377 1 14 HIS HB2 1 81 ILE MG 3.606 . 5.231 4.097 3.435 4.976 . 0 0 "[ . 1 . 2 .]" 1 378 1 14 HIS HB2 1 47 THR H 5.616 . 9.559 9.479 8.900 9.816 0.257 8 0 "[ . 1 . 2 .]" 1 379 1 14 HIS HB2 1 84 SER H 5.343 . 8.911 5.553 4.055 6.457 . 0 0 "[ . 1 . 2 .]" 1 380 1 14 HIS HB3 1 14 HIS HD2 3.390 . 4.826 3.937 3.901 3.992 . 0 0 "[ . 1 . 2 .]" 1 381 1 14 HIS HB3 1 15 ILE H 4.999 . 8.122 4.235 4.012 4.473 . 0 0 "[ . 1 . 2 .]" 1 382 1 14 HIS HB3 1 15 ILE H 4.001 . 6.002 3.526 3.425 3.592 . 0 0 "[ . 1 . 2 .]" 1 383 1 14 HIS HD2 1 15 ILE H 2.949 . 4.036 3.553 2.267 4.057 0.021 14 0 "[ . 1 . 2 .]" 1 384 1 14 HIS HD2 1 15 ILE H 3.093 . 4.289 3.366 2.101 3.953 . 0 0 "[ . 1 . 2 .]" 1 385 1 14 HIS HD2 1 15 ILE HB 3.843 . 5.689 4.018 2.346 5.177 . 0 0 "[ . 1 . 2 .]" 1 386 1 14 HIS HD2 1 15 ILE MD 4.050 . 6.100 6.050 5.292 6.274 0.174 24 0 "[ . 1 . 2 .]" 1 387 1 14 HIS HD2 1 49 GLN HB2 5.462 . 9.191 5.854 3.901 7.622 . 0 0 "[ . 1 . 2 .]" 1 388 1 14 HIS HD2 1 49 GLN HB3 4.011 . 6.022 4.236 2.216 5.944 . 0 0 "[ . 1 . 2 .]" 1 389 1 14 HIS HD2 1 49 GLN HE22 4.521 . 7.076 4.300 2.356 6.594 . 0 0 "[ . 1 . 2 .]" 1 390 1 14 HIS HD2 1 49 GLN QG 4.588 . 7.219 4.926 2.867 6.338 . 0 0 "[ . 1 . 2 .]" 1 391 1 14 HIS HD2 1 51 PHE QD 4.947 . 8.006 5.193 3.152 6.459 . 0 0 "[ . 1 . 2 .]" 1 392 1 15 ILE H 1 15 ILE HA 2.836 . 3.841 2.700 2.619 2.774 . 0 0 "[ . 1 . 2 .]" 1 393 1 15 ILE H 1 15 ILE HB 2.533 . 3.335 2.534 2.491 2.597 . 0 0 "[ . 1 . 2 .]" 1 394 1 15 ILE H 1 15 ILE MD 3.229 . 4.532 3.175 3.136 3.251 . 0 0 "[ . 1 . 2 .]" 1 395 1 15 ILE H 1 15 ILE MD 3.621 . 5.260 3.628 3.520 3.749 . 0 0 "[ . 1 . 2 .]" 1 396 1 15 ILE H 1 15 ILE MD 3.775 . 5.556 3.840 3.712 3.921 . 0 0 "[ . 1 . 2 .]" 1 397 1 15 ILE H 1 15 ILE HG12 4.191 . 6.387 3.893 3.789 3.985 . 0 0 "[ . 1 . 2 .]" 1 398 1 15 ILE H 1 15 ILE QG 3.714 . 5.439 2.644 2.536 2.734 . 0 0 "[ . 1 . 2 .]" 1 399 1 15 ILE H 1 15 ILE HG13 2.903 . 3.957 2.753 2.621 2.862 . 0 0 "[ . 1 . 2 .]" 1 400 1 15 ILE H 1 15 ILE MG 3.774 . 5.554 3.391 3.280 3.456 . 0 0 "[ . 1 . 2 .]" 1 401 1 15 ILE H 1 15 ILE MG 3.622 . 5.261 3.452 3.331 3.528 . 0 0 "[ . 1 . 2 .]" 1 402 1 15 ILE H 1 18 LEU MD1 3.090 . 4.284 2.644 2.421 2.934 . 0 0 "[ . 1 . 2 .]" 1 403 1 15 ILE H 1 28 VAL MG1 3.864 . 5.731 3.824 3.645 4.109 . 0 0 "[ . 1 . 2 .]" 1 404 1 15 ILE H 1 49 GLN H 4.657 . 7.368 6.261 6.081 6.441 . 0 0 "[ . 1 . 2 .]" 1 405 1 15 ILE H 1 50 ALA H 3.490 . 5.012 2.915 2.557 3.334 . 0 0 "[ . 1 . 2 .]" 1 406 1 15 ILE H 1 50 ALA MB 2.521 . 3.315 2.433 2.301 2.514 . 0 0 "[ . 1 . 2 .]" 1 407 1 15 ILE H 1 50 ALA MB 2.525 . 3.322 2.283 2.206 2.336 . 0 0 "[ . 1 . 2 .]" 1 408 1 15 ILE H 1 52 LEU H 4.395 . 6.809 4.610 4.341 4.803 . 0 0 "[ . 1 . 2 .]" 1 409 1 15 ILE H 1 50 ALA MB 2.335 . 3.017 2.574 2.412 2.663 . 0 0 "[ . 1 . 2 .]" 1 410 1 15 ILE H 1 51 PHE QE 4.689 . 7.437 4.524 4.437 4.641 . 0 0 "[ . 1 . 2 .]" 1 411 1 15 ILE H 1 82 ARG H 4.396 . 6.812 4.992 4.644 5.318 . 0 0 "[ . 1 . 2 .]" 1 412 1 15 ILE HA 1 18 LEU MD2 3.523 . 5.075 3.776 3.629 3.879 . 0 0 "[ . 1 . 2 .]" 1 413 1 15 ILE HA 1 15 ILE MD 4.183 . 6.370 3.802 3.781 3.827 . 0 0 "[ . 1 . 2 .]" 1 414 1 15 ILE HA 1 15 ILE MD 2.668 . 3.558 2.892 2.729 2.991 . 0 0 "[ . 1 . 2 .]" 1 415 1 15 ILE HA 1 15 ILE MD 2.958 . 4.051 3.007 2.815 3.136 . 0 0 "[ . 1 . 2 .]" 1 416 1 15 ILE HA 1 15 ILE HG12 2.105 . 2.659 1.939 1.893 1.981 . 0 0 "[ . 1 . 2 .]" 1 417 1 15 ILE HA 1 15 ILE MG 2.460 . 3.217 2.416 2.388 2.442 . 0 0 "[ . 1 . 2 .]" 1 418 1 15 ILE HA 1 16 CYS H 2.260 . 2.899 2.147 2.113 2.193 . 0 0 "[ . 1 . 2 .]" 1 419 1 15 ILE HA 1 18 LEU MD1 3.144 . 4.379 4.436 4.400 4.486 0.107 17 0 "[ . 1 . 2 .]" 1 420 1 15 ILE HA 1 18 LEU MD2 3.717 . 5.444 3.982 3.784 4.092 . 0 0 "[ . 1 . 2 .]" 1 421 1 15 ILE HA 1 81 ILE HB 4.124 . 6.250 4.072 3.765 4.250 . 0 0 "[ . 1 . 2 .]" 1 422 1 15 ILE HA 1 81 ILE MG 3.825 . 5.654 3.488 3.116 4.010 . 0 0 "[ . 1 . 2 .]" 1 423 1 15 ILE HA 1 82 ARG H 3.409 . 4.862 3.301 2.873 3.640 . 0 0 "[ . 1 . 2 .]" 1 424 1 15 ILE HB 1 15 ILE MD 1.969 . 2.454 2.456 2.413 2.479 0.025 2 0 "[ . 1 . 2 .]" 1 425 1 15 ILE HB 1 15 ILE MD 1.898 . 2.349 2.003 1.994 2.009 . 0 0 "[ . 1 . 2 .]" 1 426 1 15 ILE HB 1 15 ILE MG 1.846 . 2.272 2.123 2.116 2.129 . 0 0 "[ . 1 . 2 .]" 1 427 1 15 ILE HB 1 15 ILE MG 1.808 . 2.217 1.890 1.886 1.893 . 0 0 "[ . 1 . 2 .]" 1 428 1 15 ILE HB 1 16 CYS H 4.301 . 6.613 4.160 4.048 4.229 . 0 0 "[ . 1 . 2 .]" 1 429 1 15 ILE HB 1 29 ILE H 5.348 . 8.924 6.115 5.954 6.234 . 0 0 "[ . 1 . 2 .]" 1 430 1 15 ILE HB 1 32 GLY H 4.616 . 7.279 5.072 4.629 5.344 . 0 0 "[ . 1 . 2 .]" 1 431 1 15 ILE HB 1 50 ALA H 3.322 . 4.702 3.520 3.153 3.907 . 0 0 "[ . 1 . 2 .]" 1 432 1 15 ILE HB 1 81 ILE MD 3.169 . 4.424 3.515 3.340 3.658 . 0 0 "[ . 1 . 2 .]" 1 433 1 15 ILE MD 1 15 ILE HG12 1.381 . 1.620 1.735 1.731 1.738 0.118 5 0 "[ . 1 . 2 .]" 1 434 1 15 ILE MD 1 15 ILE HG13 1.859 . 2.291 1.966 1.940 1.983 . 0 0 "[ . 1 . 2 .]" 1 435 1 15 ILE MD 1 16 CYS H 4.214 . 6.434 3.890 3.692 4.116 . 0 0 "[ . 1 . 2 .]" 1 436 1 15 ILE MD 1 18 LEU MD1 2.247 . 2.878 2.933 2.831 2.990 0.112 6 0 "[ . 1 . 2 .]" 1 437 1 15 ILE MD 1 31 LEU HB2 2.331 . 3.010 2.568 2.188 2.717 . 0 0 "[ . 1 . 2 .]" 1 438 1 15 ILE MD 1 67 TYR QD 3.326 . 4.709 3.584 3.516 3.632 . 0 0 "[ . 1 . 2 .]" 1 439 1 15 ILE MD 1 29 ILE HA 3.038 . 4.192 3.426 3.292 3.544 . 0 0 "[ . 1 . 2 .]" 1 440 1 15 ILE MD 1 33 LEU H 3.848 . 5.699 5.215 5.014 5.452 . 0 0 "[ . 1 . 2 .]" 1 441 1 15 ILE MD 1 52 LEU HB2 3.086 . 4.276 2.850 2.643 3.058 . 0 0 "[ . 1 . 2 .]" 1 442 1 15 ILE MD 1 44 MET H 4.033 . 6.066 4.467 4.385 4.516 . 0 0 "[ . 1 . 2 .]" 1 443 1 15 ILE MD 1 50 ALA HA 3.340 . 4.734 4.048 3.885 4.167 . 0 0 "[ . 1 . 2 .]" 1 444 1 15 ILE MD 1 51 PHE H 3.897 . 5.795 4.132 3.954 4.361 . 0 0 "[ . 1 . 2 .]" 1 445 1 15 ILE MD 1 50 ALA MB 1.702 . 2.064 1.985 1.863 2.154 0.090 16 0 "[ . 1 . 2 .]" 1 446 1 15 ILE MD 1 52 LEU HB2 3.006 . 4.136 2.909 2.687 3.126 . 0 0 "[ . 1 . 2 .]" 1 447 1 15 ILE MD 1 52 LEU HB3 2.994 . 4.114 3.539 3.390 3.678 . 0 0 "[ . 1 . 2 .]" 1 448 1 15 ILE MD 1 81 ILE MD 2.143 . 2.717 2.642 2.431 2.737 0.020 9 0 "[ . 1 . 2 .]" 1 449 1 15 ILE HG12 1 15 ILE HG13 1.589 . 1.905 1.570 1.568 1.571 . 0 0 "[ . 1 . 2 .]" 1 450 1 15 ILE HG12 1 15 ILE MG 2.188 . 2.786 2.210 2.102 2.254 . 0 0 "[ . 1 . 2 .]" 1 451 1 15 ILE HG12 1 49 GLN H 4.689 . 7.437 6.965 6.686 7.340 . 0 0 "[ . 1 . 2 .]" 1 452 1 15 ILE HG12 1 79 LEU MD1 2.551 . 3.365 3.408 3.114 3.466 0.101 11 0 "[ . 1 . 2 .]" 1 453 1 15 ILE HG12 1 79 LEU H 4.454 . 6.934 6.012 5.839 6.198 . 0 0 "[ . 1 . 2 .]" 1 454 1 15 ILE HG12 1 81 ILE MD 2.866 . 3.893 3.336 3.055 3.581 . 0 0 "[ . 1 . 2 .]" 1 455 1 15 ILE HG13 1 81 ILE MD 4.115 . 6.232 4.403 4.160 4.542 . 0 0 "[ . 1 . 2 .]" 1 456 1 15 ILE MG 1 16 CYS H 2.621 . 3.480 2.563 2.357 2.748 . 0 0 "[ . 1 . 2 .]" 1 457 1 15 ILE MG 1 16 CYS HA 3.725 . 5.460 3.064 2.770 3.253 . 0 0 "[ . 1 . 2 .]" 1 458 1 15 ILE MG 1 18 LEU MD1 1.780 . 2.176 2.256 2.212 2.313 0.137 13 0 "[ . 1 . 2 .]" 1 459 1 15 ILE MG 1 50 ALA MB 2.564 . 3.386 3.023 2.935 3.222 . 0 0 "[ . 1 . 2 .]" 1 460 1 15 ILE MG 1 67 TYR QE 3.622 . 5.262 4.826 4.353 5.194 . 0 0 "[ . 1 . 2 .]" 1 461 1 15 ILE MG 1 81 ILE MD 2.584 . 3.419 2.945 2.794 3.094 . 0 0 "[ . 1 . 2 .]" 1 462 1 15 ILE MG 1 50 ALA H 3.562 . 5.148 4.282 3.874 4.581 . 0 0 "[ . 1 . 2 .]" 1 463 1 15 ILE MG 1 50 ALA MB 2.660 . 3.545 3.314 3.199 3.584 0.039 2 0 "[ . 1 . 2 .]" 1 464 1 15 ILE MG 1 81 ILE MD 3.195 . 4.471 3.620 3.339 3.948 . 0 0 "[ . 1 . 2 .]" 1 465 1 16 CYS H 1 16 CYS HB2 3.206 . 4.491 3.094 2.527 3.472 . 0 0 "[ . 1 . 2 .]" 1 466 1 16 CYS H 1 16 CYS HB3 4.109 . 6.219 3.388 2.715 3.771 . 0 0 "[ . 1 . 2 .]" 1 467 1 16 CYS H 1 79 LEU HA 4.603 . 7.251 4.776 4.332 5.293 . 0 0 "[ . 1 . 2 .]" 1 468 1 16 CYS H 1 80 LEU H 3.396 . 4.837 3.703 3.131 4.197 . 0 0 "[ . 1 . 2 .]" 1 469 1 16 CYS H 1 80 LEU QB 3.527 . 5.082 3.687 3.238 4.151 . 0 0 "[ . 1 . 2 .]" 1 470 1 16 CYS H 1 80 LEU HB3 3.112 . 4.323 3.767 3.285 4.252 . 0 0 "[ . 1 . 2 .]" 1 471 1 16 CYS H 1 80 LEU MD1 4.289 . 6.588 5.751 5.239 6.306 . 0 0 "[ . 1 . 2 .]" 1 472 1 16 CYS HA 1 16 CYS HB2 3.029 . 4.176 2.600 2.426 2.878 . 0 0 "[ . 1 . 2 .]" 1 473 1 16 CYS HA 1 17 ASN H 2.933 . 4.009 2.515 2.420 2.561 . 0 0 "[ . 1 . 2 .]" 1 474 1 16 CYS HA 1 17 ASN H 2.650 . 3.528 2.460 2.383 2.499 . 0 0 "[ . 1 . 2 .]" 1 475 1 16 CYS HA 1 18 LEU H 3.913 . 5.827 3.287 3.087 3.562 . 0 0 "[ . 1 . 2 .]" 1 476 1 16 CYS HA 1 49 GLN HA 2.849 . 3.864 3.198 2.325 3.868 0.004 12 0 "[ . 1 . 2 .]" 1 477 1 16 CYS HB2 1 17 ASN H 3.578 . 5.179 2.518 2.088 3.254 . 0 0 "[ . 1 . 2 .]" 1 478 1 16 CYS HB2 1 80 LEU QB 3.493 . 5.018 3.463 2.045 4.178 . 0 0 "[ . 1 . 2 .]" 1 479 1 16 CYS HB3 1 80 LEU QB 4.207 . 6.419 3.710 2.385 4.029 . 0 0 "[ . 1 . 2 .]" 1 480 1 16 CYS HB3 1 17 ASN H 2.394 . 3.110 3.066 2.182 3.609 0.499 13 0 "[ . 1 . 2 .]" 1 481 1 16 CYS HB3 1 17 ASN HA 4.416 . 6.854 3.489 3.311 3.668 . 0 0 "[ . 1 . 2 .]" 1 482 1 16 CYS HB3 1 80 LEU H 4.200 . 6.405 5.544 4.514 6.386 . 0 0 "[ . 1 . 2 .]" 1 483 1 17 ASN H 1 17 ASN HA 2.322 . 2.996 2.267 2.259 2.275 . 0 0 "[ . 1 . 2 .]" 1 484 1 17 ASN H 1 17 ASN HB2 3.760 . 5.527 3.584 3.512 3.668 . 0 0 "[ . 1 . 2 .]" 1 485 1 17 ASN H 1 17 ASN HB3 3.595 . 5.210 3.618 3.574 3.661 . 0 0 "[ . 1 . 2 .]" 1 486 1 17 ASN H 1 17 ASN HD21 4.419 . 6.860 4.619 2.061 5.429 . 0 0 "[ . 1 . 2 .]" 1 487 1 17 ASN H 1 18 LEU H 2.777 . 3.741 2.537 2.453 2.632 . 0 0 "[ . 1 . 2 .]" 1 488 1 17 ASN H 1 49 GLN H 5.400 . 9.045 6.547 5.751 7.385 . 0 0 "[ . 1 . 2 .]" 1 489 1 17 ASN H 1 79 LEU MD2 3.757 . 5.522 3.607 3.559 3.668 . 0 0 "[ . 1 . 2 .]" 1 490 1 17 ASN H 1 78 LYS HA 5.237 . 8.666 8.340 8.123 8.699 0.033 2 0 "[ . 1 . 2 .]" 1 491 1 17 ASN HA 1 17 ASN HB2 3.350 . 4.753 2.322 2.269 2.363 . 0 0 "[ . 1 . 2 .]" 1 492 1 17 ASN HA 1 17 ASN HB3 2.740 . 3.679 2.504 2.441 2.541 . 0 0 "[ . 1 . 2 .]" 1 493 1 17 ASN HA 1 17 ASN HB3 3.191 . 4.464 2.386 2.341 2.412 . 0 0 "[ . 1 . 2 .]" 1 494 1 17 ASN HA 1 18 LEU H 3.044 . 4.202 2.893 2.787 2.936 . 0 0 "[ . 1 . 2 .]" 1 495 1 17 ASN HA 1 18 LEU H 2.668 . 3.558 2.579 1.858 2.767 . 0 0 "[ . 1 . 2 .]" 1 496 1 17 ASN HA 1 78 LYS H 5.174 . 8.520 6.654 6.225 6.910 . 0 0 "[ . 1 . 2 .]" 1 497 1 17 ASN HB2 1 17 ASN HD21 2.913 . 3.973 3.026 2.235 3.515 . 0 0 "[ . 1 . 2 .]" 1 498 1 17 ASN HB2 1 17 ASN HD21 3.237 . 4.547 2.115 1.950 2.518 . 0 0 "[ . 1 . 2 .]" 1 499 1 17 ASN HB2 1 18 LEU H 3.555 . 5.135 4.121 4.048 4.232 . 0 0 "[ . 1 . 2 .]" 1 500 1 17 ASN HB2 1 18 LEU MD1 4.025 . 6.050 4.684 4.460 4.934 . 0 0 "[ . 1 . 2 .]" 1 501 1 17 ASN HB2 1 18 LEU MD2 3.399 . 4.843 4.833 4.665 4.901 0.058 24 0 "[ . 1 . 2 .]" 1 502 1 17 ASN HB2 1 79 LEU MD2 2.492 . 3.268 2.329 2.181 2.660 . 0 0 "[ . 1 . 2 .]" 1 503 1 17 ASN HB2 1 79 LEU HA 2.932 . 4.006 2.533 1.954 3.381 . 0 0 "[ . 1 . 2 .]" 1 504 1 17 ASN HB2 1 80 LEU H 3.700 . 5.411 2.908 2.046 3.915 . 0 0 "[ . 1 . 2 .]" 1 505 1 17 ASN HB3 1 17 ASN HD21 2.655 . 3.536 2.491 2.182 3.492 . 0 0 "[ . 1 . 2 .]" 1 506 1 17 ASN HB3 1 18 LEU H 4.114 . 6.230 4.427 4.390 4.469 . 0 0 "[ . 1 . 2 .]" 1 507 1 17 ASN HB3 1 79 LEU HA 3.904 . 5.809 3.312 2.928 3.595 . 0 0 "[ . 1 . 2 .]" 1 508 1 17 ASN HB3 1 80 LEU H 4.461 . 6.949 4.450 3.665 5.438 . 0 0 "[ . 1 . 2 .]" 1 509 1 17 ASN HD21 1 79 LEU MD2 3.162 . 4.412 3.202 3.091 3.300 . 0 0 "[ . 1 . 2 .]" 1 510 1 17 ASN HD21 1 79 LEU MD2 3.852 . 5.706 3.673 3.395 3.962 . 0 0 "[ . 1 . 2 .]" 1 511 1 17 ASN HD21 1 77 GLU QB 3.978 . 5.956 3.242 1.670 3.620 0.330 12 0 "[ . 1 . 2 .]" 1 512 1 17 ASN HD21 1 79 LEU HA 3.604 . 5.227 3.255 2.579 3.501 . 0 0 "[ . 1 . 2 .]" 1 513 1 17 ASN HD22 1 18 LEU MD2 6.143 . 10.860 5.753 5.206 6.155 . 0 0 "[ . 1 . 2 .]" 1 514 1 18 LEU H 1 18 LEU HA 2.963 . 4.061 2.636 2.228 2.861 . 0 0 "[ . 1 . 2 .]" 1 515 1 18 LEU H 1 18 LEU HA 2.995 . 4.116 2.560 2.205 2.747 . 0 0 "[ . 1 . 2 .]" 1 516 1 18 LEU H 1 18 LEU QB 2.477 . 3.244 2.304 2.283 2.334 . 0 0 "[ . 1 . 2 .]" 1 517 1 18 LEU H 1 18 LEU QB 2.377 . 3.083 2.194 1.793 2.313 . 0 0 "[ . 1 . 2 .]" 1 518 1 18 LEU H 1 18 LEU QB 2.876 . 3.910 2.283 2.265 2.309 . 0 0 "[ . 1 . 2 .]" 1 519 1 18 LEU H 1 18 LEU HB3 2.485 . 3.257 3.570 3.555 3.585 0.328 7 0 "[ . 1 . 2 .]" 1 520 1 18 LEU H 1 18 LEU MD1 3.774 . 5.554 3.602 3.553 3.655 . 0 0 "[ . 1 . 2 .]" 1 521 1 18 LEU H 1 18 LEU QD 3.347 . 4.747 3.276 3.228 3.322 . 0 0 "[ . 1 . 2 .]" 1 522 1 18 LEU H 1 18 LEU MD2 3.876 . 5.754 3.766 3.703 3.822 . 0 0 "[ . 1 . 2 .]" 1 523 1 18 LEU H 1 18 LEU HG 2.697 . 3.606 2.667 2.579 2.758 . 0 0 "[ . 1 . 2 .]" 1 524 1 18 LEU H 1 28 VAL MG1 4.362 . 6.741 6.049 5.787 6.521 . 0 0 "[ . 1 . 2 .]" 1 525 1 18 LEU H 1 49 GLN H 5.094 . 8.338 5.116 4.254 5.807 . 0 0 "[ . 1 . 2 .]" 1 526 1 18 LEU HA 1 31 LEU HB2 4.191 . 6.386 4.920 2.091 5.592 . 0 0 "[ . 1 . 2 .]" 1 527 1 18 LEU HA 1 18 LEU QB 2.976 . 4.083 2.411 2.395 2.418 . 0 0 "[ . 1 . 2 .]" 1 528 1 18 LEU HA 1 18 LEU MD1 3.573 . 5.169 3.865 3.848 3.885 . 0 0 "[ . 1 . 2 .]" 1 529 1 18 LEU HA 1 18 LEU QD 3.298 . 4.658 2.050 2.017 2.079 . 0 0 "[ . 1 . 2 .]" 1 530 1 18 LEU HA 1 18 LEU MD2 2.026 . 2.539 2.058 2.024 2.088 . 0 0 "[ . 1 . 2 .]" 1 531 1 18 LEU HA 1 18 LEU MD2 1.936 . 2.405 1.951 1.876 2.031 . 0 0 "[ . 1 . 2 .]" 1 532 1 18 LEU HA 1 19 PRO HD2 2.118 . 2.679 2.084 1.925 2.528 . 0 0 "[ . 1 . 2 .]" 1 533 1 18 LEU HA 1 19 PRO HD3 3.335 . 4.725 2.364 1.988 2.537 . 0 0 "[ . 1 . 2 .]" 1 534 1 18 LEU HA 1 74 ILE MD 3.659 . 5.333 3.929 2.526 5.015 . 0 0 "[ . 1 . 2 .]" 1 535 1 18 LEU HA 1 79 LEU MD2 2.940 . 4.021 2.356 2.126 2.629 . 0 0 "[ . 1 . 2 .]" 1 536 1 18 LEU QB 1 18 LEU MD1 2.172 . 2.762 2.101 2.085 2.114 . 0 0 "[ . 1 . 2 .]" 1 537 1 18 LEU QB 1 18 LEU MD2 2.840 . 3.848 2.045 1.796 2.130 0.036 16 0 "[ . 1 . 2 .]" 1 538 1 18 LEU QB 1 18 LEU MD2 2.386 . 3.097 2.121 1.815 2.184 . 0 0 "[ . 1 . 2 .]" 1 539 1 18 LEU QB 1 19 PRO QG 5.828 . 10.074 4.502 4.192 4.969 . 0 0 "[ . 1 . 2 .]" 1 540 1 18 LEU QB 1 22 SER H 4.924 . 7.955 5.268 4.910 5.443 . 0 0 "[ . 1 . 2 .]" 1 541 1 18 LEU QB 1 23 CYS HB2 2.863 . 3.888 2.628 2.280 3.200 . 0 0 "[ . 1 . 2 .]" 1 542 1 18 LEU QB 1 48 ASN HA 2.625 . 3.486 2.436 2.275 3.270 . 0 0 "[ . 1 . 2 .]" 1 543 1 18 LEU QB 1 50 ALA MB 2.805 . 3.789 3.817 3.715 3.909 0.120 10 0 "[ . 1 . 2 .]" 1 544 1 18 LEU QB 1 79 LEU H 5.030 . 8.193 6.211 4.657 6.466 . 0 0 "[ . 1 . 2 .]" 1 545 1 18 LEU HB3 1 18 LEU HG 2.805 . 3.788 3.016 3.013 3.019 . 0 0 "[ . 1 . 2 .]" 1 546 1 18 LEU QD 1 23 CYS H 4.542 . 7.121 4.775 4.546 4.944 . 0 0 "[ . 1 . 2 .]" 1 547 1 18 LEU MD1 1 18 LEU HG 1.955 . 2.433 2.126 2.122 2.129 . 0 0 "[ . 1 . 2 .]" 1 548 1 18 LEU MD1 1 28 VAL MG2 2.235 . 2.860 2.704 2.382 2.917 0.057 16 0 "[ . 1 . 2 .]" 1 549 1 18 LEU MD1 1 48 ASN H 5.054 . 8.247 5.850 5.423 6.608 . 0 0 "[ . 1 . 2 .]" 1 550 1 18 LEU MD1 1 49 GLN H 3.283 . 4.630 3.953 3.540 4.656 0.026 12 0 "[ . 1 . 2 .]" 1 551 1 18 LEU MD1 1 49 GLN HA 2.596 . 3.439 2.658 2.020 3.130 . 0 0 "[ . 1 . 2 .]" 1 552 1 18 LEU MD1 1 50 ALA H 3.139 . 4.371 2.691 2.446 3.036 . 0 0 "[ . 1 . 2 .]" 1 553 1 18 LEU MD1 1 50 ALA MB 1.517 . 1.805 1.900 1.851 1.947 0.142 12 0 "[ . 1 . 2 .]" 1 554 1 18 LEU MD2 1 18 LEU HG 2.133 . 2.702 1.997 1.986 2.009 . 0 0 "[ . 1 . 2 .]" 1 555 1 18 LEU MD2 1 19 PRO HD2 3.220 . 4.516 2.537 2.283 3.076 . 0 0 "[ . 1 . 2 .]" 1 556 1 18 LEU MD2 1 19 PRO HD3 3.017 . 4.155 2.728 2.380 3.145 . 0 0 "[ . 1 . 2 .]" 1 557 1 18 LEU MD2 1 22 SER H 5.837 . 10.096 6.488 6.087 6.657 . 0 0 "[ . 1 . 2 .]" 1 558 1 18 LEU MD2 1 22 SER HB3 6.041 . 10.603 6.112 5.394 6.523 . 0 0 "[ . 1 . 2 .]" 1 559 1 18 LEU MD2 1 24 THR H 3.910 . 5.821 5.251 4.866 5.483 . 0 0 "[ . 1 . 2 .]" 1 560 1 18 LEU MD2 1 28 VAL HB 3.188 . 4.459 2.817 2.429 3.457 . 0 0 "[ . 1 . 2 .]" 1 561 1 18 LEU MD2 1 28 VAL MG2 1.886 . 2.331 1.851 1.793 1.879 . 0 0 "[ . 1 . 2 .]" 1 562 1 18 LEU MD2 1 28 VAL MG2 2.041 . 2.562 2.498 2.275 2.578 0.016 24 0 "[ . 1 . 2 .]" 1 563 1 18 LEU MD2 1 80 LEU H 4.187 . 6.378 4.563 4.344 4.713 . 0 0 "[ . 1 . 2 .]" 1 564 1 18 LEU MD2 1 75 ASN HD22 5.576 . 9.463 6.185 5.722 6.632 . 0 0 "[ . 1 . 2 .]" 1 565 1 18 LEU MD2 1 81 ILE H 4.721 . 7.507 5.931 5.788 6.125 . 0 0 "[ . 1 . 2 .]" 1 566 1 19 PRO HA 1 19 PRO HB3 2.397 . 3.115 2.287 2.267 2.297 . 0 0 "[ . 1 . 2 .]" 1 567 1 19 PRO HA 1 19 PRO QG 3.460 . 4.956 3.260 2.726 3.406 . 0 0 "[ . 1 . 2 .]" 1 568 1 19 PRO HA 1 20 GLU H 2.127 . 2.693 2.148 2.121 2.179 . 0 0 "[ . 1 . 2 .]" 1 569 1 19 PRO HB2 1 19 PRO HB3 1.726 . 2.098 1.669 1.652 1.677 . 0 0 "[ . 1 . 2 .]" 1 570 1 19 PRO HB2 1 19 PRO QG 1.488 . 1.765 1.689 1.683 1.698 . 0 0 "[ . 1 . 2 .]" 1 571 1 19 PRO HB2 1 20 GLU H 2.808 . 3.794 3.553 3.390 3.835 0.041 12 0 "[ . 1 . 2 .]" 1 572 1 19 PRO HB2 1 20 GLU QG 3.255 . 4.580 3.233 2.862 3.629 . 0 0 "[ . 1 . 2 .]" 1 573 1 19 PRO HB2 1 22 SER HB2 2.980 . 4.090 2.426 1.854 3.234 0.016 23 0 "[ . 1 . 2 .]" 1 574 1 19 PRO HB2 1 22 SER HB2 2.364 . 3.062 2.312 1.846 2.835 . 0 0 "[ . 1 . 2 .]" 1 575 1 19 PRO HB2 1 22 SER HB3 2.554 . 3.369 3.072 2.015 3.877 0.508 17 1 "[ . 1 . + 2 .]" 1 576 1 19 PRO HB2 1 23 CYS H 4.954 . 8.022 4.081 3.497 4.618 . 0 0 "[ . 1 . 2 .]" 1 577 1 19 PRO HB2 1 74 ILE MG 2.901 . 3.953 3.847 3.508 4.070 0.117 18 0 "[ . 1 . 2 .]" 1 578 1 19 PRO HB2 1 48 ASN HD21 5.470 . 9.210 6.841 5.454 8.485 . 0 0 "[ . 1 . 2 .]" 1 579 1 19 PRO HB3 1 19 PRO HD3 2.470 . 3.233 2.657 2.501 2.941 . 0 0 "[ . 1 . 2 .]" 1 580 1 19 PRO HB3 1 19 PRO HD3 3.302 . 4.665 2.824 2.614 3.484 . 0 0 "[ . 1 . 2 .]" 1 581 1 19 PRO HB3 1 20 GLU H 3.444 . 4.927 3.867 3.588 3.981 . 0 0 "[ . 1 . 2 .]" 1 582 1 19 PRO HB3 1 23 CYS H 6.521 . 11.836 5.197 4.918 5.627 . 0 0 "[ . 1 . 2 .]" 1 583 1 19 PRO HB3 1 22 SER H 6.003 . 10.508 5.031 4.555 5.495 . 0 0 "[ . 1 . 2 .]" 1 584 1 19 PRO HB3 1 74 ILE MG 4.498 . 7.027 5.502 4.915 5.879 . 0 0 "[ . 1 . 2 .]" 1 585 1 19 PRO HB3 1 75 ASN HD22 6.957 . 13.006 6.412 4.871 7.605 . 0 0 "[ . 1 . 2 .]" 1 586 1 19 PRO HD2 1 19 PRO QG 2.530 . 3.330 2.190 2.170 2.245 . 0 0 "[ . 1 . 2 .]" 1 587 1 19 PRO HD2 1 23 CYS HB3 3.694 . 5.400 4.628 4.414 4.788 . 0 0 "[ . 1 . 2 .]" 1 588 1 19 PRO HD2 1 74 ILE MG 3.367 . 4.784 3.837 2.969 4.619 . 0 0 "[ . 1 . 2 .]" 1 589 1 19 PRO HD2 1 79 LEU MD2 2.773 . 3.734 2.900 2.439 3.772 0.038 12 0 "[ . 1 . 2 .]" 1 590 1 19 PRO HD3 1 74 ILE MD 4.353 . 6.721 5.365 4.648 6.771 0.050 22 0 "[ . 1 . 2 .]" 1 591 1 19 PRO HD3 1 74 ILE MG 3.636 . 5.288 4.640 3.830 5.241 . 0 0 "[ . 1 . 2 .]" 1 592 1 19 PRO QG 1 20 GLU H 3.463 . 4.962 3.025 2.243 3.268 . 0 0 "[ . 1 . 2 .]" 1 593 1 19 PRO QG 1 22 SER H 4.035 . 6.070 4.003 3.492 5.125 . 0 0 "[ . 1 . 2 .]" 1 594 1 19 PRO QG 1 23 CYS H 3.602 . 5.224 3.194 2.739 3.752 . 0 0 "[ . 1 . 2 .]" 1 595 1 19 PRO QG 1 23 CYS HB3 3.836 . 5.675 3.851 2.146 4.408 . 0 0 "[ . 1 . 2 .]" 1 596 1 19 PRO QG 1 24 THR H 5.366 . 8.965 6.054 5.691 6.693 . 0 0 "[ . 1 . 2 .]" 1 597 1 19 PRO QG 1 74 ILE H 4.307 . 6.626 5.196 4.800 5.688 . 0 0 "[ . 1 . 2 .]" 1 598 1 19 PRO QG 1 74 ILE H 4.522 . 7.078 5.253 4.831 5.793 . 0 0 "[ . 1 . 2 .]" 1 599 1 19 PRO QG 1 75 ASN HB2 3.083 . 4.271 2.992 2.338 3.221 . 0 0 "[ . 1 . 2 .]" 1 600 1 19 PRO QG 1 74 ILE HB 3.477 . 4.988 3.381 2.713 4.293 . 0 0 "[ . 1 . 2 .]" 1 601 1 19 PRO QG 1 74 ILE MG 2.712 . 3.631 3.248 2.559 3.657 0.026 14 0 "[ . 1 . 2 .]" 1 602 1 19 PRO QG 1 75 ASN HB2 3.616 . 5.251 3.426 2.384 4.034 . 0 0 "[ . 1 . 2 .]" 1 603 1 19 PRO QG 1 75 ASN HB3 4.633 . 7.316 4.641 3.658 5.252 . 0 0 "[ . 1 . 2 .]" 1 604 1 19 PRO QG 1 75 ASN HD22 4.666 . 7.387 4.916 3.252 6.193 . 0 0 "[ . 1 . 2 .]" 1 605 1 19 PRO QG 1 79 LEU MD2 3.806 . 5.617 3.831 3.413 4.360 . 0 0 "[ . 1 . 2 .]" 1 606 1 20 GLU H 1 20 GLU HA 2.900 . 3.951 2.833 2.817 2.849 . 0 0 "[ . 1 . 2 .]" 1 607 1 20 GLU H 1 20 GLU HA 3.098 . 4.298 2.392 2.357 2.415 . 0 0 "[ . 1 . 2 .]" 1 608 1 20 GLU H 1 20 GLU HB2 2.314 . 2.984 2.691 2.073 3.626 0.642 3 6 "[* + . * 1* . * 2- .]" 1 609 1 20 GLU H 1 20 GLU HB3 4.112 . 6.225 3.273 2.265 3.600 . 0 0 "[ . 1 . 2 .]" 1 610 1 20 GLU H 1 20 GLU HB3 3.333 . 4.722 3.069 2.248 3.339 . 0 0 "[ . 1 . 2 .]" 1 611 1 20 GLU H 1 20 GLU QG 2.646 . 3.521 2.517 1.847 3.869 0.348 5 0 "[ . 1 . 2 .]" 1 612 1 20 GLU H 1 21 GLY H 4.473 . 6.973 4.535 4.494 4.596 . 0 0 "[ . 1 . 2 .]" 1 613 1 20 GLU H 1 23 CYS HB2 4.456 . 6.938 6.496 5.845 6.937 . 0 0 "[ . 1 . 2 .]" 1 614 1 20 GLU H 1 48 ASN HD21 5.118 . 8.392 4.723 2.901 6.594 . 0 0 "[ . 1 . 2 .]" 1 615 1 20 GLU H 1 48 ASN HD22 4.964 . 8.044 4.231 2.899 6.279 . 0 0 "[ . 1 . 2 .]" 1 616 1 20 GLU HA 1 20 GLU HB2 3.009 . 4.141 2.278 2.126 2.515 . 0 0 "[ . 1 . 2 .]" 1 617 1 20 GLU HA 1 20 GLU HB3 2.679 . 3.576 2.499 2.147 2.975 . 0 0 "[ . 1 . 2 .]" 1 618 1 20 GLU HA 1 20 GLU QG 3.097 . 4.296 2.673 2.309 3.501 . 0 0 "[ . 1 . 2 .]" 1 619 1 20 GLU HA 1 21 GLY H 2.387 . 3.099 2.149 2.116 2.195 . 0 0 "[ . 1 . 2 .]" 1 620 1 20 GLU HA 1 22 SER H 3.370 . 4.789 3.587 3.463 3.745 . 0 0 "[ . 1 . 2 .]" 1 621 1 20 GLU HA 1 22 SER H 3.986 . 5.972 3.420 3.252 3.593 . 0 0 "[ . 1 . 2 .]" 1 622 1 20 GLU HA 1 48 ASN H 3.717 . 5.444 3.569 3.406 3.590 . 0 0 "[ . 1 . 2 .]" 1 623 1 20 GLU HA 1 45 LYS H 5.122 . 8.401 4.780 4.663 4.869 . 0 0 "[ . 1 . 2 .]" 1 624 1 20 GLU HA 1 48 ASN HD22 4.570 . 7.181 4.281 3.694 4.600 . 0 0 "[ . 1 . 2 .]" 1 625 1 20 GLU HB2 1 20 GLU QG 2.148 . 2.725 1.930 1.841 1.985 . 0 0 "[ . 1 . 2 .]" 1 626 1 20 GLU HB2 1 21 GLY H 5.171 . 8.514 4.000 3.047 4.411 . 0 0 "[ . 1 . 2 .]" 1 627 1 20 GLU HB2 1 48 ASN HA 3.550 . 5.125 5.103 4.436 6.098 0.973 18 3 "[* . 1 . + 2- .]" 1 628 1 20 GLU HB3 1 21 GLY HA2 4.045 . 6.091 3.249 2.744 3.960 . 0 0 "[ . 1 . 2 .]" 1 629 1 20 GLU QG 1 44 MET H 4.901 . 7.903 7.884 7.286 8.676 0.773 5 5 "[* + - 1* . 2* .]" 1 630 1 20 GLU QG 1 48 ASN H 4.490 . 7.010 5.155 3.321 7.062 0.052 8 0 "[ . 1 . 2 .]" 1 631 1 20 GLU QG 1 48 ASN H 4.500 . 7.031 3.052 2.432 4.521 . 0 0 "[ . 1 . 2 .]" 1 632 1 20 GLU QG 1 48 ASN HD21 5.048 . 8.233 4.041 2.388 6.900 . 0 0 "[ . 1 . 2 .]" 1 633 1 20 GLU QG 1 48 ASN HD22 3.969 . 5.938 3.811 1.978 5.963 0.025 18 0 "[ . 1 . 2 .]" 1 634 1 20 GLU HG3 1 21 GLY H 5.481 . 9.236 4.809 3.351 5.330 . 0 0 "[ . 1 . 2 .]" 1 635 1 21 GLY H 1 22 SER H 3.125 . 4.345 2.837 2.528 2.962 . 0 0 "[ . 1 . 2 .]" 1 636 1 21 GLY H 1 22 SER H 3.173 . 4.431 2.743 2.489 2.837 . 0 0 "[ . 1 . 2 .]" 1 637 1 21 GLY HA2 1 43 LEU MD1 4.108 . 6.218 5.743 5.363 6.093 . 0 0 "[ . 1 . 2 .]" 1 638 1 21 GLY HA2 1 22 SER H 3.297 . 4.656 3.414 3.110 3.452 . 0 0 "[ . 1 . 2 .]" 1 639 1 21 GLY HA2 1 23 CYS H 4.734 . 7.535 4.490 3.812 4.843 . 0 0 "[ . 1 . 2 .]" 1 640 1 21 GLY HA3 1 22 SER H 4.385 . 6.789 3.132 3.083 3.407 . 0 0 "[ . 1 . 2 .]" 1 641 1 21 GLY HA3 1 22 SER H 3.388 . 4.823 2.859 2.658 3.066 . 0 0 "[ . 1 . 2 .]" 1 642 1 21 GLY HA3 1 22 SER H 3.093 . 4.289 2.499 2.144 2.672 . 0 0 "[ . 1 . 2 .]" 1 643 1 21 GLY HA3 1 22 SER H 3.839 . 5.681 2.858 2.826 2.984 . 0 0 "[ . 1 . 2 .]" 1 644 1 22 SER H 1 22 SER HA 2.989 . 4.106 2.915 2.887 2.943 . 0 0 "[ . 1 . 2 .]" 1 645 1 22 SER H 1 22 SER HA 3.192 . 4.466 2.778 2.738 2.803 . 0 0 "[ . 1 . 2 .]" 1 646 1 22 SER H 1 22 SER HB2 3.227 . 4.529 2.625 2.464 2.840 . 0 0 "[ . 1 . 2 .]" 1 647 1 22 SER H 1 22 SER HB2 3.223 . 4.521 2.470 2.299 2.777 . 0 0 "[ . 1 . 2 .]" 1 648 1 22 SER H 1 22 SER HB3 2.865 . 3.891 3.282 2.478 3.781 . 0 0 "[ . 1 . 2 .]" 1 649 1 22 SER H 1 74 ILE MG 4.861 . 7.814 5.766 5.240 6.270 . 0 0 "[ . 1 . 2 .]" 1 650 1 22 SER H 1 75 ASN HB2 6.327 . 11.330 7.138 6.193 8.101 . 0 0 "[ . 1 . 2 .]" 1 651 1 22 SER HA 1 22 SER HB2 2.774 . 3.736 2.841 2.451 3.026 . 0 0 "[ . 1 . 2 .]" 1 652 1 22 SER HA 1 22 SER HB3 2.984 . 4.097 2.633 2.370 3.029 . 0 0 "[ . 1 . 2 .]" 1 653 1 22 SER HA 1 23 CYS H 3.444 . 4.927 3.502 3.348 3.550 . 0 0 "[ . 1 . 2 .]" 1 654 1 22 SER HB2 1 74 ILE MD 3.363 . 4.777 4.002 2.054 5.368 0.591 4 1 "[ +. 1 . 2 .]" 1 655 1 22 SER HB2 1 74 ILE MG 3.226 . 4.527 3.594 2.053 4.918 0.391 4 0 "[ . 1 . 2 .]" 1 656 1 22 SER HB2 1 74 ILE MG 3.631 . 5.279 3.719 2.056 5.029 . 0 0 "[ . 1 . 2 .]" 1 657 1 22 SER HB2 1 76 GLY H 5.922 . 10.305 8.990 7.812 10.393 0.088 2 0 "[ . 1 . 2 .]" 1 658 1 22 SER HB3 1 23 CYS H 4.186 . 6.377 3.507 2.669 4.193 . 0 0 "[ . 1 . 2 .]" 1 659 1 22 SER HB3 1 24 THR MG 4.132 . 6.266 3.512 3.153 3.940 . 0 0 "[ . 1 . 2 .]" 1 660 1 23 CYS H 1 23 CYS HA 2.948 . 4.034 2.893 2.835 2.902 . 0 0 "[ . 1 . 2 .]" 1 661 1 23 CYS H 1 23 CYS HB2 2.411 . 3.137 2.506 2.446 2.565 . 0 0 "[ . 1 . 2 .]" 1 662 1 23 CYS H 1 23 CYS HB3 3.519 . 5.067 3.624 3.586 3.637 . 0 0 "[ . 1 . 2 .]" 1 663 1 23 CYS H 1 24 THR H 4.667 . 7.390 4.539 4.462 4.600 . 0 0 "[ . 1 . 2 .]" 1 664 1 23 CYS H 1 24 THR MG 3.523 . 5.074 4.859 4.587 5.061 . 0 0 "[ . 1 . 2 .]" 1 665 1 23 CYS H 1 24 THR MG 3.906 . 5.813 4.355 4.220 4.484 . 0 0 "[ . 1 . 2 .]" 1 666 1 23 CYS H 1 28 VAL MG2 4.691 . 7.442 4.269 3.951 4.669 . 0 0 "[ . 1 . 2 .]" 1 667 1 23 CYS HA 1 23 CYS HB2 3.287 . 4.638 2.818 2.405 2.964 . 0 0 "[ . 1 . 2 .]" 1 668 1 23 CYS HA 1 24 THR H 2.384 . 3.094 2.191 2.134 2.274 . 0 0 "[ . 1 . 2 .]" 1 669 1 23 CYS HA 1 24 THR H 2.169 . 2.757 2.135 2.087 2.203 . 0 0 "[ . 1 . 2 .]" 1 670 1 23 CYS HA 1 27 ASP H 6.213 . 11.038 5.430 5.108 6.287 . 0 0 "[ . 1 . 2 .]" 1 671 1 23 CYS HA 1 27 ASP HB3 4.388 . 6.795 3.422 2.506 4.099 . 0 0 "[ . 1 . 2 .]" 1 672 1 23 CYS HB2 1 28 VAL MG1 3.119 . 4.335 3.001 2.056 3.973 . 0 0 "[ . 1 . 2 .]" 1 673 1 23 CYS HB2 1 24 THR H 4.165 . 6.334 3.583 3.397 3.801 . 0 0 "[ . 1 . 2 .]" 1 674 1 23 CYS HB2 1 24 THR H 3.569 . 5.161 2.973 2.703 3.648 . 0 0 "[ . 1 . 2 .]" 1 675 1 23 CYS HB2 1 45 LYS HA 4.203 . 6.411 4.928 4.104 5.219 . 0 0 "[ . 1 . 2 .]" 1 676 1 23 CYS HB2 1 45 LYS QG 2.476 . 3.242 2.326 2.155 2.394 . 0 0 "[ . 1 . 2 .]" 1 677 1 23 CYS HB2 1 45 LYS QG 2.755 . 3.704 2.042 1.988 2.091 . 0 0 "[ . 1 . 2 .]" 1 678 1 23 CYS HB2 1 74 ILE MD 3.156 . 4.401 3.061 2.058 4.304 . 0 0 "[ . 1 . 2 .]" 1 679 1 23 CYS HB3 1 24 THR H 3.495 . 5.022 3.148 2.875 3.374 . 0 0 "[ . 1 . 2 .]" 1 680 1 23 CYS HB3 1 24 THR H 3.612 . 5.242 2.408 1.724 3.084 0.258 12 0 "[ . 1 . 2 .]" 1 681 1 23 CYS HB3 1 27 ASP H 4.026 . 6.052 4.589 3.868 4.847 . 0 0 "[ . 1 . 2 .]" 1 682 1 23 CYS HB3 1 28 VAL H 3.733 . 5.475 2.631 2.433 2.735 . 0 0 "[ . 1 . 2 .]" 1 683 1 23 CYS HB3 1 28 VAL H 3.878 . 5.758 2.621 2.428 2.724 . 0 0 "[ . 1 . 2 .]" 1 684 1 23 CYS HB3 1 28 VAL MG1 3.628 . 5.273 3.021 1.947 3.939 0.036 17 0 "[ . 1 . 2 .]" 1 685 1 23 CYS HB3 1 28 VAL MG1 3.262 . 4.592 2.824 1.938 3.273 . 0 0 "[ . 1 . 2 .]" 1 686 1 23 CYS HB3 1 28 VAL MG2 2.577 . 3.407 2.587 2.386 2.849 . 0 0 "[ . 1 . 2 .]" 1 687 1 23 CYS HB3 1 28 VAL MG2 2.781 . 3.748 2.156 2.025 2.237 . 0 0 "[ . 1 . 2 .]" 1 688 1 24 THR H 1 24 THR HB 3.278 . 4.621 3.391 3.293 3.455 . 0 0 "[ . 1 . 2 .]" 1 689 1 24 THR H 1 24 THR MG 2.602 . 3.448 2.539 2.370 2.649 . 0 0 "[ . 1 . 2 .]" 1 690 1 24 THR H 1 24 THR MG 2.335 . 3.017 2.118 2.024 2.183 . 0 0 "[ . 1 . 2 .]" 1 691 1 24 THR H 1 24 THR MG 2.384 . 3.095 2.272 2.182 2.357 . 0 0 "[ . 1 . 2 .]" 1 692 1 24 THR H 1 24 THR MG 2.461 . 3.218 2.308 2.228 2.370 . 0 0 "[ . 1 . 2 .]" 1 693 1 24 THR H 1 25 GLU H 4.905 . 7.912 4.516 4.493 4.540 . 0 0 "[ . 1 . 2 .]" 1 694 1 24 THR H 1 26 ASN H 5.259 . 8.716 4.925 4.723 5.338 . 0 0 "[ . 1 . 2 .]" 1 695 1 24 THR H 1 27 ASP H 4.403 . 6.827 3.483 3.199 4.190 . 0 0 "[ . 1 . 2 .]" 1 696 1 24 THR H 1 27 ASP H 4.108 . 6.217 3.127 2.958 3.342 . 0 0 "[ . 1 . 2 .]" 1 697 1 24 THR H 1 27 ASP HB2 3.250 . 4.570 2.535 2.154 3.108 . 0 0 "[ . 1 . 2 .]" 1 698 1 24 THR H 1 27 ASP HB3 4.065 . 6.130 3.699 3.276 4.178 . 0 0 "[ . 1 . 2 .]" 1 699 1 24 THR H 1 28 VAL H 3.866 . 5.735 3.975 3.730 4.182 . 0 0 "[ . 1 . 2 .]" 1 700 1 24 THR H 1 28 VAL MG2 2.961 . 4.057 3.771 3.097 4.117 0.060 2 0 "[ . 1 . 2 .]" 1 701 1 24 THR H 1 74 ILE MD 3.520 . 5.069 3.521 3.299 3.990 . 0 0 "[ . 1 . 2 .]" 1 702 1 24 THR HA 1 24 THR HB 2.889 . 3.932 2.431 2.397 2.458 . 0 0 "[ . 1 . 2 .]" 1 703 1 24 THR HA 1 24 THR MG 2.177 . 2.769 2.418 2.382 2.474 . 0 0 "[ . 1 . 2 .]" 1 704 1 24 THR HA 1 24 THR MG 1.855 . 2.285 1.893 1.886 1.905 . 0 0 "[ . 1 . 2 .]" 1 705 1 24 THR HA 1 24 THR MG 2.461 . 3.218 2.118 2.100 2.143 . 0 0 "[ . 1 . 2 .]" 1 706 1 24 THR HA 1 25 GLU H 2.322 . 2.996 2.476 2.350 2.537 . 0 0 "[ . 1 . 2 .]" 1 707 1 24 THR HA 1 26 ASN H 4.943 . 7.998 4.363 4.071 4.531 . 0 0 "[ . 1 . 2 .]" 1 708 1 24 THR HA 1 45 LYS QE 3.572 . 5.167 4.481 3.463 5.228 0.061 12 0 "[ . 1 . 2 .]" 1 709 1 24 THR HB 1 24 THR MG 2.292 . 2.949 2.133 2.130 2.136 . 0 0 "[ . 1 . 2 .]" 1 710 1 24 THR HB 1 25 GLU H 2.444 . 3.190 2.356 2.253 2.580 . 0 0 "[ . 1 . 2 .]" 1 711 1 24 THR HB 1 26 ASN H 3.021 . 4.162 2.929 2.610 3.193 . 0 0 "[ . 1 . 2 .]" 1 712 1 24 THR HB 1 26 ASN H 2.940 . 4.021 2.573 2.054 2.883 . 0 0 "[ . 1 . 2 .]" 1 713 1 24 THR HB 1 28 VAL MG2 4.710 . 7.483 5.705 5.350 5.975 . 0 0 "[ . 1 . 2 .]" 1 714 1 24 THR HB 1 30 ASN HD22 6.645 . 12.164 8.550 7.714 9.993 . 0 0 "[ . 1 . 2 .]" 1 715 1 24 THR MG 1 25 GLU H 3.664 . 5.343 3.757 3.652 3.889 . 0 0 "[ . 1 . 2 .]" 1 716 1 24 THR MG 1 26 ASN H 4.308 . 6.628 4.345 4.142 4.514 . 0 0 "[ . 1 . 2 .]" 1 717 1 24 THR MG 1 26 ASN H 4.269 . 6.547 4.214 3.974 4.439 . 0 0 "[ . 1 . 2 .]" 1 718 1 24 THR MG 1 27 ASP H 4.440 . 6.905 4.193 3.870 4.557 . 0 0 "[ . 1 . 2 .]" 1 719 1 24 THR MG 1 27 ASP H 4.421 . 6.864 3.079 2.854 3.376 . 0 0 "[ . 1 . 2 .]" 1 720 1 24 THR MG 1 27 ASP HB3 3.217 . 4.511 4.474 4.287 4.613 0.102 3 0 "[ . 1 . 2 .]" 1 721 1 24 THR MG 1 28 VAL H 5.193 . 8.564 5.693 5.239 6.097 . 0 0 "[ . 1 . 2 .]" 1 722 1 24 THR MG 1 28 VAL H 3.819 . 5.642 3.102 2.867 3.379 . 0 0 "[ . 1 . 2 .]" 1 723 1 24 THR MG 1 28 VAL H 4.261 . 6.531 4.357 4.160 4.588 . 0 0 "[ . 1 . 2 .]" 1 724 1 25 GLU H 1 25 GLU HA 2.631 . 3.496 2.793 2.760 2.824 . 0 0 "[ . 1 . 2 .]" 1 725 1 25 GLU H 1 25 GLU HB2 2.733 . 3.667 2.680 2.449 3.589 . 0 0 "[ . 1 . 2 .]" 1 726 1 25 GLU H 1 25 GLU HB3 3.602 . 5.224 3.544 2.380 3.613 . 0 0 "[ . 1 . 2 .]" 1 727 1 25 GLU H 1 25 GLU HG2 2.961 . 4.057 2.595 2.284 2.968 . 0 0 "[ . 1 . 2 .]" 1 728 1 25 GLU H 1 26 ASN H 2.773 . 3.734 2.672 2.553 2.800 . 0 0 "[ . 1 . 2 .]" 1 729 1 25 GLU H 1 26 ASN QB 5.479 . 9.232 4.544 4.298 4.957 . 0 0 "[ . 1 . 2 .]" 1 730 1 25 GLU H 1 28 VAL HB 4.065 . 6.131 4.876 4.290 5.184 . 0 0 "[ . 1 . 2 .]" 1 731 1 25 GLU H 1 28 VAL MG2 3.636 . 5.288 4.524 4.212 4.850 . 0 0 "[ . 1 . 2 .]" 1 732 1 25 GLU H 1 41 TYR HB3 5.856 . 10.143 8.039 7.767 8.227 . 0 0 "[ . 1 . 2 .]" 1 733 1 25 GLU H 1 43 LEU MD1 3.952 . 5.905 3.795 3.147 4.076 . 0 0 "[ . 1 . 2 .]" 1 734 1 25 GLU H 1 43 LEU MD2 4.627 . 7.303 5.315 4.715 5.754 . 0 0 "[ . 1 . 2 .]" 1 735 1 25 GLU HA 1 25 GLU HB2 2.426 . 3.162 2.145 2.025 2.266 . 0 0 "[ . 1 . 2 .]" 1 736 1 25 GLU HA 1 25 GLU HB3 2.229 . 2.850 2.429 2.383 2.537 . 0 0 "[ . 1 . 2 .]" 1 737 1 25 GLU HA 1 25 GLU HG2 2.395 . 3.112 2.768 2.604 3.812 0.700 25 2 "[ . 1 - . 2 +]" 1 738 1 25 GLU HA 1 25 GLU HG3 3.090 . 4.283 3.135 2.473 3.539 . 0 0 "[ . 1 . 2 .]" 1 739 1 25 GLU HA 1 26 ASN H 3.457 . 4.950 3.510 3.466 3.538 . 0 0 "[ . 1 . 2 .]" 1 740 1 25 GLU HA 1 28 VAL H 3.498 . 5.027 3.953 3.566 4.178 . 0 0 "[ . 1 . 2 .]" 1 741 1 25 GLU HA 1 28 VAL MG2 2.837 . 3.843 3.552 3.290 3.878 0.035 16 0 "[ . 1 . 2 .]" 1 742 1 25 GLU HA 1 41 TYR QE 4.301 . 6.613 4.421 4.013 4.914 . 0 0 "[ . 1 . 2 .]" 1 743 1 25 GLU HA 1 43 LEU MD1 1.981 . 2.471 2.107 1.876 2.474 0.003 12 0 "[ . 1 . 2 .]" 1 744 1 25 GLU HB2 1 25 GLU HG3 2.716 . 3.638 2.495 2.420 3.008 . 0 0 "[ . 1 . 2 .]" 1 745 1 25 GLU HB2 1 25 GLU HG3 2.842 . 3.851 1.964 1.907 2.050 . 0 0 "[ . 1 . 2 .]" 1 746 1 25 GLU HB2 1 26 ASN H 2.657 . 3.540 2.594 2.419 3.902 0.362 25 0 "[ . 1 . 2 .]" 1 747 1 25 GLU HB2 1 26 ASN H 3.475 . 4.985 2.529 2.382 3.379 . 0 0 "[ . 1 . 2 .]" 1 748 1 25 GLU HB2 1 27 ASP H 5.280 . 8.764 5.116 4.960 5.824 . 0 0 "[ . 1 . 2 .]" 1 749 1 25 GLU HB2 1 28 VAL H 4.235 . 6.477 5.901 5.567 6.108 . 0 0 "[ . 1 . 2 .]" 1 750 1 25 GLU HB2 1 41 TYR QD 4.513 . 7.059 4.995 3.344 5.211 . 0 0 "[ . 1 . 2 .]" 1 751 1 25 GLU HB2 1 29 ILE MG 4.284 . 6.578 6.354 5.269 6.594 0.016 15 0 "[ . 1 . 2 .]" 1 752 1 25 GLU HB3 1 26 ASN H 3.530 . 5.087 3.712 3.511 3.852 . 0 0 "[ . 1 . 2 .]" 1 753 1 25 GLU HB3 1 29 ILE MD 2.518 . 3.311 3.004 2.751 3.959 0.648 25 1 "[ . 1 . 2 +]" 1 754 1 25 GLU HB3 1 41 TYR QE 3.538 . 5.103 3.146 2.400 3.815 . 0 0 "[ . 1 . 2 .]" 1 755 1 25 GLU HG2 1 26 ASN HD21 4.795 . 7.669 6.257 5.216 6.931 . 0 0 "[ . 1 . 2 .]" 1 756 1 25 GLU HG2 1 28 VAL MG2 3.839 . 5.681 4.197 3.794 5.501 . 0 0 "[ . 1 . 2 .]" 1 757 1 25 GLU HG2 1 29 ILE MD 3.898 . 5.797 4.820 4.233 5.130 . 0 0 "[ . 1 . 2 .]" 1 758 1 25 GLU HG2 1 41 TYR QD 4.163 . 6.330 4.243 3.872 5.178 . 0 0 "[ . 1 . 2 .]" 1 759 1 25 GLU HG2 1 41 TYR QE 3.341 . 4.737 3.037 2.692 3.809 . 0 0 "[ . 1 . 2 .]" 1 760 1 25 GLU HG2 1 47 THR H 5.157 . 8.481 8.525 8.190 9.436 0.955 16 3 "[ . 1 - .+ 2* .]" 1 761 1 25 GLU HG3 1 26 ASN H 4.398 . 6.816 3.985 2.307 4.984 . 0 0 "[ . 1 . 2 .]" 1 762 1 25 GLU HG3 1 29 ILE MD 4.098 . 6.197 5.318 2.838 5.701 . 0 0 "[ . 1 . 2 .]" 1 763 1 25 GLU HG3 1 41 TYR QE 4.468 . 6.963 4.580 3.115 5.027 . 0 0 "[ . 1 . 2 .]" 1 764 1 25 GLU HG3 1 51 PHE H 5.547 . 9.392 6.567 6.343 6.846 . 0 0 "[ . 1 . 2 .]" 1 765 1 26 ASN H 1 26 ASN HA 2.828 . 3.828 2.803 2.784 2.831 . 0 0 "[ . 1 . 2 .]" 1 766 1 26 ASN H 1 26 ASN QB . . 2.985 2.325 2.195 2.599 . 0 0 "[ . 1 . 2 .]" 1 767 1 26 ASN H 1 26 ASN QB 2.389 . 3.103 2.154 2.012 2.403 . 0 0 "[ . 1 . 2 .]" 1 768 1 26 ASN H 1 26 ASN HD21 3.470 . 4.975 4.057 2.198 4.742 . 0 0 "[ . 1 . 2 .]" 1 769 1 26 ASN H 1 27 ASP H 2.997 . 4.120 2.748 2.658 2.809 . 0 0 "[ . 1 . 2 .]" 1 770 1 26 ASN H 1 27 ASP HB3 6.586 . 12.008 6.346 6.238 6.443 . 0 0 "[ . 1 . 2 .]" 1 771 1 26 ASN H 1 28 VAL MG2 5.671 . 9.692 4.942 4.797 5.146 . 0 0 "[ . 1 . 2 .]" 1 772 1 26 ASN H 1 29 ILE HB 3.479 . 4.992 3.593 3.510 3.718 . 0 0 "[ . 1 . 2 .]" 1 773 1 26 ASN H 1 29 ILE MD 4.118 . 6.238 4.327 4.122 4.616 . 0 0 "[ . 1 . 2 .]" 1 774 1 26 ASN H 1 43 LEU MD1 4.914 . 7.932 4.990 4.698 5.274 . 0 0 "[ . 1 . 2 .]" 1 775 1 26 ASN HA 1 28 VAL MG1 3.957 . 5.914 3.960 3.697 4.070 . 0 0 "[ . 1 . 2 .]" 1 776 1 26 ASN HA 1 26 ASN QB 3.136 . 3.475 2.387 2.317 2.448 . 0 0 "[ . 1 . 2 .]" 1 777 1 26 ASN HA 1 26 ASN HD21 4.492 . 7.014 3.092 2.225 3.721 . 0 0 "[ . 1 . 2 .]" 1 778 1 26 ASN HA 1 26 ASN HD22 3.981 . 5.962 3.422 3.146 3.462 . 0 0 "[ . 1 . 2 .]" 1 779 1 26 ASN HA 1 26 ASN HD22 4.037 . 6.074 3.260 2.639 3.419 . 0 0 "[ . 1 . 2 .]" 1 780 1 26 ASN HA 1 29 ILE H 3.580 . 5.182 3.740 3.607 3.947 . 0 0 "[ . 1 . 2 .]" 1 781 1 26 ASN HA 1 29 ILE HB 2.765 . 3.721 2.899 2.695 3.140 . 0 0 "[ . 1 . 2 .]" 1 782 1 26 ASN HA 1 29 ILE MD 3.290 . 4.643 2.879 2.502 3.426 . 0 0 "[ . 1 . 2 .]" 1 783 1 26 ASN HA 1 29 ILE MD 3.107 . 4.313 2.793 2.470 3.183 . 0 0 "[ . 1 . 2 .]" 1 784 1 26 ASN HA 1 29 ILE MG 3.706 . 5.423 4.097 3.962 4.273 . 0 0 "[ . 1 . 2 .]" 1 785 1 26 ASN HA 1 29 ILE MG 3.841 . 5.685 3.811 3.191 4.064 . 0 0 "[ . 1 . 2 .]" 1 786 1 26 ASN HA 1 43 LEU MD1 3.911 . 5.823 3.484 3.142 3.607 . 0 0 "[ . 1 . 2 .]" 1 787 1 26 ASN QB 1 26 ASN HD21 . . 3.186 2.193 2.133 2.796 . 0 0 "[ . 1 . 2 .]" 1 788 1 26 ASN QB 1 26 ASN HD21 2.888 . 3.931 1.954 1.814 2.142 0.031 4 0 "[ . 1 . 2 .]" 1 789 1 26 ASN QB 1 26 ASN HD22 3.711 . 5.432 2.504 2.431 2.593 . 0 0 "[ . 1 . 2 .]" 1 790 1 26 ASN QB 1 27 ASP H 2.577 . 3.407 2.604 2.517 2.706 . 0 0 "[ . 1 . 2 .]" 1 791 1 26 ASN QB 1 28 VAL H 5.315 . 8.846 4.832 4.775 4.929 . 0 0 "[ . 1 . 2 .]" 1 792 1 26 ASN QB 1 29 ILE H 5.205 . 8.592 5.118 4.943 5.315 . 0 0 "[ . 1 . 2 .]" 1 793 1 26 ASN QB 1 30 ASN HD21 2.983 . 4.095 2.817 2.473 3.757 . 0 0 "[ . 1 . 2 .]" 1 794 1 26 ASN HD22 1 29 ILE HG12 5.426 . 9.107 6.498 5.663 7.168 . 0 0 "[ . 1 . 2 .]" 1 795 1 27 ASP H 1 27 ASP HA 2.768 . 3.726 2.817 2.802 2.838 . 0 0 "[ . 1 . 2 .]" 1 796 1 27 ASP H 1 27 ASP HB2 2.637 . 3.506 2.506 2.375 2.644 . 0 0 "[ . 1 . 2 .]" 1 797 1 27 ASP H 1 27 ASP HB3 3.765 . 5.537 3.626 3.602 3.654 . 0 0 "[ . 1 . 2 .]" 1 798 1 27 ASP H 1 28 VAL HB 4.395 . 6.810 4.924 4.810 5.031 . 0 0 "[ . 1 . 2 .]" 1 799 1 27 ASP H 1 28 VAL MG1 4.179 . 6.362 5.056 4.923 5.200 . 0 0 "[ . 1 . 2 .]" 1 800 1 27 ASP H 1 28 VAL MG2 3.311 . 4.681 3.321 2.712 3.639 . 0 0 "[ . 1 . 2 .]" 1 801 1 27 ASP H 1 29 ILE MG 3.964 . 5.928 5.482 5.280 5.616 . 0 0 "[ . 1 . 2 .]" 1 802 1 27 ASP HA 1 30 ASN HD21 4.629 . 7.307 3.753 2.438 5.930 . 0 0 "[ . 1 . 2 .]" 1 803 1 27 ASP HA 1 30 ASN HD22 4.042 . 6.084 4.876 3.852 5.980 . 0 0 "[ . 1 . 2 .]" 1 804 1 27 ASP HA 1 74 ILE MD 3.556 . 5.137 3.075 2.049 3.236 . 0 0 "[ . 1 . 2 .]" 1 805 1 27 ASP HB2 1 28 VAL H 3.099 . 4.300 2.522 2.414 2.707 . 0 0 "[ . 1 . 2 .]" 1 806 1 27 ASP HB2 1 28 VAL H 2.839 . 3.846 2.085 2.020 2.408 . 0 0 "[ . 1 . 2 .]" 1 807 1 27 ASP HB2 1 74 ILE H 5.016 . 8.160 8.171 7.976 8.238 0.078 2 0 "[ . 1 . 2 .]" 1 808 1 27 ASP HB3 1 28 VAL H 3.935 . 5.870 3.479 3.381 3.607 . 0 0 "[ . 1 . 2 .]" 1 809 1 27 ASP HB3 1 28 VAL H 2.793 . 3.768 2.169 2.107 2.663 . 0 0 "[ . 1 . 2 .]" 1 810 1 27 ASP HB3 1 29 ILE H 5.543 . 9.384 5.580 5.462 5.683 . 0 0 "[ . 1 . 2 .]" 1 811 1 27 ASP HB3 1 33 LEU H 5.349 . 8.925 9.018 8.907 9.111 0.186 19 0 "[ . 1 . 2 .]" 1 812 1 27 ASP HB3 1 72 ALA H 4.981 . 8.082 7.393 6.724 7.821 . 0 0 "[ . 1 . 2 .]" 1 813 1 27 ASP HB3 1 74 ILE MD 2.647 . 3.523 2.040 1.763 3.570 0.047 14 0 "[ . 1 . 2 .]" 1 814 1 28 VAL H 1 28 VAL HA 2.744 . 3.685 2.815 2.808 2.830 . 0 0 "[ . 1 . 2 .]" 1 815 1 28 VAL H 1 28 VAL HB 2.553 . 3.368 2.527 2.449 2.581 . 0 0 "[ . 1 . 2 .]" 1 816 1 28 VAL H 1 28 VAL HB 2.521 . 3.316 2.257 1.895 2.526 . 0 0 "[ . 1 . 2 .]" 1 817 1 28 VAL H 1 28 VAL MG1 3.343 . 4.740 3.752 3.737 3.763 . 0 0 "[ . 1 . 2 .]" 1 818 1 28 VAL H 1 28 VAL MG2 2.270 . 2.914 2.025 1.923 2.111 . 0 0 "[ . 1 . 2 .]" 1 819 1 28 VAL H 1 29 ILE H 2.523 . 3.319 2.674 2.629 2.710 . 0 0 "[ . 1 . 2 .]" 1 820 1 28 VAL H 1 29 ILE HG13 3.460 . 4.956 3.071 2.662 3.747 . 0 0 "[ . 1 . 2 .]" 1 821 1 28 VAL H 1 30 ASN H 3.901 . 5.803 4.081 3.998 4.198 . 0 0 "[ . 1 . 2 .]" 1 822 1 28 VAL H 1 31 LEU HA 4.797 . 7.673 6.893 6.511 7.040 . 0 0 "[ . 1 . 2 .]" 1 823 1 28 VAL H 1 74 ILE MD 3.504 . 5.038 2.167 2.013 2.352 . 0 0 "[ . 1 . 2 .]" 1 824 1 28 VAL HA 1 28 VAL HB 2.583 . 3.417 3.023 3.015 3.028 . 0 0 "[ . 1 . 2 .]" 1 825 1 28 VAL HA 1 28 VAL HB 3.257 . 4.583 2.924 2.916 2.931 . 0 0 "[ . 1 . 2 .]" 1 826 1 28 VAL HA 1 28 VAL MG1 2.021 . 2.531 2.436 2.401 2.487 . 0 0 "[ . 1 . 2 .]" 1 827 1 28 VAL HA 1 28 VAL MG2 2.103 . 2.656 2.381 2.328 2.423 . 0 0 "[ . 1 . 2 .]" 1 828 1 28 VAL HA 1 29 ILE H 3.182 . 4.448 3.539 3.520 3.549 . 0 0 "[ . 1 . 2 .]" 1 829 1 28 VAL HA 1 31 LEU H 3.486 . 5.005 3.632 3.470 3.753 . 0 0 "[ . 1 . 2 .]" 1 830 1 28 VAL HA 1 31 LEU HB2 2.576 . 3.406 2.790 2.522 2.997 . 0 0 "[ . 1 . 2 .]" 1 831 1 28 VAL HA 1 31 LEU MD1 2.936 . 4.013 2.822 2.599 2.913 . 0 0 "[ . 1 . 2 .]" 1 832 1 28 VAL HA 1 31 LEU MD1 2.172 . 2.762 2.764 2.565 2.826 0.064 7 0 "[ . 1 . 2 .]" 1 833 1 28 VAL HA 1 31 LEU HG 2.774 . 3.736 2.153 2.077 2.224 . 0 0 "[ . 1 . 2 .]" 1 834 1 28 VAL HB 1 28 VAL MG1 1.840 . 2.263 2.120 2.116 2.125 . 0 0 "[ . 1 . 2 .]" 1 835 1 28 VAL HB 1 28 VAL MG1 1.682 . 2.036 2.108 2.095 2.115 0.079 22 0 "[ . 1 . 2 .]" 1 836 1 28 VAL HB 1 28 VAL MG2 2.178 . 2.771 2.127 2.123 2.131 . 0 0 "[ . 1 . 2 .]" 1 837 1 28 VAL HB 1 28 VAL MG2 1.771 . 2.163 2.072 2.035 2.106 . 0 0 "[ . 1 . 2 .]" 1 838 1 28 VAL HB 1 29 ILE H 2.680 . 3.578 2.544 2.457 2.619 . 0 0 "[ . 1 . 2 .]" 1 839 1 28 VAL HB 1 30 ASN HD22 4.641 . 7.333 5.229 4.866 5.892 . 0 0 "[ . 1 . 2 .]" 1 840 1 28 VAL HB 1 50 ALA MB 3.657 . 5.329 3.740 3.320 3.937 . 0 0 "[ . 1 . 2 .]" 1 841 1 28 VAL HB 1 74 ILE MD 3.274 . 4.614 4.624 4.487 4.815 0.201 22 0 "[ . 1 . 2 .]" 1 842 1 28 VAL MG1 1 29 ILE H 2.765 . 3.720 3.425 3.324 3.521 . 0 0 "[ . 1 . 2 .]" 1 843 1 28 VAL MG1 1 29 ILE H 3.384 . 4.815 3.043 3.004 3.092 . 0 0 "[ . 1 . 2 .]" 1 844 1 28 VAL MG1 1 29 ILE H 3.103 . 4.307 3.370 3.290 3.476 . 0 0 "[ . 1 . 2 .]" 1 845 1 28 VAL MG1 1 30 ASN H 4.634 . 7.319 4.519 4.374 4.664 . 0 0 "[ . 1 . 2 .]" 1 846 1 28 VAL MG1 1 30 ASN HD21 4.255 . 6.518 4.890 4.710 5.094 . 0 0 "[ . 1 . 2 .]" 1 847 1 28 VAL MG1 1 30 ASN HD21 5.680 . 9.713 6.222 5.606 7.190 . 0 0 "[ . 1 . 2 .]" 1 848 1 28 VAL MG1 1 30 ASN HD22 5.493 . 9.264 7.063 6.644 7.708 . 0 0 "[ . 1 . 2 .]" 1 849 1 28 VAL MG1 1 32 GLY H 3.838 . 5.679 4.166 4.077 4.275 . 0 0 "[ . 1 . 2 .]" 1 850 1 28 VAL MG1 1 81 ILE MD 3.221 . 4.518 3.382 3.079 3.608 . 0 0 "[ . 1 . 2 .]" 1 851 1 28 VAL MG1 1 50 ALA MB 1.595 . 1.913 1.763 1.694 1.830 . 0 0 "[ . 1 . 2 .]" 1 852 1 28 VAL MG2 1 29 ILE H 3.740 . 5.488 3.771 3.667 3.854 . 0 0 "[ . 1 . 2 .]" 1 853 1 28 VAL MG2 1 29 ILE H 3.186 . 4.454 3.062 2.916 3.170 . 0 0 "[ . 1 . 2 .]" 1 854 1 28 VAL MG2 1 29 ILE MD 3.084 . 4.273 4.338 4.206 4.443 0.170 22 0 "[ . 1 . 2 .]" 1 855 1 28 VAL MG2 1 30 ASN H 4.552 . 7.143 5.099 5.035 5.174 . 0 0 "[ . 1 . 2 .]" 1 856 1 28 VAL MG2 1 30 ASN HD22 5.525 . 9.340 7.168 6.466 7.813 . 0 0 "[ . 1 . 2 .]" 1 857 1 28 VAL MG2 1 31 LEU H 3.780 . 5.566 4.082 3.846 4.342 . 0 0 "[ . 1 . 2 .]" 1 858 1 28 VAL MG2 1 45 LYS QE 2.377 . 3.084 2.776 2.012 3.204 0.120 23 0 "[ . 1 . 2 .]" 1 859 1 29 ILE H 1 29 ILE HA 2.761 . 3.714 2.829 2.812 2.835 . 0 0 "[ . 1 . 2 .]" 1 860 1 29 ILE H 1 29 ILE HB 2.572 . 3.399 2.479 2.437 2.513 . 0 0 "[ . 1 . 2 .]" 1 861 1 29 ILE H 1 29 ILE HB 2.280 . 2.930 2.444 2.407 2.470 . 0 0 "[ . 1 . 2 .]" 1 862 1 29 ILE H 1 29 ILE MD 3.579 . 5.180 3.485 3.429 3.579 . 0 0 "[ . 1 . 2 .]" 1 863 1 29 ILE H 1 29 ILE HG13 2.202 . 2.808 2.134 2.092 2.192 . 0 0 "[ . 1 . 2 .]" 1 864 1 29 ILE H 1 29 ILE MG 3.141 . 4.374 3.754 3.741 3.767 . 0 0 "[ . 1 . 2 .]" 1 865 1 29 ILE H 1 29 ILE MG 3.369 . 4.788 3.265 3.155 3.346 . 0 0 "[ . 1 . 2 .]" 1 866 1 29 ILE H 1 29 ILE MG 3.140 . 4.372 2.925 2.803 3.057 . 0 0 "[ . 1 . 2 .]" 1 867 1 29 ILE H 1 29 ILE MG 3.336 . 4.727 3.058 2.913 3.198 . 0 0 "[ . 1 . 2 .]" 1 868 1 29 ILE H 1 30 ASN H 2.598 . 3.442 2.625 2.584 2.665 . 0 0 "[ . 1 . 2 .]" 1 869 1 29 ILE H 1 31 LEU H 4.209 . 6.424 4.046 3.966 4.131 . 0 0 "[ . 1 . 2 .]" 1 870 1 29 ILE H 1 74 ILE MD 4.044 . 6.089 4.553 4.427 4.981 . 0 0 "[ . 1 . 2 .]" 1 871 1 29 ILE HA 1 29 ILE HB 2.866 . 3.893 3.023 3.019 3.026 . 0 0 "[ . 1 . 2 .]" 1 872 1 29 ILE HA 1 29 ILE MD 3.712 . 5.434 3.843 3.828 3.857 . 0 0 "[ . 1 . 2 .]" 1 873 1 29 ILE HA 1 29 ILE HG12 2.317 . 2.988 2.558 2.522 2.590 . 0 0 "[ . 1 . 2 .]" 1 874 1 29 ILE HA 1 29 ILE HG13 2.899 . 3.950 2.923 2.861 2.997 . 0 0 "[ . 1 . 2 .]" 1 875 1 29 ILE HA 1 29 ILE MG 2.084 . 2.627 2.430 2.410 2.453 . 0 0 "[ . 1 . 2 .]" 1 876 1 29 ILE HA 1 30 ASN H 3.688 . 5.388 3.538 3.519 3.554 . 0 0 "[ . 1 . 2 .]" 1 877 1 29 ILE HA 1 30 ASN H 3.194 . 4.469 3.198 3.091 3.308 . 0 0 "[ . 1 . 2 .]" 1 878 1 29 ILE HA 1 31 LEU HB3 4.494 . 7.019 3.555 3.171 4.047 . 0 0 "[ . 1 . 2 .]" 1 879 1 29 ILE HA 1 33 LEU MD1 3.371 . 4.792 4.717 4.512 4.860 0.068 13 0 "[ . 1 . 2 .]" 1 880 1 29 ILE HA 1 33 LEU MD1 2.670 . 3.561 2.224 2.014 2.597 . 0 0 "[ . 1 . 2 .]" 1 881 1 29 ILE HA 1 38 VAL MG2 3.746 . 5.500 2.839 2.523 3.189 . 0 0 "[ . 1 . 2 .]" 1 882 1 29 ILE HA 1 52 LEU MD2 2.601 . 3.446 2.175 1.997 2.425 . 0 0 "[ . 1 . 2 .]" 1 883 1 29 ILE HB 1 29 ILE MD 2.199 . 2.803 2.389 2.363 2.424 . 0 0 "[ . 1 . 2 .]" 1 884 1 29 ILE HB 1 29 ILE HG13 2.330 . 3.009 2.506 2.479 2.520 . 0 0 "[ . 1 . 2 .]" 1 885 1 29 ILE HB 1 29 ILE MG 1.868 . 2.304 2.129 2.125 2.131 . 0 0 "[ . 1 . 2 .]" 1 886 1 29 ILE HB 1 30 ASN H 2.773 . 3.734 2.559 2.480 2.666 . 0 0 "[ . 1 . 2 .]" 1 887 1 29 ILE HB 1 81 ILE MD 3.870 . 5.742 5.983 5.921 6.074 0.332 11 0 "[ . 1 . 2 .]" 1 888 1 29 ILE MD 1 29 ILE HG12 2.296 . 2.955 2.116 2.114 2.118 . 0 0 "[ . 1 . 2 .]" 1 889 1 29 ILE MD 1 29 ILE HG13 2.080 . 2.621 2.118 2.115 2.119 . 0 0 "[ . 1 . 2 .]" 1 890 1 29 ILE MD 1 29 ILE HG13 1.884 . 2.328 1.962 1.947 1.990 . 0 0 "[ . 1 . 2 .]" 1 891 1 29 ILE MD 1 29 ILE MG 1.703 . 2.066 1.986 1.934 2.020 . 0 0 "[ . 1 . 2 .]" 1 892 1 29 ILE MD 1 30 ASN H 4.919 . 7.944 4.492 4.400 4.617 . 0 0 "[ . 1 . 2 .]" 1 893 1 29 ILE MD 1 38 VAL MG1 2.655 . 3.536 3.427 3.264 3.558 0.022 6 0 "[ . 1 . 2 .]" 1 894 1 29 ILE MD 1 38 VAL MG1 3.147 . 4.385 3.290 3.187 3.384 . 0 0 "[ . 1 . 2 .]" 1 895 1 29 ILE MD 1 41 TYR HB3 3.206 . 4.491 2.793 2.397 3.142 . 0 0 "[ . 1 . 2 .]" 1 896 1 29 ILE MD 1 41 TYR QD 3.237 . 4.547 2.830 2.505 3.121 . 0 0 "[ . 1 . 2 .]" 1 897 1 29 ILE MD 1 41 TYR QE 3.032 . 4.181 3.070 2.697 3.441 . 0 0 "[ . 1 . 2 .]" 1 898 1 29 ILE MD 1 43 LEU MD2 3.268 . 4.603 3.635 3.518 3.729 . 0 0 "[ . 1 . 2 .]" 1 899 1 29 ILE MD 1 43 LEU MD1 2.519 . 3.312 3.295 2.785 3.457 0.145 7 0 "[ . 1 . 2 .]" 1 900 1 29 ILE MD 1 45 LYS QG 3.947 . 5.894 5.726 5.474 5.929 0.035 9 0 "[ . 1 . 2 .]" 1 901 1 29 ILE HG12 1 41 TYR HB2 2.859 . 3.881 2.261 1.974 3.211 . 0 0 "[ . 1 . 2 .]" 1 902 1 29 ILE HG12 1 41 TYR QD 3.440 . 4.919 3.316 2.916 3.609 . 0 0 "[ . 1 . 2 .]" 1 903 1 29 ILE HG13 1 29 ILE MG 2.792 . 3.767 3.202 3.196 3.206 . 0 0 "[ . 1 . 2 .]" 1 904 1 29 ILE HG13 1 30 ASN H 4.598 . 7.240 4.214 4.159 4.278 . 0 0 "[ . 1 . 2 .]" 1 905 1 29 ILE HG13 1 41 TYR QD 4.379 . 6.775 4.007 3.667 4.242 . 0 0 "[ . 1 . 2 .]" 1 906 1 29 ILE HG13 1 52 LEU MD1 3.039 . 4.194 3.152 2.852 3.383 . 0 0 "[ . 1 . 2 .]" 1 907 1 29 ILE MG 1 30 ASN H 3.160 . 4.408 3.368 3.283 3.452 . 0 0 "[ . 1 . 2 .]" 1 908 1 29 ILE MG 1 30 ASN H 3.908 . 5.817 3.284 3.205 3.359 . 0 0 "[ . 1 . 2 .]" 1 909 1 29 ILE MG 1 30 ASN HA 3.361 . 4.773 3.343 3.234 3.418 . 0 0 "[ . 1 . 2 .]" 1 910 1 29 ILE MG 1 30 ASN HD21 5.259 . 8.716 5.039 2.693 6.184 . 0 0 "[ . 1 . 2 .]" 1 911 1 29 ILE MG 1 31 LEU H 4.239 . 6.485 4.793 4.751 4.840 . 0 0 "[ . 1 . 2 .]" 1 912 1 29 ILE MG 1 33 LEU H 3.864 . 5.730 4.113 3.804 4.630 . 0 0 "[ . 1 . 2 .]" 1 913 1 29 ILE MG 1 33 LEU HG 1.954 . 2.431 2.221 2.109 2.359 . 0 0 "[ . 1 . 2 .]" 1 914 1 29 ILE MG 1 38 VAL H 3.560 . 5.144 4.442 4.123 4.715 . 0 0 "[ . 1 . 2 .]" 1 915 1 29 ILE MG 1 38 VAL HB 2.794 . 3.770 2.632 2.307 2.920 . 0 0 "[ . 1 . 2 .]" 1 916 1 29 ILE MG 1 38 VAL MG2 2.033 . 2.550 1.690 1.656 1.723 . 0 0 "[ . 1 . 2 .]" 1 917 1 29 ILE MG 1 41 TYR HB2 3.818 . 5.640 3.543 3.158 4.425 . 0 0 "[ . 1 . 2 .]" 1 918 1 29 ILE MG 1 41 TYR QD 4.049 . 6.098 4.131 3.799 4.388 . 0 0 "[ . 1 . 2 .]" 1 919 1 29 ILE MG 1 41 TYR QE 4.465 . 6.957 5.196 4.701 5.668 . 0 0 "[ . 1 . 2 .]" 1 920 1 29 ILE MG 1 41 TYR QE 3.944 . 5.888 4.925 4.373 5.513 . 0 0 "[ . 1 . 2 .]" 1 921 1 30 ASN H 1 30 ASN HA 2.796 . 3.773 2.810 2.800 2.835 . 0 0 "[ . 1 . 2 .]" 1 922 1 30 ASN H 1 30 ASN HA 3.266 . 4.599 2.661 2.646 2.681 . 0 0 "[ . 1 . 2 .]" 1 923 1 30 ASN H 1 30 ASN HB2 2.319 . 2.991 2.340 2.297 2.426 . 0 0 "[ . 1 . 2 .]" 1 924 1 30 ASN H 1 30 ASN HB2 2.351 . 3.042 2.321 2.279 2.402 . 0 0 "[ . 1 . 2 .]" 1 925 1 30 ASN H 1 30 ASN HB3 3.711 . 5.432 3.577 3.561 3.599 . 0 0 "[ . 1 . 2 .]" 1 926 1 30 ASN H 1 30 ASN HB3 3.460 . 4.956 3.210 3.201 3.223 . 0 0 "[ . 1 . 2 .]" 1 927 1 30 ASN H 1 30 ASN HD22 4.291 . 6.593 4.320 3.793 4.978 . 0 0 "[ . 1 . 2 .]" 1 928 1 30 ASN H 1 31 LEU H 2.653 . 3.533 2.682 2.607 2.707 . 0 0 "[ . 1 . 2 .]" 1 929 1 30 ASN H 1 31 LEU H 2.576 . 3.405 2.358 2.311 2.397 . 0 0 "[ . 1 . 2 .]" 1 930 1 30 ASN H 1 31 LEU HB2 4.154 . 6.311 4.154 4.053 4.248 . 0 0 "[ . 1 . 2 .]" 1 931 1 30 ASN H 1 31 LEU HG 3.870 . 5.742 3.660 3.484 3.804 . 0 0 "[ . 1 . 2 .]" 1 932 1 30 ASN H 1 38 VAL MG2 3.718 . 5.446 3.769 3.564 4.197 . 0 0 "[ . 1 . 2 .]" 1 933 1 30 ASN HA 1 30 ASN HB3 2.908 . 3.965 2.584 2.534 2.616 . 0 0 "[ . 1 . 2 .]" 1 934 1 30 ASN HA 1 31 LEU H 3.557 . 5.139 3.486 3.478 3.492 . 0 0 "[ . 1 . 2 .]" 1 935 1 30 ASN HA 1 33 LEU H 3.567 . 5.157 3.488 3.302 3.688 . 0 0 "[ . 1 . 2 .]" 1 936 1 30 ASN HA 1 33 LEU HB2 2.735 . 3.670 2.842 2.564 3.173 . 0 0 "[ . 1 . 2 .]" 1 937 1 30 ASN HA 1 33 LEU MD1 2.763 . 3.717 1.966 1.838 2.112 . 0 0 "[ . 1 . 2 .]" 1 938 1 30 ASN HB2 1 30 ASN HD21 3.360 . 4.771 2.563 2.235 3.518 . 0 0 "[ . 1 . 2 .]" 1 939 1 30 ASN HB2 1 30 ASN HD22 2.921 . 3.987 3.627 3.480 4.072 0.085 20 0 "[ . 1 . 2 .]" 1 940 1 30 ASN HB2 1 31 LEU H 3.174 . 4.434 3.070 2.983 3.177 . 0 0 "[ . 1 . 2 .]" 1 941 1 30 ASN HB2 1 33 LEU MD1 3.509 . 5.048 3.127 2.692 3.656 . 0 0 "[ . 1 . 2 .]" 1 942 1 30 ASN HB3 1 30 ASN HD21 4.145 . 6.293 2.957 2.244 3.501 . 0 0 "[ . 1 . 2 .]" 1 943 1 30 ASN HB3 1 30 ASN HD22 3.522 . 5.073 3.803 3.485 4.068 . 0 0 "[ . 1 . 2 .]" 1 944 1 30 ASN HB3 1 31 LEU H 4.193 . 6.390 3.745 3.676 3.828 . 0 0 "[ . 1 . 2 .]" 1 945 1 31 LEU H 1 31 LEU HB2 2.186 . 2.783 2.442 2.366 2.522 . 0 0 "[ . 1 . 2 .]" 1 946 1 31 LEU H 1 31 LEU HB2 2.166 . 2.753 2.197 2.154 2.216 . 0 0 "[ . 1 . 2 .]" 1 947 1 31 LEU H 1 31 LEU HB3 3.611 . 5.241 3.604 3.592 3.617 . 0 0 "[ . 1 . 2 .]" 1 948 1 31 LEU H 1 31 LEU MD1 3.556 . 5.137 3.832 3.772 3.888 . 0 0 "[ . 1 . 2 .]" 1 949 1 31 LEU H 1 31 LEU QD 3.217 . 4.192 3.074 2.895 3.248 . 0 0 "[ . 1 . 2 .]" 1 950 1 31 LEU H 1 31 LEU MD2 3.052 . 4.216 3.240 3.003 3.503 . 0 0 "[ . 1 . 2 .]" 1 951 1 31 LEU H 1 32 GLY H 2.506 . 3.291 2.616 2.532 2.718 . 0 0 "[ . 1 . 2 .]" 1 952 1 31 LEU H 1 32 GLY HA2 4.907 . 7.917 5.237 5.168 5.316 . 0 0 "[ . 1 . 2 .]" 1 953 1 31 LEU H 1 33 LEU H 3.839 . 5.681 4.105 4.018 4.176 . 0 0 "[ . 1 . 2 .]" 1 954 1 31 LEU H 1 33 LEU HG 4.196 . 6.397 5.042 4.795 5.275 . 0 0 "[ . 1 . 2 .]" 1 955 1 31 LEU H 1 52 LEU HB3 4.928 . 7.964 6.929 6.731 7.190 . 0 0 "[ . 1 . 2 .]" 1 956 1 31 LEU HA 1 31 LEU HB2 3.229 . 4.532 2.158 2.021 2.274 . 0 0 "[ . 1 . 2 .]" 1 957 1 31 LEU HA 1 31 LEU HB2 2.324 . 2.999 2.194 2.110 2.304 . 0 0 "[ . 1 . 2 .]" 1 958 1 31 LEU HA 1 31 LEU HB3 2.861 . 3.884 2.498 2.461 2.539 . 0 0 "[ . 1 . 2 .]" 1 959 1 31 LEU HA 1 31 LEU MD1 3.925 . 5.851 3.761 3.733 3.803 . 0 0 "[ . 1 . 2 .]" 1 960 1 31 LEU HA 1 31 LEU MD2 2.015 . 2.523 1.962 1.901 2.013 . 0 0 "[ . 1 . 2 .]" 1 961 1 31 LEU HA 1 32 GLY H 4.565 . 7.170 3.522 3.498 3.535 . 0 0 "[ . 1 . 2 .]" 1 962 1 31 LEU HA 1 54 MET ME 3.858 . 5.718 5.800 5.571 5.950 0.232 7 0 "[ . 1 . 2 .]" 1 963 1 31 LEU HB2 1 31 LEU HB3 1.622 . 1.951 1.674 1.673 1.676 . 0 0 "[ . 1 . 2 .]" 1 964 1 31 LEU HB2 1 31 LEU MD1 2.253 . 2.888 2.397 2.351 2.438 . 0 0 "[ . 1 . 2 .]" 1 965 1 31 LEU HB2 1 31 LEU QD 3.332 . 4.719 2.332 2.295 2.366 . 0 0 "[ . 1 . 2 .]" 1 966 1 31 LEU HB2 1 31 LEU MD1 2.015 . 2.523 1.825 1.818 1.831 . 0 0 "[ . 1 . 2 .]" 1 967 1 31 LEU HB2 1 31 LEU MD1 1.749 . 2.132 1.986 1.974 1.997 . 0 0 "[ . 1 . 2 .]" 1 968 1 31 LEU HB2 1 31 LEU MD2 2.575 . 3.404 3.197 3.190 3.205 . 0 0 "[ . 1 . 2 .]" 1 969 1 31 LEU HB2 1 34 PRO HD3 4.015 . 6.030 5.461 5.188 5.646 . 0 0 "[ . 1 . 2 .]" 1 970 1 31 LEU HB2 1 32 GLY H 2.694 . 3.601 2.803 2.671 3.002 . 0 0 "[ . 1 . 2 .]" 1 971 1 31 LEU HB2 1 32 GLY H 2.193 . 2.794 2.077 1.966 2.189 . 0 0 "[ . 1 . 2 .]" 1 972 1 31 LEU HB2 1 33 LEU H 4.470 . 6.968 4.312 4.094 4.481 . 0 0 "[ . 1 . 2 .]" 1 973 1 31 LEU HB2 1 34 PRO HD3 3.877 . 5.756 5.387 5.220 5.516 . 0 0 "[ . 1 . 2 .]" 1 974 1 31 LEU HB2 1 66 TYR HE1 4.180 . 6.364 6.017 5.704 6.269 . 0 0 "[ . 1 . 2 .]" 1 975 1 31 LEU HB2 1 81 ILE MD 2.838 . 3.844 2.943 2.710 3.227 . 0 0 "[ . 1 . 2 .]" 1 976 1 31 LEU HB3 1 31 LEU MD1 1.916 . 2.375 2.273 2.222 2.326 . 0 0 "[ . 1 . 2 .]" 1 977 1 31 LEU HB3 1 31 LEU MD2 2.268 . 2.911 2.457 2.395 2.489 . 0 0 "[ . 1 . 2 .]" 1 978 1 31 LEU HB3 1 32 GLY H 3.840 . 5.684 3.707 3.623 3.794 . 0 0 "[ . 1 . 2 .]" 1 979 1 31 LEU HB3 1 32 GLY HA3 3.665 . 5.344 3.175 2.917 3.384 . 0 0 "[ . 1 . 2 .]" 1 980 1 31 LEU HB3 1 35 PHE H 4.800 . 7.680 5.846 5.629 6.061 . 0 0 "[ . 1 . 2 .]" 1 981 1 31 LEU MD1 1 72 ALA MB 1.655 . 1.998 2.047 2.001 2.080 0.082 15 0 "[ . 1 . 2 .]" 1 982 1 31 LEU MD1 1 74 ILE MD 1.893 . 2.341 1.612 1.554 1.755 . 0 0 "[ . 1 . 2 .]" 1 983 1 31 LEU MD1 1 74 ILE MD 1.809 . 2.218 1.749 1.651 2.084 . 0 0 "[ . 1 . 2 .]" 1 984 1 31 LEU MD1 1 81 ILE MD 2.031 . 2.547 2.388 2.049 2.611 0.064 5 0 "[ . 1 . 2 .]" 1 985 1 31 LEU MD2 1 31 LEU HG 1.813 . 2.224 2.128 2.124 2.131 . 0 0 "[ . 1 . 2 .]" 1 986 1 31 LEU MD2 1 67 TYR QE 4.654 . 7.362 4.993 4.438 5.401 . 0 0 "[ . 1 . 2 .]" 1 987 1 31 LEU MD2 1 72 ALA MB 1.595 . 1.913 1.907 1.831 1.959 0.046 6 0 "[ . 1 . 2 .]" 1 988 1 31 LEU MD2 1 74 ILE H 3.686 . 5.384 3.672 3.439 4.075 . 0 0 "[ . 1 . 2 .]" 1 989 1 32 GLY H 1 32 GLY HA3 2.630 . 3.495 2.321 2.312 2.329 . 0 0 "[ . 1 . 2 .]" 1 990 1 32 GLY H 1 33 LEU H 2.595 . 3.437 2.436 2.376 2.499 . 0 0 "[ . 1 . 2 .]" 1 991 1 32 GLY H 1 33 LEU HA 5.608 . 9.539 5.005 4.943 5.080 . 0 0 "[ . 1 . 2 .]" 1 992 1 32 GLY H 1 33 LEU HB2 4.436 . 6.896 4.564 4.410 4.733 . 0 0 "[ . 1 . 2 .]" 1 993 1 32 GLY H 1 34 PRO HD3 4.268 . 6.545 4.207 3.957 4.432 . 0 0 "[ . 1 . 2 .]" 1 994 1 32 GLY H 1 38 VAL MG2 3.919 . 5.839 3.881 3.655 4.345 . 0 0 "[ . 1 . 2 .]" 1 995 1 32 GLY H 1 52 LEU QD 3.195 . 4.471 2.744 2.561 3.049 . 0 0 "[ . 1 . 2 .]" 1 996 1 32 GLY H 1 52 LEU MD2 3.596 . 5.212 2.763 2.573 3.074 . 0 0 "[ . 1 . 2 .]" 1 997 1 32 GLY H 1 54 MET ME 3.799 . 5.603 4.142 3.752 4.396 . 0 0 "[ . 1 . 2 .]" 1 998 1 32 GLY H 1 67 TYR QE 4.423 . 6.868 3.987 3.884 4.103 . 0 0 "[ . 1 . 2 .]" 1 999 1 32 GLY H 1 72 ALA MB 3.311 . 4.681 3.689 3.658 3.717 . 0 0 "[ . 1 . 2 .]" 1 1000 1 32 GLY H 1 81 ILE MG 4.050 . 6.100 4.347 4.296 4.434 . 0 0 "[ . 1 . 2 .]" 1 1001 1 32 GLY HA2 1 33 LEU H 4.347 . 6.709 3.488 3.455 3.512 . 0 0 "[ . 1 . 2 .]" 1 1002 1 32 GLY HA2 1 35 PHE QD 4.405 . 6.831 5.321 5.130 5.479 . 0 0 "[ . 1 . 2 .]" 1 1003 1 32 GLY HA2 1 54 MET ME 3.309 . 4.677 3.539 2.991 3.902 . 0 0 "[ . 1 . 2 .]" 1 1004 1 32 GLY HA2 1 63 MET ME 3.258 . 4.585 3.208 2.458 3.586 . 0 0 "[ . 1 . 2 .]" 1 1005 1 32 GLY HA3 1 33 LEU H 3.216 . 4.509 2.849 2.776 2.913 . 0 0 "[ . 1 . 2 .]" 1 1006 1 32 GLY HA3 1 33 LEU QD 3.654 . 5.323 4.041 3.892 4.205 . 0 0 "[ . 1 . 2 .]" 1 1007 1 32 GLY HA3 1 34 PRO HD3 3.708 . 5.427 5.050 4.870 5.222 . 0 0 "[ . 1 . 2 .]" 1 1008 1 32 GLY HA3 1 52 LEU MD2 2.337 . 3.020 2.188 2.001 2.340 . 0 0 "[ . 1 . 2 .]" 1 1009 1 32 GLY HA3 1 54 MET ME 2.699 . 3.610 2.643 2.043 3.075 . 0 0 "[ . 1 . 2 .]" 1 1010 1 32 GLY HA3 1 63 MET ME 2.756 . 3.705 3.062 2.412 3.415 . 0 0 "[ . 1 . 2 .]" 1 1011 1 33 LEU H 1 33 LEU HA 2.712 . 3.631 2.734 2.719 2.771 . 0 0 "[ . 1 . 2 .]" 1 1012 1 33 LEU H 1 33 LEU HB2 2.170 . 2.758 2.447 2.342 2.583 . 0 0 "[ . 1 . 2 .]" 1 1013 1 33 LEU H 1 33 LEU HB3 4.052 . 6.105 3.586 3.560 3.612 . 0 0 "[ . 1 . 2 .]" 1 1014 1 33 LEU H 1 33 LEU HB3 4.024 . 6.048 3.243 1.994 3.569 0.006 10 0 "[ . 1 . 2 .]" 1 1015 1 33 LEU H 1 33 LEU MD1 3.724 . 5.458 3.553 3.500 3.649 . 0 0 "[ . 1 . 2 .]" 1 1016 1 33 LEU H 1 33 LEU QD 3.277 . 4.620 3.121 3.011 3.218 . 0 0 "[ . 1 . 2 .]" 1 1017 1 33 LEU H 1 33 LEU QD 3.287 . 4.638 2.802 2.743 2.842 . 0 0 "[ . 1 . 2 .]" 1 1018 1 33 LEU H 1 33 LEU MD2 3.843 . 5.689 3.464 3.282 3.659 . 0 0 "[ . 1 . 2 .]" 1 1019 1 33 LEU H 1 33 LEU HG 3.347 . 4.747 2.342 2.131 2.544 . 0 0 "[ . 1 . 2 .]" 1 1020 1 33 LEU H 1 33 LEU HG 2.993 . 4.113 2.023 1.628 2.415 0.245 4 0 "[ . 1 . 2 .]" 1 1021 1 33 LEU H 1 34 PRO HA 5.890 . 10.226 5.644 5.571 5.679 . 0 0 "[ . 1 . 2 .]" 1 1022 1 33 LEU H 1 34 PRO HD2 3.508 . 5.046 2.964 2.852 3.065 . 0 0 "[ . 1 . 2 .]" 1 1023 1 33 LEU H 1 34 PRO HD3 2.780 . 3.746 2.761 2.569 2.864 . 0 0 "[ . 1 . 2 .]" 1 1024 1 33 LEU H 1 35 PHE H 3.793 . 5.592 4.195 2.526 4.685 . 0 0 "[ . 1 . 2 .]" 1 1025 1 33 LEU H 1 35 PHE HA 5.507 . 9.298 6.664 6.520 7.011 . 0 0 "[ . 1 . 2 .]" 1 1026 1 33 LEU H 1 38 VAL MG2 3.227 . 4.529 3.176 2.910 3.522 . 0 0 "[ . 1 . 2 .]" 1 1027 1 33 LEU H 1 52 LEU HA 4.834 . 7.755 7.855 7.790 7.908 0.153 11 0 "[ . 1 . 2 .]" 1 1028 1 33 LEU H 1 54 MET ME 3.359 . 4.769 4.336 4.056 4.497 . 0 0 "[ . 1 . 2 .]" 1 1029 1 33 LEU H 1 63 MET H 5.221 . 8.629 8.593 8.074 8.804 0.175 25 0 "[ . 1 . 2 .]" 1 1030 1 33 LEU HA 1 33 LEU HB3 2.811 . 3.799 2.539 2.474 2.603 . 0 0 "[ . 1 . 2 .]" 1 1031 1 33 LEU HA 1 33 LEU MD1 3.951 . 5.903 3.835 3.805 3.876 . 0 0 "[ . 1 . 2 .]" 1 1032 1 33 LEU HA 1 33 LEU MD2 1.954 . 2.431 1.989 1.929 2.058 . 0 0 "[ . 1 . 2 .]" 1 1033 1 33 LEU HA 1 33 LEU HG 2.754 . 3.702 2.795 2.681 2.883 . 0 0 "[ . 1 . 2 .]" 1 1034 1 33 LEU HA 1 35 PHE HB2 3.777 . 5.560 5.424 5.217 5.669 0.109 5 0 "[ . 1 . 2 .]" 1 1035 1 33 LEU HA 1 36 GLY H 2.847 . 3.860 3.469 3.331 3.733 . 0 0 "[ . 1 . 2 .]" 1 1036 1 33 LEU HA 1 37 LYS H 4.585 . 7.213 4.304 3.977 4.608 . 0 0 "[ . 1 . 2 .]" 1 1037 1 33 LEU HA 1 38 VAL MG2 2.101 . 2.653 2.254 2.189 2.317 . 0 0 "[ . 1 . 2 .]" 1 1038 1 33 LEU HA 1 63 MET ME 2.696 . 3.604 3.653 3.579 3.712 0.108 13 0 "[ . 1 . 2 .]" 1 1039 1 33 LEU HB2 1 33 LEU MD1 2.068 . 2.603 2.282 2.240 2.330 . 0 0 "[ . 1 . 2 .]" 1 1040 1 33 LEU HB2 1 33 LEU QD 2.189 . 2.788 2.235 2.197 2.277 . 0 0 "[ . 1 . 2 .]" 1 1041 1 33 LEU HB2 1 34 PRO HD3 2.383 . 3.093 2.128 2.002 2.372 . 0 0 "[ . 1 . 2 .]" 1 1042 1 33 LEU HB2 1 35 PHE H 4.302 . 6.615 5.406 5.312 5.507 . 0 0 "[ . 1 . 2 .]" 1 1043 1 33 LEU HB3 1 33 LEU MD1 2.327 . 3.004 2.428 2.372 2.467 . 0 0 "[ . 1 . 2 .]" 1 1044 1 33 LEU HB3 1 33 LEU QD 2.037 . 2.556 2.111 2.103 2.127 . 0 0 "[ . 1 . 2 .]" 1 1045 1 33 LEU HB3 1 35 PHE H 5.062 . 8.265 5.438 5.331 5.533 . 0 0 "[ . 1 . 2 .]" 1 1046 1 33 LEU QD 1 33 LEU HG 1.520 . 1.809 1.893 1.890 1.894 0.085 5 0 "[ . 1 . 2 .]" 1 1047 1 33 LEU QD 1 33 LEU HG 1.765 . 2.155 1.738 1.661 1.814 . 0 0 "[ . 1 . 2 .]" 1 1048 1 33 LEU QD 1 38 VAL H 2.784 . 3.753 1.880 1.760 2.199 0.055 1 0 "[ . 1 . 2 .]" 1 1049 1 33 LEU MD1 1 41 TYR QE 3.820 . 5.644 4.069 3.869 4.223 . 0 0 "[ . 1 . 2 .]" 1 1050 1 33 LEU MD2 1 36 GLY H 3.888 . 5.778 4.870 4.657 5.057 . 0 0 "[ . 1 . 2 .]" 1 1051 1 33 LEU MD2 1 37 LYS H 4.277 . 6.564 4.507 4.209 4.775 . 0 0 "[ . 1 . 2 .]" 1 1052 1 33 LEU MD2 1 37 LYS QD 2.336 . 3.018 1.983 1.816 2.148 . 0 0 "[ . 1 . 2 .]" 1 1053 1 33 LEU MD2 1 38 VAL H 2.226 . 2.845 1.882 1.761 2.205 . 0 0 "[ . 1 . 2 .]" 1 1054 1 33 LEU MD2 1 38 VAL HB 1.897 . 2.347 1.956 1.896 2.031 . 0 0 "[ . 1 . 2 .]" 1 1055 1 33 LEU MD2 1 38 VAL MG2 1.648 . 1.988 1.750 1.669 1.859 . 0 0 "[ . 1 . 2 .]" 1 1056 1 33 LEU HG 1 38 VAL MG2 2.164 . 2.749 2.105 1.973 2.304 . 0 0 "[ . 1 . 2 .]" 1 1057 1 34 PRO HA 1 34 PRO HB3 2.605 . 3.453 2.330 2.317 2.345 . 0 0 "[ . 1 . 2 .]" 1 1058 1 34 PRO HA 1 35 PHE QD 4.745 . 7.560 3.664 3.549 3.791 . 0 0 "[ . 1 . 2 .]" 1 1059 1 34 PRO HB2 1 34 PRO HD2 2.997 . 4.120 2.839 2.807 2.890 . 0 0 "[ . 1 . 2 .]" 1 1060 1 34 PRO HB2 1 34 PRO HD3 4.179 . 6.362 3.794 3.777 3.813 . 0 0 "[ . 1 . 2 .]" 1 1061 1 34 PRO HB2 1 35 PHE QD 3.619 . 5.256 2.271 2.032 2.439 . 0 0 "[ . 1 . 2 .]" 1 1062 1 34 PRO HB2 1 66 TYR QE 2.785 . 3.755 3.419 3.010 3.739 . 0 0 "[ . 1 . 2 .]" 1 1063 1 34 PRO HB3 1 34 PRO QG 3.013 . 4.148 1.958 1.840 2.120 0.038 10 0 "[ . 1 . 2 .]" 1 1064 1 34 PRO HB3 1 35 PHE H 4.904 . 7.910 3.978 3.926 4.039 . 0 0 "[ . 1 . 2 .]" 1 1065 1 34 PRO HD2 1 34 PRO QG 2.661 . 3.546 2.242 2.233 2.252 . 0 0 "[ . 1 . 2 .]" 1 1066 1 34 PRO HD2 1 35 PHE H 3.678 . 5.369 3.165 2.958 3.441 . 0 0 "[ . 1 . 2 .]" 1 1067 1 34 PRO HD2 1 35 PHE QD 5.126 . 8.410 4.180 3.908 4.435 . 0 0 "[ . 1 . 2 .]" 1 1068 1 34 PRO HD2 1 35 PHE QD 4.506 . 7.044 3.511 3.292 3.724 . 0 0 "[ . 1 . 2 .]" 1 1069 1 34 PRO HD2 1 35 PHE QE 4.533 . 7.101 5.674 5.185 6.014 . 0 0 "[ . 1 . 2 .]" 1 1070 1 34 PRO HD2 1 36 GLY H 5.393 . 9.029 4.394 4.202 4.703 . 0 0 "[ . 1 . 2 .]" 1 1071 1 34 PRO HD3 1 35 PHE H 4.477 . 6.982 4.319 4.188 4.488 . 0 0 "[ . 1 . 2 .]" 1 1072 1 34 PRO QG 1 35 PHE H 4.473 . 6.973 4.040 3.974 4.169 . 0 0 "[ . 1 . 2 .]" 1 1073 1 34 PRO QG 1 35 PHE QD 2.949 . 4.036 3.212 2.957 3.381 . 0 0 "[ . 1 . 2 .]" 1 1074 1 34 PRO QG 1 35 PHE HZ 3.412 . 4.867 4.894 4.661 4.969 0.102 21 0 "[ . 1 . 2 .]" 1 1075 1 34 PRO QG 1 67 TYR H 4.918 . 7.942 6.420 6.333 6.483 . 0 0 "[ . 1 . 2 .]" 1 1076 1 34 PRO QG 1 70 LYS HB3 4.455 . 6.936 6.113 5.999 6.263 . 0 0 "[ . 1 . 2 .]" 1 1077 1 35 PHE H 1 35 PHE HB2 2.846 . 3.858 2.522 2.494 2.611 . 0 0 "[ . 1 . 2 .]" 1 1078 1 35 PHE H 1 35 PHE HB2 3.023 . 4.165 2.139 2.003 2.465 . 0 0 "[ . 1 . 2 .]" 1 1079 1 35 PHE H 1 35 PHE HB3 3.161 . 4.410 3.718 3.704 3.759 . 0 0 "[ . 1 . 2 .]" 1 1080 1 35 PHE H 1 35 PHE HB3 3.243 . 4.557 3.069 3.025 3.113 . 0 0 "[ . 1 . 2 .]" 1 1081 1 35 PHE H 1 35 PHE HD1 3.834 . 5.671 2.707 2.526 2.825 . 0 0 "[ . 1 . 2 .]" 1 1082 1 35 PHE H 1 35 PHE QD 2.305 . 2.969 2.190 1.998 2.304 . 0 0 "[ . 1 . 2 .]" 1 1083 1 35 PHE H 1 35 PHE QE 5.014 . 8.157 4.829 4.598 4.924 . 0 0 "[ . 1 . 2 .]" 1 1084 1 35 PHE H 1 36 GLY H 2.156 . 2.737 2.060 2.030 2.094 . 0 0 "[ . 1 . 2 .]" 1 1085 1 35 PHE H 1 63 MET QB 3.894 . 5.790 2.441 2.071 2.810 . 0 0 "[ . 1 . 2 .]" 1 1086 1 35 PHE H 1 63 MET HA 5.245 . 8.684 4.509 4.109 4.745 . 0 0 "[ . 1 . 2 .]" 1 1087 1 35 PHE H 1 63 MET QB 3.145 . 4.381 2.712 2.355 3.114 . 0 0 "[ . 1 . 2 .]" 1 1088 1 35 PHE H 1 63 MET ME 3.683 . 5.378 3.399 3.199 3.576 . 0 0 "[ . 1 . 2 .]" 1 1089 1 35 PHE HA 1 35 PHE HB3 2.965 . 4.064 2.525 2.459 2.544 . 0 0 "[ . 1 . 2 .]" 1 1090 1 35 PHE HA 1 35 PHE QD 3.197 . 4.475 2.980 2.902 3.052 . 0 0 "[ . 1 . 2 .]" 1 1091 1 35 PHE HA 1 36 GLY H 2.889 . 3.932 2.772 2.755 2.786 . 0 0 "[ . 1 . 2 .]" 1 1092 1 35 PHE HB2 1 35 PHE QD 2.601 . 3.447 2.427 2.387 2.476 . 0 0 "[ . 1 . 2 .]" 1 1093 1 35 PHE HB2 1 36 GLY H 3.506 . 5.043 3.228 3.159 3.280 . 0 0 "[ . 1 . 2 .]" 1 1094 1 35 PHE HB2 1 63 MET H 4.913 . 7.930 3.813 2.806 4.312 . 0 0 "[ . 1 . 2 .]" 1 1095 1 35 PHE HB2 1 63 MET ME 3.648 . 5.311 3.453 3.134 3.713 . 0 0 "[ . 1 . 2 .]" 1 1096 1 35 PHE HB3 1 35 PHE QD 2.818 . 3.811 2.347 2.313 2.380 . 0 0 "[ . 1 . 2 .]" 1 1097 1 35 PHE HB3 1 35 PHE QE 4.360 . 6.736 4.393 4.382 4.405 . 0 0 "[ . 1 . 2 .]" 1 1098 1 35 PHE HB3 1 36 GLY H 4.124 . 6.250 3.977 3.934 4.085 . 0 0 "[ . 1 . 2 .]" 1 1099 1 35 PHE HB3 1 63 MET H 4.793 . 7.665 3.525 3.259 3.744 . 0 0 "[ . 1 . 2 .]" 1 1100 1 35 PHE QD 1 36 GLY H 4.999 . 8.123 4.408 4.219 4.486 . 0 0 "[ . 1 . 2 .]" 1 1101 1 35 PHE QD 1 63 MET HA 3.681 . 5.374 2.725 2.389 2.922 . 0 0 "[ . 1 . 2 .]" 1 1102 1 35 PHE QD 1 70 LYS QE 4.871 . 7.837 4.884 4.607 5.149 . 0 0 "[ . 1 . 2 .]" 1 1103 1 35 PHE QD 1 63 MET ME 4.034 . 6.068 4.387 4.095 4.640 . 0 0 "[ . 1 . 2 .]" 1 1104 1 35 PHE QD 1 63 MET H 5.153 . 8.472 4.813 4.295 5.022 . 0 0 "[ . 1 . 2 .]" 1 1105 1 35 PHE QD 1 62 ALA MB 4.101 . 6.203 3.660 3.255 4.028 . 0 0 "[ . 1 . 2 .]" 1 1106 1 35 PHE QD 1 63 MET H 4.745 . 7.560 4.843 4.309 5.060 . 0 0 "[ . 1 . 2 .]" 1 1107 1 35 PHE QD 1 63 MET QB 4.795 . 7.668 3.332 2.202 3.777 . 0 0 "[ . 1 . 2 .]" 1 1108 1 35 PHE QD 1 66 TYR HB3 4.073 . 6.147 3.944 3.817 4.090 . 0 0 "[ . 1 . 2 .]" 1 1109 1 35 PHE QD 1 66 TYR HB3 4.224 . 6.454 3.340 3.228 3.631 . 0 0 "[ . 1 . 2 .]" 1 1110 1 35 PHE QD 1 66 TYR QD 4.738 . 7.544 3.833 3.682 4.173 . 0 0 "[ . 1 . 2 .]" 1 1111 1 35 PHE QD 1 67 TYR QE 4.760 . 7.592 3.061 2.662 3.305 . 0 0 "[ . 1 . 2 .]" 1 1112 1 35 PHE HD1 1 36 GLY H 5.005 . 8.137 4.548 4.316 4.652 . 0 0 "[ . 1 . 2 .]" 1 1113 1 35 PHE HD1 1 63 MET H 6.088 . 10.721 6.105 4.778 6.709 . 0 0 "[ . 1 . 2 .]" 1 1114 1 35 PHE QE 1 64 VAL H 5.577 . 9.465 5.906 5.828 6.033 . 0 0 "[ . 1 . 2 .]" 1 1115 1 35 PHE QE 1 63 MET HA 3.449 . 4.936 4.075 3.662 4.184 . 0 0 "[ . 1 . 2 .]" 1 1116 1 35 PHE QE 1 66 TYR HB2 4.224 . 6.454 3.827 3.584 4.181 . 0 0 "[ . 1 . 2 .]" 1 1117 1 35 PHE QE 1 66 TYR HB3 3.696 . 5.403 3.849 3.329 4.103 . 0 0 "[ . 1 . 2 .]" 1 1118 1 35 PHE QE 1 66 TYR QD 4.201 . 6.407 3.043 2.627 3.180 . 0 0 "[ . 1 . 2 .]" 1 1119 1 35 PHE HE1 1 36 GLY H 5.490 . 9.257 6.904 6.658 6.993 . 0 0 "[ . 1 . 2 .]" 1 1120 1 35 PHE HZ 1 66 TYR HB3 3.530 . 5.087 3.571 2.920 4.112 . 0 0 "[ . 1 . 2 .]" 1 1121 1 35 PHE HZ 1 66 TYR QE 3.456 . 4.949 2.918 2.684 3.295 . 0 0 "[ . 1 . 2 .]" 1 1122 1 35 PHE HZ 1 66 TYR HB2 3.862 . 5.727 4.390 3.710 4.973 . 0 0 "[ . 1 . 2 .]" 1 1123 1 35 PHE HZ 1 66 TYR HB3 3.078 . 4.262 3.662 2.955 4.261 . 0 0 "[ . 1 . 2 .]" 1 1124 1 35 PHE HZ 1 66 TYR HD1 4.248 . 6.503 3.902 3.591 4.367 . 0 0 "[ . 1 . 2 .]" 1 1125 1 35 PHE HZ 1 66 TYR QD 3.600 . 5.220 3.618 3.368 3.809 . 0 0 "[ . 1 . 2 .]" 1 1126 1 36 GLY H 1 36 GLY HA2 2.580 . 3.412 2.933 2.910 2.952 . 0 0 "[ . 1 . 2 .]" 1 1127 1 36 GLY H 1 36 GLY HA3 2.384 . 3.095 2.577 2.485 2.652 . 0 0 "[ . 1 . 2 .]" 1 1128 1 36 GLY H 1 37 LYS H 4.044 . 6.088 4.263 4.014 4.428 . 0 0 "[ . 1 . 2 .]" 1 1129 1 36 GLY H 1 37 LYS H 4.403 . 6.826 3.957 3.804 4.048 . 0 0 "[ . 1 . 2 .]" 1 1130 1 36 GLY H 1 37 LYS QD 3.933 . 5.866 5.247 4.405 5.876 0.010 16 0 "[ . 1 . 2 .]" 1 1131 1 36 GLY H 1 38 VAL MG2 4.044 . 6.088 5.162 4.876 5.492 . 0 0 "[ . 1 . 2 .]" 1 1132 1 36 GLY H 1 54 MET QB 5.322 . 8.862 6.091 5.455 6.598 . 0 0 "[ . 1 . 2 .]" 1 1133 1 36 GLY H 1 54 MET ME 4.332 . 6.678 4.150 4.053 4.248 . 0 0 "[ . 1 . 2 .]" 1 1134 1 36 GLY H 1 58 GLU HA 5.055 . 8.250 8.627 8.551 8.714 0.464 9 0 "[ . 1 . 2 .]" 1 1135 1 36 GLY H 1 58 GLU HB2 5.516 . 9.319 8.579 8.239 9.319 . 0 0 "[ . 1 . 2 .]" 1 1136 1 36 GLY H 1 59 ALA HA 4.699 . 7.459 5.157 4.852 5.636 . 0 0 "[ . 1 . 2 .]" 1 1137 1 36 GLY H 1 63 MET ME 2.615 . 3.470 2.196 2.038 2.369 . 0 0 "[ . 1 . 2 .]" 1 1138 1 36 GLY HA2 1 37 LYS H 2.135 . 2.705 2.459 2.108 2.940 0.235 19 0 "[ . 1 . 2 .]" 1 1139 1 36 GLY HA2 1 37 LYS H 2.164 . 2.749 1.967 1.860 2.174 . 0 0 "[ . 1 . 2 .]" 1 1140 1 36 GLY HA2 1 59 ALA MB 2.846 . 3.859 2.062 1.827 2.507 0.006 16 0 "[ . 1 . 2 .]" 1 1141 1 36 GLY HA2 1 63 MET ME 3.219 . 4.514 3.275 3.127 3.461 . 0 0 "[ . 1 . 2 .]" 1 1142 1 36 GLY HA2 1 63 MET ME 2.976 . 4.083 2.316 2.279 2.352 . 0 0 "[ . 1 . 2 .]" 1 1143 1 36 GLY HA3 1 37 LYS H 2.910 . 3.969 2.742 2.152 3.208 . 0 0 "[ . 1 . 2 .]" 1 1144 1 36 GLY HA3 1 37 LYS H 3.142 . 4.376 2.392 2.099 2.857 . 0 0 "[ . 1 . 2 .]" 1 1145 1 36 GLY HA3 1 56 TYR H 4.657 . 7.369 5.099 4.816 5.454 . 0 0 "[ . 1 . 2 .]" 1 1146 1 36 GLY HA3 1 59 ALA MB 2.674 . 3.568 2.015 1.869 2.296 . 0 0 "[ . 1 . 2 .]" 1 1147 1 36 GLY HA3 1 63 MET H 3.825 . 5.654 3.504 3.360 3.625 . 0 0 "[ . 1 . 2 .]" 1 1148 1 36 GLY HA3 1 61 GLN H 4.286 . 6.583 6.270 6.014 6.541 . 0 0 "[ . 1 . 2 .]" 1 1149 1 36 GLY HA3 1 63 MET ME 2.237 . 2.863 1.932 1.778 2.168 . 0 0 "[ . 1 . 2 .]" 1 1150 1 36 GLY HA3 1 64 VAL MG2 4.097 . 6.195 6.304 6.249 6.382 0.187 13 0 "[ . 1 . 2 .]" 1 1151 1 37 LYS H 1 37 LYS QB 2.432 . 3.171 2.420 2.205 2.738 . 0 0 "[ . 1 . 2 .]" 1 1152 1 37 LYS H 1 37 LYS HB3 2.190 . 2.789 2.604 2.390 2.899 0.110 19 0 "[ . 1 . 2 .]" 1 1153 1 37 LYS H 1 37 LYS QE 5.389 . 9.020 5.808 4.558 6.238 . 0 0 "[ . 1 . 2 .]" 1 1154 1 37 LYS H 1 37 LYS HE3 5.986 . 10.464 6.680 5.748 7.149 . 0 0 "[ . 1 . 2 .]" 1 1155 1 37 LYS H 1 37 LYS QG 4.132 . 6.266 4.052 3.972 4.212 . 0 0 "[ . 1 . 2 .]" 1 1156 1 37 LYS H 1 37 LYS QG 3.968 . 5.936 2.564 2.274 2.942 . 0 0 "[ . 1 . 2 .]" 1 1157 1 37 LYS H 1 55 ALA H 3.790 . 5.585 3.890 3.086 4.376 . 0 0 "[ . 1 . 2 .]" 1 1158 1 37 LYS H 1 55 ALA MB 3.202 . 4.484 4.009 3.530 4.518 0.034 7 0 "[ . 1 . 2 .]" 1 1159 1 37 LYS H 1 56 TYR HD1 5.059 . 8.258 3.844 2.847 5.876 . 0 0 "[ . 1 . 2 .]" 1 1160 1 37 LYS H 1 56 TYR HE1 5.445 . 9.150 5.086 3.716 7.601 . 0 0 "[ . 1 . 2 .]" 1 1161 1 37 LYS H 1 58 GLU HG3 5.671 . 9.690 7.115 5.990 9.713 0.023 8 0 "[ . 1 . 2 .]" 1 1162 1 37 LYS H 1 59 ALA HA 4.834 . 7.755 4.493 3.981 4.953 . 0 0 "[ . 1 . 2 .]" 1 1163 1 37 LYS H 1 63 MET ME 4.044 . 6.088 3.656 2.759 4.331 . 0 0 "[ . 1 . 2 .]" 1 1164 1 37 LYS HA 1 38 VAL MG2 3.499 . 5.030 3.300 3.165 3.403 . 0 0 "[ . 1 . 2 .]" 1 1165 1 37 LYS HA 1 37 LYS QB 2.415 . 3.144 2.348 2.300 2.391 . 0 0 "[ . 1 . 2 .]" 1 1166 1 37 LYS HA 1 37 LYS QB 2.517 . 3.309 2.078 1.911 2.370 . 0 0 "[ . 1 . 2 .]" 1 1167 1 37 LYS HA 1 37 LYS QG 3.178 . 4.441 2.819 2.375 3.029 . 0 0 "[ . 1 . 2 .]" 1 1168 1 37 LYS HA 1 37 LYS QG 2.927 . 3.998 2.453 2.236 2.545 . 0 0 "[ . 1 . 2 .]" 1 1169 1 37 LYS HA 1 38 VAL H 1.890 . 2.336 2.183 2.112 2.253 . 0 0 "[ . 1 . 2 .]" 1 1170 1 37 LYS HA 1 38 VAL H 2.075 . 2.613 1.958 1.878 2.203 . 0 0 "[ . 1 . 2 .]" 1 1171 1 37 LYS HA 1 38 VAL H 2.088 . 2.633 1.907 1.857 1.991 . 0 0 "[ . 1 . 2 .]" 1 1172 1 37 LYS HA 1 38 VAL MG2 3.740 . 5.488 3.395 3.238 3.541 . 0 0 "[ . 1 . 2 .]" 1 1173 1 37 LYS QB 1 37 LYS QG 1.991 . 2.486 1.783 1.750 1.808 . 0 0 "[ . 1 . 2 .]" 1 1174 1 37 LYS QB 1 54 MET H 5.157 . 8.481 6.252 6.069 6.492 . 0 0 "[ . 1 . 2 .]" 1 1175 1 37 LYS QB 1 56 TYR HE1 3.570 . 5.164 3.116 2.080 5.190 0.026 23 0 "[ . 1 . 2 .]" 1 1176 1 37 LYS QB 1 37 LYS QE 3.136 . 4.366 2.838 1.772 3.175 0.134 9 0 "[ . 1 . 2 .]" 1 1177 1 37 LYS QB 1 37 LYS QE 3.059 . 4.228 3.113 1.947 3.437 . 0 0 "[ . 1 . 2 .]" 1 1178 1 37 LYS QB 1 39 THR H 3.833 . 5.670 3.487 3.306 3.633 . 0 0 "[ . 1 . 2 .]" 1 1179 1 37 LYS QB 1 56 TYR QE 3.595 . 5.211 2.738 2.135 3.476 . 0 0 "[ . 1 . 2 .]" 1 1180 1 37 LYS QB 1 55 ALA H 2.954 . 4.045 3.139 2.663 3.455 . 0 0 "[ . 1 . 2 .]" 1 1181 1 37 LYS QB 1 55 ALA MB 2.285 . 2.938 2.306 2.027 2.596 . 0 0 "[ . 1 . 2 .]" 1 1182 1 37 LYS HB3 1 38 VAL H 3.771 . 5.549 4.026 3.820 4.290 . 0 0 "[ . 1 . 2 .]" 1 1183 1 37 LYS QD 1 37 LYS QE 1.679 . 2.031 1.814 1.780 1.863 . 0 0 "[ . 1 . 2 .]" 1 1184 1 37 LYS QD 1 37 LYS QE 1.661 . 2.006 1.696 1.666 1.739 . 0 0 "[ . 1 . 2 .]" 1 1185 1 37 LYS QD 1 38 VAL H 3.186 . 4.454 2.818 1.935 4.499 0.045 17 0 "[ . 1 . 2 .]" 1 1186 1 37 LYS QD 1 38 VAL H 2.122 . 2.685 2.042 1.825 2.239 . 0 0 "[ . 1 . 2 .]" 1 1187 1 37 LYS QD 1 38 VAL HA 3.108 . 4.315 4.106 3.964 4.287 . 0 0 "[ . 1 . 2 .]" 1 1188 1 37 LYS QD 1 103 ILE MD 4.040 . 6.080 4.123 2.220 6.020 . 0 0 "[ . 1 . 2 .]" 1 1189 1 37 LYS QE 1 37 LYS QG 2.940 . 3.586 2.260 2.123 2.393 . 0 0 "[ . 1 . 2 .]" 1 1190 1 37 LYS QE 1 39 THR H 4.187 . 6.379 5.450 4.305 6.012 . 0 0 "[ . 1 . 2 .]" 1 1191 1 37 LYS QE 1 55 ALA H 4.784 . 7.645 5.477 4.095 6.332 . 0 0 "[ . 1 . 2 .]" 1 1192 1 37 LYS QE 1 55 ALA MB 3.455 . 4.947 3.934 2.761 4.453 . 0 0 "[ . 1 . 2 .]" 1 1193 1 37 LYS QE 1 97 LYS H 4.945 . 8.001 7.006 4.466 8.040 0.039 9 0 "[ . 1 . 2 .]" 1 1194 1 37 LYS QG 1 38 VAL H 4.080 . 6.160 2.585 2.282 3.004 . 0 0 "[ . 1 . 2 .]" 1 1195 1 37 LYS QG 1 38 VAL H 2.971 . 4.074 2.421 1.865 2.820 0.003 25 0 "[ . 1 . 2 .]" 1 1196 1 37 LYS QG 1 39 THR HA 3.487 . 5.007 4.204 3.939 4.535 . 0 0 "[ . 1 . 2 .]" 1 1197 1 37 LYS QG 1 55 ALA MB 1.644 . 1.982 1.728 1.641 1.751 . 0 0 "[ . 1 . 2 .]" 1 1198 1 38 VAL H 1 38 VAL HA 2.911 . 3.970 2.911 2.883 2.932 . 0 0 "[ . 1 . 2 .]" 1 1199 1 38 VAL H 1 38 VAL HA 2.456 . 3.210 2.832 2.811 2.859 . 0 0 "[ . 1 . 2 .]" 1 1200 1 38 VAL H 1 38 VAL HB 2.179 . 2.772 2.454 2.413 2.516 . 0 0 "[ . 1 . 2 .]" 1 1201 1 38 VAL H 1 38 VAL HB 2.311 . 2.978 2.312 2.271 2.359 . 0 0 "[ . 1 . 2 .]" 1 1202 1 38 VAL H 1 38 VAL HB 2.433 . 3.173 2.286 2.248 2.329 . 0 0 "[ . 1 . 2 .]" 1 1203 1 38 VAL H 1 38 VAL HB 2.421 . 3.154 2.154 2.076 2.262 . 0 0 "[ . 1 . 2 .]" 1 1204 1 38 VAL H 1 38 VAL HB 2.585 . 3.421 2.292 2.178 2.458 . 0 0 "[ . 1 . 2 .]" 1 1205 1 38 VAL H 1 38 VAL QG 2.623 . 3.483 2.437 2.281 2.549 . 0 0 "[ . 1 . 2 .]" 1 1206 1 38 VAL H 1 38 VAL MG2 2.516 . 3.307 2.469 2.302 2.592 . 0 0 "[ . 1 . 2 .]" 1 1207 1 38 VAL H 1 38 VAL MG2 2.526 . 3.323 2.270 2.160 2.340 . 0 0 "[ . 1 . 2 .]" 1 1208 1 38 VAL H 1 39 THR H 4.339 . 6.693 4.467 4.284 4.522 . 0 0 "[ . 1 . 2 .]" 1 1209 1 38 VAL H 1 39 THR MG 3.705 . 5.421 3.758 3.639 3.858 . 0 0 "[ . 1 . 2 .]" 1 1210 1 38 VAL HA 1 38 VAL MG1 2.205 . 2.813 2.426 2.388 2.449 . 0 0 "[ . 1 . 2 .]" 1 1211 1 38 VAL HA 1 38 VAL MG2 2.124 . 2.688 2.361 2.341 2.403 . 0 0 "[ . 1 . 2 .]" 1 1212 1 38 VAL HA 1 39 THR H 2.270 . 2.914 2.167 2.109 2.215 . 0 0 "[ . 1 . 2 .]" 1 1213 1 38 VAL HA 1 39 THR H 2.094 . 2.642 2.130 2.076 2.187 . 0 0 "[ . 1 . 2 .]" 1 1214 1 38 VAL HA 1 54 MET HA 3.168 . 4.422 2.385 2.179 2.708 . 0 0 "[ . 1 . 2 .]" 1 1215 1 38 VAL HA 1 55 ALA H 3.648 . 5.311 3.572 3.238 4.041 . 0 0 "[ . 1 . 2 .]" 1 1216 1 38 VAL HA 1 55 ALA H 2.744 . 3.685 2.770 2.684 2.829 . 0 0 "[ . 1 . 2 .]" 1 1217 1 38 VAL HB 1 38 VAL MG1 2.053 . 2.580 2.125 2.123 2.129 . 0 0 "[ . 1 . 2 .]" 1 1218 1 38 VAL HB 1 38 VAL MG2 1.961 . 2.442 2.128 2.125 2.131 . 0 0 "[ . 1 . 2 .]" 1 1219 1 38 VAL HB 1 38 VAL MG2 2.069 . 2.604 2.084 2.033 2.104 . 0 0 "[ . 1 . 2 .]" 1 1220 1 38 VAL HB 1 39 THR H 3.790 . 5.585 3.466 3.331 3.527 . 0 0 "[ . 1 . 2 .]" 1 1221 1 38 VAL HB 1 39 THR H 3.306 . 4.672 3.992 3.923 4.103 . 0 0 "[ . 1 . 2 .]" 1 1222 1 38 VAL HB 1 39 THR H 3.968 . 5.936 3.564 3.392 3.623 . 0 0 "[ . 1 . 2 .]" 1 1223 1 38 VAL HB 1 52 LEU HG 3.243 . 4.557 2.880 2.069 3.048 . 0 0 "[ . 1 . 2 .]" 1 1224 1 38 VAL MG1 1 39 THR H 2.247 . 2.878 2.556 2.481 2.875 . 0 0 "[ . 1 . 2 .]" 1 1225 1 38 VAL MG1 1 40 ASN H 2.127 . 2.693 2.569 2.425 2.699 0.006 19 0 "[ . 1 . 2 .]" 1 1226 1 38 VAL MG1 1 40 ASN HA 2.758 . 3.709 3.536 3.101 3.748 0.039 1 0 "[ . 1 . 2 .]" 1 1227 1 38 VAL MG1 1 41 TYR H 4.312 . 6.636 4.466 4.224 4.658 . 0 0 "[ . 1 . 2 .]" 1 1228 1 38 VAL MG1 1 41 TYR HB3 2.642 . 3.514 3.040 2.643 3.272 . 0 0 "[ . 1 . 2 .]" 1 1229 1 38 VAL MG1 1 41 TYR QD 4.093 . 6.188 3.657 3.224 4.001 . 0 0 "[ . 1 . 2 .]" 1 1230 1 38 VAL MG1 1 41 TYR QD 3.544 . 5.114 2.921 2.459 3.358 . 0 0 "[ . 1 . 2 .]" 1 1231 1 38 VAL MG1 1 41 TYR QE 3.997 . 5.994 3.888 3.046 4.381 . 0 0 "[ . 1 . 2 .]" 1 1232 1 38 VAL MG1 1 42 ILE H 4.529 . 7.092 5.811 5.510 5.980 . 0 0 "[ . 1 . 2 .]" 1 1233 1 38 VAL MG1 1 52 LEU MD1 1.578 . 1.889 1.921 1.899 1.942 0.053 9 0 "[ . 1 . 2 .]" 1 1234 1 38 VAL MG1 1 53 GLU H 2.757 . 3.707 2.773 2.549 3.263 . 0 0 "[ . 1 . 2 .]" 1 1235 1 38 VAL MG2 1 39 THR H 3.798 . 5.601 3.941 3.898 4.049 . 0 0 "[ . 1 . 2 .]" 1 1236 1 38 VAL MG2 1 39 THR H 3.161 . 4.410 3.658 3.555 3.759 . 0 0 "[ . 1 . 2 .]" 1 1237 1 38 VAL MG2 1 41 TYR QD 3.947 . 5.895 5.674 5.310 5.917 0.022 25 0 "[ . 1 . 2 .]" 1 1238 1 38 VAL MG2 1 52 LEU HB3 3.683 . 5.378 4.067 3.920 4.193 . 0 0 "[ . 1 . 2 .]" 1 1239 1 38 VAL MG2 1 52 LEU HG 2.640 . 3.511 2.028 1.923 2.109 . 0 0 "[ . 1 . 2 .]" 1 1240 1 38 VAL MG2 1 54 MET HA 3.160 . 4.408 3.789 3.467 4.211 . 0 0 "[ . 1 . 2 .]" 1 1241 1 39 THR H 1 39 THR MG 2.662 . 3.548 2.677 2.459 2.826 . 0 0 "[ . 1 . 2 .]" 1 1242 1 39 THR H 1 40 ASN H 2.108 . 2.664 2.113 1.990 2.250 . 0 0 "[ . 1 . 2 .]" 1 1243 1 39 THR H 1 54 MET HA 3.154 . 4.397 2.662 2.547 2.764 . 0 0 "[ . 1 . 2 .]" 1 1244 1 39 THR H 1 53 GLU HG3 3.837 . 5.677 4.663 3.207 5.417 . 0 0 "[ . 1 . 2 .]" 1 1245 1 39 THR H 1 54 MET H 5.078 . 8.301 4.459 4.274 4.698 . 0 0 "[ . 1 . 2 .]" 1 1246 1 39 THR H 1 54 MET HA 3.103 . 4.307 3.059 2.789 3.363 . 0 0 "[ . 1 . 2 .]" 1 1247 1 39 THR H 1 54 MET HB3 4.999 . 8.123 5.508 5.193 5.882 . 0 0 "[ . 1 . 2 .]" 1 1248 1 39 THR H 1 55 ALA H 3.461 . 4.958 3.902 3.705 4.197 . 0 0 "[ . 1 . 2 .]" 1 1249 1 39 THR HA 1 39 THR MG 2.210 . 2.820 2.338 2.275 2.440 . 0 0 "[ . 1 . 2 .]" 1 1250 1 39 THR HA 1 40 ASN H 3.685 . 5.383 2.652 2.068 3.125 . 0 0 "[ . 1 . 2 .]" 1 1251 1 39 THR HA 1 104 GLN QG 3.396 . 4.837 4.016 3.814 4.070 . 0 0 "[ . 1 . 2 .]" 1 1252 1 39 THR HA 1 104 GLN QG 3.599 . 5.218 3.980 3.464 4.061 . 0 0 "[ . 1 . 2 .]" 1 1253 1 39 THR HB 1 40 ASN QD 3.860 . 4.777 3.071 2.468 4.262 . 0 0 "[ . 1 . 2 .]" 1 1254 1 39 THR HB 1 40 ASN QD 3.425 . 4.891 2.507 2.143 2.875 . 0 0 "[ . 1 . 2 .]" 1 1255 1 39 THR HB 1 53 GLU HG3 4.155 . 6.313 3.292 2.700 4.001 . 0 0 "[ . 1 . 2 .]" 1 1256 1 39 THR MG 1 40 ASN H 3.592 . 5.204 3.657 3.512 3.784 . 0 0 "[ . 1 . 2 .]" 1 1257 1 39 THR MG 1 40 ASN QD 5.155 . 8.477 4.157 3.592 5.359 . 0 0 "[ . 1 . 2 .]" 1 1258 1 39 THR MG 1 55 ALA H 3.034 . 4.185 2.691 2.387 3.203 . 0 0 "[ . 1 . 2 .]" 1 1259 1 39 THR MG 1 55 ALA HA 1.642 . 1.979 1.973 1.755 2.112 0.133 22 0 "[ . 1 . 2 .]" 1 1260 1 39 THR MG 1 55 ALA MB 2.510 . 3.297 2.023 1.838 2.477 . 0 0 "[ . 1 . 2 .]" 1 1261 1 39 THR MG 1 56 TYR H 4.611 . 7.268 4.436 4.303 4.610 . 0 0 "[ . 1 . 2 .]" 1 1262 1 39 THR MG 1 57 THR H 4.565 . 7.170 7.256 7.123 7.352 0.182 12 0 "[ . 1 . 2 .]" 1 1263 1 39 THR MG 1 89 GLU HA 4.577 . 7.196 7.231 6.895 7.369 0.173 1 0 "[ . 1 . 2 .]" 1 1264 1 40 ASN H 1 40 ASN HA 2.777 . 3.741 2.894 2.827 2.916 . 0 0 "[ . 1 . 2 .]" 1 1265 1 40 ASN H 1 40 ASN HB2 3.031 . 4.179 3.115 2.738 4.057 . 0 0 "[ . 1 . 2 .]" 1 1266 1 40 ASN H 1 40 ASN QD 4.301 . 6.613 3.491 2.002 4.672 . 0 0 "[ . 1 . 2 .]" 1 1267 1 40 ASN H 1 41 TYR H 4.124 . 6.250 4.382 4.345 4.417 . 0 0 "[ . 1 . 2 .]" 1 1268 1 40 ASN H 1 53 GLU H 3.375 . 4.798 3.248 3.062 3.635 . 0 0 "[ . 1 . 2 .]" 1 1269 1 40 ASN H 1 53 GLU QB 3.274 . 4.614 2.034 1.856 2.567 0.078 4 0 "[ . 1 . 2 .]" 1 1270 1 40 ASN H 1 53 GLU HG2 3.601 . 5.222 3.805 3.108 4.287 . 0 0 "[ . 1 . 2 .]" 1 1271 1 40 ASN H 1 53 GLU HG3 4.148 . 6.299 4.435 3.012 5.263 . 0 0 "[ . 1 . 2 .]" 1 1272 1 40 ASN H 1 53 GLU HG3 2.708 . 3.625 2.939 2.341 3.761 0.136 17 0 "[ . 1 . 2 .]" 1 1273 1 40 ASN H 1 54 MET HA 5.517 . 9.322 4.815 4.491 5.165 . 0 0 "[ . 1 . 2 .]" 1 1274 1 40 ASN HA 1 40 ASN QD 5.128 . 7.409 3.805 3.479 4.027 . 0 0 "[ . 1 . 2 .]" 1 1275 1 40 ASN HA 1 41 TYR H 2.383 . 3.093 2.469 2.390 2.537 . 0 0 "[ . 1 . 2 .]" 1 1276 1 40 ASN HA 1 51 PHE HB3 4.700 . 7.461 7.243 7.017 7.484 0.023 5 0 "[ . 1 . 2 .]" 1 1277 1 40 ASN HA 1 90 LEU H 5.759 . 9.904 6.416 6.064 6.776 . 0 0 "[ . 1 . 2 .]" 1 1278 1 40 ASN HA 1 92 LEU MD1 3.231 . 4.536 3.365 2.828 4.412 . 0 0 "[ . 1 . 2 .]" 1 1279 1 40 ASN HB2 1 40 ASN QD . . 3.263 2.434 2.096 3.332 0.069 15 0 "[ . 1 . 2 .]" 1 1280 1 40 ASN HB2 1 41 TYR H 3.323 . 4.703 2.896 2.228 3.184 . 0 0 "[ . 1 . 2 .]" 1 1281 1 40 ASN HB2 1 90 LEU MD1 3.540 . 5.107 3.279 2.469 4.174 . 0 0 "[ . 1 . 2 .]" 1 1282 1 40 ASN HB3 1 40 ASN QD 3.916 . 5.180 2.924 2.248 3.286 . 0 0 "[ . 1 . 2 .]" 1 1283 1 40 ASN HB3 1 40 ASN QD 4.377 . 6.771 2.499 2.080 3.015 . 0 0 "[ . 1 . 2 .]" 1 1284 1 40 ASN HB3 1 41 TYR H 2.622 . 3.481 2.736 2.311 3.871 0.390 20 0 "[ . 1 . 2 .]" 1 1285 1 40 ASN HB3 1 90 LEU MD1 2.917 . 3.980 3.509 2.465 4.862 0.882 3 6 "[ + * - 1 * * * .]" 1 1286 1 40 ASN QD 1 53 GLU QB 4.853 . 7.797 3.173 1.961 4.294 . 0 0 "[ . 1 . 2 .]" 1 1287 1 40 ASN QD 1 90 LEU HB2 5.188 . 7.370 3.384 2.051 4.182 . 0 0 "[ . 1 . 2 .]" 1 1288 1 40 ASN QD 1 92 LEU MD2 5.329 . 8.878 5.040 4.084 6.099 . 0 0 "[ . 1 . 2 .]" 1 1289 1 41 TYR H 1 41 TYR HA 2.514 . 3.304 2.908 2.881 2.930 . 0 0 "[ . 1 . 2 .]" 1 1290 1 41 TYR H 1 41 TYR HB2 3.766 . 5.539 3.932 3.872 3.987 . 0 0 "[ . 1 . 2 .]" 1 1291 1 41 TYR H 1 41 TYR HD1 3.593 . 5.207 4.720 4.395 5.049 . 0 0 "[ . 1 . 2 .]" 1 1292 1 41 TYR H 1 41 TYR QD 3.435 . 4.910 2.603 2.196 2.971 . 0 0 "[ . 1 . 2 .]" 1 1293 1 41 TYR H 1 42 ILE H 3.859 . 5.720 4.337 4.286 4.383 . 0 0 "[ . 1 . 2 .]" 1 1294 1 41 TYR H 1 42 ILE HG12 4.683 . 7.424 4.203 3.922 4.529 . 0 0 "[ . 1 . 2 .]" 1 1295 1 41 TYR H 1 42 ILE MG 3.781 . 5.568 5.561 5.489 5.640 0.072 10 0 "[ . 1 . 2 .]" 1 1296 1 41 TYR H 1 90 LEU MD1 3.285 . 4.634 3.375 3.026 3.721 . 0 0 "[ . 1 . 2 .]" 1 1297 1 41 TYR H 1 92 LEU MD1 3.328 . 4.713 2.541 1.934 3.732 0.009 13 0 "[ . 1 . 2 .]" 1 1298 1 41 TYR H 1 92 LEU MD2 3.539 . 5.104 3.357 2.328 4.697 . 0 0 "[ . 1 . 2 .]" 1 1299 1 41 TYR HA 1 41 TYR HB2 2.225 . 2.844 2.430 2.380 2.471 . 0 0 "[ . 1 . 2 .]" 1 1300 1 41 TYR HA 1 41 TYR HB3 2.367 . 3.067 2.482 2.431 2.546 . 0 0 "[ . 1 . 2 .]" 1 1301 1 41 TYR HA 1 41 TYR QD 3.625 . 5.267 3.736 3.704 3.753 . 0 0 "[ . 1 . 2 .]" 1 1302 1 41 TYR HA 1 41 TYR QE 4.546 . 7.129 5.659 5.650 5.673 . 0 0 "[ . 1 . 2 .]" 1 1303 1 41 TYR HA 1 42 ILE H 2.013 . 2.520 2.242 2.223 2.263 . 0 0 "[ . 1 . 2 .]" 1 1304 1 41 TYR HA 1 42 ILE H 2.430 . 3.168 2.179 2.158 2.208 . 0 0 "[ . 1 . 2 .]" 1 1305 1 41 TYR HA 1 52 LEU MD1 3.015 . 4.151 2.816 2.504 3.061 . 0 0 "[ . 1 . 2 .]" 1 1306 1 41 TYR HA 1 53 GLU H 2.952 . 4.041 2.976 2.793 3.128 . 0 0 "[ . 1 . 2 .]" 1 1307 1 41 TYR HA 1 90 LEU MD1 1.867 . 2.303 2.103 1.949 2.305 0.002 25 0 "[ . 1 . 2 .]" 1 1308 1 41 TYR HB2 1 41 TYR HD1 3.447 . 4.932 2.355 2.303 2.428 . 0 0 "[ . 1 . 2 .]" 1 1309 1 41 TYR HB2 1 41 TYR QD 2.767 . 3.724 2.330 2.282 2.396 . 0 0 "[ . 1 . 2 .]" 1 1310 1 41 TYR HB2 1 42 ILE H 2.791 . 3.765 2.834 2.768 2.882 . 0 0 "[ . 1 . 2 .]" 1 1311 1 41 TYR HB2 1 52 LEU HA 3.152 . 4.394 3.424 3.224 3.568 . 0 0 "[ . 1 . 2 .]" 1 1312 1 41 TYR HB2 1 52 LEU MD1 2.586 . 3.422 2.606 2.387 2.782 . 0 0 "[ . 1 . 2 .]" 1 1313 1 41 TYR HB2 1 53 GLU H 4.230 . 6.467 4.701 4.301 4.914 . 0 0 "[ . 1 . 2 .]" 1 1314 1 41 TYR HB3 1 41 TYR HD1 3.344 . 4.741 3.578 3.456 3.659 . 0 0 "[ . 1 . 2 .]" 1 1315 1 41 TYR HB3 1 41 TYR QD 3.149 . 4.388 2.498 2.401 2.623 . 0 0 "[ . 1 . 2 .]" 1 1316 1 41 TYR HB3 1 41 TYR QD 2.947 . 4.032 2.139 2.090 2.297 . 0 0 "[ . 1 . 2 .]" 1 1317 1 41 TYR HB3 1 43 LEU MD2 3.614 . 5.247 3.663 2.500 4.257 . 0 0 "[ . 1 . 2 .]" 1 1318 1 41 TYR HB3 1 52 LEU HA 3.017 . 4.155 2.454 2.396 2.487 . 0 0 "[ . 1 . 2 .]" 1 1319 1 41 TYR HB3 1 52 LEU MD1 2.287 . 2.941 2.081 1.908 2.280 . 0 0 "[ . 1 . 2 .]" 1 1320 1 41 TYR HB3 1 52 LEU MD2 3.711 . 5.432 4.666 4.358 4.836 . 0 0 "[ . 1 . 2 .]" 1 1321 1 41 TYR HB3 1 53 GLU H 3.715 . 5.440 3.955 3.660 4.241 . 0 0 "[ . 1 . 2 .]" 1 1322 1 41 TYR QD 1 42 ILE H 3.876 . 5.754 3.826 3.667 4.028 . 0 0 "[ . 1 . 2 .]" 1 1323 1 41 TYR QD 1 43 LEU MD2 3.328 . 4.713 3.363 3.037 3.601 . 0 0 "[ . 1 . 2 .]" 1 1324 1 41 TYR QD 1 43 LEU H 4.015 . 6.030 3.808 3.278 4.377 . 0 0 "[ . 1 . 2 .]" 1 1325 1 41 TYR QD 1 43 LEU MD1 2.973 . 4.078 2.690 2.386 3.035 . 0 0 "[ . 1 . 2 .]" 1 1326 1 41 TYR QD 1 43 LEU MD2 3.746 . 5.500 3.414 3.069 3.676 . 0 0 "[ . 1 . 2 .]" 1 1327 1 41 TYR QD 1 43 LEU HG 2.934 . 4.010 2.035 1.851 2.430 0.007 5 0 "[ . 1 . 2 .]" 1 1328 1 41 TYR QD 1 52 LEU MD1 3.807 . 5.618 3.702 3.531 3.813 . 0 0 "[ . 1 . 2 .]" 1 1329 1 41 TYR QD 1 53 GLU H 5.109 . 8.372 5.394 5.050 5.621 . 0 0 "[ . 1 . 2 .]" 1 1330 1 41 TYR HD1 1 42 ILE H 4.625 . 7.299 3.898 3.722 4.136 . 0 0 "[ . 1 . 2 .]" 1 1331 1 41 TYR HD1 1 43 LEU H 4.469 . 6.965 3.822 3.282 4.421 . 0 0 "[ . 1 . 2 .]" 1 1332 1 41 TYR QE 1 42 ILE H 4.363 . 6.742 5.323 5.112 5.490 . 0 0 "[ . 1 . 2 .]" 1 1333 1 41 TYR QE 1 42 ILE MG 3.226 . 4.527 4.255 3.974 4.500 . 0 0 "[ . 1 . 2 .]" 1 1334 1 41 TYR QE 1 43 LEU H 4.284 . 6.578 4.453 4.208 4.867 . 0 0 "[ . 1 . 2 .]" 1 1335 1 41 TYR QE 1 43 LEU MD1 3.048 . 4.209 2.320 2.056 2.714 . 0 0 "[ . 1 . 2 .]" 1 1336 1 41 TYR QE 1 97 LYS QE 4.028 . 6.056 4.192 2.039 4.445 . 0 0 "[ . 1 . 2 .]" 1 1337 1 41 TYR QE 1 97 LYS QG 3.469 . 4.973 2.850 2.166 3.877 . 0 0 "[ . 1 . 2 .]" 1 1338 1 42 ILE H 1 42 ILE HB 2.704 . 3.618 2.707 2.646 2.794 . 0 0 "[ . 1 . 2 .]" 1 1339 1 42 ILE H 1 42 ILE HB 2.653 . 3.533 2.564 2.522 2.624 . 0 0 "[ . 1 . 2 .]" 1 1340 1 42 ILE H 1 42 ILE HG12 3.177 . 4.439 2.935 2.698 3.177 . 0 0 "[ . 1 . 2 .]" 1 1341 1 42 ILE H 1 42 ILE MG 3.141 . 4.374 3.814 3.777 3.871 . 0 0 "[ . 1 . 2 .]" 1 1342 1 42 ILE H 1 42 ILE MG 3.216 . 4.509 3.617 3.540 3.687 . 0 0 "[ . 1 . 2 .]" 1 1343 1 42 ILE H 1 43 LEU H 4.326 . 6.665 4.203 4.151 4.245 . 0 0 "[ . 1 . 2 .]" 1 1344 1 42 ILE H 1 43 LEU HA 3.272 . 4.610 4.603 4.523 4.653 0.043 8 0 "[ . 1 . 2 .]" 1 1345 1 42 ILE H 1 50 ALA MB 3.980 . 5.960 4.367 4.141 4.513 . 0 0 "[ . 1 . 2 .]" 1 1346 1 42 ILE H 1 51 PHE H 3.089 . 4.282 3.293 3.031 3.623 . 0 0 "[ . 1 . 2 .]" 1 1347 1 42 ILE H 1 51 PHE HB2 3.092 . 4.287 3.043 2.757 3.303 . 0 0 "[ . 1 . 2 .]" 1 1348 1 42 ILE H 1 51 PHE HD2 5.958 . 10.396 6.456 6.148 6.643 . 0 0 "[ . 1 . 2 .]" 1 1349 1 42 ILE H 1 52 LEU H 4.382 . 6.782 4.053 4.004 4.117 . 0 0 "[ . 1 . 2 .]" 1 1350 1 42 ILE H 1 92 LEU MD2 3.352 . 4.756 2.843 2.790 2.886 . 0 0 "[ . 1 . 2 .]" 1 1351 1 42 ILE H 1 90 LEU MD1 2.603 . 3.450 2.347 2.015 2.641 . 0 0 "[ . 1 . 2 .]" 1 1352 1 42 ILE H 1 90 LEU MD2 4.273 . 6.556 3.526 3.235 4.128 . 0 0 "[ . 1 . 2 .]" 1 1353 1 42 ILE HA 1 42 ILE HB 2.781 . 3.748 2.244 2.119 2.361 . 0 0 "[ . 1 . 2 .]" 1 1354 1 42 ILE HA 1 42 ILE MD 3.592 . 5.205 2.756 2.361 3.159 . 0 0 "[ . 1 . 2 .]" 1 1355 1 42 ILE HA 1 42 ILE HG12 3.188 . 4.458 2.388 2.336 2.473 . 0 0 "[ . 1 . 2 .]" 1 1356 1 42 ILE HA 1 42 ILE HG12 2.994 . 4.115 2.311 2.269 2.378 . 0 0 "[ . 1 . 2 .]" 1 1357 1 42 ILE HA 1 42 ILE MG 2.336 . 3.018 2.511 2.442 2.565 . 0 0 "[ . 1 . 2 .]" 1 1358 1 42 ILE HA 1 43 LEU H 2.213 . 2.825 2.137 2.101 2.156 . 0 0 "[ . 1 . 2 .]" 1 1359 1 42 ILE HA 1 92 LEU MD1 3.669 . 5.351 3.647 3.209 3.807 . 0 0 "[ . 1 . 2 .]" 1 1360 1 42 ILE HB 1 42 ILE MD 2.203 . 2.810 2.494 2.467 2.519 . 0 0 "[ . 1 . 2 .]" 1 1361 1 42 ILE HB 1 42 ILE MD 2.410 . 3.136 2.015 2.008 2.020 . 0 0 "[ . 1 . 2 .]" 1 1362 1 42 ILE HB 1 42 ILE HG12 2.566 . 3.389 3.026 3.021 3.029 . 0 0 "[ . 1 . 2 .]" 1 1363 1 42 ILE HB 1 42 ILE MG 1.828 . 2.246 2.130 2.126 2.133 . 0 0 "[ . 1 . 2 .]" 1 1364 1 42 ILE HB 1 42 ILE MG 2.014 . 2.521 1.981 1.971 1.992 . 0 0 "[ . 1 . 2 .]" 1 1365 1 42 ILE HB 1 51 PHE H 3.173 . 4.432 2.900 2.760 3.031 . 0 0 "[ . 1 . 2 .]" 1 1366 1 42 ILE HB 1 43 LEU H 3.929 . 5.859 3.612 3.387 3.832 . 0 0 "[ . 1 . 2 .]" 1 1367 1 42 ILE HB 1 51 PHE H 4.079 . 6.158 3.896 3.553 4.263 . 0 0 "[ . 1 . 2 .]" 1 1368 1 42 ILE HB 1 51 PHE QD 4.729 . 7.525 3.124 2.661 3.709 . 0 0 "[ . 1 . 2 .]" 1 1369 1 42 ILE MD 1 42 ILE HG12 1.883 . 2.326 2.117 2.115 2.120 . 0 0 "[ . 1 . 2 .]" 1 1370 1 42 ILE MD 1 42 ILE MG 1.658 . 2.002 1.900 1.871 1.926 . 0 0 "[ . 1 . 2 .]" 1 1371 1 42 ILE MD 1 43 LEU H 5.072 . 8.288 4.692 4.582 4.811 . 0 0 "[ . 1 . 2 .]" 1 1372 1 42 ILE MD 1 51 PHE HB2 3.988 . 5.976 3.931 3.558 4.287 . 0 0 "[ . 1 . 2 .]" 1 1373 1 42 ILE MD 1 51 PHE HD2 4.564 . 7.168 6.167 5.285 6.649 . 0 0 "[ . 1 . 2 .]" 1 1374 1 42 ILE MD 1 87 TYR QE 2.836 . 3.841 3.376 2.917 3.858 0.017 17 0 "[ . 1 . 2 .]" 1 1375 1 42 ILE MD 1 90 LEU MD2 2.004 . 2.506 1.878 1.831 1.916 . 0 0 "[ . 1 . 2 .]" 1 1376 1 42 ILE HG12 1 42 ILE MG 2.334 . 3.015 2.458 2.419 2.483 . 0 0 "[ . 1 . 2 .]" 1 1377 1 42 ILE HG12 1 90 LEU MD2 3.087 . 4.278 3.304 3.116 3.487 . 0 0 "[ . 1 . 2 .]" 1 1378 1 42 ILE HG12 1 91 GLN H 4.278 . 6.566 5.967 5.202 6.625 0.059 21 0 "[ . 1 . 2 .]" 1 1379 1 42 ILE HG12 1 92 LEU MD2 1.719 . 2.088 1.897 1.747 2.040 . 0 0 "[ . 1 . 2 .]" 1 1380 1 42 ILE HG13 1 92 LEU MD2 1.970 . 2.455 2.465 2.291 2.966 0.511 7 1 "[ . + 1 . 2 .]" 1 1381 1 42 ILE MG 1 43 LEU H 2.786 . 3.756 2.740 2.584 2.828 . 0 0 "[ . 1 . 2 .]" 1 1382 1 42 ILE MG 1 43 LEU H 2.534 . 3.336 2.600 2.503 2.656 . 0 0 "[ . 1 . 2 .]" 1 1383 1 42 ILE MG 1 44 MET H 3.727 . 5.463 3.229 3.149 3.307 . 0 0 "[ . 1 . 2 .]" 1 1384 1 42 ILE MG 1 51 PHE HB2 3.178 . 4.441 3.269 3.082 3.591 . 0 0 "[ . 1 . 2 .]" 1 1385 1 42 ILE MG 1 44 MET ME 1.872 . 2.310 2.105 1.915 2.317 0.007 13 0 "[ . 1 . 2 .]" 1 1386 1 42 ILE MG 1 44 MET ME 1.482 . 1.756 1.760 1.684 1.843 0.087 11 0 "[ . 1 . 2 .]" 1 1387 1 42 ILE MG 1 44 MET QG 2.640 . 3.511 2.370 2.164 2.731 . 0 0 "[ . 1 . 2 .]" 1 1388 1 42 ILE MG 1 51 PHE QD 2.967 . 4.067 2.540 2.200 3.159 . 0 0 "[ . 1 . 2 .]" 1 1389 1 42 ILE MG 1 90 LEU MD2 3.145 . 4.382 3.329 3.056 3.641 . 0 0 "[ . 1 . 2 .]" 1 1390 1 43 LEU H 1 43 LEU MD1 3.936 . 5.873 3.844 3.743 3.912 . 0 0 "[ . 1 . 2 .]" 1 1391 1 43 LEU H 1 43 LEU MD2 3.288 . 4.640 3.983 3.887 4.075 . 0 0 "[ . 1 . 2 .]" 1 1392 1 43 LEU H 1 43 LEU MD2 3.911 . 5.823 3.792 3.709 3.852 . 0 0 "[ . 1 . 2 .]" 1 1393 1 43 LEU H 1 43 LEU HG 2.506 . 3.291 3.047 2.887 3.206 . 0 0 "[ . 1 . 2 .]" 1 1394 1 43 LEU H 1 43 LEU HG 2.549 . 3.361 2.996 2.864 3.139 . 0 0 "[ . 1 . 2 .]" 1 1395 1 43 LEU H 1 44 MET H 4.757 . 7.586 4.228 4.173 4.298 . 0 0 "[ . 1 . 2 .]" 1 1396 1 43 LEU H 1 44 MET H 4.105 . 6.212 3.628 3.521 3.752 . 0 0 "[ . 1 . 2 .]" 1 1397 1 43 LEU H 1 45 LYS HB2 5.263 . 8.726 7.597 7.222 7.883 . 0 0 "[ . 1 . 2 .]" 1 1398 1 43 LEU H 1 50 ALA MB 4.796 . 7.671 5.472 5.197 5.848 . 0 0 "[ . 1 . 2 .]" 1 1399 1 43 LEU HA 1 43 LEU MD1 3.570 . 5.163 3.849 3.819 3.873 . 0 0 "[ . 1 . 2 .]" 1 1400 1 43 LEU HA 1 43 LEU MD2 2.215 . 2.829 2.050 2.022 2.083 . 0 0 "[ . 1 . 2 .]" 1 1401 1 43 LEU HA 1 43 LEU MD2 1.732 . 2.107 1.869 1.794 1.922 . 0 0 "[ . 1 . 2 .]" 1 1402 1 43 LEU HA 1 43 LEU HG 2.368 . 3.069 2.854 2.757 2.932 . 0 0 "[ . 1 . 2 .]" 1 1403 1 43 LEU HA 1 44 MET H 2.167 . 2.754 2.150 2.120 2.174 . 0 0 "[ . 1 . 2 .]" 1 1404 1 43 LEU HA 1 51 PHE H 3.545 . 5.116 3.157 2.949 3.393 . 0 0 "[ . 1 . 2 .]" 1 1405 1 43 LEU HA 1 81 ILE MD 4.438 . 6.900 6.742 6.483 6.926 0.026 16 0 "[ . 1 . 2 .]" 1 1406 1 43 LEU MD1 1 43 LEU HG 1.606 . 1.929 1.895 1.893 1.898 . 0 0 "[ . 1 . 2 .]" 1 1407 1 43 LEU MD1 1 44 MET H 4.854 . 7.799 5.323 5.210 5.400 . 0 0 "[ . 1 . 2 .]" 1 1408 1 43 LEU MD1 1 44 MET H 3.837 . 5.677 3.864 2.468 4.001 . 0 0 "[ . 1 . 2 .]" 1 1409 1 43 LEU MD2 1 43 LEU HG 1.686 . 2.041 2.118 2.115 2.122 0.081 10 0 "[ . 1 . 2 .]" 1 1410 1 43 LEU MD2 1 45 LYS QE 2.852 . 3.869 2.841 2.050 3.422 . 0 0 "[ . 1 . 2 .]" 1 1411 1 43 LEU MD2 1 45 LYS QG 2.749 . 3.694 3.745 3.389 3.848 0.154 1 0 "[ . 1 . 2 .]" 1 1412 1 43 LEU MD2 1 50 ALA HA 2.898 . 3.948 2.728 2.448 3.074 . 0 0 "[ . 1 . 2 .]" 1 1413 1 43 LEU MD2 1 50 ALA MB 1.752 . 2.136 1.725 1.669 1.802 . 0 0 "[ . 1 . 2 .]" 1 1414 1 43 LEU MD2 1 50 ALA MB 1.674 . 2.024 1.802 1.731 1.885 . 0 0 "[ . 1 . 2 .]" 1 1415 1 43 LEU MD2 1 51 PHE H 2.941 . 4.022 3.276 2.921 3.561 . 0 0 "[ . 1 . 2 .]" 1 1416 1 43 LEU HG 1 44 MET H 4.304 . 6.620 4.978 4.877 5.063 . 0 0 "[ . 1 . 2 .]" 1 1417 1 43 LEU HG 1 50 ALA MB 2.799 . 3.778 3.689 1.996 3.860 0.082 18 0 "[ . 1 . 2 .]" 1 1418 1 43 LEU HG 1 90 LEU MD2 4.203 . 6.412 6.546 6.480 6.652 0.240 21 0 "[ . 1 . 2 .]" 1 1419 1 44 MET H 1 44 MET QG 3.643 . 5.302 2.690 2.556 2.798 . 0 0 "[ . 1 . 2 .]" 1 1420 1 44 MET H 1 49 GLN H 3.817 . 5.638 4.180 3.938 4.618 . 0 0 "[ . 1 . 2 .]" 1 1421 1 44 MET H 1 50 ALA MB 3.921 . 5.843 3.943 3.677 4.222 . 0 0 "[ . 1 . 2 .]" 1 1422 1 44 MET H 1 51 PHE H 5.146 . 8.456 3.954 3.767 4.180 . 0 0 "[ . 1 . 2 .]" 1 1423 1 44 MET HA 1 44 MET ME 4.437 . 6.898 4.347 3.979 4.582 . 0 0 "[ . 1 . 2 .]" 1 1424 1 44 MET HA 1 44 MET HG3 3.527 . 5.082 3.316 2.985 3.808 . 0 0 "[ . 1 . 2 .]" 1 1425 1 44 MET HA 1 45 LYS QE 5.171 . 8.514 5.844 4.821 6.654 . 0 0 "[ . 1 . 2 .]" 1 1426 1 44 MET HA 1 45 LYS QG 5.073 . 8.290 4.266 3.831 4.963 . 0 0 "[ . 1 . 2 .]" 1 1427 1 44 MET HA 1 46 SER H 3.044 . 4.202 3.401 3.213 3.562 . 0 0 "[ . 1 . 2 .]" 1 1428 1 44 MET HA 1 47 THR H 3.717 . 5.444 4.187 4.015 4.344 . 0 0 "[ . 1 . 2 .]" 1 1429 1 44 MET HA 1 47 THR MG 3.630 . 5.277 4.953 4.641 5.267 . 0 0 "[ . 1 . 2 .]" 1 1430 1 44 MET HA 1 49 GLN H 4.465 . 6.957 5.125 4.885 5.545 . 0 0 "[ . 1 . 2 .]" 1 1431 1 44 MET QB 1 45 LYS QE 4.855 . 7.802 6.295 5.706 6.877 . 0 0 "[ . 1 . 2 .]" 1 1432 1 44 MET QB 1 51 PHE QE 2.989 . 4.106 2.613 2.319 3.100 . 0 0 "[ . 1 . 2 .]" 1 1433 1 44 MET QB 1 44 MET QG 3.088 . 4.280 1.812 1.773 1.859 0.123 18 0 "[ . 1 . 2 .]" 1 1434 1 44 MET QB 1 46 SER H 3.113 . 4.325 3.759 3.599 3.951 . 0 0 "[ . 1 . 2 .]" 1 1435 1 44 MET QB 1 46 SER H 3.556 . 5.137 3.619 3.497 3.863 . 0 0 "[ . 1 . 2 .]" 1 1436 1 44 MET QB 1 46 SER HB2 3.293 . 4.649 3.418 2.684 3.612 . 0 0 "[ . 1 . 2 .]" 1 1437 1 44 MET QB 1 47 THR H 3.790 . 5.585 2.914 2.682 3.169 . 0 0 "[ . 1 . 2 .]" 1 1438 1 44 MET QB 1 49 GLN HA 4.779 . 7.634 5.040 4.636 5.561 . 0 0 "[ . 1 . 2 .]" 1 1439 1 44 MET QB 1 51 PHE QD 3.956 . 5.913 3.311 2.549 3.657 . 0 0 "[ . 1 . 2 .]" 1 1440 1 44 MET HB3 1 44 MET HG3 2.699 . 3.609 2.828 2.427 3.012 . 0 0 "[ . 1 . 2 .]" 1 1441 1 44 MET ME 1 47 THR H 4.362 . 6.741 5.608 5.467 5.778 . 0 0 "[ . 1 . 2 .]" 1 1442 1 44 MET ME 1 48 ASN HD21 5.487 . 9.250 8.049 6.293 8.628 . 0 0 "[ . 1 . 2 .]" 1 1443 1 44 MET ME 1 48 ASN HD22 6.177 . 10.947 8.807 7.702 9.366 . 0 0 "[ . 1 . 2 .]" 1 1444 1 44 MET ME 1 51 PHE QE 2.868 . 3.896 2.885 2.464 3.415 . 0 0 "[ . 1 . 2 .]" 1 1445 1 44 MET ME 1 51 PHE H 4.677 . 7.412 4.976 4.606 5.111 . 0 0 "[ . 1 . 2 .]" 1 1446 1 44 MET ME 1 51 PHE QD 4.476 . 6.980 3.329 2.802 3.855 . 0 0 "[ . 1 . 2 .]" 1 1447 1 44 MET ME 1 51 PHE H 3.960 . 5.921 5.744 4.993 5.958 0.037 20 0 "[ . 1 . 2 .]" 1 1448 1 44 MET ME 1 51 PHE HE1 3.292 . 4.646 3.214 2.571 3.942 . 0 0 "[ . 1 . 2 .]" 1 1449 1 44 MET ME 1 87 TYR QE 3.776 . 5.558 3.434 2.212 4.511 . 0 0 "[ . 1 . 2 .]" 1 1450 1 45 LYS H 1 45 LYS HA 2.820 . 3.814 2.837 2.832 2.847 . 0 0 "[ . 1 . 2 .]" 1 1451 1 45 LYS H 1 45 LYS HB2 2.305 . 2.969 2.453 2.340 2.641 . 0 0 "[ . 1 . 2 .]" 1 1452 1 45 LYS H 1 45 LYS HB3 3.405 . 4.854 3.585 3.558 3.623 . 0 0 "[ . 1 . 2 .]" 1 1453 1 45 LYS H 1 45 LYS HB3 3.104 . 4.309 3.107 2.896 3.197 . 0 0 "[ . 1 . 2 .]" 1 1454 1 45 LYS H 1 45 LYS HB3 2.906 . 3.961 3.366 3.009 3.498 . 0 0 "[ . 1 . 2 .]" 1 1455 1 45 LYS H 1 45 LYS QG 2.805 . 3.788 2.433 2.033 3.149 . 0 0 "[ . 1 . 2 .]" 1 1456 1 45 LYS H 1 45 LYS HG3 2.885 . 3.926 3.304 2.106 3.808 . 0 0 "[ . 1 . 2 .]" 1 1457 1 45 LYS H 1 49 GLN H 4.944 . 8.000 4.903 4.658 5.068 . 0 0 "[ . 1 . 2 .]" 1 1458 1 45 LYS HA 1 45 LYS HB2 3.078 . 4.262 2.975 2.920 3.019 . 0 0 "[ . 1 . 2 .]" 1 1459 1 45 LYS HA 1 45 LYS HB3 2.712 . 3.632 2.488 2.394 2.551 . 0 0 "[ . 1 . 2 .]" 1 1460 1 45 LYS HA 1 45 LYS QD 2.916 . 3.979 2.687 2.045 4.011 0.032 16 0 "[ . 1 . 2 .]" 1 1461 1 45 LYS HA 1 45 LYS QG 2.796 . 3.774 2.687 2.372 3.042 . 0 0 "[ . 1 . 2 .]" 1 1462 1 45 LYS HA 1 45 LYS QG 2.717 . 3.640 2.401 2.105 2.677 . 0 0 "[ . 1 . 2 .]" 1 1463 1 45 LYS HA 1 49 GLN H 3.753 . 5.514 3.326 2.881 3.762 . 0 0 "[ . 1 . 2 .]" 1 1464 1 45 LYS HB2 1 45 LYS QG 2.470 . 3.233 2.024 1.907 2.262 . 0 0 "[ . 1 . 2 .]" 1 1465 1 45 LYS HB2 1 48 ASN H 5.251 . 8.698 5.299 5.118 5.497 . 0 0 "[ . 1 . 2 .]" 1 1466 1 45 LYS QD 1 45 LYS QE 2.136 . 2.706 2.021 1.978 2.093 . 0 0 "[ . 1 . 2 .]" 1 1467 1 45 LYS QE 1 45 LYS QG 2.341 . 3.026 2.341 2.108 2.793 . 0 0 "[ . 1 . 2 .]" 1 1468 1 46 SER HA 1 46 SER HB2 2.898 . 3.948 2.492 2.487 2.501 . 0 0 "[ . 1 . 2 .]" 1 1469 1 46 SER HA 1 46 SER HB3 2.756 . 3.705 2.420 2.408 2.431 . 0 0 "[ . 1 . 2 .]" 1 1470 1 46 SER HA 1 47 THR H 3.493 . 5.018 3.497 3.450 3.529 . 0 0 "[ . 1 . 2 .]" 1 1471 1 46 SER HA 1 47 THR H 4.036 . 6.072 3.372 3.323 3.412 . 0 0 "[ . 1 . 2 .]" 1 1472 1 46 SER HB2 1 47 THR H 4.754 . 7.579 3.736 3.610 3.867 . 0 0 "[ . 1 . 2 .]" 1 1473 1 46 SER HB2 1 48 ASN H 5.323 . 8.865 5.249 5.159 5.361 . 0 0 "[ . 1 . 2 .]" 1 1474 1 47 THR H 1 47 THR MG 3.149 . 4.388 2.645 2.529 2.791 . 0 0 "[ . 1 . 2 .]" 1 1475 1 47 THR H 1 47 THR MG 2.175 . 2.766 2.233 2.027 2.388 . 0 0 "[ . 1 . 2 .]" 1 1476 1 47 THR H 1 48 ASN H 2.505 . 3.289 2.322 2.054 2.477 . 0 0 "[ . 1 . 2 .]" 1 1477 1 47 THR H 1 49 GLN H 3.908 . 5.817 3.530 3.348 3.641 . 0 0 "[ . 1 . 2 .]" 1 1478 1 47 THR H 1 49 GLN QG 4.961 . 8.037 4.230 3.993 4.542 . 0 0 "[ . 1 . 2 .]" 1 1479 1 47 THR H 1 50 ALA MB 4.125 . 6.252 4.553 4.259 4.869 . 0 0 "[ . 1 . 2 .]" 1 1480 1 47 THR HA 1 49 GLN HE22 4.571 . 7.183 5.574 2.930 6.959 . 0 0 "[ . 1 . 2 .]" 1 1481 1 47 THR HA 1 49 GLN HE22 4.433 . 6.889 4.784 2.922 5.702 . 0 0 "[ . 1 . 2 .]" 1 1482 1 47 THR HA 1 48 ASN H 3.246 . 4.563 3.153 3.115 3.189 . 0 0 "[ . 1 . 2 .]" 1 1483 1 47 THR HB 1 47 THR MG 2.351 . 3.042 2.133 2.128 2.136 . 0 0 "[ . 1 . 2 .]" 1 1484 1 47 THR HB 1 48 ASN HD22 5.794 . 9.991 8.246 7.011 8.830 . 0 0 "[ . 1 . 2 .]" 1 1485 1 47 THR HB 1 49 GLN H 4.283 . 6.576 4.589 4.389 4.816 . 0 0 "[ . 1 . 2 .]" 1 1486 1 47 THR MG 1 48 ASN H 4.203 . 6.411 4.232 4.175 4.288 . 0 0 "[ . 1 . 2 .]" 1 1487 1 47 THR MG 1 48 ASN H 4.103 . 6.208 2.282 2.081 2.766 . 0 0 "[ . 1 . 2 .]" 1 1488 1 47 THR MG 1 49 GLN HE21 4.907 . 7.916 5.768 3.305 7.209 . 0 0 "[ . 1 . 2 .]" 1 1489 1 47 THR MG 1 51 PHE QE 4.930 . 7.969 5.119 4.128 5.957 . 0 0 "[ . 1 . 2 .]" 1 1490 1 48 ASN H 1 48 ASN HA 2.365 . 3.064 2.276 2.258 2.284 . 0 0 "[ . 1 . 2 .]" 1 1491 1 48 ASN H 1 48 ASN HA 2.339 . 3.023 1.994 1.946 2.132 . 0 0 "[ . 1 . 2 .]" 1 1492 1 48 ASN H 1 48 ASN QB 4.016 . 6.033 3.086 2.841 3.348 . 0 0 "[ . 1 . 2 .]" 1 1493 1 48 ASN H 1 48 ASN HD21 3.745 . 5.498 4.614 2.533 5.588 0.090 10 0 "[ . 1 . 2 .]" 1 1494 1 48 ASN H 1 48 ASN HD22 5.367 . 8.968 5.330 3.592 6.313 . 0 0 "[ . 1 . 2 .]" 1 1495 1 48 ASN HA 1 48 ASN QB 3.394 . 4.714 2.412 2.345 2.465 . 0 0 "[ . 1 . 2 .]" 1 1496 1 48 ASN HA 1 48 ASN HD22 3.687 . 5.386 4.072 3.542 4.696 . 0 0 "[ . 1 . 2 .]" 1 1497 1 48 ASN HA 1 49 GLN H 2.854 . 3.872 2.768 2.713 2.811 . 0 0 "[ . 1 . 2 .]" 1 1498 1 48 ASN QB 1 48 ASN HD21 2.480 . 3.249 2.194 2.127 2.785 . 0 0 "[ . 1 . 2 .]" 1 1499 1 48 ASN QB 1 48 ASN HD22 4.480 . 6.989 3.005 2.513 3.237 . 0 0 "[ . 1 . 2 .]" 1 1500 1 48 ASN QB 1 49 GLN H 4.652 . 7.357 3.890 3.850 3.932 . 0 0 "[ . 1 . 2 .]" 1 1501 1 48 ASN QB 1 49 GLN QG 2.466 . 3.226 3.209 3.127 3.269 0.043 10 0 "[ . 1 . 2 .]" 1 1502 1 49 GLN H 1 49 GLN HB2 2.707 . 3.623 2.758 2.687 2.837 . 0 0 "[ . 1 . 2 .]" 1 1503 1 49 GLN H 1 49 GLN HE22 6.206 . 11.020 6.406 5.853 6.784 . 0 0 "[ . 1 . 2 .]" 1 1504 1 49 GLN H 1 49 GLN HE22 5.157 . 8.482 5.294 4.846 5.772 . 0 0 "[ . 1 . 2 .]" 1 1505 1 49 GLN H 1 49 GLN QG 3.200 . 4.480 3.145 2.949 3.333 . 0 0 "[ . 1 . 2 .]" 1 1506 1 49 GLN H 1 50 ALA H 4.470 . 6.968 4.373 4.319 4.430 . 0 0 "[ . 1 . 2 .]" 1 1507 1 49 GLN H 1 50 ALA MB 4.316 . 6.645 4.736 4.573 4.830 . 0 0 "[ . 1 . 2 .]" 1 1508 1 49 GLN H 1 50 ALA MB 3.792 . 5.589 3.909 3.870 3.945 . 0 0 "[ . 1 . 2 .]" 1 1509 1 49 GLN H 1 51 PHE HZ 4.440 . 6.905 6.778 6.004 6.965 0.060 9 0 "[ . 1 . 2 .]" 1 1510 1 49 GLN HA 1 49 GLN HB3 2.476 . 3.242 2.501 2.446 2.538 . 0 0 "[ . 1 . 2 .]" 1 1511 1 49 GLN HA 1 49 GLN QG 3.493 . 5.018 2.669 2.355 2.892 . 0 0 "[ . 1 . 2 .]" 1 1512 1 49 GLN HA 1 50 ALA H 2.458 . 3.214 2.280 2.221 2.448 . 0 0 "[ . 1 . 2 .]" 1 1513 1 49 GLN HB2 1 49 GLN HE22 3.585 . 5.191 4.628 3.392 5.352 0.161 22 0 "[ . 1 . 2 .]" 1 1514 1 49 GLN HB2 1 49 GLN HE22 3.730 . 5.469 4.221 3.334 4.773 . 0 0 "[ . 1 . 2 .]" 1 1515 1 49 GLN HB3 1 49 GLN HE21 3.437 . 4.913 2.632 1.805 3.159 0.156 12 0 "[ . 1 . 2 .]" 1 1516 1 49 GLN HB3 1 49 GLN HE21 3.082 . 4.269 2.690 1.809 3.319 0.086 12 0 "[ . 1 . 2 .]" 1 1517 1 49 GLN HB3 1 49 GLN HE21 3.513 . 5.056 2.852 1.813 3.862 0.157 12 0 "[ . 1 . 2 .]" 1 1518 1 49 GLN HB3 1 49 GLN HE22 2.541 . 3.348 3.451 3.231 3.703 0.355 17 0 "[ . 1 . 2 .]" 1 1519 1 49 GLN HB3 1 50 ALA H 2.992 . 4.111 2.760 2.422 2.900 . 0 0 "[ . 1 . 2 .]" 1 1520 1 49 GLN HE21 1 49 GLN QG 3.022 . 4.164 2.358 2.128 2.792 . 0 0 "[ . 1 . 2 .]" 1 1521 1 49 GLN HE21 1 49 GLN QG 4.008 . 6.016 2.285 1.878 2.748 0.122 16 0 "[ . 1 . 2 .]" 1 1522 1 49 GLN HE21 1 49 GLN QG 3.616 . 5.251 2.281 1.877 2.737 0.104 16 0 "[ . 1 . 2 .]" 1 1523 1 49 GLN HE22 1 86 ARG QD 4.525 . 7.085 6.107 3.973 8.015 0.930 6 2 "[ .+ -1 . 2 .]" 1 1524 1 49 GLN QG 1 50 ALA H 6.403 . 11.528 4.229 3.699 4.511 . 0 0 "[ . 1 . 2 .]" 1 1525 1 50 ALA H 1 50 ALA HA 2.882 . 3.920 2.939 2.922 2.948 . 0 0 "[ . 1 . 2 .]" 1 1526 1 50 ALA H 1 50 ALA MB 2.652 . 3.531 2.557 2.511 2.639 . 0 0 "[ . 1 . 2 .]" 1 1527 1 50 ALA HA 1 50 ALA MB 1.806 . 2.214 2.129 2.123 2.134 . 0 0 "[ . 1 . 2 .]" 1 1528 1 50 ALA HA 1 51 PHE H 2.257 . 2.894 2.220 2.194 2.252 . 0 0 "[ . 1 . 2 .]" 1 1529 1 50 ALA HA 1 51 PHE QD 4.054 . 6.108 3.655 3.074 4.017 . 0 0 "[ . 1 . 2 .]" 1 1530 1 50 ALA MB 1 51 PHE H 2.781 . 3.748 2.775 2.594 2.840 . 0 0 "[ . 1 . 2 .]" 1 1531 1 50 ALA MB 1 51 PHE QD 3.809 . 5.622 3.994 3.879 4.076 . 0 0 "[ . 1 . 2 .]" 1 1532 1 51 PHE H 1 51 PHE HA 2.270 . 2.914 2.941 2.935 2.945 0.031 9 0 "[ . 1 . 2 .]" 1 1533 1 51 PHE H 1 51 PHE HB2 2.717 . 3.640 2.658 2.533 2.731 . 0 0 "[ . 1 . 2 .]" 1 1534 1 51 PHE H 1 51 PHE HB3 3.854 . 5.711 3.775 3.706 3.817 . 0 0 "[ . 1 . 2 .]" 1 1535 1 51 PHE H 1 51 PHE QD 3.357 . 4.766 2.923 2.619 3.150 . 0 0 "[ . 1 . 2 .]" 1 1536 1 51 PHE H 1 51 PHE HD2 4.270 . 6.549 4.893 4.642 5.216 . 0 0 "[ . 1 . 2 .]" 1 1537 1 51 PHE H 1 52 LEU H 4.910 . 7.923 4.321 4.256 4.390 . 0 0 "[ . 1 . 2 .]" 1 1538 1 51 PHE H 1 90 LEU MD1 4.623 . 7.295 4.416 4.172 4.808 . 0 0 "[ . 1 . 2 .]" 1 1539 1 51 PHE HA 1 51 PHE HB3 2.501 . 3.283 2.454 2.427 2.488 . 0 0 "[ . 1 . 2 .]" 1 1540 1 51 PHE HA 1 51 PHE QD 3.504 . 5.039 2.808 2.596 3.100 . 0 0 "[ . 1 . 2 .]" 1 1541 1 51 PHE HA 1 52 LEU H 2.157 . 2.738 2.150 2.116 2.193 . 0 0 "[ . 1 . 2 .]" 1 1542 1 51 PHE HB2 1 90 LEU MD1 2.933 . 4.008 3.073 2.576 3.477 . 0 0 "[ . 1 . 2 .]" 1 1543 1 51 PHE HB2 1 90 LEU MD2 2.886 . 3.927 2.489 2.301 2.740 . 0 0 "[ . 1 . 2 .]" 1 1544 1 51 PHE HB3 1 51 PHE QD 3.541 . 5.108 2.440 2.326 2.528 . 0 0 "[ . 1 . 2 .]" 1 1545 1 51 PHE HB3 1 51 PHE HD2 2.864 . 3.889 2.482 2.350 2.589 . 0 0 "[ . 1 . 2 .]" 1 1546 1 51 PHE HB3 1 51 PHE HE1 3.746 . 5.500 5.382 5.339 5.441 . 0 0 "[ . 1 . 2 .]" 1 1547 1 51 PHE HB3 1 52 LEU H 3.467 . 4.970 3.252 3.035 3.332 . 0 0 "[ . 1 . 2 .]" 1 1548 1 51 PHE HB3 1 87 TYR QD 3.993 . 5.986 3.704 3.195 4.165 . 0 0 "[ . 1 . 2 .]" 1 1549 1 51 PHE HB3 1 87 TYR QE 3.195 . 4.471 3.719 2.946 4.414 . 0 0 "[ . 1 . 2 .]" 1 1550 1 51 PHE HB3 1 90 LEU MD1 3.131 . 4.356 3.032 2.538 3.743 . 0 0 "[ . 1 . 2 .]" 1 1551 1 51 PHE HB3 1 90 LEU MD2 2.316 . 2.986 2.091 1.866 2.673 . 0 0 "[ . 1 . 2 .]" 1 1552 1 51 PHE QD 1 52 LEU H 4.624 . 7.297 4.162 3.984 4.370 . 0 0 "[ . 1 . 2 .]" 1 1553 1 51 PHE QD 1 84 SER HB3 4.511 . 7.054 3.849 3.154 4.523 . 0 0 "[ . 1 . 2 .]" 1 1554 1 51 PHE QD 1 87 TYR QD 4.291 . 6.593 3.441 2.410 3.921 . 0 0 "[ . 1 . 2 .]" 1 1555 1 51 PHE QD 1 87 TYR QE 3.248 . 4.567 4.043 3.608 4.468 . 0 0 "[ . 1 . 2 .]" 1 1556 1 51 PHE QD 1 90 LEU MD1 4.493 . 7.017 4.502 4.093 4.922 . 0 0 "[ . 1 . 2 .]" 1 1557 1 51 PHE QD 1 90 LEU MD2 3.963 . 5.927 3.555 3.404 3.946 . 0 0 "[ . 1 . 2 .]" 1 1558 1 51 PHE HD2 1 52 LEU H 5.444 . 9.148 4.250 4.051 4.506 . 0 0 "[ . 1 . 2 .]" 1 1559 1 51 PHE HD2 1 87 TYR HD1 4.339 . 6.692 5.797 2.948 6.739 0.047 4 0 "[ . 1 . 2 .]" 1 1560 1 51 PHE HD2 1 90 LEU MD2 4.039 . 6.078 3.969 3.534 4.734 . 0 0 "[ . 1 . 2 .]" 1 1561 1 51 PHE QE 1 84 SER HB3 5.369 . 8.972 4.449 3.261 5.183 . 0 0 "[ . 1 . 2 .]" 1 1562 1 51 PHE QE 1 87 TYR QD 3.171 . 4.428 3.150 2.567 3.631 . 0 0 "[ . 1 . 2 .]" 1 1563 1 51 PHE HZ 1 86 ARG QD 3.926 . 5.852 3.978 2.274 5.904 0.052 13 0 "[ . 1 . 2 .]" 1 1564 1 52 LEU H 1 52 LEU HB2 2.869 . 3.898 2.837 2.793 2.894 . 0 0 "[ . 1 . 2 .]" 1 1565 1 52 LEU H 1 52 LEU HB3 2.885 . 3.925 2.756 2.725 2.802 . 0 0 "[ . 1 . 2 .]" 1 1566 1 52 LEU H 1 52 LEU QD 3.509 . 5.048 3.857 3.838 3.886 . 0 0 "[ . 1 . 2 .]" 1 1567 1 52 LEU H 1 90 LEU MD1 3.816 . 5.637 3.508 3.247 4.185 . 0 0 "[ . 1 . 2 .]" 1 1568 1 52 LEU HA 1 52 LEU HB3 2.868 . 3.896 2.744 2.718 2.763 . 0 0 "[ . 1 . 2 .]" 1 1569 1 52 LEU HA 1 52 LEU MD1 2.621 . 3.480 1.913 1.877 1.946 . 0 0 "[ . 1 . 2 .]" 1 1570 1 52 LEU HA 1 52 LEU MD2 3.544 . 5.114 3.826 3.798 3.847 . 0 0 "[ . 1 . 2 .]" 1 1571 1 52 LEU HA 1 53 GLU H 2.369 . 3.070 2.203 2.154 2.252 . 0 0 "[ . 1 . 2 .]" 1 1572 1 52 LEU HA 1 53 GLU H 1.955 . 2.433 1.948 1.926 1.971 . 0 0 "[ . 1 . 2 .]" 1 1573 1 52 LEU HA 1 90 LEU MD1 2.766 . 3.722 2.683 2.441 3.016 . 0 0 "[ . 1 . 2 .]" 1 1574 1 52 LEU HB2 1 52 LEU MD2 2.552 . 3.366 2.356 2.328 2.392 . 0 0 "[ . 1 . 2 .]" 1 1575 1 52 LEU HB2 1 52 LEU MD2 2.598 . 3.442 2.310 2.283 2.335 . 0 0 "[ . 1 . 2 .]" 1 1576 1 52 LEU HB2 1 52 LEU HG 1.999 . 2.498 2.270 2.223 2.319 . 0 0 "[ . 1 . 2 .]" 1 1577 1 52 LEU HB2 1 53 GLU H 4.488 . 7.006 4.354 4.263 4.436 . 0 0 "[ . 1 . 2 .]" 1 1578 1 52 LEU HB2 1 54 MET ME 2.946 . 4.031 3.473 3.303 3.776 . 0 0 "[ . 1 . 2 .]" 1 1579 1 52 LEU HB3 1 52 LEU MD1 2.848 . 3.862 3.194 3.187 3.197 . 0 0 "[ . 1 . 2 .]" 1 1580 1 52 LEU HB3 1 54 MET ME 3.100 . 4.301 2.045 1.850 2.412 0.049 5 0 "[ . 1 . 2 .]" 1 1581 1 52 LEU MD1 1 53 GLU H 2.927 . 3.998 2.663 2.492 2.845 . 0 0 "[ . 1 . 2 .]" 1 1582 1 52 LEU MD2 1 52 LEU HG 2.144 . 2.718 2.129 2.127 2.130 . 0 0 "[ . 1 . 2 .]" 1 1583 1 52 LEU MD2 1 54 MET ME 1.999 . 2.498 1.901 1.815 2.014 . 0 0 "[ . 1 . 2 .]" 1 1584 1 52 LEU HG 1 53 GLU H 2.787 . 3.758 3.039 2.768 3.282 . 0 0 "[ . 1 . 2 .]" 1 1585 1 52 LEU HG 1 82 ARG H 4.788 . 7.654 7.208 7.047 7.394 . 0 0 "[ . 1 . 2 .]" 1 1586 1 53 GLU H 1 53 GLU QB 3.053 . 4.218 2.275 2.213 2.343 . 0 0 "[ . 1 . 2 .]" 1 1587 1 53 GLU H 1 53 GLU QB 3.100 . 4.301 2.135 2.064 2.298 . 0 0 "[ . 1 . 2 .]" 1 1588 1 53 GLU H 1 53 GLU HB3 2.792 . 3.766 2.552 2.363 2.682 . 0 0 "[ . 1 . 2 .]" 1 1589 1 53 GLU H 1 53 GLU HG2 4.284 . 6.578 4.546 4.318 4.705 . 0 0 "[ . 1 . 2 .]" 1 1590 1 53 GLU H 1 53 GLU HG3 5.054 . 8.246 4.509 4.272 4.656 . 0 0 "[ . 1 . 2 .]" 1 1591 1 53 GLU H 1 54 MET H 4.960 . 8.035 4.506 4.425 4.537 . 0 0 "[ . 1 . 2 .]" 1 1592 1 53 GLU H 1 92 LEU MD1 4.501 . 7.033 5.150 4.933 5.468 . 0 0 "[ . 1 . 2 .]" 1 1593 1 53 GLU H 1 90 LEU MD1 2.749 . 3.694 2.486 2.148 2.699 . 0 0 "[ . 1 . 2 .]" 1 1594 1 53 GLU HA 1 53 GLU QB 2.761 . 3.714 2.228 1.998 2.298 . 0 0 "[ . 1 . 2 .]" 1 1595 1 53 GLU HA 1 53 GLU HG2 3.160 . 4.408 3.259 2.876 3.854 . 0 0 "[ . 1 . 2 .]" 1 1596 1 53 GLU HA 1 54 MET H 2.270 . 2.914 2.191 2.110 2.238 . 0 0 "[ . 1 . 2 .]" 1 1597 1 53 GLU QB 1 53 GLU HG3 2.293 . 2.950 2.341 2.298 2.381 . 0 0 "[ . 1 . 2 .]" 1 1598 1 53 GLU QB 1 53 GLU HG3 2.206 . 2.815 1.975 1.951 1.999 . 0 0 "[ . 1 . 2 .]" 1 1599 1 53 GLU QB 1 54 MET H 4.284 . 6.578 3.283 3.151 3.381 . 0 0 "[ . 1 . 2 .]" 1 1600 1 53 GLU QB 1 90 LEU MD1 2.329 . 3.007 1.891 1.789 2.009 . 0 0 "[ . 1 . 2 .]" 1 1601 1 53 GLU HB3 1 53 GLU HG2 2.752 . 3.698 2.431 2.355 2.505 . 0 0 "[ . 1 . 2 .]" 1 1602 1 53 GLU HG2 1 54 MET H 3.407 . 4.858 3.134 2.476 4.288 . 0 0 "[ . 1 . 2 .]" 1 1603 1 53 GLU HG2 1 90 LEU MD1 3.731 . 5.471 4.329 3.480 4.632 . 0 0 "[ . 1 . 2 .]" 1 1604 1 53 GLU HG3 1 54 MET H 2.967 . 4.067 2.922 2.546 3.271 . 0 0 "[ . 1 . 2 .]" 1 1605 1 54 MET H 1 54 MET QB 3.755 . 5.517 2.513 2.348 2.639 . 0 0 "[ . 1 . 2 .]" 1 1606 1 54 MET H 1 54 MET HB3 4.030 . 6.060 3.708 3.615 3.777 . 0 0 "[ . 1 . 2 .]" 1 1607 1 54 MET H 1 54 MET QG 3.036 . 4.188 3.131 2.507 3.774 . 0 0 "[ . 1 . 2 .]" 1 1608 1 54 MET H 1 54 MET HG3 3.432 . 4.904 4.042 3.898 4.158 . 0 0 "[ . 1 . 2 .]" 1 1609 1 54 MET H 1 55 ALA H 5.008 . 8.143 4.455 4.398 4.534 . 0 0 "[ . 1 . 2 .]" 1 1610 1 54 MET H 1 60 ALA MB 3.730 . 5.469 3.814 3.514 4.164 . 0 0 "[ . 1 . 2 .]" 1 1611 1 54 MET H 1 63 MET ME 4.183 . 6.370 5.539 5.239 5.802 . 0 0 "[ . 1 . 2 .]" 1 1612 1 54 MET HA 1 54 MET QG 2.937 . 4.015 2.731 2.321 3.118 . 0 0 "[ . 1 . 2 .]" 1 1613 1 54 MET HA 1 55 ALA H 2.196 . 2.799 2.194 2.117 2.442 . 0 0 "[ . 1 . 2 .]" 1 1614 1 54 MET HA 1 55 ALA MB 4.568 . 7.176 3.976 3.912 4.153 . 0 0 "[ . 1 . 2 .]" 1 1615 1 54 MET HA 1 56 TYR H 4.659 . 7.372 4.035 3.763 4.593 . 0 0 "[ . 1 . 2 .]" 1 1616 1 54 MET HA 1 63 MET ME 3.083 . 4.271 4.279 4.013 4.383 0.112 5 0 "[ . 1 . 2 .]" 1 1617 1 54 MET QB 1 54 MET QG 2.351 . 3.042 1.989 1.967 2.006 . 0 0 "[ . 1 . 2 .]" 1 1618 1 54 MET QB 1 55 ALA H 3.495 . 5.022 2.817 2.439 3.013 . 0 0 "[ . 1 . 2 .]" 1 1619 1 54 MET QB 1 55 ALA H 3.143 . 4.378 2.224 1.869 2.948 0.039 23 0 "[ . 1 . 2 .]" 1 1620 1 54 MET QB 1 55 ALA HA 4.280 . 6.570 3.712 3.664 3.764 . 0 0 "[ . 1 . 2 .]" 1 1621 1 54 MET QB 1 56 TYR H 3.296 . 4.654 2.738 2.443 3.034 . 0 0 "[ . 1 . 2 .]" 1 1622 1 54 MET QB 1 57 THR HA 3.094 . 4.291 2.938 2.890 2.974 . 0 0 "[ . 1 . 2 .]" 1 1623 1 54 MET QB 1 59 ALA MB 2.557 . 3.374 2.341 1.953 2.925 . 0 0 "[ . 1 . 2 .]" 1 1624 1 54 MET QB 1 59 ALA MB 3.127 . 4.349 1.927 1.792 2.044 0.113 12 0 "[ . 1 . 2 .]" 1 1625 1 54 MET QB 1 60 ALA HA 3.907 . 5.815 3.119 2.943 3.243 . 0 0 "[ . 1 . 2 .]" 1 1626 1 54 MET QB 1 60 ALA MB 3.196 . 4.473 1.965 1.872 2.144 0.047 18 0 "[ . 1 . 2 .]" 1 1627 1 54 MET QB 1 61 GLN H 4.132 . 6.266 5.016 4.850 5.206 . 0 0 "[ . 1 . 2 .]" 1 1628 1 54 MET QB 1 63 MET ME 3.301 . 4.663 2.972 2.578 3.629 . 0 0 "[ . 1 . 2 .]" 1 1629 1 54 MET QB 1 62 ALA H 4.510 . 7.052 6.426 6.145 6.633 . 0 0 "[ . 1 . 2 .]" 1 1630 1 54 MET QB 1 84 SER H 5.114 . 8.383 5.623 5.123 6.042 . 0 0 "[ . 1 . 2 .]" 1 1631 1 54 MET HB3 1 55 ALA H 3.280 . 4.625 2.887 2.483 3.093 . 0 0 "[ . 1 . 2 .]" 1 1632 1 54 MET HB3 1 56 TYR H 2.808 . 3.794 2.837 2.504 3.247 . 0 0 "[ . 1 . 2 .]" 1 1633 1 54 MET HB3 1 60 ALA H 2.992 . 4.111 3.306 3.033 3.606 . 0 0 "[ . 1 . 2 .]" 1 1634 1 54 MET ME 1 60 ALA H 3.369 . 4.787 4.270 4.158 4.344 . 0 0 "[ . 1 . 2 .]" 1 1635 1 54 MET ME 1 63 MET QG 2.706 . 3.621 3.378 2.706 3.468 . 0 0 "[ . 1 . 2 .]" 1 1636 1 54 MET QG 1 55 ALA H 3.568 . 5.159 2.223 2.005 2.368 . 0 0 "[ . 1 . 2 .]" 1 1637 1 54 MET QG 1 59 ALA MB 3.994 . 5.988 3.168 2.738 3.954 . 0 0 "[ . 1 . 2 .]" 1 1638 1 54 MET QG 1 59 ALA H 4.357 . 6.730 3.256 3.184 3.450 . 0 0 "[ . 1 . 2 .]" 1 1639 1 54 MET QG 1 60 ALA H 3.984 . 5.968 3.461 3.072 3.904 . 0 0 "[ . 1 . 2 .]" 1 1640 1 54 MET QG 1 60 ALA HA 2.420 . 3.152 2.041 1.862 2.248 . 0 0 "[ . 1 . 2 .]" 1 1641 1 54 MET QG 1 60 ALA MB 2.959 . 4.054 2.389 2.034 2.824 . 0 0 "[ . 1 . 2 .]" 1 1642 1 54 MET QG 1 61 GLN H 3.903 . 5.807 2.231 2.013 2.372 . 0 0 "[ . 1 . 2 .]" 1 1643 1 54 MET QG 1 62 ALA H 5.375 . 8.986 3.769 2.010 4.114 . 0 0 "[ . 1 . 2 .]" 1 1644 1 54 MET QG 1 83 MET ME 3.042 . 4.198 3.290 2.831 4.139 . 0 0 "[ . 1 . 2 .]" 1 1645 1 54 MET QG 1 63 MET ME 2.079 . 2.619 2.139 1.790 2.688 0.069 22 0 "[ . 1 . 2 .]" 1 1646 1 54 MET HG3 1 55 ALA H 4.802 . 7.684 4.511 3.770 5.225 . 0 0 "[ . 1 . 2 .]" 1 1647 1 54 MET HG3 1 60 ALA H 3.615 . 5.248 4.204 3.414 5.171 . 0 0 "[ . 1 . 2 .]" 1 1648 1 55 ALA H 1 55 ALA HA 2.447 . 3.195 2.819 2.790 2.861 . 0 0 "[ . 1 . 2 .]" 1 1649 1 55 ALA H 1 55 ALA MB 1.908 . 2.363 2.228 2.214 2.247 . 0 0 "[ . 1 . 2 .]" 1 1650 1 55 ALA H 1 56 TYR H 2.724 . 3.652 2.625 2.471 2.725 . 0 0 "[ . 1 . 2 .]" 1 1651 1 55 ALA H 1 59 ALA MB 3.466 . 4.968 3.623 2.968 4.173 . 0 0 "[ . 1 . 2 .]" 1 1652 1 55 ALA H 1 59 ALA MB 4.004 . 6.008 3.475 2.929 3.869 . 0 0 "[ . 1 . 2 .]" 1 1653 1 55 ALA H 1 63 MET ME 3.650 . 5.315 4.602 4.325 5.105 . 0 0 "[ . 1 . 2 .]" 1 1654 1 55 ALA HA 1 55 ALA MB 1.847 . 2.274 2.128 2.123 2.132 . 0 0 "[ . 1 . 2 .]" 1 1655 1 55 ALA HA 1 56 TYR H 2.885 . 3.925 3.469 3.392 3.549 . 0 0 "[ . 1 . 2 .]" 1 1656 1 55 ALA MB 1 56 TYR H 2.268 . 2.911 2.749 2.444 2.943 0.032 8 0 "[ . 1 . 2 .]" 1 1657 1 55 ALA MB 1 56 TYR H 2.589 . 3.427 2.417 2.112 2.667 . 0 0 "[ . 1 . 2 .]" 1 1658 1 55 ALA MB 1 56 TYR HD1 3.015 . 4.152 2.771 2.182 3.447 . 0 0 "[ . 1 . 2 .]" 1 1659 1 55 ALA MB 1 56 TYR HE1 3.410 . 4.864 3.010 2.726 3.493 . 0 0 "[ . 1 . 2 .]" 1 1660 1 55 ALA MB 1 56 TYR QE 3.015 . 4.151 2.946 2.663 3.282 . 0 0 "[ . 1 . 2 .]" 1 1661 1 55 ALA MB 1 59 ALA H 4.881 . 7.859 5.692 4.966 6.062 . 0 0 "[ . 1 . 2 .]" 1 1662 1 56 TYR H 1 56 TYR HA 2.684 . 3.584 2.548 2.371 2.699 . 0 0 "[ . 1 . 2 .]" 1 1663 1 56 TYR H 1 56 TYR HB2 3.113 . 4.325 2.758 2.653 2.872 . 0 0 "[ . 1 . 2 .]" 1 1664 1 56 TYR H 1 56 TYR HB3 3.137 . 4.367 3.818 3.758 3.889 . 0 0 "[ . 1 . 2 .]" 1 1665 1 56 TYR H 1 57 THR H 5.060 . 8.260 3.756 3.332 3.906 . 0 0 "[ . 1 . 2 .]" 1 1666 1 56 TYR H 1 58 GLU H 4.532 . 7.099 4.455 4.132 4.778 . 0 0 "[ . 1 . 2 .]" 1 1667 1 56 TYR H 1 59 ALA MB 2.596 . 3.439 2.090 1.871 2.491 . 0 0 "[ . 1 . 2 .]" 1 1668 1 56 TYR H 1 59 ALA H 3.793 . 5.591 3.924 3.395 4.326 . 0 0 "[ . 1 . 2 .]" 1 1669 1 56 TYR H 1 59 ALA MB 2.474 . 3.239 2.363 1.972 2.682 . 0 0 "[ . 1 . 2 .]" 1 1670 1 56 TYR HA 1 56 TYR HB2 2.769 . 3.728 3.025 3.018 3.034 . 0 0 "[ . 1 . 2 .]" 1 1671 1 56 TYR HA 1 56 TYR HB3 2.606 . 3.455 2.430 2.380 2.549 . 0 0 "[ . 1 . 2 .]" 1 1672 1 56 TYR HA 1 56 TYR HD1 3.897 . 5.796 4.294 3.940 4.623 . 0 0 "[ . 1 . 2 .]" 1 1673 1 56 TYR HA 1 57 THR H 2.293 . 2.950 2.233 2.147 2.409 . 0 0 "[ . 1 . 2 .]" 1 1674 1 56 TYR HA 1 58 GLU H 4.448 . 6.921 4.051 3.830 4.311 . 0 0 "[ . 1 . 2 .]" 1 1675 1 56 TYR HA 1 59 ALA H 4.878 . 7.852 4.265 4.103 4.455 . 0 0 "[ . 1 . 2 .]" 1 1676 1 56 TYR HA 1 107 HIS HB3 4.701 . 7.463 6.933 5.629 8.340 0.877 23 1 "[ . 1 . 2 + .]" 1 1677 1 56 TYR HB2 1 56 TYR HD1 3.427 . 4.895 2.367 2.305 2.521 . 0 0 "[ . 1 . 2 .]" 1 1678 1 56 TYR HB2 1 56 TYR QD 2.552 . 3.366 2.341 2.285 2.474 . 0 0 "[ . 1 . 2 .]" 1 1679 1 56 TYR HB2 1 56 TYR QE 4.354 . 6.723 4.399 4.380 4.435 . 0 0 "[ . 1 . 2 .]" 1 1680 1 56 TYR HB2 1 58 GLU H 3.326 . 4.708 3.598 3.153 3.984 . 0 0 "[ . 1 . 2 .]" 1 1681 1 56 TYR HB2 1 59 ALA H 2.789 . 3.762 2.250 1.948 2.649 . 0 0 "[ . 1 . 2 .]" 1 1682 1 56 TYR HB2 1 59 ALA H 3.117 . 4.331 2.208 1.935 2.531 . 0 0 "[ . 1 . 2 .]" 1 1683 1 56 TYR HB2 1 59 ALA MB 2.828 . 3.828 2.069 1.802 3.028 0.026 9 0 "[ . 1 . 2 .]" 1 1684 1 56 TYR HB2 1 60 ALA H 4.961 . 8.037 4.211 3.914 4.866 . 0 0 "[ . 1 . 2 .]" 1 1685 1 56 TYR HB2 1 61 GLN H 5.332 . 8.886 6.270 5.975 6.613 . 0 0 "[ . 1 . 2 .]" 1 1686 1 56 TYR HB3 1 56 TYR HD1 3.584 . 5.190 3.594 3.453 3.707 . 0 0 "[ . 1 . 2 .]" 1 1687 1 56 TYR HB3 1 56 TYR QD 2.605 . 3.453 2.476 2.338 2.626 . 0 0 "[ . 1 . 2 .]" 1 1688 1 56 TYR HB3 1 58 GLU H 3.313 . 4.685 2.913 2.588 3.368 . 0 0 "[ . 1 . 2 .]" 1 1689 1 56 TYR HB3 1 59 ALA H 2.955 . 4.047 3.009 2.599 3.780 . 0 0 "[ . 1 . 2 .]" 1 1690 1 56 TYR QD 1 59 ALA MB 3.979 . 5.958 2.470 1.993 3.224 0.007 17 0 "[ . 1 . 2 .]" 1 1691 1 56 TYR QD 1 60 ALA H 5.643 . 9.624 5.616 5.287 6.120 . 0 0 "[ . 1 . 2 .]" 1 1692 1 56 TYR QD 1 107 HIS HB3 3.991 . 5.982 5.110 3.762 6.135 0.153 5 0 "[ . 1 . 2 .]" 1 1693 1 56 TYR QE 1 59 ALA MB 4.228 . 6.462 4.378 3.963 5.139 . 0 0 "[ . 1 . 2 .]" 1 1694 1 56 TYR QE 1 104 GLN QG 5.544 . 9.386 7.018 4.293 8.862 . 0 0 "[ . 1 . 2 .]" 1 1695 1 57 THR H 1 57 THR HA 2.865 . 3.891 2.816 2.781 2.843 . 0 0 "[ . 1 . 2 .]" 1 1696 1 57 THR H 1 57 THR HA 2.689 . 3.593 2.416 2.336 2.470 . 0 0 "[ . 1 . 2 .]" 1 1697 1 57 THR H 1 57 THR HB 2.587 . 3.423 2.630 2.503 2.728 . 0 0 "[ . 1 . 2 .]" 1 1698 1 57 THR H 1 57 THR MG 2.340 . 3.024 2.037 1.788 2.222 . 0 0 "[ . 1 . 2 .]" 1 1699 1 57 THR H 1 58 GLU H 3.141 . 4.374 2.630 2.532 2.740 . 0 0 "[ . 1 . 2 .]" 1 1700 1 57 THR HA 1 57 THR MG 2.743 . 3.683 3.220 3.195 3.228 . 0 0 "[ . 1 . 2 .]" 1 1701 1 57 THR HA 1 59 ALA H 3.631 . 5.279 4.147 4.042 4.248 . 0 0 "[ . 1 . 2 .]" 1 1702 1 57 THR HA 1 60 ALA H 3.231 . 4.536 3.400 3.124 3.766 . 0 0 "[ . 1 . 2 .]" 1 1703 1 57 THR HA 1 60 ALA MB 2.962 . 4.058 2.901 2.505 3.383 . 0 0 "[ . 1 . 2 .]" 1 1704 1 57 THR HA 1 60 ALA MB 3.313 . 4.685 2.897 2.506 3.393 . 0 0 "[ . 1 . 2 .]" 1 1705 1 57 THR HA 1 61 GLN H 4.239 . 6.486 4.000 3.804 4.251 . 0 0 "[ . 1 . 2 .]" 1 1706 1 57 THR HB 1 57 THR MG 1.852 . 2.281 2.131 2.125 2.134 . 0 0 "[ . 1 . 2 .]" 1 1707 1 57 THR HB 1 58 GLU H 3.127 . 4.349 4.001 3.881 4.090 . 0 0 "[ . 1 . 2 .]" 1 1708 1 57 THR MG 1 58 GLU H 1.983 . 2.474 2.141 2.036 2.292 . 0 0 "[ . 1 . 2 .]" 1 1709 1 57 THR MG 1 58 GLU HA 3.152 . 4.394 3.411 3.188 3.663 . 0 0 "[ . 1 . 2 .]" 1 1710 1 57 THR MG 1 58 GLU HG2 4.297 . 6.605 3.474 2.170 4.209 . 0 0 "[ . 1 . 2 .]" 1 1711 1 57 THR MG 1 58 GLU HG3 3.398 . 4.842 4.399 2.365 5.208 0.366 4 0 "[ . 1 . 2 .]" 1 1712 1 57 THR MG 1 59 ALA H 3.555 . 5.135 3.205 2.656 4.014 . 0 0 "[ . 1 . 2 .]" 1 1713 1 57 THR MG 1 61 GLN HE21 3.333 . 4.721 3.160 2.684 4.061 . 0 0 "[ . 1 . 2 .]" 1 1714 1 57 THR MG 1 61 GLN HE22 3.347 . 4.747 3.351 2.680 4.843 0.096 23 0 "[ . 1 . 2 .]" 1 1715 1 58 GLU H 1 58 GLU HA 2.752 . 3.699 2.826 2.800 2.840 . 0 0 "[ . 1 . 2 .]" 1 1716 1 58 GLU H 1 58 GLU HB2 3.640 . 5.296 3.444 2.535 3.627 . 0 0 "[ . 1 . 2 .]" 1 1717 1 58 GLU H 1 58 GLU HB3 3.070 . 4.248 2.787 2.483 3.584 . 0 0 "[ . 1 . 2 .]" 1 1718 1 58 GLU H 1 58 GLU HG2 3.774 . 5.554 2.233 1.884 3.327 0.110 5 0 "[ . 1 . 2 .]" 1 1719 1 58 GLU H 1 58 GLU HG3 2.366 . 3.065 3.078 2.036 3.654 0.589 4 3 "[ -+. 1 . *2 .]" 1 1720 1 58 GLU H 1 59 ALA H 2.748 . 3.692 2.574 2.537 2.666 . 0 0 "[ . 1 . 2 .]" 1 1721 1 58 GLU H 1 59 ALA HA 5.214 . 8.612 5.188 5.135 5.259 . 0 0 "[ . 1 . 2 .]" 1 1722 1 58 GLU H 1 59 ALA MB 4.554 . 7.146 4.230 4.164 4.350 . 0 0 "[ . 1 . 2 .]" 1 1723 1 58 GLU H 1 60 ALA H 4.491 . 7.012 4.225 4.043 4.456 . 0 0 "[ . 1 . 2 .]" 1 1724 1 58 GLU HA 1 58 GLU HB2 2.535 . 3.338 2.346 2.154 2.696 . 0 0 "[ . 1 . 2 .]" 1 1725 1 58 GLU HA 1 58 GLU HB3 2.291 . 2.947 2.417 2.301 2.499 . 0 0 "[ . 1 . 2 .]" 1 1726 1 58 GLU HA 1 58 GLU HG2 3.464 . 4.964 3.612 2.572 3.840 . 0 0 "[ . 1 . 2 .]" 1 1727 1 58 GLU HA 1 58 GLU HG3 4.420 . 6.862 3.719 2.775 4.253 . 0 0 "[ . 1 . 2 .]" 1 1728 1 58 GLU HA 1 58 GLU HG3 3.217 . 4.511 3.069 1.939 3.494 . 0 0 "[ . 1 . 2 .]" 1 1729 1 58 GLU HA 1 58 GLU HG3 3.756 . 5.519 2.960 1.935 3.349 0.058 21 0 "[ . 1 . 2 .]" 1 1730 1 58 GLU HA 1 59 ALA H 3.427 . 4.895 3.484 3.468 3.498 . 0 0 "[ . 1 . 2 .]" 1 1731 1 58 GLU HA 1 60 ALA H 4.179 . 6.362 4.376 4.199 4.501 . 0 0 "[ . 1 . 2 .]" 1 1732 1 58 GLU HA 1 60 ALA H 3.515 . 5.059 3.550 3.497 3.614 . 0 0 "[ . 1 . 2 .]" 1 1733 1 58 GLU HA 1 61 GLN H 3.419 . 4.880 3.427 3.065 3.698 . 0 0 "[ . 1 . 2 .]" 1 1734 1 58 GLU HA 1 61 GLN HB3 3.777 . 5.560 3.695 3.556 3.888 . 0 0 "[ . 1 . 2 .]" 1 1735 1 58 GLU HA 1 61 GLN HE21 3.320 . 4.698 3.254 2.320 4.526 . 0 0 "[ . 1 . 2 .]" 1 1736 1 58 GLU HA 1 62 ALA H 2.998 . 4.121 3.592 3.369 3.845 . 0 0 "[ . 1 . 2 .]" 1 1737 1 58 GLU QB 1 60 ALA H 4.428 . 6.878 5.118 4.743 5.266 . 0 0 "[ . 1 . 2 .]" 1 1738 1 58 GLU HB2 1 59 ALA H 3.581 . 5.184 3.608 2.573 3.934 . 0 0 "[ . 1 . 2 .]" 1 1739 1 58 GLU HB2 1 59 ALA MB 4.915 . 7.935 4.614 3.830 4.996 . 0 0 "[ . 1 . 2 .]" 1 1740 1 58 GLU HB2 1 61 GLN HE22 5.618 . 9.563 6.152 5.041 8.118 . 0 0 "[ . 1 . 2 .]" 1 1741 1 58 GLU HB2 1 62 ALA MB 2.996 . 4.118 3.841 3.370 4.743 0.625 9 2 "[ . +1 . 2 -.]" 1 1742 1 58 GLU HG2 1 59 ALA H 3.045 . 4.204 2.994 2.074 4.835 0.631 24 3 "[ . - 1 * . 2 +.]" 1 1743 1 58 GLU HG3 1 59 ALA H 3.522 . 5.072 2.815 2.082 4.710 . 0 0 "[ . 1 . 2 .]" 1 1744 1 59 ALA H 1 59 ALA HA 2.670 . 3.561 2.810 2.796 2.841 . 0 0 "[ . 1 . 2 .]" 1 1745 1 59 ALA H 1 59 ALA MB 1.982 . 2.473 2.216 2.186 2.241 . 0 0 "[ . 1 . 2 .]" 1 1746 1 59 ALA H 1 60 ALA H 2.406 . 3.130 2.652 2.574 2.709 . 0 0 "[ . 1 . 2 .]" 1 1747 1 59 ALA H 1 60 ALA MB 3.634 . 5.285 4.327 4.258 4.396 . 0 0 "[ . 1 . 2 .]" 1 1748 1 59 ALA H 1 61 GLN H 3.819 . 5.642 4.170 4.061 4.287 . 0 0 "[ . 1 . 2 .]" 1 1749 1 59 ALA H 1 61 GLN H 4.398 . 6.816 3.977 3.514 4.078 . 0 0 "[ . 1 . 2 .]" 1 1750 1 59 ALA H 1 62 ALA H 4.193 . 6.390 4.711 4.640 4.788 . 0 0 "[ . 1 . 2 .]" 1 1751 1 59 ALA HA 1 59 ALA MB 2.033 . 2.550 2.133 2.128 2.143 . 0 0 "[ . 1 . 2 .]" 1 1752 1 59 ALA HA 1 60 ALA H 3.280 . 4.625 3.534 3.520 3.550 . 0 0 "[ . 1 . 2 .]" 1 1753 1 59 ALA HA 1 61 GLN H 4.447 . 6.919 4.678 4.588 4.774 . 0 0 "[ . 1 . 2 .]" 1 1754 1 59 ALA HA 1 62 ALA MB 2.393 . 3.109 3.059 2.811 3.183 0.074 12 0 "[ . 1 . 2 .]" 1 1755 1 59 ALA HA 1 63 MET H 3.783 . 5.572 4.077 3.854 4.588 . 0 0 "[ . 1 . 2 .]" 1 1756 1 59 ALA MB 1 60 ALA H 2.425 . 3.160 2.446 2.376 2.517 . 0 0 "[ . 1 . 2 .]" 1 1757 1 59 ALA MB 1 61 GLN H 3.585 . 5.192 4.563 4.505 4.608 . 0 0 "[ . 1 . 2 .]" 1 1758 1 59 ALA MB 1 83 MET H 4.822 . 7.728 6.418 6.131 6.882 . 0 0 "[ . 1 . 2 .]" 1 1759 1 60 ALA H 1 60 ALA HA 2.612 . 3.465 2.828 2.810 2.837 . 0 0 "[ . 1 . 2 .]" 1 1760 1 60 ALA H 1 60 ALA MB 2.069 . 2.604 2.224 2.206 2.233 . 0 0 "[ . 1 . 2 .]" 1 1761 1 60 ALA H 1 61 GLN H 2.502 . 3.284 2.663 2.632 2.711 . 0 0 "[ . 1 . 2 .]" 1 1762 1 60 ALA H 1 62 ALA H 3.905 . 5.811 4.202 4.112 4.253 . 0 0 "[ . 1 . 2 .]" 1 1763 1 60 ALA H 1 62 ALA MB 4.352 . 6.720 4.971 4.847 5.047 . 0 0 "[ . 1 . 2 .]" 1 1764 1 60 ALA H 1 63 MET H 4.723 . 7.511 4.915 4.720 5.335 . 0 0 "[ . 1 . 2 .]" 1 1765 1 60 ALA H 1 63 MET H 4.619 . 7.285 4.543 4.385 4.778 . 0 0 "[ . 1 . 2 .]" 1 1766 1 60 ALA H 1 63 MET ME 3.790 . 5.586 3.785 3.602 4.311 . 0 0 "[ . 1 . 2 .]" 1 1767 1 60 ALA H 1 64 VAL MG2 4.555 . 7.149 5.741 5.582 5.928 . 0 0 "[ . 1 . 2 .]" 1 1768 1 60 ALA H 1 83 MET ME 3.830 . 5.663 4.571 4.309 4.655 . 0 0 "[ . 1 . 2 .]" 1 1769 1 60 ALA HA 1 60 ALA MB 1.774 . 2.167 2.124 2.119 2.128 . 0 0 "[ . 1 . 2 .]" 1 1770 1 60 ALA HA 1 63 MET H 3.698 . 5.407 3.953 3.709 4.099 . 0 0 "[ . 1 . 2 .]" 1 1771 1 60 ALA HA 1 63 MET ME 3.208 . 4.494 2.402 2.100 3.095 . 0 0 "[ . 1 . 2 .]" 1 1772 1 60 ALA MB 1 61 GLN H 2.362 . 3.059 2.444 2.403 2.590 . 0 0 "[ . 1 . 2 .]" 1 1773 1 60 ALA MB 1 61 GLN QG 3.211 . 4.500 3.169 2.864 4.274 . 0 0 "[ . 1 . 2 .]" 1 1774 1 60 ALA MB 1 63 MET H 4.339 . 6.693 4.920 4.765 5.119 . 0 0 "[ . 1 . 2 .]" 1 1775 1 60 ALA MB 1 83 MET ME 1.685 . 2.040 1.865 1.761 1.958 . 0 0 "[ . 1 . 2 .]" 1 1776 1 61 GLN H 1 61 GLN HA 2.939 . 4.019 2.830 2.804 2.841 . 0 0 "[ . 1 . 2 .]" 1 1777 1 61 GLN H 1 61 GLN HA 2.883 . 3.922 2.192 2.111 2.336 . 0 0 "[ . 1 . 2 .]" 1 1778 1 61 GLN H 1 61 GLN HB2 2.634 . 3.501 2.602 2.374 3.601 0.100 21 0 "[ . 1 . 2 .]" 1 1779 1 61 GLN H 1 61 GLN HB3 3.640 . 5.297 3.462 2.468 3.638 . 0 0 "[ . 1 . 2 .]" 1 1780 1 61 GLN H 1 61 GLN HE21 4.476 . 6.980 3.603 2.277 4.363 . 0 0 "[ . 1 . 2 .]" 1 1781 1 61 GLN H 1 61 GLN HE22 5.107 . 8.368 5.083 3.840 5.588 . 0 0 "[ . 1 . 2 .]" 1 1782 1 61 GLN H 1 61 GLN QG 2.492 . 3.268 2.234 2.014 2.375 . 0 0 "[ . 1 . 2 .]" 1 1783 1 61 GLN H 1 62 ALA H 2.722 . 3.648 2.659 2.622 2.724 . 0 0 "[ . 1 . 2 .]" 1 1784 1 61 GLN H 1 63 MET H 4.173 . 6.350 4.018 3.896 4.364 . 0 0 "[ . 1 . 2 .]" 1 1785 1 61 GLN H 1 64 VAL MG1 4.842 . 7.773 6.398 6.223 6.681 . 0 0 "[ . 1 . 2 .]" 1 1786 1 61 GLN H 1 83 MET ME 2.733 . 3.667 3.664 3.403 3.770 0.103 23 0 "[ . 1 . 2 .]" 1 1787 1 61 GLN HA 1 61 GLN HB2 2.643 . 3.516 2.647 2.296 2.696 . 0 0 "[ . 1 . 2 .]" 1 1788 1 61 GLN HA 1 61 GLN HB3 2.304 . 2.967 2.228 2.188 2.280 . 0 0 "[ . 1 . 2 .]" 1 1789 1 61 GLN HA 1 61 GLN QG 2.788 . 3.759 2.567 2.362 3.340 . 0 0 "[ . 1 . 2 .]" 1 1790 1 61 GLN HA 1 61 GLN QG 2.330 . 3.009 2.396 2.247 2.864 . 0 0 "[ . 1 . 2 .]" 1 1791 1 61 GLN HA 1 62 ALA H 2.999 . 4.124 2.702 2.696 2.709 . 0 0 "[ . 1 . 2 .]" 1 1792 1 61 GLN HA 1 63 MET H 3.177 . 4.439 3.580 3.434 3.891 . 0 0 "[ . 1 . 2 .]" 1 1793 1 61 GLN HA 1 64 VAL H 3.205 . 4.489 3.746 3.568 4.093 . 0 0 "[ . 1 . 2 .]" 1 1794 1 61 GLN HA 1 64 VAL MG1 3.358 . 4.768 3.301 3.121 3.418 . 0 0 "[ . 1 . 2 .]" 1 1795 1 61 GLN HA 1 64 VAL MG2 3.194 . 4.469 3.751 3.505 4.027 . 0 0 "[ . 1 . 2 .]" 1 1796 1 61 GLN HA 1 83 MET HG2 3.380 . 4.808 3.818 3.503 4.323 . 0 0 "[ . 1 . 2 .]" 1 1797 1 61 GLN HA 1 83 MET QB 3.291 . 4.645 4.746 4.693 4.876 0.231 23 0 "[ . 1 . 2 .]" 1 1798 1 61 GLN HA 1 83 MET ME 2.555 . 3.371 3.158 2.778 3.392 0.021 23 0 "[ . 1 . 2 .]" 1 1799 1 61 GLN HB2 1 61 GLN QG 3.472 . 4.979 2.339 2.148 2.393 . 0 0 "[ . 1 . 2 .]" 1 1800 1 61 GLN HB2 1 62 ALA H 2.826 . 3.825 2.701 2.457 3.858 0.033 12 0 "[ . 1 . 2 .]" 1 1801 1 61 GLN HB2 1 62 ALA H 2.347 . 3.036 2.257 2.185 2.463 . 0 0 "[ . 1 . 2 .]" 1 1802 1 61 GLN HB2 1 62 ALA HA 3.068 . 4.244 2.898 2.594 3.123 . 0 0 "[ . 1 . 2 .]" 1 1803 1 61 GLN HB3 1 61 GLN HE21 4.373 . 6.763 3.853 1.673 4.475 0.310 12 0 "[ . 1 . 2 .]" 1 1804 1 61 GLN HB3 1 61 GLN QG 2.289 . 2.944 2.329 2.268 2.429 . 0 0 "[ . 1 . 2 .]" 1 1805 1 61 GLN HB3 1 62 ALA H 3.495 . 5.021 3.606 3.429 3.911 . 0 0 "[ . 1 . 2 .]" 1 1806 1 61 GLN HB3 1 65 GLN HE21 4.038 . 6.076 4.595 2.557 6.887 0.811 16 1 "[ . 1 .+ 2 .]" 1 1807 1 61 GLN HE21 1 61 GLN QG 2.405 . 3.128 2.235 2.151 2.767 . 0 0 "[ . 1 . 2 .]" 1 1808 1 61 GLN HE21 1 83 MET ME 3.964 . 5.928 5.154 2.845 5.530 . 0 0 "[ . 1 . 2 .]" 1 1809 1 61 GLN HE22 1 83 MET ME 5.127 . 8.413 6.282 2.626 6.715 . 0 0 "[ . 1 . 2 .]" 1 1810 1 61 GLN QG 1 83 MET ME 3.912 . 5.825 3.509 2.910 5.035 . 0 0 "[ . 1 . 2 .]" 1 1811 1 61 GLN QG 1 83 MET ME 2.964 . 4.062 2.483 2.355 2.585 . 0 0 "[ . 1 . 2 .]" 1 1812 1 62 ALA H 1 62 ALA HA 2.922 . 3.989 2.813 2.797 2.839 . 0 0 "[ . 1 . 2 .]" 1 1813 1 62 ALA H 1 62 ALA MB 2.029 . 2.544 2.241 2.215 2.254 . 0 0 "[ . 1 . 2 .]" 1 1814 1 62 ALA H 1 63 MET H 2.490 . 3.265 2.706 2.598 2.843 . 0 0 "[ . 1 . 2 .]" 1 1815 1 62 ALA H 1 63 MET H 2.386 . 3.098 2.381 2.324 2.444 . 0 0 "[ . 1 . 2 .]" 1 1816 1 62 ALA HA 1 62 ALA MB 1.958 . 2.437 2.126 2.121 2.128 . 0 0 "[ . 1 . 2 .]" 1 1817 1 62 ALA HA 1 63 MET H 3.462 . 4.960 3.547 3.522 3.594 . 0 0 "[ . 1 . 2 .]" 1 1818 1 62 ALA MB 1 63 MET H 2.451 . 3.202 2.552 2.460 2.667 . 0 0 "[ . 1 . 2 .]" 1 1819 1 62 ALA MB 1 65 GLN HE22 5.982 . 10.455 6.294 4.892 7.631 . 0 0 "[ . 1 . 2 .]" 1 1820 1 62 ALA MB 1 68 GLN H 6.010 . 10.525 6.763 6.679 6.871 . 0 0 "[ . 1 . 2 .]" 1 1821 1 63 MET H 1 63 MET HA 2.611 . 3.463 2.827 2.800 2.855 . 0 0 "[ . 1 . 2 .]" 1 1822 1 63 MET H 1 63 MET QB 2.397 . 3.115 2.379 2.223 2.439 . 0 0 "[ . 1 . 2 .]" 1 1823 1 63 MET H 1 63 MET QG 3.036 . 4.188 2.525 2.375 3.251 . 0 0 "[ . 1 . 2 .]" 1 1824 1 63 MET H 1 64 VAL MG1 4.736 . 7.540 5.858 5.797 5.920 . 0 0 "[ . 1 . 2 .]" 1 1825 1 63 MET HA 1 63 MET QG 3.558 . 5.140 2.701 2.582 2.768 . 0 0 "[ . 1 . 2 .]" 1 1826 1 63 MET HA 1 63 MET QB 3.172 . 4.430 2.171 2.161 2.179 . 0 0 "[ . 1 . 2 .]" 1 1827 1 63 MET HA 1 63 MET QG 3.947 . 5.894 3.342 3.309 3.390 . 0 0 "[ . 1 . 2 .]" 1 1828 1 63 MET HA 1 64 VAL H 3.602 . 5.224 3.529 3.500 3.546 . 0 0 "[ . 1 . 2 .]" 1 1829 1 63 MET HA 1 67 TYR H 4.090 . 6.181 4.010 3.951 4.081 . 0 0 "[ . 1 . 2 .]" 1 1830 1 63 MET HA 1 66 TYR H 2.883 . 3.922 3.224 3.145 3.306 . 0 0 "[ . 1 . 2 .]" 1 1831 1 63 MET HA 1 67 TYR HE1 3.754 . 5.515 4.022 3.698 4.125 . 0 0 "[ . 1 . 2 .]" 1 1832 1 63 MET QB 1 63 MET ME 2.252 . 2.886 2.046 1.911 2.122 . 0 0 "[ . 1 . 2 .]" 1 1833 1 63 MET QB 1 63 MET QG . . 2.867 2.077 2.011 2.087 . 0 0 "[ . 1 . 2 .]" 1 1834 1 63 MET QB 1 64 VAL H 3.820 . 5.644 3.382 3.321 3.461 . 0 0 "[ . 1 . 2 .]" 1 1835 1 63 MET QB 1 67 TYR QD 4.200 . 6.405 3.378 3.222 3.594 . 0 0 "[ . 1 . 2 .]" 1 1836 1 63 MET QB 1 67 TYR HE1 3.861 . 5.724 1.992 1.957 2.150 0.041 18 0 "[ . 1 . 2 .]" 1 1837 1 63 MET QB 1 67 TYR QE 3.544 . 5.114 1.991 1.956 2.149 0.018 18 0 "[ . 1 . 2 .]" 1 1838 1 63 MET ME 1 67 TYR QE 4.171 . 6.346 3.478 2.614 4.052 . 0 0 "[ . 1 . 2 .]" 1 1839 1 63 MET QG 1 64 VAL H 2.019 . 2.528 2.040 1.702 2.266 0.290 5 0 "[ . 1 . 2 .]" 1 1840 1 63 MET QG 1 64 VAL MG1 2.671 . 3.563 3.189 2.988 3.312 . 0 0 "[ . 1 . 2 .]" 1 1841 1 63 MET QG 1 65 GLN H 5.235 . 8.661 4.047 3.948 4.218 . 0 0 "[ . 1 . 2 .]" 1 1842 1 63 MET QG 1 67 TYR QD 4.531 . 7.098 2.653 2.445 2.761 . 0 0 "[ . 1 . 2 .]" 1 1843 1 63 MET QG 1 67 TYR HE1 4.223 . 6.453 2.866 2.203 3.102 . 0 0 "[ . 1 . 2 .]" 1 1844 1 63 MET QG 1 67 TYR QE 3.751 . 5.509 2.861 2.203 3.095 . 0 0 "[ . 1 . 2 .]" 1 1845 1 64 VAL H 1 64 VAL HA 2.613 . 3.466 2.820 2.814 2.825 . 0 0 "[ . 1 . 2 .]" 1 1846 1 64 VAL H 1 64 VAL HB 2.339 . 3.023 2.436 2.374 2.505 . 0 0 "[ . 1 . 2 .]" 1 1847 1 64 VAL H 1 64 VAL HB 3.131 . 4.356 2.358 2.257 2.432 . 0 0 "[ . 1 . 2 .]" 1 1848 1 64 VAL H 1 64 VAL MG1 3.195 . 4.471 3.738 3.712 3.758 . 0 0 "[ . 1 . 2 .]" 1 1849 1 64 VAL H 1 64 VAL MG2 1.997 . 2.495 2.268 2.133 2.361 . 0 0 "[ . 1 . 2 .]" 1 1850 1 64 VAL H 1 65 GLN H 2.397 . 3.115 2.644 2.607 2.697 . 0 0 "[ . 1 . 2 .]" 1 1851 1 64 VAL H 1 67 TYR QD 5.692 . 9.742 4.213 4.075 4.312 . 0 0 "[ . 1 . 2 .]" 1 1852 1 64 VAL H 1 81 ILE MG 4.067 . 6.135 4.788 4.556 5.070 . 0 0 "[ . 1 . 2 .]" 1 1853 1 64 VAL H 1 83 MET HG2 4.432 . 6.888 4.991 4.658 5.431 . 0 0 "[ . 1 . 2 .]" 1 1854 1 64 VAL HA 1 64 VAL HB 2.810 . 3.797 3.012 3.003 3.018 . 0 0 "[ . 1 . 2 .]" 1 1855 1 64 VAL HA 1 64 VAL MG1 2.368 . 3.069 2.398 2.328 2.451 . 0 0 "[ . 1 . 2 .]" 1 1856 1 64 VAL HA 1 64 VAL MG1 2.068 . 2.603 2.360 2.290 2.411 . 0 0 "[ . 1 . 2 .]" 1 1857 1 64 VAL HA 1 64 VAL MG2 1.994 . 2.491 2.259 2.216 2.306 . 0 0 "[ . 1 . 2 .]" 1 1858 1 64 VAL HA 1 65 GLN H 3.425 . 4.892 3.537 3.524 3.555 . 0 0 "[ . 1 . 2 .]" 1 1859 1 64 VAL HA 1 67 TYR H 2.570 . 3.396 2.379 2.328 2.423 . 0 0 "[ . 1 . 2 .]" 1 1860 1 64 VAL HA 1 82 ARG HA 3.886 . 5.774 3.236 3.090 3.364 . 0 0 "[ . 1 . 2 .]" 1 1861 1 64 VAL HA 1 67 TYR QD 2.801 . 3.781 2.170 2.097 2.205 . 0 0 "[ . 1 . 2 .]" 1 1862 1 64 VAL HA 1 67 TYR QE 4.347 . 6.709 3.981 3.926 4.032 . 0 0 "[ . 1 . 2 .]" 1 1863 1 64 VAL HA 1 81 ILE MG 3.354 . 4.760 2.899 2.653 3.012 . 0 0 "[ . 1 . 2 .]" 1 1864 1 64 VAL HA 1 81 ILE MG 3.890 . 5.782 3.319 2.965 3.563 . 0 0 "[ . 1 . 2 .]" 1 1865 1 64 VAL HB 1 64 VAL MG1 1.863 . 2.297 2.127 2.118 2.134 . 0 0 "[ . 1 . 2 .]" 1 1866 1 64 VAL HB 1 64 VAL MG2 1.831 . 2.250 2.132 2.128 2.136 . 0 0 "[ . 1 . 2 .]" 1 1867 1 64 VAL HB 1 83 MET HG2 2.572 . 3.399 2.311 2.176 2.418 . 0 0 "[ . 1 . 2 .]" 1 1868 1 64 VAL MG1 1 67 TYR QD 3.006 . 4.136 2.738 1.861 3.310 0.015 11 0 "[ . 1 . 2 .]" 1 1869 1 64 VAL QG 1 65 GLN H 2.999 . 4.123 3.228 3.078 3.286 . 0 0 "[ . 1 . 2 .]" 1 1870 1 64 VAL QG 1 83 MET H 2.353 . 3.045 1.937 1.800 2.257 . 0 0 "[ . 1 . 2 .]" 1 1871 1 64 VAL MG1 1 65 GLN H 3.727 . 5.463 3.409 3.198 3.511 . 0 0 "[ . 1 . 2 .]" 1 1872 1 64 VAL MG1 1 67 TYR QD 4.046 . 6.093 4.299 4.225 4.401 . 0 0 "[ . 1 . 2 .]" 1 1873 1 64 VAL MG1 1 67 TYR HE1 4.053 . 6.106 6.191 6.151 6.251 0.145 23 0 "[ . 1 . 2 .]" 1 1874 1 64 VAL MG1 1 68 GLN H 4.348 . 6.711 3.520 3.352 3.628 . 0 0 "[ . 1 . 2 .]" 1 1875 1 64 VAL MG1 1 68 GLN HE21 3.332 . 4.720 3.101 1.869 4.362 0.075 11 0 "[ . 1 . 2 .]" 1 1876 1 64 VAL MG1 1 68 GLN HG2 2.939 . 4.019 2.817 1.951 3.303 . 0 0 "[ . 1 . 2 .]" 1 1877 1 64 VAL MG1 1 68 GLN HG2 2.352 . 3.044 1.803 1.668 1.915 . 0 0 "[ . 1 . 2 .]" 1 1878 1 64 VAL MG1 1 68 GLN HG3 2.339 . 3.023 2.107 1.884 2.612 . 0 0 "[ . 1 . 2 .]" 1 1879 1 64 VAL MG1 1 81 ILE MG 2.651 . 3.529 3.160 2.659 3.356 . 0 0 "[ . 1 . 2 .]" 1 1880 1 64 VAL MG1 1 80 LEU HG 3.616 . 5.250 5.206 5.058 5.292 0.042 23 0 "[ . 1 . 2 .]" 1 1881 1 64 VAL MG1 1 82 ARG HA 1.895 . 2.344 1.771 1.684 1.995 . 0 0 "[ . 1 . 2 .]" 1 1882 1 64 VAL MG1 1 83 MET H 2.413 . 3.141 1.954 1.818 2.286 . 0 0 "[ . 1 . 2 .]" 1 1883 1 64 VAL MG1 1 83 MET HG3 3.510 . 5.050 2.995 2.576 3.212 . 0 0 "[ . 1 . 2 .]" 1 1884 1 64 VAL MG2 1 67 TYR H 4.432 . 6.887 4.686 4.613 4.730 . 0 0 "[ . 1 . 2 .]" 1 1885 1 64 VAL MG2 1 67 TYR QD 3.783 . 5.572 3.174 3.051 3.266 . 0 0 "[ . 1 . 2 .]" 1 1886 1 64 VAL MG2 1 71 PRO HB3 4.710 . 7.484 7.601 7.572 7.636 0.152 25 0 "[ . 1 . 2 .]" 1 1887 1 64 VAL MG2 1 83 MET H 3.146 . 4.383 3.174 2.834 3.642 . 0 0 "[ . 1 . 2 .]" 1 1888 1 64 VAL MG2 1 83 MET ME 1.864 . 2.299 2.035 1.839 2.326 0.027 14 0 "[ . 1 . 2 .]" 1 1889 1 64 VAL MG2 1 83 MET HG2 2.278 . 2.926 2.377 2.034 2.723 . 0 0 "[ . 1 . 2 .]" 1 1890 1 64 VAL MG2 1 83 MET HG3 3.921 . 5.843 3.941 3.650 4.249 . 0 0 "[ . 1 . 2 .]" 1 1891 1 64 VAL MG2 1 83 MET HG3 3.819 . 5.642 3.465 2.486 3.942 . 0 0 "[ . 1 . 2 .]" 1 1892 1 65 GLN H 1 65 GLN HA 2.652 . 3.531 2.800 2.792 2.810 . 0 0 "[ . 1 . 2 .]" 1 1893 1 65 GLN H 1 65 GLN HB2 2.168 . 2.756 2.471 2.361 2.580 . 0 0 "[ . 1 . 2 .]" 1 1894 1 65 GLN H 1 65 GLN QG 2.606 . 3.455 2.308 2.145 2.467 . 0 0 "[ . 1 . 2 .]" 1 1895 1 65 GLN H 1 65 GLN HG3 2.630 . 3.494 3.334 2.173 3.811 0.317 11 0 "[ . 1 . 2 .]" 1 1896 1 65 GLN HA 1 65 GLN HE22 5.123 . 8.403 4.136 3.121 5.707 . 0 0 "[ . 1 . 2 .]" 1 1897 1 65 GLN HA 1 65 GLN HE22 3.484 . 5.001 3.279 2.952 3.689 . 0 0 "[ . 1 . 2 .]" 1 1898 1 65 GLN HA 1 65 GLN QG 2.682 . 3.581 2.759 2.256 3.081 . 0 0 "[ . 1 . 2 .]" 1 1899 1 65 GLN HA 1 67 TYR H 4.142 . 6.287 4.553 4.378 4.620 . 0 0 "[ . 1 . 2 .]" 1 1900 1 65 GLN HA 1 68 GLN H 3.301 . 4.663 3.660 3.333 3.796 . 0 0 "[ . 1 . 2 .]" 1 1901 1 65 GLN HA 1 68 GLN HB2 2.902 . 3.955 2.991 2.608 3.268 . 0 0 "[ . 1 . 2 .]" 1 1902 1 65 GLN HA 1 68 GLN HG3 3.240 . 4.552 3.996 3.601 4.324 . 0 0 "[ . 1 . 2 .]" 1 1903 1 65 GLN HA 1 69 GLU H 4.027 . 6.054 4.642 4.358 4.789 . 0 0 "[ . 1 . 2 .]" 1 1904 1 65 GLN HA 1 69 GLU QG 3.254 . 4.578 4.275 3.975 4.501 . 0 0 "[ . 1 . 2 .]" 1 1905 1 65 GLN HB2 1 65 GLN HE22 3.463 . 4.962 3.481 3.260 3.556 . 0 0 "[ . 1 . 2 .]" 1 1906 1 65 GLN HB2 1 65 GLN QG 2.488 . 3.262 2.208 2.157 2.377 . 0 0 "[ . 1 . 2 .]" 1 1907 1 65 GLN HB2 1 66 TYR H 2.953 . 4.043 2.683 2.624 2.812 . 0 0 "[ . 1 . 2 .]" 1 1908 1 65 GLN HB3 1 65 GLN QG 3.087 . 4.278 2.336 2.267 2.412 . 0 0 "[ . 1 . 2 .]" 1 1909 1 65 GLN HE21 1 65 GLN QG 2.712 . 3.631 2.295 2.123 2.784 . 0 0 "[ . 1 . 2 .]" 1 1910 1 65 GLN HE21 1 68 GLN HB2 3.923 . 5.846 5.143 3.892 6.397 0.551 23 2 "[ . - 1 . 2 + .]" 1 1911 1 65 GLN HE21 1 69 GLU HB2 4.549 . 7.135 4.880 4.039 6.342 . 0 0 "[ . 1 . 2 .]" 1 1912 1 65 GLN HE22 1 65 GLN HG3 3.969 . 5.938 3.872 3.475 4.066 . 0 0 "[ . 1 . 2 .]" 1 1913 1 65 GLN QG 1 66 TYR H 4.318 . 6.648 4.125 4.013 4.250 . 0 0 "[ . 1 . 2 .]" 1 1914 1 66 TYR H 1 66 TYR HA 2.740 . 3.678 2.836 2.829 2.844 . 0 0 "[ . 1 . 2 .]" 1 1915 1 66 TYR H 1 66 TYR HA 2.898 . 3.948 2.273 1.963 2.417 . 0 0 "[ . 1 . 2 .]" 1 1916 1 66 TYR H 1 66 TYR HB2 2.791 . 3.765 2.566 2.493 2.646 . 0 0 "[ . 1 . 2 .]" 1 1917 1 66 TYR H 1 66 TYR HB3 2.744 . 3.685 2.560 2.455 2.624 . 0 0 "[ . 1 . 2 .]" 1 1918 1 66 TYR H 1 66 TYR HD1 4.967 . 8.051 4.696 4.583 4.802 . 0 0 "[ . 1 . 2 .]" 1 1919 1 66 TYR H 1 66 TYR QD 4.579 . 7.200 4.211 4.197 4.227 . 0 0 "[ . 1 . 2 .]" 1 1920 1 66 TYR H 1 66 TYR QD 4.614 . 7.275 3.848 3.747 3.883 . 0 0 "[ . 1 . 2 .]" 1 1921 1 66 TYR H 1 67 TYR H 2.655 . 3.536 2.669 2.647 2.693 . 0 0 "[ . 1 . 2 .]" 1 1922 1 66 TYR H 1 68 GLN H 3.460 . 4.957 3.558 3.482 3.644 . 0 0 "[ . 1 . 2 .]" 1 1923 1 66 TYR HA 1 66 TYR HB2 2.974 . 4.080 2.474 2.426 2.510 . 0 0 "[ . 1 . 2 .]" 1 1924 1 66 TYR HA 1 66 TYR HB3 2.955 . 4.046 3.020 3.015 3.026 . 0 0 "[ . 1 . 2 .]" 1 1925 1 66 TYR HA 1 66 TYR HD1 3.532 . 5.091 2.792 2.540 3.071 . 0 0 "[ . 1 . 2 .]" 1 1926 1 66 TYR HA 1 66 TYR QD 3.648 . 5.311 2.750 2.523 2.978 . 0 0 "[ . 1 . 2 .]" 1 1927 1 66 TYR HA 1 67 TYR H 3.855 . 5.713 3.565 3.559 3.575 . 0 0 "[ . 1 . 2 .]" 1 1928 1 66 TYR HA 1 69 GLU H 3.692 . 5.396 3.757 3.674 3.856 . 0 0 "[ . 1 . 2 .]" 1 1929 1 66 TYR HA 1 69 GLU HB2 2.912 . 3.972 2.826 2.730 2.868 . 0 0 "[ . 1 . 2 .]" 1 1930 1 66 TYR HA 1 70 LYS H 2.689 . 3.593 3.724 3.672 3.748 0.155 2 0 "[ . 1 . 2 .]" 1 1931 1 66 TYR HB2 1 66 TYR HD1 3.139 . 4.370 2.516 2.421 2.621 . 0 0 "[ . 1 . 2 .]" 1 1932 1 66 TYR HB2 1 66 TYR QD 3.508 . 5.047 2.469 2.389 2.553 . 0 0 "[ . 1 . 2 .]" 1 1933 1 66 TYR HB2 1 66 TYR HE1 3.951 . 5.903 3.828 2.633 4.547 . 0 0 "[ . 1 . 2 .]" 1 1934 1 66 TYR HB2 1 67 TYR H 2.960 . 4.056 3.856 3.784 3.941 . 0 0 "[ . 1 . 2 .]" 1 1935 1 66 TYR HB2 1 68 GLN H 4.733 . 7.534 5.735 5.645 5.894 . 0 0 "[ . 1 . 2 .]" 1 1936 1 66 TYR HB2 1 69 GLU H 4.935 . 7.979 5.958 5.876 6.055 . 0 0 "[ . 1 . 2 .]" 1 1937 1 66 TYR HB3 1 66 TYR HD1 3.213 . 4.503 3.701 3.654 3.735 . 0 0 "[ . 1 . 2 .]" 1 1938 1 66 TYR HB3 1 66 TYR QD 3.765 . 5.537 2.344 2.294 2.415 . 0 0 "[ . 1 . 2 .]" 1 1939 1 66 TYR HB3 1 67 TYR H 3.649 . 5.313 2.546 2.509 2.602 . 0 0 "[ . 1 . 2 .]" 1 1940 1 66 TYR HB3 1 67 TYR H 3.413 . 4.869 2.537 2.502 2.591 . 0 0 "[ . 1 . 2 .]" 1 1941 1 66 TYR QD 1 67 TYR H 4.209 . 6.423 3.501 3.256 3.700 . 0 0 "[ . 1 . 2 .]" 1 1942 1 66 TYR QD 1 67 TYR QD 4.344 . 6.703 2.239 2.025 2.563 . 0 0 "[ . 1 . 2 .]" 1 1943 1 66 TYR QD 1 67 TYR QE 4.524 . 7.082 2.526 2.224 2.822 . 0 0 "[ . 1 . 2 .]" 1 1944 1 66 TYR QD 1 70 LYS HB2 4.117 . 6.236 3.613 3.428 3.738 . 0 0 "[ . 1 . 2 .]" 1 1945 1 66 TYR QD 1 70 LYS HB3 4.648 . 7.348 4.690 4.403 4.927 . 0 0 "[ . 1 . 2 .]" 1 1946 1 66 TYR QD 1 70 LYS HB3 4.681 . 7.420 3.967 3.163 4.814 . 0 0 "[ . 1 . 2 .]" 1 1947 1 66 TYR HD1 1 67 TYR H 4.739 . 7.547 5.553 5.422 5.691 . 0 0 "[ . 1 . 2 .]" 1 1948 1 66 TYR HD1 1 68 GLN H 5.882 . 10.207 6.913 6.632 7.149 . 0 0 "[ . 1 . 2 .]" 1 1949 1 66 TYR QE 1 67 TYR H 4.644 . 7.339 5.615 5.384 5.777 . 0 0 "[ . 1 . 2 .]" 1 1950 1 66 TYR QE 1 67 TYR QE 2.949 . 4.036 3.039 2.536 3.524 . 0 0 "[ . 1 . 2 .]" 1 1951 1 66 TYR QE 1 70 LYS HB2 3.534 . 5.095 3.200 2.961 3.346 . 0 0 "[ . 1 . 2 .]" 1 1952 1 66 TYR QE 1 70 LYS QE 3.976 . 5.952 3.723 2.624 4.955 . 0 0 "[ . 1 . 2 .]" 1 1953 1 66 TYR HE1 1 70 LYS HB2 3.648 . 5.311 3.882 3.262 4.545 . 0 0 "[ . 1 . 2 .]" 1 1954 1 66 TYR HE1 1 70 LYS HB3 3.536 . 5.099 4.780 3.955 5.610 0.511 1 1 "[+ . 1 . 2 .]" 1 1955 1 67 TYR H 1 67 TYR HB2 2.622 . 3.481 2.532 2.469 2.580 . 0 0 "[ . 1 . 2 .]" 1 1956 1 67 TYR H 1 67 TYR HB3 3.311 . 4.681 3.631 3.621 3.639 . 0 0 "[ . 1 . 2 .]" 1 1957 1 67 TYR H 1 67 TYR HD1 3.849 . 5.701 3.619 3.324 3.768 . 0 0 "[ . 1 . 2 .]" 1 1958 1 67 TYR H 1 67 TYR QD 3.407 . 4.858 3.222 3.137 3.292 . 0 0 "[ . 1 . 2 .]" 1 1959 1 67 TYR H 1 68 GLN H 2.850 . 3.866 2.607 2.555 2.662 . 0 0 "[ . 1 . 2 .]" 1 1960 1 67 TYR H 1 68 GLN HB2 4.674 . 7.405 4.721 4.598 4.819 . 0 0 "[ . 1 . 2 .]" 1 1961 1 67 TYR H 1 69 GLU H 4.167 . 6.337 4.121 3.973 4.221 . 0 0 "[ . 1 . 2 .]" 1 1962 1 67 TYR H 1 81 ILE MD 5.120 . 8.397 5.191 5.066 5.411 . 0 0 "[ . 1 . 2 .]" 1 1963 1 67 TYR H 1 81 ILE MG 5.193 . 8.564 4.972 4.740 5.080 . 0 0 "[ . 1 . 2 .]" 1 1964 1 67 TYR HA 1 68 GLN H 3.525 . 5.078 3.454 3.423 3.502 . 0 0 "[ . 1 . 2 .]" 1 1965 1 67 TYR HA 1 69 GLU H 4.086 . 6.173 3.899 3.815 4.000 . 0 0 "[ . 1 . 2 .]" 1 1966 1 67 TYR HA 1 72 ALA H 4.638 . 7.327 4.226 3.937 4.410 . 0 0 "[ . 1 . 2 .]" 1 1967 1 67 TYR HB2 1 67 TYR HD1 3.332 . 4.720 2.327 2.294 2.355 . 0 0 "[ . 1 . 2 .]" 1 1968 1 67 TYR HB2 1 68 GLN H 3.232 . 4.538 3.163 2.994 3.217 . 0 0 "[ . 1 . 2 .]" 1 1969 1 67 TYR HB2 1 69 GLU H 5.042 . 8.220 5.188 5.008 5.277 . 0 0 "[ . 1 . 2 .]" 1 1970 1 67 TYR HB2 1 72 ALA H 5.189 . 8.554 5.114 4.859 5.333 . 0 0 "[ . 1 . 2 .]" 1 1971 1 67 TYR HB2 1 81 ILE HB 2.631 . 3.496 2.202 2.081 2.342 . 0 0 "[ . 1 . 2 .]" 1 1972 1 67 TYR HB2 1 81 ILE MD 3.605 . 5.229 3.641 3.458 3.862 . 0 0 "[ . 1 . 2 .]" 1 1973 1 67 TYR HB3 1 67 TYR HD1 3.212 . 4.502 3.224 3.143 3.348 . 0 0 "[ . 1 . 2 .]" 1 1974 1 67 TYR HB3 1 67 TYR QD 3.286 . 4.635 2.745 2.703 2.761 . 0 0 "[ . 1 . 2 .]" 1 1975 1 67 TYR HB3 1 68 GLN H 3.403 . 4.851 4.066 3.982 4.106 . 0 0 "[ . 1 . 2 .]" 1 1976 1 67 TYR HB3 1 72 ALA H 3.921 . 5.842 3.374 3.153 3.598 . 0 0 "[ . 1 . 2 .]" 1 1977 1 67 TYR HB3 1 80 LEU HA 3.208 . 4.494 4.476 4.247 4.609 0.115 16 0 "[ . 1 . 2 .]" 1 1978 1 67 TYR HB3 1 80 LEU MD1 3.918 . 5.837 4.338 4.072 4.680 . 0 0 "[ . 1 . 2 .]" 1 1979 1 67 TYR HB3 1 81 ILE MD 3.094 . 4.290 2.867 2.666 3.092 . 0 0 "[ . 1 . 2 .]" 1 1980 1 67 TYR HB3 1 81 ILE HG12 3.744 . 5.497 3.460 3.389 3.568 . 0 0 "[ . 1 . 2 .]" 1 1981 1 67 TYR HB3 1 81 ILE HG13 3.443 . 4.924 3.123 2.945 3.365 . 0 0 "[ . 1 . 2 .]" 1 1982 1 67 TYR HB3 1 81 ILE HG13 2.940 . 4.020 2.430 2.259 2.924 . 0 0 "[ . 1 . 2 .]" 1 1983 1 67 TYR HB3 1 81 ILE MG 4.139 . 6.281 3.610 3.507 3.742 . 0 0 "[ . 1 . 2 .]" 1 1984 1 67 TYR QD 1 71 PRO HB3 5.099 . 8.349 4.916 4.324 5.249 . 0 0 "[ . 1 . 2 .]" 1 1985 1 67 TYR QD 1 71 PRO HA 3.189 . 4.460 2.754 1.998 3.269 . 0 0 "[ . 1 . 2 .]" 1 1986 1 67 TYR QD 1 72 ALA MB 4.120 . 6.242 3.425 2.920 3.693 . 0 0 "[ . 1 . 2 .]" 1 1987 1 67 TYR QD 1 81 ILE MD 3.310 . 4.679 2.807 2.665 2.962 . 0 0 "[ . 1 . 2 .]" 1 1988 1 67 TYR QD 1 81 ILE MG 2.922 . 3.989 2.179 2.022 2.365 . 0 0 "[ . 1 . 2 .]" 1 1989 1 67 TYR HD1 1 72 ALA H 4.767 . 7.608 5.862 5.525 6.179 . 0 0 "[ . 1 . 2 .]" 1 1990 1 67 TYR HD1 1 81 ILE MD 3.688 . 5.388 2.944 2.733 3.216 . 0 0 "[ . 1 . 2 .]" 1 1991 1 67 TYR QE 1 72 ALA MB 3.168 . 4.423 3.415 2.587 3.829 . 0 0 "[ . 1 . 2 .]" 1 1992 1 67 TYR QE 1 81 ILE MD 3.356 . 4.764 3.190 3.024 3.402 . 0 0 "[ . 1 . 2 .]" 1 1993 1 67 TYR QE 1 81 ILE MG 4.227 . 6.460 3.182 2.923 3.445 . 0 0 "[ . 1 . 2 .]" 1 1994 1 68 GLN H 1 68 GLN HA 2.582 . 3.416 2.862 2.842 2.875 . 0 0 "[ . 1 . 2 .]" 1 1995 1 68 GLN H 1 68 GLN HB2 2.150 . 2.728 2.329 2.287 2.368 . 0 0 "[ . 1 . 2 .]" 1 1996 1 68 GLN H 1 68 GLN HB3 3.272 . 4.610 3.584 3.555 3.611 . 0 0 "[ . 1 . 2 .]" 1 1997 1 68 GLN H 1 68 GLN HE22 4.435 . 6.893 6.097 5.085 6.402 . 0 0 "[ . 1 . 2 .]" 1 1998 1 68 GLN H 1 68 GLN HG2 3.326 . 4.709 3.472 2.673 3.901 . 0 0 "[ . 1 . 2 .]" 1 1999 1 68 GLN H 1 68 GLN HG3 2.854 . 3.872 3.053 2.662 3.914 0.042 24 0 "[ . 1 . 2 .]" 1 2000 1 68 GLN H 1 69 GLU H 2.298 . 2.958 2.460 2.386 2.542 . 0 0 "[ . 1 . 2 .]" 1 2001 1 68 GLN H 1 70 LYS HB3 6.014 . 10.536 6.080 4.616 6.452 . 0 0 "[ . 1 . 2 .]" 1 2002 1 68 GLN H 1 71 PRO QG 4.324 . 6.661 4.879 4.832 4.975 . 0 0 "[ . 1 . 2 .]" 1 2003 1 68 GLN HA 1 68 GLN HB2 2.764 . 3.719 3.008 3.002 3.019 . 0 0 "[ . 1 . 2 .]" 1 2004 1 68 GLN HA 1 68 GLN HB3 2.443 . 3.189 2.584 2.572 2.597 . 0 0 "[ . 1 . 2 .]" 1 2005 1 68 GLN HA 1 68 GLN HG2 2.638 . 3.508 2.515 2.312 2.911 . 0 0 "[ . 1 . 2 .]" 1 2006 1 68 GLN HA 1 68 GLN HG3 3.122 . 4.340 3.169 2.792 3.710 . 0 0 "[ . 1 . 2 .]" 1 2007 1 68 GLN HA 1 69 GLU H 3.305 . 4.671 3.463 3.434 3.497 . 0 0 "[ . 1 . 2 .]" 1 2008 1 68 GLN HB2 1 68 GLN HE22 4.137 . 6.276 4.716 3.817 5.329 . 0 0 "[ . 1 . 2 .]" 1 2009 1 68 GLN HB2 1 69 GLU H 2.406 . 3.130 3.046 2.941 3.132 0.002 1 0 "[ . 1 . 2 .]" 1 2010 1 68 GLN HB2 1 83 MET H 6.186 . 10.970 6.599 6.281 6.875 . 0 0 "[ . 1 . 2 .]" 1 2011 1 68 GLN HB2 1 83 MET HG2 4.295 . 6.601 6.793 6.727 6.856 0.255 5 0 "[ . 1 . 2 .]" 1 2012 1 68 GLN HB3 1 68 GLN HG2 2.479 . 3.247 2.630 2.393 3.009 . 0 0 "[ . 1 . 2 .]" 1 2013 1 68 GLN HB3 1 69 GLU H 3.087 . 4.278 3.760 3.664 3.837 . 0 0 "[ . 1 . 2 .]" 1 2014 1 68 GLN HB3 1 69 GLU HA 3.551 . 5.127 4.436 4.304 4.510 . 0 0 "[ . 1 . 2 .]" 1 2015 1 68 GLN HE21 1 80 LEU MD2 4.050 . 6.100 4.654 3.514 5.761 . 0 0 "[ . 1 . 2 .]" 1 2016 1 68 GLN HG2 1 69 GLU H 5.075 . 8.295 5.003 4.643 5.220 . 0 0 "[ . 1 . 2 .]" 1 2017 1 68 GLN HG3 1 69 GLU H 4.433 . 6.890 4.852 4.615 5.331 . 0 0 "[ . 1 . 2 .]" 1 2018 1 69 GLU H 1 69 GLU HA 2.704 . 3.618 2.926 2.918 2.930 . 0 0 "[ . 1 . 2 .]" 1 2019 1 69 GLU H 1 69 GLU QG 3.011 . 4.144 2.675 2.377 2.829 . 0 0 "[ . 1 . 2 .]" 1 2020 1 69 GLU H 1 70 LYS H 2.071 . 2.607 2.187 2.156 2.217 . 0 0 "[ . 1 . 2 .]" 1 2021 1 69 GLU H 1 70 LYS HB3 5.460 . 9.186 5.968 5.904 6.039 . 0 0 "[ . 1 . 2 .]" 1 2022 1 69 GLU H 1 71 PRO QG 3.100 . 4.302 4.432 4.389 4.467 0.165 21 0 "[ . 1 . 2 .]" 1 2023 1 69 GLU HA 1 69 GLU HB3 2.920 . 3.986 2.503 2.434 2.563 . 0 0 "[ . 1 . 2 .]" 1 2024 1 69 GLU HA 1 69 GLU QG 3.537 . 4.899 2.744 2.372 3.030 . 0 0 "[ . 1 . 2 .]" 1 2025 1 69 GLU HA 1 70 LYS H 3.593 . 5.207 3.522 3.509 3.530 . 0 0 "[ . 1 . 2 .]" 1 2026 1 69 GLU HA 1 71 PRO HB2 5.114 . 8.383 6.723 6.660 6.881 . 0 0 "[ . 1 . 2 .]" 1 2027 1 69 GLU HA 1 71 PRO QG 3.188 . 4.459 4.509 4.428 4.580 0.121 6 0 "[ . 1 . 2 .]" 1 2028 1 69 GLU HB2 1 70 LYS H 2.506 . 3.291 2.626 2.537 2.677 . 0 0 "[ . 1 . 2 .]" 1 2029 1 69 GLU QG 1 70 LYS H 5.159 . 8.486 4.071 3.849 4.166 . 0 0 "[ . 1 . 2 .]" 1 2030 1 69 GLU QG 1 70 LYS H 4.590 . 7.224 3.991 3.794 4.077 . 0 0 "[ . 1 . 2 .]" 1 2031 1 70 LYS H 1 70 LYS HA 2.396 . 3.114 2.949 2.941 2.954 . 0 0 "[ . 1 . 2 .]" 1 2032 1 70 LYS H 1 70 LYS HB2 2.301 . 2.963 2.655 2.580 2.718 . 0 0 "[ . 1 . 2 .]" 1 2033 1 70 LYS H 1 70 LYS HB2 2.466 . 3.226 2.482 1.894 2.669 . 0 0 "[ . 1 . 2 .]" 1 2034 1 70 LYS H 1 70 LYS HB3 4.076 . 6.153 3.783 3.738 3.824 . 0 0 "[ . 1 . 2 .]" 1 2035 1 70 LYS H 1 70 LYS HD3 4.225 . 6.457 4.843 4.386 5.413 . 0 0 "[ . 1 . 2 .]" 1 2036 1 70 LYS H 1 71 PRO HD2 3.964 . 5.928 4.754 4.661 4.850 . 0 0 "[ . 1 . 2 .]" 1 2037 1 70 LYS H 1 71 PRO HD3 3.264 . 4.596 3.346 3.236 3.448 . 0 0 "[ . 1 . 2 .]" 1 2038 1 70 LYS HA 1 70 LYS HB2 3.061 . 4.232 2.510 2.341 2.762 . 0 0 "[ . 1 . 2 .]" 1 2039 1 70 LYS HA 1 70 LYS HB3 2.379 . 3.086 2.500 2.456 2.575 . 0 0 "[ . 1 . 2 .]" 1 2040 1 70 LYS HA 1 70 LYS HG3 3.507 . 5.044 3.303 3.041 3.778 . 0 0 "[ . 1 . 2 .]" 1 2041 1 70 LYS HA 1 71 PRO HD2 2.402 . 3.123 2.681 2.612 2.738 . 0 0 "[ . 1 . 2 .]" 1 2042 1 70 LYS HA 1 71 PRO HD3 2.303 . 2.966 2.071 1.986 2.191 . 0 0 "[ . 1 . 2 .]" 1 2043 1 70 LYS HA 1 71 PRO QG 3.643 . 5.302 3.237 3.045 3.506 . 0 0 "[ . 1 . 2 .]" 1 2044 1 70 LYS HB2 1 70 LYS HD3 2.717 . 3.640 2.384 2.287 2.461 . 0 0 "[ . 1 . 2 .]" 1 2045 1 70 LYS HB2 1 70 LYS QE 2.832 . 3.835 2.594 2.266 3.141 . 0 0 "[ . 1 . 2 .]" 1 2046 1 70 LYS HB3 1 70 LYS QE 2.331 . 3.010 1.862 1.806 1.932 . 0 0 "[ . 1 . 2 .]" 1 2047 1 70 LYS HB3 1 70 LYS HG3 2.498 . 3.278 2.224 2.034 2.297 . 0 0 "[ . 1 . 2 .]" 1 2048 1 70 LYS HB3 1 70 LYS QE 2.171 . 2.760 1.973 1.874 2.089 . 0 0 "[ . 1 . 2 .]" 1 2049 1 70 LYS HB3 1 70 LYS HG2 2.686 . 3.588 2.628 2.391 3.013 . 0 0 "[ . 1 . 2 .]" 1 2050 1 70 LYS HB3 1 70 LYS HG3 2.865 . 3.891 2.829 2.409 3.014 . 0 0 "[ . 1 . 2 .]" 1 2051 1 70 LYS HD2 1 70 LYS QE 2.654 . 3.535 2.338 2.171 2.396 . 0 0 "[ . 1 . 2 .]" 1 2052 1 70 LYS HD2 1 70 LYS HG2 2.602 . 3.448 2.466 2.421 2.498 . 0 0 "[ . 1 . 2 .]" 1 2053 1 70 LYS HD2 1 70 LYS HG3 2.738 . 3.675 2.607 2.387 3.022 . 0 0 "[ . 1 . 2 .]" 1 2054 1 70 LYS HD3 1 70 LYS QE 2.630 . 3.495 2.302 2.171 2.388 . 0 0 "[ . 1 . 2 .]" 1 2055 1 70 LYS QE 1 70 LYS HG2 3.493 . 5.018 2.830 2.337 3.499 . 0 0 "[ . 1 . 2 .]" 1 2056 1 70 LYS QE 1 70 LYS HG3 3.550 . 5.125 3.100 2.382 3.512 . 0 0 "[ . 1 . 2 .]" 1 2057 1 70 LYS HG3 1 71 PRO QG 5.793 . 9.987 6.475 6.113 7.114 . 0 0 "[ . 1 . 2 .]" 1 2058 1 71 PRO HA 1 71 PRO HB3 2.192 . 2.793 2.267 2.258 2.277 . 0 0 "[ . 1 . 2 .]" 1 2059 1 71 PRO HA 1 71 PRO QG 3.630 . 5.277 3.024 2.983 3.059 . 0 0 "[ . 1 . 2 .]" 1 2060 1 71 PRO HA 1 72 ALA H 2.135 . 2.705 2.348 2.315 2.383 . 0 0 "[ . 1 . 2 .]" 1 2061 1 71 PRO HB2 1 71 PRO HD2 3.791 . 5.587 2.873 2.838 2.918 . 0 0 "[ . 1 . 2 .]" 1 2062 1 71 PRO HB2 1 71 PRO HD2 3.644 . 5.304 2.831 2.778 2.897 . 0 0 "[ . 1 . 2 .]" 1 2063 1 71 PRO HB2 1 72 ALA H 3.129 . 4.353 3.177 3.141 3.215 . 0 0 "[ . 1 . 2 .]" 1 2064 1 71 PRO HB3 1 72 ALA H 3.058 . 4.227 3.027 2.961 3.077 . 0 0 "[ . 1 . 2 .]" 1 2065 1 71 PRO HB3 1 73 ILE H 5.201 . 8.582 5.337 3.106 6.195 . 0 0 "[ . 1 . 2 .]" 1 2066 1 71 PRO HD2 1 71 PRO QG 2.455 . 3.208 2.268 2.259 2.273 . 0 0 "[ . 1 . 2 .]" 1 2067 1 71 PRO HD3 1 71 PRO QG 2.407 . 3.131 2.187 2.184 2.189 . 0 0 "[ . 1 . 2 .]" 1 2068 1 71 PRO HG3 1 72 ALA H 5.038 . 8.210 4.936 4.881 4.987 . 0 0 "[ . 1 . 2 .]" 1 2069 1 72 ALA H 1 72 ALA MB 2.211 . 2.822 2.320 2.299 2.335 . 0 0 "[ . 1 . 2 .]" 1 2070 1 72 ALA H 1 73 ILE H 4.663 . 7.381 4.574 4.530 4.585 . 0 0 "[ . 1 . 2 .]" 1 2071 1 72 ALA H 1 79 LEU H 3.817 . 5.638 4.034 3.874 4.288 . 0 0 "[ . 1 . 2 .]" 1 2072 1 72 ALA H 1 79 LEU HB3 4.267 . 6.543 5.148 4.956 5.346 . 0 0 "[ . 1 . 2 .]" 1 2073 1 72 ALA H 1 79 LEU MD1 3.613 . 5.245 5.009 4.611 5.255 0.010 20 0 "[ . 1 . 2 .]" 1 2074 1 72 ALA H 1 81 ILE MD 3.270 . 4.606 3.066 2.879 3.216 . 0 0 "[ . 1 . 2 .]" 1 2075 1 72 ALA H 1 81 ILE HG12 3.141 . 4.374 2.873 2.821 2.927 . 0 0 "[ . 1 . 2 .]" 1 2076 1 72 ALA H 1 81 ILE HG13 3.187 . 4.457 3.001 2.729 3.293 . 0 0 "[ . 1 . 2 .]" 1 2077 1 72 ALA H 1 81 ILE MG 4.384 . 6.786 5.226 5.081 5.343 . 0 0 "[ . 1 . 2 .]" 1 2078 1 72 ALA HA 1 72 ALA MB 1.917 . 2.376 2.129 2.123 2.132 . 0 0 "[ . 1 . 2 .]" 1 2079 1 72 ALA HA 1 73 ILE H 2.154 . 2.734 2.331 2.186 2.387 . 0 0 "[ . 1 . 2 .]" 1 2080 1 72 ALA MB 1 73 ILE H 2.586 . 3.422 2.581 2.498 2.875 . 0 0 "[ . 1 . 2 .]" 1 2081 1 72 ALA MB 1 79 LEU HB2 2.595 . 3.437 3.311 3.059 3.473 0.036 12 0 "[ . 1 . 2 .]" 1 2082 1 72 ALA MB 1 81 ILE MD 1.992 . 2.488 2.120 1.959 2.309 . 0 0 "[ . 1 . 2 .]" 1 2083 1 73 ILE H 1 73 ILE HA 2.768 . 3.726 2.945 2.939 2.949 . 0 0 "[ . 1 . 2 .]" 1 2084 1 73 ILE H 1 73 ILE HB 2.418 . 3.149 2.594 2.515 2.682 . 0 0 "[ . 1 . 2 .]" 1 2085 1 73 ILE H 1 73 ILE MD 3.684 . 5.380 4.013 3.859 4.058 . 0 0 "[ . 1 . 2 .]" 1 2086 1 73 ILE H 1 73 ILE MD 3.902 . 5.805 3.105 2.878 3.318 . 0 0 "[ . 1 . 2 .]" 1 2087 1 73 ILE H 1 73 ILE HG12 3.808 . 5.620 3.839 3.603 3.955 . 0 0 "[ . 1 . 2 .]" 1 2088 1 73 ILE H 1 73 ILE HG13 3.031 . 4.179 2.752 2.490 2.858 . 0 0 "[ . 1 . 2 .]" 1 2089 1 73 ILE H 1 73 ILE HG13 2.402 . 3.123 2.283 2.185 2.368 . 0 0 "[ . 1 . 2 .]" 1 2090 1 73 ILE H 1 73 ILE HG13 2.674 . 3.568 2.173 1.985 2.496 . 0 0 "[ . 1 . 2 .]" 1 2091 1 73 ILE H 1 73 ILE MG 3.520 . 5.069 3.832 3.786 3.874 . 0 0 "[ . 1 . 2 .]" 1 2092 1 73 ILE H 1 74 ILE H 4.254 . 6.516 4.384 4.312 4.432 . 0 0 "[ . 1 . 2 .]" 1 2093 1 73 ILE HA 1 73 ILE MD 3.781 . 5.568 3.803 3.779 3.838 . 0 0 "[ . 1 . 2 .]" 1 2094 1 73 ILE HA 1 73 ILE HG13 3.394 . 4.834 3.045 2.927 3.202 . 0 0 "[ . 1 . 2 .]" 1 2095 1 73 ILE HA 1 73 ILE MG 2.218 . 2.833 2.416 2.348 2.475 . 0 0 "[ . 1 . 2 .]" 1 2096 1 73 ILE HA 1 74 ILE H 1.997 . 2.496 2.149 2.121 2.180 . 0 0 "[ . 1 . 2 .]" 1 2097 1 73 ILE HA 1 78 LYS QG 3.011 . 4.144 3.036 2.957 3.088 . 0 0 "[ . 1 . 2 .]" 1 2098 1 73 ILE HA 1 79 LEU H 2.573 . 3.400 2.655 2.410 2.822 . 0 0 "[ . 1 . 2 .]" 1 2099 1 73 ILE HA 1 79 LEU MD1 4.264 . 6.537 4.258 4.046 4.615 . 0 0 "[ . 1 . 2 .]" 1 2100 1 73 ILE HB 1 73 ILE MD 2.727 . 3.656 2.468 2.449 2.519 . 0 0 "[ . 1 . 2 .]" 1 2101 1 73 ILE HB 1 73 ILE MD 2.299 . 2.960 2.400 2.336 2.458 . 0 0 "[ . 1 . 2 .]" 1 2102 1 73 ILE HB 1 73 ILE HG13 2.743 . 3.684 2.448 2.413 2.465 . 0 0 "[ . 1 . 2 .]" 1 2103 1 73 ILE HB 1 73 ILE MG 1.837 . 2.259 2.127 2.125 2.130 . 0 0 "[ . 1 . 2 .]" 1 2104 1 73 ILE HB 1 74 ILE H 3.592 . 5.205 4.200 4.123 4.281 . 0 0 "[ . 1 . 2 .]" 1 2105 1 73 ILE HB 1 76 GLY H 3.943 . 5.887 4.630 4.438 4.900 . 0 0 "[ . 1 . 2 .]" 1 2106 1 73 ILE HB 1 77 GLU H 4.026 . 6.052 5.395 5.248 5.573 . 0 0 "[ . 1 . 2 .]" 1 2107 1 73 ILE MD 1 73 ILE HG13 1.923 . 2.385 1.824 1.800 1.861 . 0 0 "[ . 1 . 2 .]" 1 2108 1 73 ILE MD 1 73 ILE HG13 1.388 . 1.629 1.523 1.521 1.524 . 0 0 "[ . 1 . 2 .]" 1 2109 1 73 ILE MD 1 73 ILE MG 1.948 . 2.422 1.903 1.875 1.933 . 0 0 "[ . 1 . 2 .]" 1 2110 1 73 ILE MD 1 74 ILE H 4.253 . 6.514 3.976 2.472 4.129 . 0 0 "[ . 1 . 2 .]" 1 2111 1 73 ILE MD 1 76 GLY H 4.123 . 6.248 4.692 4.387 4.930 . 0 0 "[ . 1 . 2 .]" 1 2112 1 73 ILE MD 1 76 GLY H 3.665 . 5.344 4.507 3.481 4.917 . 0 0 "[ . 1 . 2 .]" 1 2113 1 73 ILE MD 1 78 LYS H 4.311 . 6.634 4.740 4.473 4.874 . 0 0 "[ . 1 . 2 .]" 1 2114 1 73 ILE MD 1 78 LYS HA 3.668 . 5.350 3.764 3.611 3.902 . 0 0 "[ . 1 . 2 .]" 1 2115 1 73 ILE MD 1 78 LYS QG 1.839 . 2.262 2.284 2.155 2.325 0.063 8 0 "[ . 1 . 2 .]" 1 2116 1 73 ILE MD 1 78 LYS QG 1.468 . 1.738 1.630 1.615 1.634 . 0 0 "[ . 1 . 2 .]" 1 2117 1 73 ILE MD 1 78 LYS QG 1.322 . 1.541 1.636 1.621 1.640 0.099 8 0 "[ . 1 . 2 .]" 1 2118 1 73 ILE HG12 1 73 ILE MG 2.156 . 2.737 2.415 2.399 2.459 . 0 0 "[ . 1 . 2 .]" 1 2119 1 73 ILE HG13 1 73 ILE MG 2.841 . 3.850 3.201 3.196 3.205 . 0 0 "[ . 1 . 2 .]" 1 2120 1 73 ILE MG 1 74 ILE H 2.401 . 3.121 2.685 2.547 2.852 . 0 0 "[ . 1 . 2 .]" 1 2121 1 73 ILE MG 1 74 ILE HA 4.021 . 6.042 3.313 3.128 3.518 . 0 0 "[ . 1 . 2 .]" 1 2122 1 73 ILE MG 1 75 ASN H 4.058 . 6.117 3.588 3.381 3.849 . 0 0 "[ . 1 . 2 .]" 1 2123 1 73 ILE MG 1 75 ASN HA 4.569 . 7.178 4.531 4.284 4.790 . 0 0 "[ . 1 . 2 .]" 1 2124 1 73 ILE MG 1 76 GLY H 2.340 . 3.025 2.250 2.128 2.416 . 0 0 "[ . 1 . 2 .]" 1 2125 1 73 ILE MG 1 76 GLY HA2 2.461 . 3.218 2.495 2.296 2.801 . 0 0 "[ . 1 . 2 .]" 1 2126 1 73 ILE MG 1 76 GLY HA3 3.632 . 5.281 3.724 3.568 3.952 . 0 0 "[ . 1 . 2 .]" 1 2127 1 73 ILE MG 1 77 GLU H 2.310 . 2.977 2.615 2.349 2.773 . 0 0 "[ . 1 . 2 .]" 1 2128 1 73 ILE MG 1 77 GLU QB 4.164 . 6.332 3.906 3.773 4.073 . 0 0 "[ . 1 . 2 .]" 1 2129 1 73 ILE MG 1 78 LYS H 3.465 . 4.966 3.741 3.519 4.038 . 0 0 "[ . 1 . 2 .]" 1 2130 1 73 ILE MG 1 78 LYS HA 2.797 . 3.775 3.073 2.729 3.439 . 0 0 "[ . 1 . 2 .]" 1 2131 1 73 ILE MG 1 79 LEU H 3.206 . 4.491 2.943 2.832 3.094 . 0 0 "[ . 1 . 2 .]" 1 2132 1 74 ILE H 1 74 ILE HA 2.983 . 4.095 2.951 2.942 2.959 . 0 0 "[ . 1 . 2 .]" 1 2133 1 74 ILE H 1 74 ILE HB 2.525 . 3.322 2.632 2.584 2.704 . 0 0 "[ . 1 . 2 .]" 1 2134 1 74 ILE H 1 74 ILE MD 3.277 . 4.619 3.513 2.448 3.605 . 0 0 "[ . 1 . 2 .]" 1 2135 1 74 ILE H 1 74 ILE HG12 3.962 . 5.924 3.984 2.922 4.458 . 0 0 "[ . 1 . 2 .]" 1 2136 1 74 ILE H 1 74 ILE MG 3.479 . 4.992 3.822 3.788 3.852 . 0 0 "[ . 1 . 2 .]" 1 2137 1 74 ILE H 1 75 ASN H 5.087 . 8.322 4.251 4.185 4.321 . 0 0 "[ . 1 . 2 .]" 1 2138 1 74 ILE H 1 76 GLY H 4.134 . 6.270 4.219 4.098 4.358 . 0 0 "[ . 1 . 2 .]" 1 2139 1 74 ILE H 1 77 GLU H 2.855 . 3.874 3.178 2.965 3.430 . 0 0 "[ . 1 . 2 .]" 1 2140 1 74 ILE H 1 77 GLU QB 3.273 . 4.612 3.342 2.847 4.291 . 0 0 "[ . 1 . 2 .]" 1 2141 1 74 ILE H 1 77 GLU HG3 3.485 . 5.003 5.274 4.084 5.738 0.735 3 7 "[ + .* *1 * * - 2 *.]" 1 2142 1 74 ILE H 1 78 LYS QG 5.117 . 8.390 5.242 5.142 5.322 . 0 0 "[ . 1 . 2 .]" 1 2143 1 74 ILE H 1 79 LEU MD2 3.005 . 4.134 3.519 3.067 4.075 . 0 0 "[ . 1 . 2 .]" 1 2144 1 74 ILE H 1 81 ILE H 5.419 . 9.090 9.194 9.099 9.279 0.189 14 0 "[ . 1 . 2 .]" 1 2145 1 74 ILE HA 1 74 ILE HG12 2.860 . 3.883 2.509 2.360 3.624 . 0 0 "[ . 1 . 2 .]" 1 2146 1 74 ILE HA 1 74 ILE MG 2.295 . 2.953 2.478 2.439 2.523 . 0 0 "[ . 1 . 2 .]" 1 2147 1 74 ILE HA 1 75 ASN H 2.893 . 3.939 2.137 2.115 2.163 . 0 0 "[ . 1 . 2 .]" 1 2148 1 74 ILE HA 1 75 ASN H 2.107 . 2.662 1.956 1.944 1.973 . 0 0 "[ . 1 . 2 .]" 1 2149 1 74 ILE HA 1 77 GLU H 3.601 . 5.222 4.399 4.247 4.600 . 0 0 "[ . 1 . 2 .]" 1 2150 1 74 ILE HA 1 78 LYS QG 4.513 . 7.059 7.122 7.080 7.198 0.139 24 0 "[ . 1 . 2 .]" 1 2151 1 74 ILE HB 1 74 ILE MG 1.840 . 2.263 2.126 2.113 2.130 . 0 0 "[ . 1 . 2 .]" 1 2152 1 74 ILE HB 1 74 ILE MG 1.757 . 2.143 1.683 1.681 1.684 . 0 0 "[ . 1 . 2 .]" 1 2153 1 74 ILE HB 1 79 LEU MD1 2.945 . 4.029 2.683 2.234 3.235 . 0 0 "[ . 1 . 2 .]" 1 2154 1 74 ILE MD 1 74 ILE HG12 1.906 . 2.360 2.007 1.918 2.085 . 0 0 "[ . 1 . 2 .]" 1 2155 1 74 ILE MD 1 74 ILE HG12 1.690 . 2.047 1.888 1.882 1.890 . 0 0 "[ . 1 . 2 .]" 1 2156 1 74 ILE MD 1 74 ILE HG13 1.854 . 2.284 1.888 1.880 1.891 . 0 0 "[ . 1 . 2 .]" 1 2157 1 74 ILE MD 1 78 LYS H 4.640 . 7.331 6.534 5.878 6.763 . 0 0 "[ . 1 . 2 .]" 1 2158 1 74 ILE MD 1 75 ASN HB2 4.421 . 6.864 4.123 1.964 5.296 0.014 17 0 "[ . 1 . 2 .]" 1 2159 1 74 ILE HG12 1 74 ILE MG 2.107 . 2.662 2.515 2.201 3.199 0.537 22 2 "[ . 1 .- 2 + .]" 1 2160 1 74 ILE HG12 1 75 ASN H 4.932 . 7.972 4.383 4.101 5.236 . 0 0 "[ . 1 . 2 .]" 1 2161 1 74 ILE HG12 1 76 GLY H 5.612 . 9.549 6.300 6.023 7.100 . 0 0 "[ . 1 . 2 .]" 1 2162 1 74 ILE MG 1 75 ASN H 2.699 . 3.610 2.827 2.620 3.017 . 0 0 "[ . 1 . 2 .]" 1 2163 1 74 ILE MG 1 75 ASN HB2 2.594 . 3.435 2.666 2.536 2.926 . 0 0 "[ . 1 . 2 .]" 1 2164 1 74 ILE MG 1 75 ASN HB3 4.002 . 6.004 4.010 3.920 4.153 . 0 0 "[ . 1 . 2 .]" 1 2165 1 74 ILE MG 1 75 ASN HD21 3.070 . 4.248 2.883 1.770 4.244 0.122 11 0 "[ . 1 . 2 .]" 1 2166 1 74 ILE MG 1 75 ASN HD22 2.948 . 4.034 3.126 2.744 3.966 . 0 0 "[ . 1 . 2 .]" 1 2167 1 74 ILE MG 1 77 GLU H 3.689 . 5.390 4.401 4.247 4.616 . 0 0 "[ . 1 . 2 .]" 1 2168 1 75 ASN H 1 75 ASN HA 2.598 . 3.442 2.268 2.257 2.279 . 0 0 "[ . 1 . 2 .]" 1 2169 1 75 ASN H 1 75 ASN HB2 3.746 . 5.500 3.517 3.419 3.628 . 0 0 "[ . 1 . 2 .]" 1 2170 1 75 ASN H 1 76 GLY H 3.094 . 4.290 2.737 2.653 2.878 . 0 0 "[ . 1 . 2 .]" 1 2171 1 75 ASN H 1 77 GLU H 4.443 . 6.910 4.050 3.948 4.238 . 0 0 "[ . 1 . 2 .]" 1 2172 1 75 ASN H 1 78 LYS QG 5.050 . 8.237 7.877 7.678 8.185 . 0 0 "[ . 1 . 2 .]" 1 2173 1 75 ASN HA 1 75 ASN HB3 2.647 . 3.523 2.507 2.445 2.548 . 0 0 "[ . 1 . 2 .]" 1 2174 1 75 ASN HA 1 75 ASN HD21 3.219 . 4.514 3.816 1.877 4.476 0.047 18 0 "[ . 1 . 2 .]" 1 2175 1 75 ASN HA 1 76 GLY H 2.718 . 3.642 2.818 2.716 2.882 . 0 0 "[ . 1 . 2 .]" 1 2176 1 75 ASN HA 1 76 GLY H 2.554 . 3.369 2.398 2.160 2.587 . 0 0 "[ . 1 . 2 .]" 1 2177 1 75 ASN HA 1 76 GLY H 2.585 . 3.420 2.172 1.928 2.530 . 0 0 "[ . 1 . 2 .]" 1 2178 1 75 ASN HB2 1 75 ASN HD21 2.915 . 3.977 2.552 2.183 3.508 . 0 0 "[ . 1 . 2 .]" 1 2179 1 75 ASN HB2 1 75 ASN HD22 3.987 . 5.974 3.620 3.452 4.061 . 0 0 "[ . 1 . 2 .]" 1 2180 1 75 ASN HB2 1 76 GLY H 4.492 . 7.015 4.223 4.137 4.345 . 0 0 "[ . 1 . 2 .]" 1 2181 1 75 ASN HB2 1 77 GLU H 4.138 . 6.278 3.709 3.399 4.133 . 0 0 "[ . 1 . 2 .]" 1 2182 1 75 ASN HB3 1 75 ASN HD21 3.386 . 4.819 2.931 2.233 3.502 . 0 0 "[ . 1 . 2 .]" 1 2183 1 75 ASN HB3 1 76 GLY H 4.661 . 7.376 4.427 4.395 4.468 . 0 0 "[ . 1 . 2 .]" 1 2184 1 75 ASN HB3 1 77 GLU H 4.352 . 6.720 4.552 4.316 4.742 . 0 0 "[ . 1 . 2 .]" 1 2185 1 75 ASN HD21 1 77 GLU QB 4.283 . 6.576 5.746 4.819 6.402 . 0 0 "[ . 1 . 2 .]" 1 2186 1 76 GLY H 1 76 GLY HA2 2.502 . 3.284 2.322 2.308 2.332 . 0 0 "[ . 1 . 2 .]" 1 2187 1 76 GLY H 1 77 GLU H 2.801 . 3.782 2.573 2.491 2.678 . 0 0 "[ . 1 . 2 .]" 1 2188 1 76 GLY H 1 77 GLU QB 5.288 . 8.784 4.750 4.501 4.882 . 0 0 "[ . 1 . 2 .]" 1 2189 1 76 GLY H 1 77 GLU HG3 5.241 . 8.674 5.776 4.478 7.063 . 0 0 "[ . 1 . 2 .]" 1 2190 1 76 GLY H 1 78 LYS QG 4.537 . 7.111 6.124 5.887 6.525 . 0 0 "[ . 1 . 2 .]" 1 2191 1 76 GLY HA2 1 77 GLU H 3.578 . 5.178 3.270 3.204 3.340 . 0 0 "[ . 1 . 2 .]" 1 2192 1 76 GLY HA3 1 77 GLU H 3.311 . 4.682 3.302 3.252 3.380 . 0 0 "[ . 1 . 2 .]" 1 2193 1 76 GLY HA3 1 77 GLU H 3.079 . 4.264 2.636 2.220 2.765 . 0 0 "[ . 1 . 2 .]" 1 2194 1 77 GLU H 1 77 GLU HA 2.903 . 3.956 2.934 2.918 2.939 . 0 0 "[ . 1 . 2 .]" 1 2195 1 77 GLU H 1 77 GLU QB . . 3.032 2.466 2.247 2.555 . 0 0 "[ . 1 . 2 .]" 1 2196 1 77 GLU H 1 77 GLU QB 3.812 . 5.628 2.272 1.897 2.528 0.099 24 0 "[ . 1 . 2 .]" 1 2197 1 77 GLU H 1 77 GLU HG3 2.665 . 3.553 3.526 2.471 4.461 0.908 23 3 "[ . 1 * . - 2 + .]" 1 2198 1 77 GLU H 1 78 LYS H 4.159 . 6.322 4.414 4.361 4.462 . 0 0 "[ . 1 . 2 .]" 1 2199 1 77 GLU H 1 78 LYS H 4.493 . 7.017 3.852 3.013 4.030 . 0 0 "[ . 1 . 2 .]" 1 2200 1 77 GLU H 1 78 LYS QG 3.886 . 5.774 5.165 5.056 5.568 . 0 0 "[ . 1 . 2 .]" 1 2201 1 77 GLU HA 1 77 GLU QB 2.683 . 3.583 2.328 2.182 2.388 . 0 0 "[ . 1 . 2 .]" 1 2202 1 77 GLU HA 1 77 GLU HG2 3.204 . 4.487 3.019 2.488 3.892 . 0 0 "[ . 1 . 2 .]" 1 2203 1 77 GLU HA 1 77 GLU HG3 3.443 . 4.925 3.474 2.871 3.833 . 0 0 "[ . 1 . 2 .]" 1 2204 1 77 GLU HA 1 78 LYS H 1.999 . 2.499 2.156 2.131 2.213 . 0 0 "[ . 1 . 2 .]" 1 2205 1 77 GLU HA 1 78 LYS QE 4.912 . 7.928 5.834 4.261 6.712 . 0 0 "[ . 1 . 2 .]" 1 2206 1 77 GLU HB2 1 77 GLU HB3 1.611 . 1.936 1.710 1.694 1.726 . 0 0 "[ . 1 . 2 .]" 1 2207 1 77 GLU HG2 1 78 LYS H 4.670 . 7.396 4.717 3.638 5.200 . 0 0 "[ . 1 . 2 .]" 1 2208 1 77 GLU HG3 1 78 LYS H 4.382 . 6.783 4.943 2.639 5.516 . 0 0 "[ . 1 . 2 .]" 1 2209 1 78 LYS H 1 78 LYS HA 2.943 . 4.026 2.891 2.863 2.902 . 0 0 "[ . 1 . 2 .]" 1 2210 1 78 LYS H 1 78 LYS QB 2.531 . 3.332 2.428 2.336 2.539 . 0 0 "[ . 1 . 2 .]" 1 2211 1 78 LYS H 1 78 LYS HE3 5.131 . 8.422 5.034 3.664 6.039 . 0 0 "[ . 1 . 2 .]" 1 2212 1 78 LYS H 1 78 LYS QG 3.011 . 4.144 2.432 2.190 3.303 . 0 0 "[ . 1 . 2 .]" 1 2213 1 78 LYS H 1 78 LYS QG 2.518 . 3.311 2.145 2.023 2.476 . 0 0 "[ . 1 . 2 .]" 1 2214 1 78 LYS HA 1 78 LYS QE 4.168 . 6.339 4.433 3.885 5.187 . 0 0 "[ . 1 . 2 .]" 1 2215 1 78 LYS HA 1 78 LYS QG 2.280 . 2.930 2.456 2.361 2.560 . 0 0 "[ . 1 . 2 .]" 1 2216 1 78 LYS HA 1 79 LEU H 1.954 . 2.431 2.131 2.109 2.164 . 0 0 "[ . 1 . 2 .]" 1 2217 1 78 LYS QB 1 78 LYS QE 2.912 . 3.972 2.355 1.829 3.373 0.023 15 0 "[ . 1 . 2 .]" 1 2218 1 78 LYS QE 1 78 LYS QG 2.439 . 3.183 2.082 1.909 2.430 . 0 0 "[ . 1 . 2 .]" 1 2219 1 78 LYS QE 1 78 LYS QG 2.681 . 3.579 1.935 1.813 2.296 . 0 0 "[ . 1 . 2 .]" 1 2220 1 78 LYS QE 1 78 LYS QG 2.135 . 2.705 1.962 1.815 2.137 . 0 0 "[ . 1 . 2 .]" 1 2221 1 78 LYS QE 1 78 LYS QG 2.696 . 3.605 2.095 1.896 2.476 . 0 0 "[ . 1 . 2 .]" 1 2222 1 78 LYS QG 1 79 LEU H 4.386 . 6.790 4.054 3.950 4.177 . 0 0 "[ . 1 . 2 .]" 1 2223 1 78 LYS HG3 1 79 LEU H 4.493 . 7.017 5.098 4.395 5.244 . 0 0 "[ . 1 . 2 .]" 1 2224 1 79 LEU H 1 79 LEU HB2 2.589 . 3.427 2.575 2.493 2.637 . 0 0 "[ . 1 . 2 .]" 1 2225 1 79 LEU H 1 79 LEU HB2 2.319 . 2.991 2.194 2.073 2.280 . 0 0 "[ . 1 . 2 .]" 1 2226 1 79 LEU H 1 79 LEU HB3 3.605 . 5.229 3.636 3.611 3.662 . 0 0 "[ . 1 . 2 .]" 1 2227 1 79 LEU H 1 79 LEU MD1 3.778 . 5.562 3.790 3.651 3.929 . 0 0 "[ . 1 . 2 .]" 1 2228 1 79 LEU H 1 79 LEU QD 3.313 . 4.654 2.996 2.878 3.151 . 0 0 "[ . 1 . 2 .]" 1 2229 1 79 LEU H 1 79 LEU MD2 3.439 . 4.917 3.141 2.972 3.357 . 0 0 "[ . 1 . 2 .]" 1 2230 1 79 LEU H 1 80 LEU H 5.018 . 8.165 4.467 4.400 4.530 . 0 0 "[ . 1 . 2 .]" 1 2231 1 79 LEU H 1 81 ILE H 4.796 . 7.672 5.848 5.716 6.015 . 0 0 "[ . 1 . 2 .]" 1 2232 1 79 LEU HA 1 79 LEU HB2 3.479 . 4.992 2.803 2.778 2.823 . 0 0 "[ . 1 . 2 .]" 1 2233 1 79 LEU HA 1 79 LEU MD1 3.705 . 5.420 3.819 3.761 3.864 . 0 0 "[ . 1 . 2 .]" 1 2234 1 79 LEU HA 1 79 LEU MD2 2.115 . 2.674 2.146 2.053 2.224 . 0 0 "[ . 1 . 2 .]" 1 2235 1 79 LEU HA 1 80 LEU H 2.263 . 2.903 2.161 2.125 2.219 . 0 0 "[ . 1 . 2 .]" 1 2236 1 79 LEU HB2 1 79 LEU MD1 1.760 . 2.147 1.821 1.813 1.829 . 0 0 "[ . 1 . 2 .]" 1 2237 1 79 LEU HB2 1 79 LEU MD2 2.920 . 3.986 3.198 3.186 3.206 . 0 0 "[ . 1 . 2 .]" 1 2238 1 79 LEU HB2 1 80 LEU H 4.482 . 6.993 3.950 3.799 4.059 . 0 0 "[ . 1 . 2 .]" 1 2239 1 79 LEU HB3 1 80 LEU H 3.324 . 4.705 3.276 3.031 3.445 . 0 0 "[ . 1 . 2 .]" 1 2240 1 79 LEU QD 1 79 LEU HG 1.786 . 2.185 1.894 1.891 1.898 . 0 0 "[ . 1 . 2 .]" 1 2241 1 79 LEU QD 1 80 LEU H 4.149 . 5.782 3.705 3.572 3.831 . 0 0 "[ . 1 . 2 .]" 1 2242 1 79 LEU MD1 1 79 LEU HG 1.818 . 2.231 2.121 2.115 2.127 . 0 0 "[ . 1 . 2 .]" 1 2243 1 79 LEU MD1 1 82 ARG H 4.540 . 7.116 7.269 7.181 7.345 0.229 13 0 "[ . 1 . 2 .]" 1 2244 1 79 LEU MD2 1 79 LEU HG 2.173 . 2.763 2.131 2.128 2.134 . 0 0 "[ . 1 . 2 .]" 1 2245 1 79 LEU MD2 1 80 LEU H 3.829 . 5.662 3.822 3.664 3.955 . 0 0 "[ . 1 . 2 .]" 1 2246 1 80 LEU H 1 80 LEU HA 2.987 . 4.102 2.890 2.880 2.921 . 0 0 "[ . 1 . 2 .]" 1 2247 1 80 LEU H 1 80 LEU QB 2.571 . 3.397 2.296 2.275 2.339 . 0 0 "[ . 1 . 2 .]" 1 2248 1 80 LEU H 1 80 LEU HB3 2.594 . 3.435 2.522 2.449 2.577 . 0 0 "[ . 1 . 2 .]" 1 2249 1 80 LEU H 1 80 LEU MD1 4.583 . 7.209 4.143 4.077 4.211 . 0 0 "[ . 1 . 2 .]" 1 2250 1 80 LEU H 1 80 LEU MD2 4.430 . 6.883 4.312 4.288 4.363 . 0 0 "[ . 1 . 2 .]" 1 2251 1 80 LEU H 1 81 ILE H 4.518 . 7.070 4.258 4.208 4.293 . 0 0 "[ . 1 . 2 .]" 1 2252 1 80 LEU HA 1 80 LEU QB 2.541 . 3.348 2.380 2.358 2.407 . 0 0 "[ . 1 . 2 .]" 1 2253 1 80 LEU HA 1 80 LEU MD1 2.221 . 2.838 2.026 1.967 2.077 . 0 0 "[ . 1 . 2 .]" 1 2254 1 80 LEU HA 1 81 ILE H 1.880 . 2.322 2.123 2.097 2.138 . 0 0 "[ . 1 . 2 .]" 1 2255 1 80 LEU QB 1 80 LEU MD2 2.688 . 3.591 2.092 2.083 2.098 . 0 0 "[ . 1 . 2 .]" 1 2256 1 80 LEU QB 1 80 LEU MD2 1.680 . 2.033 1.878 1.873 1.881 . 0 0 "[ . 1 . 2 .]" 1 2257 1 80 LEU QD 1 81 ILE H 2.887 . 3.929 2.791 2.639 3.008 . 0 0 "[ . 1 . 2 .]" 1 2258 1 80 LEU MD1 1 80 LEU HG 1.958 . 2.437 2.127 2.125 2.131 . 0 0 "[ . 1 . 2 .]" 1 2259 1 80 LEU MD1 1 80 LEU HG 2.053 . 2.580 2.039 1.903 2.103 . 0 0 "[ . 1 . 2 .]" 1 2260 1 80 LEU MD1 1 81 ILE H 2.827 . 3.826 2.807 2.650 3.037 . 0 0 "[ . 1 . 2 .]" 1 2261 1 80 LEU MD1 1 82 ARG QD 4.082 . 6.164 3.673 3.200 5.031 . 0 0 "[ . 1 . 2 .]" 1 2262 1 80 LEU MD2 1 82 ARG QD 3.235 . 4.543 2.330 1.995 3.658 . 0 0 "[ . 1 . 2 .]" 1 2263 1 80 LEU MD2 1 83 MET H 5.641 . 9.619 6.485 6.201 6.794 . 0 0 "[ . 1 . 2 .]" 1 2264 1 81 ILE H 1 81 ILE HA 2.881 . 3.919 2.927 2.922 2.933 . 0 0 "[ . 1 . 2 .]" 1 2265 1 81 ILE H 1 81 ILE HB 2.604 . 3.451 2.542 2.465 2.590 . 0 0 "[ . 1 . 2 .]" 1 2266 1 81 ILE H 1 81 ILE HB 2.432 . 3.172 2.288 1.883 2.546 . 0 0 "[ . 1 . 2 .]" 1 2267 1 81 ILE H 1 81 ILE MD 3.704 . 5.419 3.811 3.714 3.892 . 0 0 "[ . 1 . 2 .]" 1 2268 1 81 ILE H 1 81 ILE HG12 3.359 . 4.769 3.263 3.220 3.321 . 0 0 "[ . 1 . 2 .]" 1 2269 1 81 ILE H 1 81 ILE HG13 2.213 . 2.825 2.408 2.286 2.558 . 0 0 "[ . 1 . 2 .]" 1 2270 1 81 ILE H 1 81 ILE MG 4.057 . 6.115 3.799 3.772 3.816 . 0 0 "[ . 1 . 2 .]" 1 2271 1 81 ILE H 1 82 ARG H 4.355 . 6.726 4.378 4.350 4.425 . 0 0 "[ . 1 . 2 .]" 1 2272 1 81 ILE HA 1 81 ILE MD 3.967 . 5.935 3.869 3.844 3.893 . 0 0 "[ . 1 . 2 .]" 1 2273 1 81 ILE HA 1 81 ILE HG12 2.140 . 2.713 2.201 2.190 2.217 . 0 0 "[ . 1 . 2 .]" 1 2274 1 81 ILE HA 1 81 ILE MG 2.716 . 3.638 2.378 2.346 2.432 . 0 0 "[ . 1 . 2 .]" 1 2275 1 81 ILE HB 1 81 ILE MD 2.190 . 2.789 2.455 2.408 2.490 . 0 0 "[ . 1 . 2 .]" 1 2276 1 81 ILE HB 1 81 ILE HG13 1.877 . 2.317 2.432 2.416 2.460 0.143 7 0 "[ . 1 . 2 .]" 1 2277 1 81 ILE MD 1 81 ILE HG12 1.603 . 1.924 1.765 1.748 1.786 . 0 0 "[ . 1 . 2 .]" 1 2278 1 81 ILE MD 1 81 ILE HG13 1.873 . 2.311 2.125 2.120 2.132 . 0 0 "[ . 1 . 2 .]" 1 2279 1 81 ILE MD 1 81 ILE MG 2.023 . 2.534 1.885 1.860 1.920 . 0 0 "[ . 1 . 2 .]" 1 2280 1 81 ILE MD 1 82 ARG H 4.993 . 8.110 5.285 5.230 5.324 . 0 0 "[ . 1 . 2 .]" 1 2281 1 81 ILE MG 1 82 ARG H 3.170 . 4.426 2.933 2.873 2.991 . 0 0 "[ . 1 . 2 .]" 1 2282 1 82 ARG H 1 82 ARG HB2 3.922 . 5.845 3.678 2.643 3.937 . 0 0 "[ . 1 . 2 .]" 1 2283 1 82 ARG H 1 82 ARG HD3 5.478 . 9.230 4.890 4.393 5.771 . 0 0 "[ . 1 . 2 .]" 1 2284 1 82 ARG H 1 82 ARG HG3 3.016 . 4.153 3.082 2.800 3.673 . 0 0 "[ . 1 . 2 .]" 1 2285 1 82 ARG H 1 83 MET H 4.390 . 6.799 4.440 4.412 4.502 . 0 0 "[ . 1 . 2 .]" 1 2286 1 82 ARG HA 1 82 ARG QB 2.389 . 3.103 2.201 2.149 2.457 . 0 0 "[ . 1 . 2 .]" 1 2287 1 82 ARG HA 1 83 MET H 2.062 . 2.593 2.366 2.297 2.439 . 0 0 "[ . 1 . 2 .]" 1 2288 1 82 ARG QB 1 82 ARG QD 2.985 . 4.099 2.221 2.090 2.390 . 0 0 "[ . 1 . 2 .]" 1 2289 1 82 ARG QB 1 83 MET H 2.140 . 2.712 2.356 2.179 2.600 . 0 0 "[ . 1 . 2 .]" 1 2290 1 82 ARG HB2 1 83 MET H 2.193 . 2.794 2.591 2.198 3.741 0.947 10 4 "[ - . + . ** .]" 1 2291 1 82 ARG HD3 1 83 MET H 5.288 . 8.784 5.269 4.041 6.073 . 0 0 "[ . 1 . 2 .]" 1 2292 1 83 MET H 1 83 MET HA 2.766 . 3.722 2.830 2.810 2.869 . 0 0 "[ . 1 . 2 .]" 1 2293 1 83 MET H 1 83 MET QB 2.739 . 3.677 2.488 2.401 2.530 . 0 0 "[ . 1 . 2 .]" 1 2294 1 83 MET H 1 83 MET HB3 2.743 . 3.683 3.581 3.568 3.601 . 0 0 "[ . 1 . 2 .]" 1 2295 1 83 MET H 1 83 MET ME 4.029 . 6.058 3.847 3.681 4.269 . 0 0 "[ . 1 . 2 .]" 1 2296 1 83 MET H 1 83 MET HG2 2.383 . 3.093 2.248 2.119 2.523 . 0 0 "[ . 1 . 2 .]" 1 2297 1 83 MET H 1 83 MET HG3 3.289 . 4.641 3.107 2.778 3.278 . 0 0 "[ . 1 . 2 .]" 1 2298 1 83 MET H 1 84 SER H 4.689 . 7.437 4.583 4.525 4.636 . 0 0 "[ . 1 . 2 .]" 1 2299 1 83 MET HA 1 83 MET ME 2.165 . 2.751 2.049 1.896 2.649 . 0 0 "[ . 1 . 2 .]" 1 2300 1 83 MET HA 1 83 MET HG2 3.000 . 4.125 2.744 2.644 2.830 . 0 0 "[ . 1 . 2 .]" 1 2301 1 83 MET HA 1 84 SER H 2.047 . 2.571 2.204 2.170 2.257 . 0 0 "[ . 1 . 2 .]" 1 2302 1 83 MET HA 1 85 THR HB 4.792 . 7.662 7.045 6.557 7.602 . 0 0 "[ . 1 . 2 .]" 1 2303 1 83 MET QB 1 83 MET HG3 2.595 . 3.437 2.124 2.119 2.130 . 0 0 "[ . 1 . 2 .]" 1 2304 1 83 MET QB 1 84 SER H 3.572 . 5.167 3.096 2.896 3.259 . 0 0 "[ . 1 . 2 .]" 1 2305 1 83 MET ME 1 83 MET HG3 3.163 . 4.414 3.419 3.398 3.438 . 0 0 "[ . 1 . 2 .]" 1 2306 1 83 MET ME 1 84 SER H 3.259 . 4.587 2.946 2.724 3.639 . 0 0 "[ . 1 . 2 .]" 1 2307 1 83 MET HG2 1 84 SER H 5.122 . 8.401 4.831 4.765 4.926 . 0 0 "[ . 1 . 2 .]" 1 2308 1 83 MET HG3 1 84 SER H 5.943 . 10.357 5.524 5.411 5.643 . 0 0 "[ . 1 . 2 .]" 1 2309 1 84 SER H 1 84 SER HB2 2.794 . 3.770 2.741 2.534 3.652 . 0 0 "[ . 1 . 2 .]" 1 2310 1 84 SER H 1 84 SER HB3 2.671 . 3.563 2.730 2.480 3.649 0.086 2 0 "[ . 1 . 2 .]" 1 2311 1 85 THR HA 1 85 THR MG 2.400 . 3.120 2.504 2.233 3.211 0.091 13 0 "[ . 1 . 2 .]" 1 2312 1 85 THR HB 1 85 THR MG 1.969 . 2.454 2.134 2.128 2.137 . 0 0 "[ . 1 . 2 .]" 1 2313 1 85 THR HB 1 87 TYR H 5.202 . 8.585 5.563 5.133 5.886 . 0 0 "[ . 1 . 2 .]" 1 2314 1 86 ARG HA 1 86 ARG HB2 2.727 . 3.656 3.021 3.013 3.026 . 0 0 "[ . 1 . 2 .]" 1 2315 1 86 ARG HA 1 86 ARG HB3 2.925 . 3.995 2.494 2.450 2.553 . 0 0 "[ . 1 . 2 .]" 1 2316 1 86 ARG HA 1 86 ARG HB3 2.992 . 4.111 2.256 2.184 2.289 . 0 0 "[ . 1 . 2 .]" 1 2317 1 86 ARG HA 1 86 ARG HG2 2.874 . 3.907 2.604 2.459 3.105 . 0 0 "[ . 1 . 2 .]" 1 2318 1 86 ARG HA 1 86 ARG HG2 2.598 . 3.442 2.192 2.136 2.303 . 0 0 "[ . 1 . 2 .]" 1 2319 1 86 ARG HA 1 87 TYR H 4.114 . 6.230 3.511 3.360 3.547 . 0 0 "[ . 1 . 2 .]" 1 2320 1 86 ARG HB2 1 86 ARG QD 3.018 . 4.156 2.568 2.335 3.302 . 0 0 "[ . 1 . 2 .]" 1 2321 1 86 ARG HB2 1 87 TYR H 3.596 . 5.212 2.775 2.605 3.371 . 0 0 "[ . 1 . 2 .]" 1 2322 1 86 ARG HB2 1 87 TYR QD 4.267 . 6.543 2.362 2.037 3.710 . 0 0 "[ . 1 . 2 .]" 1 2323 1 86 ARG HB3 1 86 ARG QD 3.391 . 4.828 2.594 2.343 3.098 . 0 0 "[ . 1 . 2 .]" 1 2324 1 86 ARG HB3 1 87 TYR H 3.181 . 4.445 3.737 3.556 4.167 . 0 0 "[ . 1 . 2 .]" 1 2325 1 86 ARG QD 1 86 ARG HG3 2.647 . 3.523 2.293 2.171 2.385 . 0 0 "[ . 1 . 2 .]" 1 2326 1 87 TYR H 1 87 TYR HA 2.925 . 3.994 2.944 2.936 2.948 . 0 0 "[ . 1 . 2 .]" 1 2327 1 87 TYR H 1 87 TYR HB2 3.155 . 4.399 2.576 2.479 2.701 . 0 0 "[ . 1 . 2 .]" 1 2328 1 87 TYR H 1 87 TYR HB3 3.666 . 5.346 3.737 3.679 3.812 . 0 0 "[ . 1 . 2 .]" 1 2329 1 87 TYR H 1 87 TYR HD1 4.503 . 7.038 5.197 3.987 5.414 . 0 0 "[ . 1 . 2 .]" 1 2330 1 87 TYR H 1 87 TYR QD 3.965 . 5.930 2.696 2.170 3.738 . 0 0 "[ . 1 . 2 .]" 1 2331 1 87 TYR HA 1 87 TYR HD1 3.279 . 4.623 3.443 2.748 4.546 . 0 0 "[ . 1 . 2 .]" 1 2332 1 87 TYR HA 1 89 GLU H 4.259 . 6.527 3.681 3.316 3.910 . 0 0 "[ . 1 . 2 .]" 1 2333 1 87 TYR HB2 1 87 TYR HD1 3.183 . 4.449 3.494 2.296 3.717 . 0 0 "[ . 1 . 2 .]" 1 2334 1 87 TYR HB2 1 87 TYR QD 3.756 . 5.519 2.511 2.276 2.664 . 0 0 "[ . 1 . 2 .]" 1 2335 1 87 TYR HB2 1 87 TYR QE 4.650 . 7.353 4.443 4.378 4.489 . 0 0 "[ . 1 . 2 .]" 1 2336 1 87 TYR HB2 1 90 LEU MD2 3.244 . 4.560 3.555 2.919 4.102 . 0 0 "[ . 1 . 2 .]" 1 2337 1 87 TYR HB3 1 87 TYR HD1 3.165 . 4.417 2.385 2.277 3.358 . 0 0 "[ . 1 . 2 .]" 1 2338 1 87 TYR HB3 1 87 TYR QD 3.293 . 4.649 2.334 2.259 2.688 . 0 0 "[ . 1 . 2 .]" 1 2339 1 87 TYR HB3 1 89 GLU H 3.920 . 5.841 3.188 2.551 3.455 . 0 0 "[ . 1 . 2 .]" 1 2340 1 87 TYR HB3 1 90 LEU MD2 2.918 . 3.982 3.045 2.611 3.353 . 0 0 "[ . 1 . 2 .]" 1 2341 1 87 TYR QD 1 90 LEU MD2 3.721 . 5.451 2.701 2.239 3.417 . 0 0 "[ . 1 . 2 .]" 1 2342 1 87 TYR HD1 1 89 GLU H 6.135 . 10.839 4.347 3.594 6.213 . 0 0 "[ . 1 . 2 .]" 1 2343 1 87 TYR HD1 1 90 LEU MD2 3.267 . 4.601 2.766 2.242 4.114 . 0 0 "[ . 1 . 2 .]" 1 2344 1 87 TYR QE 1 90 LEU MD2 3.624 . 5.265 3.660 3.262 4.260 . 0 0 "[ . 1 . 2 .]" 1 2345 1 88 LYS HA 1 88 LYS QD 5.170 . 8.512 3.250 1.940 4.498 . 0 0 "[ . 1 . 2 .]" 1 2346 1 88 LYS HA 1 88 LYS QG 3.358 . 4.767 2.703 2.353 3.354 . 0 0 "[ . 1 . 2 .]" 1 2347 1 88 LYS QB 1 88 LYS QG 2.857 . 3.877 2.044 1.983 2.088 . 0 0 "[ . 1 . 2 .]" 1 2348 1 88 LYS QB 1 89 GLU H 2.947 . 4.032 2.713 2.465 3.616 . 0 0 "[ . 1 . 2 .]" 1 2349 1 88 LYS HB3 1 89 GLU H 2.945 . 4.029 3.361 2.575 4.087 0.058 20 0 "[ . 1 . 2 .]" 1 2350 1 88 LYS QD 1 89 GLU H 5.128 . 8.415 4.663 3.163 5.465 . 0 0 "[ . 1 . 2 .]" 1 2351 1 88 LYS QE 1 88 LYS QG 3.023 . 4.166 2.366 2.131 2.816 . 0 0 "[ . 1 . 2 .]" 1 2352 1 88 LYS QG 1 89 GLU H 4.341 . 6.697 3.860 2.416 4.609 . 0 0 "[ . 1 . 2 .]" 1 2353 1 89 GLU H 1 89 GLU HB3 3.050 . 4.213 3.406 2.977 3.881 . 0 0 "[ . 1 . 2 .]" 1 2354 1 89 GLU H 1 90 LEU H 4.643 . 7.338 4.315 4.217 4.395 . 0 0 "[ . 1 . 2 .]" 1 2355 1 89 GLU H 1 90 LEU MD2 4.331 . 6.676 4.717 4.454 4.965 . 0 0 "[ . 1 . 2 .]" 1 2356 1 89 GLU HA 1 89 GLU QB 3.313 . 4.685 2.200 2.161 2.410 . 0 0 "[ . 1 . 2 .]" 1 2357 1 89 GLU HA 1 89 GLU QB 3.002 . 4.128 2.062 2.036 2.165 . 0 0 "[ . 1 . 2 .]" 1 2358 1 89 GLU HA 1 89 GLU QB 2.836 . 3.841 1.981 1.932 2.124 . 0 0 "[ . 1 . 2 .]" 1 2359 1 89 GLU HA 1 89 GLU QG 3.370 . 4.789 3.314 2.444 3.508 . 0 0 "[ . 1 . 2 .]" 1 2360 1 89 GLU HA 1 90 LEU H 2.399 . 3.118 2.283 2.190 2.440 . 0 0 "[ . 1 . 2 .]" 1 2361 1 89 GLU QB 1 90 LEU H 3.256 . 4.581 2.777 2.438 3.645 . 0 0 "[ . 1 . 2 .]" 1 2362 1 90 LEU H 1 90 LEU HA 2.866 . 3.892 2.923 2.905 2.932 . 0 0 "[ . 1 . 2 .]" 1 2363 1 90 LEU H 1 90 LEU HB2 2.734 . 3.669 2.461 2.416 2.527 . 0 0 "[ . 1 . 2 .]" 1 2364 1 90 LEU H 1 90 LEU HB2 2.417 . 3.148 2.289 2.226 2.318 . 0 0 "[ . 1 . 2 .]" 1 2365 1 90 LEU H 1 90 LEU MD1 3.954 . 5.908 3.861 3.721 4.007 . 0 0 "[ . 1 . 2 .]" 1 2366 1 90 LEU H 1 90 LEU MD2 3.514 . 5.057 3.621 3.496 3.753 . 0 0 "[ . 1 . 2 .]" 1 2367 1 90 LEU H 1 91 GLN H 3.857 . 5.717 4.002 2.290 4.546 . 0 0 "[ . 1 . 2 .]" 1 2368 1 90 LEU H 1 92 LEU H 4.822 . 7.728 5.790 5.108 6.592 . 0 0 "[ . 1 . 2 .]" 1 2369 1 90 LEU HA 1 90 LEU HB3 2.739 . 3.677 2.484 2.439 2.522 . 0 0 "[ . 1 . 2 .]" 1 2370 1 90 LEU HA 1 90 LEU MD1 3.967 . 5.934 3.835 3.779 3.876 . 0 0 "[ . 1 . 2 .]" 1 2371 1 90 LEU HA 1 90 LEU MD2 2.003 . 2.505 2.000 1.883 2.073 . 0 0 "[ . 1 . 2 .]" 1 2372 1 90 LEU HA 1 91 GLN H 2.565 . 3.387 2.349 2.101 3.515 0.128 4 0 "[ . 1 . 2 .]" 1 2373 1 90 LEU HB2 1 90 LEU MD1 2.228 . 2.848 2.319 2.271 2.421 . 0 0 "[ . 1 . 2 .]" 1 2374 1 90 LEU HB2 1 90 LEU MD1 1.653 . 1.994 1.965 1.950 1.995 0.001 25 0 "[ . 1 . 2 .]" 1 2375 1 90 LEU HB2 1 90 LEU MD2 2.894 . 3.941 3.198 3.193 3.207 . 0 0 "[ . 1 . 2 .]" 1 2376 1 90 LEU HB2 1 91 GLN H 3.604 . 5.227 3.980 2.035 4.394 . 0 0 "[ . 1 . 2 .]" 1 2377 1 90 LEU HB3 1 90 LEU MD1 2.263 . 2.903 2.368 2.247 2.429 . 0 0 "[ . 1 . 2 .]" 1 2378 1 90 LEU HB3 1 90 LEU MD2 2.228 . 2.848 2.391 2.347 2.472 . 0 0 "[ . 1 . 2 .]" 1 2379 1 90 LEU HB3 1 91 GLN H 2.669 . 3.560 3.496 2.872 3.697 0.137 13 0 "[ . 1 . 2 .]" 1 2380 1 90 LEU HB3 1 92 LEU H 4.087 . 6.175 4.161 3.424 4.601 . 0 0 "[ . 1 . 2 .]" 1 2381 1 90 LEU MD1 1 90 LEU MD2 1.573 . 1.882 2.038 2.019 2.049 0.167 9 0 "[ . 1 . 2 .]" 1 2382 1 90 LEU MD1 1 91 GLN H 5.329 . 8.879 5.012 3.984 5.374 . 0 0 "[ . 1 . 2 .]" 1 2383 1 90 LEU MD2 1 90 LEU HG 1.803 . 2.209 2.125 2.121 2.131 . 0 0 "[ . 1 . 2 .]" 1 2384 1 90 LEU MD2 1 91 GLN H 4.004 . 6.008 3.763 3.418 4.549 . 0 0 "[ . 1 . 2 .]" 1 2385 1 91 GLN H 1 91 GLN QB 3.154 . 4.397 2.600 2.369 3.306 . 0 0 "[ . 1 . 2 .]" 1 2386 1 91 GLN H 1 91 GLN HB3 3.356 . 4.764 3.722 3.597 4.035 . 0 0 "[ . 1 . 2 .]" 1 2387 1 91 GLN H 1 91 GLN QG 3.496 . 5.024 2.607 2.250 3.113 . 0 0 "[ . 1 . 2 .]" 1 2388 1 91 GLN H 1 91 GLN HG3 3.450 . 4.938 3.078 2.280 4.395 . 0 0 "[ . 1 . 2 .]" 1 2389 1 91 GLN HA 1 91 GLN QG 3.450 . 4.938 2.570 2.363 2.938 . 0 0 "[ . 1 . 2 .]" 1 2390 1 91 GLN HA 1 92 LEU H 2.217 . 2.832 2.269 2.121 2.499 . 0 0 "[ . 1 . 2 .]" 1 2391 1 91 GLN HA 1 92 LEU HG 3.375 . 4.799 3.086 2.958 3.174 . 0 0 "[ . 1 . 2 .]" 1 2392 1 91 GLN HB3 1 92 LEU H 4.226 . 6.458 4.052 3.727 4.358 . 0 0 "[ . 1 . 2 .]" 1 2393 1 91 GLN QE 1 91 GLN QG 2.963 . 4.061 2.288 2.126 2.685 . 0 0 "[ . 1 . 2 .]" 1 2394 1 91 GLN QE 1 91 GLN HG3 2.838 . 3.845 2.919 2.195 3.299 . 0 0 "[ . 1 . 2 .]" 1 2395 1 91 GLN HG3 1 92 LEU H 5.344 . 8.914 5.369 5.029 5.943 . 0 0 "[ . 1 . 2 .]" 1 2396 1 92 LEU H 1 92 LEU HA 2.272 . 2.917 2.834 2.716 2.924 0.007 7 0 "[ . 1 . 2 .]" 1 2397 1 92 LEU H 1 92 LEU HA 2.476 . 3.243 2.240 1.916 2.528 . 0 0 "[ . 1 . 2 .]" 1 2398 1 92 LEU H 1 92 LEU HB2 2.164 . 2.749 2.486 2.365 2.598 . 0 0 "[ . 1 . 2 .]" 1 2399 1 92 LEU H 1 92 LEU QB 2.882 . 3.920 2.443 2.333 2.540 . 0 0 "[ . 1 . 2 .]" 1 2400 1 92 LEU H 1 92 LEU QD 3.820 . 5.644 3.042 2.828 3.268 . 0 0 "[ . 1 . 2 .]" 1 2401 1 92 LEU H 1 92 LEU MD1 2.921 . 3.987 2.801 1.821 3.389 0.034 17 0 "[ . 1 . 2 .]" 1 2402 1 92 LEU H 1 92 LEU MD2 4.228 . 6.463 3.241 2.952 3.534 . 0 0 "[ . 1 . 2 .]" 1 2403 1 92 LEU HA 1 92 LEU QB 2.947 . 4.032 2.371 2.335 2.410 . 0 0 "[ . 1 . 2 .]" 1 2404 1 92 LEU HA 1 92 LEU MD2 2.205 . 2.813 2.008 1.909 2.113 . 0 0 "[ . 1 . 2 .]" 1 2405 1 92 LEU HA 1 93 LYS H 2.086 . 2.630 2.280 2.101 2.718 0.088 7 0 "[ . 1 . 2 .]" 1 2406 1 92 LEU HA 1 93 LYS H 2.145 . 2.720 2.104 1.990 2.325 . 0 0 "[ . 1 . 2 .]" 1 2407 1 92 LEU QB 1 92 LEU QD 2.412 . 3.139 1.951 1.921 1.969 . 0 0 "[ . 1 . 2 .]" 1 2408 1 92 LEU QB 1 93 LYS H 3.632 . 5.281 2.555 1.895 3.713 0.088 20 0 "[ . 1 . 2 .]" 1 2409 1 92 LEU QD 1 94 LYS QG 2.915 . 3.977 3.531 1.905 4.144 0.167 7 0 "[ . 1 . 2 .]" 1 2410 1 92 LEU MD1 1 93 LYS H 3.754 . 5.516 4.022 2.640 4.745 . 0 0 "[ . 1 . 2 .]" 1 2411 1 92 LEU MD2 1 93 LYS H 4.253 . 6.514 3.417 3.004 4.121 . 0 0 "[ . 1 . 2 .]" 1 2412 1 93 LYS H 1 93 LYS HA 2.653 . 3.533 2.525 2.109 2.736 . 0 0 "[ . 1 . 2 .]" 1 2413 1 93 LYS H 1 93 LYS QB 2.990 . 4.108 2.499 2.049 3.151 . 0 0 "[ . 1 . 2 .]" 1 2414 1 93 LYS H 1 93 LYS QB 2.523 . 3.319 2.251 2.065 2.508 . 0 0 "[ . 1 . 2 .]" 1 2415 1 93 LYS H 1 93 LYS HB3 2.742 . 3.682 3.131 2.343 4.087 0.405 6 0 "[ . 1 . 2 .]" 1 2416 1 93 LYS H 1 93 LYS QG 2.232 . 2.855 2.163 1.690 2.467 . 0 0 "[ . 1 . 2 .]" 1 2417 1 93 LYS H 1 94 LYS HA 4.183 . 6.370 5.019 3.898 5.351 . 0 0 "[ . 1 . 2 .]" 1 2418 1 93 LYS H 1 94 LYS QG 3.309 . 4.678 3.777 3.083 4.525 . 0 0 "[ . 1 . 2 .]" 1 2419 1 93 LYS HA 1 93 LYS QB 2.516 . 3.307 2.316 2.163 2.463 . 0 0 "[ . 1 . 2 .]" 1 2420 1 93 LYS HA 1 93 LYS QG 3.299 . 4.659 2.517 2.166 2.863 . 0 0 "[ . 1 . 2 .]" 1 2421 1 93 LYS HA 1 94 LYS H 2.889 . 3.932 2.985 2.314 3.537 . 0 0 "[ . 1 . 2 .]" 1 2422 1 93 LYS QB 1 94 LYS HA 3.283 . 4.631 4.456 4.073 4.697 0.066 4 0 "[ . 1 . 2 .]" 1 2423 1 93 LYS QB 1 94 LYS HA 3.594 . 5.208 2.978 2.951 2.993 . 0 0 "[ . 1 . 2 .]" 1 2424 1 93 LYS QB 1 94 LYS HA 2.974 . 4.079 2.643 2.028 2.938 . 0 0 "[ . 1 . 2 .]" 1 2425 1 93 LYS QB 1 95 PRO HD2 4.951 . 8.016 6.185 5.632 7.101 . 0 0 "[ . 1 . 2 .]" 1 2426 1 93 LYS QD 1 93 LYS QE 1.881 . 2.323 2.037 1.987 2.090 . 0 0 "[ . 1 . 2 .]" 1 2427 1 93 LYS QD 1 93 LYS QG 2.114 . 2.673 2.078 2.012 2.092 . 0 0 "[ . 1 . 2 .]" 1 2428 1 94 LYS H 1 94 LYS HA 2.815 . 3.806 2.900 2.766 2.952 . 0 0 "[ . 1 . 2 .]" 1 2429 1 94 LYS H 1 94 LYS HB2 2.257 . 2.894 2.539 2.336 2.689 . 0 0 "[ . 1 . 2 .]" 1 2430 1 94 LYS H 1 94 LYS HB3 4.158 . 6.320 3.657 3.573 3.795 . 0 0 "[ . 1 . 2 .]" 1 2431 1 94 LYS H 1 94 LYS HE3 5.644 . 9.626 5.247 3.966 6.450 . 0 0 "[ . 1 . 2 .]" 1 2432 1 94 LYS H 1 94 LYS QG 2.935 . 2.979 2.462 2.039 2.889 . 0 0 "[ . 1 . 2 .]" 1 2433 1 94 LYS HA 1 94 LYS HB3 2.751 . 3.697 2.457 2.422 2.553 . 0 0 "[ . 1 . 2 .]" 1 2434 1 94 LYS HA 1 95 PRO HD2 2.435 . 3.176 2.302 1.936 2.847 . 0 0 "[ . 1 . 2 .]" 1 2435 1 94 LYS HA 1 95 PRO HD3 2.019 . 2.529 2.187 1.847 2.487 . 0 0 "[ . 1 . 2 .]" 1 2436 1 94 LYS HB3 1 94 LYS QE 3.016 . 4.153 2.501 1.894 3.475 . 0 0 "[ . 1 . 2 .]" 1 2437 1 94 LYS HB3 1 94 LYS QG 2.538 . 3.343 2.351 2.307 2.435 . 0 0 "[ . 1 . 2 .]" 1 2438 1 94 LYS HB3 1 95 PRO HD2 2.750 . 3.695 3.090 2.227 3.738 0.043 7 0 "[ . 1 . 2 .]" 1 2439 1 94 LYS QE 1 94 LYS QG 2.908 . 3.965 2.101 1.960 2.460 . 0 0 "[ . 1 . 2 .]" 1 2440 1 94 LYS QG 1 95 PRO HA 5.060 . 8.260 5.093 3.134 6.010 . 0 0 "[ . 1 . 2 .]" 1 2441 1 94 LYS QG 1 95 PRO HD2 5.390 . 9.022 4.133 3.599 5.041 . 0 0 "[ . 1 . 2 .]" 1 2442 1 94 LYS QG 1 95 PRO HD3 5.425 . 9.103 4.479 3.906 5.198 . 0 0 "[ . 1 . 2 .]" 1 2443 1 95 PRO HA 1 95 PRO HB2 2.565 . 3.387 2.786 2.672 2.972 . 0 0 "[ . 1 . 2 .]" 1 2444 1 95 PRO HA 1 95 PRO HB3 2.834 . 3.838 2.253 2.210 2.289 . 0 0 "[ . 1 . 2 .]" 1 2445 1 95 PRO HB2 1 95 PRO HD2 3.889 . 5.779 3.688 2.931 4.054 . 0 0 "[ . 1 . 2 .]" 1 2446 1 95 PRO HB2 1 96 GLY H 4.306 . 6.624 3.646 2.124 4.355 . 0 0 "[ . 1 . 2 .]" 1 2447 1 95 PRO HB3 1 95 PRO HD2 3.357 . 4.766 3.885 3.865 3.921 . 0 0 "[ . 1 . 2 .]" 1 2448 1 95 PRO HB3 1 96 GLY H 3.580 . 5.182 4.171 3.236 4.670 . 0 0 "[ . 1 . 2 .]" 1 2449 1 95 PRO HD2 1 95 PRO QG 2.474 . 3.239 2.200 2.175 2.250 . 0 0 "[ . 1 . 2 .]" 1 2450 1 95 PRO HD3 1 95 PRO QG 2.529 . 3.328 2.210 2.178 2.247 . 0 0 "[ . 1 . 2 .]" 1 2451 1 96 GLY QA 1 97 LYS H 3.108 . 4.315 2.337 2.091 2.729 . 0 0 "[ . 1 . 2 .]" 1 2452 1 96 GLY HA3 1 97 LYS H 2.979 . 4.088 2.925 2.114 3.560 . 0 0 "[ . 1 . 2 .]" 1 2453 1 97 LYS H 1 97 LYS HA 2.679 . 3.576 2.276 1.961 2.809 . 0 0 "[ . 1 . 2 .]" 1 2454 1 97 LYS H 1 97 LYS QB 2.995 . 4.116 2.867 2.421 3.408 . 0 0 "[ . 1 . 2 .]" 1 2455 1 97 LYS H 1 97 LYS HB3 3.484 . 5.001 3.866 3.603 4.134 . 0 0 "[ . 1 . 2 .]" 1 2456 1 97 LYS H 1 97 LYS HG3 4.694 . 7.449 4.218 3.627 4.615 . 0 0 "[ . 1 . 2 .]" 1 2457 1 97 LYS HA 1 97 LYS QD 2.225 . 2.844 2.098 1.863 2.843 . 0 0 "[ . 1 . 2 .]" 1 2458 1 97 LYS HA 1 97 LYS QG 2.777 . 3.741 2.889 2.387 3.101 . 0 0 "[ . 1 . 2 .]" 1 2459 1 97 LYS QB 1 97 LYS QG 2.209 . 2.819 1.999 1.976 2.018 . 0 0 "[ . 1 . 2 .]" 1 2460 1 97 LYS QB 1 102 ILE MD 3.602 . 5.224 3.766 2.000 5.252 0.028 18 0 "[ . 1 . 2 .]" 1 2461 1 98 ASN HB3 1 98 ASN HD21 3.912 . 5.825 2.670 2.200 3.533 . 0 0 "[ . 1 . 2 .]" 1 2462 1 98 ASN HB3 1 100 ALA H 5.880 . 10.202 5.307 3.318 6.882 . 0 0 "[ . 1 . 2 .]" 1 2463 1 99 VAL H 1 99 VAL MG2 2.491 . 3.266 2.339 1.832 2.856 . 0 0 "[ . 1 . 2 .]" 1 2464 1 99 VAL H 1 100 ALA H 3.107 . 4.313 2.239 1.853 3.188 0.048 14 0 "[ . 1 . 2 .]" 1 2465 1 99 VAL HA 1 99 VAL HB 2.964 . 4.063 3.024 3.013 3.031 . 0 0 "[ . 1 . 2 .]" 1 2466 1 99 VAL HA 1 99 VAL QG 2.219 . 2.835 2.136 2.124 2.147 . 0 0 "[ . 1 . 2 .]" 1 2467 1 99 VAL HA 1 100 ALA H 2.880 . 3.917 3.538 3.493 3.571 . 0 0 "[ . 1 . 2 .]" 1 2468 1 99 VAL HB 1 99 VAL QG 1.673 . 2.023 1.897 1.894 1.899 . 0 0 "[ . 1 . 2 .]" 1 2469 1 99 VAL HB 1 100 ALA H 2.273 . 2.919 2.185 1.645 2.836 . 0 0 "[ . 1 . 2 .]" 1 2470 1 99 VAL HB 1 102 ILE H 5.044 . 8.225 7.432 4.652 8.342 0.117 13 0 "[ . 1 . 2 .]" 1 2471 1 99 VAL QG 1 100 ALA H 2.961 . 4.057 2.895 2.299 3.342 . 0 0 "[ . 1 . 2 .]" 1 2472 1 100 ALA H 1 100 ALA HA 2.632 . 3.498 2.903 2.774 2.945 . 0 0 "[ . 1 . 2 .]" 1 2473 1 100 ALA H 1 100 ALA MB 1.918 . 2.378 2.385 2.217 2.611 0.233 6 0 "[ . 1 . 2 .]" 1 2474 1 100 ALA H 1 101 ALA H 3.027 . 4.172 3.055 1.890 4.338 0.166 24 0 "[ . 1 . 2 .]" 1 2475 1 100 ALA MB 1 101 ALA H 2.122 . 2.685 2.317 1.986 2.794 0.109 4 0 "[ . 1 . 2 .]" 1 2476 1 101 ALA H 1 102 ILE MD 3.897 . 5.796 4.696 3.751 5.356 . 0 0 "[ . 1 . 2 .]" 1 2477 1 101 ALA HA 1 102 ILE H 2.040 . 2.560 2.215 2.111 2.592 0.032 12 0 "[ . 1 . 2 .]" 1 2478 1 101 ALA HA 1 102 ILE HB 3.719 . 5.448 4.615 4.377 4.841 . 0 0 "[ . 1 . 2 .]" 1 2479 1 101 ALA HA 1 102 ILE MD 3.875 . 5.752 4.510 3.219 4.818 . 0 0 "[ . 1 . 2 .]" 1 2480 1 101 ALA HA 1 102 ILE MD 2.648 . 3.525 2.564 1.816 3.567 0.042 3 0 "[ . 1 . 2 .]" 1 2481 1 101 ALA HA 1 102 ILE QG 4.868 . 7.831 3.679 3.353 4.169 . 0 0 "[ . 1 . 2 .]" 1 2482 1 101 ALA MB 1 102 ILE H 2.549 . 3.361 3.077 2.090 3.550 0.189 9 0 "[ . 1 . 2 .]" 1 2483 1 101 ALA MB 1 103 ILE MD 2.437 . 3.179 2.723 2.146 3.266 0.087 3 0 "[ . 1 . 2 .]" 1 2484 1 101 ALA MB 1 111 GLU HA 3.197 . 4.475 3.845 2.407 4.534 0.059 19 0 "[ . 1 . 2 .]" 1 2485 1 101 ALA MB 1 112 ARG H 3.260 . 4.589 3.439 2.447 4.635 0.046 19 0 "[ . 1 . 2 .]" 1 2486 1 102 ILE H 1 102 ILE HA 2.522 . 3.317 2.883 2.809 2.945 . 0 0 "[ . 1 . 2 .]" 1 2487 1 102 ILE H 1 102 ILE HB 2.135 . 2.705 2.560 2.514 2.651 . 0 0 "[ . 1 . 2 .]" 1 2488 1 102 ILE H 1 102 ILE MD 3.731 . 5.471 3.222 1.937 3.492 0.054 10 0 "[ . 1 . 2 .]" 1 2489 1 102 ILE H 1 102 ILE QG . . 2.826 2.294 2.086 2.806 . 0 0 "[ . 1 . 2 .]" 1 2490 1 102 ILE H 1 102 ILE MG 3.132 . 4.358 3.797 3.768 3.858 . 0 0 "[ . 1 . 2 .]" 1 2491 1 102 ILE H 1 103 ILE H 3.576 . 5.175 3.981 3.552 4.286 . 0 0 "[ . 1 . 2 .]" 1 2492 1 102 ILE H 1 104 GLN QG 4.453 . 6.932 6.058 5.306 6.995 0.063 10 0 "[ . 1 . 2 .]" 1 2493 1 102 ILE HA 1 102 ILE HB 2.987 . 4.102 2.694 2.690 2.698 . 0 0 "[ . 1 . 2 .]" 1 2494 1 102 ILE HA 1 102 ILE QG 2.508 . 3.294 2.278 2.161 2.459 . 0 0 "[ . 1 . 2 .]" 1 2495 1 102 ILE HA 1 102 ILE QG 2.978 . 4.086 2.429 2.284 2.725 . 0 0 "[ . 1 . 2 .]" 1 2496 1 102 ILE HA 1 102 ILE MG 2.397 . 3.115 2.381 2.336 2.429 . 0 0 "[ . 1 . 2 .]" 1 2497 1 102 ILE HA 1 102 ILE MG 2.165 . 2.751 2.115 2.084 2.147 . 0 0 "[ . 1 . 2 .]" 1 2498 1 102 ILE HA 1 103 ILE H 2.080 . 2.621 2.275 2.122 2.519 . 0 0 "[ . 1 . 2 .]" 1 2499 1 102 ILE HA 1 103 ILE H 2.355 . 3.048 2.197 2.076 2.384 . 0 0 "[ . 1 . 2 .]" 1 2500 1 102 ILE HB 1 102 ILE MD 1.883 . 2.326 2.210 2.059 2.359 0.033 16 0 "[ . 1 . 2 .]" 1 2501 1 102 ILE HB 1 102 ILE QG 2.431 . 3.170 2.129 2.048 2.229 . 0 0 "[ . 1 . 2 .]" 1 2502 1 102 ILE HB 1 102 ILE MG 1.865 . 2.300 1.834 1.829 1.842 . 0 0 "[ . 1 . 2 .]" 1 2503 1 102 ILE HB 1 102 ILE MG 1.715 . 2.083 1.900 1.895 1.903 . 0 0 "[ . 1 . 2 .]" 1 2504 1 102 ILE MD 1 102 ILE QG 2.033 . 2.550 1.887 1.886 1.889 . 0 0 "[ . 1 . 2 .]" 1 2505 1 102 ILE MD 1 102 ILE QG 1.922 . 2.384 1.753 1.708 1.761 . 0 0 "[ . 1 . 2 .]" 1 2506 1 102 ILE MD 1 102 ILE QG 1.921 . 2.382 1.763 1.762 1.765 . 0 0 "[ . 1 . 2 .]" 1 2507 1 102 ILE MD 1 102 ILE QG 1.858 . 2.290 1.764 1.762 1.765 . 0 0 "[ . 1 . 2 .]" 1 2508 1 102 ILE QG 1 103 ILE H 3.895 . 5.792 3.476 3.194 3.813 . 0 0 "[ . 1 . 2 .]" 1 2509 1 103 ILE H 1 103 ILE HA 2.974 . 4.079 2.914 2.861 2.951 . 0 0 "[ . 1 . 2 .]" 1 2510 1 103 ILE H 1 103 ILE HB 1.989 . 2.484 2.560 2.422 2.635 0.151 1 0 "[ . 1 . 2 .]" 1 2511 1 103 ILE H 1 103 ILE MD 3.988 . 5.976 3.744 3.494 3.951 . 0 0 "[ . 1 . 2 .]" 1 2512 1 103 ILE H 1 103 ILE HG12 3.473 . 4.981 3.624 3.280 3.999 . 0 0 "[ . 1 . 2 .]" 1 2513 1 103 ILE H 1 103 ILE HG13 2.255 . 2.891 2.406 1.989 2.806 . 0 0 "[ . 1 . 2 .]" 1 2514 1 103 ILE H 1 103 ILE MG 2.855 . 3.874 3.801 3.745 3.845 . 0 0 "[ . 1 . 2 .]" 1 2515 1 103 ILE H 1 104 GLN QB 4.707 . 7.477 5.435 4.224 6.025 . 0 0 "[ . 1 . 2 .]" 1 2516 1 103 ILE HA 1 103 ILE HB 2.413 . 3.141 2.601 2.348 2.697 . 0 0 "[ . 1 . 2 .]" 1 2517 1 103 ILE HA 1 103 ILE HG12 2.294 . 2.952 2.578 2.434 2.643 . 0 0 "[ . 1 . 2 .]" 1 2518 1 103 ILE HA 1 103 ILE HG13 2.907 . 3.963 3.057 2.935 3.137 . 0 0 "[ . 1 . 2 .]" 1 2519 1 103 ILE HA 1 104 GLN H 2.239 . 2.866 2.289 2.134 2.886 0.020 1 0 "[ . 1 . 2 .]" 1 2520 1 103 ILE HA 1 105 ASP QB 4.292 . 6.595 5.237 3.962 6.282 . 0 0 "[ . 1 . 2 .]" 1 2521 1 103 ILE MD 1 111 GLU QG 4.311 . 6.634 3.805 2.171 6.149 . 0 0 "[ . 1 . 2 .]" 1 2522 1 103 ILE HG12 1 111 GLU QB 3.586 . 5.194 4.524 2.622 5.252 0.058 25 0 "[ . 1 . 2 .]" 1 2523 1 103 ILE MG 1 104 GLN H 2.939 . 4.019 3.459 2.665 4.163 0.144 1 0 "[ . 1 . 2 .]" 1 2524 1 103 ILE MG 1 104 GLN H 3.048 . 4.210 2.961 1.877 3.807 0.009 21 0 "[ . 1 . 2 .]" 1 2525 1 103 ILE MG 1 111 GLU HA 3.606 . 5.231 4.057 1.980 5.312 0.081 15 0 "[ . 1 . 2 .]" 1 2526 1 104 GLN H 1 104 GLN HB2 2.334 . 3.015 2.576 2.328 3.315 0.300 10 0 "[ . 1 . 2 .]" 1 2527 1 104 GLN H 1 104 GLN QB 2.937 . 4.015 2.528 2.299 3.160 . 0 0 "[ . 1 . 2 .]" 1 2528 1 104 GLN H 1 104 GLN QB 3.335 . 4.726 2.378 1.994 3.017 . 0 0 "[ . 1 . 2 .]" 1 2529 1 104 GLN H 1 104 GLN QG 3.458 . 4.953 2.689 2.079 3.301 . 0 0 "[ . 1 . 2 .]" 1 2530 1 104 GLN H 1 104 GLN HG3 3.314 . 4.687 3.096 2.337 4.398 . 0 0 "[ . 1 . 2 .]" 1 2531 1 104 GLN QG 1 107 HIS H 4.205 . 6.415 5.308 3.015 6.513 0.098 9 0 "[ . 1 . 2 .]" 1 2532 1 104 GLN QG 1 108 SER H 4.962 . 8.039 4.227 2.656 5.532 . 0 0 "[ . 1 . 2 .]" 1 2533 1 105 ASP H 1 105 ASP QB 3.674 . 3.855 2.630 2.262 3.354 . 0 0 "[ . 1 . 2 .]" 1 2534 1 105 ASP H 1 106 ILE H 2.631 . 3.496 2.980 2.021 3.876 0.380 1 0 "[ . 1 . 2 .]" 1 2535 1 105 ASP HA 1 105 ASP QB 3.091 . 4.243 2.363 2.180 2.479 . 0 0 "[ . 1 . 2 .]" 1 2536 1 105 ASP QB 1 106 ILE H 2.992 . 3.989 2.606 1.734 3.733 0.139 12 0 "[ . 1 . 2 .]" 1 2537 1 106 ILE H 1 106 ILE MD 2.589 . 3.427 2.952 1.825 3.696 0.269 23 0 "[ . 1 . 2 .]" 1 2538 1 106 ILE H 1 106 ILE HG13 3.191 . 4.464 2.713 1.807 4.342 0.111 22 0 "[ . 1 . 2 .]" 1 2539 1 106 ILE H 1 106 ILE MG 3.163 . 4.414 3.537 2.221 4.155 . 0 0 "[ . 1 . 2 .]" 1 2540 1 106 ILE HA 1 106 ILE MD 2.856 . 3.876 3.554 1.985 4.144 0.268 7 0 "[ . 1 . 2 .]" 1 2541 1 106 ILE HA 1 106 ILE HG12 2.986 . 4.101 3.132 2.500 4.229 0.128 22 0 "[ . 1 . 2 .]" 1 2542 1 106 ILE HA 1 106 ILE HG13 3.319 . 4.696 3.242 2.311 4.267 . 0 0 "[ . 1 . 2 .]" 1 2543 1 106 ILE HA 1 106 ILE MG 2.235 . 2.859 2.378 2.147 3.166 0.307 1 0 "[ . 1 . 2 .]" 1 2544 1 106 ILE HA 1 107 HIS H 3.429 . 4.898 2.597 2.105 3.594 . 0 0 "[ . 1 . 2 .]" 1 2545 1 106 ILE HB 1 106 ILE MG 1.877 . 2.318 2.126 2.110 2.132 . 0 0 "[ . 1 . 2 .]" 1 2546 1 106 ILE HB 1 107 HIS H 3.456 . 4.949 3.552 1.828 4.445 0.135 17 0 "[ . 1 . 2 .]" 1 2547 1 106 ILE MD 1 106 ILE HG13 2.283 . 2.934 2.057 1.969 2.093 . 0 0 "[ . 1 . 2 .]" 1 2548 1 106 ILE MG 1 107 HIS H 3.936 . 5.873 3.201 1.992 4.366 0.007 18 0 "[ . 1 . 2 .]" 1 2549 1 107 HIS H 1 107 HIS HB2 3.080 . 4.266 2.688 2.304 3.606 . 0 0 "[ . 1 . 2 .]" 1 2550 1 107 HIS H 1 107 HIS HB3 3.310 . 4.679 3.741 3.564 4.172 . 0 0 "[ . 1 . 2 .]" 1 2551 1 107 HIS H 1 108 SER QB 3.992 . 5.984 4.690 3.808 5.956 . 0 0 "[ . 1 . 2 .]" 1 2552 1 107 HIS HA 1 107 HIS HB2 2.926 . 3.997 3.018 2.994 3.032 . 0 0 "[ . 1 . 2 .]" 1 2553 1 107 HIS HA 1 107 HIS HB3 2.743 . 3.683 2.520 2.419 2.594 . 0 0 "[ . 1 . 2 .]" 1 2554 1 107 HIS HA 1 108 SER H 3.443 . 4.925 3.007 2.150 3.594 . 0 0 "[ . 1 . 2 .]" 1 2555 1 108 SER HA 1 108 SER QB 2.378 . 3.085 2.331 2.184 2.430 . 0 0 "[ . 1 . 2 .]" 1 2556 1 108 SER HA 1 109 GLN H 3.198 . 4.476 3.007 2.098 3.589 . 0 0 "[ . 1 . 2 .]" 1 2557 1 109 GLN H 1 109 GLN HB2 2.562 . 3.382 2.838 2.328 3.576 0.194 15 0 "[ . 1 . 2 .]" 1 2558 1 109 GLN H 1 109 GLN HG3 3.372 . 4.793 3.389 2.209 4.461 . 0 0 "[ . 1 . 2 .]" 1 2559 1 109 GLN HA 1 109 GLN HB3 2.405 . 3.128 2.499 2.437 2.552 . 0 0 "[ . 1 . 2 .]" 1 2560 1 109 GLN HA 1 110 ARG H 2.409 . 3.134 2.325 1.979 2.810 . 0 0 "[ . 1 . 2 .]" 1 2561 1 110 ARG H 1 110 ARG HB3 2.625 . 3.486 3.747 3.578 4.117 0.631 1 5 "[+** . 1 * . - 2 .]" 1 2562 1 110 ARG H 1 110 ARG HG3 3.057 . 4.225 3.180 2.126 4.408 0.183 10 0 "[ . 1 . 2 .]" 1 2563 1 110 ARG H 1 111 GLU H 4.774 . 7.623 3.794 2.656 4.583 . 0 0 "[ . 1 . 2 .]" 1 2564 1 110 ARG HA 1 111 GLU H 2.164 . 2.749 2.394 2.107 2.885 0.136 16 0 "[ . 1 . 2 .]" 1 2565 1 111 GLU H 1 111 GLU HG3 3.546 . 5.118 3.250 1.935 4.843 0.039 7 0 "[ . 1 . 2 .]" 1 2566 1 111 GLU H 1 112 ARG H 4.622 . 7.292 4.317 3.068 4.658 . 0 0 "[ . 1 . 2 .]" 1 2567 1 111 GLU HA 1 111 GLU QG 3.359 . 4.769 2.981 2.423 3.462 . 0 0 "[ . 1 . 2 .]" 1 2568 1 111 GLU HA 1 112 ARG H 2.034 . 2.551 2.331 2.118 2.659 0.108 19 0 "[ . 1 . 2 .]" 1 2569 1 111 GLU HB3 1 112 ARG H 4.085 . 6.171 3.747 1.983 4.604 0.016 24 0 "[ . 1 . 2 .]" 1 2570 1 112 ARG H 1 112 ARG HB3 3.649 . 5.313 3.658 2.845 4.138 . 0 0 "[ . 1 . 2 .]" 1 2571 1 112 ARG H 1 112 ARG HG3 2.761 . 3.714 3.373 2.178 4.573 0.859 16 3 "[ .- 1 .+ *2 .]" 1 stop_ save_
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