NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
547455 | 2lhh | 17849 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2lhh 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 2071 _Distance_constraint_stats_list.Viol_count 1281 _Distance_constraint_stats_list.Viol_total 337.091 _Distance_constraint_stats_list.Viol_max 0.311 _Distance_constraint_stats_list.Viol_rms 0.0052 _Distance_constraint_stats_list.Viol_average_all_restraints 0.0004 _Distance_constraint_stats_list.Viol_average_violations_only 0.0132 _Distance_constraint_stats_list.Cutoff_violation_report 0.500 _Distance_constraint_stats_list.Details ; Description of the tags in this list: * 1 * Administrative tag * 2 * Administrative tag * 3 * Administrative tag * 4 * ID of the restraint list. * 5 * Number of restraints in list. * 6 * Number of violated restraints (each model violation is used). * 7 * Sum of violations in Angstrom. * 8 * Maximum violation of a restraint without averaging in any way. * 9 * Rms of violations over all restraints. * 10 * Average violation over all restraints. * 11 * Average violation over violated restraints. This violation is averaged over only those models in which the restraint is violated. These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998). * 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table. * 13 * This tag Description of the tags in the per residue table below: * 1 * Chain identifier (can be absent if none defined) * 2 * Residue number * 3 * Residue name * 4 * Maximum violation in ensemble of models (without any averaging) * 5 * Model number with the maximum violation * 6 * Number of models with a violation above cutoff * 7 * List of models (1 character per model) with a violation above cutoff. An '*' marks a violation above the cutoff. A '+' indicates the largest violation above the cutoff and a '-' marks the smallest violation over cutoff. For models 5, 15, 25,... a ' ' is replaced by a '.'. For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1. * 8 * Administrative tag * 9 * Administrative tag Description of the tags in the per restraint table below: * 1 * Restraint ID within restraint list. First node, FIRST member, first atom's: * 2 * Chain identifier (can be absent if none defined) * 3 * Residue number * 4 * Residue name * 5 * Name of (pseudo-)atom First node, SECOND member, first atom's: * 6 * Chain identifier (can be absent if none defined) * 7 * Residue number * 8 * Residue name * 9 * Name of (pseudo-)atom FIRST node's: * 10 * Target distance value (Angstrom) * 11 * Lower bound distance (Angstrom) * 12 * Upper bound distance (Angstrom) * 13 * Average distance in ensemble of models * 14 * Minimum distance in ensemble of models * 15 * Maximum distance in ensemble of models * 16 * Maximum violation (without any averaging) * 17 * Model number with the maximum violation * 18 * Number of models with a violation above cutoff * 19 * List of models with a violation above cutoff. See description above. * 20 * Administrative tag * 21 * Administrative tag ; loop_ _Distance_constraint_stats_per_res.Atom_entity_assembly_ID _Distance_constraint_stats_per_res.Atom_comp_index_ID _Distance_constraint_stats_per_res.Atom_comp_ID _Distance_constraint_stats_per_res.Total_violation _Distance_constraint_stats_per_res.Max_violation _Distance_constraint_stats_per_res.Max_violation_model_number _Distance_constraint_stats_per_res.Over_cutoff_viol_count _Distance_constraint_stats_per_res.Over_cutoff_viol_per_model 1 3 ASN 0.000 0.000 . 0 "[ . 1 . 2]" 1 4 LEU 0.035 0.008 4 0 "[ . 1 . 2]" 1 5 THR 0.013 0.009 4 0 "[ . 1 . 2]" 1 6 GLU 0.011 0.009 4 0 "[ . 1 . 2]" 1 7 GLU 0.674 0.137 13 0 "[ . 1 . 2]" 1 8 GLN 0.038 0.016 14 0 "[ . 1 . 2]" 1 9 ILE 0.017 0.004 15 0 "[ . 1 . 2]" 1 10 ALA 0.004 0.002 8 0 "[ . 1 . 2]" 1 11 GLU 0.005 0.003 8 0 "[ . 1 . 2]" 1 12 PHE 0.004 0.001 13 0 "[ . 1 . 2]" 1 13 LYS 0.005 0.002 8 0 "[ . 1 . 2]" 1 14 GLU 0.006 0.003 8 0 "[ . 1 . 2]" 1 15 ALA 0.017 0.004 1 0 "[ . 1 . 2]" 1 16 PHE 0.019 0.005 12 0 "[ . 1 . 2]" 1 17 ALA 0.006 0.003 1 0 "[ . 1 . 2]" 1 18 LEU 0.085 0.012 12 0 "[ . 1 . 2]" 1 19 PHE 0.188 0.113 8 0 "[ . 1 . 2]" 1 20 ASP 0.234 0.113 8 0 "[ . 1 . 2]" 1 21 LYS 0.746 0.114 11 0 "[ . 1 . 2]" 1 22 ASP 0.179 0.053 11 0 "[ . 1 . 2]" 1 23 ASN 0.004 0.004 18 0 "[ . 1 . 2]" 1 24 ASN 0.102 0.053 11 0 "[ . 1 . 2]" 1 25 GLY 0.000 0.000 . 0 "[ . 1 . 2]" 1 26 SER 0.085 0.040 11 0 "[ . 1 . 2]" 1 27 ILE 0.114 0.011 11 0 "[ . 1 . 2]" 1 28 SER 0.027 0.006 1 0 "[ . 1 . 2]" 1 29 SER 0.110 0.014 6 0 "[ . 1 . 2]" 1 30 SER 0.000 0.000 . 0 "[ . 1 . 2]" 1 31 GLU 0.045 0.007 1 0 "[ . 1 . 2]" 1 32 LEU 0.184 0.037 1 0 "[ . 1 . 2]" 1 33 ALA 0.067 0.019 1 0 "[ . 1 . 2]" 1 34 THR 0.067 0.018 4 0 "[ . 1 . 2]" 1 35 VAL 0.092 0.019 1 0 "[ . 1 . 2]" 1 36 MET 0.074 0.020 1 0 "[ . 1 . 2]" 1 37 ARG 0.051 0.011 4 0 "[ . 1 . 2]" 1 38 SER 0.039 0.019 1 0 "[ . 1 . 2]" 1 39 LEU 0.106 0.020 1 0 "[ . 1 . 2]" 1 40 GLY 0.018 0.011 4 0 "[ . 1 . 2]" 1 41 LEU 0.143 0.038 4 0 "[ . 1 . 2]" 1 42 SER 0.115 0.021 4 0 "[ . 1 . 2]" 1 43 PRO 0.316 0.047 4 0 "[ . 1 . 2]" 1 44 SER 0.247 0.041 10 0 "[ . 1 . 2]" 1 45 GLU 0.197 0.041 10 0 "[ . 1 . 2]" 1 46 ALA 0.136 0.028 10 0 "[ . 1 . 2]" 1 47 GLU 0.311 0.041 8 0 "[ . 1 . 2]" 1 48 VAL 0.354 0.047 4 0 "[ . 1 . 2]" 1 49 ASN 0.272 0.041 8 0 "[ . 1 . 2]" 1 50 ASP 0.167 0.016 10 0 "[ . 1 . 2]" 1 51 LEU 0.111 0.010 13 0 "[ . 1 . 2]" 1 52 MET 0.298 0.015 13 0 "[ . 1 . 2]" 1 53 ASN 0.993 0.072 13 0 "[ . 1 . 2]" 1 54 GLU 1.352 0.292 17 0 "[ . 1 . 2]" 1 55 ILE 0.804 0.292 17 0 "[ . 1 . 2]" 1 56 ASP 0.034 0.018 17 0 "[ . 1 . 2]" 1 57 VAL 0.000 0.000 . 0 "[ . 1 . 2]" 1 58 ASP 0.036 0.008 15 0 "[ . 1 . 2]" 1 59 GLY 0.000 0.000 . 0 "[ . 1 . 2]" 1 60 ASN 0.044 0.008 15 0 "[ . 1 . 2]" 1 61 HIS 0.062 0.024 11 0 "[ . 1 . 2]" 1 62 GLN 0.130 0.024 11 0 "[ . 1 . 2]" 1 63 ILE 0.061 0.013 8 0 "[ . 1 . 2]" 1 64 GLU 0.059 0.013 8 0 "[ . 1 . 2]" 1 65 PHE 0.025 0.005 4 0 "[ . 1 . 2]" 1 66 SER 0.007 0.003 10 0 "[ . 1 . 2]" 1 67 GLU 0.020 0.006 15 0 "[ . 1 . 2]" 1 68 PHE 0.037 0.020 4 0 "[ . 1 . 2]" 1 69 LEU 0.054 0.020 4 0 "[ . 1 . 2]" 1 70 ALA 0.079 0.065 4 0 "[ . 1 . 2]" 1 71 LEU 0.624 0.169 13 0 "[ . 1 . 2]" 1 72 MET 0.070 0.043 13 0 "[ . 1 . 2]" 1 73 SER 0.000 0.000 . 0 "[ . 1 . 2]" 1 74 ARG 0.062 0.036 2 0 "[ . 1 . 2]" 1 75 GLN 0.043 0.036 2 0 "[ . 1 . 2]" 1 77 LYS 0.049 0.020 7 0 "[ . 1 . 2]" 1 78 SER 0.022 0.009 8 0 "[ . 1 . 2]" 1 79 ASN 0.003 0.002 20 0 "[ . 1 . 2]" 1 80 ASP 0.007 0.003 11 0 "[ . 1 . 2]" 1 81 SER 0.004 0.003 11 0 "[ . 1 . 2]" 1 82 GLU 0.931 0.109 17 0 "[ . 1 . 2]" 1 83 GLN 0.913 0.143 15 0 "[ . 1 . 2]" 1 84 GLU 0.677 0.130 15 0 "[ . 1 . 2]" 1 85 LEU 0.154 0.043 5 0 "[ . 1 . 2]" 1 86 LEU 0.332 0.121 14 0 "[ . 1 . 2]" 1 87 GLU 0.148 0.121 14 0 "[ . 1 . 2]" 1 88 ALA 0.035 0.035 15 0 "[ . 1 . 2]" 1 89 PHE 0.030 0.010 14 0 "[ . 1 . 2]" 1 90 LYS 0.409 0.064 11 0 "[ . 1 . 2]" 1 91 VAL 0.190 0.041 1 0 "[ . 1 . 2]" 1 92 PHE 0.020 0.005 19 0 "[ . 1 . 2]" 1 93 ASP 0.073 0.024 6 0 "[ . 1 . 2]" 1 94 LYS 0.404 0.167 18 0 "[ . 1 . 2]" 1 95 ASN 0.053 0.008 15 0 "[ . 1 . 2]" 1 96 GLY 0.204 0.028 10 0 "[ . 1 . 2]" 1 97 ASP 0.265 0.075 18 0 "[ . 1 . 2]" 1 98 GLY 0.474 0.049 4 0 "[ . 1 . 2]" 1 99 LEU 0.310 0.049 4 0 "[ . 1 . 2]" 1 100 ILE 0.163 0.034 4 0 "[ . 1 . 2]" 1 101 SER 0.023 0.014 19 0 "[ . 1 . 2]" 1 102 ALA 0.058 0.028 16 0 "[ . 1 . 2]" 1 103 ALA 0.064 0.058 16 0 "[ . 1 . 2]" 1 104 GLU 0.027 0.007 9 0 "[ . 1 . 2]" 1 105 LEU 0.313 0.086 2 0 "[ . 1 . 2]" 1 106 LYS 0.475 0.163 16 0 "[ . 1 . 2]" 1 107 HIS 0.005 0.005 5 0 "[ . 1 . 2]" 1 108 VAL 0.036 0.023 10 0 "[ . 1 . 2]" 1 109 LEU 0.055 0.023 10 0 "[ . 1 . 2]" 1 110 THR 0.664 0.087 12 0 "[ . 1 . 2]" 1 111 SER 0.548 0.069 5 0 "[ . 1 . 2]" 1 112 ILE 2.896 0.143 5 0 "[ . 1 . 2]" 1 113 GLY 1.879 0.143 5 0 "[ . 1 . 2]" 1 114 GLU 0.420 0.166 3 0 "[ . 1 . 2]" 1 115 LYS 0.286 0.095 8 0 "[ . 1 . 2]" 1 116 LEU 0.765 0.213 18 0 "[ . 1 . 2]" 1 117 THR 0.767 0.311 20 0 "[ . 1 . 2]" 1 118 ASP 0.018 0.015 3 0 "[ . 1 . 2]" 1 119 ALA 0.110 0.040 3 0 "[ . 1 . 2]" 1 120 GLU 0.123 0.040 3 0 "[ . 1 . 2]" 1 121 LEU 0.418 0.056 14 0 "[ . 1 . 2]" 1 122 GLU 0.129 0.056 14 0 "[ . 1 . 2]" 1 123 HIS 0.000 0.000 . 0 "[ . 1 . 2]" stop_ loop_ _Distance_constraint_stats.Restraint_ID _Distance_constraint_stats.Atom_1_entity_assembly_ID _Distance_constraint_stats.Atom_1_comp_index_ID _Distance_constraint_stats.Atom_1_comp_ID _Distance_constraint_stats.Atom_1_ID _Distance_constraint_stats.Atom_2_entity_assembly_ID _Distance_constraint_stats.Atom_2_comp_index_ID _Distance_constraint_stats.Atom_2_comp_ID _Distance_constraint_stats.Atom_2_ID _Distance_constraint_stats.Node_1_distance_val _Distance_constraint_stats.Node_1_distance_lower_bound_val _Distance_constraint_stats.Node_1_distance_upper_bound_val _Distance_constraint_stats.Distance_average _Distance_constraint_stats.Distance_minimum _Distance_constraint_stats.Distance_maximum _Distance_constraint_stats.Max_violation _Distance_constraint_stats.Max_violation_model_number _Distance_constraint_stats.Over_cutoff_violation_count _Distance_constraint_stats.Over_cutoff_viol_per_model _Distance_constraint_stats.Distance_constraint_stats_ID 1 1 3 ASN HA 1 4 LEU H . . 2.770 2.493 2.254 2.763 . 0 0 "[ . 1 . 2]" 1 2 1 3 ASN QB 1 4 LEU H . . 3.820 2.713 2.000 3.494 . 0 0 "[ . 1 . 2]" 1 3 1 3 ASN HB2 1 4 LEU H . . 4.490 3.380 2.015 4.233 . 0 0 "[ . 1 . 2]" 1 4 1 3 ASN HB3 1 4 LEU H . . 4.490 3.167 2.081 4.363 . 0 0 "[ . 1 . 2]" 1 5 1 4 LEU H 1 4 LEU QB . . 2.710 2.439 2.339 2.544 . 0 0 "[ . 1 . 2]" 1 6 1 4 LEU H 1 4 LEU MD1 . . 3.880 3.100 1.812 3.640 . 0 0 "[ . 1 . 2]" 1 7 1 4 LEU H 1 4 LEU QD . . 3.200 2.870 1.809 3.197 . 0 0 "[ . 1 . 2]" 1 8 1 4 LEU H 1 4 LEU MD2 . . 3.880 3.648 3.399 3.888 0.008 4 0 "[ . 1 . 2]" 1 9 1 4 LEU H 1 5 THR H . . 4.640 4.582 4.500 4.639 . 0 0 "[ . 1 . 2]" 1 10 1 4 LEU HA 1 4 LEU MD1 . . 4.260 3.808 3.082 3.967 . 0 0 "[ . 1 . 2]" 1 11 1 4 LEU HA 1 4 LEU QD . . 2.930 2.395 2.087 2.936 0.006 4 0 "[ . 1 . 2]" 1 12 1 4 LEU HA 1 4 LEU MD2 . . 4.260 2.516 2.095 3.655 . 0 0 "[ . 1 . 2]" 1 13 1 4 LEU HA 1 5 THR H . . 2.810 2.282 2.185 2.614 . 0 0 "[ . 1 . 2]" 1 14 1 4 LEU QB 1 4 LEU QD . . 2.570 1.883 1.820 1.939 . 0 0 "[ . 1 . 2]" 1 15 1 4 LEU QB 1 5 THR H . . 3.490 2.960 2.166 3.278 . 0 0 "[ . 1 . 2]" 1 16 1 4 LEU QB 1 8 GLN HG3 . . 4.550 4.082 2.604 4.486 . 0 0 "[ . 1 . 2]" 1 17 1 4 LEU HB2 1 4 LEU MD1 . . 3.560 2.191 2.005 2.331 . 0 0 "[ . 1 . 2]" 1 18 1 4 LEU HB2 1 4 LEU MD2 . . 3.560 3.092 2.561 3.203 . 0 0 "[ . 1 . 2]" 1 19 1 4 LEU HB2 1 5 THR H . . 4.280 4.034 3.464 4.251 . 0 0 "[ . 1 . 2]" 1 20 1 4 LEU HB3 1 4 LEU MD1 . . 3.560 2.659 2.405 3.188 . 0 0 "[ . 1 . 2]" 1 21 1 4 LEU HB3 1 4 LEU MD2 . . 3.560 2.207 2.076 2.305 . 0 0 "[ . 1 . 2]" 1 22 1 4 LEU HB3 1 5 THR H . . 4.280 3.052 2.187 3.412 . 0 0 "[ . 1 . 2]" 1 23 1 4 LEU QD 1 5 THR H . . 3.830 3.593 3.363 3.723 . 0 0 "[ . 1 . 2]" 1 24 1 4 LEU QD 1 8 GLN HB2 . . 3.870 2.847 2.620 3.167 . 0 0 "[ . 1 . 2]" 1 25 1 4 LEU QD 1 8 GLN HB3 . . 3.950 2.582 1.962 2.943 . 0 0 "[ . 1 . 2]" 1 26 1 4 LEU QD 1 8 GLN QE . . 4.270 3.152 2.202 4.084 . 0 0 "[ . 1 . 2]" 1 27 1 4 LEU QD 1 8 GLN HG2 . . 4.470 4.351 4.032 4.473 0.003 5 0 "[ . 1 . 2]" 1 28 1 4 LEU QD 1 8 GLN HG3 . . 3.870 3.472 3.156 3.872 0.002 4 0 "[ . 1 . 2]" 1 29 1 4 LEU QD 1 12 PHE QE . . 3.460 1.904 1.762 2.253 . 0 0 "[ . 1 . 2]" 1 30 1 4 LEU QD 1 12 PHE HZ . . 3.590 2.360 1.786 3.522 . 0 0 "[ . 1 . 2]" 1 31 1 4 LEU QD 1 69 LEU QD . . 3.540 2.239 1.719 2.858 . 0 0 "[ . 1 . 2]" 1 32 1 4 LEU QD 1 70 ALA HA . . 4.050 3.956 3.748 4.051 0.001 4 0 "[ . 1 . 2]" 1 33 1 4 LEU QD 1 73 SER QB . . 5.060 2.532 1.771 3.782 . 0 0 "[ . 1 . 2]" 1 34 1 4 LEU QD 1 74 ARG H . . 5.440 5.207 4.660 5.440 0.000 14 0 "[ . 1 . 2]" 1 35 1 4 LEU MD1 1 12 PHE QE . . 3.980 3.173 1.985 3.981 0.001 4 0 "[ . 1 . 2]" 1 36 1 4 LEU MD2 1 12 PHE QE . . 3.980 1.965 1.775 2.448 . 0 0 "[ . 1 . 2]" 1 37 1 5 THR H 1 5 THR HB . . 3.910 3.737 3.609 3.780 . 0 0 "[ . 1 . 2]" 1 38 1 5 THR H 1 5 THR MG . . 3.080 2.419 2.119 2.713 . 0 0 "[ . 1 . 2]" 1 39 1 5 THR H 1 6 GLU H . . 4.580 4.472 4.391 4.589 0.009 4 0 "[ . 1 . 2]" 1 40 1 5 THR H 1 8 GLN H . . 3.580 3.109 2.815 3.472 . 0 0 "[ . 1 . 2]" 1 41 1 5 THR H 1 8 GLN HA . . 5.180 4.907 4.673 5.184 0.004 4 0 "[ . 1 . 2]" 1 42 1 5 THR H 1 8 GLN HB2 . . 3.320 2.332 1.958 2.708 . 0 0 "[ . 1 . 2]" 1 43 1 5 THR H 1 8 GLN HB3 . . 4.010 3.851 3.617 4.010 . 0 0 "[ . 1 . 2]" 1 44 1 5 THR H 1 8 GLN HG2 . . 5.140 3.562 2.902 4.593 . 0 0 "[ . 1 . 2]" 1 45 1 5 THR H 1 8 GLN HG3 . . 4.690 2.360 1.953 3.055 . 0 0 "[ . 1 . 2]" 1 46 1 5 THR HA 1 5 THR MG . . 3.150 2.575 2.443 2.647 . 0 0 "[ . 1 . 2]" 1 47 1 5 THR HA 1 6 GLU H . . 3.160 2.541 2.363 2.693 . 0 0 "[ . 1 . 2]" 1 48 1 5 THR HA 1 6 GLU QG . . 4.870 4.311 4.014 4.609 . 0 0 "[ . 1 . 2]" 1 49 1 5 THR HA 1 7 GLU H . . 4.670 4.389 3.910 4.670 . 0 0 "[ . 1 . 2]" 1 50 1 5 THR HB 1 6 GLU H . . 2.850 2.498 2.143 2.838 . 0 0 "[ . 1 . 2]" 1 51 1 5 THR HG1 1 7 GLU H . . 5.470 2.984 1.950 3.684 . 0 0 "[ . 1 . 2]" 1 52 1 5 THR HG1 1 8 GLN H . . 5.090 2.774 2.032 3.587 . 0 0 "[ . 1 . 2]" 1 53 1 5 THR MG 1 6 GLU H . . 4.180 3.989 3.743 4.151 . 0 0 "[ . 1 . 2]" 1 54 1 5 THR MG 1 7 GLU H . . 4.660 4.382 4.143 4.646 . 0 0 "[ . 1 . 2]" 1 55 1 5 THR MG 1 8 GLN H . . 4.720 4.111 3.788 4.378 . 0 0 "[ . 1 . 2]" 1 56 1 5 THR MG 1 8 GLN HB2 . . 4.570 4.267 3.711 4.452 . 0 0 "[ . 1 . 2]" 1 57 1 5 THR MG 1 8 GLN HB3 . . 5.480 5.357 4.936 5.476 . 0 0 "[ . 1 . 2]" 1 58 1 6 GLU H 1 6 GLU QB . . 3.030 2.434 2.327 2.637 . 0 0 "[ . 1 . 2]" 1 59 1 6 GLU H 1 6 GLU HG2 . . 3.700 2.128 1.964 2.318 . 0 0 "[ . 1 . 2]" 1 60 1 6 GLU H 1 6 GLU QG . . 3.230 2.098 1.918 2.282 . 0 0 "[ . 1 . 2]" 1 61 1 6 GLU H 1 6 GLU HG3 . . 3.700 3.296 2.416 3.650 . 0 0 "[ . 1 . 2]" 1 62 1 6 GLU H 1 7 GLU H . . 3.740 2.828 2.681 2.963 . 0 0 "[ . 1 . 2]" 1 63 1 6 GLU H 1 8 GLN H . . 5.000 4.704 4.452 4.982 . 0 0 "[ . 1 . 2]" 1 64 1 6 GLU H 1 9 ILE MD . . 4.880 3.680 3.133 4.044 . 0 0 "[ . 1 . 2]" 1 65 1 6 GLU HA 1 6 GLU HG2 . . 3.880 3.712 3.631 3.841 . 0 0 "[ . 1 . 2]" 1 66 1 6 GLU HA 1 6 GLU QG . . 3.390 3.328 3.300 3.333 . 0 0 "[ . 1 . 2]" 1 67 1 6 GLU HA 1 6 GLU HG3 . . 3.880 3.770 3.629 3.871 . 0 0 "[ . 1 . 2]" 1 68 1 6 GLU HA 1 9 ILE H . . 3.920 3.648 3.431 3.921 0.001 15 0 "[ . 1 . 2]" 1 69 1 6 GLU HA 1 9 ILE HB . . 2.830 2.577 2.345 2.741 . 0 0 "[ . 1 . 2]" 1 70 1 6 GLU HA 1 9 ILE MD . . 3.140 2.276 1.789 3.004 . 0 0 "[ . 1 . 2]" 1 71 1 6 GLU HA 1 9 ILE MG . . 4.200 3.795 3.532 3.983 . 0 0 "[ . 1 . 2]" 1 72 1 6 GLU HA 1 10 ALA H . . 4.370 4.011 3.457 4.319 . 0 0 "[ . 1 . 2]" 1 73 1 6 GLU QB 1 7 GLU H . . 3.700 3.499 3.304 3.701 0.001 4 0 "[ . 1 . 2]" 1 74 1 6 GLU QG 1 7 GLU H . . 3.400 2.065 1.827 2.302 . 0 0 "[ . 1 . 2]" 1 75 1 6 GLU HG2 1 7 GLU H . . 3.940 2.511 1.978 3.533 . 0 0 "[ . 1 . 2]" 1 76 1 6 GLU HG3 1 7 GLU H . . 3.940 2.297 2.086 2.756 . 0 0 "[ . 1 . 2]" 1 77 1 7 GLU H 1 7 GLU HB2 . . 3.000 2.511 2.415 2.672 . 0 0 "[ . 1 . 2]" 1 78 1 7 GLU H 1 7 GLU HB3 . . 3.640 3.552 3.542 3.575 . 0 0 "[ . 1 . 2]" 1 79 1 7 GLU H 1 7 GLU HG2 . . 3.970 2.822 2.198 3.606 . 0 0 "[ . 1 . 2]" 1 80 1 7 GLU H 1 7 GLU QG . . 3.410 2.156 1.939 2.382 . 0 0 "[ . 1 . 2]" 1 81 1 7 GLU H 1 7 GLU HG3 . . 3.970 2.500 1.970 3.720 . 0 0 "[ . 1 . 2]" 1 82 1 7 GLU H 1 8 GLN H . . 3.490 2.896 2.691 3.134 . 0 0 "[ . 1 . 2]" 1 83 1 7 GLU HA 1 7 GLU HG2 . . 3.480 2.591 2.234 3.498 0.018 14 0 "[ . 1 . 2]" 1 84 1 7 GLU HA 1 7 GLU QG . . 2.970 2.462 2.208 2.978 0.008 13 0 "[ . 1 . 2]" 1 85 1 7 GLU HA 1 7 GLU HG3 . . 3.480 3.323 2.555 3.617 0.137 13 0 "[ . 1 . 2]" 1 86 1 7 GLU HA 1 10 ALA H . . 3.940 3.567 3.163 3.939 . 0 0 "[ . 1 . 2]" 1 87 1 7 GLU HA 1 10 ALA MB . . 3.130 2.684 2.319 3.043 . 0 0 "[ . 1 . 2]" 1 88 1 7 GLU HB2 1 7 GLU QG . . 2.480 2.293 2.202 2.548 0.068 14 0 "[ . 1 . 2]" 1 89 1 7 GLU HB2 1 8 GLN H . . 3.350 2.310 1.975 2.476 . 0 0 "[ . 1 . 2]" 1 90 1 7 GLU HB3 1 7 GLU QG . . 2.670 2.436 2.180 2.564 . 0 0 "[ . 1 . 2]" 1 91 1 7 GLU HB3 1 8 GLN H . . 3.570 3.389 2.970 3.569 . 0 0 "[ . 1 . 2]" 1 92 1 7 GLU QG 1 8 GLN H . . 3.980 3.940 3.796 3.996 0.016 14 0 "[ . 1 . 2]" 1 93 1 7 GLU HG2 1 8 GLN H . . 4.820 4.664 4.278 4.813 . 0 0 "[ . 1 . 2]" 1 94 1 7 GLU HG3 1 8 GLN H . . 4.820 4.299 4.009 4.732 . 0 0 "[ . 1 . 2]" 1 95 1 8 GLN H 1 8 GLN HB2 . . 3.060 2.550 2.447 2.615 . 0 0 "[ . 1 . 2]" 1 96 1 8 GLN H 1 8 GLN HB3 . . 3.560 3.550 3.545 3.560 . 0 0 "[ . 1 . 2]" 1 97 1 8 GLN H 1 8 GLN HG2 . . 4.240 2.262 1.950 2.923 . 0 0 "[ . 1 . 2]" 1 98 1 8 GLN H 1 8 GLN HG3 . . 3.060 2.755 2.172 3.046 . 0 0 "[ . 1 . 2]" 1 99 1 8 GLN H 1 9 ILE H . . 3.480 2.898 2.729 3.084 . 0 0 "[ . 1 . 2]" 1 100 1 8 GLN H 1 9 ILE MD . . 5.130 4.992 4.644 5.130 . 0 0 "[ . 1 . 2]" 1 101 1 8 GLN H 1 10 ALA H . . 4.450 4.245 3.986 4.450 . 0 0 "[ . 1 . 2]" 1 102 1 8 GLN H 1 10 ALA MB . . 4.970 4.759 4.551 4.957 . 0 0 "[ . 1 . 2]" 1 103 1 8 GLN HA 1 8 GLN HG2 . . 3.270 2.536 2.238 2.704 . 0 0 "[ . 1 . 2]" 1 104 1 8 GLN HA 1 8 GLN HG3 . . 4.180 3.628 3.297 3.789 . 0 0 "[ . 1 . 2]" 1 105 1 8 GLN HA 1 11 GLU H . . 4.230 3.244 3.005 3.662 . 0 0 "[ . 1 . 2]" 1 106 1 8 GLN HA 1 11 GLU HG2 . . 4.510 3.634 2.789 4.465 . 0 0 "[ . 1 . 2]" 1 107 1 8 GLN HA 1 11 GLU QG . . 3.900 2.803 2.313 3.514 . 0 0 "[ . 1 . 2]" 1 108 1 8 GLN HA 1 11 GLU HG3 . . 4.510 3.007 2.372 3.888 . 0 0 "[ . 1 . 2]" 1 109 1 8 GLN HB2 1 9 ILE H . . 3.980 2.447 2.298 2.781 . 0 0 "[ . 1 . 2]" 1 110 1 8 GLN HB3 1 9 ILE H . . 3.760 3.551 3.296 3.760 0.000 8 0 "[ . 1 . 2]" 1 111 1 8 GLN HB3 1 12 PHE QE . . 4.400 2.523 2.011 3.264 . 0 0 "[ . 1 . 2]" 1 112 1 8 GLN HG3 1 9 ILE H . . 4.480 4.419 4.132 4.484 0.004 15 0 "[ . 1 . 2]" 1 113 1 9 ILE H 1 9 ILE HB . . 3.340 2.411 2.358 2.511 . 0 0 "[ . 1 . 2]" 1 114 1 9 ILE H 1 9 ILE MD . . 3.910 3.213 2.975 3.436 . 0 0 "[ . 1 . 2]" 1 115 1 9 ILE H 1 9 ILE HG12 . . 3.780 3.499 3.380 3.570 . 0 0 "[ . 1 . 2]" 1 116 1 9 ILE H 1 9 ILE HG13 . . 3.660 2.064 1.949 2.153 . 0 0 "[ . 1 . 2]" 1 117 1 9 ILE H 1 9 ILE MG . . 4.000 3.705 3.695 3.719 . 0 0 "[ . 1 . 2]" 1 118 1 9 ILE H 1 10 ALA H . . 3.450 2.858 2.593 3.066 . 0 0 "[ . 1 . 2]" 1 119 1 9 ILE H 1 10 ALA MB . . 4.610 4.373 4.172 4.529 . 0 0 "[ . 1 . 2]" 1 120 1 9 ILE H 1 11 GLU H . . 4.630 4.133 3.649 4.631 0.001 12 0 "[ . 1 . 2]" 1 121 1 9 ILE H 1 69 LEU QD . . 5.440 4.118 3.663 4.857 . 0 0 "[ . 1 . 2]" 1 122 1 9 ILE HA 1 9 ILE MD . . 4.100 3.842 3.796 3.906 . 0 0 "[ . 1 . 2]" 1 123 1 9 ILE HA 1 9 ILE HG12 . . 3.590 2.665 2.492 2.830 . 0 0 "[ . 1 . 2]" 1 124 1 9 ILE HA 1 9 ILE HG13 . . 4.120 2.710 2.601 2.855 . 0 0 "[ . 1 . 2]" 1 125 1 9 ILE HA 1 9 ILE MG . . 3.410 2.480 2.281 2.580 . 0 0 "[ . 1 . 2]" 1 126 1 9 ILE HA 1 11 GLU H . . 4.720 4.171 3.691 4.714 . 0 0 "[ . 1 . 2]" 1 127 1 9 ILE HA 1 12 PHE H . . 4.060 3.225 2.959 3.455 . 0 0 "[ . 1 . 2]" 1 128 1 9 ILE HA 1 12 PHE QD . . 4.290 2.026 1.998 2.259 . 0 0 "[ . 1 . 2]" 1 129 1 9 ILE HA 1 69 LEU MD1 . . 4.470 3.819 3.321 4.190 . 0 0 "[ . 1 . 2]" 1 130 1 9 ILE HA 1 69 LEU MD2 . . 4.470 2.725 2.137 3.560 . 0 0 "[ . 1 . 2]" 1 131 1 9 ILE HB 1 9 ILE MD . . 3.220 2.144 1.998 2.315 . 0 0 "[ . 1 . 2]" 1 132 1 9 ILE HB 1 10 ALA H . . 3.180 2.679 2.460 2.946 . 0 0 "[ . 1 . 2]" 1 133 1 9 ILE MD 1 9 ILE MG . . 2.980 2.244 1.932 2.486 . 0 0 "[ . 1 . 2]" 1 134 1 9 ILE MD 1 10 ALA H . . 4.540 4.391 4.222 4.540 . 0 0 "[ . 1 . 2]" 1 135 1 9 ILE MD 1 65 PHE QE . . 4.580 4.183 3.235 4.573 . 0 0 "[ . 1 . 2]" 1 136 1 9 ILE MD 1 69 LEU MD1 . . 5.210 5.083 4.482 5.212 0.002 15 0 "[ . 1 . 2]" 1 137 1 9 ILE MD 1 69 LEU QD . . 4.140 3.288 3.033 3.543 . 0 0 "[ . 1 . 2]" 1 138 1 9 ILE MD 1 69 LEU MD2 . . 5.210 3.331 3.084 3.607 . 0 0 "[ . 1 . 2]" 1 139 1 9 ILE HG12 1 9 ILE MG . . 2.400 2.269 2.129 2.400 0.000 2 0 "[ . 1 . 2]" 1 140 1 9 ILE HG12 1 69 LEU MD1 . . 5.070 4.094 3.522 4.271 . 0 0 "[ . 1 . 2]" 1 141 1 9 ILE HG12 1 69 LEU MD2 . . 5.070 2.137 1.863 2.441 . 0 0 "[ . 1 . 2]" 1 142 1 9 ILE HG13 1 9 ILE MG . . 3.480 3.207 3.160 3.237 . 0 0 "[ . 1 . 2]" 1 143 1 9 ILE HG13 1 10 ALA H . . 4.510 4.418 4.203 4.509 . 0 0 "[ . 1 . 2]" 1 144 1 9 ILE HG13 1 69 LEU MD1 . . 5.340 5.102 4.586 5.333 . 0 0 "[ . 1 . 2]" 1 145 1 9 ILE HG13 1 69 LEU QD . . 4.650 2.955 2.441 3.459 . 0 0 "[ . 1 . 2]" 1 146 1 9 ILE HG13 1 69 LEU MD2 . . 5.340 2.975 2.449 3.506 . 0 0 "[ . 1 . 2]" 1 147 1 9 ILE MG 1 10 ALA H . . 3.780 3.358 2.874 3.665 . 0 0 "[ . 1 . 2]" 1 148 1 9 ILE MG 1 10 ALA HA . . 4.090 3.447 3.043 3.757 . 0 0 "[ . 1 . 2]" 1 149 1 9 ILE MG 1 11 GLU H . . 5.200 4.835 4.462 5.100 . 0 0 "[ . 1 . 2]" 1 150 1 9 ILE MG 1 12 PHE H . . 4.760 4.492 4.003 4.760 . 17 0 "[ . 1 . 2]" 1 151 1 9 ILE MG 1 12 PHE HB2 . . 5.060 3.523 2.920 3.864 . 0 0 "[ . 1 . 2]" 1 152 1 9 ILE MG 1 12 PHE HB3 . . 5.010 4.698 3.945 5.011 0.001 13 0 "[ . 1 . 2]" 1 153 1 9 ILE MG 1 12 PHE QD . . 4.150 3.808 3.269 4.151 0.001 12 0 "[ . 1 . 2]" 1 154 1 9 ILE MG 1 13 LYS H . . 4.760 3.889 3.423 4.258 . 0 0 "[ . 1 . 2]" 1 155 1 9 ILE MG 1 13 LYS QE . . 3.550 2.637 1.874 3.549 . 0 0 "[ . 1 . 2]" 1 156 1 9 ILE MG 1 65 PHE QD . . 4.790 3.969 3.004 4.743 . 0 0 "[ . 1 . 2]" 1 157 1 9 ILE MG 1 65 PHE QE . . 3.610 2.242 1.858 2.932 . 0 0 "[ . 1 . 2]" 1 158 1 9 ILE MG 1 65 PHE HZ . . 3.700 2.032 1.807 2.856 . 0 0 "[ . 1 . 2]" 1 159 1 9 ILE MG 1 69 LEU MD1 . . 4.030 3.766 3.085 4.031 0.001 10 0 "[ . 1 . 2]" 1 160 1 9 ILE MG 1 69 LEU QD . . 3.430 2.777 2.049 3.365 . 0 0 "[ . 1 . 2]" 1 161 1 9 ILE MG 1 69 LEU MD2 . . 4.030 2.874 2.080 3.649 . 0 0 "[ . 1 . 2]" 1 162 1 10 ALA H 1 10 ALA MB . . 2.880 2.046 1.931 2.165 . 0 0 "[ . 1 . 2]" 1 163 1 10 ALA H 1 11 GLU H . . 3.290 2.726 2.488 3.124 . 0 0 "[ . 1 . 2]" 1 164 1 10 ALA H 1 12 PHE H . . 4.750 4.273 3.968 4.562 . 0 0 "[ . 1 . 2]" 1 165 1 10 ALA H 1 13 LYS H . . 5.030 4.753 4.567 4.864 . 0 0 "[ . 1 . 2]" 1 166 1 10 ALA H 1 13 LYS QE . . 4.950 4.406 3.081 4.950 0.000 11 0 "[ . 1 . 2]" 1 167 1 10 ALA HA 1 12 PHE H . . 4.860 4.591 4.022 4.861 0.001 12 0 "[ . 1 . 2]" 1 168 1 10 ALA HA 1 13 LYS H . . 3.860 3.491 3.034 3.644 . 0 0 "[ . 1 . 2]" 1 169 1 10 ALA HA 1 13 LYS HB2 . . 3.330 2.761 2.371 3.094 . 0 0 "[ . 1 . 2]" 1 170 1 10 ALA HA 1 13 LYS HB3 . . 4.440 4.194 3.519 4.440 . 0 0 "[ . 1 . 2]" 1 171 1 10 ALA HA 1 13 LYS QD . . 3.550 2.859 1.980 3.552 0.002 8 0 "[ . 1 . 2]" 1 172 1 10 ALA MB 1 11 GLU H . . 3.240 2.725 2.312 3.049 . 0 0 "[ . 1 . 2]" 1 173 1 10 ALA MB 1 12 PHE H . . 5.000 4.677 4.372 4.990 . 0 0 "[ . 1 . 2]" 1 174 1 10 ALA MB 1 13 LYS H . . 4.720 4.612 4.309 4.721 0.001 6 0 "[ . 1 . 2]" 1 175 1 11 GLU H 1 11 GLU HB2 . . 3.690 2.394 2.166 2.636 . 0 0 "[ . 1 . 2]" 1 176 1 11 GLU H 1 11 GLU QB . . 2.930 2.357 2.145 2.568 . 0 0 "[ . 1 . 2]" 1 177 1 11 GLU H 1 11 GLU HB3 . . 3.690 3.542 3.455 3.595 . 0 0 "[ . 1 . 2]" 1 178 1 11 GLU H 1 11 GLU HG2 . . 3.860 2.568 2.079 3.674 . 0 0 "[ . 1 . 2]" 1 179 1 11 GLU H 1 11 GLU QG . . 3.200 2.326 1.970 2.890 . 0 0 "[ . 1 . 2]" 1 180 1 11 GLU H 1 11 GLU HG3 . . 3.860 3.242 2.029 3.855 . 0 0 "[ . 1 . 2]" 1 181 1 11 GLU H 1 12 PHE H . . 3.340 2.624 2.332 2.924 . 0 0 "[ . 1 . 2]" 1 182 1 11 GLU H 1 12 PHE HB2 . . 4.800 4.555 4.121 4.799 . 0 0 "[ . 1 . 2]" 1 183 1 11 GLU H 1 13 LYS H . . 4.410 3.950 3.570 4.263 . 0 0 "[ . 1 . 2]" 1 184 1 11 GLU HA 1 11 GLU HG2 . . 3.770 2.689 2.141 3.194 . 0 0 "[ . 1 . 2]" 1 185 1 11 GLU HA 1 11 GLU QG . . 3.160 2.608 2.109 3.008 . 0 0 "[ . 1 . 2]" 1 186 1 11 GLU HA 1 11 GLU HG3 . . 3.770 3.584 2.769 3.770 . 0 0 "[ . 1 . 2]" 1 187 1 11 GLU HA 1 13 LYS H . . 5.020 4.179 3.696 4.499 . 0 0 "[ . 1 . 2]" 1 188 1 11 GLU HA 1 14 GLU H . . 4.020 3.751 3.371 4.023 0.003 8 0 "[ . 1 . 2]" 1 189 1 11 GLU QB 1 11 GLU QG . . 2.370 2.066 2.015 2.127 . 0 0 "[ . 1 . 2]" 1 190 1 11 GLU QB 1 12 PHE H . . 3.410 2.572 2.346 2.900 . 0 0 "[ . 1 . 2]" 1 191 1 11 GLU QB 1 13 LYS H . . 4.940 4.586 4.242 4.768 . 0 0 "[ . 1 . 2]" 1 192 1 11 GLU QB 1 102 ALA MB . . 3.830 1.988 1.608 3.025 . 0 0 "[ . 1 . 2]" 1 193 1 11 GLU HB2 1 12 PHE H . . 3.900 2.641 2.384 2.991 . 0 0 "[ . 1 . 2]" 1 194 1 11 GLU HB2 1 102 ALA MB . . 4.430 2.251 1.771 3.529 . 0 0 "[ . 1 . 2]" 1 195 1 11 GLU HB3 1 12 PHE H . . 3.900 3.589 3.171 3.899 . 0 0 "[ . 1 . 2]" 1 196 1 11 GLU HB3 1 102 ALA MB . . 4.430 2.278 1.779 3.291 . 0 0 "[ . 1 . 2]" 1 197 1 11 GLU QG 1 12 PHE H . . 4.480 4.107 3.800 4.396 . 0 0 "[ . 1 . 2]" 1 198 1 11 GLU HG2 1 12 PHE H . . 5.210 4.547 4.251 5.089 . 0 0 "[ . 1 . 2]" 1 199 1 11 GLU HG3 1 12 PHE H . . 5.210 4.773 4.015 5.195 . 0 0 "[ . 1 . 2]" 1 200 1 12 PHE H 1 12 PHE HB2 . . 3.510 2.316 2.027 2.554 . 0 0 "[ . 1 . 2]" 1 201 1 12 PHE H 1 12 PHE HB3 . . 3.800 3.447 3.365 3.474 . 0 0 "[ . 1 . 2]" 1 202 1 12 PHE H 1 12 PHE QD . . 4.050 2.864 2.067 3.098 . 0 0 "[ . 1 . 2]" 1 203 1 12 PHE H 1 13 LYS H . . 3.650 2.687 2.406 2.918 . 0 0 "[ . 1 . 2]" 1 204 1 12 PHE H 1 69 LEU QD . . 5.420 4.249 3.754 4.808 . 0 0 "[ . 1 . 2]" 1 205 1 12 PHE H 1 102 ALA MB . . 4.370 3.153 2.513 4.371 0.001 15 0 "[ . 1 . 2]" 1 206 1 12 PHE HA 1 12 PHE QD . . 3.980 2.201 1.995 3.017 . 0 0 "[ . 1 . 2]" 1 207 1 12 PHE HA 1 15 ALA H . . 4.140 3.252 3.020 3.600 . 0 0 "[ . 1 . 2]" 1 208 1 12 PHE HA 1 15 ALA MB . . 3.940 2.301 1.959 2.663 . 0 0 "[ . 1 . 2]" 1 209 1 12 PHE HB2 1 13 LYS H . . 4.520 2.718 2.409 3.207 . 0 0 "[ . 1 . 2]" 1 210 1 12 PHE HB2 1 69 LEU QD . . 4.420 2.672 2.149 3.131 . 0 0 "[ . 1 . 2]" 1 211 1 12 PHE HB3 1 13 LYS H . . 4.600 3.698 3.332 3.979 . 0 0 "[ . 1 . 2]" 1 212 1 12 PHE HB3 1 69 LEU MD1 . . 4.920 2.237 1.935 2.704 . 0 0 "[ . 1 . 2]" 1 213 1 12 PHE HB3 1 69 LEU QD . . 4.080 2.218 1.929 2.685 . 0 0 "[ . 1 . 2]" 1 214 1 12 PHE HB3 1 69 LEU MD2 . . 4.920 3.853 2.752 4.589 . 0 0 "[ . 1 . 2]" 1 215 1 12 PHE QD 1 13 LYS H . . 4.840 4.422 4.171 4.724 . 0 0 "[ . 1 . 2]" 1 216 1 12 PHE QE 1 69 LEU MD1 . . 4.330 3.977 3.198 4.320 . 0 0 "[ . 1 . 2]" 1 217 1 12 PHE QE 1 69 LEU QD . . 3.780 2.750 1.969 3.625 . 0 0 "[ . 1 . 2]" 1 218 1 12 PHE QE 1 69 LEU MD2 . . 4.330 2.847 1.978 3.894 . 0 0 "[ . 1 . 2]" 1 219 1 12 PHE QE 1 102 ALA HA . . 4.600 2.208 1.998 3.623 . 0 0 "[ . 1 . 2]" 1 220 1 13 LYS H 1 13 LYS HB2 . . 3.610 2.229 2.142 2.383 . 0 0 "[ . 1 . 2]" 1 221 1 13 LYS H 1 13 LYS HB3 . . 3.780 3.452 2.829 3.540 . 0 0 "[ . 1 . 2]" 1 222 1 13 LYS H 1 13 LYS QD . . 4.990 3.875 2.028 4.379 . 0 0 "[ . 1 . 2]" 1 223 1 13 LYS H 1 13 LYS QG . . 4.060 2.656 2.237 3.849 . 0 0 "[ . 1 . 2]" 1 224 1 13 LYS H 1 14 GLU H . . 3.480 2.794 2.626 3.207 . 0 0 "[ . 1 . 2]" 1 225 1 13 LYS H 1 65 PHE HZ . . 4.620 3.464 2.330 4.598 . 0 0 "[ . 1 . 2]" 1 226 1 13 LYS HA 1 13 LYS HD2 . . 4.660 4.363 3.768 4.606 . 0 0 "[ . 1 . 2]" 1 227 1 13 LYS HA 1 13 LYS QD . . 4.090 3.786 3.034 3.978 . 0 0 "[ . 1 . 2]" 1 228 1 13 LYS HA 1 13 LYS HD3 . . 4.660 4.189 3.199 4.560 . 0 0 "[ . 1 . 2]" 1 229 1 13 LYS HA 1 13 LYS HG2 . . 4.040 2.411 2.057 3.383 . 0 0 "[ . 1 . 2]" 1 230 1 13 LYS HA 1 13 LYS QG . . 3.550 2.150 2.025 2.276 . 0 0 "[ . 1 . 2]" 1 231 1 13 LYS HA 1 13 LYS HG3 . . 4.040 2.712 2.058 3.220 . 0 0 "[ . 1 . 2]" 1 232 1 13 LYS HA 1 16 PHE H . . 4.400 4.108 3.874 4.399 . 0 0 "[ . 1 . 2]" 1 233 1 13 LYS HA 1 16 PHE HB2 . . 3.950 3.687 3.173 3.951 0.001 7 0 "[ . 1 . 2]" 1 234 1 13 LYS HA 1 16 PHE QB . . 3.460 3.109 2.852 3.457 . 0 0 "[ . 1 . 2]" 1 235 1 13 LYS HA 1 16 PHE HB3 . . 3.950 3.417 2.934 3.874 . 0 0 "[ . 1 . 2]" 1 236 1 13 LYS HA 1 17 ALA H . . 5.020 4.506 3.998 4.950 . 0 0 "[ . 1 . 2]" 1 237 1 13 LYS HA 1 65 PHE QD . . 4.790 4.203 3.639 4.615 . 0 0 "[ . 1 . 2]" 1 238 1 13 LYS HA 1 65 PHE QE . . 3.620 2.452 2.000 3.198 . 0 0 "[ . 1 . 2]" 1 239 1 13 LYS HA 1 65 PHE HZ . . 4.550 3.595 2.411 4.299 . 0 0 "[ . 1 . 2]" 1 240 1 13 LYS HB2 1 14 GLU H . . 3.440 3.139 2.381 3.438 . 0 0 "[ . 1 . 2]" 1 241 1 13 LYS HB3 1 13 LYS QD . . 3.690 2.577 2.168 3.429 . 0 0 "[ . 1 . 2]" 1 242 1 13 LYS HB3 1 14 GLU H . . 3.940 3.640 2.213 3.942 0.002 15 0 "[ . 1 . 2]" 1 243 1 13 LYS HB3 1 14 GLU HA . . 5.190 4.312 3.995 4.463 . 0 0 "[ . 1 . 2]" 1 244 1 13 LYS QE 1 13 LYS QG . . 3.490 2.379 2.072 2.921 . 0 0 "[ . 1 . 2]" 1 245 1 13 LYS QE 1 65 PHE QE . . 5.200 3.852 2.128 5.193 . 0 0 "[ . 1 . 2]" 1 246 1 14 GLU H 1 14 GLU HB2 . . 3.820 2.751 2.590 2.812 . 0 0 "[ . 1 . 2]" 1 247 1 14 GLU H 1 14 GLU QB . . 3.140 2.670 2.538 2.719 . 0 0 "[ . 1 . 2]" 1 248 1 14 GLU H 1 14 GLU HB3 . . 3.820 3.613 3.522 3.637 . 0 0 "[ . 1 . 2]" 1 249 1 14 GLU H 1 14 GLU HG2 . . 3.390 2.607 2.298 2.792 . 0 0 "[ . 1 . 2]" 1 250 1 14 GLU H 1 14 GLU HG3 . . 3.630 2.224 2.024 2.757 . 0 0 "[ . 1 . 2]" 1 251 1 14 GLU HA 1 14 GLU HG2 . . 3.050 2.635 2.512 2.705 . 0 0 "[ . 1 . 2]" 1 252 1 14 GLU HA 1 14 GLU HG3 . . 3.770 3.606 3.562 3.685 . 0 0 "[ . 1 . 2]" 1 253 1 14 GLU HA 1 16 PHE H . . 4.950 3.920 3.685 4.744 . 0 0 "[ . 1 . 2]" 1 254 1 14 GLU HA 1 18 LEU H . . 4.770 4.132 3.883 4.491 . 0 0 "[ . 1 . 2]" 1 255 1 14 GLU QB 1 15 ALA H . . 3.270 2.204 2.063 2.383 . 0 0 "[ . 1 . 2]" 1 256 1 14 GLU HB2 1 15 ALA H . . 3.770 2.223 2.078 2.409 . 0 0 "[ . 1 . 2]" 1 257 1 14 GLU HB3 1 15 ALA H . . 3.770 3.628 3.386 3.770 . 17 0 "[ . 1 . 2]" 1 258 1 14 GLU HG2 1 15 ALA H . . 4.450 4.381 4.266 4.452 0.002 12 0 "[ . 1 . 2]" 1 259 1 14 GLU HG3 1 15 ALA H . . 4.010 3.619 3.446 3.967 . 0 0 "[ . 1 . 2]" 1 260 1 15 ALA H 1 15 ALA MB . . 3.190 2.041 1.955 2.173 . 0 0 "[ . 1 . 2]" 1 261 1 15 ALA H 1 16 PHE H . . 3.710 2.902 2.829 3.050 . 0 0 "[ . 1 . 2]" 1 262 1 15 ALA H 1 16 PHE HA . . 5.500 5.398 5.342 5.502 0.002 7 0 "[ . 1 . 2]" 1 263 1 15 ALA H 1 18 LEU QD . . 4.730 3.333 3.148 3.529 . 0 0 "[ . 1 . 2]" 1 264 1 15 ALA H 1 102 ALA MB . . 5.310 4.812 3.793 5.312 0.002 2 0 "[ . 1 . 2]" 1 265 1 15 ALA H 1 106 LYS HE2 . . 5.500 4.631 3.044 5.500 0.000 8 0 "[ . 1 . 2]" 1 266 1 15 ALA H 1 106 LYS HE3 . . 5.500 4.679 2.866 5.502 0.002 13 0 "[ . 1 . 2]" 1 267 1 15 ALA HA 1 18 LEU QD . . 3.440 2.116 1.829 2.505 . 0 0 "[ . 1 . 2]" 1 268 1 15 ALA MB 1 16 PHE H . . 4.250 2.817 2.435 2.942 . 0 0 "[ . 1 . 2]" 1 269 1 15 ALA MB 1 16 PHE HA . . 4.780 3.835 3.682 3.923 . 0 0 "[ . 1 . 2]" 1 270 1 15 ALA MB 1 16 PHE QB . . 4.710 3.813 3.703 3.946 . 0 0 "[ . 1 . 2]" 1 271 1 15 ALA MB 1 18 LEU HB2 . . 4.340 4.029 3.613 4.344 0.004 1 0 "[ . 1 . 2]" 1 272 1 15 ALA MB 1 19 PHE QE . . 4.510 4.119 3.460 4.469 . 0 0 "[ . 1 . 2]" 1 273 1 15 ALA MB 1 68 PHE HZ . . 4.610 3.840 2.287 4.610 0.000 4 0 "[ . 1 . 2]" 1 274 1 15 ALA MB 1 102 ALA MB . . 4.090 3.424 2.554 4.017 . 0 0 "[ . 1 . 2]" 1 275 1 15 ALA MB 1 105 LEU QB . . 5.040 3.249 2.296 4.714 . 0 0 "[ . 1 . 2]" 1 276 1 15 ALA MB 1 105 LEU MD1 . . 4.290 3.430 1.695 4.283 . 0 0 "[ . 1 . 2]" 1 277 1 15 ALA MB 1 105 LEU QD . . 3.740 2.454 1.692 3.086 . 0 0 "[ . 1 . 2]" 1 278 1 15 ALA MB 1 105 LEU MD2 . . 4.290 2.906 1.783 4.292 0.002 15 0 "[ . 1 . 2]" 1 279 1 15 ALA MB 1 106 LYS QG . . 4.120 3.003 2.232 4.035 . 0 0 "[ . 1 . 2]" 1 280 1 15 ALA MB 1 109 LEU MD1 . . 4.020 3.668 2.348 4.024 0.004 14 0 "[ . 1 . 2]" 1 281 1 16 PHE H 1 16 PHE HB2 . . 4.070 2.210 2.042 2.536 . 0 0 "[ . 1 . 2]" 1 282 1 16 PHE H 1 16 PHE QB . . 3.520 2.058 1.986 2.123 . 0 0 "[ . 1 . 2]" 1 283 1 16 PHE H 1 16 PHE HB3 . . 4.070 2.547 2.228 2.715 . 0 0 "[ . 1 . 2]" 1 284 1 16 PHE H 1 17 ALA H . . 3.860 2.628 2.407 2.839 . 0 0 "[ . 1 . 2]" 1 285 1 16 PHE H 1 17 ALA MB . . 5.380 4.164 4.030 4.402 . 0 0 "[ . 1 . 2]" 1 286 1 16 PHE H 1 18 LEU H . . 5.340 3.803 3.591 4.074 . 0 0 "[ . 1 . 2]" 1 287 1 16 PHE HA 1 16 PHE QD . . 4.430 3.019 2.332 3.268 . 0 0 "[ . 1 . 2]" 1 288 1 16 PHE HA 1 17 ALA HA . . 4.890 4.802 4.690 4.893 0.003 1 0 "[ . 1 . 2]" 1 289 1 16 PHE HA 1 18 LEU H . . 4.290 4.063 3.747 4.295 0.005 12 0 "[ . 1 . 2]" 1 290 1 16 PHE HA 1 19 PHE H . . 4.390 3.475 3.104 3.661 . 0 0 "[ . 1 . 2]" 1 291 1 16 PHE HA 1 19 PHE QD . . 4.240 3.439 2.610 3.855 . 0 0 "[ . 1 . 2]" 1 292 1 16 PHE HA 1 20 ASP H . . 5.130 4.251 3.885 4.483 . 0 0 "[ . 1 . 2]" 1 293 1 16 PHE HA 1 27 ILE MD . . 4.530 3.318 2.718 3.755 . 0 0 "[ . 1 . 2]" 1 294 1 16 PHE HA 1 68 PHE HZ . . 4.600 3.860 3.103 4.590 . 0 0 "[ . 1 . 2]" 1 295 1 16 PHE HA 1 105 LEU QD . . 5.200 4.526 3.701 5.166 . 0 0 "[ . 1 . 2]" 1 296 1 16 PHE QB 1 17 ALA H . . 3.490 2.281 1.991 2.763 . 0 0 "[ . 1 . 2]" 1 297 1 16 PHE QB 1 18 LEU H . . 4.650 4.348 4.124 4.557 . 0 0 "[ . 1 . 2]" 1 298 1 16 PHE QB 1 65 PHE QD . . 4.350 3.848 3.018 4.350 0.000 18 0 "[ . 1 . 2]" 1 299 1 16 PHE HB2 1 17 ALA H . . 4.270 3.550 3.254 3.833 . 0 0 "[ . 1 . 2]" 1 300 1 16 PHE HB2 1 18 LEU H . . 5.500 5.329 5.085 5.502 0.002 5 0 "[ . 1 . 2]" 1 301 1 16 PHE HB2 1 65 PHE QD . . 5.030 4.215 3.157 4.933 . 0 0 "[ . 1 . 2]" 1 302 1 16 PHE HB2 1 65 PHE QE . . 4.990 3.951 2.739 4.705 . 0 0 "[ . 1 . 2]" 1 303 1 16 PHE HB3 1 17 ALA H . . 4.270 2.312 2.009 2.844 . 0 0 "[ . 1 . 2]" 1 304 1 16 PHE HB3 1 18 LEU H . . 5.500 4.610 4.361 4.880 . 0 0 "[ . 1 . 2]" 1 305 1 16 PHE HB3 1 65 PHE QD . . 5.030 4.515 3.691 5.030 0.000 11 0 "[ . 1 . 2]" 1 306 1 16 PHE HB3 1 65 PHE QE . . 4.990 4.300 2.614 4.990 0.000 15 0 "[ . 1 . 2]" 1 307 1 16 PHE QD 1 17 ALA HA . . 4.450 3.268 2.333 4.432 . 0 0 "[ . 1 . 2]" 1 308 1 16 PHE QD 1 27 ILE MD . . 4.740 3.017 2.675 3.250 . 0 0 "[ . 1 . 2]" 1 309 1 16 PHE QE 1 25 GLY H . . 5.010 3.415 2.375 4.104 . 0 0 "[ . 1 . 2]" 1 310 1 16 PHE QE 1 25 GLY QA . . 4.430 3.006 2.087 3.789 . 0 0 "[ . 1 . 2]" 1 311 1 16 PHE QE 1 26 SER HA . . 4.440 3.627 2.493 4.439 . 0 0 "[ . 1 . 2]" 1 312 1 16 PHE QE 1 27 ILE H . . 4.670 4.040 3.545 4.658 . 0 0 "[ . 1 . 2]" 1 313 1 16 PHE QE 1 27 ILE MD . . 4.000 2.593 2.007 3.010 . 0 0 "[ . 1 . 2]" 1 314 1 16 PHE QE 1 27 ILE MG . . 5.300 4.682 4.338 5.102 . 0 0 "[ . 1 . 2]" 1 315 1 16 PHE QE 1 63 ILE MG . . 3.910 2.978 2.378 3.492 . 0 0 "[ . 1 . 2]" 1 316 1 16 PHE QE 1 65 PHE H . . 5.000 4.050 3.231 4.859 . 0 0 "[ . 1 . 2]" 1 317 1 16 PHE QE 1 65 PHE HA . . 4.460 2.698 2.035 3.567 . 0 0 "[ . 1 . 2]" 1 318 1 16 PHE QE 1 68 PHE H . . 4.520 3.797 3.121 4.370 . 0 0 "[ . 1 . 2]" 1 319 1 16 PHE HZ 1 26 SER HA . . 3.730 2.893 2.010 3.414 . 0 0 "[ . 1 . 2]" 1 320 1 16 PHE HZ 1 27 ILE H . . 4.530 3.405 2.983 4.524 . 0 0 "[ . 1 . 2]" 1 321 1 16 PHE HZ 1 65 PHE H . . 4.600 4.172 3.144 4.601 0.001 2 0 "[ . 1 . 2]" 1 322 1 17 ALA H 1 17 ALA MB . . 3.030 2.077 1.931 2.161 . 0 0 "[ . 1 . 2]" 1 323 1 17 ALA H 1 18 LEU H . . 3.700 2.666 2.324 2.868 . 0 0 "[ . 1 . 2]" 1 324 1 17 ALA H 1 20 ASP HB3 . . 5.350 5.154 4.566 5.352 0.002 13 0 "[ . 1 . 2]" 1 325 1 17 ALA HA 1 20 ASP H . . 3.540 2.953 2.615 3.292 . 0 0 "[ . 1 . 2]" 1 326 1 17 ALA HA 1 20 ASP HB2 . . 4.860 2.635 2.087 3.659 . 0 0 "[ . 1 . 2]" 1 327 1 17 ALA HA 1 20 ASP HB3 . . 3.490 2.530 2.163 2.736 . 0 0 "[ . 1 . 2]" 1 328 1 17 ALA MB 1 18 LEU H . . 3.690 2.833 2.601 3.078 . 0 0 "[ . 1 . 2]" 1 329 1 17 ALA MB 1 18 LEU QD . . 4.150 2.732 2.532 3.035 . 0 0 "[ . 1 . 2]" 1 330 1 17 ALA MB 1 19 PHE H . . 4.810 4.453 4.306 4.608 . 0 0 "[ . 1 . 2]" 1 331 1 18 LEU H 1 18 LEU HB2 . . 3.690 2.184 2.110 2.365 . 0 0 "[ . 1 . 2]" 1 332 1 18 LEU H 1 18 LEU HB3 . . 3.520 3.463 3.422 3.523 0.003 1 0 "[ . 1 . 2]" 1 333 1 18 LEU H 1 18 LEU MD1 . . 3.940 2.109 1.897 2.775 . 0 0 "[ . 1 . 2]" 1 334 1 18 LEU H 1 18 LEU QD . . 3.430 2.055 1.877 2.180 . 0 0 "[ . 1 . 2]" 1 335 1 18 LEU H 1 18 LEU MD2 . . 3.940 3.677 1.909 3.941 0.001 4 0 "[ . 1 . 2]" 1 336 1 18 LEU H 1 18 LEU HG . . 3.900 3.890 3.834 3.912 0.012 12 0 "[ . 1 . 2]" 1 337 1 18 LEU H 1 19 PHE H . . 2.950 2.696 2.472 2.854 . 0 0 "[ . 1 . 2]" 1 338 1 18 LEU H 1 109 LEU MD1 . . 5.500 4.661 3.667 5.436 . 0 0 "[ . 1 . 2]" 1 339 1 18 LEU H 1 109 LEU MD2 . . 5.500 5.443 4.556 5.502 0.002 4 0 "[ . 1 . 2]" 1 340 1 18 LEU HA 1 18 LEU MD1 . . 3.840 2.310 1.894 2.561 . 0 0 "[ . 1 . 2]" 1 341 1 18 LEU HA 1 18 LEU QD . . 2.890 2.287 1.884 2.519 . 0 0 "[ . 1 . 2]" 1 342 1 18 LEU HA 1 18 LEU MD2 . . 3.840 3.759 3.381 3.834 . 0 0 "[ . 1 . 2]" 1 343 1 18 LEU HA 1 18 LEU HG . . 3.800 2.544 2.368 3.534 . 0 0 "[ . 1 . 2]" 1 344 1 18 LEU HB2 1 19 PHE H . . 4.420 3.045 2.800 3.162 . 0 0 "[ . 1 . 2]" 1 345 1 18 LEU HB2 1 109 LEU MD1 . . 4.790 2.836 1.920 3.592 . 0 0 "[ . 1 . 2]" 1 346 1 18 LEU HB2 1 109 LEU MD2 . . 5.160 3.759 2.509 3.946 . 0 0 "[ . 1 . 2]" 1 347 1 18 LEU HB3 1 19 PHE H . . 4.330 3.630 3.523 3.733 . 0 0 "[ . 1 . 2]" 1 348 1 18 LEU HB3 1 19 PHE QD . . 4.070 3.525 2.916 4.068 . 0 0 "[ . 1 . 2]" 1 349 1 18 LEU HB3 1 109 LEU MD1 . . 4.730 2.261 1.795 3.020 . 0 0 "[ . 1 . 2]" 1 350 1 18 LEU HB3 1 109 LEU MD2 . . 4.840 2.615 2.239 2.992 . 0 0 "[ . 1 . 2]" 1 351 1 18 LEU QD 1 19 PHE QD . . 4.410 4.043 3.830 4.379 . 0 0 "[ . 1 . 2]" 1 352 1 18 LEU QD 1 106 LYS H . . 5.440 5.351 4.949 5.443 0.003 14 0 "[ . 1 . 2]" 1 353 1 18 LEU QD 1 106 LYS HA . . 3.570 3.293 2.926 3.516 . 0 0 "[ . 1 . 2]" 1 354 1 18 LEU QD 1 109 LEU QB . . 3.590 3.415 3.006 3.592 0.002 12 0 "[ . 1 . 2]" 1 355 1 18 LEU MD1 1 19 PHE H . . 4.960 4.207 4.143 4.504 . 0 0 "[ . 1 . 2]" 1 356 1 18 LEU MD2 1 19 PHE H . . 4.960 4.845 3.804 4.962 0.002 2 0 "[ . 1 . 2]" 1 357 1 18 LEU HG 1 19 PHE H . . 5.350 5.279 5.209 5.355 0.005 10 0 "[ . 1 . 2]" 1 358 1 19 PHE H 1 19 PHE HB2 . . 3.750 2.125 2.037 2.260 . 0 0 "[ . 1 . 2]" 1 359 1 19 PHE H 1 19 PHE HB3 . . 3.750 3.428 3.369 3.517 . 0 0 "[ . 1 . 2]" 1 360 1 19 PHE H 1 19 PHE QD . . 3.390 2.508 2.165 3.010 . 0 0 "[ . 1 . 2]" 1 361 1 19 PHE H 1 20 ASP H . . 2.450 2.286 2.075 2.426 . 0 0 "[ . 1 . 2]" 1 362 1 19 PHE H 1 20 ASP HB2 . . 4.540 4.145 3.856 4.347 . 0 0 "[ . 1 . 2]" 1 363 1 19 PHE H 1 20 ASP HB3 . . 5.130 4.907 4.630 5.243 0.113 8 0 "[ . 1 . 2]" 1 364 1 19 PHE H 1 27 ILE MD . . 4.310 4.134 3.867 4.312 0.002 13 0 "[ . 1 . 2]" 1 365 1 19 PHE H 1 109 LEU MD1 . . 5.500 4.845 3.684 5.408 . 0 0 "[ . 1 . 2]" 1 366 1 19 PHE H 1 109 LEU MD2 . . 5.500 4.784 3.781 5.165 . 0 0 "[ . 1 . 2]" 1 367 1 19 PHE HA 1 19 PHE QD . . 4.070 3.024 2.711 3.148 . 0 0 "[ . 1 . 2]" 1 368 1 19 PHE HA 1 20 ASP H . . 3.630 3.582 3.407 3.639 0.009 10 0 "[ . 1 . 2]" 1 369 1 19 PHE HA 1 27 ILE MD . . 5.020 4.811 4.355 5.021 0.001 15 0 "[ . 1 . 2]" 1 370 1 19 PHE HA 1 35 VAL MG1 . . 4.060 3.229 2.005 4.022 . 0 0 "[ . 1 . 2]" 1 371 1 19 PHE HA 1 35 VAL QG . . 3.360 2.241 1.700 2.928 . 0 0 "[ . 1 . 2]" 1 372 1 19 PHE HA 1 35 VAL MG2 . . 4.060 2.302 1.803 3.055 . 0 0 "[ . 1 . 2]" 1 373 1 19 PHE QB 1 20 ASP H . . 3.220 2.578 2.248 3.178 . 0 0 "[ . 1 . 2]" 1 374 1 19 PHE QB 1 27 ILE MD . . 3.430 2.288 1.917 2.597 . 0 0 "[ . 1 . 2]" 1 375 1 19 PHE QB 1 27 ILE MG . . 3.810 2.757 2.299 3.261 . 0 0 "[ . 1 . 2]" 1 376 1 19 PHE HB2 1 20 ASP H . . 4.000 2.671 2.306 3.340 . 0 0 "[ . 1 . 2]" 1 377 1 19 PHE HB2 1 27 ILE MD . . 3.920 2.534 2.017 2.858 . 0 0 "[ . 1 . 2]" 1 378 1 19 PHE HB2 1 27 ILE MG . . 4.630 3.879 3.295 4.480 . 0 0 "[ . 1 . 2]" 1 379 1 19 PHE HB3 1 20 ASP H . . 4.000 3.412 3.023 4.004 0.004 1 0 "[ . 1 . 2]" 1 380 1 19 PHE HB3 1 27 ILE MD . . 3.920 2.663 2.086 2.983 . 0 0 "[ . 1 . 2]" 1 381 1 19 PHE HB3 1 27 ILE MG . . 4.630 2.824 2.330 3.354 . 0 0 "[ . 1 . 2]" 1 382 1 19 PHE QD 1 27 ILE MD . . 4.240 3.713 3.307 4.199 . 0 0 "[ . 1 . 2]" 1 383 1 19 PHE QD 1 27 ILE MG . . 4.900 3.721 2.794 4.080 . 0 0 "[ . 1 . 2]" 1 384 1 19 PHE QD 1 32 LEU QD . . 4.050 2.449 1.869 3.574 . 0 0 "[ . 1 . 2]" 1 385 1 19 PHE QD 1 35 VAL MG1 . . 4.100 2.985 1.885 3.735 . 0 0 "[ . 1 . 2]" 1 386 1 19 PHE QD 1 35 VAL MG2 . . 4.100 2.687 1.903 3.505 . 0 0 "[ . 1 . 2]" 1 387 1 19 PHE QD 1 109 LEU MD1 . . 4.910 3.643 2.331 4.346 . 0 0 "[ . 1 . 2]" 1 388 1 19 PHE QE 1 32 LEU QD . . 4.340 2.913 2.068 3.948 . 0 0 "[ . 1 . 2]" 1 389 1 19 PHE QE 1 35 VAL MG1 . . 4.390 2.710 2.169 3.210 . 0 0 "[ . 1 . 2]" 1 390 1 19 PHE QE 1 35 VAL QG . . 3.310 2.646 2.164 3.069 . 0 0 "[ . 1 . 2]" 1 391 1 19 PHE QE 1 35 VAL MG2 . . 4.390 3.952 3.288 4.394 0.004 12 0 "[ . 1 . 2]" 1 392 1 19 PHE QE 1 36 MET ME . . 4.730 4.137 3.001 4.731 0.001 11 0 "[ . 1 . 2]" 1 393 1 19 PHE QE 1 109 LEU MD1 . . 3.540 2.827 1.859 3.541 0.001 12 0 "[ . 1 . 2]" 1 394 1 19 PHE QE 1 109 LEU MD2 . . 4.040 2.955 1.904 3.792 . 0 0 "[ . 1 . 2]" 1 395 1 19 PHE HZ 1 35 VAL QG . . 4.170 3.611 2.862 4.025 . 0 0 "[ . 1 . 2]" 1 396 1 19 PHE HZ 1 36 MET ME . . 5.500 5.020 4.099 5.502 0.002 4 0 "[ . 1 . 2]" 1 397 1 19 PHE HZ 1 39 LEU MD1 . . 4.850 4.105 3.265 4.481 . 0 0 "[ . 1 . 2]" 1 398 1 19 PHE HZ 1 39 LEU QD . . 3.990 3.805 3.206 3.991 0.001 17 0 "[ . 1 . 2]" 1 399 1 19 PHE HZ 1 39 LEU MD2 . . 4.850 4.577 3.841 4.849 . 0 0 "[ . 1 . 2]" 1 400 1 19 PHE HZ 1 109 LEU H . . 5.500 5.325 4.526 5.504 0.004 1 0 "[ . 1 . 2]" 1 401 1 19 PHE HZ 1 109 LEU MD1 . . 4.640 4.232 2.349 4.641 0.001 11 0 "[ . 1 . 2]" 1 402 1 19 PHE HZ 1 109 LEU MD2 . . 4.190 3.208 2.163 4.192 0.002 6 0 "[ . 1 . 2]" 1 403 1 19 PHE HZ 1 109 LEU HG . . 4.640 3.652 2.828 4.072 . 0 0 "[ . 1 . 2]" 1 404 1 20 ASP H 1 20 ASP HB2 . . 3.700 2.163 2.049 2.635 . 0 0 "[ . 1 . 2]" 1 405 1 20 ASP H 1 20 ASP HB3 . . 3.420 2.925 2.708 3.244 . 0 0 "[ . 1 . 2]" 1 406 1 20 ASP H 1 27 ILE MD . . 4.600 3.523 2.805 4.385 . 0 0 "[ . 1 . 2]" 1 407 1 20 ASP HA 1 21 LYS H . . 3.050 2.296 2.252 2.359 . 0 0 "[ . 1 . 2]" 1 408 1 20 ASP HA 1 21 LYS QB . . 4.860 4.589 4.559 4.614 . 0 0 "[ . 1 . 2]" 1 409 1 20 ASP HA 1 22 ASP H . . 4.600 4.556 4.310 4.613 0.013 18 0 "[ . 1 . 2]" 1 410 1 20 ASP HA 1 27 ILE MD . . 4.750 3.953 3.415 4.761 0.011 11 0 "[ . 1 . 2]" 1 411 1 20 ASP HB3 1 21 LYS H . . 4.320 3.824 3.608 4.306 . 0 0 "[ . 1 . 2]" 1 412 1 20 ASP HB3 1 21 LYS HA . . 4.900 4.676 4.625 4.848 . 0 0 "[ . 1 . 2]" 1 413 1 21 LYS H 1 21 LYS QB . . 3.120 2.504 2.474 2.523 . 0 0 "[ . 1 . 2]" 1 414 1 21 LYS H 1 21 LYS QD . . 4.460 4.079 3.927 4.191 . 0 0 "[ . 1 . 2]" 1 415 1 21 LYS H 1 21 LYS QE . . 4.830 4.073 3.305 4.823 . 0 0 "[ . 1 . 2]" 1 416 1 21 LYS H 1 21 LYS HG2 . . 3.710 2.182 2.025 2.379 . 0 0 "[ . 1 . 2]" 1 417 1 21 LYS H 1 21 LYS HG3 . . 3.620 3.122 2.810 3.233 . 0 0 "[ . 1 . 2]" 1 418 1 21 LYS H 1 22 ASP H . . 3.380 2.593 2.508 2.723 . 0 0 "[ . 1 . 2]" 1 419 1 21 LYS H 1 23 ASN H . . 4.670 3.217 3.139 3.556 . 0 0 "[ . 1 . 2]" 1 420 1 21 LYS H 1 31 GLU HB2 . . 4.840 4.782 4.439 4.843 0.003 1 0 "[ . 1 . 2]" 1 421 1 21 LYS H 1 31 GLU HB3 . . 4.020 3.612 3.276 3.779 . 0 0 "[ . 1 . 2]" 1 422 1 21 LYS H 1 31 GLU HG2 . . 4.820 4.376 3.627 4.821 0.001 1 0 "[ . 1 . 2]" 1 423 1 21 LYS HA 1 21 LYS QD . . 3.240 2.951 2.552 3.275 0.035 11 0 "[ . 1 . 2]" 1 424 1 21 LYS HA 1 21 LYS QE . . 4.610 3.331 1.882 4.625 0.015 12 0 "[ . 1 . 2]" 1 425 1 21 LYS HA 1 21 LYS HG2 . . 3.510 2.746 2.602 2.861 . 0 0 "[ . 1 . 2]" 1 426 1 21 LYS HA 1 21 LYS HG3 . . 3.880 3.803 3.759 3.831 . 0 0 "[ . 1 . 2]" 1 427 1 21 LYS HA 1 23 ASN H . . 4.130 4.003 3.746 4.134 0.004 18 0 "[ . 1 . 2]" 1 428 1 21 LYS QB 1 22 ASP H . . 3.240 2.123 2.098 2.200 . 0 0 "[ . 1 . 2]" 1 429 1 21 LYS QB 1 22 ASP QB . . 5.180 3.582 3.493 3.927 . 0 0 "[ . 1 . 2]" 1 430 1 21 LYS QB 1 23 ASN H . . 4.510 4.138 4.118 4.212 . 0 0 "[ . 1 . 2]" 1 431 1 21 LYS QB 1 31 GLU HG2 . . 4.390 3.591 3.322 4.375 . 0 0 "[ . 1 . 2]" 1 432 1 21 LYS QD 1 21 LYS HG2 . . 2.400 2.371 2.184 2.514 0.114 11 0 "[ . 1 . 2]" 1 433 1 21 LYS QD 1 22 ASP H . . 5.200 4.944 4.827 5.065 . 0 0 "[ . 1 . 2]" 1 434 1 21 LYS QE 1 21 LYS HG2 . . 3.360 2.505 2.113 3.300 . 0 0 "[ . 1 . 2]" 1 435 1 21 LYS QE 1 21 LYS HG3 . . 3.390 2.859 2.075 3.361 . 0 0 "[ . 1 . 2]" 1 436 1 21 LYS QE 1 34 THR MG . . 4.290 2.767 1.818 4.214 . 0 0 "[ . 1 . 2]" 1 437 1 21 LYS QE 1 35 VAL QG . . 4.050 3.366 2.214 4.055 0.005 12 0 "[ . 1 . 2]" 1 438 1 21 LYS HG2 1 22 ASP H . . 4.350 4.101 4.008 4.215 . 0 0 "[ . 1 . 2]" 1 439 1 21 LYS HG2 1 23 ASN H . . 5.500 5.162 5.100 5.267 . 0 0 "[ . 1 . 2]" 1 440 1 21 LYS HG3 1 22 ASP H . . 4.680 4.222 4.112 4.258 . 0 0 "[ . 1 . 2]" 1 441 1 22 ASP H 1 22 ASP HB2 . . 3.610 3.546 3.492 3.589 . 0 0 "[ . 1 . 2]" 1 442 1 22 ASP H 1 22 ASP QB . . 3.100 2.550 2.445 2.633 . 0 0 "[ . 1 . 2]" 1 443 1 22 ASP H 1 22 ASP HB3 . . 3.610 2.615 2.493 2.715 . 0 0 "[ . 1 . 2]" 1 444 1 22 ASP H 1 24 ASN H . . 4.450 4.208 3.965 4.503 0.053 11 0 "[ . 1 . 2]" 1 445 1 22 ASP H 1 31 GLU HG2 . . 5.300 5.184 4.139 5.303 0.003 2 0 "[ . 1 . 2]" 1 446 1 22 ASP QB 1 23 ASN H . . 4.520 3.857 3.679 3.941 . 0 0 "[ . 1 . 2]" 1 447 1 22 ASP QB 1 24 ASN H . . 4.720 4.178 3.131 4.472 . 0 0 "[ . 1 . 2]" 1 448 1 23 ASN H 1 23 ASN HA . . 2.730 2.175 2.166 2.189 . 0 0 "[ . 1 . 2]" 1 449 1 23 ASN H 1 23 ASN HB2 . . 4.170 3.406 2.900 4.014 . 0 0 "[ . 1 . 2]" 1 450 1 23 ASN H 1 23 ASN QB . . 3.540 3.032 2.786 3.436 . 0 0 "[ . 1 . 2]" 1 451 1 23 ASN H 1 23 ASN HB3 . . 4.170 3.596 3.133 4.071 . 0 0 "[ . 1 . 2]" 1 452 1 23 ASN H 1 24 ASN H . . 3.380 2.894 2.675 3.103 . 0 0 "[ . 1 . 2]" 1 453 1 23 ASN H 1 25 GLY H . . 4.760 4.493 4.274 4.676 . 0 0 "[ . 1 . 2]" 1 454 1 23 ASN HA 1 24 ASN H . . 3.310 2.697 2.619 2.863 . 0 0 "[ . 1 . 2]" 1 455 1 23 ASN HA 1 25 GLY H . . 4.410 3.234 2.915 3.466 . 0 0 "[ . 1 . 2]" 1 456 1 23 ASN QB 1 24 ASN H . . 4.390 4.020 3.941 4.070 . 0 0 "[ . 1 . 2]" 1 457 1 23 ASN QB 1 25 GLY H . . 5.340 4.697 4.056 5.169 . 0 0 "[ . 1 . 2]" 1 458 1 24 ASN H 1 24 ASN HB2 . . 3.880 3.477 2.515 3.642 . 0 0 "[ . 1 . 2]" 1 459 1 24 ASN H 1 24 ASN QB . . 3.310 2.723 2.466 2.805 . 0 0 "[ . 1 . 2]" 1 460 1 24 ASN H 1 24 ASN HB3 . . 3.880 2.928 2.783 3.551 . 0 0 "[ . 1 . 2]" 1 461 1 24 ASN H 1 24 ASN QD . . 4.880 3.750 3.322 3.952 . 0 0 "[ . 1 . 2]" 1 462 1 24 ASN H 1 25 GLY H . . 3.170 2.236 2.006 2.651 . 0 0 "[ . 1 . 2]" 1 463 1 24 ASN H 1 25 GLY QA . . 4.670 4.226 4.019 4.572 . 0 0 "[ . 1 . 2]" 1 464 1 24 ASN H 1 26 SER H . . 3.880 3.569 3.182 3.799 . 0 0 "[ . 1 . 2]" 1 465 1 24 ASN QB 1 26 SER H . . 4.500 3.320 2.776 3.669 . 0 0 "[ . 1 . 2]" 1 466 1 24 ASN HB2 1 25 GLY H . . 4.930 3.926 3.214 4.110 . 0 0 "[ . 1 . 2]" 1 467 1 24 ASN HB3 1 25 GLY H . . 4.930 4.218 4.112 4.382 . 0 0 "[ . 1 . 2]" 1 468 1 25 GLY H 1 26 SER H . . 3.020 2.377 2.040 2.599 . 0 0 "[ . 1 . 2]" 1 469 1 26 SER H 1 26 SER HB2 . . 3.870 3.207 2.855 3.882 0.012 12 0 "[ . 1 . 2]" 1 470 1 26 SER H 1 26 SER QB . . 3.240 2.954 2.774 3.250 0.010 12 0 "[ . 1 . 2]" 1 471 1 26 SER H 1 26 SER HB3 . . 3.870 3.627 3.304 3.910 0.040 11 0 "[ . 1 . 2]" 1 472 1 26 SER H 1 27 ILE H . . 4.690 4.411 4.288 4.511 . 0 0 "[ . 1 . 2]" 1 473 1 26 SER HA 1 27 ILE H . . 3.280 2.316 2.220 2.603 . 0 0 "[ . 1 . 2]" 1 474 1 26 SER HA 1 27 ILE HG12 . . 5.110 4.907 4.621 5.117 0.007 11 0 "[ . 1 . 2]" 1 475 1 26 SER HA 1 27 ILE QG . . 4.330 3.328 3.101 3.590 . 0 0 "[ . 1 . 2]" 1 476 1 26 SER HA 1 27 ILE HG13 . . 5.110 3.387 3.141 3.669 . 0 0 "[ . 1 . 2]" 1 477 1 26 SER HA 1 62 GLN HB3 . . 5.190 4.105 3.530 4.930 . 0 0 "[ . 1 . 2]" 1 478 1 26 SER HA 1 63 ILE H . . 4.670 3.901 3.582 4.341 . 0 0 "[ . 1 . 2]" 1 479 1 26 SER HA 1 64 GLU H . . 5.500 4.975 4.610 5.292 . 0 0 "[ . 1 . 2]" 1 480 1 26 SER HA 1 64 GLU HA . . 3.860 3.129 2.661 3.413 . 0 0 "[ . 1 . 2]" 1 481 1 26 SER HA 1 64 GLU HG2 . . 5.500 4.915 3.793 5.500 . 0 0 "[ . 1 . 2]" 1 482 1 26 SER HA 1 64 GLU HG3 . . 4.970 4.012 2.679 4.959 . 0 0 "[ . 1 . 2]" 1 483 1 26 SER HA 1 65 PHE H . . 4.970 4.911 4.534 4.973 0.003 4 0 "[ . 1 . 2]" 1 484 1 26 SER QB 1 27 ILE H . . 3.700 3.025 2.227 3.333 . 0 0 "[ . 1 . 2]" 1 485 1 26 SER QB 1 62 GLN HB2 . . 3.980 3.666 3.332 3.974 . 0 0 "[ . 1 . 2]" 1 486 1 26 SER QB 1 62 GLN HB3 . . 3.750 2.185 1.969 2.486 . 0 0 "[ . 1 . 2]" 1 487 1 26 SER QB 1 62 GLN QE . . 4.240 3.709 3.147 4.239 . 0 0 "[ . 1 . 2]" 1 488 1 26 SER QB 1 63 ILE H . . 4.290 3.632 2.854 4.091 . 0 0 "[ . 1 . 2]" 1 489 1 26 SER QB 1 64 GLU HA . . 4.840 3.886 3.316 4.286 . 0 0 "[ . 1 . 2]" 1 490 1 26 SER QB 1 64 GLU HG3 . . 4.510 3.531 2.452 4.504 . 0 0 "[ . 1 . 2]" 1 491 1 26 SER HB2 1 27 ILE H . . 4.240 3.512 2.248 4.017 . 0 0 "[ . 1 . 2]" 1 492 1 26 SER HB2 1 62 GLN HB2 . . 4.820 4.505 3.831 4.822 0.002 20 0 "[ . 1 . 2]" 1 493 1 26 SER HB2 1 62 GLN HB3 . . 4.370 2.827 2.132 3.194 . 0 0 "[ . 1 . 2]" 1 494 1 26 SER HB2 1 62 GLN HG3 . . 5.500 5.064 4.461 5.493 . 0 0 "[ . 1 . 2]" 1 495 1 26 SER HB2 1 63 ILE H . . 4.880 4.402 2.889 4.880 0.000 4 0 "[ . 1 . 2]" 1 496 1 26 SER HB3 1 27 ILE H . . 4.240 3.456 2.503 4.071 . 0 0 "[ . 1 . 2]" 1 497 1 26 SER HB3 1 62 GLN HB2 . . 4.820 3.967 3.428 4.499 . 0 0 "[ . 1 . 2]" 1 498 1 26 SER HB3 1 62 GLN HB3 . . 4.370 2.413 1.996 2.903 . 0 0 "[ . 1 . 2]" 1 499 1 26 SER HB3 1 62 GLN HG3 . . 5.500 5.216 4.777 5.501 0.001 12 0 "[ . 1 . 2]" 1 500 1 26 SER HB3 1 63 ILE H . . 4.880 4.080 3.115 4.876 . 0 0 "[ . 1 . 2]" 1 501 1 27 ILE H 1 27 ILE HB . . 3.580 2.594 2.473 2.726 . 0 0 "[ . 1 . 2]" 1 502 1 27 ILE H 1 27 ILE MD . . 3.790 3.632 3.401 3.797 0.007 11 0 "[ . 1 . 2]" 1 503 1 27 ILE H 1 27 ILE QG . . 3.830 2.484 2.137 2.935 . 0 0 "[ . 1 . 2]" 1 504 1 27 ILE H 1 27 ILE MG . . 4.270 3.817 3.771 3.882 . 0 0 "[ . 1 . 2]" 1 505 1 27 ILE H 1 28 SER H . . 4.970 4.500 4.424 4.580 . 0 0 "[ . 1 . 2]" 1 506 1 27 ILE H 1 62 GLN HA . . 4.680 3.776 3.236 4.181 . 0 0 "[ . 1 . 2]" 1 507 1 27 ILE H 1 63 ILE H . . 3.860 2.270 1.975 2.637 . 0 0 "[ . 1 . 2]" 1 508 1 27 ILE H 1 63 ILE HB . . 3.970 2.812 2.534 3.058 . 0 0 "[ . 1 . 2]" 1 509 1 27 ILE H 1 63 ILE MD . . 5.140 4.652 4.223 4.856 . 0 0 "[ . 1 . 2]" 1 510 1 27 ILE H 1 63 ILE MG . . 4.290 4.129 3.891 4.299 0.009 8 0 "[ . 1 . 2]" 1 511 1 27 ILE H 1 64 GLU HA . . 4.720 4.497 3.940 4.726 0.006 1 0 "[ . 1 . 2]" 1 512 1 27 ILE HA 1 27 ILE MD . . 4.570 3.897 3.818 3.922 . 0 0 "[ . 1 . 2]" 1 513 1 27 ILE HA 1 28 SER H . . 3.090 2.272 2.201 2.315 . 0 0 "[ . 1 . 2]" 1 514 1 27 ILE HB 1 28 SER H . . 4.640 3.991 3.831 4.219 . 0 0 "[ . 1 . 2]" 1 515 1 27 ILE HB 1 63 ILE H . . 4.530 3.326 3.040 3.723 . 0 0 "[ . 1 . 2]" 1 516 1 27 ILE HB 1 63 ILE HB . . 3.760 2.351 2.015 2.655 . 0 0 "[ . 1 . 2]" 1 517 1 27 ILE HB 1 63 ILE MG . . 4.010 3.773 3.347 4.011 0.001 19 0 "[ . 1 . 2]" 1 518 1 27 ILE MD 1 27 ILE MG . . 3.390 2.172 1.902 2.386 . 0 0 "[ . 1 . 2]" 1 519 1 27 ILE MD 1 28 SER H . . 5.100 5.049 4.954 5.106 0.006 1 0 "[ . 1 . 2]" 1 520 1 27 ILE MD 1 32 LEU HB2 . . 4.850 4.710 4.508 4.855 0.005 6 0 "[ . 1 . 2]" 1 521 1 27 ILE MD 1 52 MET ME . . 5.000 4.899 4.618 5.002 0.002 18 0 "[ . 1 . 2]" 1 522 1 27 ILE MD 1 63 ILE H . . 5.040 4.668 4.401 4.906 . 0 0 "[ . 1 . 2]" 1 523 1 27 ILE MD 1 63 ILE HB . . 4.230 3.000 2.652 3.219 . 0 0 "[ . 1 . 2]" 1 524 1 27 ILE MD 1 63 ILE MD . . 5.180 5.071 4.735 5.181 0.001 2 0 "[ . 1 . 2]" 1 525 1 27 ILE MD 1 63 ILE MG . . 3.400 3.183 2.637 3.399 . 0 0 "[ . 1 . 2]" 1 526 1 27 ILE MD 1 68 PHE QD . . 4.170 3.303 2.196 4.160 . 0 0 "[ . 1 . 2]" 1 527 1 27 ILE QG 1 27 ILE MG . . 3.270 2.272 2.119 2.452 . 0 0 "[ . 1 . 2]" 1 528 1 27 ILE QG 1 28 SER H . . 4.470 4.205 4.020 4.296 . 0 0 "[ . 1 . 2]" 1 529 1 27 ILE HG12 1 28 SER H . . 5.320 4.523 4.301 4.626 . 0 0 "[ . 1 . 2]" 1 530 1 27 ILE HG13 1 28 SER H . . 5.320 5.001 4.831 5.204 . 0 0 "[ . 1 . 2]" 1 531 1 27 ILE MG 1 28 SER H . . 3.800 2.242 2.020 2.551 . 0 0 "[ . 1 . 2]" 1 532 1 27 ILE MG 1 31 GLU H . . 4.400 4.218 3.747 4.401 0.001 12 0 "[ . 1 . 2]" 1 533 1 27 ILE MG 1 31 GLU HB2 . . 4.180 2.618 2.082 3.053 . 0 0 "[ . 1 . 2]" 1 534 1 27 ILE MG 1 31 GLU HB3 . . 3.950 3.302 2.905 3.950 0.000 12 0 "[ . 1 . 2]" 1 535 1 27 ILE MG 1 32 LEU H . . 3.340 3.186 2.485 3.343 0.003 2 0 "[ . 1 . 2]" 1 536 1 27 ILE MG 1 32 LEU HA . . 4.070 3.145 2.713 3.638 . 0 0 "[ . 1 . 2]" 1 537 1 27 ILE MG 1 32 LEU HB2 . . 4.070 2.348 2.004 2.594 . 0 0 "[ . 1 . 2]" 1 538 1 27 ILE MG 1 32 LEU HB3 . . 3.980 3.809 3.523 3.984 0.004 4 0 "[ . 1 . 2]" 1 539 1 27 ILE MG 1 32 LEU HG . . 4.680 3.879 2.580 4.567 . 0 0 "[ . 1 . 2]" 1 540 1 28 SER H 1 28 SER HB2 . . 4.180 3.251 2.528 3.733 . 0 0 "[ . 1 . 2]" 1 541 1 28 SER H 1 28 SER QB . . 3.530 2.562 2.292 2.973 . 0 0 "[ . 1 . 2]" 1 542 1 28 SER H 1 28 SER HB3 . . 4.180 2.794 2.337 3.754 . 0 0 "[ . 1 . 2]" 1 543 1 28 SER H 1 29 SER H . . 5.500 4.515 4.498 4.540 . 0 0 "[ . 1 . 2]" 1 544 1 28 SER H 1 31 GLU H . . 4.370 3.448 3.069 3.656 . 0 0 "[ . 1 . 2]" 1 545 1 28 SER H 1 31 GLU HA . . 5.500 5.119 4.870 5.339 . 0 0 "[ . 1 . 2]" 1 546 1 28 SER H 1 31 GLU HB2 . . 3.420 2.220 1.954 2.424 . 0 0 "[ . 1 . 2]" 1 547 1 28 SER H 1 31 GLU HB3 . . 3.980 3.804 3.532 3.982 0.002 1 0 "[ . 1 . 2]" 1 548 1 28 SER H 1 32 LEU H . . 4.800 3.795 3.457 4.111 . 0 0 "[ . 1 . 2]" 1 549 1 28 SER HA 1 29 SER H . . 2.780 2.463 2.334 2.695 . 0 0 "[ . 1 . 2]" 1 550 1 28 SER HA 1 32 LEU H . . 5.250 4.982 4.724 5.215 . 0 0 "[ . 1 . 2]" 1 551 1 28 SER QB 1 29 SER H . . 3.390 3.000 2.181 3.393 0.003 11 0 "[ . 1 . 2]" 1 552 1 28 SER QB 1 31 GLU H . . 4.870 2.930 2.254 3.635 . 0 0 "[ . 1 . 2]" 1 553 1 28 SER QB 1 31 GLU HG3 . . 4.800 3.321 2.426 4.652 . 0 0 "[ . 1 . 2]" 1 554 1 28 SER HB2 1 29 SER H . . 4.080 3.371 2.197 4.082 0.002 5 0 "[ . 1 . 2]" 1 555 1 28 SER HB3 1 29 SER H . . 4.080 3.709 2.314 4.082 0.002 11 0 "[ . 1 . 2]" 1 556 1 29 SER H 1 29 SER HB2 . . 3.370 3.256 2.925 3.379 0.009 10 0 "[ . 1 . 2]" 1 557 1 29 SER H 1 29 SER HB3 . . 3.370 2.182 2.047 3.221 . 0 0 "[ . 1 . 2]" 1 558 1 29 SER H 1 30 SER H . . 4.550 2.731 2.307 3.062 . 0 0 "[ . 1 . 2]" 1 559 1 29 SER H 1 32 LEU H . . 5.130 4.647 4.409 4.770 . 0 0 "[ . 1 . 2]" 1 560 1 29 SER H 1 48 VAL MG1 . . 4.810 4.164 3.952 4.491 . 0 0 "[ . 1 . 2]" 1 561 1 29 SER H 1 52 MET ME . . 3.660 2.861 2.396 3.618 . 0 0 "[ . 1 . 2]" 1 562 1 29 SER H 1 52 MET QG . . 5.070 3.567 2.748 4.934 . 0 0 "[ . 1 . 2]" 1 563 1 29 SER HA 1 32 LEU H . . 3.590 3.456 3.171 3.591 0.001 13 0 "[ . 1 . 2]" 1 564 1 29 SER HA 1 32 LEU HB2 . . 3.760 3.204 2.821 3.601 . 0 0 "[ . 1 . 2]" 1 565 1 29 SER HA 1 32 LEU HB3 . . 4.010 2.576 2.243 3.128 . 0 0 "[ . 1 . 2]" 1 566 1 29 SER HA 1 48 VAL MG1 . . 3.790 2.051 1.919 2.323 . 0 0 "[ . 1 . 2]" 1 567 1 29 SER HA 1 52 MET ME . . 3.330 3.269 2.910 3.340 0.010 13 0 "[ . 1 . 2]" 1 568 1 29 SER HA 1 52 MET QG . . 4.500 2.758 2.344 3.517 . 0 0 "[ . 1 . 2]" 1 569 1 29 SER QB 1 30 SER H . . 3.530 3.327 3.070 3.530 . 0 0 "[ . 1 . 2]" 1 570 1 29 SER QB 1 48 VAL MG1 . . 3.150 2.074 1.753 2.665 . 0 0 "[ . 1 . 2]" 1 571 1 29 SER QB 1 52 MET ME . . 3.300 3.166 2.722 3.314 0.014 6 0 "[ . 1 . 2]" 1 572 1 29 SER HB2 1 48 VAL MG1 . . 3.780 2.125 1.877 3.015 . 0 0 "[ . 1 . 2]" 1 573 1 29 SER HB2 1 52 MET QB . . 4.640 3.875 3.461 4.643 0.003 2 0 "[ . 1 . 2]" 1 574 1 29 SER HB2 1 52 MET QG . . 4.530 2.353 1.953 3.666 . 0 0 "[ . 1 . 2]" 1 575 1 29 SER HB3 1 48 VAL MG1 . . 3.780 3.298 1.877 3.770 . 0 0 "[ . 1 . 2]" 1 576 1 29 SER HB3 1 52 MET QB . . 4.640 3.848 3.075 4.621 . 0 0 "[ . 1 . 2]" 1 577 1 29 SER HB3 1 52 MET QG . . 4.530 2.699 1.980 4.104 . 0 0 "[ . 1 . 2]" 1 578 1 30 SER H 1 30 SER HB2 . . 4.050 2.717 2.140 3.580 . 0 0 "[ . 1 . 2]" 1 579 1 30 SER H 1 30 SER QB . . 3.420 2.357 2.120 2.747 . 0 0 "[ . 1 . 2]" 1 580 1 30 SER H 1 30 SER HB3 . . 4.050 2.981 2.260 3.565 . 0 0 "[ . 1 . 2]" 1 581 1 30 SER H 1 31 GLU H . . 4.580 2.709 2.288 3.003 . 0 0 "[ . 1 . 2]" 1 582 1 30 SER H 1 31 GLU HG3 . . 5.270 4.474 3.781 5.032 . 0 0 "[ . 1 . 2]" 1 583 1 30 SER HA 1 33 ALA H . . 4.250 3.524 3.185 3.908 . 0 0 "[ . 1 . 2]" 1 584 1 30 SER HA 1 33 ALA MB . . 3.390 2.860 2.592 3.187 . 0 0 "[ . 1 . 2]" 1 585 1 30 SER HA 1 48 VAL MG2 . . 5.390 4.552 3.848 5.240 . 0 0 "[ . 1 . 2]" 1 586 1 30 SER QB 1 31 GLU H . . 3.580 2.597 2.076 3.454 . 0 0 "[ . 1 . 2]" 1 587 1 30 SER HB2 1 31 GLU H . . 4.120 3.133 2.171 3.833 . 0 0 "[ . 1 . 2]" 1 588 1 30 SER HB3 1 31 GLU H . . 4.120 3.182 2.093 4.073 . 0 0 "[ . 1 . 2]" 1 589 1 31 GLU H 1 31 GLU HB2 . . 3.290 2.449 2.306 2.539 . 0 0 "[ . 1 . 2]" 1 590 1 31 GLU H 1 31 GLU HB3 . . 3.640 3.551 3.521 3.589 . 0 0 "[ . 1 . 2]" 1 591 1 31 GLU H 1 31 GLU HG2 . . 3.770 3.518 3.280 3.771 0.001 6 0 "[ . 1 . 2]" 1 592 1 31 GLU H 1 31 GLU HG3 . . 3.360 2.173 1.966 2.420 . 0 0 "[ . 1 . 2]" 1 593 1 31 GLU H 1 32 LEU H . . 3.660 2.639 2.304 2.782 . 0 0 "[ . 1 . 2]" 1 594 1 31 GLU H 1 32 LEU HB2 . . 4.900 4.726 4.296 4.900 0.000 5 0 "[ . 1 . 2]" 1 595 1 31 GLU H 1 32 LEU HB3 . . 5.170 5.038 4.539 5.177 0.007 1 0 "[ . 1 . 2]" 1 596 1 31 GLU HA 1 31 GLU HB3 . . 2.880 2.537 2.477 2.620 . 0 0 "[ . 1 . 2]" 1 597 1 31 GLU HA 1 31 GLU HG2 . . 2.850 2.610 2.364 2.786 . 0 0 "[ . 1 . 2]" 1 598 1 31 GLU HA 1 31 GLU HG3 . . 3.170 2.818 2.586 3.049 . 0 0 "[ . 1 . 2]" 1 599 1 31 GLU HA 1 34 THR H . . 4.400 3.412 3.160 3.853 . 0 0 "[ . 1 . 2]" 1 600 1 31 GLU HA 1 34 THR HB . . 4.320 2.412 2.126 3.165 . 0 0 "[ . 1 . 2]" 1 601 1 31 GLU HA 1 34 THR MG . . 4.090 3.476 2.868 3.762 . 0 0 "[ . 1 . 2]" 1 602 1 31 GLU HB2 1 32 LEU H . . 3.560 2.953 2.570 3.275 . 0 0 "[ . 1 . 2]" 1 603 1 31 GLU HB3 1 31 GLU HG2 . . 2.550 2.423 2.343 2.543 . 0 0 "[ . 1 . 2]" 1 604 1 31 GLU HB3 1 32 LEU H . . 4.140 3.904 3.573 4.143 0.003 4 0 "[ . 1 . 2]" 1 605 1 31 GLU HG2 1 32 LEU H . . 5.250 5.209 4.970 5.252 0.002 14 0 "[ . 1 . 2]" 1 606 1 31 GLU HG3 1 32 LEU H . . 4.710 4.440 4.142 4.606 . 0 0 "[ . 1 . 2]" 1 607 1 32 LEU H 1 32 LEU HB2 . . 3.250 2.354 2.083 2.518 . 0 0 "[ . 1 . 2]" 1 608 1 32 LEU H 1 32 LEU HB3 . . 3.200 2.589 2.437 2.863 . 0 0 "[ . 1 . 2]" 1 609 1 32 LEU H 1 32 LEU MD1 . . 4.310 4.053 3.812 4.255 . 0 0 "[ . 1 . 2]" 1 610 1 32 LEU H 1 32 LEU MD2 . . 4.310 4.118 3.583 4.275 . 0 0 "[ . 1 . 2]" 1 611 1 32 LEU H 1 32 LEU HG . . 4.480 4.445 4.357 4.517 0.037 1 0 "[ . 1 . 2]" 1 612 1 32 LEU H 1 33 ALA H . . 2.760 2.606 2.440 2.779 0.019 1 0 "[ . 1 . 2]" 1 613 1 32 LEU HA 1 32 LEU MD1 . . 3.960 2.671 1.947 3.881 . 0 0 "[ . 1 . 2]" 1 614 1 32 LEU HA 1 32 LEU QD . . 3.150 2.243 1.886 2.749 . 0 0 "[ . 1 . 2]" 1 615 1 32 LEU HA 1 32 LEU MD2 . . 3.960 3.302 1.979 3.912 . 0 0 "[ . 1 . 2]" 1 616 1 32 LEU HA 1 32 LEU HG . . 3.790 2.870 2.376 3.673 . 0 0 "[ . 1 . 2]" 1 617 1 32 LEU HA 1 35 VAL H . . 3.970 3.429 3.186 3.674 . 0 0 "[ . 1 . 2]" 1 618 1 32 LEU HA 1 35 VAL HB . . 4.350 3.303 2.744 3.990 . 0 0 "[ . 1 . 2]" 1 619 1 32 LEU HA 1 35 VAL QG . . 4.960 2.754 1.950 3.517 . 0 0 "[ . 1 . 2]" 1 620 1 32 LEU HB2 1 33 ALA H . . 3.800 3.730 3.471 3.806 0.006 17 0 "[ . 1 . 2]" 1 621 1 32 LEU HB3 1 33 ALA H . . 3.630 2.524 2.330 2.776 . 0 0 "[ . 1 . 2]" 1 622 1 32 LEU HB3 1 34 THR H . . 5.030 4.805 4.498 5.025 . 0 0 "[ . 1 . 2]" 1 623 1 32 LEU QD 1 33 ALA H . . 4.420 3.676 2.802 4.136 . 0 0 "[ . 1 . 2]" 1 624 1 32 LEU QD 1 35 VAL H . . 4.970 4.178 3.393 4.864 . 0 0 "[ . 1 . 2]" 1 625 1 32 LEU QD 1 35 VAL QG . . 3.280 3.109 2.448 3.283 0.003 3 0 "[ . 1 . 2]" 1 626 1 32 LEU QD 1 36 MET H . . 5.020 4.209 3.261 5.020 . 0 0 "[ . 1 . 2]" 1 627 1 32 LEU QD 1 52 MET ME . . 3.580 3.333 2.603 3.584 0.004 10 0 "[ . 1 . 2]" 1 628 1 32 LEU MD1 1 33 ALA H . . 5.080 4.486 3.692 4.964 . 0 0 "[ . 1 . 2]" 1 629 1 32 LEU MD2 1 33 ALA H . . 5.080 4.004 2.842 4.891 . 0 0 "[ . 1 . 2]" 1 630 1 32 LEU HG 1 33 ALA H . . 4.930 4.409 3.707 4.936 0.006 1 0 "[ . 1 . 2]" 1 631 1 32 LEU HG 1 35 VAL QG . . 4.760 4.308 3.574 4.776 0.016 6 0 "[ . 1 . 2]" 1 632 1 33 ALA H 1 33 ALA MB . . 3.110 2.122 1.948 2.163 . 0 0 "[ . 1 . 2]" 1 633 1 33 ALA H 1 34 THR H . . 3.650 2.676 2.539 2.915 . 0 0 "[ . 1 . 2]" 1 634 1 33 ALA H 1 48 VAL MG1 . . 3.680 3.147 2.876 3.321 . 0 0 "[ . 1 . 2]" 1 635 1 33 ALA H 1 48 VAL MG2 . . 4.520 3.697 3.405 3.924 . 0 0 "[ . 1 . 2]" 1 636 1 33 ALA HA 1 36 MET H . . 4.240 2.985 2.754 3.266 . 0 0 "[ . 1 . 2]" 1 637 1 33 ALA HA 1 36 MET HB2 . . 3.540 2.529 2.097 3.030 . 0 0 "[ . 1 . 2]" 1 638 1 33 ALA HA 1 36 MET HB3 . . 4.380 4.003 3.580 4.389 0.009 6 0 "[ . 1 . 2]" 1 639 1 33 ALA HA 1 36 MET HG2 . . 4.350 3.030 2.002 3.750 . 0 0 "[ . 1 . 2]" 1 640 1 33 ALA HA 1 36 MET QG . . 3.770 2.314 1.917 2.844 . 0 0 "[ . 1 . 2]" 1 641 1 33 ALA HA 1 36 MET HG3 . . 4.350 2.539 1.995 3.191 . 0 0 "[ . 1 . 2]" 1 642 1 33 ALA HA 1 37 ARG H . . 4.200 4.080 3.897 4.203 0.003 10 0 "[ . 1 . 2]" 1 643 1 33 ALA HA 1 43 PRO QD . . 5.060 3.198 2.397 3.889 . 0 0 "[ . 1 . 2]" 1 644 1 33 ALA HA 1 48 VAL MG2 . . 3.410 3.345 3.134 3.417 0.007 6 0 "[ . 1 . 2]" 1 645 1 33 ALA MB 1 34 THR H . . 3.430 2.760 2.499 3.015 . 0 0 "[ . 1 . 2]" 1 646 1 33 ALA MB 1 34 THR HA . . 4.470 3.865 3.804 3.930 . 0 0 "[ . 1 . 2]" 1 647 1 33 ALA MB 1 35 VAL H . . 5.220 4.401 4.236 4.653 . 0 0 "[ . 1 . 2]" 1 648 1 33 ALA MB 1 48 VAL HB . . 4.780 3.812 3.530 4.079 . 0 0 "[ . 1 . 2]" 1 649 1 33 ALA MB 1 48 VAL MG1 . . 2.980 2.824 2.475 2.983 0.003 10 0 "[ . 1 . 2]" 1 650 1 33 ALA MB 1 48 VAL MG2 . . 2.980 2.040 1.898 2.180 . 0 0 "[ . 1 . 2]" 1 651 1 34 THR H 1 34 THR HB . . 3.200 2.172 2.032 2.529 . 0 0 "[ . 1 . 2]" 1 652 1 34 THR H 1 34 THR MG . . 3.940 3.554 2.851 3.685 . 0 0 "[ . 1 . 2]" 1 653 1 34 THR H 1 35 VAL H . . 3.720 2.678 2.425 2.842 . 0 0 "[ . 1 . 2]" 1 654 1 34 THR H 1 35 VAL HB . . 5.220 4.859 4.411 5.221 0.001 1 0 "[ . 1 . 2]" 1 655 1 34 THR H 1 35 VAL QG . . 4.780 3.991 3.387 4.461 . 0 0 "[ . 1 . 2]" 1 656 1 34 THR H 1 48 VAL MG2 . . 5.500 5.457 5.173 5.512 0.012 4 0 "[ . 1 . 2]" 1 657 1 34 THR HA 1 34 THR MG . . 3.270 2.635 2.350 3.148 . 0 0 "[ . 1 . 2]" 1 658 1 34 THR HA 1 37 ARG H . . 4.100 3.710 3.563 3.937 . 0 0 "[ . 1 . 2]" 1 659 1 34 THR HA 1 37 ARG QB . . 3.990 3.794 3.540 3.990 . 0 0 "[ . 1 . 2]" 1 660 1 34 THR HA 1 37 ARG HD2 . . 4.850 2.864 2.002 4.536 . 0 0 "[ . 1 . 2]" 1 661 1 34 THR HA 1 37 ARG QD . . 4.140 2.483 1.955 3.143 . 0 0 "[ . 1 . 2]" 1 662 1 34 THR HA 1 37 ARG HD3 . . 4.850 3.183 2.120 4.223 . 0 0 "[ . 1 . 2]" 1 663 1 34 THR HA 1 37 ARG HG2 . . 5.020 2.143 2.000 2.479 . 0 0 "[ . 1 . 2]" 1 664 1 34 THR HA 1 37 ARG HG3 . . 5.020 3.522 3.252 3.716 . 0 0 "[ . 1 . 2]" 1 665 1 34 THR HB 1 35 VAL H . . 3.620 3.191 2.948 3.638 0.018 4 0 "[ . 1 . 2]" 1 666 1 34 THR HB 1 35 VAL QG . . 4.980 3.525 3.097 4.118 . 0 0 "[ . 1 . 2]" 1 667 1 34 THR MG 1 35 VAL H . . 4.120 3.430 1.966 4.102 . 0 0 "[ . 1 . 2]" 1 668 1 34 THR MG 1 35 VAL HA . . 4.600 3.505 3.026 4.196 . 0 0 "[ . 1 . 2]" 1 669 1 34 THR MG 1 35 VAL QG . . 4.130 3.021 1.878 3.863 . 0 0 "[ . 1 . 2]" 1 670 1 34 THR MG 1 38 SER H . . 5.070 5.018 4.904 5.077 0.007 4 0 "[ . 1 . 2]" 1 671 1 34 THR MG 1 38 SER QB . . 4.580 4.439 4.154 4.581 0.001 13 0 "[ . 1 . 2]" 1 672 1 35 VAL H 1 35 VAL HB . . 3.310 2.372 2.141 2.710 . 0 0 "[ . 1 . 2]" 1 673 1 35 VAL H 1 35 VAL MG1 . . 4.110 3.675 3.582 3.742 . 0 0 "[ . 1 . 2]" 1 674 1 35 VAL H 1 35 VAL QG . . 3.220 2.330 1.890 2.727 . 0 0 "[ . 1 . 2]" 1 675 1 35 VAL H 1 35 VAL MG2 . . 4.110 2.368 1.895 2.827 . 0 0 "[ . 1 . 2]" 1 676 1 35 VAL H 1 36 MET H . . 3.620 2.369 2.284 2.514 . 0 0 "[ . 1 . 2]" 1 677 1 35 VAL H 1 36 MET QG . . 4.870 3.909 3.491 4.367 . 0 0 "[ . 1 . 2]" 1 678 1 35 VAL H 1 37 ARG H . . 4.540 4.195 3.947 4.538 . 0 0 "[ . 1 . 2]" 1 679 1 35 VAL HA 1 35 VAL MG1 . . 3.550 2.419 2.132 2.625 . 0 0 "[ . 1 . 2]" 1 680 1 35 VAL HA 1 35 VAL QG . . 3.090 2.086 1.991 2.164 . 0 0 "[ . 1 . 2]" 1 681 1 35 VAL HA 1 35 VAL MG2 . . 3.550 2.333 2.070 2.580 . 0 0 "[ . 1 . 2]" 1 682 1 35 VAL HA 1 37 ARG HG2 . . 5.270 4.290 3.928 4.674 . 0 0 "[ . 1 . 2]" 1 683 1 35 VAL HA 1 37 ARG QG . . 4.580 3.742 3.563 4.052 . 0 0 "[ . 1 . 2]" 1 684 1 35 VAL HA 1 37 ARG HG3 . . 5.270 4.151 3.878 4.744 . 0 0 "[ . 1 . 2]" 1 685 1 35 VAL HA 1 38 SER H . . 3.990 3.501 3.310 3.717 . 0 0 "[ . 1 . 2]" 1 686 1 35 VAL HA 1 38 SER QB . . 4.380 2.866 2.572 3.208 . 0 0 "[ . 1 . 2]" 1 687 1 35 VAL HB 1 36 MET H . . 3.670 2.820 2.539 3.035 . 0 0 "[ . 1 . 2]" 1 688 1 35 VAL QG 1 36 MET HA . . 4.820 3.590 3.116 4.113 . 0 0 "[ . 1 . 2]" 1 689 1 35 VAL QG 1 36 MET QG . . 4.870 3.708 3.237 4.003 . 0 0 "[ . 1 . 2]" 1 690 1 35 VAL QG 1 38 SER H . . 4.320 4.134 3.940 4.321 0.001 1 0 "[ . 1 . 2]" 1 691 1 35 VAL QG 1 109 LEU HG . . 4.960 4.516 3.252 4.959 . 0 0 "[ . 1 . 2]" 1 692 1 35 VAL MG1 1 36 MET H . . 4.160 3.598 2.998 4.089 . 0 0 "[ . 1 . 2]" 1 693 1 35 VAL MG1 1 38 SER H . . 5.330 4.329 4.098 4.562 . 0 0 "[ . 1 . 2]" 1 694 1 35 VAL MG2 1 36 MET H . . 4.160 3.906 3.416 4.166 0.006 3 0 "[ . 1 . 2]" 1 695 1 35 VAL MG2 1 38 SER H . . 5.330 5.243 5.058 5.349 0.019 1 0 "[ . 1 . 2]" 1 696 1 36 MET H 1 36 MET HB2 . . 3.540 2.392 2.258 2.649 . 0 0 "[ . 1 . 2]" 1 697 1 36 MET H 1 36 MET HB3 . . 3.770 3.507 3.492 3.524 . 0 0 "[ . 1 . 2]" 1 698 1 36 MET H 1 36 MET ME . . 4.480 3.727 3.427 4.077 . 0 0 "[ . 1 . 2]" 1 699 1 36 MET H 1 36 MET HG2 . . 3.800 2.251 1.943 2.497 . 0 0 "[ . 1 . 2]" 1 700 1 36 MET H 1 36 MET QG . . 3.280 2.200 1.933 2.436 . 0 0 "[ . 1 . 2]" 1 701 1 36 MET H 1 36 MET HG3 . . 3.800 3.254 2.267 3.492 . 0 0 "[ . 1 . 2]" 1 702 1 36 MET H 1 37 ARG H . . 3.660 2.811 2.664 3.054 . 0 0 "[ . 1 . 2]" 1 703 1 36 MET H 1 39 LEU HB2 . . 5.350 5.223 5.034 5.352 0.002 10 0 "[ . 1 . 2]" 1 704 1 36 MET HA 1 36 MET ME . . 3.710 1.957 1.808 2.658 . 0 0 "[ . 1 . 2]" 1 705 1 36 MET HA 1 36 MET HG2 . . 4.310 2.743 2.486 3.360 . 0 0 "[ . 1 . 2]" 1 706 1 36 MET HA 1 36 MET QG . . 3.770 2.660 2.447 3.135 . 0 0 "[ . 1 . 2]" 1 707 1 36 MET HA 1 36 MET HG3 . . 4.310 3.724 3.638 3.800 . 0 0 "[ . 1 . 2]" 1 708 1 36 MET HA 1 39 LEU H . . 4.130 3.062 2.875 3.207 . 0 0 "[ . 1 . 2]" 1 709 1 36 MET HA 1 39 LEU HB2 . . 4.070 2.585 2.409 2.722 . 0 0 "[ . 1 . 2]" 1 710 1 36 MET HA 1 39 LEU HB3 . . 4.690 4.152 3.901 4.363 . 0 0 "[ . 1 . 2]" 1 711 1 36 MET HA 1 39 LEU MD1 . . 4.330 2.328 1.852 3.022 . 0 0 "[ . 1 . 2]" 1 712 1 36 MET HA 1 39 LEU QD . . 3.610 2.286 1.849 2.902 . 0 0 "[ . 1 . 2]" 1 713 1 36 MET HA 1 39 LEU MD2 . . 4.330 3.837 3.677 4.154 . 0 0 "[ . 1 . 2]" 1 714 1 36 MET HA 1 41 LEU H . . 5.500 4.623 4.262 5.116 . 0 0 "[ . 1 . 2]" 1 715 1 36 MET HA 1 41 LEU QD . . 3.720 3.353 2.680 3.695 . 0 0 "[ . 1 . 2]" 1 716 1 36 MET HA 1 41 LEU HG . . 5.240 3.958 3.388 4.513 . 0 0 "[ . 1 . 2]" 1 717 1 36 MET HB2 1 37 ARG H . . 3.700 2.432 2.182 2.629 . 0 0 "[ . 1 . 2]" 1 718 1 36 MET HB2 1 43 PRO HD2 . . 4.810 2.309 2.007 2.797 . 0 0 "[ . 1 . 2]" 1 719 1 36 MET HB2 1 43 PRO QD . . 4.100 2.172 1.891 2.630 . 0 0 "[ . 1 . 2]" 1 720 1 36 MET HB2 1 43 PRO HD3 . . 4.810 2.718 2.311 3.201 . 0 0 "[ . 1 . 2]" 1 721 1 36 MET HB2 1 43 PRO HG2 . . 4.170 2.872 2.022 3.851 . 0 0 "[ . 1 . 2]" 1 722 1 36 MET HB2 1 43 PRO QG . . 3.570 2.634 1.924 3.472 . 0 0 "[ . 1 . 2]" 1 723 1 36 MET HB2 1 43 PRO HG3 . . 4.170 3.115 2.005 4.173 0.003 8 0 "[ . 1 . 2]" 1 724 1 36 MET HB3 1 37 ARG H . . 3.610 3.418 2.975 3.619 0.009 1 0 "[ . 1 . 2]" 1 725 1 36 MET HB3 1 41 LEU H . . 5.490 4.207 3.752 4.600 . 0 0 "[ . 1 . 2]" 1 726 1 36 MET HB3 1 41 LEU QD . . 3.700 2.622 2.073 3.132 . 0 0 "[ . 1 . 2]" 1 727 1 36 MET ME 1 37 ARG HA . . 5.500 5.465 5.284 5.510 0.010 4 0 "[ . 1 . 2]" 1 728 1 36 MET ME 1 39 LEU MD1 . . 3.890 2.036 1.645 3.129 . 0 0 "[ . 1 . 2]" 1 729 1 36 MET ME 1 39 LEU QD . . 3.100 1.958 1.642 2.893 . 0 0 "[ . 1 . 2]" 1 730 1 36 MET ME 1 39 LEU MD2 . . 3.890 3.011 2.205 3.910 0.020 1 0 "[ . 1 . 2]" 1 731 1 36 MET ME 1 41 LEU H . . 5.190 3.958 3.494 5.034 . 0 0 "[ . 1 . 2]" 1 732 1 36 MET ME 1 41 LEU QD . . 2.950 1.972 1.622 2.316 . 0 0 "[ . 1 . 2]" 1 733 1 36 MET ME 1 43 PRO HD2 . . 5.500 4.975 4.192 5.501 0.001 20 0 "[ . 1 . 2]" 1 734 1 36 MET ME 1 43 PRO QD . . 4.820 3.940 3.042 4.478 . 0 0 "[ . 1 . 2]" 1 735 1 36 MET ME 1 43 PRO HD3 . . 5.500 4.139 3.119 4.742 . 0 0 "[ . 1 . 2]" 1 736 1 36 MET QG 1 37 ARG H . . 4.260 4.008 3.740 4.176 . 0 0 "[ . 1 . 2]" 1 737 1 36 MET QG 1 41 LEU QD . . 4.280 3.332 2.793 4.059 . 0 0 "[ . 1 . 2]" 1 738 1 36 MET HG2 1 37 ARG H . . 4.890 4.378 3.938 4.598 . 0 0 "[ . 1 . 2]" 1 739 1 36 MET HG3 1 37 ARG H . . 4.890 4.689 4.049 4.842 . 0 0 "[ . 1 . 2]" 1 740 1 37 ARG H 1 37 ARG QB . . 2.930 2.516 2.395 2.566 . 0 0 "[ . 1 . 2]" 1 741 1 37 ARG H 1 37 ARG QD . . 4.870 3.970 3.644 4.185 . 0 0 "[ . 1 . 2]" 1 742 1 37 ARG H 1 37 ARG HG2 . . 3.460 2.085 1.952 2.328 . 0 0 "[ . 1 . 2]" 1 743 1 37 ARG H 1 37 ARG QG . . 2.900 2.035 1.917 2.225 . 0 0 "[ . 1 . 2]" 1 744 1 37 ARG H 1 37 ARG HG3 . . 3.460 2.907 2.632 3.293 . 0 0 "[ . 1 . 2]" 1 745 1 37 ARG H 1 38 SER H . . 3.340 2.812 2.667 2.930 . 0 0 "[ . 1 . 2]" 1 746 1 37 ARG H 1 39 LEU H . . 4.970 4.286 3.909 4.696 . 0 0 "[ . 1 . 2]" 1 747 1 37 ARG H 1 39 LEU HB2 . . 5.310 5.224 5.081 5.315 0.005 5 0 "[ . 1 . 2]" 1 748 1 37 ARG HA 1 37 ARG HG2 . . 3.990 3.777 3.660 3.900 . 0 0 "[ . 1 . 2]" 1 749 1 37 ARG HA 1 37 ARG HG3 . . 3.990 3.694 3.619 3.801 . 0 0 "[ . 1 . 2]" 1 750 1 37 ARG HA 1 40 GLY H . . 4.130 3.864 3.397 4.141 0.011 4 0 "[ . 1 . 2]" 1 751 1 37 ARG QB 1 37 ARG HD2 . . 3.390 2.805 2.094 3.335 . 0 0 "[ . 1 . 2]" 1 752 1 37 ARG QB 1 37 ARG QD . . 2.830 2.339 2.031 2.556 . 0 0 "[ . 1 . 2]" 1 753 1 37 ARG QB 1 37 ARG HD3 . . 3.390 2.878 2.134 3.337 . 0 0 "[ . 1 . 2]" 1 754 1 37 ARG QB 1 38 SER H . . 3.740 3.567 3.399 3.686 . 0 0 "[ . 1 . 2]" 1 755 1 37 ARG QD 1 37 ARG QG . . 2.390 2.042 1.995 2.116 . 0 0 "[ . 1 . 2]" 1 756 1 37 ARG QG 1 38 SER H . . 3.300 2.108 1.938 2.384 . 0 0 "[ . 1 . 2]" 1 757 1 37 ARG HG2 1 38 SER H . . 3.830 3.092 2.638 3.412 . 0 0 "[ . 1 . 2]" 1 758 1 37 ARG HG3 1 38 SER H . . 3.830 2.156 1.959 2.546 . 0 0 "[ . 1 . 2]" 1 759 1 38 SER H 1 38 SER HB2 . . 3.290 2.289 2.057 2.715 . 0 0 "[ . 1 . 2]" 1 760 1 38 SER H 1 38 SER HB3 . . 3.290 2.809 2.388 3.246 . 0 0 "[ . 1 . 2]" 1 761 1 38 SER H 1 39 LEU H . . 3.370 2.483 2.247 2.684 . 0 0 "[ . 1 . 2]" 1 762 1 38 SER H 1 40 GLY H . . 4.700 4.432 4.190 4.704 0.004 4 0 "[ . 1 . 2]" 1 763 1 38 SER QB 1 39 LEU QD . . 4.000 2.929 2.630 3.278 . 0 0 "[ . 1 . 2]" 1 764 1 38 SER HB2 1 39 LEU H . . 4.320 3.651 2.948 4.243 . 0 0 "[ . 1 . 2]" 1 765 1 38 SER HB3 1 39 LEU H . . 4.320 2.854 2.310 3.661 . 0 0 "[ . 1 . 2]" 1 766 1 39 LEU H 1 39 LEU HB2 . . 3.560 2.296 2.198 2.470 . 0 0 "[ . 1 . 2]" 1 767 1 39 LEU H 1 39 LEU HB3 . . 3.580 3.512 3.473 3.580 . 0 0 "[ . 1 . 2]" 1 768 1 39 LEU H 1 39 LEU MD1 . . 4.170 2.853 1.928 4.077 . 0 0 "[ . 1 . 2]" 1 769 1 39 LEU H 1 39 LEU QD . . 3.400 2.344 1.924 3.012 . 0 0 "[ . 1 . 2]" 1 770 1 39 LEU H 1 39 LEU MD2 . . 4.170 3.584 2.613 4.179 0.009 6 0 "[ . 1 . 2]" 1 771 1 39 LEU H 1 39 LEU HG . . 3.280 3.005 2.334 3.293 0.013 4 0 "[ . 1 . 2]" 1 772 1 39 LEU H 1 40 GLY H . . 3.340 2.875 2.322 3.076 . 0 0 "[ . 1 . 2]" 1 773 1 39 LEU H 1 40 GLY QA . . 5.190 4.599 4.243 4.761 . 0 0 "[ . 1 . 2]" 1 774 1 39 LEU H 1 41 LEU H . . 4.580 4.432 3.775 4.586 0.006 6 0 "[ . 1 . 2]" 1 775 1 39 LEU H 1 41 LEU QD . . 5.330 4.480 3.172 5.331 0.001 2 0 "[ . 1 . 2]" 1 776 1 39 LEU H 1 112 ILE MD . . 5.500 4.704 4.022 5.499 . 0 0 "[ . 1 . 2]" 1 777 1 39 LEU HA 1 39 LEU MD1 . . 4.530 3.402 3.161 3.760 . 0 0 "[ . 1 . 2]" 1 778 1 39 LEU HA 1 39 LEU QD . . 3.090 2.547 1.870 3.004 . 0 0 "[ . 1 . 2]" 1 779 1 39 LEU HA 1 39 LEU MD2 . . 4.530 2.827 1.876 3.488 . 0 0 "[ . 1 . 2]" 1 780 1 39 LEU HA 1 39 LEU HG . . 3.720 2.689 2.176 3.495 . 0 0 "[ . 1 . 2]" 1 781 1 39 LEU HA 1 40 GLY QA . . 4.990 4.257 4.249 4.259 . 0 0 "[ . 1 . 2]" 1 782 1 39 LEU HB2 1 40 GLY H . . 4.070 2.461 2.070 2.759 . 0 0 "[ . 1 . 2]" 1 783 1 39 LEU HB3 1 40 GLY H . . 3.910 3.186 2.785 3.782 . 0 0 "[ . 1 . 2]" 1 784 1 39 LEU HB3 1 41 LEU H . . 5.420 3.877 3.358 5.248 . 0 0 "[ . 1 . 2]" 1 785 1 39 LEU QD 1 40 GLY H . . 4.240 3.843 3.618 4.126 . 0 0 "[ . 1 . 2]" 1 786 1 39 LEU QD 1 112 ILE HA . . 5.440 3.094 2.018 4.725 . 0 0 "[ . 1 . 2]" 1 787 1 39 LEU QD 1 112 ILE MD . . 4.010 2.249 1.582 3.618 . 0 0 "[ . 1 . 2]" 1 788 1 39 LEU QD 1 112 ILE MG . . 4.650 3.427 1.895 3.974 . 0 0 "[ . 1 . 2]" 1 789 1 39 LEU MD1 1 40 GLY H . . 5.130 4.226 3.843 4.907 . 0 0 "[ . 1 . 2]" 1 790 1 39 LEU MD2 1 40 GLY H . . 5.130 4.490 4.331 4.765 . 0 0 "[ . 1 . 2]" 1 791 1 40 GLY H 1 41 LEU H . . 3.270 1.969 1.890 2.276 . 0 0 "[ . 1 . 2]" 1 792 1 40 GLY H 1 41 LEU HA . . 5.170 4.367 4.285 4.552 . 0 0 "[ . 1 . 2]" 1 793 1 40 GLY H 1 41 LEU QB . . 4.540 4.296 3.746 4.539 . 0 0 "[ . 1 . 2]" 1 794 1 40 GLY H 1 41 LEU QD . . 4.900 3.303 2.061 4.367 . 0 0 "[ . 1 . 2]" 1 795 1 40 GLY H 1 41 LEU HG . . 4.950 4.075 3.364 4.517 . 0 0 "[ . 1 . 2]" 1 796 1 41 LEU H 1 41 LEU QB . . 3.320 2.648 2.301 3.318 . 0 0 "[ . 1 . 2]" 1 797 1 41 LEU H 1 41 LEU MD1 . . 4.230 4.014 3.899 4.225 . 0 0 "[ . 1 . 2]" 1 798 1 41 LEU H 1 41 LEU QD . . 3.690 2.399 1.819 3.589 . 0 0 "[ . 1 . 2]" 1 799 1 41 LEU H 1 41 LEU MD2 . . 4.230 2.462 1.821 3.936 . 0 0 "[ . 1 . 2]" 1 800 1 41 LEU H 1 41 LEU HG . . 2.950 2.854 2.671 2.988 0.038 4 0 "[ . 1 . 2]" 1 801 1 41 LEU H 1 42 SER H . . 5.100 4.537 4.321 4.613 . 0 0 "[ . 1 . 2]" 1 802 1 41 LEU H 1 43 PRO QD . . 5.340 4.565 4.074 4.940 . 0 0 "[ . 1 . 2]" 1 803 1 41 LEU HA 1 41 LEU MD1 . . 4.130 3.811 3.408 4.106 . 0 0 "[ . 1 . 2]" 1 804 1 41 LEU HA 1 41 LEU QD . . 3.380 3.337 3.251 3.385 0.005 8 0 "[ . 1 . 2]" 1 805 1 41 LEU HA 1 41 LEU MD2 . . 4.130 3.804 3.490 4.107 . 0 0 "[ . 1 . 2]" 1 806 1 41 LEU HA 1 41 LEU HG . . 4.000 3.657 3.620 3.713 . 0 0 "[ . 1 . 2]" 1 807 1 41 LEU HA 1 42 SER H . . 3.300 2.494 2.410 2.722 . 0 0 "[ . 1 . 2]" 1 808 1 41 LEU QB 1 41 LEU MD1 . . 2.820 2.065 1.948 2.165 . 0 0 "[ . 1 . 2]" 1 809 1 41 LEU QB 1 41 LEU MD2 . . 2.820 2.042 1.926 2.120 . 0 0 "[ . 1 . 2]" 1 810 1 41 LEU QB 1 41 LEU HG . . 2.550 2.489 2.450 2.525 . 0 0 "[ . 1 . 2]" 1 811 1 41 LEU QB 1 42 SER H . . 3.360 2.522 2.013 2.812 . 0 0 "[ . 1 . 2]" 1 812 1 41 LEU QB 1 43 PRO QD . . 4.240 3.718 2.935 3.993 . 0 0 "[ . 1 . 2]" 1 813 1 41 LEU QD 1 42 SER H . . 4.010 3.063 2.172 3.706 . 0 0 "[ . 1 . 2]" 1 814 1 41 LEU QD 1 43 PRO QD . . 4.430 2.402 1.764 3.059 . 0 0 "[ . 1 . 2]" 1 815 1 41 LEU MD1 1 42 SER H . . 4.620 3.157 2.176 3.903 . 0 0 "[ . 1 . 2]" 1 816 1 41 LEU MD2 1 42 SER H . . 4.620 4.602 4.358 4.641 0.021 4 0 "[ . 1 . 2]" 1 817 1 41 LEU HG 1 42 SER H . . 3.990 3.683 3.156 3.979 . 0 0 "[ . 1 . 2]" 1 818 1 42 SER H 1 42 SER HA . . 2.910 2.898 2.868 2.917 0.007 7 0 "[ . 1 . 2]" 1 819 1 42 SER H 1 42 SER HB2 . . 4.140 3.198 2.512 3.957 . 0 0 "[ . 1 . 2]" 1 820 1 42 SER H 1 42 SER HB3 . . 4.140 3.320 2.625 3.861 . 0 0 "[ . 1 . 2]" 1 821 1 42 SER H 1 43 PRO HD2 . . 4.530 4.463 4.088 4.541 0.011 4 0 "[ . 1 . 2]" 1 822 1 42 SER H 1 43 PRO QD . . 3.960 3.299 2.820 3.408 . 0 0 "[ . 1 . 2]" 1 823 1 42 SER H 1 43 PRO HD3 . . 4.530 3.399 2.874 3.522 . 0 0 "[ . 1 . 2]" 1 824 1 42 SER HA 1 43 PRO HD2 . . 3.900 2.225 2.209 2.295 . 0 0 "[ . 1 . 2]" 1 825 1 42 SER HA 1 43 PRO QD . . 3.400 2.015 1.969 2.126 . 0 0 "[ . 1 . 2]" 1 826 1 42 SER HA 1 43 PRO HD3 . . 3.900 2.307 2.212 2.511 . 0 0 "[ . 1 . 2]" 1 827 1 43 PRO HA 1 44 SER H . . 2.830 2.212 2.203 2.218 . 0 0 "[ . 1 . 2]" 1 828 1 43 PRO HA 1 48 VAL MG2 . . 4.360 3.859 3.607 3.966 . 0 0 "[ . 1 . 2]" 1 829 1 43 PRO QB 1 44 SER H . . 3.260 3.148 3.134 3.179 . 0 0 "[ . 1 . 2]" 1 830 1 43 PRO QB 1 48 VAL MG2 . . 2.820 1.902 1.792 1.934 . 0 0 "[ . 1 . 2]" 1 831 1 43 PRO HB2 1 44 SER H . . 3.770 3.370 3.352 3.408 . 0 0 "[ . 1 . 2]" 1 832 1 43 PRO HB2 1 48 VAL MG2 . . 3.420 1.914 1.805 1.945 . 0 0 "[ . 1 . 2]" 1 833 1 43 PRO HB3 1 44 SER H . . 3.770 3.777 3.766 3.802 0.032 10 0 "[ . 1 . 2]" 1 834 1 43 PRO HB3 1 48 VAL MG2 . . 3.420 3.321 3.001 3.467 0.047 4 0 "[ . 1 . 2]" 1 835 1 43 PRO QG 1 48 VAL MG2 . . 3.140 2.629 2.019 2.954 . 0 0 "[ . 1 . 2]" 1 836 1 43 PRO HG2 1 48 VAL MG2 . . 3.920 2.688 2.033 3.071 . 0 0 "[ . 1 . 2]" 1 837 1 43 PRO HG3 1 48 VAL MG2 . . 3.920 3.799 3.449 3.926 0.006 15 0 "[ . 1 . 2]" 1 838 1 44 SER H 1 44 SER HB2 . . 4.060 2.745 2.496 2.855 . 0 0 "[ . 1 . 2]" 1 839 1 44 SER H 1 44 SER QB . . 3.310 2.621 2.243 2.736 . 0 0 "[ . 1 . 2]" 1 840 1 44 SER H 1 44 SER HB3 . . 4.060 3.460 2.402 3.628 . 0 0 "[ . 1 . 2]" 1 841 1 44 SER H 1 47 GLU H . . 4.050 3.530 3.060 3.894 . 0 0 "[ . 1 . 2]" 1 842 1 44 SER H 1 47 GLU HB2 . . 4.110 2.225 1.948 2.931 . 0 0 "[ . 1 . 2]" 1 843 1 44 SER H 1 47 GLU QB . . 3.340 2.061 1.930 2.544 . 0 0 "[ . 1 . 2]" 1 844 1 44 SER H 1 47 GLU HB3 . . 4.110 3.031 2.092 3.687 . 0 0 "[ . 1 . 2]" 1 845 1 44 SER H 1 47 GLU QG . . 4.530 3.215 2.400 4.521 . 0 0 "[ . 1 . 2]" 1 846 1 44 SER H 1 48 VAL H . . 4.890 4.349 3.985 4.705 . 0 0 "[ . 1 . 2]" 1 847 1 44 SER HA 1 45 GLU H . . 3.230 2.346 2.289 2.513 . 0 0 "[ . 1 . 2]" 1 848 1 44 SER QB 1 45 GLU H . . 3.320 2.937 2.682 3.361 0.041 10 0 "[ . 1 . 2]" 1 849 1 44 SER QB 1 46 ALA H . . 3.420 2.753 2.430 3.128 . 0 0 "[ . 1 . 2]" 1 850 1 44 SER QB 1 47 GLU H . . 3.400 2.223 1.966 2.696 . 0 0 "[ . 1 . 2]" 1 851 1 44 SER QB 1 47 GLU QB . . 3.800 2.661 1.989 3.401 . 0 0 "[ . 1 . 2]" 1 852 1 44 SER QB 1 47 GLU QG . . 5.340 3.096 2.028 4.957 . 0 0 "[ . 1 . 2]" 1 853 1 44 SER QB 1 48 VAL H . . 4.500 4.186 4.029 4.492 . 0 0 "[ . 1 . 2]" 1 854 1 44 SER HB2 1 45 GLU H . . 3.850 3.748 3.630 3.860 0.010 10 0 "[ . 1 . 2]" 1 855 1 44 SER HB2 1 46 ALA H . . 4.060 3.103 2.589 4.085 0.025 10 0 "[ . 1 . 2]" 1 856 1 44 SER HB3 1 45 GLU H . . 3.850 3.080 2.754 3.698 . 0 0 "[ . 1 . 2]" 1 857 1 44 SER HB3 1 46 ALA H . . 4.060 3.209 2.760 3.599 . 0 0 "[ . 1 . 2]" 1 858 1 45 GLU H 1 45 GLU QB . . 3.090 2.187 2.149 2.210 . 0 0 "[ . 1 . 2]" 1 859 1 45 GLU H 1 45 GLU HG2 . . 4.470 3.797 2.699 4.387 . 0 0 "[ . 1 . 2]" 1 860 1 45 GLU H 1 45 GLU QG . . 3.900 3.489 2.657 3.916 0.016 17 0 "[ . 1 . 2]" 1 861 1 45 GLU H 1 45 GLU HG3 . . 4.470 4.256 3.836 4.441 . 0 0 "[ . 1 . 2]" 1 862 1 45 GLU H 1 46 ALA H . . 3.900 2.932 2.687 3.041 . 0 0 "[ . 1 . 2]" 1 863 1 45 GLU H 1 46 ALA HA . . 5.500 5.424 5.224 5.504 0.004 5 0 "[ . 1 . 2]" 1 864 1 45 GLU H 1 46 ALA MB . . 5.010 4.459 4.193 4.598 . 0 0 "[ . 1 . 2]" 1 865 1 45 GLU H 1 47 GLU H . . 5.060 4.226 3.856 4.532 . 0 0 "[ . 1 . 2]" 1 866 1 45 GLU H 1 48 VAL MG2 . . 5.280 3.571 3.384 3.975 . 0 0 "[ . 1 . 2]" 1 867 1 45 GLU HA 1 45 GLU HG2 . . 3.880 3.642 3.496 3.786 . 0 0 "[ . 1 . 2]" 1 868 1 45 GLU HA 1 45 GLU HG3 . . 3.880 3.025 2.650 3.767 . 0 0 "[ . 1 . 2]" 1 869 1 45 GLU HA 1 47 GLU H . . 4.720 4.410 3.995 4.728 0.008 15 0 "[ . 1 . 2]" 1 870 1 45 GLU HA 1 48 VAL H . . 3.530 3.352 3.102 3.533 0.003 13 0 "[ . 1 . 2]" 1 871 1 45 GLU HA 1 48 VAL HA . . 5.500 5.355 5.042 5.499 . 0 0 "[ . 1 . 2]" 1 872 1 45 GLU HA 1 48 VAL HB . . 3.140 2.856 2.514 3.019 . 0 0 "[ . 1 . 2]" 1 873 1 45 GLU HA 1 48 VAL MG2 . . 3.440 2.190 1.981 2.847 . 0 0 "[ . 1 . 2]" 1 874 1 45 GLU QB 1 45 GLU HG2 . . 2.790 2.341 2.261 2.501 . 0 0 "[ . 1 . 2]" 1 875 1 45 GLU QB 1 45 GLU QG . . 2.370 2.119 2.109 2.135 . 0 0 "[ . 1 . 2]" 1 876 1 45 GLU QB 1 45 GLU HG3 . . 2.790 2.446 2.287 2.522 . 0 0 "[ . 1 . 2]" 1 877 1 45 GLU QB 1 46 ALA H . . 3.660 3.037 2.490 3.688 0.028 10 0 "[ . 1 . 2]" 1 878 1 45 GLU QB 1 46 ALA HA . . 4.670 4.481 4.362 4.670 0.000 10 0 "[ . 1 . 2]" 1 879 1 45 GLU QG 1 46 ALA H . . 3.690 2.847 1.866 3.691 0.001 19 0 "[ . 1 . 2]" 1 880 1 45 GLU QG 1 46 ALA HA . . 3.820 3.214 2.899 3.526 . 0 0 "[ . 1 . 2]" 1 881 1 45 GLU QG 1 49 ASN QB . . 4.600 4.155 3.542 4.595 . 0 0 "[ . 1 . 2]" 1 882 1 45 GLU QG 1 49 ASN HD21 . . 4.280 2.952 2.255 3.624 . 0 0 "[ . 1 . 2]" 1 883 1 45 GLU QG 1 49 ASN HD22 . . 4.170 2.936 2.144 3.370 . 0 0 "[ . 1 . 2]" 1 884 1 45 GLU HG2 1 46 ALA H . . 4.370 2.969 1.948 3.974 . 0 0 "[ . 1 . 2]" 1 885 1 45 GLU HG2 1 46 ALA HA . . 4.340 3.601 3.215 4.023 . 0 0 "[ . 1 . 2]" 1 886 1 45 GLU HG2 1 49 ASN HD21 . . 4.870 3.788 2.447 4.674 . 0 0 "[ . 1 . 2]" 1 887 1 45 GLU HG2 1 49 ASN HD22 . . 5.000 3.937 2.528 5.004 0.004 8 0 "[ . 1 . 2]" 1 888 1 45 GLU HG3 1 46 ALA H . . 4.370 3.740 2.387 4.382 0.012 19 0 "[ . 1 . 2]" 1 889 1 45 GLU HG3 1 46 ALA HA . . 4.340 3.814 2.973 4.259 . 0 0 "[ . 1 . 2]" 1 890 1 45 GLU HG3 1 49 ASN HD21 . . 4.870 3.204 2.478 4.224 . 0 0 "[ . 1 . 2]" 1 891 1 45 GLU HG3 1 49 ASN HD22 . . 5.000 3.092 2.316 3.755 . 0 0 "[ . 1 . 2]" 1 892 1 46 ALA H 1 46 ALA MB . . 2.920 2.032 1.945 2.194 . 0 0 "[ . 1 . 2]" 1 893 1 46 ALA H 1 47 GLU H . . 3.450 2.529 2.259 2.712 . 0 0 "[ . 1 . 2]" 1 894 1 46 ALA H 1 49 ASN QB . . 4.940 4.855 4.609 4.952 0.012 10 0 "[ . 1 . 2]" 1 895 1 46 ALA HA 1 49 ASN H . . 3.670 3.344 3.075 3.679 0.009 10 0 "[ . 1 . 2]" 1 896 1 46 ALA HA 1 49 ASN QB . . 3.040 2.502 2.328 2.827 . 0 0 "[ . 1 . 2]" 1 897 1 46 ALA HA 1 49 ASN HD21 . . 4.140 2.702 1.953 4.038 . 0 0 "[ . 1 . 2]" 1 898 1 46 ALA HA 1 49 ASN HD22 . . 4.720 4.110 3.473 4.721 0.001 17 0 "[ . 1 . 2]" 1 899 1 46 ALA MB 1 47 GLU H . . 3.390 2.735 2.404 3.008 . 0 0 "[ . 1 . 2]" 1 900 1 46 ALA MB 1 47 GLU QB . . 5.340 4.153 3.683 4.385 . 0 0 "[ . 1 . 2]" 1 901 1 46 ALA MB 1 47 GLU QG . . 5.500 3.849 2.991 5.231 . 0 0 "[ . 1 . 2]" 1 902 1 46 ALA MB 1 49 ASN QB . . 4.480 3.896 3.663 4.267 . 0 0 "[ . 1 . 2]" 1 903 1 47 GLU H 1 47 GLU HB2 . . 3.580 2.321 2.145 2.521 . 0 0 "[ . 1 . 2]" 1 904 1 47 GLU H 1 47 GLU HB3 . . 3.580 3.291 2.723 3.550 . 0 0 "[ . 1 . 2]" 1 905 1 47 GLU H 1 47 GLU QG . . 3.980 2.946 1.981 3.999 0.019 5 0 "[ . 1 . 2]" 1 906 1 47 GLU H 1 48 VAL H . . 3.360 2.538 2.204 2.739 . 0 0 "[ . 1 . 2]" 1 907 1 47 GLU H 1 48 VAL HA . . 5.270 5.103 4.807 5.273 0.003 14 0 "[ . 1 . 2]" 1 908 1 47 GLU H 1 48 VAL MG2 . . 4.320 3.600 3.248 3.806 . 0 0 "[ . 1 . 2]" 1 909 1 47 GLU H 1 49 ASN QB . . 4.860 4.862 4.818 4.901 0.041 8 0 "[ . 1 . 2]" 1 910 1 47 GLU HA 1 47 GLU QG . . 3.170 2.448 2.068 2.985 . 0 0 "[ . 1 . 2]" 1 911 1 47 GLU HA 1 50 ASP H . . 3.630 3.625 3.553 3.646 0.016 10 0 "[ . 1 . 2]" 1 912 1 47 GLU HA 1 50 ASP HB2 . . 3.460 3.365 3.009 3.468 0.008 8 0 "[ . 1 . 2]" 1 913 1 47 GLU HA 1 50 ASP HB3 . . 3.460 3.420 3.143 3.467 0.007 8 0 "[ . 1 . 2]" 1 914 1 47 GLU HB2 1 48 VAL H . . 3.940 3.304 2.791 3.940 0.000 19 0 "[ . 1 . 2]" 1 915 1 47 GLU HB3 1 48 VAL H . . 3.940 3.623 2.952 3.947 0.007 10 0 "[ . 1 . 2]" 1 916 1 47 GLU QG 1 48 VAL H . . 4.650 4.393 4.048 4.658 0.008 17 0 "[ . 1 . 2]" 1 917 1 48 VAL H 1 48 VAL HB . . 3.240 2.591 2.484 2.690 . 0 0 "[ . 1 . 2]" 1 918 1 48 VAL H 1 48 VAL MG1 . . 3.810 3.721 3.683 3.753 . 0 0 "[ . 1 . 2]" 1 919 1 48 VAL H 1 48 VAL MG2 . . 3.090 2.070 1.910 2.262 . 0 0 "[ . 1 . 2]" 1 920 1 48 VAL H 1 49 ASN H . . 2.700 2.456 2.247 2.639 . 0 0 "[ . 1 . 2]" 1 921 1 48 VAL H 1 49 ASN HA . . 5.500 4.981 4.814 5.126 . 0 0 "[ . 1 . 2]" 1 922 1 48 VAL H 1 49 ASN QB . . 4.510 4.138 3.998 4.296 . 0 0 "[ . 1 . 2]" 1 923 1 48 VAL H 1 50 ASP H . . 4.190 3.776 3.646 3.880 . 0 0 "[ . 1 . 2]" 1 924 1 48 VAL HA 1 48 VAL MG1 . . 3.060 2.318 2.155 2.387 . 0 0 "[ . 1 . 2]" 1 925 1 48 VAL HA 1 48 VAL MG2 . . 3.040 2.505 2.412 2.552 . 0 0 "[ . 1 . 2]" 1 926 1 48 VAL HA 1 50 ASP H . . 4.840 3.742 3.492 4.042 . 0 0 "[ . 1 . 2]" 1 927 1 48 VAL HA 1 51 LEU H . . 4.040 3.106 2.830 3.270 . 0 0 "[ . 1 . 2]" 1 928 1 48 VAL HA 1 51 LEU HA . . 5.500 5.425 5.007 5.510 0.010 13 0 "[ . 1 . 2]" 1 929 1 48 VAL HA 1 51 LEU HB2 . . 3.990 3.064 2.569 3.197 . 0 0 "[ . 1 . 2]" 1 930 1 48 VAL HA 1 51 LEU HB3 . . 5.020 4.719 4.215 4.851 . 0 0 "[ . 1 . 2]" 1 931 1 48 VAL HA 1 51 LEU MD2 . . 4.290 4.275 4.202 4.291 0.001 19 0 "[ . 1 . 2]" 1 932 1 48 VAL HA 1 51 LEU HG . . 3.810 2.912 2.619 3.008 . 0 0 "[ . 1 . 2]" 1 933 1 48 VAL HA 1 52 MET H . . 4.460 4.095 3.575 4.223 . 0 0 "[ . 1 . 2]" 1 934 1 48 VAL HB 1 49 ASN H . . 3.240 2.584 2.409 2.760 . 0 0 "[ . 1 . 2]" 1 935 1 48 VAL HB 1 49 ASN QB . . 4.760 4.505 4.374 4.616 . 0 0 "[ . 1 . 2]" 1 936 1 48 VAL HB 1 50 ASP H . . 5.070 4.739 4.601 4.908 . 0 0 "[ . 1 . 2]" 1 937 1 48 VAL MG1 1 49 ASN H . . 3.770 3.772 3.735 3.798 0.028 13 0 "[ . 1 . 2]" 1 938 1 48 VAL MG1 1 49 ASN HA . . 4.200 3.981 3.857 4.136 . 0 0 "[ . 1 . 2]" 1 939 1 48 VAL MG1 1 52 MET H . . 4.280 3.696 3.321 4.030 . 0 0 "[ . 1 . 2]" 1 940 1 48 VAL MG1 1 52 MET QG . . 4.120 2.075 1.801 2.371 . 0 0 "[ . 1 . 2]" 1 941 1 48 VAL MG2 1 49 ASN H . . 4.220 3.616 3.439 3.786 . 0 0 "[ . 1 . 2]" 1 942 1 48 VAL MG2 1 49 ASN QB . . 5.500 5.112 4.932 5.284 . 0 0 "[ . 1 . 2]" 1 943 1 49 ASN H 1 49 ASN QB . . 2.950 2.178 2.115 2.238 . 0 0 "[ . 1 . 2]" 1 944 1 49 ASN H 1 49 ASN HD21 . . 4.220 3.091 2.002 4.005 . 0 0 "[ . 1 . 2]" 1 945 1 49 ASN H 1 49 ASN HD22 . . 4.840 4.173 3.694 4.630 . 0 0 "[ . 1 . 2]" 1 946 1 49 ASN H 1 50 ASP H . . 3.330 2.757 2.662 2.838 . 0 0 "[ . 1 . 2]" 1 947 1 49 ASN H 1 51 LEU H . . 4.920 4.447 4.157 4.846 . 0 0 "[ . 1 . 2]" 1 948 1 49 ASN HA 1 52 MET H . . 4.000 3.284 3.005 4.003 0.003 2 0 "[ . 1 . 2]" 1 949 1 49 ASN HA 1 52 MET QB . . 3.840 2.239 1.990 2.748 . 0 0 "[ . 1 . 2]" 1 950 1 49 ASN HA 1 52 MET QG . . 4.590 2.905 2.554 3.852 . 0 0 "[ . 1 . 2]" 1 951 1 49 ASN QB 1 49 ASN HD22 . . 3.730 3.287 3.231 3.491 . 0 0 "[ . 1 . 2]" 1 952 1 49 ASN QB 1 50 ASP H . . 3.190 2.908 2.737 3.124 . 0 0 "[ . 1 . 2]" 1 953 1 49 ASN QB 1 52 MET QB . . 4.800 4.111 3.895 4.671 . 0 0 "[ . 1 . 2]" 1 954 1 49 ASN HD21 1 50 ASP H . . 5.490 4.985 4.533 5.407 . 0 0 "[ . 1 . 2]" 1 955 1 50 ASP H 1 50 ASP HB2 . . 3.450 2.502 2.359 2.657 . 0 0 "[ . 1 . 2]" 1 956 1 50 ASP H 1 50 ASP QB . . 2.860 2.192 2.174 2.221 . 0 0 "[ . 1 . 2]" 1 957 1 50 ASP H 1 50 ASP HB3 . . 3.450 2.435 2.344 2.564 . 0 0 "[ . 1 . 2]" 1 958 1 50 ASP H 1 51 LEU H . . 3.380 2.604 2.443 2.807 . 0 0 "[ . 1 . 2]" 1 959 1 50 ASP H 1 51 LEU HB2 . . 4.920 4.827 4.669 4.921 0.001 4 0 "[ . 1 . 2]" 1 960 1 50 ASP H 1 51 LEU MD2 . . 5.000 4.105 3.883 4.352 . 0 0 "[ . 1 . 2]" 1 961 1 50 ASP H 1 51 LEU HG . . 4.650 4.469 4.113 4.633 . 0 0 "[ . 1 . 2]" 1 962 1 50 ASP H 1 52 MET QB . . 4.990 4.710 4.416 4.955 . 0 0 "[ . 1 . 2]" 1 963 1 50 ASP HA 1 53 ASN H . . 3.700 3.420 3.183 3.566 . 0 0 "[ . 1 . 2]" 1 964 1 50 ASP HA 1 53 ASN HB2 . . 3.770 2.547 2.243 2.726 . 0 0 "[ . 1 . 2]" 1 965 1 50 ASP HA 1 53 ASN HB3 . . 4.020 3.746 3.392 4.025 0.005 10 0 "[ . 1 . 2]" 1 966 1 50 ASP HA 1 53 ASN HD21 . . 4.110 3.296 2.838 3.756 . 0 0 "[ . 1 . 2]" 1 967 1 50 ASP HA 1 53 ASN HD22 . . 5.200 4.881 4.555 5.199 . 0 0 "[ . 1 . 2]" 1 968 1 50 ASP HA 1 54 GLU H . . 5.160 5.027 4.614 5.163 0.003 2 0 "[ . 1 . 2]" 1 969 1 50 ASP QB 1 51 LEU H . . 3.430 2.397 2.030 2.682 . 0 0 "[ . 1 . 2]" 1 970 1 50 ASP QB 1 51 LEU MD2 . . 4.190 2.336 1.982 2.659 . 0 0 "[ . 1 . 2]" 1 971 1 50 ASP HB2 1 51 LEU H . . 4.020 3.780 3.558 3.994 . 0 0 "[ . 1 . 2]" 1 972 1 50 ASP HB2 1 51 LEU MD2 . . 4.950 3.838 3.599 4.208 . 0 0 "[ . 1 . 2]" 1 973 1 50 ASP HB3 1 51 LEU H . . 4.020 2.425 2.042 2.725 . 0 0 "[ . 1 . 2]" 1 974 1 50 ASP HB3 1 51 LEU MD2 . . 4.950 2.358 1.992 2.689 . 0 0 "[ . 1 . 2]" 1 975 1 51 LEU H 1 51 LEU HB2 . . 3.400 2.503 2.373 2.666 . 0 0 "[ . 1 . 2]" 1 976 1 51 LEU H 1 51 LEU HB3 . . 3.960 3.554 3.524 3.580 . 0 0 "[ . 1 . 2]" 1 977 1 51 LEU H 1 51 LEU MD2 . . 3.780 2.400 1.961 2.657 . 0 0 "[ . 1 . 2]" 1 978 1 51 LEU H 1 51 LEU HG . . 3.210 2.478 2.208 2.689 . 0 0 "[ . 1 . 2]" 1 979 1 51 LEU H 1 52 MET H . . 3.510 2.509 2.321 2.908 . 0 0 "[ . 1 . 2]" 1 980 1 51 LEU H 1 52 MET QB . . 4.830 4.538 4.353 4.835 0.005 17 0 "[ . 1 . 2]" 1 981 1 51 LEU H 1 52 MET QG . . 4.690 3.848 3.534 4.596 . 0 0 "[ . 1 . 2]" 1 982 1 51 LEU H 1 53 ASN H . . 4.210 3.855 3.704 4.018 . 0 0 "[ . 1 . 2]" 1 983 1 51 LEU HA 1 51 LEU MD2 . . 2.840 1.945 1.891 2.061 . 0 0 "[ . 1 . 2]" 1 984 1 51 LEU HA 1 51 LEU HG . . 3.780 3.535 3.403 3.603 . 0 0 "[ . 1 . 2]" 1 985 1 51 LEU HA 1 54 GLU H . . 3.780 3.669 3.533 3.780 . 9 0 "[ . 1 . 2]" 1 986 1 51 LEU HA 1 54 GLU QB . . 4.000 3.758 3.408 3.997 . 0 0 "[ . 1 . 2]" 1 987 1 51 LEU HB2 1 51 LEU MD2 . . 3.410 3.147 3.134 3.198 . 0 0 "[ . 1 . 2]" 1 988 1 51 LEU HB2 1 52 MET H . . 3.710 2.969 2.425 3.266 . 0 0 "[ . 1 . 2]" 1 989 1 51 LEU HB3 1 51 LEU MD2 . . 3.300 2.708 2.577 2.742 . 0 0 "[ . 1 . 2]" 1 990 1 51 LEU HB3 1 52 MET H . . 4.220 4.010 3.675 4.220 0.000 5 0 "[ . 1 . 2]" 1 991 1 51 LEU HB3 1 53 ASN H . . 5.500 5.423 5.100 5.505 0.005 9 0 "[ . 1 . 2]" 1 992 1 51 LEU HB3 1 54 GLU H . . 5.490 5.448 5.118 5.498 0.008 10 0 "[ . 1 . 2]" 1 993 1 51 LEU MD2 1 52 MET H . . 4.400 4.255 4.135 4.400 . 0 0 "[ . 1 . 2]" 1 994 1 51 LEU HG 1 52 MET H . . 4.520 4.448 4.034 4.522 0.002 9 0 "[ . 1 . 2]" 1 995 1 52 MET H 1 52 MET QB . . 3.140 2.389 2.287 2.495 . 0 0 "[ . 1 . 2]" 1 996 1 52 MET H 1 52 MET ME . . 4.850 4.503 4.243 4.718 . 0 0 "[ . 1 . 2]" 1 997 1 52 MET H 1 52 MET QG . . 3.540 2.172 1.937 2.570 . 0 0 "[ . 1 . 2]" 1 998 1 52 MET H 1 53 ASN H . . 3.470 2.459 2.291 2.716 . 0 0 "[ . 1 . 2]" 1 999 1 52 MET H 1 53 ASN HB2 . . 4.650 4.259 4.094 4.576 . 0 0 "[ . 1 . 2]" 1 1000 1 52 MET H 1 53 ASN HB3 . . 5.490 5.290 4.977 5.498 0.008 17 0 "[ . 1 . 2]" 1 1001 1 52 MET H 1 54 GLU H . . 4.490 4.317 4.025 4.500 0.010 6 0 "[ . 1 . 2]" 1 1002 1 52 MET H 1 55 ILE H . . 5.310 5.042 4.789 5.310 . 0 0 "[ . 1 . 2]" 1 1003 1 52 MET HA 1 52 MET ME . . 3.740 3.150 2.671 3.549 . 0 0 "[ . 1 . 2]" 1 1004 1 52 MET HA 1 52 MET QG . . 3.400 2.800 2.305 3.119 . 0 0 "[ . 1 . 2]" 1 1005 1 52 MET HA 1 55 ILE H . . 3.520 3.239 2.962 3.489 . 0 0 "[ . 1 . 2]" 1 1006 1 52 MET HA 1 55 ILE HB . . 4.580 2.704 2.181 3.112 . 0 0 "[ . 1 . 2]" 1 1007 1 52 MET HA 1 55 ILE MD . . 3.950 2.578 2.153 3.179 . 0 0 "[ . 1 . 2]" 1 1008 1 52 MET HA 1 55 ILE MG . . 4.710 4.156 3.620 4.564 . 0 0 "[ . 1 . 2]" 1 1009 1 52 MET HA 1 56 ASP H . . 4.530 3.989 3.718 4.458 . 0 0 "[ . 1 . 2]" 1 1010 1 52 MET HA 1 63 ILE MD . . 3.670 3.001 2.657 3.416 . 0 0 "[ . 1 . 2]" 1 1011 1 52 MET QB 1 53 ASN H . . 3.280 3.047 2.822 3.169 . 0 0 "[ . 1 . 2]" 1 1012 1 52 MET ME 1 52 MET QG . . 3.320 2.363 2.195 2.429 . 0 0 "[ . 1 . 2]" 1 1013 1 52 MET ME 1 53 ASN H . . 5.500 5.348 5.204 5.500 0.000 9 0 "[ . 1 . 2]" 1 1014 1 52 MET ME 1 55 ILE H . . 5.350 5.355 5.329 5.365 0.015 13 0 "[ . 1 . 2]" 1 1015 1 52 MET ME 1 55 ILE HB . . 4.240 3.819 3.525 4.241 0.001 4 0 "[ . 1 . 2]" 1 1016 1 52 MET ME 1 62 GLN H . . 4.570 3.635 3.251 4.115 . 0 0 "[ . 1 . 2]" 1 1017 1 52 MET ME 1 62 GLN HA . . 3.440 3.237 2.768 3.444 0.004 17 0 "[ . 1 . 2]" 1 1018 1 52 MET ME 1 63 ILE H . . 3.530 3.117 2.800 3.512 . 0 0 "[ . 1 . 2]" 1 1019 1 52 MET ME 1 63 ILE MD . . 2.970 1.947 1.654 2.255 . 0 0 "[ . 1 . 2]" 1 1020 1 52 MET QG 1 53 ASN H . . 4.330 4.163 3.990 4.331 0.001 2 0 "[ . 1 . 2]" 1 1021 1 53 ASN H 1 53 ASN HB2 . . 3.110 2.119 2.057 2.229 . 0 0 "[ . 1 . 2]" 1 1022 1 53 ASN H 1 53 ASN HB3 . . 2.990 2.946 2.796 3.049 0.059 13 0 "[ . 1 . 2]" 1 1023 1 53 ASN H 1 53 ASN HD21 . . 4.450 3.938 3.544 4.131 . 0 0 "[ . 1 . 2]" 1 1024 1 53 ASN H 1 53 ASN HD22 . . 5.460 5.282 5.027 5.448 . 0 0 "[ . 1 . 2]" 1 1025 1 53 ASN H 1 54 GLU H . . 3.230 2.607 2.429 2.793 . 0 0 "[ . 1 . 2]" 1 1026 1 53 ASN HA 1 56 ASP H . . 4.080 3.435 3.099 3.844 . 0 0 "[ . 1 . 2]" 1 1027 1 53 ASN HB2 1 53 ASN HD21 . . 3.550 2.141 2.102 2.221 . 0 0 "[ . 1 . 2]" 1 1028 1 53 ASN HB2 1 53 ASN HD22 . . 3.650 3.461 3.445 3.494 . 0 0 "[ . 1 . 2]" 1 1029 1 53 ASN HB2 1 54 GLU H . . 3.780 3.466 3.207 3.781 0.001 12 0 "[ . 1 . 2]" 1 1030 1 53 ASN HB2 1 54 GLU QB . . 5.340 5.311 5.174 5.412 0.072 13 0 "[ . 1 . 2]" 1 1031 1 53 ASN HB3 1 53 ASN HD21 . . 3.490 3.279 2.998 3.467 . 0 0 "[ . 1 . 2]" 1 1032 1 53 ASN HB3 1 54 GLU H . . 3.480 2.741 2.440 3.071 . 0 0 "[ . 1 . 2]" 1 1033 1 53 ASN HB3 1 54 GLU QB . . 4.600 4.293 3.907 4.571 . 0 0 "[ . 1 . 2]" 1 1034 1 54 GLU H 1 54 GLU HB2 . . 3.580 2.918 2.269 3.574 . 0 0 "[ . 1 . 2]" 1 1035 1 54 GLU H 1 54 GLU QB . . 2.760 2.410 2.243 2.487 . 0 0 "[ . 1 . 2]" 1 1036 1 54 GLU H 1 54 GLU HB3 . . 3.580 3.089 2.290 3.570 . 0 0 "[ . 1 . 2]" 1 1037 1 54 GLU H 1 54 GLU HG2 . . 4.120 2.250 1.945 3.620 . 0 0 "[ . 1 . 2]" 1 1038 1 54 GLU H 1 54 GLU QG . . 3.500 2.218 1.933 3.372 . 0 0 "[ . 1 . 2]" 1 1039 1 54 GLU H 1 54 GLU HG3 . . 4.120 3.541 3.150 4.026 . 0 0 "[ . 1 . 2]" 1 1040 1 54 GLU H 1 55 ILE H . . 3.400 2.634 2.388 2.861 . 0 0 "[ . 1 . 2]" 1 1041 1 54 GLU H 1 55 ILE HA . . 5.450 5.190 5.014 5.351 . 0 0 "[ . 1 . 2]" 1 1042 1 54 GLU H 1 55 ILE HB . . 5.310 4.782 4.604 4.991 . 0 0 "[ . 1 . 2]" 1 1043 1 54 GLU H 1 55 ILE MD . . 4.810 4.605 4.322 4.812 0.002 17 0 "[ . 1 . 2]" 1 1044 1 54 GLU H 1 55 ILE HG13 . . 4.500 4.237 3.982 4.515 0.015 17 0 "[ . 1 . 2]" 1 1045 1 54 GLU H 1 56 ASP H . . 3.900 3.643 3.437 3.736 . 0 0 "[ . 1 . 2]" 1 1046 1 54 GLU HA 1 54 GLU HG2 . . 3.760 3.265 2.679 3.682 . 0 0 "[ . 1 . 2]" 1 1047 1 54 GLU HA 1 54 GLU HG3 . . 3.760 3.712 2.724 3.794 0.034 10 0 "[ . 1 . 2]" 1 1048 1 54 GLU QB 1 54 GLU QG . . 2.270 2.075 1.987 2.125 . 0 0 "[ . 1 . 2]" 1 1049 1 54 GLU QB 1 55 ILE H . . 3.710 2.826 2.156 3.577 . 0 0 "[ . 1 . 2]" 1 1050 1 54 GLU QB 1 55 ILE MD . . 5.280 4.242 3.699 4.864 . 0 0 "[ . 1 . 2]" 1 1051 1 54 GLU HB2 1 55 ILE H . . 4.310 3.072 2.225 4.141 . 0 0 "[ . 1 . 2]" 1 1052 1 54 GLU HB2 1 56 ASP H . . 5.500 4.938 4.387 5.505 0.005 4 0 "[ . 1 . 2]" 1 1053 1 54 GLU HB2 1 85 LEU MD2 . . 4.370 2.976 2.070 4.371 0.001 7 0 "[ . 1 . 2]" 1 1054 1 54 GLU HB3 1 55 ILE H . . 4.310 3.640 2.891 3.911 . 0 0 "[ . 1 . 2]" 1 1055 1 54 GLU HB3 1 56 ASP H . . 5.500 5.219 4.787 5.384 . 0 0 "[ . 1 . 2]" 1 1056 1 54 GLU HB3 1 85 LEU MD2 . . 4.370 3.294 1.943 4.340 . 0 0 "[ . 1 . 2]" 1 1057 1 54 GLU QG 1 55 ILE H . . 3.880 3.154 1.920 4.172 0.292 17 0 "[ . 1 . 2]" 1 1058 1 54 GLU QG 1 85 LEU MD2 . . 4.090 2.757 2.059 3.528 . 0 0 "[ . 1 . 2]" 1 1059 1 54 GLU HG2 1 85 LEU MD2 . . 4.690 3.864 3.183 4.672 . 0 0 "[ . 1 . 2]" 1 1060 1 54 GLU HG3 1 85 LEU MD2 . . 4.690 2.877 2.084 4.009 . 0 0 "[ . 1 . 2]" 1 1061 1 55 ILE H 1 55 ILE HB . . 3.200 2.446 2.366 2.491 . 0 0 "[ . 1 . 2]" 1 1062 1 55 ILE H 1 55 ILE MD . . 3.640 3.102 2.866 3.448 . 0 0 "[ . 1 . 2]" 1 1063 1 55 ILE H 1 55 ILE HG12 . . 3.800 3.574 3.417 3.799 . 0 0 "[ . 1 . 2]" 1 1064 1 55 ILE H 1 55 ILE HG13 . . 3.310 2.112 1.940 2.405 . 0 0 "[ . 1 . 2]" 1 1065 1 55 ILE H 1 55 ILE MG . . 3.800 3.718 3.707 3.736 . 0 0 "[ . 1 . 2]" 1 1066 1 55 ILE H 1 56 ASP H . . 3.080 2.510 2.237 2.780 . 0 0 "[ . 1 . 2]" 1 1067 1 55 ILE H 1 56 ASP HB2 . . 4.620 4.387 4.078 4.638 0.018 17 0 "[ . 1 . 2]" 1 1068 1 55 ILE HA 1 55 ILE MD . . 4.020 3.885 3.865 3.902 . 0 0 "[ . 1 . 2]" 1 1069 1 55 ILE HA 1 55 ILE HG12 . . 3.010 2.790 2.665 2.896 . 0 0 "[ . 1 . 2]" 1 1070 1 55 ILE HA 1 55 ILE HG13 . . 3.780 2.750 2.697 2.839 . 0 0 "[ . 1 . 2]" 1 1071 1 55 ILE HA 1 55 ILE MG . . 3.010 2.454 2.429 2.490 . 0 0 "[ . 1 . 2]" 1 1072 1 55 ILE HB 1 55 ILE MD . . 3.410 2.171 2.022 2.281 . 0 0 "[ . 1 . 2]" 1 1073 1 55 ILE HB 1 56 ASP H . . 3.520 3.207 3.093 3.363 . 0 0 "[ . 1 . 2]" 1 1074 1 55 ILE MD 1 55 ILE MG . . 2.640 2.285 2.017 2.483 . 0 0 "[ . 1 . 2]" 1 1075 1 55 ILE MD 1 56 ASP H . . 4.900 4.645 4.449 4.902 0.002 9 0 "[ . 1 . 2]" 1 1076 1 55 ILE MD 1 63 ILE HG13 . . 3.390 2.846 2.663 3.285 . 0 0 "[ . 1 . 2]" 1 1077 1 55 ILE MD 1 71 LEU QD . . 3.410 2.289 1.799 3.330 . 0 0 "[ . 1 . 2]" 1 1078 1 55 ILE MD 1 89 PHE QE . . 4.330 2.922 2.067 4.291 . 0 0 "[ . 1 . 2]" 1 1079 1 55 ILE MD 1 89 PHE HZ . . 4.820 2.995 1.981 4.797 . 0 0 "[ . 1 . 2]" 1 1080 1 55 ILE HG12 1 71 LEU HA . . 5.000 4.905 4.380 5.002 0.002 10 0 "[ . 1 . 2]" 1 1081 1 55 ILE HG13 1 55 ILE MG . . 3.350 3.188 3.159 3.224 . 0 0 "[ . 1 . 2]" 1 1082 1 55 ILE HG13 1 56 ASP H . . 4.590 4.370 4.306 4.453 . 0 0 "[ . 1 . 2]" 1 1083 1 55 ILE MG 1 56 ASP H . . 3.960 3.900 3.790 3.962 0.002 4 0 "[ . 1 . 2]" 1 1084 1 55 ILE MG 1 56 ASP HA . . 4.130 3.739 3.654 3.842 . 0 0 "[ . 1 . 2]" 1 1085 1 55 ILE MG 1 63 ILE HA . . 4.410 3.133 2.782 3.426 . 0 0 "[ . 1 . 2]" 1 1086 1 55 ILE MG 1 63 ILE MG . . 2.860 1.879 1.703 2.634 . 0 0 "[ . 1 . 2]" 1 1087 1 55 ILE MG 1 64 GLU H . . 4.260 4.095 3.539 4.263 0.003 8 0 "[ . 1 . 2]" 1 1088 1 55 ILE MG 1 67 GLU H . . 5.120 4.968 4.370 5.123 0.003 1 0 "[ . 1 . 2]" 1 1089 1 55 ILE MG 1 67 GLU HB2 . . 4.700 3.069 2.410 3.536 . 0 0 "[ . 1 . 2]" 1 1090 1 55 ILE MG 1 67 GLU QB . . 3.890 2.215 1.761 2.437 . 0 0 "[ . 1 . 2]" 1 1091 1 55 ILE MG 1 67 GLU HB3 . . 4.700 2.276 1.810 2.483 . 0 0 "[ . 1 . 2]" 1 1092 1 55 ILE MG 1 67 GLU QG . . 4.190 3.936 3.301 4.192 0.002 13 0 "[ . 1 . 2]" 1 1093 1 55 ILE MG 1 68 PHE H . . 4.390 3.946 3.505 4.364 . 0 0 "[ . 1 . 2]" 1 1094 1 55 ILE MG 1 68 PHE HB2 . . 5.210 4.376 3.976 4.807 . 0 0 "[ . 1 . 2]" 1 1095 1 55 ILE MG 1 71 LEU H . . 4.720 4.412 3.921 4.721 0.001 9 0 "[ . 1 . 2]" 1 1096 1 55 ILE MG 1 71 LEU QD . . 3.800 2.156 1.698 3.808 0.008 13 0 "[ . 1 . 2]" 1 1097 1 56 ASP H 1 56 ASP HB2 . . 3.140 2.130 2.090 2.155 . 0 0 "[ . 1 . 2]" 1 1098 1 56 ASP H 1 56 ASP HB3 . . 3.590 3.425 3.398 3.443 . 0 0 "[ . 1 . 2]" 1 1099 1 56 ASP H 1 57 VAL MG2 . . 4.970 4.828 4.682 4.954 . 0 0 "[ . 1 . 2]" 1 1100 1 56 ASP HA 1 57 VAL H . . 3.150 2.264 2.253 2.272 . 0 0 "[ . 1 . 2]" 1 1101 1 56 ASP HA 1 57 VAL HB . . 4.760 4.531 4.442 4.655 . 0 0 "[ . 1 . 2]" 1 1102 1 56 ASP HA 1 57 VAL MG2 . . 4.420 3.707 3.487 3.873 . 0 0 "[ . 1 . 2]" 1 1103 1 56 ASP HA 1 58 ASP H . . 3.960 3.628 3.510 3.781 . 0 0 "[ . 1 . 2]" 1 1104 1 56 ASP HA 1 59 GLY H . . 4.900 3.657 3.587 3.723 . 0 0 "[ . 1 . 2]" 1 1105 1 56 ASP HB2 1 57 VAL H . . 4.610 4.463 4.424 4.526 . 0 0 "[ . 1 . 2]" 1 1106 1 56 ASP HB2 1 57 VAL HA . . 5.500 5.264 5.229 5.350 . 0 0 "[ . 1 . 2]" 1 1107 1 56 ASP HB3 1 57 VAL H . . 3.790 3.468 3.392 3.591 . 0 0 "[ . 1 . 2]" 1 1108 1 56 ASP HB3 1 58 ASP H . . 4.300 3.242 3.127 3.458 . 0 0 "[ . 1 . 2]" 1 1109 1 56 ASP HB3 1 59 GLY H . . 4.880 1.990 1.948 2.351 . 0 0 "[ . 1 . 2]" 1 1110 1 56 ASP HB3 1 61 HIS H . . 4.750 3.854 3.672 4.279 . 0 0 "[ . 1 . 2]" 1 1111 1 57 VAL H 1 57 VAL HB . . 3.390 2.327 2.255 2.429 . 0 0 "[ . 1 . 2]" 1 1112 1 57 VAL H 1 57 VAL MG1 . . 3.820 3.701 3.651 3.746 . 0 0 "[ . 1 . 2]" 1 1113 1 57 VAL H 1 57 VAL MG2 . . 3.250 2.525 2.299 2.716 . 0 0 "[ . 1 . 2]" 1 1114 1 57 VAL H 1 58 ASP H . . 3.000 2.109 2.104 2.119 . 0 0 "[ . 1 . 2]" 1 1115 1 57 VAL H 1 59 GLY H . . 4.760 3.334 3.238 3.409 . 0 0 "[ . 1 . 2]" 1 1116 1 57 VAL HA 1 57 VAL MG1 . . 3.160 2.468 2.375 2.562 . 0 0 "[ . 1 . 2]" 1 1117 1 57 VAL HA 1 57 VAL MG2 . . 3.120 2.351 2.269 2.444 . 0 0 "[ . 1 . 2]" 1 1118 1 57 VAL HA 1 59 GLY H . . 4.970 4.600 4.490 4.684 . 0 0 "[ . 1 . 2]" 1 1119 1 57 VAL HB 1 58 ASP H . . 3.210 3.002 2.827 3.105 . 0 0 "[ . 1 . 2]" 1 1120 1 57 VAL HB 1 58 ASP HB3 . . 4.830 4.125 3.996 4.216 . 0 0 "[ . 1 . 2]" 1 1121 1 57 VAL HB 1 59 GLY H . . 5.070 4.893 4.738 4.993 . 0 0 "[ . 1 . 2]" 1 1122 1 57 VAL MG1 1 58 ASP H . . 3.880 3.663 3.525 3.851 . 0 0 "[ . 1 . 2]" 1 1123 1 57 VAL MG1 1 58 ASP HA . . 4.740 3.813 3.660 3.990 . 0 0 "[ . 1 . 2]" 1 1124 1 57 VAL MG1 1 59 GLY H . . 5.330 5.187 5.096 5.302 . 0 0 "[ . 1 . 2]" 1 1125 1 57 VAL MG2 1 58 ASP H . . 4.100 3.994 3.885 4.087 . 0 0 "[ . 1 . 2]" 1 1126 1 57 VAL MG2 1 59 GLY H . . 5.380 5.248 5.126 5.349 . 0 0 "[ . 1 . 2]" 1 1127 1 57 VAL MG2 1 67 GLU HG2 . . 4.090 2.345 1.787 2.727 . 0 0 "[ . 1 . 2]" 1 1128 1 57 VAL MG2 1 67 GLU QG . . 3.400 2.317 1.777 2.678 . 0 0 "[ . 1 . 2]" 1 1129 1 57 VAL MG2 1 67 GLU HG3 . . 4.090 3.642 2.924 4.043 . 0 0 "[ . 1 . 2]" 1 1130 1 58 ASP H 1 58 ASP HB2 . . 3.680 3.664 3.622 3.686 0.006 20 0 "[ . 1 . 2]" 1 1131 1 58 ASP H 1 58 ASP HB3 . . 3.340 3.050 2.935 3.130 . 0 0 "[ . 1 . 2]" 1 1132 1 58 ASP H 1 59 GLY H . . 3.100 1.964 1.914 2.053 . 0 0 "[ . 1 . 2]" 1 1133 1 58 ASP H 1 59 GLY QA . . 4.520 3.928 3.883 4.004 . 0 0 "[ . 1 . 2]" 1 1134 1 58 ASP H 1 60 ASN H . . 4.330 3.721 3.582 3.862 . 0 0 "[ . 1 . 2]" 1 1135 1 58 ASP H 1 61 HIS H . . 5.500 5.428 5.230 5.507 0.007 20 0 "[ . 1 . 2]" 1 1136 1 58 ASP HA 1 59 GLY H . . 3.650 3.569 3.560 3.571 . 0 0 "[ . 1 . 2]" 1 1137 1 58 ASP HB2 1 59 GLY H . . 4.550 4.008 3.949 4.092 . 0 0 "[ . 1 . 2]" 1 1138 1 58 ASP HB2 1 60 ASN H . . 4.710 4.571 4.293 4.718 0.008 15 0 "[ . 1 . 2]" 1 1139 1 58 ASP HB3 1 59 GLY H . . 4.280 4.239 4.200 4.271 . 0 0 "[ . 1 . 2]" 1 1140 1 59 GLY H 1 60 ASN H . . 2.990 2.412 2.303 2.524 . 0 0 "[ . 1 . 2]" 1 1141 1 59 GLY H 1 61 HIS H . . 4.070 3.917 3.844 3.965 . 0 0 "[ . 1 . 2]" 1 1142 1 59 GLY QA 1 61 HIS H . . 4.620 3.077 2.918 3.235 . 0 0 "[ . 1 . 2]" 1 1143 1 59 GLY HA2 1 61 HIS H . . 5.250 3.139 2.977 3.302 . 0 0 "[ . 1 . 2]" 1 1144 1 59 GLY HA3 1 61 HIS H . . 5.250 4.429 4.195 4.634 . 0 0 "[ . 1 . 2]" 1 1145 1 60 ASN H 1 60 ASN HB2 . . 3.830 3.654 3.603 3.716 . 0 0 "[ . 1 . 2]" 1 1146 1 60 ASN H 1 60 ASN QB . . 3.210 2.706 2.618 2.809 . 0 0 "[ . 1 . 2]" 1 1147 1 60 ASN H 1 60 ASN HB3 . . 3.830 2.789 2.688 2.907 . 0 0 "[ . 1 . 2]" 1 1148 1 60 ASN H 1 60 ASN HD22 . . 4.740 4.386 4.298 4.526 . 0 0 "[ . 1 . 2]" 1 1149 1 60 ASN H 1 61 HIS H . . 3.040 2.146 1.897 2.377 . 0 0 "[ . 1 . 2]" 1 1150 1 60 ASN H 1 61 HIS HA . . 4.580 4.295 4.081 4.464 . 0 0 "[ . 1 . 2]" 1 1151 1 60 ASN H 1 62 GLN H . . 3.950 3.524 3.436 3.663 . 0 0 "[ . 1 . 2]" 1 1152 1 60 ASN HA 1 60 ASN HD21 . . 4.840 4.641 4.609 4.651 . 0 0 "[ . 1 . 2]" 1 1153 1 60 ASN HA 1 62 GLN H . . 5.200 5.072 4.894 5.207 0.007 17 0 "[ . 1 . 2]" 1 1154 1 60 ASN QB 1 61 HIS H . . 4.520 3.834 3.749 3.983 . 0 0 "[ . 1 . 2]" 1 1155 1 60 ASN HD21 1 62 GLN HB2 . . 4.250 3.052 2.808 3.272 . 0 0 "[ . 1 . 2]" 1 1156 1 60 ASN HD21 1 62 GLN HE21 . . 4.920 2.673 2.146 3.169 . 0 0 "[ . 1 . 2]" 1 1157 1 60 ASN HD21 1 62 GLN QE . . 4.230 2.637 2.118 3.100 . 0 0 "[ . 1 . 2]" 1 1158 1 60 ASN HD21 1 62 GLN HE22 . . 4.920 4.041 3.272 4.528 . 0 0 "[ . 1 . 2]" 1 1159 1 60 ASN HD21 1 62 GLN HG2 . . 5.500 5.495 5.429 5.507 0.007 11 0 "[ . 1 . 2]" 1 1160 1 60 ASN HD21 1 62 GLN HG3 . . 4.570 4.092 3.948 4.310 . 0 0 "[ . 1 . 2]" 1 1161 1 60 ASN HD22 1 62 GLN H . . 4.530 3.749 3.465 4.111 . 0 0 "[ . 1 . 2]" 1 1162 1 60 ASN HD22 1 62 GLN HB2 . . 4.350 1.968 1.948 2.032 . 0 0 "[ . 1 . 2]" 1 1163 1 60 ASN HD22 1 62 GLN HE21 . . 4.940 2.901 2.229 3.737 . 0 0 "[ . 1 . 2]" 1 1164 1 60 ASN HD22 1 62 GLN QE . . 4.350 2.859 2.212 3.628 . 0 0 "[ . 1 . 2]" 1 1165 1 60 ASN HD22 1 62 GLN HE22 . . 4.940 4.389 3.714 4.911 . 0 0 "[ . 1 . 2]" 1 1166 1 60 ASN HD22 1 62 GLN HG2 . . 5.200 4.915 4.798 5.014 . 0 0 "[ . 1 . 2]" 1 1167 1 60 ASN HD22 1 62 GLN HG3 . . 4.910 3.886 3.625 4.109 . 0 0 "[ . 1 . 2]" 1 1168 1 61 HIS H 1 61 HIS HA . . 2.840 2.205 2.192 2.218 . 0 0 "[ . 1 . 2]" 1 1169 1 61 HIS H 1 61 HIS QB . . 3.650 3.323 2.887 3.503 . 0 0 "[ . 1 . 2]" 1 1170 1 61 HIS H 1 62 GLN H . . 3.070 2.566 2.352 2.923 . 0 0 "[ . 1 . 2]" 1 1171 1 61 HIS H 1 62 GLN HA . . 5.350 5.116 4.956 5.374 0.024 11 0 "[ . 1 . 2]" 1 1172 1 61 HIS HA 1 62 GLN H . . 3.280 2.773 2.650 2.883 . 0 0 "[ . 1 . 2]" 1 1173 1 61 HIS HA 1 62 GLN HA . . 4.460 4.297 4.271 4.316 . 0 0 "[ . 1 . 2]" 1 1174 1 61 HIS QB 1 62 GLN H . . 4.110 3.992 3.944 4.104 . 0 0 "[ . 1 . 2]" 1 1175 1 61 HIS HB2 1 62 GLN H . . 4.850 4.413 4.276 4.662 . 0 0 "[ . 1 . 2]" 1 1176 1 61 HIS HB3 1 62 GLN H . . 4.850 4.576 4.280 4.700 . 0 0 "[ . 1 . 2]" 1 1177 1 62 GLN H 1 62 GLN HB2 . . 3.540 2.890 2.783 2.946 . 0 0 "[ . 1 . 2]" 1 1178 1 62 GLN H 1 62 GLN HB3 . . 3.910 3.895 3.830 3.925 0.015 1 0 "[ . 1 . 2]" 1 1179 1 62 GLN H 1 62 GLN HG2 . . 4.250 3.967 3.788 4.192 . 0 0 "[ . 1 . 2]" 1 1180 1 62 GLN H 1 62 GLN HG3 . . 3.710 3.432 3.191 3.709 . 0 0 "[ . 1 . 2]" 1 1181 1 62 GLN H 1 63 ILE H . . 4.440 4.106 3.976 4.297 . 0 0 "[ . 1 . 2]" 1 1182 1 62 GLN H 1 63 ILE HA . . 4.800 4.448 4.352 4.540 . 0 0 "[ . 1 . 2]" 1 1183 1 62 GLN H 1 63 ILE HG12 . . 5.190 4.854 4.422 5.191 0.001 18 0 "[ . 1 . 2]" 1 1184 1 62 GLN HA 1 62 GLN HG2 . . 4.140 2.344 2.201 2.509 . 0 0 "[ . 1 . 2]" 1 1185 1 62 GLN HA 1 63 ILE H . . 3.220 2.217 2.202 2.295 . 0 0 "[ . 1 . 2]" 1 1186 1 62 GLN HB2 1 62 GLN QE . . 4.440 2.340 1.941 2.924 . 0 0 "[ . 1 . 2]" 1 1187 1 62 GLN HB2 1 62 GLN HE22 . . 5.050 3.788 3.527 4.103 . 0 0 "[ . 1 . 2]" 1 1188 1 62 GLN HB2 1 63 ILE H . . 4.460 4.326 4.032 4.454 . 0 0 "[ . 1 . 2]" 1 1189 1 62 GLN HB2 1 63 ILE HA . . 5.250 5.036 4.834 5.175 . 0 0 "[ . 1 . 2]" 1 1190 1 62 GLN HB3 1 63 ILE H . . 3.620 3.439 3.011 3.570 . 0 0 "[ . 1 . 2]" 1 1191 1 62 GLN QE 1 62 GLN HG3 . . 3.310 2.479 2.186 2.734 . 0 0 "[ . 1 . 2]" 1 1192 1 62 GLN HE22 1 62 GLN HG3 . . 3.920 3.627 3.488 3.759 . 0 0 "[ . 1 . 2]" 1 1193 1 62 GLN HG2 1 63 ILE H . . 4.450 4.363 4.221 4.450 0.000 17 0 "[ . 1 . 2]" 1 1194 1 62 GLN HG3 1 63 ILE H . . 5.400 5.307 5.128 5.385 . 0 0 "[ . 1 . 2]" 1 1195 1 63 ILE H 1 63 ILE HB . . 3.560 2.497 2.354 2.614 . 0 0 "[ . 1 . 2]" 1 1196 1 63 ILE H 1 63 ILE MD . . 3.640 2.865 2.377 3.154 . 0 0 "[ . 1 . 2]" 1 1197 1 63 ILE H 1 63 ILE HG12 . . 3.640 2.451 2.109 2.679 . 0 0 "[ . 1 . 2]" 1 1198 1 63 ILE H 1 63 ILE HG13 . . 4.050 3.873 3.579 4.053 0.003 1 0 "[ . 1 . 2]" 1 1199 1 63 ILE H 1 63 ILE MG . . 4.140 3.766 3.712 3.826 . 0 0 "[ . 1 . 2]" 1 1200 1 63 ILE H 1 64 GLU H . . 4.840 4.447 4.369 4.570 . 0 0 "[ . 1 . 2]" 1 1201 1 63 ILE HA 1 63 ILE MD . . 4.160 1.919 1.892 1.977 . 0 0 "[ . 1 . 2]" 1 1202 1 63 ILE HA 1 63 ILE MG . . 3.540 2.305 2.170 2.442 . 0 0 "[ . 1 . 2]" 1 1203 1 63 ILE HA 1 64 GLU H . . 2.880 2.182 2.176 2.217 . 0 0 "[ . 1 . 2]" 1 1204 1 63 ILE HA 1 67 GLU H . . 5.500 5.092 4.730 5.290 . 0 0 "[ . 1 . 2]" 1 1205 1 63 ILE HB 1 63 ILE MD . . 3.710 3.182 3.177 3.196 . 0 0 "[ . 1 . 2]" 1 1206 1 63 ILE HB 1 64 GLU H . . 4.430 4.310 4.151 4.393 . 0 0 "[ . 1 . 2]" 1 1207 1 63 ILE MD 1 63 ILE MG . . 2.860 2.284 2.090 2.396 . 0 0 "[ . 1 . 2]" 1 1208 1 63 ILE MD 1 64 GLU H . . 4.010 3.618 3.359 3.799 . 0 0 "[ . 1 . 2]" 1 1209 1 63 ILE MD 1 67 GLU QB . . 4.860 3.105 2.641 3.391 . 0 0 "[ . 1 . 2]" 1 1210 1 63 ILE MD 1 67 GLU QG . . 5.130 4.500 4.063 4.826 . 0 0 "[ . 1 . 2]" 1 1211 1 63 ILE HG13 1 64 GLU H . . 5.500 5.486 5.234 5.513 0.013 8 0 "[ . 1 . 2]" 1 1212 1 63 ILE MG 1 64 GLU H . . 3.720 2.830 2.521 3.016 . 0 0 "[ . 1 . 2]" 1 1213 1 63 ILE MG 1 65 PHE HA . . 5.190 4.557 4.360 4.770 . 0 0 "[ . 1 . 2]" 1 1214 1 63 ILE MG 1 66 SER H . . 5.500 5.294 5.068 5.500 0.000 9 0 "[ . 1 . 2]" 1 1215 1 63 ILE MG 1 67 GLU H . . 4.360 4.130 3.860 4.312 . 0 0 "[ . 1 . 2]" 1 1216 1 63 ILE MG 1 67 GLU HA . . 4.800 4.568 4.175 4.799 . 0 0 "[ . 1 . 2]" 1 1217 1 63 ILE MG 1 67 GLU HB2 . . 3.660 2.362 1.952 2.715 . 0 0 "[ . 1 . 2]" 1 1218 1 63 ILE MG 1 67 GLU HB3 . . 3.660 2.951 2.333 3.316 . 0 0 "[ . 1 . 2]" 1 1219 1 63 ILE MG 1 68 PHE H . . 3.820 2.610 2.173 3.155 . 0 0 "[ . 1 . 2]" 1 1220 1 63 ILE MG 1 68 PHE HA . . 4.000 2.748 2.357 3.179 . 0 0 "[ . 1 . 2]" 1 1221 1 63 ILE MG 1 68 PHE HB2 . . 4.210 2.201 1.921 2.607 . 0 0 "[ . 1 . 2]" 1 1222 1 63 ILE MG 1 68 PHE HB3 . . 4.300 3.668 3.334 4.057 . 0 0 "[ . 1 . 2]" 1 1223 1 63 ILE MG 1 68 PHE QD . . 3.820 2.229 1.806 2.604 . 0 0 "[ . 1 . 2]" 1 1224 1 63 ILE MG 1 68 PHE QE . . 4.400 4.003 3.472 4.400 . 0 0 "[ . 1 . 2]" 1 1225 1 64 GLU H 1 64 GLU HB2 . . 3.610 2.233 2.158 2.356 . 0 0 "[ . 1 . 2]" 1 1226 1 64 GLU H 1 64 GLU QB . . 3.150 2.196 2.125 2.321 . 0 0 "[ . 1 . 2]" 1 1227 1 64 GLU H 1 64 GLU HB3 . . 3.610 3.299 2.907 3.497 . 0 0 "[ . 1 . 2]" 1 1228 1 64 GLU H 1 64 GLU HG2 . . 4.600 4.502 4.390 4.598 . 0 0 "[ . 1 . 2]" 1 1229 1 64 GLU H 1 64 GLU HG3 . . 4.090 3.659 3.333 4.089 . 0 0 "[ . 1 . 2]" 1 1230 1 64 GLU H 1 65 PHE H . . 5.180 4.578 4.518 4.641 . 0 0 "[ . 1 . 2]" 1 1231 1 64 GLU H 1 67 GLU H . . 4.360 3.252 2.861 3.469 . 0 0 "[ . 1 . 2]" 1 1232 1 64 GLU H 1 67 GLU HA . . 5.330 4.892 4.527 5.121 . 0 0 "[ . 1 . 2]" 1 1233 1 64 GLU H 1 67 GLU HB2 . . 3.910 2.087 1.947 2.386 . 0 0 "[ . 1 . 2]" 1 1234 1 64 GLU H 1 67 GLU QB . . 3.400 2.074 1.934 2.365 . 0 0 "[ . 1 . 2]" 1 1235 1 64 GLU H 1 67 GLU HB3 . . 3.910 3.594 3.325 3.875 . 0 0 "[ . 1 . 2]" 1 1236 1 64 GLU H 1 67 GLU HG2 . . 4.500 4.205 3.605 4.466 . 0 0 "[ . 1 . 2]" 1 1237 1 64 GLU H 1 67 GLU QG . . 3.720 2.954 2.034 3.327 . 0 0 "[ . 1 . 2]" 1 1238 1 64 GLU H 1 67 GLU HG3 . . 4.500 3.028 2.046 3.444 . 0 0 "[ . 1 . 2]" 1 1239 1 64 GLU H 1 68 PHE H . . 4.960 3.711 3.325 3.984 . 0 0 "[ . 1 . 2]" 1 1240 1 64 GLU H 1 68 PHE HB2 . . 5.500 4.682 4.392 4.966 . 0 0 "[ . 1 . 2]" 1 1241 1 64 GLU HA 1 64 GLU HG3 . . 4.150 2.282 2.229 2.454 . 0 0 "[ . 1 . 2]" 1 1242 1 64 GLU HA 1 65 PHE H . . 3.580 2.479 2.393 2.628 . 0 0 "[ . 1 . 2]" 1 1243 1 64 GLU QB 1 65 PHE H . . 3.480 2.726 2.247 3.244 . 0 0 "[ . 1 . 2]" 1 1244 1 64 GLU QB 1 66 SER H . . 3.820 2.246 2.171 2.344 . 0 0 "[ . 1 . 2]" 1 1245 1 64 GLU QB 1 67 GLU H . . 4.630 2.582 2.176 2.959 . 0 0 "[ . 1 . 2]" 1 1246 1 64 GLU HB2 1 66 SER H . . 4.620 3.582 3.285 4.035 . 0 0 "[ . 1 . 2]" 1 1247 1 64 GLU HB3 1 66 SER H . . 4.620 2.272 2.200 2.384 . 0 0 "[ . 1 . 2]" 1 1248 1 64 GLU HG2 1 65 PHE H . . 3.440 3.010 2.121 3.442 0.002 15 0 "[ . 1 . 2]" 1 1249 1 64 GLU HG3 1 65 PHE H . . 4.090 3.875 3.277 4.090 . 0 0 "[ . 1 . 2]" 1 1250 1 65 PHE H 1 65 PHE HB2 . . 3.500 2.142 1.978 2.270 . 0 0 "[ . 1 . 2]" 1 1251 1 65 PHE H 1 65 PHE HB3 . . 3.500 2.602 2.435 2.860 . 0 0 "[ . 1 . 2]" 1 1252 1 65 PHE H 1 65 PHE QD . . 4.350 3.954 3.774 4.053 . 0 0 "[ . 1 . 2]" 1 1253 1 65 PHE H 1 66 SER H . . 3.980 2.749 2.568 2.880 . 0 0 "[ . 1 . 2]" 1 1254 1 65 PHE H 1 67 GLU H . . 5.490 4.421 4.163 4.716 . 0 0 "[ . 1 . 2]" 1 1255 1 65 PHE H 1 68 PHE HB3 . . 5.500 5.417 5.217 5.503 0.003 20 0 "[ . 1 . 2]" 1 1256 1 65 PHE HA 1 65 PHE QD . . 3.650 2.534 1.997 3.076 . 0 0 "[ . 1 . 2]" 1 1257 1 65 PHE HA 1 68 PHE H . . 4.380 3.805 3.569 3.972 . 0 0 "[ . 1 . 2]" 1 1258 1 65 PHE HA 1 68 PHE HB2 . . 4.110 3.402 3.106 3.715 . 0 0 "[ . 1 . 2]" 1 1259 1 65 PHE HA 1 68 PHE HB3 . . 4.420 3.050 2.679 3.208 . 0 0 "[ . 1 . 2]" 1 1260 1 65 PHE HA 1 69 LEU H . . 4.460 4.112 3.758 4.465 0.005 4 0 "[ . 1 . 2]" 1 1261 1 65 PHE QB 1 66 SER H . . 3.400 2.855 2.691 2.965 . 0 0 "[ . 1 . 2]" 1 1262 1 65 PHE HB2 1 66 SER H . . 4.070 3.906 3.670 4.070 . 0 0 "[ . 1 . 2]" 1 1263 1 65 PHE HB3 1 66 SER H . . 4.070 2.937 2.757 3.093 . 0 0 "[ . 1 . 2]" 1 1264 1 65 PHE QD 1 66 SER H . . 4.510 4.367 4.201 4.513 0.003 10 0 "[ . 1 . 2]" 1 1265 1 65 PHE QE 1 69 LEU QB . . 5.340 4.981 4.577 5.330 . 0 0 "[ . 1 . 2]" 1 1266 1 65 PHE QE 1 69 LEU QD . . 3.980 2.459 1.961 3.015 . 0 0 "[ . 1 . 2]" 1 1267 1 65 PHE HZ 1 69 LEU MD1 . . 4.760 3.657 3.048 4.328 . 0 0 "[ . 1 . 2]" 1 1268 1 65 PHE HZ 1 69 LEU QD . . 4.040 3.266 2.768 3.861 . 0 0 "[ . 1 . 2]" 1 1269 1 65 PHE HZ 1 69 LEU MD2 . . 4.760 3.730 3.100 4.622 . 0 0 "[ . 1 . 2]" 1 1270 1 66 SER H 1 66 SER HB2 . . 3.690 2.623 2.152 3.590 . 0 0 "[ . 1 . 2]" 1 1271 1 66 SER H 1 66 SER QB . . 3.070 2.353 2.121 2.743 . 0 0 "[ . 1 . 2]" 1 1272 1 66 SER H 1 66 SER HB3 . . 3.690 3.041 2.178 3.603 . 0 0 "[ . 1 . 2]" 1 1273 1 66 SER H 1 67 GLU H . . 3.760 2.428 2.262 2.574 . 0 0 "[ . 1 . 2]" 1 1274 1 66 SER H 1 68 PHE H . . 4.940 3.994 3.573 4.326 . 0 0 "[ . 1 . 2]" 1 1275 1 66 SER H 1 69 LEU QD . . 5.440 4.557 4.331 4.876 . 0 0 "[ . 1 . 2]" 1 1276 1 66 SER HA 1 69 LEU H . . 4.430 3.652 3.289 3.830 . 0 0 "[ . 1 . 2]" 1 1277 1 66 SER HA 1 69 LEU HB2 . . 4.740 2.928 2.697 3.096 . 0 0 "[ . 1 . 2]" 1 1278 1 66 SER HA 1 69 LEU QB . . 4.140 2.884 2.668 3.049 . 0 0 "[ . 1 . 2]" 1 1279 1 66 SER HA 1 69 LEU HB3 . . 4.740 4.335 4.145 4.574 . 0 0 "[ . 1 . 2]" 1 1280 1 66 SER HA 1 69 LEU QD . . 5.050 3.447 3.106 3.679 . 0 0 "[ . 1 . 2]" 1 1281 1 66 SER HA 1 70 ALA H . . 5.230 4.301 3.744 4.767 . 0 0 "[ . 1 . 2]" 1 1282 1 66 SER HB2 1 67 GLU H . . 4.310 3.203 2.422 4.131 . 0 0 "[ . 1 . 2]" 1 1283 1 66 SER HB3 1 67 GLU H . . 4.310 3.237 2.331 4.056 . 0 0 "[ . 1 . 2]" 1 1284 1 67 GLU H 1 67 GLU HB2 . . 3.820 2.456 2.244 2.625 . 0 0 "[ . 1 . 2]" 1 1285 1 67 GLU H 1 67 GLU QB . . 3.290 2.412 2.219 2.559 . 0 0 "[ . 1 . 2]" 1 1286 1 67 GLU H 1 67 GLU HB3 . . 3.820 3.544 3.501 3.556 . 0 0 "[ . 1 . 2]" 1 1287 1 67 GLU H 1 67 GLU HG2 . . 3.770 3.297 2.542 3.719 . 0 0 "[ . 1 . 2]" 1 1288 1 67 GLU H 1 67 GLU QG . . 3.200 2.149 1.928 2.548 . 0 0 "[ . 1 . 2]" 1 1289 1 67 GLU H 1 67 GLU HG3 . . 3.770 2.184 1.949 2.595 . 0 0 "[ . 1 . 2]" 1 1290 1 67 GLU H 1 68 PHE H . . 3.480 2.762 2.563 2.926 . 0 0 "[ . 1 . 2]" 1 1291 1 67 GLU H 1 68 PHE HB2 . . 4.790 4.676 4.428 4.786 . 0 0 "[ . 1 . 2]" 1 1292 1 67 GLU H 1 68 PHE HB3 . . 5.490 4.954 4.677 5.227 . 0 0 "[ . 1 . 2]" 1 1293 1 67 GLU H 1 69 LEU H . . 5.180 4.294 3.993 4.807 . 0 0 "[ . 1 . 2]" 1 1294 1 67 GLU HA 1 67 GLU HG2 . . 3.480 2.481 2.297 2.747 . 0 0 "[ . 1 . 2]" 1 1295 1 67 GLU HA 1 67 GLU QG . . 3.040 2.357 2.244 2.447 . 0 0 "[ . 1 . 2]" 1 1296 1 67 GLU HA 1 67 GLU HG3 . . 3.480 3.013 2.712 3.486 0.006 15 0 "[ . 1 . 2]" 1 1297 1 67 GLU HA 1 70 ALA H . . 4.190 3.259 2.936 3.660 . 0 0 "[ . 1 . 2]" 1 1298 1 67 GLU HA 1 70 ALA MB . . 3.460 2.201 1.956 2.634 . 0 0 "[ . 1 . 2]" 1 1299 1 67 GLU HA 1 71 LEU H . . 5.060 4.585 4.312 5.050 . 0 0 "[ . 1 . 2]" 1 1300 1 67 GLU QB 1 68 PHE H . . 3.690 2.487 2.245 2.905 . 0 0 "[ . 1 . 2]" 1 1301 1 67 GLU HB2 1 68 PHE H . . 4.280 2.541 2.282 2.979 . 0 0 "[ . 1 . 2]" 1 1302 1 67 GLU HB3 1 68 PHE H . . 4.280 3.562 3.297 4.032 . 0 0 "[ . 1 . 2]" 1 1303 1 67 GLU QG 1 68 PHE H . . 4.360 4.062 3.793 4.309 . 0 0 "[ . 1 . 2]" 1 1304 1 67 GLU HG2 1 68 PHE H . . 5.100 4.957 4.613 5.100 . 0 0 "[ . 1 . 2]" 1 1305 1 67 GLU HG3 1 68 PHE H . . 5.100 4.316 4.008 4.647 . 0 0 "[ . 1 . 2]" 1 1306 1 68 PHE H 1 68 PHE HB2 . . 3.550 2.120 1.976 2.308 . 0 0 "[ . 1 . 2]" 1 1307 1 68 PHE H 1 68 PHE HB3 . . 3.640 2.637 2.388 2.817 . 0 0 "[ . 1 . 2]" 1 1308 1 68 PHE H 1 68 PHE QD . . 4.100 3.936 3.734 4.062 . 0 0 "[ . 1 . 2]" 1 1309 1 68 PHE H 1 69 LEU H . . 3.540 2.875 2.610 3.009 . 0 0 "[ . 1 . 2]" 1 1310 1 68 PHE H 1 70 ALA H . . 5.030 3.918 3.563 4.322 . 0 0 "[ . 1 . 2]" 1 1311 1 68 PHE HA 1 69 LEU QD . . 4.990 4.564 4.215 4.924 . 0 0 "[ . 1 . 2]" 1 1312 1 68 PHE HA 1 71 LEU H . . 4.080 3.493 3.120 3.925 . 0 0 "[ . 1 . 2]" 1 1313 1 68 PHE HB2 1 69 LEU H . . 3.660 3.573 3.355 3.680 0.020 4 0 "[ . 1 . 2]" 1 1314 1 68 PHE HB2 1 71 LEU QD . . 5.170 4.287 3.643 4.988 . 0 0 "[ . 1 . 2]" 1 1315 1 68 PHE HB3 1 69 LEU H . . 4.130 2.325 1.950 2.607 . 0 0 "[ . 1 . 2]" 1 1316 1 68 PHE HB3 1 69 LEU QB . . 4.950 3.970 3.779 4.108 . 0 0 "[ . 1 . 2]" 1 1317 1 68 PHE HB3 1 69 LEU HG . . 5.500 4.798 4.570 5.128 . 0 0 "[ . 1 . 2]" 1 1318 1 68 PHE QD 1 69 LEU H . . 4.060 3.726 3.058 4.067 0.007 4 0 "[ . 1 . 2]" 1 1319 1 68 PHE QD 1 69 LEU HA . . 4.910 3.792 2.961 4.562 . 0 0 "[ . 1 . 2]" 1 1320 1 68 PHE HZ 1 105 LEU QD . . 4.550 2.229 1.741 2.751 . 0 0 "[ . 1 . 2]" 1 1321 1 69 LEU H 1 69 LEU HB2 . . 3.680 2.119 2.082 2.164 . 0 0 "[ . 1 . 2]" 1 1322 1 69 LEU H 1 69 LEU QB . . 3.050 2.100 2.064 2.143 . 0 0 "[ . 1 . 2]" 1 1323 1 69 LEU H 1 69 LEU HB3 . . 3.680 3.423 3.400 3.458 . 0 0 "[ . 1 . 2]" 1 1324 1 69 LEU H 1 69 LEU MD1 . . 4.500 2.106 1.933 2.307 . 0 0 "[ . 1 . 2]" 1 1325 1 69 LEU H 1 69 LEU QD . . 3.940 2.099 1.928 2.288 . 0 0 "[ . 1 . 2]" 1 1326 1 69 LEU H 1 69 LEU MD2 . . 4.500 4.057 3.804 4.191 . 0 0 "[ . 1 . 2]" 1 1327 1 69 LEU H 1 69 LEU HG . . 4.250 3.873 3.592 4.251 0.001 4 0 "[ . 1 . 2]" 1 1328 1 69 LEU H 1 70 ALA H . . 3.590 2.561 2.314 2.862 . 0 0 "[ . 1 . 2]" 1 1329 1 69 LEU H 1 70 ALA MB . . 4.480 4.121 3.921 4.408 . 0 0 "[ . 1 . 2]" 1 1330 1 69 LEU H 1 71 LEU H . . 5.030 4.120 3.779 4.634 . 0 0 "[ . 1 . 2]" 1 1331 1 69 LEU HA 1 69 LEU MD1 . . 3.800 2.740 2.306 2.970 . 0 0 "[ . 1 . 2]" 1 1332 1 69 LEU HA 1 69 LEU QD . . 3.330 2.664 2.287 2.829 . 0 0 "[ . 1 . 2]" 1 1333 1 69 LEU HA 1 69 LEU MD2 . . 3.800 3.679 3.558 3.806 0.006 4 0 "[ . 1 . 2]" 1 1334 1 69 LEU HA 1 69 LEU HG . . 4.090 2.308 2.192 2.604 . 0 0 "[ . 1 . 2]" 1 1335 1 69 LEU HA 1 71 LEU H . . 4.570 3.942 3.637 4.442 . 0 0 "[ . 1 . 2]" 1 1336 1 69 LEU HA 1 72 MET H . . 4.560 3.317 2.827 3.541 . 0 0 "[ . 1 . 2]" 1 1337 1 69 LEU HA 1 72 MET QB . . 3.860 3.074 1.984 3.684 . 0 0 "[ . 1 . 2]" 1 1338 1 69 LEU QB 1 70 ALA H . . 3.510 2.991 2.711 3.275 . 0 0 "[ . 1 . 2]" 1 1339 1 69 LEU QB 1 70 ALA HA . . 4.990 3.975 3.866 4.082 . 0 0 "[ . 1 . 2]" 1 1340 1 69 LEU QB 1 72 MET H . . 5.340 4.598 4.351 4.987 . 0 0 "[ . 1 . 2]" 1 1341 1 69 LEU QB 1 72 MET ME . . 4.590 3.725 3.387 4.161 . 0 0 "[ . 1 . 2]" 1 1342 1 69 LEU HB2 1 70 ALA H . . 4.150 3.176 2.874 3.494 . 0 0 "[ . 1 . 2]" 1 1343 1 69 LEU HB3 1 70 ALA H . . 4.150 3.651 3.323 3.958 . 0 0 "[ . 1 . 2]" 1 1344 1 69 LEU QD 1 70 ALA H . . 4.560 4.038 3.917 4.162 . 0 0 "[ . 1 . 2]" 1 1345 1 69 LEU QD 1 72 MET ME . . 3.570 2.829 2.021 3.469 . 0 0 "[ . 1 . 2]" 1 1346 1 69 LEU MD1 1 70 ALA H . . 5.310 4.250 4.146 4.399 . 0 0 "[ . 1 . 2]" 1 1347 1 69 LEU MD1 1 72 MET ME . . 4.460 2.906 2.024 3.638 . 0 0 "[ . 1 . 2]" 1 1348 1 69 LEU MD2 1 70 ALA H . . 5.310 5.052 4.733 5.267 . 0 0 "[ . 1 . 2]" 1 1349 1 69 LEU MD2 1 72 MET ME . . 4.460 4.107 3.575 4.463 0.003 4 0 "[ . 1 . 2]" 1 1350 1 69 LEU HG 1 70 ALA H . . 5.470 5.220 5.100 5.471 0.001 4 0 "[ . 1 . 2]" 1 1351 1 69 LEU HG 1 72 MET H . . 5.500 5.358 5.102 5.502 0.002 5 0 "[ . 1 . 2]" 1 1352 1 69 LEU HG 1 72 MET ME . . 4.850 2.835 2.137 3.670 . 0 0 "[ . 1 . 2]" 1 1353 1 70 ALA H 1 70 ALA MB . . 3.030 2.066 1.933 2.177 . 0 0 "[ . 1 . 2]" 1 1354 1 70 ALA H 1 71 LEU H . . 3.030 2.613 2.320 2.830 . 0 0 "[ . 1 . 2]" 1 1355 1 70 ALA H 1 71 LEU QB . . 5.010 4.651 3.939 5.075 0.065 4 0 "[ . 1 . 2]" 1 1356 1 70 ALA H 1 72 MET H . . 4.340 4.093 3.833 4.318 . 0 0 "[ . 1 . 2]" 1 1357 1 70 ALA HA 1 72 MET H . . 4.660 3.935 3.485 4.407 . 0 0 "[ . 1 . 2]" 1 1358 1 70 ALA HA 1 73 SER H . . 5.000 3.004 2.596 3.502 . 0 0 "[ . 1 . 2]" 1 1359 1 70 ALA HA 1 74 ARG H . . 4.960 4.227 3.540 4.831 . 0 0 "[ . 1 . 2]" 1 1360 1 70 ALA MB 1 71 LEU H . . 3.060 2.808 2.403 3.067 0.007 12 0 "[ . 1 . 2]" 1 1361 1 71 LEU H 1 71 LEU HB2 . . 3.630 2.821 2.488 3.522 . 0 0 "[ . 1 . 2]" 1 1362 1 71 LEU H 1 71 LEU QB . . 3.020 2.435 1.987 2.722 . 0 0 "[ . 1 . 2]" 1 1363 1 71 LEU H 1 71 LEU HB3 . . 3.630 3.146 2.008 3.541 . 0 0 "[ . 1 . 2]" 1 1364 1 71 LEU H 1 71 LEU MD1 . . 4.440 3.731 2.865 4.433 . 0 0 "[ . 1 . 2]" 1 1365 1 71 LEU H 1 71 LEU QD . . 3.880 2.662 1.926 3.130 . 0 0 "[ . 1 . 2]" 1 1366 1 71 LEU H 1 71 LEU MD2 . . 4.440 2.802 1.933 4.197 . 0 0 "[ . 1 . 2]" 1 1367 1 71 LEU H 1 71 LEU HG . . 4.120 2.470 1.947 4.289 0.169 13 0 "[ . 1 . 2]" 1 1368 1 71 LEU H 1 72 MET H . . 3.620 2.632 2.243 2.872 . 0 0 "[ . 1 . 2]" 1 1369 1 71 LEU H 1 72 MET ME . . 4.060 3.801 3.343 4.046 . 0 0 "[ . 1 . 2]" 1 1370 1 71 LEU HA 1 71 LEU MD1 . . 4.330 3.730 3.390 4.071 . 0 0 "[ . 1 . 2]" 1 1371 1 71 LEU HA 1 71 LEU QD . . 3.240 2.314 1.920 3.307 0.067 4 0 "[ . 1 . 2]" 1 1372 1 71 LEU HA 1 71 LEU MD2 . . 4.330 2.473 1.926 4.116 . 0 0 "[ . 1 . 2]" 1 1373 1 71 LEU HA 1 71 LEU HG . . 4.010 3.403 3.014 4.069 0.059 13 0 "[ . 1 . 2]" 1 1374 1 71 LEU HA 1 74 ARG H . . 4.540 3.667 2.927 4.202 . 0 0 "[ . 1 . 2]" 1 1375 1 71 LEU HA 1 74 ARG QD . . 3.920 2.856 1.977 3.921 0.001 8 0 "[ . 1 . 2]" 1 1376 1 71 LEU HA 1 74 ARG HG2 . . 4.900 3.168 2.082 4.513 . 0 0 "[ . 1 . 2]" 1 1377 1 71 LEU HA 1 74 ARG QG . . 4.180 2.548 1.978 3.415 . 0 0 "[ . 1 . 2]" 1 1378 1 71 LEU HA 1 74 ARG HG3 . . 4.900 3.314 1.998 4.752 . 0 0 "[ . 1 . 2]" 1 1379 1 71 LEU QB 1 72 MET H . . 3.670 3.044 2.517 3.563 . 0 0 "[ . 1 . 2]" 1 1380 1 71 LEU HB2 1 72 MET H . . 4.390 3.342 2.557 4.402 0.012 12 0 "[ . 1 . 2]" 1 1381 1 71 LEU HB3 1 72 MET H . . 4.390 3.920 3.290 4.295 . 0 0 "[ . 1 . 2]" 1 1382 1 71 LEU QD 1 72 MET H . . 5.120 3.707 1.954 4.254 . 0 0 "[ . 1 . 2]" 1 1383 1 71 LEU QD 1 74 ARG H . . 5.200 4.885 3.794 5.206 0.006 2 0 "[ . 1 . 2]" 1 1384 1 71 LEU QD 1 74 ARG QD . . 4.110 3.370 2.503 4.090 . 0 0 "[ . 1 . 2]" 1 1385 1 71 LEU HG 1 72 MET H . . 4.410 3.928 1.950 4.453 0.043 13 0 "[ . 1 . 2]" 1 1386 1 72 MET H 1 72 MET HB2 . . 3.710 2.294 2.065 2.596 . 0 0 "[ . 1 . 2]" 1 1387 1 72 MET H 1 72 MET QB . . 3.190 2.265 2.047 2.545 . 0 0 "[ . 1 . 2]" 1 1388 1 72 MET H 1 72 MET HB3 . . 3.710 3.516 3.354 3.669 . 0 0 "[ . 1 . 2]" 1 1389 1 72 MET H 1 72 MET ME . . 4.400 2.770 2.149 3.507 . 0 0 "[ . 1 . 2]" 1 1390 1 72 MET H 1 72 MET QG . . 3.420 2.726 2.131 3.213 . 0 0 "[ . 1 . 2]" 1 1391 1 72 MET H 1 73 SER H . . 4.170 2.359 2.122 2.652 . 0 0 "[ . 1 . 2]" 1 1392 1 72 MET HA 1 72 MET ME . . 4.710 4.146 3.733 4.717 0.007 12 0 "[ . 1 . 2]" 1 1393 1 72 MET HA 1 72 MET HG2 . . 3.140 2.735 2.542 2.866 . 0 0 "[ . 1 . 2]" 1 1394 1 72 MET HA 1 72 MET QG . . 2.750 2.375 2.221 2.588 . 0 0 "[ . 1 . 2]" 1 1395 1 72 MET HA 1 72 MET HG3 . . 3.140 2.640 2.332 3.098 . 0 0 "[ . 1 . 2]" 1 1396 1 72 MET ME 1 72 MET HG2 . . 3.670 3.250 2.894 3.382 . 0 0 "[ . 1 . 2]" 1 1397 1 72 MET ME 1 72 MET QG . . 3.160 2.206 1.957 2.396 . 0 0 "[ . 1 . 2]" 1 1398 1 72 MET ME 1 72 MET HG3 . . 3.670 2.246 1.979 2.452 . 0 0 "[ . 1 . 2]" 1 1399 1 73 SER H 1 74 ARG H . . 4.030 2.204 1.899 2.747 . 0 0 "[ . 1 . 2]" 1 1400 1 74 ARG H 1 74 ARG QB . . 3.540 2.456 2.116 2.791 . 0 0 "[ . 1 . 2]" 1 1401 1 74 ARG H 1 74 ARG QD . . 4.510 4.008 3.486 4.510 0.000 9 0 "[ . 1 . 2]" 1 1402 1 74 ARG H 1 74 ARG HG2 . . 4.420 2.626 1.960 3.901 . 0 0 "[ . 1 . 2]" 1 1403 1 74 ARG H 1 74 ARG QG . . 3.600 2.286 1.904 3.115 . 0 0 "[ . 1 . 2]" 1 1404 1 74 ARG H 1 74 ARG HG3 . . 4.420 2.922 1.983 3.828 . 0 0 "[ . 1 . 2]" 1 1405 1 74 ARG H 1 75 GLN H . . 4.350 2.721 2.236 4.386 0.036 2 0 "[ . 1 . 2]" 1 1406 1 74 ARG HA 1 74 ARG QD . . 4.860 4.189 3.276 4.695 . 0 0 "[ . 1 . 2]" 1 1407 1 74 ARG HA 1 74 ARG HG2 . . 3.910 3.142 2.123 3.863 . 0 0 "[ . 1 . 2]" 1 1408 1 74 ARG HA 1 74 ARG HG3 . . 3.910 3.471 2.755 3.799 . 0 0 "[ . 1 . 2]" 1 1409 1 74 ARG QB 1 74 ARG QD . . 2.890 2.221 2.025 2.577 . 0 0 "[ . 1 . 2]" 1 1410 1 74 ARG QB 1 75 GLN H . . 4.610 3.229 1.936 4.006 . 0 0 "[ . 1 . 2]" 1 1411 1 74 ARG QD 1 85 LEU HA . . 5.100 4.912 4.369 5.103 0.003 3 0 "[ . 1 . 2]" 1 1412 1 74 ARG QD 1 85 LEU MD2 . . 4.500 4.085 2.738 4.502 0.002 10 0 "[ . 1 . 2]" 1 1413 1 74 ARG QG 1 75 GLN H . . 4.530 3.341 1.922 4.535 0.005 20 0 "[ . 1 . 2]" 1 1414 1 75 GLN H 1 75 GLN QB . . 3.580 2.485 2.089 3.362 . 0 0 "[ . 1 . 2]" 1 1415 1 75 GLN H 1 75 GLN QG . . 3.990 3.090 2.245 3.975 . 0 0 "[ . 1 . 2]" 1 1416 1 75 GLN QE 1 86 LEU HA . . 5.100 3.638 1.993 4.911 . 0 0 "[ . 1 . 2]" 1 1417 1 75 GLN QE 1 99 LEU QD . . 4.760 3.216 1.903 4.364 . 0 0 "[ . 1 . 2]" 1 1418 1 75 GLN QE 1 100 ILE H . . 4.980 3.583 2.466 4.756 . 0 0 "[ . 1 . 2]" 1 1419 1 75 GLN QG 1 86 LEU QB . . 4.160 2.679 1.765 4.007 . 0 0 "[ . 1 . 2]" 1 1420 1 75 GLN QG 1 99 LEU HG . . 4.750 3.918 2.369 4.645 . 0 0 "[ . 1 . 2]" 1 1421 1 75 GLN QG 1 100 ILE H . . 5.010 4.204 2.863 5.002 . 0 0 "[ . 1 . 2]" 1 1422 1 77 LYS HA 1 77 LYS QD . . 4.200 3.228 1.991 4.200 0.000 16 0 "[ . 1 . 2]" 1 1423 1 77 LYS HA 1 77 LYS HG2 . . 4.230 3.189 2.119 4.233 0.003 10 0 "[ . 1 . 2]" 1 1424 1 77 LYS HA 1 77 LYS QG . . 3.550 2.635 2.100 3.416 . 0 0 "[ . 1 . 2]" 1 1425 1 77 LYS HA 1 77 LYS HG3 . . 4.230 3.135 2.202 4.211 . 0 0 "[ . 1 . 2]" 1 1426 1 77 LYS QB 1 77 LYS QD . . 3.020 2.363 2.061 2.688 . 0 0 "[ . 1 . 2]" 1 1427 1 77 LYS QB 1 77 LYS QE . . 2.890 2.385 2.035 2.890 0.000 13 0 "[ . 1 . 2]" 1 1428 1 77 LYS QB 1 78 SER H . . 3.930 3.314 2.013 3.930 0.000 17 0 "[ . 1 . 2]" 1 1429 1 77 LYS HB2 1 77 LYS QD . . 3.490 2.820 2.098 3.510 0.020 7 0 "[ . 1 . 2]" 1 1430 1 77 LYS HB2 1 78 SER H . . 4.580 3.957 2.966 4.583 0.003 3 0 "[ . 1 . 2]" 1 1431 1 77 LYS HB3 1 77 LYS QD . . 3.490 2.929 2.263 3.453 . 0 0 "[ . 1 . 2]" 1 1432 1 77 LYS HB3 1 78 SER H . . 4.580 3.743 2.028 4.589 0.009 8 0 "[ . 1 . 2]" 1 1433 1 77 LYS QD 1 78 SER QB . . 4.670 4.122 2.776 4.679 0.009 15 0 "[ . 1 . 2]" 1 1434 1 77 LYS QE 1 77 LYS HG2 . . 3.610 2.865 2.123 3.613 0.003 18 0 "[ . 1 . 2]" 1 1435 1 77 LYS QE 1 77 LYS QG . . 3.110 2.322 2.098 2.935 . 0 0 "[ . 1 . 2]" 1 1436 1 77 LYS QE 1 77 LYS HG3 . . 3.610 2.857 2.167 3.557 . 0 0 "[ . 1 . 2]" 1 1437 1 77 LYS QG 1 78 SER H . . 4.900 3.348 1.800 4.680 . 0 0 "[ . 1 . 2]" 1 1438 1 79 ASN HA 1 80 ASP HB2 . . 5.180 4.629 4.136 5.181 0.001 7 0 "[ . 1 . 2]" 1 1439 1 79 ASN HA 1 80 ASP HB3 . . 5.180 4.952 4.531 5.182 0.002 20 0 "[ . 1 . 2]" 1 1440 1 79 ASN QB 1 80 ASP H . . 4.440 3.316 1.943 4.038 . 0 0 "[ . 1 . 2]" 1 1441 1 80 ASP QB 1 81 SER H . . 4.050 3.671 2.517 4.051 0.001 10 0 "[ . 1 . 2]" 1 1442 1 80 ASP HB2 1 81 SER H . . 4.690 4.406 3.782 4.693 0.003 11 0 "[ . 1 . 2]" 1 1443 1 80 ASP HB3 1 81 SER H . . 4.690 3.966 2.551 4.624 . 0 0 "[ . 1 . 2]" 1 1444 1 81 SER H 1 81 SER HB2 . . 4.180 3.109 2.168 4.076 . 0 0 "[ . 1 . 2]" 1 1445 1 81 SER H 1 81 SER HB3 . . 4.180 3.463 2.274 4.098 . 0 0 "[ . 1 . 2]" 1 1446 1 81 SER H 1 82 GLU H . . 4.400 3.573 2.240 4.377 . 0 0 "[ . 1 . 2]" 1 1447 1 81 SER HB2 1 82 GLU H . . 4.370 3.475 2.269 4.247 . 0 0 "[ . 1 . 2]" 1 1448 1 81 SER HB3 1 82 GLU H . . 4.370 3.134 1.986 4.365 . 0 0 "[ . 1 . 2]" 1 1449 1 82 GLU H 1 82 GLU HB2 . . 4.110 2.637 2.103 3.433 . 0 0 "[ . 1 . 2]" 1 1450 1 82 GLU H 1 82 GLU QB . . 3.560 2.189 2.062 2.344 . 0 0 "[ . 1 . 2]" 1 1451 1 82 GLU H 1 82 GLU HB3 . . 4.110 2.498 2.116 2.970 . 0 0 "[ . 1 . 2]" 1 1452 1 82 GLU H 1 82 GLU HG2 . . 4.630 4.299 2.938 4.637 0.007 15 0 "[ . 1 . 2]" 1 1453 1 82 GLU H 1 82 GLU HG3 . . 4.630 4.399 4.108 4.564 . 0 0 "[ . 1 . 2]" 1 1454 1 82 GLU H 1 83 GLN H . . 4.630 4.045 1.974 4.654 0.024 15 0 "[ . 1 . 2]" 1 1455 1 82 GLU HA 1 82 GLU HG2 . . 3.620 3.499 3.071 3.672 0.052 6 0 "[ . 1 . 2]" 1 1456 1 82 GLU HA 1 82 GLU QG . . 3.160 2.656 2.055 3.263 0.103 13 0 "[ . 1 . 2]" 1 1457 1 82 GLU HA 1 82 GLU HG3 . . 3.620 2.781 2.088 3.662 0.042 13 0 "[ . 1 . 2]" 1 1458 1 82 GLU HA 1 83 GLN H . . 3.530 2.608 2.202 3.639 0.109 17 0 "[ . 1 . 2]" 1 1459 1 82 GLU QB 1 83 GLN H . . 3.940 3.323 1.839 3.969 0.029 9 0 "[ . 1 . 2]" 1 1460 1 82 GLU HB2 1 83 GLN H . . 4.620 4.058 3.252 4.621 0.001 18 0 "[ . 1 . 2]" 1 1461 1 82 GLU HB3 1 83 GLN H . . 4.620 3.732 1.847 4.581 . 0 0 "[ . 1 . 2]" 1 1462 1 82 GLU QG 1 83 GLN H . . 3.760 3.049 1.896 3.779 0.019 6 0 "[ . 1 . 2]" 1 1463 1 83 GLN H 1 83 GLN HB2 . . 3.950 2.751 2.310 3.562 . 0 0 "[ . 1 . 2]" 1 1464 1 83 GLN H 1 83 GLN QB . . 3.230 2.597 2.281 3.232 0.002 17 0 "[ . 1 . 2]" 1 1465 1 83 GLN H 1 83 GLN HB3 . . 3.950 3.564 2.504 3.952 0.002 7 0 "[ . 1 . 2]" 1 1466 1 83 GLN H 1 83 GLN QG . . 4.060 2.963 2.075 4.068 0.008 10 0 "[ . 1 . 2]" 1 1467 1 83 GLN H 1 84 GLU H . . 4.280 2.471 1.888 4.410 0.130 15 0 "[ . 1 . 2]" 1 1468 1 83 GLN HA 1 83 GLN QG . . 3.410 2.613 2.057 3.423 0.013 15 0 "[ . 1 . 2]" 1 1469 1 83 GLN HA 1 84 GLU H . . 3.500 3.207 2.772 3.598 0.098 5 0 "[ . 1 . 2]" 1 1470 1 83 GLN QB 1 83 GLN QE . . 3.930 2.899 1.902 3.720 . 0 0 "[ . 1 . 2]" 1 1471 1 83 GLN QB 1 83 GLN QG . . 2.500 2.061 1.990 2.134 . 0 0 "[ . 1 . 2]" 1 1472 1 83 GLN QB 1 84 GLU H . . 4.050 3.362 1.907 3.914 . 0 0 "[ . 1 . 2]" 1 1473 1 83 GLN HB2 1 83 GLN HE22 . . 5.170 4.791 3.295 5.207 0.037 5 0 "[ . 1 . 2]" 1 1474 1 83 GLN HB2 1 84 GLU H . . 4.780 3.664 1.925 4.404 . 0 0 "[ . 1 . 2]" 1 1475 1 83 GLN HB3 1 83 GLN HE22 . . 5.170 4.133 3.555 5.313 0.143 15 0 "[ . 1 . 2]" 1 1476 1 83 GLN HB3 1 84 GLU H . . 4.780 4.070 1.947 4.538 . 0 0 "[ . 1 . 2]" 1 1477 1 83 GLN QE 1 99 LEU QD . . 4.850 4.721 4.364 4.860 0.010 5 0 "[ . 1 . 2]" 1 1478 1 83 GLN QG 1 84 GLU H . . 4.640 4.382 2.790 4.641 0.001 16 0 "[ . 1 . 2]" 1 1479 1 84 GLU H 1 84 GLU QB . . 3.690 2.426 2.176 2.994 . 0 0 "[ . 1 . 2]" 1 1480 1 84 GLU H 1 84 GLU QG . . 4.020 2.956 1.783 4.037 0.017 4 0 "[ . 1 . 2]" 1 1481 1 84 GLU HA 1 84 GLU QG . . 3.180 2.609 2.213 3.287 0.107 10 0 "[ . 1 . 2]" 1 1482 1 84 GLU HA 1 85 LEU H . . 3.580 3.484 3.376 3.623 0.043 5 0 "[ . 1 . 2]" 1 1483 1 84 GLU QB 1 84 GLU QG . . 2.480 2.098 2.043 2.135 . 0 0 "[ . 1 . 2]" 1 1484 1 84 GLU QB 1 85 LEU H . . 3.910 3.186 2.584 3.844 . 0 0 "[ . 1 . 2]" 1 1485 1 84 GLU QG 1 85 LEU H . . 4.460 3.859 2.081 4.454 . 0 0 "[ . 1 . 2]" 1 1486 1 85 LEU H 1 85 LEU HB2 . . 3.870 2.407 2.216 2.783 . 0 0 "[ . 1 . 2]" 1 1487 1 85 LEU H 1 85 LEU QB . . 3.140 2.203 2.119 2.283 . 0 0 "[ . 1 . 2]" 1 1488 1 85 LEU H 1 85 LEU HB3 . . 3.870 2.647 2.346 3.529 . 0 0 "[ . 1 . 2]" 1 1489 1 85 LEU H 1 85 LEU MD1 . . 4.310 4.129 3.778 4.291 . 0 0 "[ . 1 . 2]" 1 1490 1 85 LEU H 1 85 LEU MD2 . . 4.200 3.851 2.278 4.206 0.006 11 0 "[ . 1 . 2]" 1 1491 1 85 LEU H 1 85 LEU HG . . 4.800 4.521 3.956 4.660 . 0 0 "[ . 1 . 2]" 1 1492 1 85 LEU H 1 86 LEU H . . 4.160 2.556 2.154 3.176 . 0 0 "[ . 1 . 2]" 1 1493 1 85 LEU HA 1 85 LEU MD1 . . 3.160 3.014 2.045 3.171 0.011 7 0 "[ . 1 . 2]" 1 1494 1 85 LEU HA 1 85 LEU MD2 . . 3.030 1.992 1.894 2.491 . 0 0 "[ . 1 . 2]" 1 1495 1 85 LEU HA 1 85 LEU HG . . 3.810 3.652 3.584 3.819 0.009 15 0 "[ . 1 . 2]" 1 1496 1 85 LEU QB 1 85 LEU MD1 . . 2.760 2.184 2.053 2.278 . 0 0 "[ . 1 . 2]" 1 1497 1 85 LEU QB 1 85 LEU MD2 . . 2.850 2.398 2.300 2.448 . 0 0 "[ . 1 . 2]" 1 1498 1 85 LEU QB 1 89 PHE QD . . 5.250 4.808 3.886 5.179 . 0 0 "[ . 1 . 2]" 1 1499 1 85 LEU HB2 1 85 LEU MD1 . . 3.350 3.185 3.154 3.212 . 0 0 "[ . 1 . 2]" 1 1500 1 85 LEU HB2 1 85 LEU MD2 . . 3.260 2.476 2.357 2.540 . 0 0 "[ . 1 . 2]" 1 1501 1 85 LEU HB3 1 85 LEU MD1 . . 3.350 2.225 2.080 2.330 . 0 0 "[ . 1 . 2]" 1 1502 1 85 LEU HB3 1 85 LEU MD2 . . 3.260 3.211 3.198 3.222 . 0 0 "[ . 1 . 2]" 1 1503 1 85 LEU MD1 1 86 LEU H . . 4.820 3.685 2.222 4.822 0.002 19 0 "[ . 1 . 2]" 1 1504 1 85 LEU MD1 1 88 ALA MB . . 3.730 3.427 2.428 3.765 0.035 15 0 "[ . 1 . 2]" 1 1505 1 85 LEU MD1 1 89 PHE QB . . 3.950 2.497 1.801 3.172 . 0 0 "[ . 1 . 2]" 1 1506 1 85 LEU MD1 1 89 PHE QE . . 3.550 3.051 2.182 3.554 0.004 15 0 "[ . 1 . 2]" 1 1507 1 85 LEU MD1 1 89 PHE HZ . . 5.190 4.241 3.198 5.087 . 0 0 "[ . 1 . 2]" 1 1508 1 85 LEU MD2 1 86 LEU H . . 4.690 4.497 4.115 4.697 0.007 10 0 "[ . 1 . 2]" 1 1509 1 85 LEU MD2 1 88 ALA MB . . 3.450 2.510 1.921 3.425 . 0 0 "[ . 1 . 2]" 1 1510 1 85 LEU MD2 1 89 PHE H . . 4.900 4.274 3.501 4.897 . 0 0 "[ . 1 . 2]" 1 1511 1 85 LEU MD2 1 89 PHE QB . . 4.580 3.903 2.546 4.550 . 0 0 "[ . 1 . 2]" 1 1512 1 85 LEU MD2 1 89 PHE QD . . 4.220 2.969 2.083 4.221 0.001 19 0 "[ . 1 . 2]" 1 1513 1 85 LEU HG 1 89 PHE QD . . 5.500 4.723 4.139 5.219 . 0 0 "[ . 1 . 2]" 1 1514 1 86 LEU H 1 86 LEU QB . . 3.480 2.213 2.001 2.738 . 0 0 "[ . 1 . 2]" 1 1515 1 86 LEU H 1 86 LEU MD1 . . 5.250 3.594 1.880 4.363 . 0 0 "[ . 1 . 2]" 1 1516 1 86 LEU H 1 86 LEU QD . . 4.310 3.132 1.873 3.710 . 0 0 "[ . 1 . 2]" 1 1517 1 86 LEU H 1 86 LEU MD2 . . 5.250 3.779 1.964 4.227 . 0 0 "[ . 1 . 2]" 1 1518 1 86 LEU H 1 86 LEU HG . . 4.550 3.920 1.977 4.605 0.055 3 0 "[ . 1 . 2]" 1 1519 1 86 LEU HA 1 86 LEU MD1 . . 3.980 3.431 2.254 3.982 0.002 12 0 "[ . 1 . 2]" 1 1520 1 86 LEU HA 1 86 LEU QD . . 3.490 2.540 1.978 3.411 . 0 0 "[ . 1 . 2]" 1 1521 1 86 LEU HA 1 86 LEU MD2 . . 3.980 2.845 1.989 3.987 0.007 2 0 "[ . 1 . 2]" 1 1522 1 86 LEU QB 1 86 LEU MD1 . . 3.190 2.175 1.984 2.443 . 0 0 "[ . 1 . 2]" 1 1523 1 86 LEU QB 1 86 LEU QD . . 2.780 1.948 1.798 2.045 . 0 0 "[ . 1 . 2]" 1 1524 1 86 LEU QB 1 86 LEU MD2 . . 3.190 2.246 1.929 2.551 . 0 0 "[ . 1 . 2]" 1 1525 1 86 LEU QB 1 87 GLU H . . 4.410 2.945 2.151 3.771 . 0 0 "[ . 1 . 2]" 1 1526 1 86 LEU QB 1 87 GLU QG . . 4.060 3.784 3.049 4.181 0.121 14 0 "[ . 1 . 2]" 1 1527 1 86 LEU QB 1 98 GLY QA . . 5.340 4.795 3.042 5.354 0.014 15 0 "[ . 1 . 2]" 1 1528 1 86 LEU QD 1 87 GLU H . . 4.630 2.589 1.864 3.348 . 0 0 "[ . 1 . 2]" 1 1529 1 86 LEU QD 1 87 GLU HA . . 4.690 2.682 2.094 4.699 0.009 6 0 "[ . 1 . 2]" 1 1530 1 86 LEU QD 1 87 GLU QG . . 4.300 2.689 1.632 4.304 0.004 10 0 "[ . 1 . 2]" 1 1531 1 86 LEU QD 1 98 GLY H . . 5.440 4.445 3.883 5.442 0.002 12 0 "[ . 1 . 2]" 1 1532 1 86 LEU QD 1 98 GLY QA . . 5.050 2.585 1.957 3.168 . 0 0 "[ . 1 . 2]" 1 1533 1 86 LEU HG 1 98 GLY QA . . 5.340 4.540 3.548 5.295 . 0 0 "[ . 1 . 2]" 1 1534 1 87 GLU H 1 87 GLU HB2 . . 3.940 2.883 2.205 3.617 . 0 0 "[ . 1 . 2]" 1 1535 1 87 GLU H 1 87 GLU HB3 . . 3.940 3.286 2.535 3.618 . 0 0 "[ . 1 . 2]" 1 1536 1 87 GLU H 1 87 GLU QG . . 3.680 2.061 1.865 2.799 . 0 0 "[ . 1 . 2]" 1 1537 1 87 GLU H 1 88 ALA H . . 4.360 2.617 2.284 2.877 . 0 0 "[ . 1 . 2]" 1 1538 1 87 GLU HA 1 87 GLU QG . . 3.440 2.780 2.270 3.441 0.001 19 0 "[ . 1 . 2]" 1 1539 1 87 GLU HA 1 90 LYS H . . 4.430 3.721 3.038 4.418 . 0 0 "[ . 1 . 2]" 1 1540 1 87 GLU QB 1 88 ALA H . . 4.180 3.090 2.271 3.752 . 0 0 "[ . 1 . 2]" 1 1541 1 87 GLU HB2 1 88 ALA H . . 4.770 3.236 2.293 4.051 . 0 0 "[ . 1 . 2]" 1 1542 1 87 GLU HB3 1 88 ALA H . . 4.770 4.062 3.215 4.431 . 0 0 "[ . 1 . 2]" 1 1543 1 87 GLU QG 1 88 ALA H . . 4.520 3.454 1.944 4.495 . 0 0 "[ . 1 . 2]" 1 1544 1 88 ALA H 1 88 ALA MB . . 3.590 2.156 1.943 2.268 . 0 0 "[ . 1 . 2]" 1 1545 1 88 ALA H 1 89 PHE H . . 4.290 2.389 2.107 2.804 . 0 0 "[ . 1 . 2]" 1 1546 1 88 ALA H 1 90 LYS H . . 4.800 4.024 3.624 4.724 . 0 0 "[ . 1 . 2]" 1 1547 1 88 ALA HA 1 90 LYS H . . 4.340 3.694 3.396 3.950 . 0 0 "[ . 1 . 2]" 1 1548 1 88 ALA MB 1 89 PHE H . . 4.240 2.960 2.525 3.291 . 0 0 "[ . 1 . 2]" 1 1549 1 88 ALA MB 1 89 PHE QD . . 4.620 3.141 2.288 4.370 . 0 0 "[ . 1 . 2]" 1 1550 1 89 PHE H 1 89 PHE QB . . 3.550 2.144 1.972 2.458 . 0 0 "[ . 1 . 2]" 1 1551 1 89 PHE H 1 90 LYS H . . 2.880 2.603 2.055 2.885 0.005 10 0 "[ . 1 . 2]" 1 1552 1 89 PHE HA 1 91 VAL H . . 4.700 3.349 3.044 3.751 . 0 0 "[ . 1 . 2]" 1 1553 1 89 PHE HA 1 91 VAL QG . . 4.300 2.911 2.577 3.330 . 0 0 "[ . 1 . 2]" 1 1554 1 89 PHE QB 1 90 LYS H . . 4.200 3.654 3.364 3.878 . 0 0 "[ . 1 . 2]" 1 1555 1 89 PHE QB 1 100 ILE MD . . 4.630 2.577 1.779 3.839 . 0 0 "[ . 1 . 2]" 1 1556 1 89 PHE HB2 1 90 LYS H . . 4.880 4.109 3.751 4.379 . 0 0 "[ . 1 . 2]" 1 1557 1 89 PHE HB3 1 90 LYS H . . 4.880 4.131 3.584 4.366 . 0 0 "[ . 1 . 2]" 1 1558 1 89 PHE QD 1 100 ILE MD . . 5.180 2.725 1.833 3.944 . 0 0 "[ . 1 . 2]" 1 1559 1 89 PHE QE 1 105 LEU QD . . 3.420 3.194 2.741 3.430 0.010 14 0 "[ . 1 . 2]" 1 1560 1 89 PHE HZ 1 105 LEU QD . . 4.970 4.637 3.831 4.975 0.005 10 0 "[ . 1 . 2]" 1 1561 1 90 LYS H 1 90 LYS QB . . 3.350 2.216 2.060 2.285 . 0 0 "[ . 1 . 2]" 1 1562 1 90 LYS H 1 90 LYS QD . . 4.520 4.254 3.755 4.543 0.023 8 0 "[ . 1 . 2]" 1 1563 1 90 LYS H 1 90 LYS HG2 . . 4.680 4.425 3.975 4.668 . 0 0 "[ . 1 . 2]" 1 1564 1 90 LYS H 1 90 LYS HG3 . . 4.680 4.459 4.225 4.701 0.021 5 0 "[ . 1 . 2]" 1 1565 1 90 LYS H 1 91 VAL H . . 3.900 2.335 2.212 2.585 . 0 0 "[ . 1 . 2]" 1 1566 1 90 LYS H 1 91 VAL MG1 . . 5.500 3.731 3.183 4.658 . 0 0 "[ . 1 . 2]" 1 1567 1 90 LYS H 1 91 VAL QG . . 4.710 3.636 3.072 4.421 . 0 0 "[ . 1 . 2]" 1 1568 1 90 LYS H 1 91 VAL MG2 . . 5.500 5.297 4.028 5.528 0.028 10 0 "[ . 1 . 2]" 1 1569 1 90 LYS H 1 121 LEU MD1 . . 5.500 5.069 3.511 5.555 0.055 6 0 "[ . 1 . 2]" 1 1570 1 90 LYS H 1 121 LEU MD2 . . 5.500 4.122 3.354 5.540 0.040 15 0 "[ . 1 . 2]" 1 1571 1 90 LYS HA 1 90 LYS QD . . 4.130 3.148 1.982 4.056 . 0 0 "[ . 1 . 2]" 1 1572 1 90 LYS HA 1 90 LYS HG2 . . 3.900 3.188 2.168 3.844 . 0 0 "[ . 1 . 2]" 1 1573 1 90 LYS HA 1 90 LYS QG . . 3.410 2.527 2.146 3.087 . 0 0 "[ . 1 . 2]" 1 1574 1 90 LYS HA 1 90 LYS HG3 . . 3.900 2.943 2.376 3.591 . 0 0 "[ . 1 . 2]" 1 1575 1 90 LYS HA 1 92 PHE H . . 4.300 3.639 3.266 4.302 0.002 18 0 "[ . 1 . 2]" 1 1576 1 90 LYS HA 1 93 ASP H . . 4.340 2.995 2.657 3.424 . 0 0 "[ . 1 . 2]" 1 1577 1 90 LYS HA 1 93 ASP HB2 . . 4.800 2.898 2.485 3.360 . 0 0 "[ . 1 . 2]" 1 1578 1 90 LYS HA 1 93 ASP QB . . 3.940 2.680 2.435 2.938 . 0 0 "[ . 1 . 2]" 1 1579 1 90 LYS HA 1 93 ASP HB3 . . 4.800 3.240 2.721 3.515 . 0 0 "[ . 1 . 2]" 1 1580 1 90 LYS QB 1 90 LYS HE2 . . 4.370 3.713 2.639 4.370 . 0 0 "[ . 1 . 2]" 1 1581 1 90 LYS QB 1 90 LYS HE3 . . 4.370 3.781 2.362 4.362 . 0 0 "[ . 1 . 2]" 1 1582 1 90 LYS QB 1 91 VAL H . . 3.690 3.164 2.928 3.468 . 0 0 "[ . 1 . 2]" 1 1583 1 90 LYS QB 1 93 ASP QB . . 5.340 3.860 3.375 4.284 . 0 0 "[ . 1 . 2]" 1 1584 1 90 LYS QD 1 91 VAL H . . 5.500 4.753 3.601 5.496 . 0 0 "[ . 1 . 2]" 1 1585 1 90 LYS QE 1 90 LYS QG . . 3.000 2.239 2.009 2.597 . 0 0 "[ . 1 . 2]" 1 1586 1 90 LYS HE2 1 90 LYS HG2 . . 4.000 3.092 2.047 3.793 . 0 0 "[ . 1 . 2]" 1 1587 1 90 LYS HE2 1 90 LYS HG3 . . 4.000 3.096 2.105 4.064 0.064 11 0 "[ . 1 . 2]" 1 1588 1 90 LYS HE3 1 90 LYS HG2 . . 4.000 3.224 2.123 4.001 0.001 19 0 "[ . 1 . 2]" 1 1589 1 90 LYS HE3 1 90 LYS HG3 . . 4.000 3.380 2.510 4.004 0.004 4 0 "[ . 1 . 2]" 1 1590 1 90 LYS QG 1 91 VAL H . . 4.620 4.163 3.650 4.628 0.008 18 0 "[ . 1 . 2]" 1 1591 1 90 LYS QG 1 93 ASP QB . . 4.090 2.358 1.871 3.260 . 0 0 "[ . 1 . 2]" 1 1592 1 90 LYS HG2 1 93 ASP HB2 . . 5.230 4.370 3.031 5.254 0.024 6 0 "[ . 1 . 2]" 1 1593 1 90 LYS HG2 1 93 ASP HB3 . . 5.230 3.295 2.000 4.435 . 0 0 "[ . 1 . 2]" 1 1594 1 90 LYS HG3 1 93 ASP HB2 . . 5.230 3.948 2.855 5.248 0.018 5 0 "[ . 1 . 2]" 1 1595 1 90 LYS HG3 1 93 ASP HB3 . . 5.230 2.942 1.998 4.174 . 0 0 "[ . 1 . 2]" 1 1596 1 91 VAL H 1 91 VAL HB . . 3.450 2.529 2.067 3.491 0.041 1 0 "[ . 1 . 2]" 1 1597 1 91 VAL H 1 91 VAL MG1 . . 3.750 2.180 1.855 2.785 . 0 0 "[ . 1 . 2]" 1 1598 1 91 VAL H 1 91 VAL QG . . 3.270 2.146 1.806 2.685 . 0 0 "[ . 1 . 2]" 1 1599 1 91 VAL H 1 91 VAL MG2 . . 3.750 3.473 2.448 3.713 . 0 0 "[ . 1 . 2]" 1 1600 1 91 VAL H 1 92 PHE H . . 3.580 2.821 2.576 3.030 . 0 0 "[ . 1 . 2]" 1 1601 1 91 VAL HA 1 91 VAL MG1 . . 3.560 3.079 2.438 3.220 . 0 0 "[ . 1 . 2]" 1 1602 1 91 VAL HA 1 91 VAL QG . . 3.060 2.307 2.020 2.461 . 0 0 "[ . 1 . 2]" 1 1603 1 91 VAL HA 1 91 VAL MG2 . . 3.560 2.484 2.044 3.198 . 0 0 "[ . 1 . 2]" 1 1604 1 91 VAL HB 1 92 PHE H . . 4.280 4.004 3.762 4.283 0.003 3 0 "[ . 1 . 2]" 1 1605 1 91 VAL QG 1 92 PHE H . . 3.660 2.076 1.829 2.434 . 0 0 "[ . 1 . 2]" 1 1606 1 91 VAL QG 1 92 PHE HA . . 4.700 3.138 2.867 3.298 . 0 0 "[ . 1 . 2]" 1 1607 1 91 VAL QG 1 92 PHE QE . . 4.900 2.493 1.889 3.007 . 0 0 "[ . 1 . 2]" 1 1608 1 91 VAL MG1 1 92 PHE H . . 4.230 2.354 1.842 3.788 . 0 0 "[ . 1 . 2]" 1 1609 1 91 VAL MG2 1 92 PHE H . . 4.230 3.533 1.834 4.218 . 0 0 "[ . 1 . 2]" 1 1610 1 92 PHE H 1 92 PHE HB2 . . 4.160 2.301 2.020 2.540 . 0 0 "[ . 1 . 2]" 1 1611 1 92 PHE H 1 92 PHE QB . . 3.380 2.267 2.004 2.483 . 0 0 "[ . 1 . 2]" 1 1612 1 92 PHE H 1 92 PHE HB3 . . 4.160 3.454 3.359 3.511 . 0 0 "[ . 1 . 2]" 1 1613 1 92 PHE H 1 92 PHE QD . . 3.250 2.415 1.944 2.739 . 0 0 "[ . 1 . 2]" 1 1614 1 92 PHE H 1 100 ILE MD . . 4.550 4.334 3.726 4.555 0.005 19 0 "[ . 1 . 2]" 1 1615 1 92 PHE H 1 100 ILE MG . . 4.310 3.590 3.256 4.101 . 0 0 "[ . 1 . 2]" 1 1616 1 92 PHE HA 1 92 PHE QD . . 4.210 2.393 1.995 3.136 . 0 0 "[ . 1 . 2]" 1 1617 1 92 PHE HA 1 108 VAL QG . . 4.100 2.137 1.777 3.026 . 0 0 "[ . 1 . 2]" 1 1618 1 92 PHE QB 1 100 ILE MD . . 4.160 2.945 2.046 3.623 . 0 0 "[ . 1 . 2]" 1 1619 1 92 PHE QB 1 100 ILE MG . . 3.760 1.896 1.650 2.337 . 0 0 "[ . 1 . 2]" 1 1620 1 92 PHE QB 1 105 LEU HA . . 4.720 3.340 2.524 4.629 . 0 0 "[ . 1 . 2]" 1 1621 1 92 PHE HB2 1 93 ASP H . . 5.130 2.647 2.126 3.146 . 0 0 "[ . 1 . 2]" 1 1622 1 92 PHE HB2 1 100 ILE MG . . 4.300 2.029 1.769 2.711 . 0 0 "[ . 1 . 2]" 1 1623 1 92 PHE HB3 1 93 ASP H . . 5.130 3.602 2.828 4.133 . 0 0 "[ . 1 . 2]" 1 1624 1 92 PHE HB3 1 100 ILE MG . . 4.300 2.440 1.938 3.546 . 0 0 "[ . 1 . 2]" 1 1625 1 92 PHE QD 1 93 ASP H . . 4.450 4.178 3.742 4.407 . 0 0 "[ . 1 . 2]" 1 1626 1 92 PHE QD 1 105 LEU HA . . 4.060 2.989 1.997 3.731 . 0 0 "[ . 1 . 2]" 1 1627 1 92 PHE QD 1 108 VAL HB . . 4.580 3.365 1.999 4.338 . 0 0 "[ . 1 . 2]" 1 1628 1 92 PHE QD 1 108 VAL MG1 . . 4.240 3.102 1.774 4.153 . 0 0 "[ . 1 . 2]" 1 1629 1 92 PHE QD 1 108 VAL QG . . 3.690 2.067 1.713 2.557 . 0 0 "[ . 1 . 2]" 1 1630 1 92 PHE QD 1 108 VAL MG2 . . 4.240 2.334 1.781 3.983 . 0 0 "[ . 1 . 2]" 1 1631 1 92 PHE QE 1 105 LEU HA . . 4.900 4.184 3.066 4.903 0.003 19 0 "[ . 1 . 2]" 1 1632 1 92 PHE QE 1 105 LEU QD . . 4.310 2.813 1.880 3.860 . 0 0 "[ . 1 . 2]" 1 1633 1 92 PHE QE 1 108 VAL MG1 . . 4.940 3.166 1.987 4.529 . 0 0 "[ . 1 . 2]" 1 1634 1 92 PHE QE 1 108 VAL QG . . 4.200 2.487 1.865 3.113 . 0 0 "[ . 1 . 2]" 1 1635 1 92 PHE QE 1 108 VAL MG2 . . 4.940 2.758 1.904 3.960 . 0 0 "[ . 1 . 2]" 1 1636 1 93 ASP H 1 93 ASP HB2 . . 4.000 2.250 2.005 2.719 . 0 0 "[ . 1 . 2]" 1 1637 1 93 ASP H 1 93 ASP QB . . 3.420 2.130 1.975 2.252 . 0 0 "[ . 1 . 2]" 1 1638 1 93 ASP H 1 93 ASP HB3 . . 4.000 2.767 2.339 2.963 . 0 0 "[ . 1 . 2]" 1 1639 1 93 ASP H 1 94 LYS H . . 4.800 4.295 3.919 4.511 . 0 0 "[ . 1 . 2]" 1 1640 1 93 ASP HA 1 94 LYS H . . 3.180 2.396 2.311 2.570 . 0 0 "[ . 1 . 2]" 1 1641 1 93 ASP QB 1 94 LYS H . . 4.330 4.049 3.934 4.142 . 0 0 "[ . 1 . 2]" 1 1642 1 93 ASP QB 1 100 ILE MG . . 3.840 2.066 1.763 2.874 . 0 0 "[ . 1 . 2]" 1 1643 1 93 ASP HB2 1 94 LYS H . . 4.950 4.755 4.685 4.789 . 0 0 "[ . 1 . 2]" 1 1644 1 93 ASP HB2 1 100 ILE MG . . 4.480 2.082 1.773 2.922 . 0 0 "[ . 1 . 2]" 1 1645 1 93 ASP HB3 1 94 LYS H . . 4.950 4.388 4.212 4.587 . 0 0 "[ . 1 . 2]" 1 1646 1 93 ASP HB3 1 100 ILE MG . . 4.480 3.491 3.076 4.252 . 0 0 "[ . 1 . 2]" 1 1647 1 94 LYS H 1 94 LYS HB2 . . 3.600 2.221 2.175 2.362 . 0 0 "[ . 1 . 2]" 1 1648 1 94 LYS H 1 94 LYS QB . . 3.110 2.197 2.153 2.331 . 0 0 "[ . 1 . 2]" 1 1649 1 94 LYS H 1 94 LYS HB3 . . 3.600 3.485 3.430 3.580 . 0 0 "[ . 1 . 2]" 1 1650 1 94 LYS H 1 94 LYS HG2 . . 4.030 3.091 2.774 3.375 . 0 0 "[ . 1 . 2]" 1 1651 1 94 LYS H 1 94 LYS QG . . 3.350 2.943 2.667 3.179 . 0 0 "[ . 1 . 2]" 1 1652 1 94 LYS H 1 94 LYS HG3 . . 4.030 3.703 3.405 3.936 . 0 0 "[ . 1 . 2]" 1 1653 1 94 LYS H 1 95 ASN H . . 3.880 2.294 2.173 2.647 . 0 0 "[ . 1 . 2]" 1 1654 1 94 LYS H 1 95 ASN QB . . 4.800 4.396 3.977 4.788 . 0 0 "[ . 1 . 2]" 1 1655 1 94 LYS H 1 100 ILE MG . . 4.970 4.569 3.976 4.963 . 0 0 "[ . 1 . 2]" 1 1656 1 94 LYS H 1 104 GLU HG2 . . 4.910 4.334 3.121 4.909 . 0 0 "[ . 1 . 2]" 1 1657 1 94 LYS H 1 104 GLU QG . . 4.230 3.976 3.086 4.235 0.005 14 0 "[ . 1 . 2]" 1 1658 1 94 LYS H 1 104 GLU HG3 . . 4.910 4.744 4.116 4.917 0.007 9 0 "[ . 1 . 2]" 1 1659 1 94 LYS HA 1 94 LYS QD . . 3.230 2.799 2.341 3.237 0.007 15 0 "[ . 1 . 2]" 1 1660 1 94 LYS HA 1 94 LYS HE2 . . 4.810 3.507 2.033 4.817 0.007 6 0 "[ . 1 . 2]" 1 1661 1 94 LYS HA 1 94 LYS QE . . 4.000 2.996 1.899 3.995 . 0 0 "[ . 1 . 2]" 1 1662 1 94 LYS HA 1 94 LYS HE3 . . 4.810 3.325 2.086 4.916 0.106 18 0 "[ . 1 . 2]" 1 1663 1 94 LYS HA 1 94 LYS HG2 . . 3.620 2.351 2.234 2.439 . 0 0 "[ . 1 . 2]" 1 1664 1 94 LYS HA 1 94 LYS QG . . 3.170 2.320 2.211 2.404 . 0 0 "[ . 1 . 2]" 1 1665 1 94 LYS HA 1 94 LYS HG3 . . 3.620 3.570 3.512 3.648 0.028 18 0 "[ . 1 . 2]" 1 1666 1 94 LYS HA 1 96 GLY H . . 4.220 3.379 3.182 4.125 . 0 0 "[ . 1 . 2]" 1 1667 1 94 LYS QB 1 94 LYS QE . . 3.390 2.436 1.965 2.930 . 0 0 "[ . 1 . 2]" 1 1668 1 94 LYS QB 1 96 GLY H . . 4.690 4.466 4.391 4.692 0.002 15 0 "[ . 1 . 2]" 1 1669 1 94 LYS HB2 1 94 LYS HE2 . . 4.410 3.877 3.222 4.363 . 0 0 "[ . 1 . 2]" 1 1670 1 94 LYS HB2 1 94 LYS HE3 . . 4.410 3.996 3.292 4.577 0.167 18 0 "[ . 1 . 2]" 1 1671 1 94 LYS HB2 1 95 ASN H . . 4.040 3.366 2.874 3.502 . 0 0 "[ . 1 . 2]" 1 1672 1 94 LYS HB2 1 96 GLY H . . 5.330 5.054 4.827 5.206 . 0 0 "[ . 1 . 2]" 1 1673 1 94 LYS HB3 1 94 LYS HE2 . . 4.410 2.945 1.995 3.306 . 0 0 "[ . 1 . 2]" 1 1674 1 94 LYS HB3 1 94 LYS HE3 . . 4.410 2.986 2.040 3.889 . 0 0 "[ . 1 . 2]" 1 1675 1 94 LYS HB3 1 95 ASN H . . 4.040 3.950 3.549 4.048 0.008 15 0 "[ . 1 . 2]" 1 1676 1 94 LYS HB3 1 96 GLY H . . 5.330 4.982 4.855 5.333 0.003 10 0 "[ . 1 . 2]" 1 1677 1 94 LYS QD 1 94 LYS HG2 . . 2.730 2.327 2.191 2.509 . 0 0 "[ . 1 . 2]" 1 1678 1 94 LYS QD 1 94 LYS QG . . 2.250 2.051 2.015 2.060 . 0 0 "[ . 1 . 2]" 1 1679 1 94 LYS QD 1 94 LYS HG3 . . 2.730 2.326 2.189 2.496 . 0 0 "[ . 1 . 2]" 1 1680 1 94 LYS QE 1 94 LYS QG . . 3.000 2.218 2.073 3.002 0.002 18 0 "[ . 1 . 2]" 1 1681 1 94 LYS QG 1 95 ASN H . . 4.680 4.510 4.222 4.570 . 0 0 "[ . 1 . 2]" 1 1682 1 94 LYS HG2 1 95 ASN H . . 5.490 4.832 4.595 4.912 . 0 0 "[ . 1 . 2]" 1 1683 1 94 LYS HG3 1 95 ASN H . . 5.490 5.406 4.922 5.496 0.006 11 0 "[ . 1 . 2]" 1 1684 1 95 ASN H 1 95 ASN QB . . 3.500 2.589 2.174 2.806 . 0 0 "[ . 1 . 2]" 1 1685 1 95 ASN H 1 96 GLY H . . 3.140 2.542 2.151 2.696 . 0 0 "[ . 1 . 2]" 1 1686 1 95 ASN H 1 96 GLY QA . . 4.940 4.302 4.065 4.456 . 0 0 "[ . 1 . 2]" 1 1687 1 95 ASN H 1 97 ASP H . . 4.950 4.291 3.937 4.890 . 0 0 "[ . 1 . 2]" 1 1688 1 95 ASN QB 1 96 GLY H . . 4.210 3.837 3.415 4.049 . 0 0 "[ . 1 . 2]" 1 1689 1 95 ASN HB2 1 96 GLY H . . 4.780 4.349 3.998 4.505 . 0 0 "[ . 1 . 2]" 1 1690 1 95 ASN HB3 1 96 GLY H . . 4.780 4.324 3.546 4.641 . 0 0 "[ . 1 . 2]" 1 1691 1 95 ASN QD 1 97 ASP QB . . 4.490 2.918 1.698 4.281 . 0 0 "[ . 1 . 2]" 1 1692 1 96 GLY H 1 96 GLY HA2 . . 2.940 2.262 2.247 2.277 . 0 0 "[ . 1 . 2]" 1 1693 1 96 GLY H 1 96 GLY QA . . 2.530 2.158 2.151 2.190 . 0 0 "[ . 1 . 2]" 1 1694 1 96 GLY H 1 96 GLY HA3 . . 2.940 2.734 2.658 2.877 . 0 0 "[ . 1 . 2]" 1 1695 1 96 GLY H 1 97 ASP H . . 3.190 3.090 2.671 3.214 0.024 8 0 "[ . 1 . 2]" 1 1696 1 96 GLY H 1 97 ASP HA . . 5.500 5.294 5.003 5.434 . 0 0 "[ . 1 . 2]" 1 1697 1 96 GLY H 1 98 GLY H . . 4.660 4.553 4.165 4.688 0.028 10 0 "[ . 1 . 2]" 1 1698 1 96 GLY QA 1 97 ASP H . . 3.040 2.552 2.409 2.659 . 0 0 "[ . 1 . 2]" 1 1699 1 96 GLY QA 1 98 GLY H . . 3.960 3.222 2.979 3.342 . 0 0 "[ . 1 . 2]" 1 1700 1 96 GLY HA2 1 98 GLY H . . 4.760 3.288 3.036 3.411 . 0 0 "[ . 1 . 2]" 1 1701 1 96 GLY HA3 1 98 GLY H . . 4.760 4.629 4.321 4.788 0.028 6 0 "[ . 1 . 2]" 1 1702 1 97 ASP H 1 97 ASP HB2 . . 3.590 3.163 2.269 3.665 0.075 18 0 "[ . 1 . 2]" 1 1703 1 97 ASP H 1 97 ASP HB3 . . 3.590 2.505 2.205 3.591 0.001 13 0 "[ . 1 . 2]" 1 1704 1 97 ASP H 1 98 GLY H . . 3.080 1.932 1.832 2.082 . 0 0 "[ . 1 . 2]" 1 1705 1 97 ASP H 1 98 GLY HA2 . . 4.710 4.195 4.056 4.328 . 0 0 "[ . 1 . 2]" 1 1706 1 97 ASP H 1 98 GLY QA . . 3.970 3.900 3.793 4.000 0.030 10 0 "[ . 1 . 2]" 1 1707 1 97 ASP H 1 98 GLY HA3 . . 4.710 4.634 4.551 4.718 0.008 18 0 "[ . 1 . 2]" 1 1708 1 97 ASP QB 1 99 LEU H . . 4.910 2.996 2.371 3.976 . 0 0 "[ . 1 . 2]" 1 1709 1 97 ASP HB2 1 98 GLY H . . 5.500 4.197 3.065 4.565 . 0 0 "[ . 1 . 2]" 1 1710 1 97 ASP HB3 1 98 GLY H . . 5.500 3.449 3.146 3.953 . 0 0 "[ . 1 . 2]" 1 1711 1 98 GLY H 1 99 LEU H . . 3.090 2.617 2.089 3.003 . 0 0 "[ . 1 . 2]" 1 1712 1 98 GLY H 1 99 LEU HB2 . . 5.500 5.199 4.839 5.524 0.024 6 0 "[ . 1 . 2]" 1 1713 1 98 GLY H 1 99 LEU HB3 . . 5.500 5.418 5.077 5.549 0.049 4 0 "[ . 1 . 2]" 1 1714 1 98 GLY H 1 121 LEU MD1 . . 5.500 4.446 2.466 5.438 . 0 0 "[ . 1 . 2]" 1 1715 1 98 GLY H 1 121 LEU MD2 . . 5.500 5.250 3.780 5.537 0.037 6 0 "[ . 1 . 2]" 1 1716 1 98 GLY QA 1 99 LEU QB . . 5.100 3.916 3.708 4.151 . 0 0 "[ . 1 . 2]" 1 1717 1 98 GLY QA 1 121 LEU QB . . 5.180 4.577 3.602 5.188 0.008 12 0 "[ . 1 . 2]" 1 1718 1 98 GLY QA 1 121 LEU QD . . 3.940 2.857 1.805 3.880 . 0 0 "[ . 1 . 2]" 1 1719 1 99 LEU H 1 99 LEU HB2 . . 3.300 2.930 2.298 3.293 . 0 0 "[ . 1 . 2]" 1 1720 1 99 LEU H 1 99 LEU HB3 . . 3.300 2.955 2.643 3.243 . 0 0 "[ . 1 . 2]" 1 1721 1 99 LEU H 1 99 LEU MD1 . . 4.950 4.283 3.723 4.844 . 0 0 "[ . 1 . 2]" 1 1722 1 99 LEU H 1 99 LEU QD . . 4.100 3.879 3.512 4.096 . 0 0 "[ . 1 . 2]" 1 1723 1 99 LEU H 1 99 LEU MD2 . . 4.950 4.504 4.000 4.857 . 0 0 "[ . 1 . 2]" 1 1724 1 99 LEU H 1 99 LEU HG . . 5.200 4.621 4.478 4.745 . 0 0 "[ . 1 . 2]" 1 1725 1 99 LEU H 1 100 ILE H . . 4.720 4.382 4.153 4.610 . 0 0 "[ . 1 . 2]" 1 1726 1 99 LEU HA 1 99 LEU MD1 . . 3.890 2.558 1.942 3.598 . 0 0 "[ . 1 . 2]" 1 1727 1 99 LEU HA 1 99 LEU QD . . 3.180 2.417 1.937 3.011 . 0 0 "[ . 1 . 2]" 1 1728 1 99 LEU HA 1 99 LEU MD2 . . 3.890 3.685 3.024 3.886 . 0 0 "[ . 1 . 2]" 1 1729 1 99 LEU HA 1 99 LEU HG . . 4.140 2.576 2.250 2.943 . 0 0 "[ . 1 . 2]" 1 1730 1 99 LEU HA 1 100 ILE H . . 3.250 2.293 2.225 2.496 . 0 0 "[ . 1 . 2]" 1 1731 1 99 LEU HA 1 100 ILE MG . . 4.270 4.051 3.801 4.274 0.004 16 0 "[ . 1 . 2]" 1 1732 1 99 LEU QB 1 99 LEU QD . . 2.610 1.864 1.757 1.957 . 0 0 "[ . 1 . 2]" 1 1733 1 99 LEU QB 1 100 ILE H . . 3.680 3.537 3.247 3.703 0.023 6 0 "[ . 1 . 2]" 1 1734 1 99 LEU HB2 1 99 LEU MD1 . . 3.350 2.205 2.021 2.406 . 0 0 "[ . 1 . 2]" 1 1735 1 99 LEU HB2 1 99 LEU MD2 . . 3.350 2.688 2.285 3.178 . 0 0 "[ . 1 . 2]" 1 1736 1 99 LEU HB2 1 100 ILE H . . 4.330 4.265 3.962 4.364 0.034 4 0 "[ . 1 . 2]" 1 1737 1 99 LEU HB3 1 99 LEU MD1 . . 3.350 3.067 2.624 3.221 . 0 0 "[ . 1 . 2]" 1 1738 1 99 LEU HB3 1 99 LEU MD2 . . 3.350 2.161 1.972 2.381 . 0 0 "[ . 1 . 2]" 1 1739 1 99 LEU HB3 1 100 ILE H . . 4.330 3.784 3.449 4.046 . 0 0 "[ . 1 . 2]" 1 1740 1 99 LEU QD 1 100 ILE H . . 3.870 2.900 1.910 3.319 . 0 0 "[ . 1 . 2]" 1 1741 1 99 LEU MD1 1 100 ILE H . . 4.890 3.430 2.576 4.399 . 0 0 "[ . 1 . 2]" 1 1742 1 99 LEU MD2 1 100 ILE H . . 4.890 3.643 1.913 4.300 . 0 0 "[ . 1 . 2]" 1 1743 1 99 LEU HG 1 100 ILE H . . 4.250 2.507 1.962 2.947 . 0 0 "[ . 1 . 2]" 1 1744 1 100 ILE H 1 100 ILE HB . . 3.840 3.666 3.533 3.794 . 0 0 "[ . 1 . 2]" 1 1745 1 100 ILE H 1 100 ILE MD . . 3.910 3.030 1.868 3.914 0.004 2 0 "[ . 1 . 2]" 1 1746 1 100 ILE H 1 100 ILE HG12 . . 3.980 2.436 1.953 3.660 . 0 0 "[ . 1 . 2]" 1 1747 1 100 ILE H 1 100 ILE HG13 . . 3.980 2.912 1.952 3.864 . 0 0 "[ . 1 . 2]" 1 1748 1 100 ILE H 1 100 ILE MG . . 3.850 3.338 2.999 3.529 . 0 0 "[ . 1 . 2]" 1 1749 1 100 ILE H 1 101 SER H . . 5.120 4.383 4.206 4.541 . 0 0 "[ . 1 . 2]" 1 1750 1 100 ILE HA 1 101 SER H . . 3.420 2.259 2.177 2.332 . 0 0 "[ . 1 . 2]" 1 1751 1 100 ILE HB 1 101 SER H . . 5.170 3.121 2.816 3.559 . 0 0 "[ . 1 . 2]" 1 1752 1 100 ILE MD 1 101 SER H . . 5.030 4.814 3.739 5.044 0.014 19 0 "[ . 1 . 2]" 1 1753 1 100 ILE QG 1 100 ILE MG . . 3.190 2.331 2.040 2.501 . 0 0 "[ . 1 . 2]" 1 1754 1 100 ILE QG 1 101 SER H . . 4.500 4.356 4.073 4.499 . 0 0 "[ . 1 . 2]" 1 1755 1 100 ILE MG 1 101 SER H . . 3.980 3.606 3.381 3.821 . 0 0 "[ . 1 . 2]" 1 1756 1 100 ILE MG 1 104 GLU QG . . 4.400 2.706 2.008 4.383 . 0 0 "[ . 1 . 2]" 1 1757 1 100 ILE MG 1 105 LEU H . . 5.060 4.765 4.244 5.062 0.002 5 0 "[ . 1 . 2]" 1 1758 1 100 ILE MG 1 105 LEU QB . . 5.020 4.600 3.942 5.011 . 0 0 "[ . 1 . 2]" 1 1759 1 101 SER H 1 104 GLU H . . 4.360 3.289 2.892 3.696 . 0 0 "[ . 1 . 2]" 1 1760 1 101 SER H 1 104 GLU HB2 . . 4.480 2.294 1.948 3.420 . 0 0 "[ . 1 . 2]" 1 1761 1 101 SER H 1 104 GLU QB . . 3.630 1.969 1.747 2.366 . 0 0 "[ . 1 . 2]" 1 1762 1 101 SER H 1 104 GLU HB3 . . 4.480 2.334 1.950 3.645 . 0 0 "[ . 1 . 2]" 1 1763 1 101 SER H 1 104 GLU HG2 . . 5.260 4.125 3.590 4.812 . 0 0 "[ . 1 . 2]" 1 1764 1 101 SER H 1 104 GLU QG . . 4.630 3.775 3.387 4.427 . 0 0 "[ . 1 . 2]" 1 1765 1 101 SER H 1 104 GLU HG3 . . 5.260 4.463 3.621 5.169 . 0 0 "[ . 1 . 2]" 1 1766 1 101 SER H 1 105 LEU H . . 5.330 3.851 3.075 4.279 . 0 0 "[ . 1 . 2]" 1 1767 1 101 SER QB 1 102 ALA H . . 3.940 2.093 1.907 2.973 . 0 0 "[ . 1 . 2]" 1 1768 1 101 SER QB 1 103 ALA H . . 3.830 2.969 2.251 3.823 . 0 0 "[ . 1 . 2]" 1 1769 1 101 SER QB 1 104 GLU H . . 4.410 3.000 2.403 4.043 . 0 0 "[ . 1 . 2]" 1 1770 1 101 SER HB2 1 102 ALA H . . 4.490 2.871 1.950 3.607 . 0 0 "[ . 1 . 2]" 1 1771 1 101 SER HB3 1 102 ALA H . . 4.490 2.498 1.947 3.673 . 0 0 "[ . 1 . 2]" 1 1772 1 102 ALA H 1 103 ALA H . . 3.740 2.681 2.369 2.956 . 0 0 "[ . 1 . 2]" 1 1773 1 102 ALA H 1 103 ALA MB . . 4.750 4.182 4.029 4.382 . 0 0 "[ . 1 . 2]" 1 1774 1 102 ALA H 1 104 GLU H . . 4.820 3.988 3.455 4.698 . 0 0 "[ . 1 . 2]" 1 1775 1 102 ALA HA 1 104 GLU H . . 5.250 4.293 3.754 5.109 . 0 0 "[ . 1 . 2]" 1 1776 1 102 ALA HA 1 105 LEU H . . 5.060 3.376 2.980 3.957 . 0 0 "[ . 1 . 2]" 1 1777 1 102 ALA HA 1 105 LEU HB2 . . 5.420 3.424 2.686 5.348 . 0 0 "[ . 1 . 2]" 1 1778 1 102 ALA HA 1 105 LEU QB . . 4.570 2.899 2.165 4.572 0.002 7 0 "[ . 1 . 2]" 1 1779 1 102 ALA HA 1 105 LEU HB3 . . 5.420 3.181 2.188 4.978 . 0 0 "[ . 1 . 2]" 1 1780 1 102 ALA HA 1 105 LEU MD1 . . 4.800 3.504 2.797 3.861 . 0 0 "[ . 1 . 2]" 1 1781 1 102 ALA HA 1 105 LEU QD . . 3.880 3.287 2.264 3.672 . 0 0 "[ . 1 . 2]" 1 1782 1 102 ALA HA 1 105 LEU MD2 . . 4.800 4.192 2.339 4.811 0.011 2 0 "[ . 1 . 2]" 1 1783 1 102 ALA HA 1 105 LEU HG . . 5.500 4.903 2.469 5.528 0.028 16 0 "[ . 1 . 2]" 1 1784 1 102 ALA HA 1 106 LYS H . . 5.140 4.225 3.916 4.789 . 0 0 "[ . 1 . 2]" 1 1785 1 102 ALA MB 1 103 ALA H . . 3.720 2.497 2.044 3.146 . 0 0 "[ . 1 . 2]" 1 1786 1 102 ALA MB 1 103 ALA HA . . 4.720 3.754 3.598 3.948 . 0 0 "[ . 1 . 2]" 1 1787 1 102 ALA MB 1 103 ALA MB . . 4.240 3.626 3.436 3.903 . 0 0 "[ . 1 . 2]" 1 1788 1 102 ALA MB 1 104 GLU H . . 5.150 4.427 3.989 5.148 . 0 0 "[ . 1 . 2]" 1 1789 1 103 ALA H 1 103 ALA MB . . 2.990 2.069 1.951 2.206 . 0 0 "[ . 1 . 2]" 1 1790 1 103 ALA H 1 104 GLU H . . 3.540 2.715 2.281 3.047 . 0 0 "[ . 1 . 2]" 1 1791 1 103 ALA H 1 104 GLU QB . . 4.990 4.399 3.938 4.640 . 0 0 "[ . 1 . 2]" 1 1792 1 103 ALA HA 1 106 LYS H . . 3.690 3.431 2.888 3.690 . 0 0 "[ . 1 . 2]" 1 1793 1 103 ALA HA 1 106 LYS HB2 . . 3.930 3.470 2.639 3.988 0.058 16 0 "[ . 1 . 2]" 1 1794 1 103 ALA HA 1 106 LYS QB . . 3.220 2.672 1.974 3.093 . 0 0 "[ . 1 . 2]" 1 1795 1 103 ALA HA 1 106 LYS HB3 . . 3.930 2.853 2.006 3.469 . 0 0 "[ . 1 . 2]" 1 1796 1 103 ALA HA 1 106 LYS HD2 . . 4.950 3.998 3.041 4.949 . 0 0 "[ . 1 . 2]" 1 1797 1 103 ALA HA 1 106 LYS QD . . 4.190 3.646 2.784 4.186 . 0 0 "[ . 1 . 2]" 1 1798 1 103 ALA HA 1 106 LYS HD3 . . 4.950 4.275 3.228 4.869 . 0 0 "[ . 1 . 2]" 1 1799 1 103 ALA HA 1 107 HIS H . . 4.920 4.314 3.773 4.925 0.005 5 0 "[ . 1 . 2]" 1 1800 1 103 ALA MB 1 104 GLU H . . 3.440 2.707 2.117 3.139 . 0 0 "[ . 1 . 2]" 1 1801 1 104 GLU H 1 104 GLU HB2 . . 3.770 2.281 2.082 2.529 . 0 0 "[ . 1 . 2]" 1 1802 1 104 GLU H 1 104 GLU QB . . 2.960 2.182 2.047 2.373 . 0 0 "[ . 1 . 2]" 1 1803 1 104 GLU H 1 104 GLU HB3 . . 3.770 2.867 2.422 3.542 . 0 0 "[ . 1 . 2]" 1 1804 1 104 GLU H 1 104 GLU QG . . 4.230 3.727 2.222 3.972 . 0 0 "[ . 1 . 2]" 1 1805 1 104 GLU H 1 107 HIS H . . 4.950 4.542 4.120 4.907 . 0 0 "[ . 1 . 2]" 1 1806 1 104 GLU H 1 107 HIS QB . . 5.260 4.711 4.175 5.252 . 0 0 "[ . 1 . 2]" 1 1807 1 104 GLU HA 1 104 GLU HG2 . . 3.890 3.065 2.683 3.239 . 0 0 "[ . 1 . 2]" 1 1808 1 104 GLU HA 1 104 GLU QG . . 3.180 2.162 2.065 2.483 . 0 0 "[ . 1 . 2]" 1 1809 1 104 GLU HA 1 104 GLU HG3 . . 3.890 2.226 2.100 2.619 . 0 0 "[ . 1 . 2]" 1 1810 1 104 GLU HA 1 107 HIS H . . 4.520 3.155 2.831 3.598 . 0 0 "[ . 1 . 2]" 1 1811 1 104 GLU HA 1 107 HIS QB . . 3.710 2.506 2.137 3.065 . 0 0 "[ . 1 . 2]" 1 1812 1 104 GLU HA 1 108 VAL H . . 5.010 4.466 3.711 5.011 0.001 10 0 "[ . 1 . 2]" 1 1813 1 104 GLU QB 1 105 LEU H . . 4.300 2.628 2.007 3.000 . 0 0 "[ . 1 . 2]" 1 1814 1 104 GLU HB2 1 105 LEU H . . 4.930 3.573 2.507 4.138 . 0 0 "[ . 1 . 2]" 1 1815 1 104 GLU HB3 1 105 LEU H . . 4.930 2.792 2.023 3.586 . 0 0 "[ . 1 . 2]" 1 1816 1 104 GLU HG2 1 105 LEU H . . 5.360 4.490 3.787 5.204 . 0 0 "[ . 1 . 2]" 1 1817 1 104 GLU HG3 1 105 LEU H . . 5.360 4.831 4.435 5.093 . 0 0 "[ . 1 . 2]" 1 1818 1 105 LEU H 1 105 LEU MD1 . . 4.970 3.934 3.534 4.286 . 0 0 "[ . 1 . 2]" 1 1819 1 105 LEU H 1 105 LEU QD . . 4.170 3.532 2.796 3.722 . 0 0 "[ . 1 . 2]" 1 1820 1 105 LEU H 1 105 LEU MD2 . . 4.970 4.063 2.917 4.336 . 0 0 "[ . 1 . 2]" 1 1821 1 105 LEU H 1 105 LEU HG . . 4.450 3.907 1.948 4.536 0.086 2 0 "[ . 1 . 2]" 1 1822 1 105 LEU H 1 106 LYS H . . 4.060 2.572 2.304 2.904 . 0 0 "[ . 1 . 2]" 1 1823 1 105 LEU H 1 108 VAL H . . 5.220 4.797 4.463 5.186 . 0 0 "[ . 1 . 2]" 1 1824 1 105 LEU HA 1 105 LEU MD1 . . 3.930 3.617 3.397 3.826 . 0 0 "[ . 1 . 2]" 1 1825 1 105 LEU HA 1 105 LEU QD . . 3.420 2.856 2.084 3.405 . 0 0 "[ . 1 . 2]" 1 1826 1 105 LEU HA 1 105 LEU MD2 . . 3.930 3.047 2.103 3.964 0.034 14 0 "[ . 1 . 2]" 1 1827 1 105 LEU HA 1 105 LEU HG . . 3.790 2.572 2.215 3.819 0.029 2 0 "[ . 1 . 2]" 1 1828 1 105 LEU HA 1 108 VAL HB . . 4.890 3.170 2.011 4.888 . 0 0 "[ . 1 . 2]" 1 1829 1 105 LEU HA 1 108 VAL QG . . 4.970 2.564 1.759 3.508 . 0 0 "[ . 1 . 2]" 1 1830 1 105 LEU HB2 1 106 LYS H . . 4.450 3.924 3.605 4.143 . 0 0 "[ . 1 . 2]" 1 1831 1 105 LEU HB3 1 106 LYS H . . 4.450 3.262 2.632 4.336 . 0 0 "[ . 1 . 2]" 1 1832 1 105 LEU QD 1 106 LYS H . . 5.300 3.685 2.447 4.171 . 0 0 "[ . 1 . 2]" 1 1833 1 105 LEU QD 1 106 LYS QG . . 4.870 4.603 3.762 4.876 0.006 5 0 "[ . 1 . 2]" 1 1834 1 105 LEU QD 1 108 VAL QG . . 3.640 2.716 1.911 3.649 0.009 14 0 "[ . 1 . 2]" 1 1835 1 105 LEU HG 1 106 LYS H . . 5.170 4.735 2.583 5.172 0.002 8 0 "[ . 1 . 2]" 1 1836 1 106 LYS H 1 106 LYS HB2 . . 3.360 2.542 2.249 3.429 0.069 16 0 "[ . 1 . 2]" 1 1837 1 106 LYS H 1 106 LYS HB3 . . 3.360 2.567 2.124 2.798 . 0 0 "[ . 1 . 2]" 1 1838 1 106 LYS H 1 106 LYS HD2 . . 5.170 4.825 4.663 4.954 . 0 0 "[ . 1 . 2]" 1 1839 1 106 LYS H 1 106 LYS QD . . 4.490 4.412 4.315 4.494 0.004 16 0 "[ . 1 . 2]" 1 1840 1 106 LYS H 1 106 LYS HD3 . . 5.170 5.115 4.895 5.205 0.035 16 0 "[ . 1 . 2]" 1 1841 1 106 LYS H 1 106 LYS HG2 . . 4.580 4.352 2.872 4.531 . 0 0 "[ . 1 . 2]" 1 1842 1 106 LYS H 1 106 LYS QG . . 4.030 3.882 2.796 3.993 . 0 0 "[ . 1 . 2]" 1 1843 1 106 LYS H 1 106 LYS HG3 . . 4.580 4.396 3.844 4.574 . 0 0 "[ . 1 . 2]" 1 1844 1 106 LYS H 1 107 HIS H . . 3.780 2.362 2.163 2.608 . 0 0 "[ . 1 . 2]" 1 1845 1 106 LYS H 1 107 HIS QB . . 5.230 4.137 3.835 4.547 . 0 0 "[ . 1 . 2]" 1 1846 1 106 LYS HA 1 106 LYS QD . . 5.070 4.037 3.901 4.509 . 0 0 "[ . 1 . 2]" 1 1847 1 106 LYS HA 1 106 LYS HG2 . . 4.030 2.809 2.556 3.837 . 0 0 "[ . 1 . 2]" 1 1848 1 106 LYS HA 1 106 LYS QG . . 3.410 2.377 2.178 3.217 . 0 0 "[ . 1 . 2]" 1 1849 1 106 LYS HA 1 106 LYS HG3 . . 4.030 2.583 2.268 3.454 . 0 0 "[ . 1 . 2]" 1 1850 1 106 LYS HA 1 109 LEU H . . 4.640 3.721 3.277 4.196 . 0 0 "[ . 1 . 2]" 1 1851 1 106 LYS HA 1 109 LEU MD1 . . 4.190 2.412 1.809 2.973 . 0 0 "[ . 1 . 2]" 1 1852 1 106 LYS QB 1 106 LYS QD . . 2.590 2.171 2.140 2.589 . 0 0 "[ . 1 . 2]" 1 1853 1 106 LYS QB 1 106 LYS QE . . 3.660 3.492 1.804 3.665 0.005 9 0 "[ . 1 . 2]" 1 1854 1 106 LYS QB 1 107 HIS H . . 3.870 2.995 2.465 3.636 . 0 0 "[ . 1 . 2]" 1 1855 1 106 LYS HB2 1 106 LYS HD2 . . 3.570 2.627 2.417 3.733 0.163 16 0 "[ . 1 . 2]" 1 1856 1 106 LYS HB2 1 106 LYS HD3 . . 3.570 3.339 2.821 3.541 . 0 0 "[ . 1 . 2]" 1 1857 1 106 LYS HB2 1 106 LYS HE2 . . 4.860 4.279 2.146 4.892 0.032 5 0 "[ . 1 . 2]" 1 1858 1 106 LYS HB2 1 106 LYS HE3 . . 4.860 4.494 3.056 4.859 . 0 0 "[ . 1 . 2]" 1 1859 1 106 LYS HB2 1 107 HIS H . . 4.580 4.026 3.623 4.406 . 0 0 "[ . 1 . 2]" 1 1860 1 106 LYS HB3 1 106 LYS HD2 . . 3.570 2.792 2.546 3.613 0.043 16 0 "[ . 1 . 2]" 1 1861 1 106 LYS HB3 1 106 LYS HD3 . . 3.570 2.640 2.450 3.529 . 0 0 "[ . 1 . 2]" 1 1862 1 106 LYS HB3 1 106 LYS HE2 . . 4.860 4.430 2.316 4.812 . 0 0 "[ . 1 . 2]" 1 1863 1 106 LYS HB3 1 106 LYS HE3 . . 4.860 4.582 2.119 4.859 . 0 0 "[ . 1 . 2]" 1 1864 1 106 LYS HB3 1 107 HIS H . . 4.580 3.097 2.497 3.874 . 0 0 "[ . 1 . 2]" 1 1865 1 106 LYS QD 1 106 LYS QG . . 2.360 2.120 1.978 2.134 . 0 0 "[ . 1 . 2]" 1 1866 1 106 LYS QD 1 107 HIS H . . 5.340 4.872 4.093 5.340 . 0 0 "[ . 1 . 2]" 1 1867 1 106 LYS QE 1 106 LYS QG . . 3.140 2.216 2.141 2.590 . 0 0 "[ . 1 . 2]" 1 1868 1 106 LYS HE2 1 106 LYS HG2 . . 4.220 3.002 2.437 3.673 . 0 0 "[ . 1 . 2]" 1 1869 1 106 LYS HE2 1 106 LYS HG3 . . 4.220 2.660 2.242 3.623 . 0 0 "[ . 1 . 2]" 1 1870 1 106 LYS HE3 1 106 LYS HG2 . . 4.220 3.543 2.701 3.934 . 0 0 "[ . 1 . 2]" 1 1871 1 106 LYS HE3 1 106 LYS HG3 . . 4.220 3.176 2.296 3.730 . 0 0 "[ . 1 . 2]" 1 1872 1 106 LYS QG 1 107 HIS H . . 5.180 4.096 2.666 4.482 . 0 0 "[ . 1 . 2]" 1 1873 1 106 LYS QG 1 107 HIS HA . . 4.640 4.133 3.120 4.639 . 0 0 "[ . 1 . 2]" 1 1874 1 107 HIS H 1 107 HIS QB . . 3.480 2.211 2.100 2.436 . 0 0 "[ . 1 . 2]" 1 1875 1 107 HIS H 1 108 VAL H . . 3.780 2.422 2.284 2.834 . 0 0 "[ . 1 . 2]" 1 1876 1 107 HIS QB 1 108 VAL H . . 3.930 3.152 2.698 3.264 . 0 0 "[ . 1 . 2]" 1 1877 1 107 HIS QB 1 108 VAL HA . . 4.730 4.140 3.945 4.420 . 0 0 "[ . 1 . 2]" 1 1878 1 107 HIS QB 1 108 VAL QG . . 4.890 4.158 3.176 4.646 . 0 0 "[ . 1 . 2]" 1 1879 1 107 HIS QB 1 109 LEU H . . 5.260 4.796 4.468 5.116 . 0 0 "[ . 1 . 2]" 1 1880 1 108 VAL H 1 108 VAL HB . . 3.750 2.503 2.071 3.564 . 0 0 "[ . 1 . 2]" 1 1881 1 108 VAL H 1 108 VAL MG1 . . 3.970 2.468 1.923 3.563 . 0 0 "[ . 1 . 2]" 1 1882 1 108 VAL H 1 108 VAL QG . . 3.440 2.329 1.817 2.661 . 0 0 "[ . 1 . 2]" 1 1883 1 108 VAL H 1 108 VAL MG2 . . 3.970 3.196 2.078 3.736 . 0 0 "[ . 1 . 2]" 1 1884 1 108 VAL H 1 109 LEU H . . 3.040 2.628 2.329 2.850 . 0 0 "[ . 1 . 2]" 1 1885 1 108 VAL HA 1 111 SER H . . 4.940 2.741 2.326 3.405 . 0 0 "[ . 1 . 2]" 1 1886 1 108 VAL HB 1 109 LEU H . . 4.230 3.826 2.721 4.176 . 0 0 "[ . 1 . 2]" 1 1887 1 108 VAL QG 1 109 LEU H . . 3.830 2.116 1.908 2.570 . 0 0 "[ . 1 . 2]" 1 1888 1 108 VAL QG 1 109 LEU HA . . 3.910 3.075 2.856 3.422 . 0 0 "[ . 1 . 2]" 1 1889 1 108 VAL QG 1 109 LEU QB . . 3.800 3.641 3.410 3.823 0.023 10 0 "[ . 1 . 2]" 1 1890 1 108 VAL QG 1 109 LEU MD1 . . 4.610 3.314 1.894 4.026 . 0 0 "[ . 1 . 2]" 1 1891 1 108 VAL QG 1 109 LEU HG . . 4.680 2.537 1.981 3.345 . 0 0 "[ . 1 . 2]" 1 1892 1 108 VAL QG 1 111 SER H . . 4.620 3.769 3.237 4.205 . 0 0 "[ . 1 . 2]" 1 1893 1 108 VAL MG1 1 109 LEU H . . 4.490 2.582 1.911 4.002 . 0 0 "[ . 1 . 2]" 1 1894 1 108 VAL MG2 1 109 LEU H . . 4.490 3.623 1.988 4.324 . 0 0 "[ . 1 . 2]" 1 1895 1 109 LEU H 1 109 LEU HB2 . . 3.890 2.359 2.145 2.616 . 0 0 "[ . 1 . 2]" 1 1896 1 109 LEU H 1 109 LEU QB . . 3.340 2.323 2.125 2.552 . 0 0 "[ . 1 . 2]" 1 1897 1 109 LEU H 1 109 LEU HB3 . . 3.890 3.514 3.446 3.552 . 0 0 "[ . 1 . 2]" 1 1898 1 109 LEU H 1 109 LEU MD1 . . 3.970 3.012 1.978 3.378 . 0 0 "[ . 1 . 2]" 1 1899 1 109 LEU H 1 109 LEU MD2 . . 4.260 3.844 3.525 4.082 . 0 0 "[ . 1 . 2]" 1 1900 1 109 LEU H 1 109 LEU HG . . 3.230 2.507 1.987 3.226 . 0 0 "[ . 1 . 2]" 1 1901 1 109 LEU H 1 110 THR H . . 3.920 2.656 2.531 2.884 . 0 0 "[ . 1 . 2]" 1 1902 1 109 LEU H 1 111 SER H . . 4.490 3.854 3.493 4.142 . 0 0 "[ . 1 . 2]" 1 1903 1 109 LEU HA 1 109 LEU MD1 . . 3.970 3.811 3.306 3.976 0.006 2 0 "[ . 1 . 2]" 1 1904 1 109 LEU HA 1 109 LEU MD2 . . 3.540 2.675 2.509 3.455 . 0 0 "[ . 1 . 2]" 1 1905 1 109 LEU HA 1 109 LEU HG . . 2.970 2.625 2.285 2.927 . 0 0 "[ . 1 . 2]" 1 1906 1 109 LEU QB 1 109 LEU MD2 . . 2.930 2.031 2.003 2.073 . 0 0 "[ . 1 . 2]" 1 1907 1 109 LEU QB 1 110 THR H . . 3.870 3.072 2.662 3.315 . 0 0 "[ . 1 . 2]" 1 1908 1 109 LEU QB 1 110 THR HA . . 4.860 4.168 3.962 4.227 . 0 0 "[ . 1 . 2]" 1 1909 1 109 LEU QB 1 111 SER H . . 5.340 4.649 4.297 4.890 . 0 0 "[ . 1 . 2]" 1 1910 1 109 LEU HB2 1 109 LEU MD2 . . 3.480 3.099 2.735 3.164 . 0 0 "[ . 1 . 2]" 1 1911 1 109 LEU HB2 1 110 THR H . . 4.560 3.200 2.707 3.462 . 0 0 "[ . 1 . 2]" 1 1912 1 109 LEU HB3 1 109 LEU MD2 . . 3.480 2.061 2.027 2.125 . 0 0 "[ . 1 . 2]" 1 1913 1 109 LEU HB3 1 110 THR H . . 4.560 3.994 3.643 4.305 . 0 0 "[ . 1 . 2]" 1 1914 1 109 LEU MD1 1 110 THR H . . 5.450 4.592 3.939 4.892 . 0 0 "[ . 1 . 2]" 1 1915 1 110 THR H 1 110 THR HB . . 3.800 2.487 2.043 3.542 . 0 0 "[ . 1 . 2]" 1 1916 1 110 THR H 1 110 THR MG . . 3.940 3.458 2.767 3.752 . 0 0 "[ . 1 . 2]" 1 1917 1 110 THR H 1 111 SER H . . 3.570 2.099 1.966 2.608 . 0 0 "[ . 1 . 2]" 1 1918 1 110 THR H 1 111 SER QB . . 4.910 3.911 3.718 4.721 . 0 0 "[ . 1 . 2]" 1 1919 1 110 THR HA 1 110 THR MG . . 3.040 2.561 2.350 3.087 0.047 13 0 "[ . 1 . 2]" 1 1920 1 110 THR HA 1 112 ILE H . . 5.500 4.210 3.059 4.968 . 0 0 "[ . 1 . 2]" 1 1921 1 110 THR HA 1 112 ILE HB . . 5.480 4.774 3.524 5.504 0.024 11 0 "[ . 1 . 2]" 1 1922 1 110 THR HA 1 112 ILE MD . . 4.850 3.190 2.423 3.939 . 0 0 "[ . 1 . 2]" 1 1923 1 110 THR HB 1 111 SER H . . 3.790 3.579 3.133 3.852 0.062 12 0 "[ . 1 . 2]" 1 1924 1 110 THR HB 1 112 ILE MD . . 5.500 5.401 4.672 5.587 0.087 12 0 "[ . 1 . 2]" 1 1925 1 110 THR MG 1 111 SER H . . 4.170 3.799 2.302 4.195 0.025 14 0 "[ . 1 . 2]" 1 1926 1 111 SER H 1 111 SER HB2 . . 3.740 2.513 2.146 3.560 . 0 0 "[ . 1 . 2]" 1 1927 1 111 SER H 1 111 SER QB . . 3.270 2.253 2.088 2.487 . 0 0 "[ . 1 . 2]" 1 1928 1 111 SER H 1 111 SER HB3 . . 3.740 2.772 2.243 3.570 . 0 0 "[ . 1 . 2]" 1 1929 1 111 SER H 1 112 ILE H . . 3.750 2.818 2.584 3.033 . 0 0 "[ . 1 . 2]" 1 1930 1 111 SER H 1 112 ILE HB . . 5.500 5.222 4.573 5.569 0.069 5 0 "[ . 1 . 2]" 1 1931 1 111 SER H 1 112 ILE QG . . 5.340 3.914 3.320 5.387 0.047 14 0 "[ . 1 . 2]" 1 1932 1 111 SER QB 1 112 ILE H . . 3.720 2.649 2.001 3.445 . 0 0 "[ . 1 . 2]" 1 1933 1 111 SER HB2 1 112 ILE H . . 4.580 3.559 2.059 4.380 . 0 0 "[ . 1 . 2]" 1 1934 1 111 SER HB3 1 112 ILE H . . 4.580 2.972 2.014 4.380 . 0 0 "[ . 1 . 2]" 1 1935 1 112 ILE H 1 112 ILE HB . . 3.770 3.165 2.162 3.757 . 0 0 "[ . 1 . 2]" 1 1936 1 112 ILE H 1 112 ILE MD . . 4.400 2.642 1.800 3.785 . 0 0 "[ . 1 . 2]" 1 1937 1 112 ILE H 1 112 ILE HG12 . . 4.290 3.152 1.962 4.035 . 0 0 "[ . 1 . 2]" 1 1938 1 112 ILE H 1 112 ILE QG . . 3.750 2.703 1.950 3.329 . 0 0 "[ . 1 . 2]" 1 1939 1 112 ILE H 1 112 ILE HG13 . . 4.290 3.675 2.406 4.306 0.016 6 0 "[ . 1 . 2]" 1 1940 1 112 ILE H 1 112 ILE MG . . 3.930 3.797 3.598 3.967 0.037 8 0 "[ . 1 . 2]" 1 1941 1 112 ILE H 1 113 GLY H . . 4.680 3.375 2.572 4.674 . 0 0 "[ . 1 . 2]" 1 1942 1 112 ILE H 1 113 GLY QA . . 5.350 4.746 4.423 5.271 . 0 0 "[ . 1 . 2]" 1 1943 1 112 ILE HA 1 112 ILE MD . . 3.720 2.582 1.935 3.858 0.138 8 0 "[ . 1 . 2]" 1 1944 1 112 ILE HA 1 112 ILE HG12 . . 4.040 3.188 2.687 3.590 . 0 0 "[ . 1 . 2]" 1 1945 1 112 ILE HA 1 112 ILE QG . . 3.550 2.767 2.112 3.188 . 0 0 "[ . 1 . 2]" 1 1946 1 112 ILE HA 1 112 ILE HG13 . . 4.040 3.271 2.131 3.907 . 0 0 "[ . 1 . 2]" 1 1947 1 112 ILE HA 1 112 ILE MG . . 3.340 2.379 2.084 2.748 . 0 0 "[ . 1 . 2]" 1 1948 1 112 ILE HA 1 113 GLY H . . 3.460 2.944 2.290 3.570 0.110 17 0 "[ . 1 . 2]" 1 1949 1 112 ILE HB 1 112 ILE MD . . 3.370 2.792 1.990 3.214 . 0 0 "[ . 1 . 2]" 1 1950 1 112 ILE HB 1 113 GLY H . . 4.230 3.825 2.199 4.233 0.003 4 0 "[ . 1 . 2]" 1 1951 1 112 ILE HB 1 113 GLY QA . . 4.890 4.403 4.132 4.856 . 0 0 "[ . 1 . 2]" 1 1952 1 112 ILE MD 1 113 GLY H . . 4.680 4.470 3.790 4.717 0.037 12 0 "[ . 1 . 2]" 1 1953 1 112 ILE MD 1 113 GLY QA . . 5.500 5.463 5.066 5.570 0.070 5 0 "[ . 1 . 2]" 1 1954 1 112 ILE QG 1 112 ILE MG . . 2.930 2.280 2.070 2.448 . 0 0 "[ . 1 . 2]" 1 1955 1 112 ILE QG 1 113 GLY H . . 4.800 4.008 3.315 4.414 . 0 0 "[ . 1 . 2]" 1 1956 1 112 ILE QG 1 113 GLY QA . . 5.340 5.187 4.801 5.375 0.035 7 0 "[ . 1 . 2]" 1 1957 1 112 ILE HG12 1 112 ILE MG . . 3.520 2.839 2.100 3.240 . 0 0 "[ . 1 . 2]" 1 1958 1 112 ILE HG12 1 113 GLY H . . 5.500 4.427 3.667 5.607 0.107 8 0 "[ . 1 . 2]" 1 1959 1 112 ILE HG13 1 112 ILE MG . . 3.520 2.625 2.153 3.193 . 0 0 "[ . 1 . 2]" 1 1960 1 112 ILE HG13 1 113 GLY H . . 5.500 4.961 3.437 5.643 0.143 5 0 "[ . 1 . 2]" 1 1961 1 112 ILE MG 1 113 GLY H . . 4.520 3.387 1.851 4.378 . 0 0 "[ . 1 . 2]" 1 1962 1 112 ILE MG 1 113 GLY QA . . 4.640 3.761 2.699 4.620 . 0 0 "[ . 1 . 2]" 1 1963 1 112 ILE MG 1 114 GLU H . . 5.240 4.828 3.886 5.243 0.003 14 0 "[ . 1 . 2]" 1 1964 1 113 GLY QA 1 114 GLU H . . 3.240 2.287 2.169 2.983 . 0 0 "[ . 1 . 2]" 1 1965 1 113 GLY QA 1 116 LEU QB . . 5.120 4.794 3.950 5.125 0.005 12 0 "[ . 1 . 2]" 1 1966 1 113 GLY QA 1 116 LEU QD . . 5.440 3.883 2.185 5.353 . 0 0 "[ . 1 . 2]" 1 1967 1 114 GLU H 1 114 GLU HB2 . . 3.730 2.623 2.063 3.527 . 0 0 "[ . 1 . 2]" 1 1968 1 114 GLU H 1 114 GLU QB . . 3.070 2.497 2.045 3.065 . 0 0 "[ . 1 . 2]" 1 1969 1 114 GLU H 1 114 GLU HB3 . . 3.730 3.507 2.868 3.726 . 0 0 "[ . 1 . 2]" 1 1970 1 114 GLU H 1 114 GLU HG2 . . 3.870 3.310 1.962 3.872 0.002 8 0 "[ . 1 . 2]" 1 1971 1 114 GLU H 1 114 GLU QG . . 3.390 2.519 1.847 3.307 . 0 0 "[ . 1 . 2]" 1 1972 1 114 GLU H 1 114 GLU HG3 . . 3.870 2.676 1.948 3.736 . 0 0 "[ . 1 . 2]" 1 1973 1 114 GLU HA 1 114 GLU HG2 . . 3.590 2.943 2.104 3.614 0.024 16 0 "[ . 1 . 2]" 1 1974 1 114 GLU HA 1 114 GLU QG . . 3.050 2.476 2.052 3.216 0.166 3 0 "[ . 1 . 2]" 1 1975 1 114 GLU HA 1 114 GLU HG3 . . 3.590 3.006 2.230 3.609 0.019 3 0 "[ . 1 . 2]" 1 1976 1 114 GLU HA 1 115 LYS H . . 3.640 3.199 2.495 3.645 0.005 20 0 "[ . 1 . 2]" 1 1977 1 114 GLU QB 1 114 GLU QG . . 2.320 2.099 2.040 2.134 . 0 0 "[ . 1 . 2]" 1 1978 1 114 GLU QB 1 115 LYS H . . 3.350 2.275 1.931 2.832 . 0 0 "[ . 1 . 2]" 1 1979 1 114 GLU HB2 1 115 LYS H . . 3.940 2.882 1.962 3.778 . 0 0 "[ . 1 . 2]" 1 1980 1 114 GLU HB3 1 115 LYS H . . 3.940 2.935 1.940 3.947 0.007 16 0 "[ . 1 . 2]" 1 1981 1 114 GLU HG2 1 115 LYS H . . 4.680 4.210 3.044 4.683 0.003 11 0 "[ . 1 . 2]" 1 1982 1 114 GLU HG3 1 115 LYS H . . 4.680 3.965 1.940 4.678 . 0 0 "[ . 1 . 2]" 1 1983 1 115 LYS H 1 115 LYS HB2 . . 3.870 2.732 2.124 3.905 0.035 8 0 "[ . 1 . 2]" 1 1984 1 115 LYS H 1 115 LYS QB . . 3.370 2.484 2.074 3.371 0.001 14 0 "[ . 1 . 2]" 1 1985 1 115 LYS H 1 115 LYS HB3 . . 3.870 3.273 2.138 3.885 0.015 5 0 "[ . 1 . 2]" 1 1986 1 115 LYS H 1 115 LYS QD . . 4.770 4.093 2.427 4.699 . 0 0 "[ . 1 . 2]" 1 1987 1 115 LYS H 1 115 LYS HG2 . . 4.730 3.664 2.079 4.546 . 0 0 "[ . 1 . 2]" 1 1988 1 115 LYS H 1 115 LYS QG . . 3.960 2.910 2.054 3.907 . 0 0 "[ . 1 . 2]" 1 1989 1 115 LYS H 1 115 LYS HG3 . . 4.730 3.187 2.189 4.435 . 0 0 "[ . 1 . 2]" 1 1990 1 115 LYS HA 1 115 LYS QD . . 4.490 3.761 2.104 4.401 . 0 0 "[ . 1 . 2]" 1 1991 1 115 LYS HA 1 115 LYS HG2 . . 3.930 2.859 2.061 3.912 . 0 0 "[ . 1 . 2]" 1 1992 1 115 LYS HA 1 115 LYS QG . . 3.440 2.477 2.027 3.323 . 0 0 "[ . 1 . 2]" 1 1993 1 115 LYS HA 1 115 LYS HG3 . . 3.930 2.985 2.068 3.917 . 0 0 "[ . 1 . 2]" 1 1994 1 115 LYS HA 1 116 LEU H . . 3.210 2.413 2.177 3.296 0.086 18 0 "[ . 1 . 2]" 1 1995 1 115 LYS QB 1 116 LEU H . . 3.980 3.662 2.077 4.075 0.095 8 0 "[ . 1 . 2]" 1 1996 1 115 LYS HB2 1 116 LEU H . . 4.770 4.289 2.092 4.703 . 0 0 "[ . 1 . 2]" 1 1997 1 115 LYS HB3 1 116 LEU H . . 4.770 4.124 3.126 4.703 . 0 0 "[ . 1 . 2]" 1 1998 1 115 LYS QG 1 116 LEU H . . 5.000 3.882 2.387 4.576 . 0 0 "[ . 1 . 2]" 1 1999 1 116 LEU H 1 116 LEU QB . . 3.280 2.817 2.028 3.290 0.010 15 0 "[ . 1 . 2]" 1 2000 1 116 LEU H 1 116 LEU MD1 . . 4.740 4.234 2.482 4.740 0.000 18 0 "[ . 1 . 2]" 1 2001 1 116 LEU H 1 116 LEU QD . . 4.140 2.984 1.913 3.956 . 0 0 "[ . 1 . 2]" 1 2002 1 116 LEU H 1 116 LEU MD2 . . 4.740 3.318 1.915 4.607 . 0 0 "[ . 1 . 2]" 1 2003 1 116 LEU H 1 116 LEU HG . . 4.000 3.654 2.258 4.033 0.033 5 0 "[ . 1 . 2]" 1 2004 1 116 LEU HA 1 116 LEU MD1 . . 4.060 3.776 2.478 4.094 0.034 9 0 "[ . 1 . 2]" 1 2005 1 116 LEU HA 1 116 LEU QD . . 3.440 2.939 1.966 3.411 . 0 0 "[ . 1 . 2]" 1 2006 1 116 LEU HA 1 116 LEU MD2 . . 4.060 3.256 1.972 4.062 0.002 6 0 "[ . 1 . 2]" 1 2007 1 116 LEU HA 1 116 LEU HG . . 3.880 3.220 2.187 3.723 . 0 0 "[ . 1 . 2]" 1 2008 1 116 LEU HA 1 117 THR H . . 3.340 2.364 2.177 3.403 0.063 8 0 "[ . 1 . 2]" 1 2009 1 116 LEU QB 1 116 LEU QD . . 2.740 1.879 1.764 1.970 . 0 0 "[ . 1 . 2]" 1 2010 1 116 LEU QB 1 117 THR H . . 3.890 3.240 2.027 4.103 0.213 18 0 "[ . 1 . 2]" 1 2011 1 116 LEU HB2 1 116 LEU MD1 . . 3.510 2.190 2.046 2.652 . 0 0 "[ . 1 . 2]" 1 2012 1 116 LEU HB2 1 116 LEU MD2 . . 3.510 3.061 2.507 3.222 . 0 0 "[ . 1 . 2]" 1 2013 1 116 LEU HB2 1 117 THR H . . 4.560 3.750 2.718 4.591 0.031 18 0 "[ . 1 . 2]" 1 2014 1 116 LEU HB3 1 116 LEU MD1 . . 3.510 2.660 2.049 3.200 . 0 0 "[ . 1 . 2]" 1 2015 1 116 LEU HB3 1 116 LEU MD2 . . 3.510 2.258 1.987 2.664 . 0 0 "[ . 1 . 2]" 1 2016 1 116 LEU HB3 1 117 THR H . . 4.560 3.956 2.039 4.620 0.060 18 0 "[ . 1 . 2]" 1 2017 1 116 LEU QD 1 117 THR H . . 4.370 3.402 1.926 4.337 . 0 0 "[ . 1 . 2]" 1 2018 1 116 LEU MD1 1 117 THR H . . 5.100 4.434 1.928 5.144 0.044 18 0 "[ . 1 . 2]" 1 2019 1 116 LEU MD2 1 117 THR H . . 5.100 3.947 2.122 4.919 . 0 0 "[ . 1 . 2]" 1 2020 1 116 LEU HG 1 117 THR H . . 4.520 4.012 2.846 4.515 . 0 0 "[ . 1 . 2]" 1 2021 1 117 THR H 1 117 THR HB . . 3.840 3.680 3.143 3.849 0.009 8 0 "[ . 1 . 2]" 1 2022 1 117 THR H 1 117 THR MG . . 4.200 3.012 1.954 3.975 . 0 0 "[ . 1 . 2]" 1 2023 1 117 THR H 1 120 GLU QB . . 4.460 3.712 1.956 4.468 0.008 8 0 "[ . 1 . 2]" 1 2024 1 117 THR HA 1 117 THR HB . . 2.700 2.609 2.404 3.011 0.311 20 0 "[ . 1 . 2]" 1 2025 1 117 THR HA 1 117 THR MG . . 3.080 2.331 2.075 2.612 . 0 0 "[ . 1 . 2]" 1 2026 1 117 THR HA 1 118 ASP H . . 3.310 2.555 2.188 2.818 . 0 0 "[ . 1 . 2]" 1 2027 1 117 THR HB 1 118 ASP H . . 3.310 2.467 1.961 3.302 . 0 0 "[ . 1 . 2]" 1 2028 1 117 THR HB 1 118 ASP QB . . 5.340 4.438 3.835 5.179 . 0 0 "[ . 1 . 2]" 1 2029 1 117 THR MG 1 118 ASP H . . 4.950 3.585 2.139 4.144 . 0 0 "[ . 1 . 2]" 1 2030 1 118 ASP H 1 118 ASP HB2 . . 4.110 2.452 2.185 3.560 . 0 0 "[ . 1 . 2]" 1 2031 1 118 ASP H 1 118 ASP QB . . 3.570 2.330 2.162 2.823 . 0 0 "[ . 1 . 2]" 1 2032 1 118 ASP H 1 118 ASP HB3 . . 4.110 3.388 2.635 3.622 . 0 0 "[ . 1 . 2]" 1 2033 1 118 ASP HB2 1 119 ALA H . . 4.290 3.317 2.707 4.203 . 0 0 "[ . 1 . 2]" 1 2034 1 118 ASP HB3 1 119 ALA H . . 4.290 3.839 2.426 4.305 0.015 3 0 "[ . 1 . 2]" 1 2035 1 119 ALA H 1 119 ALA MB . . 3.180 2.104 1.993 2.260 . 0 0 "[ . 1 . 2]" 1 2036 1 119 ALA HA 1 120 GLU H . . 3.350 3.231 3.058 3.390 0.040 3 0 "[ . 1 . 2]" 1 2037 1 119 ALA HA 1 122 GLU QB . . 4.400 2.286 1.904 3.597 . 0 0 "[ . 1 . 2]" 1 2038 1 119 ALA HA 1 122 GLU QG . . 4.530 4.150 3.759 4.536 0.006 5 0 "[ . 1 . 2]" 1 2039 1 119 ALA MB 1 120 GLU H . . 3.810 3.461 3.257 3.638 . 0 0 "[ . 1 . 2]" 1 2040 1 120 GLU H 1 120 GLU QB . . 3.020 2.187 2.086 2.343 . 0 0 "[ . 1 . 2]" 1 2041 1 120 GLU H 1 120 GLU QG . . 4.130 3.555 2.367 4.051 . 0 0 "[ . 1 . 2]" 1 2042 1 120 GLU HA 1 120 GLU QG . . 3.470 2.723 2.096 3.332 . 0 0 "[ . 1 . 2]" 1 2043 1 120 GLU QB 1 120 GLU QG . . 2.480 2.060 1.996 2.134 . 0 0 "[ . 1 . 2]" 1 2044 1 120 GLU QB 1 121 LEU H . . 3.540 2.645 2.267 3.542 0.002 6 0 "[ . 1 . 2]" 1 2045 1 120 GLU QG 1 121 LEU H . . 4.600 3.702 1.889 4.616 0.016 6 0 "[ . 1 . 2]" 1 2046 1 121 LEU H 1 121 LEU QB . . 2.810 2.746 2.207 2.833 0.023 8 0 "[ . 1 . 2]" 1 2047 1 121 LEU H 1 121 LEU MD1 . . 4.520 3.938 2.022 4.259 . 0 0 "[ . 1 . 2]" 1 2048 1 121 LEU H 1 121 LEU QD . . 3.870 2.174 1.847 3.653 . 0 0 "[ . 1 . 2]" 1 2049 1 121 LEU H 1 121 LEU MD2 . . 4.520 2.308 1.850 4.054 . 0 0 "[ . 1 . 2]" 1 2050 1 121 LEU H 1 121 LEU HG . . 3.530 2.867 2.169 3.577 0.047 6 0 "[ . 1 . 2]" 1 2051 1 121 LEU HA 1 121 LEU MD1 . . 4.150 3.915 2.562 4.099 . 0 0 "[ . 1 . 2]" 1 2052 1 121 LEU HA 1 121 LEU QD . . 3.550 3.132 1.972 3.432 . 0 0 "[ . 1 . 2]" 1 2053 1 121 LEU HA 1 121 LEU MD2 . . 4.150 3.417 1.979 4.074 . 0 0 "[ . 1 . 2]" 1 2054 1 121 LEU HA 1 121 LEU HG . . 3.710 3.579 2.846 3.697 . 0 0 "[ . 1 . 2]" 1 2055 1 121 LEU QB 1 122 GLU H . . 3.790 3.380 2.150 3.765 . 0 0 "[ . 1 . 2]" 1 2056 1 121 LEU HB2 1 121 LEU MD1 . . 3.290 2.176 1.988 2.562 . 0 0 "[ . 1 . 2]" 1 2057 1 121 LEU HB2 1 121 LEU MD2 . . 3.290 3.107 2.462 3.218 . 0 0 "[ . 1 . 2]" 1 2058 1 121 LEU HB2 1 122 GLU H . . 4.450 3.809 2.165 4.368 . 0 0 "[ . 1 . 2]" 1 2059 1 121 LEU HB3 1 121 LEU MD1 . . 3.290 2.614 2.107 3.206 . 0 0 "[ . 1 . 2]" 1 2060 1 121 LEU HB3 1 121 LEU MD2 . . 3.290 2.214 2.003 2.591 . 0 0 "[ . 1 . 2]" 1 2061 1 121 LEU HB3 1 122 GLU H . . 4.450 3.947 2.972 4.486 0.036 14 0 "[ . 1 . 2]" 1 2062 1 121 LEU QD 1 122 GLU H . . 4.680 2.770 1.928 4.047 . 0 0 "[ . 1 . 2]" 1 2063 1 121 LEU HG 1 122 GLU H . . 4.220 2.663 1.951 4.276 0.056 14 0 "[ . 1 . 2]" 1 2064 1 122 GLU H 1 122 GLU QB . . 3.210 2.233 2.066 2.545 . 0 0 "[ . 1 . 2]" 1 2065 1 122 GLU H 1 122 GLU HG2 . . 4.370 3.423 1.963 4.376 0.006 11 0 "[ . 1 . 2]" 1 2066 1 122 GLU H 1 122 GLU QG . . 3.820 2.764 1.952 3.738 . 0 0 "[ . 1 . 2]" 1 2067 1 122 GLU H 1 122 GLU HG3 . . 4.370 3.178 2.082 4.060 . 0 0 "[ . 1 . 2]" 1 2068 1 122 GLU HA 1 122 GLU HG2 . . 3.800 2.421 2.064 3.297 . 0 0 "[ . 1 . 2]" 1 2069 1 122 GLU HA 1 122 GLU QG . . 3.250 2.302 2.034 3.094 . 0 0 "[ . 1 . 2]" 1 2070 1 122 GLU HA 1 122 GLU HG3 . . 3.800 3.085 2.213 3.746 . 0 0 "[ . 1 . 2]" 1 2071 1 122 GLU QB 1 123 HIS H . . 4.170 3.532 1.997 3.990 . 0 0 "[ . 1 . 2]" 1 stop_ save_
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