NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
632774 | 6ewv | 34196 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_6ewv 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 2382 _Distance_constraint_stats_list.Viol_count 6259 _Distance_constraint_stats_list.Viol_total 7016.534 _Distance_constraint_stats_list.Viol_max 0.803 _Distance_constraint_stats_list.Viol_rms 0.0224 _Distance_constraint_stats_list.Viol_average_all_restraints 0.0074 _Distance_constraint_stats_list.Viol_average_violations_only 0.0561 _Distance_constraint_stats_list.Cutoff_violation_report 0.500 _Distance_constraint_stats_list.Details ; Description of the tags in this list: * 1 * Administrative tag * 2 * Administrative tag * 3 * Administrative tag * 4 * ID of the restraint list. * 5 * Number of restraints in list. * 6 * Number of violated restraints (each model violation is used). * 7 * Sum of violations in Angstrom. * 8 * Maximum violation of a restraint without averaging in any way. * 9 * Rms of violations over all restraints. * 10 * Average violation over all restraints. * 11 * Average violation over violated restraints. This violation is averaged over only those models in which the restraint is violated. These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998). * 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table. * 13 * This tag Description of the tags in the per residue table below: * 1 * Chain identifier (can be absent if none defined) * 2 * Residue number * 3 * Residue name * 4 * Maximum violation in ensemble of models (without any averaging) * 5 * Model number with the maximum violation * 6 * Number of models with a violation above cutoff * 7 * List of models (1 character per model) with a violation above cutoff. An '*' marks a violation above the cutoff. A '+' indicates the largest violation above the cutoff and a '-' marks the smallest violation over cutoff. For models 5, 15, 25,... a ' ' is replaced by a '.'. For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1. * 8 * Administrative tag * 9 * Administrative tag Description of the tags in the per restraint table below: * 1 * Restraint ID within restraint list. First node, FIRST member, first atom's: * 2 * Chain identifier (can be absent if none defined) * 3 * Residue number * 4 * Residue name * 5 * Name of (pseudo-)atom First node, SECOND member, first atom's: * 6 * Chain identifier (can be absent if none defined) * 7 * Residue number * 8 * Residue name * 9 * Name of (pseudo-)atom FIRST node's: * 10 * Target distance value (Angstrom) * 11 * Lower bound distance (Angstrom) * 12 * Upper bound distance (Angstrom) * 13 * Average distance in ensemble of models * 14 * Minimum distance in ensemble of models * 15 * Maximum distance in ensemble of models * 16 * Maximum violation (without any averaging) * 17 * Model number with the maximum violation * 18 * Number of models with a violation above cutoff * 19 * List of models with a violation above cutoff. See description above. * 20 * Administrative tag * 21 * Administrative tag ; loop_ _Distance_constraint_stats_per_res.Atom_entity_assembly_ID _Distance_constraint_stats_per_res.Atom_comp_index_ID _Distance_constraint_stats_per_res.Atom_comp_ID _Distance_constraint_stats_per_res.Total_violation _Distance_constraint_stats_per_res.Max_violation _Distance_constraint_stats_per_res.Max_violation_model_number _Distance_constraint_stats_per_res.Over_cutoff_viol_count _Distance_constraint_stats_per_res.Over_cutoff_viol_per_model 1 2 ILE 14.812 0.108 2 0 "[ . 1 . 2]" 1 3 ASP 9.087 0.138 2 0 "[ . 1 . 2]" 1 4 ALA 4.029 0.091 4 0 "[ . 1 . 2]" 1 5 ALA 8.048 0.098 2 0 "[ . 1 . 2]" 1 6 GLN 8.148 0.092 16 0 "[ . 1 . 2]" 1 7 ILE 23.945 0.138 2 0 "[ . 1 . 2]" 1 8 VAL 11.337 0.128 2 0 "[ . 1 . 2]" 1 9 ASP 4.978 0.085 18 0 "[ . 1 . 2]" 1 10 GLU 2.522 0.099 20 0 "[ . 1 . 2]" 1 11 ALA 11.308 0.128 2 0 "[ . 1 . 2]" 1 12 LEU 8.360 0.120 14 0 "[ . 1 . 2]" 1 13 GLU 7.595 0.102 20 0 "[ . 1 . 2]" 1 14 GLN 8.182 0.105 10 0 "[ . 1 . 2]" 1 15 GLY 3.099 0.083 6 0 "[ . 1 . 2]" 1 16 ILE 21.561 0.136 3 0 "[ . 1 . 2]" 1 17 THR 5.116 0.145 2 0 "[ . 1 . 2]" 1 18 LEU 15.658 0.177 2 0 "[ . 1 . 2]" 1 19 PHE 5.451 0.109 12 0 "[ . 1 . 2]" 1 20 VAL 8.283 0.115 13 0 "[ . 1 . 2]" 1 21 VAL 10.387 0.112 5 0 "[ . 1 . 2]" 1 22 ASN 5.083 0.084 14 0 "[ . 1 . 2]" 1 23 ASN 7.006 0.095 2 0 "[ . 1 . 2]" 1 24 ARG 10.728 0.115 13 0 "[ . 1 . 2]" 1 25 LEU 16.451 0.258 2 0 "[ . 1 . 2]" 1 26 GLN 6.634 0.134 2 0 "[ . 1 . 2]" 1 27 TYR 11.407 0.217 2 0 "[ . 1 . 2]" 1 28 GLU 5.352 0.146 2 0 "[ . 1 . 2]" 1 29 THR 8.540 0.121 16 0 "[ . 1 . 2]" 1 30 SER 5.693 0.096 13 0 "[ . 1 . 2]" 1 31 ARG 6.713 0.244 2 0 "[ . 1 . 2]" 1 32 ASP 4.104 0.127 9 0 "[ . 1 . 2]" 1 33 SER 7.974 0.532 2 1 "[ + . 1 . 2]" 1 34 ILE 9.189 0.532 2 1 "[ + . 1 . 2]" 1 35 PRO 9.373 0.108 5 0 "[ . 1 . 2]" 1 36 THR 8.972 0.100 8 0 "[ . 1 . 2]" 1 37 GLU 6.440 0.089 9 0 "[ . 1 . 2]" 1 38 LEU 22.201 0.137 2 0 "[ . 1 . 2]" 1 39 LEU 18.601 0.147 2 0 "[ . 1 . 2]" 1 40 ASN 8.857 0.137 2 0 "[ . 1 . 2]" 1 41 LYS 10.282 0.086 1 0 "[ . 1 . 2]" 1 42 TRP 20.099 0.224 2 0 "[ . 1 . 2]" 1 43 LYS 12.773 0.163 2 0 "[ . 1 . 2]" 1 44 GLN 7.682 0.163 2 0 "[ . 1 . 2]" 1 45 HIS 8.322 0.127 2 0 "[ . 1 . 2]" 1 46 LYS 7.115 0.094 1 0 "[ . 1 . 2]" 1 47 GLN 6.746 0.127 2 0 "[ . 1 . 2]" 1 48 GLU 6.073 0.247 2 0 "[ . 1 . 2]" 1 49 LEU 17.031 0.247 2 0 "[ . 1 . 2]" 1 50 ILE 16.595 0.102 15 0 "[ . 1 . 2]" 1 51 ASP 7.704 0.108 5 0 "[ . 1 . 2]" 1 52 PHE 2.893 0.126 2 0 "[ . 1 . 2]" 1 53 LEU 14.111 0.108 5 0 "[ . 1 . 2]" 1 54 ASN 6.313 0.103 2 0 "[ . 1 . 2]" 1 55 GLN 6.283 0.103 2 0 "[ . 1 . 2]" 1 56 LEU 7.055 0.126 2 0 "[ . 1 . 2]" 1 57 ASP 2.299 0.073 12 0 "[ . 1 . 2]" 1 58 SER 5.510 0.117 2 0 "[ . 1 . 2]" 1 59 GLU 3.868 0.100 6 0 "[ . 1 . 2]" 1 60 GLU 3.413 0.161 2 0 "[ . 1 . 2]" 1 61 GLN 3.893 0.161 2 0 "[ . 1 . 2]" 1 62 THR 2.870 0.106 11 0 "[ . 1 . 2]" 1 63 LYS 3.660 0.106 11 0 "[ . 1 . 2]" 1 64 GLY 1.635 0.103 19 0 "[ . 1 . 2]" 1 65 SER 0.858 0.093 20 0 "[ . 1 . 2]" 1 66 GLY 0.706 0.093 20 0 "[ . 1 . 2]" 1 67 SER 0.136 0.070 11 0 "[ . 1 . 2]" 1 68 GLY 0.136 0.070 11 0 "[ . 1 . 2]" 1 76 LEU 4.313 0.147 2 0 "[ . 1 . 2]" 1 77 LEU 1.002 0.070 17 0 "[ . 1 . 2]" 1 78 LYS 4.937 0.562 2 1 "[ + . 1 . 2]" 1 79 GLU 7.383 0.299 2 0 "[ . 1 . 2]" 1 80 LYS 3.114 0.803 2 1 "[ + . 1 . 2]" 1 81 ARG 3.021 0.562 2 1 "[ + . 1 . 2]" 1 82 LYS 3.359 0.086 20 0 "[ . 1 . 2]" 1 83 HIS 3.935 0.803 2 1 "[ + . 1 . 2]" 1 84 PHE 0.311 0.091 2 0 "[ . 1 . 2]" 1 85 GLN 2.640 0.090 11 0 "[ . 1 . 2]" 1 86 ALA 4.935 0.715 2 1 "[ + . 1 . 2]" 1 87 GLU 4.362 0.744 2 1 "[ + . 1 . 2]" 1 88 GLN 4.450 0.466 2 0 "[ . 1 . 2]" 1 89 ASN 2.389 0.299 2 0 "[ . 1 . 2]" 1 90 SER 1.220 0.282 2 0 "[ . 1 . 2]" 1 91 SER 1.655 0.085 5 0 "[ . 1 . 2]" 1 92 GLN 2.326 0.307 2 0 "[ . 1 . 2]" 1 93 GLU 4.323 0.307 2 0 "[ . 1 . 2]" 1 94 TYR 6.925 0.122 2 0 "[ . 1 . 2]" 1 95 LEU 9.188 0.265 2 0 "[ . 1 . 2]" 1 96 ARG 5.154 0.265 2 0 "[ . 1 . 2]" 1 97 GLY 5.100 0.146 2 0 "[ . 1 . 2]" 1 98 GLU 4.530 0.217 2 0 "[ . 1 . 2]" 1 99 ILE 21.495 0.258 2 0 "[ . 1 . 2]" stop_ loop_ _Distance_constraint_stats.Restraint_ID _Distance_constraint_stats.Atom_1_entity_assembly_ID _Distance_constraint_stats.Atom_1_comp_index_ID _Distance_constraint_stats.Atom_1_comp_ID _Distance_constraint_stats.Atom_1_ID _Distance_constraint_stats.Atom_2_entity_assembly_ID _Distance_constraint_stats.Atom_2_comp_index_ID _Distance_constraint_stats.Atom_2_comp_ID _Distance_constraint_stats.Atom_2_ID _Distance_constraint_stats.Node_1_distance_val _Distance_constraint_stats.Node_1_distance_lower_bound_val _Distance_constraint_stats.Node_1_distance_upper_bound_val _Distance_constraint_stats.Distance_average _Distance_constraint_stats.Distance_minimum _Distance_constraint_stats.Distance_maximum _Distance_constraint_stats.Max_violation _Distance_constraint_stats.Max_violation_model_number _Distance_constraint_stats.Over_cutoff_violation_count _Distance_constraint_stats.Over_cutoff_viol_per_model _Distance_constraint_stats.Distance_constraint_stats_ID 1 1 2 ILE HA 1 2 ILE HB . . 2.850 2.626 2.582 2.677 . 0 0 "[ . 1 . 2]" 1 2 1 2 ILE HA 1 2 ILE MD . . 2.630 2.246 2.152 2.337 . 0 0 "[ . 1 . 2]" 1 3 1 2 ILE HA 1 2 ILE HG12 . . 3.350 2.705 2.464 2.803 . 0 0 "[ . 1 . 2]" 1 4 1 2 ILE HA 1 2 ILE HG13 . . 3.620 3.674 3.564 3.693 0.073 10 0 "[ . 1 . 2]" 1 5 1 2 ILE HA 1 2 ILE MG . . 3.300 3.198 3.126 3.238 . 0 0 "[ . 1 . 2]" 1 6 1 2 ILE HA 1 3 ASP H . . 2.730 2.235 2.156 2.320 . 0 0 "[ . 1 . 2]" 1 7 1 2 ILE HA 1 3 ASP HA . . 4.430 4.453 4.374 4.485 0.055 8 0 "[ . 1 . 2]" 1 8 1 2 ILE HA 1 3 ASP HB2 . . 4.380 4.232 4.096 4.420 0.040 16 0 "[ . 1 . 2]" 1 9 1 2 ILE HA 1 6 GLN HB2 . . 4.530 4.572 4.459 4.606 0.076 7 0 "[ . 1 . 2]" 1 10 1 2 ILE HB 1 2 ILE MD . . 3.350 3.236 3.220 3.250 . 0 0 "[ . 1 . 2]" 1 11 1 2 ILE HB 1 7 ILE MD . . 4.160 3.926 3.623 4.124 . 0 0 "[ . 1 . 2]" 1 12 1 2 ILE HB 1 7 ILE HG12 . . 5.500 5.334 5.202 5.445 . 0 0 "[ . 1 . 2]" 1 13 1 2 ILE MD 1 3 ASP H . . 3.970 1.872 1.778 1.967 . 0 0 "[ . 1 . 2]" 1 14 1 2 ILE MD 1 3 ASP HA . . 5.500 3.828 3.628 3.890 . 0 0 "[ . 1 . 2]" 1 15 1 2 ILE MD 1 4 ALA H . . 4.500 4.464 4.218 4.552 0.052 16 0 "[ . 1 . 2]" 1 16 1 2 ILE MD 1 4 ALA HA . . 3.950 3.952 3.849 4.014 0.064 12 0 "[ . 1 . 2]" 1 17 1 2 ILE MD 1 5 ALA H . . 5.050 5.124 5.012 5.144 0.094 4 0 "[ . 1 . 2]" 1 18 1 2 ILE MD 1 6 GLN H . . 4.200 3.718 3.650 3.779 . 0 0 "[ . 1 . 2]" 1 19 1 2 ILE MD 1 6 GLN HB3 . . 5.500 2.943 2.838 3.023 . 0 0 "[ . 1 . 2]" 1 20 1 2 ILE MD 1 6 GLN HG3 . . 4.160 3.662 3.191 3.962 . 0 0 "[ . 1 . 2]" 1 21 1 2 ILE MD 1 7 ILE H . . 3.950 3.100 2.976 3.196 . 0 0 "[ . 1 . 2]" 1 22 1 2 ILE MD 1 7 ILE HA . . 5.500 3.669 3.586 3.796 . 0 0 "[ . 1 . 2]" 1 23 1 2 ILE MD 1 7 ILE HB . . 4.310 4.315 4.192 4.368 0.058 17 0 "[ . 1 . 2]" 1 24 1 2 ILE MD 1 7 ILE MD . . 5.500 2.468 2.353 2.610 . 0 0 "[ . 1 . 2]" 1 25 1 2 ILE MD 1 7 ILE HG12 . . 4.150 1.920 1.839 1.962 . 0 0 "[ . 1 . 2]" 1 26 1 2 ILE MD 1 7 ILE HG13 . . 5.500 2.764 2.577 2.840 . 0 0 "[ . 1 . 2]" 1 27 1 2 ILE MD 1 7 ILE MG . . 3.840 3.814 3.654 3.898 0.058 10 0 "[ . 1 . 2]" 1 28 1 2 ILE MD 1 8 VAL H . . 5.180 5.178 5.073 5.243 0.063 15 0 "[ . 1 . 2]" 1 29 1 2 ILE MD 1 41 LYS HE3 . . 4.760 4.702 4.450 4.834 0.074 5 0 "[ . 1 . 2]" 1 30 1 2 ILE MD 1 41 LYS HG3 . . 5.500 4.809 4.622 5.090 . 0 0 "[ . 1 . 2]" 1 31 1 2 ILE MD 1 45 HIS HB3 . . 5.210 5.136 4.938 5.282 0.072 1 0 "[ . 1 . 2]" 1 32 1 2 ILE MD 1 49 LEU QD . . 5.200 4.221 3.835 4.551 . 0 0 "[ . 1 . 2]" 1 33 1 2 ILE HG12 1 3 ASP H . . 3.940 3.924 3.752 3.999 0.059 18 0 "[ . 1 . 2]" 1 34 1 2 ILE HG12 1 6 GLN HB3 . . 5.120 5.174 5.144 5.191 0.071 8 0 "[ . 1 . 2]" 1 35 1 2 ILE HG12 1 7 ILE MG . . 5.500 5.588 5.576 5.608 0.108 2 0 "[ . 1 . 2]" 1 36 1 2 ILE HG12 1 41 LYS HG3 . . 5.500 5.350 5.055 5.555 0.055 17 0 "[ . 1 . 2]" 1 37 1 2 ILE HG13 1 2 ILE MG . . 3.250 2.246 2.201 2.314 . 0 0 "[ . 1 . 2]" 1 38 1 2 ILE HG13 1 3 ASP H . . 5.160 4.421 4.288 4.517 . 0 0 "[ . 1 . 2]" 1 39 1 2 ILE HG13 1 6 GLN HB2 . . 5.150 4.821 4.697 4.959 . 0 0 "[ . 1 . 2]" 1 40 1 2 ILE HG13 1 7 ILE MD . . 3.780 2.372 2.124 2.745 . 0 0 "[ . 1 . 2]" 1 41 1 2 ILE HG13 1 7 ILE MG . . 4.360 4.366 4.302 4.418 0.058 18 0 "[ . 1 . 2]" 1 42 1 2 ILE MG 1 3 ASP H . . 3.620 3.576 3.424 3.654 0.034 20 0 "[ . 1 . 2]" 1 43 1 2 ILE MG 1 3 ASP HA . . 4.280 3.950 3.697 4.056 . 0 0 "[ . 1 . 2]" 1 44 1 2 ILE MG 1 3 ASP HB2 . . 5.130 5.208 5.015 5.228 0.098 11 0 "[ . 1 . 2]" 1 45 1 2 ILE MG 1 4 ALA H . . 4.520 4.431 4.065 4.560 0.040 11 0 "[ . 1 . 2]" 1 46 1 2 ILE MG 1 4 ALA HA . . 4.450 4.111 3.821 4.217 . 0 0 "[ . 1 . 2]" 1 47 1 2 ILE MG 1 6 GLN HB2 . . 4.840 4.875 4.564 4.932 0.092 16 0 "[ . 1 . 2]" 1 48 1 2 ILE MG 1 7 ILE MD . . 3.010 1.909 1.798 1.991 . 0 0 "[ . 1 . 2]" 1 49 1 2 ILE MG 1 7 ILE HG12 . . 3.600 3.417 3.253 3.549 . 0 0 "[ . 1 . 2]" 1 50 1 2 ILE MG 1 7 ILE HG13 . . 3.330 3.321 2.861 3.411 0.081 7 0 "[ . 1 . 2]" 1 51 1 2 ILE MG 1 7 ILE MG . . 4.790 4.338 4.124 4.467 . 0 0 "[ . 1 . 2]" 1 52 1 2 ILE MG 1 45 HIS H . . 5.500 5.333 5.088 5.578 0.078 13 0 "[ . 1 . 2]" 1 53 1 2 ILE MG 1 48 GLU H . . 5.110 5.098 4.753 5.206 0.096 20 0 "[ . 1 . 2]" 1 54 1 2 ILE MG 1 48 GLU QB . . 3.690 2.749 2.209 2.959 . 0 0 "[ . 1 . 2]" 1 55 1 2 ILE MG 1 48 GLU QG . . 3.810 2.686 2.172 3.871 0.061 9 0 "[ . 1 . 2]" 1 56 1 3 ASP H 1 3 ASP HB2 . . 3.120 2.195 2.051 2.271 . 0 0 "[ . 1 . 2]" 1 57 1 3 ASP H 1 3 ASP HB3 . . 3.480 3.440 3.309 3.544 0.064 16 0 "[ . 1 . 2]" 1 58 1 3 ASP H 1 4 ALA H . . 4.570 4.523 4.474 4.588 0.018 18 0 "[ . 1 . 2]" 1 59 1 3 ASP H 1 4 ALA HA . . 5.420 5.288 5.221 5.406 . 0 0 "[ . 1 . 2]" 1 60 1 3 ASP H 1 5 ALA H . . 5.370 5.361 5.247 5.439 0.069 2 0 "[ . 1 . 2]" 1 61 1 3 ASP H 1 5 ALA MB . . 5.500 5.532 5.359 5.582 0.082 20 0 "[ . 1 . 2]" 1 62 1 3 ASP H 1 6 GLN H . . 4.110 4.097 4.023 4.186 0.076 2 0 "[ . 1 . 2]" 1 63 1 3 ASP H 1 6 GLN HB2 . . 3.720 2.984 2.797 3.141 . 0 0 "[ . 1 . 2]" 1 64 1 3 ASP H 1 6 GLN HG3 . . 4.030 3.464 2.945 3.825 . 0 0 "[ . 1 . 2]" 1 65 1 3 ASP H 1 7 ILE MD . . 4.730 4.651 4.504 4.790 0.060 8 0 "[ . 1 . 2]" 1 66 1 3 ASP HA 1 3 ASP HB3 . . 2.960 2.691 2.521 2.797 . 0 0 "[ . 1 . 2]" 1 67 1 3 ASP HA 1 4 ALA H . . 2.810 2.178 2.103 2.245 . 0 0 "[ . 1 . 2]" 1 68 1 3 ASP HA 1 4 ALA MB . . 4.200 4.000 3.907 4.079 . 0 0 "[ . 1 . 2]" 1 69 1 3 ASP HA 1 5 ALA H . . 4.010 4.043 3.955 4.079 0.069 11 0 "[ . 1 . 2]" 1 70 1 3 ASP HA 1 5 ALA MB . . 5.500 4.996 4.847 5.132 . 0 0 "[ . 1 . 2]" 1 71 1 3 ASP HA 1 6 GLN H . . 4.730 4.549 4.418 4.635 . 0 0 "[ . 1 . 2]" 1 72 1 3 ASP HA 1 6 GLN HB2 . . 5.500 4.975 4.748 5.122 . 0 0 "[ . 1 . 2]" 1 73 1 3 ASP HA 1 7 ILE H . . 5.500 5.544 5.471 5.569 0.069 3 0 "[ . 1 . 2]" 1 74 1 3 ASP HA 1 7 ILE HG12 . . 5.500 5.577 5.568 5.638 0.138 2 0 "[ . 1 . 2]" 1 75 1 3 ASP HA 1 48 GLU QB . . 5.340 4.859 4.509 5.149 . 0 0 "[ . 1 . 2]" 1 76 1 3 ASP HB2 1 5 ALA H . . 4.410 4.307 3.775 4.472 0.062 4 0 "[ . 1 . 2]" 1 77 1 3 ASP HB2 1 5 ALA MB . . 4.230 4.054 3.577 4.271 0.041 5 0 "[ . 1 . 2]" 1 78 1 3 ASP HB2 1 6 GLN H . . 3.620 3.287 2.670 3.652 0.032 5 0 "[ . 1 . 2]" 1 79 1 3 ASP HB2 1 6 GLN HB2 . . 3.730 3.297 2.679 3.796 0.066 18 0 "[ . 1 . 2]" 1 80 1 3 ASP HB2 1 6 GLN HB3 . . 5.500 4.592 4.087 4.934 . 0 0 "[ . 1 . 2]" 1 81 1 3 ASP HB2 1 6 GLN HG2 . . 4.200 3.868 3.466 4.144 . 0 0 "[ . 1 . 2]" 1 82 1 3 ASP HB2 1 6 GLN HG3 . . 4.000 2.222 1.943 2.476 . 0 0 "[ . 1 . 2]" 1 83 1 3 ASP HB3 1 4 ALA H . . 3.530 3.341 3.169 3.503 . 0 0 "[ . 1 . 2]" 1 84 1 3 ASP HB3 1 4 ALA MB . . 4.630 4.431 4.324 4.594 . 0 0 "[ . 1 . 2]" 1 85 1 3 ASP HB3 1 5 ALA H . . 3.870 2.811 2.672 2.892 . 0 0 "[ . 1 . 2]" 1 86 1 3 ASP HB3 1 5 ALA MB . . 5.500 2.926 2.732 3.086 . 0 0 "[ . 1 . 2]" 1 87 1 3 ASP HB3 1 6 GLN H . . 3.740 2.851 2.414 3.217 . 0 0 "[ . 1 . 2]" 1 88 1 3 ASP HB3 1 6 GLN HB2 . . 5.500 4.045 3.466 4.486 . 0 0 "[ . 1 . 2]" 1 89 1 3 ASP HB3 1 6 GLN HG3 . . 5.500 2.880 2.331 3.372 . 0 0 "[ . 1 . 2]" 1 90 1 3 ASP HB3 1 7 ILE H . . 5.100 4.937 4.565 5.162 0.062 11 0 "[ . 1 . 2]" 1 91 1 4 ALA H 1 4 ALA MB . . 2.710 2.195 2.126 2.248 . 0 0 "[ . 1 . 2]" 1 92 1 4 ALA H 1 5 ALA H . . 3.110 2.850 2.742 2.944 . 0 0 "[ . 1 . 2]" 1 93 1 4 ALA H 1 5 ALA MB . . 4.600 4.479 4.360 4.580 . 0 0 "[ . 1 . 2]" 1 94 1 4 ALA H 1 6 GLN H . . 4.360 4.367 4.221 4.418 0.058 15 0 "[ . 1 . 2]" 1 95 1 4 ALA H 1 7 ILE MD . . 5.110 5.022 4.884 5.136 0.026 2 0 "[ . 1 . 2]" 1 96 1 4 ALA H 1 7 ILE HG13 . . 4.480 4.282 4.195 4.361 . 0 0 "[ . 1 . 2]" 1 97 1 4 ALA H 1 49 LEU HA . . 4.540 4.488 4.013 4.604 0.064 12 0 "[ . 1 . 2]" 1 98 1 4 ALA H 1 53 LEU H . . 5.500 5.472 4.979 5.573 0.073 18 0 "[ . 1 . 2]" 1 99 1 4 ALA HA 1 5 ALA MB . . 5.020 5.028 5.000 5.050 0.030 11 0 "[ . 1 . 2]" 1 100 1 4 ALA HA 1 6 GLN H . . 4.230 4.219 4.092 4.286 0.056 7 0 "[ . 1 . 2]" 1 101 1 4 ALA HA 1 7 ILE H . . 3.530 3.316 3.215 3.415 . 0 0 "[ . 1 . 2]" 1 102 1 4 ALA HA 1 7 ILE HA . . 5.500 5.443 5.345 5.541 0.041 19 0 "[ . 1 . 2]" 1 103 1 4 ALA HA 1 7 ILE HB . . 3.790 3.206 3.053 3.337 . 0 0 "[ . 1 . 2]" 1 104 1 4 ALA HA 1 7 ILE MD . . 3.640 3.478 3.342 3.661 0.021 2 0 "[ . 1 . 2]" 1 105 1 4 ALA HA 1 7 ILE HG12 . . 4.260 3.644 3.563 3.774 . 0 0 "[ . 1 . 2]" 1 106 1 4 ALA HA 1 7 ILE HG13 . . 4.030 2.076 2.004 2.192 . 0 0 "[ . 1 . 2]" 1 107 1 4 ALA HA 1 7 ILE MG . . 4.730 4.392 4.296 4.552 . 0 0 "[ . 1 . 2]" 1 108 1 4 ALA HA 1 8 VAL H . . 4.250 4.151 4.004 4.283 0.033 19 0 "[ . 1 . 2]" 1 109 1 4 ALA HA 1 49 LEU HB3 . . 5.250 4.988 4.492 5.208 . 0 0 "[ . 1 . 2]" 1 110 1 4 ALA HA 1 49 LEU QD . . 3.270 2.500 1.952 2.997 . 0 0 "[ . 1 . 2]" 1 111 1 4 ALA HA 1 49 LEU HG . . 4.540 3.204 2.185 4.577 0.037 19 0 "[ . 1 . 2]" 1 112 1 4 ALA MB 1 5 ALA H . . 2.910 2.578 2.476 2.714 . 0 0 "[ . 1 . 2]" 1 113 1 4 ALA MB 1 5 ALA MB . . 3.910 3.809 3.699 3.925 0.015 12 0 "[ . 1 . 2]" 1 114 1 4 ALA MB 1 6 GLN H . . 4.600 4.508 4.400 4.614 0.014 12 0 "[ . 1 . 2]" 1 115 1 4 ALA MB 1 7 ILE HB . . 4.350 4.221 4.061 4.399 0.049 4 0 "[ . 1 . 2]" 1 116 1 4 ALA MB 1 7 ILE MD . . 4.640 4.427 4.286 4.611 . 0 0 "[ . 1 . 2]" 1 117 1 4 ALA MB 1 7 ILE HG13 . . 4.000 3.786 3.707 3.888 . 0 0 "[ . 1 . 2]" 1 118 1 4 ALA MB 1 8 VAL H . . 5.500 4.398 4.288 4.557 . 0 0 "[ . 1 . 2]" 1 119 1 4 ALA MB 1 8 VAL HB . . 5.350 5.025 4.831 5.334 . 0 0 "[ . 1 . 2]" 1 120 1 4 ALA MB 1 48 GLU HA . . 5.500 4.982 4.539 5.214 . 0 0 "[ . 1 . 2]" 1 121 1 4 ALA MB 1 48 GLU QB . . 4.700 3.954 3.523 4.258 . 0 0 "[ . 1 . 2]" 1 122 1 4 ALA MB 1 49 LEU HA . . 3.170 2.010 1.873 2.143 . 0 0 "[ . 1 . 2]" 1 123 1 4 ALA MB 1 49 LEU HB2 . . 4.590 4.379 4.156 4.566 . 0 0 "[ . 1 . 2]" 1 124 1 4 ALA MB 1 49 LEU QD . . 3.000 2.148 1.915 2.547 . 0 0 "[ . 1 . 2]" 1 125 1 4 ALA MB 1 49 LEU HG . . 4.260 3.311 2.410 4.351 0.091 4 0 "[ . 1 . 2]" 1 126 1 4 ALA MB 1 51 ASP HB3 . . 5.500 5.260 5.022 5.488 . 0 0 "[ . 1 . 2]" 1 127 1 4 ALA MB 1 52 PHE H . . 3.730 3.452 3.226 3.571 . 0 0 "[ . 1 . 2]" 1 128 1 4 ALA MB 1 52 PHE HA . . 4.380 4.294 4.109 4.365 . 0 0 "[ . 1 . 2]" 1 129 1 4 ALA MB 1 52 PHE HB2 . . 3.450 2.078 1.944 2.637 . 0 0 "[ . 1 . 2]" 1 130 1 4 ALA MB 1 52 PHE HB3 . . 3.710 2.117 1.937 2.244 . 0 0 "[ . 1 . 2]" 1 131 1 4 ALA MB 1 53 LEU H . . 5.500 2.905 2.558 3.030 . 0 0 "[ . 1 . 2]" 1 132 1 5 ALA H 1 5 ALA MB . . 2.520 2.221 2.176 2.251 . 0 0 "[ . 1 . 2]" 1 133 1 5 ALA H 1 6 GLN H . . 2.940 2.764 2.663 2.853 . 0 0 "[ . 1 . 2]" 1 134 1 5 ALA H 1 6 GLN HG2 . . 5.500 5.536 5.053 5.576 0.076 16 0 "[ . 1 . 2]" 1 135 1 5 ALA H 1 6 GLN HG3 . . 5.500 4.555 4.156 4.986 . 0 0 "[ . 1 . 2]" 1 136 1 5 ALA H 1 8 VAL H . . 4.890 4.773 4.721 4.831 . 0 0 "[ . 1 . 2]" 1 137 1 5 ALA H 1 49 LEU QD . . 4.990 4.617 4.264 5.060 0.070 14 0 "[ . 1 . 2]" 1 138 1 5 ALA H 1 52 PHE HB3 . . 4.960 4.435 4.068 4.767 . 0 0 "[ . 1 . 2]" 1 139 1 5 ALA H 1 56 LEU QD . . 5.150 4.151 3.578 4.984 . 0 0 "[ . 1 . 2]" 1 140 1 5 ALA HA 1 6 GLN HA . . 4.900 4.821 4.747 4.868 . 0 0 "[ . 1 . 2]" 1 141 1 5 ALA HA 1 7 ILE H . . 4.390 4.348 4.198 4.444 0.054 1 0 "[ . 1 . 2]" 1 142 1 5 ALA HA 1 8 VAL H . . 3.870 3.459 3.338 3.604 . 0 0 "[ . 1 . 2]" 1 143 1 5 ALA HA 1 8 VAL HA . . 5.500 5.506 5.392 5.598 0.098 2 0 "[ . 1 . 2]" 1 144 1 5 ALA HA 1 8 VAL HB . . 3.560 2.839 2.742 2.970 . 0 0 "[ . 1 . 2]" 1 145 1 5 ALA HA 1 8 VAL MG1 . . 4.370 4.288 4.177 4.435 0.065 15 0 "[ . 1 . 2]" 1 146 1 5 ALA HA 1 8 VAL MG2 . . 3.410 3.121 2.572 3.293 . 0 0 "[ . 1 . 2]" 1 147 1 5 ALA HA 1 9 ASP H . . 4.150 3.978 3.798 4.197 0.047 6 0 "[ . 1 . 2]" 1 148 1 5 ALA HA 1 19 PHE QE . . 4.930 4.990 4.693 5.020 0.090 20 0 "[ . 1 . 2]" 1 149 1 5 ALA HA 1 49 LEU QD . . 5.180 4.510 4.197 4.832 . 0 0 "[ . 1 . 2]" 1 150 1 5 ALA HA 1 53 LEU QD . . 3.930 3.478 3.202 3.781 . 0 0 "[ . 1 . 2]" 1 151 1 5 ALA HA 1 56 LEU QD . . 5.350 4.173 3.594 5.263 . 0 0 "[ . 1 . 2]" 1 152 1 5 ALA MB 1 6 GLN H . . 2.860 2.640 2.443 2.756 . 0 0 "[ . 1 . 2]" 1 153 1 5 ALA MB 1 6 GLN HA . . 3.940 3.892 3.761 3.943 0.003 6 0 "[ . 1 . 2]" 1 154 1 5 ALA MB 1 6 GLN HB2 . . 5.440 4.641 4.466 4.761 . 0 0 "[ . 1 . 2]" 1 155 1 5 ALA MB 1 6 GLN HB3 . . 5.500 5.295 5.111 5.377 . 0 0 "[ . 1 . 2]" 1 156 1 5 ALA MB 1 6 GLN HG2 . . 4.510 3.806 3.536 4.030 . 0 0 "[ . 1 . 2]" 1 157 1 5 ALA MB 1 6 GLN HG3 . . 4.290 3.482 3.074 4.033 . 0 0 "[ . 1 . 2]" 1 158 1 5 ALA MB 1 7 ILE H . . 4.610 4.513 4.396 4.597 . 0 0 "[ . 1 . 2]" 1 159 1 5 ALA MB 1 8 VAL HB . . 4.700 4.260 4.124 4.361 . 0 0 "[ . 1 . 2]" 1 160 1 5 ALA MB 1 8 VAL MG1 . . 5.500 5.073 4.941 5.224 . 0 0 "[ . 1 . 2]" 1 161 1 5 ALA MB 1 8 VAL MG2 . . 5.500 4.357 4.006 4.499 . 0 0 "[ . 1 . 2]" 1 162 1 5 ALA MB 1 9 ASP H . . 5.030 4.487 4.328 4.680 . 0 0 "[ . 1 . 2]" 1 163 1 5 ALA MB 1 56 LEU MD1 . . 5.500 3.993 3.042 4.618 . 0 0 "[ . 1 . 2]" 1 164 1 5 ALA MB 1 56 LEU MD2 . . 5.500 3.512 2.628 4.641 . 0 0 "[ . 1 . 2]" 1 165 1 6 GLN H 1 6 GLN HB2 . . 2.920 2.469 2.383 2.546 . 0 0 "[ . 1 . 2]" 1 166 1 6 GLN H 1 6 GLN HB3 . . 3.600 3.592 3.552 3.623 0.023 12 0 "[ . 1 . 2]" 1 167 1 6 GLN H 1 6 GLN HG2 . . 3.470 3.148 2.779 3.305 . 0 0 "[ . 1 . 2]" 1 168 1 6 GLN H 1 6 GLN HG3 . . 3.310 2.432 2.150 2.777 . 0 0 "[ . 1 . 2]" 1 169 1 6 GLN H 1 7 ILE HA . . 5.290 5.193 5.102 5.240 . 0 0 "[ . 1 . 2]" 1 170 1 6 GLN H 1 7 ILE HG12 . . 4.240 4.257 4.190 4.293 0.053 10 0 "[ . 1 . 2]" 1 171 1 6 GLN H 1 7 ILE HG13 . . 4.300 4.333 4.224 4.364 0.064 12 0 "[ . 1 . 2]" 1 172 1 6 GLN H 1 8 VAL H . . 4.370 4.080 3.969 4.160 . 0 0 "[ . 1 . 2]" 1 173 1 6 GLN H 1 9 ASP H . . 5.070 4.645 4.534 4.777 . 0 0 "[ . 1 . 2]" 1 174 1 6 GLN HA 1 6 GLN HB2 . . 3.020 3.065 3.023 3.081 0.061 4 0 "[ . 1 . 2]" 1 175 1 6 GLN HA 1 6 GLN HB3 . . 2.830 2.501 2.445 2.547 . 0 0 "[ . 1 . 2]" 1 176 1 6 GLN HA 1 6 GLN HG2 . . 3.170 2.343 2.181 2.588 . 0 0 "[ . 1 . 2]" 1 177 1 6 GLN HA 1 6 GLN HG3 . . 3.580 3.296 3.104 3.599 0.019 2 0 "[ . 1 . 2]" 1 178 1 6 GLN HA 1 8 VAL H . . 4.920 4.466 4.314 4.658 . 0 0 "[ . 1 . 2]" 1 179 1 6 GLN HA 1 9 ASP H . . 3.910 3.427 3.239 3.637 . 0 0 "[ . 1 . 2]" 1 180 1 6 GLN HA 1 9 ASP QB . . 3.180 2.570 2.203 2.819 . 0 0 "[ . 1 . 2]" 1 181 1 6 GLN HB2 1 6 GLN HG3 . . 2.820 2.375 2.216 2.471 . 0 0 "[ . 1 . 2]" 1 182 1 6 GLN HB2 1 7 ILE H . . 3.370 2.822 2.663 3.002 . 0 0 "[ . 1 . 2]" 1 183 1 6 GLN HB2 1 7 ILE MD . . 4.850 4.651 4.421 4.849 . 0 0 "[ . 1 . 2]" 1 184 1 6 GLN HB3 1 7 ILE H . . 3.800 3.777 3.612 3.857 0.057 17 0 "[ . 1 . 2]" 1 185 1 6 GLN HB3 1 9 ASP QB . . 5.340 4.429 4.080 4.645 . 0 0 "[ . 1 . 2]" 1 186 1 6 GLN HG2 1 7 ILE H . . 4.960 4.869 4.624 4.961 0.001 11 0 "[ . 1 . 2]" 1 187 1 6 GLN HG3 1 7 ILE H . . 5.010 4.432 4.168 4.727 . 0 0 "[ . 1 . 2]" 1 188 1 7 ILE H 1 7 ILE HB . . 3.270 2.800 2.707 2.905 . 0 0 "[ . 1 . 2]" 1 189 1 7 ILE H 1 7 ILE MD . . 3.810 3.814 3.720 3.872 0.062 13 0 "[ . 1 . 2]" 1 190 1 7 ILE H 1 7 ILE HG12 . . 3.220 2.270 2.145 2.345 . 0 0 "[ . 1 . 2]" 1 191 1 7 ILE H 1 7 ILE HG13 . . 3.390 2.486 2.413 2.588 . 0 0 "[ . 1 . 2]" 1 192 1 7 ILE H 1 7 ILE MG . . 3.810 3.768 3.723 3.813 0.003 20 0 "[ . 1 . 2]" 1 193 1 7 ILE H 1 8 VAL H . . 3.360 2.560 2.490 2.706 . 0 0 "[ . 1 . 2]" 1 194 1 7 ILE H 1 8 VAL MG2 . . 4.080 4.132 4.013 4.165 0.085 4 0 "[ . 1 . 2]" 1 195 1 7 ILE H 1 9 ASP H . . 4.180 4.044 3.827 4.164 . 0 0 "[ . 1 . 2]" 1 196 1 7 ILE H 1 9 ASP QB . . 4.820 4.783 4.432 4.895 0.075 13 0 "[ . 1 . 2]" 1 197 1 7 ILE H 1 49 LEU MD1 . . 4.670 4.386 3.868 4.752 0.082 2 0 "[ . 1 . 2]" 1 198 1 7 ILE H 1 49 LEU QD . . 3.940 3.713 3.500 3.933 . 0 0 "[ . 1 . 2]" 1 199 1 7 ILE H 1 49 LEU MD2 . . 4.670 4.040 3.687 4.205 . 0 0 "[ . 1 . 2]" 1 200 1 7 ILE HA 1 7 ILE MD . . 3.590 3.559 3.268 3.661 0.071 7 0 "[ . 1 . 2]" 1 201 1 7 ILE HA 1 7 ILE HG12 . . 3.970 2.804 2.602 2.875 . 0 0 "[ . 1 . 2]" 1 202 1 7 ILE HA 1 7 ILE HG13 . . 3.760 3.800 3.738 3.819 0.059 3 0 "[ . 1 . 2]" 1 203 1 7 ILE HA 1 7 ILE MG . . 3.430 2.252 2.153 2.364 . 0 0 "[ . 1 . 2]" 1 204 1 7 ILE HA 1 9 ASP H . . 4.510 4.472 4.232 4.568 0.058 7 0 "[ . 1 . 2]" 1 205 1 7 ILE HA 1 10 GLU H . . 3.800 3.704 3.591 3.851 0.051 7 0 "[ . 1 . 2]" 1 206 1 7 ILE HA 1 10 GLU HB2 . . 4.550 3.896 3.246 4.607 0.057 20 0 "[ . 1 . 2]" 1 207 1 7 ILE HA 1 10 GLU QB . . 3.850 3.124 2.862 3.413 . 0 0 "[ . 1 . 2]" 1 208 1 7 ILE HA 1 10 GLU HB3 . . 4.550 3.354 2.971 3.746 . 0 0 "[ . 1 . 2]" 1 209 1 7 ILE HA 1 10 GLU QG . . 5.340 4.770 3.730 5.328 . 0 0 "[ . 1 . 2]" 1 210 1 7 ILE HA 1 11 ALA H . . 5.320 4.764 4.522 4.962 . 0 0 "[ . 1 . 2]" 1 211 1 7 ILE HA 1 41 LYS HE3 . . 4.700 2.870 2.672 3.354 . 0 0 "[ . 1 . 2]" 1 212 1 7 ILE HA 1 49 LEU QD . . 5.440 4.123 4.000 4.177 . 0 0 "[ . 1 . 2]" 1 213 1 7 ILE HB 1 7 ILE MD . . 3.260 2.915 2.826 2.995 . 0 0 "[ . 1 . 2]" 1 214 1 7 ILE HB 1 8 VAL H . . 3.500 2.719 2.588 2.859 . 0 0 "[ . 1 . 2]" 1 215 1 7 ILE HB 1 8 VAL HA . . 4.680 4.168 4.028 4.253 . 0 0 "[ . 1 . 2]" 1 216 1 7 ILE HB 1 8 VAL MG2 . . 3.340 3.326 3.006 3.418 0.078 15 0 "[ . 1 . 2]" 1 217 1 7 ILE HB 1 11 ALA MB . . 5.500 5.354 5.192 5.524 0.024 10 0 "[ . 1 . 2]" 1 218 1 7 ILE HB 1 18 LEU QD . . 4.430 3.876 3.713 4.131 . 0 0 "[ . 1 . 2]" 1 219 1 7 ILE HB 1 41 LYS HE3 . . 4.920 4.880 4.532 4.994 0.074 12 0 "[ . 1 . 2]" 1 220 1 7 ILE HB 1 42 TRP HA . . 5.500 5.519 5.392 5.579 0.079 20 0 "[ . 1 . 2]" 1 221 1 7 ILE HB 1 49 LEU QD . . 3.290 1.923 1.837 1.970 . 0 0 "[ . 1 . 2]" 1 222 1 7 ILE HB 1 49 LEU HG . . 5.500 3.283 2.955 3.693 . 0 0 "[ . 1 . 2]" 1 223 1 7 ILE MD 1 7 ILE MG . . 2.850 1.903 1.728 1.935 . 0 0 "[ . 1 . 2]" 1 224 1 7 ILE MD 1 8 VAL H . . 4.930 4.994 4.872 5.018 0.088 4 0 "[ . 1 . 2]" 1 225 1 7 ILE MD 1 8 VAL MG2 . . 5.500 5.168 5.003 5.263 . 0 0 "[ . 1 . 2]" 1 226 1 7 ILE MD 1 41 LYS QD . . 3.420 2.291 1.942 2.484 . 0 0 "[ . 1 . 2]" 1 227 1 7 ILE MD 1 41 LYS HE3 . . 3.910 3.668 3.037 3.958 0.048 3 0 "[ . 1 . 2]" 1 228 1 7 ILE MD 1 41 LYS HG2 . . 3.490 2.853 2.637 3.169 . 0 0 "[ . 1 . 2]" 1 229 1 7 ILE MD 1 41 LYS HG3 . . 3.720 2.613 2.423 2.872 . 0 0 "[ . 1 . 2]" 1 230 1 7 ILE MD 1 42 TRP HD1 . . 4.400 3.590 3.310 3.721 . 0 0 "[ . 1 . 2]" 1 231 1 7 ILE MD 1 42 TRP HE1 . . 4.760 4.776 4.487 4.849 0.089 17 0 "[ . 1 . 2]" 1 232 1 7 ILE MD 1 45 HIS H . . 4.860 4.428 4.258 4.510 . 0 0 "[ . 1 . 2]" 1 233 1 7 ILE MD 1 45 HIS HB2 . . 4.620 2.528 2.403 2.622 . 0 0 "[ . 1 . 2]" 1 234 1 7 ILE MD 1 45 HIS HB3 . . 3.970 2.767 2.522 3.095 . 0 0 "[ . 1 . 2]" 1 235 1 7 ILE MD 1 45 HIS HD2 . . 3.760 3.492 2.783 3.835 0.075 6 0 "[ . 1 . 2]" 1 236 1 7 ILE MD 1 46 LYS H . . 5.500 5.568 5.455 5.594 0.094 1 0 "[ . 1 . 2]" 1 237 1 7 ILE MD 1 48 GLU QB . . 3.880 3.229 2.869 3.505 . 0 0 "[ . 1 . 2]" 1 238 1 7 ILE MD 1 49 LEU H . . 4.590 4.325 4.026 4.584 . 0 0 "[ . 1 . 2]" 1 239 1 7 ILE MD 1 49 LEU HA . . 5.020 4.810 4.514 5.044 0.024 18 0 "[ . 1 . 2]" 1 240 1 7 ILE MD 1 49 LEU MD1 . . 3.650 2.699 1.881 3.753 0.103 19 0 "[ . 1 . 2]" 1 241 1 7 ILE MD 1 49 LEU QD . . 2.930 1.979 1.875 2.073 . 0 0 "[ . 1 . 2]" 1 242 1 7 ILE MD 1 49 LEU MD2 . . 3.650 2.993 1.939 3.764 0.114 5 0 "[ . 1 . 2]" 1 243 1 7 ILE HG12 1 8 VAL H . . 4.310 4.348 4.251 4.374 0.064 7 0 "[ . 1 . 2]" 1 244 1 7 ILE HG12 1 45 HIS HB2 . . 5.500 5.406 5.258 5.554 0.054 1 0 "[ . 1 . 2]" 1 245 1 7 ILE HG13 1 7 ILE MG . . 3.240 3.074 3.011 3.118 . 0 0 "[ . 1 . 2]" 1 246 1 7 ILE MG 1 8 VAL H . . 3.890 3.822 3.739 3.924 0.034 3 0 "[ . 1 . 2]" 1 247 1 7 ILE MG 1 10 GLU H . . 4.930 4.845 4.655 4.965 0.035 7 0 "[ . 1 . 2]" 1 248 1 7 ILE MG 1 10 GLU QB . . 4.090 3.807 3.534 4.176 0.086 1 0 "[ . 1 . 2]" 1 249 1 7 ILE MG 1 11 ALA MB . . 4.460 4.080 3.918 4.292 . 0 0 "[ . 1 . 2]" 1 250 1 7 ILE MG 1 18 LEU MD1 . . 4.130 3.686 3.457 4.006 . 0 0 "[ . 1 . 2]" 1 251 1 7 ILE MG 1 18 LEU QD . . 3.330 3.182 2.996 3.451 0.121 17 0 "[ . 1 . 2]" 1 252 1 7 ILE MG 1 18 LEU MD2 . . 4.130 3.481 3.229 3.845 . 0 0 "[ . 1 . 2]" 1 253 1 7 ILE MG 1 38 LEU HA . . 5.280 4.481 4.179 4.666 . 0 0 "[ . 1 . 2]" 1 254 1 7 ILE MG 1 38 LEU HB3 . . 5.290 4.571 4.414 4.755 . 0 0 "[ . 1 . 2]" 1 255 1 7 ILE MG 1 41 LYS H . . 5.500 5.492 5.358 5.586 0.086 20 0 "[ . 1 . 2]" 1 256 1 7 ILE MG 1 41 LYS QD . . 3.310 2.397 2.101 2.710 . 0 0 "[ . 1 . 2]" 1 257 1 7 ILE MG 1 41 LYS HE3 . . 3.900 2.148 1.833 2.451 . 0 0 "[ . 1 . 2]" 1 258 1 7 ILE MG 1 41 LYS HG2 . . 3.750 2.397 2.254 2.629 . 0 0 "[ . 1 . 2]" 1 259 1 7 ILE MG 1 41 LYS HG3 . . 3.480 3.288 2.985 3.566 0.086 1 0 "[ . 1 . 2]" 1 260 1 7 ILE MG 1 42 TRP H . . 4.470 4.214 4.086 4.403 . 0 0 "[ . 1 . 2]" 1 261 1 7 ILE MG 1 42 TRP HA . . 3.920 3.068 2.873 3.170 . 0 0 "[ . 1 . 2]" 1 262 1 7 ILE MG 1 42 TRP HD1 . . 3.000 2.044 1.959 2.129 . 0 0 "[ . 1 . 2]" 1 263 1 7 ILE MG 1 42 TRP HE1 . . 3.240 1.993 1.791 2.113 . 0 0 "[ . 1 . 2]" 1 264 1 7 ILE MG 1 45 HIS H . . 5.300 5.169 5.053 5.362 0.062 1 0 "[ . 1 . 2]" 1 265 1 7 ILE MG 1 49 LEU HA . . 5.500 5.593 5.450 5.620 0.120 11 0 "[ . 1 . 2]" 1 266 1 7 ILE MG 1 49 LEU MD1 . . 3.450 2.373 1.802 3.233 . 0 0 "[ . 1 . 2]" 1 267 1 7 ILE MG 1 49 LEU QD . . 2.800 2.011 1.787 2.257 . 0 0 "[ . 1 . 2]" 1 268 1 7 ILE MG 1 49 LEU MD2 . . 3.450 2.703 2.182 3.277 . 0 0 "[ . 1 . 2]" 1 269 1 8 VAL H 1 8 VAL HB . . 3.090 2.607 2.523 2.806 . 0 0 "[ . 1 . 2]" 1 270 1 8 VAL H 1 8 VAL MG1 . . 3.930 3.831 3.763 3.857 . 0 0 "[ . 1 . 2]" 1 271 1 8 VAL H 1 8 VAL MG2 . . 2.900 2.260 2.064 2.368 . 0 0 "[ . 1 . 2]" 1 272 1 8 VAL H 1 9 ASP H . . 3.320 2.669 2.566 2.924 . 0 0 "[ . 1 . 2]" 1 273 1 8 VAL H 1 9 ASP HA . . 5.500 5.265 5.174 5.509 0.009 20 0 "[ . 1 . 2]" 1 274 1 8 VAL H 1 9 ASP QB . . 4.690 4.360 4.219 4.634 . 0 0 "[ . 1 . 2]" 1 275 1 8 VAL H 1 11 ALA H . . 5.340 4.891 4.752 4.968 . 0 0 "[ . 1 . 2]" 1 276 1 8 VAL H 1 11 ALA MB . . 5.130 4.809 4.710 4.908 . 0 0 "[ . 1 . 2]" 1 277 1 8 VAL H 1 18 LEU MD1 . . 5.500 4.024 3.886 4.209 . 0 0 "[ . 1 . 2]" 1 278 1 8 VAL H 1 18 LEU QD . . 4.080 3.928 3.787 4.091 0.011 7 0 "[ . 1 . 2]" 1 279 1 8 VAL H 1 18 LEU MD2 . . 5.500 5.490 5.229 5.575 0.075 12 0 "[ . 1 . 2]" 1 280 1 8 VAL H 1 49 LEU QD . . 3.580 3.049 2.796 3.250 . 0 0 "[ . 1 . 2]" 1 281 1 8 VAL HA 1 8 VAL MG1 . . 3.260 2.328 2.241 2.400 . 0 0 "[ . 1 . 2]" 1 282 1 8 VAL HA 1 8 VAL MG2 . . 3.050 2.490 2.435 2.541 . 0 0 "[ . 1 . 2]" 1 283 1 8 VAL HA 1 10 GLU H . . 4.750 4.412 4.312 4.525 . 0 0 "[ . 1 . 2]" 1 284 1 8 VAL HA 1 11 ALA H . . 3.920 3.247 3.154 3.361 . 0 0 "[ . 1 . 2]" 1 285 1 8 VAL HA 1 11 ALA HA . . 5.500 5.169 5.081 5.291 . 0 0 "[ . 1 . 2]" 1 286 1 8 VAL HA 1 11 ALA MB . . 3.580 2.537 2.446 2.627 . 0 0 "[ . 1 . 2]" 1 287 1 8 VAL HA 1 12 LEU QD . . 4.680 4.433 4.190 4.744 0.064 7 0 "[ . 1 . 2]" 1 288 1 8 VAL HA 1 18 LEU QD . . 3.370 2.171 2.032 2.267 . 0 0 "[ . 1 . 2]" 1 289 1 8 VAL HA 1 42 TRP HE1 . . 5.250 4.471 4.262 4.800 . 0 0 "[ . 1 . 2]" 1 290 1 8 VAL HA 1 49 LEU QD . . 4.110 3.631 3.468 3.928 . 0 0 "[ . 1 . 2]" 1 291 1 8 VAL HA 1 53 LEU QD . . 5.440 4.599 4.421 4.792 . 0 0 "[ . 1 . 2]" 1 292 1 8 VAL HB 1 9 ASP H . . 3.330 2.751 2.602 2.859 . 0 0 "[ . 1 . 2]" 1 293 1 8 VAL HB 1 18 LEU QD . . 4.370 3.996 3.865 4.174 . 0 0 "[ . 1 . 2]" 1 294 1 8 VAL HB 1 49 LEU QD . . 4.230 4.136 3.990 4.277 0.047 9 0 "[ . 1 . 2]" 1 295 1 8 VAL MG1 1 9 ASP H . . 3.630 3.594 3.489 3.711 0.081 20 0 "[ . 1 . 2]" 1 296 1 8 VAL MG1 1 9 ASP HA . . 5.500 3.597 3.454 3.753 . 0 0 "[ . 1 . 2]" 1 297 1 8 VAL MG1 1 11 ALA H . . 4.450 4.209 4.114 4.267 . 0 0 "[ . 1 . 2]" 1 298 1 8 VAL MG1 1 11 ALA HA . . 5.500 5.591 5.571 5.628 0.128 2 0 "[ . 1 . 2]" 1 299 1 8 VAL MG1 1 11 ALA MB . . 3.190 2.897 2.861 3.050 . 0 0 "[ . 1 . 2]" 1 300 1 8 VAL MG1 1 12 LEU HA . . 5.500 5.029 4.825 5.277 . 0 0 "[ . 1 . 2]" 1 301 1 8 VAL MG1 1 12 LEU QD . . 5.460 2.353 2.086 2.736 . 0 0 "[ . 1 . 2]" 1 302 1 8 VAL MG1 1 12 LEU HG . . 3.600 2.539 2.365 2.877 . 0 0 "[ . 1 . 2]" 1 303 1 8 VAL MG1 1 18 LEU H . . 3.510 3.348 3.157 3.556 0.046 7 0 "[ . 1 . 2]" 1 304 1 8 VAL MG1 1 18 LEU HA . . 5.320 5.282 5.135 5.383 0.063 17 0 "[ . 1 . 2]" 1 305 1 8 VAL MG1 1 18 LEU HB2 . . 5.500 5.133 4.956 5.333 . 0 0 "[ . 1 . 2]" 1 306 1 8 VAL MG1 1 18 LEU QD . . 3.120 2.205 2.034 2.662 . 0 0 "[ . 1 . 2]" 1 307 1 8 VAL MG1 1 18 LEU HG . . 5.030 3.845 3.092 4.374 . 0 0 "[ . 1 . 2]" 1 308 1 8 VAL MG1 1 19 PHE HB2 . . 5.500 4.474 4.241 4.626 . 0 0 "[ . 1 . 2]" 1 309 1 8 VAL MG1 1 19 PHE QD . . 3.210 2.649 2.202 2.923 . 0 0 "[ . 1 . 2]" 1 310 1 8 VAL MG1 1 49 LEU QD . . 4.040 3.989 3.838 4.139 0.099 18 0 "[ . 1 . 2]" 1 311 1 8 VAL MG1 1 53 LEU MD1 . . 5.500 3.816 3.583 3.934 . 0 0 "[ . 1 . 2]" 1 312 1 8 VAL MG1 1 53 LEU QD . . 4.800 3.406 3.251 3.513 . 0 0 "[ . 1 . 2]" 1 313 1 8 VAL MG1 1 53 LEU MD2 . . 5.500 3.834 3.706 4.009 . 0 0 "[ . 1 . 2]" 1 314 1 8 VAL MG2 1 9 ASP H . . 3.930 3.961 3.824 4.002 0.072 7 0 "[ . 1 . 2]" 1 315 1 8 VAL MG2 1 18 LEU MD1 . . 3.960 2.030 1.952 2.495 . 0 0 "[ . 1 . 2]" 1 316 1 8 VAL MG2 1 18 LEU QD . . 2.960 2.023 1.946 2.472 . 0 0 "[ . 1 . 2]" 1 317 1 8 VAL MG2 1 18 LEU MD2 . . 3.960 3.893 3.704 4.021 0.061 20 0 "[ . 1 . 2]" 1 318 1 8 VAL MG2 1 19 PHE QE . . 3.290 2.907 2.662 3.117 . 0 0 "[ . 1 . 2]" 1 319 1 8 VAL MG2 1 20 VAL H . . 5.500 5.259 5.044 5.510 0.010 20 0 "[ . 1 . 2]" 1 320 1 8 VAL MG2 1 20 VAL MG2 . . 5.500 5.297 5.099 5.580 0.080 20 0 "[ . 1 . 2]" 1 321 1 8 VAL MG2 1 49 LEU HA . . 5.500 4.727 4.562 4.839 . 0 0 "[ . 1 . 2]" 1 322 1 8 VAL MG2 1 49 LEU QD . . 5.440 2.019 1.877 2.113 . 0 0 "[ . 1 . 2]" 1 323 1 8 VAL MG2 1 49 LEU HG . . 4.010 4.032 3.842 4.097 0.087 13 0 "[ . 1 . 2]" 1 324 1 8 VAL MG2 1 53 LEU H . . 5.500 5.532 5.386 5.589 0.089 12 0 "[ . 1 . 2]" 1 325 1 8 VAL MG2 1 53 LEU HB2 . . 5.460 5.170 5.020 5.296 . 0 0 "[ . 1 . 2]" 1 326 1 8 VAL MG2 1 53 LEU QD . . 3.370 1.940 1.828 2.046 . 0 0 "[ . 1 . 2]" 1 327 1 9 ASP H 1 9 ASP HB2 . . 3.400 2.205 2.094 2.377 . 0 0 "[ . 1 . 2]" 1 328 1 9 ASP H 1 9 ASP QB . . 2.830 2.142 2.064 2.231 . 0 0 "[ . 1 . 2]" 1 329 1 9 ASP H 1 9 ASP HB3 . . 3.400 3.030 2.586 3.470 0.070 7 0 "[ . 1 . 2]" 1 330 1 9 ASP H 1 11 ALA H . . 4.190 4.083 3.977 4.172 . 0 0 "[ . 1 . 2]" 1 331 1 9 ASP H 1 11 ALA MB . . 4.840 4.791 4.699 4.875 0.035 5 0 "[ . 1 . 2]" 1 332 1 9 ASP H 1 18 LEU QD . . 5.020 5.033 4.883 5.103 0.083 17 0 "[ . 1 . 2]" 1 333 1 9 ASP H 1 49 LEU QD . . 5.360 5.129 4.950 5.265 . 0 0 "[ . 1 . 2]" 1 334 1 9 ASP HA 1 10 GLU HA . . 5.500 4.826 4.722 4.949 . 0 0 "[ . 1 . 2]" 1 335 1 9 ASP HA 1 11 ALA H . . 4.130 4.168 4.084 4.195 0.065 17 0 "[ . 1 . 2]" 1 336 1 9 ASP HA 1 11 ALA MB . . 4.800 4.770 4.615 4.873 0.073 17 0 "[ . 1 . 2]" 1 337 1 9 ASP HA 1 12 LEU HB2 . . 3.740 3.173 2.905 3.412 . 0 0 "[ . 1 . 2]" 1 338 1 9 ASP HA 1 12 LEU HB3 . . 4.980 4.771 4.513 5.037 0.057 7 0 "[ . 1 . 2]" 1 339 1 9 ASP HA 1 12 LEU QD . . 5.500 2.697 2.261 3.352 . 0 0 "[ . 1 . 2]" 1 340 1 9 ASP HA 1 12 LEU HG . . 5.500 3.285 2.652 3.880 . 0 0 "[ . 1 . 2]" 1 341 1 9 ASP HA 1 13 GLU H . . 4.480 4.190 3.964 4.466 . 0 0 "[ . 1 . 2]" 1 342 1 9 ASP QB 1 10 GLU H . . 3.300 2.481 2.248 2.816 . 0 0 "[ . 1 . 2]" 1 343 1 9 ASP QB 1 10 GLU QB . . 4.760 3.736 3.520 4.009 . 0 0 "[ . 1 . 2]" 1 344 1 9 ASP QB 1 11 ALA H . . 4.980 4.531 4.412 4.666 . 0 0 "[ . 1 . 2]" 1 345 1 9 ASP QB 1 12 LEU QD . . 5.340 4.349 3.927 4.769 . 0 0 "[ . 1 . 2]" 1 346 1 9 ASP QB 1 13 GLU H . . 5.160 5.106 4.767 5.245 0.085 18 0 "[ . 1 . 2]" 1 347 1 9 ASP QB 1 13 GLU HG2 . . 4.810 4.709 4.077 4.885 0.075 20 0 "[ . 1 . 2]" 1 348 1 10 GLU H 1 10 GLU HB2 . . 3.310 2.483 2.135 3.268 . 0 0 "[ . 1 . 2]" 1 349 1 10 GLU H 1 10 GLU QB . . 2.860 2.168 1.895 2.326 . 0 0 "[ . 1 . 2]" 1 350 1 10 GLU H 1 10 GLU HB3 . . 3.310 2.532 1.908 2.853 . 0 0 "[ . 1 . 2]" 1 351 1 10 GLU H 1 11 ALA H . . 3.210 2.674 2.588 2.752 . 0 0 "[ . 1 . 2]" 1 352 1 10 GLU H 1 11 ALA MB . . 4.390 4.372 4.284 4.461 0.071 8 0 "[ . 1 . 2]" 1 353 1 10 GLU H 1 12 LEU H . . 4.730 4.412 4.321 4.588 . 0 0 "[ . 1 . 2]" 1 354 1 10 GLU H 1 13 GLU H . . 5.130 4.916 4.820 5.101 . 0 0 "[ . 1 . 2]" 1 355 1 10 GLU H 1 13 GLU HG2 . . 5.500 4.404 4.269 4.560 . 0 0 "[ . 1 . 2]" 1 356 1 10 GLU HA 1 13 GLU HG2 . . 2.840 2.059 1.960 2.248 . 0 0 "[ . 1 . 2]" 1 357 1 10 GLU HA 1 13 GLU HG3 . . 3.210 3.095 2.663 3.260 0.050 11 0 "[ . 1 . 2]" 1 358 1 10 GLU HA 1 14 GLN HG2 . . 5.500 4.290 3.989 4.551 . 0 0 "[ . 1 . 2]" 1 359 1 10 GLU QB 1 11 ALA H . . 3.150 2.864 2.555 3.232 0.082 1 0 "[ . 1 . 2]" 1 360 1 10 GLU QB 1 11 ALA MB . . 5.340 4.074 3.692 4.592 . 0 0 "[ . 1 . 2]" 1 361 1 10 GLU QB 1 38 LEU MD2 . . 3.540 3.226 2.749 3.637 0.097 20 0 "[ . 1 . 2]" 1 362 1 10 GLU QB 1 38 LEU HG . . 5.340 5.248 4.765 5.439 0.099 20 0 "[ . 1 . 2]" 1 363 1 10 GLU QG 1 11 ALA H . . 4.440 3.842 2.430 4.194 . 0 0 "[ . 1 . 2]" 1 364 1 10 GLU QG 1 38 LEU MD1 . . 4.620 4.231 3.753 4.461 . 0 0 "[ . 1 . 2]" 1 365 1 10 GLU QG 1 38 LEU MD2 . . 4.190 2.039 1.867 2.255 . 0 0 "[ . 1 . 2]" 1 366 1 10 GLU HG2 1 38 LEU MD1 . . 5.440 4.547 4.148 5.026 . 0 0 "[ . 1 . 2]" 1 367 1 10 GLU HG3 1 38 LEU MD1 . . 5.440 5.195 4.204 5.532 0.092 6 0 "[ . 1 . 2]" 1 368 1 11 ALA H 1 11 ALA MB . . 2.950 2.242 2.089 2.298 . 0 0 "[ . 1 . 2]" 1 369 1 11 ALA H 1 12 LEU H . . 3.220 2.642 2.564 2.721 . 0 0 "[ . 1 . 2]" 1 370 1 11 ALA H 1 12 LEU QD . . 4.600 4.561 4.286 4.681 0.081 4 0 "[ . 1 . 2]" 1 371 1 11 ALA H 1 12 LEU HG . . 4.260 4.225 4.019 4.335 0.075 20 0 "[ . 1 . 2]" 1 372 1 11 ALA H 1 13 GLU H . . 4.270 4.169 4.066 4.281 0.011 19 0 "[ . 1 . 2]" 1 373 1 11 ALA H 1 13 GLU HG2 . . 4.860 4.534 4.085 4.902 0.042 15 0 "[ . 1 . 2]" 1 374 1 11 ALA H 1 14 GLN H . . 4.760 4.738 4.604 4.818 0.058 13 0 "[ . 1 . 2]" 1 375 1 11 ALA H 1 14 GLN HB2 . . 4.960 5.001 4.729 5.028 0.068 10 0 "[ . 1 . 2]" 1 376 1 11 ALA H 1 18 LEU QD . . 4.620 4.093 3.879 4.250 . 0 0 "[ . 1 . 2]" 1 377 1 11 ALA H 1 38 LEU MD1 . . 5.500 5.473 5.318 5.599 0.099 2 0 "[ . 1 . 2]" 1 378 1 11 ALA H 1 42 TRP HE1 . . 4.950 4.366 4.177 4.601 . 0 0 "[ . 1 . 2]" 1 379 1 11 ALA H 1 42 TRP HZ2 . . 4.360 3.909 3.720 4.161 . 0 0 "[ . 1 . 2]" 1 380 1 11 ALA HA 1 14 GLN H . . 3.910 3.544 3.378 3.615 . 0 0 "[ . 1 . 2]" 1 381 1 11 ALA HA 1 14 GLN HA . . 5.500 5.560 5.352 5.575 0.075 6 0 "[ . 1 . 2]" 1 382 1 11 ALA HA 1 14 GLN HB2 . . 3.630 2.706 2.494 2.760 . 0 0 "[ . 1 . 2]" 1 383 1 11 ALA HA 1 14 GLN HG2 . . 4.990 4.442 4.129 4.813 . 0 0 "[ . 1 . 2]" 1 384 1 11 ALA HA 1 14 GLN HG3 . . 5.350 4.329 3.791 4.642 . 0 0 "[ . 1 . 2]" 1 385 1 11 ALA HA 1 16 ILE H . . 3.990 3.619 3.501 3.710 . 0 0 "[ . 1 . 2]" 1 386 1 11 ALA HA 1 16 ILE HB . . 3.590 3.097 2.995 3.180 . 0 0 "[ . 1 . 2]" 1 387 1 11 ALA HA 1 16 ILE MD . . 4.560 4.392 4.235 4.505 . 0 0 "[ . 1 . 2]" 1 388 1 11 ALA HA 1 16 ILE HG13 . . 3.780 3.477 3.299 3.634 . 0 0 "[ . 1 . 2]" 1 389 1 11 ALA HA 1 16 ILE MG . . 4.490 4.527 4.382 4.578 0.088 7 0 "[ . 1 . 2]" 1 390 1 11 ALA HA 1 18 LEU QD . . 5.440 4.344 3.776 4.581 . 0 0 "[ . 1 . 2]" 1 391 1 11 ALA HA 1 38 LEU MD1 . . 5.500 3.707 3.505 3.921 . 0 0 "[ . 1 . 2]" 1 392 1 11 ALA HA 1 38 LEU MD2 . . 5.500 2.177 2.030 2.323 . 0 0 "[ . 1 . 2]" 1 393 1 11 ALA HA 1 42 TRP HE1 . . 5.050 4.763 4.617 4.969 . 0 0 "[ . 1 . 2]" 1 394 1 11 ALA HA 1 42 TRP HZ2 . . 4.010 2.608 2.421 2.751 . 0 0 "[ . 1 . 2]" 1 395 1 11 ALA MB 1 12 LEU H . . 3.120 2.331 2.227 2.459 . 0 0 "[ . 1 . 2]" 1 396 1 11 ALA MB 1 12 LEU QD . . 3.240 3.094 2.472 3.360 0.120 14 0 "[ . 1 . 2]" 1 397 1 11 ALA MB 1 12 LEU HG . . 4.040 3.148 2.851 3.460 . 0 0 "[ . 1 . 2]" 1 398 1 11 ALA MB 1 13 GLU H . . 4.650 4.587 4.477 4.679 0.029 15 0 "[ . 1 . 2]" 1 399 1 11 ALA MB 1 14 GLN H . . 4.670 4.570 4.416 4.655 . 0 0 "[ . 1 . 2]" 1 400 1 11 ALA MB 1 14 GLN HB2 . . 4.380 4.280 4.083 4.367 . 0 0 "[ . 1 . 2]" 1 401 1 11 ALA MB 1 14 GLN HB3 . . 5.500 5.460 5.046 5.571 0.071 5 0 "[ . 1 . 2]" 1 402 1 11 ALA MB 1 16 ILE H . . 3.930 3.761 3.597 3.841 . 0 0 "[ . 1 . 2]" 1 403 1 11 ALA MB 1 16 ILE HB . . 5.500 2.135 1.958 2.271 . 0 0 "[ . 1 . 2]" 1 404 1 11 ALA MB 1 16 ILE HG12 . . 3.760 3.540 3.392 3.677 . 0 0 "[ . 1 . 2]" 1 405 1 11 ALA MB 1 17 THR H . . 4.470 4.478 4.344 4.548 0.078 8 0 "[ . 1 . 2]" 1 406 1 11 ALA MB 1 18 LEU H . . 4.130 3.095 2.952 3.234 . 0 0 "[ . 1 . 2]" 1 407 1 11 ALA MB 1 18 LEU MD1 . . 3.610 2.596 2.121 2.868 . 0 0 "[ . 1 . 2]" 1 408 1 11 ALA MB 1 18 LEU QD . . 2.980 2.332 1.996 2.536 . 0 0 "[ . 1 . 2]" 1 409 1 11 ALA MB 1 18 LEU MD2 . . 3.610 2.808 2.045 3.157 . 0 0 "[ . 1 . 2]" 1 410 1 11 ALA MB 1 18 LEU HG . . 3.200 2.299 2.189 2.477 . 0 0 "[ . 1 . 2]" 1 411 1 11 ALA MB 1 28 GLU H . . 5.500 5.571 5.306 5.598 0.098 16 0 "[ . 1 . 2]" 1 412 1 11 ALA MB 1 38 LEU MD1 . . 5.500 3.984 3.884 4.132 . 0 0 "[ . 1 . 2]" 1 413 1 11 ALA MB 1 38 LEU MD2 . . 3.670 3.233 3.041 3.381 . 0 0 "[ . 1 . 2]" 1 414 1 11 ALA MB 1 42 TRP HE1 . . 3.660 3.345 3.113 3.700 0.040 1 0 "[ . 1 . 2]" 1 415 1 11 ALA MB 1 42 TRP HZ2 . . 3.590 2.029 1.908 2.116 . 0 0 "[ . 1 . 2]" 1 416 1 12 LEU H 1 12 LEU HB2 . . 2.910 2.645 2.532 2.771 . 0 0 "[ . 1 . 2]" 1 417 1 12 LEU H 1 12 LEU HB3 . . 3.640 3.629 3.576 3.670 0.030 20 0 "[ . 1 . 2]" 1 418 1 12 LEU H 1 12 LEU QD . . 3.020 2.881 2.505 3.024 0.004 9 0 "[ . 1 . 2]" 1 419 1 12 LEU H 1 12 LEU HG . . 2.880 2.069 1.947 2.220 . 0 0 "[ . 1 . 2]" 1 420 1 12 LEU H 1 13 GLU H . . 3.220 2.864 2.783 2.950 . 0 0 "[ . 1 . 2]" 1 421 1 12 LEU H 1 13 GLU HB3 . . 5.500 5.507 5.231 5.568 0.068 18 0 "[ . 1 . 2]" 1 422 1 12 LEU H 1 14 GLN H . . 4.130 4.071 3.985 4.161 0.031 19 0 "[ . 1 . 2]" 1 423 1 12 LEU H 1 16 ILE H . . 4.910 4.744 4.615 4.833 . 0 0 "[ . 1 . 2]" 1 424 1 12 LEU H 1 18 LEU QD . . 5.030 4.672 4.423 4.985 . 0 0 "[ . 1 . 2]" 1 425 1 12 LEU HA 1 12 LEU QD . . 2.860 2.204 2.144 2.273 . 0 0 "[ . 1 . 2]" 1 426 1 12 LEU HA 1 12 LEU HG . . 3.920 3.209 2.973 3.534 . 0 0 "[ . 1 . 2]" 1 427 1 12 LEU HA 1 15 GLY H . . 3.620 3.275 3.075 3.492 . 0 0 "[ . 1 . 2]" 1 428 1 12 LEU HA 1 16 ILE H . . 3.580 3.434 3.293 3.561 . 0 0 "[ . 1 . 2]" 1 429 1 12 LEU HA 1 16 ILE MD . . 5.500 5.595 5.587 5.605 0.105 3 0 "[ . 1 . 2]" 1 430 1 12 LEU HB2 1 13 GLU H . . 3.690 2.568 2.447 2.715 . 0 0 "[ . 1 . 2]" 1 431 1 12 LEU HB2 1 14 GLN H . . 4.910 4.855 4.719 4.944 0.034 1 0 "[ . 1 . 2]" 1 432 1 12 LEU HB3 1 12 LEU QD . . 3.200 2.151 2.076 2.187 . 0 0 "[ . 1 . 2]" 1 433 1 12 LEU HB3 1 13 GLU H . . 3.880 3.692 3.539 3.873 . 0 0 "[ . 1 . 2]" 1 434 1 12 LEU QD 1 13 GLU H . . 4.010 4.052 3.935 4.112 0.102 20 0 "[ . 1 . 2]" 1 435 1 12 LEU QD 1 13 GLU HG2 . . 5.500 5.520 5.304 5.585 0.085 3 0 "[ . 1 . 2]" 1 436 1 12 LEU QD 1 16 ILE H . . 5.500 4.539 4.220 4.775 . 0 0 "[ . 1 . 2]" 1 437 1 12 LEU QD 1 17 THR HA . . 3.050 2.573 2.292 2.752 . 0 0 "[ . 1 . 2]" 1 438 1 12 LEU QD 1 17 THR HB . . 3.870 3.621 2.929 3.963 0.093 10 0 "[ . 1 . 2]" 1 439 1 12 LEU QD 1 18 LEU H . . 3.520 3.491 3.250 3.601 0.081 9 0 "[ . 1 . 2]" 1 440 1 12 LEU QD 1 19 PHE HB2 . . 5.500 5.337 5.158 5.538 0.038 3 0 "[ . 1 . 2]" 1 441 1 12 LEU HG 1 13 GLU H . . 4.170 4.216 4.039 4.241 0.071 9 0 "[ . 1 . 2]" 1 442 1 12 LEU HG 1 18 LEU QD . . 4.980 4.687 4.305 5.011 0.031 13 0 "[ . 1 . 2]" 1 443 1 13 GLU H 1 13 GLU HA . . 2.870 2.888 2.825 2.911 0.041 1 0 "[ . 1 . 2]" 1 444 1 13 GLU H 1 13 GLU HB3 . . 2.790 2.723 2.517 2.811 0.021 13 0 "[ . 1 . 2]" 1 445 1 13 GLU H 1 13 GLU HG2 . . 5.500 2.306 1.973 2.655 . 0 0 "[ . 1 . 2]" 1 446 1 13 GLU H 1 13 GLU HG3 . . 3.310 3.223 2.701 3.380 0.070 16 0 "[ . 1 . 2]" 1 447 1 13 GLU H 1 14 GLN H . . 3.260 2.670 2.581 2.743 . 0 0 "[ . 1 . 2]" 1 448 1 13 GLU H 1 14 GLN HG2 . . 5.310 4.873 4.561 5.192 . 0 0 "[ . 1 . 2]" 1 449 1 13 GLU H 1 15 GLY H . . 4.070 4.006 3.847 4.115 0.045 15 0 "[ . 1 . 2]" 1 450 1 13 GLU H 1 16 ILE H . . 5.180 5.194 4.988 5.250 0.070 5 0 "[ . 1 . 2]" 1 451 1 13 GLU H 1 38 LEU MD2 . . 5.330 5.206 5.000 5.393 0.063 2 0 "[ . 1 . 2]" 1 452 1 13 GLU HA 1 13 GLU HB2 . . 2.730 2.405 2.331 2.453 . 0 0 "[ . 1 . 2]" 1 453 1 13 GLU HA 1 13 GLU HB3 . . 2.910 2.397 2.311 2.471 . 0 0 "[ . 1 . 2]" 1 454 1 13 GLU HA 1 14 GLN HA . . 5.500 4.690 4.628 4.771 . 0 0 "[ . 1 . 2]" 1 455 1 13 GLU HB2 1 13 GLU HG3 . . 2.740 2.555 2.457 2.760 0.020 8 0 "[ . 1 . 2]" 1 456 1 13 GLU HB2 1 14 GLN H . . 4.220 4.058 3.942 4.184 . 0 0 "[ . 1 . 2]" 1 457 1 13 GLU HB2 1 14 GLN HA . . 4.680 4.713 4.622 4.744 0.064 14 0 "[ . 1 . 2]" 1 458 1 13 GLU HB2 1 15 GLY H . . 5.500 5.254 5.167 5.361 . 0 0 "[ . 1 . 2]" 1 459 1 13 GLU HB3 1 13 GLU HG2 . . 2.720 2.379 2.233 2.478 . 0 0 "[ . 1 . 2]" 1 460 1 13 GLU HB3 1 14 GLN H . . 4.630 4.221 3.998 4.384 . 0 0 "[ . 1 . 2]" 1 461 1 13 GLU HB3 1 15 GLY H . . 5.500 5.504 5.405 5.559 0.059 14 0 "[ . 1 . 2]" 1 462 1 13 GLU HG2 1 14 GLN H . . 5.500 3.239 2.827 3.790 . 0 0 "[ . 1 . 2]" 1 463 1 13 GLU HG2 1 14 GLN HG2 . . 5.500 3.907 3.655 4.330 . 0 0 "[ . 1 . 2]" 1 464 1 13 GLU HG3 1 14 GLN H . . 3.110 2.682 2.333 3.101 . 0 0 "[ . 1 . 2]" 1 465 1 13 GLU HG3 1 14 GLN HG2 . . 3.420 2.548 2.303 2.895 . 0 0 "[ . 1 . 2]" 1 466 1 14 GLN H 1 14 GLN HB2 . . 3.290 2.283 2.188 2.354 . 0 0 "[ . 1 . 2]" 1 467 1 14 GLN H 1 14 GLN HB3 . . 3.660 3.558 3.474 3.606 . 0 0 "[ . 1 . 2]" 1 468 1 14 GLN H 1 14 GLN HG2 . . 3.360 2.881 2.624 3.174 . 0 0 "[ . 1 . 2]" 1 469 1 14 GLN H 1 15 GLY H . . 3.040 2.497 2.315 2.637 . 0 0 "[ . 1 . 2]" 1 470 1 14 GLN H 1 15 GLY HA2 . . 5.500 4.807 4.622 4.955 . 0 0 "[ . 1 . 2]" 1 471 1 14 GLN H 1 15 GLY QA . . 4.740 4.431 4.280 4.546 . 0 0 "[ . 1 . 2]" 1 472 1 14 GLN H 1 15 GLY HA3 . . 5.500 5.192 5.054 5.312 . 0 0 "[ . 1 . 2]" 1 473 1 14 GLN H 1 16 ILE H . . 3.760 3.537 3.321 3.796 0.036 10 0 "[ . 1 . 2]" 1 474 1 14 GLN H 1 16 ILE MD . . 5.040 4.746 4.626 4.918 . 0 0 "[ . 1 . 2]" 1 475 1 14 GLN H 1 16 ILE HG12 . . 4.250 3.919 3.761 4.238 . 0 0 "[ . 1 . 2]" 1 476 1 14 GLN H 1 38 LEU MD2 . . 4.030 3.826 3.704 3.962 . 0 0 "[ . 1 . 2]" 1 477 1 14 GLN HA 1 14 GLN HG2 . . 3.480 2.863 2.416 3.162 . 0 0 "[ . 1 . 2]" 1 478 1 14 GLN HA 1 15 GLY H . . 3.440 3.309 3.223 3.402 . 0 0 "[ . 1 . 2]" 1 479 1 14 GLN HA 1 16 ILE H . . 5.000 4.561 4.421 4.779 . 0 0 "[ . 1 . 2]" 1 480 1 14 GLN HA 1 16 ILE MD . . 5.500 4.220 4.082 4.352 . 0 0 "[ . 1 . 2]" 1 481 1 14 GLN HA 1 16 ILE HG12 . . 4.800 4.581 4.487 4.817 0.017 10 0 "[ . 1 . 2]" 1 482 1 14 GLN HA 1 38 LEU MD2 . . 4.350 4.432 4.393 4.455 0.105 10 0 "[ . 1 . 2]" 1 483 1 14 GLN HB2 1 15 GLY H . . 3.750 3.597 3.482 3.732 . 0 0 "[ . 1 . 2]" 1 484 1 14 GLN HB2 1 16 ILE H . . 4.090 3.240 3.162 3.311 . 0 0 "[ . 1 . 2]" 1 485 1 14 GLN HB2 1 16 ILE MD . . 3.840 3.343 3.228 3.567 . 0 0 "[ . 1 . 2]" 1 486 1 14 GLN HB2 1 38 LEU MD2 . . 3.280 2.271 2.187 2.374 . 0 0 "[ . 1 . 2]" 1 487 1 14 GLN HB3 1 15 GLY H . . 4.210 4.140 3.964 4.248 0.038 15 0 "[ . 1 . 2]" 1 488 1 14 GLN HB3 1 16 ILE MD . . 3.500 2.467 2.236 2.616 . 0 0 "[ . 1 . 2]" 1 489 1 14 GLN HB3 1 38 LEU MD2 . . 3.450 2.775 2.581 3.050 . 0 0 "[ . 1 . 2]" 1 490 1 14 GLN HG2 1 15 GLY H . . 5.270 4.916 4.667 5.017 . 0 0 "[ . 1 . 2]" 1 491 1 14 GLN HG2 1 16 ILE H . . 5.500 5.502 5.388 5.568 0.068 2 0 "[ . 1 . 2]" 1 492 1 14 GLN HG3 1 16 ILE H . . 5.500 5.565 5.417 5.579 0.079 15 0 "[ . 1 . 2]" 1 493 1 14 GLN HG3 1 16 ILE MD . . 4.710 4.386 4.125 4.733 0.023 19 0 "[ . 1 . 2]" 1 494 1 14 GLN HG3 1 16 ILE HG13 . . 4.740 4.771 4.578 4.813 0.073 19 0 "[ . 1 . 2]" 1 495 1 14 GLN HG3 1 35 PRO HG3 . . 3.800 2.676 2.278 3.791 . 0 0 "[ . 1 . 2]" 1 496 1 14 GLN HG3 1 38 LEU MD1 . . 4.520 3.865 3.711 4.190 . 0 0 "[ . 1 . 2]" 1 497 1 14 GLN HG3 1 38 LEU MD2 . . 3.930 1.940 1.835 2.056 . 0 0 "[ . 1 . 2]" 1 498 1 15 GLY H 1 15 GLY QA . . 2.570 2.237 2.203 2.274 . 0 0 "[ . 1 . 2]" 1 499 1 15 GLY H 1 16 ILE H . . 3.090 2.488 2.354 2.633 . 0 0 "[ . 1 . 2]" 1 500 1 15 GLY H 1 16 ILE HA . . 5.190 5.125 5.003 5.217 0.027 13 0 "[ . 1 . 2]" 1 501 1 15 GLY H 1 16 ILE MD . . 4.120 4.139 3.930 4.203 0.083 20 0 "[ . 1 . 2]" 1 502 1 15 GLY H 1 16 ILE HG12 . . 3.980 3.954 3.674 4.037 0.057 10 0 "[ . 1 . 2]" 1 503 1 15 GLY H 1 31 ARG HD2 . . 5.280 5.101 4.789 5.341 0.061 7 0 "[ . 1 . 2]" 1 504 1 15 GLY H 1 38 LEU MD2 . . 5.190 5.237 5.160 5.273 0.083 6 0 "[ . 1 . 2]" 1 505 1 15 GLY QA 1 16 ILE H . . 3.120 2.983 2.918 3.016 . 0 0 "[ . 1 . 2]" 1 506 1 15 GLY HA2 1 16 ILE H . . 3.560 3.270 3.181 3.326 . 0 0 "[ . 1 . 2]" 1 507 1 15 GLY HA3 1 16 ILE H . . 3.560 3.443 3.310 3.496 . 0 0 "[ . 1 . 2]" 1 508 1 16 ILE H 1 16 ILE HB . . 3.140 2.987 2.908 3.067 . 0 0 "[ . 1 . 2]" 1 509 1 16 ILE H 1 16 ILE MD . . 3.340 2.710 2.601 2.836 . 0 0 "[ . 1 . 2]" 1 510 1 16 ILE H 1 16 ILE HG12 . . 3.540 2.049 1.853 2.130 . 0 0 "[ . 1 . 2]" 1 511 1 16 ILE H 1 16 ILE HG13 . . 4.240 3.625 3.484 3.706 . 0 0 "[ . 1 . 2]" 1 512 1 16 ILE H 1 16 ILE MG . . 3.830 3.824 3.770 3.897 0.067 10 0 "[ . 1 . 2]" 1 513 1 16 ILE H 1 17 THR H . . 4.630 4.524 4.453 4.595 . 0 0 "[ . 1 . 2]" 1 514 1 16 ILE H 1 29 THR HB . . 5.350 4.614 4.335 4.795 . 0 0 "[ . 1 . 2]" 1 515 1 16 ILE H 1 31 ARG HD2 . . 5.280 4.812 4.549 5.257 . 0 0 "[ . 1 . 2]" 1 516 1 16 ILE H 1 34 ILE MD . . 5.500 5.543 5.413 5.602 0.102 2 0 "[ . 1 . 2]" 1 517 1 16 ILE H 1 38 LEU MD2 . . 4.460 4.442 4.294 4.547 0.087 5 0 "[ . 1 . 2]" 1 518 1 16 ILE HA 1 16 ILE MD . . 3.990 2.501 2.344 2.593 . 0 0 "[ . 1 . 2]" 1 519 1 16 ILE HA 1 16 ILE HG12 . . 4.240 3.620 3.495 3.687 . 0 0 "[ . 1 . 2]" 1 520 1 16 ILE HA 1 16 ILE MG . . 3.520 2.159 2.085 2.255 . 0 0 "[ . 1 . 2]" 1 521 1 16 ILE HA 1 17 THR H . . 3.210 2.175 2.119 2.291 . 0 0 "[ . 1 . 2]" 1 522 1 16 ILE HA 1 28 GLU H . . 4.690 4.253 4.078 4.426 . 0 0 "[ . 1 . 2]" 1 523 1 16 ILE HA 1 29 THR H . . 5.500 5.242 4.987 5.378 . 0 0 "[ . 1 . 2]" 1 524 1 16 ILE HA 1 29 THR HA . . 4.000 3.949 3.755 4.076 0.076 8 0 "[ . 1 . 2]" 1 525 1 16 ILE HA 1 29 THR HB . . 3.970 1.993 1.797 2.092 . 0 0 "[ . 1 . 2]" 1 526 1 16 ILE HA 1 29 THR MG . . 3.820 3.369 3.169 3.517 . 0 0 "[ . 1 . 2]" 1 527 1 16 ILE HA 1 34 ILE MD . . 5.500 4.397 4.304 4.530 . 0 0 "[ . 1 . 2]" 1 528 1 16 ILE HB 1 16 ILE MD . . 3.320 3.234 3.200 3.288 . 0 0 "[ . 1 . 2]" 1 529 1 16 ILE HB 1 16 ILE HG12 . . 2.980 2.408 2.359 2.479 . 0 0 "[ . 1 . 2]" 1 530 1 16 ILE HB 1 17 THR H . . 4.180 3.612 3.494 3.668 . 0 0 "[ . 1 . 2]" 1 531 1 16 ILE HB 1 17 THR MG . . 5.500 5.086 4.911 5.335 . 0 0 "[ . 1 . 2]" 1 532 1 16 ILE HB 1 18 LEU H . . 4.840 4.499 4.260 4.672 . 0 0 "[ . 1 . 2]" 1 533 1 16 ILE HB 1 18 LEU MD1 . . 5.060 5.005 4.467 5.163 0.103 15 0 "[ . 1 . 2]" 1 534 1 16 ILE HB 1 18 LEU QD . . 4.130 3.958 2.922 4.215 0.085 4 0 "[ . 1 . 2]" 1 535 1 16 ILE HB 1 18 LEU MD2 . . 5.060 4.207 2.938 4.622 . 0 0 "[ . 1 . 2]" 1 536 1 16 ILE HB 1 28 GLU H . . 5.240 4.917 4.768 5.048 . 0 0 "[ . 1 . 2]" 1 537 1 16 ILE HB 1 38 LEU MD2 . . 5.500 4.025 3.835 4.229 . 0 0 "[ . 1 . 2]" 1 538 1 16 ILE HB 1 42 TRP HH2 . . 4.480 2.355 2.123 2.669 . 0 0 "[ . 1 . 2]" 1 539 1 16 ILE HB 1 42 TRP HZ2 . . 4.760 3.301 3.156 3.503 . 0 0 "[ . 1 . 2]" 1 540 1 16 ILE MD 1 16 ILE MG . . 2.820 2.211 2.086 2.312 . 0 0 "[ . 1 . 2]" 1 541 1 16 ILE MD 1 17 THR H . . 4.270 4.354 4.248 4.370 0.100 16 0 "[ . 1 . 2]" 1 542 1 16 ILE MD 1 29 THR H . . 5.440 5.463 5.068 5.519 0.079 18 0 "[ . 1 . 2]" 1 543 1 16 ILE MD 1 29 THR HA . . 5.500 4.659 4.289 4.809 . 0 0 "[ . 1 . 2]" 1 544 1 16 ILE MD 1 29 THR HB . . 3.530 2.706 2.256 2.890 . 0 0 "[ . 1 . 2]" 1 545 1 16 ILE MD 1 29 THR MG . . 3.480 1.989 1.840 2.068 . 0 0 "[ . 1 . 2]" 1 546 1 16 ILE MD 1 30 SER H . . 5.500 5.512 5.290 5.593 0.093 20 0 "[ . 1 . 2]" 1 547 1 16 ILE MD 1 31 ARG H . . 5.440 5.035 4.903 5.201 . 0 0 "[ . 1 . 2]" 1 548 1 16 ILE MD 1 31 ARG HD2 . . 3.810 3.279 2.898 3.728 . 0 0 "[ . 1 . 2]" 1 549 1 16 ILE MD 1 31 ARG HD3 . . 4.090 3.351 2.778 3.790 . 0 0 "[ . 1 . 2]" 1 550 1 16 ILE MD 1 31 ARG HG3 . . 5.010 4.483 4.229 4.988 . 0 0 "[ . 1 . 2]" 1 551 1 16 ILE MD 1 33 SER H . . 4.830 4.671 4.443 4.919 0.089 15 0 "[ . 1 . 2]" 1 552 1 16 ILE MD 1 34 ILE HA . . 3.870 2.896 2.635 3.108 . 0 0 "[ . 1 . 2]" 1 553 1 16 ILE MD 1 34 ILE MD . . 3.030 2.299 2.193 2.499 . 0 0 "[ . 1 . 2]" 1 554 1 16 ILE MD 1 34 ILE MG . . 3.390 3.084 2.840 3.340 . 0 0 "[ . 1 . 2]" 1 555 1 16 ILE MD 1 35 PRO HD2 . . 3.910 2.944 2.628 3.372 . 0 0 "[ . 1 . 2]" 1 556 1 16 ILE MD 1 35 PRO HD3 . . 3.890 3.088 2.728 3.365 . 0 0 "[ . 1 . 2]" 1 557 1 16 ILE MD 1 35 PRO HG3 . . 3.950 3.856 3.523 4.058 0.108 5 0 "[ . 1 . 2]" 1 558 1 16 ILE MD 1 38 LEU MD1 . . 3.750 3.594 3.420 3.786 0.036 10 0 "[ . 1 . 2]" 1 559 1 16 ILE MD 1 38 LEU MD2 . . 3.780 3.614 3.429 3.802 0.022 12 0 "[ . 1 . 2]" 1 560 1 16 ILE MD 1 42 TRP HH2 . . 3.950 3.749 3.442 4.023 0.073 20 0 "[ . 1 . 2]" 1 561 1 16 ILE HG12 1 16 ILE MG . . 3.470 3.264 3.191 3.304 . 0 0 "[ . 1 . 2]" 1 562 1 16 ILE HG12 1 29 THR HB . . 5.220 4.884 4.573 5.052 . 0 0 "[ . 1 . 2]" 1 563 1 16 ILE HG12 1 35 PRO HD2 . . 4.500 4.216 3.943 4.569 0.069 5 0 "[ . 1 . 2]" 1 564 1 16 ILE HG12 1 38 LEU MD1 . . 3.920 3.630 3.546 3.938 0.018 2 0 "[ . 1 . 2]" 1 565 1 16 ILE HG12 1 42 TRP HZ2 . . 5.040 4.183 4.013 4.376 . 0 0 "[ . 1 . 2]" 1 566 1 16 ILE HG13 1 16 ILE MG . . 2.970 2.449 2.288 2.598 . 0 0 "[ . 1 . 2]" 1 567 1 16 ILE HG13 1 29 THR HB . . 5.500 4.861 4.657 5.030 . 0 0 "[ . 1 . 2]" 1 568 1 16 ILE HG13 1 29 THR MG . . 4.050 3.986 3.682 4.117 0.067 19 0 "[ . 1 . 2]" 1 569 1 16 ILE HG13 1 34 ILE MD . . 3.580 3.184 2.892 3.427 . 0 0 "[ . 1 . 2]" 1 570 1 16 ILE HG13 1 35 PRO HD2 . . 4.610 3.149 2.878 3.466 . 0 0 "[ . 1 . 2]" 1 571 1 16 ILE HG13 1 35 PRO HD3 . . 4.500 4.347 3.900 4.544 0.044 18 0 "[ . 1 . 2]" 1 572 1 16 ILE HG13 1 38 LEU MD1 . . 5.500 2.535 2.380 2.696 . 0 0 "[ . 1 . 2]" 1 573 1 16 ILE HG13 1 38 LEU MD2 . . 3.960 2.940 2.741 3.224 . 0 0 "[ . 1 . 2]" 1 574 1 16 ILE HG13 1 42 TRP HH2 . . 4.260 2.328 2.064 2.808 . 0 0 "[ . 1 . 2]" 1 575 1 16 ILE MG 1 17 THR H . . 3.260 2.376 2.230 2.705 . 0 0 "[ . 1 . 2]" 1 576 1 16 ILE MG 1 18 LEU HA . . 5.270 4.854 4.611 5.023 . 0 0 "[ . 1 . 2]" 1 577 1 16 ILE MG 1 18 LEU MD1 . . 4.970 5.035 4.707 5.106 0.136 3 0 "[ . 1 . 2]" 1 578 1 16 ILE MG 1 18 LEU QD . . 3.830 3.683 3.001 3.918 0.088 6 0 "[ . 1 . 2]" 1 579 1 16 ILE MG 1 18 LEU MD2 . . 4.970 3.803 3.023 4.137 . 0 0 "[ . 1 . 2]" 1 580 1 16 ILE MG 1 27 TYR H . . 5.290 5.271 5.086 5.361 0.071 14 0 "[ . 1 . 2]" 1 581 1 16 ILE MG 1 27 TYR HA . . 3.850 3.672 3.482 3.852 0.002 5 0 "[ . 1 . 2]" 1 582 1 16 ILE MG 1 27 TYR HB2 . . 4.150 2.125 1.907 2.227 . 0 0 "[ . 1 . 2]" 1 583 1 16 ILE MG 1 27 TYR HB3 . . 4.270 3.391 3.268 3.511 . 0 0 "[ . 1 . 2]" 1 584 1 16 ILE MG 1 27 TYR QD . . 3.700 2.777 2.625 2.928 . 0 0 "[ . 1 . 2]" 1 585 1 16 ILE MG 1 27 TYR QE . . 4.160 4.182 3.993 4.262 0.102 7 0 "[ . 1 . 2]" 1 586 1 16 ILE MG 1 28 GLU H . . 3.550 2.615 2.454 2.820 . 0 0 "[ . 1 . 2]" 1 587 1 16 ILE MG 1 28 GLU QB . . 4.530 4.455 4.216 4.587 0.057 5 0 "[ . 1 . 2]" 1 588 1 16 ILE MG 1 29 THR HB . . 3.590 2.131 1.964 2.257 . 0 0 "[ . 1 . 2]" 1 589 1 16 ILE MG 1 34 ILE MD . . 2.860 2.048 1.937 2.193 . 0 0 "[ . 1 . 2]" 1 590 1 16 ILE MG 1 34 ILE MG . . 3.090 3.030 2.807 3.180 0.090 8 0 "[ . 1 . 2]" 1 591 1 16 ILE MG 1 38 LEU MD1 . . 3.730 3.749 3.550 3.831 0.101 10 0 "[ . 1 . 2]" 1 592 1 16 ILE MG 1 38 LEU MD2 . . 4.530 4.454 4.148 4.620 0.090 10 0 "[ . 1 . 2]" 1 593 1 16 ILE MG 1 42 TRP HH2 . . 3.600 1.993 1.923 2.071 . 0 0 "[ . 1 . 2]" 1 594 1 16 ILE MG 1 42 TRP HZ2 . . 4.260 4.012 3.843 4.200 . 0 0 "[ . 1 . 2]" 1 595 1 16 ILE MG 1 97 GLY H . . 5.500 5.558 5.460 5.586 0.086 5 0 "[ . 1 . 2]" 1 596 1 17 THR H 1 17 THR HB . . 3.840 3.652 3.282 3.820 . 0 0 "[ . 1 . 2]" 1 597 1 17 THR H 1 18 LEU H . . 4.430 4.136 3.881 4.287 . 0 0 "[ . 1 . 2]" 1 598 1 17 THR H 1 18 LEU QD . . 5.440 5.188 4.631 5.322 . 0 0 "[ . 1 . 2]" 1 599 1 17 THR H 1 27 TYR HA . . 4.710 4.424 4.318 4.549 . 0 0 "[ . 1 . 2]" 1 600 1 17 THR H 1 27 TYR HB2 . . 5.080 4.118 3.996 4.381 . 0 0 "[ . 1 . 2]" 1 601 1 17 THR H 1 27 TYR HB3 . . 5.500 5.552 5.477 5.645 0.145 2 0 "[ . 1 . 2]" 1 602 1 17 THR H 1 28 GLU H . . 3.990 2.731 2.590 2.885 . 0 0 "[ . 1 . 2]" 1 603 1 17 THR H 1 28 GLU HA . . 5.070 4.895 4.733 5.085 0.015 16 0 "[ . 1 . 2]" 1 604 1 17 THR H 1 28 GLU QB . . 4.340 3.915 3.665 4.234 . 0 0 "[ . 1 . 2]" 1 605 1 17 THR H 1 28 GLU QG . . 5.340 5.084 4.540 5.412 0.072 13 0 "[ . 1 . 2]" 1 606 1 17 THR H 1 29 THR HA . . 4.560 4.316 4.159 4.486 . 0 0 "[ . 1 . 2]" 1 607 1 17 THR H 1 29 THR HB . . 3.790 3.171 2.975 3.335 . 0 0 "[ . 1 . 2]" 1 608 1 17 THR H 1 29 THR MG . . 4.780 4.448 4.233 4.632 . 0 0 "[ . 1 . 2]" 1 609 1 17 THR H 1 34 ILE MD . . 5.350 5.192 5.063 5.365 0.015 2 0 "[ . 1 . 2]" 1 610 1 17 THR HA 1 18 LEU H . . 3.030 2.185 2.008 2.269 . 0 0 "[ . 1 . 2]" 1 611 1 17 THR HA 1 18 LEU QD . . 5.440 4.241 3.758 4.522 . 0 0 "[ . 1 . 2]" 1 612 1 17 THR HA 1 28 GLU H . . 5.030 4.790 4.649 5.099 0.069 5 0 "[ . 1 . 2]" 1 613 1 17 THR HB 1 18 LEU H . . 4.120 3.985 3.803 4.197 0.077 6 0 "[ . 1 . 2]" 1 614 1 17 THR HB 1 28 GLU QB . . 5.170 4.695 3.872 5.235 0.065 6 0 "[ . 1 . 2]" 1 615 1 17 THR MG 1 18 LEU QD . . 5.400 5.348 5.051 5.517 0.117 7 0 "[ . 1 . 2]" 1 616 1 18 LEU H 1 18 LEU HB2 . . 3.920 3.791 3.646 3.862 . 0 0 "[ . 1 . 2]" 1 617 1 18 LEU H 1 18 LEU HB3 . . 3.960 3.283 3.049 3.434 . 0 0 "[ . 1 . 2]" 1 618 1 18 LEU H 1 18 LEU MD1 . . 4.070 2.638 2.127 3.327 . 0 0 "[ . 1 . 2]" 1 619 1 18 LEU H 1 18 LEU QD . . 3.520 2.586 2.120 3.018 . 0 0 "[ . 1 . 2]" 1 620 1 18 LEU H 1 18 LEU MD2 . . 4.070 4.037 3.457 4.176 0.106 7 0 "[ . 1 . 2]" 1 621 1 18 LEU H 1 18 LEU HG . . 4.090 2.558 1.927 2.859 . 0 0 "[ . 1 . 2]" 1 622 1 18 LEU H 1 19 PHE H . . 4.560 4.452 4.376 4.546 . 0 0 "[ . 1 . 2]" 1 623 1 18 LEU H 1 25 LEU QD . . 5.440 5.119 4.857 5.553 0.113 11 0 "[ . 1 . 2]" 1 624 1 18 LEU H 1 27 TYR HA . . 5.160 4.374 4.181 4.553 . 0 0 "[ . 1 . 2]" 1 625 1 18 LEU H 1 42 TRP HZ2 . . 5.500 5.568 5.551 5.587 0.087 17 0 "[ . 1 . 2]" 1 626 1 18 LEU HA 1 18 LEU MD1 . . 4.290 3.667 3.545 3.764 . 0 0 "[ . 1 . 2]" 1 627 1 18 LEU HA 1 18 LEU QD . . 3.710 3.412 3.346 3.467 . 0 0 "[ . 1 . 2]" 1 628 1 18 LEU HA 1 18 LEU MD2 . . 4.290 4.067 4.009 4.204 . 0 0 "[ . 1 . 2]" 1 629 1 18 LEU HA 1 19 PHE H . . 3.050 2.282 2.208 2.373 . 0 0 "[ . 1 . 2]" 1 630 1 18 LEU HA 1 19 PHE QD . . 5.450 5.364 5.198 5.511 0.061 1 0 "[ . 1 . 2]" 1 631 1 18 LEU HA 1 25 LEU QD . . 5.440 4.069 3.854 4.602 . 0 0 "[ . 1 . 2]" 1 632 1 18 LEU HA 1 26 GLN H . . 4.830 4.208 4.061 4.535 . 0 0 "[ . 1 . 2]" 1 633 1 18 LEU HA 1 27 TYR HA . . 4.010 2.418 2.293 2.544 . 0 0 "[ . 1 . 2]" 1 634 1 18 LEU HA 1 27 TYR HB2 . . 4.950 4.325 3.974 4.523 . 0 0 "[ . 1 . 2]" 1 635 1 18 LEU HA 1 27 TYR HB3 . . 4.950 4.074 3.890 4.235 . 0 0 "[ . 1 . 2]" 1 636 1 18 LEU HA 1 28 GLU H . . 4.060 3.984 3.758 4.127 0.067 16 0 "[ . 1 . 2]" 1 637 1 18 LEU HA 1 53 LEU QD . . 5.440 5.473 5.336 5.540 0.100 12 0 "[ . 1 . 2]" 1 638 1 18 LEU HB2 1 18 LEU MD1 . . 3.670 2.481 2.205 2.700 . 0 0 "[ . 1 . 2]" 1 639 1 18 LEU HB2 1 18 LEU MD2 . . 3.670 2.305 2.165 2.599 . 0 0 "[ . 1 . 2]" 1 640 1 18 LEU HB2 1 19 PHE H . . 3.700 2.563 2.373 2.740 . 0 0 "[ . 1 . 2]" 1 641 1 18 LEU HB2 1 25 LEU MD1 . . 4.580 3.746 3.249 4.398 . 0 0 "[ . 1 . 2]" 1 642 1 18 LEU HB2 1 25 LEU QD . . 3.650 2.495 2.153 3.226 . 0 0 "[ . 1 . 2]" 1 643 1 18 LEU HB2 1 25 LEU MD2 . . 4.580 2.656 2.170 4.626 0.046 11 0 "[ . 1 . 2]" 1 644 1 18 LEU HB2 1 26 GLN H . . 4.010 3.501 3.317 3.744 . 0 0 "[ . 1 . 2]" 1 645 1 18 LEU HB2 1 27 TYR H . . 4.850 4.792 4.490 4.911 0.061 20 0 "[ . 1 . 2]" 1 646 1 18 LEU HB2 1 53 LEU QD . . 4.960 4.601 4.429 4.918 . 0 0 "[ . 1 . 2]" 1 647 1 18 LEU HB3 1 18 LEU QD . . 2.980 2.259 2.118 2.344 . 0 0 "[ . 1 . 2]" 1 648 1 18 LEU HB3 1 19 PHE H . . 4.700 3.724 3.557 3.885 . 0 0 "[ . 1 . 2]" 1 649 1 18 LEU HB3 1 25 LEU QD . . 4.640 3.837 3.455 4.537 . 0 0 "[ . 1 . 2]" 1 650 1 18 LEU HB3 1 27 TYR H . . 4.950 4.280 4.059 4.571 . 0 0 "[ . 1 . 2]" 1 651 1 18 LEU HB3 1 27 TYR HA . . 4.040 2.263 1.968 2.454 . 0 0 "[ . 1 . 2]" 1 652 1 18 LEU HB3 1 27 TYR HB2 . . 4.880 2.808 2.457 3.010 . 0 0 "[ . 1 . 2]" 1 653 1 18 LEU HB3 1 27 TYR HB3 . . 4.660 2.168 2.082 2.293 . 0 0 "[ . 1 . 2]" 1 654 1 18 LEU HB3 1 28 GLU H . . 3.970 3.921 3.654 4.027 0.057 7 0 "[ . 1 . 2]" 1 655 1 18 LEU QD 1 19 PHE H . . 4.130 3.428 3.235 3.643 . 0 0 "[ . 1 . 2]" 1 656 1 18 LEU QD 1 19 PHE QE . . 5.380 4.945 4.714 5.210 . 0 0 "[ . 1 . 2]" 1 657 1 18 LEU QD 1 25 LEU QD . . 2.820 2.137 1.972 2.620 . 0 0 "[ . 1 . 2]" 1 658 1 18 LEU QD 1 25 LEU HG . . 4.180 4.132 2.738 4.357 0.177 2 0 "[ . 1 . 2]" 1 659 1 18 LEU QD 1 26 GLN H . . 4.540 4.260 4.064 4.482 . 0 0 "[ . 1 . 2]" 1 660 1 18 LEU QD 1 26 GLN HA . . 5.440 4.921 4.726 5.299 . 0 0 "[ . 1 . 2]" 1 661 1 18 LEU QD 1 27 TYR H . . 4.990 4.781 4.622 5.033 0.043 15 0 "[ . 1 . 2]" 1 662 1 18 LEU QD 1 27 TYR HA . . 4.210 3.866 3.635 3.951 . 0 0 "[ . 1 . 2]" 1 663 1 18 LEU QD 1 27 TYR HB2 . . 3.530 3.458 3.042 3.619 0.089 3 0 "[ . 1 . 2]" 1 664 1 18 LEU QD 1 27 TYR HB3 . . 3.510 2.560 2.442 2.806 . 0 0 "[ . 1 . 2]" 1 665 1 18 LEU QD 1 27 TYR QD . . 3.890 3.712 3.439 3.996 0.106 11 0 "[ . 1 . 2]" 1 666 1 18 LEU QD 1 42 TRP H . . 5.440 5.492 5.357 5.552 0.112 17 0 "[ . 1 . 2]" 1 667 1 18 LEU QD 1 42 TRP HD1 . . 4.260 3.813 3.624 4.001 . 0 0 "[ . 1 . 2]" 1 668 1 18 LEU QD 1 42 TRP HE1 . . 3.840 2.919 2.671 3.148 . 0 0 "[ . 1 . 2]" 1 669 1 18 LEU QD 1 49 LEU QD . . 3.100 2.400 2.195 2.921 . 0 0 "[ . 1 . 2]" 1 670 1 18 LEU QD 1 49 LEU HG . . 4.930 4.179 3.306 4.851 . 0 0 "[ . 1 . 2]" 1 671 1 18 LEU QD 1 53 LEU QD . . 3.610 2.931 2.809 3.195 . 0 0 "[ . 1 . 2]" 1 672 1 18 LEU QD 1 99 ILE HB . . 4.570 4.010 3.603 4.543 . 0 0 "[ . 1 . 2]" 1 673 1 18 LEU QD 1 99 ILE MD . . 3.990 3.810 3.366 4.136 0.146 8 0 "[ . 1 . 2]" 1 674 1 18 LEU QD 1 99 ILE HG12 . . 4.350 3.495 3.116 3.969 . 0 0 "[ . 1 . 2]" 1 675 1 18 LEU QD 1 99 ILE HG13 . . 3.860 2.909 2.522 3.429 . 0 0 "[ . 1 . 2]" 1 676 1 18 LEU QD 1 99 ILE MG . . 4.380 3.566 3.292 4.047 . 0 0 "[ . 1 . 2]" 1 677 1 18 LEU MD1 1 25 LEU MD1 . . 5.500 3.215 2.715 3.525 . 0 0 "[ . 1 . 2]" 1 678 1 18 LEU MD1 1 25 LEU MD2 . . 5.500 2.599 2.223 3.860 . 0 0 "[ . 1 . 2]" 1 679 1 18 LEU MD1 1 26 GLN H . . 5.500 4.956 4.704 5.466 . 0 0 "[ . 1 . 2]" 1 680 1 18 LEU MD1 1 42 TRP HD1 . . 5.190 5.089 4.924 5.256 0.066 3 0 "[ . 1 . 2]" 1 681 1 18 LEU MD1 1 42 TRP HE1 . . 4.960 3.928 3.737 4.045 . 0 0 "[ . 1 . 2]" 1 682 1 18 LEU MD1 1 49 LEU MD1 . . 5.500 3.302 2.451 4.062 . 0 0 "[ . 1 . 2]" 1 683 1 18 LEU MD1 1 49 LEU MD2 . . 5.500 3.259 2.285 4.921 . 0 0 "[ . 1 . 2]" 1 684 1 18 LEU MD2 1 25 LEU MD1 . . 5.500 2.712 2.198 3.911 . 0 0 "[ . 1 . 2]" 1 685 1 18 LEU MD2 1 25 LEU MD2 . . 5.500 2.892 2.398 3.946 . 0 0 "[ . 1 . 2]" 1 686 1 18 LEU MD2 1 26 GLN H . . 5.500 4.693 4.331 5.460 . 0 0 "[ . 1 . 2]" 1 687 1 18 LEU MD2 1 42 TRP HD1 . . 5.190 3.942 3.719 4.233 . 0 0 "[ . 1 . 2]" 1 688 1 18 LEU MD2 1 42 TRP HE1 . . 4.960 3.015 2.715 3.286 . 0 0 "[ . 1 . 2]" 1 689 1 18 LEU MD2 1 49 LEU MD1 . . 5.500 3.612 3.236 4.170 . 0 0 "[ . 1 . 2]" 1 690 1 18 LEU MD2 1 49 LEU MD2 . . 5.500 3.831 2.928 4.734 . 0 0 "[ . 1 . 2]" 1 691 1 18 LEU HG 1 42 TRP HZ2 . . 5.300 3.471 3.213 4.096 . 0 0 "[ . 1 . 2]" 1 692 1 19 PHE H 1 19 PHE HB2 . . 3.760 3.335 3.152 3.458 . 0 0 "[ . 1 . 2]" 1 693 1 19 PHE H 1 19 PHE HB3 . . 3.950 3.504 3.412 3.632 . 0 0 "[ . 1 . 2]" 1 694 1 19 PHE H 1 19 PHE QD . . 4.530 4.473 4.385 4.539 0.009 5 0 "[ . 1 . 2]" 1 695 1 19 PHE H 1 20 VAL HA . . 4.840 4.672 4.559 4.766 . 0 0 "[ . 1 . 2]" 1 696 1 19 PHE H 1 25 LEU HA . . 4.290 4.163 3.993 4.342 0.052 5 0 "[ . 1 . 2]" 1 697 1 19 PHE H 1 25 LEU QD . . 3.630 2.788 2.619 3.369 . 0 0 "[ . 1 . 2]" 1 698 1 19 PHE H 1 26 GLN H . . 3.700 2.836 2.642 3.168 . 0 0 "[ . 1 . 2]" 1 699 1 19 PHE H 1 26 GLN QG . . 4.350 3.553 3.206 3.864 . 0 0 "[ . 1 . 2]" 1 700 1 19 PHE H 1 27 TYR H . . 5.500 5.552 5.457 5.581 0.081 5 0 "[ . 1 . 2]" 1 701 1 19 PHE H 1 27 TYR HA . . 4.440 4.176 4.039 4.300 . 0 0 "[ . 1 . 2]" 1 702 1 19 PHE H 1 53 LEU QD . . 4.270 4.145 3.975 4.215 . 0 0 "[ . 1 . 2]" 1 703 1 19 PHE HA 1 20 VAL H . . 3.310 2.654 2.595 2.710 . 0 0 "[ . 1 . 2]" 1 704 1 19 PHE HA 1 20 VAL HB . . 4.570 4.548 4.324 4.634 0.064 11 0 "[ . 1 . 2]" 1 705 1 19 PHE HA 1 20 VAL MG2 . . 5.500 4.276 4.051 4.510 . 0 0 "[ . 1 . 2]" 1 706 1 19 PHE HA 1 53 LEU QD . . 3.720 2.125 1.950 2.217 . 0 0 "[ . 1 . 2]" 1 707 1 19 PHE HB2 1 20 VAL H . . 4.310 3.843 3.747 3.908 . 0 0 "[ . 1 . 2]" 1 708 1 19 PHE HB2 1 53 LEU MD1 . . 5.500 4.147 4.008 4.286 . 0 0 "[ . 1 . 2]" 1 709 1 19 PHE HB2 1 53 LEU QD . . 4.080 4.033 3.888 4.154 0.074 13 0 "[ . 1 . 2]" 1 710 1 19 PHE HB2 1 53 LEU MD2 . . 5.500 5.515 5.236 5.570 0.070 8 0 "[ . 1 . 2]" 1 711 1 19 PHE HB3 1 20 VAL H . . 3.120 2.782 2.575 2.953 . 0 0 "[ . 1 . 2]" 1 712 1 19 PHE HB3 1 53 LEU QD . . 4.280 4.044 3.774 4.181 . 0 0 "[ . 1 . 2]" 1 713 1 19 PHE QD 1 20 VAL H . . 3.190 2.388 2.103 2.922 . 0 0 "[ . 1 . 2]" 1 714 1 19 PHE QD 1 20 VAL HB . . 4.220 3.589 3.275 4.208 . 0 0 "[ . 1 . 2]" 1 715 1 19 PHE QD 1 20 VAL MG1 . . 4.240 4.162 3.786 4.333 0.093 10 0 "[ . 1 . 2]" 1 716 1 19 PHE QD 1 53 LEU QD . . 3.310 2.786 2.620 2.926 . 0 0 "[ . 1 . 2]" 1 717 1 19 PHE QE 1 20 VAL H . . 4.400 3.779 3.509 4.159 . 0 0 "[ . 1 . 2]" 1 718 1 19 PHE QE 1 20 VAL HB . . 4.780 4.063 3.479 4.753 . 0 0 "[ . 1 . 2]" 1 719 1 19 PHE QE 1 53 LEU HA . . 4.710 4.367 4.100 4.775 0.065 4 0 "[ . 1 . 2]" 1 720 1 19 PHE QE 1 53 LEU MD1 . . 4.190 3.289 3.070 3.514 . 0 0 "[ . 1 . 2]" 1 721 1 19 PHE QE 1 53 LEU QD . . 3.300 2.412 2.176 2.656 . 0 0 "[ . 1 . 2]" 1 722 1 19 PHE QE 1 53 LEU MD2 . . 4.190 2.482 2.220 2.749 . 0 0 "[ . 1 . 2]" 1 723 1 19 PHE QE 1 56 LEU QD . . 3.910 3.476 2.729 4.019 0.109 12 0 "[ . 1 . 2]" 1 724 1 20 VAL H 1 20 VAL HB . . 3.080 2.169 2.059 2.226 . 0 0 "[ . 1 . 2]" 1 725 1 20 VAL H 1 21 VAL H . . 4.650 4.483 4.424 4.535 . 0 0 "[ . 1 . 2]" 1 726 1 20 VAL H 1 21 VAL QG . . 4.570 3.911 3.772 4.113 . 0 0 "[ . 1 . 2]" 1 727 1 20 VAL H 1 25 LEU QD . . 3.860 3.620 3.408 3.846 . 0 0 "[ . 1 . 2]" 1 728 1 20 VAL H 1 53 LEU HB3 . . 3.440 3.083 2.821 3.317 . 0 0 "[ . 1 . 2]" 1 729 1 20 VAL H 1 53 LEU QD . . 3.230 2.482 2.162 2.625 . 0 0 "[ . 1 . 2]" 1 730 1 20 VAL HA 1 20 VAL MG1 . . 3.300 2.845 2.724 3.007 . 0 0 "[ . 1 . 2]" 1 731 1 20 VAL HA 1 20 VAL MG2 . . 3.410 2.258 2.178 2.374 . 0 0 "[ . 1 . 2]" 1 732 1 20 VAL HA 1 21 VAL H . . 2.840 2.133 2.053 2.207 . 0 0 "[ . 1 . 2]" 1 733 1 20 VAL HA 1 21 VAL HA . . 4.570 4.441 4.338 4.501 . 0 0 "[ . 1 . 2]" 1 734 1 20 VAL HA 1 23 ASN H . . 5.370 5.201 4.938 5.356 . 0 0 "[ . 1 . 2]" 1 735 1 20 VAL HA 1 24 ARG H . . 4.100 3.918 3.737 4.148 0.048 19 0 "[ . 1 . 2]" 1 736 1 20 VAL HA 1 25 LEU H . . 5.190 4.928 4.711 5.220 0.030 8 0 "[ . 1 . 2]" 1 737 1 20 VAL HA 1 25 LEU QD . . 4.180 2.909 2.701 3.185 . 0 0 "[ . 1 . 2]" 1 738 1 20 VAL HA 1 26 GLN H . . 4.640 4.135 3.831 4.504 . 0 0 "[ . 1 . 2]" 1 739 1 20 VAL HB 1 25 LEU QD . . 4.540 4.321 4.040 4.636 0.096 20 0 "[ . 1 . 2]" 1 740 1 20 VAL HB 1 50 ILE HA . . 4.660 4.524 4.344 4.691 0.031 4 0 "[ . 1 . 2]" 1 741 1 20 VAL HB 1 53 LEU HB2 . . 4.140 3.019 2.760 3.184 . 0 0 "[ . 1 . 2]" 1 742 1 20 VAL HB 1 53 LEU QD . . 3.800 3.120 2.920 3.291 . 0 0 "[ . 1 . 2]" 1 743 1 20 VAL MG1 1 21 VAL H . . 2.830 2.802 2.607 2.916 0.086 20 0 "[ . 1 . 2]" 1 744 1 20 VAL MG1 1 21 VAL QG . . 5.440 3.859 3.628 3.965 . 0 0 "[ . 1 . 2]" 1 745 1 20 VAL MG1 1 22 ASN H . . 5.500 3.922 3.563 4.281 . 0 0 "[ . 1 . 2]" 1 746 1 20 VAL MG1 1 23 ASN H . . 3.120 2.871 2.536 3.189 0.069 8 0 "[ . 1 . 2]" 1 747 1 20 VAL MG1 1 23 ASN HA . . 3.570 2.924 2.460 3.614 0.044 4 0 "[ . 1 . 2]" 1 748 1 20 VAL MG1 1 24 ARG H . . 3.580 3.291 2.843 3.695 0.115 13 0 "[ . 1 . 2]" 1 749 1 20 VAL MG1 1 24 ARG HG2 . . 5.500 5.231 4.871 5.577 0.077 13 0 "[ . 1 . 2]" 1 750 1 20 VAL MG1 1 25 LEU HA . . 5.500 4.978 4.616 5.416 . 0 0 "[ . 1 . 2]" 1 751 1 20 VAL MG1 1 50 ILE HA . . 5.060 3.962 3.677 4.250 . 0 0 "[ . 1 . 2]" 1 752 1 20 VAL MG1 1 53 LEU HB2 . . 5.500 3.872 3.681 4.020 . 0 0 "[ . 1 . 2]" 1 753 1 20 VAL MG1 1 53 LEU HB3 . . 3.890 3.819 3.558 3.966 0.076 17 0 "[ . 1 . 2]" 1 754 1 20 VAL MG1 1 54 ASN HA . . 3.460 2.260 2.128 2.599 . 0 0 "[ . 1 . 2]" 1 755 1 20 VAL MG1 1 54 ASN HB2 . . 4.630 3.124 2.682 3.447 . 0 0 "[ . 1 . 2]" 1 756 1 20 VAL MG1 1 55 GLN H . . 5.500 5.228 4.979 5.563 0.063 10 0 "[ . 1 . 2]" 1 757 1 20 VAL MG2 1 21 VAL H . . 3.440 3.478 3.163 3.530 0.090 2 0 "[ . 1 . 2]" 1 758 1 20 VAL MG2 1 23 ASN HA . . 5.500 3.829 3.387 4.349 . 0 0 "[ . 1 . 2]" 1 759 1 20 VAL MG2 1 24 ARG H . . 4.150 3.825 3.296 4.185 0.035 19 0 "[ . 1 . 2]" 1 760 1 20 VAL MG2 1 25 LEU HA . . 4.130 3.567 3.260 4.057 . 0 0 "[ . 1 . 2]" 1 761 1 20 VAL MG2 1 25 LEU QD . . 5.410 2.796 2.178 3.376 . 0 0 "[ . 1 . 2]" 1 762 1 20 VAL MG2 1 49 LEU HB2 . . 5.500 4.788 4.523 5.003 . 0 0 "[ . 1 . 2]" 1 763 1 20 VAL MG2 1 50 ILE H . . 4.220 4.000 3.875 4.142 . 0 0 "[ . 1 . 2]" 1 764 1 20 VAL MG2 1 50 ILE HA . . 2.910 1.984 1.902 2.068 . 0 0 "[ . 1 . 2]" 1 765 1 20 VAL MG2 1 50 ILE QG . . 3.280 2.494 2.281 2.851 . 0 0 "[ . 1 . 2]" 1 766 1 20 VAL MG2 1 51 ASP H . . 4.600 4.635 4.508 4.688 0.088 20 0 "[ . 1 . 2]" 1 767 1 20 VAL MG2 1 52 PHE H . . 5.500 5.108 4.940 5.191 . 0 0 "[ . 1 . 2]" 1 768 1 20 VAL MG2 1 53 LEU H . . 3.910 3.752 3.603 3.867 . 0 0 "[ . 1 . 2]" 1 769 1 20 VAL MG2 1 53 LEU HA . . 4.280 4.193 3.982 4.282 0.002 5 0 "[ . 1 . 2]" 1 770 1 20 VAL MG2 1 53 LEU HB2 . . 3.140 1.936 1.819 1.995 . 0 0 "[ . 1 . 2]" 1 771 1 20 VAL MG2 1 53 LEU HB3 . . 3.430 2.673 2.459 2.792 . 0 0 "[ . 1 . 2]" 1 772 1 20 VAL MG2 1 53 LEU QD . . 2.990 2.318 2.098 2.472 . 0 0 "[ . 1 . 2]" 1 773 1 20 VAL MG2 1 54 ASN H . . 2.850 2.698 2.373 2.788 . 0 0 "[ . 1 . 2]" 1 774 1 20 VAL MG2 1 54 ASN HA . . 5.500 3.121 2.745 3.388 . 0 0 "[ . 1 . 2]" 1 775 1 20 VAL MG2 1 54 ASN HB2 . . 4.220 3.235 2.970 3.431 . 0 0 "[ . 1 . 2]" 1 776 1 20 VAL MG2 1 54 ASN HB3 . . 4.090 4.097 3.748 4.178 0.088 15 0 "[ . 1 . 2]" 1 777 1 20 VAL MG2 1 55 GLN H . . 4.870 4.933 4.670 4.968 0.098 9 0 "[ . 1 . 2]" 1 778 1 20 VAL MG2 1 56 LEU HB2 . . 5.500 5.515 5.275 5.588 0.088 4 0 "[ . 1 . 2]" 1 779 1 21 VAL H 1 21 VAL HB . . 3.590 3.057 2.896 3.270 . 0 0 "[ . 1 . 2]" 1 780 1 21 VAL H 1 21 VAL MG1 . . 4.150 4.008 3.968 4.065 . 0 0 "[ . 1 . 2]" 1 781 1 21 VAL H 1 21 VAL QG . . 3.180 2.741 2.591 2.932 . 0 0 "[ . 1 . 2]" 1 782 1 21 VAL H 1 21 VAL MG2 . . 4.150 2.791 2.623 3.008 . 0 0 "[ . 1 . 2]" 1 783 1 21 VAL H 1 22 ASN H . . 4.550 4.103 3.923 4.205 . 0 0 "[ . 1 . 2]" 1 784 1 21 VAL H 1 22 ASN HB2 . . 5.500 5.561 5.536 5.577 0.077 10 0 "[ . 1 . 2]" 1 785 1 21 VAL H 1 22 ASN HB3 . . 5.420 5.126 4.839 5.347 . 0 0 "[ . 1 . 2]" 1 786 1 21 VAL H 1 23 ASN H . . 3.870 3.782 3.577 3.928 0.058 8 0 "[ . 1 . 2]" 1 787 1 21 VAL H 1 23 ASN HA . . 4.850 4.602 4.286 4.837 . 0 0 "[ . 1 . 2]" 1 788 1 21 VAL H 1 24 ARG H . . 3.390 2.576 2.428 2.704 . 0 0 "[ . 1 . 2]" 1 789 1 21 VAL H 1 24 ARG HA . . 4.820 4.742 4.596 4.862 0.042 10 0 "[ . 1 . 2]" 1 790 1 21 VAL H 1 24 ARG HD2 . . 5.500 4.725 4.468 4.920 . 0 0 "[ . 1 . 2]" 1 791 1 21 VAL H 1 24 ARG HD3 . . 5.500 4.876 4.680 5.069 . 0 0 "[ . 1 . 2]" 1 792 1 21 VAL H 1 24 ARG HG2 . . 4.100 3.242 3.004 3.367 . 0 0 "[ . 1 . 2]" 1 793 1 21 VAL H 1 24 ARG HG3 . . 4.940 4.907 4.543 5.008 0.068 6 0 "[ . 1 . 2]" 1 794 1 21 VAL H 1 25 LEU H . . 5.270 5.100 4.941 5.286 0.016 10 0 "[ . 1 . 2]" 1 795 1 21 VAL H 1 25 LEU HA . . 3.990 3.743 3.541 3.939 . 0 0 "[ . 1 . 2]" 1 796 1 21 VAL H 1 25 LEU QD . . 4.420 4.459 4.272 4.532 0.112 5 0 "[ . 1 . 2]" 1 797 1 21 VAL H 1 26 GLN H . . 5.020 4.718 4.288 4.900 . 0 0 "[ . 1 . 2]" 1 798 1 21 VAL H 1 50 ILE MD . . 5.500 5.580 5.486 5.602 0.102 15 0 "[ . 1 . 2]" 1 799 1 21 VAL H 1 53 LEU QD . . 5.440 5.402 5.128 5.529 0.089 19 0 "[ . 1 . 2]" 1 800 1 21 VAL HA 1 21 VAL MG1 . . 3.200 2.272 2.137 2.354 . 0 0 "[ . 1 . 2]" 1 801 1 21 VAL HA 1 21 VAL QG . . 2.720 2.163 2.086 2.209 . 0 0 "[ . 1 . 2]" 1 802 1 21 VAL HA 1 21 VAL MG2 . . 3.200 2.728 2.557 2.905 . 0 0 "[ . 1 . 2]" 1 803 1 21 VAL HA 1 22 ASN H . . 3.080 2.235 2.144 2.320 . 0 0 "[ . 1 . 2]" 1 804 1 21 VAL HB 1 22 ASN H . . 4.480 4.019 3.825 4.192 . 0 0 "[ . 1 . 2]" 1 805 1 21 VAL HB 1 22 ASN HB2 . . 4.210 4.186 3.964 4.276 0.066 15 0 "[ . 1 . 2]" 1 806 1 21 VAL HB 1 22 ASN HB3 . . 5.500 4.139 3.765 4.351 . 0 0 "[ . 1 . 2]" 1 807 1 21 VAL HB 1 24 ARG H . . 5.500 4.468 4.258 4.688 . 0 0 "[ . 1 . 2]" 1 808 1 21 VAL HB 1 24 ARG HG2 . . 5.500 3.387 3.145 3.727 . 0 0 "[ . 1 . 2]" 1 809 1 21 VAL HB 1 26 GLN H . . 5.500 5.356 4.724 5.558 0.058 8 0 "[ . 1 . 2]" 1 810 1 21 VAL HB 1 26 GLN QG . . 4.110 3.031 2.444 4.078 . 0 0 "[ . 1 . 2]" 1 811 1 21 VAL QG 1 22 ASN H . . 3.310 2.791 2.542 3.109 . 0 0 "[ . 1 . 2]" 1 812 1 21 VAL QG 1 22 ASN HB2 . . 3.420 2.886 2.535 3.478 0.058 10 0 "[ . 1 . 2]" 1 813 1 21 VAL QG 1 22 ASN HB3 . . 4.080 3.702 3.413 4.018 . 0 0 "[ . 1 . 2]" 1 814 1 21 VAL QG 1 23 ASN H . . 5.340 4.597 4.477 4.788 . 0 0 "[ . 1 . 2]" 1 815 1 21 VAL QG 1 24 ARG H . . 4.770 4.421 4.311 4.566 . 0 0 "[ . 1 . 2]" 1 816 1 21 VAL QG 1 24 ARG HG3 . . 5.440 4.842 4.543 5.101 . 0 0 "[ . 1 . 2]" 1 817 1 21 VAL QG 1 26 GLN H . . 3.870 3.678 3.374 3.972 0.102 17 0 "[ . 1 . 2]" 1 818 1 21 VAL QG 1 26 GLN QB . . 5.280 3.881 3.697 4.019 . 0 0 "[ . 1 . 2]" 1 819 1 21 VAL QG 1 26 GLN QG . . 3.320 2.225 2.038 2.780 . 0 0 "[ . 1 . 2]" 1 820 1 21 VAL MG1 1 22 ASN H . . 4.450 2.823 2.559 3.168 . 0 0 "[ . 1 . 2]" 1 821 1 21 VAL MG1 1 22 ASN HB3 . . 5.500 3.773 3.446 4.165 . 0 0 "[ . 1 . 2]" 1 822 1 21 VAL MG1 1 24 ARG HD2 . . 5.500 4.952 4.507 5.572 0.072 10 0 "[ . 1 . 2]" 1 823 1 21 VAL MG1 1 24 ARG HD3 . . 5.500 4.356 3.871 4.827 . 0 0 "[ . 1 . 2]" 1 824 1 21 VAL MG2 1 22 ASN H . . 4.450 4.428 4.325 4.532 0.082 10 0 "[ . 1 . 2]" 1 825 1 21 VAL MG2 1 22 ASN HB3 . . 5.500 5.440 5.152 5.584 0.084 14 0 "[ . 1 . 2]" 1 826 1 21 VAL MG2 1 24 ARG HD2 . . 5.500 5.574 5.519 5.594 0.094 8 0 "[ . 1 . 2]" 1 827 1 21 VAL MG2 1 24 ARG HD3 . . 5.500 4.895 4.594 5.217 . 0 0 "[ . 1 . 2]" 1 828 1 22 ASN H 1 22 ASN HB2 . . 4.070 2.838 2.675 3.133 . 0 0 "[ . 1 . 2]" 1 829 1 22 ASN H 1 23 ASN H . . 3.760 2.852 2.579 2.933 . 0 0 "[ . 1 . 2]" 1 830 1 22 ASN H 1 23 ASN HA . . 4.950 5.001 4.850 5.025 0.075 8 0 "[ . 1 . 2]" 1 831 1 22 ASN H 1 24 ARG H . . 4.680 4.415 4.157 4.517 . 0 0 "[ . 1 . 2]" 1 832 1 22 ASN HA 1 22 ASN HB2 . . 2.960 2.586 2.502 2.668 . 0 0 "[ . 1 . 2]" 1 833 1 22 ASN HA 1 23 ASN H . . 3.010 2.735 2.601 2.897 . 0 0 "[ . 1 . 2]" 1 834 1 22 ASN HA 1 23 ASN HA . . 5.500 4.653 4.513 4.824 . 0 0 "[ . 1 . 2]" 1 835 1 22 ASN HA 1 23 ASN HB2 . . 4.370 3.960 3.834 4.117 . 0 0 "[ . 1 . 2]" 1 836 1 22 ASN HA 1 24 ARG H . . 4.790 4.644 4.535 4.748 . 0 0 "[ . 1 . 2]" 1 837 1 22 ASN HA 1 24 ARG HD2 . . 4.990 4.599 4.374 5.062 0.072 15 0 "[ . 1 . 2]" 1 838 1 22 ASN HB2 1 23 ASN H . . 5.500 4.508 4.466 4.553 . 0 0 "[ . 1 . 2]" 1 839 1 22 ASN HB2 1 24 ARG H . . 5.500 5.241 5.035 5.373 . 0 0 "[ . 1 . 2]" 1 840 1 22 ASN HB2 1 24 ARG HD2 . . 5.500 3.953 3.628 4.399 . 0 0 "[ . 1 . 2]" 1 841 1 22 ASN HB2 1 24 ARG HD3 . . 5.500 4.068 3.725 4.620 . 0 0 "[ . 1 . 2]" 1 842 1 22 ASN HB3 1 23 ASN H . . 4.190 4.199 4.064 4.251 0.061 8 0 "[ . 1 . 2]" 1 843 1 22 ASN HB3 1 24 ARG H . . 4.220 4.204 3.893 4.296 0.076 13 0 "[ . 1 . 2]" 1 844 1 22 ASN HB3 1 24 ARG HD2 . . 5.500 2.285 1.972 2.711 . 0 0 "[ . 1 . 2]" 1 845 1 22 ASN HB3 1 24 ARG HD3 . . 5.500 2.745 2.307 3.271 . 0 0 "[ . 1 . 2]" 1 846 1 23 ASN H 1 23 ASN HA . . 2.760 2.173 2.101 2.278 . 0 0 "[ . 1 . 2]" 1 847 1 23 ASN H 1 23 ASN HB2 . . 3.310 3.090 2.972 3.237 . 0 0 "[ . 1 . 2]" 1 848 1 23 ASN H 1 23 ASN HB3 . . 4.100 3.865 3.697 4.026 . 0 0 "[ . 1 . 2]" 1 849 1 23 ASN H 1 24 ARG H . . 3.260 2.718 2.448 2.853 . 0 0 "[ . 1 . 2]" 1 850 1 23 ASN H 1 24 ARG HA . . 5.480 5.339 5.199 5.442 . 0 0 "[ . 1 . 2]" 1 851 1 23 ASN H 1 24 ARG HB3 . . 4.990 5.054 4.906 5.066 0.076 10 0 "[ . 1 . 2]" 1 852 1 23 ASN H 1 24 ARG HD2 . . 5.130 4.535 4.193 4.968 . 0 0 "[ . 1 . 2]" 1 853 1 23 ASN H 1 24 ARG HG2 . . 5.060 5.043 4.873 5.125 0.065 11 0 "[ . 1 . 2]" 1 854 1 23 ASN HA 1 24 ARG H . . 3.270 2.939 2.608 3.120 . 0 0 "[ . 1 . 2]" 1 855 1 23 ASN HA 1 24 ARG HB3 . . 5.030 4.944 4.863 5.076 0.046 19 0 "[ . 1 . 2]" 1 856 1 23 ASN HA 1 50 ILE MG . . 3.510 3.295 2.995 3.577 0.067 7 0 "[ . 1 . 2]" 1 857 1 23 ASN HB2 1 24 ARG H . . 4.660 4.543 4.455 4.632 . 0 0 "[ . 1 . 2]" 1 858 1 23 ASN HB2 1 24 ARG HD2 . . 5.500 5.528 5.262 5.595 0.095 2 0 "[ . 1 . 2]" 1 859 1 23 ASN HB3 1 24 ARG H . . 4.190 4.200 4.096 4.259 0.069 13 0 "[ . 1 . 2]" 1 860 1 23 ASN HB3 1 24 ARG HD2 . . 5.080 4.912 4.643 5.154 0.074 13 0 "[ . 1 . 2]" 1 861 1 23 ASN HB3 1 50 ILE MD . . 5.500 5.476 5.304 5.545 0.045 4 0 "[ . 1 . 2]" 1 862 1 23 ASN HB3 1 50 ILE MG . . 4.460 4.428 4.021 4.550 0.090 18 0 "[ . 1 . 2]" 1 863 1 24 ARG H 1 24 ARG HB3 . . 3.240 3.007 2.864 3.246 0.006 13 0 "[ . 1 . 2]" 1 864 1 24 ARG H 1 24 ARG HD2 . . 3.930 3.203 2.987 3.692 . 0 0 "[ . 1 . 2]" 1 865 1 24 ARG H 1 24 ARG HG2 . . 2.990 2.756 2.585 3.015 0.025 13 0 "[ . 1 . 2]" 1 866 1 24 ARG H 1 24 ARG HG3 . . 4.400 4.185 4.042 4.443 0.043 13 0 "[ . 1 . 2]" 1 867 1 24 ARG H 1 25 LEU H . . 4.490 4.414 4.373 4.494 0.004 13 0 "[ . 1 . 2]" 1 868 1 24 ARG H 1 25 LEU HA . . 4.800 4.702 4.648 4.846 0.046 19 0 "[ . 1 . 2]" 1 869 1 24 ARG H 1 25 LEU QD . . 5.440 5.497 5.307 5.546 0.106 10 0 "[ . 1 . 2]" 1 870 1 24 ARG H 1 50 ILE MD . . 4.880 4.481 4.338 4.732 . 0 0 "[ . 1 . 2]" 1 871 1 24 ARG H 1 50 ILE QG . . 4.050 4.084 3.824 4.131 0.081 11 0 "[ . 1 . 2]" 1 872 1 24 ARG HA 1 24 ARG HG2 . . 3.860 3.660 3.557 3.708 . 0 0 "[ . 1 . 2]" 1 873 1 24 ARG HA 1 24 ARG HG3 . . 4.060 4.000 3.865 4.060 . 0 0 "[ . 1 . 2]" 1 874 1 24 ARG HA 1 25 LEU H . . 3.030 2.392 2.342 2.470 . 0 0 "[ . 1 . 2]" 1 875 1 24 ARG HA 1 50 ILE MD . . 3.800 2.184 1.934 2.432 . 0 0 "[ . 1 . 2]" 1 876 1 24 ARG HA 1 50 ILE MG . . 4.420 3.227 2.692 3.556 . 0 0 "[ . 1 . 2]" 1 877 1 24 ARG HB2 1 24 ARG HD2 . . 3.690 3.534 3.408 3.672 . 0 0 "[ . 1 . 2]" 1 878 1 24 ARG HB2 1 25 LEU H . . 3.340 2.809 2.700 2.903 . 0 0 "[ . 1 . 2]" 1 879 1 24 ARG HB2 1 50 ILE MG . . 5.450 5.154 4.571 5.492 0.042 10 0 "[ . 1 . 2]" 1 880 1 24 ARG HB3 1 24 ARG HD2 . . 3.020 2.299 2.186 2.483 . 0 0 "[ . 1 . 2]" 1 881 1 24 ARG HB3 1 25 LEU H . . 4.210 4.099 4.035 4.166 . 0 0 "[ . 1 . 2]" 1 882 1 24 ARG HD2 1 24 ARG HG2 . . 2.960 2.510 2.365 2.636 . 0 0 "[ . 1 . 2]" 1 883 1 24 ARG HD2 1 98 GLU QG . . 5.500 5.213 4.946 5.568 0.068 15 0 "[ . 1 . 2]" 1 884 1 24 ARG HD3 1 98 GLU QG . . 5.500 4.674 4.286 4.992 . 0 0 "[ . 1 . 2]" 1 885 1 24 ARG HG2 1 25 LEU H . . 4.380 3.875 3.756 4.077 . 0 0 "[ . 1 . 2]" 1 886 1 24 ARG HG3 1 25 LEU H . . 3.770 3.761 3.460 3.840 0.070 3 0 "[ . 1 . 2]" 1 887 1 24 ARG HG3 1 98 GLU QG . . 4.620 2.507 2.239 3.034 . 0 0 "[ . 1 . 2]" 1 888 1 25 LEU H 1 25 LEU HB2 . . 3.690 2.301 2.189 2.399 . 0 0 "[ . 1 . 2]" 1 889 1 25 LEU H 1 25 LEU HB3 . . 3.490 3.205 2.940 3.409 . 0 0 "[ . 1 . 2]" 1 890 1 25 LEU H 1 25 LEU MD1 . . 4.680 4.329 4.074 4.490 . 0 0 "[ . 1 . 2]" 1 891 1 25 LEU H 1 25 LEU QD . . 3.880 3.806 3.590 3.897 0.017 20 0 "[ . 1 . 2]" 1 892 1 25 LEU H 1 25 LEU MD2 . . 4.680 4.223 3.988 4.324 . 0 0 "[ . 1 . 2]" 1 893 1 25 LEU H 1 25 LEU HG . . 4.970 4.133 3.665 4.750 . 0 0 "[ . 1 . 2]" 1 894 1 25 LEU H 1 46 LYS HE2 . . 5.500 5.529 5.419 5.572 0.072 3 0 "[ . 1 . 2]" 1 895 1 25 LEU H 1 46 LYS HE3 . . 5.500 4.775 4.408 5.248 . 0 0 "[ . 1 . 2]" 1 896 1 25 LEU H 1 46 LYS QG . . 5.430 4.288 3.987 4.483 . 0 0 "[ . 1 . 2]" 1 897 1 25 LEU H 1 50 ILE MD . . 3.300 2.016 1.855 2.237 . 0 0 "[ . 1 . 2]" 1 898 1 25 LEU H 1 98 GLU QG . . 4.400 3.532 3.201 3.983 . 0 0 "[ . 1 . 2]" 1 899 1 25 LEU H 1 99 ILE H . . 4.630 4.343 4.075 4.780 0.150 2 0 "[ . 1 . 2]" 1 900 1 25 LEU H 1 99 ILE MG . . 5.260 5.032 4.742 5.254 . 0 0 "[ . 1 . 2]" 1 901 1 25 LEU HA 1 25 LEU MD1 . . 4.180 3.616 2.055 3.865 . 0 0 "[ . 1 . 2]" 1 902 1 25 LEU HA 1 25 LEU QD . . 3.220 2.043 1.963 2.105 . 0 0 "[ . 1 . 2]" 1 903 1 25 LEU HA 1 25 LEU MD2 . . 4.180 2.216 1.970 3.729 . 0 0 "[ . 1 . 2]" 1 904 1 25 LEU HA 1 26 GLN H . . 3.090 2.241 2.123 2.309 . 0 0 "[ . 1 . 2]" 1 905 1 25 LEU HA 1 26 GLN QG . . 5.340 3.733 3.381 4.242 . 0 0 "[ . 1 . 2]" 1 906 1 25 LEU HA 1 50 ILE MD . . 4.360 4.009 3.839 4.122 . 0 0 "[ . 1 . 2]" 1 907 1 25 LEU HA 1 53 LEU QD . . 5.060 4.286 4.209 4.347 . 0 0 "[ . 1 . 2]" 1 908 1 25 LEU HA 1 99 ILE H . . 4.960 4.923 4.769 5.046 0.086 2 0 "[ . 1 . 2]" 1 909 1 25 LEU HA 1 99 ILE HB . . 5.500 4.721 4.499 4.787 . 0 0 "[ . 1 . 2]" 1 910 1 25 LEU HB2 1 26 GLN H . . 4.420 4.409 4.205 4.471 0.051 10 0 "[ . 1 . 2]" 1 911 1 25 LEU HB2 1 46 LYS HA . . 4.800 4.330 4.082 4.619 . 0 0 "[ . 1 . 2]" 1 912 1 25 LEU HB2 1 50 ILE HA . . 5.240 5.066 4.387 5.290 0.050 8 0 "[ . 1 . 2]" 1 913 1 25 LEU HB2 1 50 ILE MD . . 3.500 2.297 2.114 2.406 . 0 0 "[ . 1 . 2]" 1 914 1 25 LEU HB2 1 50 ILE QG . . 5.500 2.550 1.963 2.828 . 0 0 "[ . 1 . 2]" 1 915 1 25 LEU HB2 1 50 ILE MG . . 4.910 4.931 4.506 5.010 0.100 8 0 "[ . 1 . 2]" 1 916 1 25 LEU HB2 1 99 ILE H . . 4.620 3.933 3.505 4.626 0.006 2 0 "[ . 1 . 2]" 1 917 1 25 LEU HB2 1 99 ILE HB . . 4.100 2.899 2.491 3.119 . 0 0 "[ . 1 . 2]" 1 918 1 25 LEU HB2 1 99 ILE MD . . 5.500 5.574 5.260 5.758 0.258 2 0 "[ . 1 . 2]" 1 919 1 25 LEU HB2 1 99 ILE MG . . 5.500 3.416 3.119 3.697 . 0 0 "[ . 1 . 2]" 1 920 1 25 LEU HB3 1 49 LEU HB2 . . 5.320 5.011 4.827 5.353 0.033 11 0 "[ . 1 . 2]" 1 921 1 25 LEU HB3 1 53 LEU QD . . 5.440 5.226 4.984 5.546 0.106 19 0 "[ . 1 . 2]" 1 922 1 25 LEU HB3 1 99 ILE H . . 4.220 2.873 2.452 3.141 . 0 0 "[ . 1 . 2]" 1 923 1 25 LEU HB3 1 99 ILE HB . . 3.670 1.955 1.679 2.019 . 0 0 "[ . 1 . 2]" 1 924 1 25 LEU HB3 1 99 ILE HG12 . . 5.500 3.508 3.259 3.792 . 0 0 "[ . 1 . 2]" 1 925 1 25 LEU HB3 1 99 ILE MG . . 3.260 3.273 3.078 3.348 0.088 11 0 "[ . 1 . 2]" 1 926 1 25 LEU QD 1 26 GLN H . . 3.160 2.434 1.971 2.989 . 0 0 "[ . 1 . 2]" 1 927 1 25 LEU QD 1 42 TRP HB2 . . 5.440 5.038 4.846 5.399 . 0 0 "[ . 1 . 2]" 1 928 1 25 LEU QD 1 42 TRP HD1 . . 4.960 4.639 4.402 5.053 0.093 19 0 "[ . 1 . 2]" 1 929 1 25 LEU QD 1 43 LYS HA . . 5.440 5.155 4.867 5.352 . 0 0 "[ . 1 . 2]" 1 930 1 25 LEU QD 1 46 LYS HA . . 3.350 2.676 2.519 2.871 . 0 0 "[ . 1 . 2]" 1 931 1 25 LEU QD 1 46 LYS QB . . 5.280 3.922 3.621 4.124 . 0 0 "[ . 1 . 2]" 1 932 1 25 LEU QD 1 49 LEU H . . 3.730 3.760 3.313 3.840 0.110 18 0 "[ . 1 . 2]" 1 933 1 25 LEU QD 1 49 LEU HA . . 5.440 4.043 3.734 4.199 . 0 0 "[ . 1 . 2]" 1 934 1 25 LEU QD 1 49 LEU HB2 . . 3.760 2.111 1.877 2.269 . 0 0 "[ . 1 . 2]" 1 935 1 25 LEU QD 1 49 LEU QD . . 5.370 1.958 1.721 2.356 . 0 0 "[ . 1 . 2]" 1 936 1 25 LEU QD 1 49 LEU HG . . 3.550 2.959 1.945 3.660 0.110 3 0 "[ . 1 . 2]" 1 937 1 25 LEU QD 1 50 ILE H . . 3.650 3.418 2.277 3.731 0.081 12 0 "[ . 1 . 2]" 1 938 1 25 LEU QD 1 50 ILE HA . . 4.550 3.941 2.899 4.331 . 0 0 "[ . 1 . 2]" 1 939 1 25 LEU QD 1 50 ILE MD . . 4.520 3.448 2.761 3.725 . 0 0 "[ . 1 . 2]" 1 940 1 25 LEU QD 1 50 ILE QG . . 3.430 2.877 2.064 3.188 . 0 0 "[ . 1 . 2]" 1 941 1 25 LEU QD 1 53 LEU QD . . 5.240 2.140 1.942 2.389 . 0 0 "[ . 1 . 2]" 1 942 1 25 LEU QD 1 99 ILE H . . 4.020 3.806 3.667 3.999 . 0 0 "[ . 1 . 2]" 1 943 1 25 LEU QD 1 99 ILE HA . . 4.600 4.595 4.385 4.686 0.086 3 0 "[ . 1 . 2]" 1 944 1 25 LEU QD 1 99 ILE HB . . 3.650 2.263 2.118 2.338 . 0 0 "[ . 1 . 2]" 1 945 1 25 LEU QD 1 99 ILE MD . . 5.190 4.030 3.766 4.293 . 0 0 "[ . 1 . 2]" 1 946 1 25 LEU QD 1 99 ILE HG12 . . 3.790 3.436 3.087 3.894 0.104 11 0 "[ . 1 . 2]" 1 947 1 25 LEU QD 1 99 ILE MG . . 3.980 2.104 1.970 2.268 . 0 0 "[ . 1 . 2]" 1 948 1 25 LEU MD1 1 26 GLN H . . 4.420 4.117 2.492 4.430 0.010 18 0 "[ . 1 . 2]" 1 949 1 25 LEU MD1 1 49 LEU HB2 . . 4.430 2.252 1.888 3.244 . 0 0 "[ . 1 . 2]" 1 950 1 25 LEU MD1 1 49 LEU HB3 . . 4.200 2.390 2.051 2.739 . 0 0 "[ . 1 . 2]" 1 951 1 25 LEU MD1 1 50 ILE H . . 4.650 3.645 3.145 3.919 . 0 0 "[ . 1 . 2]" 1 952 1 25 LEU MD1 1 50 ILE HA . . 5.500 4.697 2.984 5.286 . 0 0 "[ . 1 . 2]" 1 953 1 25 LEU MD1 1 99 ILE H . . 4.930 4.115 3.866 4.997 0.067 19 0 "[ . 1 . 2]" 1 954 1 25 LEU MD1 1 99 ILE MG . . 4.910 2.334 1.974 4.389 . 0 0 "[ . 1 . 2]" 1 955 1 25 LEU MD2 1 26 GLN H . . 4.420 2.641 1.974 4.524 0.104 19 0 "[ . 1 . 2]" 1 956 1 25 LEU MD2 1 49 LEU HB2 . . 4.430 3.522 1.894 3.944 . 0 0 "[ . 1 . 2]" 1 957 1 25 LEU MD2 1 49 LEU HB3 . . 4.200 2.699 2.099 3.140 . 0 0 "[ . 1 . 2]" 1 958 1 25 LEU MD2 1 50 ILE H . . 4.650 4.439 2.306 4.729 0.079 18 0 "[ . 1 . 2]" 1 959 1 25 LEU MD2 1 50 ILE HA . . 5.500 4.288 3.822 4.599 . 0 0 "[ . 1 . 2]" 1 960 1 25 LEU MD2 1 99 ILE H . . 4.930 4.621 3.973 5.029 0.099 5 0 "[ . 1 . 2]" 1 961 1 25 LEU MD2 1 99 ILE MG . . 4.910 3.950 2.023 4.264 . 0 0 "[ . 1 . 2]" 1 962 1 25 LEU HG 1 26 GLN H . . 4.650 4.520 3.296 4.724 0.074 5 0 "[ . 1 . 2]" 1 963 1 25 LEU HG 1 50 ILE H . . 5.030 3.555 3.272 5.123 0.093 11 0 "[ . 1 . 2]" 1 964 1 26 GLN H 1 26 GLN HG2 . . 3.610 2.709 2.316 2.982 . 0 0 "[ . 1 . 2]" 1 965 1 26 GLN H 1 26 GLN HG3 . . 3.610 3.116 2.637 3.671 0.061 8 0 "[ . 1 . 2]" 1 966 1 26 GLN H 1 27 TYR H . . 4.490 4.336 4.195 4.440 . 0 0 "[ . 1 . 2]" 1 967 1 26 GLN H 1 53 LEU QD . . 4.980 5.041 4.846 5.082 0.102 4 0 "[ . 1 . 2]" 1 968 1 26 GLN H 1 99 ILE H . . 4.460 4.491 4.277 4.546 0.086 8 0 "[ . 1 . 2]" 1 969 1 26 GLN HA 1 26 GLN HG2 . . 3.970 3.792 3.621 3.884 . 0 0 "[ . 1 . 2]" 1 970 1 26 GLN HA 1 26 GLN HG3 . . 3.970 3.792 3.707 3.920 . 0 0 "[ . 1 . 2]" 1 971 1 26 GLN HA 1 27 TYR H . . 3.260 2.261 2.194 2.430 . 0 0 "[ . 1 . 2]" 1 972 1 26 GLN HA 1 97 GLY H . . 4.950 4.586 4.368 4.821 . 0 0 "[ . 1 . 2]" 1 973 1 26 GLN HA 1 99 ILE HB . . 4.980 4.353 4.277 4.478 . 0 0 "[ . 1 . 2]" 1 974 1 26 GLN HA 1 99 ILE HG12 . . 4.810 3.643 3.406 4.191 . 0 0 "[ . 1 . 2]" 1 975 1 26 GLN HA 1 99 ILE HG13 . . 5.500 5.210 5.015 5.575 0.075 8 0 "[ . 1 . 2]" 1 976 1 26 GLN HA 1 99 ILE MG . . 5.500 5.581 5.536 5.634 0.134 2 0 "[ . 1 . 2]" 1 977 1 26 GLN QB 1 27 TYR H . . 3.440 2.741 2.591 2.954 . 0 0 "[ . 1 . 2]" 1 978 1 26 GLN QB 1 97 GLY H . . 4.620 4.206 3.891 4.423 . 0 0 "[ . 1 . 2]" 1 979 1 26 GLN QB 1 99 ILE H . . 5.030 4.260 4.023 4.511 . 0 0 "[ . 1 . 2]" 1 980 1 26 GLN QG 1 27 TYR H . . 4.030 3.991 3.456 4.162 0.132 2 0 "[ . 1 . 2]" 1 981 1 27 TYR H 1 27 TYR QD . . 3.590 2.859 2.603 3.301 . 0 0 "[ . 1 . 2]" 1 982 1 27 TYR H 1 27 TYR QE . . 4.350 4.378 4.137 4.446 0.096 15 0 "[ . 1 . 2]" 1 983 1 27 TYR H 1 28 GLU H . . 4.600 4.525 4.471 4.573 . 0 0 "[ . 1 . 2]" 1 984 1 27 TYR H 1 28 GLU HA . . 5.320 5.111 4.990 5.207 . 0 0 "[ . 1 . 2]" 1 985 1 27 TYR H 1 96 ARG HA . . 4.960 4.597 4.446 4.736 . 0 0 "[ . 1 . 2]" 1 986 1 27 TYR H 1 96 ARG HB3 . . 5.500 4.327 4.022 4.599 . 0 0 "[ . 1 . 2]" 1 987 1 27 TYR H 1 97 GLY H . . 3.530 2.802 2.667 2.928 . 0 0 "[ . 1 . 2]" 1 988 1 27 TYR H 1 97 GLY HA2 . . 5.300 4.797 4.617 4.986 . 0 0 "[ . 1 . 2]" 1 989 1 27 TYR H 1 97 GLY QA . . 4.460 4.049 3.892 4.149 . 0 0 "[ . 1 . 2]" 1 990 1 27 TYR H 1 97 GLY HA3 . . 5.300 4.368 4.192 4.535 . 0 0 "[ . 1 . 2]" 1 991 1 27 TYR H 1 98 GLU H . . 4.910 4.871 4.691 5.037 0.127 2 0 "[ . 1 . 2]" 1 992 1 27 TYR H 1 98 GLU QG . . 5.500 5.343 5.073 5.574 0.074 8 0 "[ . 1 . 2]" 1 993 1 27 TYR H 1 99 ILE H . . 4.290 4.330 3.994 4.363 0.073 15 0 "[ . 1 . 2]" 1 994 1 27 TYR H 1 99 ILE MD . . 4.740 4.741 4.343 4.838 0.098 8 0 "[ . 1 . 2]" 1 995 1 27 TYR HA 1 27 TYR QD . . 4.070 3.776 3.740 3.809 . 0 0 "[ . 1 . 2]" 1 996 1 27 TYR HA 1 28 GLU H . . 3.240 2.331 2.274 2.423 . 0 0 "[ . 1 . 2]" 1 997 1 27 TYR HA 1 97 GLY H . . 5.020 4.859 4.733 4.960 . 0 0 "[ . 1 . 2]" 1 998 1 27 TYR HB2 1 28 GLU H . . 3.760 2.573 2.386 2.772 . 0 0 "[ . 1 . 2]" 1 999 1 27 TYR HB2 1 34 ILE MD . . 4.670 3.608 3.345 3.931 . 0 0 "[ . 1 . 2]" 1 1000 1 27 TYR HB2 1 99 ILE MD . . 5.220 5.067 4.581 5.296 0.076 11 0 "[ . 1 . 2]" 1 1001 1 27 TYR HB3 1 28 GLU H . . 4.020 3.880 3.762 3.960 . 0 0 "[ . 1 . 2]" 1 1002 1 27 TYR HB3 1 34 ILE MD . . 4.970 4.553 4.237 4.874 . 0 0 "[ . 1 . 2]" 1 1003 1 27 TYR HB3 1 97 GLY H . . 5.340 4.807 4.696 4.947 . 0 0 "[ . 1 . 2]" 1 1004 1 27 TYR HB3 1 99 ILE MD . . 4.360 4.027 3.529 4.364 0.004 5 0 "[ . 1 . 2]" 1 1005 1 27 TYR QD 1 28 GLU H . . 3.800 3.286 2.942 3.606 . 0 0 "[ . 1 . 2]" 1 1006 1 27 TYR QD 1 28 GLU HA . . 4.590 3.093 2.741 3.343 . 0 0 "[ . 1 . 2]" 1 1007 1 27 TYR QD 1 29 THR H . . 4.520 4.152 3.878 4.410 . 0 0 "[ . 1 . 2]" 1 1008 1 27 TYR QD 1 29 THR MG . . 4.100 3.201 2.675 3.545 . 0 0 "[ . 1 . 2]" 1 1009 1 27 TYR QD 1 34 ILE MD . . 3.370 2.467 2.237 2.758 . 0 0 "[ . 1 . 2]" 1 1010 1 27 TYR QD 1 96 ARG HA . . 4.480 2.915 2.700 3.116 . 0 0 "[ . 1 . 2]" 1 1011 1 27 TYR QD 1 97 GLY H . . 3.760 3.345 3.231 3.429 . 0 0 "[ . 1 . 2]" 1 1012 1 27 TYR QD 1 98 GLU H . . 4.500 4.543 4.339 4.717 0.217 2 0 "[ . 1 . 2]" 1 1013 1 27 TYR QD 1 99 ILE H . . 4.500 3.682 3.191 4.202 . 0 0 "[ . 1 . 2]" 1 1014 1 27 TYR QD 1 99 ILE HA . . 4.800 4.690 4.256 4.882 0.082 15 0 "[ . 1 . 2]" 1 1015 1 27 TYR QD 1 99 ILE MD . . 3.380 2.432 2.054 2.698 . 0 0 "[ . 1 . 2]" 1 1016 1 27 TYR QD 1 99 ILE HG12 . . 4.080 2.152 1.997 2.586 . 0 0 "[ . 1 . 2]" 1 1017 1 27 TYR QD 1 99 ILE HG13 . . 4.160 3.291 3.075 3.559 . 0 0 "[ . 1 . 2]" 1 1018 1 27 TYR QD 1 99 ILE MG . . 4.890 4.733 4.580 4.902 0.012 11 0 "[ . 1 . 2]" 1 1019 1 27 TYR QE 1 29 THR H . . 5.390 5.156 4.450 5.457 0.067 9 0 "[ . 1 . 2]" 1 1020 1 27 TYR QE 1 34 ILE MD . . 3.640 2.311 2.204 2.485 . 0 0 "[ . 1 . 2]" 1 1021 1 27 TYR QE 1 34 ILE MG . . 4.090 4.088 3.739 4.197 0.107 9 0 "[ . 1 . 2]" 1 1022 1 27 TYR QE 1 97 GLY H . . 4.630 3.497 3.202 3.668 . 0 0 "[ . 1 . 2]" 1 1023 1 27 TYR QE 1 99 ILE MD . . 4.950 2.240 2.042 2.667 . 0 0 "[ . 1 . 2]" 1 1024 1 28 GLU H 1 28 GLU QB . . 3.600 2.665 2.535 2.756 . 0 0 "[ . 1 . 2]" 1 1025 1 28 GLU H 1 28 GLU HG2 . . 5.500 4.519 4.359 4.668 . 0 0 "[ . 1 . 2]" 1 1026 1 28 GLU H 1 28 GLU HG3 . . 5.500 4.995 4.749 5.172 . 0 0 "[ . 1 . 2]" 1 1027 1 28 GLU H 1 29 THR H . . 4.510 4.296 4.218 4.404 . 0 0 "[ . 1 . 2]" 1 1028 1 28 GLU H 1 29 THR MG . . 5.100 4.463 4.001 4.742 . 0 0 "[ . 1 . 2]" 1 1029 1 28 GLU H 1 34 ILE MD . . 4.810 4.719 4.526 4.873 0.063 15 0 "[ . 1 . 2]" 1 1030 1 28 GLU H 1 96 ARG HG2 . . 5.500 5.082 4.697 5.554 0.054 1 0 "[ . 1 . 2]" 1 1031 1 28 GLU HA 1 28 GLU HG2 . . 4.240 2.835 2.324 3.370 . 0 0 "[ . 1 . 2]" 1 1032 1 28 GLU HA 1 28 GLU QG . . 3.690 2.555 2.278 2.757 . 0 0 "[ . 1 . 2]" 1 1033 1 28 GLU HA 1 28 GLU HG3 . . 4.240 3.164 2.568 3.647 . 0 0 "[ . 1 . 2]" 1 1034 1 28 GLU HA 1 29 THR H . . 3.150 2.271 2.178 2.340 . 0 0 "[ . 1 . 2]" 1 1035 1 28 GLU HA 1 29 THR MG . . 4.320 3.867 3.439 4.138 . 0 0 "[ . 1 . 2]" 1 1036 1 28 GLU HA 1 94 TYR QD . . 5.500 5.056 4.501 5.454 . 0 0 "[ . 1 . 2]" 1 1037 1 28 GLU HA 1 95 LEU H . . 5.280 5.047 4.790 5.236 . 0 0 "[ . 1 . 2]" 1 1038 1 28 GLU HA 1 96 ARG H . . 5.110 5.014 4.888 5.164 0.054 12 0 "[ . 1 . 2]" 1 1039 1 28 GLU HA 1 96 ARG HA . . 3.890 2.585 2.386 2.731 . 0 0 "[ . 1 . 2]" 1 1040 1 28 GLU HA 1 96 ARG HB3 . . 4.810 3.431 3.075 3.614 . 0 0 "[ . 1 . 2]" 1 1041 1 28 GLU HA 1 96 ARG HG2 . . 4.580 2.352 1.956 3.068 . 0 0 "[ . 1 . 2]" 1 1042 1 28 GLU HA 1 96 ARG HG3 . . 4.400 3.784 2.623 4.262 . 0 0 "[ . 1 . 2]" 1 1043 1 28 GLU HA 1 97 GLY H . . 4.120 4.140 3.973 4.266 0.146 2 0 "[ . 1 . 2]" 1 1044 1 28 GLU QB 1 29 THR H . . 3.650 3.666 3.557 3.720 0.070 1 0 "[ . 1 . 2]" 1 1045 1 28 GLU QB 1 96 ARG HA . . 5.500 4.135 3.722 4.364 . 0 0 "[ . 1 . 2]" 1 1046 1 28 GLU QB 1 96 ARG HD2 . . 5.500 4.403 3.098 5.572 0.072 18 0 "[ . 1 . 2]" 1 1047 1 28 GLU QB 1 96 ARG HD3 . . 5.500 3.074 2.299 5.089 . 0 0 "[ . 1 . 2]" 1 1048 1 28 GLU QB 1 96 ARG HG2 . . 4.470 2.809 2.413 3.192 . 0 0 "[ . 1 . 2]" 1 1049 1 28 GLU QB 1 97 GLY H . . 5.010 4.832 4.468 5.020 0.010 11 0 "[ . 1 . 2]" 1 1050 1 28 GLU QG 1 29 THR H . . 3.500 2.393 2.092 2.669 . 0 0 "[ . 1 . 2]" 1 1051 1 28 GLU QG 1 30 SER H . . 5.340 4.852 4.280 5.215 . 0 0 "[ . 1 . 2]" 1 1052 1 28 GLU QG 1 30 SER QB . . 5.180 4.862 4.503 5.233 0.053 5 0 "[ . 1 . 2]" 1 1053 1 28 GLU QG 1 94 TYR HB3 . . 4.340 3.771 3.275 4.278 . 0 0 "[ . 1 . 2]" 1 1054 1 28 GLU QG 1 96 ARG QD . . 4.650 2.963 2.251 4.085 . 0 0 "[ . 1 . 2]" 1 1055 1 28 GLU QG 1 96 ARG HG2 . . 4.590 2.360 2.088 2.712 . 0 0 "[ . 1 . 2]" 1 1056 1 28 GLU HG2 1 29 THR H . . 4.050 2.497 2.101 2.922 . 0 0 "[ . 1 . 2]" 1 1057 1 28 GLU HG2 1 96 ARG HA . . 5.500 5.033 4.143 5.565 0.065 18 0 "[ . 1 . 2]" 1 1058 1 28 GLU HG3 1 29 THR H . . 4.050 3.564 2.389 4.115 0.065 5 0 "[ . 1 . 2]" 1 1059 1 28 GLU HG3 1 96 ARG HA . . 5.500 5.023 4.267 5.559 0.059 15 0 "[ . 1 . 2]" 1 1060 1 29 THR H 1 29 THR MG . . 3.360 2.868 2.585 3.111 . 0 0 "[ . 1 . 2]" 1 1061 1 29 THR H 1 30 SER H . . 4.120 4.151 4.017 4.183 0.063 10 0 "[ . 1 . 2]" 1 1062 1 29 THR H 1 30 SER QB . . 5.040 4.696 4.527 4.888 . 0 0 "[ . 1 . 2]" 1 1063 1 29 THR H 1 31 ARG H . . 5.500 5.479 5.394 5.561 0.061 2 0 "[ . 1 . 2]" 1 1064 1 29 THR H 1 34 ILE MD . . 4.930 4.456 4.128 4.681 . 0 0 "[ . 1 . 2]" 1 1065 1 29 THR H 1 94 TYR HA . . 4.910 4.415 4.143 4.658 . 0 0 "[ . 1 . 2]" 1 1066 1 29 THR H 1 94 TYR HB3 . . 4.770 4.615 4.168 4.835 0.065 17 0 "[ . 1 . 2]" 1 1067 1 29 THR H 1 94 TYR QD . . 4.390 3.812 3.186 4.249 . 0 0 "[ . 1 . 2]" 1 1068 1 29 THR H 1 94 TYR QE . . 5.500 5.255 4.372 5.583 0.083 11 0 "[ . 1 . 2]" 1 1069 1 29 THR H 1 95 LEU H . . 3.810 3.526 3.160 3.738 . 0 0 "[ . 1 . 2]" 1 1070 1 29 THR H 1 95 LEU HA . . 5.500 5.399 5.135 5.567 0.067 14 0 "[ . 1 . 2]" 1 1071 1 29 THR H 1 95 LEU MD1 . . 5.480 3.958 3.718 4.317 . 0 0 "[ . 1 . 2]" 1 1072 1 29 THR H 1 95 LEU QD . . 4.150 3.850 3.665 4.084 . 0 0 "[ . 1 . 2]" 1 1073 1 29 THR H 1 95 LEU MD2 . . 5.480 5.338 4.757 5.547 0.067 12 0 "[ . 1 . 2]" 1 1074 1 29 THR H 1 95 LEU HG . . 5.500 4.029 3.533 4.237 . 0 0 "[ . 1 . 2]" 1 1075 1 29 THR H 1 96 ARG H . . 5.430 5.465 5.191 5.506 0.076 3 0 "[ . 1 . 2]" 1 1076 1 29 THR H 1 96 ARG HA . . 4.120 3.955 3.847 4.038 . 0 0 "[ . 1 . 2]" 1 1077 1 29 THR H 1 96 ARG HB3 . . 5.260 5.262 4.862 5.331 0.071 12 0 "[ . 1 . 2]" 1 1078 1 29 THR H 1 96 ARG HG2 . . 4.620 3.370 2.953 4.369 . 0 0 "[ . 1 . 2]" 1 1079 1 29 THR H 1 96 ARG HG3 . . 4.910 4.280 3.268 4.891 . 0 0 "[ . 1 . 2]" 1 1080 1 29 THR HA 1 30 SER H . . 3.090 2.381 2.160 2.491 . 0 0 "[ . 1 . 2]" 1 1081 1 29 THR HA 1 31 ARG H . . 5.500 4.990 4.781 5.187 . 0 0 "[ . 1 . 2]" 1 1082 1 29 THR HA 1 95 LEU QD . . 5.440 5.079 4.942 5.306 . 0 0 "[ . 1 . 2]" 1 1083 1 29 THR HB 1 30 SER H . . 4.410 4.274 4.091 4.397 . 0 0 "[ . 1 . 2]" 1 1084 1 29 THR HB 1 31 ARG HD2 . . 4.760 4.419 4.065 4.807 0.047 14 0 "[ . 1 . 2]" 1 1085 1 29 THR HB 1 34 ILE MD . . 4.110 3.740 3.537 3.994 . 0 0 "[ . 1 . 2]" 1 1086 1 29 THR MG 1 30 SER H . . 3.960 3.756 3.520 4.038 0.078 13 0 "[ . 1 . 2]" 1 1087 1 29 THR MG 1 31 ARG H . . 3.300 2.752 2.379 3.240 . 0 0 "[ . 1 . 2]" 1 1088 1 29 THR MG 1 31 ARG HB2 . . 3.750 3.338 2.956 3.831 0.081 4 0 "[ . 1 . 2]" 1 1089 1 29 THR MG 1 31 ARG HD2 . . 4.690 4.023 3.330 4.713 0.023 16 0 "[ . 1 . 2]" 1 1090 1 29 THR MG 1 31 ARG HD3 . . 5.050 4.111 3.591 4.903 . 0 0 "[ . 1 . 2]" 1 1091 1 29 THR MG 1 31 ARG HG3 . . 4.410 3.856 3.409 4.473 0.063 4 0 "[ . 1 . 2]" 1 1092 1 29 THR MG 1 32 ASP H . . 4.460 4.105 3.750 4.527 0.067 4 0 "[ . 1 . 2]" 1 1093 1 29 THR MG 1 33 SER H . . 4.060 3.866 3.570 4.128 0.068 13 0 "[ . 1 . 2]" 1 1094 1 29 THR MG 1 34 ILE MD . . 2.970 1.989 1.852 2.182 . 0 0 "[ . 1 . 2]" 1 1095 1 29 THR MG 1 34 ILE HG12 . . 4.200 3.900 3.570 4.242 0.042 8 0 "[ . 1 . 2]" 1 1096 1 29 THR MG 1 34 ILE MG . . 4.170 4.014 3.765 4.257 0.087 10 0 "[ . 1 . 2]" 1 1097 1 29 THR MG 1 35 PRO HD2 . . 5.440 4.821 4.480 5.204 . 0 0 "[ . 1 . 2]" 1 1098 1 29 THR MG 1 95 LEU H . . 3.960 3.905 3.585 4.045 0.085 8 0 "[ . 1 . 2]" 1 1099 1 29 THR MG 1 95 LEU MD1 . . 3.350 2.253 2.075 2.609 . 0 0 "[ . 1 . 2]" 1 1100 1 29 THR MG 1 95 LEU QD . . 2.920 2.209 2.057 2.537 . 0 0 "[ . 1 . 2]" 1 1101 1 29 THR MG 1 95 LEU MD2 . . 3.350 3.283 2.688 3.471 0.121 16 0 "[ . 1 . 2]" 1 1102 1 29 THR MG 1 95 LEU HG . . 3.200 2.907 2.610 3.080 . 0 0 "[ . 1 . 2]" 1 1103 1 30 SER H 1 30 SER HB2 . . 3.790 3.568 2.969 3.831 0.041 9 0 "[ . 1 . 2]" 1 1104 1 30 SER H 1 30 SER HB3 . . 3.790 3.147 2.671 3.493 . 0 0 "[ . 1 . 2]" 1 1105 1 30 SER H 1 31 ARG H . . 3.670 3.675 3.571 3.732 0.062 18 0 "[ . 1 . 2]" 1 1106 1 30 SER H 1 31 ARG HA . . 5.030 4.636 4.467 4.903 . 0 0 "[ . 1 . 2]" 1 1107 1 30 SER H 1 31 ARG HD2 . . 4.930 4.679 4.018 4.989 0.059 13 0 "[ . 1 . 2]" 1 1108 1 30 SER H 1 31 ARG HG3 . . 4.020 3.106 2.880 3.291 . 0 0 "[ . 1 . 2]" 1 1109 1 30 SER H 1 94 TYR QD . . 4.600 4.476 3.751 4.679 0.079 17 0 "[ . 1 . 2]" 1 1110 1 30 SER H 1 94 TYR QE . . 4.500 4.308 3.277 4.577 0.077 14 0 "[ . 1 . 2]" 1 1111 1 30 SER H 1 95 LEU H . . 5.100 4.994 4.790 5.137 0.037 14 0 "[ . 1 . 2]" 1 1112 1 30 SER H 1 95 LEU QD . . 5.180 5.051 4.617 5.276 0.096 13 0 "[ . 1 . 2]" 1 1113 1 30 SER HA 1 94 TYR H . . 5.220 5.022 4.738 5.287 0.067 8 0 "[ . 1 . 2]" 1 1114 1 30 SER HA 1 94 TYR HA . . 3.740 2.589 2.380 2.771 . 0 0 "[ . 1 . 2]" 1 1115 1 30 SER HA 1 94 TYR QD . . 4.360 4.413 4.232 4.448 0.088 6 0 "[ . 1 . 2]" 1 1116 1 30 SER HA 1 95 LEU HG . . 5.500 3.230 2.921 3.533 . 0 0 "[ . 1 . 2]" 1 1117 1 30 SER HB2 1 31 ARG H . . 4.730 4.467 4.258 4.791 0.061 17 0 "[ . 1 . 2]" 1 1118 1 30 SER HB3 1 31 ARG H . . 4.730 4.721 4.575 4.796 0.066 8 0 "[ . 1 . 2]" 1 1119 1 31 ARG H 1 31 ARG HD2 . . 5.070 4.872 4.298 5.142 0.072 14 0 "[ . 1 . 2]" 1 1120 1 31 ARG H 1 31 ARG HD3 . . 5.400 4.630 4.285 4.894 . 0 0 "[ . 1 . 2]" 1 1121 1 31 ARG H 1 31 ARG HG3 . . 3.400 3.279 3.085 3.400 0.000 6 0 "[ . 1 . 2]" 1 1122 1 31 ARG H 1 32 ASP H . . 3.820 2.973 2.838 3.119 . 0 0 "[ . 1 . 2]" 1 1123 1 31 ARG H 1 33 SER H . . 4.420 3.696 3.545 3.897 . 0 0 "[ . 1 . 2]" 1 1124 1 31 ARG H 1 33 SER HA . . 5.500 4.567 4.333 4.798 . 0 0 "[ . 1 . 2]" 1 1125 1 31 ARG H 1 34 ILE MD . . 5.500 5.103 4.813 5.384 . 0 0 "[ . 1 . 2]" 1 1126 1 31 ARG H 1 95 LEU H . . 4.610 4.604 4.380 4.683 0.073 16 0 "[ . 1 . 2]" 1 1127 1 31 ARG H 1 95 LEU MD1 . . 4.360 4.089 3.711 4.409 0.049 2 0 "[ . 1 . 2]" 1 1128 1 31 ARG H 1 95 LEU QD . . 3.810 2.965 2.268 3.488 . 0 0 "[ . 1 . 2]" 1 1129 1 31 ARG H 1 95 LEU MD2 . . 4.360 3.056 2.280 3.676 . 0 0 "[ . 1 . 2]" 1 1130 1 31 ARG H 1 95 LEU HG . . 4.160 3.711 3.367 3.949 . 0 0 "[ . 1 . 2]" 1 1131 1 31 ARG HA 1 31 ARG HD2 . . 5.190 4.829 4.715 4.900 . 0 0 "[ . 1 . 2]" 1 1132 1 31 ARG HA 1 31 ARG HD3 . . 5.470 4.463 4.371 4.589 . 0 0 "[ . 1 . 2]" 1 1133 1 31 ARG HA 1 32 ASP HA . . 5.500 4.600 4.542 4.670 . 0 0 "[ . 1 . 2]" 1 1134 1 31 ARG HA 1 32 ASP QB . . 4.890 4.754 4.604 4.966 0.076 7 0 "[ . 1 . 2]" 1 1135 1 31 ARG HB2 1 31 ARG HD3 . . 3.350 2.266 2.087 2.356 . 0 0 "[ . 1 . 2]" 1 1136 1 31 ARG HB2 1 32 ASP H . . 3.460 1.911 1.814 1.980 . 0 0 "[ . 1 . 2]" 1 1137 1 31 ARG HB2 1 33 SER H . . 3.330 3.271 3.178 3.385 0.055 13 0 "[ . 1 . 2]" 1 1138 1 31 ARG HB3 1 32 ASP H . . 3.520 2.304 2.169 2.538 . 0 0 "[ . 1 . 2]" 1 1139 1 31 ARG HB3 1 33 SER H . . 4.070 4.148 4.126 4.314 0.244 2 0 "[ . 1 . 2]" 1 1140 1 31 ARG HD3 1 32 ASP H . . 4.210 3.777 3.621 3.962 . 0 0 "[ . 1 . 2]" 1 1141 1 31 ARG HD3 1 32 ASP QB . . 5.330 4.824 4.390 5.382 0.052 16 0 "[ . 1 . 2]" 1 1142 1 31 ARG HD3 1 33 SER H . . 4.880 4.935 4.656 4.964 0.084 5 0 "[ . 1 . 2]" 1 1143 1 32 ASP H 1 32 ASP HB2 . . 3.450 2.665 2.257 3.111 . 0 0 "[ . 1 . 2]" 1 1144 1 32 ASP H 1 32 ASP HB3 . . 3.450 3.078 2.415 3.515 0.065 12 0 "[ . 1 . 2]" 1 1145 1 32 ASP H 1 33 SER H . . 3.040 1.942 1.824 2.107 . 0 0 "[ . 1 . 2]" 1 1146 1 32 ASP H 1 95 LEU MD1 . . 5.200 5.018 4.663 5.219 0.019 12 0 "[ . 1 . 2]" 1 1147 1 32 ASP H 1 95 LEU QD . . 4.100 3.823 3.267 4.170 0.070 16 0 "[ . 1 . 2]" 1 1148 1 32 ASP H 1 95 LEU MD2 . . 5.200 3.969 3.333 4.387 . 0 0 "[ . 1 . 2]" 1 1149 1 32 ASP HA 1 32 ASP HB2 . . 2.890 2.712 2.361 2.961 0.071 12 0 "[ . 1 . 2]" 1 1150 1 32 ASP HA 1 32 ASP HB3 . . 2.890 2.879 2.611 2.981 0.091 2 0 "[ . 1 . 2]" 1 1151 1 32 ASP HA 1 95 LEU QD . . 4.070 4.166 4.066 4.197 0.127 9 0 "[ . 1 . 2]" 1 1152 1 32 ASP QB 1 95 LEU QD . . 5.120 4.597 4.364 4.804 . 0 0 "[ . 1 . 2]" 1 1153 1 32 ASP HB2 1 33 SER H . . 3.800 3.429 2.629 3.855 0.055 11 0 "[ . 1 . 2]" 1 1154 1 32 ASP HB3 1 33 SER H . . 3.800 2.913 2.466 3.449 . 0 0 "[ . 1 . 2]" 1 1155 1 33 SER H 1 33 SER HB2 . . 4.050 3.651 3.257 4.092 0.042 4 0 "[ . 1 . 2]" 1 1156 1 33 SER H 1 33 SER QB . . 3.460 3.336 3.131 3.558 0.098 8 0 "[ . 1 . 2]" 1 1157 1 33 SER H 1 33 SER HB3 . . 4.050 3.975 3.432 4.124 0.074 18 0 "[ . 1 . 2]" 1 1158 1 33 SER H 1 34 ILE H . . 4.470 4.251 4.184 4.387 . 0 0 "[ . 1 . 2]" 1 1159 1 33 SER H 1 34 ILE MD . . 4.670 4.421 4.071 4.737 0.067 20 0 "[ . 1 . 2]" 1 1160 1 33 SER H 1 95 LEU MD1 . . 4.570 3.931 3.624 4.228 . 0 0 "[ . 1 . 2]" 1 1161 1 33 SER H 1 95 LEU QD . . 3.690 3.050 2.687 3.269 . 0 0 "[ . 1 . 2]" 1 1162 1 33 SER H 1 95 LEU MD2 . . 4.570 3.179 2.762 3.436 . 0 0 "[ . 1 . 2]" 1 1163 1 33 SER HA 1 33 SER HB2 . . 3.000 2.836 2.274 3.050 0.050 7 0 "[ . 1 . 2]" 1 1164 1 33 SER HA 1 33 SER HB3 . . 3.000 2.493 2.197 3.031 0.031 16 0 "[ . 1 . 2]" 1 1165 1 33 SER HA 1 34 ILE H . . 2.820 2.795 2.512 2.894 0.074 17 0 "[ . 1 . 2]" 1 1166 1 33 SER HA 1 34 ILE HB . . 5.500 5.163 4.921 5.325 . 0 0 "[ . 1 . 2]" 1 1167 1 33 SER HA 1 34 ILE MD . . 4.430 3.700 3.367 4.094 . 0 0 "[ . 1 . 2]" 1 1168 1 33 SER HA 1 34 ILE HG12 . . 5.500 3.575 3.359 3.833 . 0 0 "[ . 1 . 2]" 1 1169 1 33 SER HA 1 95 LEU MD1 . . 3.740 2.273 2.069 2.512 . 0 0 "[ . 1 . 2]" 1 1170 1 33 SER HA 1 95 LEU QD . . 2.850 1.841 1.785 1.955 . 0 0 "[ . 1 . 2]" 1 1171 1 33 SER HA 1 95 LEU MD2 . . 3.740 1.953 1.852 2.051 . 0 0 "[ . 1 . 2]" 1 1172 1 33 SER QB 1 34 ILE H . . 3.020 1.925 1.590 2.941 . 0 0 "[ . 1 . 2]" 1 1173 1 33 SER QB 1 34 ILE HA . . 5.050 4.292 4.131 4.929 . 0 0 "[ . 1 . 2]" 1 1174 1 33 SER QB 1 95 LEU QD . . 4.850 2.910 2.380 3.345 . 0 0 "[ . 1 . 2]" 1 1175 1 33 SER HB2 1 34 ILE H . . 3.550 2.688 1.595 3.470 . 0 0 "[ . 1 . 2]" 1 1176 1 33 SER HB2 1 34 ILE HB . . 5.500 5.161 3.972 6.032 0.532 2 1 "[ + . 1 . 2]" 1 1177 1 33 SER HB3 1 34 ILE H . . 3.550 2.393 1.717 3.353 . 0 0 "[ . 1 . 2]" 1 1178 1 33 SER HB3 1 34 ILE HB . . 5.500 4.860 4.164 5.586 0.086 4 0 "[ . 1 . 2]" 1 1179 1 34 ILE H 1 34 ILE HB . . 3.150 2.658 2.493 2.773 . 0 0 "[ . 1 . 2]" 1 1180 1 34 ILE H 1 34 ILE MD . . 3.710 3.365 3.027 3.753 0.043 20 0 "[ . 1 . 2]" 1 1181 1 34 ILE H 1 34 ILE HG12 . . 3.300 2.412 2.079 2.657 . 0 0 "[ . 1 . 2]" 1 1182 1 34 ILE H 1 34 ILE HG13 . . 4.100 3.822 3.532 4.036 . 0 0 "[ . 1 . 2]" 1 1183 1 34 ILE H 1 34 ILE MG . . 3.910 3.826 3.699 3.900 . 0 0 "[ . 1 . 2]" 1 1184 1 34 ILE H 1 35 PRO HD2 . . 5.030 4.885 4.731 4.972 . 0 0 "[ . 1 . 2]" 1 1185 1 34 ILE H 1 35 PRO HD3 . . 4.940 4.747 4.506 4.988 0.048 7 0 "[ . 1 . 2]" 1 1186 1 34 ILE H 1 39 LEU QD . . 5.440 4.182 4.042 4.292 . 0 0 "[ . 1 . 2]" 1 1187 1 34 ILE H 1 95 LEU QD . . 4.530 3.141 2.759 3.491 . 0 0 "[ . 1 . 2]" 1 1188 1 34 ILE HA 1 34 ILE MD . . 3.520 2.232 2.164 2.315 . 0 0 "[ . 1 . 2]" 1 1189 1 34 ILE HA 1 34 ILE MG . . 3.380 2.283 2.219 2.379 . 0 0 "[ . 1 . 2]" 1 1190 1 34 ILE HA 1 35 PRO HB3 . . 5.500 5.113 4.886 5.210 . 0 0 "[ . 1 . 2]" 1 1191 1 34 ILE HA 1 35 PRO HD2 . . 3.570 2.166 1.971 2.299 . 0 0 "[ . 1 . 2]" 1 1192 1 34 ILE HA 1 35 PRO HD3 . . 3.480 2.431 2.284 2.573 . 0 0 "[ . 1 . 2]" 1 1193 1 34 ILE HA 1 35 PRO HG2 . . 4.530 4.358 4.170 4.474 . 0 0 "[ . 1 . 2]" 1 1194 1 34 ILE HA 1 35 PRO HG3 . . 4.900 4.488 4.317 4.588 . 0 0 "[ . 1 . 2]" 1 1195 1 34 ILE HA 1 38 LEU MD2 . . 5.270 5.057 4.527 5.260 . 0 0 "[ . 1 . 2]" 1 1196 1 34 ILE HA 1 95 LEU QD . . 5.440 3.968 3.797 4.156 . 0 0 "[ . 1 . 2]" 1 1197 1 34 ILE HB 1 34 ILE MD . . 3.610 3.262 3.185 3.296 . 0 0 "[ . 1 . 2]" 1 1198 1 34 ILE HB 1 35 PRO HA . . 5.500 5.175 5.061 5.253 . 0 0 "[ . 1 . 2]" 1 1199 1 34 ILE HB 1 35 PRO HD2 . . 5.500 4.215 3.981 4.418 . 0 0 "[ . 1 . 2]" 1 1200 1 34 ILE HB 1 35 PRO HD3 . . 5.500 5.006 4.846 5.144 . 0 0 "[ . 1 . 2]" 1 1201 1 34 ILE HB 1 39 LEU H . . 5.500 5.302 5.133 5.555 0.055 20 0 "[ . 1 . 2]" 1 1202 1 34 ILE HB 1 39 LEU HB2 . . 4.250 3.241 3.059 3.764 . 0 0 "[ . 1 . 2]" 1 1203 1 34 ILE HB 1 39 LEU MD1 . . 4.420 2.163 1.936 2.346 . 0 0 "[ . 1 . 2]" 1 1204 1 34 ILE HB 1 39 LEU QD . . 3.500 2.138 1.928 2.269 . 0 0 "[ . 1 . 2]" 1 1205 1 34 ILE HB 1 39 LEU MD2 . . 4.420 3.541 2.997 4.284 . 0 0 "[ . 1 . 2]" 1 1206 1 34 ILE HB 1 39 LEU HG . . 4.840 4.917 4.882 4.928 0.088 4 0 "[ . 1 . 2]" 1 1207 1 34 ILE MD 1 34 ILE MG . . 2.910 2.049 1.891 2.113 . 0 0 "[ . 1 . 2]" 1 1208 1 34 ILE MD 1 35 PRO HD2 . . 4.090 3.533 3.395 3.702 . 0 0 "[ . 1 . 2]" 1 1209 1 34 ILE MD 1 35 PRO HD3 . . 4.190 4.112 3.976 4.250 0.060 14 0 "[ . 1 . 2]" 1 1210 1 34 ILE MD 1 39 LEU MD1 . . 5.500 3.737 3.455 3.890 . 0 0 "[ . 1 . 2]" 1 1211 1 34 ILE MD 1 39 LEU MD2 . . 5.500 5.496 5.141 5.641 0.141 9 0 "[ . 1 . 2]" 1 1212 1 34 ILE MD 1 42 TRP HE3 . . 5.280 4.824 4.341 5.214 . 0 0 "[ . 1 . 2]" 1 1213 1 34 ILE MD 1 95 LEU QD . . 3.310 2.069 1.814 2.173 . 0 0 "[ . 1 . 2]" 1 1214 1 34 ILE MD 1 95 LEU HG . . 4.490 4.043 3.767 4.314 . 0 0 "[ . 1 . 2]" 1 1215 1 34 ILE MD 1 99 ILE MD . . 5.460 5.016 4.643 5.270 . 0 0 "[ . 1 . 2]" 1 1216 1 34 ILE HG12 1 34 ILE MG . . 3.670 3.220 3.184 3.246 . 0 0 "[ . 1 . 2]" 1 1217 1 34 ILE HG12 1 39 LEU QD . . 5.440 3.588 3.444 3.775 . 0 0 "[ . 1 . 2]" 1 1218 1 34 ILE HG12 1 95 LEU HB2 . . 5.500 4.860 4.403 5.179 . 0 0 "[ . 1 . 2]" 1 1219 1 34 ILE HG12 1 95 LEU QD . . 3.440 2.308 1.945 2.571 . 0 0 "[ . 1 . 2]" 1 1220 1 34 ILE HG13 1 34 ILE MG . . 2.820 2.343 2.275 2.485 . 0 0 "[ . 1 . 2]" 1 1221 1 34 ILE HG13 1 39 LEU HB2 . . 5.280 4.584 4.435 5.039 . 0 0 "[ . 1 . 2]" 1 1222 1 34 ILE HG13 1 39 LEU QD . . 5.430 2.687 2.492 2.864 . 0 0 "[ . 1 . 2]" 1 1223 1 34 ILE HG13 1 42 TRP HZ3 . . 5.100 3.352 2.829 4.588 . 0 0 "[ . 1 . 2]" 1 1224 1 34 ILE MG 1 35 PRO HA . . 5.500 4.322 4.188 4.442 . 0 0 "[ . 1 . 2]" 1 1225 1 34 ILE MG 1 35 PRO HD2 . . 3.660 2.213 2.003 2.518 . 0 0 "[ . 1 . 2]" 1 1226 1 34 ILE MG 1 35 PRO HD3 . . 3.680 3.505 3.311 3.741 0.061 14 0 "[ . 1 . 2]" 1 1227 1 34 ILE MG 1 35 PRO HG2 . . 3.780 3.481 3.233 3.829 0.049 16 0 "[ . 1 . 2]" 1 1228 1 34 ILE MG 1 36 THR HA . . 4.510 4.213 3.863 4.357 . 0 0 "[ . 1 . 2]" 1 1229 1 34 ILE MG 1 38 LEU H . . 4.840 4.465 4.346 4.576 . 0 0 "[ . 1 . 2]" 1 1230 1 34 ILE MG 1 38 LEU MD2 . . 4.980 3.715 3.598 3.864 . 0 0 "[ . 1 . 2]" 1 1231 1 34 ILE MG 1 39 LEU H . . 3.470 3.175 2.976 3.293 . 0 0 "[ . 1 . 2]" 1 1232 1 34 ILE MG 1 39 LEU HA . . 4.060 3.387 3.192 3.708 . 0 0 "[ . 1 . 2]" 1 1233 1 34 ILE MG 1 39 LEU HB2 . . 3.130 2.021 1.803 2.159 . 0 0 "[ . 1 . 2]" 1 1234 1 34 ILE MG 1 39 LEU HB3 . . 3.610 3.442 3.104 3.669 0.059 20 0 "[ . 1 . 2]" 1 1235 1 34 ILE MG 1 39 LEU MD1 . . 5.500 2.031 1.784 2.144 . 0 0 "[ . 1 . 2]" 1 1236 1 34 ILE MG 1 39 LEU QD . . 4.060 2.021 1.779 2.131 . 0 0 "[ . 1 . 2]" 1 1237 1 34 ILE MG 1 39 LEU MD2 . . 5.500 3.686 3.461 3.914 . 0 0 "[ . 1 . 2]" 1 1238 1 34 ILE MG 1 40 ASN H . . 5.190 5.121 4.945 5.250 0.060 20 0 "[ . 1 . 2]" 1 1239 1 34 ILE MG 1 42 TRP HZ3 . . 3.940 2.230 1.978 3.185 . 0 0 "[ . 1 . 2]" 1 1240 1 34 ILE MG 1 99 ILE MD . . 5.000 4.034 3.771 4.262 . 0 0 "[ . 1 . 2]" 1 1241 1 35 PRO HA 1 36 THR H . . 2.710 2.146 2.108 2.189 . 0 0 "[ . 1 . 2]" 1 1242 1 35 PRO HA 1 36 THR HA . . 4.510 4.382 4.332 4.420 . 0 0 "[ . 1 . 2]" 1 1243 1 35 PRO HA 1 36 THR HB . . 4.640 4.422 4.267 4.603 . 0 0 "[ . 1 . 2]" 1 1244 1 35 PRO HA 1 36 THR MG . . 4.110 3.991 3.848 4.157 0.047 16 0 "[ . 1 . 2]" 1 1245 1 35 PRO HA 1 37 GLU H . . 3.620 3.684 3.577 3.699 0.079 11 0 "[ . 1 . 2]" 1 1246 1 35 PRO HA 1 38 LEU H . . 5.250 5.096 5.004 5.186 . 0 0 "[ . 1 . 2]" 1 1247 1 35 PRO HA 1 38 LEU MD1 . . 4.960 4.573 4.432 4.679 . 0 0 "[ . 1 . 2]" 1 1248 1 35 PRO HA 1 39 LEU H . . 5.380 5.319 5.206 5.447 0.067 20 0 "[ . 1 . 2]" 1 1249 1 35 PRO HB2 1 36 THR H . . 3.800 3.633 3.424 3.701 . 0 0 "[ . 1 . 2]" 1 1250 1 35 PRO HB2 1 36 THR MG . . 4.350 4.405 4.102 4.440 0.090 14 0 "[ . 1 . 2]" 1 1251 1 35 PRO HB2 1 37 GLU H . . 3.870 2.659 2.538 2.737 . 0 0 "[ . 1 . 2]" 1 1252 1 35 PRO HB2 1 38 LEU H . . 3.890 3.156 3.076 3.240 . 0 0 "[ . 1 . 2]" 1 1253 1 35 PRO HB2 1 38 LEU HB3 . . 5.500 5.510 5.313 5.563 0.063 11 0 "[ . 1 . 2]" 1 1254 1 35 PRO HB2 1 38 LEU MD1 . . 3.740 3.794 3.703 3.824 0.084 14 0 "[ . 1 . 2]" 1 1255 1 35 PRO HB2 1 38 LEU MD2 . . 4.190 4.178 3.978 4.279 0.089 10 0 "[ . 1 . 2]" 1 1256 1 35 PRO HB2 1 38 LEU HG . . 3.990 3.262 3.103 3.337 . 0 0 "[ . 1 . 2]" 1 1257 1 35 PRO HB2 1 39 LEU H . . 4.910 4.509 4.438 4.722 . 0 0 "[ . 1 . 2]" 1 1258 1 35 PRO HB3 1 36 THR H . . 4.360 4.012 3.882 4.116 . 0 0 "[ . 1 . 2]" 1 1259 1 35 PRO HB3 1 36 THR MG . . 5.500 5.062 4.901 5.150 . 0 0 "[ . 1 . 2]" 1 1260 1 35 PRO HB3 1 37 GLU H . . 4.110 4.077 3.979 4.157 0.047 20 0 "[ . 1 . 2]" 1 1261 1 35 PRO HB3 1 38 LEU H . . 5.500 4.881 4.821 4.970 . 0 0 "[ . 1 . 2]" 1 1262 1 35 PRO HB3 1 38 LEU MD2 . . 5.500 4.838 4.653 4.968 . 0 0 "[ . 1 . 2]" 1 1263 1 35 PRO HB3 1 38 LEU HG . . 5.500 4.622 4.503 4.686 . 0 0 "[ . 1 . 2]" 1 1264 1 35 PRO HD2 1 36 THR H . . 5.500 5.543 5.466 5.566 0.066 16 0 "[ . 1 . 2]" 1 1265 1 35 PRO HD2 1 38 LEU H . . 5.170 4.959 4.833 5.182 0.012 7 0 "[ . 1 . 2]" 1 1266 1 35 PRO HD2 1 38 LEU MD1 . . 4.250 2.304 2.071 2.534 . 0 0 "[ . 1 . 2]" 1 1267 1 35 PRO HD2 1 38 LEU MD2 . . 3.580 3.274 2.849 3.535 . 0 0 "[ . 1 . 2]" 1 1268 1 35 PRO HD2 1 38 LEU HG . . 5.500 3.838 3.537 4.134 . 0 0 "[ . 1 . 2]" 1 1269 1 35 PRO HD2 1 39 LEU H . . 5.060 4.728 4.499 5.000 . 0 0 "[ . 1 . 2]" 1 1270 1 35 PRO HD3 1 38 LEU MD1 . . 5.500 3.760 3.588 3.950 . 0 0 "[ . 1 . 2]" 1 1271 1 35 PRO HD3 1 38 LEU MD2 . . 4.310 4.247 3.940 4.390 0.080 15 0 "[ . 1 . 2]" 1 1272 1 35 PRO HG2 1 38 LEU H . . 4.040 3.223 2.977 3.380 . 0 0 "[ . 1 . 2]" 1 1273 1 35 PRO HG2 1 38 LEU HB2 . . 4.650 4.719 4.595 4.730 0.080 10 0 "[ . 1 . 2]" 1 1274 1 35 PRO HG2 1 38 LEU HB3 . . 4.580 4.446 4.327 4.525 . 0 0 "[ . 1 . 2]" 1 1275 1 35 PRO HG2 1 38 LEU MD1 . . 3.550 2.297 2.110 2.534 . 0 0 "[ . 1 . 2]" 1 1276 1 35 PRO HG2 1 38 LEU MD2 . . 3.510 2.456 2.240 2.692 . 0 0 "[ . 1 . 2]" 1 1277 1 35 PRO HG2 1 38 LEU HG . . 4.160 2.045 1.858 2.149 . 0 0 "[ . 1 . 2]" 1 1278 1 35 PRO HG2 1 39 LEU H . . 5.010 4.042 3.758 4.270 . 0 0 "[ . 1 . 2]" 1 1279 1 35 PRO HG3 1 38 LEU MD2 . . 4.060 3.147 2.826 3.270 . 0 0 "[ . 1 . 2]" 1 1280 1 36 THR H 1 36 THR HB . . 3.060 2.364 2.216 2.511 . 0 0 "[ . 1 . 2]" 1 1281 1 36 THR H 1 36 THR MG . . 3.240 2.352 2.238 2.538 . 0 0 "[ . 1 . 2]" 1 1282 1 36 THR H 1 37 GLU H . . 3.380 2.786 2.610 2.863 . 0 0 "[ . 1 . 2]" 1 1283 1 36 THR H 1 37 GLU HA . . 5.500 5.316 5.146 5.393 . 0 0 "[ . 1 . 2]" 1 1284 1 36 THR H 1 37 GLU HG2 . . 5.500 4.751 4.351 5.062 . 0 0 "[ . 1 . 2]" 1 1285 1 36 THR H 1 37 GLU HG3 . . 5.500 4.014 3.792 4.211 . 0 0 "[ . 1 . 2]" 1 1286 1 36 THR H 1 38 LEU H . . 5.100 4.922 4.763 5.012 . 0 0 "[ . 1 . 2]" 1 1287 1 36 THR H 1 38 LEU MD1 . . 5.040 5.023 4.854 5.108 0.068 10 0 "[ . 1 . 2]" 1 1288 1 36 THR H 1 39 LEU H . . 4.890 4.870 4.707 4.956 0.066 1 0 "[ . 1 . 2]" 1 1289 1 36 THR H 1 39 LEU HB3 . . 4.480 4.452 4.064 4.549 0.069 20 0 "[ . 1 . 2]" 1 1290 1 36 THR H 1 39 LEU QD . . 4.660 4.479 3.931 4.674 0.014 14 0 "[ . 1 . 2]" 1 1291 1 36 THR HA 1 36 THR MG . . 3.200 3.234 3.191 3.254 0.054 20 0 "[ . 1 . 2]" 1 1292 1 36 THR HA 1 37 GLU H . . 3.520 3.503 3.457 3.526 0.006 9 0 "[ . 1 . 2]" 1 1293 1 36 THR HA 1 38 LEU H . . 4.460 4.461 4.299 4.527 0.067 15 0 "[ . 1 . 2]" 1 1294 1 36 THR HA 1 39 LEU H . . 3.670 3.320 3.086 3.411 . 0 0 "[ . 1 . 2]" 1 1295 1 36 THR HA 1 39 LEU HA . . 4.800 4.801 4.630 4.859 0.059 3 0 "[ . 1 . 2]" 1 1296 1 36 THR HA 1 39 LEU HB2 . . 3.650 3.160 2.617 3.573 . 0 0 "[ . 1 . 2]" 1 1297 1 36 THR HA 1 39 LEU HB3 . . 3.650 1.940 1.827 2.000 . 0 0 "[ . 1 . 2]" 1 1298 1 36 THR HA 1 39 LEU MD1 . . 4.540 4.282 3.509 4.622 0.082 8 0 "[ . 1 . 2]" 1 1299 1 36 THR HA 1 39 LEU QD . . 3.420 2.794 2.388 3.065 . 0 0 "[ . 1 . 2]" 1 1300 1 36 THR HA 1 39 LEU MD2 . . 4.540 2.837 2.416 3.147 . 0 0 "[ . 1 . 2]" 1 1301 1 36 THR HA 1 39 LEU HG . . 4.460 4.522 4.320 4.548 0.088 20 0 "[ . 1 . 2]" 1 1302 1 36 THR HA 1 40 ASN H . . 3.690 2.943 2.569 3.110 . 0 0 "[ . 1 . 2]" 1 1303 1 36 THR HA 1 40 ASN HB2 . . 4.880 4.025 3.484 4.389 . 0 0 "[ . 1 . 2]" 1 1304 1 36 THR HB 1 37 GLU H . . 4.190 4.111 4.001 4.234 0.044 6 0 "[ . 1 . 2]" 1 1305 1 36 THR HB 1 39 LEU QD . . 4.360 3.856 3.459 4.073 . 0 0 "[ . 1 . 2]" 1 1306 1 36 THR HB 1 40 ASN H . . 4.960 5.005 4.652 5.039 0.079 4 0 "[ . 1 . 2]" 1 1307 1 36 THR MG 1 37 GLU H . . 3.440 2.524 2.075 2.634 . 0 0 "[ . 1 . 2]" 1 1308 1 36 THR MG 1 37 GLU HA . . 5.500 3.245 3.076 3.343 . 0 0 "[ . 1 . 2]" 1 1309 1 36 THR MG 1 37 GLU HG2 . . 5.500 3.073 2.808 3.464 . 0 0 "[ . 1 . 2]" 1 1310 1 36 THR MG 1 37 GLU HG3 . . 5.500 3.434 3.155 3.658 . 0 0 "[ . 1 . 2]" 1 1311 1 36 THR MG 1 40 ASN HB2 . . 3.960 3.966 3.587 4.060 0.100 8 0 "[ . 1 . 2]" 1 1312 1 36 THR MG 1 40 ASN HB3 . . 5.500 4.464 4.217 4.678 . 0 0 "[ . 1 . 2]" 1 1313 1 37 GLU H 1 37 GLU HB2 . . 2.800 2.801 2.676 2.856 0.056 17 0 "[ . 1 . 2]" 1 1314 1 37 GLU H 1 37 GLU HG2 . . 3.740 2.543 2.234 2.756 . 0 0 "[ . 1 . 2]" 1 1315 1 37 GLU H 1 37 GLU HG3 . . 3.440 1.967 1.781 2.113 . 0 0 "[ . 1 . 2]" 1 1316 1 37 GLU H 1 38 LEU H . . 3.450 2.933 2.854 2.999 . 0 0 "[ . 1 . 2]" 1 1317 1 37 GLU H 1 38 LEU MD1 . . 4.740 4.565 4.405 4.675 . 0 0 "[ . 1 . 2]" 1 1318 1 37 GLU H 1 38 LEU HG . . 4.360 4.344 4.220 4.416 0.056 3 0 "[ . 1 . 2]" 1 1319 1 37 GLU H 1 39 LEU H . . 4.280 4.010 3.906 4.164 . 0 0 "[ . 1 . 2]" 1 1320 1 37 GLU H 1 40 ASN H . . 4.660 4.671 4.571 4.716 0.056 20 0 "[ . 1 . 2]" 1 1321 1 37 GLU HA 1 37 GLU HB3 . . 2.730 2.369 2.319 2.417 . 0 0 "[ . 1 . 2]" 1 1322 1 37 GLU HA 1 37 GLU HG2 . . 3.020 2.670 2.565 2.784 . 0 0 "[ . 1 . 2]" 1 1323 1 37 GLU HA 1 38 LEU HA . . 4.760 4.614 4.572 4.658 . 0 0 "[ . 1 . 2]" 1 1324 1 37 GLU HA 1 38 LEU HG . . 5.330 5.378 5.174 5.404 0.074 7 0 "[ . 1 . 2]" 1 1325 1 37 GLU HA 1 39 LEU H . . 5.180 4.853 4.734 5.048 . 0 0 "[ . 1 . 2]" 1 1326 1 37 GLU HA 1 40 ASN H . . 5.500 4.424 4.241 4.665 . 0 0 "[ . 1 . 2]" 1 1327 1 37 GLU HA 1 40 ASN HB3 . . 4.380 3.948 3.666 4.297 . 0 0 "[ . 1 . 2]" 1 1328 1 37 GLU HA 1 41 LYS H . . 5.360 4.979 4.773 5.252 . 0 0 "[ . 1 . 2]" 1 1329 1 37 GLU HB2 1 37 GLU HG3 . . 2.400 2.328 2.238 2.403 0.003 10 0 "[ . 1 . 2]" 1 1330 1 37 GLU HB2 1 38 LEU H . . 3.460 2.310 2.213 2.371 . 0 0 "[ . 1 . 2]" 1 1331 1 37 GLU HB2 1 38 LEU HB3 . . 4.910 4.180 4.059 4.281 . 0 0 "[ . 1 . 2]" 1 1332 1 37 GLU HB2 1 38 LEU HG . . 4.280 3.261 2.962 3.439 . 0 0 "[ . 1 . 2]" 1 1333 1 37 GLU HB2 1 39 LEU H . . 4.550 4.594 4.371 4.618 0.068 3 0 "[ . 1 . 2]" 1 1334 1 37 GLU HG2 1 38 LEU H . . 5.490 4.582 4.456 4.646 . 0 0 "[ . 1 . 2]" 1 1335 1 37 GLU HG3 1 38 LEU H . . 4.990 3.759 3.662 3.880 . 0 0 "[ . 1 . 2]" 1 1336 1 37 GLU HG3 1 38 LEU MD1 . . 5.500 5.397 5.284 5.577 0.077 16 0 "[ . 1 . 2]" 1 1337 1 37 GLU HG3 1 38 LEU MD2 . . 5.500 5.567 5.456 5.589 0.089 9 0 "[ . 1 . 2]" 1 1338 1 37 GLU HG3 1 38 LEU HG . . 5.500 4.715 4.609 4.855 . 0 0 "[ . 1 . 2]" 1 1339 1 38 LEU H 1 38 LEU HB2 . . 3.590 3.634 3.557 3.655 0.065 4 0 "[ . 1 . 2]" 1 1340 1 38 LEU H 1 38 LEU HB3 . . 3.410 3.137 3.062 3.224 . 0 0 "[ . 1 . 2]" 1 1341 1 38 LEU H 1 38 LEU MD1 . . 3.390 2.814 2.649 2.978 . 0 0 "[ . 1 . 2]" 1 1342 1 38 LEU H 1 38 LEU MD2 . . 3.530 3.585 3.459 3.613 0.083 12 0 "[ . 1 . 2]" 1 1343 1 38 LEU H 1 38 LEU HG . . 3.430 1.887 1.724 1.939 . 0 0 "[ . 1 . 2]" 1 1344 1 38 LEU H 1 39 LEU H . . 3.260 2.352 2.241 2.464 . 0 0 "[ . 1 . 2]" 1 1345 1 38 LEU H 1 39 LEU HA . . 4.940 4.966 4.890 5.002 0.062 20 0 "[ . 1 . 2]" 1 1346 1 38 LEU H 1 39 LEU HB2 . . 4.830 4.559 4.343 4.714 . 0 0 "[ . 1 . 2]" 1 1347 1 38 LEU H 1 39 LEU HB3 . . 4.780 4.589 4.290 4.770 . 0 0 "[ . 1 . 2]" 1 1348 1 38 LEU H 1 40 ASN H . . 4.480 4.269 4.156 4.375 . 0 0 "[ . 1 . 2]" 1 1349 1 38 LEU H 1 40 ASN HB3 . . 5.500 5.498 5.261 5.637 0.137 2 0 "[ . 1 . 2]" 1 1350 1 38 LEU H 1 41 LYS H . . 5.050 4.944 4.823 5.075 0.025 1 0 "[ . 1 . 2]" 1 1351 1 38 LEU HA 1 38 LEU MD1 . . 3.790 3.737 3.629 3.810 0.020 14 0 "[ . 1 . 2]" 1 1352 1 38 LEU HA 1 38 LEU MD2 . . 4.260 4.038 3.979 4.114 . 0 0 "[ . 1 . 2]" 1 1353 1 38 LEU HA 1 38 LEU HG . . 4.000 3.571 3.525 3.618 . 0 0 "[ . 1 . 2]" 1 1354 1 38 LEU HA 1 40 ASN H . . 4.940 4.564 4.445 4.677 . 0 0 "[ . 1 . 2]" 1 1355 1 38 LEU HA 1 41 LYS H . . 3.690 3.451 3.305 3.622 . 0 0 "[ . 1 . 2]" 1 1356 1 38 LEU HA 1 41 LYS QB . . 3.530 2.575 2.352 2.816 . 0 0 "[ . 1 . 2]" 1 1357 1 38 LEU HA 1 41 LYS QD . . 4.410 3.967 3.789 4.165 . 0 0 "[ . 1 . 2]" 1 1358 1 38 LEU HA 1 41 LYS HE2 . . 3.990 1.900 1.798 2.069 . 0 0 "[ . 1 . 2]" 1 1359 1 38 LEU HA 1 42 TRP H . . 4.770 4.067 3.921 4.260 . 0 0 "[ . 1 . 2]" 1 1360 1 38 LEU HA 1 42 TRP HE1 . . 4.770 4.542 4.266 4.660 . 0 0 "[ . 1 . 2]" 1 1361 1 38 LEU HB2 1 38 LEU MD1 . . 3.050 2.240 2.138 2.294 . 0 0 "[ . 1 . 2]" 1 1362 1 38 LEU HB2 1 39 LEU H . . 3.600 3.626 3.532 3.662 0.062 7 0 "[ . 1 . 2]" 1 1363 1 38 LEU HB2 1 39 LEU HA . . 4.350 4.254 4.137 4.364 0.014 1 0 "[ . 1 . 2]" 1 1364 1 38 LEU HB2 1 39 LEU HB2 . . 5.320 5.293 5.109 5.378 0.058 12 0 "[ . 1 . 2]" 1 1365 1 38 LEU HB2 1 41 LYS H . . 5.220 5.194 5.053 5.289 0.069 16 0 "[ . 1 . 2]" 1 1366 1 38 LEU HB2 1 42 TRP HZ2 . . 3.630 3.352 3.077 3.438 . 0 0 "[ . 1 . 2]" 1 1367 1 38 LEU HB3 1 38 LEU MD2 . . 3.070 2.270 2.183 2.395 . 0 0 "[ . 1 . 2]" 1 1368 1 38 LEU HB3 1 39 LEU H . . 4.410 4.218 4.127 4.272 . 0 0 "[ . 1 . 2]" 1 1369 1 38 LEU HB3 1 41 LYS QB . . 5.240 4.556 4.314 4.851 . 0 0 "[ . 1 . 2]" 1 1370 1 38 LEU HB3 1 41 LYS HE2 . . 5.190 3.114 2.808 3.438 . 0 0 "[ . 1 . 2]" 1 1371 1 38 LEU HB3 1 41 LYS HE3 . . 5.040 3.574 3.375 3.879 . 0 0 "[ . 1 . 2]" 1 1372 1 38 LEU HB3 1 42 TRP HE1 . . 4.270 3.962 3.783 4.091 . 0 0 "[ . 1 . 2]" 1 1373 1 38 LEU HB3 1 42 TRP HZ2 . . 4.510 4.542 4.201 4.580 0.070 15 0 "[ . 1 . 2]" 1 1374 1 38 LEU MD1 1 39 LEU H . . 3.520 2.037 1.804 2.272 . 0 0 "[ . 1 . 2]" 1 1375 1 38 LEU MD1 1 39 LEU HB2 . . 3.260 2.709 2.454 2.895 . 0 0 "[ . 1 . 2]" 1 1376 1 38 LEU MD1 1 41 LYS H . . 5.210 5.205 4.964 5.287 0.077 14 0 "[ . 1 . 2]" 1 1377 1 38 LEU MD1 1 41 LYS QB . . 5.500 5.212 5.038 5.441 . 0 0 "[ . 1 . 2]" 1 1378 1 38 LEU MD1 1 42 TRP H . . 4.980 4.692 4.535 4.923 . 0 0 "[ . 1 . 2]" 1 1379 1 38 LEU MD1 1 42 TRP HD1 . . 5.120 4.750 4.600 4.988 . 0 0 "[ . 1 . 2]" 1 1380 1 38 LEU MD1 1 42 TRP HE1 . . 3.960 3.812 3.734 3.973 0.013 16 0 "[ . 1 . 2]" 1 1381 1 38 LEU MD1 1 42 TRP HE3 . . 4.370 3.631 3.439 4.027 . 0 0 "[ . 1 . 2]" 1 1382 1 38 LEU MD1 1 42 TRP HH2 . . 3.860 2.764 2.501 3.223 . 0 0 "[ . 1 . 2]" 1 1383 1 38 LEU MD1 1 42 TRP HZ2 . . 3.870 2.821 2.672 2.932 . 0 0 "[ . 1 . 2]" 1 1384 1 38 LEU MD2 1 39 LEU H . . 5.500 4.309 4.171 4.377 . 0 0 "[ . 1 . 2]" 1 1385 1 38 LEU MD2 1 41 LYS HE2 . . 5.500 4.748 4.467 5.052 . 0 0 "[ . 1 . 2]" 1 1386 1 38 LEU MD2 1 41 LYS HE3 . . 5.450 4.817 4.596 5.126 . 0 0 "[ . 1 . 2]" 1 1387 1 38 LEU MD2 1 42 TRP HE1 . . 4.040 3.747 3.627 4.022 . 0 0 "[ . 1 . 2]" 1 1388 1 38 LEU MD2 1 42 TRP HH2 . . 4.160 3.681 3.193 3.968 . 0 0 "[ . 1 . 2]" 1 1389 1 38 LEU MD2 1 42 TRP HZ2 . . 3.570 2.584 2.233 2.939 . 0 0 "[ . 1 . 2]" 1 1390 1 38 LEU MD2 1 42 TRP HZ3 . . 5.500 5.201 4.740 5.449 . 0 0 "[ . 1 . 2]" 1 1391 1 38 LEU HG 1 42 TRP HE1 . . 5.500 5.573 5.545 5.584 0.084 11 0 "[ . 1 . 2]" 1 1392 1 39 LEU H 1 39 LEU HB2 . . 3.080 2.399 2.127 2.531 . 0 0 "[ . 1 . 2]" 1 1393 1 39 LEU H 1 39 LEU HB3 . . 3.380 2.577 2.333 2.748 . 0 0 "[ . 1 . 2]" 1 1394 1 39 LEU H 1 39 LEU QD . . 4.420 3.752 3.687 3.835 . 0 0 "[ . 1 . 2]" 1 1395 1 39 LEU H 1 39 LEU HG . . 4.670 4.416 4.211 4.488 . 0 0 "[ . 1 . 2]" 1 1396 1 39 LEU H 1 40 ASN H . . 3.300 2.925 2.861 2.999 . 0 0 "[ . 1 . 2]" 1 1397 1 39 LEU H 1 40 ASN HA . . 5.480 5.514 5.411 5.537 0.057 16 0 "[ . 1 . 2]" 1 1398 1 39 LEU H 1 40 ASN HB2 . . 5.500 5.328 5.098 5.526 0.026 17 0 "[ . 1 . 2]" 1 1399 1 39 LEU H 1 40 ASN HB3 . . 5.500 5.033 4.835 5.273 . 0 0 "[ . 1 . 2]" 1 1400 1 39 LEU H 1 41 LYS H . . 4.310 4.214 4.098 4.334 0.024 1 0 "[ . 1 . 2]" 1 1401 1 39 LEU H 1 42 TRP HE3 . . 5.190 4.988 4.676 5.266 0.076 20 0 "[ . 1 . 2]" 1 1402 1 39 LEU HA 1 39 LEU MD1 . . 3.960 2.839 2.453 3.396 . 0 0 "[ . 1 . 2]" 1 1403 1 39 LEU HA 1 39 LEU QD . . 3.050 2.752 2.429 3.144 0.094 9 0 "[ . 1 . 2]" 1 1404 1 39 LEU HA 1 39 LEU MD2 . . 3.960 3.854 3.580 3.938 . 0 0 "[ . 1 . 2]" 1 1405 1 39 LEU HA 1 39 LEU HG . . 4.100 2.627 2.387 2.734 . 0 0 "[ . 1 . 2]" 1 1406 1 39 LEU HA 1 41 LYS H . . 4.460 4.261 4.158 4.409 . 0 0 "[ . 1 . 2]" 1 1407 1 39 LEU HA 1 41 LYS HE2 . . 5.500 5.570 5.495 5.584 0.084 3 0 "[ . 1 . 2]" 1 1408 1 39 LEU HA 1 42 TRP H . . 4.070 3.167 2.978 3.330 . 0 0 "[ . 1 . 2]" 1 1409 1 39 LEU HA 1 42 TRP HB2 . . 4.330 2.397 2.277 2.593 . 0 0 "[ . 1 . 2]" 1 1410 1 39 LEU HA 1 42 TRP HB3 . . 4.300 3.856 3.699 4.023 . 0 0 "[ . 1 . 2]" 1 1411 1 39 LEU HA 1 42 TRP HE3 . . 4.180 2.666 2.362 3.109 . 0 0 "[ . 1 . 2]" 1 1412 1 39 LEU HA 1 43 LYS H . . 4.580 4.073 3.978 4.233 . 0 0 "[ . 1 . 2]" 1 1413 1 39 LEU HA 1 43 LYS HG2 . . 5.500 5.123 4.893 5.302 . 0 0 "[ . 1 . 2]" 1 1414 1 39 LEU HA 1 99 ILE MD . . 3.800 3.757 3.561 3.899 0.099 3 0 "[ . 1 . 2]" 1 1415 1 39 LEU HA 1 99 ILE HG13 . . 5.500 5.049 4.774 5.242 . 0 0 "[ . 1 . 2]" 1 1416 1 39 LEU HA 1 99 ILE MG . . 5.210 5.005 4.782 5.227 0.017 15 0 "[ . 1 . 2]" 1 1417 1 39 LEU HB2 1 39 LEU QD . . 3.080 2.203 2.071 2.253 . 0 0 "[ . 1 . 2]" 1 1418 1 39 LEU HB2 1 40 ASN H . . 4.000 3.783 3.575 3.968 . 0 0 "[ . 1 . 2]" 1 1419 1 39 LEU HB2 1 42 TRP HE3 . . 4.920 3.997 3.467 4.826 . 0 0 "[ . 1 . 2]" 1 1420 1 39 LEU HB2 1 99 ILE MD . . 5.500 4.873 4.560 5.130 . 0 0 "[ . 1 . 2]" 1 1421 1 39 LEU HB3 1 40 ASN H . . 3.340 2.425 2.276 2.615 . 0 0 "[ . 1 . 2]" 1 1422 1 39 LEU HB3 1 40 ASN HB2 . . 4.460 4.294 4.015 4.516 0.056 9 0 "[ . 1 . 2]" 1 1423 1 39 LEU HB3 1 41 LYS H . . 4.840 4.873 4.785 4.901 0.061 5 0 "[ . 1 . 2]" 1 1424 1 39 LEU HB3 1 43 LYS QE . . 5.500 5.277 4.833 5.554 0.054 10 0 "[ . 1 . 2]" 1 1425 1 39 LEU QD 1 40 ASN H . . 3.750 3.347 2.921 3.699 . 0 0 "[ . 1 . 2]" 1 1426 1 39 LEU QD 1 41 LYS H . . 5.440 5.118 4.773 5.323 . 0 0 "[ . 1 . 2]" 1 1427 1 39 LEU QD 1 42 TRP H . . 5.310 4.876 4.764 5.065 . 0 0 "[ . 1 . 2]" 1 1428 1 39 LEU QD 1 42 TRP HB2 . . 5.440 3.751 3.476 4.234 . 0 0 "[ . 1 . 2]" 1 1429 1 39 LEU QD 1 42 TRP HE3 . . 3.650 2.462 2.104 3.690 0.040 20 0 "[ . 1 . 2]" 1 1430 1 39 LEU QD 1 42 TRP HZ3 . . 5.440 3.090 2.778 3.999 . 0 0 "[ . 1 . 2]" 1 1431 1 39 LEU QD 1 43 LYS H . . 5.240 4.432 4.369 4.554 . 0 0 "[ . 1 . 2]" 1 1432 1 39 LEU QD 1 43 LYS HB2 . . 5.440 5.530 5.490 5.554 0.114 4 0 "[ . 1 . 2]" 1 1433 1 39 LEU QD 1 43 LYS HB3 . . 5.440 4.543 4.366 4.696 . 0 0 "[ . 1 . 2]" 1 1434 1 39 LEU QD 1 43 LYS HD2 . . 3.980 2.979 2.827 3.178 . 0 0 "[ . 1 . 2]" 1 1435 1 39 LEU QD 1 43 LYS HD3 . . 4.190 2.797 2.390 3.419 . 0 0 "[ . 1 . 2]" 1 1436 1 39 LEU QD 1 43 LYS QE . . 3.250 2.645 2.175 2.993 . 0 0 "[ . 1 . 2]" 1 1437 1 39 LEU QD 1 43 LYS HG3 . . 5.440 4.756 4.518 5.154 . 0 0 "[ . 1 . 2]" 1 1438 1 39 LEU QD 1 99 ILE HA . . 5.440 5.117 4.750 5.524 0.084 5 0 "[ . 1 . 2]" 1 1439 1 39 LEU MD1 1 40 ASN H . . 4.730 4.796 4.620 4.828 0.098 3 0 "[ . 1 . 2]" 1 1440 1 39 LEU MD1 1 43 LYS HD2 . . 5.500 3.666 3.381 4.402 . 0 0 "[ . 1 . 2]" 1 1441 1 39 LEU MD1 1 43 LYS QE . . 3.970 3.911 3.540 4.064 0.094 18 0 "[ . 1 . 2]" 1 1442 1 39 LEU MD1 1 99 ILE MD . . 5.500 2.734 2.331 3.446 . 0 0 "[ . 1 . 2]" 1 1443 1 39 LEU MD2 1 40 ASN H . . 4.730 3.424 2.948 3.845 . 0 0 "[ . 1 . 2]" 1 1444 1 39 LEU MD2 1 43 LYS HD2 . . 5.500 3.181 2.881 3.493 . 0 0 "[ . 1 . 2]" 1 1445 1 39 LEU MD2 1 43 LYS QE . . 3.970 2.695 2.184 3.089 . 0 0 "[ . 1 . 2]" 1 1446 1 39 LEU MD2 1 99 ILE MD . . 5.500 4.349 4.090 4.693 . 0 0 "[ . 1 . 2]" 1 1447 1 39 LEU HG 1 40 ASN H . . 5.490 3.979 3.728 4.315 . 0 0 "[ . 1 . 2]" 1 1448 1 39 LEU HG 1 42 TRP HZ3 . . 5.310 5.335 5.051 5.457 0.147 2 0 "[ . 1 . 2]" 1 1449 1 39 LEU HG 1 43 LYS H . . 4.560 4.109 3.980 4.619 0.059 20 0 "[ . 1 . 2]" 1 1450 1 39 LEU HG 1 43 LYS HD2 . . 5.230 2.567 2.393 3.108 . 0 0 "[ . 1 . 2]" 1 1451 1 39 LEU HG 1 43 LYS QE . . 3.620 3.579 3.000 3.690 0.070 20 0 "[ . 1 . 2]" 1 1452 1 39 LEU HG 1 99 ILE MD . . 4.120 3.535 3.323 3.745 . 0 0 "[ . 1 . 2]" 1 1453 1 40 ASN H 1 40 ASN HB2 . . 3.100 2.516 2.379 2.689 . 0 0 "[ . 1 . 2]" 1 1454 1 40 ASN H 1 40 ASN HB3 . . 3.400 2.513 2.352 2.698 . 0 0 "[ . 1 . 2]" 1 1455 1 40 ASN H 1 41 LYS H . . 3.210 2.767 2.674 2.876 . 0 0 "[ . 1 . 2]" 1 1456 1 40 ASN H 1 42 TRP H . . 4.190 4.140 4.022 4.242 0.052 15 0 "[ . 1 . 2]" 1 1457 1 40 ASN H 1 42 TRP HB2 . . 5.360 5.027 4.873 5.133 . 0 0 "[ . 1 . 2]" 1 1458 1 40 ASN H 1 43 LYS HD3 . . 4.370 4.240 3.759 4.421 0.051 10 0 "[ . 1 . 2]" 1 1459 1 40 ASN H 1 43 LYS HG2 . . 5.500 4.958 4.791 5.152 . 0 0 "[ . 1 . 2]" 1 1460 1 40 ASN HA 1 40 ASN HB2 . . 2.810 2.495 2.455 2.542 . 0 0 "[ . 1 . 2]" 1 1461 1 40 ASN HA 1 41 LYS HA . . 5.500 4.791 4.703 4.845 . 0 0 "[ . 1 . 2]" 1 1462 1 40 ASN HA 1 42 TRP H . . 4.460 4.506 4.293 4.534 0.074 20 0 "[ . 1 . 2]" 1 1463 1 40 ASN HA 1 43 LYS H . . 4.260 3.971 3.831 4.201 . 0 0 "[ . 1 . 2]" 1 1464 1 40 ASN HA 1 43 LYS HB2 . . 5.500 5.431 5.207 5.567 0.067 1 0 "[ . 1 . 2]" 1 1465 1 40 ASN HA 1 43 LYS HB3 . . 5.500 5.267 4.998 5.497 . 0 0 "[ . 1 . 2]" 1 1466 1 40 ASN HA 1 43 LYS HD3 . . 3.080 2.303 2.058 2.659 . 0 0 "[ . 1 . 2]" 1 1467 1 40 ASN HA 1 43 LYS QE . . 4.100 4.029 3.220 4.189 0.089 15 0 "[ . 1 . 2]" 1 1468 1 40 ASN HA 1 43 LYS HG3 . . 5.500 3.514 3.268 3.654 . 0 0 "[ . 1 . 2]" 1 1469 1 40 ASN HA 1 44 GLN H . . 5.060 4.437 4.253 4.649 . 0 0 "[ . 1 . 2]" 1 1470 1 40 ASN HB2 1 43 LYS HD3 . . 4.820 4.436 4.136 4.781 . 0 0 "[ . 1 . 2]" 1 1471 1 40 ASN HB3 1 41 LYS H . . 3.190 2.653 2.438 2.777 . 0 0 "[ . 1 . 2]" 1 1472 1 40 ASN HB3 1 41 LYS HA . . 5.500 4.417 4.234 4.597 . 0 0 "[ . 1 . 2]" 1 1473 1 40 ASN HB3 1 41 LYS QB . . 4.130 3.941 3.775 4.078 . 0 0 "[ . 1 . 2]" 1 1474 1 40 ASN HB3 1 42 TRP H . . 5.040 5.019 4.860 5.097 0.057 15 0 "[ . 1 . 2]" 1 1475 1 41 LYS H 1 41 LYS QB . . 2.860 2.028 2.000 2.079 . 0 0 "[ . 1 . 2]" 1 1476 1 41 LYS H 1 41 LYS QD . . 4.860 4.633 4.489 4.704 . 0 0 "[ . 1 . 2]" 1 1477 1 41 LYS H 1 41 LYS HE2 . . 4.220 3.847 3.535 4.066 . 0 0 "[ . 1 . 2]" 1 1478 1 41 LYS H 1 41 LYS HG2 . . 4.040 3.939 3.663 4.026 . 0 0 "[ . 1 . 2]" 1 1479 1 41 LYS H 1 41 LYS HG3 . . 4.570 4.513 4.440 4.560 . 0 0 "[ . 1 . 2]" 1 1480 1 41 LYS H 1 42 TRP H . . 3.060 2.555 2.413 2.672 . 0 0 "[ . 1 . 2]" 1 1481 1 41 LYS H 1 42 TRP HA . . 5.110 5.156 5.021 5.182 0.072 12 0 "[ . 1 . 2]" 1 1482 1 41 LYS H 1 42 TRP HB2 . . 4.760 4.636 4.448 4.803 0.043 11 0 "[ . 1 . 2]" 1 1483 1 41 LYS H 1 43 LYS H . . 4.970 4.524 4.452 4.596 . 0 0 "[ . 1 . 2]" 1 1484 1 41 LYS H 1 43 LYS HG2 . . 5.500 4.688 4.583 4.843 . 0 0 "[ . 1 . 2]" 1 1485 1 41 LYS H 1 44 GLN H . . 5.160 4.869 4.771 4.953 . 0 0 "[ . 1 . 2]" 1 1486 1 41 LYS H 1 44 GLN HB2 . . 5.420 5.335 5.121 5.470 0.050 20 0 "[ . 1 . 2]" 1 1487 1 41 LYS HA 1 41 LYS QD . . 4.230 4.186 4.102 4.248 0.018 8 0 "[ . 1 . 2]" 1 1488 1 41 LYS HA 1 41 LYS HE2 . . 5.220 4.870 4.665 5.075 . 0 0 "[ . 1 . 2]" 1 1489 1 41 LYS HA 1 41 LYS HG2 . . 3.750 3.621 3.551 3.723 . 0 0 "[ . 1 . 2]" 1 1490 1 41 LYS HA 1 41 LYS HG3 . . 3.760 3.051 2.929 3.149 . 0 0 "[ . 1 . 2]" 1 1491 1 41 LYS HA 1 42 TRP HD1 . . 5.500 5.436 5.265 5.558 0.058 2 0 "[ . 1 . 2]" 1 1492 1 41 LYS HA 1 43 LYS H . . 4.810 4.757 4.670 4.821 0.011 9 0 "[ . 1 . 2]" 1 1493 1 41 LYS HA 1 44 GLN H . . 3.590 3.526 3.378 3.642 0.052 8 0 "[ . 1 . 2]" 1 1494 1 41 LYS HA 1 44 GLN HB2 . . 3.460 3.347 3.082 3.518 0.058 6 0 "[ . 1 . 2]" 1 1495 1 41 LYS HA 1 44 GLN HB3 . . 4.100 2.615 2.320 3.157 . 0 0 "[ . 1 . 2]" 1 1496 1 41 LYS HA 1 45 HIS H . . 4.130 3.953 3.754 4.080 . 0 0 "[ . 1 . 2]" 1 1497 1 41 LYS HA 1 45 HIS HD2 . . 4.950 3.001 2.440 3.988 . 0 0 "[ . 1 . 2]" 1 1498 1 41 LYS QB 1 41 LYS HE2 . . 3.310 2.108 1.953 2.543 . 0 0 "[ . 1 . 2]" 1 1499 1 41 LYS QB 1 42 TRP HA . . 5.500 4.623 4.565 4.737 . 0 0 "[ . 1 . 2]" 1 1500 1 41 LYS QB 1 42 TRP HD1 . . 4.530 4.058 3.859 4.352 . 0 0 "[ . 1 . 2]" 1 1501 1 41 LYS QB 1 42 TRP HE1 . . 5.500 5.256 5.034 5.504 0.004 2 0 "[ . 1 . 2]" 1 1502 1 41 LYS QB 1 45 HIS HD2 . . 3.700 3.436 2.929 3.772 0.072 18 0 "[ . 1 . 2]" 1 1503 1 41 LYS QD 1 42 TRP HD1 . . 4.150 4.191 4.022 4.225 0.075 17 0 "[ . 1 . 2]" 1 1504 1 41 LYS QD 1 42 TRP HE1 . . 5.230 4.957 4.756 5.085 . 0 0 "[ . 1 . 2]" 1 1505 1 41 LYS QD 1 45 HIS HD2 . . 4.000 3.793 3.120 4.058 0.058 9 0 "[ . 1 . 2]" 1 1506 1 41 LYS HE2 1 41 LYS HG2 . . 3.560 2.448 2.148 2.673 . 0 0 "[ . 1 . 2]" 1 1507 1 41 LYS HE2 1 42 TRP H . . 4.040 3.864 3.626 4.067 0.027 5 0 "[ . 1 . 2]" 1 1508 1 41 LYS HE2 1 42 TRP HD1 . . 5.500 3.535 3.112 3.852 . 0 0 "[ . 1 . 2]" 1 1509 1 41 LYS HE3 1 42 TRP HD1 . . 5.480 3.683 2.980 4.224 . 0 0 "[ . 1 . 2]" 1 1510 1 41 LYS HE3 1 49 LEU QD . . 5.410 5.043 4.636 5.385 . 0 0 "[ . 1 . 2]" 1 1511 1 41 LYS HG2 1 42 TRP H . . 4.430 3.017 2.849 3.124 . 0 0 "[ . 1 . 2]" 1 1512 1 41 LYS HG2 1 42 TRP HB2 . . 5.500 5.016 4.681 5.166 . 0 0 "[ . 1 . 2]" 1 1513 1 41 LYS HG2 1 45 HIS H . . 4.940 4.729 4.556 4.992 0.052 5 0 "[ . 1 . 2]" 1 1514 1 41 LYS HG2 1 45 HIS HD2 . . 3.880 3.724 3.542 3.929 0.049 19 0 "[ . 1 . 2]" 1 1515 1 41 LYS HG3 1 42 TRP H . . 4.220 4.189 3.947 4.276 0.056 16 0 "[ . 1 . 2]" 1 1516 1 41 LYS HG3 1 42 TRP HD1 . . 4.280 4.097 3.783 4.320 0.040 16 0 "[ . 1 . 2]" 1 1517 1 41 LYS HG3 1 45 HIS H . . 4.290 4.317 3.943 4.362 0.072 7 0 "[ . 1 . 2]" 1 1518 1 41 LYS HG3 1 45 HIS HD2 . . 3.850 2.201 1.963 2.424 . 0 0 "[ . 1 . 2]" 1 1519 1 42 TRP H 1 42 TRP HB2 . . 3.800 2.445 2.316 2.534 . 0 0 "[ . 1 . 2]" 1 1520 1 42 TRP H 1 42 TRP HB3 . . 3.880 3.556 3.507 3.605 . 0 0 "[ . 1 . 2]" 1 1521 1 42 TRP H 1 42 TRP HD1 . . 3.320 2.942 2.791 3.254 . 0 0 "[ . 1 . 2]" 1 1522 1 42 TRP H 1 42 TRP HE1 . . 5.120 4.813 4.638 5.085 . 0 0 "[ . 1 . 2]" 1 1523 1 42 TRP H 1 43 LYS H . . 3.630 2.967 2.883 3.010 . 0 0 "[ . 1 . 2]" 1 1524 1 42 TRP H 1 44 GLN H . . 4.310 4.153 3.829 4.278 . 0 0 "[ . 1 . 2]" 1 1525 1 42 TRP H 1 45 HIS H . . 4.780 4.718 4.596 4.840 0.060 15 0 "[ . 1 . 2]" 1 1526 1 42 TRP H 1 99 ILE MG . . 4.530 4.530 4.419 4.596 0.066 8 0 "[ . 1 . 2]" 1 1527 1 42 TRP HA 1 42 TRP HD1 . . 3.210 2.155 2.040 2.220 . 0 0 "[ . 1 . 2]" 1 1528 1 42 TRP HA 1 42 TRP HE1 . . 4.880 4.538 4.406 4.634 . 0 0 "[ . 1 . 2]" 1 1529 1 42 TRP HA 1 43 LYS HG2 . . 5.500 5.345 5.154 5.421 . 0 0 "[ . 1 . 2]" 1 1530 1 42 TRP HA 1 44 GLN H . . 4.770 4.482 4.239 4.593 . 0 0 "[ . 1 . 2]" 1 1531 1 42 TRP HA 1 45 HIS H . . 4.020 3.616 3.507 3.772 . 0 0 "[ . 1 . 2]" 1 1532 1 42 TRP HA 1 46 LYS H . . 4.960 4.818 4.653 4.993 0.033 15 0 "[ . 1 . 2]" 1 1533 1 42 TRP HA 1 46 LYS HA . . 4.580 4.338 4.181 4.504 . 0 0 "[ . 1 . 2]" 1 1534 1 42 TRP HA 1 49 LEU QD . . 5.440 3.435 2.860 4.068 . 0 0 "[ . 1 . 2]" 1 1535 1 42 TRP HA 1 99 ILE MD . . 4.720 4.678 4.345 4.793 0.073 12 0 "[ . 1 . 2]" 1 1536 1 42 TRP HA 1 99 ILE HG13 . . 5.500 4.564 4.143 4.746 . 0 0 "[ . 1 . 2]" 1 1537 1 42 TRP HB2 1 43 LYS H . . 3.650 2.378 2.266 2.472 . 0 0 "[ . 1 . 2]" 1 1538 1 42 TRP HB2 1 44 GLN H . . 5.280 4.810 4.619 4.982 . 0 0 "[ . 1 . 2]" 1 1539 1 42 TRP HB2 1 99 ILE MD . . 3.600 2.764 2.577 2.921 . 0 0 "[ . 1 . 2]" 1 1540 1 42 TRP HB2 1 99 ILE MG . . 5.500 3.084 2.894 3.188 . 0 0 "[ . 1 . 2]" 1 1541 1 42 TRP HB3 1 43 LYS H . . 3.700 3.245 3.080 3.361 . 0 0 "[ . 1 . 2]" 1 1542 1 42 TRP HB3 1 44 GLN H . . 5.500 5.389 5.105 5.536 0.036 4 0 "[ . 1 . 2]" 1 1543 1 42 TRP HB3 1 45 HIS H . . 5.500 5.480 5.329 5.560 0.060 12 0 "[ . 1 . 2]" 1 1544 1 42 TRP HB3 1 99 ILE H . . 5.500 5.560 5.303 5.584 0.084 19 0 "[ . 1 . 2]" 1 1545 1 42 TRP HB3 1 99 ILE MD . . 3.680 2.523 2.116 2.688 . 0 0 "[ . 1 . 2]" 1 1546 1 42 TRP HB3 1 99 ILE MG . . 4.160 1.908 1.838 1.962 . 0 0 "[ . 1 . 2]" 1 1547 1 42 TRP HD1 1 43 LYS H . . 5.200 5.063 4.967 5.134 . 0 0 "[ . 1 . 2]" 1 1548 1 42 TRP HD1 1 45 HIS H . . 5.390 5.396 5.301 5.456 0.066 8 0 "[ . 1 . 2]" 1 1549 1 42 TRP HD1 1 49 LEU MD1 . . 5.120 3.974 2.962 5.116 . 0 0 "[ . 1 . 2]" 1 1550 1 42 TRP HD1 1 49 LEU QD . . 3.870 3.534 2.930 3.981 0.111 18 0 "[ . 1 . 2]" 1 1551 1 42 TRP HD1 1 49 LEU MD2 . . 5.120 4.508 4.129 5.122 0.002 3 0 "[ . 1 . 2]" 1 1552 1 42 TRP HD1 1 99 ILE HG13 . . 5.200 5.117 4.679 5.255 0.055 20 0 "[ . 1 . 2]" 1 1553 1 42 TRP HD1 1 99 ILE MG . . 4.320 4.279 4.119 4.361 0.041 3 0 "[ . 1 . 2]" 1 1554 1 42 TRP HE1 1 99 ILE MG . . 5.500 5.618 5.605 5.724 0.224 2 0 "[ . 1 . 2]" 1 1555 1 42 TRP HE3 1 43 LYS H . . 5.500 4.940 4.802 5.115 . 0 0 "[ . 1 . 2]" 1 1556 1 42 TRP HE3 1 99 ILE HA . . 5.500 5.352 5.064 5.540 0.040 15 0 "[ . 1 . 2]" 1 1557 1 42 TRP HZ3 1 99 ILE MD . . 5.430 3.419 3.143 3.633 . 0 0 "[ . 1 . 2]" 1 1558 1 43 LYS H 1 43 LYS HB2 . . 3.930 3.596 3.536 3.634 . 0 0 "[ . 1 . 2]" 1 1559 1 43 LYS H 1 43 LYS HD2 . . 4.000 2.811 2.557 3.034 . 0 0 "[ . 1 . 2]" 1 1560 1 43 LYS H 1 43 LYS HD3 . . 4.320 3.495 2.989 3.876 . 0 0 "[ . 1 . 2]" 1 1561 1 43 LYS H 1 43 LYS QE . . 4.590 4.448 4.182 4.665 0.075 12 0 "[ . 1 . 2]" 1 1562 1 43 LYS H 1 43 LYS HG2 . . 3.640 1.960 1.852 2.037 . 0 0 "[ . 1 . 2]" 1 1563 1 43 LYS H 1 43 LYS HG3 . . 3.880 3.493 3.393 3.560 . 0 0 "[ . 1 . 2]" 1 1564 1 43 LYS H 1 44 GLN H . . 3.550 2.689 2.622 2.757 . 0 0 "[ . 1 . 2]" 1 1565 1 43 LYS H 1 44 GLN HA . . 5.500 5.284 5.216 5.365 . 0 0 "[ . 1 . 2]" 1 1566 1 43 LYS H 1 44 GLN HB2 . . 4.740 4.785 4.681 4.903 0.163 2 0 "[ . 1 . 2]" 1 1567 1 43 LYS H 1 45 HIS H . . 4.340 4.279 4.179 4.397 0.057 16 0 "[ . 1 . 2]" 1 1568 1 43 LYS H 1 46 LYS H . . 5.300 5.256 5.084 5.369 0.069 11 0 "[ . 1 . 2]" 1 1569 1 43 LYS H 1 46 LYS QB . . 4.960 4.755 4.601 5.029 0.069 3 0 "[ . 1 . 2]" 1 1570 1 43 LYS H 1 99 ILE MD . . 4.060 3.568 3.315 3.762 . 0 0 "[ . 1 . 2]" 1 1571 1 43 LYS H 1 99 ILE MG . . 3.590 3.242 3.050 3.376 . 0 0 "[ . 1 . 2]" 1 1572 1 43 LYS HA 1 43 LYS HD2 . . 4.850 4.184 3.931 4.459 . 0 0 "[ . 1 . 2]" 1 1573 1 43 LYS HA 1 43 LYS HD3 . . 5.500 5.284 5.039 5.465 . 0 0 "[ . 1 . 2]" 1 1574 1 43 LYS HA 1 43 LYS HG2 . . 3.760 3.648 3.543 3.675 . 0 0 "[ . 1 . 2]" 1 1575 1 43 LYS HA 1 45 HIS H . . 4.730 4.350 4.120 4.611 . 0 0 "[ . 1 . 2]" 1 1576 1 43 LYS HA 1 46 LYS H . . 5.500 3.664 3.357 3.898 . 0 0 "[ . 1 . 2]" 1 1577 1 43 LYS HA 1 46 LYS QB . . 3.640 2.416 2.217 2.670 . 0 0 "[ . 1 . 2]" 1 1578 1 43 LYS HA 1 46 LYS QG . . 4.560 4.020 3.824 4.328 . 0 0 "[ . 1 . 2]" 1 1579 1 43 LYS HA 1 99 ILE HA . . 4.430 3.958 3.569 4.255 . 0 0 "[ . 1 . 2]" 1 1580 1 43 LYS HA 1 99 ILE MD . . 4.320 3.803 3.601 4.010 . 0 0 "[ . 1 . 2]" 1 1581 1 43 LYS HA 1 99 ILE MG . . 3.170 2.375 2.031 2.503 . 0 0 "[ . 1 . 2]" 1 1582 1 43 LYS HB2 1 43 LYS QE . . 4.280 3.345 2.807 3.805 . 0 0 "[ . 1 . 2]" 1 1583 1 43 LYS HB2 1 44 GLN H . . 3.590 3.641 3.589 3.705 0.115 2 0 "[ . 1 . 2]" 1 1584 1 43 LYS HB2 1 44 GLN HA . . 4.230 4.295 4.272 4.305 0.075 2 0 "[ . 1 . 2]" 1 1585 1 43 LYS HB3 1 43 LYS QE . . 4.450 2.973 2.256 3.428 . 0 0 "[ . 1 . 2]" 1 1586 1 43 LYS HB3 1 99 ILE MD . . 3.490 3.456 3.180 3.574 0.084 2 0 "[ . 1 . 2]" 1 1587 1 43 LYS HD2 1 44 GLN H . . 4.980 4.781 4.588 5.021 0.041 12 0 "[ . 1 . 2]" 1 1588 1 43 LYS HD2 1 99 ILE MD . . 3.820 3.445 3.217 3.743 . 0 0 "[ . 1 . 2]" 1 1589 1 43 LYS HD3 1 44 GLN H . . 5.350 4.732 4.386 4.976 . 0 0 "[ . 1 . 2]" 1 1590 1 43 LYS HD3 1 99 ILE MD . . 5.500 4.879 4.597 5.242 . 0 0 "[ . 1 . 2]" 1 1591 1 43 LYS QE 1 43 LYS HG2 . . 3.490 3.477 3.381 3.557 0.067 9 0 "[ . 1 . 2]" 1 1592 1 43 LYS QE 1 44 GLN H . . 5.500 5.452 5.317 5.564 0.064 12 0 "[ . 1 . 2]" 1 1593 1 43 LYS HG2 1 44 GLN H . . 4.590 2.430 2.207 2.655 . 0 0 "[ . 1 . 2]" 1 1594 1 43 LYS HG2 1 45 HIS H . . 5.500 4.960 4.708 5.212 . 0 0 "[ . 1 . 2]" 1 1595 1 43 LYS HG2 1 99 ILE MD . . 5.500 4.802 4.624 4.958 . 0 0 "[ . 1 . 2]" 1 1596 1 43 LYS HG2 1 99 ILE MG . . 5.280 4.695 4.446 4.788 . 0 0 "[ . 1 . 2]" 1 1597 1 43 LYS HG3 1 44 GLN H . . 3.470 3.382 3.133 3.536 0.066 3 0 "[ . 1 . 2]" 1 1598 1 43 LYS HG3 1 99 ILE MD . . 5.500 5.563 5.374 5.598 0.098 1 0 "[ . 1 . 2]" 1 1599 1 43 LYS HG3 1 99 ILE MG . . 5.500 5.530 5.315 5.597 0.097 5 0 "[ . 1 . 2]" 1 1600 1 44 GLN H 1 44 GLN HB2 . . 2.850 2.304 2.181 2.527 . 0 0 "[ . 1 . 2]" 1 1601 1 44 GLN H 1 44 GLN HB3 . . 3.010 2.654 2.412 2.964 . 0 0 "[ . 1 . 2]" 1 1602 1 44 GLN H 1 44 GLN HG2 . . 5.500 4.520 4.257 4.627 . 0 0 "[ . 1 . 2]" 1 1603 1 44 GLN H 1 44 GLN HG3 . . 5.500 4.365 4.132 4.546 . 0 0 "[ . 1 . 2]" 1 1604 1 44 GLN H 1 45 HIS H . . 3.220 2.718 2.576 2.788 . 0 0 "[ . 1 . 2]" 1 1605 1 44 GLN H 1 45 HIS HA . . 5.310 5.347 5.196 5.381 0.071 14 0 "[ . 1 . 2]" 1 1606 1 44 GLN H 1 45 HIS HB2 . . 5.080 5.013 4.867 5.142 0.062 15 0 "[ . 1 . 2]" 1 1607 1 44 GLN H 1 46 LYS H . . 4.510 4.222 3.944 4.374 . 0 0 "[ . 1 . 2]" 1 1608 1 44 GLN H 1 99 ILE MG . . 4.870 4.686 4.290 4.836 . 0 0 "[ . 1 . 2]" 1 1609 1 44 GLN HA 1 44 GLN QG . . 3.140 2.430 2.147 2.870 . 0 0 "[ . 1 . 2]" 1 1610 1 44 GLN HA 1 45 HIS H . . 3.570 3.573 3.537 3.622 0.052 12 0 "[ . 1 . 2]" 1 1611 1 44 GLN HA 1 45 HIS HA . . 4.570 4.624 4.566 4.638 0.068 11 0 "[ . 1 . 2]" 1 1612 1 44 GLN HA 1 46 LYS H . . 4.290 4.032 3.851 4.188 . 0 0 "[ . 1 . 2]" 1 1613 1 44 GLN HB2 1 45 HIS H . . 3.890 3.878 3.752 3.953 0.063 17 0 "[ . 1 . 2]" 1 1614 1 44 GLN HB3 1 45 HIS H . . 3.300 2.794 2.517 3.194 . 0 0 "[ . 1 . 2]" 1 1615 1 44 GLN HB3 1 45 HIS HD2 . . 4.060 3.068 2.485 4.117 0.057 18 0 "[ . 1 . 2]" 1 1616 1 45 HIS H 1 45 HIS HB2 . . 3.390 2.504 2.407 2.664 . 0 0 "[ . 1 . 2]" 1 1617 1 45 HIS H 1 45 HIS HB3 . . 3.760 3.681 3.626 3.775 0.015 15 0 "[ . 1 . 2]" 1 1618 1 45 HIS H 1 45 HIS HD2 . . 4.180 3.387 2.909 4.205 0.025 18 0 "[ . 1 . 2]" 1 1619 1 45 HIS H 1 46 LYS H . . 3.160 2.685 2.547 2.839 . 0 0 "[ . 1 . 2]" 1 1620 1 45 HIS H 1 46 LYS HA . . 4.720 4.449 4.312 4.612 . 0 0 "[ . 1 . 2]" 1 1621 1 45 HIS H 1 47 GLN H . . 5.300 5.332 5.168 5.427 0.127 2 0 "[ . 1 . 2]" 1 1622 1 45 HIS HA 1 46 LYS H . . 3.230 2.901 2.801 3.000 . 0 0 "[ . 1 . 2]" 1 1623 1 45 HIS HA 1 47 GLN H . . 4.070 3.834 3.725 3.983 . 0 0 "[ . 1 . 2]" 1 1624 1 45 HIS HA 1 47 GLN HB3 . . 5.110 4.692 4.320 5.039 . 0 0 "[ . 1 . 2]" 1 1625 1 45 HIS HA 1 48 GLU H . . 3.820 3.321 3.160 3.531 . 0 0 "[ . 1 . 2]" 1 1626 1 45 HIS HA 1 48 GLU HB2 . . 5.500 3.912 3.576 4.275 . 0 0 "[ . 1 . 2]" 1 1627 1 45 HIS HA 1 48 GLU HB3 . . 5.500 5.126 4.780 5.388 . 0 0 "[ . 1 . 2]" 1 1628 1 45 HIS HA 1 49 LEU H . . 5.310 5.056 4.888 5.328 0.018 15 0 "[ . 1 . 2]" 1 1629 1 45 HIS HB2 1 46 LYS H . . 4.430 4.147 4.039 4.255 . 0 0 "[ . 1 . 2]" 1 1630 1 45 HIS HB2 1 48 GLU H . . 5.170 4.956 4.807 5.173 0.003 5 0 "[ . 1 . 2]" 1 1631 1 45 HIS HB2 1 49 LEU QD . . 5.440 3.396 3.139 3.592 . 0 0 "[ . 1 . 2]" 1 1632 1 45 HIS HB2 1 49 LEU HG . . 5.500 5.459 4.969 5.573 0.073 15 0 "[ . 1 . 2]" 1 1633 1 45 HIS HB3 1 46 LYS H . . 4.490 4.484 4.429 4.529 0.039 15 0 "[ . 1 . 2]" 1 1634 1 45 HIS HB3 1 47 GLN H . . 5.500 5.407 5.282 5.552 0.052 7 0 "[ . 1 . 2]" 1 1635 1 45 HIS HB3 1 48 GLU H . . 3.930 3.780 3.585 3.974 0.044 4 0 "[ . 1 . 2]" 1 1636 1 45 HIS HB3 1 49 LEU QD . . 4.500 3.453 3.055 3.921 . 0 0 "[ . 1 . 2]" 1 1637 1 46 LYS H 1 46 LYS HB2 . . 3.070 2.709 2.614 2.841 . 0 0 "[ . 1 . 2]" 1 1638 1 46 LYS H 1 46 LYS HB3 . . 3.070 2.140 2.040 2.279 . 0 0 "[ . 1 . 2]" 1 1639 1 46 LYS H 1 46 LYS QD . . 4.060 3.840 3.647 3.990 . 0 0 "[ . 1 . 2]" 1 1640 1 46 LYS H 1 46 LYS HE2 . . 5.500 5.557 5.479 5.574 0.074 13 0 "[ . 1 . 2]" 1 1641 1 46 LYS H 1 46 LYS QG . . 4.050 3.975 3.916 4.030 . 0 0 "[ . 1 . 2]" 1 1642 1 46 LYS H 1 47 GLN H . . 3.370 2.904 2.800 3.021 . 0 0 "[ . 1 . 2]" 1 1643 1 46 LYS H 1 48 GLU H . . 4.140 4.145 4.025 4.201 0.061 9 0 "[ . 1 . 2]" 1 1644 1 46 LYS H 1 48 GLU QG . . 5.320 4.544 4.246 5.323 0.003 9 0 "[ . 1 . 2]" 1 1645 1 46 LYS H 1 99 ILE MG . . 4.470 3.852 3.546 4.005 . 0 0 "[ . 1 . 2]" 1 1646 1 46 LYS HA 1 46 LYS QD . . 4.280 4.076 4.000 4.139 . 0 0 "[ . 1 . 2]" 1 1647 1 46 LYS HA 1 46 LYS QG . . 3.440 2.754 2.614 2.850 . 0 0 "[ . 1 . 2]" 1 1648 1 46 LYS HA 1 49 LEU H . . 3.930 3.867 3.650 3.994 0.064 5 0 "[ . 1 . 2]" 1 1649 1 46 LYS HA 1 49 LEU HB2 . . 3.880 3.483 3.194 3.706 . 0 0 "[ . 1 . 2]" 1 1650 1 46 LYS HA 1 49 LEU HB3 . . 5.500 5.112 4.771 5.369 . 0 0 "[ . 1 . 2]" 1 1651 1 46 LYS HA 1 49 LEU QD . . 3.960 3.496 2.903 4.017 0.057 8 0 "[ . 1 . 2]" 1 1652 1 46 LYS HA 1 50 ILE H . . 4.670 4.430 4.194 4.669 . 0 0 "[ . 1 . 2]" 1 1653 1 46 LYS HA 1 50 ILE MD . . 4.370 4.162 3.908 4.431 0.061 15 0 "[ . 1 . 2]" 1 1654 1 46 LYS HA 1 50 ILE QG . . 5.270 4.540 4.193 4.948 . 0 0 "[ . 1 . 2]" 1 1655 1 46 LYS QB 1 46 LYS HE2 . . 4.590 3.864 3.695 3.918 . 0 0 "[ . 1 . 2]" 1 1656 1 46 LYS QB 1 46 LYS HE3 . . 4.470 4.143 4.064 4.245 . 0 0 "[ . 1 . 2]" 1 1657 1 46 LYS QB 1 47 GLN H . . 3.020 2.620 2.466 2.770 . 0 0 "[ . 1 . 2]" 1 1658 1 46 LYS QB 1 50 ILE MD . . 4.280 4.132 3.811 4.352 0.072 15 0 "[ . 1 . 2]" 1 1659 1 46 LYS QB 1 99 ILE MG . . 3.550 2.191 1.826 2.449 . 0 0 "[ . 1 . 2]" 1 1660 1 46 LYS HB2 1 50 ILE MD . . 4.920 4.562 4.194 4.844 . 0 0 "[ . 1 . 2]" 1 1661 1 46 LYS HB3 1 50 ILE MD . . 4.920 4.727 4.376 4.928 0.008 15 0 "[ . 1 . 2]" 1 1662 1 46 LYS QD 1 47 GLN H . . 3.600 2.370 2.254 2.574 . 0 0 "[ . 1 . 2]" 1 1663 1 46 LYS QD 1 47 GLN HA . . 3.890 3.394 3.225 3.662 . 0 0 "[ . 1 . 2]" 1 1664 1 46 LYS QD 1 50 ILE MD . . 4.010 3.503 3.181 3.678 . 0 0 "[ . 1 . 2]" 1 1665 1 46 LYS HD2 1 50 ILE MD . . 4.630 3.997 3.432 4.238 . 0 0 "[ . 1 . 2]" 1 1666 1 46 LYS HD2 1 99 ILE MG . . 5.500 4.997 4.463 5.240 . 0 0 "[ . 1 . 2]" 1 1667 1 46 LYS HD3 1 50 ILE MD . . 4.630 3.880 3.760 4.049 . 0 0 "[ . 1 . 2]" 1 1668 1 46 LYS HD3 1 99 ILE MG . . 5.500 5.010 4.563 5.184 . 0 0 "[ . 1 . 2]" 1 1669 1 46 LYS HE2 1 46 LYS QG . . 3.740 2.356 2.194 2.496 . 0 0 "[ . 1 . 2]" 1 1670 1 46 LYS HE2 1 47 GLN H . . 4.510 3.430 3.245 3.685 . 0 0 "[ . 1 . 2]" 1 1671 1 46 LYS HE2 1 47 GLN HA . . 5.500 2.207 1.975 2.552 . 0 0 "[ . 1 . 2]" 1 1672 1 46 LYS HE2 1 47 GLN QG . . 5.340 3.712 3.319 4.050 . 0 0 "[ . 1 . 2]" 1 1673 1 46 LYS HE2 1 50 ILE H . . 5.420 4.550 4.270 4.917 . 0 0 "[ . 1 . 2]" 1 1674 1 46 LYS HE2 1 50 ILE MD . . 3.240 1.982 1.886 2.096 . 0 0 "[ . 1 . 2]" 1 1675 1 46 LYS HE2 1 99 ILE MG . . 5.500 5.336 5.157 5.564 0.064 20 0 "[ . 1 . 2]" 1 1676 1 46 LYS HE3 1 46 LYS QG . . 3.610 2.379 2.239 2.546 . 0 0 "[ . 1 . 2]" 1 1677 1 46 LYS HE3 1 47 GLN H . . 5.500 4.784 4.692 4.987 . 0 0 "[ . 1 . 2]" 1 1678 1 46 LYS HE3 1 99 ILE MG . . 5.500 5.291 4.829 5.574 0.074 6 0 "[ . 1 . 2]" 1 1679 1 46 LYS QG 1 47 GLN H . . 3.510 3.462 3.140 3.551 0.041 3 0 "[ . 1 . 2]" 1 1680 1 46 LYS QG 1 47 GLN HA . . 4.590 3.633 3.219 3.777 . 0 0 "[ . 1 . 2]" 1 1681 1 46 LYS QG 1 47 GLN HB2 . . 4.950 4.474 4.272 4.652 . 0 0 "[ . 1 . 2]" 1 1682 1 46 LYS QG 1 48 GLU H . . 5.180 5.234 4.814 5.269 0.089 19 0 "[ . 1 . 2]" 1 1683 1 46 LYS QG 1 50 ILE H . . 5.500 4.425 3.798 4.636 . 0 0 "[ . 1 . 2]" 1 1684 1 46 LYS QG 1 50 ILE MD . . 3.120 2.234 1.866 2.454 . 0 0 "[ . 1 . 2]" 1 1685 1 46 LYS QG 1 99 ILE MG . . 3.450 2.846 2.571 3.004 . 0 0 "[ . 1 . 2]" 1 1686 1 47 GLN H 1 47 GLN HB2 . . 2.890 2.458 2.283 2.687 . 0 0 "[ . 1 . 2]" 1 1687 1 47 GLN H 1 47 GLN HB3 . . 2.890 2.488 2.284 2.694 . 0 0 "[ . 1 . 2]" 1 1688 1 47 GLN H 1 48 GLU H . . 3.080 2.691 2.551 2.794 . 0 0 "[ . 1 . 2]" 1 1689 1 47 GLN H 1 48 GLU HA . . 5.290 5.263 5.123 5.332 0.042 1 0 "[ . 1 . 2]" 1 1690 1 47 GLN H 1 48 GLU QG . . 5.340 4.014 3.813 4.265 . 0 0 "[ . 1 . 2]" 1 1691 1 47 GLN H 1 49 LEU H . . 4.590 4.433 4.262 4.529 . 0 0 "[ . 1 . 2]" 1 1692 1 47 GLN H 1 50 ILE H . . 5.070 5.017 4.863 5.142 0.072 19 0 "[ . 1 . 2]" 1 1693 1 47 GLN H 1 50 ILE HB . . 5.320 5.060 4.872 5.228 . 0 0 "[ . 1 . 2]" 1 1694 1 47 GLN H 1 50 ILE MD . . 4.650 4.480 4.299 4.692 0.042 15 0 "[ . 1 . 2]" 1 1695 1 47 GLN H 1 99 ILE MG . . 5.120 5.081 4.767 5.203 0.083 5 0 "[ . 1 . 2]" 1 1696 1 47 GLN HA 1 47 GLN QG . . 3.140 2.442 2.248 2.602 . 0 0 "[ . 1 . 2]" 1 1697 1 47 GLN HA 1 49 LEU H . . 5.500 4.352 4.193 4.516 . 0 0 "[ . 1 . 2]" 1 1698 1 47 GLN HA 1 50 ILE H . . 3.620 3.481 3.305 3.630 0.010 20 0 "[ . 1 . 2]" 1 1699 1 47 GLN HA 1 50 ILE HA . . 5.470 5.351 5.194 5.504 0.034 8 0 "[ . 1 . 2]" 1 1700 1 47 GLN HA 1 50 ILE HB . . 3.840 2.508 2.360 2.678 . 0 0 "[ . 1 . 2]" 1 1701 1 47 GLN HA 1 50 ILE MD . . 3.070 3.017 2.761 3.144 0.074 2 0 "[ . 1 . 2]" 1 1702 1 47 GLN HA 1 50 ILE QG . . 5.460 4.114 3.912 4.379 . 0 0 "[ . 1 . 2]" 1 1703 1 47 GLN HA 1 50 ILE MG . . 3.920 3.797 3.438 3.981 0.061 6 0 "[ . 1 . 2]" 1 1704 1 47 GLN HA 1 51 ASP H . . 4.040 3.827 3.578 4.037 . 0 0 "[ . 1 . 2]" 1 1705 1 47 GLN HB2 1 47 GLN QG . . 2.630 2.334 2.144 2.435 . 0 0 "[ . 1 . 2]" 1 1706 1 47 GLN HB2 1 48 GLU H . . 4.190 4.003 3.843 4.234 0.044 18 0 "[ . 1 . 2]" 1 1707 1 47 GLN HB2 1 50 ILE HB . . 5.500 4.910 4.562 5.086 . 0 0 "[ . 1 . 2]" 1 1708 1 47 GLN HB2 1 50 ILE MD . . 4.660 4.639 4.332 4.745 0.085 15 0 "[ . 1 . 2]" 1 1709 1 47 GLN HB3 1 48 GLU H . . 2.970 2.801 2.639 3.014 0.044 18 0 "[ . 1 . 2]" 1 1710 1 47 GLN HB3 1 51 ASP HB2 . . 5.500 5.127 4.721 5.541 0.041 4 0 "[ . 1 . 2]" 1 1711 1 47 GLN QG 1 49 LEU H . . 5.340 5.338 5.153 5.417 0.077 3 0 "[ . 1 . 2]" 1 1712 1 47 GLN QG 1 50 ILE H . . 5.240 4.955 4.833 5.063 . 0 0 "[ . 1 . 2]" 1 1713 1 47 GLN QG 1 50 ILE HB . . 4.180 3.861 3.534 4.169 . 0 0 "[ . 1 . 2]" 1 1714 1 47 GLN QG 1 50 ILE MD . . 4.630 4.459 4.189 4.727 0.097 7 0 "[ . 1 . 2]" 1 1715 1 47 GLN QG 1 50 ILE MG . . 4.280 4.081 3.548 4.380 0.100 16 0 "[ . 1 . 2]" 1 1716 1 47 GLN QG 1 51 ASP H . . 3.910 3.884 3.537 3.992 0.082 14 0 "[ . 1 . 2]" 1 1717 1 47 GLN QG 1 51 ASP HB2 . . 4.060 2.826 2.250 3.077 . 0 0 "[ . 1 . 2]" 1 1718 1 47 GLN HG2 1 48 GLU HA . . 5.500 3.939 3.641 4.378 . 0 0 "[ . 1 . 2]" 1 1719 1 47 GLN HG2 1 50 ILE MD . . 5.500 5.483 4.930 5.588 0.088 12 0 "[ . 1 . 2]" 1 1720 1 47 GLN HG3 1 48 GLU HA . . 5.500 5.402 4.872 5.570 0.070 2 0 "[ . 1 . 2]" 1 1721 1 47 GLN HG3 1 50 ILE MD . . 5.500 4.767 4.334 5.595 0.095 18 0 "[ . 1 . 2]" 1 1722 1 48 GLU H 1 48 GLU QB . . 3.040 2.659 2.463 2.942 . 0 0 "[ . 1 . 2]" 1 1723 1 48 GLU H 1 48 GLU HG2 . . 3.670 2.201 1.862 3.471 . 0 0 "[ . 1 . 2]" 1 1724 1 48 GLU H 1 48 GLU QG . . 2.830 2.045 1.854 2.270 . 0 0 "[ . 1 . 2]" 1 1725 1 48 GLU H 1 48 GLU HG3 . . 3.670 3.366 2.258 3.719 0.049 3 0 "[ . 1 . 2]" 1 1726 1 48 GLU H 1 49 LEU QD . . 4.500 4.217 3.866 4.747 0.247 2 0 "[ . 1 . 2]" 1 1727 1 48 GLU H 1 51 ASP H . . 4.900 4.731 4.609 4.860 . 0 0 "[ . 1 . 2]" 1 1728 1 48 GLU HA 1 48 GLU HG2 . . 3.980 3.185 2.292 3.452 . 0 0 "[ . 1 . 2]" 1 1729 1 48 GLU HA 1 48 GLU QG . . 3.110 3.010 2.226 3.200 0.090 5 0 "[ . 1 . 2]" 1 1730 1 48 GLU HA 1 48 GLU HG3 . . 3.980 3.733 2.940 3.928 . 0 0 "[ . 1 . 2]" 1 1731 1 48 GLU HA 1 50 ILE H . . 5.250 4.888 4.717 5.145 . 0 0 "[ . 1 . 2]" 1 1732 1 48 GLU HA 1 51 ASP H . . 4.090 3.695 3.370 3.917 . 0 0 "[ . 1 . 2]" 1 1733 1 48 GLU HA 1 51 ASP HB3 . . 3.360 2.910 2.472 3.422 0.062 5 0 "[ . 1 . 2]" 1 1734 1 48 GLU HA 1 52 PHE H . . 4.280 4.012 3.795 4.160 . 0 0 "[ . 1 . 2]" 1 1735 1 48 GLU QB 1 49 LEU H . . 3.150 2.629 2.454 2.871 . 0 0 "[ . 1 . 2]" 1 1736 1 48 GLU QB 1 49 LEU HA . . 4.730 3.936 3.702 4.118 . 0 0 "[ . 1 . 2]" 1 1737 1 48 GLU QB 1 49 LEU QD . . 3.960 2.991 2.347 3.652 . 0 0 "[ . 1 . 2]" 1 1738 1 48 GLU HB2 1 49 LEU H . . 3.800 2.679 2.485 2.962 . 0 0 "[ . 1 . 2]" 1 1739 1 48 GLU HB3 1 49 LEU H . . 3.800 3.827 3.696 3.867 0.067 18 0 "[ . 1 . 2]" 1 1740 1 48 GLU QG 1 49 LEU H . . 4.320 3.909 3.449 4.211 . 0 0 "[ . 1 . 2]" 1 1741 1 48 GLU QG 1 49 LEU QD . . 4.850 4.259 3.677 4.948 0.098 6 0 "[ . 1 . 2]" 1 1742 1 49 LEU H 1 49 LEU HB2 . . 3.590 2.221 2.105 2.374 . 0 0 "[ . 1 . 2]" 1 1743 1 49 LEU H 1 49 LEU HB3 . . 4.160 3.520 3.457 3.613 . 0 0 "[ . 1 . 2]" 1 1744 1 49 LEU H 1 49 LEU QD . . 3.080 2.480 2.161 3.056 . 0 0 "[ . 1 . 2]" 1 1745 1 49 LEU H 1 49 LEU HG . . 4.010 3.424 3.085 3.869 . 0 0 "[ . 1 . 2]" 1 1746 1 49 LEU H 1 50 ILE H . . 3.700 2.689 2.591 2.776 . 0 0 "[ . 1 . 2]" 1 1747 1 49 LEU H 1 50 ILE HA . . 5.440 5.279 5.220 5.345 . 0 0 "[ . 1 . 2]" 1 1748 1 49 LEU H 1 50 ILE HB . . 4.800 4.650 4.482 4.817 0.017 6 0 "[ . 1 . 2]" 1 1749 1 49 LEU H 1 51 ASP H . . 4.040 3.945 3.840 4.057 0.017 5 0 "[ . 1 . 2]" 1 1750 1 49 LEU H 1 52 PHE H . . 4.880 4.777 4.622 4.848 . 0 0 "[ . 1 . 2]" 1 1751 1 49 LEU H 1 53 LEU H . . 5.500 5.559 5.482 5.573 0.073 17 0 "[ . 1 . 2]" 1 1752 1 49 LEU H 1 53 LEU QD . . 5.240 5.194 5.054 5.307 0.067 5 0 "[ . 1 . 2]" 1 1753 1 49 LEU HA 1 49 LEU MD1 . . 4.030 3.038 2.226 3.701 . 0 0 "[ . 1 . 2]" 1 1754 1 49 LEU HA 1 49 LEU QD . . 3.000 2.480 2.041 2.832 . 0 0 "[ . 1 . 2]" 1 1755 1 49 LEU HA 1 49 LEU MD2 . . 4.030 2.652 2.188 3.113 . 0 0 "[ . 1 . 2]" 1 1756 1 49 LEU HA 1 51 ASP H . . 4.190 4.233 4.144 4.260 0.070 19 0 "[ . 1 . 2]" 1 1757 1 49 LEU HA 1 52 PHE H . . 3.680 3.555 3.442 3.642 . 0 0 "[ . 1 . 2]" 1 1758 1 49 LEU HA 1 52 PHE HB2 . . 4.490 3.255 2.957 3.964 . 0 0 "[ . 1 . 2]" 1 1759 1 49 LEU HA 1 52 PHE HB3 . . 5.500 4.205 3.641 4.555 . 0 0 "[ . 1 . 2]" 1 1760 1 49 LEU HA 1 53 LEU H . . 4.190 3.218 3.138 3.264 . 0 0 "[ . 1 . 2]" 1 1761 1 49 LEU HA 1 53 LEU QD . . 4.560 3.499 3.379 3.572 . 0 0 "[ . 1 . 2]" 1 1762 1 49 LEU HA 1 54 ASN H . . 5.500 5.569 5.548 5.583 0.083 11 0 "[ . 1 . 2]" 1 1763 1 49 LEU HB2 1 50 ILE H . . 3.730 2.498 2.279 2.662 . 0 0 "[ . 1 . 2]" 1 1764 1 49 LEU HB2 1 50 ILE HB . . 4.920 4.726 4.424 4.955 0.035 11 0 "[ . 1 . 2]" 1 1765 1 49 LEU HB2 1 51 ASP H . . 4.990 4.868 4.722 4.968 . 0 0 "[ . 1 . 2]" 1 1766 1 49 LEU HB2 1 53 LEU QD . . 4.300 4.017 3.842 4.222 . 0 0 "[ . 1 . 2]" 1 1767 1 49 LEU HB3 1 49 LEU QD . . 2.620 2.160 1.967 2.256 . 0 0 "[ . 1 . 2]" 1 1768 1 49 LEU HB3 1 50 ILE H . . 3.670 3.068 2.861 3.226 . 0 0 "[ . 1 . 2]" 1 1769 1 49 LEU HB3 1 51 ASP H . . 5.190 5.124 5.053 5.205 0.015 10 0 "[ . 1 . 2]" 1 1770 1 49 LEU HB3 1 53 LEU H . . 4.630 4.457 4.265 4.580 . 0 0 "[ . 1 . 2]" 1 1771 1 49 LEU HB3 1 53 LEU HB2 . . 3.930 3.919 3.691 3.993 0.063 12 0 "[ . 1 . 2]" 1 1772 1 49 LEU HB3 1 53 LEU QD . . 4.620 2.583 2.317 2.852 . 0 0 "[ . 1 . 2]" 1 1773 1 49 LEU HB3 1 53 LEU HG . . 4.320 2.989 2.735 3.127 . 0 0 "[ . 1 . 2]" 1 1774 1 49 LEU QD 1 50 ILE H . . 4.110 3.890 3.802 4.005 . 0 0 "[ . 1 . 2]" 1 1775 1 49 LEU QD 1 52 PHE H . . 5.440 5.001 4.537 5.351 . 0 0 "[ . 1 . 2]" 1 1776 1 49 LEU QD 1 53 LEU H . . 4.460 4.219 3.789 4.555 0.095 14 0 "[ . 1 . 2]" 1 1777 1 49 LEU QD 1 53 LEU QD . . 3.000 2.017 1.887 2.152 . 0 0 "[ . 1 . 2]" 1 1778 1 49 LEU QD 1 53 LEU HG . . 4.570 2.449 2.151 2.754 . 0 0 "[ . 1 . 2]" 1 1779 1 49 LEU MD1 1 50 ILE H . . 5.500 4.354 3.999 4.702 . 0 0 "[ . 1 . 2]" 1 1780 1 49 LEU MD2 1 50 ILE H . . 5.500 4.479 4.112 4.760 . 0 0 "[ . 1 . 2]" 1 1781 1 49 LEU HG 1 53 LEU QD . . 4.370 3.870 3.678 4.093 . 0 0 "[ . 1 . 2]" 1 1782 1 50 ILE H 1 50 ILE HB . . 3.260 2.366 2.234 2.542 . 0 0 "[ . 1 . 2]" 1 1783 1 50 ILE H 1 50 ILE MD . . 3.690 3.374 3.140 3.511 . 0 0 "[ . 1 . 2]" 1 1784 1 50 ILE H 1 50 ILE QG . . 3.440 2.299 2.147 2.496 . 0 0 "[ . 1 . 2]" 1 1785 1 50 ILE H 1 50 ILE MG . . 3.950 3.757 3.706 3.872 . 0 0 "[ . 1 . 2]" 1 1786 1 50 ILE H 1 51 ASP H . . 3.320 2.775 2.720 2.974 . 0 0 "[ . 1 . 2]" 1 1787 1 50 ILE H 1 51 ASP HA . . 5.400 5.398 5.345 5.473 0.073 19 0 "[ . 1 . 2]" 1 1788 1 50 ILE H 1 51 ASP HB2 . . 5.500 5.062 4.828 5.272 . 0 0 "[ . 1 . 2]" 1 1789 1 50 ILE H 1 51 ASP HB3 . . 5.500 5.125 4.880 5.350 . 0 0 "[ . 1 . 2]" 1 1790 1 50 ILE H 1 52 PHE H . . 4.500 4.550 4.439 4.578 0.078 19 0 "[ . 1 . 2]" 1 1791 1 50 ILE H 1 53 LEU H . . 5.020 4.858 4.794 4.898 . 0 0 "[ . 1 . 2]" 1 1792 1 50 ILE H 1 53 LEU QD . . 4.990 4.555 4.318 4.782 . 0 0 "[ . 1 . 2]" 1 1793 1 50 ILE H 1 53 LEU HG . . 4.910 4.928 4.774 4.974 0.064 4 0 "[ . 1 . 2]" 1 1794 1 50 ILE H 1 54 ASN H . . 5.500 5.573 5.562 5.583 0.083 8 0 "[ . 1 . 2]" 1 1795 1 50 ILE HA 1 50 ILE MD . . 3.830 3.812 3.738 3.879 0.049 12 0 "[ . 1 . 2]" 1 1796 1 50 ILE HA 1 50 ILE QG . . 3.350 2.333 2.227 2.446 . 0 0 "[ . 1 . 2]" 1 1797 1 50 ILE HA 1 50 ILE MG . . 3.150 2.592 2.486 2.760 . 0 0 "[ . 1 . 2]" 1 1798 1 50 ILE HA 1 51 ASP HA . . 4.810 4.747 4.689 4.803 . 0 0 "[ . 1 . 2]" 1 1799 1 50 ILE HA 1 53 LEU H . . 4.520 4.174 4.007 4.362 . 0 0 "[ . 1 . 2]" 1 1800 1 50 ILE HA 1 53 LEU HB2 . . 4.310 3.096 2.893 3.188 . 0 0 "[ . 1 . 2]" 1 1801 1 50 ILE HA 1 53 LEU QD . . 3.950 3.874 3.681 3.980 0.030 18 0 "[ . 1 . 2]" 1 1802 1 50 ILE HA 1 54 ASN H . . 3.960 3.631 3.500 3.743 . 0 0 "[ . 1 . 2]" 1 1803 1 50 ILE HB 1 50 ILE MD . . 3.590 2.311 2.236 2.417 . 0 0 "[ . 1 . 2]" 1 1804 1 50 ILE HB 1 51 ASP H . . 3.020 2.966 2.846 3.062 0.042 16 0 "[ . 1 . 2]" 1 1805 1 50 ILE HB 1 51 ASP HA . . 5.500 4.690 4.515 4.812 . 0 0 "[ . 1 . 2]" 1 1806 1 50 ILE MD 1 99 ILE MG . . 4.330 4.141 3.922 4.414 0.084 12 0 "[ . 1 . 2]" 1 1807 1 50 ILE QG 1 50 ILE MG . . 3.270 2.225 2.111 2.321 . 0 0 "[ . 1 . 2]" 1 1808 1 50 ILE MG 1 51 ASP H . . 3.490 3.489 3.190 3.569 0.079 5 0 "[ . 1 . 2]" 1 1809 1 50 ILE MG 1 51 ASP HA . . 3.580 3.494 3.181 3.633 0.053 4 0 "[ . 1 . 2]" 1 1810 1 50 ILE MG 1 51 ASP HB2 . . 4.360 4.249 3.653 4.437 0.077 6 0 "[ . 1 . 2]" 1 1811 1 50 ILE MG 1 52 PHE H . . 5.500 5.365 5.113 5.490 . 0 0 "[ . 1 . 2]" 1 1812 1 50 ILE MG 1 54 ASN H . . 4.450 4.434 4.155 4.539 0.089 15 0 "[ . 1 . 2]" 1 1813 1 50 ILE MG 1 54 ASN HB2 . . 3.730 3.467 3.054 3.777 0.047 15 0 "[ . 1 . 2]" 1 1814 1 50 ILE MG 1 54 ASN HB3 . . 4.510 4.272 3.919 4.583 0.073 8 0 "[ . 1 . 2]" 1 1815 1 51 ASP H 1 51 ASP HB2 . . 3.040 2.506 2.340 2.703 . 0 0 "[ . 1 . 2]" 1 1816 1 51 ASP H 1 51 ASP HB3 . . 3.250 2.562 2.368 2.779 . 0 0 "[ . 1 . 2]" 1 1817 1 51 ASP H 1 52 PHE H . . 3.430 2.697 2.573 2.762 . 0 0 "[ . 1 . 2]" 1 1818 1 51 ASP H 1 52 PHE HB2 . . 4.720 4.570 4.414 4.745 0.025 6 0 "[ . 1 . 2]" 1 1819 1 51 ASP H 1 53 LEU H . . 4.210 4.234 4.148 4.271 0.061 14 0 "[ . 1 . 2]" 1 1820 1 51 ASP H 1 53 LEU HB2 . . 5.130 5.172 4.994 5.201 0.071 16 0 "[ . 1 . 2]" 1 1821 1 51 ASP H 1 53 LEU QD . . 5.440 5.505 5.379 5.548 0.108 5 0 "[ . 1 . 2]" 1 1822 1 51 ASP H 1 54 ASN H . . 4.990 4.485 4.417 4.535 . 0 0 "[ . 1 . 2]" 1 1823 1 51 ASP HA 1 51 ASP HB2 . . 2.870 2.495 2.398 2.595 . 0 0 "[ . 1 . 2]" 1 1824 1 51 ASP HA 1 53 LEU H . . 5.450 5.090 4.979 5.215 . 0 0 "[ . 1 . 2]" 1 1825 1 51 ASP HA 1 54 ASN H . . 4.320 3.945 3.785 4.060 . 0 0 "[ . 1 . 2]" 1 1826 1 51 ASP HA 1 54 ASN HB2 . . 4.070 3.949 3.683 4.116 0.046 14 0 "[ . 1 . 2]" 1 1827 1 51 ASP HA 1 54 ASN HB3 . . 3.500 3.078 2.818 3.340 . 0 0 "[ . 1 . 2]" 1 1828 1 51 ASP HA 1 55 GLN H . . 5.220 4.869 4.496 5.251 0.031 8 0 "[ . 1 . 2]" 1 1829 1 51 ASP HB3 1 52 PHE H . . 3.230 2.541 2.419 2.648 . 0 0 "[ . 1 . 2]" 1 1830 1 51 ASP HB3 1 52 PHE HA . . 5.500 4.370 4.211 4.532 . 0 0 "[ . 1 . 2]" 1 1831 1 51 ASP HB3 1 53 LEU H . . 5.120 5.107 4.998 5.172 0.052 13 0 "[ . 1 . 2]" 1 1832 1 52 PHE H 1 52 PHE HB2 . . 3.250 2.090 2.032 2.211 . 0 0 "[ . 1 . 2]" 1 1833 1 52 PHE H 1 52 PHE HB3 . . 3.290 3.323 2.905 3.365 0.075 20 0 "[ . 1 . 2]" 1 1834 1 52 PHE H 1 53 LEU H . . 3.320 2.640 2.527 2.744 . 0 0 "[ . 1 . 2]" 1 1835 1 52 PHE H 1 53 LEU HB2 . . 4.770 4.746 4.589 4.840 0.070 5 0 "[ . 1 . 2]" 1 1836 1 52 PHE H 1 54 ASN H . . 4.420 3.890 3.768 4.003 . 0 0 "[ . 1 . 2]" 1 1837 1 52 PHE H 1 55 GLN H . . 5.080 5.006 4.775 5.143 0.063 8 0 "[ . 1 . 2]" 1 1838 1 52 PHE HA 1 53 LEU HA . . 5.500 4.822 4.785 4.870 . 0 0 "[ . 1 . 2]" 1 1839 1 52 PHE HA 1 54 ASN H . . 4.490 4.257 4.163 4.375 . 0 0 "[ . 1 . 2]" 1 1840 1 52 PHE HA 1 55 GLN H . . 3.840 3.574 3.375 3.797 . 0 0 "[ . 1 . 2]" 1 1841 1 52 PHE HA 1 55 GLN QB . . 3.450 3.025 2.556 3.286 . 0 0 "[ . 1 . 2]" 1 1842 1 52 PHE HA 1 55 GLN HG2 . . 5.500 4.550 4.000 5.289 . 0 0 "[ . 1 . 2]" 1 1843 1 52 PHE HA 1 55 GLN QG . . 4.810 3.887 3.464 4.516 . 0 0 "[ . 1 . 2]" 1 1844 1 52 PHE HA 1 55 GLN HG3 . . 5.500 4.252 3.582 4.905 . 0 0 "[ . 1 . 2]" 1 1845 1 52 PHE HA 1 56 LEU H . . 4.610 4.486 4.110 4.736 0.126 2 0 "[ . 1 . 2]" 1 1846 1 52 PHE HB2 1 53 LEU H . . 3.760 2.800 2.516 3.437 . 0 0 "[ . 1 . 2]" 1 1847 1 52 PHE HB3 1 53 LEU H . . 3.610 2.810 2.482 3.096 . 0 0 "[ . 1 . 2]" 1 1848 1 52 PHE HB3 1 53 LEU HB2 . . 5.500 5.136 4.851 5.467 . 0 0 "[ . 1 . 2]" 1 1849 1 52 PHE HB3 1 53 LEU QD . . 5.440 3.329 2.935 3.604 . 0 0 "[ . 1 . 2]" 1 1850 1 52 PHE HB3 1 56 LEU H . . 5.500 5.001 4.778 5.430 . 0 0 "[ . 1 . 2]" 1 1851 1 53 LEU H 1 53 LEU HB2 . . 3.460 2.507 2.438 2.595 . 0 0 "[ . 1 . 2]" 1 1852 1 53 LEU H 1 53 LEU MD1 . . 3.830 3.877 3.838 3.904 0.074 8 0 "[ . 1 . 2]" 1 1853 1 53 LEU H 1 53 LEU QD . . 3.050 2.953 2.862 3.042 . 0 0 "[ . 1 . 2]" 1 1854 1 53 LEU H 1 53 LEU MD2 . . 3.830 3.063 2.949 3.183 . 0 0 "[ . 1 . 2]" 1 1855 1 53 LEU H 1 53 LEU HG . . 3.130 2.451 2.398 2.523 . 0 0 "[ . 1 . 2]" 1 1856 1 53 LEU H 1 54 ASN HA . . 5.500 5.409 5.343 5.507 0.007 18 0 "[ . 1 . 2]" 1 1857 1 53 LEU H 1 55 GLN H . . 4.960 4.331 4.110 4.480 . 0 0 "[ . 1 . 2]" 1 1858 1 53 LEU H 1 56 LEU H . . 5.050 4.770 4.629 4.997 . 0 0 "[ . 1 . 2]" 1 1859 1 53 LEU H 1 56 LEU HB2 . . 5.190 4.836 4.594 5.083 . 0 0 "[ . 1 . 2]" 1 1860 1 53 LEU H 1 56 LEU QD . . 5.010 3.878 3.515 4.414 . 0 0 "[ . 1 . 2]" 1 1861 1 53 LEU HA 1 53 LEU MD1 . . 3.930 3.768 3.687 3.859 . 0 0 "[ . 1 . 2]" 1 1862 1 53 LEU HA 1 53 LEU QD . . 2.910 2.116 1.912 2.193 . 0 0 "[ . 1 . 2]" 1 1863 1 53 LEU HA 1 53 LEU MD2 . . 3.930 2.127 1.917 2.206 . 0 0 "[ . 1 . 2]" 1 1864 1 53 LEU HA 1 55 GLN H . . 4.210 4.114 4.019 4.261 0.051 4 0 "[ . 1 . 2]" 1 1865 1 53 LEU HA 1 56 LEU H . . 3.780 3.047 2.870 3.267 . 0 0 "[ . 1 . 2]" 1 1866 1 53 LEU HA 1 56 LEU HB2 . . 3.970 2.134 1.958 2.371 . 0 0 "[ . 1 . 2]" 1 1867 1 53 LEU HA 1 56 LEU HB3 . . 3.970 3.721 3.509 3.971 0.001 13 0 "[ . 1 . 2]" 1 1868 1 53 LEU HA 1 56 LEU MD1 . . 4.530 2.830 2.158 4.598 0.068 14 0 "[ . 1 . 2]" 1 1869 1 53 LEU HA 1 56 LEU QD . . 3.610 2.479 2.153 3.044 . 0 0 "[ . 1 . 2]" 1 1870 1 53 LEU HA 1 56 LEU MD2 . . 4.530 3.204 2.682 4.519 . 0 0 "[ . 1 . 2]" 1 1871 1 53 LEU HA 1 57 ASP H . . 4.400 3.953 3.736 4.197 . 0 0 "[ . 1 . 2]" 1 1872 1 53 LEU HB2 1 53 LEU MD1 . . 3.450 2.406 2.330 2.474 . 0 0 "[ . 1 . 2]" 1 1873 1 53 LEU HB2 1 53 LEU QD . . 2.970 2.344 2.279 2.393 . 0 0 "[ . 1 . 2]" 1 1874 1 53 LEU HB2 1 53 LEU MD2 . . 3.450 3.230 3.183 3.246 . 0 0 "[ . 1 . 2]" 1 1875 1 53 LEU HB2 1 54 ASN H . . 3.560 2.830 2.737 2.924 . 0 0 "[ . 1 . 2]" 1 1876 1 53 LEU HB2 1 54 ASN HB3 . . 5.500 5.155 4.950 5.299 . 0 0 "[ . 1 . 2]" 1 1877 1 53 LEU HB2 1 55 GLN H . . 5.500 5.127 4.976 5.232 . 0 0 "[ . 1 . 2]" 1 1878 1 53 LEU HB3 1 53 LEU MD1 . . 3.430 2.215 2.147 2.293 . 0 0 "[ . 1 . 2]" 1 1879 1 53 LEU HB3 1 53 LEU QD . . 2.990 2.089 2.025 2.121 . 0 0 "[ . 1 . 2]" 1 1880 1 53 LEU HB3 1 53 LEU MD2 . . 3.430 2.564 2.480 2.628 . 0 0 "[ . 1 . 2]" 1 1881 1 53 LEU HB3 1 54 ASN HA . . 4.620 4.479 4.327 4.630 0.010 13 0 "[ . 1 . 2]" 1 1882 1 53 LEU HB3 1 56 LEU H . . 5.320 4.976 4.748 5.191 . 0 0 "[ . 1 . 2]" 1 1883 1 53 LEU QD 1 56 LEU H . . 4.730 4.420 4.250 4.668 . 0 0 "[ . 1 . 2]" 1 1884 1 53 LEU QD 1 56 LEU HB2 . . 3.490 3.181 3.045 3.435 . 0 0 "[ . 1 . 2]" 1 1885 1 53 LEU QD 1 56 LEU HB3 . . 4.240 3.881 3.683 4.119 . 0 0 "[ . 1 . 2]" 1 1886 1 53 LEU QD 1 56 LEU QD . . 3.480 2.323 1.989 3.200 . 0 0 "[ . 1 . 2]" 1 1887 1 53 LEU QD 1 57 ASP H . . 5.120 4.805 4.592 5.031 . 0 0 "[ . 1 . 2]" 1 1888 1 53 LEU QD 1 57 ASP HB2 . . 5.440 5.094 4.786 5.513 0.073 17 0 "[ . 1 . 2]" 1 1889 1 54 ASN H 1 54 ASN HB2 . . 3.110 2.829 2.693 2.959 . 0 0 "[ . 1 . 2]" 1 1890 1 54 ASN H 1 54 ASN HB3 . . 2.890 2.415 2.310 2.626 . 0 0 "[ . 1 . 2]" 1 1891 1 54 ASN H 1 55 GLN H . . 3.120 2.720 2.548 2.842 . 0 0 "[ . 1 . 2]" 1 1892 1 54 ASN H 1 55 GLN HA . . 5.490 5.417 5.248 5.527 0.037 12 0 "[ . 1 . 2]" 1 1893 1 54 ASN H 1 55 GLN QB . . 4.630 4.529 4.157 4.685 0.055 6 0 "[ . 1 . 2]" 1 1894 1 54 ASN H 1 56 LEU H . . 4.330 4.186 4.050 4.375 0.045 13 0 "[ . 1 . 2]" 1 1895 1 54 ASN H 1 56 LEU HB2 . . 5.170 4.955 4.809 5.098 . 0 0 "[ . 1 . 2]" 1 1896 1 54 ASN H 1 57 ASP H . . 5.060 4.942 4.700 5.130 0.070 10 0 "[ . 1 . 2]" 1 1897 1 54 ASN HA 1 54 ASN HB2 . . 2.800 2.373 2.319 2.426 . 0 0 "[ . 1 . 2]" 1 1898 1 54 ASN HA 1 55 GLN H . . 3.540 3.519 3.466 3.578 0.038 8 0 "[ . 1 . 2]" 1 1899 1 54 ASN HA 1 56 LEU H . . 4.760 4.599 4.421 4.796 0.036 10 0 "[ . 1 . 2]" 1 1900 1 54 ASN HA 1 56 LEU HB2 . . 5.500 5.325 5.035 5.554 0.054 19 0 "[ . 1 . 2]" 1 1901 1 54 ASN HB2 1 55 GLN H . . 4.290 4.002 3.852 4.191 . 0 0 "[ . 1 . 2]" 1 1902 1 54 ASN HB3 1 55 GLN H . . 3.510 2.695 2.457 2.934 . 0 0 "[ . 1 . 2]" 1 1903 1 54 ASN HB3 1 55 GLN QB . . 4.420 4.388 3.922 4.523 0.103 2 0 "[ . 1 . 2]" 1 1904 1 54 ASN HB3 1 55 GLN QG . . 5.340 3.932 3.245 4.795 . 0 0 "[ . 1 . 2]" 1 1905 1 54 ASN HB3 1 56 LEU H . . 5.500 5.096 4.942 5.283 . 0 0 "[ . 1 . 2]" 1 1906 1 55 GLN H 1 55 GLN QB . . 2.690 2.206 2.015 2.396 . 0 0 "[ . 1 . 2]" 1 1907 1 55 GLN H 1 55 GLN QG . . 3.380 2.950 2.341 3.450 0.070 18 0 "[ . 1 . 2]" 1 1908 1 55 GLN H 1 56 LEU H . . 3.410 2.566 2.415 2.652 . 0 0 "[ . 1 . 2]" 1 1909 1 55 GLN H 1 56 LEU HA . . 5.330 5.224 5.099 5.313 . 0 0 "[ . 1 . 2]" 1 1910 1 55 GLN H 1 56 LEU HB2 . . 4.460 4.442 4.183 4.526 0.066 9 0 "[ . 1 . 2]" 1 1911 1 55 GLN H 1 56 LEU QD . . 4.230 4.014 3.772 4.319 0.089 12 0 "[ . 1 . 2]" 1 1912 1 55 GLN H 1 57 ASP H . . 4.400 4.162 3.951 4.279 . 0 0 "[ . 1 . 2]" 1 1913 1 55 GLN H 1 58 SER H . . 5.010 4.885 4.583 5.067 0.057 11 0 "[ . 1 . 2]" 1 1914 1 55 GLN HA 1 55 GLN QG . . 3.240 2.623 2.366 2.827 . 0 0 "[ . 1 . 2]" 1 1915 1 55 GLN HA 1 56 LEU H . . 3.560 3.575 3.524 3.610 0.050 14 0 "[ . 1 . 2]" 1 1916 1 55 GLN HA 1 57 ASP H . . 4.700 4.416 4.173 4.560 . 0 0 "[ . 1 . 2]" 1 1917 1 55 GLN HA 1 58 SER H . . 3.700 3.401 3.102 3.696 . 0 0 "[ . 1 . 2]" 1 1918 1 55 GLN HA 1 58 SER HB2 . . 5.500 3.021 2.174 3.710 . 0 0 "[ . 1 . 2]" 1 1919 1 55 GLN HA 1 58 SER HB3 . . 3.420 3.207 2.709 3.487 0.067 12 0 "[ . 1 . 2]" 1 1920 1 55 GLN QB 1 56 LEU H . . 3.130 2.667 2.382 2.935 . 0 0 "[ . 1 . 2]" 1 1921 1 55 GLN QB 1 56 LEU HA . . 3.980 3.908 3.807 4.038 0.058 16 0 "[ . 1 . 2]" 1 1922 1 55 GLN QB 1 58 SER H . . 5.210 4.771 4.573 4.997 . 0 0 "[ . 1 . 2]" 1 1923 1 55 GLN QB 1 58 SER HB3 . . 5.340 4.679 4.120 5.074 . 0 0 "[ . 1 . 2]" 1 1924 1 55 GLN HB2 1 56 LEU H . . 3.730 2.879 2.427 3.263 . 0 0 "[ . 1 . 2]" 1 1925 1 55 GLN HB2 1 56 LEU HB2 . . 5.500 4.994 4.494 5.418 . 0 0 "[ . 1 . 2]" 1 1926 1 55 GLN HB2 1 57 ASP H . . 5.500 5.316 5.000 5.560 0.060 18 0 "[ . 1 . 2]" 1 1927 1 55 GLN HB3 1 56 LEU H . . 3.730 3.283 2.757 3.600 . 0 0 "[ . 1 . 2]" 1 1928 1 55 GLN HB3 1 56 LEU HB2 . . 5.500 5.361 4.852 5.567 0.067 6 0 "[ . 1 . 2]" 1 1929 1 55 GLN HB3 1 57 ASP H . . 5.500 5.455 5.209 5.571 0.071 7 0 "[ . 1 . 2]" 1 1930 1 55 GLN QG 1 56 LEU H . . 4.780 4.388 4.108 4.567 . 0 0 "[ . 1 . 2]" 1 1931 1 55 GLN HG2 1 56 LEU H . . 5.500 4.818 4.543 5.060 . 0 0 "[ . 1 . 2]" 1 1932 1 55 GLN HG3 1 56 LEU H . . 5.500 5.077 4.351 5.373 . 0 0 "[ . 1 . 2]" 1 1933 1 56 LEU H 1 56 LEU HB2 . . 3.650 2.245 2.123 2.458 . 0 0 "[ . 1 . 2]" 1 1934 1 56 LEU H 1 56 LEU HB3 . . 3.550 3.522 3.440 3.582 0.032 13 0 "[ . 1 . 2]" 1 1935 1 56 LEU H 1 56 LEU QD . . 3.610 2.423 2.204 2.998 . 0 0 "[ . 1 . 2]" 1 1936 1 56 LEU H 1 56 LEU HG . . 3.850 3.689 2.414 3.916 0.066 16 0 "[ . 1 . 2]" 1 1937 1 56 LEU H 1 57 ASP H . . 3.210 2.810 2.640 2.947 . 0 0 "[ . 1 . 2]" 1 1938 1 56 LEU H 1 57 ASP HA . . 5.500 5.437 5.317 5.539 0.039 10 0 "[ . 1 . 2]" 1 1939 1 56 LEU HA 1 56 LEU QD . . 3.250 2.516 1.951 2.754 . 0 0 "[ . 1 . 2]" 1 1940 1 56 LEU HA 1 56 LEU HG . . 3.520 2.592 2.264 3.595 0.075 16 0 "[ . 1 . 2]" 1 1941 1 56 LEU HA 1 57 ASP HA . . 5.500 4.823 4.743 4.891 . 0 0 "[ . 1 . 2]" 1 1942 1 56 LEU HA 1 59 GLU H . . 3.570 3.274 3.056 3.410 . 0 0 "[ . 1 . 2]" 1 1943 1 56 LEU HA 1 59 GLU QB . . 3.820 2.497 2.115 2.784 . 0 0 "[ . 1 . 2]" 1 1944 1 56 LEU HA 1 59 GLU QG . . 5.340 3.253 2.682 3.847 . 0 0 "[ . 1 . 2]" 1 1945 1 56 LEU HB2 1 56 LEU MD1 . . 3.390 2.500 2.217 3.210 . 0 0 "[ . 1 . 2]" 1 1946 1 56 LEU HB2 1 56 LEU MD2 . . 3.390 2.611 2.414 3.215 . 0 0 "[ . 1 . 2]" 1 1947 1 56 LEU HB2 1 57 ASP H . . 3.450 2.771 2.365 2.935 . 0 0 "[ . 1 . 2]" 1 1948 1 56 LEU HB2 1 57 ASP HA . . 5.500 4.720 4.338 4.929 . 0 0 "[ . 1 . 2]" 1 1949 1 56 LEU HB2 1 57 ASP HB2 . . 5.500 4.633 4.202 4.944 . 0 0 "[ . 1 . 2]" 1 1950 1 56 LEU HB2 1 59 GLU QB . . 5.340 5.216 4.857 5.418 0.078 16 0 "[ . 1 . 2]" 1 1951 1 56 LEU HB3 1 56 LEU MD1 . . 3.180 2.979 2.244 3.252 0.072 20 0 "[ . 1 . 2]" 1 1952 1 56 LEU HB3 1 56 LEU MD2 . . 3.180 2.423 2.179 3.256 0.076 3 0 "[ . 1 . 2]" 1 1953 1 56 LEU HB3 1 57 ASP H . . 3.430 3.241 3.064 3.432 0.002 9 0 "[ . 1 . 2]" 1 1954 1 56 LEU HB3 1 57 ASP HA . . 4.640 4.052 3.836 4.391 . 0 0 "[ . 1 . 2]" 1 1955 1 56 LEU HB3 1 57 ASP HB3 . . 5.500 5.498 5.364 5.573 0.073 12 0 "[ . 1 . 2]" 1 1956 1 56 LEU HB3 1 58 SER H . . 5.340 5.190 4.935 5.404 0.064 17 0 "[ . 1 . 2]" 1 1957 1 56 LEU HB3 1 59 GLU H . . 5.350 5.019 4.820 5.227 . 0 0 "[ . 1 . 2]" 1 1958 1 56 LEU HB3 1 59 GLU QB . . 5.340 4.521 4.197 4.845 . 0 0 "[ . 1 . 2]" 1 1959 1 56 LEU QD 1 57 ASP H . . 4.590 4.015 3.893 4.174 . 0 0 "[ . 1 . 2]" 1 1960 1 56 LEU QD 1 58 SER H . . 5.440 5.214 4.827 5.468 0.028 17 0 "[ . 1 . 2]" 1 1961 1 56 LEU QD 1 59 GLU QB . . 5.280 3.925 2.698 4.506 . 0 0 "[ . 1 . 2]" 1 1962 1 56 LEU MD1 1 57 ASP H . . 5.440 4.396 4.215 4.659 . 0 0 "[ . 1 . 2]" 1 1963 1 56 LEU MD2 1 57 ASP H . . 5.440 4.666 4.355 4.845 . 0 0 "[ . 1 . 2]" 1 1964 1 57 ASP H 1 57 ASP HB2 . . 2.980 2.568 2.254 2.833 . 0 0 "[ . 1 . 2]" 1 1965 1 57 ASP H 1 57 ASP HB3 . . 3.050 2.487 2.246 2.665 . 0 0 "[ . 1 . 2]" 1 1966 1 57 ASP H 1 58 SER HA . . 5.340 5.316 5.219 5.393 0.053 16 0 "[ . 1 . 2]" 1 1967 1 57 ASP H 1 59 GLU H . . 4.240 4.040 3.819 4.240 . 0 0 "[ . 1 . 2]" 1 1968 1 57 ASP HA 1 57 ASP HB2 . . 2.950 2.447 2.341 2.545 . 0 0 "[ . 1 . 2]" 1 1969 1 57 ASP HA 1 58 SER H . . 3.540 3.530 3.479 3.579 0.039 4 0 "[ . 1 . 2]" 1 1970 1 57 ASP HA 1 58 SER HA . . 5.500 4.759 4.669 4.876 . 0 0 "[ . 1 . 2]" 1 1971 1 57 ASP HA 1 59 GLU H . . 4.360 4.163 3.688 4.415 0.055 2 0 "[ . 1 . 2]" 1 1972 1 57 ASP HA 1 59 GLU QB . . 5.340 5.126 4.743 5.382 0.042 12 0 "[ . 1 . 2]" 1 1973 1 57 ASP HA 1 60 GLU H . . 4.070 3.574 3.201 3.900 . 0 0 "[ . 1 . 2]" 1 1974 1 57 ASP HA 1 60 GLU QB . . 5.500 3.038 2.178 3.744 . 0 0 "[ . 1 . 2]" 1 1975 1 57 ASP HB2 1 58 SER H . . 4.330 4.043 3.791 4.253 . 0 0 "[ . 1 . 2]" 1 1976 1 57 ASP HB3 1 58 SER H . . 3.470 2.864 2.437 3.131 . 0 0 "[ . 1 . 2]" 1 1977 1 57 ASP HB3 1 58 SER HB2 . . 5.500 4.166 3.858 4.515 . 0 0 "[ . 1 . 2]" 1 1978 1 57 ASP HB3 1 59 GLU H . . 5.160 5.033 4.819 5.208 0.048 9 0 "[ . 1 . 2]" 1 1979 1 58 SER H 1 58 SER HB2 . . 2.920 2.217 1.952 2.545 . 0 0 "[ . 1 . 2]" 1 1980 1 58 SER H 1 58 SER HB3 . . 3.330 2.874 2.486 3.265 . 0 0 "[ . 1 . 2]" 1 1981 1 58 SER H 1 59 GLU H . . 3.200 2.480 2.299 2.670 . 0 0 "[ . 1 . 2]" 1 1982 1 58 SER H 1 59 GLU QB . . 4.480 4.299 3.979 4.540 0.060 1 0 "[ . 1 . 2]" 1 1983 1 58 SER H 1 59 GLU QG . . 5.340 4.752 4.164 5.290 . 0 0 "[ . 1 . 2]" 1 1984 1 58 SER H 1 60 GLU H . . 4.790 4.080 3.726 4.440 . 0 0 "[ . 1 . 2]" 1 1985 1 58 SER HA 1 58 SER HB2 . . 2.690 2.698 2.545 2.777 0.087 8 0 "[ . 1 . 2]" 1 1986 1 58 SER HA 1 59 GLU H . . 3.560 3.511 3.378 3.566 0.006 3 0 "[ . 1 . 2]" 1 1987 1 58 SER HA 1 59 GLU HA . . 5.500 4.756 4.650 4.855 . 0 0 "[ . 1 . 2]" 1 1988 1 58 SER HA 1 60 GLU H . . 4.230 4.258 4.115 4.347 0.117 2 0 "[ . 1 . 2]" 1 1989 1 58 SER HA 1 61 GLN H . . 3.360 3.340 3.162 3.438 0.078 16 0 "[ . 1 . 2]" 1 1990 1 58 SER HA 1 61 GLN HB2 . . 5.500 5.446 5.147 5.575 0.075 20 0 "[ . 1 . 2]" 1 1991 1 58 SER HA 1 61 GLN QG . . 4.100 2.969 2.351 3.747 . 0 0 "[ . 1 . 2]" 1 1992 1 58 SER HB2 1 59 GLU H . . 3.780 3.754 3.376 3.851 0.071 15 0 "[ . 1 . 2]" 1 1993 1 58 SER HB2 1 59 GLU HA . . 5.500 5.522 5.228 5.575 0.075 9 0 "[ . 1 . 2]" 1 1994 1 58 SER HB3 1 59 GLU H . . 5.500 3.094 2.695 3.515 . 0 0 "[ . 1 . 2]" 1 1995 1 58 SER HB3 1 59 GLU HA . . 5.500 4.139 3.983 4.294 . 0 0 "[ . 1 . 2]" 1 1996 1 58 SER HB3 1 59 GLU QB . . 4.780 4.562 4.063 4.850 0.070 8 0 "[ . 1 . 2]" 1 1997 1 59 GLU H 1 59 GLU HA . . 2.860 2.887 2.800 2.922 0.062 14 0 "[ . 1 . 2]" 1 1998 1 59 GLU H 1 59 GLU QB . . 2.810 2.201 2.028 2.384 . 0 0 "[ . 1 . 2]" 1 1999 1 59 GLU H 1 59 GLU QG . . 3.450 2.929 2.395 3.498 0.048 15 0 "[ . 1 . 2]" 1 2000 1 59 GLU H 1 60 GLU QG . . 4.970 4.178 3.974 4.461 . 0 0 "[ . 1 . 2]" 1 2001 1 59 GLU HA 1 59 GLU QG . . 3.290 2.733 2.169 3.390 0.100 6 0 "[ . 1 . 2]" 1 2002 1 60 GLU H 1 60 GLU QB . . 2.560 2.357 2.122 2.621 0.061 19 0 "[ . 1 . 2]" 1 2003 1 60 GLU H 1 60 GLU QG . . 3.020 2.438 2.167 2.651 . 0 0 "[ . 1 . 2]" 1 2004 1 60 GLU H 1 62 THR MG . . 5.110 5.058 4.580 5.196 0.086 16 0 "[ . 1 . 2]" 1 2005 1 60 GLU HA 1 60 GLU QG . . 3.290 2.609 2.269 3.056 . 0 0 "[ . 1 . 2]" 1 2006 1 60 GLU HA 1 61 GLN HA . . 5.500 5.365 5.293 5.398 . 0 0 "[ . 1 . 2]" 1 2007 1 60 GLU QB 1 61 GLN H . . 2.730 2.612 2.345 2.891 0.161 2 0 "[ . 1 . 2]" 1 2008 1 60 GLU QB 1 62 THR H . . 3.430 2.524 2.280 2.905 . 0 0 "[ . 1 . 2]" 1 2009 1 60 GLU QB 1 62 THR MG . . 5.500 2.312 1.930 3.639 . 0 0 "[ . 1 . 2]" 1 2010 1 60 GLU QG 1 61 GLN H . . 4.030 4.085 3.966 4.115 0.085 9 0 "[ . 1 . 2]" 1 2011 1 60 GLU QG 1 62 THR H . . 4.730 4.556 4.291 4.812 0.082 19 0 "[ . 1 . 2]" 1 2012 1 61 GLN H 1 61 GLN HA . . 2.580 2.248 2.189 2.320 . 0 0 "[ . 1 . 2]" 1 2013 1 61 GLN H 1 61 GLN HB2 . . 3.410 3.416 3.151 3.487 0.077 1 0 "[ . 1 . 2]" 1 2014 1 61 GLN H 1 61 GLN HG2 . . 3.870 3.127 2.437 3.941 0.071 6 0 "[ . 1 . 2]" 1 2015 1 61 GLN H 1 61 GLN QG . . 3.160 2.798 2.416 3.230 0.070 18 0 "[ . 1 . 2]" 1 2016 1 61 GLN H 1 61 GLN HG3 . . 3.870 3.370 2.822 3.949 0.079 20 0 "[ . 1 . 2]" 1 2017 1 61 GLN H 1 62 THR H . . 3.230 2.864 2.697 3.218 . 0 0 "[ . 1 . 2]" 1 2018 1 61 GLN H 1 62 THR MG . . 5.120 4.339 3.827 4.613 . 0 0 "[ . 1 . 2]" 1 2019 1 61 GLN HA 1 61 GLN QG . . 3.040 2.294 2.040 2.596 . 0 0 "[ . 1 . 2]" 1 2020 1 61 GLN HA 1 62 THR H . . 3.560 3.043 2.528 3.486 . 0 0 "[ . 1 . 2]" 1 2021 1 61 GLN HA 1 62 THR MG . . 5.500 4.775 3.431 5.171 . 0 0 "[ . 1 . 2]" 1 2022 1 61 GLN HB2 1 61 GLN QG . . 2.510 2.230 2.106 2.346 . 0 0 "[ . 1 . 2]" 1 2023 1 61 GLN HB2 1 62 THR H . . 4.280 4.057 3.260 4.352 0.072 19 0 "[ . 1 . 2]" 1 2024 1 62 THR H 1 62 THR HB . . 3.640 3.204 2.102 3.724 0.084 15 0 "[ . 1 . 2]" 1 2025 1 62 THR H 1 62 THR MG . . 2.930 2.447 2.093 2.899 . 0 0 "[ . 1 . 2]" 1 2026 1 62 THR H 1 63 LYS H . . 4.830 4.354 2.558 4.642 . 0 0 "[ . 1 . 2]" 1 2027 1 62 THR HA 1 62 THR MG . . 3.320 2.800 2.153 3.289 . 0 0 "[ . 1 . 2]" 1 2028 1 62 THR HA 1 63 LYS H . . 2.940 2.482 2.093 3.019 0.079 17 0 "[ . 1 . 2]" 1 2029 1 62 THR HA 1 63 LYS QB . . 4.730 4.337 4.037 4.815 0.085 1 0 "[ . 1 . 2]" 1 2030 1 62 THR HA 1 63 LYS QD . . 5.500 4.057 2.664 5.573 0.073 16 0 "[ . 1 . 2]" 1 2031 1 62 THR HA 1 63 LYS QG . . 4.760 3.942 3.216 4.845 0.085 17 0 "[ . 1 . 2]" 1 2032 1 62 THR HB 1 63 LYS H . . 3.870 3.222 2.145 3.945 0.075 17 0 "[ . 1 . 2]" 1 2033 1 62 THR MG 1 63 LYS H . . 3.900 3.272 2.471 3.765 . 0 0 "[ . 1 . 2]" 1 2034 1 62 THR MG 1 63 LYS HA . . 5.500 4.585 3.226 5.582 0.082 13 0 "[ . 1 . 2]" 1 2035 1 62 THR MG 1 63 LYS QB . . 5.340 4.874 3.381 5.446 0.106 11 0 "[ . 1 . 2]" 1 2036 1 62 THR MG 1 63 LYS QG . . 5.340 4.553 2.116 5.112 . 0 0 "[ . 1 . 2]" 1 2037 1 63 LYS H 1 63 LYS QB . . 3.380 3.125 2.442 3.456 0.076 13 0 "[ . 1 . 2]" 1 2038 1 63 LYS H 1 63 LYS QD . . 4.430 2.872 1.629 4.255 . 0 0 "[ . 1 . 2]" 1 2039 1 63 LYS H 1 63 LYS HE2 . . 5.500 4.414 2.522 5.469 . 0 0 "[ . 1 . 2]" 1 2040 1 63 LYS H 1 63 LYS HE3 . . 5.500 4.452 2.842 5.563 0.063 15 0 "[ . 1 . 2]" 1 2041 1 63 LYS H 1 64 GLY H . . 4.770 4.237 1.664 4.667 . 0 0 "[ . 1 . 2]" 1 2042 1 63 LYS HA 1 63 LYS QD . . 4.060 3.695 2.170 4.146 0.086 4 0 "[ . 1 . 2]" 1 2043 1 63 LYS HA 1 64 GLY H . . 3.240 2.676 2.300 3.314 0.074 18 0 "[ . 1 . 2]" 1 2044 1 63 LYS QB 1 64 GLY H . . 4.210 2.422 1.683 3.909 . 0 0 "[ . 1 . 2]" 1 2045 1 63 LYS QB 1 64 GLY QA . . 3.950 3.804 3.345 4.053 0.103 19 0 "[ . 1 . 2]" 1 2046 1 63 LYS QD 1 63 LYS HG2 . . 2.770 2.372 2.127 2.551 . 0 0 "[ . 1 . 2]" 1 2047 1 63 LYS QD 1 63 LYS QG . . 2.410 2.101 2.010 2.136 . 0 0 "[ . 1 . 2]" 1 2048 1 63 LYS QD 1 63 LYS HG3 . . 2.770 2.361 2.192 2.556 . 0 0 "[ . 1 . 2]" 1 2049 1 63 LYS QD 1 64 GLY QA . . 5.500 4.506 2.606 5.602 0.102 11 0 "[ . 1 . 2]" 1 2050 1 63 LYS QE 1 63 LYS QG . . 3.270 2.237 2.016 2.561 . 0 0 "[ . 1 . 2]" 1 2051 1 63 LYS HG2 1 64 GLY QA . . 5.500 4.851 2.912 5.585 0.085 1 0 "[ . 1 . 2]" 1 2052 1 63 LYS HG3 1 64 GLY QA . . 5.500 4.849 3.672 5.601 0.101 17 0 "[ . 1 . 2]" 1 2053 1 64 GLY H 1 65 SER HA . . 5.500 5.078 4.537 5.558 0.058 17 0 "[ . 1 . 2]" 1 2054 1 65 SER H 1 65 SER QB . . 3.560 2.833 2.239 3.527 . 0 0 "[ . 1 . 2]" 1 2055 1 65 SER H 1 66 GLY QA . . 5.500 4.599 3.680 5.415 . 0 0 "[ . 1 . 2]" 1 2056 1 65 SER HA 1 65 SER QB . . 2.660 2.349 2.132 2.489 . 0 0 "[ . 1 . 2]" 1 2057 1 65 SER QB 1 66 GLY H . . 3.250 2.472 1.877 3.317 0.067 5 0 "[ . 1 . 2]" 1 2058 1 65 SER QB 1 66 GLY QA . . 3.780 3.739 3.517 3.873 0.093 20 0 "[ . 1 . 2]" 1 2059 1 67 SER HA 1 68 GLY H . . 3.260 2.527 2.265 3.330 0.070 11 0 "[ . 1 . 2]" 1 2060 1 76 LEU H 1 76 LEU QB . . 2.760 2.188 2.013 2.442 . 0 0 "[ . 1 . 2]" 1 2061 1 76 LEU H 1 76 LEU MD1 . . 5.500 3.997 3.737 4.351 . 0 0 "[ . 1 . 2]" 1 2062 1 76 LEU H 1 76 LEU QD . . 4.580 2.677 2.101 3.641 . 0 0 "[ . 1 . 2]" 1 2063 1 76 LEU H 1 76 LEU MD2 . . 5.500 2.826 2.112 4.489 . 0 0 "[ . 1 . 2]" 1 2064 1 76 LEU H 1 76 LEU HG . . 4.570 4.092 3.761 4.416 . 0 0 "[ . 1 . 2]" 1 2065 1 76 LEU H 1 77 LEU H . . 3.210 2.935 2.699 3.150 . 0 0 "[ . 1 . 2]" 1 2066 1 76 LEU H 1 77 LEU HG . . 5.500 4.804 4.337 5.385 . 0 0 "[ . 1 . 2]" 1 2067 1 76 LEU H 1 78 LYS H . . 4.520 4.571 4.430 4.629 0.109 2 0 "[ . 1 . 2]" 1 2068 1 76 LEU H 1 79 GLU QB . . 5.280 4.882 4.096 5.365 0.085 4 0 "[ . 1 . 2]" 1 2069 1 76 LEU HA 1 76 LEU MD1 . . 3.260 2.323 2.037 3.346 0.086 18 0 "[ . 1 . 2]" 1 2070 1 76 LEU HA 1 76 LEU QD . . 2.670 2.104 1.863 2.786 0.116 8 0 "[ . 1 . 2]" 1 2071 1 76 LEU HA 1 76 LEU MD2 . . 3.260 2.487 1.916 3.351 0.091 13 0 "[ . 1 . 2]" 1 2072 1 76 LEU HA 1 77 LEU HG . . 5.500 5.357 4.818 5.553 0.053 10 0 "[ . 1 . 2]" 1 2073 1 76 LEU HA 1 78 LYS H . . 4.860 3.996 3.601 4.622 . 0 0 "[ . 1 . 2]" 1 2074 1 76 LEU HA 1 78 LYS QG . . 5.340 3.915 3.014 5.008 . 0 0 "[ . 1 . 2]" 1 2075 1 76 LEU HA 1 79 GLU H . . 3.830 3.207 2.776 3.636 . 0 0 "[ . 1 . 2]" 1 2076 1 76 LEU HA 1 79 GLU HA . . 5.500 5.235 4.859 5.559 0.059 19 0 "[ . 1 . 2]" 1 2077 1 76 LEU HA 1 79 GLU QB . . 5.460 2.572 2.042 2.974 . 0 0 "[ . 1 . 2]" 1 2078 1 76 LEU QB 1 76 LEU QD . . 2.490 2.051 1.897 2.101 . 0 0 "[ . 1 . 2]" 1 2079 1 76 LEU QB 1 77 LEU H . . 3.760 2.977 2.509 3.203 . 0 0 "[ . 1 . 2]" 1 2080 1 76 LEU QB 1 79 GLU QG . . 5.340 5.267 4.791 5.487 0.147 2 0 "[ . 1 . 2]" 1 2081 1 76 LEU QD 1 77 LEU H . . 5.440 4.075 3.776 4.196 . 0 0 "[ . 1 . 2]" 1 2082 1 76 LEU QD 1 79 GLU H . . 4.440 3.978 3.307 4.526 0.086 8 0 "[ . 1 . 2]" 1 2083 1 76 LEU QD 1 79 GLU QB . . 3.500 2.522 1.933 3.169 . 0 0 "[ . 1 . 2]" 1 2084 1 76 LEU QD 1 79 GLU QG . . 5.440 3.236 2.380 3.767 . 0 0 "[ . 1 . 2]" 1 2085 1 76 LEU QD 1 80 LYS H . . 4.820 3.708 2.812 4.173 . 0 0 "[ . 1 . 2]" 1 2086 1 76 LEU QD 1 80 LYS QB . . 5.440 4.466 3.561 5.369 . 0 0 "[ . 1 . 2]" 1 2087 1 76 LEU QD 1 80 LYS QD . . 5.440 3.647 2.104 5.165 . 0 0 "[ . 1 . 2]" 1 2088 1 76 LEU QD 1 80 LYS QG . . 5.280 2.851 2.012 3.846 . 0 0 "[ . 1 . 2]" 1 2089 1 76 LEU MD1 1 79 GLU H . . 5.500 4.362 3.390 5.584 0.084 18 0 "[ . 1 . 2]" 1 2090 1 76 LEU MD1 1 79 GLU QB . . 4.040 2.707 1.944 4.091 0.051 18 0 "[ . 1 . 2]" 1 2091 1 76 LEU MD2 1 79 GLU H . . 5.500 4.883 3.731 5.271 . 0 0 "[ . 1 . 2]" 1 2092 1 76 LEU MD2 1 79 GLU QB . . 4.040 3.634 2.493 4.131 0.091 5 0 "[ . 1 . 2]" 1 2093 1 76 LEU HG 1 80 LYS QG . . 5.340 4.693 3.221 5.403 0.063 11 0 "[ . 1 . 2]" 1 2094 1 77 LEU H 1 77 LEU HB3 . . 2.800 2.481 2.255 2.706 . 0 0 "[ . 1 . 2]" 1 2095 1 77 LEU H 1 77 LEU MD1 . . 4.410 3.965 3.829 4.080 . 0 0 "[ . 1 . 2]" 1 2096 1 77 LEU H 1 77 LEU QD . . 3.820 2.773 1.724 3.213 . 0 0 "[ . 1 . 2]" 1 2097 1 77 LEU H 1 77 LEU MD2 . . 4.410 2.854 1.726 3.375 . 0 0 "[ . 1 . 2]" 1 2098 1 77 LEU H 1 77 LEU HG . . 2.820 2.551 2.270 2.873 0.053 18 0 "[ . 1 . 2]" 1 2099 1 77 LEU H 1 78 LYS QG . . 4.720 4.462 4.122 4.758 0.038 20 0 "[ . 1 . 2]" 1 2100 1 77 LEU HA 1 77 LEU HB2 . . 2.790 2.391 2.314 2.497 . 0 0 "[ . 1 . 2]" 1 2101 1 77 LEU HA 1 77 LEU HB3 . . 3.000 2.452 2.365 2.550 . 0 0 "[ . 1 . 2]" 1 2102 1 77 LEU HA 1 77 LEU QD . . 3.630 3.444 3.338 3.492 . 0 0 "[ . 1 . 2]" 1 2103 1 77 LEU HA 1 80 LYS QB . . 3.600 3.101 2.220 3.670 0.070 17 0 "[ . 1 . 2]" 1 2104 1 77 LEU HA 1 80 LYS QG . . 4.570 3.388 1.722 4.446 . 0 0 "[ . 1 . 2]" 1 2105 1 77 LEU HB2 1 77 LEU MD1 . . 3.660 2.256 2.091 2.309 . 0 0 "[ . 1 . 2]" 1 2106 1 77 LEU HB2 1 77 LEU MD2 . . 3.660 2.782 2.553 3.176 . 0 0 "[ . 1 . 2]" 1 2107 1 77 LEU HB2 1 78 LYS H . . 4.160 4.030 3.737 4.192 0.032 5 0 "[ . 1 . 2]" 1 2108 1 77 LEU HB3 1 77 LEU QD . . 2.970 2.166 2.150 2.180 . 0 0 "[ . 1 . 2]" 1 2109 1 77 LEU QD 1 78 LYS H . . 5.440 2.892 2.443 3.336 . 0 0 "[ . 1 . 2]" 1 2110 1 77 LEU QD 1 78 LYS HB3 . . 5.440 3.114 2.406 3.983 . 0 0 "[ . 1 . 2]" 1 2111 1 77 LEU QD 1 81 ARG QD . . 5.440 3.257 1.743 4.033 . 0 0 "[ . 1 . 2]" 1 2112 1 77 LEU HG 1 78 LYS H . . 3.100 2.256 1.684 2.494 . 0 0 "[ . 1 . 2]" 1 2113 1 77 LEU HG 1 78 LYS HB3 . . 3.710 3.592 3.059 3.757 0.047 5 0 "[ . 1 . 2]" 1 2114 1 77 LEU HG 1 78 LYS QG . . 5.340 4.023 2.915 4.793 . 0 0 "[ . 1 . 2]" 1 2115 1 78 LYS H 1 78 LYS HB3 . . 2.970 2.566 2.293 2.993 0.023 8 0 "[ . 1 . 2]" 1 2116 1 78 LYS H 1 78 LYS QD . . 4.090 3.846 3.379 4.156 0.066 18 0 "[ . 1 . 2]" 1 2117 1 78 LYS H 1 78 LYS HE2 . . 5.500 5.429 4.813 5.564 0.064 14 0 "[ . 1 . 2]" 1 2118 1 78 LYS H 1 78 LYS HE3 . . 5.500 5.264 4.851 5.747 0.247 2 0 "[ . 1 . 2]" 1 2119 1 78 LYS H 1 78 LYS HG2 . . 4.010 2.747 1.829 3.571 . 0 0 "[ . 1 . 2]" 1 2120 1 78 LYS H 1 78 LYS QG . . 3.240 2.353 1.817 2.723 . 0 0 "[ . 1 . 2]" 1 2121 1 78 LYS H 1 78 LYS HG3 . . 4.010 3.133 2.194 3.971 . 0 0 "[ . 1 . 2]" 1 2122 1 78 LYS H 1 79 GLU QB . . 4.540 4.197 3.892 4.502 . 0 0 "[ . 1 . 2]" 1 2123 1 78 LYS H 1 80 LYS H . . 5.160 4.206 4.004 4.400 . 0 0 "[ . 1 . 2]" 1 2124 1 78 LYS H 1 81 ARG QB . . 5.340 5.152 4.469 5.902 0.562 2 1 "[ + . 1 . 2]" 1 2125 1 78 LYS H 1 81 ARG QD . . 5.500 5.107 3.798 5.577 0.077 12 0 "[ . 1 . 2]" 1 2126 1 78 LYS HA 1 78 LYS HE2 . . 5.500 4.964 4.299 5.556 0.056 1 0 "[ . 1 . 2]" 1 2127 1 78 LYS HA 1 78 LYS HE3 . . 5.500 4.982 4.352 5.561 0.061 14 0 "[ . 1 . 2]" 1 2128 1 78 LYS HA 1 81 ARG QB . . 5.340 2.833 2.225 3.623 . 0 0 "[ . 1 . 2]" 1 2129 1 78 LYS HA 1 81 ARG QD . . 3.210 2.930 2.232 3.278 0.068 13 0 "[ . 1 . 2]" 1 2130 1 78 LYS HB2 1 78 LYS QE . . 3.730 2.283 2.060 2.421 . 0 0 "[ . 1 . 2]" 1 2131 1 78 LYS HB3 1 78 LYS QE . . 3.830 3.064 2.516 3.645 . 0 0 "[ . 1 . 2]" 1 2132 1 78 LYS QD 1 79 GLU H . . 4.400 3.738 2.750 4.431 0.031 6 0 "[ . 1 . 2]" 1 2133 1 78 LYS QD 1 79 GLU HA . . 5.500 4.440 2.757 5.590 0.090 3 0 "[ . 1 . 2]" 1 2134 1 78 LYS QD 1 79 GLU QB . . 5.500 4.005 2.745 5.113 . 0 0 "[ . 1 . 2]" 1 2135 1 78 LYS QE 1 78 LYS QG . . 3.310 2.234 2.047 2.428 . 0 0 "[ . 1 . 2]" 1 2136 1 78 LYS QE 1 79 GLU HA . . 5.340 4.886 3.280 5.413 0.073 13 0 "[ . 1 . 2]" 1 2137 1 78 LYS QG 1 79 GLU H . . 3.960 2.196 1.937 2.655 . 0 0 "[ . 1 . 2]" 1 2138 1 79 GLU H 1 79 GLU QB . . 2.830 2.173 2.076 2.271 . 0 0 "[ . 1 . 2]" 1 2139 1 79 GLU H 1 79 GLU QG . . 4.000 3.930 3.850 3.995 . 0 0 "[ . 1 . 2]" 1 2140 1 79 GLU H 1 80 LYS H . . 3.240 2.737 2.445 2.956 . 0 0 "[ . 1 . 2]" 1 2141 1 79 GLU HA 1 79 GLU QG . . 3.520 2.526 2.321 3.031 . 0 0 "[ . 1 . 2]" 1 2142 1 79 GLU HA 1 82 LYS QD . . 2.850 2.737 2.047 2.934 0.084 17 0 "[ . 1 . 2]" 1 2143 1 79 GLU HA 1 82 LYS HE2 . . 5.500 3.144 1.947 4.407 . 0 0 "[ . 1 . 2]" 1 2144 1 79 GLU HA 1 82 LYS QE . . 4.660 2.697 1.935 3.894 . 0 0 "[ . 1 . 2]" 1 2145 1 79 GLU HA 1 82 LYS HE3 . . 5.500 3.481 2.307 4.434 . 0 0 "[ . 1 . 2]" 1 2146 1 79 GLU HA 1 82 LYS HG2 . . 3.820 2.530 2.035 3.895 0.075 13 0 "[ . 1 . 2]" 1 2147 1 79 GLU HA 1 82 LYS QG . . 2.990 2.176 2.008 2.523 . 0 0 "[ . 1 . 2]" 1 2148 1 79 GLU HA 1 82 LYS HG3 . . 3.820 3.061 2.068 3.881 0.061 19 0 "[ . 1 . 2]" 1 2149 1 79 GLU QB 1 80 LYS H . . 3.140 2.509 2.251 2.909 . 0 0 "[ . 1 . 2]" 1 2150 1 79 GLU QB 1 80 LYS QD . . 5.500 4.591 2.973 5.543 0.043 20 0 "[ . 1 . 2]" 1 2151 1 79 GLU QB 1 82 LYS H . . 5.500 5.121 4.794 5.359 . 0 0 "[ . 1 . 2]" 1 2152 1 79 GLU QB 1 82 LYS HE2 . . 5.500 4.446 3.101 5.585 0.085 5 0 "[ . 1 . 2]" 1 2153 1 79 GLU QB 1 82 LYS HE3 . . 5.500 4.645 3.492 5.570 0.070 20 0 "[ . 1 . 2]" 1 2154 1 79 GLU QB 1 83 HIS H . . 5.210 5.213 4.623 5.287 0.077 3 0 "[ . 1 . 2]" 1 2155 1 79 GLU QG 1 80 LYS H . . 4.000 3.494 3.098 3.774 . 0 0 "[ . 1 . 2]" 1 2156 1 79 GLU QG 1 80 LYS HA . . 3.550 3.566 3.122 3.849 0.299 2 0 "[ . 1 . 2]" 1 2157 1 79 GLU QG 1 80 LYS QG . . 4.470 3.971 3.323 4.526 0.056 7 0 "[ . 1 . 2]" 1 2158 1 79 GLU QG 1 81 ARG H . . 5.310 5.227 4.932 5.582 0.272 2 0 "[ . 1 . 2]" 1 2159 1 79 GLU QG 1 82 LYS HE2 . . 5.500 4.105 2.070 5.575 0.075 17 0 "[ . 1 . 2]" 1 2160 1 79 GLU QG 1 82 LYS HE3 . . 5.500 4.052 2.521 5.580 0.080 7 0 "[ . 1 . 2]" 1 2161 1 79 GLU QG 1 82 LYS QG . . 4.870 3.517 3.046 4.193 . 0 0 "[ . 1 . 2]" 1 2162 1 80 LYS H 1 80 LYS HA . . 2.900 2.835 2.782 2.881 . 0 0 "[ . 1 . 2]" 1 2163 1 80 LYS H 1 80 LYS QB . . 2.800 2.523 2.210 2.875 0.075 2 0 "[ . 1 . 2]" 1 2164 1 80 LYS H 1 80 LYS QD . . 4.180 3.712 2.732 4.237 0.057 6 0 "[ . 1 . 2]" 1 2165 1 80 LYS H 1 80 LYS QG . . 3.580 2.303 1.444 2.785 . 0 0 "[ . 1 . 2]" 1 2166 1 80 LYS H 1 83 HIS QB . . 5.020 4.732 4.442 5.083 0.063 13 0 "[ . 1 . 2]" 1 2167 1 80 LYS HA 1 80 LYS QG . . 3.730 2.762 2.312 3.182 . 0 0 "[ . 1 . 2]" 1 2168 1 80 LYS HA 1 83 HIS H . . 3.990 3.378 3.187 3.651 . 0 0 "[ . 1 . 2]" 1 2169 1 80 LYS HA 1 83 HIS HA . . 5.500 5.249 4.957 5.555 0.055 11 0 "[ . 1 . 2]" 1 2170 1 80 LYS HA 1 83 HIS HB2 . . 4.290 3.026 2.336 5.093 0.803 2 1 "[ + . 1 . 2]" 1 2171 1 80 LYS HA 1 83 HIS QB . . 3.770 2.552 2.234 3.740 . 0 0 "[ . 1 . 2]" 1 2172 1 80 LYS HA 1 83 HIS HB3 . . 4.290 3.224 2.308 4.286 . 0 0 "[ . 1 . 2]" 1 2173 1 80 LYS QB 1 81 ARG H . . 2.990 2.761 2.356 3.063 0.073 8 0 "[ . 1 . 2]" 1 2174 1 80 LYS QG 1 81 ARG H . . 4.470 4.205 3.093 4.516 0.046 14 0 "[ . 1 . 2]" 1 2175 1 81 ARG H 1 81 ARG QB . . 3.030 2.267 1.925 2.924 . 0 0 "[ . 1 . 2]" 1 2176 1 81 ARG H 1 81 ARG QD . . 4.450 3.844 2.889 4.423 . 0 0 "[ . 1 . 2]" 1 2177 1 81 ARG H 1 81 ARG QG . . 3.560 2.786 1.463 3.665 0.105 15 0 "[ . 1 . 2]" 1 2178 1 81 ARG H 1 82 LYS H . . 3.590 2.814 2.538 2.996 . 0 0 "[ . 1 . 2]" 1 2179 1 81 ARG H 1 82 LYS QG . . 4.700 4.209 3.822 4.749 0.049 15 0 "[ . 1 . 2]" 1 2180 1 81 ARG HA 1 84 PHE QB . . 3.890 3.064 2.415 3.981 0.091 2 0 "[ . 1 . 2]" 1 2181 1 81 ARG QB 1 81 ARG QD . . 3.180 2.197 2.080 2.384 . 0 0 "[ . 1 . 2]" 1 2182 1 81 ARG QB 1 82 LYS H . . 3.030 2.653 2.363 3.092 0.062 10 0 "[ . 1 . 2]" 1 2183 1 81 ARG HB2 1 81 ARG QD . . 3.680 2.501 2.211 3.341 . 0 0 "[ . 1 . 2]" 1 2184 1 81 ARG HB3 1 81 ARG QD . . 3.680 2.540 2.260 3.193 . 0 0 "[ . 1 . 2]" 1 2185 1 81 ARG QD 1 82 LYS H . . 4.830 4.660 4.216 4.908 0.078 20 0 "[ . 1 . 2]" 1 2186 1 82 LYS H 1 82 LYS HB2 . . 3.710 3.561 2.646 3.708 . 0 0 "[ . 1 . 2]" 1 2187 1 82 LYS H 1 82 LYS HB3 . . 3.710 2.742 2.393 3.629 . 0 0 "[ . 1 . 2]" 1 2188 1 82 LYS H 1 82 LYS QD . . 4.200 3.877 3.444 4.260 0.060 11 0 "[ . 1 . 2]" 1 2189 1 82 LYS H 1 82 LYS HE2 . . 5.500 4.698 3.465 5.586 0.086 20 0 "[ . 1 . 2]" 1 2190 1 82 LYS H 1 82 LYS HE3 . . 5.500 5.167 3.878 5.570 0.070 19 0 "[ . 1 . 2]" 1 2191 1 82 LYS H 1 82 LYS HG2 . . 3.840 2.537 2.058 3.623 . 0 0 "[ . 1 . 2]" 1 2192 1 82 LYS H 1 82 LYS QG . . 3.320 2.148 1.702 2.552 . 0 0 "[ . 1 . 2]" 1 2193 1 82 LYS H 1 82 LYS HG3 . . 3.840 2.974 1.714 3.793 . 0 0 "[ . 1 . 2]" 1 2194 1 82 LYS H 1 85 GLN H . . 5.380 5.185 4.188 5.440 0.060 10 0 "[ . 1 . 2]" 1 2195 1 82 LYS HA 1 82 LYS QB . . 2.390 2.171 2.120 2.345 . 0 0 "[ . 1 . 2]" 1 2196 1 82 LYS HA 1 83 HIS HA . . 5.500 4.772 4.670 4.858 . 0 0 "[ . 1 . 2]" 1 2197 1 82 LYS QB 1 82 LYS QE . . 4.120 3.032 1.997 3.668 . 0 0 "[ . 1 . 2]" 1 2198 1 82 LYS QB 1 83 HIS H . . 4.000 3.528 2.396 3.823 . 0 0 "[ . 1 . 2]" 1 2199 1 82 LYS QB 1 83 HIS HA . . 5.340 4.449 3.771 4.833 . 0 0 "[ . 1 . 2]" 1 2200 1 82 LYS HB2 1 82 LYS HE2 . . 5.500 4.060 2.666 4.782 . 0 0 "[ . 1 . 2]" 1 2201 1 82 LYS HB2 1 82 LYS HE3 . . 5.500 4.184 2.767 4.752 . 0 0 "[ . 1 . 2]" 1 2202 1 82 LYS HB3 1 82 LYS HE2 . . 5.500 3.812 2.097 4.673 . 0 0 "[ . 1 . 2]" 1 2203 1 82 LYS HB3 1 82 LYS HE3 . . 5.500 4.256 2.066 5.068 . 0 0 "[ . 1 . 2]" 1 2204 1 82 LYS QD 1 83 HIS H . . 4.640 4.080 2.534 4.706 0.066 9 0 "[ . 1 . 2]" 1 2205 1 82 LYS QG 1 83 HIS H . . 3.950 2.611 1.683 3.996 0.046 13 0 "[ . 1 . 2]" 1 2206 1 83 HIS H 1 83 HIS QB . . 3.450 2.250 2.094 2.410 . 0 0 "[ . 1 . 2]" 1 2207 1 83 HIS H 1 84 PHE H . . 4.500 2.761 2.508 2.969 . 0 0 "[ . 1 . 2]" 1 2208 1 83 HIS HA 1 85 GLN H . . 5.500 4.432 3.309 4.853 . 0 0 "[ . 1 . 2]" 1 2209 1 83 HIS HA 1 86 ALA MB . . 4.050 4.058 3.319 4.765 0.715 2 1 "[ + . 1 . 2]" 1 2210 1 83 HIS QB 1 85 GLN H . . 5.180 5.008 4.483 5.239 0.059 16 0 "[ . 1 . 2]" 1 2211 1 84 PHE H 1 84 PHE QB . . 3.140 2.174 2.013 2.323 . 0 0 "[ . 1 . 2]" 1 2212 1 84 PHE HA 1 85 GLN QG . . 4.920 4.425 3.928 4.985 0.065 1 0 "[ . 1 . 2]" 1 2213 1 84 PHE QB 1 85 GLN H . . 3.290 2.697 2.325 3.339 0.049 17 0 "[ . 1 . 2]" 1 2214 1 84 PHE QB 1 85 GLN QG . . 5.340 2.968 2.414 3.717 . 0 0 "[ . 1 . 2]" 1 2215 1 85 GLN H 1 85 GLN QG . . 3.530 3.032 2.303 3.605 0.075 18 0 "[ . 1 . 2]" 1 2216 1 85 GLN HA 1 85 GLN HB2 . . 2.980 2.804 2.425 3.041 0.061 15 0 "[ . 1 . 2]" 1 2217 1 85 GLN HA 1 85 GLN HB3 . . 2.980 2.444 2.252 2.674 . 0 0 "[ . 1 . 2]" 1 2218 1 85 GLN HA 1 85 GLN QG . . 3.730 2.920 2.226 3.457 . 0 0 "[ . 1 . 2]" 1 2219 1 85 GLN HA 1 86 ALA H . . 2.720 2.170 2.000 2.543 . 0 0 "[ . 1 . 2]" 1 2220 1 85 GLN HA 1 86 ALA MB . . 5.210 4.060 3.891 4.465 . 0 0 "[ . 1 . 2]" 1 2221 1 85 GLN QB 1 86 ALA H . . 3.770 3.247 2.184 3.768 . 0 0 "[ . 1 . 2]" 1 2222 1 85 GLN QB 1 86 ALA HA . . 5.340 4.195 3.953 4.685 . 0 0 "[ . 1 . 2]" 1 2223 1 85 GLN HB2 1 86 ALA MB . . 5.500 4.881 3.672 5.477 . 0 0 "[ . 1 . 2]" 1 2224 1 85 GLN HB3 1 86 ALA MB . . 5.500 5.114 3.846 5.590 0.090 11 0 "[ . 1 . 2]" 1 2225 1 85 GLN QG 1 86 ALA H . . 4.530 4.377 3.835 4.611 0.081 6 0 "[ . 1 . 2]" 1 2226 1 86 ALA H 1 86 ALA MB . . 2.960 2.776 2.429 3.111 0.151 2 0 "[ . 1 . 2]" 1 2227 1 86 ALA HA 1 87 GLU H . . 2.970 2.625 2.183 3.313 0.343 2 0 "[ . 1 . 2]" 1 2228 1 86 ALA MB 1 87 GLU H . . 3.260 2.660 1.709 3.361 0.101 19 0 "[ . 1 . 2]" 1 2229 1 86 ALA MB 1 87 GLU HA . . 5.300 4.201 3.595 4.800 . 0 0 "[ . 1 . 2]" 1 2230 1 86 ALA MB 1 87 GLU HB2 . . 5.500 4.805 3.937 5.581 0.081 16 0 "[ . 1 . 2]" 1 2231 1 86 ALA MB 1 87 GLU HB3 . . 5.500 5.112 3.981 5.592 0.092 17 0 "[ . 1 . 2]" 1 2232 1 86 ALA MB 1 87 GLU HG2 . . 5.500 4.663 3.478 5.569 0.069 7 0 "[ . 1 . 2]" 1 2233 1 86 ALA MB 1 87 GLU HG3 . . 5.500 4.823 3.104 5.593 0.093 5 0 "[ . 1 . 2]" 1 2234 1 87 GLU H 1 87 GLU HB2 . . 3.960 3.109 2.195 3.964 0.004 20 0 "[ . 1 . 2]" 1 2235 1 87 GLU H 1 87 GLU QB . . 3.210 2.755 2.173 3.279 0.069 19 0 "[ . 1 . 2]" 1 2236 1 87 GLU H 1 87 GLU HB3 . . 3.960 3.520 2.558 4.074 0.114 2 0 "[ . 1 . 2]" 1 2237 1 87 GLU H 1 87 GLU HG2 . . 3.970 3.140 2.012 4.030 0.060 4 0 "[ . 1 . 2]" 1 2238 1 87 GLU H 1 87 GLU QG . . 3.300 2.602 1.991 3.363 0.063 2 0 "[ . 1 . 2]" 1 2239 1 87 GLU H 1 87 GLU HG3 . . 3.970 3.246 2.271 4.714 0.744 2 1 "[ + . 1 . 2]" 1 2240 1 87 GLU HA 1 88 GLN H . . 3.080 2.634 2.128 3.546 0.466 2 0 "[ . 1 . 2]" 1 2241 1 87 GLU QB 1 88 GLN H . . 3.240 2.494 1.906 3.311 0.071 18 0 "[ . 1 . 2]" 1 2242 1 88 GLN H 1 88 GLN QG . . 3.280 2.758 1.916 3.356 0.076 8 0 "[ . 1 . 2]" 1 2243 1 88 GLN H 1 89 ASN H . . 4.830 4.101 1.725 4.640 . 0 0 "[ . 1 . 2]" 1 2244 1 88 GLN HA 1 88 GLN QG . . 3.990 2.941 2.288 3.523 . 0 0 "[ . 1 . 2]" 1 2245 1 88 GLN HA 1 89 ASN H . . 2.980 2.482 2.022 3.279 0.299 2 0 "[ . 1 . 2]" 1 2246 1 88 GLN HA 1 89 ASN HB2 . . 5.500 4.577 4.058 5.565 0.065 17 0 "[ . 1 . 2]" 1 2247 1 88 GLN HA 1 89 ASN HB3 . . 5.500 5.165 4.208 5.709 0.209 2 0 "[ . 1 . 2]" 1 2248 1 88 GLN HA 1 90 SER H . . 5.100 4.138 3.165 4.918 . 0 0 "[ . 1 . 2]" 1 2249 1 88 GLN QB 1 89 ASN H . . 3.610 2.578 1.894 3.701 0.091 15 0 "[ . 1 . 2]" 1 2250 1 88 GLN QB 1 90 SER H . . 5.300 2.695 2.302 3.135 . 0 0 "[ . 1 . 2]" 1 2251 1 88 GLN QB 1 90 SER QB . . 5.180 3.946 2.861 5.172 . 0 0 "[ . 1 . 2]" 1 2252 1 88 GLN QB 1 91 SER H . . 5.340 5.079 3.647 5.412 0.072 8 0 "[ . 1 . 2]" 1 2253 1 88 GLN HB2 1 89 ASN H . . 4.300 3.157 2.194 4.380 0.080 10 0 "[ . 1 . 2]" 1 2254 1 88 GLN HB2 1 90 SER HA . . 5.500 4.543 3.830 5.561 0.061 17 0 "[ . 1 . 2]" 1 2255 1 88 GLN HB3 1 89 ASN H . . 4.300 3.184 1.923 4.435 0.135 2 0 "[ . 1 . 2]" 1 2256 1 88 GLN HB3 1 90 SER HA . . 5.500 4.848 3.239 5.562 0.062 6 0 "[ . 1 . 2]" 1 2257 1 88 GLN QG 1 89 ASN H . . 4.320 3.928 3.068 4.403 0.083 16 0 "[ . 1 . 2]" 1 2258 1 88 GLN QG 1 90 SER QB . . 5.340 4.594 2.312 5.622 0.282 2 0 "[ . 1 . 2]" 1 2259 1 89 ASN H 1 89 ASN QB . . 3.510 2.609 2.135 3.533 0.023 16 0 "[ . 1 . 2]" 1 2260 1 89 ASN QB 1 90 SER H . . 4.330 3.228 2.598 4.108 . 0 0 "[ . 1 . 2]" 1 2261 1 89 ASN QB 1 90 SER HA . . 5.340 4.645 4.131 5.284 . 0 0 "[ . 1 . 2]" 1 2262 1 89 ASN QB 1 91 SER H . . 5.060 3.482 2.387 5.127 0.067 17 0 "[ . 1 . 2]" 1 2263 1 89 ASN QB 1 91 SER HA . . 5.340 5.013 3.985 5.425 0.085 5 0 "[ . 1 . 2]" 1 2264 1 90 SER HA 1 90 SER QB . . 2.600 2.442 2.143 2.575 . 0 0 "[ . 1 . 2]" 1 2265 1 91 SER H 1 92 GLN H . . 4.410 3.604 1.920 4.481 0.071 13 0 "[ . 1 . 2]" 1 2266 1 91 SER HA 1 92 GLN H . . 3.000 2.470 2.159 3.077 0.077 10 0 "[ . 1 . 2]" 1 2267 1 91 SER HA 1 92 GLN QB . . 5.500 4.442 3.941 4.907 . 0 0 "[ . 1 . 2]" 1 2268 1 91 SER HA 1 93 GLU H . . 5.500 3.452 2.982 4.180 . 0 0 "[ . 1 . 2]" 1 2269 1 91 SER HA 1 93 GLU QB . . 5.340 4.752 3.927 5.416 0.076 14 0 "[ . 1 . 2]" 1 2270 1 91 SER HA 1 94 TYR H . . 5.470 4.810 3.697 5.531 0.061 13 0 "[ . 1 . 2]" 1 2271 1 91 SER QB 1 92 GLN H . . 4.380 3.344 1.991 4.039 . 0 0 "[ . 1 . 2]" 1 2272 1 91 SER QB 1 93 GLU H . . 4.650 3.780 2.470 4.711 0.061 16 0 "[ . 1 . 2]" 1 2273 1 91 SER HB2 1 92 GLN H . . 5.210 3.831 2.211 4.648 . 0 0 "[ . 1 . 2]" 1 2274 1 91 SER HB3 1 92 GLN H . . 5.210 3.934 2.029 4.627 . 0 0 "[ . 1 . 2]" 1 2275 1 92 GLN H 1 93 GLU H . . 3.440 2.337 1.691 3.195 . 0 0 "[ . 1 . 2]" 1 2276 1 92 GLN H 1 94 TYR QD . . 4.980 3.872 2.969 4.752 . 0 0 "[ . 1 . 2]" 1 2277 1 92 GLN H 1 94 TYR QE . . 5.500 4.889 2.878 5.576 0.076 16 0 "[ . 1 . 2]" 1 2278 1 92 GLN HA 1 93 GLU H . . 3.060 3.115 2.918 3.367 0.307 2 0 "[ . 1 . 2]" 1 2279 1 92 GLN HA 1 94 TYR H . . 3.940 3.749 3.335 4.014 0.074 12 0 "[ . 1 . 2]" 1 2280 1 93 GLU H 1 93 GLU HB2 . . 3.470 2.955 2.382 3.554 0.084 16 0 "[ . 1 . 2]" 1 2281 1 93 GLU H 1 93 GLU QB . . 2.860 2.577 2.281 2.919 0.059 16 0 "[ . 1 . 2]" 1 2282 1 93 GLU H 1 93 GLU HB3 . . 3.470 2.885 2.726 3.155 . 0 0 "[ . 1 . 2]" 1 2283 1 93 GLU H 1 94 TYR H . . 3.410 2.163 1.808 2.623 . 0 0 "[ . 1 . 2]" 1 2284 1 93 GLU H 1 94 TYR HB2 . . 4.060 4.006 3.720 4.134 0.074 17 0 "[ . 1 . 2]" 1 2285 1 93 GLU H 1 94 TYR QD . . 4.200 2.798 2.400 3.391 . 0 0 "[ . 1 . 2]" 1 2286 1 93 GLU H 1 94 TYR QE . . 4.570 4.492 3.900 4.692 0.122 2 0 "[ . 1 . 2]" 1 2287 1 93 GLU HA 1 93 GLU QB . . 2.640 2.429 2.171 2.559 . 0 0 "[ . 1 . 2]" 1 2288 1 93 GLU HA 1 94 TYR H . . 3.060 3.096 2.638 3.143 0.083 16 0 "[ . 1 . 2]" 1 2289 1 93 GLU HA 1 94 TYR HA . . 5.500 4.701 4.617 4.822 . 0 0 "[ . 1 . 2]" 1 2290 1 93 GLU QB 1 94 TYR H . . 4.090 3.616 3.226 4.002 . 0 0 "[ . 1 . 2]" 1 2291 1 94 TYR H 1 94 TYR HB2 . . 3.150 2.338 2.200 2.441 . 0 0 "[ . 1 . 2]" 1 2292 1 94 TYR H 1 94 TYR HB3 . . 3.690 3.595 3.490 3.672 . 0 0 "[ . 1 . 2]" 1 2293 1 94 TYR H 1 94 TYR QD . . 3.220 2.613 2.246 2.894 . 0 0 "[ . 1 . 2]" 1 2294 1 94 TYR H 1 95 LEU H . . 4.570 4.443 4.349 4.583 0.013 16 0 "[ . 1 . 2]" 1 2295 1 94 TYR H 1 95 LEU HB3 . . 5.500 5.505 5.299 5.586 0.086 2 0 "[ . 1 . 2]" 1 2296 1 94 TYR HA 1 95 LEU H . . 3.370 2.122 2.038 2.184 . 0 0 "[ . 1 . 2]" 1 2297 1 94 TYR HA 1 95 LEU HA . . 5.500 4.404 4.355 4.435 . 0 0 "[ . 1 . 2]" 1 2298 1 94 TYR HA 1 95 LEU HB3 . . 5.220 4.606 4.494 4.772 . 0 0 "[ . 1 . 2]" 1 2299 1 94 TYR HA 1 95 LEU QD . . 5.440 4.150 3.839 4.356 . 0 0 "[ . 1 . 2]" 1 2300 1 94 TYR HA 1 96 ARG HG3 . . 5.500 4.990 4.693 5.270 . 0 0 "[ . 1 . 2]" 1 2301 1 94 TYR HB2 1 95 LEU H . . 4.680 4.454 4.373 4.528 . 0 0 "[ . 1 . 2]" 1 2302 1 94 TYR HB3 1 95 LEU H . . 3.760 3.536 3.337 3.712 . 0 0 "[ . 1 . 2]" 1 2303 1 94 TYR HB3 1 96 ARG HG3 . . 4.120 3.403 3.036 3.817 . 0 0 "[ . 1 . 2]" 1 2304 1 94 TYR QD 1 95 LEU H . . 4.540 4.197 3.749 4.468 . 0 0 "[ . 1 . 2]" 1 2305 1 94 TYR QD 1 96 ARG HG2 . . 5.500 4.358 3.728 4.745 . 0 0 "[ . 1 . 2]" 1 2306 1 94 TYR QD 1 96 ARG HG3 . . 5.330 4.522 3.841 5.052 . 0 0 "[ . 1 . 2]" 1 2307 1 95 LEU H 1 95 LEU HB2 . . 3.880 3.756 3.696 3.853 . 0 0 "[ . 1 . 2]" 1 2308 1 95 LEU H 1 95 LEU MD1 . . 3.740 3.474 3.312 3.711 . 0 0 "[ . 1 . 2]" 1 2309 1 95 LEU H 1 95 LEU QD . . 3.260 2.975 2.759 3.078 . 0 0 "[ . 1 . 2]" 1 2310 1 95 LEU H 1 95 LEU MD2 . . 3.740 3.264 2.845 3.640 . 0 0 "[ . 1 . 2]" 1 2311 1 95 LEU H 1 95 LEU HG . . 3.090 2.022 1.910 2.150 . 0 0 "[ . 1 . 2]" 1 2312 1 95 LEU H 1 96 ARG H . . 4.550 4.390 4.277 4.483 . 0 0 "[ . 1 . 2]" 1 2313 1 95 LEU HA 1 95 LEU HB2 . . 2.850 2.420 2.381 2.485 . 0 0 "[ . 1 . 2]" 1 2314 1 95 LEU HA 1 95 LEU MD1 . . 4.110 3.720 3.647 3.756 . 0 0 "[ . 1 . 2]" 1 2315 1 95 LEU HA 1 95 LEU QD . . 3.430 3.423 3.385 3.448 0.018 12 0 "[ . 1 . 2]" 1 2316 1 95 LEU HA 1 95 LEU MD2 . . 4.110 4.003 3.949 4.066 . 0 0 "[ . 1 . 2]" 1 2317 1 95 LEU HA 1 95 LEU HG . . 4.120 3.660 3.606 3.725 . 0 0 "[ . 1 . 2]" 1 2318 1 95 LEU HA 1 96 ARG H . . 2.950 2.163 2.052 2.240 . 0 0 "[ . 1 . 2]" 1 2319 1 95 LEU HA 1 96 ARG HG3 . . 4.140 3.620 3.331 4.018 . 0 0 "[ . 1 . 2]" 1 2320 1 95 LEU HB2 1 96 ARG H . . 3.240 3.153 2.854 3.449 0.209 2 0 "[ . 1 . 2]" 1 2321 1 95 LEU QD 1 96 ARG H . . 3.650 3.691 3.496 3.915 0.265 2 0 "[ . 1 . 2]" 1 2322 1 95 LEU QD 1 96 ARG HA . . 5.440 3.532 3.445 3.696 . 0 0 "[ . 1 . 2]" 1 2323 1 95 LEU QD 1 97 GLY H . . 4.890 4.993 4.977 5.012 0.122 2 0 "[ . 1 . 2]" 1 2324 1 95 LEU QD 1 97 GLY QA . . 5.280 5.024 4.881 5.166 . 0 0 "[ . 1 . 2]" 1 2325 1 96 ARG H 1 96 ARG HB2 . . 3.370 2.856 2.780 2.951 . 0 0 "[ . 1 . 2]" 1 2326 1 96 ARG H 1 96 ARG HB3 . . 4.000 3.875 3.808 3.915 . 0 0 "[ . 1 . 2]" 1 2327 1 96 ARG H 1 96 ARG HD2 . . 5.500 4.623 2.653 5.562 0.062 12 0 "[ . 1 . 2]" 1 2328 1 96 ARG H 1 96 ARG HD3 . . 5.500 5.289 4.026 5.556 0.056 8 0 "[ . 1 . 2]" 1 2329 1 96 ARG H 1 96 ARG HG3 . . 3.190 3.062 2.581 3.259 0.069 18 0 "[ . 1 . 2]" 1 2330 1 96 ARG H 1 97 GLY H . . 4.450 4.373 4.316 4.472 0.022 2 0 "[ . 1 . 2]" 1 2331 1 96 ARG H 1 97 GLY QA . . 5.340 4.449 4.359 4.587 . 0 0 "[ . 1 . 2]" 1 2332 1 96 ARG HA 1 96 ARG HD2 . . 5.500 4.644 4.086 4.823 . 0 0 "[ . 1 . 2]" 1 2333 1 96 ARG HA 1 96 ARG QD . . 4.830 4.013 3.843 4.179 . 0 0 "[ . 1 . 2]" 1 2334 1 96 ARG HA 1 96 ARG HD3 . . 5.500 4.417 4.139 4.755 . 0 0 "[ . 1 . 2]" 1 2335 1 96 ARG HA 1 96 ARG HG2 . . 3.870 2.810 2.491 3.496 . 0 0 "[ . 1 . 2]" 1 2336 1 96 ARG HA 1 96 ARG HG3 . . 3.640 3.330 2.605 3.542 . 0 0 "[ . 1 . 2]" 1 2337 1 96 ARG HA 1 97 GLY H . . 3.030 2.344 2.279 2.423 . 0 0 "[ . 1 . 2]" 1 2338 1 96 ARG HA 1 97 GLY QA . . 4.860 3.970 3.916 4.003 . 0 0 "[ . 1 . 2]" 1 2339 1 96 ARG HB2 1 97 GLY H . . 4.250 3.501 3.391 3.748 . 0 0 "[ . 1 . 2]" 1 2340 1 96 ARG HB3 1 96 ARG QD . . 3.690 2.455 2.146 3.055 . 0 0 "[ . 1 . 2]" 1 2341 1 96 ARG HB3 1 97 GLY H . . 3.490 2.549 2.235 2.773 . 0 0 "[ . 1 . 2]" 1 2342 1 96 ARG HB3 1 97 GLY QA . . 5.340 4.106 3.811 4.245 . 0 0 "[ . 1 . 2]" 1 2343 1 96 ARG HD2 1 97 GLY H . . 5.500 5.372 4.988 5.579 0.079 12 0 "[ . 1 . 2]" 1 2344 1 96 ARG HD3 1 97 GLY H . . 5.500 5.078 4.648 5.558 0.058 18 0 "[ . 1 . 2]" 1 2345 1 96 ARG HG2 1 97 GLY H . . 5.500 4.430 4.015 4.645 . 0 0 "[ . 1 . 2]" 1 2346 1 96 ARG HG3 1 97 GLY H . . 5.500 5.004 4.512 5.193 . 0 0 "[ . 1 . 2]" 1 2347 1 97 GLY H 1 98 GLU H . . 4.350 4.383 4.319 4.408 0.058 9 0 "[ . 1 . 2]" 1 2348 1 97 GLY H 1 98 GLU HA . . 5.180 4.801 4.683 4.962 . 0 0 "[ . 1 . 2]" 1 2349 1 97 GLY QA 1 98 GLU H . . 2.570 2.258 2.187 2.296 . 0 0 "[ . 1 . 2]" 1 2350 1 97 GLY QA 1 98 GLU HA . . 4.870 4.017 3.943 4.042 . 0 0 "[ . 1 . 2]" 1 2351 1 97 GLY QA 1 98 GLU QB . . 4.760 3.652 3.513 3.799 . 0 0 "[ . 1 . 2]" 1 2352 1 97 GLY QA 1 99 ILE MD . . 5.310 4.051 3.833 4.263 . 0 0 "[ . 1 . 2]" 1 2353 1 97 GLY HA2 1 98 GLU H . . 3.000 2.555 2.449 2.812 . 0 0 "[ . 1 . 2]" 1 2354 1 97 GLY HA3 1 98 GLU H . . 3.000 2.532 2.316 2.626 . 0 0 "[ . 1 . 2]" 1 2355 1 98 GLU H 1 98 GLU HB2 . . 3.690 3.062 2.809 3.362 . 0 0 "[ . 1 . 2]" 1 2356 1 98 GLU H 1 98 GLU QB . . 3.180 2.511 2.330 2.815 . 0 0 "[ . 1 . 2]" 1 2357 1 98 GLU H 1 98 GLU HB3 . . 3.690 2.674 2.454 3.020 . 0 0 "[ . 1 . 2]" 1 2358 1 98 GLU H 1 98 GLU QG . . 4.500 4.088 3.993 4.189 . 0 0 "[ . 1 . 2]" 1 2359 1 98 GLU H 1 99 ILE H . . 4.250 4.138 3.841 4.298 0.048 18 0 "[ . 1 . 2]" 1 2360 1 98 GLU H 1 99 ILE MD . . 4.200 3.958 3.432 4.235 0.035 1 0 "[ . 1 . 2]" 1 2361 1 98 GLU HA 1 98 GLU QG . . 3.780 2.441 2.299 2.671 . 0 0 "[ . 1 . 2]" 1 2362 1 98 GLU HA 1 99 ILE H . . 3.180 2.182 2.088 2.304 . 0 0 "[ . 1 . 2]" 1 2363 1 98 GLU HA 1 99 ILE HA . . 4.650 4.466 4.408 4.523 . 0 0 "[ . 1 . 2]" 1 2364 1 98 GLU HA 1 99 ILE HB . . 5.440 4.380 4.103 4.582 . 0 0 "[ . 1 . 2]" 1 2365 1 98 GLU HA 1 99 ILE MD . . 4.120 4.194 4.151 4.212 0.092 3 0 "[ . 1 . 2]" 1 2366 1 98 GLU HA 1 99 ILE HG12 . . 5.280 3.867 3.696 4.182 . 0 0 "[ . 1 . 2]" 1 2367 1 98 GLU HA 1 99 ILE MG . . 5.500 5.428 5.243 5.520 0.020 19 0 "[ . 1 . 2]" 1 2368 1 98 GLU HB2 1 99 ILE H . . 5.500 4.486 4.351 4.624 . 0 0 "[ . 1 . 2]" 1 2369 1 98 GLU HB3 1 99 ILE H . . 5.500 4.387 4.253 4.514 . 0 0 "[ . 1 . 2]" 1 2370 1 98 GLU QG 1 99 ILE H . . 3.430 3.202 2.747 3.498 0.068 12 0 "[ . 1 . 2]" 1 2371 1 98 GLU QG 1 99 ILE HA . . 5.500 4.573 4.254 4.823 . 0 0 "[ . 1 . 2]" 1 2372 1 98 GLU QG 1 99 ILE MD . . 5.170 5.090 4.868 5.240 0.070 3 0 "[ . 1 . 2]" 1 2373 1 99 ILE H 1 99 ILE HB . . 3.210 2.236 2.059 2.524 . 0 0 "[ . 1 . 2]" 1 2374 1 99 ILE H 1 99 ILE MD . . 3.370 3.126 2.752 3.285 . 0 0 "[ . 1 . 2]" 1 2375 1 99 ILE H 1 99 ILE HG12 . . 3.620 2.339 2.143 2.639 . 0 0 "[ . 1 . 2]" 1 2376 1 99 ILE H 1 99 ILE HG13 . . 4.130 3.734 3.583 3.848 . 0 0 "[ . 1 . 2]" 1 2377 1 99 ILE H 1 99 ILE MG . . 3.860 3.663 3.531 3.762 . 0 0 "[ . 1 . 2]" 1 2378 1 99 ILE HA 1 99 ILE MD . . 2.920 2.025 1.894 2.108 . 0 0 "[ . 1 . 2]" 1 2379 1 99 ILE HA 1 99 ILE HG12 . . 3.510 3.253 3.166 3.355 . 0 0 "[ . 1 . 2]" 1 2380 1 99 ILE HA 1 99 ILE HG13 . . 3.760 3.721 3.595 3.777 0.017 4 0 "[ . 1 . 2]" 1 2381 1 99 ILE HA 1 99 ILE MG . . 3.060 2.594 2.339 2.704 . 0 0 "[ . 1 . 2]" 1 2382 1 99 ILE HG13 1 99 ILE MG . . 3.020 2.193 2.079 2.285 . 0 0 "[ . 1 . 2]" 1 stop_ save_
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