NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
591076 | 2n2j | 19390 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2n2j 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 2522 _Distance_constraint_stats_list.Viol_count 2015 _Distance_constraint_stats_list.Viol_total 1168.271 _Distance_constraint_stats_list.Viol_max 1.000 _Distance_constraint_stats_list.Viol_rms 0.0304 _Distance_constraint_stats_list.Viol_average_all_restraints 0.0046 _Distance_constraint_stats_list.Viol_average_violations_only 0.0580 _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 4 GLU 0.397 0.125 1 0 "[ . 1]" 1 5 MET 3.939 0.672 10 3 "[ * . - +]" 1 6 PRO 3.769 0.672 10 3 "[ * . - +]" 1 7 THR 1.541 0.101 2 0 "[ . 1]" 1 8 PHE 3.553 0.114 7 0 "[ . 1]" 1 9 TYR 0.842 0.194 2 0 "[ . 1]" 1 10 LEU 2.295 0.081 10 0 "[ . 1]" 1 11 ALA 3.574 0.207 6 0 "[ . 1]" 1 12 LEU 1.378 0.082 8 0 "[ . 1]" 1 13 HIS 0.603 0.136 10 0 "[ . 1]" 1 14 GLY 0.122 0.020 6 0 "[ . 1]" 1 15 GLY 1.230 0.109 2 0 "[ . 1]" 1 16 GLN 0.700 0.136 10 0 "[ . 1]" 1 17 THR 2.418 0.166 10 0 "[ . 1]" 1 18 TYR 2.212 0.154 7 0 "[ . 1]" 1 19 HIS 4.721 0.129 7 0 "[ . 1]" 1 20 LEU 4.187 0.176 7 0 "[ . 1]" 1 21 ILE 1.929 0.125 9 0 "[ . 1]" 1 22 VAL 2.781 0.108 10 0 "[ . 1]" 1 23 ASP 1.334 0.108 10 0 "[ . 1]" 1 24 THR 0.964 0.177 1 0 "[ . 1]" 1 25 ASP 0.288 0.071 7 0 "[ . 1]" 1 26 SER 0.000 0.000 . 0 "[ . 1]" 1 27 LEU 1.003 0.082 7 0 "[ . 1]" 1 28 GLY 0.465 0.076 6 0 "[ . 1]" 1 29 ASN 3.241 0.267 8 0 "[ . 1]" 1 30 PRO 1.865 0.329 1 0 "[ . 1]" 1 31 SER 2.883 0.329 1 0 "[ . 1]" 1 32 LEU 1.132 0.087 5 0 "[ . 1]" 1 33 SER 0.532 0.154 10 0 "[ . 1]" 1 34 VAL 2.083 0.154 10 0 "[ . 1]" 1 35 ILE 3.159 0.154 7 0 "[ . 1]" 1 36 PRO 0.480 0.065 10 0 "[ . 1]" 1 37 SER 0.963 0.128 1 0 "[ . 1]" 1 38 ASN 0.417 0.094 2 0 "[ . 1]" 1 39 PRO 0.199 0.065 1 0 "[ . 1]" 1 40 TYR 0.000 0.000 . 0 "[ . 1]" 1 41 GLN 0.574 0.115 5 0 "[ . 1]" 1 42 GLU 0.352 0.112 10 0 "[ . 1]" 1 43 GLN 0.540 0.106 2 0 "[ . 1]" 1 44 LEU 0.889 0.115 5 0 "[ . 1]" 1 45 SER 1.639 0.174 6 0 "[ . 1]" 1 46 ASP 0.000 0.000 . 0 "[ . 1]" 1 47 THR 1.032 0.136 4 0 "[ . 1]" 1 48 PRO 0.071 0.024 8 0 "[ . 1]" 1 49 LEU 2.774 0.207 6 0 "[ . 1]" 1 50 ILE 4.566 0.608 2 2 "[ + . - 1]" 1 51 PRO 9.649 1.000 8 2 "[ * . + 1]" 1 52 LEU 3.056 0.169 3 0 "[ . 1]" 1 53 THR 2.811 0.114 7 0 "[ . 1]" 1 54 ILE 2.235 0.134 1 0 "[ . 1]" 1 55 PHE 3.283 0.197 3 0 "[ . 1]" 1 56 VAL 5.625 0.320 2 0 "[ . 1]" 1 57 GLY 10.862 0.994 8 2 "[ - . + 1]" 1 58 GLU 1.475 0.292 10 0 "[ . 1]" 1 59 ASN 0.921 0.270 4 0 "[ . 1]" 1 60 THR 0.000 0.000 . 0 "[ . 1]" 2 4 GLU 0.402 0.130 1 0 "[ . 1]" 2 5 MET 3.944 0.669 10 3 "[ * . - +]" 2 6 PRO 3.749 0.669 10 3 "[ * . - +]" 2 7 THR 1.556 0.098 2 0 "[ . 1]" 2 8 PHE 3.581 0.115 7 0 "[ . 1]" 2 9 TYR 0.859 0.197 2 0 "[ . 1]" 2 10 LEU 2.245 0.080 5 0 "[ . 1]" 2 11 ALA 3.572 0.205 6 0 "[ . 1]" 2 12 LEU 1.328 0.077 8 0 "[ . 1]" 2 13 HIS 0.594 0.136 10 0 "[ . 1]" 2 14 GLY 0.188 0.031 10 0 "[ . 1]" 2 15 GLY 1.250 0.096 2 0 "[ . 1]" 2 16 GLN 0.683 0.136 10 0 "[ . 1]" 2 17 THR 2.456 0.176 7 0 "[ . 1]" 2 18 TYR 2.250 0.154 7 0 "[ . 1]" 2 19 HIS 4.765 0.129 7 0 "[ . 1]" 2 20 LEU 4.240 0.166 10 0 "[ . 1]" 2 21 ILE 1.960 0.125 8 0 "[ . 1]" 2 22 VAL 2.835 0.109 10 0 "[ . 1]" 2 23 ASP 1.262 0.109 10 0 "[ . 1]" 2 24 THR 0.989 0.174 1 0 "[ . 1]" 2 25 ASP 0.319 0.065 7 0 "[ . 1]" 2 26 SER 0.000 0.000 . 0 "[ . 1]" 2 27 LEU 1.025 0.080 2 0 "[ . 1]" 2 28 GLY 0.476 0.070 6 0 "[ . 1]" 2 29 ASN 3.260 0.272 8 0 "[ . 1]" 2 30 PRO 1.795 0.326 1 0 "[ . 1]" 2 31 SER 2.853 0.326 1 0 "[ . 1]" 2 32 LEU 1.101 0.082 5 0 "[ . 1]" 2 33 SER 0.523 0.151 10 0 "[ . 1]" 2 34 VAL 2.064 0.151 10 0 "[ . 1]" 2 35 ILE 3.133 0.154 7 0 "[ . 1]" 2 36 PRO 0.475 0.055 10 0 "[ . 1]" 2 37 SER 0.948 0.122 1 0 "[ . 1]" 2 38 ASN 0.423 0.100 2 0 "[ . 1]" 2 39 PRO 0.205 0.061 1 0 "[ . 1]" 2 40 TYR 0.000 0.000 . 0 "[ . 1]" 2 41 GLN 0.569 0.116 5 0 "[ . 1]" 2 42 GLU 0.347 0.115 10 0 "[ . 1]" 2 43 GLN 0.490 0.114 2 0 "[ . 1]" 2 44 LEU 0.836 0.116 5 0 "[ . 1]" 2 45 SER 1.618 0.177 6 0 "[ . 1]" 2 46 ASP 0.000 0.000 . 0 "[ . 1]" 2 47 THR 1.017 0.139 3 0 "[ . 1]" 2 48 PRO 0.072 0.025 8 0 "[ . 1]" 2 49 LEU 2.714 0.205 6 0 "[ . 1]" 2 50 ILE 4.571 0.624 2 2 "[ + . - 1]" 2 51 PRO 9.652 0.994 8 2 "[ - . + 1]" 2 52 LEU 2.430 0.179 3 0 "[ . 1]" 2 53 THR 2.924 0.115 7 0 "[ . 1]" 2 54 ILE 2.212 0.132 1 0 "[ . 1]" 2 55 PHE 3.201 0.195 3 0 "[ . 1]" 2 56 VAL 6.188 0.317 2 0 "[ . 1]" 2 57 GLY 10.811 1.000 8 2 "[ * . + 1]" 2 58 GLU 1.469 0.285 10 0 "[ . 1]" 2 59 ASN 0.949 0.275 4 0 "[ . 1]" 2 60 THR 0.000 0.000 . 0 "[ . 1]" 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 4 GLU HA 1 4 GLU QG 2.725 . 3.650 2.743 2.348 3.505 . 0 0 "[ . 1]" 1 2 1 4 GLU HA 1 5 MET H 2.435 . 3.070 2.392 2.112 3.082 0.012 1 0 "[ . 1]" 1 3 1 4 GLU HA 1 5 MET HA 3.280 . 4.760 4.463 4.356 4.737 . 0 0 "[ . 1]" 1 4 1 4 GLU HA 1 5 MET HG2 3.555 . 5.310 4.251 3.624 5.427 0.117 7 0 "[ . 1]" 1 5 1 4 GLU HA 1 5 MET QG 3.160 . 4.520 3.864 3.443 4.479 . 0 0 "[ . 1]" 1 6 1 4 GLU HA 1 5 MET HG3 3.555 . 5.310 4.938 3.528 5.435 0.125 1 0 "[ . 1]" 1 7 1 4 GLU QB 1 4 GLU QG 2.050 . 2.300 2.051 1.990 2.086 . 0 0 "[ . 1]" 1 8 1 4 GLU HB2 1 4 GLU QG 2.370 . 2.940 2.298 2.144 2.365 . 0 0 "[ . 1]" 1 9 1 4 GLU HB3 1 4 GLU QG 2.370 . 2.940 2.323 2.162 2.438 . 0 0 "[ . 1]" 1 10 1 4 GLU QG 1 5 MET H 3.295 . 4.790 3.858 2.430 4.482 . 0 0 "[ . 1]" 1 11 1 5 MET H 1 5 MET HB2 2.910 . 4.020 3.466 2.602 3.780 . 0 0 "[ . 1]" 1 12 1 5 MET H 1 5 MET HB3 2.910 . 4.020 3.094 2.655 3.782 . 0 0 "[ . 1]" 1 13 1 5 MET H 1 5 MET HG2 2.990 . 4.180 2.358 1.754 4.065 0.046 1 0 "[ . 1]" 1 14 1 5 MET H 1 5 MET HG3 2.990 . 4.180 2.999 2.613 3.285 . 0 0 "[ . 1]" 1 15 1 5 MET HA 1 5 MET ME 3.250 . 4.700 4.124 3.905 4.392 . 0 0 "[ . 1]" 1 16 1 5 MET HA 1 5 MET HG2 2.880 . 3.960 3.587 2.616 3.744 . 0 0 "[ . 1]" 1 17 1 5 MET HA 1 5 MET QG 2.635 . 3.470 3.182 2.492 3.351 . 0 0 "[ . 1]" 1 18 1 5 MET HA 1 5 MET HG3 2.880 . 3.960 3.628 2.713 3.842 . 0 0 "[ . 1]" 1 19 1 5 MET HA 1 6 PRO HA 3.265 . 4.730 4.397 4.350 4.511 . 0 0 "[ . 1]" 1 20 1 5 MET HA 1 6 PRO HB3 3.330 . 4.860 5.126 4.874 5.532 0.672 10 3 "[ * . - +]" 1 21 1 5 MET HA 1 6 PRO QD 2.155 . 2.510 1.906 1.722 2.131 0.078 9 0 "[ . 1]" 1 22 1 5 MET HA 1 6 PRO QG 3.095 . 4.390 3.809 3.622 4.019 . 0 0 "[ . 1]" 1 23 1 5 MET QB 1 6 PRO QD 2.585 . 3.370 2.571 1.955 3.205 . 0 0 "[ . 1]" 1 24 1 5 MET QB 1 55 PHE HB2 3.570 . 5.340 4.901 3.856 5.347 0.007 9 0 "[ . 1]" 1 25 1 5 MET QB 1 55 PHE HB3 3.165 . 4.530 3.367 2.310 3.788 . 0 0 "[ . 1]" 1 26 1 5 MET QB 1 55 PHE QD 3.165 . 4.530 3.580 2.354 3.899 . 0 0 "[ . 1]" 1 27 1 5 MET QB 1 57 GLY HA2 3.570 . 5.340 4.026 3.304 5.182 . 0 0 "[ . 1]" 1 28 1 5 MET HB2 1 6 PRO QD 2.905 . 4.010 2.864 2.334 4.203 0.193 8 0 "[ . 1]" 1 29 1 5 MET HB3 1 6 PRO QD 2.905 . 4.010 3.298 1.973 3.649 . 0 0 "[ . 1]" 1 30 1 5 MET ME 1 6 PRO QD 3.190 . 4.580 4.462 4.137 4.620 0.040 10 0 "[ . 1]" 1 31 1 5 MET ME 1 55 PHE HB2 3.365 . 4.930 3.792 2.515 4.881 . 0 0 "[ . 1]" 1 32 1 5 MET ME 1 57 GLY HA2 2.965 . 4.130 3.238 2.700 4.014 . 0 0 "[ . 1]" 1 33 1 5 MET ME 1 57 GLY HA3 3.350 . 4.900 3.916 2.500 4.701 . 0 0 "[ . 1]" 1 34 1 5 MET QG 1 55 PHE QD 3.570 . 5.340 2.560 1.767 5.133 0.033 10 0 "[ . 1]" 1 35 1 5 MET QG 1 56 VAL H 3.340 . 4.880 4.338 3.598 4.903 0.023 8 0 "[ . 1]" 1 36 1 5 MET HG2 1 6 PRO QD 3.265 . 4.730 4.619 3.926 4.843 0.113 4 0 "[ . 1]" 1 37 1 5 MET HG3 1 6 PRO QD 3.265 . 4.730 4.315 3.892 4.642 . 0 0 "[ . 1]" 1 38 1 6 PRO HA 1 7 THR H 2.265 . 2.730 2.153 2.132 2.188 . 0 0 "[ . 1]" 1 39 1 6 PRO HA 1 7 THR HA 3.435 . 5.070 4.365 4.346 4.384 . 0 0 "[ . 1]" 1 40 1 6 PRO HA 1 7 THR HB 3.365 . 4.930 4.680 4.564 4.790 . 0 0 "[ . 1]" 1 41 1 6 PRO HB2 1 7 THR H 3.015 . 4.230 3.583 3.273 3.991 . 0 0 "[ . 1]" 1 42 1 6 PRO HB2 1 7 THR HA 3.290 . 4.780 4.496 4.403 4.558 . 0 0 "[ . 1]" 1 43 1 6 PRO HB2 1 8 PHE QE 3.010 . 4.220 2.941 2.547 3.327 . 0 0 "[ . 1]" 1 44 1 6 PRO HB2 1 8 PHE HZ 3.300 . 4.800 4.110 3.790 4.873 0.073 10 0 "[ . 1]" 1 45 1 6 PRO HB2 1 56 VAL H 3.305 . 4.810 3.973 2.542 4.843 0.033 3 0 "[ . 1]" 1 46 1 6 PRO HB2 1 56 VAL HB 3.160 . 4.520 3.231 1.786 4.541 0.021 9 0 "[ . 1]" 1 47 1 6 PRO HB2 1 56 VAL QG 2.960 . 4.120 3.287 2.465 3.758 . 0 0 "[ . 1]" 1 48 1 6 PRO HB3 1 7 THR H 2.945 . 4.090 3.654 3.299 3.856 . 0 0 "[ . 1]" 1 49 1 6 PRO HB3 1 8 PHE QE 3.380 . 4.960 4.221 3.187 4.859 . 0 0 "[ . 1]" 1 50 1 6 PRO HB3 1 8 PHE HZ 3.595 . 5.390 4.831 3.882 5.365 . 0 0 "[ . 1]" 1 51 1 6 PRO HB3 1 56 VAL QG 3.345 . 4.890 4.126 3.471 4.486 . 0 0 "[ . 1]" 1 52 1 6 PRO QD 1 56 VAL H 2.960 . 4.120 3.747 3.009 4.147 0.027 7 0 "[ . 1]" 1 53 1 6 PRO QD 1 56 VAL HB 2.910 . 4.020 3.034 1.971 4.101 0.081 3 0 "[ . 1]" 1 54 1 6 PRO QD 1 56 VAL MG1 3.265 . 4.730 2.521 1.779 2.864 0.021 9 0 "[ . 1]" 1 55 1 6 PRO QD 1 56 VAL QG 2.955 . 4.110 2.491 1.776 2.827 0.024 9 0 "[ . 1]" 1 56 1 6 PRO QD 1 56 VAL MG2 3.265 . 4.730 4.105 3.611 4.387 . 0 0 "[ . 1]" 1 57 1 6 PRO QG 1 7 THR H 3.285 . 4.770 4.643 4.541 4.781 0.011 9 0 "[ . 1]" 1 58 1 7 THR H 1 7 THR HB 2.545 . 3.290 2.713 2.623 2.791 . 0 0 "[ . 1]" 1 59 1 7 THR H 1 7 THR MG 2.870 . 3.940 3.871 3.841 3.895 . 0 0 "[ . 1]" 1 60 1 7 THR H 1 8 PHE H 3.225 . 4.650 4.418 4.371 4.482 . 0 0 "[ . 1]" 1 61 1 7 THR H 1 8 PHE QD 3.395 . 4.990 4.812 4.634 4.992 0.002 9 0 "[ . 1]" 1 62 1 7 THR H 1 55 PHE HA 3.640 . 5.480 5.065 4.844 5.402 . 0 0 "[ . 1]" 1 63 1 7 THR HA 1 7 THR MG 2.510 . 3.220 2.306 2.273 2.334 . 0 0 "[ . 1]" 1 64 1 7 THR HA 1 8 PHE H 2.375 . 2.950 2.176 2.146 2.242 . 0 0 "[ . 1]" 1 65 1 7 THR HA 1 55 PHE HA 2.665 . 3.530 2.545 2.399 2.708 . 0 0 "[ . 1]" 1 66 1 7 THR HA 1 55 PHE HB3 3.210 . 4.620 4.530 4.361 4.664 0.044 7 0 "[ . 1]" 1 67 1 7 THR HA 1 55 PHE QD 3.045 . 4.290 3.786 3.516 4.038 . 0 0 "[ . 1]" 1 68 1 7 THR HA 1 56 VAL H 2.925 . 4.050 3.747 3.585 4.007 . 0 0 "[ . 1]" 1 69 1 7 THR HB 1 8 PHE H 2.940 . 4.080 3.946 3.786 4.007 . 0 0 "[ . 1]" 1 70 1 7 THR HB 1 8 PHE QD 3.650 . 5.500 5.570 5.551 5.601 0.101 2 0 "[ . 1]" 1 71 1 7 THR HB 1 53 THR MG 2.995 . 4.190 4.222 4.197 4.264 0.074 10 0 "[ . 1]" 1 72 1 7 THR HB 1 55 PHE HA 3.650 . 5.500 5.382 5.238 5.536 0.036 3 0 "[ . 1]" 1 73 1 7 THR HB 1 55 PHE HZ 3.650 . 5.500 5.507 5.418 5.536 0.036 2 0 "[ . 1]" 1 74 1 7 THR MG 1 8 PHE H 2.605 . 3.410 2.493 2.236 2.626 . 0 0 "[ . 1]" 1 75 1 7 THR MG 1 8 PHE HA 3.220 . 4.640 3.770 3.695 3.849 . 0 0 "[ . 1]" 1 76 1 7 THR MG 1 9 TYR HA 3.270 . 4.740 4.413 4.320 4.480 . 0 0 "[ . 1]" 1 77 1 7 THR MG 1 9 TYR QE 3.550 . 5.300 5.271 4.912 5.360 0.060 2 0 "[ . 1]" 1 78 1 7 THR MG 1 53 THR HA 3.030 . 4.260 3.901 3.770 3.995 . 0 0 "[ . 1]" 1 79 1 7 THR MG 1 53 THR MG 2.245 . 2.690 1.999 1.941 2.045 . 0 0 "[ . 1]" 1 80 1 7 THR MG 1 54 ILE H 2.805 . 3.810 3.609 3.414 3.811 0.001 10 0 "[ . 1]" 1 81 1 7 THR MG 1 55 PHE HA 2.905 . 4.010 3.436 3.090 3.776 . 0 0 "[ . 1]" 1 82 1 7 THR MG 1 55 PHE HB2 3.415 . 5.030 4.849 4.634 5.066 0.036 10 0 "[ . 1]" 1 83 1 7 THR MG 1 55 PHE HB3 3.335 . 4.870 4.581 4.349 4.829 . 0 0 "[ . 1]" 1 84 1 7 THR MG 1 55 PHE QD 2.730 . 3.660 3.256 3.148 3.369 . 0 0 "[ . 1]" 1 85 1 7 THR MG 1 55 PHE HZ 2.745 . 3.690 3.002 2.889 3.087 . 0 0 "[ . 1]" 1 86 1 7 THR MG 1 56 VAL H 3.635 . 5.470 5.077 4.742 5.370 . 0 0 "[ . 1]" 1 87 1 8 PHE H 1 8 PHE HB2 2.685 . 3.570 2.595 2.556 2.633 . 0 0 "[ . 1]" 1 88 1 8 PHE H 1 8 PHE HB3 2.870 . 3.940 3.742 3.717 3.765 . 0 0 "[ . 1]" 1 89 1 8 PHE H 1 8 PHE QD 2.750 . 3.700 2.599 2.434 2.733 . 0 0 "[ . 1]" 1 90 1 8 PHE H 1 9 TYR H 3.205 . 4.610 4.447 4.417 4.469 . 0 0 "[ . 1]" 1 91 1 8 PHE H 1 53 THR MG 3.005 . 4.210 3.597 3.427 3.732 . 0 0 "[ . 1]" 1 92 1 8 PHE H 1 54 ILE H 2.695 . 3.590 3.015 2.922 3.090 . 0 0 "[ . 1]" 1 93 1 8 PHE H 1 54 ILE HB 2.905 . 4.010 3.455 3.369 3.519 . 0 0 "[ . 1]" 1 94 1 8 PHE H 1 54 ILE MG 3.245 . 4.690 4.139 4.066 4.226 . 0 0 "[ . 1]" 1 95 1 8 PHE H 1 55 PHE H 3.485 . 5.170 4.799 4.711 4.883 . 0 0 "[ . 1]" 1 96 1 8 PHE H 1 55 PHE HA 3.165 . 4.530 3.512 3.399 3.612 . 0 0 "[ . 1]" 1 97 1 8 PHE HA 1 8 PHE QD 2.630 . 3.460 3.081 3.027 3.128 . 0 0 "[ . 1]" 1 98 1 8 PHE HA 1 9 TYR H 2.325 . 2.850 2.253 2.224 2.294 . 0 0 "[ . 1]" 1 99 1 8 PHE HA 1 9 TYR HA 3.355 . 4.910 4.423 4.412 4.446 . 0 0 "[ . 1]" 1 100 1 8 PHE HA 1 9 TYR HB2 3.265 . 4.730 4.192 4.121 4.231 . 0 0 "[ . 1]" 1 101 1 8 PHE HA 1 54 ILE HB 3.490 . 5.180 4.950 4.894 5.011 . 0 0 "[ . 1]" 1 102 1 8 PHE HB2 1 9 TYR H 3.020 . 4.240 3.999 3.903 4.073 . 0 0 "[ . 1]" 1 103 1 8 PHE HB2 1 10 LEU MD2 2.950 . 4.100 4.128 4.112 4.143 0.043 6 0 "[ . 1]" 1 104 1 8 PHE HB2 1 32 LEU HB2 3.160 . 4.520 4.348 4.208 4.452 . 0 0 "[ . 1]" 1 105 1 8 PHE HB2 1 32 LEU HB3 3.130 . 4.460 4.484 4.436 4.505 0.045 9 0 "[ . 1]" 1 106 1 8 PHE HB2 1 32 LEU MD1 3.290 . 4.780 4.395 4.231 4.552 . 0 0 "[ . 1]" 1 107 1 8 PHE HB2 1 32 LEU MD2 2.925 . 4.050 2.507 2.396 2.606 . 0 0 "[ . 1]" 1 108 1 8 PHE HB2 1 53 THR HA 3.450 . 5.100 4.945 4.879 5.007 . 0 0 "[ . 1]" 1 109 1 8 PHE HB2 1 54 ILE H 3.055 . 4.310 3.137 3.079 3.187 . 0 0 "[ . 1]" 1 110 1 8 PHE HB2 1 54 ILE HB 2.650 . 3.500 2.066 2.026 2.122 . 0 0 "[ . 1]" 1 111 1 8 PHE HB2 1 54 ILE MD 2.985 . 4.170 3.610 3.506 3.685 . 0 0 "[ . 1]" 1 112 1 8 PHE HB2 1 54 ILE HG12 3.400 . 5.000 4.970 4.927 5.016 0.016 10 0 "[ . 1]" 1 113 1 8 PHE HB2 1 54 ILE HG13 3.190 . 4.580 3.867 3.821 3.901 . 0 0 "[ . 1]" 1 114 1 8 PHE HB2 1 54 ILE MG 2.955 . 4.110 3.462 3.394 3.519 . 0 0 "[ . 1]" 1 115 1 8 PHE HB3 1 9 TYR H 2.955 . 4.110 2.966 2.826 3.050 . 0 0 "[ . 1]" 1 116 1 8 PHE HB3 1 10 LEU MD1 3.650 . 5.500 5.506 5.435 5.536 0.036 1 0 "[ . 1]" 1 117 1 8 PHE HB3 1 10 LEU MD2 2.875 . 3.950 3.583 3.481 3.677 . 0 0 "[ . 1]" 1 118 1 8 PHE HB3 1 10 LEU HG 3.115 . 4.430 4.279 4.196 4.306 . 0 0 "[ . 1]" 1 119 1 8 PHE HB3 1 32 LEU HB2 3.215 . 4.630 4.197 4.027 4.316 . 0 0 "[ . 1]" 1 120 1 8 PHE HB3 1 32 LEU HB3 2.980 . 4.160 3.675 3.609 3.710 . 0 0 "[ . 1]" 1 121 1 8 PHE HB3 1 32 LEU MD1 3.460 . 5.120 4.771 4.613 4.909 . 0 0 "[ . 1]" 1 122 1 8 PHE HB3 1 32 LEU MD2 2.905 . 4.010 2.529 2.393 2.659 . 0 0 "[ . 1]" 1 123 1 8 PHE HB3 1 53 THR HA 3.650 . 5.500 5.599 5.566 5.614 0.114 7 0 "[ . 1]" 1 124 1 8 PHE HB3 1 54 ILE H 3.225 . 4.650 4.281 4.254 4.315 . 0 0 "[ . 1]" 1 125 1 8 PHE HB3 1 54 ILE HB 2.765 . 3.730 3.601 3.536 3.662 . 0 0 "[ . 1]" 1 126 1 8 PHE HB3 1 54 ILE MD 3.180 . 4.560 4.235 4.121 4.347 . 0 0 "[ . 1]" 1 127 1 8 PHE HB3 1 54 ILE HG13 3.375 . 4.950 4.817 4.728 4.879 . 0 0 "[ . 1]" 1 128 1 8 PHE HB3 1 54 ILE MG 3.350 . 4.900 4.757 4.697 4.822 . 0 0 "[ . 1]" 1 129 1 8 PHE QD 1 9 TYR H 3.155 . 4.510 4.129 4.049 4.248 . 0 0 "[ . 1]" 1 130 1 8 PHE QD 1 10 LEU MD2 3.255 . 4.710 4.631 4.464 4.714 0.004 2 0 "[ . 1]" 1 131 1 8 PHE QD 1 32 LEU HB3 2.725 . 3.650 2.763 2.610 2.861 . 0 0 "[ . 1]" 1 132 1 8 PHE QD 1 32 LEU MD2 2.830 . 3.860 3.052 2.946 3.107 . 0 0 "[ . 1]" 1 133 1 8 PHE QD 1 54 ILE H 3.475 . 5.150 4.564 4.461 4.647 . 0 0 "[ . 1]" 1 134 1 8 PHE QD 1 54 ILE HB 2.645 . 3.490 3.314 3.169 3.420 . 0 0 "[ . 1]" 1 135 1 8 PHE QD 1 54 ILE MD 3.260 . 4.720 4.659 4.538 4.725 0.005 10 0 "[ . 1]" 1 136 1 8 PHE QD 1 54 ILE HG13 3.650 . 5.500 5.473 5.376 5.525 0.025 5 0 "[ . 1]" 1 137 1 8 PHE QD 1 54 ILE MG 2.670 . 3.540 3.267 3.079 3.418 . 0 0 "[ . 1]" 1 138 1 8 PHE QD 2 52 LEU QD 3.230 . 4.660 4.234 4.050 4.409 . 0 0 "[ . 1]" 1 139 1 8 PHE QE 1 30 PRO HB2 2.985 . 4.170 3.185 2.889 3.631 . 0 0 "[ . 1]" 1 140 1 8 PHE QE 1 30 PRO HB3 3.650 . 5.500 4.606 4.391 5.075 . 0 0 "[ . 1]" 1 141 1 8 PHE QE 1 30 PRO HG2 3.180 . 4.560 2.946 2.497 4.037 . 0 0 "[ . 1]" 1 142 1 8 PHE QE 1 31 SER H 3.630 . 5.460 4.926 4.832 5.091 . 0 0 "[ . 1]" 1 143 1 8 PHE QE 1 31 SER HA 2.890 . 3.980 2.840 2.787 2.933 . 0 0 "[ . 1]" 1 144 1 8 PHE QE 1 31 SER HB2 3.650 . 5.500 5.089 4.913 5.567 0.067 1 0 "[ . 1]" 1 145 1 8 PHE QE 1 31 SER HB3 3.650 . 5.500 5.473 4.808 5.590 0.090 3 0 "[ . 1]" 1 146 1 8 PHE QE 1 32 LEU H 3.000 . 4.200 2.500 2.374 2.595 . 0 0 "[ . 1]" 1 147 1 8 PHE QE 1 32 LEU HB2 2.915 . 4.030 3.197 3.091 3.268 . 0 0 "[ . 1]" 1 148 1 8 PHE QE 1 32 LEU HB3 3.425 . 5.050 3.314 3.184 3.451 . 0 0 "[ . 1]" 1 149 1 8 PHE QE 1 56 VAL H 3.205 . 4.610 4.116 3.901 4.399 . 0 0 "[ . 1]" 1 150 1 8 PHE QE 1 56 VAL HB 2.950 . 4.100 3.361 3.005 3.608 . 0 0 "[ . 1]" 1 151 1 8 PHE HZ 1 30 PRO HB2 3.210 . 4.620 3.150 2.868 3.558 . 0 0 "[ . 1]" 1 152 1 8 PHE HZ 1 30 PRO HB3 3.650 . 5.500 4.768 4.550 5.182 . 0 0 "[ . 1]" 1 153 1 8 PHE HZ 1 30 PRO HG2 3.230 . 4.660 3.228 2.559 4.654 . 0 0 "[ . 1]" 1 154 1 8 PHE HZ 1 31 SER H 3.650 . 5.500 4.192 4.063 4.402 . 0 0 "[ . 1]" 1 155 1 8 PHE HZ 1 31 SER HA 2.790 . 3.780 2.738 2.611 2.870 . 0 0 "[ . 1]" 1 156 1 8 PHE HZ 1 31 SER HB2 3.650 . 5.500 5.001 4.813 5.515 0.015 1 0 "[ . 1]" 1 157 1 8 PHE HZ 1 31 SER HB3 3.650 . 5.500 5.518 5.381 5.585 0.085 8 0 "[ . 1]" 1 158 1 8 PHE HZ 1 32 LEU HB3 3.425 . 5.050 4.761 4.643 4.892 . 0 0 "[ . 1]" 1 159 1 8 PHE HZ 1 56 VAL HB 3.650 . 5.500 5.368 4.907 5.548 0.048 8 0 "[ . 1]" 1 160 1 9 TYR H 1 9 TYR HB2 2.605 . 3.410 2.856 2.718 2.928 . 0 0 "[ . 1]" 1 161 1 9 TYR H 1 9 TYR HB3 2.640 . 3.480 2.932 2.857 3.029 . 0 0 "[ . 1]" 1 162 1 9 TYR H 1 9 TYR QD 3.380 . 4.960 4.398 4.370 4.425 . 0 0 "[ . 1]" 1 163 1 9 TYR H 1 10 LEU QB 3.330 . 4.860 4.725 4.669 4.782 . 0 0 "[ . 1]" 1 164 1 9 TYR H 1 10 LEU MD2 3.330 . 4.860 4.824 4.702 4.876 0.016 10 0 "[ . 1]" 1 165 1 9 TYR HA 1 9 TYR QD 2.560 . 3.320 2.985 2.758 3.076 . 0 0 "[ . 1]" 1 166 1 9 TYR HA 1 9 TYR QE 3.385 . 4.970 4.550 4.434 4.609 . 0 0 "[ . 1]" 1 167 1 9 TYR HA 1 10 LEU H 2.320 . 2.840 2.143 2.131 2.155 . 0 0 "[ . 1]" 1 168 1 9 TYR HA 1 10 LEU HA 3.530 . 5.260 4.390 4.375 4.398 . 0 0 "[ . 1]" 1 169 1 9 TYR HA 1 10 LEU QB 3.390 . 4.980 4.599 4.573 4.622 . 0 0 "[ . 1]" 1 170 1 9 TYR HA 1 10 LEU MD1 3.275 . 4.750 4.448 4.407 4.539 . 0 0 "[ . 1]" 1 171 1 9 TYR HA 1 10 LEU HG 2.950 . 4.100 3.532 3.463 3.580 . 0 0 "[ . 1]" 1 172 1 9 TYR HA 1 53 THR H 3.490 . 5.180 4.990 4.954 5.053 . 0 0 "[ . 1]" 1 173 1 9 TYR HA 1 53 THR HA 2.630 . 3.460 2.480 2.412 2.563 . 0 0 "[ . 1]" 1 174 1 9 TYR HA 1 53 THR MG 2.970 . 4.140 3.411 3.256 3.578 . 0 0 "[ . 1]" 1 175 1 9 TYR HA 1 54 ILE H 3.040 . 4.280 3.388 3.313 3.501 . 0 0 "[ . 1]" 1 176 1 9 TYR HB2 1 10 LEU H 3.155 . 4.510 4.432 4.401 4.471 . 0 0 "[ . 1]" 1 177 1 9 TYR HB2 1 53 THR MG 3.330 . 4.860 3.459 3.271 3.764 . 0 0 "[ . 1]" 1 178 1 9 TYR HB3 1 10 LEU H 2.970 . 4.140 4.017 3.922 4.073 . 0 0 "[ . 1]" 1 179 1 9 TYR HB3 1 10 LEU HA 3.300 . 4.800 4.404 4.290 4.481 . 0 0 "[ . 1]" 1 180 1 9 TYR HB3 1 53 THR HA 3.650 . 5.500 5.195 5.113 5.305 . 0 0 "[ . 1]" 1 181 1 9 TYR QD 1 10 LEU H 3.000 . 4.200 3.140 2.390 3.713 . 0 0 "[ . 1]" 1 182 1 9 TYR QD 1 10 LEU HA 2.980 . 4.160 3.515 3.224 3.847 . 0 0 "[ . 1]" 1 183 1 9 TYR QD 1 52 LEU H 3.400 . 5.000 4.176 3.430 4.814 . 0 0 "[ . 1]" 1 184 1 9 TYR QD 1 53 THR HA 2.920 . 4.040 3.623 3.202 4.052 0.012 8 0 "[ . 1]" 1 185 1 9 TYR QD 1 53 THR MG 2.600 . 3.400 2.500 2.100 2.953 . 0 0 "[ . 1]" 1 186 1 9 TYR QD 1 54 ILE H 3.650 . 5.500 5.099 4.833 5.361 . 0 0 "[ . 1]" 1 187 1 9 TYR QE 1 11 ALA MB 3.255 . 4.710 3.913 3.573 4.347 . 0 0 "[ . 1]" 1 188 1 9 TYR QE 1 51 PRO HB2 2.885 . 3.970 2.732 2.031 3.072 . 0 0 "[ . 1]" 1 189 1 9 TYR QE 1 51 PRO HB3 2.965 . 4.130 2.612 2.384 2.909 . 0 0 "[ . 1]" 1 190 1 9 TYR QE 1 51 PRO HG2 3.230 . 4.660 4.665 4.309 4.854 0.194 2 0 "[ . 1]" 1 191 1 9 TYR QE 1 53 THR MG 2.685 . 3.570 3.568 3.462 3.625 0.055 2 0 "[ . 1]" 1 192 1 10 LEU H 1 10 LEU QB 2.800 . 3.800 3.247 3.237 3.254 . 0 0 "[ . 1]" 1 193 1 10 LEU H 1 10 LEU MD1 2.875 . 3.950 2.815 2.780 2.890 . 0 0 "[ . 1]" 1 194 1 10 LEU H 1 10 LEU MD2 2.905 . 4.010 3.915 3.894 3.938 . 0 0 "[ . 1]" 1 195 1 10 LEU H 1 10 LEU HG 2.430 . 3.060 2.286 2.259 2.313 . 0 0 "[ . 1]" 1 196 1 10 LEU H 1 52 LEU H 2.600 . 3.400 3.071 2.970 3.165 . 0 0 "[ . 1]" 1 197 1 10 LEU H 1 52 LEU HB2 3.255 . 4.710 3.744 3.606 3.847 . 0 0 "[ . 1]" 1 198 1 10 LEU H 1 52 LEU QD 3.310 . 4.820 4.567 4.488 4.641 . 0 0 "[ . 1]" 1 199 1 10 LEU H 1 53 THR HA 2.920 . 4.040 3.632 3.535 3.703 . 0 0 "[ . 1]" 1 200 1 10 LEU H 1 54 ILE H 3.400 . 5.000 4.537 4.441 4.620 . 0 0 "[ . 1]" 1 201 1 10 LEU H 1 54 ILE MD 3.650 . 5.500 5.138 5.037 5.256 . 0 0 "[ . 1]" 1 202 1 10 LEU HA 1 10 LEU QB 2.365 . 2.930 2.154 2.151 2.158 . 0 0 "[ . 1]" 1 203 1 10 LEU HA 1 10 LEU MD1 2.800 . 3.800 3.689 3.681 3.700 . 0 0 "[ . 1]" 1 204 1 10 LEU HA 1 10 LEU MD2 2.900 . 4.000 4.023 4.015 4.030 0.030 4 0 "[ . 1]" 1 205 1 10 LEU HA 1 10 LEU HG 2.950 . 4.100 3.613 3.594 3.627 . 0 0 "[ . 1]" 1 206 1 10 LEU HA 1 11 ALA H 2.425 . 3.050 2.344 2.321 2.358 . 0 0 "[ . 1]" 1 207 1 10 LEU HA 1 11 ALA MB 2.915 . 4.030 3.924 3.891 3.944 . 0 0 "[ . 1]" 1 208 1 10 LEU HA 1 12 LEU MD2 3.425 . 5.050 4.953 4.902 5.027 . 0 0 "[ . 1]" 1 209 1 10 LEU QB 1 10 LEU MD1 2.415 . 3.030 2.215 2.205 2.233 . 0 0 "[ . 1]" 1 210 1 10 LEU QB 1 10 LEU MD2 2.475 . 3.150 2.077 2.073 2.085 . 0 0 "[ . 1]" 1 211 1 10 LEU QB 1 11 ALA H 2.655 . 3.510 2.543 2.520 2.564 . 0 0 "[ . 1]" 1 212 1 10 LEU QB 1 11 ALA HA 3.030 . 4.260 4.216 4.188 4.252 . 0 0 "[ . 1]" 1 213 1 10 LEU QB 1 11 ALA MB 3.065 . 4.330 4.339 4.323 4.347 0.017 7 0 "[ . 1]" 1 214 1 10 LEU QB 1 12 LEU MD2 2.680 . 3.560 2.900 2.845 2.955 . 0 0 "[ . 1]" 1 215 1 10 LEU QB 1 12 LEU HG 3.005 . 4.210 3.718 3.579 3.814 . 0 0 "[ . 1]" 1 216 1 10 LEU QB 1 32 LEU MD2 2.885 . 3.970 3.945 3.844 3.992 0.022 7 0 "[ . 1]" 1 217 1 10 LEU QB 1 34 VAL MG1 2.960 . 4.120 3.807 3.757 3.866 . 0 0 "[ . 1]" 1 218 1 10 LEU QB 1 34 VAL QG 2.695 . 3.590 3.361 3.307 3.399 . 0 0 "[ . 1]" 1 219 1 10 LEU QB 1 34 VAL MG2 2.960 . 4.120 3.741 3.655 3.816 . 0 0 "[ . 1]" 1 220 1 10 LEU QB 1 52 LEU H 3.460 . 5.120 4.768 4.612 4.916 . 0 0 "[ . 1]" 1 221 1 10 LEU QB 1 54 ILE MD 3.610 . 5.420 4.630 4.527 4.700 . 0 0 "[ . 1]" 1 222 1 10 LEU QB 2 20 LEU MD2 3.310 . 4.820 4.873 4.838 4.901 0.081 10 0 "[ . 1]" 1 223 1 10 LEU MD1 1 11 ALA H 3.030 . 4.260 3.670 3.599 3.712 . 0 0 "[ . 1]" 1 224 1 10 LEU MD1 1 12 LEU MD2 2.630 . 3.460 2.138 2.075 2.253 . 0 0 "[ . 1]" 1 225 1 10 LEU MD1 1 34 VAL HB 3.195 . 4.590 4.569 4.481 4.609 0.019 8 0 "[ . 1]" 1 226 1 10 LEU MD1 1 53 THR HA 3.390 . 4.980 4.810 4.702 4.983 0.003 9 0 "[ . 1]" 1 227 1 10 LEU MD2 1 11 ALA H 3.380 . 4.960 4.727 4.701 4.753 . 0 0 "[ . 1]" 1 228 1 10 LEU MD2 1 12 LEU MD2 2.775 . 3.750 3.012 2.954 3.105 . 0 0 "[ . 1]" 1 229 1 10 LEU MD2 1 34 VAL H 3.140 . 4.480 4.529 4.498 4.560 0.080 5 0 "[ . 1]" 1 230 1 10 LEU MD2 1 34 VAL HA 3.480 . 5.160 4.803 4.781 4.827 . 0 0 "[ . 1]" 1 231 1 10 LEU MD2 1 34 VAL HB 2.870 . 3.940 2.817 2.742 2.885 . 0 0 "[ . 1]" 1 232 1 10 LEU HG 1 12 LEU MD2 3.335 . 4.870 4.658 4.625 4.718 . 0 0 "[ . 1]" 1 233 1 10 LEU HG 1 34 VAL QG 2.995 . 4.190 4.224 4.208 4.257 0.067 1 0 "[ . 1]" 1 234 1 11 ALA H 1 11 ALA MB 2.625 . 3.450 2.479 2.448 2.509 . 0 0 "[ . 1]" 1 235 1 11 ALA HA 1 12 LEU H 2.305 . 2.810 2.137 2.129 2.144 . 0 0 "[ . 1]" 1 236 1 11 ALA HA 1 12 LEU HB2 3.440 . 5.080 4.557 4.539 4.591 . 0 0 "[ . 1]" 1 237 1 11 ALA HA 1 12 LEU HB3 3.650 . 5.500 5.559 5.543 5.582 0.082 8 0 "[ . 1]" 1 238 1 11 ALA HA 1 12 LEU MD2 3.395 . 4.990 4.155 4.098 4.212 . 0 0 "[ . 1]" 1 239 1 11 ALA HA 1 12 LEU HG 3.425 . 5.050 3.526 3.474 3.600 . 0 0 "[ . 1]" 1 240 1 11 ALA HA 1 49 LEU HB3 3.345 . 4.890 4.002 3.905 4.102 . 0 0 "[ . 1]" 1 241 1 11 ALA HA 1 49 LEU MD1 3.130 . 4.460 4.584 4.533 4.667 0.207 6 0 "[ . 1]" 1 242 1 11 ALA HA 1 51 PRO HB2 3.650 . 5.500 4.992 4.693 5.325 . 0 0 "[ . 1]" 1 243 1 11 ALA HA 1 51 PRO HB3 3.330 . 4.860 4.307 3.974 4.663 . 0 0 "[ . 1]" 1 244 1 11 ALA HA 1 52 LEU H 2.835 . 3.870 3.116 3.011 3.260 . 0 0 "[ . 1]" 1 245 1 11 ALA HA 1 52 LEU HG 3.650 . 5.500 5.506 5.425 5.538 0.038 10 0 "[ . 1]" 1 246 1 11 ALA HA 2 22 VAL MG1 3.615 . 5.430 5.448 5.361 5.497 0.067 1 0 "[ . 1]" 1 247 1 11 ALA MB 1 12 LEU H 2.780 . 3.760 3.018 2.984 3.044 . 0 0 "[ . 1]" 1 248 1 11 ALA MB 1 49 LEU HA 3.205 . 4.610 3.915 3.791 4.042 . 0 0 "[ . 1]" 1 249 1 11 ALA MB 1 49 LEU HB2 2.615 . 3.430 3.355 3.230 3.452 0.022 1 0 "[ . 1]" 1 250 1 11 ALA MB 1 49 LEU MD1 2.450 . 3.100 2.176 2.092 2.298 . 0 0 "[ . 1]" 1 251 1 11 ALA MB 1 49 LEU MD2 2.630 . 3.460 2.484 2.340 2.855 . 0 0 "[ . 1]" 1 252 1 11 ALA MB 1 50 ILE H 3.230 . 4.660 4.057 3.936 4.240 . 0 0 "[ . 1]" 1 253 1 11 ALA MB 1 51 PRO HA 2.690 . 3.580 2.862 2.678 3.076 . 0 0 "[ . 1]" 1 254 1 11 ALA MB 1 51 PRO HB2 3.560 . 5.320 4.646 4.261 5.067 . 0 0 "[ . 1]" 1 255 1 11 ALA MB 1 51 PRO HB3 2.980 . 4.160 3.490 3.035 3.955 . 0 0 "[ . 1]" 1 256 1 11 ALA MB 1 51 PRO HG3 3.650 . 5.500 5.084 4.711 5.445 . 0 0 "[ . 1]" 1 257 1 11 ALA MB 1 52 LEU H 3.140 . 4.480 4.106 4.015 4.218 . 0 0 "[ . 1]" 1 258 1 11 ALA MB 1 52 LEU HB2 3.650 . 5.500 5.618 5.586 5.669 0.169 3 0 "[ . 1]" 1 259 1 12 LEU H 1 12 LEU HB2 2.570 . 3.340 2.673 2.637 2.709 . 0 0 "[ . 1]" 1 260 1 12 LEU H 1 12 LEU HB3 2.970 . 4.140 3.766 3.745 3.786 . 0 0 "[ . 1]" 1 261 1 12 LEU H 1 12 LEU MD1 2.925 . 4.050 3.987 3.930 4.024 . 0 0 "[ . 1]" 1 262 1 12 LEU H 1 12 LEU MD2 2.985 . 4.170 3.575 3.548 3.623 . 0 0 "[ . 1]" 1 263 1 12 LEU H 1 12 LEU HG 2.485 . 3.170 2.781 2.745 2.815 . 0 0 "[ . 1]" 1 264 1 12 LEU H 1 49 LEU HA 3.255 . 4.710 4.060 3.982 4.183 . 0 0 "[ . 1]" 1 265 1 12 LEU H 1 49 LEU HB2 3.650 . 5.500 5.530 5.510 5.540 0.040 2 0 "[ . 1]" 1 266 1 12 LEU H 1 49 LEU HB3 3.430 . 5.060 3.856 3.818 3.879 . 0 0 "[ . 1]" 1 267 1 12 LEU H 1 49 LEU MD1 3.330 . 4.860 4.825 4.761 4.873 0.013 6 0 "[ . 1]" 1 268 1 12 LEU H 1 50 ILE H 2.750 . 3.700 3.033 2.868 3.110 . 0 0 "[ . 1]" 1 269 1 12 LEU H 1 50 ILE HB 2.860 . 3.920 3.637 3.549 3.751 . 0 0 "[ . 1]" 1 270 1 12 LEU H 1 51 PRO HA 3.120 . 4.440 3.795 3.601 4.049 . 0 0 "[ . 1]" 1 271 1 12 LEU H 1 52 LEU H 3.530 . 5.260 4.519 4.442 4.624 . 0 0 "[ . 1]" 1 272 1 12 LEU H 1 52 LEU HB2 3.650 . 5.500 4.850 4.732 4.953 . 0 0 "[ . 1]" 1 273 1 12 LEU H 1 52 LEU QD 2.900 . 4.000 2.681 2.625 2.759 . 0 0 "[ . 1]" 1 274 1 12 LEU HA 1 12 LEU MD1 3.215 . 4.630 3.888 3.877 3.901 . 0 0 "[ . 1]" 1 275 1 12 LEU HA 1 12 LEU MD2 2.425 . 3.050 2.135 2.112 2.161 . 0 0 "[ . 1]" 1 276 1 12 LEU HA 1 18 TYR QE 2.965 . 4.130 3.224 3.153 3.294 . 0 0 "[ . 1]" 1 277 1 12 LEU HA 1 49 LEU MD2 3.035 . 4.270 2.944 2.844 3.194 . 0 0 "[ . 1]" 1 278 1 12 LEU HA 1 52 LEU QD 3.350 . 4.900 4.342 4.290 4.414 . 0 0 "[ . 1]" 1 279 1 12 LEU HB2 1 12 LEU MD1 2.605 . 3.410 2.322 2.313 2.334 . 0 0 "[ . 1]" 1 280 1 12 LEU HB2 1 12 LEU MD2 2.835 . 3.870 3.202 3.200 3.205 . 0 0 "[ . 1]" 1 281 1 12 LEU HB2 1 13 HIS H 3.265 . 4.730 3.927 3.856 3.950 . 0 0 "[ . 1]" 1 282 1 12 LEU HB2 1 18 TYR QE 3.100 . 4.400 3.902 3.819 4.057 . 0 0 "[ . 1]" 1 283 1 12 LEU HB2 1 50 ILE HB 3.095 . 4.390 3.645 3.511 3.823 . 0 0 "[ . 1]" 1 284 1 12 LEU HB2 1 52 LEU QD 2.840 . 3.880 2.529 2.453 2.597 . 0 0 "[ . 1]" 1 285 1 12 LEU HB2 2 22 VAL MG1 2.825 . 3.850 1.897 1.836 1.961 . 0 0 "[ . 1]" 1 286 1 12 LEU HB3 1 12 LEU MD1 2.520 . 3.240 2.366 2.357 2.383 . 0 0 "[ . 1]" 1 287 1 12 LEU HB3 1 12 LEU MD2 2.640 . 3.480 2.386 2.366 2.396 . 0 0 "[ . 1]" 1 288 1 12 LEU HB3 1 13 HIS H 2.795 . 3.790 3.006 2.908 3.046 . 0 0 "[ . 1]" 1 289 1 12 LEU HB3 1 13 HIS QB 3.430 . 5.060 4.689 4.593 4.770 . 0 0 "[ . 1]" 1 290 1 12 LEU HB3 1 18 TYR QB 3.250 . 4.700 4.656 4.570 4.714 0.014 10 0 "[ . 1]" 1 291 1 12 LEU HB3 1 18 TYR QD 2.995 . 4.190 3.208 3.125 3.279 . 0 0 "[ . 1]" 1 292 1 12 LEU HB3 1 18 TYR QE 2.930 . 4.060 2.312 2.239 2.464 . 0 0 "[ . 1]" 1 293 1 12 LEU HB3 1 52 LEU QD 3.045 . 4.290 3.720 3.669 3.769 . 0 0 "[ . 1]" 1 294 1 12 LEU HB3 2 20 LEU MD1 3.515 . 5.230 5.223 5.168 5.266 0.036 8 0 "[ . 1]" 1 295 1 12 LEU HB3 2 22 VAL MG1 2.800 . 3.800 2.506 2.456 2.568 . 0 0 "[ . 1]" 1 296 1 12 LEU MD1 1 18 TYR QB 3.025 . 4.250 3.339 3.211 3.502 . 0 0 "[ . 1]" 1 297 1 12 LEU MD1 1 18 TYR QD 2.900 . 4.000 3.024 2.892 3.140 . 0 0 "[ . 1]" 1 298 1 12 LEU MD1 1 18 TYR QE 3.140 . 4.480 3.765 3.671 3.924 . 0 0 "[ . 1]" 1 299 1 12 LEU MD1 1 50 ILE HB 3.330 . 4.860 4.777 4.633 4.864 0.004 10 0 "[ . 1]" 1 300 1 12 LEU MD1 1 52 LEU HB2 3.250 . 4.700 3.592 3.465 3.663 . 0 0 "[ . 1]" 1 301 1 12 LEU MD1 1 52 LEU QD 2.220 . 2.640 1.996 1.928 2.032 . 0 0 "[ . 1]" 1 302 1 12 LEU MD1 1 52 LEU HG 3.100 . 4.400 4.387 4.279 4.423 0.023 2 0 "[ . 1]" 1 303 1 12 LEU MD1 2 20 LEU HB2 3.255 . 4.710 4.657 4.596 4.717 0.007 2 0 "[ . 1]" 1 304 1 12 LEU MD1 2 20 LEU MD1 2.850 . 3.900 2.722 2.685 2.772 . 0 0 "[ . 1]" 1 305 1 12 LEU MD1 2 20 LEU MD2 2.395 . 2.990 1.841 1.802 1.901 . 0 0 "[ . 1]" 1 306 1 12 LEU MD1 2 20 LEU HG 2.680 . 3.560 2.399 2.314 2.476 . 0 0 "[ . 1]" 1 307 1 12 LEU MD1 2 22 VAL HA 3.270 . 4.740 4.765 4.725 4.804 0.064 9 0 "[ . 1]" 1 308 1 12 LEU MD1 2 22 VAL HB 3.100 . 4.400 2.783 2.751 2.850 . 0 0 "[ . 1]" 1 309 1 12 LEU MD1 2 22 VAL MG1 2.405 . 3.010 2.403 2.314 2.553 . 0 0 "[ . 1]" 1 310 1 12 LEU MD1 2 32 LEU MD1 2.715 . 3.630 3.457 3.310 3.642 0.012 3 0 "[ . 1]" 1 311 1 12 LEU MD2 1 13 HIS H 3.200 . 4.600 3.746 3.710 3.795 . 0 0 "[ . 1]" 1 312 1 12 LEU MD2 1 18 TYR QB 3.175 . 4.550 3.133 3.063 3.204 . 0 0 "[ . 1]" 1 313 1 12 LEU MD2 1 18 TYR QD 2.915 . 4.030 2.904 2.844 2.955 . 0 0 "[ . 1]" 1 314 1 12 LEU MD2 1 18 TYR QE 2.750 . 3.700 2.972 2.942 3.026 . 0 0 "[ . 1]" 1 315 1 12 LEU MD2 1 34 VAL HB 3.235 . 4.670 3.834 3.741 3.924 . 0 0 "[ . 1]" 1 316 1 12 LEU MD2 1 34 VAL QG 2.425 . 3.050 2.059 2.014 2.100 . 0 0 "[ . 1]" 1 317 1 12 LEU MD2 1 52 LEU QD 2.705 . 3.610 3.453 3.394 3.520 . 0 0 "[ . 1]" 1 318 1 12 LEU MD2 2 20 LEU MD2 2.670 . 3.540 3.027 2.857 3.107 . 0 0 "[ . 1]" 1 319 1 12 LEU MD2 2 22 VAL MG1 2.995 . 4.190 3.905 3.858 3.977 . 0 0 "[ . 1]" 1 320 1 12 LEU HG 1 52 LEU QD 2.610 . 3.420 2.095 2.008 2.199 . 0 0 "[ . 1]" 1 321 1 13 HIS H 1 13 HIS QB 2.575 . 3.350 2.362 2.297 2.437 . 0 0 "[ . 1]" 1 322 1 13 HIS H 1 16 GLN QB 3.150 . 4.500 3.283 3.101 3.518 . 0 0 "[ . 1]" 1 323 1 13 HIS H 1 18 TYR QE 2.985 . 4.170 2.465 2.260 2.619 . 0 0 "[ . 1]" 1 324 1 13 HIS H 1 49 LEU HA 3.220 . 4.640 4.344 4.207 4.485 . 0 0 "[ . 1]" 1 325 1 13 HIS H 1 49 LEU MD2 3.250 . 4.700 2.867 2.733 3.154 . 0 0 "[ . 1]" 1 326 1 13 HIS HA 1 14 GLY H 2.505 . 3.210 2.154 2.141 2.171 . 0 0 "[ . 1]" 1 327 1 13 HIS HA 1 14 GLY HA2 3.065 . 4.330 4.333 4.319 4.348 0.018 10 0 "[ . 1]" 1 328 1 13 HIS HA 1 14 GLY HA3 3.220 . 4.640 4.377 4.365 4.394 . 0 0 "[ . 1]" 1 329 1 13 HIS HA 1 49 LEU HA 2.630 . 3.460 2.495 2.393 2.588 . 0 0 "[ . 1]" 1 330 1 13 HIS HA 1 49 LEU HB3 3.295 . 4.790 4.819 4.797 4.846 0.056 5 0 "[ . 1]" 1 331 1 13 HIS HA 1 49 LEU MD1 3.465 . 5.130 5.064 4.965 5.147 0.017 7 0 "[ . 1]" 1 332 1 13 HIS HA 1 49 LEU MD2 2.825 . 3.850 2.336 2.256 2.463 . 0 0 "[ . 1]" 1 333 1 13 HIS HA 1 49 LEU HG 3.185 . 4.570 4.179 3.931 4.512 . 0 0 "[ . 1]" 1 334 1 13 HIS HA 1 50 ILE H 2.995 . 4.190 3.489 3.301 3.663 . 0 0 "[ . 1]" 1 335 1 13 HIS QB 1 14 GLY H 2.945 . 4.090 3.144 3.078 3.204 . 0 0 "[ . 1]" 1 336 1 13 HIS QB 1 16 GLN H 3.530 . 5.260 3.574 3.367 3.833 . 0 0 "[ . 1]" 1 337 1 13 HIS QB 1 16 GLN QB 2.730 . 3.660 2.125 1.768 2.395 0.032 9 0 "[ . 1]" 1 338 1 13 HIS QB 1 16 GLN HB3 3.410 . 5.020 3.191 2.751 3.478 . 0 0 "[ . 1]" 1 339 1 13 HIS QB 1 16 GLN QE 3.090 . 4.380 3.950 3.270 4.516 0.136 10 0 "[ . 1]" 1 340 1 13 HIS QB 1 16 GLN QG 2.560 . 3.320 2.033 1.765 2.373 0.035 6 0 "[ . 1]" 1 341 1 13 HIS QB 1 18 TYR QE 2.870 . 3.940 3.270 3.080 3.429 . 0 0 "[ . 1]" 1 342 1 13 HIS QB 1 47 THR MG 3.045 . 4.290 3.359 3.039 3.867 . 0 0 "[ . 1]" 1 343 1 13 HIS HB2 1 14 GLY H 3.355 . 4.910 4.243 4.160 4.309 . 0 0 "[ . 1]" 1 344 1 13 HIS HB2 1 16 GLN HG2 3.095 . 4.390 2.876 2.357 3.522 . 0 0 "[ . 1]" 1 345 1 13 HIS HB2 1 16 GLN HG3 3.095 . 4.390 2.209 1.866 2.458 . 0 0 "[ . 1]" 1 346 1 13 HIS HB3 1 14 GLY H 3.355 . 4.910 3.240 3.163 3.304 . 0 0 "[ . 1]" 1 347 1 13 HIS HB3 1 16 GLN HB2 3.085 . 4.370 3.332 2.727 3.800 . 0 0 "[ . 1]" 1 348 1 13 HIS HB3 1 16 GLN HG2 3.095 . 4.390 3.025 2.467 4.380 . 0 0 "[ . 1]" 1 349 1 13 HIS HB3 1 16 GLN HG3 3.095 . 4.390 3.002 2.390 3.683 . 0 0 "[ . 1]" 1 350 1 13 HIS HE1 1 49 LEU MD2 3.560 . 5.320 3.257 3.047 3.702 . 0 0 "[ . 1]" 1 351 1 14 GLY H 1 15 GLY H 3.180 . 4.560 4.391 4.297 4.455 . 0 0 "[ . 1]" 1 352 1 14 GLY H 1 47 THR HB 2.955 . 4.110 2.945 2.721 3.161 . 0 0 "[ . 1]" 1 353 1 14 GLY H 1 47 THR MG 3.265 . 4.730 4.102 3.981 4.311 . 0 0 "[ . 1]" 1 354 1 14 GLY H 1 49 LEU HA 3.250 . 4.700 3.585 3.452 3.690 . 0 0 "[ . 1]" 1 355 1 14 GLY H 1 50 ILE MD 3.020 . 4.240 3.983 3.737 4.242 0.002 10 0 "[ . 1]" 1 356 1 14 GLY H 1 50 ILE HG13 3.220 . 4.640 3.638 3.362 3.880 . 0 0 "[ . 1]" 1 357 1 14 GLY H 2 22 VAL MG1 3.280 . 4.760 4.260 4.137 4.354 . 0 0 "[ . 1]" 1 358 1 14 GLY HA2 1 15 GLY HA2 3.100 . 4.400 4.324 4.311 4.347 . 0 0 "[ . 1]" 1 359 1 14 GLY HA2 1 16 GLN H 3.045 . 4.290 3.627 3.509 3.711 . 0 0 "[ . 1]" 1 360 1 14 GLY HA2 1 47 THR MG 3.650 . 5.500 5.113 4.846 5.520 0.020 6 0 "[ . 1]" 1 361 1 14 GLY HA2 1 50 ILE MD 2.640 . 3.480 2.838 2.537 3.215 . 0 0 "[ . 1]" 1 362 1 14 GLY HA2 1 50 ILE HG13 3.305 . 4.810 3.973 3.716 4.220 . 0 0 "[ . 1]" 1 363 1 14 GLY HA2 2 22 VAL MG1 2.940 . 4.080 2.495 2.332 2.615 . 0 0 "[ . 1]" 1 364 1 14 GLY HA2 2 23 ASP HA 2.945 . 4.090 3.028 2.591 3.306 . 0 0 "[ . 1]" 1 365 1 14 GLY HA2 2 24 THR MG 3.560 . 5.320 4.608 4.265 4.915 . 0 0 "[ . 1]" 1 366 1 14 GLY HA3 1 16 GLN H 3.565 . 5.330 4.628 4.470 4.775 . 0 0 "[ . 1]" 1 367 1 14 GLY HA3 1 50 ILE MD 2.690 . 3.580 3.112 2.731 3.452 . 0 0 "[ . 1]" 1 368 1 14 GLY HA3 1 50 ILE HG13 3.285 . 4.770 3.799 3.440 4.046 . 0 0 "[ . 1]" 1 369 1 14 GLY HA3 2 22 VAL MG1 2.955 . 4.110 4.006 3.831 4.120 0.010 9 0 "[ . 1]" 1 370 1 14 GLY HA3 2 23 ASP HA 2.835 . 3.870 3.678 3.295 3.884 0.014 10 0 "[ . 1]" 1 371 1 14 GLY HA3 2 24 THR MG 3.610 . 5.420 4.321 3.744 4.672 . 0 0 "[ . 1]" 1 372 1 15 GLY H 1 16 GLN H 2.745 . 3.690 2.292 2.107 2.430 . 0 0 "[ . 1]" 1 373 1 15 GLY H 1 16 GLN QB 3.570 . 5.340 4.332 4.178 4.558 . 0 0 "[ . 1]" 1 374 1 15 GLY H 2 21 ILE MG 2.825 . 3.850 3.716 3.645 3.799 . 0 0 "[ . 1]" 1 375 1 15 GLY H 2 22 VAL H 3.265 . 4.730 3.743 3.644 3.832 . 0 0 "[ . 1]" 1 376 1 15 GLY H 2 22 VAL HB 3.650 . 5.500 5.534 5.514 5.569 0.069 6 0 "[ . 1]" 1 377 1 15 GLY H 2 22 VAL MG1 3.110 . 4.420 3.028 2.965 3.152 . 0 0 "[ . 1]" 1 378 1 15 GLY H 2 23 ASP HA 2.910 . 4.020 2.760 2.512 2.990 . 0 0 "[ . 1]" 1 379 1 15 GLY H 2 23 ASP QB 3.025 . 4.250 3.357 2.978 3.846 . 0 0 "[ . 1]" 1 380 1 15 GLY HA2 2 21 ILE MG 2.665 . 3.530 3.210 3.115 3.260 . 0 0 "[ . 1]" 1 381 1 15 GLY HA2 2 23 ASP HA 3.345 . 4.890 3.490 3.136 3.880 . 0 0 "[ . 1]" 1 382 1 15 GLY HA2 2 23 ASP QB 2.905 . 4.010 2.564 2.213 3.278 . 0 0 "[ . 1]" 1 383 1 15 GLY HA3 1 16 GLN QB 3.450 . 5.100 5.010 4.695 5.175 0.075 1 0 "[ . 1]" 1 384 1 15 GLY HA3 2 21 ILE MG 3.125 . 4.450 4.510 4.445 4.559 0.109 2 0 "[ . 1]" 1 385 1 15 GLY HA3 2 23 ASP QB 3.200 . 4.600 3.885 3.403 4.640 0.040 10 0 "[ . 1]" 1 386 1 16 GLN H 1 16 GLN QB 2.440 . 3.080 2.325 2.118 2.530 . 0 0 "[ . 1]" 1 387 1 16 GLN H 1 16 GLN HB3 2.910 . 4.020 3.489 3.093 3.720 . 0 0 "[ . 1]" 1 388 1 16 GLN H 1 16 GLN QG 2.705 . 3.610 3.058 2.635 3.681 0.071 9 0 "[ . 1]" 1 389 1 16 GLN H 1 17 THR H 3.345 . 4.890 4.553 4.513 4.587 . 0 0 "[ . 1]" 1 390 1 16 GLN H 2 21 ILE MG 2.920 . 4.040 3.809 3.544 4.052 0.012 9 0 "[ . 1]" 1 391 1 16 GLN H 2 22 VAL MG1 3.230 . 4.660 3.863 3.702 4.047 . 0 0 "[ . 1]" 1 392 1 16 GLN HA 1 16 GLN HG2 3.000 . 4.200 2.819 2.239 3.199 . 0 0 "[ . 1]" 1 393 1 16 GLN HA 1 16 GLN QG 2.615 . 3.430 2.717 2.216 3.023 . 0 0 "[ . 1]" 1 394 1 16 GLN HA 1 16 GLN HG3 3.000 . 4.200 3.657 3.526 3.808 . 0 0 "[ . 1]" 1 395 1 16 GLN QB 1 17 THR H 2.870 . 3.940 2.798 2.500 3.221 . 0 0 "[ . 1]" 1 396 1 16 GLN QB 1 18 TYR QE 2.695 . 3.590 2.282 2.047 2.476 . 0 0 "[ . 1]" 1 397 1 16 GLN QB 1 36 PRO HA 3.515 . 5.230 4.718 4.200 4.972 . 0 0 "[ . 1]" 1 398 1 16 GLN HB2 1 17 THR H 3.365 . 4.930 3.982 3.689 4.286 . 0 0 "[ . 1]" 1 399 1 16 GLN HB3 1 18 TYR QE 2.950 . 4.100 3.051 2.096 3.737 . 0 0 "[ . 1]" 1 400 1 16 GLN QG 1 17 THR H 3.180 . 4.560 4.059 3.406 4.448 . 0 0 "[ . 1]" 1 401 1 16 GLN HG2 1 18 TYR QE 3.375 . 4.950 4.699 4.468 4.959 0.009 5 0 "[ . 1]" 1 402 1 16 GLN HG3 1 18 TYR QE 3.375 . 4.950 4.232 3.658 4.548 . 0 0 "[ . 1]" 1 403 1 17 THR H 1 17 THR HB 2.745 . 3.690 2.666 2.619 2.751 . 0 0 "[ . 1]" 1 404 1 17 THR H 1 17 THR MG 3.175 . 4.550 3.814 3.780 3.835 . 0 0 "[ . 1]" 1 405 1 17 THR HA 1 17 THR MG 2.520 . 3.240 2.296 2.256 2.337 . 0 0 "[ . 1]" 1 406 1 17 THR HA 1 18 TYR H 2.475 . 3.150 2.156 2.144 2.168 . 0 0 "[ . 1]" 1 407 1 17 THR HA 1 18 TYR QB 3.125 . 4.450 4.227 4.196 4.246 . 0 0 "[ . 1]" 1 408 1 17 THR HA 1 18 TYR QD 3.055 . 4.310 3.587 3.535 3.658 . 0 0 "[ . 1]" 1 409 1 17 THR HA 2 20 LEU MD1 3.650 . 5.500 5.647 5.613 5.666 0.166 10 0 "[ . 1]" 1 410 1 17 THR HA 2 21 ILE MD 2.805 . 3.810 3.717 3.588 3.815 0.005 9 0 "[ . 1]" 1 411 1 17 THR HA 2 21 ILE HG12 2.620 . 3.440 2.134 2.017 2.232 . 0 0 "[ . 1]" 1 412 1 17 THR HA 2 21 ILE HG13 2.745 . 3.690 2.936 2.796 3.112 . 0 0 "[ . 1]" 1 413 1 17 THR HA 2 21 ILE MG 3.000 . 4.200 3.075 2.905 3.347 . 0 0 "[ . 1]" 1 414 1 17 THR HB 1 18 TYR H 3.325 . 4.850 3.924 3.872 4.024 . 0 0 "[ . 1]" 1 415 1 17 THR HB 1 37 SER H 3.195 . 4.590 3.642 3.446 3.942 . 0 0 "[ . 1]" 1 416 1 17 THR HB 1 37 SER HA 3.165 . 4.530 4.616 4.550 4.658 0.128 1 0 "[ . 1]" 1 417 1 17 THR HB 1 37 SER QB 2.725 . 3.650 1.991 1.808 2.363 . 0 0 "[ . 1]" 1 418 1 17 THR HB 2 21 ILE MD 3.420 . 5.040 4.739 4.574 4.846 . 0 0 "[ . 1]" 1 419 1 17 THR MG 1 18 TYR H 2.645 . 3.490 2.493 2.435 2.561 . 0 0 "[ . 1]" 1 420 1 17 THR MG 1 18 TYR HA 3.010 . 4.220 3.789 3.668 3.929 . 0 0 "[ . 1]" 1 421 1 17 THR MG 1 18 TYR QB 3.180 . 4.560 4.356 4.277 4.415 . 0 0 "[ . 1]" 1 422 1 17 THR MG 1 18 TYR QD 3.445 . 5.090 4.747 4.679 4.825 . 0 0 "[ . 1]" 1 423 1 17 THR MG 1 19 HIS H 3.540 . 5.280 4.783 4.669 4.966 . 0 0 "[ . 1]" 1 424 1 17 THR MG 1 37 SER HA 3.490 . 5.180 4.775 4.574 4.952 . 0 0 "[ . 1]" 1 425 1 17 THR MG 1 37 SER QB 2.495 . 3.190 2.909 2.333 3.238 0.048 1 0 "[ . 1]" 1 426 1 17 THR MG 2 19 HIS HA 2.775 . 3.750 3.608 3.372 3.761 0.011 7 0 "[ . 1]" 1 427 1 17 THR MG 2 19 HIS HB2 3.120 . 4.440 4.264 4.049 4.414 . 0 0 "[ . 1]" 1 428 1 17 THR MG 2 19 HIS HB3 2.550 . 3.300 2.962 2.734 3.118 . 0 0 "[ . 1]" 1 429 1 17 THR MG 2 19 HIS HD2 2.780 . 3.760 2.204 2.011 2.379 . 0 0 "[ . 1]" 1 430 1 17 THR MG 2 20 LEU H 3.050 . 4.300 3.576 3.445 3.732 . 0 0 "[ . 1]" 1 431 1 17 THR MG 2 20 LEU HA 3.650 . 5.500 4.988 4.854 5.120 . 0 0 "[ . 1]" 1 432 1 17 THR MG 2 20 LEU HB3 3.650 . 5.500 5.127 5.014 5.268 . 0 0 "[ . 1]" 1 433 1 17 THR MG 2 21 ILE MD 2.805 . 3.810 2.301 2.216 2.408 . 0 0 "[ . 1]" 1 434 1 17 THR MG 2 21 ILE HG12 3.175 . 4.550 2.171 2.020 2.291 . 0 0 "[ . 1]" 1 435 1 17 THR MG 2 21 ILE HG13 2.845 . 3.890 2.432 2.369 2.495 . 0 0 "[ . 1]" 1 436 1 18 TYR H 1 18 TYR QB 2.620 . 3.440 2.547 2.507 2.572 . 0 0 "[ . 1]" 1 437 1 18 TYR H 1 18 TYR QD 2.910 . 4.020 3.080 2.995 3.167 . 0 0 "[ . 1]" 1 438 1 18 TYR H 2 21 ILE HG12 3.285 . 4.770 3.610 3.480 3.786 . 0 0 "[ . 1]" 1 439 1 18 TYR H 2 21 ILE HG13 3.140 . 4.480 3.278 3.201 3.347 . 0 0 "[ . 1]" 1 440 1 18 TYR HA 1 18 TYR QD 2.795 . 3.790 2.914 2.849 2.952 . 0 0 "[ . 1]" 1 441 1 18 TYR HA 1 18 TYR QE 3.290 . 4.780 4.584 4.523 4.622 . 0 0 "[ . 1]" 1 442 1 18 TYR HA 1 19 HIS H 2.410 . 3.020 2.234 2.216 2.248 . 0 0 "[ . 1]" 1 443 1 18 TYR HA 1 19 HIS HA 3.250 . 4.700 4.376 4.363 4.383 . 0 0 "[ . 1]" 1 444 1 18 TYR HA 1 19 HIS HB2 3.040 . 4.280 4.246 4.229 4.286 0.006 8 0 "[ . 1]" 1 445 1 18 TYR HA 1 19 HIS HB3 3.650 . 5.500 5.593 5.579 5.619 0.119 8 0 "[ . 1]" 1 446 1 18 TYR HA 1 34 VAL QG 2.990 . 4.180 3.852 3.796 3.918 . 0 0 "[ . 1]" 1 447 1 18 TYR HA 1 35 ILE H 3.160 . 4.520 4.289 4.182 4.389 . 0 0 "[ . 1]" 1 448 1 18 TYR HA 1 36 PRO HA 2.585 . 3.370 2.565 2.396 2.766 . 0 0 "[ . 1]" 1 449 1 18 TYR HA 1 36 PRO HB2 3.650 . 5.500 5.193 5.060 5.338 . 0 0 "[ . 1]" 1 450 1 18 TYR HA 1 36 PRO HB3 3.415 . 5.030 4.792 4.595 5.022 . 0 0 "[ . 1]" 1 451 1 18 TYR HA 1 37 SER H 2.635 . 3.470 2.733 2.488 3.214 . 0 0 "[ . 1]" 1 452 1 18 TYR HA 1 37 SER QB 3.045 . 4.290 3.934 3.288 4.308 0.018 7 0 "[ . 1]" 1 453 1 18 TYR HA 2 20 LEU HB3 3.650 . 5.500 4.830 4.599 4.899 . 0 0 "[ . 1]" 1 454 1 18 TYR QB 1 19 HIS H 2.520 . 3.240 2.683 2.659 2.702 . 0 0 "[ . 1]" 1 455 1 18 TYR QB 1 19 HIS HA 3.155 . 4.510 4.205 4.189 4.221 . 0 0 "[ . 1]" 1 456 1 18 TYR QB 1 20 LEU HA 3.510 . 5.220 4.605 4.550 4.635 . 0 0 "[ . 1]" 1 457 1 18 TYR QB 1 34 VAL HA 3.195 . 4.590 3.853 3.770 3.969 . 0 0 "[ . 1]" 1 458 1 18 TYR QB 1 34 VAL HB 3.405 . 5.010 4.575 4.489 4.628 . 0 0 "[ . 1]" 1 459 1 18 TYR QB 1 34 VAL QG 2.390 . 2.980 1.828 1.787 1.880 0.013 4 0 "[ . 1]" 1 460 1 18 TYR QB 1 35 ILE H 2.955 . 4.110 3.338 3.246 3.459 . 0 0 "[ . 1]" 1 461 1 18 TYR QB 1 36 PRO HA 2.955 . 4.110 3.822 3.730 3.915 . 0 0 "[ . 1]" 1 462 1 18 TYR QB 2 20 LEU HA 3.370 . 4.940 4.623 4.536 4.661 . 0 0 "[ . 1]" 1 463 1 18 TYR QB 2 20 LEU HB2 3.115 . 4.430 4.005 3.772 4.069 . 0 0 "[ . 1]" 1 464 1 18 TYR QB 2 20 LEU HB3 2.575 . 3.350 2.475 2.190 2.578 . 0 0 "[ . 1]" 1 465 1 18 TYR QB 2 20 LEU MD1 3.260 . 4.720 4.079 4.015 4.170 . 0 0 "[ . 1]" 1 466 1 18 TYR QB 2 20 LEU MD2 2.615 . 3.430 2.856 2.768 2.914 . 0 0 "[ . 1]" 1 467 1 18 TYR QB 2 20 LEU HG 2.955 . 4.110 2.637 2.541 2.781 . 0 0 "[ . 1]" 1 468 1 18 TYR QD 1 19 HIS H 3.070 . 4.340 3.591 3.454 3.675 . 0 0 "[ . 1]" 1 469 1 18 TYR QD 1 34 VAL QG 2.540 . 3.280 2.285 2.214 2.362 . 0 0 "[ . 1]" 1 470 1 18 TYR QD 1 35 ILE H 3.130 . 4.460 3.787 3.663 3.903 . 0 0 "[ . 1]" 1 471 1 18 TYR QD 1 35 ILE HA 3.295 . 4.790 3.685 3.628 3.760 . 0 0 "[ . 1]" 1 472 1 18 TYR QD 1 36 PRO HA 2.715 . 3.630 2.490 2.447 2.539 . 0 0 "[ . 1]" 1 473 1 18 TYR QD 1 36 PRO HB3 3.215 . 4.630 3.507 3.356 3.690 . 0 0 "[ . 1]" 1 474 1 18 TYR QD 1 36 PRO HD2 3.155 . 4.510 4.217 4.094 4.315 . 0 0 "[ . 1]" 1 475 1 18 TYR QD 1 37 SER H 3.245 . 4.690 4.224 4.128 4.349 . 0 0 "[ . 1]" 1 476 1 18 TYR QD 2 20 LEU HB3 3.475 . 5.150 4.447 4.143 4.590 . 0 0 "[ . 1]" 1 477 1 18 TYR QD 2 20 LEU MD2 3.025 . 4.250 4.122 4.013 4.203 . 0 0 "[ . 1]" 1 478 1 18 TYR QD 2 21 ILE HA 3.225 . 4.650 3.403 3.286 3.604 . 0 0 "[ . 1]" 1 479 1 18 TYR QD 2 22 VAL MG1 3.170 . 4.540 3.840 3.675 4.050 . 0 0 "[ . 1]" 1 480 1 18 TYR QE 1 34 VAL QG 2.805 . 3.810 3.625 3.519 3.719 . 0 0 "[ . 1]" 1 481 1 18 TYR QE 1 35 ILE MG 3.650 . 5.500 5.619 5.575 5.654 0.154 7 0 "[ . 1]" 1 482 1 18 TYR QE 1 36 PRO HA 2.945 . 4.090 3.189 3.004 3.383 . 0 0 "[ . 1]" 1 483 1 18 TYR QE 1 36 PRO HB2 3.375 . 4.950 4.144 3.946 4.331 . 0 0 "[ . 1]" 1 484 1 18 TYR QE 1 36 PRO HB3 3.065 . 4.330 2.439 2.221 2.640 . 0 0 "[ . 1]" 1 485 1 18 TYR QE 1 36 PRO HD2 3.215 . 4.630 4.556 4.463 4.612 . 0 0 "[ . 1]" 1 486 1 18 TYR QE 1 36 PRO HD3 3.085 . 4.370 2.912 2.794 2.991 . 0 0 "[ . 1]" 1 487 1 18 TYR QE 1 36 PRO QG 2.795 . 3.790 3.505 3.356 3.657 . 0 0 "[ . 1]" 1 488 1 18 TYR QE 1 42 GLU QG 3.065 . 4.330 3.803 3.629 4.088 . 0 0 "[ . 1]" 1 489 1 18 TYR QE 2 22 VAL MG1 3.060 . 4.320 3.592 3.384 3.872 . 0 0 "[ . 1]" 1 490 1 19 HIS H 1 19 HIS HB2 2.545 . 3.290 2.192 2.177 2.200 . 0 0 "[ . 1]" 1 491 1 19 HIS H 1 19 HIS HB3 2.695 . 3.590 3.437 3.416 3.472 . 0 0 "[ . 1]" 1 492 1 19 HIS H 1 34 VAL HA 3.105 . 4.410 4.158 4.083 4.235 . 0 0 "[ . 1]" 1 493 1 19 HIS H 1 34 VAL QG 3.040 . 4.280 3.467 3.434 3.509 . 0 0 "[ . 1]" 1 494 1 19 HIS H 1 35 ILE H 2.760 . 3.720 2.508 2.418 2.592 . 0 0 "[ . 1]" 1 495 1 19 HIS H 1 35 ILE HB 3.045 . 4.290 3.337 3.195 3.426 . 0 0 "[ . 1]" 1 496 1 19 HIS H 1 35 ILE HG12 3.580 . 5.360 5.324 5.231 5.374 0.014 8 0 "[ . 1]" 1 497 1 19 HIS H 1 35 ILE HG13 3.395 . 4.990 4.118 3.996 4.189 . 0 0 "[ . 1]" 1 498 1 19 HIS H 1 35 ILE MG 3.410 . 5.020 4.546 4.470 4.600 . 0 0 "[ . 1]" 1 499 1 19 HIS H 1 36 PRO HA 3.020 . 4.240 3.896 3.788 4.040 . 0 0 "[ . 1]" 1 500 1 19 HIS H 1 37 SER H 3.570 . 5.340 4.325 4.091 4.875 . 0 0 "[ . 1]" 1 501 1 19 HIS H 2 19 HIS HD2 3.200 . 4.600 4.663 4.534 4.729 0.129 7 0 "[ . 1]" 1 502 1 19 HIS H 2 20 LEU HB3 3.510 . 5.220 4.783 4.717 4.832 . 0 0 "[ . 1]" 1 503 1 19 HIS H 2 20 LEU MD2 3.650 . 5.500 5.427 5.284 5.497 . 0 0 "[ . 1]" 1 504 1 19 HIS HA 1 19 HIS HD2 2.670 . 3.540 2.475 2.242 2.627 . 0 0 "[ . 1]" 1 505 1 19 HIS HA 1 20 LEU H 2.375 . 2.950 2.096 2.082 2.109 . 0 0 "[ . 1]" 1 506 1 19 HIS HA 1 20 LEU HA 3.140 . 4.480 4.373 4.367 4.386 . 0 0 "[ . 1]" 1 507 1 19 HIS HA 1 20 LEU HB2 3.510 . 5.220 4.733 4.652 4.786 . 0 0 "[ . 1]" 1 508 1 19 HIS HA 1 20 LEU HB3 3.080 . 4.360 4.234 4.176 4.273 . 0 0 "[ . 1]" 1 509 1 19 HIS HA 1 21 ILE HG13 3.555 . 5.310 4.795 4.735 4.840 . 0 0 "[ . 1]" 1 510 1 19 HIS HA 1 34 VAL MG1 3.650 . 5.500 4.912 4.829 5.030 . 0 0 "[ . 1]" 1 511 1 19 HIS HA 1 34 VAL MG2 3.650 . 5.500 5.556 5.539 5.573 0.073 1 0 "[ . 1]" 1 512 1 19 HIS HA 1 35 ILE HB 3.650 . 5.500 5.186 5.037 5.302 . 0 0 "[ . 1]" 1 513 1 19 HIS HA 1 35 ILE HG13 3.650 . 5.500 5.232 5.201 5.265 . 0 0 "[ . 1]" 1 514 1 19 HIS HA 2 17 THR MG 2.775 . 3.750 3.612 3.385 3.763 0.013 7 0 "[ . 1]" 1 515 1 19 HIS HA 2 19 HIS HB2 3.650 . 5.500 5.543 5.490 5.595 0.095 10 0 "[ . 1]" 1 516 1 19 HIS HA 2 19 HIS HB3 3.650 . 5.500 5.335 5.269 5.475 . 0 0 "[ . 1]" 1 517 1 19 HIS HA 2 19 HIS HD2 2.920 . 4.040 3.416 3.125 3.609 . 0 0 "[ . 1]" 1 518 1 19 HIS HA 2 20 LEU HB3 3.555 . 5.310 4.338 4.226 4.503 . 0 0 "[ . 1]" 1 519 1 19 HIS HB2 1 19 HIS HE1 3.280 . 4.760 4.713 4.702 4.747 . 0 0 "[ . 1]" 1 520 1 19 HIS HB2 1 20 LEU H 3.305 . 4.810 4.454 4.427 4.472 . 0 0 "[ . 1]" 1 521 1 19 HIS HB2 1 21 ILE MD 3.115 . 4.430 4.264 4.166 4.318 . 0 0 "[ . 1]" 1 522 1 19 HIS HB2 1 21 ILE HG13 3.650 . 5.500 5.124 5.037 5.198 . 0 0 "[ . 1]" 1 523 1 19 HIS HB2 1 34 VAL QG 3.430 . 5.060 4.632 4.518 4.716 . 0 0 "[ . 1]" 1 524 1 19 HIS HB2 1 35 ILE H 2.930 . 4.060 2.852 2.689 2.933 . 0 0 "[ . 1]" 1 525 1 19 HIS HB2 1 35 ILE HB 2.730 . 3.660 2.285 2.107 2.434 . 0 0 "[ . 1]" 1 526 1 19 HIS HB2 1 35 ILE MD 3.020 . 4.240 3.274 3.014 3.452 . 0 0 "[ . 1]" 1 527 1 19 HIS HB2 1 35 ILE HG12 3.125 . 4.450 4.455 4.338 4.495 0.045 2 0 "[ . 1]" 1 528 1 19 HIS HB2 1 35 ILE HG13 2.910 . 4.020 2.990 2.875 3.067 . 0 0 "[ . 1]" 1 529 1 19 HIS HB2 1 35 ILE MG 3.150 . 4.500 3.972 3.815 4.101 . 0 0 "[ . 1]" 1 530 1 19 HIS HB2 2 17 THR MG 3.120 . 4.440 4.266 4.058 4.394 . 0 0 "[ . 1]" 1 531 1 19 HIS HB2 2 19 HIS HA 3.650 . 5.500 5.540 5.485 5.591 0.091 10 0 "[ . 1]" 1 532 1 19 HIS HB3 1 20 LEU H 3.010 . 4.220 3.576 3.545 3.597 . 0 0 "[ . 1]" 1 533 1 19 HIS HB3 1 21 ILE MD 3.050 . 4.300 3.023 2.945 3.138 . 0 0 "[ . 1]" 1 534 1 19 HIS HB3 1 21 ILE HG13 3.520 . 5.240 3.479 3.420 3.544 . 0 0 "[ . 1]" 1 535 1 19 HIS HB3 1 34 VAL QG 3.620 . 5.440 4.905 4.849 4.970 . 0 0 "[ . 1]" 1 536 1 19 HIS HB3 1 35 ILE H 3.015 . 4.230 3.496 3.444 3.538 . 0 0 "[ . 1]" 1 537 1 19 HIS HB3 1 35 ILE HB 2.965 . 4.130 3.588 3.371 3.728 . 0 0 "[ . 1]" 1 538 1 19 HIS HB3 1 35 ILE MD 3.175 . 4.550 3.338 3.056 3.576 . 0 0 "[ . 1]" 1 539 1 19 HIS HB3 1 35 ILE HG12 3.280 . 4.760 4.841 4.800 4.869 0.109 5 0 "[ . 1]" 1 540 1 19 HIS HB3 1 35 ILE HG13 3.015 . 4.230 3.124 3.088 3.181 . 0 0 "[ . 1]" 1 541 1 19 HIS HB3 1 35 ILE MG 3.535 . 5.270 4.932 4.757 5.052 . 0 0 "[ . 1]" 1 542 1 19 HIS HB3 2 17 THR MG 2.550 . 3.300 2.965 2.719 3.112 . 0 0 "[ . 1]" 1 543 1 19 HIS HB3 2 19 HIS HA 3.650 . 5.500 5.335 5.267 5.477 . 0 0 "[ . 1]" 1 544 1 19 HIS HD2 2 17 THR MG 2.780 . 3.760 2.204 2.015 2.356 . 0 0 "[ . 1]" 1 545 1 19 HIS HD2 2 19 HIS H 3.200 . 4.600 4.658 4.541 4.698 0.098 2 0 "[ . 1]" 1 546 1 19 HIS HD2 2 19 HIS HA 2.920 . 4.040 3.407 3.123 3.592 . 0 0 "[ . 1]" 1 547 1 19 HIS HD2 2 37 SER QB 3.410 . 5.020 4.193 3.445 4.910 . 0 0 "[ . 1]" 1 548 1 20 LEU H 1 20 LEU HB2 2.805 . 3.810 3.148 3.051 3.191 . 0 0 "[ . 1]" 1 549 1 20 LEU H 1 20 LEU HB3 2.735 . 3.670 2.324 2.308 2.337 . 0 0 "[ . 1]" 1 550 1 20 LEU H 1 20 LEU MD1 3.170 . 4.540 4.275 4.250 4.304 . 0 0 "[ . 1]" 1 551 1 20 LEU H 1 20 LEU MD2 3.050 . 4.300 4.316 4.283 4.326 0.026 6 0 "[ . 1]" 1 552 1 20 LEU H 1 20 LEU HG 3.225 . 4.650 4.126 4.079 4.194 . 0 0 "[ . 1]" 1 553 1 20 LEU H 1 21 ILE MD 3.400 . 5.000 4.832 4.802 4.858 . 0 0 "[ . 1]" 1 554 1 20 LEU H 1 21 ILE HG13 3.285 . 4.770 3.847 3.808 3.885 . 0 0 "[ . 1]" 1 555 1 20 LEU H 1 34 VAL MG1 3.650 . 5.500 4.825 4.700 4.975 . 0 0 "[ . 1]" 1 556 1 20 LEU H 1 34 VAL MG2 3.650 . 5.500 4.656 4.636 4.698 . 0 0 "[ . 1]" 1 557 1 20 LEU H 2 17 THR MG 3.050 . 4.300 3.585 3.454 3.754 . 0 0 "[ . 1]" 1 558 1 20 LEU H 2 34 VAL QG 3.620 . 5.440 4.696 4.629 4.753 . 0 0 "[ . 1]" 1 559 1 20 LEU HA 1 20 LEU MD1 2.495 . 3.190 2.317 2.232 2.381 . 0 0 "[ . 1]" 1 560 1 20 LEU HA 1 20 LEU MD2 2.935 . 4.070 3.918 3.889 3.952 . 0 0 "[ . 1]" 1 561 1 20 LEU HA 1 20 LEU HG 2.700 . 3.600 3.458 3.412 3.482 . 0 0 "[ . 1]" 1 562 1 20 LEU HA 1 21 ILE H 2.350 . 2.900 2.114 2.107 2.120 . 0 0 "[ . 1]" 1 563 1 20 LEU HA 1 21 ILE HA 3.240 . 4.680 4.383 4.376 4.389 . 0 0 "[ . 1]" 1 564 1 20 LEU HA 1 21 ILE HB 3.345 . 4.890 4.663 4.612 4.695 . 0 0 "[ . 1]" 1 565 1 20 LEU HA 1 21 ILE MD 3.075 . 4.350 4.462 4.444 4.475 0.125 9 0 "[ . 1]" 1 566 1 20 LEU HA 1 21 ILE HG13 3.055 . 4.310 3.644 3.576 3.724 . 0 0 "[ . 1]" 1 567 1 20 LEU HA 1 33 SER H 3.195 . 4.590 4.528 4.449 4.592 0.002 10 0 "[ . 1]" 1 568 1 20 LEU HA 1 33 SER QB 3.530 . 5.260 4.724 4.595 4.867 . 0 0 "[ . 1]" 1 569 1 20 LEU HA 1 34 VAL HA 2.530 . 3.260 2.680 2.633 2.746 . 0 0 "[ . 1]" 1 570 1 20 LEU HA 1 34 VAL HB 3.650 . 5.500 4.993 4.946 5.085 . 0 0 "[ . 1]" 1 571 1 20 LEU HA 1 34 VAL QG 2.745 . 3.690 2.377 2.315 2.457 . 0 0 "[ . 1]" 1 572 1 20 LEU HA 1 35 ILE H 3.170 . 4.540 4.086 4.015 4.163 . 0 0 "[ . 1]" 1 573 1 20 LEU HA 2 17 THR MG 3.650 . 5.500 4.995 4.850 5.139 . 0 0 "[ . 1]" 1 574 1 20 LEU HA 2 18 TYR QB 3.370 . 4.940 4.624 4.542 4.666 . 0 0 "[ . 1]" 1 575 1 20 LEU HA 2 20 LEU MD2 3.195 . 4.590 3.969 3.831 4.046 . 0 0 "[ . 1]" 1 576 1 20 LEU HB2 1 20 LEU MD1 2.525 . 3.250 2.401 2.379 2.416 . 0 0 "[ . 1]" 1 577 1 20 LEU HB2 1 20 LEU MD2 2.515 . 3.230 2.335 2.321 2.368 . 0 0 "[ . 1]" 1 578 1 20 LEU HB2 1 21 ILE H 3.080 . 4.360 4.137 4.106 4.162 . 0 0 "[ . 1]" 1 579 1 20 LEU HB2 1 34 VAL HA 3.285 . 4.770 4.305 4.235 4.421 . 0 0 "[ . 1]" 1 580 1 20 LEU HB2 1 34 VAL QG 2.865 . 3.930 2.723 2.612 2.900 . 0 0 "[ . 1]" 1 581 1 20 LEU HB2 2 12 LEU MD1 3.255 . 4.710 4.654 4.585 4.714 0.004 6 0 "[ . 1]" 1 582 1 20 LEU HB2 2 18 TYR QB 3.115 . 4.430 4.009 3.777 4.072 . 0 0 "[ . 1]" 1 583 1 20 LEU HB2 2 20 LEU HB3 3.200 . 4.600 2.609 2.480 2.836 . 0 0 "[ . 1]" 1 584 1 20 LEU HB2 2 20 LEU MD1 3.650 . 5.500 4.043 3.931 4.151 . 0 0 "[ . 1]" 1 585 1 20 LEU HB2 2 20 LEU MD2 2.755 . 3.710 2.460 2.376 2.597 . 0 0 "[ . 1]" 1 586 1 20 LEU HB2 2 20 LEU HG 3.545 . 5.290 4.399 4.249 4.587 . 0 0 "[ . 1]" 1 587 1 20 LEU HB2 2 54 ILE MD 3.595 . 5.390 5.445 5.414 5.485 0.095 7 0 "[ . 1]" 1 588 1 20 LEU HB3 1 20 LEU MD1 2.700 . 3.600 3.193 3.188 3.196 . 0 0 "[ . 1]" 1 589 1 20 LEU HB3 1 20 LEU MD2 2.500 . 3.200 2.350 2.320 2.363 . 0 0 "[ . 1]" 1 590 1 20 LEU HB3 1 21 ILE H 3.380 . 4.960 4.410 4.362 4.437 . 0 0 "[ . 1]" 1 591 1 20 LEU HB3 1 34 VAL HA 3.650 . 5.500 5.382 5.318 5.503 0.003 10 0 "[ . 1]" 1 592 1 20 LEU HB3 2 17 THR MG 3.650 . 5.500 5.135 5.022 5.305 . 0 0 "[ . 1]" 1 593 1 20 LEU HB3 2 18 TYR HA 3.650 . 5.500 4.837 4.612 4.918 . 0 0 "[ . 1]" 1 594 1 20 LEU HB3 2 18 TYR QB 2.575 . 3.350 2.479 2.194 2.582 . 0 0 "[ . 1]" 1 595 1 20 LEU HB3 2 18 TYR QD 3.475 . 5.150 4.448 4.147 4.594 . 0 0 "[ . 1]" 1 596 1 20 LEU HB3 2 19 HIS H 3.510 . 5.220 4.790 4.735 4.833 . 0 0 "[ . 1]" 1 597 1 20 LEU HB3 2 19 HIS HA 3.555 . 5.310 4.347 4.241 4.517 . 0 0 "[ . 1]" 1 598 1 20 LEU HB3 2 20 LEU HB2 3.200 . 4.600 2.606 2.472 2.831 . 0 0 "[ . 1]" 1 599 1 20 LEU HB3 2 20 LEU MD1 3.500 . 5.200 4.501 4.427 4.575 . 0 0 "[ . 1]" 1 600 1 20 LEU HB3 2 20 LEU MD2 2.955 . 4.110 3.679 3.614 3.903 . 0 0 "[ . 1]" 1 601 1 20 LEU HB3 2 34 VAL HA 3.650 . 5.500 5.297 5.153 5.385 . 0 0 "[ . 1]" 1 602 1 20 LEU HB3 2 34 VAL MG1 3.575 . 5.350 3.573 3.491 3.694 . 0 0 "[ . 1]" 1 603 1 20 LEU HB3 2 34 VAL QG 3.165 . 4.530 3.349 3.286 3.421 . 0 0 "[ . 1]" 1 604 1 20 LEU HB3 2 34 VAL MG2 3.575 . 5.350 4.050 3.962 4.097 . 0 0 "[ . 1]" 1 605 1 20 LEU MD1 1 21 ILE H 2.685 . 3.570 2.145 2.058 2.226 . 0 0 "[ . 1]" 1 606 1 20 LEU MD1 1 33 SER H 2.855 . 3.910 3.436 3.374 3.492 . 0 0 "[ . 1]" 1 607 1 20 LEU MD1 1 34 VAL HA 3.335 . 4.870 4.010 3.927 4.084 . 0 0 "[ . 1]" 1 608 1 20 LEU MD1 2 12 LEU HB3 3.515 . 5.230 5.222 5.148 5.256 0.026 8 0 "[ . 1]" 1 609 1 20 LEU MD1 2 12 LEU MD1 2.850 . 3.900 2.719 2.677 2.759 . 0 0 "[ . 1]" 1 610 1 20 LEU MD1 2 17 THR HA 3.650 . 5.500 5.652 5.613 5.676 0.176 7 0 "[ . 1]" 1 611 1 20 LEU MD1 2 18 TYR QB 3.260 . 4.720 4.083 4.024 4.168 . 0 0 "[ . 1]" 1 612 1 20 LEU MD1 2 20 LEU HB2 3.650 . 5.500 4.048 3.938 4.153 . 0 0 "[ . 1]" 1 613 1 20 LEU MD1 2 20 LEU HB3 3.500 . 5.200 4.508 4.436 4.582 . 0 0 "[ . 1]" 1 614 1 20 LEU MD2 1 21 ILE H 3.395 . 4.990 4.727 4.672 4.778 . 0 0 "[ . 1]" 1 615 1 20 LEU MD2 1 21 ILE HA 3.475 . 5.150 5.169 5.156 5.199 0.049 10 0 "[ . 1]" 1 616 1 20 LEU MD2 1 22 VAL HB 3.285 . 4.770 4.685 4.600 4.775 0.005 10 0 "[ . 1]" 1 617 1 20 LEU MD2 2 10 LEU QB 3.310 . 4.820 4.869 4.834 4.899 0.079 10 0 "[ . 1]" 1 618 1 20 LEU MD2 2 12 LEU MD1 2.395 . 2.990 1.836 1.798 1.901 0.002 10 0 "[ . 1]" 1 619 1 20 LEU MD2 2 12 LEU MD2 2.670 . 3.540 3.027 2.857 3.110 . 0 0 "[ . 1]" 1 620 1 20 LEU MD2 2 18 TYR QB 2.615 . 3.430 2.864 2.758 2.926 . 0 0 "[ . 1]" 1 621 1 20 LEU MD2 2 18 TYR QD 3.025 . 4.250 4.127 4.021 4.211 . 0 0 "[ . 1]" 1 622 1 20 LEU MD2 2 19 HIS H 3.650 . 5.500 5.434 5.286 5.501 0.001 8 0 "[ . 1]" 1 623 1 20 LEU MD2 2 20 LEU HA 3.195 . 4.590 3.974 3.835 4.051 . 0 0 "[ . 1]" 1 624 1 20 LEU MD2 2 20 LEU HB2 2.755 . 3.710 2.466 2.381 2.605 . 0 0 "[ . 1]" 1 625 1 20 LEU MD2 2 20 LEU HB3 2.955 . 4.110 3.686 3.615 3.912 . 0 0 "[ . 1]" 1 626 1 20 LEU MD2 2 32 LEU MD1 3.275 . 4.750 4.593 4.398 4.713 . 0 0 "[ . 1]" 1 627 1 20 LEU MD2 2 34 VAL MG1 2.680 . 3.560 2.538 2.419 2.682 . 0 0 "[ . 1]" 1 628 1 20 LEU MD2 2 34 VAL QG 2.415 . 3.030 2.259 2.176 2.347 . 0 0 "[ . 1]" 1 629 1 20 LEU MD2 2 34 VAL MG2 2.680 . 3.560 2.537 2.424 2.599 . 0 0 "[ . 1]" 1 630 1 20 LEU HG 1 21 ILE H 2.915 . 4.030 3.713 3.615 3.804 . 0 0 "[ . 1]" 1 631 1 20 LEU HG 1 22 VAL HB 3.360 . 4.920 4.576 4.518 4.632 . 0 0 "[ . 1]" 1 632 1 20 LEU HG 1 32 LEU MD1 3.125 . 4.450 3.958 3.880 4.057 . 0 0 "[ . 1]" 1 633 1 20 LEU HG 2 12 LEU MD1 2.680 . 3.560 2.394 2.310 2.470 . 0 0 "[ . 1]" 1 634 1 20 LEU HG 2 18 TYR QB 2.955 . 4.110 2.644 2.552 2.794 . 0 0 "[ . 1]" 1 635 1 20 LEU HG 2 20 LEU HB2 3.545 . 5.290 4.400 4.248 4.588 . 0 0 "[ . 1]" 1 636 1 21 ILE H 1 21 ILE HB 2.625 . 3.450 2.751 2.733 2.776 . 0 0 "[ . 1]" 1 637 1 21 ILE H 1 21 ILE MD 3.095 . 4.390 3.571 3.473 3.637 . 0 0 "[ . 1]" 1 638 1 21 ILE H 1 21 ILE HG12 3.315 . 4.830 4.184 4.148 4.204 . 0 0 "[ . 1]" 1 639 1 21 ILE H 1 21 ILE HG13 2.990 . 4.180 2.798 2.753 2.839 . 0 0 "[ . 1]" 1 640 1 21 ILE H 1 21 ILE MG 2.905 . 4.010 3.903 3.895 3.913 . 0 0 "[ . 1]" 1 641 1 21 ILE H 1 22 VAL H 3.150 . 4.500 4.238 4.225 4.247 . 0 0 "[ . 1]" 1 642 1 21 ILE H 1 32 LEU MD1 3.375 . 4.950 3.827 3.699 3.978 . 0 0 "[ . 1]" 1 643 1 21 ILE H 1 32 LEU HG 3.195 . 4.590 4.186 3.996 4.367 . 0 0 "[ . 1]" 1 644 1 21 ILE H 1 33 SER QB 2.915 . 4.030 3.300 3.163 3.443 . 0 0 "[ . 1]" 1 645 1 21 ILE H 1 34 VAL HA 3.050 . 4.300 3.654 3.578 3.735 . 0 0 "[ . 1]" 1 646 1 21 ILE H 1 34 VAL QG 3.190 . 4.580 3.400 3.336 3.455 . 0 0 "[ . 1]" 1 647 1 21 ILE HA 1 21 ILE MD 3.190 . 4.580 3.922 3.914 3.931 . 0 0 "[ . 1]" 1 648 1 21 ILE HA 1 21 ILE HG13 2.850 . 3.900 2.784 2.745 2.821 . 0 0 "[ . 1]" 1 649 1 21 ILE HA 1 21 ILE MG 2.515 . 3.230 2.351 2.341 2.361 . 0 0 "[ . 1]" 1 650 1 21 ILE HA 1 22 VAL H 2.545 . 3.290 2.159 2.147 2.169 . 0 0 "[ . 1]" 1 651 1 21 ILE HA 2 18 TYR QD 3.225 . 4.650 3.398 3.254 3.606 . 0 0 "[ . 1]" 1 652 1 21 ILE HB 1 21 ILE MD 2.595 . 3.390 2.274 2.261 2.287 . 0 0 "[ . 1]" 1 653 1 21 ILE HB 1 22 VAL H 3.330 . 4.860 4.176 4.162 4.191 . 0 0 "[ . 1]" 1 654 1 21 ILE HB 1 33 SER H 2.980 . 4.160 3.253 3.065 3.542 . 0 0 "[ . 1]" 1 655 1 21 ILE HB 1 33 SER HA 3.650 . 5.500 4.816 4.664 5.122 . 0 0 "[ . 1]" 1 656 1 21 ILE HB 1 33 SER QB 2.530 . 3.260 1.999 1.799 2.336 0.001 5 0 "[ . 1]" 1 657 1 21 ILE MD 1 33 SER HB2 2.945 . 4.090 2.706 2.398 3.804 . 0 0 "[ . 1]" 1 658 1 21 ILE MD 1 33 SER QB 2.650 . 3.500 2.471 2.303 2.844 . 0 0 "[ . 1]" 1 659 1 21 ILE MD 1 33 SER HB3 2.945 . 4.090 3.111 2.441 3.601 . 0 0 "[ . 1]" 1 660 1 21 ILE MD 1 34 VAL HA 3.590 . 5.380 4.501 4.431 4.594 . 0 0 "[ . 1]" 1 661 1 21 ILE MD 1 35 ILE HG12 3.040 . 4.280 4.202 4.039 4.305 0.025 2 0 "[ . 1]" 1 662 1 21 ILE MD 2 17 THR HA 2.805 . 3.810 3.712 3.559 3.782 . 0 0 "[ . 1]" 1 663 1 21 ILE MD 2 17 THR HB 3.420 . 5.040 4.739 4.537 4.818 . 0 0 "[ . 1]" 1 664 1 21 ILE MD 2 17 THR MG 2.805 . 3.810 2.299 2.216 2.430 . 0 0 "[ . 1]" 1 665 1 21 ILE HG12 1 21 ILE MG 2.420 . 3.040 2.213 2.199 2.230 . 0 0 "[ . 1]" 1 666 1 21 ILE HG12 2 17 THR HA 2.620 . 3.440 2.130 1.991 2.245 . 0 0 "[ . 1]" 1 667 1 21 ILE HG12 2 17 THR MG 3.175 . 4.550 2.177 2.005 2.290 . 0 0 "[ . 1]" 1 668 1 21 ILE HG12 2 18 TYR H 3.285 . 4.770 3.604 3.512 3.787 . 0 0 "[ . 1]" 1 669 1 21 ILE HG13 1 33 SER QB 3.455 . 5.110 3.853 3.594 4.270 . 0 0 "[ . 1]" 1 670 1 21 ILE HG13 2 17 THR HA 2.745 . 3.690 2.935 2.762 3.092 . 0 0 "[ . 1]" 1 671 1 21 ILE HG13 2 17 THR MG 2.845 . 3.890 2.439 2.365 2.513 . 0 0 "[ . 1]" 1 672 1 21 ILE HG13 2 18 TYR H 3.140 . 4.480 3.275 3.171 3.356 . 0 0 "[ . 1]" 1 673 1 21 ILE MG 1 22 VAL H 2.820 . 3.840 2.782 2.759 2.815 . 0 0 "[ . 1]" 1 674 1 21 ILE MG 1 22 VAL HA 2.920 . 4.040 3.627 3.571 3.674 . 0 0 "[ . 1]" 1 675 1 21 ILE MG 1 23 ASP H 3.170 . 4.540 4.135 3.954 4.277 . 0 0 "[ . 1]" 1 676 1 21 ILE MG 1 23 ASP QB 2.800 . 3.800 2.955 2.799 3.157 . 0 0 "[ . 1]" 1 677 1 21 ILE MG 1 33 SER QB 2.885 . 3.970 3.414 3.300 3.653 . 0 0 "[ . 1]" 1 678 1 21 ILE MG 2 15 GLY H 2.825 . 3.850 3.709 3.649 3.834 . 0 0 "[ . 1]" 1 679 1 21 ILE MG 2 15 GLY HA2 2.665 . 3.530 3.206 3.119 3.261 . 0 0 "[ . 1]" 1 680 1 21 ILE MG 2 15 GLY HA3 3.125 . 4.450 4.508 4.454 4.546 0.096 2 0 "[ . 1]" 1 681 1 21 ILE MG 2 16 GLN H 2.920 . 4.040 3.804 3.511 4.018 . 0 0 "[ . 1]" 1 682 1 21 ILE MG 2 17 THR HA 3.000 . 4.200 3.076 2.934 3.357 . 0 0 "[ . 1]" 1 683 1 22 VAL H 1 22 VAL MG1 2.820 . 3.840 2.165 2.118 2.233 . 0 0 "[ . 1]" 1 684 1 22 VAL H 2 15 GLY H 3.265 . 4.730 3.740 3.641 3.824 . 0 0 "[ . 1]" 1 685 1 22 VAL HA 1 22 VAL MG2 2.485 . 3.170 2.335 2.314 2.347 . 0 0 "[ . 1]" 1 686 1 22 VAL HA 1 23 ASP H 2.275 . 2.750 2.171 2.157 2.195 . 0 0 "[ . 1]" 1 687 1 22 VAL HA 1 23 ASP QB 3.390 . 4.980 4.061 3.833 4.352 . 0 0 "[ . 1]" 1 688 1 22 VAL HA 1 32 LEU H 3.575 . 5.350 4.991 4.933 5.106 . 0 0 "[ . 1]" 1 689 1 22 VAL HA 1 32 LEU MD1 2.995 . 4.190 2.842 2.688 3.046 . 0 0 "[ . 1]" 1 690 1 22 VAL HA 1 33 SER H 3.020 . 4.240 3.660 3.590 3.745 . 0 0 "[ . 1]" 1 691 1 22 VAL HA 2 12 LEU MD1 3.270 . 4.740 4.763 4.730 4.809 0.069 6 0 "[ . 1]" 1 692 1 22 VAL HB 1 23 ASP H 3.105 . 4.410 4.159 4.062 4.215 . 0 0 "[ . 1]" 1 693 1 22 VAL HB 1 31 SER H 3.650 . 5.500 5.578 5.545 5.600 0.100 10 0 "[ . 1]" 1 694 1 22 VAL HB 1 32 LEU MD1 3.005 . 4.210 2.591 2.364 2.833 . 0 0 "[ . 1]" 1 695 1 22 VAL HB 2 12 LEU MD1 3.100 . 4.400 2.781 2.740 2.827 . 0 0 "[ . 1]" 1 696 1 22 VAL HB 2 15 GLY H 3.650 . 5.500 5.537 5.517 5.570 0.070 9 0 "[ . 1]" 1 697 1 22 VAL HB 2 50 ILE MD 3.230 . 4.660 4.511 4.315 4.669 0.009 3 0 "[ . 1]" 1 698 1 22 VAL HB 2 50 ILE MG 3.500 . 5.200 5.012 4.890 5.204 0.004 1 0 "[ . 1]" 1 699 1 22 VAL HB 2 52 LEU MD1 3.290 . 4.780 3.360 3.199 3.544 . 0 0 "[ . 1]" 1 700 1 22 VAL HB 2 52 LEU QD 2.960 . 4.120 2.693 2.585 2.814 . 0 0 "[ . 1]" 1 701 1 22 VAL HB 2 52 LEU MD2 3.290 . 4.780 2.837 2.719 3.005 . 0 0 "[ . 1]" 1 702 1 22 VAL MG1 1 23 ASP HA 3.005 . 4.210 3.722 3.590 3.829 . 0 0 "[ . 1]" 1 703 1 22 VAL MG1 1 23 ASP HB2 3.650 . 5.500 5.167 4.789 5.602 0.102 3 0 "[ . 1]" 1 704 1 22 VAL MG1 1 23 ASP QB 3.315 . 4.830 4.575 4.510 4.665 . 0 0 "[ . 1]" 1 705 1 22 VAL MG1 1 23 ASP HB3 3.650 . 5.500 5.273 4.768 5.608 0.108 10 0 "[ . 1]" 1 706 1 22 VAL MG1 2 11 ALA HA 3.615 . 5.430 5.442 5.379 5.517 0.087 6 0 "[ . 1]" 1 707 1 22 VAL MG1 2 12 LEU HB2 2.825 . 3.850 1.896 1.796 1.961 0.004 7 0 "[ . 1]" 1 708 1 22 VAL MG1 2 12 LEU HB3 2.800 . 3.800 2.507 2.421 2.604 . 0 0 "[ . 1]" 1 709 1 22 VAL MG1 2 12 LEU MD1 2.405 . 3.010 2.401 2.300 2.556 . 0 0 "[ . 1]" 1 710 1 22 VAL MG1 2 12 LEU MD2 2.995 . 4.190 3.906 3.829 3.990 . 0 0 "[ . 1]" 1 711 1 22 VAL MG1 2 14 GLY H 3.280 . 4.760 4.260 4.153 4.372 . 0 0 "[ . 1]" 1 712 1 22 VAL MG1 2 14 GLY HA2 2.940 . 4.080 2.498 2.340 2.622 . 0 0 "[ . 1]" 1 713 1 22 VAL MG1 2 14 GLY HA3 2.955 . 4.110 4.008 3.837 4.127 0.017 9 0 "[ . 1]" 1 714 1 22 VAL MG1 2 15 GLY H 3.110 . 4.420 3.033 2.938 3.142 . 0 0 "[ . 1]" 1 715 1 22 VAL MG1 2 16 GLN H 3.230 . 4.660 3.869 3.702 4.063 . 0 0 "[ . 1]" 1 716 1 22 VAL MG1 2 18 TYR QD 3.170 . 4.540 3.844 3.663 4.059 . 0 0 "[ . 1]" 1 717 1 22 VAL MG1 2 18 TYR QE 3.060 . 4.320 3.595 3.359 3.854 . 0 0 "[ . 1]" 1 718 1 22 VAL MG1 2 50 ILE H 2.875 . 3.950 3.968 3.854 4.019 0.069 6 0 "[ . 1]" 1 719 1 22 VAL MG1 2 50 ILE HB 2.680 . 3.560 2.828 2.711 3.039 . 0 0 "[ . 1]" 1 720 1 22 VAL MG1 2 50 ILE MD 2.565 . 3.330 2.616 2.368 2.848 . 0 0 "[ . 1]" 1 721 1 22 VAL MG1 2 50 ILE HG12 3.475 . 5.150 4.918 4.761 5.128 . 0 0 "[ . 1]" 1 722 1 22 VAL MG1 2 50 ILE HG13 3.000 . 4.200 4.042 3.908 4.164 . 0 0 "[ . 1]" 1 723 1 22 VAL MG1 2 52 LEU HB2 3.650 . 5.500 5.261 5.089 5.395 . 0 0 "[ . 1]" 1 724 1 22 VAL MG1 2 52 LEU QD 2.410 . 3.020 2.324 2.166 2.526 . 0 0 "[ . 1]" 1 725 1 22 VAL MG2 1 23 ASP H 2.530 . 3.260 2.497 2.307 2.623 . 0 0 "[ . 1]" 1 726 1 22 VAL MG2 1 23 ASP HA 3.155 . 4.510 3.576 3.503 3.714 . 0 0 "[ . 1]" 1 727 1 22 VAL MG2 1 23 ASP HB2 3.650 . 5.500 5.032 4.657 5.325 . 0 0 "[ . 1]" 1 728 1 22 VAL MG2 1 23 ASP HB3 3.650 . 5.500 4.812 4.755 4.904 . 0 0 "[ . 1]" 1 729 1 22 VAL MG2 1 30 PRO HA 3.045 . 4.290 3.640 3.456 3.817 . 0 0 "[ . 1]" 1 730 1 22 VAL MG2 1 31 SER H 2.805 . 3.810 3.060 2.990 3.096 . 0 0 "[ . 1]" 1 731 1 22 VAL MG2 1 32 LEU H 3.420 . 5.040 4.919 4.784 5.053 0.013 4 0 "[ . 1]" 1 732 1 22 VAL MG2 1 32 LEU HA 2.780 . 3.760 3.554 3.387 3.692 . 0 0 "[ . 1]" 1 733 1 22 VAL MG2 1 32 LEU MD1 2.640 . 3.480 2.849 2.647 3.099 . 0 0 "[ . 1]" 1 734 1 22 VAL MG2 2 50 ILE HB 2.840 . 3.880 3.118 2.972 3.271 . 0 0 "[ . 1]" 1 735 1 22 VAL MG2 2 50 ILE MD 2.640 . 3.480 2.292 2.191 2.478 . 0 0 "[ . 1]" 1 736 1 22 VAL MG2 2 50 ILE HG12 3.650 . 5.500 4.596 4.483 4.771 . 0 0 "[ . 1]" 1 737 1 22 VAL MG2 2 52 LEU HB2 3.650 . 5.500 5.444 5.326 5.511 0.011 4 0 "[ . 1]" 1 738 1 22 VAL MG2 2 52 LEU MD1 2.570 . 3.340 2.544 2.413 2.705 . 0 0 "[ . 1]" 1 739 1 22 VAL MG2 2 52 LEU QD 2.335 . 2.870 2.213 2.133 2.282 . 0 0 "[ . 1]" 1 740 1 22 VAL MG2 2 52 LEU MD2 2.570 . 3.340 2.443 2.335 2.587 . 0 0 "[ . 1]" 1 741 1 22 VAL MG2 2 52 LEU HG 2.925 . 4.050 3.729 3.585 3.845 . 0 0 "[ . 1]" 1 742 1 23 ASP H 1 23 ASP HB2 2.890 . 3.980 3.522 3.117 3.931 . 0 0 "[ . 1]" 1 743 1 23 ASP H 1 23 ASP HB3 2.890 . 3.980 2.983 2.700 3.285 . 0 0 "[ . 1]" 1 744 1 23 ASP H 1 30 PRO HA 3.120 . 4.440 4.141 3.878 4.454 0.014 3 0 "[ . 1]" 1 745 1 23 ASP H 1 31 SER H 2.560 . 3.320 2.520 2.401 2.701 . 0 0 "[ . 1]" 1 746 1 23 ASP H 1 31 SER HB2 3.255 . 4.710 4.491 3.094 4.752 0.042 9 0 "[ . 1]" 1 747 1 23 ASP H 1 31 SER HB3 3.160 . 4.520 3.315 3.046 4.232 . 0 0 "[ . 1]" 1 748 1 23 ASP H 1 32 LEU HA 3.195 . 4.590 3.967 3.835 4.101 . 0 0 "[ . 1]" 1 749 1 23 ASP H 2 50 ILE MD 3.220 . 4.640 4.255 4.036 4.473 . 0 0 "[ . 1]" 1 750 1 23 ASP HA 1 24 THR H 2.350 . 2.900 2.466 2.305 2.562 . 0 0 "[ . 1]" 1 751 1 23 ASP HA 1 24 THR MG 3.105 . 4.410 3.873 3.678 4.118 . 0 0 "[ . 1]" 1 752 1 23 ASP HA 1 31 SER H 3.300 . 4.800 4.534 4.454 4.617 . 0 0 "[ . 1]" 1 753 1 23 ASP HA 2 14 GLY HA2 2.945 . 4.090 3.024 2.709 3.318 . 0 0 "[ . 1]" 1 754 1 23 ASP HA 2 14 GLY HA3 2.835 . 3.870 3.671 3.361 3.901 0.031 10 0 "[ . 1]" 1 755 1 23 ASP HA 2 15 GLY H 2.910 . 4.020 2.760 2.561 3.001 . 0 0 "[ . 1]" 1 756 1 23 ASP HA 2 15 GLY HA2 3.345 . 4.890 3.498 3.144 3.897 . 0 0 "[ . 1]" 1 757 1 23 ASP HA 2 50 ILE MD 2.785 . 3.770 3.629 3.255 3.827 0.057 4 0 "[ . 1]" 1 758 1 23 ASP QB 1 24 THR HA 3.415 . 5.030 4.511 4.318 4.682 . 0 0 "[ . 1]" 1 759 1 23 ASP QB 1 31 SER H 3.510 . 5.220 4.240 3.654 4.810 . 0 0 "[ . 1]" 1 760 1 23 ASP QB 1 31 SER HB2 3.570 . 5.340 4.616 2.935 5.398 0.058 6 0 "[ . 1]" 1 761 1 23 ASP QB 1 31 SER HB3 3.135 . 4.470 3.446 2.528 4.139 . 0 0 "[ . 1]" 1 762 1 23 ASP QB 2 15 GLY H 3.025 . 4.250 3.350 2.983 3.835 . 0 0 "[ . 1]" 1 763 1 23 ASP QB 2 15 GLY HA2 2.905 . 4.010 2.566 2.232 3.296 . 0 0 "[ . 1]" 1 764 1 23 ASP QB 2 15 GLY HA3 3.200 . 4.600 3.884 3.441 4.656 0.056 10 0 "[ . 1]" 1 765 1 23 ASP HB2 1 24 THR H 2.845 . 3.890 3.262 2.284 3.912 0.022 8 0 "[ . 1]" 1 766 1 23 ASP HB3 1 24 THR H 2.845 . 3.890 3.678 3.240 3.919 0.029 8 0 "[ . 1]" 1 767 1 24 THR H 1 24 THR HB 2.785 . 3.770 3.655 3.531 3.709 . 0 0 "[ . 1]" 1 768 1 24 THR H 1 24 THR MG 2.685 . 3.570 3.225 2.890 3.448 . 0 0 "[ . 1]" 1 769 1 24 THR H 1 25 ASP H 3.185 . 4.570 4.405 4.326 4.494 . 0 0 "[ . 1]" 1 770 1 24 THR H 1 25 ASP HA 3.510 . 5.220 4.982 4.734 5.124 . 0 0 "[ . 1]" 1 771 1 24 THR H 1 30 PRO HA 3.330 . 4.860 4.734 4.562 4.919 0.059 3 0 "[ . 1]" 1 772 1 24 THR H 2 50 ILE MD 3.245 . 4.690 4.214 3.749 4.531 . 0 0 "[ . 1]" 1 773 1 24 THR HA 1 24 THR MG 2.470 . 3.140 2.215 2.147 2.273 . 0 0 "[ . 1]" 1 774 1 24 THR HA 1 25 ASP H 2.255 . 2.710 2.156 2.070 2.200 . 0 0 "[ . 1]" 1 775 1 24 THR HA 1 25 ASP QB 3.270 . 4.740 4.085 3.921 4.377 . 0 0 "[ . 1]" 1 776 1 24 THR HA 1 28 GLY H 3.615 . 5.430 5.213 4.934 5.462 0.032 3 0 "[ . 1]" 1 777 1 24 THR HA 1 30 PRO HA 2.375 . 2.950 2.437 2.186 2.575 . 0 0 "[ . 1]" 1 778 1 24 THR HA 1 30 PRO HB2 3.645 . 5.490 5.151 4.846 5.413 . 0 0 "[ . 1]" 1 779 1 24 THR HA 1 30 PRO HB3 3.220 . 4.640 4.457 4.082 4.607 . 0 0 "[ . 1]" 1 780 1 24 THR HA 1 31 SER H 2.750 . 3.700 3.423 3.141 3.547 . 0 0 "[ . 1]" 1 781 1 24 THR HA 1 31 SER HB2 3.220 . 4.640 4.509 3.501 4.678 0.038 4 0 "[ . 1]" 1 782 1 24 THR HA 1 31 SER HB3 3.350 . 4.900 4.604 3.959 5.077 0.177 1 0 "[ . 1]" 1 783 1 24 THR HA 2 50 ILE MD 3.375 . 4.950 4.219 4.007 4.432 . 0 0 "[ . 1]" 1 784 1 24 THR HB 1 25 ASP H 2.555 . 3.310 3.086 2.955 3.309 . 0 0 "[ . 1]" 1 785 1 24 THR HB 1 28 GLY H 3.125 . 4.450 4.006 3.566 4.304 . 0 0 "[ . 1]" 1 786 1 24 THR HB 1 28 GLY HA2 2.570 . 3.340 2.849 1.998 3.356 0.016 3 0 "[ . 1]" 1 787 1 24 THR HB 1 29 ASN H 3.285 . 4.770 4.359 3.834 4.749 . 0 0 "[ . 1]" 1 788 1 24 THR HB 1 30 PRO HA 3.365 . 4.930 4.475 4.220 4.686 . 0 0 "[ . 1]" 1 789 1 24 THR HB 2 50 ILE MD 3.570 . 5.340 4.486 4.313 4.655 . 0 0 "[ . 1]" 1 790 1 24 THR MG 1 25 ASP H 2.795 . 3.790 3.468 3.229 3.659 . 0 0 "[ . 1]" 1 791 1 24 THR MG 1 28 GLY H 3.310 . 4.820 4.757 4.579 4.856 0.036 8 0 "[ . 1]" 1 792 1 24 THR MG 1 28 GLY HA2 2.650 . 3.500 3.403 3.119 3.544 0.044 1 0 "[ . 1]" 1 793 1 24 THR MG 1 28 GLY HA3 3.200 . 4.600 4.448 4.003 4.609 0.009 1 0 "[ . 1]" 1 794 1 24 THR MG 1 29 ASN H 3.145 . 4.490 4.311 4.185 4.499 0.009 1 0 "[ . 1]" 1 795 1 24 THR MG 1 29 ASN HA 3.275 . 4.750 4.056 3.818 4.236 . 0 0 "[ . 1]" 1 796 1 24 THR MG 1 29 ASN HB2 3.650 . 5.500 5.321 5.218 5.444 . 0 0 "[ . 1]" 1 797 1 24 THR MG 1 29 ASN HB3 3.650 . 5.500 5.511 5.421 5.569 0.069 7 0 "[ . 1]" 1 798 1 24 THR MG 1 30 PRO HA 2.605 . 3.410 2.484 2.279 2.590 . 0 0 "[ . 1]" 1 799 1 24 THR MG 1 30 PRO HB2 3.145 . 4.490 4.301 4.079 4.508 0.018 2 0 "[ . 1]" 1 800 1 24 THR MG 1 30 PRO HB3 2.690 . 3.580 3.124 2.816 3.374 . 0 0 "[ . 1]" 1 801 1 24 THR MG 1 30 PRO HD3 3.105 . 4.410 3.690 3.422 4.067 . 0 0 "[ . 1]" 1 802 1 24 THR MG 1 30 PRO HG2 3.510 . 5.220 5.023 4.518 5.274 0.054 10 0 "[ . 1]" 1 803 1 24 THR MG 1 31 SER H 3.015 . 4.230 3.979 3.821 4.120 . 0 0 "[ . 1]" 1 804 1 24 THR MG 2 14 GLY HA2 3.560 . 5.320 4.612 4.274 4.930 . 0 0 "[ . 1]" 1 805 1 24 THR MG 2 14 GLY HA3 3.610 . 5.420 4.324 3.754 4.705 . 0 0 "[ . 1]" 1 806 1 24 THR MG 2 50 ILE MD 2.425 . 3.050 1.996 1.841 2.115 . 0 0 "[ . 1]" 1 807 1 24 THR MG 2 50 ILE MG 3.105 . 4.410 3.889 3.611 4.098 . 0 0 "[ . 1]" 1 808 1 25 ASP H 1 25 ASP HB2 2.810 . 3.820 3.265 2.643 3.649 . 0 0 "[ . 1]" 1 809 1 25 ASP H 1 25 ASP QB 2.485 . 3.170 2.300 2.094 2.684 . 0 0 "[ . 1]" 1 810 1 25 ASP H 1 25 ASP HB3 2.810 . 3.820 2.369 2.152 2.763 . 0 0 "[ . 1]" 1 811 1 25 ASP H 1 28 GLY H 3.095 . 4.390 3.661 3.365 4.101 . 0 0 "[ . 1]" 1 812 1 25 ASP H 1 28 GLY HA2 3.205 . 4.610 4.242 3.796 4.618 0.008 7 0 "[ . 1]" 1 813 1 25 ASP H 1 29 ASN H 2.640 . 3.480 3.167 2.847 3.507 0.027 1 0 "[ . 1]" 1 814 1 25 ASP H 1 29 ASN QB 3.115 . 4.430 3.683 3.392 4.501 0.071 7 0 "[ . 1]" 1 815 1 25 ASP H 1 30 PRO HA 2.950 . 4.100 3.868 3.519 4.123 0.023 9 0 "[ . 1]" 1 816 1 25 ASP H 1 31 SER H 3.450 . 5.100 4.782 4.464 4.978 . 0 0 "[ . 1]" 1 817 1 25 ASP HA 1 25 ASP QB 2.220 . 2.640 2.226 2.164 2.348 . 0 0 "[ . 1]" 1 818 1 25 ASP HA 1 29 ASN H 3.590 . 5.380 5.103 4.794 5.302 . 0 0 "[ . 1]" 1 819 1 25 ASP QB 1 31 SER HB2 3.155 . 4.510 4.171 3.679 4.509 . 0 0 "[ . 1]" 1 820 1 25 ASP QB 1 31 SER HB3 3.495 . 5.190 5.064 4.721 5.243 0.053 9 0 "[ . 1]" 1 821 1 26 SER HA 1 26 SER QB 2.245 . 2.690 2.318 2.178 2.408 . 0 0 "[ . 1]" 1 822 1 26 SER QB 1 27 LEU H 2.810 . 3.820 2.972 2.793 3.506 . 0 0 "[ . 1]" 1 823 1 26 SER QB 1 27 LEU MD2 3.050 . 4.300 3.492 3.171 3.866 . 0 0 "[ . 1]" 1 824 1 26 SER QB 1 27 LEU HG 3.200 . 4.600 3.444 3.124 4.225 . 0 0 "[ . 1]" 1 825 1 27 LEU H 1 27 LEU HB2 2.335 . 2.870 2.535 2.484 2.586 . 0 0 "[ . 1]" 1 826 1 27 LEU H 1 27 LEU HB3 2.755 . 3.710 3.613 3.594 3.633 . 0 0 "[ . 1]" 1 827 1 27 LEU H 1 27 LEU MD1 2.690 . 3.580 3.581 3.525 3.614 0.034 9 0 "[ . 1]" 1 828 1 27 LEU H 1 27 LEU MD2 3.080 . 4.360 3.330 3.240 3.435 . 0 0 "[ . 1]" 1 829 1 27 LEU H 1 27 LEU HG 2.525 . 3.250 2.254 2.197 2.342 . 0 0 "[ . 1]" 1 830 1 27 LEU H 1 28 GLY HA2 3.370 . 4.940 4.793 4.648 4.916 . 0 0 "[ . 1]" 1 831 1 27 LEU H 1 29 ASN H 2.975 . 4.150 3.590 3.352 3.713 . 0 0 "[ . 1]" 1 832 1 27 LEU HA 1 27 LEU HB3 2.390 . 2.980 2.428 2.405 2.457 . 0 0 "[ . 1]" 1 833 1 27 LEU HA 1 27 LEU MD1 2.950 . 4.100 3.891 3.866 3.904 . 0 0 "[ . 1]" 1 834 1 27 LEU HA 1 27 LEU MD2 2.375 . 2.950 2.119 2.057 2.176 . 0 0 "[ . 1]" 1 835 1 27 LEU HA 1 27 LEU HG 2.750 . 3.700 3.160 3.081 3.227 . 0 0 "[ . 1]" 1 836 1 27 LEU HB2 1 27 LEU MD1 2.530 . 3.260 2.281 2.253 2.314 . 0 0 "[ . 1]" 1 837 1 27 LEU HB2 1 28 GLY H 2.885 . 3.970 3.082 2.964 3.261 . 0 0 "[ . 1]" 1 838 1 27 LEU HB2 1 29 ASN H 2.775 . 3.750 2.926 2.564 3.071 . 0 0 "[ . 1]" 1 839 1 27 LEU HB2 1 29 ASN QB 3.015 . 4.230 3.676 3.015 3.889 . 0 0 "[ . 1]" 1 840 1 27 LEU HB2 1 29 ASN HD21 2.795 . 3.790 2.057 1.718 3.168 0.082 7 0 "[ . 1]" 1 841 1 27 LEU HB2 1 29 ASN HD22 2.795 . 3.790 2.410 1.998 3.575 . 0 0 "[ . 1]" 1 842 1 27 LEU HB3 1 27 LEU MD1 2.410 . 3.020 2.398 2.372 2.417 . 0 0 "[ . 1]" 1 843 1 27 LEU HB3 1 27 LEU MD2 2.540 . 3.280 2.346 2.316 2.378 . 0 0 "[ . 1]" 1 844 1 27 LEU HB3 1 29 ASN H 3.385 . 4.970 4.223 3.741 4.463 . 0 0 "[ . 1]" 1 845 1 27 LEU HB3 1 29 ASN QD 2.745 . 3.690 2.763 2.553 3.249 . 0 0 "[ . 1]" 1 846 1 27 LEU MD1 1 28 GLY H 3.320 . 4.840 4.792 4.690 4.916 0.076 6 0 "[ . 1]" 1 847 1 27 LEU MD1 1 29 ASN H 3.225 . 4.650 4.499 4.254 4.599 . 0 0 "[ . 1]" 1 848 1 27 LEU MD1 1 29 ASN HB2 3.520 . 5.240 4.335 3.630 5.300 0.060 7 0 "[ . 1]" 1 849 1 27 LEU MD1 1 29 ASN HB3 3.520 . 5.240 5.136 4.367 5.321 0.081 2 0 "[ . 1]" 1 850 1 27 LEU MD1 1 29 ASN HD21 2.935 . 4.070 2.822 2.594 4.125 0.055 6 0 "[ . 1]" 1 851 1 27 LEU MD1 1 29 ASN QD 2.685 . 3.570 2.392 2.112 3.528 . 0 0 "[ . 1]" 1 852 1 27 LEU MD1 1 29 ASN HD22 2.935 . 4.070 2.604 2.233 3.832 . 0 0 "[ . 1]" 1 853 1 27 LEU HG 1 29 ASN H 3.440 . 5.080 4.945 4.743 5.089 0.009 5 0 "[ . 1]" 1 854 1 28 GLY H 1 29 ASN H 2.455 . 3.110 2.123 2.012 2.320 . 0 0 "[ . 1]" 1 855 1 28 GLY H 1 29 ASN QB 3.230 . 4.660 4.290 4.178 4.687 0.027 7 0 "[ . 1]" 1 856 1 28 GLY HA2 1 29 ASN HA 3.275 . 4.750 4.637 4.589 4.722 . 0 0 "[ . 1]" 1 857 1 28 GLY HA3 1 29 ASN HA 3.420 . 5.040 4.499 4.451 4.539 . 0 0 "[ . 1]" 1 858 1 29 ASN H 1 29 ASN QB 2.320 . 2.840 2.489 2.317 2.723 . 0 0 "[ . 1]" 1 859 1 29 ASN H 1 29 ASN HD21 3.100 . 4.400 2.480 2.154 3.836 . 0 0 "[ . 1]" 1 860 1 29 ASN H 1 29 ASN QD 2.755 . 3.710 2.427 2.142 3.589 . 0 0 "[ . 1]" 1 861 1 29 ASN H 1 29 ASN HD22 3.100 . 4.400 3.634 3.049 4.316 . 0 0 "[ . 1]" 1 862 1 29 ASN H 1 30 PRO HD3 3.380 . 4.960 4.713 4.458 4.950 . 0 0 "[ . 1]" 1 863 1 29 ASN HA 1 29 ASN HD21 3.310 . 4.820 3.888 2.526 4.475 . 0 0 "[ . 1]" 1 864 1 29 ASN HA 1 29 ASN QD 3.005 . 4.210 3.647 2.484 4.090 . 0 0 "[ . 1]" 1 865 1 29 ASN HA 1 29 ASN HD22 3.310 . 4.820 4.471 3.669 5.034 0.214 7 0 "[ . 1]" 1 866 1 29 ASN HA 1 30 PRO HB2 3.650 . 5.500 5.418 5.116 5.500 . 3 0 "[ . 1]" 1 867 1 29 ASN HA 1 30 PRO HD2 2.265 . 2.730 2.331 2.151 2.740 0.010 2 0 "[ . 1]" 1 868 1 29 ASN HA 1 30 PRO HD3 2.250 . 2.700 2.070 1.716 2.254 0.084 2 0 "[ . 1]" 1 869 1 29 ASN HA 1 30 PRO HG2 3.155 . 4.510 4.348 4.293 4.492 . 0 0 "[ . 1]" 1 870 1 29 ASN HA 1 30 PRO HG3 3.200 . 4.600 4.211 3.831 4.376 . 0 0 "[ . 1]" 1 871 1 29 ASN HA 1 56 VAL MG1 3.650 . 5.500 5.085 4.914 5.252 . 0 0 "[ . 1]" 1 872 1 29 ASN HA 1 56 VAL MG2 3.650 . 5.500 5.645 5.436 5.767 0.267 8 0 "[ . 1]" 1 873 1 29 ASN QB 1 29 ASN QD 2.310 . 2.820 2.190 2.115 2.675 . 0 0 "[ . 1]" 1 874 1 29 ASN QB 1 30 PRO HD2 2.555 . 3.310 2.690 2.357 2.860 . 0 0 "[ . 1]" 1 875 1 29 ASN QB 1 30 PRO HD3 2.825 . 3.850 3.649 3.241 3.889 0.039 3 0 "[ . 1]" 1 876 1 29 ASN HB2 1 30 PRO HD2 2.995 . 4.190 3.986 2.577 4.325 0.135 1 0 "[ . 1]" 1 877 1 29 ASN HB3 1 30 PRO HD2 2.995 . 4.190 2.852 2.379 3.814 . 0 0 "[ . 1]" 1 878 1 30 PRO HA 1 31 SER H 2.215 . 2.630 2.176 2.120 2.229 . 0 0 "[ . 1]" 1 879 1 30 PRO HA 1 31 SER HB2 3.350 . 4.900 4.388 3.926 4.578 . 0 0 "[ . 1]" 1 880 1 30 PRO HA 1 31 SER HB3 3.355 . 4.910 4.556 4.175 5.239 0.329 1 0 "[ . 1]" 1 881 1 30 PRO HA 2 50 ILE MD 3.125 . 4.450 3.662 3.459 3.864 . 0 0 "[ . 1]" 1 882 1 30 PRO HB2 1 31 SER H 2.705 . 3.610 3.143 2.961 3.355 . 0 0 "[ . 1]" 1 883 1 30 PRO HB2 1 56 VAL MG1 3.115 . 4.430 3.798 3.406 4.170 . 0 0 "[ . 1]" 1 884 1 30 PRO HB2 1 56 VAL QG 2.780 . 3.760 2.331 1.955 3.139 . 0 0 "[ . 1]" 1 885 1 30 PRO HB2 1 56 VAL MG2 3.115 . 4.430 2.366 1.963 3.301 . 0 0 "[ . 1]" 1 886 1 30 PRO HB2 2 50 ILE MD 3.390 . 4.980 4.047 3.421 4.282 . 0 0 "[ . 1]" 1 887 1 30 PRO HB2 2 50 ILE MG 3.200 . 4.600 4.052 3.599 4.284 . 0 0 "[ . 1]" 1 888 1 30 PRO HB3 1 31 SER H 2.780 . 3.760 3.649 3.085 3.793 0.033 8 0 "[ . 1]" 1 889 1 30 PRO HB3 1 56 VAL MG1 2.960 . 4.120 3.333 2.704 3.931 . 0 0 "[ . 1]" 1 890 1 30 PRO HB3 1 56 VAL QG 2.615 . 3.430 2.433 2.076 2.878 . 0 0 "[ . 1]" 1 891 1 30 PRO HB3 1 56 VAL MG2 2.960 . 4.120 2.523 2.125 3.004 . 0 0 "[ . 1]" 1 892 1 30 PRO HB3 2 50 ILE MD 2.995 . 4.190 2.859 2.294 3.214 . 0 0 "[ . 1]" 1 893 1 30 PRO HB3 2 50 ILE MG 2.800 . 3.800 3.156 2.914 3.361 . 0 0 "[ . 1]" 1 894 1 30 PRO HD2 1 56 VAL MG1 3.460 . 5.120 3.925 3.437 4.374 . 0 0 "[ . 1]" 1 895 1 30 PRO HD2 1 56 VAL QG 3.125 . 4.450 3.574 3.125 3.865 . 0 0 "[ . 1]" 1 896 1 30 PRO HD2 1 56 VAL MG2 3.460 . 5.120 4.149 3.590 4.506 . 0 0 "[ . 1]" 1 897 1 30 PRO HD3 1 56 VAL MG1 3.505 . 5.210 3.344 2.971 3.635 . 0 0 "[ . 1]" 1 898 1 30 PRO HD3 1 56 VAL QG 3.105 . 4.410 3.152 2.874 3.458 . 0 0 "[ . 1]" 1 899 1 30 PRO HD3 1 56 VAL MG2 3.505 . 5.210 3.929 3.454 4.332 . 0 0 "[ . 1]" 1 900 1 30 PRO HG2 1 56 VAL HB 2.855 . 3.910 3.341 2.730 3.776 . 0 0 "[ . 1]" 1 901 1 30 PRO HG2 1 56 VAL QG 2.815 . 3.830 2.354 1.595 2.880 0.205 1 0 "[ . 1]" 1 902 1 30 PRO HG2 2 50 ILE MG 3.640 . 5.480 4.964 3.521 5.509 0.029 5 0 "[ . 1]" 1 903 1 30 PRO HG3 1 31 SER H 3.650 . 5.500 5.344 4.941 5.457 . 0 0 "[ . 1]" 1 904 1 30 PRO HG3 1 56 VAL MG1 2.975 . 4.150 1.997 1.818 2.637 . 0 0 "[ . 1]" 1 905 1 30 PRO HG3 1 56 VAL QG 2.655 . 3.510 1.823 1.706 2.488 0.094 4 0 "[ . 1]" 1 906 1 30 PRO HG3 1 56 VAL MG2 2.975 . 4.150 2.200 1.871 3.050 . 0 0 "[ . 1]" 1 907 1 30 PRO HG3 2 50 ILE MG 3.080 . 4.360 3.996 3.133 4.412 0.052 3 0 "[ . 1]" 1 908 1 31 SER H 1 31 SER HB2 2.710 . 3.620 3.074 2.448 3.335 . 0 0 "[ . 1]" 1 909 1 31 SER H 1 31 SER HB3 2.590 . 3.380 2.758 2.528 3.605 0.225 1 0 "[ . 1]" 1 910 1 31 SER H 2 50 ILE MD 3.290 . 4.780 4.449 4.171 4.701 . 0 0 "[ . 1]" 1 911 1 31 SER HA 1 32 LEU H 2.350 . 2.900 2.261 2.222 2.312 . 0 0 "[ . 1]" 1 912 1 31 SER HA 1 32 LEU HB2 3.160 . 4.520 4.115 4.078 4.168 . 0 0 "[ . 1]" 1 913 1 31 SER HA 1 32 LEU HB3 3.315 . 4.830 4.719 4.661 4.780 . 0 0 "[ . 1]" 1 914 1 31 SER HB2 1 32 LEU H 3.025 . 4.250 4.081 3.908 4.172 . 0 0 "[ . 1]" 1 915 1 31 SER HB3 1 32 LEU H 2.995 . 4.190 3.872 3.111 4.124 . 0 0 "[ . 1]" 1 916 1 32 LEU H 1 32 LEU HB2 2.690 . 3.580 2.866 2.790 2.928 . 0 0 "[ . 1]" 1 917 1 32 LEU H 1 32 LEU HB3 2.795 . 3.790 2.790 2.732 2.857 . 0 0 "[ . 1]" 1 918 1 32 LEU H 1 32 LEU MD1 3.285 . 4.770 4.230 4.188 4.269 . 0 0 "[ . 1]" 1 919 1 32 LEU H 1 32 LEU HG 3.255 . 4.710 4.586 4.557 4.609 . 0 0 "[ . 1]" 1 920 1 32 LEU H 1 33 SER H 3.245 . 4.690 4.310 4.217 4.370 . 0 0 "[ . 1]" 1 921 1 32 LEU HA 1 32 LEU MD1 2.735 . 3.670 2.055 2.007 2.115 . 0 0 "[ . 1]" 1 922 1 32 LEU HA 1 32 LEU MD2 3.000 . 4.200 3.843 3.824 3.856 . 0 0 "[ . 1]" 1 923 1 32 LEU HA 1 32 LEU HG 2.825 . 3.850 2.788 2.706 2.870 . 0 0 "[ . 1]" 1 924 1 32 LEU HA 1 33 SER H 2.335 . 2.870 2.132 2.101 2.157 . 0 0 "[ . 1]" 1 925 1 32 LEU HA 1 33 SER QB 3.210 . 4.620 4.383 4.084 4.445 . 0 0 "[ . 1]" 1 926 1 32 LEU HB2 1 32 LEU MD2 2.745 . 3.690 2.489 2.466 2.525 . 0 0 "[ . 1]" 1 927 1 32 LEU HB2 1 33 SER H 3.285 . 4.770 4.324 4.270 4.370 . 0 0 "[ . 1]" 1 928 1 32 LEU HB3 1 32 LEU MD1 2.745 . 3.690 3.175 3.164 3.180 . 0 0 "[ . 1]" 1 929 1 32 LEU HB3 1 33 SER H 3.305 . 4.810 4.024 3.972 4.071 . 0 0 "[ . 1]" 1 930 1 32 LEU HB3 1 33 SER HA 3.260 . 4.720 4.508 4.435 4.592 . 0 0 "[ . 1]" 1 931 1 32 LEU HB3 1 34 VAL H 3.650 . 5.500 5.422 5.331 5.515 0.015 3 0 "[ . 1]" 1 932 1 32 LEU MD1 1 33 SER H 2.890 . 3.980 2.999 2.795 3.189 . 0 0 "[ . 1]" 1 933 1 32 LEU MD1 1 34 VAL QG 2.785 . 3.770 3.351 3.121 3.587 . 0 0 "[ . 1]" 1 934 1 32 LEU MD1 1 54 ILE MG 2.510 . 3.220 2.980 2.848 3.122 . 0 0 "[ . 1]" 1 935 1 32 LEU MD1 2 12 LEU MD1 2.715 . 3.630 3.457 3.316 3.652 0.022 3 0 "[ . 1]" 1 936 1 32 LEU MD1 2 20 LEU MD2 3.275 . 4.750 4.596 4.402 4.724 . 0 0 "[ . 1]" 1 937 1 32 LEU MD1 2 52 LEU QD 2.495 . 3.190 2.403 2.275 2.514 . 0 0 "[ . 1]" 1 938 1 32 LEU MD2 1 33 SER H 3.090 . 4.380 4.406 4.335 4.467 0.087 5 0 "[ . 1]" 1 939 1 32 LEU MD2 1 33 SER HA 3.465 . 5.130 4.996 4.909 5.131 0.001 5 0 "[ . 1]" 1 940 1 32 LEU MD2 1 34 VAL HB 3.310 . 4.820 4.506 4.417 4.630 . 0 0 "[ . 1]" 1 941 1 32 LEU MD2 1 34 VAL QG 2.400 . 3.000 2.740 2.683 2.804 . 0 0 "[ . 1]" 1 942 1 32 LEU MD2 1 54 ILE HB 3.075 . 4.350 2.742 2.652 2.835 . 0 0 "[ . 1]" 1 943 1 32 LEU MD2 1 54 ILE MD 2.580 . 3.360 1.761 1.747 1.782 0.053 5 0 "[ . 1]" 1 944 1 32 LEU MD2 1 54 ILE MG 2.575 . 3.350 2.882 2.781 2.971 . 0 0 "[ . 1]" 1 945 1 32 LEU MD2 2 52 LEU QD 2.795 . 3.790 3.515 3.317 3.663 . 0 0 "[ . 1]" 1 946 1 32 LEU HG 1 33 SER H 2.920 . 4.040 2.848 2.751 2.937 . 0 0 "[ . 1]" 1 947 1 32 LEU HG 1 34 VAL QG 2.870 . 3.940 2.475 2.377 2.573 . 0 0 "[ . 1]" 1 948 1 32 LEU HG 2 52 LEU QD 3.390 . 4.980 4.784 4.594 4.912 . 0 0 "[ . 1]" 1 949 1 33 SER H 1 33 SER QB 2.495 . 3.190 2.639 2.571 2.698 . 0 0 "[ . 1]" 1 950 1 33 SER H 1 34 VAL QG 2.915 . 4.030 3.711 3.604 3.830 . 0 0 "[ . 1]" 1 951 1 33 SER HA 1 34 VAL H 2.295 . 2.790 2.145 2.117 2.157 . 0 0 "[ . 1]" 1 952 1 33 SER HA 1 34 VAL HB 3.610 . 5.420 4.569 4.500 4.597 . 0 0 "[ . 1]" 1 953 1 33 SER HA 1 34 VAL QG 3.125 . 4.450 3.758 3.699 3.807 . 0 0 "[ . 1]" 1 954 1 33 SER QB 1 34 VAL H 2.685 . 3.570 3.386 3.283 3.724 0.154 10 0 "[ . 1]" 1 955 1 33 SER QB 1 34 VAL QG 3.495 . 5.190 4.312 4.279 4.417 . 0 0 "[ . 1]" 1 956 1 33 SER QB 1 35 ILE MD 2.965 . 4.130 3.533 3.371 3.760 . 0 0 "[ . 1]" 1 957 1 33 SER QB 1 35 ILE HG12 3.460 . 5.120 3.838 3.672 4.445 . 0 0 "[ . 1]" 1 958 1 33 SER QB 1 35 ILE HG13 3.480 . 5.160 3.877 3.758 4.082 . 0 0 "[ . 1]" 1 959 1 33 SER HB2 1 34 VAL H 3.100 . 4.400 4.272 4.234 4.340 . 0 0 "[ . 1]" 1 960 1 33 SER HB2 1 35 ILE MD 3.290 . 4.780 4.470 4.309 4.826 0.046 10 0 "[ . 1]" 1 961 1 33 SER HB3 1 34 VAL H 3.100 . 4.400 3.556 3.417 4.054 . 0 0 "[ . 1]" 1 962 1 33 SER HB3 1 35 ILE MD 3.290 . 4.780 3.703 3.521 3.922 . 0 0 "[ . 1]" 1 963 1 34 VAL H 1 34 VAL HB 2.805 . 3.810 2.651 2.630 2.684 . 0 0 "[ . 1]" 1 964 1 34 VAL H 1 34 VAL QG 2.640 . 3.480 2.842 2.805 2.914 . 0 0 "[ . 1]" 1 965 1 34 VAL H 1 35 ILE H 3.270 . 4.740 4.257 4.220 4.277 . 0 0 "[ . 1]" 1 966 1 34 VAL H 1 35 ILE HG12 3.315 . 4.830 4.149 4.026 4.282 . 0 0 "[ . 1]" 1 967 1 34 VAL H 1 35 ILE HG13 3.445 . 5.090 4.460 4.261 4.583 . 0 0 "[ . 1]" 1 968 1 34 VAL H 1 35 ILE MG 3.650 . 5.500 5.511 5.457 5.541 0.041 4 0 "[ . 1]" 1 969 1 34 VAL HA 1 34 VAL MG1 2.620 . 3.440 2.468 2.461 2.494 . 0 0 "[ . 1]" 1 970 1 34 VAL HA 1 34 VAL QG 2.380 . 2.960 2.129 2.120 2.138 . 0 0 "[ . 1]" 1 971 1 34 VAL HA 1 34 VAL MG2 2.620 . 3.440 2.326 2.300 2.346 . 0 0 "[ . 1]" 1 972 1 34 VAL HA 1 35 ILE H 2.300 . 2.800 2.124 2.111 2.140 . 0 0 "[ . 1]" 1 973 1 34 VAL HA 1 35 ILE HA 3.175 . 4.550 4.393 4.386 4.408 . 0 0 "[ . 1]" 1 974 1 34 VAL HA 1 35 ILE HB 3.550 . 5.300 4.954 4.872 5.011 . 0 0 "[ . 1]" 1 975 1 34 VAL HA 1 35 ILE MD 3.370 . 4.940 4.825 4.747 4.885 . 0 0 "[ . 1]" 1 976 1 34 VAL HA 1 35 ILE HG12 3.290 . 4.780 4.205 4.131 4.333 . 0 0 "[ . 1]" 1 977 1 34 VAL HA 1 35 ILE HG13 3.255 . 4.710 3.383 3.288 3.471 . 0 0 "[ . 1]" 1 978 1 34 VAL HA 1 35 ILE MG 3.540 . 5.280 5.303 5.293 5.311 0.031 4 0 "[ . 1]" 1 979 1 34 VAL HA 2 20 LEU HB3 3.650 . 5.500 5.298 5.152 5.397 . 0 0 "[ . 1]" 1 980 1 34 VAL HB 1 35 ILE H 3.285 . 4.770 4.290 4.279 4.312 . 0 0 "[ . 1]" 1 981 1 34 VAL QG 1 35 ILE H 2.565 . 3.330 2.730 2.716 2.743 . 0 0 "[ . 1]" 1 982 1 34 VAL QG 1 35 ILE HA 3.030 . 4.260 3.573 3.518 3.610 . 0 0 "[ . 1]" 1 983 1 34 VAL QG 1 35 ILE HB 3.405 . 5.010 4.843 4.799 4.883 . 0 0 "[ . 1]" 1 984 1 34 VAL QG 1 36 PRO HA 3.280 . 4.760 4.339 4.289 4.387 . 0 0 "[ . 1]" 1 985 1 34 VAL QG 1 36 PRO HD2 3.415 . 5.030 4.759 4.722 4.828 . 0 0 "[ . 1]" 1 986 1 34 VAL QG 2 20 LEU H 3.620 . 5.440 4.700 4.644 4.757 . 0 0 "[ . 1]" 1 987 1 34 VAL QG 2 20 LEU HB3 3.165 . 4.530 3.352 3.289 3.419 . 0 0 "[ . 1]" 1 988 1 34 VAL QG 2 20 LEU MD2 2.415 . 3.030 2.258 2.176 2.353 . 0 0 "[ . 1]" 1 989 1 34 VAL MG1 2 20 LEU HB3 3.575 . 5.350 3.575 3.498 3.689 . 0 0 "[ . 1]" 1 990 1 34 VAL MG1 2 20 LEU MD2 2.680 . 3.560 2.535 2.416 2.676 . 0 0 "[ . 1]" 1 991 1 34 VAL MG2 2 20 LEU HB3 3.575 . 5.350 4.055 3.967 4.108 . 0 0 "[ . 1]" 1 992 1 34 VAL MG2 2 20 LEU MD2 2.680 . 3.560 2.537 2.428 2.610 . 0 0 "[ . 1]" 1 993 1 35 ILE H 1 35 ILE HB 2.640 . 3.480 2.976 2.924 3.031 . 0 0 "[ . 1]" 1 994 1 35 ILE H 1 35 ILE MD 3.085 . 4.370 3.911 3.844 3.979 . 0 0 "[ . 1]" 1 995 1 35 ILE H 1 35 ILE HG12 2.735 . 3.670 3.321 3.261 3.416 . 0 0 "[ . 1]" 1 996 1 35 ILE H 1 35 ILE HG13 2.830 . 3.860 2.328 2.271 2.384 . 0 0 "[ . 1]" 1 997 1 35 ILE H 1 35 ILE MG 2.945 . 4.090 3.911 3.897 3.926 . 0 0 "[ . 1]" 1 998 1 35 ILE H 1 36 PRO HD2 3.425 . 5.050 4.757 4.723 4.781 . 0 0 "[ . 1]" 1 999 1 35 ILE H 1 36 PRO HD3 3.485 . 5.170 4.771 4.712 4.835 . 0 0 "[ . 1]" 1 1000 1 35 ILE HA 1 35 ILE MD 3.000 . 4.200 3.938 3.921 3.967 . 0 0 "[ . 1]" 1 1001 1 35 ILE HA 1 35 ILE HG12 2.825 . 3.850 2.840 2.810 2.867 . 0 0 "[ . 1]" 1 1002 1 35 ILE HA 1 35 ILE HG13 2.950 . 4.100 3.426 3.365 3.483 . 0 0 "[ . 1]" 1 1003 1 35 ILE HA 1 35 ILE MG 2.555 . 3.310 2.189 2.176 2.204 . 0 0 "[ . 1]" 1 1004 1 35 ILE HA 1 36 PRO HA 3.280 . 4.760 4.477 4.462 4.487 . 0 0 "[ . 1]" 1 1005 1 35 ILE HA 1 36 PRO HD2 2.340 . 2.880 2.021 1.984 2.047 . 0 0 "[ . 1]" 1 1006 1 35 ILE HA 1 36 PRO HD3 2.440 . 3.080 2.457 2.410 2.491 . 0 0 "[ . 1]" 1 1007 1 35 ILE HA 1 36 PRO QG 2.880 . 3.960 3.837 3.814 3.857 . 0 0 "[ . 1]" 1 1008 1 35 ILE HB 1 35 ILE MD 2.655 . 3.510 2.462 2.418 2.497 . 0 0 "[ . 1]" 1 1009 1 35 ILE HB 1 36 PRO HA 3.650 . 5.500 5.007 4.961 5.079 . 0 0 "[ . 1]" 1 1010 1 35 ILE HB 1 36 PRO HD2 2.815 . 3.830 3.846 3.816 3.895 0.065 10 0 "[ . 1]" 1 1011 1 35 ILE HB 1 36 PRO QG 3.510 . 5.220 4.961 4.908 5.019 . 0 0 "[ . 1]" 1 1012 1 35 ILE MD 1 36 PRO HD2 3.305 . 4.810 4.738 4.703 4.776 . 0 0 "[ . 1]" 1 1013 1 35 ILE HG12 1 35 ILE MG 2.605 . 3.410 2.409 2.360 2.440 . 0 0 "[ . 1]" 1 1014 1 35 ILE HG12 1 36 PRO HD2 3.320 . 4.840 4.376 4.303 4.430 . 0 0 "[ . 1]" 1 1015 1 35 ILE HG12 1 36 PRO HD3 3.515 . 5.230 5.254 5.220 5.270 0.040 8 0 "[ . 1]" 1 1016 1 35 ILE HG13 1 35 ILE MG 2.595 . 3.390 3.204 3.199 3.210 . 0 0 "[ . 1]" 1 1017 1 35 ILE HG13 1 36 PRO HD2 3.635 . 5.470 5.125 5.081 5.174 . 0 0 "[ . 1]" 1 1018 1 35 ILE MG 1 36 PRO HA 3.390 . 4.980 4.526 4.467 4.587 . 0 0 "[ . 1]" 1 1019 1 35 ILE MG 1 36 PRO HB2 3.515 . 5.230 4.624 4.519 4.681 . 0 0 "[ . 1]" 1 1020 1 35 ILE MG 1 36 PRO HB3 3.490 . 5.180 4.944 4.886 4.990 . 0 0 "[ . 1]" 1 1021 1 35 ILE MG 1 36 PRO HD2 2.745 . 3.690 2.009 1.959 2.072 . 0 0 "[ . 1]" 1 1022 1 35 ILE MG 1 36 PRO HD3 2.625 . 3.450 3.408 3.381 3.462 0.012 10 0 "[ . 1]" 1 1023 1 35 ILE MG 1 36 PRO QG 2.815 . 3.830 3.025 2.955 3.073 . 0 0 "[ . 1]" 1 1024 1 35 ILE MG 1 37 SER HA 3.640 . 5.480 4.949 4.832 5.092 . 0 0 "[ . 1]" 1 1025 1 36 PRO HA 1 37 SER H 2.485 . 3.170 2.176 2.151 2.218 . 0 0 "[ . 1]" 1 1026 1 36 PRO HA 1 37 SER HA 3.170 . 4.540 4.380 4.369 4.397 . 0 0 "[ . 1]" 1 1027 1 36 PRO HA 1 42 GLU QG 3.205 . 4.610 4.491 4.230 4.636 0.026 3 0 "[ . 1]" 1 1028 1 36 PRO HB2 1 38 ASN HA 3.540 . 5.280 4.471 4.312 4.628 . 0 0 "[ . 1]" 1 1029 1 36 PRO HB2 1 39 PRO HA 2.855 . 3.910 2.884 2.541 3.332 . 0 0 "[ . 1]" 1 1030 1 36 PRO HB2 1 39 PRO HD2 3.650 . 5.500 5.149 4.996 5.358 . 0 0 "[ . 1]" 1 1031 1 36 PRO HB2 1 39 PRO HD3 3.235 . 4.670 4.157 3.871 4.409 . 0 0 "[ . 1]" 1 1032 1 36 PRO HB2 1 42 GLU QG 2.890 . 3.980 2.693 2.345 2.924 . 0 0 "[ . 1]" 1 1033 1 36 PRO HB3 1 37 SER H 2.955 . 4.110 3.859 3.744 3.927 . 0 0 "[ . 1]" 1 1034 1 36 PRO HB3 1 39 PRO HA 3.345 . 4.890 4.028 3.838 4.390 . 0 0 "[ . 1]" 1 1035 1 36 PRO HB3 1 42 GLU QG 2.810 . 3.820 2.551 2.318 2.681 . 0 0 "[ . 1]" 1 1036 1 36 PRO QG 1 39 PRO HA 2.785 . 3.770 2.662 2.379 3.061 . 0 0 "[ . 1]" 1 1037 1 36 PRO QG 1 39 PRO HD3 3.160 . 4.520 4.031 3.628 4.516 . 0 0 "[ . 1]" 1 1038 1 37 SER H 1 37 SER QB 2.545 . 3.290 2.422 2.252 2.652 . 0 0 "[ . 1]" 1 1039 1 37 SER QB 2 19 HIS HD2 3.345 . 4.890 4.187 3.441 4.905 0.015 1 0 "[ . 1]" 1 1040 1 38 ASN HA 1 39 PRO HD2 2.380 . 2.960 1.960 1.896 2.012 . 0 0 "[ . 1]" 1 1041 1 38 ASN HA 1 39 PRO HD3 2.410 . 3.020 2.464 2.351 2.542 . 0 0 "[ . 1]" 1 1042 1 38 ASN HA 1 39 PRO HG2 3.145 . 4.490 4.163 4.091 4.215 . 0 0 "[ . 1]" 1 1043 1 38 ASN HA 1 39 PRO HG3 3.145 . 4.490 4.387 4.356 4.426 . 0 0 "[ . 1]" 1 1044 1 38 ASN QB 1 41 GLN QB 2.620 . 3.440 2.570 1.836 3.534 0.094 2 0 "[ . 1]" 1 1045 1 38 ASN HB2 1 39 PRO HD2 3.205 . 4.610 4.325 3.673 4.675 0.065 1 0 "[ . 1]" 1 1046 1 38 ASN HB2 1 39 PRO HD3 3.465 . 5.130 4.975 4.723 5.145 0.015 7 0 "[ . 1]" 1 1047 1 38 ASN HB2 1 41 GLN QG 3.125 . 4.450 3.776 2.766 4.530 0.080 8 0 "[ . 1]" 1 1048 1 38 ASN HB3 1 39 PRO HD2 3.205 . 4.610 4.222 3.647 4.607 . 0 0 "[ . 1]" 1 1049 1 38 ASN HB3 1 39 PRO HD3 3.465 . 5.130 4.955 4.618 5.156 0.026 4 0 "[ . 1]" 1 1050 1 38 ASN HB3 1 41 GLN QG 3.125 . 4.450 3.269 2.158 4.446 . 0 0 "[ . 1]" 1 1051 1 39 PRO HA 1 42 GLU QB 2.755 . 3.710 3.184 2.526 3.718 0.008 5 0 "[ . 1]" 1 1052 1 39 PRO HA 1 42 GLU QG 3.125 . 4.450 2.540 2.146 2.869 . 0 0 "[ . 1]" 1 1053 1 39 PRO QG 1 40 TYR QD 3.350 . 4.900 3.031 2.679 3.499 . 0 0 "[ . 1]" 1 1054 1 39 PRO QG 1 40 TYR QE 3.255 . 4.710 3.108 2.889 3.512 . 0 0 "[ . 1]" 1 1055 1 39 PRO HG2 1 40 TYR QE 3.570 . 5.340 3.202 2.975 3.630 . 0 0 "[ . 1]" 1 1056 1 39 PRO HG3 1 40 TYR QE 3.570 . 5.340 4.208 3.887 4.673 . 0 0 "[ . 1]" 1 1057 1 40 TYR HA 1 40 TYR QD 2.750 . 3.700 2.791 2.602 2.944 . 0 0 "[ . 1]" 1 1058 1 41 GLN H 1 41 GLN QB 2.745 . 3.690 2.274 2.073 2.442 . 0 0 "[ . 1]" 1 1059 1 41 GLN H 1 41 GLN QG 3.270 . 4.740 3.054 2.304 4.048 . 0 0 "[ . 1]" 1 1060 1 41 GLN HA 1 41 GLN QG 2.635 . 3.470 2.565 2.284 2.819 . 0 0 "[ . 1]" 1 1061 1 41 GLN HA 1 44 LEU QB 2.735 . 3.670 2.567 2.185 2.915 . 0 0 "[ . 1]" 1 1062 1 41 GLN HA 1 44 LEU MD1 2.915 . 4.030 3.573 2.744 4.089 0.059 6 0 "[ . 1]" 1 1063 1 41 GLN HA 1 44 LEU HG 3.420 . 5.040 4.217 3.608 4.790 . 0 0 "[ . 1]" 1 1064 1 41 GLN QG 1 44 LEU QB 3.355 . 4.910 4.120 3.577 4.805 . 0 0 "[ . 1]" 1 1065 1 41 GLN QG 1 44 LEU MD1 3.235 . 4.670 4.547 3.976 4.785 0.115 5 0 "[ . 1]" 1 1066 1 42 GLU HA 1 42 GLU QG 2.545 . 3.290 2.941 2.873 3.043 . 0 0 "[ . 1]" 1 1067 1 42 GLU HA 1 45 SER HA 3.275 . 4.750 4.457 3.647 4.765 0.015 1 0 "[ . 1]" 1 1068 1 42 GLU HA 1 45 SER QB 2.925 . 4.050 3.815 3.287 4.162 0.112 10 0 "[ . 1]" 1 1069 1 42 GLU QB 1 42 GLU QG 2.075 . 2.350 1.993 1.985 2.002 . 0 0 "[ . 1]" 1 1070 1 43 GLN HA 1 43 GLN QG 2.685 . 3.570 2.768 2.495 3.348 . 0 0 "[ . 1]" 1 1071 1 43 GLN QB 1 44 LEU MD1 3.240 . 4.680 4.146 3.920 4.674 . 0 0 "[ . 1]" 1 1072 1 43 GLN QB 1 44 LEU MD2 3.320 . 4.840 3.519 3.270 4.076 . 0 0 "[ . 1]" 1 1073 1 43 GLN QB 1 44 LEU HG 3.005 . 4.210 2.848 2.600 3.589 . 0 0 "[ . 1]" 1 1074 1 43 GLN HB2 1 44 LEU MD1 3.650 . 5.500 4.597 4.078 5.526 0.026 6 0 "[ . 1]" 1 1075 1 43 GLN HB2 1 44 LEU MD2 3.650 . 5.500 4.007 3.564 5.060 . 0 0 "[ . 1]" 1 1076 1 43 GLN HB3 1 44 LEU MD1 3.650 . 5.500 5.111 4.111 5.606 0.106 2 0 "[ . 1]" 1 1077 1 43 GLN HB3 1 44 LEU MD2 3.650 . 5.500 4.168 3.580 5.436 . 0 0 "[ . 1]" 1 1078 1 43 GLN QG 1 44 LEU MD1 3.615 . 5.430 4.832 2.993 5.470 0.040 7 0 "[ . 1]" 1 1079 1 43 GLN QG 1 44 LEU MD2 3.650 . 5.500 4.404 3.226 5.193 . 0 0 "[ . 1]" 1 1080 1 43 GLN QG 1 44 LEU HG 3.225 . 4.650 3.893 1.761 4.668 0.039 10 0 "[ . 1]" 1 1081 1 44 LEU H 1 44 LEU HG 3.200 . 4.600 2.412 2.215 2.618 . 0 0 "[ . 1]" 1 1082 1 44 LEU HA 1 44 LEU QB 2.370 . 2.940 2.337 2.313 2.356 . 0 0 "[ . 1]" 1 1083 1 44 LEU HA 1 44 LEU MD1 3.005 . 4.210 3.922 3.898 3.962 . 0 0 "[ . 1]" 1 1084 1 44 LEU HA 1 44 LEU MD2 2.365 . 2.930 2.183 2.110 2.320 . 0 0 "[ . 1]" 1 1085 1 44 LEU HA 1 44 LEU HG 2.850 . 3.900 3.106 2.959 3.166 . 0 0 "[ . 1]" 1 1086 1 44 LEU QB 1 44 LEU MD1 2.370 . 2.940 2.085 2.060 2.099 . 0 0 "[ . 1]" 1 1087 1 44 LEU QB 1 44 LEU MD2 2.460 . 3.120 2.252 2.204 2.280 . 0 0 "[ . 1]" 1 1088 1 45 SER HA 1 47 THR H 3.000 . 4.200 2.773 2.545 3.689 . 0 0 "[ . 1]" 1 1089 1 45 SER QB 1 47 THR HB 3.420 . 5.040 5.080 4.592 5.176 0.136 4 0 "[ . 1]" 1 1090 1 45 SER HB2 1 47 THR H 3.175 . 4.550 3.661 2.621 4.385 . 0 0 "[ . 1]" 1 1091 1 45 SER HB2 1 49 LEU MD1 3.650 . 5.500 5.376 4.850 5.674 0.174 6 0 "[ . 1]" 1 1092 1 45 SER HB3 1 47 THR H 3.175 . 4.550 3.911 2.865 4.449 . 0 0 "[ . 1]" 1 1093 1 45 SER HB3 1 49 LEU MD1 3.650 . 5.500 5.153 4.716 5.554 0.054 8 0 "[ . 1]" 1 1094 1 46 ASP HA 1 46 ASP QB 2.330 . 2.860 2.271 2.169 2.428 . 0 0 "[ . 1]" 1 1095 1 46 ASP HA 1 47 THR H 2.610 . 3.420 3.237 2.899 3.359 . 0 0 "[ . 1]" 1 1096 1 46 ASP QB 1 47 THR H 3.010 . 4.220 3.554 3.047 4.019 . 0 0 "[ . 1]" 1 1097 1 47 THR H 1 47 THR HB 2.685 . 3.570 3.533 3.444 3.673 0.103 6 0 "[ . 1]" 1 1098 1 47 THR H 1 47 THR MG 2.800 . 3.800 3.063 2.921 3.349 . 0 0 "[ . 1]" 1 1099 1 47 THR H 1 48 PRO HD3 3.405 . 5.010 4.832 4.745 4.918 . 0 0 "[ . 1]" 1 1100 1 47 THR HA 1 47 THR MG 2.410 . 3.020 2.220 2.182 2.255 . 0 0 "[ . 1]" 1 1101 1 47 THR HA 1 48 PRO HD2 2.405 . 3.010 2.207 2.099 2.333 . 0 0 "[ . 1]" 1 1102 1 47 THR HA 1 48 PRO HD3 2.280 . 2.760 2.293 2.230 2.364 . 0 0 "[ . 1]" 1 1103 1 47 THR HA 1 48 PRO QG 2.965 . 4.130 3.902 3.855 3.951 . 0 0 "[ . 1]" 1 1104 1 47 THR HB 1 48 PRO HD2 2.510 . 3.220 2.856 2.646 3.125 . 0 0 "[ . 1]" 1 1105 1 47 THR HB 1 48 PRO HD3 3.065 . 4.330 4.111 3.893 4.340 0.010 3 0 "[ . 1]" 1 1106 1 47 THR MG 1 48 PRO HD2 2.760 . 3.720 2.825 2.558 2.985 . 0 0 "[ . 1]" 1 1107 1 47 THR MG 1 48 PRO HD3 2.820 . 3.840 3.760 3.492 3.864 0.024 8 0 "[ . 1]" 1 1108 1 48 PRO HA 1 49 LEU H 2.230 . 2.660 2.265 2.187 2.325 . 0 0 "[ . 1]" 1 1109 1 48 PRO HA 1 49 LEU HB2 3.265 . 4.730 4.516 4.411 4.576 . 0 0 "[ . 1]" 1 1110 1 48 PRO HA 1 49 LEU MD1 3.615 . 5.430 5.292 5.163 5.406 . 0 0 "[ . 1]" 1 1111 1 48 PRO HA 1 49 LEU HG 3.310 . 4.820 4.207 4.013 4.425 . 0 0 "[ . 1]" 1 1112 1 48 PRO HB2 1 49 LEU H 2.770 . 3.740 2.997 2.822 3.266 . 0 0 "[ . 1]" 1 1113 1 48 PRO HB2 1 50 ILE MD 3.650 . 5.500 5.188 4.917 5.512 0.012 4 0 "[ . 1]" 1 1114 1 48 PRO HB2 1 50 ILE HG12 3.590 . 5.380 4.798 4.453 5.109 . 0 0 "[ . 1]" 1 1115 1 48 PRO HB2 1 50 ILE HG13 3.290 . 4.780 4.342 4.146 4.655 . 0 0 "[ . 1]" 1 1116 1 48 PRO HB3 1 49 LEU H 2.815 . 3.830 3.677 3.577 3.803 . 0 0 "[ . 1]" 1 1117 1 49 LEU H 1 49 LEU HB2 2.410 . 3.020 2.351 2.292 2.412 . 0 0 "[ . 1]" 1 1118 1 49 LEU H 1 49 LEU HB3 2.750 . 3.700 3.592 3.554 3.620 . 0 0 "[ . 1]" 1 1119 1 49 LEU H 1 49 LEU MD1 2.855 . 3.910 3.894 3.852 3.929 0.019 3 0 "[ . 1]" 1 1120 1 49 LEU H 1 49 LEU MD2 2.965 . 4.130 3.809 3.515 3.948 . 0 0 "[ . 1]" 1 1121 1 49 LEU H 1 49 LEU HG 2.565 . 3.330 2.969 2.766 3.081 . 0 0 "[ . 1]" 1 1122 1 49 LEU H 1 50 ILE H 3.210 . 4.620 4.420 4.371 4.515 . 0 0 "[ . 1]" 1 1123 1 49 LEU HA 1 49 LEU MD1 2.865 . 3.930 3.818 3.793 3.836 . 0 0 "[ . 1]" 1 1124 1 49 LEU HA 1 49 LEU MD2 2.610 . 3.420 1.931 1.885 1.962 . 0 0 "[ . 1]" 1 1125 1 49 LEU HA 1 49 LEU HG 2.825 . 3.850 2.973 2.856 3.147 . 0 0 "[ . 1]" 1 1126 1 49 LEU HA 1 50 ILE H 2.375 . 2.950 2.126 2.102 2.159 . 0 0 "[ . 1]" 1 1127 1 49 LEU HA 1 50 ILE HB 3.270 . 4.740 4.677 4.605 4.737 . 0 0 "[ . 1]" 1 1128 1 49 LEU HA 1 50 ILE HG12 3.550 . 5.300 5.303 5.253 5.336 0.036 10 0 "[ . 1]" 1 1129 1 49 LEU HA 1 50 ILE HG13 2.945 . 4.090 3.913 3.852 3.964 . 0 0 "[ . 1]" 1 1130 1 49 LEU HB2 1 49 LEU MD1 2.495 . 3.190 2.313 2.279 2.373 . 0 0 "[ . 1]" 1 1131 1 49 LEU HB2 1 49 LEU MD2 2.845 . 3.890 3.188 3.183 3.192 . 0 0 "[ . 1]" 1 1132 1 49 LEU HB2 1 50 ILE H 3.115 . 4.430 4.326 4.198 4.401 . 0 0 "[ . 1]" 1 1133 1 49 LEU HB3 1 49 LEU MD1 2.675 . 3.550 2.349 2.276 2.377 . 0 0 "[ . 1]" 1 1134 1 49 LEU HB3 1 49 LEU MD2 2.650 . 3.500 2.358 2.319 2.420 . 0 0 "[ . 1]" 1 1135 1 49 LEU HB3 1 50 ILE H 2.645 . 3.490 3.380 3.126 3.496 0.006 6 0 "[ . 1]" 1 1136 1 49 LEU HB3 1 50 ILE HA 3.340 . 4.880 4.433 4.211 4.614 . 0 0 "[ . 1]" 1 1137 1 49 LEU MD1 1 50 ILE H 3.415 . 5.030 5.012 4.844 5.090 0.060 6 0 "[ . 1]" 1 1138 1 49 LEU MD2 1 50 ILE H 3.045 . 4.290 3.316 3.218 3.426 . 0 0 "[ . 1]" 1 1139 1 49 LEU HG 1 50 ILE H 3.490 . 5.180 4.996 4.910 5.145 . 0 0 "[ . 1]" 1 1140 1 50 ILE H 1 50 ILE HB 2.515 . 3.230 2.568 2.517 2.618 . 0 0 "[ . 1]" 1 1141 1 50 ILE H 1 50 ILE MD 3.035 . 4.270 3.711 3.613 3.863 . 0 0 "[ . 1]" 1 1142 1 50 ILE H 1 50 ILE HG12 3.015 . 4.230 3.763 3.642 3.916 . 0 0 "[ . 1]" 1 1143 1 50 ILE H 1 50 ILE HG13 2.620 . 3.440 2.483 2.326 2.700 . 0 0 "[ . 1]" 1 1144 1 50 ILE H 1 50 ILE MG 2.935 . 4.070 3.814 3.793 3.834 . 0 0 "[ . 1]" 1 1145 1 50 ILE H 1 51 PRO HA 3.635 . 5.470 5.181 5.049 5.314 . 0 0 "[ . 1]" 1 1146 1 50 ILE H 1 52 LEU QD 3.335 . 4.870 3.973 3.895 4.067 . 0 0 "[ . 1]" 1 1147 1 50 ILE H 2 22 VAL MG1 2.875 . 3.950 3.971 3.844 4.017 0.067 9 0 "[ . 1]" 1 1148 1 50 ILE HA 1 50 ILE MD 2.890 . 3.980 3.877 3.856 3.894 . 0 0 "[ . 1]" 1 1149 1 50 ILE HA 1 50 ILE HG12 2.715 . 3.630 2.620 2.577 2.644 . 0 0 "[ . 1]" 1 1150 1 50 ILE HA 1 50 ILE HG13 2.790 . 3.780 2.979 2.958 2.994 . 0 0 "[ . 1]" 1 1151 1 50 ILE HA 1 50 ILE MG 2.455 . 3.110 2.364 2.335 2.397 . 0 0 "[ . 1]" 1 1152 1 50 ILE HA 1 51 PRO HA 3.205 . 4.610 4.468 4.432 4.478 . 0 0 "[ . 1]" 1 1153 1 50 ILE HA 1 51 PRO HB3 3.375 . 4.950 4.887 4.839 4.952 0.002 2 0 "[ . 1]" 1 1154 1 50 ILE HA 1 51 PRO HD2 2.380 . 2.960 2.156 2.044 2.673 . 0 0 "[ . 1]" 1 1155 1 50 ILE HA 1 51 PRO HD3 2.345 . 2.890 2.231 1.853 2.295 . 0 0 "[ . 1]" 1 1156 1 50 ILE HA 1 51 PRO HG3 3.120 . 4.440 4.314 4.061 4.375 . 0 0 "[ . 1]" 1 1157 1 50 ILE HA 1 52 LEU QD 3.495 . 5.190 4.240 4.168 4.308 . 0 0 "[ . 1]" 1 1158 1 50 ILE HB 1 50 ILE MD 2.485 . 3.170 2.384 2.371 2.397 . 0 0 "[ . 1]" 1 1159 1 50 ILE HB 1 51 PRO HD2 3.455 . 5.110 4.319 4.276 4.391 . 0 0 "[ . 1]" 1 1160 1 50 ILE HB 1 51 PRO HD3 3.405 . 5.010 4.938 4.564 5.004 . 0 0 "[ . 1]" 1 1161 1 50 ILE HB 2 22 VAL MG1 2.680 . 3.560 2.835 2.738 3.051 . 0 0 "[ . 1]" 1 1162 1 50 ILE HB 2 22 VAL MG2 2.840 . 3.880 3.121 3.011 3.286 . 0 0 "[ . 1]" 1 1163 1 50 ILE MD 2 22 VAL HB 3.230 . 4.660 4.515 4.290 4.671 0.011 5 0 "[ . 1]" 1 1164 1 50 ILE MD 2 22 VAL MG1 2.565 . 3.330 2.619 2.365 2.846 . 0 0 "[ . 1]" 1 1165 1 50 ILE MD 2 22 VAL MG2 2.640 . 3.480 2.295 2.163 2.474 . 0 0 "[ . 1]" 1 1166 1 50 ILE MD 2 23 ASP H 3.220 . 4.640 4.264 4.078 4.477 . 0 0 "[ . 1]" 1 1167 1 50 ILE MD 2 23 ASP HA 2.785 . 3.770 3.637 3.300 3.844 0.074 1 0 "[ . 1]" 1 1168 1 50 ILE MD 2 24 THR H 3.245 . 4.690 4.228 3.836 4.539 . 0 0 "[ . 1]" 1 1169 1 50 ILE MD 2 24 THR HA 3.375 . 4.950 4.224 3.993 4.422 . 0 0 "[ . 1]" 1 1170 1 50 ILE MD 2 24 THR HB 3.570 . 5.340 4.490 4.326 4.691 . 0 0 "[ . 1]" 1 1171 1 50 ILE MD 2 24 THR MG 2.425 . 3.050 1.999 1.785 2.096 0.015 6 0 "[ . 1]" 1 1172 1 50 ILE MD 2 30 PRO HA 3.125 . 4.450 3.666 3.470 3.856 . 0 0 "[ . 1]" 1 1173 1 50 ILE MD 2 30 PRO HB2 3.390 . 4.980 4.047 3.481 4.311 . 0 0 "[ . 1]" 1 1174 1 50 ILE MD 2 30 PRO HB3 2.995 . 4.190 2.860 2.356 3.238 . 0 0 "[ . 1]" 1 1175 1 50 ILE MD 2 31 SER H 3.290 . 4.780 4.453 4.221 4.713 . 0 0 "[ . 1]" 1 1176 1 50 ILE HG12 1 50 ILE MG 2.400 . 3.000 2.338 2.330 2.352 . 0 0 "[ . 1]" 1 1177 1 50 ILE HG12 1 51 PRO HD2 3.105 . 4.410 3.950 3.837 4.315 . 0 0 "[ . 1]" 1 1178 1 50 ILE HG12 1 51 PRO HD3 3.410 . 5.020 4.661 4.146 4.782 . 0 0 "[ . 1]" 1 1179 1 50 ILE HG12 2 22 VAL MG1 3.475 . 5.150 4.923 4.747 5.133 . 0 0 "[ . 1]" 1 1180 1 50 ILE HG12 2 22 VAL MG2 3.650 . 5.500 4.600 4.490 4.766 . 0 0 "[ . 1]" 1 1181 1 50 ILE HG13 1 50 ILE MG 2.525 . 3.250 3.201 3.194 3.204 . 0 0 "[ . 1]" 1 1182 1 50 ILE HG13 1 51 PRO HD2 3.290 . 4.780 4.887 4.820 5.275 0.495 9 0 "[ . 1]" 1 1183 1 50 ILE HG13 2 22 VAL MG1 3.000 . 4.200 4.046 3.883 4.171 . 0 0 "[ . 1]" 1 1184 1 50 ILE MG 1 51 PRO HA 3.025 . 4.250 4.066 4.033 4.090 . 0 0 "[ . 1]" 1 1185 1 50 ILE MG 1 51 PRO HD2 2.535 . 3.270 2.238 2.146 2.288 . 0 0 "[ . 1]" 1 1186 1 50 ILE MG 1 51 PRO HD3 2.680 . 3.560 3.475 2.933 3.569 0.009 3 0 "[ . 1]" 1 1187 1 50 ILE MG 1 51 PRO HG2 2.870 . 3.940 3.640 3.534 3.993 0.053 9 0 "[ . 1]" 1 1188 1 50 ILE MG 1 51 PRO HG3 3.110 . 4.420 4.494 4.441 4.529 0.109 3 0 "[ . 1]" 1 1189 1 50 ILE MG 1 52 LEU HA 3.290 . 4.780 4.138 3.996 4.232 . 0 0 "[ . 1]" 1 1190 1 50 ILE MG 2 22 VAL HB 3.500 . 5.200 5.018 4.924 5.213 0.013 1 0 "[ . 1]" 1 1191 1 50 ILE MG 2 24 THR MG 3.105 . 4.410 3.893 3.638 4.128 . 0 0 "[ . 1]" 1 1192 1 50 ILE MG 2 30 PRO HB2 3.200 . 4.600 4.056 3.684 4.275 . 0 0 "[ . 1]" 1 1193 1 50 ILE MG 2 30 PRO HB3 2.800 . 3.800 3.160 2.950 3.354 . 0 0 "[ . 1]" 1 1194 1 50 ILE MG 2 30 PRO HG2 3.640 . 5.480 4.965 3.569 5.499 0.019 5 0 "[ . 1]" 1 1195 1 50 ILE MG 2 30 PRO HG3 3.080 . 4.360 3.997 3.182 4.388 0.028 9 0 "[ . 1]" 1 1196 1 50 ILE MG 2 56 VAL HA 2.790 . 3.780 3.551 3.413 3.650 . 0 0 "[ . 1]" 1 1197 1 50 ILE MG 2 56 VAL HB 3.340 . 4.880 4.460 3.877 4.709 . 0 0 "[ . 1]" 1 1198 1 50 ILE MG 2 56 VAL QG 2.275 . 2.750 2.128 1.978 2.249 . 0 0 "[ . 1]" 1 1199 1 50 ILE MG 2 57 GLY H 2.860 . 3.920 3.250 3.070 3.698 . 0 0 "[ . 1]" 1 1200 1 50 ILE MG 2 57 GLY HA2 3.510 . 5.220 5.020 4.098 5.343 0.123 10 0 "[ . 1]" 1 1201 1 50 ILE MG 2 57 GLY HA3 3.240 . 4.680 4.731 4.442 5.288 0.608 2 2 "[ + . - 1]" 1 1202 1 51 PRO HA 1 52 LEU H 2.270 . 2.740 2.158 2.146 2.175 . 0 0 "[ . 1]" 1 1203 1 51 PRO HA 1 52 LEU HA 3.190 . 4.580 4.403 4.385 4.411 . 0 0 "[ . 1]" 1 1204 1 51 PRO HA 1 52 LEU HB2 3.155 . 4.510 4.452 4.394 4.500 . 0 0 "[ . 1]" 1 1205 1 51 PRO HA 1 52 LEU QD 2.905 . 4.010 3.106 2.967 3.190 . 0 0 "[ . 1]" 1 1206 1 51 PRO HA 1 52 LEU HG 3.430 . 5.060 4.820 4.717 4.926 . 0 0 "[ . 1]" 1 1207 1 51 PRO HB2 1 52 LEU H 2.865 . 3.930 3.374 3.339 3.426 . 0 0 "[ . 1]" 1 1208 1 51 PRO HB2 2 57 GLY H 3.100 . 4.400 3.716 3.345 4.132 . 0 0 "[ . 1]" 1 1209 1 51 PRO HB2 2 57 GLY HA3 2.905 . 4.010 3.363 2.253 4.923 0.913 2 2 "[ + . - 1]" 1 1210 1 51 PRO HB3 1 52 LEU H 2.895 . 3.990 3.919 3.872 3.944 . 0 0 "[ . 1]" 1 1211 1 51 PRO HB3 2 57 GLY H 3.570 . 5.340 5.059 4.800 5.362 0.022 5 0 "[ . 1]" 1 1212 1 51 PRO HD2 2 56 VAL QG 3.050 . 4.300 3.674 3.072 3.940 . 0 0 "[ . 1]" 1 1213 1 51 PRO HD2 2 57 GLY H 3.020 . 4.240 3.726 2.585 4.254 0.014 8 0 "[ . 1]" 1 1214 1 51 PRO HD2 2 57 GLY HA3 3.115 . 4.430 4.293 3.329 5.430 1.000 8 2 "[ - . + 1]" 1 1215 1 51 PRO HG2 1 52 LEU H 3.405 . 5.010 4.888 4.800 5.038 0.028 9 0 "[ . 1]" 1 1216 1 51 PRO HG2 1 52 LEU QD 3.620 . 5.440 4.941 4.869 5.159 . 0 0 "[ . 1]" 1 1217 1 51 PRO HG2 2 56 VAL QG 2.970 . 4.140 3.965 3.712 4.193 0.053 5 0 "[ . 1]" 1 1218 1 51 PRO HG2 2 57 GLY H 2.725 . 3.650 2.812 2.571 2.918 . 0 0 "[ . 1]" 1 1219 1 51 PRO HG2 2 57 GLY HA2 2.790 . 3.780 3.316 2.316 3.805 0.025 5 0 "[ . 1]" 1 1220 1 51 PRO HG2 2 57 GLY HA3 2.530 . 3.260 2.361 1.734 3.773 0.513 2 2 "[ + . - 1]" 1 1221 1 51 PRO HG2 2 58 GLU H 3.035 . 4.270 3.676 2.826 4.346 0.076 6 0 "[ . 1]" 1 1222 1 51 PRO HG3 1 52 LEU H 3.650 . 5.500 5.558 5.538 5.587 0.087 8 0 "[ . 1]" 1 1223 1 51 PRO HG3 2 56 VAL QG 3.620 . 5.440 5.196 4.978 5.425 . 0 0 "[ . 1]" 1 1224 1 51 PRO HG3 2 57 GLY H 3.250 . 4.700 4.545 4.332 4.683 . 0 0 "[ . 1]" 1 1225 1 51 PRO HG3 2 57 GLY HA3 3.090 . 4.380 3.751 3.043 5.151 0.771 2 2 "[ + . - 1]" 1 1226 1 52 LEU H 1 52 LEU HB2 2.545 . 3.290 2.664 2.600 2.723 . 0 0 "[ . 1]" 1 1227 1 52 LEU H 1 52 LEU HB3 2.805 . 3.810 3.786 3.750 3.817 0.007 8 0 "[ . 1]" 1 1228 1 52 LEU H 1 52 LEU QD 2.745 . 3.690 2.739 2.691 2.806 . 0 0 "[ . 1]" 1 1229 1 52 LEU H 1 52 LEU HG 2.890 . 3.980 3.863 3.816 3.927 . 0 0 "[ . 1]" 1 1230 1 52 LEU H 2 57 GLY H 3.650 . 5.500 4.732 4.525 4.949 . 0 0 "[ . 1]" 1 1231 1 52 LEU HA 1 52 LEU MD1 2.875 . 3.950 3.347 3.303 3.403 . 0 0 "[ . 1]" 1 1232 1 52 LEU HA 1 52 LEU MD2 2.875 . 3.950 3.462 3.427 3.507 . 0 0 "[ . 1]" 1 1233 1 52 LEU HA 1 52 LEU HG 2.865 . 3.930 2.387 2.362 2.409 . 0 0 "[ . 1]" 1 1234 1 52 LEU HA 1 53 THR H 2.275 . 2.750 2.143 2.111 2.167 . 0 0 "[ . 1]" 1 1235 1 52 LEU HA 1 53 THR HB 3.520 . 5.240 4.737 4.669 4.803 . 0 0 "[ . 1]" 1 1236 1 52 LEU HA 2 54 ILE MG 2.995 . 4.190 3.631 3.541 3.698 . 0 0 "[ . 1]" 1 1237 1 52 LEU HA 2 55 PHE H 3.170 . 4.540 4.468 4.330 4.571 0.031 3 0 "[ . 1]" 1 1238 1 52 LEU HA 2 56 VAL H 3.430 . 5.060 4.980 4.913 5.079 0.019 3 0 "[ . 1]" 1 1239 1 52 LEU HA 2 56 VAL HA 2.450 . 3.100 2.734 2.614 2.851 . 0 0 "[ . 1]" 1 1240 1 52 LEU HA 2 56 VAL MG1 3.650 . 5.500 4.814 4.440 5.432 . 0 0 "[ . 1]" 1 1241 1 52 LEU HA 2 56 VAL QG 3.290 . 4.780 3.769 3.579 4.133 . 0 0 "[ . 1]" 1 1242 1 52 LEU HA 2 56 VAL MG2 3.650 . 5.500 3.945 3.720 4.284 . 0 0 "[ . 1]" 1 1243 1 52 LEU HA 2 57 GLY H 2.920 . 4.040 3.108 2.884 3.449 . 0 0 "[ . 1]" 1 1244 1 52 LEU HB2 1 52 LEU QD 2.445 . 3.090 2.093 2.086 2.101 . 0 0 "[ . 1]" 1 1245 1 52 LEU HB2 1 53 THR H 3.125 . 4.450 4.173 4.126 4.221 . 0 0 "[ . 1]" 1 1246 1 52 LEU HB2 1 54 ILE MD 3.415 . 5.030 4.310 4.137 4.537 . 0 0 "[ . 1]" 1 1247 1 52 LEU HB2 2 22 VAL MG1 3.650 . 5.500 5.268 5.111 5.420 . 0 0 "[ . 1]" 1 1248 1 52 LEU HB2 2 22 VAL MG2 3.650 . 5.500 5.449 5.296 5.519 0.019 9 0 "[ . 1]" 1 1249 1 52 LEU HB2 2 54 ILE MD 3.310 . 4.820 4.845 4.817 4.871 0.051 6 0 "[ . 1]" 1 1250 1 52 LEU HB2 2 54 ILE MG 2.925 . 4.050 3.617 3.528 3.720 . 0 0 "[ . 1]" 1 1251 1 52 LEU HB3 1 52 LEU QD 2.440 . 3.080 2.128 2.116 2.139 . 0 0 "[ . 1]" 1 1252 1 52 LEU HB3 1 53 THR H 2.670 . 3.540 3.154 3.067 3.243 . 0 0 "[ . 1]" 1 1253 1 52 LEU HB3 1 53 THR HA 3.295 . 4.790 4.574 4.525 4.628 . 0 0 "[ . 1]" 1 1254 1 52 LEU HB3 1 54 ILE HG12 3.030 . 4.260 3.845 3.690 4.028 . 0 0 "[ . 1]" 1 1255 1 52 LEU HB3 2 54 ILE HA 3.330 . 4.860 4.669 4.603 4.732 . 0 0 "[ . 1]" 1 1256 1 52 LEU HB3 2 54 ILE MD 2.915 . 4.030 3.898 3.842 3.944 . 0 0 "[ . 1]" 1 1257 1 52 LEU HB3 2 54 ILE HG12 3.415 . 5.030 4.734 4.653 4.810 . 0 0 "[ . 1]" 1 1258 1 52 LEU HB3 2 54 ILE MG 2.630 . 3.460 2.238 2.160 2.306 . 0 0 "[ . 1]" 1 1259 1 52 LEU HB3 2 56 VAL HA 3.310 . 4.820 4.406 4.281 4.512 . 0 0 "[ . 1]" 1 1260 1 52 LEU QD 1 53 THR H 3.110 . 4.420 4.091 4.022 4.134 . 0 0 "[ . 1]" 1 1261 1 52 LEU MD1 2 22 VAL HB 3.290 . 4.780 3.366 3.165 3.486 . 0 0 "[ . 1]" 1 1262 1 52 LEU MD1 2 22 VAL MG1 2.415 . 3.030 2.381 2.236 2.602 . 0 0 "[ . 1]" 1 1263 1 52 LEU MD1 2 22 VAL MG2 2.570 . 3.340 2.547 2.372 2.663 . 0 0 "[ . 1]" 1 1264 1 52 LEU MD2 2 8 PHE QD 3.250 . 4.700 4.281 4.093 4.446 . 0 0 "[ . 1]" 1 1265 1 52 LEU MD2 2 22 VAL HB 3.145 . 4.490 2.850 2.719 3.022 . 0 0 "[ . 1]" 1 1266 1 52 LEU MD2 2 22 VAL MG2 2.460 . 3.120 2.446 2.337 2.586 . 0 0 "[ . 1]" 1 1267 1 52 LEU MD2 2 32 LEU MD1 2.500 . 3.200 2.429 2.299 2.559 . 0 0 "[ . 1]" 1 1268 1 52 LEU MD2 2 32 LEU MD2 2.805 . 3.810 3.558 3.374 3.714 . 0 0 "[ . 1]" 1 1269 1 52 LEU MD2 2 32 LEU HG 3.415 . 5.030 4.893 4.697 5.036 0.006 2 0 "[ . 1]" 1 1270 1 52 LEU MD2 2 54 ILE HA 3.345 . 4.890 4.788 4.761 4.823 . 0 0 "[ . 1]" 1 1271 1 52 LEU MD2 2 54 ILE MD 2.515 . 3.230 3.052 3.009 3.089 . 0 0 "[ . 1]" 1 1272 1 52 LEU MD2 2 54 ILE MG 2.345 . 2.890 1.867 1.836 1.888 . 0 0 "[ . 1]" 1 1273 1 52 LEU MD2 2 55 PHE H 3.590 . 5.380 4.712 4.635 4.799 . 0 0 "[ . 1]" 1 1274 1 52 LEU MD2 2 56 VAL HA 2.760 . 3.720 3.781 3.742 3.840 0.120 9 0 "[ . 1]" 1 1275 1 52 LEU MD2 2 56 VAL HB 3.650 . 5.500 5.008 4.240 5.244 . 0 0 "[ . 1]" 1 1276 1 52 LEU HG 1 53 THR H 3.160 . 4.520 4.252 4.200 4.319 . 0 0 "[ . 1]" 1 1277 1 52 LEU HG 2 22 VAL MG2 2.925 . 4.050 3.738 3.561 3.867 . 0 0 "[ . 1]" 1 1278 1 52 LEU HG 2 54 ILE MD 3.650 . 5.500 5.487 5.420 5.525 0.025 1 0 "[ . 1]" 1 1279 1 52 LEU HG 2 54 ILE MG 2.820 . 3.840 3.554 3.482 3.601 . 0 0 "[ . 1]" 1 1280 1 52 LEU HG 2 56 VAL HA 3.065 . 4.330 2.842 2.733 2.939 . 0 0 "[ . 1]" 1 1281 1 52 LEU HG 2 57 GLY H 3.290 . 4.780 3.805 3.621 4.008 . 0 0 "[ . 1]" 1 1282 1 53 THR H 1 53 THR HB 2.550 . 3.300 2.705 2.649 2.745 . 0 0 "[ . 1]" 1 1283 1 53 THR H 1 53 THR MG 2.925 . 4.050 3.860 3.841 3.873 . 0 0 "[ . 1]" 1 1284 1 53 THR H 2 54 ILE HA 3.295 . 4.790 4.358 4.277 4.424 . 0 0 "[ . 1]" 1 1285 1 53 THR H 2 54 ILE MG 2.665 . 3.530 3.348 3.251 3.401 . 0 0 "[ . 1]" 1 1286 1 53 THR H 2 55 PHE H 2.705 . 3.610 2.833 2.721 2.898 . 0 0 "[ . 1]" 1 1287 1 53 THR H 2 55 PHE HA 3.275 . 4.750 4.597 4.564 4.626 . 0 0 "[ . 1]" 1 1288 1 53 THR H 2 55 PHE HB2 2.815 . 3.830 3.192 3.133 3.281 . 0 0 "[ . 1]" 1 1289 1 53 THR H 2 55 PHE HB3 3.205 . 4.610 4.319 4.241 4.414 . 0 0 "[ . 1]" 1 1290 1 53 THR H 2 55 PHE QD 3.175 . 4.550 4.594 4.557 4.637 0.087 1 0 "[ . 1]" 1 1291 1 53 THR H 2 56 VAL H 3.495 . 5.190 4.898 4.845 4.958 . 0 0 "[ . 1]" 1 1292 1 53 THR H 2 57 GLY H 3.650 . 5.500 4.417 4.119 4.814 . 0 0 "[ . 1]" 1 1293 1 53 THR HA 1 53 THR MG 2.460 . 3.120 2.288 2.267 2.321 . 0 0 "[ . 1]" 1 1294 1 53 THR HA 1 54 ILE H 2.315 . 2.830 2.149 2.140 2.154 . 0 0 "[ . 1]" 1 1295 1 53 THR HA 1 54 ILE HB 3.315 . 4.830 4.642 4.620 4.662 . 0 0 "[ . 1]" 1 1296 1 53 THR HA 1 54 ILE HG13 2.890 . 3.980 3.811 3.738 3.880 . 0 0 "[ . 1]" 1 1297 1 53 THR HA 2 54 ILE MG 3.315 . 4.830 4.704 4.640 4.763 . 0 0 "[ . 1]" 1 1298 1 53 THR HA 2 55 PHE HB2 3.345 . 4.890 4.900 4.878 4.924 0.034 8 0 "[ . 1]" 1 1299 1 53 THR HB 1 54 ILE H 3.245 . 4.690 4.169 4.134 4.217 . 0 0 "[ . 1]" 1 1300 1 53 THR HB 2 55 PHE H 2.875 . 3.950 3.222 3.151 3.289 . 0 0 "[ . 1]" 1 1301 1 53 THR HB 2 55 PHE HB2 2.490 . 3.180 2.189 2.098 2.250 . 0 0 "[ . 1]" 1 1302 1 53 THR HB 2 55 PHE HB3 2.895 . 3.990 3.794 3.707 3.856 . 0 0 "[ . 1]" 1 1303 1 53 THR HB 2 55 PHE QD 2.940 . 4.080 3.292 3.120 3.434 . 0 0 "[ . 1]" 1 1304 1 53 THR MG 1 54 ILE H 2.555 . 3.310 2.924 2.852 2.966 . 0 0 "[ . 1]" 1 1305 1 53 THR MG 1 55 PHE HB3 3.650 . 5.500 5.576 5.555 5.598 0.098 3 0 "[ . 1]" 1 1306 1 53 THR MG 1 55 PHE QD 2.710 . 3.620 3.320 3.281 3.420 . 0 0 "[ . 1]" 1 1307 1 53 THR MG 1 55 PHE HZ 2.790 . 3.780 2.874 2.733 3.001 . 0 0 "[ . 1]" 1 1308 1 53 THR MG 2 55 PHE HB2 2.955 . 4.110 3.770 3.649 3.850 . 0 0 "[ . 1]" 1 1309 1 53 THR MG 2 55 PHE HB3 3.565 . 5.330 5.049 4.924 5.129 . 0 0 "[ . 1]" 1 1310 1 54 ILE H 1 54 ILE HB 2.575 . 3.350 2.594 2.579 2.611 . 0 0 "[ . 1]" 1 1311 1 54 ILE H 1 54 ILE MD 3.145 . 4.490 4.033 4.000 4.072 . 0 0 "[ . 1]" 1 1312 1 54 ILE H 1 54 ILE HG12 3.090 . 4.380 3.697 3.668 3.734 . 0 0 "[ . 1]" 1 1313 1 54 ILE H 1 54 ILE HG13 2.700 . 3.600 2.684 2.648 2.745 . 0 0 "[ . 1]" 1 1314 1 54 ILE H 1 54 ILE MG 2.820 . 3.840 3.831 3.823 3.837 . 0 0 "[ . 1]" 1 1315 1 54 ILE H 1 55 PHE H 3.350 . 4.900 4.356 4.316 4.393 . 0 0 "[ . 1]" 1 1316 1 54 ILE H 2 55 PHE H 3.585 . 5.370 4.760 4.725 4.792 . 0 0 "[ . 1]" 1 1317 1 54 ILE HA 1 54 ILE MD 2.835 . 3.870 3.768 3.749 3.789 . 0 0 "[ . 1]" 1 1318 1 54 ILE HA 1 54 ILE HG12 2.575 . 3.350 2.461 2.432 2.491 . 0 0 "[ . 1]" 1 1319 1 54 ILE HA 1 54 ILE HG13 2.675 . 3.550 3.149 3.113 3.171 . 0 0 "[ . 1]" 1 1320 1 54 ILE HA 1 54 ILE MG 2.445 . 3.090 2.383 2.368 2.402 . 0 0 "[ . 1]" 1 1321 1 54 ILE HA 1 55 PHE H 2.310 . 2.820 2.101 2.084 2.123 . 0 0 "[ . 1]" 1 1322 1 54 ILE HA 1 55 PHE HA 3.225 . 4.650 4.379 4.370 4.388 . 0 0 "[ . 1]" 1 1323 1 54 ILE HA 1 55 PHE HB2 3.185 . 4.570 4.477 4.449 4.526 . 0 0 "[ . 1]" 1 1324 1 54 ILE HA 1 55 PHE QD 3.185 . 4.570 3.428 3.276 3.598 . 0 0 "[ . 1]" 1 1325 1 54 ILE HA 2 52 LEU HB3 3.330 . 4.860 4.673 4.614 4.734 . 0 0 "[ . 1]" 1 1326 1 54 ILE HA 2 52 LEU QD 3.325 . 4.850 4.709 4.687 4.733 . 0 0 "[ . 1]" 1 1327 1 54 ILE HA 2 53 THR H 3.295 . 4.790 4.354 4.278 4.422 . 0 0 "[ . 1]" 1 1328 1 54 ILE HA 2 54 ILE MD 3.180 . 4.560 4.395 4.366 4.442 . 0 0 "[ . 1]" 1 1329 1 54 ILE HA 2 54 ILE HG12 2.875 . 3.950 2.874 2.846 2.911 . 0 0 "[ . 1]" 1 1330 1 54 ILE HA 2 54 ILE HG13 3.135 . 4.470 4.135 4.106 4.181 . 0 0 "[ . 1]" 1 1331 1 54 ILE HA 2 54 ILE MG 2.835 . 3.870 3.497 3.428 3.584 . 0 0 "[ . 1]" 1 1332 1 54 ILE HB 1 54 ILE MD 2.580 . 3.360 2.509 2.498 2.517 . 0 0 "[ . 1]" 1 1333 1 54 ILE HB 2 54 ILE MD 3.605 . 5.410 4.839 4.788 4.949 . 0 0 "[ . 1]" 1 1334 1 54 ILE MD 1 54 ILE MG 2.240 . 2.680 1.864 1.846 1.892 . 0 0 "[ . 1]" 1 1335 1 54 ILE MD 1 55 PHE H 3.365 . 4.930 5.014 4.968 5.064 0.134 1 0 "[ . 1]" 1 1336 1 54 ILE MD 2 20 LEU HB2 3.595 . 5.390 5.452 5.422 5.511 0.121 7 0 "[ . 1]" 1 1337 1 54 ILE MD 2 52 LEU HB2 3.310 . 4.820 4.844 4.798 4.887 0.067 6 0 "[ . 1]" 1 1338 1 54 ILE MD 2 52 LEU HB3 2.915 . 4.030 3.893 3.831 3.942 . 0 0 "[ . 1]" 1 1339 1 54 ILE MD 2 52 LEU QD 2.510 . 3.220 3.022 2.981 3.058 . 0 0 "[ . 1]" 1 1340 1 54 ILE MD 2 52 LEU HG 3.650 . 5.500 5.481 5.402 5.511 0.011 1 0 "[ . 1]" 1 1341 1 54 ILE MD 2 54 ILE HA 3.180 . 4.560 4.388 4.359 4.449 . 0 0 "[ . 1]" 1 1342 1 54 ILE MD 2 54 ILE HB 3.605 . 5.410 4.836 4.777 4.950 . 0 0 "[ . 1]" 1 1343 1 54 ILE MD 2 54 ILE HG12 2.755 . 3.710 2.645 2.615 2.713 . 0 0 "[ . 1]" 1 1344 1 54 ILE MD 2 54 ILE HG13 2.925 . 4.050 3.727 3.669 3.783 . 0 0 "[ . 1]" 1 1345 1 54 ILE MD 2 54 ILE MG 2.780 . 3.760 3.168 3.058 3.295 . 0 0 "[ . 1]" 1 1346 1 54 ILE HG12 1 54 ILE MG 2.290 . 2.780 2.463 2.444 2.478 . 0 0 "[ . 1]" 1 1347 1 54 ILE HG12 1 55 PHE H 3.275 . 4.750 4.348 4.295 4.375 . 0 0 "[ . 1]" 1 1348 1 54 ILE HG12 2 52 LEU HB3 3.415 . 5.030 4.730 4.653 4.805 . 0 0 "[ . 1]" 1 1349 1 54 ILE HG12 2 54 ILE HA 2.875 . 3.950 2.866 2.838 2.922 . 0 0 "[ . 1]" 1 1350 1 54 ILE HG12 2 54 ILE MD 2.755 . 3.710 2.650 2.622 2.707 . 0 0 "[ . 1]" 1 1351 1 54 ILE HG12 2 54 ILE HG13 3.155 . 4.510 3.363 3.279 3.465 . 0 0 "[ . 1]" 1 1352 1 54 ILE HG12 2 54 ILE MG 2.410 . 3.020 2.280 2.158 2.446 . 0 0 "[ . 1]" 1 1353 1 54 ILE HG12 2 55 PHE H 3.450 . 5.100 4.244 4.202 4.291 . 0 0 "[ . 1]" 1 1354 1 54 ILE HG13 1 54 ILE MG 2.565 . 3.330 3.201 3.198 3.206 . 0 0 "[ . 1]" 1 1355 1 54 ILE HG13 1 55 PHE H 3.650 . 5.500 5.118 5.076 5.136 . 0 0 "[ . 1]" 1 1356 1 54 ILE HG13 2 54 ILE HA 3.135 . 4.470 4.129 4.099 4.178 . 0 0 "[ . 1]" 1 1357 1 54 ILE HG13 2 54 ILE MD 2.925 . 4.050 3.731 3.663 3.782 . 0 0 "[ . 1]" 1 1358 1 54 ILE HG13 2 54 ILE HG12 3.155 . 4.510 3.363 3.279 3.465 . 0 0 "[ . 1]" 1 1359 1 54 ILE HG13 2 54 ILE MG 2.845 . 3.890 3.087 3.017 3.166 . 0 0 "[ . 1]" 1 1360 1 54 ILE HG13 2 55 PHE H 3.650 . 5.500 4.888 4.841 4.932 . 0 0 "[ . 1]" 1 1361 1 54 ILE MG 1 55 PHE H 2.480 . 3.160 2.694 2.613 2.777 . 0 0 "[ . 1]" 1 1362 1 54 ILE MG 1 55 PHE HA 3.010 . 4.220 3.697 3.627 3.773 . 0 0 "[ . 1]" 1 1363 1 54 ILE MG 1 55 PHE HB2 3.315 . 4.830 4.563 4.488 4.633 . 0 0 "[ . 1]" 1 1364 1 54 ILE MG 1 55 PHE HB3 3.605 . 5.410 5.173 5.092 5.253 . 0 0 "[ . 1]" 1 1365 1 54 ILE MG 1 56 VAL H 3.095 . 4.390 4.263 4.189 4.390 . 0 0 "[ . 1]" 1 1366 1 54 ILE MG 1 56 VAL HA 3.070 . 4.340 4.049 4.006 4.086 . 0 0 "[ . 1]" 1 1367 1 54 ILE MG 1 56 VAL HB 3.585 . 5.370 5.146 4.552 5.380 0.010 2 0 "[ . 1]" 1 1368 1 54 ILE MG 2 52 LEU HA 2.995 . 4.190 3.625 3.513 3.708 . 0 0 "[ . 1]" 1 1369 1 54 ILE MG 2 52 LEU HB2 2.925 . 4.050 3.618 3.520 3.738 . 0 0 "[ . 1]" 1 1370 1 54 ILE MG 2 52 LEU HB3 2.630 . 3.460 2.237 2.149 2.322 . 0 0 "[ . 1]" 1 1371 1 54 ILE MG 2 52 LEU QD 2.340 . 2.880 1.863 1.829 1.885 . 0 0 "[ . 1]" 1 1372 1 54 ILE MG 2 52 LEU HG 2.820 . 3.840 3.549 3.473 3.606 . 0 0 "[ . 1]" 1 1373 1 54 ILE MG 2 53 THR H 2.665 . 3.530 3.340 3.241 3.397 . 0 0 "[ . 1]" 1 1374 1 54 ILE MG 2 53 THR HA 3.315 . 4.830 4.698 4.616 4.786 . 0 0 "[ . 1]" 1 1375 1 54 ILE MG 2 54 ILE HA 2.835 . 3.870 3.492 3.425 3.596 . 0 0 "[ . 1]" 1 1376 1 54 ILE MG 2 54 ILE MD 2.780 . 3.760 3.171 3.067 3.295 . 0 0 "[ . 1]" 1 1377 1 54 ILE MG 2 54 ILE HG12 2.410 . 3.020 2.280 2.156 2.449 . 0 0 "[ . 1]" 1 1378 1 54 ILE MG 2 54 ILE HG13 2.845 . 3.890 3.087 3.010 3.174 . 0 0 "[ . 1]" 1 1379 1 55 PHE H 1 55 PHE HB2 2.610 . 3.420 2.492 2.473 2.533 . 0 0 "[ . 1]" 1 1380 1 55 PHE H 1 55 PHE HB3 2.785 . 3.770 3.682 3.669 3.703 . 0 0 "[ . 1]" 1 1381 1 55 PHE H 1 55 PHE QD 2.830 . 3.860 2.546 2.392 2.721 . 0 0 "[ . 1]" 1 1382 1 55 PHE H 1 56 VAL H 3.200 . 4.600 4.449 4.428 4.468 . 0 0 "[ . 1]" 1 1383 1 55 PHE H 2 52 LEU HA 3.170 . 4.540 4.470 4.341 4.572 0.032 3 0 "[ . 1]" 1 1384 1 55 PHE H 2 52 LEU QD 3.560 . 5.320 4.616 4.538 4.681 . 0 0 "[ . 1]" 1 1385 1 55 PHE H 2 53 THR H 2.705 . 3.610 2.833 2.712 2.893 . 0 0 "[ . 1]" 1 1386 1 55 PHE H 2 53 THR HB 2.875 . 3.950 3.215 3.123 3.263 . 0 0 "[ . 1]" 1 1387 1 55 PHE H 2 54 ILE H 3.585 . 5.370 4.761 4.720 4.799 . 0 0 "[ . 1]" 1 1388 1 55 PHE H 2 54 ILE HG12 3.450 . 5.100 4.251 4.218 4.288 . 0 0 "[ . 1]" 1 1389 1 55 PHE H 2 54 ILE HG13 3.650 . 5.500 4.894 4.862 4.932 . 0 0 "[ . 1]" 1 1390 1 55 PHE HA 1 55 PHE QD 2.855 . 3.910 3.094 3.019 3.160 . 0 0 "[ . 1]" 1 1391 1 55 PHE HA 1 56 VAL H 2.265 . 2.730 2.189 2.163 2.224 . 0 0 "[ . 1]" 1 1392 1 55 PHE HA 1 56 VAL HA 3.200 . 4.600 4.373 4.361 4.384 . 0 0 "[ . 1]" 1 1393 1 55 PHE HA 1 56 VAL HB 3.155 . 4.510 4.422 4.241 4.530 0.020 8 0 "[ . 1]" 1 1394 1 55 PHE HA 2 53 THR H 3.275 . 4.750 4.597 4.557 4.640 . 0 0 "[ . 1]" 1 1395 1 55 PHE HB2 1 56 VAL H 3.035 . 4.270 4.123 4.050 4.204 . 0 0 "[ . 1]" 1 1396 1 55 PHE HB2 2 53 THR H 2.815 . 3.830 3.199 3.140 3.277 . 0 0 "[ . 1]" 1 1397 1 55 PHE HB2 2 53 THR HA 3.345 . 4.890 4.902 4.877 4.929 0.039 10 0 "[ . 1]" 1 1398 1 55 PHE HB2 2 53 THR HB 2.490 . 3.180 2.187 2.113 2.257 . 0 0 "[ . 1]" 1 1399 1 55 PHE HB2 2 53 THR MG 2.955 . 4.110 3.768 3.662 3.857 . 0 0 "[ . 1]" 1 1400 1 55 PHE HB3 1 56 VAL H 2.725 . 3.650 3.084 2.980 3.225 . 0 0 "[ . 1]" 1 1401 1 55 PHE HB3 1 56 VAL MG1 3.650 . 5.500 5.189 4.161 5.597 0.097 8 0 "[ . 1]" 1 1402 1 55 PHE HB3 1 56 VAL MG2 3.650 . 5.500 5.446 5.151 5.697 0.197 3 0 "[ . 1]" 1 1403 1 55 PHE HB3 2 53 THR H 3.205 . 4.610 4.324 4.241 4.415 . 0 0 "[ . 1]" 1 1404 1 55 PHE HB3 2 53 THR HB 2.895 . 3.990 3.791 3.720 3.865 . 0 0 "[ . 1]" 1 1405 1 55 PHE HB3 2 53 THR MG 3.565 . 5.330 5.047 4.938 5.138 . 0 0 "[ . 1]" 1 1406 1 55 PHE QD 1 56 VAL H 3.395 . 4.990 4.111 3.945 4.245 . 0 0 "[ . 1]" 1 1407 1 55 PHE QD 2 53 THR H 3.175 . 4.550 4.599 4.566 4.637 0.087 1 0 "[ . 1]" 1 1408 1 55 PHE QD 2 53 THR HB 2.940 . 4.080 3.291 3.113 3.425 . 0 0 "[ . 1]" 1 1409 1 56 VAL H 1 56 VAL HB 2.410 . 3.020 2.369 2.215 2.722 . 0 0 "[ . 1]" 1 1410 1 56 VAL H 1 56 VAL QG 2.500 . 3.200 2.656 1.951 2.911 . 0 0 "[ . 1]" 1 1411 1 56 VAL H 2 52 LEU HA 3.430 . 5.060 4.982 4.921 5.095 0.035 3 0 "[ . 1]" 1 1412 1 56 VAL H 2 53 THR H 3.495 . 5.190 4.896 4.829 4.955 . 0 0 "[ . 1]" 1 1413 1 56 VAL HA 1 56 VAL MG1 2.560 . 3.320 2.786 2.496 3.203 . 0 0 "[ . 1]" 1 1414 1 56 VAL HA 1 56 VAL QG 2.290 . 2.780 2.109 2.045 2.288 . 0 0 "[ . 1]" 1 1415 1 56 VAL HA 1 56 VAL MG2 2.560 . 3.320 2.195 2.110 2.343 . 0 0 "[ . 1]" 1 1416 1 56 VAL HA 1 57 GLY H 2.270 . 2.740 2.167 2.123 2.243 . 0 0 "[ . 1]" 1 1417 1 56 VAL HA 2 50 ILE MG 2.790 . 3.780 3.556 3.419 3.655 . 0 0 "[ . 1]" 1 1418 1 56 VAL HA 2 52 LEU HA 2.450 . 3.100 2.736 2.628 2.824 . 0 0 "[ . 1]" 1 1419 1 56 VAL HA 2 52 LEU HB3 3.310 . 4.820 4.420 4.287 4.526 . 0 0 "[ . 1]" 1 1420 1 56 VAL HA 2 52 LEU QD 2.750 . 3.700 3.560 3.508 3.610 . 0 0 "[ . 1]" 1 1421 1 56 VAL HA 2 52 LEU HG 3.065 . 4.330 2.857 2.749 2.958 . 0 0 "[ . 1]" 1 1422 1 56 VAL HB 2 50 ILE MG 3.340 . 4.880 4.463 3.865 4.691 . 0 0 "[ . 1]" 1 1423 1 56 VAL HB 2 52 LEU QD 3.620 . 5.440 4.779 4.088 4.998 . 0 0 "[ . 1]" 1 1424 1 56 VAL QG 1 57 GLY H 2.495 . 3.190 2.540 2.303 2.886 . 0 0 "[ . 1]" 1 1425 1 56 VAL QG 1 57 GLY HA2 3.125 . 4.450 3.355 2.901 3.831 . 0 0 "[ . 1]" 1 1426 1 56 VAL QG 1 57 GLY HA3 3.035 . 4.270 3.743 3.372 3.861 . 0 0 "[ . 1]" 1 1427 1 56 VAL QG 2 50 ILE MG 2.275 . 2.750 2.131 1.973 2.238 . 0 0 "[ . 1]" 1 1428 1 56 VAL QG 2 51 PRO HD2 3.050 . 4.300 3.672 3.043 3.946 . 0 0 "[ . 1]" 1 1429 1 56 VAL QG 2 51 PRO HG2 2.970 . 4.140 3.960 3.802 4.198 0.058 5 0 "[ . 1]" 1 1430 1 56 VAL QG 2 51 PRO HG3 3.620 . 5.440 5.192 5.066 5.431 . 0 0 "[ . 1]" 1 1431 1 56 VAL QG 2 52 LEU HA 3.290 . 4.780 3.766 3.582 4.118 . 0 0 "[ . 1]" 1 1432 1 56 VAL MG1 1 57 GLY HA2 3.500 . 5.200 3.471 2.916 3.945 . 0 0 "[ . 1]" 1 1433 1 56 VAL MG1 1 57 GLY HA3 3.460 . 5.120 4.005 3.406 4.890 . 0 0 "[ . 1]" 1 1434 1 56 VAL MG1 2 52 LEU HA 3.650 . 5.500 4.814 4.436 5.434 . 0 0 "[ . 1]" 1 1435 1 56 VAL MG2 1 57 GLY HA2 3.500 . 5.200 4.987 3.830 5.378 0.178 6 0 "[ . 1]" 1 1436 1 56 VAL MG2 1 57 GLY HA3 3.460 . 5.120 5.066 3.965 5.440 0.320 2 0 "[ . 1]" 1 1437 1 56 VAL MG2 2 52 LEU HA 3.650 . 5.500 3.940 3.728 4.268 . 0 0 "[ . 1]" 1 1438 1 57 GLY H 1 58 GLU H 3.215 . 4.630 4.444 4.367 4.538 . 0 0 "[ . 1]" 1 1439 1 57 GLY H 1 58 GLU HA 3.625 . 5.450 5.095 4.813 5.467 0.017 6 0 "[ . 1]" 1 1440 1 57 GLY H 2 50 ILE MG 2.860 . 3.920 3.259 3.076 3.719 . 0 0 "[ . 1]" 1 1441 1 57 GLY H 2 51 PRO HB2 3.100 . 4.400 3.711 3.330 4.145 . 0 0 "[ . 1]" 1 1442 1 57 GLY H 2 51 PRO HB3 3.570 . 5.340 5.056 4.879 5.377 0.037 5 0 "[ . 1]" 1 1443 1 57 GLY H 2 51 PRO HD2 3.020 . 4.240 3.731 2.596 4.259 0.019 8 0 "[ . 1]" 1 1444 1 57 GLY H 2 51 PRO HG2 2.725 . 3.650 2.807 2.507 2.950 . 0 0 "[ . 1]" 1 1445 1 57 GLY H 2 51 PRO HG3 3.250 . 4.700 4.541 4.270 4.713 0.013 3 0 "[ . 1]" 1 1446 1 57 GLY H 2 52 LEU H 3.650 . 5.500 4.736 4.544 4.965 . 0 0 "[ . 1]" 1 1447 1 57 GLY H 2 52 LEU HA 2.920 . 4.040 3.112 2.882 3.449 . 0 0 "[ . 1]" 1 1448 1 57 GLY H 2 52 LEU HG 3.290 . 4.780 3.819 3.614 4.035 . 0 0 "[ . 1]" 1 1449 1 57 GLY H 2 53 THR H 3.650 . 5.500 4.416 4.123 4.795 . 0 0 "[ . 1]" 1 1450 1 57 GLY HA2 1 58 GLU QB 3.570 . 5.340 4.494 4.274 4.646 . 0 0 "[ . 1]" 1 1451 1 57 GLY HA2 2 50 ILE MG 3.510 . 5.220 5.030 4.115 5.345 0.125 10 0 "[ . 1]" 1 1452 1 57 GLY HA2 2 51 PRO HG2 2.790 . 3.780 3.316 2.287 3.819 0.039 5 0 "[ . 1]" 1 1453 1 57 GLY HA3 1 58 GLU H 2.640 . 3.480 2.776 2.408 3.222 . 0 0 "[ . 1]" 1 1454 1 57 GLY HA3 1 58 GLU QG 3.230 . 4.660 4.500 4.027 4.952 0.292 10 0 "[ . 1]" 1 1455 1 57 GLY HA3 2 50 ILE MG 3.240 . 4.680 4.739 4.389 5.304 0.624 2 2 "[ + . - 1]" 1 1456 1 57 GLY HA3 2 51 PRO HB2 2.905 . 4.010 3.365 2.317 4.919 0.909 2 2 "[ + . - 1]" 1 1457 1 57 GLY HA3 2 51 PRO HD2 3.115 . 4.430 4.301 3.361 5.424 0.994 8 2 "[ - . + 1]" 1 1458 1 57 GLY HA3 2 51 PRO HG2 2.530 . 3.260 2.364 1.725 3.775 0.515 2 1 "[ + . 1]" 1 1459 1 57 GLY HA3 2 51 PRO HG3 3.090 . 4.380 3.751 3.075 5.144 0.764 2 2 "[ + . - 1]" 1 1460 1 58 GLU H 1 58 GLU QB 2.625 . 3.450 2.716 2.443 3.177 . 0 0 "[ . 1]" 1 1461 1 58 GLU H 1 58 GLU QG 2.920 . 4.040 2.230 1.885 2.804 . 0 0 "[ . 1]" 1 1462 1 58 GLU H 2 51 PRO HG2 3.035 . 4.270 3.679 2.835 4.362 0.092 6 0 "[ . 1]" 1 1463 1 58 GLU HA 1 58 GLU QG 2.715 . 3.630 2.996 2.411 3.414 . 0 0 "[ . 1]" 1 1464 1 58 GLU HA 1 59 ASN HB2 3.475 . 5.150 4.675 4.094 5.297 0.147 10 0 "[ . 1]" 1 1465 1 58 GLU HA 1 59 ASN HB3 3.475 . 5.150 4.947 4.262 5.420 0.270 4 0 "[ . 1]" 1 1466 1 60 THR HA 1 60 THR MG 2.645 . 3.490 2.474 2.241 3.218 . 0 0 "[ . 1]" 1 1467 2 4 GLU HA 2 4 GLU QG 2.725 . 3.650 2.747 2.353 3.507 . 0 0 "[ . 1]" 1 1468 2 4 GLU HA 2 5 MET H 2.435 . 3.070 2.390 2.113 3.077 0.007 1 0 "[ . 1]" 1 1469 2 4 GLU HA 2 5 MET HA 3.280 . 4.760 4.461 4.353 4.736 . 0 0 "[ . 1]" 1 1470 2 4 GLU HA 2 5 MET HG2 3.555 . 5.310 4.252 3.627 5.430 0.120 7 0 "[ . 1]" 1 1471 2 4 GLU HA 2 5 MET QG 3.160 . 4.520 3.864 3.435 4.483 . 0 0 "[ . 1]" 1 1472 2 4 GLU HA 2 5 MET HG3 3.555 . 5.310 4.938 3.519 5.440 0.130 1 0 "[ . 1]" 1 1473 2 4 GLU QB 2 4 GLU QG 2.050 . 2.300 2.052 1.988 2.086 . 0 0 "[ . 1]" 1 1474 2 4 GLU HB2 2 4 GLU QG 2.370 . 2.940 2.299 2.144 2.357 . 0 0 "[ . 1]" 1 1475 2 4 GLU HB3 2 4 GLU QG 2.370 . 2.940 2.324 2.164 2.435 . 0 0 "[ . 1]" 1 1476 2 4 GLU QG 2 5 MET H 3.295 . 4.790 3.856 2.411 4.482 . 0 0 "[ . 1]" 1 1477 2 5 MET H 2 5 MET HB2 2.910 . 4.020 3.466 2.601 3.780 . 0 0 "[ . 1]" 1 1478 2 5 MET H 2 5 MET HB3 2.910 . 4.020 3.095 2.662 3.782 . 0 0 "[ . 1]" 1 1479 2 5 MET H 2 5 MET HG2 2.990 . 4.180 2.358 1.755 4.069 0.045 1 0 "[ . 1]" 1 1480 2 5 MET H 2 5 MET HG3 2.990 . 4.180 2.999 2.617 3.279 . 0 0 "[ . 1]" 1 1481 2 5 MET HA 2 5 MET ME 3.250 . 4.700 4.126 3.901 4.400 . 0 0 "[ . 1]" 1 1482 2 5 MET HA 2 5 MET HG2 2.880 . 3.960 3.586 2.610 3.747 . 0 0 "[ . 1]" 1 1483 2 5 MET HA 2 5 MET QG 2.635 . 3.470 3.182 2.488 3.348 . 0 0 "[ . 1]" 1 1484 2 5 MET HA 2 5 MET HG3 2.880 . 3.960 3.630 2.725 3.844 . 0 0 "[ . 1]" 1 1485 2 5 MET HA 2 6 PRO HA 3.265 . 4.730 4.398 4.342 4.514 . 0 0 "[ . 1]" 1 1486 2 5 MET HA 2 6 PRO HB3 3.330 . 4.860 5.125 4.871 5.529 0.669 10 3 "[ * . - +]" 1 1487 2 5 MET HA 2 6 PRO QD 2.155 . 2.510 1.905 1.720 2.127 0.080 9 0 "[ . 1]" 1 1488 2 5 MET HA 2 6 PRO QG 3.095 . 4.390 3.809 3.620 4.015 . 0 0 "[ . 1]" 1 1489 2 5 MET QB 2 6 PRO QD 2.585 . 3.370 2.570 1.956 3.206 . 0 0 "[ . 1]" 1 1490 2 5 MET QB 2 55 PHE HB2 3.570 . 5.340 4.901 3.856 5.350 0.010 9 0 "[ . 1]" 1 1491 2 5 MET QB 2 55 PHE HB3 3.165 . 4.530 3.366 2.309 3.788 . 0 0 "[ . 1]" 1 1492 2 5 MET QB 2 55 PHE QD 3.165 . 4.530 3.579 2.358 3.900 . 0 0 "[ . 1]" 1 1493 2 5 MET QB 2 57 GLY HA2 3.570 . 5.340 4.029 3.308 5.193 . 0 0 "[ . 1]" 1 1494 2 5 MET HB2 2 6 PRO QD 2.905 . 4.010 2.862 2.328 4.203 0.193 8 0 "[ . 1]" 1 1495 2 5 MET HB3 2 6 PRO QD 2.905 . 4.010 3.297 1.973 3.656 . 0 0 "[ . 1]" 1 1496 2 5 MET ME 2 6 PRO QD 3.190 . 4.580 4.463 4.140 4.616 0.036 10 0 "[ . 1]" 1 1497 2 5 MET ME 2 55 PHE HB2 3.365 . 4.930 3.791 2.520 4.875 . 0 0 "[ . 1]" 1 1498 2 5 MET ME 2 57 GLY HA2 2.965 . 4.130 3.240 2.699 4.022 . 0 0 "[ . 1]" 1 1499 2 5 MET ME 2 57 GLY HA3 3.350 . 4.900 3.917 2.507 4.702 . 0 0 "[ . 1]" 1 1500 2 5 MET QG 2 55 PHE QD 3.570 . 5.340 2.558 1.758 5.130 0.042 10 0 "[ . 1]" 1 1501 2 5 MET QG 2 56 VAL H 3.340 . 4.880 4.338 3.594 4.903 0.023 8 0 "[ . 1]" 1 1502 2 5 MET HG2 2 6 PRO QD 3.265 . 4.730 4.617 3.921 4.841 0.111 4 0 "[ . 1]" 1 1503 2 5 MET HG3 2 6 PRO QD 3.265 . 4.730 4.314 3.898 4.640 . 0 0 "[ . 1]" 1 1504 2 6 PRO HA 2 7 THR H 2.265 . 2.730 2.154 2.132 2.185 . 0 0 "[ . 1]" 1 1505 2 6 PRO HA 2 7 THR HA 3.435 . 5.070 4.365 4.344 4.384 . 0 0 "[ . 1]" 1 1506 2 6 PRO HA 2 7 THR HB 3.365 . 4.930 4.677 4.557 4.782 . 0 0 "[ . 1]" 1 1507 2 6 PRO HB2 2 7 THR H 3.015 . 4.230 3.584 3.274 3.991 . 0 0 "[ . 1]" 1 1508 2 6 PRO HB2 2 7 THR HA 3.290 . 4.780 4.495 4.395 4.559 . 0 0 "[ . 1]" 1 1509 2 6 PRO HB2 2 8 PHE QE 3.010 . 4.220 2.941 2.540 3.331 . 0 0 "[ . 1]" 1 1510 2 6 PRO HB2 2 8 PHE HZ 3.300 . 4.800 4.110 3.788 4.864 0.064 10 0 "[ . 1]" 1 1511 2 6 PRO HB2 2 56 VAL H 3.305 . 4.810 3.972 2.543 4.849 0.039 3 0 "[ . 1]" 1 1512 2 6 PRO HB2 2 56 VAL HB 3.160 . 4.520 3.233 1.797 4.544 0.024 9 0 "[ . 1]" 1 1513 2 6 PRO HB2 2 56 VAL QG 2.960 . 4.120 3.288 2.464 3.762 . 0 0 "[ . 1]" 1 1514 2 6 PRO HB3 2 7 THR H 2.945 . 4.090 3.657 3.302 3.861 . 0 0 "[ . 1]" 1 1515 2 6 PRO HB3 2 8 PHE QE 3.380 . 4.960 4.222 3.190 4.863 . 0 0 "[ . 1]" 1 1516 2 6 PRO HB3 2 8 PHE HZ 3.595 . 5.390 4.832 3.872 5.368 . 0 0 "[ . 1]" 1 1517 2 6 PRO HB3 2 56 VAL QG 3.345 . 4.890 4.127 3.466 4.490 . 0 0 "[ . 1]" 1 1518 2 6 PRO QD 2 56 VAL H 2.960 . 4.120 3.746 3.010 4.154 0.034 7 0 "[ . 1]" 1 1519 2 6 PRO QD 2 56 VAL HB 2.910 . 4.020 3.038 1.977 4.098 0.078 3 0 "[ . 1]" 1 1520 2 6 PRO QD 2 56 VAL MG1 3.265 . 4.730 2.522 1.780 2.867 0.020 9 0 "[ . 1]" 1 1521 2 6 PRO QD 2 56 VAL QG 2.955 . 4.110 2.492 1.777 2.830 0.023 9 0 "[ . 1]" 1 1522 2 6 PRO QD 2 56 VAL MG2 3.265 . 4.730 4.106 3.618 4.387 . 0 0 "[ . 1]" 1 1523 2 6 PRO QG 2 7 THR H 3.285 . 4.770 4.645 4.548 4.779 0.009 9 0 "[ . 1]" 1 1524 2 7 THR H 2 7 THR HB 2.545 . 3.290 2.709 2.620 2.784 . 0 0 "[ . 1]" 1 1525 2 7 THR H 2 7 THR MG 2.870 . 3.940 3.870 3.840 3.890 . 0 0 "[ . 1]" 1 1526 2 7 THR H 2 8 PHE H 3.225 . 4.650 4.418 4.376 4.487 . 0 0 "[ . 1]" 1 1527 2 7 THR H 2 8 PHE QD 3.395 . 4.990 4.814 4.645 5.001 0.011 9 0 "[ . 1]" 1 1528 2 7 THR H 2 55 PHE HA 3.640 . 5.480 5.065 4.844 5.412 . 0 0 "[ . 1]" 1 1529 2 7 THR HA 2 7 THR MG 2.510 . 3.220 2.306 2.275 2.333 . 0 0 "[ . 1]" 1 1530 2 7 THR HA 2 8 PHE H 2.375 . 2.950 2.177 2.142 2.243 . 0 0 "[ . 1]" 1 1531 2 7 THR HA 2 55 PHE HA 2.665 . 3.530 2.544 2.401 2.714 . 0 0 "[ . 1]" 1 1532 2 7 THR HA 2 55 PHE HB3 3.210 . 4.620 4.530 4.369 4.661 0.041 7 0 "[ . 1]" 1 1533 2 7 THR HA 2 55 PHE QD 3.045 . 4.290 3.787 3.519 4.033 . 0 0 "[ . 1]" 1 1534 2 7 THR HA 2 56 VAL H 2.925 . 4.050 3.746 3.588 4.001 . 0 0 "[ . 1]" 1 1535 2 7 THR HB 2 8 PHE H 2.940 . 4.080 3.947 3.786 4.006 . 0 0 "[ . 1]" 1 1536 2 7 THR HB 2 8 PHE QD 3.650 . 5.500 5.571 5.553 5.598 0.098 2 0 "[ . 1]" 1 1537 2 7 THR HB 2 53 THR MG 2.995 . 4.190 4.223 4.197 4.260 0.070 10 0 "[ . 1]" 1 1538 2 7 THR HB 2 55 PHE HA 3.650 . 5.500 5.380 5.247 5.534 0.034 3 0 "[ . 1]" 1 1539 2 7 THR HB 2 55 PHE HZ 3.650 . 5.500 5.507 5.426 5.536 0.036 2 0 "[ . 1]" 1 1540 2 7 THR MG 2 8 PHE H 2.605 . 3.410 2.494 2.242 2.621 . 0 0 "[ . 1]" 1 1541 2 7 THR MG 2 8 PHE HA 3.220 . 4.640 3.771 3.701 3.849 . 0 0 "[ . 1]" 1 1542 2 7 THR MG 2 9 TYR HA 3.270 . 4.740 4.414 4.323 4.480 . 0 0 "[ . 1]" 1 1543 2 7 THR MG 2 9 TYR QE 3.550 . 5.300 5.273 4.913 5.362 0.062 2 0 "[ . 1]" 1 1544 2 7 THR MG 2 53 THR HA 3.030 . 4.260 3.902 3.770 3.991 . 0 0 "[ . 1]" 1 1545 2 7 THR MG 2 53 THR MG 2.245 . 2.690 2.000 1.941 2.046 . 0 0 "[ . 1]" 1 1546 2 7 THR MG 2 54 ILE H 2.805 . 3.810 3.609 3.416 3.814 0.004 10 0 "[ . 1]" 1 1547 2 7 THR MG 2 55 PHE HA 2.905 . 4.010 3.435 3.096 3.772 . 0 0 "[ . 1]" 1 1548 2 7 THR MG 2 55 PHE HB2 3.415 . 5.030 4.848 4.638 5.066 0.036 10 0 "[ . 1]" 1 1549 2 7 THR MG 2 55 PHE HB3 3.335 . 4.870 4.581 4.354 4.825 . 0 0 "[ . 1]" 1 1550 2 7 THR MG 2 55 PHE QD 2.730 . 3.660 3.256 3.149 3.364 . 0 0 "[ . 1]" 1 1551 2 7 THR MG 2 55 PHE HZ 2.745 . 3.690 3.001 2.893 3.087 . 0 0 "[ . 1]" 1 1552 2 7 THR MG 2 56 VAL H 3.635 . 5.470 5.077 4.745 5.372 . 0 0 "[ . 1]" 1 1553 2 8 PHE H 2 8 PHE HB2 2.685 . 3.570 2.594 2.558 2.619 . 0 0 "[ . 1]" 1 1554 2 8 PHE H 2 8 PHE HB3 2.870 . 3.940 3.741 3.718 3.756 . 0 0 "[ . 1]" 1 1555 2 8 PHE H 2 8 PHE QD 2.750 . 3.700 2.599 2.439 2.727 . 0 0 "[ . 1]" 1 1556 2 8 PHE H 2 9 TYR H 3.205 . 4.610 4.448 4.412 4.478 . 0 0 "[ . 1]" 1 1557 2 8 PHE H 2 53 THR MG 3.005 . 4.210 3.597 3.417 3.732 . 0 0 "[ . 1]" 1 1558 2 8 PHE H 2 54 ILE H 2.695 . 3.590 3.016 2.909 3.097 . 0 0 "[ . 1]" 1 1559 2 8 PHE H 2 54 ILE HB 2.905 . 4.010 3.454 3.370 3.515 . 0 0 "[ . 1]" 1 1560 2 8 PHE H 2 54 ILE MG 3.245 . 4.690 4.137 4.061 4.227 . 0 0 "[ . 1]" 1 1561 2 8 PHE H 2 55 PHE H 3.485 . 5.170 4.799 4.717 4.887 . 0 0 "[ . 1]" 1 1562 2 8 PHE H 2 55 PHE HA 3.165 . 4.530 3.513 3.397 3.622 . 0 0 "[ . 1]" 1 1563 2 8 PHE HA 2 8 PHE QD 2.630 . 3.460 3.081 3.022 3.130 . 0 0 "[ . 1]" 1 1564 2 8 PHE HA 2 9 TYR H 2.325 . 2.850 2.255 2.217 2.297 . 0 0 "[ . 1]" 1 1565 2 8 PHE HA 2 9 TYR HA 3.355 . 4.910 4.425 4.413 4.442 . 0 0 "[ . 1]" 1 1566 2 8 PHE HA 2 9 TYR HB2 3.265 . 4.730 4.193 4.119 4.228 . 0 0 "[ . 1]" 1 1567 2 8 PHE HA 2 54 ILE HB 3.490 . 5.180 4.950 4.899 5.006 . 0 0 "[ . 1]" 1 1568 2 8 PHE HB2 2 9 TYR H 3.020 . 4.240 3.998 3.902 4.064 . 0 0 "[ . 1]" 1 1569 2 8 PHE HB2 2 10 LEU MD2 2.950 . 4.100 4.129 4.115 4.147 0.047 2 0 "[ . 1]" 1 1570 2 8 PHE HB2 2 32 LEU HB2 3.160 . 4.520 4.347 4.219 4.457 . 0 0 "[ . 1]" 1 1571 2 8 PHE HB2 2 32 LEU HB3 3.130 . 4.460 4.483 4.426 4.505 0.045 1 0 "[ . 1]" 1 1572 2 8 PHE HB2 2 32 LEU MD1 3.290 . 4.780 4.397 4.241 4.557 . 0 0 "[ . 1]" 1 1573 2 8 PHE HB2 2 32 LEU MD2 2.925 . 4.050 2.508 2.404 2.609 . 0 0 "[ . 1]" 1 1574 2 8 PHE HB2 2 53 THR HA 3.450 . 5.100 4.946 4.885 5.010 . 0 0 "[ . 1]" 1 1575 2 8 PHE HB2 2 54 ILE H 3.055 . 4.310 3.138 3.079 3.190 . 0 0 "[ . 1]" 1 1576 2 8 PHE HB2 2 54 ILE HB 2.650 . 3.500 2.067 2.029 2.117 . 0 0 "[ . 1]" 1 1577 2 8 PHE HB2 2 54 ILE MD 2.985 . 4.170 3.610 3.502 3.683 . 0 0 "[ . 1]" 1 1578 2 8 PHE HB2 2 54 ILE HG12 3.400 . 5.000 4.972 4.934 5.017 0.017 10 0 "[ . 1]" 1 1579 2 8 PHE HB2 2 54 ILE HG13 3.190 . 4.580 3.869 3.833 3.901 . 0 0 "[ . 1]" 1 1580 2 8 PHE HB2 2 54 ILE MG 2.955 . 4.110 3.461 3.392 3.522 . 0 0 "[ . 1]" 1 1581 2 8 PHE HB3 2 9 TYR H 2.955 . 4.110 2.962 2.818 3.033 . 0 0 "[ . 1]" 1 1582 2 8 PHE HB3 2 10 LEU MD1 3.650 . 5.500 5.506 5.439 5.537 0.037 1 0 "[ . 1]" 1 1583 2 8 PHE HB3 2 10 LEU MD2 2.875 . 3.950 3.584 3.479 3.684 . 0 0 "[ . 1]" 1 1584 2 8 PHE HB3 2 10 LEU HG 3.115 . 4.430 4.280 4.200 4.303 . 0 0 "[ . 1]" 1 1585 2 8 PHE HB3 2 32 LEU HB2 3.215 . 4.630 4.198 4.032 4.326 . 0 0 "[ . 1]" 1 1586 2 8 PHE HB3 2 32 LEU HB3 2.980 . 4.160 3.676 3.604 3.718 . 0 0 "[ . 1]" 1 1587 2 8 PHE HB3 2 32 LEU MD1 3.460 . 5.120 4.773 4.615 4.915 . 0 0 "[ . 1]" 1 1588 2 8 PHE HB3 2 32 LEU MD2 2.905 . 4.010 2.531 2.390 2.668 . 0 0 "[ . 1]" 1 1589 2 8 PHE HB3 2 53 THR HA 3.650 . 5.500 5.600 5.563 5.615 0.115 7 0 "[ . 1]" 1 1590 2 8 PHE HB3 2 54 ILE H 3.225 . 4.650 4.281 4.257 4.314 . 0 0 "[ . 1]" 1 1591 2 8 PHE HB3 2 54 ILE HB 2.765 . 3.730 3.601 3.540 3.663 . 0 0 "[ . 1]" 1 1592 2 8 PHE HB3 2 54 ILE MD 3.180 . 4.560 4.235 4.120 4.345 . 0 0 "[ . 1]" 1 1593 2 8 PHE HB3 2 54 ILE HG13 3.375 . 4.950 4.818 4.720 4.880 . 0 0 "[ . 1]" 1 1594 2 8 PHE HB3 2 54 ILE MG 3.350 . 4.900 4.758 4.698 4.825 . 0 0 "[ . 1]" 1 1595 2 8 PHE QD 2 9 TYR H 3.155 . 4.510 4.128 4.050 4.238 . 0 0 "[ . 1]" 1 1596 2 8 PHE QD 2 10 LEU MD2 3.255 . 4.710 4.632 4.462 4.717 0.007 1 0 "[ . 1]" 1 1597 2 8 PHE QD 2 32 LEU HB3 2.725 . 3.650 2.765 2.613 2.852 . 0 0 "[ . 1]" 1 1598 2 8 PHE QD 2 32 LEU MD2 2.830 . 3.860 3.053 2.945 3.113 . 0 0 "[ . 1]" 1 1599 2 8 PHE QD 2 54 ILE H 3.475 . 5.150 4.564 4.462 4.651 . 0 0 "[ . 1]" 1 1600 2 8 PHE QD 2 54 ILE HB 2.645 . 3.490 3.314 3.175 3.419 . 0 0 "[ . 1]" 1 1601 2 8 PHE QD 2 54 ILE MD 3.260 . 4.720 4.658 4.538 4.724 0.004 10 0 "[ . 1]" 1 1602 2 8 PHE QD 2 54 ILE HG13 3.650 . 5.500 5.474 5.384 5.522 0.022 5 0 "[ . 1]" 1 1603 2 8 PHE QD 2 54 ILE MG 2.670 . 3.540 3.265 3.074 3.414 . 0 0 "[ . 1]" 1 1604 2 8 PHE QE 2 30 PRO HB2 2.985 . 4.170 3.187 2.897 3.631 . 0 0 "[ . 1]" 1 1605 2 8 PHE QE 2 30 PRO HB3 3.650 . 5.500 4.608 4.393 5.074 . 0 0 "[ . 1]" 1 1606 2 8 PHE QE 2 30 PRO HG2 3.180 . 4.560 2.948 2.501 4.039 . 0 0 "[ . 1]" 1 1607 2 8 PHE QE 2 31 SER H 3.630 . 5.460 4.927 4.835 5.094 . 0 0 "[ . 1]" 1 1608 2 8 PHE QE 2 31 SER HA 2.890 . 3.980 2.841 2.784 2.934 . 0 0 "[ . 1]" 1 1609 2 8 PHE QE 2 31 SER HB2 3.650 . 5.500 5.091 4.911 5.570 0.070 1 0 "[ . 1]" 1 1610 2 8 PHE QE 2 31 SER HB3 3.650 . 5.500 5.474 4.809 5.592 0.092 3 0 "[ . 1]" 1 1611 2 8 PHE QE 2 32 LEU H 3.000 . 4.200 2.502 2.377 2.586 . 0 0 "[ . 1]" 1 1612 2 8 PHE QE 2 32 LEU HB2 2.915 . 4.030 3.200 3.104 3.273 . 0 0 "[ . 1]" 1 1613 2 8 PHE QE 2 32 LEU HB3 3.425 . 5.050 3.317 3.187 3.460 . 0 0 "[ . 1]" 1 1614 2 8 PHE QE 2 56 VAL H 3.205 . 4.610 4.115 3.909 4.400 . 0 0 "[ . 1]" 1 1615 2 8 PHE QE 2 56 VAL HB 2.950 . 4.100 3.361 3.007 3.604 . 0 0 "[ . 1]" 1 1616 2 8 PHE HZ 2 30 PRO HB2 3.210 . 4.620 3.153 2.877 3.558 . 0 0 "[ . 1]" 1 1617 2 8 PHE HZ 2 30 PRO HB3 3.650 . 5.500 4.771 4.557 5.182 . 0 0 "[ . 1]" 1 1618 2 8 PHE HZ 2 30 PRO HG2 3.230 . 4.660 3.230 2.566 4.658 . 0 0 "[ . 1]" 1 1619 2 8 PHE HZ 2 31 SER H 3.650 . 5.500 4.193 4.062 4.399 . 0 0 "[ . 1]" 1 1620 2 8 PHE HZ 2 31 SER HA 2.790 . 3.780 2.737 2.610 2.869 . 0 0 "[ . 1]" 1 1621 2 8 PHE HZ 2 31 SER HB2 3.650 . 5.500 5.002 4.813 5.515 0.015 1 0 "[ . 1]" 1 1622 2 8 PHE HZ 2 31 SER HB3 3.650 . 5.500 5.517 5.376 5.579 0.079 8 0 "[ . 1]" 1 1623 2 8 PHE HZ 2 32 LEU HB3 3.425 . 5.050 4.760 4.643 4.899 . 0 0 "[ . 1]" 1 1624 2 8 PHE HZ 2 56 VAL HB 3.650 . 5.500 5.368 4.908 5.542 0.042 8 0 "[ . 1]" 1 1625 2 9 TYR H 2 9 TYR HB2 2.605 . 3.410 2.859 2.711 2.936 . 0 0 "[ . 1]" 1 1626 2 9 TYR H 2 9 TYR HB3 2.640 . 3.480 2.933 2.875 3.027 . 0 0 "[ . 1]" 1 1627 2 9 TYR H 2 9 TYR QD 3.380 . 4.960 4.399 4.365 4.427 . 0 0 "[ . 1]" 1 1628 2 9 TYR H 2 10 LEU QB 3.330 . 4.860 4.720 4.660 4.779 . 0 0 "[ . 1]" 1 1629 2 9 TYR H 2 10 LEU MD2 3.330 . 4.860 4.821 4.695 4.866 0.006 1 0 "[ . 1]" 1 1630 2 9 TYR HA 2 9 TYR QD 2.560 . 3.320 2.986 2.759 3.078 . 0 0 "[ . 1]" 1 1631 2 9 TYR HA 2 9 TYR QE 3.385 . 4.970 4.550 4.432 4.611 . 0 0 "[ . 1]" 1 1632 2 9 TYR HA 2 10 LEU H 2.320 . 2.840 2.142 2.131 2.152 . 0 0 "[ . 1]" 1 1633 2 9 TYR HA 2 10 LEU HA 3.530 . 5.260 4.388 4.372 4.396 . 0 0 "[ . 1]" 1 1634 2 9 TYR HA 2 10 LEU QB 3.390 . 4.980 4.597 4.573 4.615 . 0 0 "[ . 1]" 1 1635 2 9 TYR HA 2 10 LEU MD1 3.275 . 4.750 4.447 4.409 4.539 . 0 0 "[ . 1]" 1 1636 2 9 TYR HA 2 10 LEU HG 2.950 . 4.100 3.531 3.464 3.571 . 0 0 "[ . 1]" 1 1637 2 9 TYR HA 2 53 THR H 3.490 . 5.180 4.990 4.954 5.051 . 0 0 "[ . 1]" 1 1638 2 9 TYR HA 2 53 THR HA 2.630 . 3.460 2.481 2.408 2.566 . 0 0 "[ . 1]" 1 1639 2 9 TYR HA 2 53 THR MG 2.970 . 4.140 3.412 3.258 3.579 . 0 0 "[ . 1]" 1 1640 2 9 TYR HA 2 54 ILE H 3.040 . 4.280 3.388 3.310 3.505 . 0 0 "[ . 1]" 1 1641 2 9 TYR HB2 2 10 LEU H 3.155 . 4.510 4.432 4.403 4.473 . 0 0 "[ . 1]" 1 1642 2 9 TYR HB2 2 53 THR MG 3.330 . 4.860 3.459 3.267 3.766 . 0 0 "[ . 1]" 1 1643 2 9 TYR HB3 2 10 LEU H 2.970 . 4.140 4.018 3.927 4.073 . 0 0 "[ . 1]" 1 1644 2 9 TYR HB3 2 10 LEU HA 3.300 . 4.800 4.404 4.295 4.489 . 0 0 "[ . 1]" 1 1645 2 9 TYR HB3 2 53 THR HA 3.650 . 5.500 5.196 5.123 5.305 . 0 0 "[ . 1]" 1 1646 2 9 TYR QD 2 10 LEU H 3.000 . 4.200 3.141 2.398 3.710 . 0 0 "[ . 1]" 1 1647 2 9 TYR QD 2 10 LEU HA 2.980 . 4.160 3.514 3.219 3.849 . 0 0 "[ . 1]" 1 1648 2 9 TYR QD 2 52 LEU H 3.400 . 5.000 4.178 3.431 4.813 . 0 0 "[ . 1]" 1 1649 2 9 TYR QD 2 53 THR HA 2.920 . 4.040 3.623 3.197 4.054 0.014 8 0 "[ . 1]" 1 1650 2 9 TYR QD 2 53 THR MG 2.600 . 3.400 2.500 2.100 2.957 . 0 0 "[ . 1]" 1 1651 2 9 TYR QD 2 54 ILE H 3.650 . 5.500 5.099 4.831 5.361 . 0 0 "[ . 1]" 1 1652 2 9 TYR QE 2 11 ALA MB 3.255 . 4.710 3.913 3.568 4.345 . 0 0 "[ . 1]" 1 1653 2 9 TYR QE 2 51 PRO HB2 2.885 . 3.970 2.734 2.026 3.076 . 0 0 "[ . 1]" 1 1654 2 9 TYR QE 2 51 PRO HB3 2.965 . 4.130 2.613 2.380 2.916 . 0 0 "[ . 1]" 1 1655 2 9 TYR QE 2 51 PRO HG2 3.230 . 4.660 4.665 4.306 4.857 0.197 2 0 "[ . 1]" 1 1656 2 9 TYR QE 2 53 THR MG 2.685 . 3.570 3.569 3.468 3.624 0.054 2 0 "[ . 1]" 1 1657 2 10 LEU H 2 10 LEU QB 2.800 . 3.800 3.245 3.235 3.252 . 0 0 "[ . 1]" 1 1658 2 10 LEU H 2 10 LEU MD1 2.875 . 3.950 2.814 2.775 2.893 . 0 0 "[ . 1]" 1 1659 2 10 LEU H 2 10 LEU MD2 2.905 . 4.010 3.912 3.892 3.936 . 0 0 "[ . 1]" 1 1660 2 10 LEU H 2 10 LEU HG 2.430 . 3.060 2.283 2.256 2.308 . 0 0 "[ . 1]" 1 1661 2 10 LEU H 2 52 LEU H 2.600 . 3.400 3.073 2.976 3.171 . 0 0 "[ . 1]" 1 1662 2 10 LEU H 2 52 LEU HB2 3.255 . 4.710 3.743 3.606 3.856 . 0 0 "[ . 1]" 1 1663 2 10 LEU H 2 52 LEU QD 3.310 . 4.820 4.566 4.483 4.633 . 0 0 "[ . 1]" 1 1664 2 10 LEU H 2 53 THR HA 2.920 . 4.040 3.634 3.533 3.710 . 0 0 "[ . 1]" 1 1665 2 10 LEU H 2 54 ILE H 3.400 . 5.000 4.535 4.440 4.621 . 0 0 "[ . 1]" 1 1666 2 10 LEU H 2 54 ILE MD 3.650 . 5.500 5.136 5.036 5.253 . 0 0 "[ . 1]" 1 1667 2 10 LEU HA 2 10 LEU QB 2.365 . 2.930 2.153 2.151 2.156 . 0 0 "[ . 1]" 1 1668 2 10 LEU HA 2 10 LEU MD1 2.800 . 3.800 3.689 3.678 3.699 . 0 0 "[ . 1]" 1 1669 2 10 LEU HA 2 10 LEU MD2 2.900 . 4.000 4.021 4.011 4.028 0.028 1 0 "[ . 1]" 1 1670 2 10 LEU HA 2 10 LEU HG 2.950 . 4.100 3.611 3.593 3.627 . 0 0 "[ . 1]" 1 1671 2 10 LEU HA 2 11 ALA H 2.425 . 3.050 2.348 2.330 2.364 . 0 0 "[ . 1]" 1 1672 2 10 LEU HA 2 11 ALA MB 2.915 . 4.030 3.925 3.896 3.938 . 0 0 "[ . 1]" 1 1673 2 10 LEU HA 2 12 LEU MD2 3.425 . 5.050 4.953 4.907 5.024 . 0 0 "[ . 1]" 1 1674 2 10 LEU QB 2 10 LEU MD1 2.415 . 3.030 2.217 2.206 2.232 . 0 0 "[ . 1]" 1 1675 2 10 LEU QB 2 10 LEU MD2 2.475 . 3.150 2.075 2.071 2.079 . 0 0 "[ . 1]" 1 1676 2 10 LEU QB 2 11 ALA H 2.655 . 3.510 2.540 2.513 2.562 . 0 0 "[ . 1]" 1 1677 2 10 LEU QB 2 11 ALA HA 3.030 . 4.260 4.217 4.191 4.252 . 0 0 "[ . 1]" 1 1678 2 10 LEU QB 2 11 ALA MB 3.065 . 4.330 4.339 4.323 4.350 0.020 3 0 "[ . 1]" 1 1679 2 10 LEU QB 2 12 LEU MD2 2.680 . 3.560 2.901 2.849 2.953 . 0 0 "[ . 1]" 1 1680 2 10 LEU QB 2 12 LEU HG 3.005 . 4.210 3.719 3.581 3.811 . 0 0 "[ . 1]" 1 1681 2 10 LEU QB 2 32 LEU MD2 2.885 . 3.970 3.943 3.846 3.993 0.023 7 0 "[ . 1]" 1 1682 2 10 LEU QB 2 34 VAL MG1 2.960 . 4.120 3.807 3.748 3.869 . 0 0 "[ . 1]" 1 1683 2 10 LEU QB 2 34 VAL QG 2.695 . 3.590 3.361 3.302 3.403 . 0 0 "[ . 1]" 1 1684 2 10 LEU QB 2 34 VAL MG2 2.960 . 4.120 3.741 3.650 3.820 . 0 0 "[ . 1]" 1 1685 2 10 LEU QB 2 52 LEU H 3.460 . 5.120 4.767 4.613 4.919 . 0 0 "[ . 1]" 1 1686 2 10 LEU QB 2 54 ILE MD 3.610 . 5.420 4.630 4.531 4.698 . 0 0 "[ . 1]" 1 1687 2 10 LEU MD1 2 11 ALA H 3.030 . 4.260 3.668 3.597 3.715 . 0 0 "[ . 1]" 1 1688 2 10 LEU MD1 2 12 LEU MD2 2.630 . 3.460 2.140 2.074 2.255 . 0 0 "[ . 1]" 1 1689 2 10 LEU MD1 2 34 VAL HB 3.195 . 4.590 4.569 4.478 4.607 0.017 8 0 "[ . 1]" 1 1690 2 10 LEU MD1 2 53 THR HA 3.390 . 4.980 4.810 4.701 4.988 0.008 9 0 "[ . 1]" 1 1691 2 10 LEU MD2 2 11 ALA H 3.380 . 4.960 4.724 4.703 4.754 . 0 0 "[ . 1]" 1 1692 2 10 LEU MD2 2 12 LEU MD2 2.775 . 3.750 3.012 2.956 3.104 . 0 0 "[ . 1]" 1 1693 2 10 LEU MD2 2 34 VAL H 3.140 . 4.480 4.529 4.507 4.560 0.080 5 0 "[ . 1]" 1 1694 2 10 LEU MD2 2 34 VAL HA 3.480 . 5.160 4.803 4.783 4.826 . 0 0 "[ . 1]" 1 1695 2 10 LEU MD2 2 34 VAL HB 2.870 . 3.940 2.817 2.743 2.879 . 0 0 "[ . 1]" 1 1696 2 10 LEU HG 2 12 LEU MD2 3.335 . 4.870 4.659 4.626 4.720 . 0 0 "[ . 1]" 1 1697 2 10 LEU HG 2 34 VAL QG 2.995 . 4.190 4.224 4.207 4.258 0.068 1 0 "[ . 1]" 1 1698 2 11 ALA H 2 11 ALA MB 2.625 . 3.450 2.481 2.457 2.502 . 0 0 "[ . 1]" 1 1699 2 11 ALA HA 2 12 LEU H 2.305 . 2.810 2.137 2.128 2.149 . 0 0 "[ . 1]" 1 1700 2 11 ALA HA 2 12 LEU HB2 3.440 . 5.080 4.557 4.538 4.594 . 0 0 "[ . 1]" 1 1701 2 11 ALA HA 2 12 LEU HB3 3.650 . 5.500 5.558 5.542 5.577 0.077 8 0 "[ . 1]" 1 1702 2 11 ALA HA 2 12 LEU MD2 3.395 . 4.990 4.154 4.101 4.213 . 0 0 "[ . 1]" 1 1703 2 11 ALA HA 2 12 LEU HG 3.425 . 5.050 3.527 3.475 3.598 . 0 0 "[ . 1]" 1 1704 2 11 ALA HA 2 49 LEU HB3 3.345 . 4.890 4.003 3.910 4.092 . 0 0 "[ . 1]" 1 1705 2 11 ALA HA 2 49 LEU MD1 3.130 . 4.460 4.582 4.525 4.665 0.205 6 0 "[ . 1]" 1 1706 2 11 ALA HA 2 51 PRO HB2 3.650 . 5.500 4.995 4.696 5.325 . 0 0 "[ . 1]" 1 1707 2 11 ALA HA 2 51 PRO HB3 3.330 . 4.860 4.309 3.969 4.663 . 0 0 "[ . 1]" 1 1708 2 11 ALA HA 2 52 LEU H 2.835 . 3.870 3.115 3.014 3.255 . 0 0 "[ . 1]" 1 1709 2 11 ALA HA 2 52 LEU HG 3.650 . 5.500 5.510 5.423 5.536 0.036 10 0 "[ . 1]" 1 1710 2 11 ALA MB 2 12 LEU H 2.780 . 3.760 3.018 2.987 3.047 . 0 0 "[ . 1]" 1 1711 2 11 ALA MB 2 49 LEU HA 3.205 . 4.610 3.915 3.802 4.041 . 0 0 "[ . 1]" 1 1712 2 11 ALA MB 2 49 LEU HB2 2.615 . 3.430 3.355 3.235 3.451 0.021 7 0 "[ . 1]" 1 1713 2 11 ALA MB 2 49 LEU MD1 2.450 . 3.100 2.176 2.086 2.296 . 0 0 "[ . 1]" 1 1714 2 11 ALA MB 2 49 LEU MD2 2.630 . 3.460 2.485 2.339 2.853 . 0 0 "[ . 1]" 1 1715 2 11 ALA MB 2 50 ILE H 3.230 . 4.660 4.060 3.933 4.235 . 0 0 "[ . 1]" 1 1716 2 11 ALA MB 2 51 PRO HA 2.690 . 3.580 2.863 2.692 3.074 . 0 0 "[ . 1]" 1 1717 2 11 ALA MB 2 51 PRO HB2 3.560 . 5.320 4.647 4.273 5.062 . 0 0 "[ . 1]" 1 1718 2 11 ALA MB 2 51 PRO HB3 2.980 . 4.160 3.491 3.042 3.952 . 0 0 "[ . 1]" 1 1719 2 11 ALA MB 2 51 PRO HG3 3.650 . 5.500 5.082 4.717 5.448 . 0 0 "[ . 1]" 1 1720 2 11 ALA MB 2 52 LEU H 3.140 . 4.480 4.105 4.018 4.210 . 0 0 "[ . 1]" 1 1721 2 11 ALA MB 2 52 LEU HB2 3.650 . 5.500 5.617 5.584 5.679 0.179 3 0 "[ . 1]" 1 1722 2 12 LEU H 2 12 LEU HB2 2.570 . 3.340 2.675 2.632 2.716 . 0 0 "[ . 1]" 1 1723 2 12 LEU H 2 12 LEU HB3 2.970 . 4.140 3.766 3.742 3.786 . 0 0 "[ . 1]" 1 1724 2 12 LEU H 2 12 LEU MD1 2.925 . 4.050 3.989 3.926 4.027 . 0 0 "[ . 1]" 1 1725 2 12 LEU H 2 12 LEU MD2 2.985 . 4.170 3.576 3.551 3.618 . 0 0 "[ . 1]" 1 1726 2 12 LEU H 2 12 LEU HG 2.485 . 3.170 2.784 2.743 2.811 . 0 0 "[ . 1]" 1 1727 2 12 LEU H 2 49 LEU HA 3.255 . 4.710 4.059 3.993 4.179 . 0 0 "[ . 1]" 1 1728 2 12 LEU H 2 49 LEU HB2 3.650 . 5.500 5.528 5.509 5.540 0.040 2 0 "[ . 1]" 1 1729 2 12 LEU H 2 49 LEU HB3 3.430 . 5.060 3.855 3.809 3.880 . 0 0 "[ . 1]" 1 1730 2 12 LEU H 2 49 LEU MD1 3.330 . 4.860 4.822 4.756 4.867 0.007 8 0 "[ . 1]" 1 1731 2 12 LEU H 2 50 ILE H 2.750 . 3.700 3.036 2.862 3.116 . 0 0 "[ . 1]" 1 1732 2 12 LEU H 2 50 ILE HB 2.860 . 3.920 3.638 3.547 3.754 . 0 0 "[ . 1]" 1 1733 2 12 LEU H 2 51 PRO HA 3.120 . 4.440 3.797 3.606 4.049 . 0 0 "[ . 1]" 1 1734 2 12 LEU H 2 52 LEU H 3.530 . 5.260 4.518 4.441 4.621 . 0 0 "[ . 1]" 1 1735 2 12 LEU H 2 52 LEU HB2 3.650 . 5.500 4.851 4.720 4.961 . 0 0 "[ . 1]" 1 1736 2 12 LEU H 2 52 LEU QD 2.900 . 4.000 2.684 2.618 2.767 . 0 0 "[ . 1]" 1 1737 2 12 LEU HA 2 12 LEU MD1 3.215 . 4.630 3.889 3.877 3.903 . 0 0 "[ . 1]" 1 1738 2 12 LEU HA 2 12 LEU MD2 2.425 . 3.050 2.136 2.114 2.159 . 0 0 "[ . 1]" 1 1739 2 12 LEU HA 2 18 TYR QE 2.965 . 4.130 3.225 3.151 3.294 . 0 0 "[ . 1]" 1 1740 2 12 LEU HA 2 49 LEU MD2 3.035 . 4.270 2.943 2.841 3.194 . 0 0 "[ . 1]" 1 1741 2 12 LEU HA 2 52 LEU QD 3.350 . 4.900 4.343 4.289 4.417 . 0 0 "[ . 1]" 1 1742 2 12 LEU HB2 2 12 LEU MD1 2.605 . 3.410 2.320 2.309 2.340 . 0 0 "[ . 1]" 1 1743 2 12 LEU HB2 2 12 LEU MD2 2.835 . 3.870 3.202 3.200 3.205 . 0 0 "[ . 1]" 1 1744 2 12 LEU HB2 2 13 HIS H 3.265 . 4.730 3.927 3.852 3.949 . 0 0 "[ . 1]" 1 1745 2 12 LEU HB2 2 18 TYR QE 3.100 . 4.400 3.900 3.815 4.057 . 0 0 "[ . 1]" 1 1746 2 12 LEU HB2 2 50 ILE HB 3.095 . 4.390 3.646 3.507 3.825 . 0 0 "[ . 1]" 1 1747 2 12 LEU HB2 2 52 LEU QD 2.840 . 3.880 2.529 2.452 2.599 . 0 0 "[ . 1]" 1 1748 2 12 LEU HB3 2 12 LEU MD1 2.520 . 3.240 2.366 2.357 2.384 . 0 0 "[ . 1]" 1 1749 2 12 LEU HB3 2 12 LEU MD2 2.640 . 3.480 2.386 2.371 2.396 . 0 0 "[ . 1]" 1 1750 2 12 LEU HB3 2 13 HIS H 2.795 . 3.790 3.006 2.903 3.044 . 0 0 "[ . 1]" 1 1751 2 12 LEU HB3 2 13 HIS QB 3.430 . 5.060 4.688 4.596 4.767 . 0 0 "[ . 1]" 1 1752 2 12 LEU HB3 2 18 TYR QB 3.250 . 4.700 4.654 4.565 4.715 0.015 10 0 "[ . 1]" 1 1753 2 12 LEU HB3 2 18 TYR QD 2.995 . 4.190 3.208 3.128 3.276 . 0 0 "[ . 1]" 1 1754 2 12 LEU HB3 2 18 TYR QE 2.930 . 4.060 2.311 2.237 2.467 . 0 0 "[ . 1]" 1 1755 2 12 LEU HB3 2 52 LEU QD 3.045 . 4.290 3.720 3.665 3.769 . 0 0 "[ . 1]" 1 1756 2 12 LEU MD1 2 18 TYR QB 3.025 . 4.250 3.338 3.206 3.501 . 0 0 "[ . 1]" 1 1757 2 12 LEU MD1 2 18 TYR QD 2.900 . 4.000 3.022 2.894 3.137 . 0 0 "[ . 1]" 1 1758 2 12 LEU MD1 2 18 TYR QE 3.140 . 4.480 3.764 3.671 3.923 . 0 0 "[ . 1]" 1 1759 2 12 LEU MD1 2 50 ILE HB 3.330 . 4.860 4.776 4.630 4.865 0.005 10 0 "[ . 1]" 1 1760 2 12 LEU MD1 2 52 LEU HB2 3.250 . 4.700 3.592 3.470 3.665 . 0 0 "[ . 1]" 1 1761 2 12 LEU MD1 2 52 LEU QD 2.220 . 2.640 1.996 1.928 2.031 . 0 0 "[ . 1]" 1 1762 2 12 LEU MD1 2 52 LEU HG 3.100 . 4.400 4.386 4.279 4.422 0.022 2 0 "[ . 1]" 1 1763 2 12 LEU MD2 2 13 HIS H 3.200 . 4.600 3.745 3.717 3.791 . 0 0 "[ . 1]" 1 1764 2 12 LEU MD2 2 18 TYR QB 3.175 . 4.550 3.131 3.065 3.198 . 0 0 "[ . 1]" 1 1765 2 12 LEU MD2 2 18 TYR QD 2.915 . 4.030 2.903 2.849 2.955 . 0 0 "[ . 1]" 1 1766 2 12 LEU MD2 2 18 TYR QE 2.750 . 3.700 2.972 2.943 3.028 . 0 0 "[ . 1]" 1 1767 2 12 LEU MD2 2 34 VAL HB 3.235 . 4.670 3.834 3.739 3.923 . 0 0 "[ . 1]" 1 1768 2 12 LEU MD2 2 34 VAL QG 2.425 . 3.050 2.058 2.009 2.098 . 0 0 "[ . 1]" 1 1769 2 12 LEU MD2 2 52 LEU QD 2.705 . 3.610 3.453 3.393 3.519 . 0 0 "[ . 1]" 1 1770 2 12 LEU HG 2 52 LEU QD 2.610 . 3.420 2.094 2.004 2.199 . 0 0 "[ . 1]" 1 1771 2 13 HIS H 2 13 HIS QB 2.575 . 3.350 2.362 2.303 2.443 . 0 0 "[ . 1]" 1 1772 2 13 HIS H 2 16 GLN QB 3.150 . 4.500 3.284 3.102 3.513 . 0 0 "[ . 1]" 1 1773 2 13 HIS H 2 18 TYR QE 2.985 . 4.170 2.466 2.278 2.611 . 0 0 "[ . 1]" 1 1774 2 13 HIS H 2 49 LEU HA 3.220 . 4.640 4.344 4.211 4.488 . 0 0 "[ . 1]" 1 1775 2 13 HIS H 2 49 LEU MD2 3.250 . 4.700 2.866 2.732 3.160 . 0 0 "[ . 1]" 1 1776 2 13 HIS HA 2 14 GLY H 2.505 . 3.210 2.153 2.142 2.169 . 0 0 "[ . 1]" 1 1777 2 13 HIS HA 2 14 GLY HA2 3.065 . 4.330 4.332 4.316 4.347 0.017 10 0 "[ . 1]" 1 1778 2 13 HIS HA 2 14 GLY HA3 3.220 . 4.640 4.377 4.360 4.392 . 0 0 "[ . 1]" 1 1779 2 13 HIS HA 2 49 LEU HA 2.630 . 3.460 2.495 2.390 2.587 . 0 0 "[ . 1]" 1 1780 2 13 HIS HA 2 49 LEU HB3 3.295 . 4.790 4.818 4.797 4.849 0.059 5 0 "[ . 1]" 1 1781 2 13 HIS HA 2 49 LEU MD1 3.465 . 5.130 5.063 4.964 5.144 0.014 7 0 "[ . 1]" 1 1782 2 13 HIS HA 2 49 LEU MD2 2.825 . 3.850 2.336 2.257 2.463 . 0 0 "[ . 1]" 1 1783 2 13 HIS HA 2 49 LEU HG 3.185 . 4.570 4.179 3.930 4.515 . 0 0 "[ . 1]" 1 1784 2 13 HIS HA 2 50 ILE H 2.995 . 4.190 3.489 3.300 3.668 . 0 0 "[ . 1]" 1 1785 2 13 HIS QB 2 14 GLY H 2.945 . 4.090 3.144 3.080 3.205 . 0 0 "[ . 1]" 1 1786 2 13 HIS QB 2 16 GLN H 3.530 . 5.260 3.571 3.365 3.828 . 0 0 "[ . 1]" 1 1787 2 13 HIS QB 2 16 GLN QB 2.730 . 3.660 2.125 1.768 2.397 0.032 9 0 "[ . 1]" 1 1788 2 13 HIS QB 2 16 GLN HB3 3.410 . 5.020 3.191 2.740 3.486 . 0 0 "[ . 1]" 1 1789 2 13 HIS QB 2 16 GLN QE 3.090 . 4.380 3.951 3.275 4.516 0.136 10 0 "[ . 1]" 1 1790 2 13 HIS QB 2 16 GLN QG 2.560 . 3.320 2.034 1.766 2.371 0.034 6 0 "[ . 1]" 1 1791 2 13 HIS QB 2 18 TYR QE 2.870 . 3.940 3.269 3.077 3.426 . 0 0 "[ . 1]" 1 1792 2 13 HIS QB 2 47 THR MG 3.045 . 4.290 3.359 3.034 3.868 . 0 0 "[ . 1]" 1 1793 2 13 HIS HB2 2 14 GLY H 3.355 . 4.910 4.242 4.162 4.312 . 0 0 "[ . 1]" 1 1794 2 13 HIS HB2 2 16 GLN HG2 3.095 . 4.390 2.877 2.369 3.516 . 0 0 "[ . 1]" 1 1795 2 13 HIS HB2 2 16 GLN HG3 3.095 . 4.390 2.209 1.867 2.456 . 0 0 "[ . 1]" 1 1796 2 13 HIS HB3 2 14 GLY H 3.355 . 4.910 3.240 3.167 3.305 . 0 0 "[ . 1]" 1 1797 2 13 HIS HB3 2 16 GLN HB2 3.085 . 4.370 3.332 2.713 3.799 . 0 0 "[ . 1]" 1 1798 2 13 HIS HB3 2 16 GLN HG2 3.095 . 4.390 3.026 2.470 4.378 . 0 0 "[ . 1]" 1 1799 2 13 HIS HB3 2 16 GLN HG3 3.095 . 4.390 3.002 2.393 3.686 . 0 0 "[ . 1]" 1 1800 2 13 HIS HE1 2 49 LEU MD2 3.560 . 5.320 3.256 3.038 3.707 . 0 0 "[ . 1]" 1 1801 2 14 GLY H 2 15 GLY H 3.180 . 4.560 4.394 4.293 4.454 . 0 0 "[ . 1]" 1 1802 2 14 GLY H 2 47 THR HB 2.955 . 4.110 2.947 2.732 3.146 . 0 0 "[ . 1]" 1 1803 2 14 GLY H 2 47 THR MG 3.265 . 4.730 4.105 3.990 4.313 . 0 0 "[ . 1]" 1 1804 2 14 GLY H 2 49 LEU HA 3.250 . 4.700 3.583 3.452 3.684 . 0 0 "[ . 1]" 1 1805 2 14 GLY H 2 50 ILE MD 3.020 . 4.240 3.982 3.733 4.249 0.009 10 0 "[ . 1]" 1 1806 2 14 GLY H 2 50 ILE HG13 3.220 . 4.640 3.637 3.369 3.882 . 0 0 "[ . 1]" 1 1807 2 14 GLY HA2 2 15 GLY HA2 3.100 . 4.400 4.327 4.310 4.350 . 0 0 "[ . 1]" 1 1808 2 14 GLY HA2 2 16 GLN H 3.045 . 4.290 3.630 3.515 3.711 . 0 0 "[ . 1]" 1 1809 2 14 GLY HA2 2 47 THR MG 3.650 . 5.500 5.115 4.841 5.527 0.027 6 0 "[ . 1]" 1 1810 2 14 GLY HA2 2 50 ILE MD 2.640 . 3.480 2.837 2.539 3.212 . 0 0 "[ . 1]" 1 1811 2 14 GLY HA2 2 50 ILE HG13 3.305 . 4.810 3.970 3.713 4.212 . 0 0 "[ . 1]" 1 1812 2 14 GLY HA3 2 16 GLN H 3.565 . 5.330 4.629 4.473 4.779 . 0 0 "[ . 1]" 1 1813 2 14 GLY HA3 2 50 ILE MD 2.690 . 3.580 3.113 2.738 3.452 . 0 0 "[ . 1]" 1 1814 2 14 GLY HA3 2 50 ILE HG13 3.285 . 4.770 3.798 3.440 4.044 . 0 0 "[ . 1]" 1 1815 2 15 GLY H 2 16 GLN H 2.745 . 3.690 2.296 2.106 2.429 . 0 0 "[ . 1]" 1 1816 2 15 GLY H 2 16 GLN QB 3.570 . 5.340 4.334 4.181 4.566 . 0 0 "[ . 1]" 1 1817 2 15 GLY HA3 2 16 GLN QB 3.450 . 5.100 5.010 4.691 5.177 0.077 1 0 "[ . 1]" 1 1818 2 16 GLN H 2 16 GLN QB 2.440 . 3.080 2.323 2.115 2.536 . 0 0 "[ . 1]" 1 1819 2 16 GLN H 2 16 GLN HB3 2.910 . 4.020 3.489 3.094 3.724 . 0 0 "[ . 1]" 1 1820 2 16 GLN H 2 16 GLN QG 2.705 . 3.610 3.056 2.633 3.678 0.068 9 0 "[ . 1]" 1 1821 2 16 GLN H 2 17 THR H 3.345 . 4.890 4.551 4.513 4.585 . 0 0 "[ . 1]" 1 1822 2 16 GLN HA 2 16 GLN HG2 3.000 . 4.200 2.817 2.231 3.203 . 0 0 "[ . 1]" 1 1823 2 16 GLN HA 2 16 GLN QG 2.615 . 3.430 2.716 2.208 3.025 . 0 0 "[ . 1]" 1 1824 2 16 GLN HA 2 16 GLN HG3 3.000 . 4.200 3.656 3.523 3.803 . 0 0 "[ . 1]" 1 1825 2 16 GLN QB 2 17 THR H 2.870 . 3.940 2.794 2.510 3.223 . 0 0 "[ . 1]" 1 1826 2 16 GLN QB 2 18 TYR QE 2.695 . 3.590 2.281 2.052 2.470 . 0 0 "[ . 1]" 1 1827 2 16 GLN QB 2 36 PRO HA 3.515 . 5.230 4.715 4.204 4.972 . 0 0 "[ . 1]" 1 1828 2 16 GLN HB2 2 17 THR H 3.365 . 4.930 3.978 3.698 4.288 . 0 0 "[ . 1]" 1 1829 2 16 GLN HB3 2 18 TYR QE 2.950 . 4.100 3.051 2.102 3.738 . 0 0 "[ . 1]" 1 1830 2 16 GLN QG 2 17 THR H 3.180 . 4.560 4.055 3.412 4.437 . 0 0 "[ . 1]" 1 1831 2 16 GLN HG2 2 18 TYR QE 3.375 . 4.950 4.698 4.474 4.957 0.007 5 0 "[ . 1]" 1 1832 2 16 GLN HG3 2 18 TYR QE 3.375 . 4.950 4.232 3.659 4.553 . 0 0 "[ . 1]" 1 1833 2 17 THR H 2 17 THR HB 2.745 . 3.690 2.667 2.614 2.752 . 0 0 "[ . 1]" 1 1834 2 17 THR H 2 17 THR MG 3.175 . 4.550 3.814 3.782 3.836 . 0 0 "[ . 1]" 1 1835 2 17 THR HA 2 17 THR MG 2.520 . 3.240 2.295 2.257 2.334 . 0 0 "[ . 1]" 1 1836 2 17 THR HA 2 18 TYR H 2.475 . 3.150 2.154 2.147 2.165 . 0 0 "[ . 1]" 1 1837 2 17 THR HA 2 18 TYR QB 3.125 . 4.450 4.225 4.184 4.244 . 0 0 "[ . 1]" 1 1838 2 17 THR HA 2 18 TYR QD 3.055 . 4.310 3.586 3.537 3.651 . 0 0 "[ . 1]" 1 1839 2 17 THR HB 2 18 TYR H 3.325 . 4.850 3.924 3.874 4.021 . 0 0 "[ . 1]" 1 1840 2 17 THR HB 2 37 SER H 3.195 . 4.590 3.644 3.455 3.944 . 0 0 "[ . 1]" 1 1841 2 17 THR HB 2 37 SER HA 3.165 . 4.530 4.615 4.549 4.652 0.122 1 0 "[ . 1]" 1 1842 2 17 THR HB 2 37 SER QB 2.725 . 3.650 1.991 1.801 2.365 . 0 0 "[ . 1]" 1 1843 2 17 THR MG 2 18 TYR H 2.645 . 3.490 2.493 2.432 2.565 . 0 0 "[ . 1]" 1 1844 2 17 THR MG 2 18 TYR HA 3.010 . 4.220 3.789 3.663 3.937 . 0 0 "[ . 1]" 1 1845 2 17 THR MG 2 18 TYR QB 3.180 . 4.560 4.356 4.273 4.418 . 0 0 "[ . 1]" 1 1846 2 17 THR MG 2 18 TYR QD 3.445 . 5.090 4.747 4.679 4.825 . 0 0 "[ . 1]" 1 1847 2 17 THR MG 2 19 HIS H 3.540 . 5.280 4.784 4.658 4.969 . 0 0 "[ . 1]" 1 1848 2 17 THR MG 2 37 SER HA 3.490 . 5.180 4.774 4.570 4.952 . 0 0 "[ . 1]" 1 1849 2 17 THR MG 2 37 SER QB 2.495 . 3.190 2.909 2.331 3.242 0.052 1 0 "[ . 1]" 1 1850 2 18 TYR H 2 18 TYR QB 2.620 . 3.440 2.547 2.510 2.570 . 0 0 "[ . 1]" 1 1851 2 18 TYR H 2 18 TYR QD 2.910 . 4.020 3.080 2.994 3.161 . 0 0 "[ . 1]" 1 1852 2 18 TYR HA 2 18 TYR QD 2.795 . 3.790 2.915 2.850 2.951 . 0 0 "[ . 1]" 1 1853 2 18 TYR HA 2 18 TYR QE 3.290 . 4.780 4.584 4.527 4.619 . 0 0 "[ . 1]" 1 1854 2 18 TYR HA 2 19 HIS H 2.410 . 3.020 2.235 2.216 2.247 . 0 0 "[ . 1]" 1 1855 2 18 TYR HA 2 19 HIS HA 3.250 . 4.700 4.377 4.362 4.386 . 0 0 "[ . 1]" 1 1856 2 18 TYR HA 2 19 HIS HB2 3.040 . 4.280 4.250 4.227 4.285 0.005 8 0 "[ . 1]" 1 1857 2 18 TYR HA 2 19 HIS HB3 3.650 . 5.500 5.595 5.578 5.620 0.120 8 0 "[ . 1]" 1 1858 2 18 TYR HA 2 34 VAL QG 2.990 . 4.180 3.852 3.802 3.916 . 0 0 "[ . 1]" 1 1859 2 18 TYR HA 2 35 ILE H 3.160 . 4.520 4.291 4.179 4.392 . 0 0 "[ . 1]" 1 1860 2 18 TYR HA 2 36 PRO HA 2.585 . 3.370 2.565 2.398 2.763 . 0 0 "[ . 1]" 1 1861 2 18 TYR HA 2 36 PRO HB2 3.650 . 5.500 5.194 5.059 5.336 . 0 0 "[ . 1]" 1 1862 2 18 TYR HA 2 36 PRO HB3 3.415 . 5.030 4.792 4.596 5.018 . 0 0 "[ . 1]" 1 1863 2 18 TYR HA 2 37 SER H 2.635 . 3.470 2.734 2.479 3.236 . 0 0 "[ . 1]" 1 1864 2 18 TYR HA 2 37 SER QB 3.045 . 4.290 3.937 3.294 4.314 0.024 7 0 "[ . 1]" 1 1865 2 18 TYR QB 2 19 HIS H 2.520 . 3.240 2.684 2.660 2.707 . 0 0 "[ . 1]" 1 1866 2 18 TYR QB 2 19 HIS HA 3.155 . 4.510 4.208 4.189 4.226 . 0 0 "[ . 1]" 1 1867 2 18 TYR QB 2 20 LEU HA 3.510 . 5.220 4.607 4.551 4.637 . 0 0 "[ . 1]" 1 1868 2 18 TYR QB 2 34 VAL HA 3.195 . 4.590 3.854 3.768 3.971 . 0 0 "[ . 1]" 1 1869 2 18 TYR QB 2 34 VAL HB 3.405 . 5.010 4.577 4.491 4.631 . 0 0 "[ . 1]" 1 1870 2 18 TYR QB 2 34 VAL QG 2.390 . 2.980 1.830 1.785 1.880 0.015 4 0 "[ . 1]" 1 1871 2 18 TYR QB 2 35 ILE H 2.955 . 4.110 3.340 3.243 3.457 . 0 0 "[ . 1]" 1 1872 2 18 TYR QB 2 36 PRO HA 2.955 . 4.110 3.823 3.733 3.909 . 0 0 "[ . 1]" 1 1873 2 18 TYR QD 2 19 HIS H 3.070 . 4.340 3.592 3.458 3.676 . 0 0 "[ . 1]" 1 1874 2 18 TYR QD 2 34 VAL QG 2.540 . 3.280 2.286 2.217 2.366 . 0 0 "[ . 1]" 1 1875 2 18 TYR QD 2 35 ILE H 3.130 . 4.460 3.789 3.661 3.900 . 0 0 "[ . 1]" 1 1876 2 18 TYR QD 2 35 ILE HA 3.295 . 4.790 3.687 3.630 3.765 . 0 0 "[ . 1]" 1 1877 2 18 TYR QD 2 36 PRO HA 2.715 . 3.630 2.491 2.460 2.540 . 0 0 "[ . 1]" 1 1878 2 18 TYR QD 2 36 PRO HB3 3.215 . 4.630 3.505 3.355 3.682 . 0 0 "[ . 1]" 1 1879 2 18 TYR QD 2 36 PRO HD2 3.155 . 4.510 4.218 4.096 4.313 . 0 0 "[ . 1]" 1 1880 2 18 TYR QD 2 37 SER H 3.245 . 4.690 4.224 4.129 4.355 . 0 0 "[ . 1]" 1 1881 2 18 TYR QE 2 34 VAL QG 2.805 . 3.810 3.625 3.514 3.723 . 0 0 "[ . 1]" 1 1882 2 18 TYR QE 2 35 ILE MG 3.650 . 5.500 5.620 5.580 5.654 0.154 7 0 "[ . 1]" 1 1883 2 18 TYR QE 2 36 PRO HA 2.945 . 4.090 3.192 3.003 3.379 . 0 0 "[ . 1]" 1 1884 2 18 TYR QE 2 36 PRO HB2 3.375 . 4.950 4.146 3.945 4.335 . 0 0 "[ . 1]" 1 1885 2 18 TYR QE 2 36 PRO HB3 3.065 . 4.330 2.440 2.221 2.641 . 0 0 "[ . 1]" 1 1886 2 18 TYR QE 2 36 PRO HD2 3.215 . 4.630 4.559 4.466 4.608 . 0 0 "[ . 1]" 1 1887 2 18 TYR QE 2 36 PRO HD3 3.085 . 4.370 2.915 2.799 2.986 . 0 0 "[ . 1]" 1 1888 2 18 TYR QE 2 36 PRO QG 2.795 . 3.790 3.508 3.359 3.649 . 0 0 "[ . 1]" 1 1889 2 18 TYR QE 2 42 GLU QG 3.065 . 4.330 3.802 3.631 4.089 . 0 0 "[ . 1]" 1 1890 2 19 HIS H 2 19 HIS HB2 2.545 . 3.290 2.195 2.183 2.203 . 0 0 "[ . 1]" 1 1891 2 19 HIS H 2 19 HIS HB3 2.695 . 3.590 3.439 3.411 3.474 . 0 0 "[ . 1]" 1 1892 2 19 HIS H 2 34 VAL HA 3.105 . 4.410 4.156 4.078 4.239 . 0 0 "[ . 1]" 1 1893 2 19 HIS H 2 34 VAL QG 3.040 . 4.280 3.466 3.430 3.507 . 0 0 "[ . 1]" 1 1894 2 19 HIS H 2 35 ILE H 2.760 . 3.720 2.508 2.412 2.593 . 0 0 "[ . 1]" 1 1895 2 19 HIS H 2 35 ILE HB 3.045 . 4.290 3.337 3.202 3.423 . 0 0 "[ . 1]" 1 1896 2 19 HIS H 2 35 ILE HG12 3.580 . 5.360 5.322 5.223 5.372 0.012 3 0 "[ . 1]" 1 1897 2 19 HIS H 2 35 ILE HG13 3.395 . 4.990 4.117 3.994 4.187 . 0 0 "[ . 1]" 1 1898 2 19 HIS H 2 35 ILE MG 3.410 . 5.020 4.546 4.473 4.602 . 0 0 "[ . 1]" 1 1899 2 19 HIS H 2 36 PRO HA 3.020 . 4.240 3.896 3.793 4.040 . 0 0 "[ . 1]" 1 1900 2 19 HIS H 2 37 SER H 3.570 . 5.340 4.326 4.083 4.900 . 0 0 "[ . 1]" 1 1901 2 19 HIS HA 2 19 HIS HD2 2.670 . 3.540 2.475 2.242 2.625 . 0 0 "[ . 1]" 1 1902 2 19 HIS HA 2 20 LEU H 2.375 . 2.950 2.098 2.085 2.112 . 0 0 "[ . 1]" 1 1903 2 19 HIS HA 2 20 LEU HA 3.140 . 4.480 4.375 4.368 4.390 . 0 0 "[ . 1]" 1 1904 2 19 HIS HA 2 20 LEU HB2 3.510 . 5.220 4.737 4.656 4.791 . 0 0 "[ . 1]" 1 1905 2 19 HIS HA 2 20 LEU HB3 3.080 . 4.360 4.236 4.172 4.278 . 0 0 "[ . 1]" 1 1906 2 19 HIS HA 2 21 ILE HG13 3.555 . 5.310 4.796 4.739 4.837 . 0 0 "[ . 1]" 1 1907 2 19 HIS HA 2 34 VAL MG1 3.650 . 5.500 4.913 4.828 5.031 . 0 0 "[ . 1]" 1 1908 2 19 HIS HA 2 34 VAL MG2 3.650 . 5.500 5.557 5.547 5.572 0.072 1 0 "[ . 1]" 1 1909 2 19 HIS HA 2 35 ILE HB 3.650 . 5.500 5.186 5.043 5.305 . 0 0 "[ . 1]" 1 1910 2 19 HIS HA 2 35 ILE HG13 3.650 . 5.500 5.232 5.204 5.264 . 0 0 "[ . 1]" 1 1911 2 19 HIS HB2 2 19 HIS HE1 3.280 . 4.760 4.713 4.703 4.742 . 0 0 "[ . 1]" 1 1912 2 19 HIS HB2 2 20 LEU H 3.305 . 4.810 4.454 4.429 4.470 . 0 0 "[ . 1]" 1 1913 2 19 HIS HB2 2 21 ILE MD 3.115 . 4.430 4.262 4.165 4.319 . 0 0 "[ . 1]" 1 1914 2 19 HIS HB2 2 21 ILE HG13 3.650 . 5.500 5.123 5.034 5.202 . 0 0 "[ . 1]" 1 1915 2 19 HIS HB2 2 34 VAL QG 3.430 . 5.060 4.632 4.520 4.712 . 0 0 "[ . 1]" 1 1916 2 19 HIS HB2 2 35 ILE H 2.930 . 4.060 2.854 2.686 2.936 . 0 0 "[ . 1]" 1 1917 2 19 HIS HB2 2 35 ILE HB 2.730 . 3.660 2.286 2.114 2.437 . 0 0 "[ . 1]" 1 1918 2 19 HIS HB2 2 35 ILE MD 3.020 . 4.240 3.274 3.026 3.456 . 0 0 "[ . 1]" 1 1919 2 19 HIS HB2 2 35 ILE HG12 3.125 . 4.450 4.453 4.339 4.489 0.039 6 0 "[ . 1]" 1 1920 2 19 HIS HB2 2 35 ILE HG13 2.910 . 4.020 2.988 2.875 3.062 . 0 0 "[ . 1]" 1 1921 2 19 HIS HB2 2 35 ILE MG 3.150 . 4.500 3.972 3.820 4.102 . 0 0 "[ . 1]" 1 1922 2 19 HIS HB3 2 20 LEU H 3.010 . 4.220 3.574 3.548 3.600 . 0 0 "[ . 1]" 1 1923 2 19 HIS HB3 2 21 ILE MD 3.050 . 4.300 3.023 2.947 3.141 . 0 0 "[ . 1]" 1 1924 2 19 HIS HB3 2 21 ILE HG13 3.520 . 5.240 3.478 3.419 3.540 . 0 0 "[ . 1]" 1 1925 2 19 HIS HB3 2 34 VAL QG 3.620 . 5.440 4.905 4.852 4.969 . 0 0 "[ . 1]" 1 1926 2 19 HIS HB3 2 35 ILE H 3.015 . 4.230 3.499 3.452 3.541 . 0 0 "[ . 1]" 1 1927 2 19 HIS HB3 2 35 ILE HB 2.965 . 4.130 3.591 3.378 3.730 . 0 0 "[ . 1]" 1 1928 2 19 HIS HB3 2 35 ILE MD 3.175 . 4.550 3.341 3.065 3.580 . 0 0 "[ . 1]" 1 1929 2 19 HIS HB3 2 35 ILE HG12 3.280 . 4.760 4.842 4.797 4.872 0.112 5 0 "[ . 1]" 1 1930 2 19 HIS HB3 2 35 ILE HG13 3.015 . 4.230 3.124 3.081 3.179 . 0 0 "[ . 1]" 1 1931 2 19 HIS HB3 2 35 ILE MG 3.535 . 5.270 4.934 4.763 5.052 . 0 0 "[ . 1]" 1 1932 2 20 LEU H 2 20 LEU HB2 2.805 . 3.810 3.151 3.057 3.189 . 0 0 "[ . 1]" 1 1933 2 20 LEU H 2 20 LEU HB3 2.735 . 3.670 2.324 2.307 2.337 . 0 0 "[ . 1]" 1 1934 2 20 LEU H 2 20 LEU MD1 3.170 . 4.540 4.276 4.254 4.299 . 0 0 "[ . 1]" 1 1935 2 20 LEU H 2 20 LEU MD2 3.050 . 4.300 4.316 4.280 4.326 0.026 1 0 "[ . 1]" 1 1936 2 20 LEU H 2 20 LEU HG 3.225 . 4.650 4.127 4.077 4.198 . 0 0 "[ . 1]" 1 1937 2 20 LEU H 2 21 ILE MD 3.400 . 5.000 4.831 4.799 4.861 . 0 0 "[ . 1]" 1 1938 2 20 LEU H 2 21 ILE HG13 3.285 . 4.770 3.846 3.811 3.878 . 0 0 "[ . 1]" 1 1939 2 20 LEU H 2 34 VAL MG1 3.650 . 5.500 4.826 4.704 4.977 . 0 0 "[ . 1]" 1 1940 2 20 LEU H 2 34 VAL MG2 3.650 . 5.500 4.657 4.635 4.700 . 0 0 "[ . 1]" 1 1941 2 20 LEU HA 2 20 LEU MD1 2.495 . 3.190 2.317 2.229 2.378 . 0 0 "[ . 1]" 1 1942 2 20 LEU HA 2 20 LEU MD2 2.935 . 4.070 3.917 3.885 3.954 . 0 0 "[ . 1]" 1 1943 2 20 LEU HA 2 20 LEU HG 2.700 . 3.600 3.460 3.410 3.489 . 0 0 "[ . 1]" 1 1944 2 20 LEU HA 2 21 ILE H 2.350 . 2.900 2.117 2.111 2.126 . 0 0 "[ . 1]" 1 1945 2 20 LEU HA 2 21 ILE HA 3.240 . 4.680 4.383 4.377 4.391 . 0 0 "[ . 1]" 1 1946 2 20 LEU HA 2 21 ILE HB 3.345 . 4.890 4.665 4.612 4.696 . 0 0 "[ . 1]" 1 1947 2 20 LEU HA 2 21 ILE MD 3.075 . 4.350 4.461 4.440 4.475 0.125 8 0 "[ . 1]" 1 1948 2 20 LEU HA 2 21 ILE HG13 3.055 . 4.310 3.644 3.581 3.726 . 0 0 "[ . 1]" 1 1949 2 20 LEU HA 2 33 SER H 3.195 . 4.590 4.526 4.453 4.598 0.008 10 0 "[ . 1]" 1 1950 2 20 LEU HA 2 33 SER QB 3.530 . 5.260 4.724 4.597 4.871 . 0 0 "[ . 1]" 1 1951 2 20 LEU HA 2 34 VAL HA 2.530 . 3.260 2.681 2.636 2.749 . 0 0 "[ . 1]" 1 1952 2 20 LEU HA 2 34 VAL HB 3.650 . 5.500 4.993 4.944 5.088 . 0 0 "[ . 1]" 1 1953 2 20 LEU HA 2 34 VAL QG 2.745 . 3.690 2.376 2.311 2.456 . 0 0 "[ . 1]" 1 1954 2 20 LEU HA 2 35 ILE H 3.170 . 4.540 4.085 4.019 4.163 . 0 0 "[ . 1]" 1 1955 2 20 LEU HB2 2 20 LEU MD1 2.525 . 3.250 2.398 2.375 2.415 . 0 0 "[ . 1]" 1 1956 2 20 LEU HB2 2 20 LEU MD2 2.515 . 3.230 2.332 2.320 2.369 . 0 0 "[ . 1]" 1 1957 2 20 LEU HB2 2 21 ILE H 3.080 . 4.360 4.138 4.107 4.164 . 0 0 "[ . 1]" 1 1958 2 20 LEU HB2 2 34 VAL HA 3.285 . 4.770 4.306 4.240 4.422 . 0 0 "[ . 1]" 1 1959 2 20 LEU HB2 2 34 VAL QG 2.865 . 3.930 2.723 2.614 2.905 . 0 0 "[ . 1]" 1 1960 2 20 LEU HB3 2 20 LEU MD1 2.700 . 3.600 3.192 3.190 3.195 . 0 0 "[ . 1]" 1 1961 2 20 LEU HB3 2 20 LEU MD2 2.500 . 3.200 2.349 2.324 2.362 . 0 0 "[ . 1]" 1 1962 2 20 LEU HB3 2 21 ILE H 3.380 . 4.960 4.412 4.364 4.447 . 0 0 "[ . 1]" 1 1963 2 20 LEU HB3 2 34 VAL HA 3.650 . 5.500 5.383 5.316 5.504 0.004 10 0 "[ . 1]" 1 1964 2 20 LEU MD1 2 21 ILE H 2.685 . 3.570 2.147 2.066 2.221 . 0 0 "[ . 1]" 1 1965 2 20 LEU MD1 2 33 SER H 2.855 . 3.910 3.434 3.377 3.491 . 0 0 "[ . 1]" 1 1966 2 20 LEU MD1 2 34 VAL HA 3.335 . 4.870 4.012 3.926 4.086 . 0 0 "[ . 1]" 1 1967 2 20 LEU MD2 2 21 ILE H 3.395 . 4.990 4.728 4.668 4.777 . 0 0 "[ . 1]" 1 1968 2 20 LEU MD2 2 21 ILE HA 3.475 . 5.150 5.170 5.160 5.198 0.048 10 0 "[ . 1]" 1 1969 2 20 LEU MD2 2 22 VAL HB 3.285 . 4.770 4.686 4.598 4.778 0.008 4 0 "[ . 1]" 1 1970 2 20 LEU HG 2 21 ILE H 2.915 . 4.030 3.716 3.613 3.800 . 0 0 "[ . 1]" 1 1971 2 20 LEU HG 2 22 VAL HB 3.360 . 4.920 4.576 4.516 4.637 . 0 0 "[ . 1]" 1 1972 2 20 LEU HG 2 32 LEU MD1 3.125 . 4.450 3.957 3.879 4.056 . 0 0 "[ . 1]" 1 1973 2 21 ILE H 2 21 ILE HB 2.625 . 3.450 2.751 2.735 2.765 . 0 0 "[ . 1]" 1 1974 2 21 ILE H 2 21 ILE MD 3.095 . 4.390 3.569 3.479 3.635 . 0 0 "[ . 1]" 1 1975 2 21 ILE H 2 21 ILE HG12 3.315 . 4.830 4.187 4.155 4.207 . 0 0 "[ . 1]" 1 1976 2 21 ILE H 2 21 ILE HG13 2.990 . 4.180 2.800 2.759 2.839 . 0 0 "[ . 1]" 1 1977 2 21 ILE H 2 21 ILE MG 2.905 . 4.010 3.902 3.895 3.906 . 0 0 "[ . 1]" 1 1978 2 21 ILE H 2 22 VAL H 3.150 . 4.500 4.238 4.221 4.250 . 0 0 "[ . 1]" 1 1979 2 21 ILE H 2 32 LEU MD1 3.375 . 4.950 3.825 3.696 3.971 . 0 0 "[ . 1]" 1 1980 2 21 ILE H 2 32 LEU HG 3.195 . 4.590 4.184 3.988 4.378 . 0 0 "[ . 1]" 1 1981 2 21 ILE H 2 33 SER QB 2.915 . 4.030 3.297 3.159 3.435 . 0 0 "[ . 1]" 1 1982 2 21 ILE H 2 34 VAL HA 3.050 . 4.300 3.656 3.570 3.735 . 0 0 "[ . 1]" 1 1983 2 21 ILE H 2 34 VAL QG 3.190 . 4.580 3.399 3.331 3.459 . 0 0 "[ . 1]" 1 1984 2 21 ILE HA 2 21 ILE MD 3.190 . 4.580 3.921 3.911 3.930 . 0 0 "[ . 1]" 1 1985 2 21 ILE HA 2 21 ILE HG13 2.850 . 3.900 2.783 2.741 2.819 . 0 0 "[ . 1]" 1 1986 2 21 ILE HA 2 21 ILE MG 2.515 . 3.230 2.350 2.341 2.365 . 0 0 "[ . 1]" 1 1987 2 21 ILE HA 2 22 VAL H 2.545 . 3.290 2.160 2.145 2.169 . 0 0 "[ . 1]" 1 1988 2 21 ILE HB 2 21 ILE MD 2.595 . 3.390 2.272 2.262 2.288 . 0 0 "[ . 1]" 1 1989 2 21 ILE HB 2 22 VAL H 3.330 . 4.860 4.179 4.165 4.196 . 0 0 "[ . 1]" 1 1990 2 21 ILE HB 2 33 SER H 2.980 . 4.160 3.254 3.070 3.547 . 0 0 "[ . 1]" 1 1991 2 21 ILE HB 2 33 SER HA 3.650 . 5.500 4.814 4.661 5.126 . 0 0 "[ . 1]" 1 1992 2 21 ILE HB 2 33 SER QB 2.530 . 3.260 1.996 1.796 2.340 0.004 5 0 "[ . 1]" 1 1993 2 21 ILE MD 2 33 SER HB2 2.945 . 4.090 2.703 2.385 3.797 . 0 0 "[ . 1]" 1 1994 2 21 ILE MD 2 33 SER QB 2.650 . 3.500 2.469 2.294 2.843 . 0 0 "[ . 1]" 1 1995 2 21 ILE MD 2 33 SER HB3 2.945 . 4.090 3.111 2.437 3.607 . 0 0 "[ . 1]" 1 1996 2 21 ILE MD 2 34 VAL HA 3.590 . 5.380 4.501 4.432 4.593 . 0 0 "[ . 1]" 1 1997 2 21 ILE MD 2 35 ILE HG12 3.040 . 4.280 4.200 4.034 4.299 0.019 2 0 "[ . 1]" 1 1998 2 21 ILE HG12 2 21 ILE MG 2.420 . 3.040 2.214 2.195 2.232 . 0 0 "[ . 1]" 1 1999 2 21 ILE HG13 2 33 SER QB 3.455 . 5.110 3.850 3.587 4.272 . 0 0 "[ . 1]" 1 2000 2 21 ILE MG 2 22 VAL H 2.820 . 3.840 2.784 2.768 2.809 . 0 0 "[ . 1]" 1 2001 2 21 ILE MG 2 22 VAL HA 2.920 . 4.040 3.627 3.575 3.675 . 0 0 "[ . 1]" 1 2002 2 21 ILE MG 2 23 ASP H 3.170 . 4.540 4.133 3.953 4.280 . 0 0 "[ . 1]" 1 2003 2 21 ILE MG 2 23 ASP QB 2.800 . 3.800 2.954 2.798 3.160 . 0 0 "[ . 1]" 1 2004 2 21 ILE MG 2 33 SER QB 2.885 . 3.970 3.413 3.299 3.656 . 0 0 "[ . 1]" 1 2005 2 22 VAL H 2 22 VAL MG1 2.820 . 3.840 2.166 2.120 2.218 . 0 0 "[ . 1]" 1 2006 2 22 VAL HA 2 22 VAL MG2 2.485 . 3.170 2.336 2.318 2.346 . 0 0 "[ . 1]" 1 2007 2 22 VAL HA 2 23 ASP H 2.275 . 2.750 2.171 2.155 2.194 . 0 0 "[ . 1]" 1 2008 2 22 VAL HA 2 23 ASP QB 3.390 . 4.980 4.062 3.827 4.350 . 0 0 "[ . 1]" 1 2009 2 22 VAL HA 2 32 LEU H 3.575 . 5.350 4.990 4.930 5.103 . 0 0 "[ . 1]" 1 2010 2 22 VAL HA 2 32 LEU MD1 2.995 . 4.190 2.840 2.685 3.044 . 0 0 "[ . 1]" 1 2011 2 22 VAL HA 2 33 SER H 3.020 . 4.240 3.661 3.585 3.754 . 0 0 "[ . 1]" 1 2012 2 22 VAL HB 2 23 ASP H 3.105 . 4.410 4.159 4.054 4.215 . 0 0 "[ . 1]" 1 2013 2 22 VAL HB 2 31 SER H 3.650 . 5.500 5.577 5.545 5.603 0.103 10 0 "[ . 1]" 1 2014 2 22 VAL HB 2 32 LEU MD1 3.005 . 4.210 2.592 2.365 2.833 . 0 0 "[ . 1]" 1 2015 2 22 VAL MG1 2 23 ASP HA 3.005 . 4.210 3.721 3.585 3.835 . 0 0 "[ . 1]" 1 2016 2 22 VAL MG1 2 23 ASP HB2 3.650 . 5.500 5.167 4.794 5.600 0.100 3 0 "[ . 1]" 1 2017 2 22 VAL MG1 2 23 ASP QB 3.315 . 4.830 4.576 4.517 4.667 . 0 0 "[ . 1]" 1 2018 2 22 VAL MG1 2 23 ASP HB3 3.650 . 5.500 5.274 4.775 5.609 0.109 10 0 "[ . 1]" 1 2019 2 22 VAL MG2 2 23 ASP H 2.530 . 3.260 2.499 2.305 2.623 . 0 0 "[ . 1]" 1 2020 2 22 VAL MG2 2 23 ASP HA 3.155 . 4.510 3.574 3.501 3.714 . 0 0 "[ . 1]" 1 2021 2 22 VAL MG2 2 23 ASP HB2 3.650 . 5.500 5.033 4.659 5.324 . 0 0 "[ . 1]" 1 2022 2 22 VAL MG2 2 23 ASP HB3 3.650 . 5.500 4.813 4.754 4.907 . 0 0 "[ . 1]" 1 2023 2 22 VAL MG2 2 30 PRO HA 3.045 . 4.290 3.641 3.463 3.818 . 0 0 "[ . 1]" 1 2024 2 22 VAL MG2 2 31 SER H 2.805 . 3.810 3.060 2.996 3.098 . 0 0 "[ . 1]" 1 2025 2 22 VAL MG2 2 32 LEU H 3.420 . 5.040 4.919 4.779 5.047 0.007 4 0 "[ . 1]" 1 2026 2 22 VAL MG2 2 32 LEU HA 2.780 . 3.760 3.556 3.388 3.702 . 0 0 "[ . 1]" 1 2027 2 22 VAL MG2 2 32 LEU MD1 2.640 . 3.480 2.850 2.647 3.098 . 0 0 "[ . 1]" 1 2028 2 23 ASP H 2 23 ASP HB2 2.890 . 3.980 3.521 3.119 3.932 . 0 0 "[ . 1]" 1 2029 2 23 ASP H 2 23 ASP HB3 2.890 . 3.980 2.983 2.693 3.287 . 0 0 "[ . 1]" 1 2030 2 23 ASP H 2 30 PRO HA 3.120 . 4.440 4.144 3.881 4.450 0.010 3 0 "[ . 1]" 1 2031 2 23 ASP H 2 31 SER H 2.560 . 3.320 2.521 2.401 2.710 . 0 0 "[ . 1]" 1 2032 2 23 ASP H 2 31 SER HB2 3.255 . 4.710 4.487 3.094 4.743 0.033 9 0 "[ . 1]" 1 2033 2 23 ASP H 2 31 SER HB3 3.160 . 4.520 3.312 3.048 4.238 . 0 0 "[ . 1]" 1 2034 2 23 ASP H 2 32 LEU HA 3.195 . 4.590 3.965 3.829 4.108 . 0 0 "[ . 1]" 1 2035 2 23 ASP HA 2 24 THR H 2.350 . 2.900 2.470 2.309 2.563 . 0 0 "[ . 1]" 1 2036 2 23 ASP HA 2 24 THR MG 3.105 . 4.410 3.872 3.684 4.114 . 0 0 "[ . 1]" 1 2037 2 23 ASP HA 2 31 SER H 3.300 . 4.800 4.532 4.448 4.616 . 0 0 "[ . 1]" 1 2038 2 23 ASP QB 2 24 THR HA 3.415 . 5.030 4.511 4.318 4.676 . 0 0 "[ . 1]" 1 2039 2 23 ASP QB 2 31 SER H 3.510 . 5.220 4.240 3.653 4.814 . 0 0 "[ . 1]" 1 2040 2 23 ASP QB 2 31 SER HB2 3.570 . 5.340 4.612 2.935 5.380 0.040 6 0 "[ . 1]" 1 2041 2 23 ASP QB 2 31 SER HB3 3.135 . 4.470 3.445 2.529 4.139 . 0 0 "[ . 1]" 1 2042 2 23 ASP HB2 2 24 THR H 2.845 . 3.890 3.259 2.295 3.915 0.025 8 0 "[ . 1]" 1 2043 2 23 ASP HB3 2 24 THR H 2.845 . 3.890 3.672 3.228 3.914 0.024 8 0 "[ . 1]" 1 2044 2 24 THR H 2 24 THR HB 2.785 . 3.770 3.654 3.529 3.714 . 0 0 "[ . 1]" 1 2045 2 24 THR H 2 24 THR MG 2.685 . 3.570 3.230 2.899 3.436 . 0 0 "[ . 1]" 1 2046 2 24 THR H 2 25 ASP H 3.185 . 4.570 4.402 4.322 4.493 . 0 0 "[ . 1]" 1 2047 2 24 THR H 2 25 ASP HA 3.510 . 5.220 4.977 4.732 5.119 . 0 0 "[ . 1]" 1 2048 2 24 THR H 2 30 PRO HA 3.330 . 4.860 4.735 4.568 4.916 0.056 3 0 "[ . 1]" 1 2049 2 24 THR HA 2 24 THR MG 2.470 . 3.140 2.215 2.147 2.276 . 0 0 "[ . 1]" 1 2050 2 24 THR HA 2 25 ASP H 2.255 . 2.710 2.158 2.071 2.200 . 0 0 "[ . 1]" 1 2051 2 24 THR HA 2 25 ASP QB 3.270 . 4.740 4.085 3.918 4.382 . 0 0 "[ . 1]" 1 2052 2 24 THR HA 2 28 GLY H 3.615 . 5.430 5.213 4.929 5.464 0.034 3 0 "[ . 1]" 1 2053 2 24 THR HA 2 30 PRO HA 2.375 . 2.950 2.437 2.177 2.575 . 0 0 "[ . 1]" 1 2054 2 24 THR HA 2 30 PRO HB2 3.645 . 5.490 5.150 4.839 5.413 . 0 0 "[ . 1]" 1 2055 2 24 THR HA 2 30 PRO HB3 3.220 . 4.640 4.456 4.080 4.613 . 0 0 "[ . 1]" 1 2056 2 24 THR HA 2 31 SER H 2.750 . 3.700 3.422 3.143 3.542 . 0 0 "[ . 1]" 1 2057 2 24 THR HA 2 31 SER HB2 3.220 . 4.640 4.505 3.505 4.690 0.050 8 0 "[ . 1]" 1 2058 2 24 THR HA 2 31 SER HB3 3.350 . 4.900 4.604 3.956 5.074 0.174 1 0 "[ . 1]" 1 2059 2 24 THR HB 2 25 ASP H 2.555 . 3.310 3.092 2.950 3.314 0.004 3 0 "[ . 1]" 1 2060 2 24 THR HB 2 28 GLY H 3.125 . 4.450 4.012 3.560 4.304 . 0 0 "[ . 1]" 1 2061 2 24 THR HB 2 28 GLY HA2 2.570 . 3.340 2.852 1.996 3.359 0.019 3 0 "[ . 1]" 1 2062 2 24 THR HB 2 29 ASN H 3.285 . 4.770 4.369 3.830 4.740 . 0 0 "[ . 1]" 1 2063 2 24 THR HB 2 30 PRO HA 3.365 . 4.930 4.478 4.233 4.682 . 0 0 "[ . 1]" 1 2064 2 24 THR MG 2 25 ASP H 2.795 . 3.790 3.471 3.239 3.655 . 0 0 "[ . 1]" 1 2065 2 24 THR MG 2 28 GLY H 3.310 . 4.820 4.758 4.583 4.859 0.039 8 0 "[ . 1]" 1 2066 2 24 THR MG 2 28 GLY HA2 2.650 . 3.500 3.404 3.118 3.545 0.045 1 0 "[ . 1]" 1 2067 2 24 THR MG 2 28 GLY HA3 3.200 . 4.600 4.448 4.002 4.611 0.011 1 0 "[ . 1]" 1 2068 2 24 THR MG 2 29 ASN H 3.145 . 4.490 4.315 4.199 4.499 0.009 1 0 "[ . 1]" 1 2069 2 24 THR MG 2 29 ASN HA 3.275 . 4.750 4.059 3.827 4.238 . 0 0 "[ . 1]" 1 2070 2 24 THR MG 2 29 ASN HB2 3.650 . 5.500 5.323 5.226 5.443 . 0 0 "[ . 1]" 1 2071 2 24 THR MG 2 29 ASN HB3 3.650 . 5.500 5.514 5.429 5.577 0.077 7 0 "[ . 1]" 1 2072 2 24 THR MG 2 30 PRO HA 2.605 . 3.410 2.485 2.288 2.583 . 0 0 "[ . 1]" 1 2073 2 24 THR MG 2 30 PRO HB2 3.145 . 4.490 4.302 4.081 4.508 0.018 2 0 "[ . 1]" 1 2074 2 24 THR MG 2 30 PRO HB3 2.690 . 3.580 3.125 2.820 3.374 . 0 0 "[ . 1]" 1 2075 2 24 THR MG 2 30 PRO HD3 3.105 . 4.410 3.694 3.434 4.074 . 0 0 "[ . 1]" 1 2076 2 24 THR MG 2 30 PRO HG2 3.510 . 5.220 5.025 4.525 5.272 0.052 10 0 "[ . 1]" 1 2077 2 24 THR MG 2 31 SER H 3.015 . 4.230 3.979 3.820 4.115 . 0 0 "[ . 1]" 1 2078 2 25 ASP H 2 25 ASP HB2 2.810 . 3.820 3.264 2.647 3.648 . 0 0 "[ . 1]" 1 2079 2 25 ASP H 2 25 ASP QB 2.485 . 3.170 2.297 2.087 2.683 . 0 0 "[ . 1]" 1 2080 2 25 ASP H 2 25 ASP HB3 2.810 . 3.820 2.365 2.144 2.761 . 0 0 "[ . 1]" 1 2081 2 25 ASP H 2 28 GLY H 3.095 . 4.390 3.661 3.360 4.112 . 0 0 "[ . 1]" 1 2082 2 25 ASP H 2 28 GLY HA2 3.205 . 4.610 4.242 3.794 4.616 0.006 7 0 "[ . 1]" 1 2083 2 25 ASP H 2 29 ASN H 2.640 . 3.480 3.172 2.846 3.511 0.031 1 0 "[ . 1]" 1 2084 2 25 ASP H 2 29 ASN QB 3.115 . 4.430 3.683 3.391 4.495 0.065 7 0 "[ . 1]" 1 2085 2 25 ASP H 2 30 PRO HA 2.950 . 4.100 3.869 3.522 4.124 0.024 9 0 "[ . 1]" 1 2086 2 25 ASP H 2 31 SER H 3.450 . 5.100 4.783 4.467 4.978 . 0 0 "[ . 1]" 1 2087 2 25 ASP HA 2 25 ASP QB 2.220 . 2.640 2.225 2.166 2.347 . 0 0 "[ . 1]" 1 2088 2 25 ASP HA 2 29 ASN H 3.590 . 5.380 5.108 4.791 5.315 . 0 0 "[ . 1]" 1 2089 2 25 ASP QB 2 31 SER HB2 3.155 . 4.510 4.173 3.682 4.505 . 0 0 "[ . 1]" 1 2090 2 25 ASP QB 2 31 SER HB3 3.495 . 5.190 5.067 4.720 5.254 0.064 6 0 "[ . 1]" 1 2091 2 26 SER HA 2 26 SER QB 2.245 . 2.690 2.317 2.179 2.408 . 0 0 "[ . 1]" 1 2092 2 26 SER QB 2 27 LEU H 2.810 . 3.820 2.971 2.785 3.511 . 0 0 "[ . 1]" 1 2093 2 26 SER QB 2 27 LEU MD2 3.050 . 4.300 3.493 3.166 3.861 . 0 0 "[ . 1]" 1 2094 2 26 SER QB 2 27 LEU HG 3.200 . 4.600 3.444 3.123 4.215 . 0 0 "[ . 1]" 1 2095 2 27 LEU H 2 27 LEU HB2 2.335 . 2.870 2.537 2.480 2.591 . 0 0 "[ . 1]" 1 2096 2 27 LEU H 2 27 LEU HB3 2.755 . 3.710 3.614 3.593 3.633 . 0 0 "[ . 1]" 1 2097 2 27 LEU H 2 27 LEU MD1 2.690 . 3.580 3.584 3.534 3.618 0.038 9 0 "[ . 1]" 1 2098 2 27 LEU H 2 27 LEU MD2 3.080 . 4.360 3.330 3.241 3.441 . 0 0 "[ . 1]" 1 2099 2 27 LEU H 2 27 LEU HG 2.525 . 3.250 2.255 2.200 2.341 . 0 0 "[ . 1]" 1 2100 2 27 LEU H 2 28 GLY HA2 3.370 . 4.940 4.789 4.646 4.919 . 0 0 "[ . 1]" 1 2101 2 27 LEU H 2 29 ASN H 2.975 . 4.150 3.589 3.347 3.714 . 0 0 "[ . 1]" 1 2102 2 27 LEU HA 2 27 LEU HB3 2.390 . 2.980 2.428 2.402 2.460 . 0 0 "[ . 1]" 1 2103 2 27 LEU HA 2 27 LEU MD1 2.950 . 4.100 3.891 3.866 3.902 . 0 0 "[ . 1]" 1 2104 2 27 LEU HA 2 27 LEU MD2 2.375 . 2.950 2.117 2.058 2.176 . 0 0 "[ . 1]" 1 2105 2 27 LEU HA 2 27 LEU HG 2.750 . 3.700 3.159 3.080 3.225 . 0 0 "[ . 1]" 1 2106 2 27 LEU HB2 2 27 LEU MD1 2.530 . 3.260 2.283 2.249 2.314 . 0 0 "[ . 1]" 1 2107 2 27 LEU HB2 2 28 GLY H 2.885 . 3.970 3.078 2.950 3.269 . 0 0 "[ . 1]" 1 2108 2 27 LEU HB2 2 29 ASN H 2.775 . 3.750 2.923 2.565 3.073 . 0 0 "[ . 1]" 1 2109 2 27 LEU HB2 2 29 ASN QB 3.015 . 4.230 3.678 3.016 3.890 . 0 0 "[ . 1]" 1 2110 2 27 LEU HB2 2 29 ASN HD21 2.795 . 3.790 2.054 1.724 3.157 0.076 7 0 "[ . 1]" 1 2111 2 27 LEU HB2 2 29 ASN HD22 2.795 . 3.790 2.409 1.996 3.590 . 0 0 "[ . 1]" 1 2112 2 27 LEU HB3 2 27 LEU MD1 2.410 . 3.020 2.399 2.372 2.418 . 0 0 "[ . 1]" 1 2113 2 27 LEU HB3 2 27 LEU MD2 2.540 . 3.280 2.346 2.322 2.372 . 0 0 "[ . 1]" 1 2114 2 27 LEU HB3 2 29 ASN H 3.385 . 4.970 4.220 3.737 4.460 . 0 0 "[ . 1]" 1 2115 2 27 LEU HB3 2 29 ASN QD 2.745 . 3.690 2.761 2.550 3.252 . 0 0 "[ . 1]" 1 2116 2 27 LEU MD1 2 28 GLY H 3.320 . 4.840 4.790 4.685 4.910 0.070 6 0 "[ . 1]" 1 2117 2 27 LEU MD1 2 29 ASN H 3.225 . 4.650 4.499 4.259 4.604 . 0 0 "[ . 1]" 1 2118 2 27 LEU MD1 2 29 ASN HB2 3.520 . 5.240 4.337 3.636 5.306 0.066 7 0 "[ . 1]" 1 2119 2 27 LEU MD1 2 29 ASN HB3 3.520 . 5.240 5.138 4.377 5.320 0.080 2 0 "[ . 1]" 1 2120 2 27 LEU MD1 2 29 ASN HD21 2.935 . 4.070 2.820 2.596 4.128 0.058 6 0 "[ . 1]" 1 2121 2 27 LEU MD1 2 29 ASN QD 2.685 . 3.570 2.390 2.115 3.536 . 0 0 "[ . 1]" 1 2122 2 27 LEU MD1 2 29 ASN HD22 2.935 . 4.070 2.604 2.238 3.845 . 0 0 "[ . 1]" 1 2123 2 27 LEU HG 2 29 ASN H 3.440 . 5.080 4.942 4.744 5.084 0.004 5 0 "[ . 1]" 1 2124 2 28 GLY H 2 29 ASN H 2.455 . 3.110 2.119 2.005 2.306 . 0 0 "[ . 1]" 1 2125 2 28 GLY H 2 29 ASN QB 3.230 . 4.660 4.287 4.165 4.685 0.025 7 0 "[ . 1]" 1 2126 2 28 GLY HA2 2 29 ASN HA 3.275 . 4.750 4.637 4.591 4.720 . 0 0 "[ . 1]" 1 2127 2 28 GLY HA3 2 29 ASN HA 3.420 . 5.040 4.500 4.452 4.541 . 0 0 "[ . 1]" 1 2128 2 29 ASN H 2 29 ASN QB 2.320 . 2.840 2.490 2.319 2.719 . 0 0 "[ . 1]" 1 2129 2 29 ASN H 2 29 ASN HD21 3.100 . 4.400 2.480 2.162 3.834 . 0 0 "[ . 1]" 1 2130 2 29 ASN H 2 29 ASN QD 2.755 . 3.710 2.427 2.149 3.586 . 0 0 "[ . 1]" 1 2131 2 29 ASN H 2 29 ASN HD22 3.100 . 4.400 3.632 3.042 4.312 . 0 0 "[ . 1]" 1 2132 2 29 ASN H 2 30 PRO HD3 3.380 . 4.960 4.712 4.453 4.946 . 0 0 "[ . 1]" 1 2133 2 29 ASN HA 2 29 ASN HD21 3.310 . 4.820 3.891 2.528 4.485 . 0 0 "[ . 1]" 1 2134 2 29 ASN HA 2 29 ASN QD 3.005 . 4.210 3.649 2.485 4.094 . 0 0 "[ . 1]" 1 2135 2 29 ASN HA 2 29 ASN HD22 3.310 . 4.820 4.472 3.662 5.032 0.212 7 0 "[ . 1]" 1 2136 2 29 ASN HA 2 30 PRO HB2 3.650 . 5.500 5.419 5.123 5.500 0.000 3 0 "[ . 1]" 1 2137 2 29 ASN HA 2 30 PRO HD2 2.265 . 2.730 2.332 2.151 2.744 0.014 2 0 "[ . 1]" 1 2138 2 29 ASN HA 2 30 PRO HD3 2.250 . 2.700 2.069 1.718 2.246 0.082 2 0 "[ . 1]" 1 2139 2 29 ASN HA 2 30 PRO HG2 3.155 . 4.510 4.348 4.295 4.495 . 0 0 "[ . 1]" 1 2140 2 29 ASN HA 2 30 PRO HG3 3.200 . 4.600 4.211 3.832 4.372 . 0 0 "[ . 1]" 1 2141 2 29 ASN HA 2 56 VAL MG1 3.650 . 5.500 5.087 4.912 5.253 . 0 0 "[ . 1]" 1 2142 2 29 ASN HA 2 56 VAL MG2 3.650 . 5.500 5.647 5.437 5.772 0.272 8 0 "[ . 1]" 1 2143 2 29 ASN QB 2 29 ASN QD 2.310 . 2.820 2.193 2.119 2.677 . 0 0 "[ . 1]" 1 2144 2 29 ASN QB 2 30 PRO HD2 2.555 . 3.310 2.689 2.353 2.860 . 0 0 "[ . 1]" 1 2145 2 29 ASN QB 2 30 PRO HD3 2.825 . 3.850 3.648 3.240 3.885 0.035 3 0 "[ . 1]" 1 2146 2 29 ASN HB2 2 30 PRO HD2 2.995 . 4.190 3.985 2.575 4.324 0.134 1 0 "[ . 1]" 1 2147 2 29 ASN HB3 2 30 PRO HD2 2.995 . 4.190 2.850 2.375 3.811 . 0 0 "[ . 1]" 1 2148 2 30 PRO HA 2 31 SER H 2.215 . 2.630 2.177 2.116 2.230 . 0 0 "[ . 1]" 1 2149 2 30 PRO HA 2 31 SER HB2 3.350 . 4.900 4.386 3.929 4.581 . 0 0 "[ . 1]" 1 2150 2 30 PRO HA 2 31 SER HB3 3.355 . 4.910 4.557 4.169 5.236 0.326 1 0 "[ . 1]" 1 2151 2 30 PRO HB2 2 31 SER H 2.705 . 3.610 3.141 2.956 3.350 . 0 0 "[ . 1]" 1 2152 2 30 PRO HB2 2 56 VAL MG1 3.115 . 4.430 3.798 3.407 4.171 . 0 0 "[ . 1]" 1 2153 2 30 PRO HB2 2 56 VAL QG 2.780 . 3.760 2.331 1.948 3.140 . 0 0 "[ . 1]" 1 2154 2 30 PRO HB2 2 56 VAL MG2 3.115 . 4.430 2.366 1.956 3.302 . 0 0 "[ . 1]" 1 2155 2 30 PRO HB3 2 31 SER H 2.780 . 3.760 3.649 3.091 3.797 0.037 8 0 "[ . 1]" 1 2156 2 30 PRO HB3 2 56 VAL MG1 2.960 . 4.120 3.333 2.701 3.930 . 0 0 "[ . 1]" 1 2157 2 30 PRO HB3 2 56 VAL QG 2.615 . 3.430 2.433 2.073 2.873 . 0 0 "[ . 1]" 1 2158 2 30 PRO HB3 2 56 VAL MG2 2.960 . 4.120 2.524 2.120 2.998 . 0 0 "[ . 1]" 1 2159 2 30 PRO HD2 2 56 VAL MG1 3.460 . 5.120 3.927 3.442 4.371 . 0 0 "[ . 1]" 1 2160 2 30 PRO HD2 2 56 VAL QG 3.125 . 4.450 3.576 3.127 3.865 . 0 0 "[ . 1]" 1 2161 2 30 PRO HD2 2 56 VAL MG2 3.460 . 5.120 4.151 3.587 4.504 . 0 0 "[ . 1]" 1 2162 2 30 PRO HD3 2 56 VAL MG1 3.505 . 5.210 3.347 2.979 3.636 . 0 0 "[ . 1]" 1 2163 2 30 PRO HD3 2 56 VAL QG 3.105 . 4.410 3.155 2.881 3.458 . 0 0 "[ . 1]" 1 2164 2 30 PRO HD3 2 56 VAL MG2 3.505 . 5.210 3.932 3.454 4.330 . 0 0 "[ . 1]" 1 2165 2 30 PRO HG2 2 56 VAL HB 2.855 . 3.910 3.341 2.731 3.776 . 0 0 "[ . 1]" 1 2166 2 30 PRO HG2 2 56 VAL QG 2.815 . 3.830 2.355 1.595 2.887 0.205 1 0 "[ . 1]" 1 2167 2 30 PRO HG3 2 31 SER H 3.650 . 5.500 5.343 4.940 5.455 . 0 0 "[ . 1]" 1 2168 2 30 PRO HG3 2 56 VAL MG1 2.975 . 4.150 1.998 1.820 2.637 . 0 0 "[ . 1]" 1 2169 2 30 PRO HG3 2 56 VAL QG 2.655 . 3.510 1.825 1.708 2.488 0.092 4 0 "[ . 1]" 1 2170 2 30 PRO HG3 2 56 VAL MG2 2.975 . 4.150 2.203 1.874 3.051 . 0 0 "[ . 1]" 1 2171 2 31 SER H 2 31 SER HB2 2.710 . 3.620 3.073 2.451 3.341 . 0 0 "[ . 1]" 1 2172 2 31 SER H 2 31 SER HB3 2.590 . 3.380 2.759 2.531 3.605 0.225 1 0 "[ . 1]" 1 2173 2 31 SER HA 2 32 LEU H 2.350 . 2.900 2.259 2.227 2.321 . 0 0 "[ . 1]" 1 2174 2 31 SER HA 2 32 LEU HB2 3.160 . 4.520 4.115 4.079 4.165 . 0 0 "[ . 1]" 1 2175 2 31 SER HA 2 32 LEU HB3 3.315 . 4.830 4.720 4.657 4.780 . 0 0 "[ . 1]" 1 2176 2 31 SER HB2 2 32 LEU H 3.025 . 4.250 4.081 3.908 4.157 . 0 0 "[ . 1]" 1 2177 2 31 SER HB3 2 32 LEU H 2.995 . 4.190 3.871 3.110 4.127 . 0 0 "[ . 1]" 1 2178 2 32 LEU H 2 32 LEU HB2 2.690 . 3.580 2.866 2.800 2.935 . 0 0 "[ . 1]" 1 2179 2 32 LEU H 2 32 LEU HB3 2.795 . 3.790 2.791 2.736 2.860 . 0 0 "[ . 1]" 1 2180 2 32 LEU H 2 32 LEU MD1 3.285 . 4.770 4.229 4.186 4.271 . 0 0 "[ . 1]" 1 2181 2 32 LEU H 2 32 LEU HG 3.255 . 4.710 4.587 4.562 4.608 . 0 0 "[ . 1]" 1 2182 2 32 LEU H 2 33 SER H 3.245 . 4.690 4.311 4.214 4.371 . 0 0 "[ . 1]" 1 2183 2 32 LEU HA 2 32 LEU MD1 2.735 . 3.670 2.055 2.013 2.121 . 0 0 "[ . 1]" 1 2184 2 32 LEU HA 2 32 LEU MD2 3.000 . 4.200 3.843 3.821 3.856 . 0 0 "[ . 1]" 1 2185 2 32 LEU HA 2 32 LEU HG 2.825 . 3.850 2.788 2.703 2.868 . 0 0 "[ . 1]" 1 2186 2 32 LEU HA 2 33 SER H 2.335 . 2.870 2.132 2.102 2.162 . 0 0 "[ . 1]" 1 2187 2 32 LEU HA 2 33 SER QB 3.210 . 4.620 4.383 4.072 4.445 . 0 0 "[ . 1]" 1 2188 2 32 LEU HB2 2 32 LEU MD2 2.745 . 3.690 2.489 2.466 2.530 . 0 0 "[ . 1]" 1 2189 2 32 LEU HB2 2 33 SER H 3.285 . 4.770 4.323 4.273 4.368 . 0 0 "[ . 1]" 1 2190 2 32 LEU HB3 2 32 LEU MD1 2.745 . 3.690 3.174 3.166 3.182 . 0 0 "[ . 1]" 1 2191 2 32 LEU HB3 2 33 SER H 3.305 . 4.810 4.023 3.965 4.071 . 0 0 "[ . 1]" 1 2192 2 32 LEU HB3 2 33 SER HA 3.260 . 4.720 4.509 4.421 4.588 . 0 0 "[ . 1]" 1 2193 2 32 LEU HB3 2 34 VAL H 3.650 . 5.500 5.421 5.327 5.508 0.008 6 0 "[ . 1]" 1 2194 2 32 LEU MD1 2 33 SER H 2.890 . 3.980 2.996 2.792 3.188 . 0 0 "[ . 1]" 1 2195 2 32 LEU MD1 2 34 VAL QG 2.785 . 3.770 3.351 3.117 3.585 . 0 0 "[ . 1]" 1 2196 2 32 LEU MD1 2 54 ILE MG 2.510 . 3.220 2.981 2.850 3.119 . 0 0 "[ . 1]" 1 2197 2 32 LEU MD2 2 33 SER H 3.090 . 4.380 4.404 4.330 4.462 0.082 5 0 "[ . 1]" 1 2198 2 32 LEU MD2 2 33 SER HA 3.465 . 5.130 4.995 4.903 5.126 . 0 0 "[ . 1]" 1 2199 2 32 LEU MD2 2 34 VAL HB 3.310 . 4.820 4.505 4.420 4.623 . 0 0 "[ . 1]" 1 2200 2 32 LEU MD2 2 34 VAL QG 2.400 . 3.000 2.740 2.684 2.804 . 0 0 "[ . 1]" 1 2201 2 32 LEU MD2 2 54 ILE HB 3.075 . 4.350 2.741 2.650 2.828 . 0 0 "[ . 1]" 1 2202 2 32 LEU MD2 2 54 ILE MD 2.580 . 3.360 1.760 1.747 1.774 0.053 8 0 "[ . 1]" 1 2203 2 32 LEU MD2 2 54 ILE MG 2.575 . 3.350 2.882 2.785 2.974 . 0 0 "[ . 1]" 1 2204 2 32 LEU HG 2 33 SER H 2.920 . 4.040 2.846 2.744 2.931 . 0 0 "[ . 1]" 1 2205 2 32 LEU HG 2 34 VAL QG 2.870 . 3.940 2.475 2.378 2.572 . 0 0 "[ . 1]" 1 2206 2 33 SER H 2 33 SER QB 2.495 . 3.190 2.641 2.570 2.698 . 0 0 "[ . 1]" 1 2207 2 33 SER H 2 34 VAL QG 2.915 . 4.030 3.708 3.596 3.825 . 0 0 "[ . 1]" 1 2208 2 33 SER HA 2 34 VAL H 2.295 . 2.790 2.144 2.109 2.164 . 0 0 "[ . 1]" 1 2209 2 33 SER HA 2 34 VAL HB 3.610 . 5.420 4.569 4.496 4.599 . 0 0 "[ . 1]" 1 2210 2 33 SER HA 2 34 VAL QG 3.125 . 4.450 3.758 3.695 3.807 . 0 0 "[ . 1]" 1 2211 2 33 SER QB 2 34 VAL H 2.685 . 3.570 3.387 3.274 3.721 0.151 10 0 "[ . 1]" 1 2212 2 33 SER QB 2 34 VAL QG 3.495 . 5.190 4.312 4.284 4.411 . 0 0 "[ . 1]" 1 2213 2 33 SER QB 2 35 ILE MD 2.965 . 4.130 3.534 3.358 3.766 . 0 0 "[ . 1]" 1 2214 2 33 SER QB 2 35 ILE HG12 3.460 . 5.120 3.839 3.665 4.446 . 0 0 "[ . 1]" 1 2215 2 33 SER QB 2 35 ILE HG13 3.480 . 5.160 3.880 3.746 4.087 . 0 0 "[ . 1]" 1 2216 2 33 SER HB2 2 34 VAL H 3.100 . 4.400 4.272 4.240 4.337 . 0 0 "[ . 1]" 1 2217 2 33 SER HB2 2 35 ILE MD 3.290 . 4.780 4.469 4.297 4.829 0.049 10 0 "[ . 1]" 1 2218 2 33 SER HB3 2 34 VAL H 3.100 . 4.400 3.558 3.406 4.050 . 0 0 "[ . 1]" 1 2219 2 33 SER HB3 2 35 ILE MD 3.290 . 4.780 3.705 3.505 3.930 . 0 0 "[ . 1]" 1 2220 2 34 VAL H 2 34 VAL HB 2.805 . 3.810 2.651 2.635 2.667 . 0 0 "[ . 1]" 1 2221 2 34 VAL H 2 34 VAL QG 2.640 . 3.480 2.841 2.804 2.908 . 0 0 "[ . 1]" 1 2222 2 34 VAL H 2 35 ILE H 3.270 . 4.740 4.256 4.223 4.275 . 0 0 "[ . 1]" 1 2223 2 34 VAL H 2 35 ILE HG12 3.315 . 4.830 4.149 4.045 4.277 . 0 0 "[ . 1]" 1 2224 2 34 VAL H 2 35 ILE HG13 3.445 . 5.090 4.463 4.266 4.575 . 0 0 "[ . 1]" 1 2225 2 34 VAL H 2 35 ILE MG 3.650 . 5.500 5.511 5.452 5.545 0.045 3 0 "[ . 1]" 1 2226 2 34 VAL HA 2 34 VAL MG1 2.620 . 3.440 2.466 2.456 2.490 . 0 0 "[ . 1]" 1 2227 2 34 VAL HA 2 34 VAL QG 2.380 . 2.960 2.128 2.118 2.137 . 0 0 "[ . 1]" 1 2228 2 34 VAL HA 2 34 VAL MG2 2.620 . 3.440 2.325 2.293 2.343 . 0 0 "[ . 1]" 1 2229 2 34 VAL HA 2 35 ILE H 2.300 . 2.800 2.121 2.107 2.135 . 0 0 "[ . 1]" 1 2230 2 34 VAL HA 2 35 ILE HA 3.175 . 4.550 4.391 4.380 4.405 . 0 0 "[ . 1]" 1 2231 2 34 VAL HA 2 35 ILE HB 3.550 . 5.300 4.954 4.870 5.007 . 0 0 "[ . 1]" 1 2232 2 34 VAL HA 2 35 ILE MD 3.370 . 4.940 4.826 4.748 4.884 . 0 0 "[ . 1]" 1 2233 2 34 VAL HA 2 35 ILE HG12 3.290 . 4.780 4.202 4.126 4.327 . 0 0 "[ . 1]" 1 2234 2 34 VAL HA 2 35 ILE HG13 3.255 . 4.710 3.384 3.288 3.476 . 0 0 "[ . 1]" 1 2235 2 34 VAL HA 2 35 ILE MG 3.540 . 5.280 5.301 5.290 5.312 0.032 2 0 "[ . 1]" 1 2236 2 34 VAL HB 2 35 ILE H 3.285 . 4.770 4.288 4.276 4.307 . 0 0 "[ . 1]" 1 2237 2 34 VAL QG 2 35 ILE H 2.565 . 3.330 2.728 2.713 2.743 . 0 0 "[ . 1]" 1 2238 2 34 VAL QG 2 35 ILE HA 3.030 . 4.260 3.573 3.522 3.609 . 0 0 "[ . 1]" 1 2239 2 34 VAL QG 2 35 ILE HB 3.405 . 5.010 4.843 4.798 4.884 . 0 0 "[ . 1]" 1 2240 2 34 VAL QG 2 36 PRO HA 3.280 . 4.760 4.340 4.292 4.392 . 0 0 "[ . 1]" 1 2241 2 34 VAL QG 2 36 PRO HD2 3.415 . 5.030 4.759 4.727 4.830 . 0 0 "[ . 1]" 1 2242 2 35 ILE H 2 35 ILE HB 2.640 . 3.480 2.979 2.926 3.036 . 0 0 "[ . 1]" 1 2243 2 35 ILE H 2 35 ILE MD 3.085 . 4.370 3.913 3.854 3.973 . 0 0 "[ . 1]" 1 2244 2 35 ILE H 2 35 ILE HG12 2.735 . 3.670 3.320 3.250 3.416 . 0 0 "[ . 1]" 1 2245 2 35 ILE H 2 35 ILE HG13 2.830 . 3.860 2.330 2.277 2.380 . 0 0 "[ . 1]" 1 2246 2 35 ILE H 2 35 ILE MG 2.945 . 4.090 3.912 3.897 3.924 . 0 0 "[ . 1]" 1 2247 2 35 ILE H 2 36 PRO HD2 3.425 . 5.050 4.758 4.725 4.783 . 0 0 "[ . 1]" 1 2248 2 35 ILE H 2 36 PRO HD3 3.485 . 5.170 4.772 4.715 4.838 . 0 0 "[ . 1]" 1 2249 2 35 ILE HA 2 35 ILE MD 3.000 . 4.200 3.937 3.914 3.965 . 0 0 "[ . 1]" 1 2250 2 35 ILE HA 2 35 ILE HG12 2.825 . 3.850 2.838 2.813 2.866 . 0 0 "[ . 1]" 1 2251 2 35 ILE HA 2 35 ILE HG13 2.950 . 4.100 3.426 3.366 3.485 . 0 0 "[ . 1]" 1 2252 2 35 ILE HA 2 35 ILE MG 2.555 . 3.310 2.188 2.176 2.210 . 0 0 "[ . 1]" 1 2253 2 35 ILE HA 2 36 PRO HA 3.280 . 4.760 4.478 4.463 4.491 . 0 0 "[ . 1]" 1 2254 2 35 ILE HA 2 36 PRO HD2 2.340 . 2.880 2.022 1.992 2.046 . 0 0 "[ . 1]" 1 2255 2 35 ILE HA 2 36 PRO HD3 2.440 . 3.080 2.459 2.422 2.492 . 0 0 "[ . 1]" 1 2256 2 35 ILE HA 2 36 PRO QG 2.880 . 3.960 3.839 3.821 3.859 . 0 0 "[ . 1]" 1 2257 2 35 ILE HB 2 35 ILE MD 2.655 . 3.510 2.462 2.422 2.496 . 0 0 "[ . 1]" 1 2258 2 35 ILE HB 2 36 PRO HA 3.650 . 5.500 5.008 4.965 5.077 . 0 0 "[ . 1]" 1 2259 2 35 ILE HB 2 36 PRO HD2 2.815 . 3.830 3.846 3.814 3.885 0.055 10 0 "[ . 1]" 1 2260 2 35 ILE HB 2 36 PRO QG 3.510 . 5.220 4.962 4.909 5.022 . 0 0 "[ . 1]" 1 2261 2 35 ILE MD 2 36 PRO HD2 3.305 . 4.810 4.737 4.701 4.784 . 0 0 "[ . 1]" 1 2262 2 35 ILE HG12 2 35 ILE MG 2.605 . 3.410 2.410 2.362 2.441 . 0 0 "[ . 1]" 1 2263 2 35 ILE HG12 2 36 PRO HD2 3.320 . 4.840 4.377 4.303 4.433 . 0 0 "[ . 1]" 1 2264 2 35 ILE HG12 2 36 PRO HD3 3.515 . 5.230 5.254 5.230 5.269 0.039 8 0 "[ . 1]" 1 2265 2 35 ILE HG13 2 35 ILE MG 2.595 . 3.390 3.204 3.201 3.210 . 0 0 "[ . 1]" 1 2266 2 35 ILE HG13 2 36 PRO HD2 3.635 . 5.470 5.127 5.085 5.170 . 0 0 "[ . 1]" 1 2267 2 35 ILE MG 2 36 PRO HA 3.390 . 4.980 4.526 4.469 4.591 . 0 0 "[ . 1]" 1 2268 2 35 ILE MG 2 36 PRO HB2 3.515 . 5.230 4.625 4.522 4.683 . 0 0 "[ . 1]" 1 2269 2 35 ILE MG 2 36 PRO HB3 3.490 . 5.180 4.943 4.884 4.987 . 0 0 "[ . 1]" 1 2270 2 35 ILE MG 2 36 PRO HD2 2.745 . 3.690 2.008 1.957 2.066 . 0 0 "[ . 1]" 1 2271 2 35 ILE MG 2 36 PRO HD3 2.625 . 3.450 3.407 3.375 3.457 0.007 10 0 "[ . 1]" 1 2272 2 35 ILE MG 2 36 PRO QG 2.815 . 3.830 3.025 2.955 3.075 . 0 0 "[ . 1]" 1 2273 2 35 ILE MG 2 37 SER HA 3.640 . 5.480 4.953 4.839 5.096 . 0 0 "[ . 1]" 1 2274 2 36 PRO HA 2 37 SER H 2.485 . 3.170 2.174 2.151 2.219 . 0 0 "[ . 1]" 1 2275 2 36 PRO HA 2 37 SER HA 3.170 . 4.540 4.381 4.369 4.396 . 0 0 "[ . 1]" 1 2276 2 36 PRO HA 2 42 GLU QG 3.205 . 4.610 4.489 4.222 4.635 0.025 3 0 "[ . 1]" 1 2277 2 36 PRO HB2 2 38 ASN HA 3.540 . 5.280 4.470 4.315 4.635 . 0 0 "[ . 1]" 1 2278 2 36 PRO HB2 2 39 PRO HA 2.855 . 3.910 2.884 2.543 3.332 . 0 0 "[ . 1]" 1 2279 2 36 PRO HB2 2 39 PRO HD2 3.650 . 5.500 5.148 4.987 5.364 . 0 0 "[ . 1]" 1 2280 2 36 PRO HB2 2 39 PRO HD3 3.235 . 4.670 4.153 3.867 4.402 . 0 0 "[ . 1]" 1 2281 2 36 PRO HB2 2 42 GLU QG 2.890 . 3.980 2.692 2.336 2.921 . 0 0 "[ . 1]" 1 2282 2 36 PRO HB3 2 37 SER H 2.955 . 4.110 3.859 3.730 3.929 . 0 0 "[ . 1]" 1 2283 2 36 PRO HB3 2 39 PRO HA 3.345 . 4.890 4.028 3.842 4.387 . 0 0 "[ . 1]" 1 2284 2 36 PRO HB3 2 42 GLU QG 2.810 . 3.820 2.550 2.311 2.678 . 0 0 "[ . 1]" 1 2285 2 36 PRO QG 2 39 PRO HA 2.785 . 3.770 2.662 2.378 3.068 . 0 0 "[ . 1]" 1 2286 2 36 PRO QG 2 39 PRO HD3 3.160 . 4.520 4.026 3.630 4.510 . 0 0 "[ . 1]" 1 2287 2 37 SER H 2 37 SER QB 2.545 . 3.290 2.425 2.251 2.655 . 0 0 "[ . 1]" 1 2288 2 38 ASN HA 2 39 PRO HD2 2.380 . 2.960 1.961 1.896 2.009 . 0 0 "[ . 1]" 1 2289 2 38 ASN HA 2 39 PRO HD3 2.410 . 3.020 2.465 2.348 2.546 . 0 0 "[ . 1]" 1 2290 2 38 ASN HA 2 39 PRO HG2 3.145 . 4.490 4.165 4.100 4.214 . 0 0 "[ . 1]" 1 2291 2 38 ASN HA 2 39 PRO HG3 3.145 . 4.490 4.388 4.351 4.430 . 0 0 "[ . 1]" 1 2292 2 38 ASN QB 2 41 GLN QB 2.620 . 3.440 2.572 1.837 3.540 0.100 2 0 "[ . 1]" 1 2293 2 38 ASN HB2 2 39 PRO HD2 3.205 . 4.610 4.325 3.663 4.671 0.061 1 0 "[ . 1]" 1 2294 2 38 ASN HB2 2 39 PRO HD3 3.465 . 5.130 4.975 4.713 5.144 0.014 7 0 "[ . 1]" 1 2295 2 38 ASN HB2 2 41 GLN QG 3.125 . 4.450 3.777 2.768 4.534 0.084 8 0 "[ . 1]" 1 2296 2 38 ASN HB3 2 39 PRO HD2 3.205 . 4.610 4.223 3.648 4.608 . 0 0 "[ . 1]" 1 2297 2 38 ASN HB3 2 39 PRO HD3 3.465 . 5.130 4.955 4.618 5.156 0.026 4 0 "[ . 1]" 1 2298 2 38 ASN HB3 2 41 GLN QG 3.125 . 4.450 3.269 2.161 4.445 . 0 0 "[ . 1]" 1 2299 2 39 PRO HA 2 42 GLU QB 2.755 . 3.710 3.181 2.528 3.715 0.005 5 0 "[ . 1]" 1 2300 2 39 PRO HA 2 42 GLU QG 3.125 . 4.450 2.539 2.146 2.865 . 0 0 "[ . 1]" 1 2301 2 39 PRO QG 2 40 TYR QD 3.350 . 4.900 3.032 2.673 3.494 . 0 0 "[ . 1]" 1 2302 2 39 PRO QG 2 40 TYR QE 3.255 . 4.710 3.106 2.890 3.511 . 0 0 "[ . 1]" 1 2303 2 39 PRO HG2 2 40 TYR QE 3.570 . 5.340 3.200 2.969 3.629 . 0 0 "[ . 1]" 1 2304 2 39 PRO HG3 2 40 TYR QE 3.570 . 5.340 4.207 3.885 4.668 . 0 0 "[ . 1]" 1 2305 2 40 TYR HA 2 40 TYR QD 2.750 . 3.700 2.789 2.591 2.949 . 0 0 "[ . 1]" 1 2306 2 41 GLN H 2 41 GLN QB 2.745 . 3.690 2.276 2.071 2.444 . 0 0 "[ . 1]" 1 2307 2 41 GLN H 2 41 GLN QG 3.270 . 4.740 3.051 2.293 4.044 . 0 0 "[ . 1]" 1 2308 2 41 GLN HA 2 41 GLN QG 2.635 . 3.470 2.564 2.280 2.822 . 0 0 "[ . 1]" 1 2309 2 41 GLN HA 2 44 LEU QB 2.735 . 3.670 2.564 2.180 2.913 . 0 0 "[ . 1]" 1 2310 2 41 GLN HA 2 44 LEU MD1 2.915 . 4.030 3.573 2.744 4.094 0.064 6 0 "[ . 1]" 1 2311 2 41 GLN HA 2 44 LEU HG 3.420 . 5.040 4.216 3.609 4.790 . 0 0 "[ . 1]" 1 2312 2 41 GLN QG 2 44 LEU QB 3.355 . 4.910 4.116 3.570 4.804 . 0 0 "[ . 1]" 1 2313 2 41 GLN QG 2 44 LEU MD1 3.235 . 4.670 4.545 3.975 4.786 0.116 5 0 "[ . 1]" 1 2314 2 42 GLU HA 2 42 GLU QG 2.545 . 3.290 2.941 2.871 3.039 . 0 0 "[ . 1]" 1 2315 2 42 GLU HA 2 45 SER HA 3.275 . 4.750 4.457 3.644 4.767 0.017 1 0 "[ . 1]" 1 2316 2 42 GLU HA 2 45 SER QB 2.925 . 4.050 3.814 3.285 4.165 0.115 10 0 "[ . 1]" 1 2317 2 42 GLU QB 2 42 GLU QG 2.075 . 2.350 1.994 1.986 2.003 . 0 0 "[ . 1]" 1 2318 2 43 GLN HA 2 43 GLN QG 2.685 . 3.570 2.766 2.497 3.345 . 0 0 "[ . 1]" 1 2319 2 43 GLN QB 2 44 LEU MD1 3.240 . 4.680 4.145 3.922 4.682 0.002 2 0 "[ . 1]" 1 2320 2 43 GLN QB 2 44 LEU MD2 3.320 . 4.840 3.520 3.273 4.079 . 0 0 "[ . 1]" 1 2321 2 43 GLN QB 2 44 LEU HG 3.005 . 4.210 2.848 2.602 3.598 . 0 0 "[ . 1]" 1 2322 2 43 GLN HB2 2 44 LEU MD1 3.650 . 5.500 4.596 4.081 5.531 0.031 6 0 "[ . 1]" 1 2323 2 43 GLN HB2 2 44 LEU MD2 3.650 . 5.500 4.008 3.566 5.059 . 0 0 "[ . 1]" 1 2324 2 43 GLN HB3 2 44 LEU MD1 3.650 . 5.500 5.110 4.117 5.614 0.114 2 0 "[ . 1]" 1 2325 2 43 GLN HB3 2 44 LEU MD2 3.650 . 5.500 4.167 3.589 5.437 . 0 0 "[ . 1]" 1 2326 2 43 GLN QG 2 44 LEU MD1 3.615 . 5.430 4.830 2.988 5.461 0.031 7 0 "[ . 1]" 1 2327 2 43 GLN QG 2 44 LEU MD2 3.650 . 5.500 4.404 3.226 5.195 . 0 0 "[ . 1]" 1 2328 2 43 GLN QG 2 44 LEU HG 3.225 . 4.650 3.891 1.759 4.665 0.041 10 0 "[ . 1]" 1 2329 2 44 LEU H 2 44 LEU HG 3.200 . 4.600 2.412 2.209 2.626 . 0 0 "[ . 1]" 1 2330 2 44 LEU HA 2 44 LEU QB 2.370 . 2.940 2.337 2.314 2.357 . 0 0 "[ . 1]" 1 2331 2 44 LEU HA 2 44 LEU MD1 3.005 . 4.210 3.920 3.897 3.959 . 0 0 "[ . 1]" 1 2332 2 44 LEU HA 2 44 LEU MD2 2.365 . 2.930 2.179 2.110 2.313 . 0 0 "[ . 1]" 1 2333 2 44 LEU HA 2 44 LEU HG 2.850 . 3.900 3.104 2.962 3.165 . 0 0 "[ . 1]" 1 2334 2 44 LEU QB 2 44 LEU MD1 2.370 . 2.940 2.085 2.064 2.096 . 0 0 "[ . 1]" 1 2335 2 44 LEU QB 2 44 LEU MD2 2.460 . 3.120 2.251 2.203 2.277 . 0 0 "[ . 1]" 1 2336 2 45 SER HA 2 47 THR H 3.000 . 4.200 2.772 2.539 3.684 . 0 0 "[ . 1]" 1 2337 2 45 SER QB 2 47 THR HB 3.420 . 5.040 5.078 4.593 5.179 0.139 3 0 "[ . 1]" 1 2338 2 45 SER HB2 2 47 THR H 3.175 . 4.550 3.655 2.619 4.380 . 0 0 "[ . 1]" 1 2339 2 45 SER HB2 2 49 LEU MD1 3.650 . 5.500 5.377 4.857 5.677 0.177 6 0 "[ . 1]" 1 2340 2 45 SER HB3 2 47 THR H 3.175 . 4.550 3.908 2.858 4.450 . 0 0 "[ . 1]" 1 2341 2 45 SER HB3 2 49 LEU MD1 3.650 . 5.500 5.153 4.715 5.546 0.046 8 0 "[ . 1]" 1 2342 2 46 ASP HA 2 46 ASP QB 2.330 . 2.860 2.271 2.171 2.427 . 0 0 "[ . 1]" 1 2343 2 46 ASP HA 2 47 THR H 2.610 . 3.420 3.235 2.896 3.361 . 0 0 "[ . 1]" 1 2344 2 46 ASP QB 2 47 THR H 3.010 . 4.220 3.557 3.045 4.019 . 0 0 "[ . 1]" 1 2345 2 47 THR H 2 47 THR HB 2.685 . 3.570 3.535 3.448 3.673 0.103 6 0 "[ . 1]" 1 2346 2 47 THR H 2 47 THR MG 2.800 . 3.800 3.066 2.939 3.343 . 0 0 "[ . 1]" 1 2347 2 47 THR H 2 48 PRO HD3 3.405 . 5.010 4.832 4.754 4.925 . 0 0 "[ . 1]" 1 2348 2 47 THR HA 2 47 THR MG 2.410 . 3.020 2.221 2.189 2.247 . 0 0 "[ . 1]" 1 2349 2 47 THR HA 2 48 PRO HD2 2.405 . 3.010 2.207 2.098 2.333 . 0 0 "[ . 1]" 1 2350 2 47 THR HA 2 48 PRO HD3 2.280 . 2.760 2.294 2.232 2.362 . 0 0 "[ . 1]" 1 2351 2 47 THR HA 2 48 PRO QG 2.965 . 4.130 3.903 3.853 3.952 . 0 0 "[ . 1]" 1 2352 2 47 THR HB 2 48 PRO HD2 2.510 . 3.220 2.857 2.646 3.107 . 0 0 "[ . 1]" 1 2353 2 47 THR HB 2 48 PRO HD3 3.065 . 4.330 4.113 3.894 4.328 . 0 0 "[ . 1]" 1 2354 2 47 THR MG 2 48 PRO HD2 2.760 . 3.720 2.825 2.557 2.985 . 0 0 "[ . 1]" 1 2355 2 47 THR MG 2 48 PRO HD3 2.820 . 3.840 3.762 3.497 3.865 0.025 8 0 "[ . 1]" 1 2356 2 48 PRO HA 2 49 LEU H 2.230 . 2.660 2.263 2.183 2.321 . 0 0 "[ . 1]" 1 2357 2 48 PRO HA 2 49 LEU HB2 3.265 . 4.730 4.514 4.404 4.570 . 0 0 "[ . 1]" 1 2358 2 48 PRO HA 2 49 LEU MD1 3.615 . 5.430 5.292 5.155 5.405 . 0 0 "[ . 1]" 1 2359 2 48 PRO HA 2 49 LEU HG 3.310 . 4.820 4.208 4.009 4.421 . 0 0 "[ . 1]" 1 2360 2 48 PRO HB2 2 49 LEU H 2.770 . 3.740 2.999 2.820 3.259 . 0 0 "[ . 1]" 1 2361 2 48 PRO HB2 2 50 ILE MD 3.650 . 5.500 5.187 4.917 5.511 0.011 4 0 "[ . 1]" 1 2362 2 48 PRO HB2 2 50 ILE HG12 3.590 . 5.380 4.795 4.452 5.107 . 0 0 "[ . 1]" 1 2363 2 48 PRO HB2 2 50 ILE HG13 3.290 . 4.780 4.341 4.148 4.649 . 0 0 "[ . 1]" 1 2364 2 48 PRO HB3 2 49 LEU H 2.815 . 3.830 3.678 3.575 3.797 . 0 0 "[ . 1]" 1 2365 2 49 LEU H 2 49 LEU HB2 2.410 . 3.020 2.349 2.290 2.407 . 0 0 "[ . 1]" 1 2366 2 49 LEU H 2 49 LEU HB3 2.750 . 3.700 3.590 3.553 3.614 . 0 0 "[ . 1]" 1 2367 2 49 LEU H 2 49 LEU MD1 2.855 . 3.910 3.891 3.840 3.930 0.020 3 0 "[ . 1]" 1 2368 2 49 LEU H 2 49 LEU MD2 2.965 . 4.130 3.808 3.514 3.948 . 0 0 "[ . 1]" 1 2369 2 49 LEU H 2 49 LEU HG 2.565 . 3.330 2.966 2.771 3.081 . 0 0 "[ . 1]" 1 2370 2 49 LEU H 2 50 ILE H 3.210 . 4.620 4.420 4.377 4.512 . 0 0 "[ . 1]" 1 2371 2 49 LEU HA 2 49 LEU MD1 2.865 . 3.930 3.818 3.793 3.835 . 0 0 "[ . 1]" 1 2372 2 49 LEU HA 2 49 LEU MD2 2.610 . 3.420 1.930 1.889 1.966 . 0 0 "[ . 1]" 1 2373 2 49 LEU HA 2 49 LEU HG 2.825 . 3.850 2.974 2.856 3.150 . 0 0 "[ . 1]" 1 2374 2 49 LEU HA 2 50 ILE H 2.375 . 2.950 2.126 2.104 2.152 . 0 0 "[ . 1]" 1 2375 2 49 LEU HA 2 50 ILE HB 3.270 . 4.740 4.677 4.609 4.735 . 0 0 "[ . 1]" 1 2376 2 49 LEU HA 2 50 ILE HG12 3.550 . 5.300 5.302 5.251 5.333 0.033 10 0 "[ . 1]" 1 2377 2 49 LEU HA 2 50 ILE HG13 2.945 . 4.090 3.913 3.854 3.966 . 0 0 "[ . 1]" 1 2378 2 49 LEU HB2 2 49 LEU MD1 2.495 . 3.190 2.312 2.279 2.377 . 0 0 "[ . 1]" 1 2379 2 49 LEU HB2 2 49 LEU MD2 2.845 . 3.890 3.188 3.183 3.193 . 0 0 "[ . 1]" 1 2380 2 49 LEU HB2 2 50 ILE H 3.115 . 4.430 4.326 4.190 4.403 . 0 0 "[ . 1]" 1 2381 2 49 LEU HB3 2 49 LEU MD1 2.675 . 3.550 2.347 2.278 2.375 . 0 0 "[ . 1]" 1 2382 2 49 LEU HB3 2 49 LEU MD2 2.650 . 3.500 2.359 2.320 2.425 . 0 0 "[ . 1]" 1 2383 2 49 LEU HB3 2 50 ILE H 2.645 . 3.490 3.382 3.120 3.497 0.007 6 0 "[ . 1]" 1 2384 2 49 LEU HB3 2 50 ILE HA 3.340 . 4.880 4.435 4.212 4.621 . 0 0 "[ . 1]" 1 2385 2 49 LEU MD1 2 50 ILE H 3.415 . 5.030 5.012 4.837 5.088 0.058 6 0 "[ . 1]" 1 2386 2 49 LEU MD2 2 50 ILE H 3.045 . 4.290 3.318 3.220 3.427 . 0 0 "[ . 1]" 1 2387 2 49 LEU HG 2 50 ILE H 3.490 . 5.180 4.998 4.910 5.146 . 0 0 "[ . 1]" 1 2388 2 50 ILE H 2 50 ILE HB 2.515 . 3.230 2.568 2.517 2.617 . 0 0 "[ . 1]" 1 2389 2 50 ILE H 2 50 ILE MD 3.035 . 4.270 3.708 3.618 3.865 . 0 0 "[ . 1]" 1 2390 2 50 ILE H 2 50 ILE HG12 3.015 . 4.230 3.759 3.644 3.912 . 0 0 "[ . 1]" 1 2391 2 50 ILE H 2 50 ILE HG13 2.620 . 3.440 2.479 2.330 2.695 . 0 0 "[ . 1]" 1 2392 2 50 ILE H 2 50 ILE MG 2.935 . 4.070 3.814 3.792 3.835 . 0 0 "[ . 1]" 1 2393 2 50 ILE H 2 51 PRO HA 3.635 . 5.470 5.186 5.053 5.318 . 0 0 "[ . 1]" 1 2394 2 50 ILE H 2 52 LEU QD 3.335 . 4.870 3.975 3.894 4.067 . 0 0 "[ . 1]" 1 2395 2 50 ILE HA 2 50 ILE MD 2.890 . 3.980 3.877 3.859 3.891 . 0 0 "[ . 1]" 1 2396 2 50 ILE HA 2 50 ILE HG12 2.715 . 3.630 2.619 2.583 2.645 . 0 0 "[ . 1]" 1 2397 2 50 ILE HA 2 50 ILE HG13 2.790 . 3.780 2.980 2.965 2.991 . 0 0 "[ . 1]" 1 2398 2 50 ILE HA 2 50 ILE MG 2.455 . 3.110 2.364 2.337 2.394 . 0 0 "[ . 1]" 1 2399 2 50 ILE HA 2 51 PRO HA 3.205 . 4.610 4.470 4.433 4.478 . 0 0 "[ . 1]" 1 2400 2 50 ILE HA 2 51 PRO HB3 3.375 . 4.950 4.887 4.842 4.954 0.004 6 0 "[ . 1]" 1 2401 2 50 ILE HA 2 51 PRO HD2 2.380 . 2.960 2.155 2.042 2.662 . 0 0 "[ . 1]" 1 2402 2 50 ILE HA 2 51 PRO HD3 2.345 . 2.890 2.231 1.853 2.304 . 0 0 "[ . 1]" 1 2403 2 50 ILE HA 2 51 PRO HG3 3.120 . 4.440 4.313 4.063 4.372 . 0 0 "[ . 1]" 1 2404 2 50 ILE HA 2 52 LEU QD 3.495 . 5.190 4.240 4.169 4.308 . 0 0 "[ . 1]" 1 2405 2 50 ILE HB 2 50 ILE MD 2.485 . 3.170 2.383 2.367 2.398 . 0 0 "[ . 1]" 1 2406 2 50 ILE HB 2 51 PRO HD2 3.455 . 5.110 4.319 4.278 4.393 . 0 0 "[ . 1]" 1 2407 2 50 ILE HB 2 51 PRO HD3 3.405 . 5.010 4.937 4.569 4.997 . 0 0 "[ . 1]" 1 2408 2 50 ILE HG12 2 50 ILE MG 2.400 . 3.000 2.339 2.326 2.352 . 0 0 "[ . 1]" 1 2409 2 50 ILE HG12 2 51 PRO HD2 3.105 . 4.410 3.949 3.843 4.302 . 0 0 "[ . 1]" 1 2410 2 50 ILE HG12 2 51 PRO HD3 3.410 . 5.020 4.661 4.149 4.784 . 0 0 "[ . 1]" 1 2411 2 50 ILE HG13 2 50 ILE MG 2.525 . 3.250 3.202 3.198 3.204 . 0 0 "[ . 1]" 1 2412 2 50 ILE HG13 2 51 PRO HD2 3.290 . 4.780 4.887 4.823 5.266 0.486 9 0 "[ . 1]" 1 2413 2 50 ILE MG 2 51 PRO HA 3.025 . 4.250 4.065 4.032 4.093 . 0 0 "[ . 1]" 1 2414 2 50 ILE MG 2 51 PRO HD2 2.535 . 3.270 2.237 2.147 2.291 . 0 0 "[ . 1]" 1 2415 2 50 ILE MG 2 51 PRO HD3 2.680 . 3.560 3.475 2.944 3.573 0.013 3 0 "[ . 1]" 1 2416 2 50 ILE MG 2 51 PRO HG2 2.870 . 3.940 3.639 3.531 3.992 0.052 9 0 "[ . 1]" 1 2417 2 50 ILE MG 2 51 PRO HG3 3.110 . 4.420 4.493 4.437 4.531 0.111 3 0 "[ . 1]" 1 2418 2 50 ILE MG 2 52 LEU HA 3.290 . 4.780 4.137 3.998 4.229 . 0 0 "[ . 1]" 1 2419 2 51 PRO HA 2 52 LEU H 2.270 . 2.740 2.155 2.145 2.167 . 0 0 "[ . 1]" 1 2420 2 51 PRO HA 2 52 LEU HA 3.190 . 4.580 4.402 4.385 4.410 . 0 0 "[ . 1]" 1 2421 2 51 PRO HA 2 52 LEU HB2 3.155 . 4.510 4.450 4.389 4.496 . 0 0 "[ . 1]" 1 2422 2 51 PRO HA 2 52 LEU QD 2.905 . 4.010 3.104 2.963 3.187 . 0 0 "[ . 1]" 1 2423 2 51 PRO HA 2 52 LEU HG 3.430 . 5.060 4.824 4.724 4.922 . 0 0 "[ . 1]" 1 2424 2 51 PRO HB2 2 52 LEU H 2.865 . 3.930 3.377 3.333 3.425 . 0 0 "[ . 1]" 1 2425 2 51 PRO HB3 2 52 LEU H 2.895 . 3.990 3.919 3.869 3.947 . 0 0 "[ . 1]" 1 2426 2 51 PRO HG2 2 52 LEU H 3.405 . 5.010 4.889 4.800 5.038 0.028 9 0 "[ . 1]" 1 2427 2 51 PRO HG2 2 52 LEU QD 3.620 . 5.440 4.940 4.870 5.158 . 0 0 "[ . 1]" 1 2428 2 51 PRO HG3 2 52 LEU H 3.650 . 5.500 5.558 5.532 5.584 0.084 8 0 "[ . 1]" 1 2429 2 52 LEU H 2 52 LEU HB2 2.545 . 3.290 2.661 2.600 2.716 . 0 0 "[ . 1]" 1 2430 2 52 LEU H 2 52 LEU HB3 2.805 . 3.810 3.784 3.751 3.814 0.004 2 0 "[ . 1]" 1 2431 2 52 LEU H 2 52 LEU QD 2.745 . 3.690 2.734 2.685 2.800 . 0 0 "[ . 1]" 1 2432 2 52 LEU H 2 52 LEU HG 2.890 . 3.980 3.864 3.818 3.922 . 0 0 "[ . 1]" 1 2433 2 52 LEU HA 2 52 LEU MD1 2.875 . 3.950 3.344 3.304 3.396 . 0 0 "[ . 1]" 1 2434 2 52 LEU HA 2 52 LEU MD2 2.875 . 3.950 3.467 3.432 3.510 . 0 0 "[ . 1]" 1 2435 2 52 LEU HA 2 52 LEU HG 2.865 . 3.930 2.387 2.366 2.407 . 0 0 "[ . 1]" 1 2436 2 52 LEU HA 2 53 THR H 2.275 . 2.750 2.144 2.111 2.167 . 0 0 "[ . 1]" 1 2437 2 52 LEU HA 2 53 THR HB 3.520 . 5.240 4.739 4.664 4.810 . 0 0 "[ . 1]" 1 2438 2 52 LEU HB2 2 52 LEU QD 2.445 . 3.090 2.092 2.087 2.096 . 0 0 "[ . 1]" 1 2439 2 52 LEU HB2 2 53 THR H 3.125 . 4.450 4.175 4.130 4.223 . 0 0 "[ . 1]" 1 2440 2 52 LEU HB2 2 54 ILE MD 3.415 . 5.030 4.311 4.140 4.543 . 0 0 "[ . 1]" 1 2441 2 52 LEU HB3 2 52 LEU QD 2.440 . 3.080 2.130 2.117 2.140 . 0 0 "[ . 1]" 1 2442 2 52 LEU HB3 2 53 THR H 2.670 . 3.540 3.156 3.079 3.247 . 0 0 "[ . 1]" 1 2443 2 52 LEU HB3 2 53 THR HA 3.295 . 4.790 4.574 4.526 4.626 . 0 0 "[ . 1]" 1 2444 2 52 LEU HB3 2 54 ILE HG12 3.030 . 4.260 3.841 3.684 4.024 . 0 0 "[ . 1]" 1 2445 2 52 LEU QD 2 53 THR H 3.110 . 4.420 4.094 4.031 4.139 . 0 0 "[ . 1]" 1 2446 2 52 LEU HG 2 53 THR H 3.160 . 4.520 4.252 4.207 4.319 . 0 0 "[ . 1]" 1 2447 2 53 THR H 2 53 THR HB 2.550 . 3.300 2.706 2.648 2.748 . 0 0 "[ . 1]" 1 2448 2 53 THR H 2 53 THR MG 2.925 . 4.050 3.860 3.840 3.867 . 0 0 "[ . 1]" 1 2449 2 53 THR HA 2 53 THR MG 2.460 . 3.120 2.287 2.266 2.316 . 0 0 "[ . 1]" 1 2450 2 53 THR HA 2 54 ILE H 2.315 . 2.830 2.149 2.143 2.154 . 0 0 "[ . 1]" 1 2451 2 53 THR HA 2 54 ILE HB 3.315 . 4.830 4.641 4.627 4.657 . 0 0 "[ . 1]" 1 2452 2 53 THR HA 2 54 ILE HG13 2.890 . 3.980 3.812 3.736 3.880 . 0 0 "[ . 1]" 1 2453 2 53 THR HB 2 54 ILE H 3.245 . 4.690 4.170 4.134 4.213 . 0 0 "[ . 1]" 1 2454 2 53 THR MG 2 54 ILE H 2.555 . 3.310 2.924 2.842 2.966 . 0 0 "[ . 1]" 1 2455 2 53 THR MG 2 55 PHE HB3 3.650 . 5.500 5.577 5.554 5.598 0.098 3 0 "[ . 1]" 1 2456 2 53 THR MG 2 55 PHE QD 2.710 . 3.620 3.320 3.288 3.417 . 0 0 "[ . 1]" 1 2457 2 53 THR MG 2 55 PHE HZ 2.790 . 3.780 2.874 2.735 2.996 . 0 0 "[ . 1]" 1 2458 2 54 ILE H 2 54 ILE HB 2.575 . 3.350 2.594 2.578 2.605 . 0 0 "[ . 1]" 1 2459 2 54 ILE H 2 54 ILE MD 3.145 . 4.490 4.032 3.999 4.069 . 0 0 "[ . 1]" 1 2460 2 54 ILE H 2 54 ILE HG12 3.090 . 4.380 3.697 3.659 3.739 . 0 0 "[ . 1]" 1 2461 2 54 ILE H 2 54 ILE HG13 2.700 . 3.600 2.684 2.643 2.741 . 0 0 "[ . 1]" 1 2462 2 54 ILE H 2 54 ILE MG 2.820 . 3.840 3.829 3.822 3.837 . 0 0 "[ . 1]" 1 2463 2 54 ILE H 2 55 PHE H 3.350 . 4.900 4.357 4.322 4.387 . 0 0 "[ . 1]" 1 2464 2 54 ILE HA 2 54 ILE MD 2.835 . 3.870 3.767 3.751 3.786 . 0 0 "[ . 1]" 1 2465 2 54 ILE HA 2 54 ILE HG12 2.575 . 3.350 2.461 2.436 2.486 . 0 0 "[ . 1]" 1 2466 2 54 ILE HA 2 54 ILE HG13 2.675 . 3.550 3.150 3.110 3.169 . 0 0 "[ . 1]" 1 2467 2 54 ILE HA 2 54 ILE MG 2.445 . 3.090 2.382 2.364 2.400 . 0 0 "[ . 1]" 1 2468 2 54 ILE HA 2 55 PHE H 2.310 . 2.820 2.103 2.090 2.120 . 0 0 "[ . 1]" 1 2469 2 54 ILE HA 2 55 PHE HA 3.225 . 4.650 4.380 4.375 4.387 . 0 0 "[ . 1]" 1 2470 2 54 ILE HA 2 55 PHE HB2 3.185 . 4.570 4.479 4.456 4.521 . 0 0 "[ . 1]" 1 2471 2 54 ILE HA 2 55 PHE QD 3.185 . 4.570 3.429 3.282 3.595 . 0 0 "[ . 1]" 1 2472 2 54 ILE HB 2 54 ILE MD 2.580 . 3.360 2.508 2.493 2.517 . 0 0 "[ . 1]" 1 2473 2 54 ILE MD 2 54 ILE MG 2.240 . 2.680 1.862 1.842 1.898 . 0 0 "[ . 1]" 1 2474 2 54 ILE MD 2 55 PHE H 3.365 . 4.930 5.014 4.973 5.062 0.132 1 0 "[ . 1]" 1 2475 2 54 ILE HG12 2 54 ILE MG 2.290 . 2.780 2.464 2.443 2.477 . 0 0 "[ . 1]" 1 2476 2 54 ILE HG12 2 55 PHE H 3.275 . 4.750 4.350 4.291 4.378 . 0 0 "[ . 1]" 1 2477 2 54 ILE HG13 2 54 ILE MG 2.565 . 3.330 3.201 3.197 3.204 . 0 0 "[ . 1]" 1 2478 2 54 ILE HG13 2 55 PHE H 3.650 . 5.500 5.121 5.074 5.143 . 0 0 "[ . 1]" 1 2479 2 54 ILE MG 2 55 PHE H 2.480 . 3.160 2.694 2.622 2.780 . 0 0 "[ . 1]" 1 2480 2 54 ILE MG 2 55 PHE HA 3.010 . 4.220 3.697 3.629 3.773 . 0 0 "[ . 1]" 1 2481 2 54 ILE MG 2 55 PHE HB2 3.315 . 4.830 4.563 4.489 4.635 . 0 0 "[ . 1]" 1 2482 2 54 ILE MG 2 55 PHE HB3 3.605 . 5.410 5.175 5.095 5.257 . 0 0 "[ . 1]" 1 2483 2 54 ILE MG 2 56 VAL H 3.095 . 4.390 4.263 4.190 4.392 0.002 7 0 "[ . 1]" 1 2484 2 54 ILE MG 2 56 VAL HA 3.070 . 4.340 4.045 4.001 4.085 . 0 0 "[ . 1]" 1 2485 2 54 ILE MG 2 56 VAL HB 3.585 . 5.370 5.144 4.548 5.381 0.011 2 0 "[ . 1]" 1 2486 2 55 PHE H 2 55 PHE HB2 2.610 . 3.420 2.492 2.474 2.527 . 0 0 "[ . 1]" 1 2487 2 55 PHE H 2 55 PHE HB3 2.785 . 3.770 3.684 3.673 3.702 . 0 0 "[ . 1]" 1 2488 2 55 PHE H 2 55 PHE QD 2.830 . 3.860 2.545 2.391 2.707 . 0 0 "[ . 1]" 1 2489 2 55 PHE H 2 56 VAL H 3.200 . 4.600 4.451 4.426 4.472 . 0 0 "[ . 1]" 1 2490 2 55 PHE HA 2 55 PHE QD 2.855 . 3.910 3.094 3.017 3.159 . 0 0 "[ . 1]" 1 2491 2 55 PHE HA 2 56 VAL H 2.265 . 2.730 2.190 2.167 2.217 . 0 0 "[ . 1]" 1 2492 2 55 PHE HA 2 56 VAL HA 3.200 . 4.600 4.372 4.355 4.385 . 0 0 "[ . 1]" 1 2493 2 55 PHE HA 2 56 VAL HB 3.155 . 4.510 4.421 4.241 4.524 0.014 8 0 "[ . 1]" 1 2494 2 55 PHE HB2 2 56 VAL H 3.035 . 4.270 4.124 4.042 4.203 . 0 0 "[ . 1]" 1 2495 2 55 PHE HB3 2 56 VAL H 2.725 . 3.650 3.086 2.979 3.226 . 0 0 "[ . 1]" 1 2496 2 55 PHE HB3 2 56 VAL MG1 3.650 . 5.500 5.186 4.159 5.598 0.098 8 0 "[ . 1]" 1 2497 2 55 PHE HB3 2 56 VAL MG2 3.650 . 5.500 5.446 5.150 5.695 0.195 3 0 "[ . 1]" 1 2498 2 55 PHE QD 2 56 VAL H 3.395 . 4.990 4.113 3.946 4.242 . 0 0 "[ . 1]" 1 2499 2 56 VAL H 2 56 VAL HB 2.410 . 3.020 2.367 2.214 2.720 . 0 0 "[ . 1]" 1 2500 2 56 VAL H 2 56 VAL QG 2.500 . 3.200 2.654 1.947 2.915 . 0 0 "[ . 1]" 1 2501 2 56 VAL HA 2 56 VAL MG1 2.560 . 3.320 2.788 2.495 3.208 . 0 0 "[ . 1]" 1 2502 2 56 VAL HA 2 56 VAL QG 2.290 . 2.780 2.108 2.047 2.285 . 0 0 "[ . 1]" 1 2503 2 56 VAL HA 2 56 VAL MG2 2.560 . 3.320 2.193 2.112 2.339 . 0 0 "[ . 1]" 1 2504 2 56 VAL HA 2 57 GLY H 2.270 . 2.740 2.171 2.127 2.257 . 0 0 "[ . 1]" 1 2505 2 56 VAL QG 2 57 GLY H 2.495 . 3.190 2.538 2.291 2.885 . 0 0 "[ . 1]" 1 2506 2 56 VAL QG 2 57 GLY HA2 3.125 . 4.450 3.353 2.896 3.826 . 0 0 "[ . 1]" 1 2507 2 56 VAL QG 2 57 GLY HA3 3.035 . 4.270 3.740 3.374 3.857 . 0 0 "[ . 1]" 1 2508 2 56 VAL MG1 2 57 GLY HA2 3.500 . 5.200 3.468 2.911 3.937 . 0 0 "[ . 1]" 1 2509 2 56 VAL MG1 2 57 GLY HA3 3.460 . 5.120 4.002 3.407 4.890 . 0 0 "[ . 1]" 1 2510 2 56 VAL MG2 2 57 GLY HA2 3.500 . 5.200 4.984 3.821 5.374 0.174 6 0 "[ . 1]" 1 2511 2 56 VAL MG2 2 57 GLY HA3 3.460 . 5.120 5.064 3.967 5.437 0.317 2 0 "[ . 1]" 1 2512 2 57 GLY H 2 58 GLU H 3.215 . 4.630 4.444 4.362 4.534 . 0 0 "[ . 1]" 1 2513 2 57 GLY H 2 58 GLU HA 3.625 . 5.450 5.093 4.807 5.468 0.018 6 0 "[ . 1]" 1 2514 2 57 GLY HA2 2 58 GLU QB 3.570 . 5.340 4.492 4.271 4.647 . 0 0 "[ . 1]" 1 2515 2 57 GLY HA3 2 58 GLU H 2.640 . 3.480 2.774 2.400 3.229 . 0 0 "[ . 1]" 1 2516 2 57 GLY HA3 2 58 GLU QG 3.230 . 4.660 4.497 4.019 4.945 0.285 10 0 "[ . 1]" 1 2517 2 58 GLU H 2 58 GLU QB 2.625 . 3.450 2.713 2.443 3.172 . 0 0 "[ . 1]" 1 2518 2 58 GLU H 2 58 GLU QG 2.920 . 4.040 2.231 1.880 2.791 . 0 0 "[ . 1]" 1 2519 2 58 GLU HA 2 58 GLU QG 2.715 . 3.630 2.994 2.411 3.414 . 0 0 "[ . 1]" 1 2520 2 58 GLU HA 2 59 ASN HB2 3.475 . 5.150 4.678 4.101 5.299 0.149 10 0 "[ . 1]" 1 2521 2 58 GLU HA 2 59 ASN HB3 3.475 . 5.150 4.950 4.272 5.425 0.275 4 0 "[ . 1]" 1 2522 2 60 THR HA 2 60 THR MG 2.645 . 3.490 2.476 2.232 3.219 . 0 0 "[ . 1]" 1 stop_ save_
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