NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
541807 | 2ltd | 18469 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2ltd 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 3211 _Distance_constraint_stats_list.Viol_count 1065 _Distance_constraint_stats_list.Viol_total 1466.223 _Distance_constraint_stats_list.Viol_max 0.451 _Distance_constraint_stats_list.Viol_rms 0.0117 _Distance_constraint_stats_list.Viol_average_all_restraints 0.0011 _Distance_constraint_stats_list.Viol_average_violations_only 0.0688 _Distance_constraint_stats_list.Cutoff_violation_report 0.500 _Distance_constraint_stats_list.Details ; Description of the tags in this list: * 1 * Administrative tag * 2 * Administrative tag * 3 * Administrative tag * 4 * ID of the restraint list. * 5 * Number of restraints in list. * 6 * Number of violated restraints (each model violation is used). * 7 * Sum of violations in Angstrom. * 8 * Maximum violation of a restraint without averaging in any way. * 9 * Rms of violations over all restraints. * 10 * Average violation over all restraints. * 11 * Average violation over violated restraints. This violation is averaged over only those models in which the restraint is violated. These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998). * 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table. * 13 * This tag Description of the tags in the per residue table below: * 1 * Chain identifier (can be absent if none defined) * 2 * Residue number * 3 * Residue name * 4 * Maximum violation in ensemble of models (without any averaging) * 5 * Model number with the maximum violation * 6 * Number of models with a violation above cutoff * 7 * List of models (1 character per model) with a violation above cutoff. An '*' marks a violation above the cutoff. A '+' indicates the largest violation above the cutoff and a '-' marks the smallest violation over cutoff. For models 5, 15, 25,... a ' ' is replaced by a '.'. For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1. * 8 * Administrative tag * 9 * Administrative tag Description of the tags in the per restraint table below: * 1 * Restraint ID within restraint list. First node, FIRST member, first atom's: * 2 * Chain identifier (can be absent if none defined) * 3 * Residue number * 4 * Residue name * 5 * Name of (pseudo-)atom First node, SECOND member, first atom's: * 6 * Chain identifier (can be absent if none defined) * 7 * Residue number * 8 * Residue name * 9 * Name of (pseudo-)atom FIRST node's: * 10 * Target distance value (Angstrom) * 11 * Lower bound distance (Angstrom) * 12 * Upper bound distance (Angstrom) * 13 * Average distance in ensemble of models * 14 * Minimum distance in ensemble of models * 15 * Maximum distance in ensemble of models * 16 * Maximum violation (without any averaging) * 17 * Model number with the maximum violation * 18 * Number of models with a violation above cutoff * 19 * List of models with a violation above cutoff. See description above. * 20 * Administrative tag * 21 * Administrative tag ; loop_ _Distance_constraint_stats_per_res.Atom_entity_assembly_ID _Distance_constraint_stats_per_res.Atom_comp_index_ID _Distance_constraint_stats_per_res.Atom_comp_ID _Distance_constraint_stats_per_res.Total_violation _Distance_constraint_stats_per_res.Max_violation _Distance_constraint_stats_per_res.Max_violation_model_number _Distance_constraint_stats_per_res.Over_cutoff_viol_count _Distance_constraint_stats_per_res.Over_cutoff_viol_per_model 1 3 ASP 0.000 0.000 . 0 "[ . 1 . 2]" 1 4 LYS 0.346 0.189 4 0 "[ . 1 . 2]" 1 5 LEU 3.198 0.266 13 0 "[ . 1 . 2]" 1 6 LYS 0.696 0.204 11 0 "[ . 1 . 2]" 1 7 PHE 0.093 0.034 8 0 "[ . 1 . 2]" 1 8 GLU 0.066 0.066 1 0 "[ . 1 . 2]" 1 9 ILE 0.469 0.182 2 0 "[ . 1 . 2]" 1 10 ILE 0.682 0.120 18 0 "[ . 1 . 2]" 1 11 GLU 1.086 0.337 2 0 "[ . 1 . 2]" 1 12 GLU 0.000 0.000 . 0 "[ . 1 . 2]" 1 13 LEU 1.357 0.198 15 0 "[ . 1 . 2]" 1 14 ILE 0.213 0.092 5 0 "[ . 1 . 2]" 1 15 VAL 0.575 0.172 7 0 "[ . 1 . 2]" 1 16 LEU 1.185 0.135 14 0 "[ . 1 . 2]" 1 17 SER 0.000 0.000 . 0 "[ . 1 . 2]" 1 18 GLU 0.000 0.000 . 0 "[ . 1 . 2]" 1 19 ASN 0.930 0.174 9 0 "[ . 1 . 2]" 1 20 ALA 0.000 0.000 . 0 "[ . 1 . 2]" 1 21 LYS 0.530 0.154 8 0 "[ . 1 . 2]" 1 22 GLY 0.000 0.000 . 0 "[ . 1 . 2]" 1 23 TRP 2.198 0.188 3 0 "[ . 1 . 2]" 1 24 ARG 1.750 0.160 6 0 "[ . 1 . 2]" 1 25 LYS 0.069 0.037 9 0 "[ . 1 . 2]" 1 26 GLU 0.648 0.172 7 0 "[ . 1 . 2]" 1 27 LEU 0.757 0.093 2 0 "[ . 1 . 2]" 1 28 ASN 0.773 0.136 18 0 "[ . 1 . 2]" 1 29 ARG 2.420 0.337 2 0 "[ . 1 . 2]" 1 30 VAL 0.486 0.103 14 0 "[ . 1 . 2]" 1 31 SER 0.121 0.066 1 0 "[ . 1 . 2]" 1 32 TRP 0.123 0.048 11 0 "[ . 1 . 2]" 1 33 ASN 2.862 0.266 13 0 "[ . 1 . 2]" 1 34 ASP 0.000 0.000 . 0 "[ . 1 . 2]" 1 35 ALA 0.245 0.087 5 0 "[ . 1 . 2]" 1 36 GLU 0.086 0.086 1 0 "[ . 1 . 2]" 1 37 PRO 0.474 0.108 18 0 "[ . 1 . 2]" 1 38 LYS 2.897 0.225 20 0 "[ . 1 . 2]" 1 39 TYR 0.712 0.105 2 0 "[ . 1 . 2]" 1 40 ASP 0.286 0.136 18 0 "[ . 1 . 2]" 1 41 ILE 0.243 0.041 1 0 "[ . 1 . 2]" 1 42 ARG 0.000 0.000 . 0 "[ . 1 . 2]" 1 43 THR 1.802 0.160 6 0 "[ . 1 . 2]" 1 44 TRP 0.642 0.094 10 0 "[ . 1 . 2]" 1 45 SER 0.814 0.127 3 0 "[ . 1 . 2]" 1 46 PRO 0.889 0.210 9 0 "[ . 1 . 2]" 1 47 ASP 0.710 0.210 9 0 "[ . 1 . 2]" 1 48 HIS 1.428 0.220 7 0 "[ . 1 . 2]" 1 49 GLU 1.233 0.220 7 0 "[ . 1 . 2]" 1 50 LYS 3.742 0.285 11 0 "[ . 1 . 2]" 1 51 MET 0.845 0.285 11 0 "[ . 1 . 2]" 1 52 GLY 0.000 0.000 . 0 "[ . 1 . 2]" 1 53 LYS 0.078 0.040 13 0 "[ . 1 . 2]" 1 54 GLY 0.289 0.082 4 0 "[ . 1 . 2]" 1 55 ILE 0.416 0.070 7 0 "[ . 1 . 2]" 1 56 THR 3.017 0.225 20 0 "[ . 1 . 2]" 1 57 LEU 1.538 0.314 6 0 "[ . 1 . 2]" 1 58 SER 0.760 0.130 6 0 "[ . 1 . 2]" 1 59 GLU 0.517 0.130 6 0 "[ . 1 . 2]" 1 60 GLU 0.154 0.058 1 0 "[ . 1 . 2]" 1 61 GLU 1.305 0.156 2 0 "[ . 1 . 2]" 1 62 PHE 1.610 0.314 6 0 "[ . 1 . 2]" 1 63 GLY 0.183 0.080 9 0 "[ . 1 . 2]" 1 64 VAL 1.326 0.175 12 0 "[ . 1 . 2]" 1 65 LEU 3.783 0.278 7 0 "[ . 1 . 2]" 1 66 LEU 3.148 0.259 6 0 "[ . 1 . 2]" 1 67 LYS 2.331 0.175 12 0 "[ . 1 . 2]" 1 68 GLU 0.075 0.065 11 0 "[ . 1 . 2]" 1 69 LEU 5.725 0.278 7 0 "[ . 1 . 2]" 1 70 GLY 0.000 0.000 . 0 "[ . 1 . 2]" 1 71 ASN 0.494 0.134 11 0 "[ . 1 . 2]" 1 72 LYS 1.463 0.192 6 0 "[ . 1 . 2]" 1 73 LEU 1.709 0.233 19 0 "[ . 1 . 2]" 1 74 GLU 0.047 0.047 9 0 "[ . 1 . 2]" 1 75 HIS 0.000 0.000 . 0 "[ . 1 . 2]" 2 3 ASP 0.000 0.000 . 0 "[ . 1 . 2]" 2 4 LYS 0.303 0.197 8 0 "[ . 1 . 2]" 2 5 LEU 4.367 0.451 19 0 "[ . 1 . 2]" 2 6 LYS 0.849 0.451 19 0 "[ . 1 . 2]" 2 7 PHE 0.313 0.085 14 0 "[ . 1 . 2]" 2 8 GLU 0.296 0.169 4 0 "[ . 1 . 2]" 2 9 ILE 0.276 0.169 4 0 "[ . 1 . 2]" 2 10 ILE 0.785 0.173 7 0 "[ . 1 . 2]" 2 11 GLU 0.465 0.262 7 0 "[ . 1 . 2]" 2 12 GLU 0.000 0.000 . 0 "[ . 1 . 2]" 2 13 LEU 0.520 0.135 17 0 "[ . 1 . 2]" 2 14 ILE 0.121 0.032 13 0 "[ . 1 . 2]" 2 15 VAL 0.883 0.175 17 0 "[ . 1 . 2]" 2 16 LEU 1.745 0.200 6 0 "[ . 1 . 2]" 2 17 SER 0.000 0.000 . 0 "[ . 1 . 2]" 2 18 GLU 2.976 0.346 9 0 "[ . 1 . 2]" 2 19 ASN 0.947 0.173 7 0 "[ . 1 . 2]" 2 20 ALA 0.000 0.000 . 0 "[ . 1 . 2]" 2 21 LYS 0.329 0.088 8 0 "[ . 1 . 2]" 2 22 GLY 0.000 0.000 . 0 "[ . 1 . 2]" 2 23 TRP 3.088 0.173 7 0 "[ . 1 . 2]" 2 24 ARG 4.824 0.346 9 0 "[ . 1 . 2]" 2 25 LYS 0.129 0.036 14 0 "[ . 1 . 2]" 2 26 GLU 0.998 0.175 17 0 "[ . 1 . 2]" 2 27 LEU 0.526 0.107 15 0 "[ . 1 . 2]" 2 28 ASN 0.451 0.083 6 0 "[ . 1 . 2]" 2 29 ARG 1.227 0.262 7 0 "[ . 1 . 2]" 2 30 VAL 0.380 0.091 5 0 "[ . 1 . 2]" 2 31 SER 0.000 0.000 . 0 "[ . 1 . 2]" 2 32 TRP 0.214 0.085 14 0 "[ . 1 . 2]" 2 33 ASN 3.789 0.286 14 0 "[ . 1 . 2]" 2 34 ASP 0.000 0.000 . 0 "[ . 1 . 2]" 2 35 ALA 0.058 0.058 5 0 "[ . 1 . 2]" 2 36 GLU 0.058 0.058 5 0 "[ . 1 . 2]" 2 37 PRO 0.556 0.091 8 0 "[ . 1 . 2]" 2 38 LYS 3.050 0.191 2 0 "[ . 1 . 2]" 2 39 TYR 0.718 0.190 15 0 "[ . 1 . 2]" 2 40 ASP 0.257 0.083 6 0 "[ . 1 . 2]" 2 41 ILE 0.510 0.084 3 0 "[ . 1 . 2]" 2 42 ARG 0.000 0.000 . 0 "[ . 1 . 2]" 2 43 THR 1.820 0.185 16 0 "[ . 1 . 2]" 2 44 TRP 0.233 0.057 20 0 "[ . 1 . 2]" 2 45 SER 0.620 0.126 19 0 "[ . 1 . 2]" 2 46 PRO 0.628 0.162 2 0 "[ . 1 . 2]" 2 47 ASP 0.317 0.162 2 0 "[ . 1 . 2]" 2 48 HIS 0.855 0.153 7 0 "[ . 1 . 2]" 2 49 GLU 1.033 0.153 7 0 "[ . 1 . 2]" 2 50 LYS 3.814 0.165 1 0 "[ . 1 . 2]" 2 51 MET 0.492 0.165 1 0 "[ . 1 . 2]" 2 52 GLY 0.000 0.000 . 0 "[ . 1 . 2]" 2 53 LYS 0.096 0.052 3 0 "[ . 1 . 2]" 2 54 GLY 0.311 0.084 3 0 "[ . 1 . 2]" 2 55 ILE 0.362 0.082 4 0 "[ . 1 . 2]" 2 56 THR 3.121 0.191 2 0 "[ . 1 . 2]" 2 57 LEU 1.005 0.107 15 0 "[ . 1 . 2]" 2 58 SER 0.678 0.190 15 0 "[ . 1 . 2]" 2 59 GLU 0.327 0.126 4 0 "[ . 1 . 2]" 2 60 GLU 0.000 0.000 . 0 "[ . 1 . 2]" 2 61 GLU 0.921 0.135 14 0 "[ . 1 . 2]" 2 62 PHE 0.847 0.087 4 0 "[ . 1 . 2]" 2 63 GLY 0.063 0.063 15 0 "[ . 1 . 2]" 2 64 VAL 1.431 0.172 17 0 "[ . 1 . 2]" 2 65 LEU 3.974 0.319 6 0 "[ . 1 . 2]" 2 66 LEU 2.859 0.233 19 0 "[ . 1 . 2]" 2 67 LYS 2.262 0.209 15 0 "[ . 1 . 2]" 2 68 GLU 0.535 0.209 15 0 "[ . 1 . 2]" 2 69 LEU 6.694 0.319 6 0 "[ . 1 . 2]" 2 70 GLY 0.023 0.023 7 0 "[ . 1 . 2]" 2 71 ASN 0.708 0.185 17 0 "[ . 1 . 2]" 2 72 LYS 1.445 0.285 7 0 "[ . 1 . 2]" 2 73 LEU 1.631 0.139 19 0 "[ . 1 . 2]" 2 74 GLU 0.069 0.069 9 0 "[ . 1 . 2]" 2 75 HIS 0.000 0.000 . 0 "[ . 1 . 2]" stop_ loop_ _Distance_constraint_stats.Restraint_ID _Distance_constraint_stats.Atom_1_entity_assembly_ID _Distance_constraint_stats.Atom_1_comp_index_ID _Distance_constraint_stats.Atom_1_comp_ID _Distance_constraint_stats.Atom_1_ID _Distance_constraint_stats.Atom_2_entity_assembly_ID _Distance_constraint_stats.Atom_2_comp_index_ID _Distance_constraint_stats.Atom_2_comp_ID _Distance_constraint_stats.Atom_2_ID _Distance_constraint_stats.Node_1_distance_val _Distance_constraint_stats.Node_1_distance_lower_bound_val _Distance_constraint_stats.Node_1_distance_upper_bound_val _Distance_constraint_stats.Distance_average _Distance_constraint_stats.Distance_minimum _Distance_constraint_stats.Distance_maximum _Distance_constraint_stats.Max_violation _Distance_constraint_stats.Max_violation_model_number _Distance_constraint_stats.Over_cutoff_violation_count _Distance_constraint_stats.Over_cutoff_viol_per_model _Distance_constraint_stats.Distance_constraint_stats_ID 1 1 3 ASP HA 1 4 LYS HA 4.860 . 5.590 4.679 4.450 4.886 . 0 0 "[ . 1 . 2]" 1 2 2 3 ASP HA 2 4 LYS HA 4.860 . 5.590 4.679 4.589 4.824 . 0 0 "[ . 1 . 2]" 1 3 1 50 LYS HA 1 51 MET ME 5.020 . 5.770 4.942 3.689 5.474 . 0 0 "[ . 1 . 2]" 1 4 2 50 LYS HA 2 51 MET ME 5.020 . 5.770 5.005 4.199 5.460 . 0 0 "[ . 1 . 2]" 1 5 1 50 LYS HA 1 50 LYS HG2 3.480 . 4.000 2.810 2.514 2.963 . 0 0 "[ . 1 . 2]" 1 6 2 50 LYS HA 2 50 LYS HG2 3.480 . 4.000 2.850 2.554 3.008 . 0 0 "[ . 1 . 2]" 1 7 1 4 LYS HA 1 4 LYS HG2 3.900 . 4.490 3.220 2.515 3.907 . 0 0 "[ . 1 . 2]" 1 8 2 4 LYS HA 2 4 LYS HG2 3.900 . 4.490 3.263 3.032 3.910 . 0 0 "[ . 1 . 2]" 1 9 1 4 LYS HA 1 4 LYS HG3 3.900 . 4.490 2.860 2.479 3.771 . 0 0 "[ . 1 . 2]" 1 10 2 4 LYS HA 2 4 LYS HG3 3.900 . 4.490 2.744 2.510 3.786 . 0 0 "[ . 1 . 2]" 1 11 1 4 LYS HA 1 5 LEU MD2 4.250 . 4.890 4.299 3.464 4.738 . 0 0 "[ . 1 . 2]" 1 12 2 4 LYS HA 2 5 LEU MD2 4.250 . 4.890 4.278 3.841 4.877 . 0 0 "[ . 1 . 2]" 1 13 1 5 LEU HA 1 33 ASN HD22 3.980 . 4.580 2.514 1.756 3.202 0.044 6 0 "[ . 1 . 2]" 1 14 2 5 LEU HA 2 33 ASN HD22 3.980 . 4.580 2.398 1.746 3.090 0.054 10 0 "[ . 1 . 2]" 1 15 1 4 LYS HA 1 5 LEU HA 4.480 . 5.150 4.446 4.250 4.517 . 0 0 "[ . 1 . 2]" 1 16 2 4 LYS HA 2 5 LEU HA 4.480 . 5.150 4.431 4.303 4.514 . 0 0 "[ . 1 . 2]" 1 17 2 5 LEU HA 2 5 LEU HB3 2.740 . 3.150 2.465 2.422 2.524 . 0 0 "[ . 1 . 2]" 1 18 1 5 LEU HA 1 6 LYS HG2 4.350 . 5.000 3.833 3.621 4.062 . 0 0 "[ . 1 . 2]" 1 19 2 5 LEU HA 2 6 LYS HG2 4.350 . 5.000 3.833 3.583 4.062 . 0 0 "[ . 1 . 2]" 1 20 1 6 LYS HA 1 32 TRP HE3 4.850 . 5.580 5.056 4.404 5.616 0.036 7 0 "[ . 1 . 2]" 1 21 2 6 LYS HA 2 32 TRP HE3 4.850 . 5.580 5.041 4.633 5.542 . 0 0 "[ . 1 . 2]" 1 22 1 6 LYS HA 1 7 PHE QD 3.880 . 4.460 3.359 3.060 3.666 . 0 0 "[ . 1 . 2]" 1 23 2 6 LYS HA 2 7 PHE HD1 3.880 . 4.460 3.351 3.083 3.605 . 0 0 "[ . 1 . 2]" 1 24 1 6 LYS HA 1 7 PHE HA 4.610 . 5.300 4.517 4.477 4.558 . 0 0 "[ . 1 . 2]" 1 25 2 6 LYS HA 2 7 PHE HA 4.610 . 5.300 4.518 4.475 4.574 . 0 0 "[ . 1 . 2]" 1 26 1 6 LYS HA 1 6 LYS HD2 3.740 . 4.300 2.229 2.065 2.332 . 0 0 "[ . 1 . 2]" 1 27 2 6 LYS HA 2 6 LYS HD2 3.740 . 4.300 2.204 2.087 2.345 . 0 0 "[ . 1 . 2]" 1 28 1 7 PHE HA 1 31 SER H 4.650 . 5.350 4.298 4.083 4.606 . 0 0 "[ . 1 . 2]" 1 29 2 7 PHE HA 2 31 SER H 4.650 . 5.350 4.338 4.102 4.746 . 0 0 "[ . 1 . 2]" 1 30 1 7 PHE HA 1 32 TRP HE3 4.260 . 4.900 3.862 3.491 4.109 . 0 0 "[ . 1 . 2]" 1 31 2 7 PHE HA 2 32 TRP HE3 4.260 . 4.900 3.883 3.603 4.181 . 0 0 "[ . 1 . 2]" 1 32 2 7 PHE HA 2 7 PHE HD1 4.550 . 5.230 4.160 4.036 4.274 . 0 0 "[ . 1 . 2]" 1 33 1 7 PHE HA 1 8 GLU HA 4.640 . 5.340 4.479 4.438 4.549 . 0 0 "[ . 1 . 2]" 1 34 2 7 PHE HA 2 8 GLU HA 4.640 . 5.340 4.477 4.444 4.507 . 0 0 "[ . 1 . 2]" 1 35 1 7 PHE HA 1 30 VAL MG1 3.980 . 4.580 2.845 2.557 3.213 . 0 0 "[ . 1 . 2]" 1 36 2 7 PHE HA 2 30 VAL MG1 3.980 . 4.580 2.863 2.685 3.448 . 0 0 "[ . 1 . 2]" 1 37 1 7 PHE QD 1 8 GLU HA 4.260 . 4.900 3.933 3.256 4.458 . 0 0 "[ . 1 . 2]" 1 38 2 7 PHE HD2 2 8 GLU HA 4.260 . 4.900 3.955 3.160 4.386 . 0 0 "[ . 1 . 2]" 1 39 1 8 GLU HA 1 9 ILE HA 4.700 . 5.400 4.400 4.303 4.448 . 0 0 "[ . 1 . 2]" 1 40 2 8 GLU HA 2 9 ILE HA 4.700 . 5.400 4.394 4.363 4.446 . 0 0 "[ . 1 . 2]" 1 41 1 8 GLU HA 1 9 ILE QG 4.550 . 5.230 3.712 3.597 3.964 . 0 0 "[ . 1 . 2]" 1 42 2 8 GLU HA 2 9 ILE HG13 4.550 . 5.230 3.798 3.605 3.961 . 0 0 "[ . 1 . 2]" 1 43 1 8 GLU HA 1 9 ILE MD 5.390 . 6.200 5.158 4.982 5.386 . 0 0 "[ . 1 . 2]" 1 44 2 8 GLU HA 2 9 ILE MD 5.390 . 6.200 5.152 4.994 5.336 . 0 0 "[ . 1 . 2]" 1 45 1 9 ILE HA 1 10 ILE HA 4.570 . 5.260 4.428 4.393 4.468 . 0 0 "[ . 1 . 2]" 1 46 2 9 ILE HA 2 10 ILE HA 4.570 . 5.260 4.420 4.362 4.462 . 0 0 "[ . 1 . 2]" 1 47 1 8 GLU HG2 1 10 ILE HA 4.280 . 4.920 3.779 3.425 4.246 . 0 0 "[ . 1 . 2]" 1 48 2 8 GLU HG2 2 10 ILE HA 4.280 . 4.920 3.946 3.491 4.948 0.028 4 0 "[ . 1 . 2]" 1 49 1 10 ILE HA 1 11 GLU HB2 4.870 . 5.600 4.834 4.701 4.982 . 0 0 "[ . 1 . 2]" 1 50 2 10 ILE HA 2 11 GLU HB2 4.870 . 5.600 4.852 4.706 5.105 . 0 0 "[ . 1 . 2]" 1 51 1 10 ILE HA 1 10 ILE HG12 4.030 . 4.630 3.162 3.047 3.236 . 0 0 "[ . 1 . 2]" 1 52 2 10 ILE HA 2 10 ILE HG12 4.030 . 4.630 3.185 3.081 3.325 . 0 0 "[ . 1 . 2]" 1 53 1 10 ILE HA 1 10 ILE HG13 4.090 . 4.700 3.788 3.728 3.832 . 0 0 "[ . 1 . 2]" 1 54 2 10 ILE HA 2 10 ILE HG13 4.090 . 4.700 3.790 3.747 3.859 . 0 0 "[ . 1 . 2]" 1 55 1 11 GLU HA 1 11 GLU HG3 3.880 . 4.460 2.772 2.481 3.237 . 0 0 "[ . 1 . 2]" 1 56 2 11 GLU HA 2 11 GLU HG3 3.880 . 4.460 2.922 2.511 3.252 . 0 0 "[ . 1 . 2]" 1 57 1 12 GLU HA 1 29 ARG H 4.490 . 5.160 3.393 3.048 3.588 . 0 0 "[ . 1 . 2]" 1 58 2 12 GLU HA 2 29 ARG H 4.490 . 5.160 3.471 3.213 3.712 . 0 0 "[ . 1 . 2]" 1 59 1 12 GLU HA 1 13 LEU HG 4.460 . 5.130 3.720 3.358 3.947 . 0 0 "[ . 1 . 2]" 1 60 2 12 GLU HA 2 13 LEU HG 4.460 . 5.130 3.755 3.452 3.954 . 0 0 "[ . 1 . 2]" 1 61 1 12 GLU HA 1 13 LEU QD 4.630 . 5.320 4.022 3.686 4.304 . 0 0 "[ . 1 . 2]" 1 62 2 12 GLU HA 2 13 LEU QD 4.630 . 5.320 4.050 3.752 4.299 . 0 0 "[ . 1 . 2]" 1 63 1 12 GLU HB2 1 13 LEU HA 5.550 . 6.380 5.082 4.843 5.250 . 0 0 "[ . 1 . 2]" 1 64 2 12 GLU HB2 2 13 LEU HA 5.550 . 6.380 5.108 4.887 5.341 . 0 0 "[ . 1 . 2]" 1 65 1 13 LEU HA 1 27 LEU HG 6.000 . 6.900 5.436 5.290 5.724 . 0 0 "[ . 1 . 2]" 1 66 2 13 LEU HA 2 27 LEU HG 6.000 . 6.900 5.441 5.227 5.637 . 0 0 "[ . 1 . 2]" 1 67 1 14 ILE HA 1 15 VAL HB 4.560 . 5.240 4.854 4.745 4.940 . 0 0 "[ . 1 . 2]" 1 68 2 14 ILE HA 2 15 VAL HB 4.560 . 5.240 4.821 4.742 4.888 . 0 0 "[ . 1 . 2]" 1 69 1 14 ILE HA 1 14 ILE HG12 3.790 . 4.360 2.796 2.735 2.860 . 0 0 "[ . 1 . 2]" 1 70 2 14 ILE HA 2 14 ILE HG12 3.790 . 4.360 2.788 2.708 2.846 . 0 0 "[ . 1 . 2]" 1 71 1 14 ILE HA 1 14 ILE HG13 3.660 . 4.210 3.254 3.212 3.308 . 0 0 "[ . 1 . 2]" 1 72 2 14 ILE HA 2 14 ILE HG13 3.660 . 4.210 3.243 3.183 3.284 . 0 0 "[ . 1 . 2]" 1 73 1 14 ILE HA 1 15 VAL MG2 3.840 . 4.420 3.948 3.831 4.106 . 0 0 "[ . 1 . 2]" 1 74 2 14 ILE HA 2 15 VAL MG2 3.840 . 4.420 3.931 3.787 4.077 . 0 0 "[ . 1 . 2]" 1 75 1 14 ILE HA 1 14 ILE MG 3.130 . 3.600 2.397 2.376 2.447 . 0 0 "[ . 1 . 2]" 1 76 2 14 ILE HA 2 14 ILE MG 3.130 . 3.600 2.396 2.370 2.424 . 0 0 "[ . 1 . 2]" 1 77 1 32 TRP H 1 37 PRO HA 4.290 . 4.930 4.286 3.618 4.792 . 0 0 "[ . 1 . 2]" 1 78 2 32 TRP H 2 37 PRO HA 4.290 . 4.930 4.122 3.579 4.469 . 0 0 "[ . 1 . 2]" 1 79 1 15 VAL HA 1 17 SER H 4.220 . 4.850 3.781 3.639 3.910 . 0 0 "[ . 1 . 2]" 1 80 2 15 VAL HA 2 17 SER H 4.220 . 4.850 3.773 3.589 3.898 . 0 0 "[ . 1 . 2]" 1 81 1 31 SER HA 1 37 PRO HA 3.950 . 4.540 2.440 1.866 2.872 . 0 0 "[ . 1 . 2]" 1 82 2 31 SER HA 2 37 PRO HA 3.950 . 4.540 2.303 1.898 2.535 . 0 0 "[ . 1 . 2]" 1 83 1 15 VAL HA 1 26 GLU HB2 4.220 . 4.850 2.658 2.282 3.301 . 0 0 "[ . 1 . 2]" 1 84 2 15 VAL HA 2 26 GLU HB2 4.220 . 4.850 2.737 2.302 3.200 . 0 0 "[ . 1 . 2]" 1 85 1 15 VAL HA 1 26 GLU HB3 4.220 . 4.850 2.451 1.904 4.631 . 0 0 "[ . 1 . 2]" 1 86 2 15 VAL HA 2 26 GLU HB3 4.220 . 4.850 2.408 1.979 2.853 . 0 0 "[ . 1 . 2]" 1 87 1 37 PRO HA 1 38 LYS HG2 3.970 . 4.570 3.758 3.510 3.992 . 0 0 "[ . 1 . 2]" 1 88 2 37 PRO HA 2 38 LYS HG2 3.970 . 4.570 3.746 3.473 4.012 . 0 0 "[ . 1 . 2]" 1 89 1 14 ILE MG 1 15 VAL HA 3.980 . 4.580 3.812 3.566 4.136 . 0 0 "[ . 1 . 2]" 1 90 2 14 ILE MG 2 15 VAL HA 3.980 . 4.580 3.847 3.628 4.072 . 0 0 "[ . 1 . 2]" 1 91 1 61 GLU HA 2 16 LEU HA 4.480 . 5.150 3.656 3.220 4.288 . 0 0 "[ . 1 . 2]" 1 92 1 16 LEU HA 2 61 GLU HA 4.480 . 5.150 3.594 3.136 3.937 . 0 0 "[ . 1 . 2]" 1 93 1 65 LEU HA 2 16 LEU HA 5.760 . 6.620 5.392 5.165 5.640 . 0 0 "[ . 1 . 2]" 1 94 1 16 LEU HA 2 65 LEU HA 5.760 . 6.620 5.351 5.079 5.796 . 0 0 "[ . 1 . 2]" 1 95 1 64 VAL HB 2 16 LEU HA 4.220 . 4.850 2.998 2.450 3.585 . 0 0 "[ . 1 . 2]" 1 96 1 16 LEU HA 2 64 VAL HB 4.220 . 4.850 2.985 2.595 3.506 . 0 0 "[ . 1 . 2]" 1 97 1 64 VAL MG2 2 16 LEU HA 4.140 . 4.760 3.644 3.018 4.114 . 0 0 "[ . 1 . 2]" 1 98 1 16 LEU HA 2 64 VAL MG2 4.140 . 4.760 3.677 3.341 4.073 . 0 0 "[ . 1 . 2]" 1 99 1 64 VAL MG1 2 16 LEU HA 3.520 . 4.050 2.678 2.292 3.044 . 0 0 "[ . 1 . 2]" 1 100 1 16 LEU HA 2 64 VAL MG1 3.520 . 4.050 2.749 2.422 3.259 . 0 0 "[ . 1 . 2]" 1 101 1 16 LEU HA 1 16 LEU MD2 3.110 . 3.580 2.066 2.022 2.105 . 0 0 "[ . 1 . 2]" 1 102 2 16 LEU HA 2 16 LEU MD2 3.110 . 3.580 2.088 2.014 2.175 . 0 0 "[ . 1 . 2]" 1 103 1 17 SER HA 1 18 GLU HA 4.590 . 5.280 4.528 4.490 4.563 . 0 0 "[ . 1 . 2]" 1 104 2 17 SER HA 2 18 GLU HA 4.590 . 5.280 4.526 4.476 4.568 . 0 0 "[ . 1 . 2]" 1 105 1 17 SER HA 1 18 GLU HB2 4.470 . 5.140 4.362 4.188 4.598 . 0 0 "[ . 1 . 2]" 1 106 2 17 SER HA 2 18 GLU HB2 4.470 . 5.140 4.398 4.162 4.574 . 0 0 "[ . 1 . 2]" 1 107 1 18 GLU HA 1 24 ARG HG3 4.600 . 5.290 3.728 3.150 4.341 . 0 0 "[ . 1 . 2]" 1 108 2 18 GLU HA 2 24 ARG HG2 4.340 . 4.990 2.417 2.074 3.160 . 0 0 "[ . 1 . 2]" 1 109 1 19 ASN HA 1 19 ASN HD21 4.430 . 5.090 4.085 2.957 4.531 . 0 0 "[ . 1 . 2]" 1 110 2 19 ASN HA 2 19 ASN HD21 4.430 . 5.090 4.128 2.902 4.538 . 0 0 "[ . 1 . 2]" 1 111 1 20 ALA HA 1 22 GLY H 4.230 . 4.860 3.750 3.544 3.932 . 0 0 "[ . 1 . 2]" 1 112 2 20 ALA HA 2 22 GLY H 4.230 . 4.860 3.732 3.540 3.883 . 0 0 "[ . 1 . 2]" 1 113 1 19 ASN HA 1 20 ALA HA 4.820 . 5.540 4.474 4.390 4.519 . 0 0 "[ . 1 . 2]" 1 114 2 19 ASN HA 2 20 ALA HA 4.820 . 5.540 4.482 4.400 4.535 . 0 0 "[ . 1 . 2]" 1 115 1 20 ALA HA 1 21 LYS HA 4.920 . 5.660 4.799 4.702 4.915 . 0 0 "[ . 1 . 2]" 1 116 2 20 ALA HA 2 21 LYS HA 4.920 . 5.660 4.798 4.669 4.906 . 0 0 "[ . 1 . 2]" 1 117 1 21 LYS HA 1 21 LYS HG2 3.410 . 3.920 3.241 2.902 3.429 . 0 0 "[ . 1 . 2]" 1 118 2 21 LYS HA 2 21 LYS HG2 3.410 . 3.920 3.242 2.973 3.509 . 0 0 "[ . 1 . 2]" 1 119 1 18 GLU H 1 24 ARG HA 4.540 . 5.220 4.487 4.291 4.563 . 0 0 "[ . 1 . 2]" 1 120 2 18 GLU H 2 24 ARG HA 4.540 . 5.220 4.460 4.239 4.635 . 0 0 "[ . 1 . 2]" 1 121 1 17 SER H 1 24 ARG HA 4.560 . 5.240 4.464 4.368 4.584 . 0 0 "[ . 1 . 2]" 1 122 2 17 SER H 2 24 ARG HA 4.560 . 5.240 4.404 4.247 4.552 . 0 0 "[ . 1 . 2]" 1 123 1 18 GLU HA 1 24 ARG HA 3.890 . 4.470 2.058 1.893 2.155 . 0 0 "[ . 1 . 2]" 1 124 2 18 GLU HA 2 24 ARG HA 3.890 . 4.470 2.133 1.945 2.403 . 0 0 "[ . 1 . 2]" 1 125 1 15 VAL MG1 1 24 ARG HA 4.730 . 5.440 3.858 3.542 4.240 . 0 0 "[ . 1 . 2]" 1 126 2 15 VAL MG1 2 24 ARG HA 4.730 . 5.440 3.929 3.587 4.252 . 0 0 "[ . 1 . 2]" 1 127 1 8 GLU H 1 32 TRP HA 4.190 . 4.820 4.015 3.768 4.228 . 0 0 "[ . 1 . 2]" 1 128 2 8 GLU H 2 32 TRP HA 4.190 . 4.820 3.981 3.736 4.169 . 0 0 "[ . 1 . 2]" 1 129 1 7 PHE H 1 32 TRP HA 4.830 . 5.550 4.872 4.738 5.027 . 0 0 "[ . 1 . 2]" 1 130 2 7 PHE H 2 32 TRP HA 4.830 . 5.550 4.852 4.763 4.997 . 0 0 "[ . 1 . 2]" 1 131 1 32 TRP HA 1 32 TRP HE3 3.790 . 4.360 3.033 2.766 3.240 . 0 0 "[ . 1 . 2]" 1 132 2 32 TRP HA 2 32 TRP HE3 3.790 . 4.360 3.061 2.860 3.287 . 0 0 "[ . 1 . 2]" 1 133 1 7 PHE HA 1 32 TRP HA 3.970 . 4.570 2.607 2.366 2.871 . 0 0 "[ . 1 . 2]" 1 134 2 7 PHE HA 2 32 TRP HA 3.970 . 4.570 2.564 2.366 2.778 . 0 0 "[ . 1 . 2]" 1 135 1 32 TRP HA 1 33 ASN HA 4.540 . 5.220 4.353 4.320 4.382 . 0 0 "[ . 1 . 2]" 1 136 2 32 TRP HA 2 33 ASN HA 4.540 . 5.220 4.354 4.307 4.413 . 0 0 "[ . 1 . 2]" 1 137 1 7 PHE HB2 1 32 TRP HA 4.620 . 5.310 4.538 3.866 5.025 . 0 0 "[ . 1 . 2]" 1 138 2 7 PHE HB2 2 32 TRP HA 4.620 . 5.310 4.486 3.557 4.966 . 0 0 "[ . 1 . 2]" 1 139 1 16 LEU H 1 26 GLU HA 4.360 . 5.010 2.374 2.038 2.759 . 0 0 "[ . 1 . 2]" 1 140 2 16 LEU H 2 26 GLU HA 4.360 . 5.010 2.520 2.171 2.785 . 0 0 "[ . 1 . 2]" 1 141 1 15 VAL HA 1 26 GLU HA 4.050 . 4.660 2.653 2.310 3.012 . 0 0 "[ . 1 . 2]" 1 142 2 15 VAL HA 2 26 GLU HA 4.050 . 4.660 2.751 2.427 3.625 . 0 0 "[ . 1 . 2]" 1 143 1 16 LEU HG 1 26 GLU HA 4.210 . 4.840 2.527 2.104 3.196 . 0 0 "[ . 1 . 2]" 1 144 2 16 LEU HG 2 26 GLU HA 4.210 . 4.840 2.516 1.989 2.984 . 0 0 "[ . 1 . 2]" 1 145 1 16 LEU MD1 1 26 GLU HA 4.080 . 4.690 3.344 2.962 4.007 . 0 0 "[ . 1 . 2]" 1 146 2 16 LEU MD1 2 26 GLU HA 4.080 . 4.690 3.354 2.670 3.755 . 0 0 "[ . 1 . 2]" 1 147 1 27 LEU HA 1 27 LEU HG 4.120 . 4.740 3.205 3.114 3.308 . 0 0 "[ . 1 . 2]" 1 148 2 27 LEU HA 2 27 LEU HG 4.120 . 4.740 3.196 3.113 3.268 . 0 0 "[ . 1 . 2]" 1 149 1 12 GLU HA 1 28 ASN HA 3.970 . 4.570 2.570 2.243 2.813 . 0 0 "[ . 1 . 2]" 1 150 2 12 GLU HA 2 28 ASN HA 3.970 . 4.570 2.599 2.264 2.858 . 0 0 "[ . 1 . 2]" 1 151 1 13 LEU HB3 1 28 ASN HA 4.430 . 5.090 4.600 4.292 4.866 . 0 0 "[ . 1 . 2]" 1 152 2 13 LEU HB3 2 28 ASN HA 4.430 . 5.090 4.572 4.368 4.789 . 0 0 "[ . 1 . 2]" 1 153 1 27 LEU HG 1 28 ASN HA 4.290 . 4.930 3.858 3.587 4.036 . 0 0 "[ . 1 . 2]" 1 154 2 27 LEU HG 2 28 ASN HA 4.290 . 4.930 3.823 3.670 3.954 . 0 0 "[ . 1 . 2]" 1 155 1 13 LEU HG 1 28 ASN HA 4.140 . 4.760 2.227 1.805 2.587 . 0 0 "[ . 1 . 2]" 1 156 2 13 LEU HG 2 28 ASN HA 4.140 . 4.760 2.212 2.013 2.504 . 0 0 "[ . 1 . 2]" 1 157 1 13 LEU QD 1 28 ASN HA . . 4.220 3.106 2.798 3.444 . 0 0 "[ . 1 . 2]" 1 158 2 13 LEU QD 2 28 ASN HA . . 4.220 3.088 2.695 3.272 . 0 0 "[ . 1 . 2]" 1 159 1 29 ARG HA 1 39 TYR H 4.680 . 5.380 4.691 4.441 4.836 . 0 0 "[ . 1 . 2]" 1 160 2 29 ARG HA 2 39 TYR H 4.680 . 5.380 4.715 4.506 4.829 . 0 0 "[ . 1 . 2]" 1 161 1 7 PHE HB3 1 32 TRP HA 3.820 . 4.390 3.899 3.274 4.317 . 0 0 "[ . 1 . 2]" 1 162 2 7 PHE HB3 2 32 TRP HA 3.820 . 4.390 3.842 3.070 4.287 . 0 0 "[ . 1 . 2]" 1 163 1 29 ARG HA 1 30 VAL HB 5.010 . 5.760 4.555 4.430 4.672 . 0 0 "[ . 1 . 2]" 1 164 2 29 ARG HA 2 30 VAL HB 5.010 . 5.760 4.557 4.449 4.650 . 0 0 "[ . 1 . 2]" 1 165 1 29 ARG HA 1 29 ARG HG2 4.230 . 4.860 2.662 2.439 3.408 . 0 0 "[ . 1 . 2]" 1 166 2 29 ARG HA 2 29 ARG HG2 4.230 . 4.860 2.613 2.453 3.298 . 0 0 "[ . 1 . 2]" 1 167 1 29 ARG HA 1 29 ARG HG3 4.230 . 4.860 3.043 2.427 3.286 . 0 0 "[ . 1 . 2]" 1 168 2 29 ARG HA 2 29 ARG HG3 4.230 . 4.860 3.048 2.421 3.277 . 0 0 "[ . 1 . 2]" 1 169 1 29 ARG HA 1 30 VAL MG1 5.580 . 6.420 5.500 5.447 5.530 . 0 0 "[ . 1 . 2]" 1 170 2 29 ARG HA 2 30 VAL MG1 5.580 . 6.420 5.509 5.460 5.562 . 0 0 "[ . 1 . 2]" 1 171 1 10 ILE H 1 30 VAL HA 3.990 . 4.590 2.425 2.221 2.551 . 0 0 "[ . 1 . 2]" 1 172 2 10 ILE H 2 30 VAL HA 3.990 . 4.590 2.455 2.359 2.569 . 0 0 "[ . 1 . 2]" 1 173 1 9 ILE HA 1 30 VAL HA 3.930 . 4.520 2.383 2.259 2.625 . 0 0 "[ . 1 . 2]" 1 174 2 9 ILE HA 2 30 VAL HA 3.930 . 4.520 2.363 2.103 2.656 . 0 0 "[ . 1 . 2]" 1 175 1 10 ILE HB 1 30 VAL HA 4.410 . 5.070 3.856 3.490 4.090 . 0 0 "[ . 1 . 2]" 1 176 2 10 ILE HB 2 30 VAL HA 4.410 . 5.070 3.886 3.593 4.050 . 0 0 "[ . 1 . 2]" 1 177 1 10 ILE HG13 1 30 VAL HA 4.190 . 4.820 4.211 4.045 4.424 . 0 0 "[ . 1 . 2]" 1 178 2 10 ILE HG13 2 30 VAL HA 4.190 . 4.820 4.209 3.803 4.420 . 0 0 "[ . 1 . 2]" 1 179 1 31 SER HA 1 35 ALA H 4.750 . 5.460 4.422 4.104 4.876 . 0 0 "[ . 1 . 2]" 1 180 2 31 SER HA 2 35 ALA H 4.750 . 5.460 4.510 4.162 4.923 . 0 0 "[ . 1 . 2]" 1 181 1 31 SER HA 1 37 PRO HB3 4.130 . 4.750 4.018 3.206 4.564 . 0 0 "[ . 1 . 2]" 1 182 2 31 SER HA 2 37 PRO HB3 4.130 . 4.750 3.850 3.207 4.409 . 0 0 "[ . 1 . 2]" 1 183 1 34 ASP HB3 1 35 ALA HA 4.800 . 5.520 4.927 4.800 5.044 . 0 0 "[ . 1 . 2]" 1 184 2 34 ASP HB3 2 35 ALA HA 4.800 . 5.520 4.911 4.775 5.073 . 0 0 "[ . 1 . 2]" 1 185 1 36 GLU HA 1 37 PRO HD3 3.170 . 3.650 2.448 1.934 2.818 . 0 0 "[ . 1 . 2]" 1 186 2 36 GLU HA 2 37 PRO HD3 3.170 . 3.650 2.339 2.024 2.776 . 0 0 "[ . 1 . 2]" 1 187 1 36 GLU HA 1 37 PRO HD2 3.150 . 3.620 2.245 1.906 2.764 . 0 0 "[ . 1 . 2]" 1 188 2 36 GLU HA 2 37 PRO HD2 3.150 . 3.620 2.352 1.955 2.679 . 0 0 "[ . 1 . 2]" 1 189 1 36 GLU HA 1 37 PRO HG2 4.390 . 5.050 4.351 4.068 4.609 . 0 0 "[ . 1 . 2]" 1 190 2 36 GLU HA 2 37 PRO HG2 4.390 . 5.050 4.430 4.144 4.586 . 0 0 "[ . 1 . 2]" 1 191 1 35 ALA MB 1 36 GLU HA 4.470 . 5.140 4.275 4.146 4.417 . 0 0 "[ . 1 . 2]" 1 192 2 35 ALA MB 2 36 GLU HA 4.470 . 5.140 4.245 4.186 4.372 . 0 0 "[ . 1 . 2]" 1 193 1 50 LYS HA 1 51 MET HB3 4.730 . 5.440 4.413 4.120 4.630 . 0 0 "[ . 1 . 2]" 1 194 2 50 LYS HA 2 51 MET HB3 4.730 . 5.440 4.448 4.194 4.690 . 0 0 "[ . 1 . 2]" 1 195 1 30 VAL H 1 39 TYR HA 4.390 . 5.050 3.639 3.433 3.821 . 0 0 "[ . 1 . 2]" 1 196 2 30 VAL H 2 39 TYR HA 4.390 . 5.050 3.663 3.449 3.958 . 0 0 "[ . 1 . 2]" 1 197 1 29 ARG HA 1 39 TYR HA 4.250 . 4.890 2.370 2.124 2.506 . 0 0 "[ . 1 . 2]" 1 198 2 29 ARG HA 2 39 TYR HA 4.250 . 4.890 2.395 2.157 2.653 . 0 0 "[ . 1 . 2]" 1 199 1 27 LEU HG 1 39 TYR HA 5.230 . 6.010 5.191 4.878 5.461 . 0 0 "[ . 1 . 2]" 1 200 2 27 LEU HG 2 39 TYR HA 5.230 . 6.010 5.200 4.963 5.478 . 0 0 "[ . 1 . 2]" 1 201 1 29 ARG HB2 1 39 TYR HA 4.960 . 5.700 4.765 3.419 5.113 . 0 0 "[ . 1 . 2]" 1 202 2 29 ARG HB2 2 39 TYR HA 4.960 . 5.700 4.854 3.610 5.239 . 0 0 "[ . 1 . 2]" 1 203 1 40 ASP HA 1 57 LEU H 4.730 . 5.440 3.370 3.129 3.766 . 0 0 "[ . 1 . 2]" 1 204 2 40 ASP HA 2 57 LEU H 4.730 . 5.440 3.318 3.035 3.608 . 0 0 "[ . 1 . 2]" 1 205 1 40 ASP HA 1 57 LEU HG 4.540 . 5.220 4.310 3.986 4.712 . 0 0 "[ . 1 . 2]" 1 206 2 40 ASP HA 2 57 LEU HG 4.540 . 5.220 4.280 3.928 4.627 . 0 0 "[ . 1 . 2]" 1 207 1 40 ASP HA 1 56 THR MG 4.030 . 4.630 3.136 2.643 4.095 . 0 0 "[ . 1 . 2]" 1 208 2 40 ASP HA 2 56 THR MG 4.030 . 4.630 3.198 2.664 3.673 . 0 0 "[ . 1 . 2]" 1 209 1 40 ASP HA 1 41 ILE MG 3.900 . 4.490 3.550 3.399 3.689 . 0 0 "[ . 1 . 2]" 1 210 2 40 ASP HA 2 41 ILE MG 3.900 . 4.490 3.541 3.402 3.658 . 0 0 "[ . 1 . 2]" 1 211 1 41 ILE HA 1 41 ILE HG12 3.830 . 4.400 3.221 3.140 3.257 . 0 0 "[ . 1 . 2]" 1 212 2 41 ILE HA 2 41 ILE HG12 3.830 . 4.400 3.222 3.170 3.251 . 0 0 "[ . 1 . 2]" 1 213 1 41 ILE HA 1 41 ILE MG 3.280 . 3.770 3.270 3.260 3.280 . 0 0 "[ . 1 . 2]" 1 214 2 41 ILE HA 2 41 ILE MG 3.280 . 3.770 3.271 3.258 3.287 . 0 0 "[ . 1 . 2]" 1 215 1 25 LYS HA 1 43 THR HA 4.010 . 4.610 1.937 1.763 2.199 0.037 9 0 "[ . 1 . 2]" 1 216 2 25 LYS HA 2 43 THR HA 4.010 . 4.610 1.983 1.764 2.214 0.036 14 0 "[ . 1 . 2]" 1 217 1 44 TRP HA 1 50 LYS H 4.540 . 5.220 4.770 4.229 5.110 . 0 0 "[ . 1 . 2]" 1 218 2 44 TRP HA 2 50 LYS H 4.540 . 5.220 4.872 4.489 5.154 . 0 0 "[ . 1 . 2]" 1 219 1 44 TRP HA 1 44 TRP HD1 4.620 . 5.310 4.256 4.138 4.434 . 0 0 "[ . 1 . 2]" 1 220 2 44 TRP HA 2 44 TRP HD1 4.620 . 5.310 4.271 4.172 4.362 . 0 0 "[ . 1 . 2]" 1 221 1 43 THR MG 1 44 TRP HA 4.590 . 5.280 4.135 3.899 4.291 . 0 0 "[ . 1 . 2]" 1 222 2 43 THR MG 2 44 TRP HA 4.590 . 5.280 4.152 3.966 4.268 . 0 0 "[ . 1 . 2]" 1 223 1 23 TRP HD1 1 45 SER HA 4.630 . 5.320 4.179 3.865 4.631 . 0 0 "[ . 1 . 2]" 1 224 2 23 TRP HD1 2 45 SER HA 4.630 . 5.320 4.046 3.594 4.721 . 0 0 "[ . 1 . 2]" 1 225 1 23 TRP HA 1 45 SER HA 4.440 . 5.110 2.521 2.292 2.779 . 0 0 "[ . 1 . 2]" 1 226 2 23 TRP HA 2 45 SER HA 4.440 . 5.110 2.458 2.270 2.684 . 0 0 "[ . 1 . 2]" 1 227 1 45 SER HA 1 46 PRO HD3 3.920 . 4.510 2.708 2.219 2.987 . 0 0 "[ . 1 . 2]" 1 228 2 45 SER HA 2 46 PRO HD3 3.920 . 4.510 2.735 2.329 2.902 . 0 0 "[ . 1 . 2]" 1 229 1 45 SER HA 1 46 PRO HG3 5.150 . 5.920 4.745 4.414 4.921 . 0 0 "[ . 1 . 2]" 1 230 2 45 SER HA 2 46 PRO HG3 5.150 . 5.920 4.751 4.557 4.895 . 0 0 "[ . 1 . 2]" 1 231 1 45 SER HA 1 50 LYS HB3 5.610 . 6.450 5.502 4.934 6.231 . 0 0 "[ . 1 . 2]" 1 232 2 45 SER HA 2 50 LYS HB3 5.610 . 6.450 5.505 5.041 6.261 . 0 0 "[ . 1 . 2]" 1 233 1 45 SER HA 1 50 LYS HB2 4.540 . 5.220 4.104 3.586 4.774 . 0 0 "[ . 1 . 2]" 1 234 2 45 SER HA 2 50 LYS HB2 4.540 . 5.220 4.202 3.843 4.793 . 0 0 "[ . 1 . 2]" 1 235 1 46 PRO HA 1 47 ASP HA 4.730 . 5.440 4.763 4.692 4.839 . 0 0 "[ . 1 . 2]" 1 236 2 46 PRO HA 2 47 ASP HA 4.730 . 5.440 4.765 4.664 4.852 . 0 0 "[ . 1 . 2]" 1 237 1 46 PRO HG2 1 47 ASP HA 4.950 . 5.690 5.104 4.573 5.900 0.210 9 0 "[ . 1 . 2]" 1 238 2 46 PRO HG2 2 47 ASP HA 4.950 . 5.690 4.955 4.622 5.852 0.162 2 0 "[ . 1 . 2]" 1 239 1 44 TRP HE3 1 48 HIS HA 3.950 . 4.540 2.776 2.416 3.220 . 0 0 "[ . 1 . 2]" 1 240 2 44 TRP HE3 2 48 HIS HA 3.950 . 4.540 2.869 2.665 3.435 . 0 0 "[ . 1 . 2]" 1 241 1 48 HIS HA 1 48 HIS HD2 4.710 . 5.420 2.605 2.271 2.964 . 0 0 "[ . 1 . 2]" 1 242 2 48 HIS HA 2 48 HIS HD2 4.710 . 5.420 2.570 2.198 2.930 . 0 0 "[ . 1 . 2]" 1 243 1 9 ILE MD 1 48 HIS HA 4.460 . 5.130 3.960 3.502 4.376 . 0 0 "[ . 1 . 2]" 1 244 2 9 ILE MD 2 48 HIS HA 4.460 . 5.130 3.879 3.311 4.468 . 0 0 "[ . 1 . 2]" 1 245 1 7 PHE HZ 1 49 GLU HA 4.920 . 5.660 3.932 2.446 5.565 . 0 0 "[ . 1 . 2]" 1 246 2 7 PHE HZ 2 49 GLU HA 4.920 . 5.660 3.674 2.092 5.553 . 0 0 "[ . 1 . 2]" 1 247 1 49 GLU HA 1 49 GLU HG2 3.910 . 4.500 3.863 3.757 4.290 . 0 0 "[ . 1 . 2]" 1 248 2 49 GLU HA 2 49 GLU HG2 3.910 . 4.500 3.889 3.778 4.285 . 0 0 "[ . 1 . 2]" 1 249 1 49 GLU HA 1 50 LYS HG2 5.300 . 6.100 5.020 4.695 5.601 . 0 0 "[ . 1 . 2]" 1 250 2 49 GLU HA 2 50 LYS HG2 5.300 . 6.100 4.968 4.708 5.267 . 0 0 "[ . 1 . 2]" 1 251 1 23 TRP HH2 1 50 LYS HA 5.180 . 5.960 4.468 4.174 4.827 . 0 0 "[ . 1 . 2]" 1 252 2 23 TRP HH2 2 50 LYS HA 5.180 . 5.960 4.419 4.198 4.695 . 0 0 "[ . 1 . 2]" 1 253 1 53 LYS HA 1 53 LYS HD2 4.230 . 4.860 3.379 2.192 4.757 . 0 0 "[ . 1 . 2]" 1 254 2 53 LYS HA 2 53 LYS HD2 4.230 . 4.860 3.484 2.232 4.744 . 0 0 "[ . 1 . 2]" 1 255 1 53 LYS HA 1 53 LYS HD3 4.230 . 4.860 2.983 1.983 4.890 0.030 7 0 "[ . 1 . 2]" 1 256 2 53 LYS HA 2 53 LYS HD3 4.230 . 4.860 3.409 2.028 4.912 0.052 3 0 "[ . 1 . 2]" 1 257 1 41 ILE H 1 56 THR HA 4.230 . 4.860 3.572 3.133 3.993 . 0 0 "[ . 1 . 2]" 1 258 2 41 ILE H 2 56 THR HA 4.230 . 4.860 3.539 3.218 3.979 . 0 0 "[ . 1 . 2]" 1 259 1 55 ILE HA 1 56 THR HA 4.600 . 5.290 4.440 4.385 4.467 . 0 0 "[ . 1 . 2]" 1 260 2 55 ILE HA 2 56 THR HA 4.600 . 5.290 4.445 4.411 4.470 . 0 0 "[ . 1 . 2]" 1 261 1 38 LYS HD2 1 56 THR HA 5.020 . 5.770 5.224 4.103 5.882 0.112 20 0 "[ . 1 . 2]" 1 262 2 38 LYS HD2 2 56 THR HA 5.020 . 5.770 5.192 4.455 5.862 0.092 5 0 "[ . 1 . 2]" 1 263 1 38 LYS HD3 1 56 THR HA 5.520 . 6.350 4.746 3.544 5.926 . 0 0 "[ . 1 . 2]" 1 264 2 38 LYS HD3 2 56 THR HA 5.520 . 6.350 4.711 3.880 5.543 . 0 0 "[ . 1 . 2]" 1 265 1 38 LYS HG3 1 56 THR HA 4.550 . 5.230 4.648 4.028 5.073 . 0 0 "[ . 1 . 2]" 1 266 2 38 LYS HG3 2 56 THR HA 4.550 . 5.230 4.629 3.980 5.256 0.026 14 0 "[ . 1 . 2]" 1 267 1 56 THR HA 1 57 LEU HG 4.780 . 5.500 3.675 3.184 3.985 . 0 0 "[ . 1 . 2]" 1 268 2 56 THR HA 2 57 LEU HG 4.780 . 5.500 3.701 3.358 3.944 . 0 0 "[ . 1 . 2]" 1 269 1 56 THR HA 1 56 THR MG 3.530 . 4.060 2.316 2.254 2.406 . 0 0 "[ . 1 . 2]" 1 270 2 56 THR HA 2 56 THR MG 3.530 . 4.060 2.311 2.213 2.373 . 0 0 "[ . 1 . 2]" 1 271 1 41 ILE MG 1 56 THR HA 4.470 . 5.140 4.126 3.760 4.485 . 0 0 "[ . 1 . 2]" 1 272 2 41 ILE MG 2 56 THR HA 4.470 . 5.140 4.073 3.738 4.477 . 0 0 "[ . 1 . 2]" 1 273 1 55 ILE MG 1 56 THR HA 4.740 . 5.450 4.346 4.153 4.532 . 0 0 "[ . 1 . 2]" 1 274 2 55 ILE MG 2 56 THR HA 4.740 . 5.450 4.316 4.147 4.454 . 0 0 "[ . 1 . 2]" 1 275 1 57 LEU HA 1 61 GLU HB3 4.460 . 5.130 4.043 3.312 4.615 . 0 0 "[ . 1 . 2]" 1 276 2 57 LEU HA 2 61 GLU HB3 4.460 . 5.130 3.954 3.501 4.650 . 0 0 "[ . 1 . 2]" 1 277 1 58 SER HA 1 59 GLU HG2 5.030 . 5.780 5.007 4.194 5.806 0.026 7 0 "[ . 1 . 2]" 1 278 2 58 SER HA 2 59 GLU HG2 5.030 . 5.780 4.903 4.059 5.374 . 0 0 "[ . 1 . 2]" 1 279 1 58 SER HA 1 59 GLU HG3 5.340 . 6.140 4.236 3.624 5.902 . 0 0 "[ . 1 . 2]" 1 280 2 58 SER HA 2 59 GLU HG3 5.340 . 6.140 4.193 3.807 5.778 . 0 0 "[ . 1 . 2]" 1 281 1 38 LYS HB2 1 58 SER HA 4.110 . 4.730 2.549 2.158 3.154 . 0 0 "[ . 1 . 2]" 1 282 2 38 LYS HB2 2 58 SER HA 4.110 . 4.730 2.414 2.007 2.907 . 0 0 "[ . 1 . 2]" 1 283 1 38 LYS HD3 1 58 SER HA 4.630 . 5.320 3.744 2.559 4.565 . 0 0 "[ . 1 . 2]" 1 284 2 38 LYS HD3 2 58 SER HA 4.630 . 5.320 3.546 2.820 4.476 . 0 0 "[ . 1 . 2]" 1 285 1 38 LYS HG3 1 58 SER HA 5.060 . 5.820 4.845 4.176 5.348 . 0 0 "[ . 1 . 2]" 1 286 2 38 LYS HG3 2 58 SER HA 5.060 . 5.820 4.686 4.250 5.250 . 0 0 "[ . 1 . 2]" 1 287 1 59 GLU HA 1 63 GLY H 4.310 . 4.960 3.766 3.617 4.172 . 0 0 "[ . 1 . 2]" 1 288 2 59 GLU HA 2 63 GLY H 4.310 . 4.960 3.759 3.442 4.049 . 0 0 "[ . 1 . 2]" 1 289 1 59 GLU HA 1 62 PHE HD2 4.890 . 5.620 4.150 3.689 4.782 . 0 0 "[ . 1 . 2]" 1 290 2 59 GLU HA 2 62 PHE HD2 4.890 . 5.620 4.166 3.846 4.536 . 0 0 "[ . 1 . 2]" 1 291 1 58 SER HA 1 59 GLU HA 4.790 . 5.510 4.363 4.228 4.479 . 0 0 "[ . 1 . 2]" 1 292 2 58 SER HA 2 59 GLU HA 4.790 . 5.510 4.357 4.263 4.451 . 0 0 "[ . 1 . 2]" 1 293 1 58 SER HB3 1 59 GLU HA 5.280 . 6.070 4.934 4.768 5.058 . 0 0 "[ . 1 . 2]" 1 294 2 58 SER HB3 2 59 GLU HA 5.280 . 6.070 4.941 4.801 5.074 . 0 0 "[ . 1 . 2]" 1 295 1 59 GLU HA 1 59 GLU HG2 3.510 . 4.040 2.637 2.443 3.650 . 0 0 "[ . 1 . 2]" 1 296 2 59 GLU HA 2 59 GLU HG2 3.510 . 4.040 2.619 2.455 3.110 . 0 0 "[ . 1 . 2]" 1 297 1 60 GLU HA 1 61 GLU HA 4.960 . 5.700 4.836 4.696 4.916 . 0 0 "[ . 1 . 2]" 1 298 2 60 GLU HA 2 61 GLU HA 4.960 . 5.700 4.836 4.774 4.906 . 0 0 "[ . 1 . 2]" 1 299 1 58 SER H 1 61 GLU HA 4.890 . 5.620 5.161 4.894 5.670 0.050 6 0 "[ . 1 . 2]" 1 300 2 58 SER H 2 61 GLU HA 4.890 . 5.620 5.124 4.898 5.440 . 0 0 "[ . 1 . 2]" 1 301 1 61 GLU HA 1 64 VAL H 4.290 . 4.930 3.595 3.235 3.973 . 0 0 "[ . 1 . 2]" 1 302 2 61 GLU HA 2 64 VAL H 4.290 . 4.930 3.621 3.306 4.076 . 0 0 "[ . 1 . 2]" 1 303 1 61 GLU HA 1 65 LEU H 4.620 . 5.310 4.417 4.214 4.547 . 0 0 "[ . 1 . 2]" 1 304 2 61 GLU HA 2 65 LEU H 4.620 . 5.310 4.398 4.119 4.526 . 0 0 "[ . 1 . 2]" 1 305 1 61 GLU HA 1 64 VAL HB 4.240 . 4.880 3.027 2.834 3.372 . 0 0 "[ . 1 . 2]" 1 306 2 61 GLU HA 2 64 VAL HB 4.240 . 4.880 3.046 2.835 3.253 . 0 0 "[ . 1 . 2]" 1 307 1 16 LEU MD2 2 61 GLU HA 3.870 . 4.450 3.662 3.317 3.945 . 0 0 "[ . 1 . 2]" 1 308 1 61 GLU HA 2 16 LEU MD2 3.870 . 4.450 3.658 3.225 4.200 . 0 0 "[ . 1 . 2]" 1 309 1 62 PHE HA 1 62 PHE HE1 4.590 . 5.280 4.815 4.668 4.924 . 0 0 "[ . 1 . 2]" 1 310 2 62 PHE HA 2 62 PHE HE1 4.590 . 5.280 4.823 4.733 4.896 . 0 0 "[ . 1 . 2]" 1 311 1 62 PHE HA 1 65 LEU HB3 3.900 . 4.490 2.573 2.377 2.707 . 0 0 "[ . 1 . 2]" 1 312 2 62 PHE HA 2 65 LEU HB3 3.900 . 4.490 2.521 2.342 2.635 . 0 0 "[ . 1 . 2]" 1 313 1 62 PHE HA 1 65 LEU HB2 3.920 . 4.510 2.696 2.588 2.973 . 0 0 "[ . 1 . 2]" 1 314 2 62 PHE HA 2 65 LEU HB2 3.920 . 4.510 2.638 2.479 2.820 . 0 0 "[ . 1 . 2]" 1 315 1 16 LEU MD2 2 62 PHE HA 4.000 . 4.600 3.612 3.411 3.928 . 0 0 "[ . 1 . 2]" 1 316 1 62 PHE HA 2 16 LEU MD2 4.000 . 4.600 3.695 3.499 3.980 . 0 0 "[ . 1 . 2]" 1 317 1 63 GLY HA3 1 64 VAL HA 4.390 . 5.050 4.439 4.420 4.468 . 0 0 "[ . 1 . 2]" 1 318 2 63 GLY HA3 2 64 VAL HA 4.390 . 5.050 4.432 4.402 4.454 . 0 0 "[ . 1 . 2]" 1 319 1 64 VAL HA 1 67 LYS HB2 3.310 . 3.810 2.640 2.512 2.814 . 0 0 "[ . 1 . 2]" 1 320 2 64 VAL HA 2 67 LYS HB2 3.310 . 3.810 2.661 2.450 3.480 . 0 0 "[ . 1 . 2]" 1 321 1 64 VAL HA 1 67 LYS HD3 3.880 . 4.460 2.120 1.912 2.390 . 0 0 "[ . 1 . 2]" 1 322 2 64 VAL HA 2 67 LYS HD3 3.880 . 4.460 2.145 1.795 3.189 0.005 9 0 "[ . 1 . 2]" 1 323 1 64 VAL HA 1 67 LYS HG2 5.040 . 5.800 4.698 4.549 4.983 . 0 0 "[ . 1 . 2]" 1 324 2 64 VAL HA 2 67 LYS HG2 5.040 . 5.800 4.670 4.432 5.021 . 0 0 "[ . 1 . 2]" 1 325 1 14 ILE MG 2 64 VAL HA 4.470 . 5.140 4.690 4.457 4.981 . 0 0 "[ . 1 . 2]" 1 326 1 64 VAL HA 2 14 ILE MG 4.470 . 5.140 4.704 4.361 4.951 . 0 0 "[ . 1 . 2]" 1 327 1 65 LEU HA 1 68 GLU H 4.340 . 4.990 3.916 3.793 4.056 . 0 0 "[ . 1 . 2]" 1 328 2 65 LEU HA 2 68 GLU H 4.340 . 4.990 3.938 3.811 4.033 . 0 0 "[ . 1 . 2]" 1 329 1 65 LEU HA 1 69 LEU HG 4.430 . 5.090 3.508 3.360 3.690 . 0 0 "[ . 1 . 2]" 1 330 2 65 LEU HA 2 69 LEU HG 4.430 . 5.090 3.453 3.367 3.598 . 0 0 "[ . 1 . 2]" 1 331 1 65 LEU HA 1 65 LEU HG 4.060 . 4.670 3.002 2.964 3.038 . 0 0 "[ . 1 . 2]" 1 332 2 65 LEU HA 2 65 LEU HG 4.060 . 4.670 3.003 2.935 3.045 . 0 0 "[ . 1 . 2]" 1 333 1 64 VAL MG1 1 65 LEU HA 4.140 . 4.760 3.595 3.377 3.739 . 0 0 "[ . 1 . 2]" 1 334 2 64 VAL MG1 2 65 LEU HA 4.140 . 4.760 3.625 3.467 3.718 . 0 0 "[ . 1 . 2]" 1 335 1 27 LEU QD 2 65 LEU HA 5.260 . 6.050 4.456 4.280 4.651 . 0 0 "[ . 1 . 2]" 1 336 1 65 LEU HA 2 27 LEU QD 5.260 . 6.050 4.470 4.302 4.660 . 0 0 "[ . 1 . 2]" 1 337 1 14 ILE MG 2 65 LEU HA 3.300 . 3.800 2.370 1.951 2.710 . 0 0 "[ . 1 . 2]" 1 338 1 65 LEU HA 2 14 ILE MG 3.300 . 3.800 2.289 2.101 2.511 . 0 0 "[ . 1 . 2]" 1 339 1 65 LEU HA 1 69 LEU MD1 3.770 . 4.340 4.172 4.085 4.277 . 0 0 "[ . 1 . 2]" 1 340 2 65 LEU HA 2 69 LEU MD1 3.770 . 4.340 4.135 4.054 4.244 . 0 0 "[ . 1 . 2]" 1 341 1 66 LEU HA 1 68 GLU H 5.120 . 5.890 4.851 4.675 4.983 . 0 0 "[ . 1 . 2]" 1 342 2 66 LEU HA 2 68 GLU H 5.120 . 5.890 4.880 4.764 4.973 . 0 0 "[ . 1 . 2]" 1 343 1 66 LEU HA 1 69 LEU H 4.230 . 4.860 3.882 3.642 4.090 . 0 0 "[ . 1 . 2]" 1 344 2 66 LEU HA 2 69 LEU H 4.230 . 4.860 3.909 3.761 4.207 . 0 0 "[ . 1 . 2]" 1 345 1 66 LEU HA 1 69 LEU HB3 4.080 . 4.690 4.410 4.107 4.570 . 0 0 "[ . 1 . 2]" 1 346 2 66 LEU HA 2 69 LEU HB3 4.080 . 4.690 4.436 4.128 4.656 . 0 0 "[ . 1 . 2]" 1 347 1 66 LEU HA 1 69 LEU HG 4.300 . 4.950 4.071 3.798 4.239 . 0 0 "[ . 1 . 2]" 1 348 2 66 LEU HA 2 69 LEU HG 4.300 . 4.950 4.098 3.897 4.495 . 0 0 "[ . 1 . 2]" 1 349 1 66 LEU HA 1 69 LEU HB2 3.350 . 3.850 2.831 2.530 3.007 . 0 0 "[ . 1 . 2]" 1 350 2 66 LEU HA 2 69 LEU HB2 3.350 . 3.850 2.856 2.598 3.079 . 0 0 "[ . 1 . 2]" 1 351 1 73 LEU MD1 2 66 LEU HA 4.020 . 4.620 3.551 2.697 4.389 . 0 0 "[ . 1 . 2]" 1 352 1 66 LEU HA 2 73 LEU MD1 4.020 . 4.620 3.632 2.517 4.199 . 0 0 "[ . 1 . 2]" 1 353 1 66 LEU HA 1 69 LEU MD1 3.130 . 3.600 2.999 2.577 3.209 . 0 0 "[ . 1 . 2]" 1 354 2 66 LEU HA 2 69 LEU MD1 3.130 . 3.600 3.062 2.652 3.387 . 0 0 "[ . 1 . 2]" 1 355 1 67 LYS HA 1 67 LYS HD3 4.540 . 5.220 4.695 4.603 4.736 . 0 0 "[ . 1 . 2]" 1 356 2 67 LYS HA 2 67 LYS HD3 4.540 . 5.220 4.712 4.614 5.078 . 0 0 "[ . 1 . 2]" 1 357 1 67 LYS HA 1 67 LYS HG3 3.460 . 3.980 2.814 2.650 2.901 . 0 0 "[ . 1 . 2]" 1 358 2 67 LYS HA 2 67 LYS HG3 3.460 . 3.980 2.824 2.700 3.203 . 0 0 "[ . 1 . 2]" 1 359 1 73 LEU MD1 2 67 LYS HA 4.210 . 4.840 4.413 3.830 4.807 . 0 0 "[ . 1 . 2]" 1 360 1 67 LYS HA 2 73 LEU MD1 4.210 . 4.840 4.373 4.015 4.744 . 0 0 "[ . 1 . 2]" 1 361 1 66 LEU MD1 1 67 LYS HA 5.790 . 6.660 5.741 5.658 5.905 . 0 0 "[ . 1 . 2]" 1 362 2 66 LEU MD1 2 67 LYS HA 5.790 . 6.660 5.744 5.641 5.850 . 0 0 "[ . 1 . 2]" 1 363 1 68 GLU HA 1 72 LYS H 3.920 . 4.510 3.940 3.626 4.178 . 0 0 "[ . 1 . 2]" 1 364 2 68 GLU HA 2 72 LYS H 3.920 . 4.510 3.968 3.702 4.151 . 0 0 "[ . 1 . 2]" 1 365 1 68 GLU HA 1 71 ASN H 4.130 . 4.750 3.202 3.000 3.340 . 0 0 "[ . 1 . 2]" 1 366 2 68 GLU HA 2 71 ASN H 4.130 . 4.750 3.212 2.932 3.417 . 0 0 "[ . 1 . 2]" 1 367 1 68 GLU HA 1 71 ASN HB2 3.810 . 4.380 2.618 2.323 2.849 . 0 0 "[ . 1 . 2]" 1 368 2 68 GLU HA 2 71 ASN HB2 3.810 . 4.380 2.665 2.404 2.969 . 0 0 "[ . 1 . 2]" 1 369 1 14 ILE MD 2 68 GLU HA 3.990 . 4.590 4.307 4.188 4.452 . 0 0 "[ . 1 . 2]" 1 370 1 68 GLU HA 2 14 ILE MD 3.990 . 4.590 4.262 4.137 4.368 . 0 0 "[ . 1 . 2]" 1 371 1 14 ILE MD 2 69 LEU HA 3.550 . 4.080 3.108 2.797 3.408 . 0 0 "[ . 1 . 2]" 1 372 1 69 LEU HA 2 14 ILE MD 3.550 . 4.080 3.012 2.782 3.520 . 0 0 "[ . 1 . 2]" 1 373 1 72 LYS HA 1 73 LEU H 3.520 . 4.050 3.494 3.261 3.571 . 0 0 "[ . 1 . 2]" 1 374 2 72 LYS HA 2 73 LEU H 3.520 . 4.050 3.500 3.428 3.587 . 0 0 "[ . 1 . 2]" 1 375 1 71 ASN HB2 1 72 LYS HA 5.040 . 5.800 4.429 4.243 5.628 . 0 0 "[ . 1 . 2]" 1 376 2 71 ASN HB2 2 72 LYS HA 5.040 . 5.800 4.366 4.230 4.562 . 0 0 "[ . 1 . 2]" 1 377 1 72 LYS HA 1 72 LYS HG2 3.700 . 4.260 2.628 2.491 3.747 . 0 0 "[ . 1 . 2]" 1 378 2 72 LYS HA 2 72 LYS HG2 3.700 . 4.260 2.569 2.456 2.987 . 0 0 "[ . 1 . 2]" 1 379 1 72 LYS HA 1 72 LYS HG3 3.700 . 4.260 3.110 2.929 3.818 . 0 0 "[ . 1 . 2]" 1 380 2 72 LYS HA 2 72 LYS HG3 3.700 . 4.260 3.075 2.908 3.842 . 0 0 "[ . 1 . 2]" 1 381 1 72 LYS HB2 1 73 LEU HA 4.290 . 4.930 4.648 4.433 4.960 0.030 11 0 "[ . 1 . 2]" 1 382 2 72 LYS HB2 2 73 LEU HA 4.290 . 4.930 4.682 4.303 4.859 . 0 0 "[ . 1 . 2]" 1 383 1 42 ARG HA 1 54 GLY HA2 4.190 . 4.820 3.089 2.599 3.435 . 0 0 "[ . 1 . 2]" 1 384 2 42 ARG HA 2 54 GLY HA2 4.190 . 4.820 2.988 2.585 3.292 . 0 0 "[ . 1 . 2]" 1 385 1 55 ILE HB 2 54 GLY HA2 4.060 . 4.670 2.094 1.783 2.505 0.017 10 0 "[ . 1 . 2]" 1 386 1 54 GLY HA2 2 55 ILE HB 4.060 . 4.670 2.112 1.788 2.647 0.012 10 0 "[ . 1 . 2]" 1 387 1 55 ILE HG12 2 54 GLY HA2 5.520 . 6.350 5.049 4.714 5.402 . 0 0 "[ . 1 . 2]" 1 388 1 54 GLY HA2 2 55 ILE HG12 5.520 . 6.350 5.079 4.591 5.681 . 0 0 "[ . 1 . 2]" 1 389 1 63 GLY HA2 1 66 LEU HB3 4.610 . 5.300 4.438 4.191 4.680 . 0 0 "[ . 1 . 2]" 1 390 2 63 GLY HA2 2 66 LEU HB3 4.610 . 5.300 4.502 4.254 4.914 . 0 0 "[ . 1 . 2]" 1 391 1 63 GLY HA2 1 66 LEU HG 4.110 . 4.730 3.229 2.971 3.496 . 0 0 "[ . 1 . 2]" 1 392 2 63 GLY HA2 2 66 LEU HG 4.110 . 4.730 3.287 2.964 3.590 . 0 0 "[ . 1 . 2]" 1 393 1 69 LEU HB3 1 70 GLY HA2 4.170 . 4.800 4.433 4.277 4.651 . 0 0 "[ . 1 . 2]" 1 394 2 69 LEU HB3 2 70 GLY HA2 4.170 . 4.800 4.457 4.254 4.693 . 0 0 "[ . 1 . 2]" 1 395 1 18 GLU HG2 1 22 GLY HA2 4.240 . 4.880 2.992 2.578 3.363 . 0 0 "[ . 1 . 2]" 1 396 2 18 GLU HG2 2 22 GLY HA2 4.240 . 4.880 3.028 2.496 3.268 . 0 0 "[ . 1 . 2]" 1 397 1 18 GLU HG3 1 22 GLY HA2 4.240 . 4.880 3.094 2.725 3.416 . 0 0 "[ . 1 . 2]" 1 398 2 18 GLU HG3 2 22 GLY HA2 4.240 . 4.880 3.101 2.625 3.481 . 0 0 "[ . 1 . 2]" 1 399 2 22 GLY HA2 2 24 ARG HG3 4.530 . 5.210 4.597 4.103 5.036 . 0 0 "[ . 1 . 2]" 1 400 1 42 ARG HA 1 54 GLY HA3 4.320 . 4.970 2.489 2.057 3.216 . 0 0 "[ . 1 . 2]" 1 401 2 42 ARG HA 2 54 GLY HA3 4.320 . 4.970 2.482 2.082 2.936 . 0 0 "[ . 1 . 2]" 1 402 1 55 ILE HB 2 54 GLY HA3 4.310 . 4.960 3.334 3.108 3.864 . 0 0 "[ . 1 . 2]" 1 403 1 54 GLY HA3 2 55 ILE HB 4.310 . 4.960 3.373 3.112 3.885 . 0 0 "[ . 1 . 2]" 1 404 1 55 ILE MD 2 54 GLY HA3 4.420 . 5.080 4.025 3.525 4.503 . 0 0 "[ . 1 . 2]" 1 405 1 54 GLY HA3 2 55 ILE MD 4.420 . 5.080 3.969 3.359 4.472 . 0 0 "[ . 1 . 2]" 1 406 1 63 GLY HA3 1 64 VAL MG2 4.300 . 4.950 4.026 3.953 4.147 . 0 0 "[ . 1 . 2]" 1 407 2 63 GLY HA3 2 64 VAL MG2 4.300 . 4.950 3.993 3.925 4.091 . 0 0 "[ . 1 . 2]" 1 408 1 63 GLY HA3 1 66 LEU MD1 4.310 . 4.960 3.994 3.547 4.340 . 0 0 "[ . 1 . 2]" 1 409 2 63 GLY HA3 2 66 LEU MD1 4.310 . 4.960 4.012 3.627 4.546 . 0 0 "[ . 1 . 2]" 1 410 1 8 GLU HA 1 9 ILE HB 4.920 . 5.660 4.691 4.546 4.853 . 0 0 "[ . 1 . 2]" 1 411 2 8 GLU HA 2 9 ILE HB 4.920 . 5.660 4.704 4.622 4.827 . 0 0 "[ . 1 . 2]" 1 412 1 8 GLU HG2 1 9 ILE HB 5.040 . 5.800 4.956 4.514 5.266 . 0 0 "[ . 1 . 2]" 1 413 2 8 GLU HG2 2 9 ILE HB 5.040 . 5.800 5.016 4.526 5.969 0.169 4 0 "[ . 1 . 2]" 1 414 1 9 ILE HB 1 30 VAL MG2 5.170 . 5.950 4.479 4.107 5.162 . 0 0 "[ . 1 . 2]" 1 415 2 9 ILE HB 2 30 VAL MG2 5.170 . 5.950 4.417 4.119 4.720 . 0 0 "[ . 1 . 2]" 1 416 1 10 ILE HB 1 11 GLU HB3 4.500 . 5.180 3.972 3.747 4.344 . 0 0 "[ . 1 . 2]" 1 417 2 10 ILE HB 2 11 GLU HB3 4.500 . 5.180 3.959 3.732 4.176 . 0 0 "[ . 1 . 2]" 1 418 1 10 ILE HB 1 11 GLU HB2 4.620 . 5.310 4.044 3.734 4.285 . 0 0 "[ . 1 . 2]" 1 419 2 10 ILE HB 2 11 GLU HB2 4.620 . 5.310 4.035 3.832 4.211 . 0 0 "[ . 1 . 2]" 1 420 1 10 ILE HB 1 37 PRO HB3 4.940 . 5.680 3.627 2.900 4.187 . 0 0 "[ . 1 . 2]" 1 421 2 10 ILE HB 2 37 PRO HB3 4.940 . 5.680 3.690 3.027 4.374 . 0 0 "[ . 1 . 2]" 1 422 1 9 ILE MG 1 10 ILE HB 4.560 . 5.240 4.686 4.579 4.862 . 0 0 "[ . 1 . 2]" 1 423 2 9 ILE MG 2 10 ILE HB 4.560 . 5.240 4.653 4.445 4.909 . 0 0 "[ . 1 . 2]" 1 424 1 14 ILE HB 1 27 LEU HB3 4.020 . 4.620 2.291 2.038 2.508 . 0 0 "[ . 1 . 2]" 1 425 2 14 ILE HB 2 27 LEU HB3 4.020 . 4.620 2.311 2.126 2.598 . 0 0 "[ . 1 . 2]" 1 426 1 14 ILE HB 1 27 LEU HB2 4.650 . 5.350 3.556 3.343 3.915 . 0 0 "[ . 1 . 2]" 1 427 2 14 ILE HB 2 27 LEU HB2 4.650 . 5.350 3.583 3.276 3.883 . 0 0 "[ . 1 . 2]" 1 428 1 14 ILE MG 1 15 VAL HB 4.250 . 4.890 4.485 4.336 4.822 . 0 0 "[ . 1 . 2]" 1 429 2 14 ILE MG 2 15 VAL HB 4.250 . 4.890 4.520 4.244 4.791 . 0 0 "[ . 1 . 2]" 1 430 1 20 ALA MB 1 22 GLY H 4.100 . 4.720 4.198 4.079 4.348 . 0 0 "[ . 1 . 2]" 1 431 2 20 ALA MB 2 22 GLY H 4.100 . 4.720 4.217 4.075 4.315 . 0 0 "[ . 1 . 2]" 1 432 1 19 ASN HA 1 20 ALA MB 4.170 . 4.800 4.227 4.184 4.280 . 0 0 "[ . 1 . 2]" 1 433 2 19 ASN HA 2 20 ALA MB 4.170 . 4.800 4.226 4.180 4.274 . 0 0 "[ . 1 . 2]" 1 434 1 20 ALA MB 1 21 LYS HA 4.080 . 4.690 4.110 4.015 4.270 . 0 0 "[ . 1 . 2]" 1 435 2 20 ALA MB 2 21 LYS HA 4.080 . 4.690 4.141 4.018 4.304 . 0 0 "[ . 1 . 2]" 1 436 1 20 ALA MB 1 21 LYS HB2 4.520 . 5.200 4.686 4.340 4.992 . 0 0 "[ . 1 . 2]" 1 437 2 20 ALA MB 2 21 LYS HB2 4.520 . 5.200 4.748 4.320 5.079 . 0 0 "[ . 1 . 2]" 1 438 1 30 VAL HB 1 38 LYS H 4.910 . 5.650 4.666 4.402 4.906 . 0 0 "[ . 1 . 2]" 1 439 2 30 VAL HB 2 38 LYS H 4.910 . 5.650 4.627 4.384 4.799 . 0 0 "[ . 1 . 2]" 1 440 1 30 VAL HB 1 32 TRP HD1 4.580 . 5.270 3.979 3.371 4.479 . 0 0 "[ . 1 . 2]" 1 441 2 30 VAL HB 2 32 TRP HD1 4.580 . 5.270 3.942 3.425 4.531 . 0 0 "[ . 1 . 2]" 1 442 1 35 ALA MB 1 36 GLU H 2.720 . 3.130 2.110 1.903 2.513 . 0 0 "[ . 1 . 2]" 1 443 2 35 ALA MB 2 36 GLU H 2.720 . 3.130 2.028 1.903 2.233 . 0 0 "[ . 1 . 2]" 1 444 1 34 ASP HA 1 35 ALA MB 4.750 . 5.460 4.681 4.568 4.812 . 0 0 "[ . 1 . 2]" 1 445 2 34 ASP HA 2 35 ALA MB 4.750 . 5.460 4.682 4.554 4.854 . 0 0 "[ . 1 . 2]" 1 446 1 31 SER HB2 1 35 ALA MB 6.000 . 6.900 5.485 4.843 5.882 . 0 0 "[ . 1 . 2]" 1 447 2 31 SER HB2 2 35 ALA MB 6.000 . 6.900 5.608 4.642 6.255 . 0 0 "[ . 1 . 2]" 1 448 1 31 SER HB3 1 35 ALA MB 6.000 . 6.900 5.852 5.321 6.197 . 0 0 "[ . 1 . 2]" 1 449 2 31 SER HB3 2 35 ALA MB 6.000 . 6.900 5.944 5.525 6.288 . 0 0 "[ . 1 . 2]" 1 450 1 35 ALA MB 1 37 PRO HD2 6.000 . 6.900 5.905 5.637 6.341 . 0 0 "[ . 1 . 2]" 1 451 2 35 ALA MB 2 37 PRO HD2 6.000 . 6.900 5.980 5.665 6.320 . 0 0 "[ . 1 . 2]" 1 452 1 32 TRP HB2 1 35 ALA MB 3.890 . 4.470 3.497 3.132 3.867 . 0 0 "[ . 1 . 2]" 1 453 2 32 TRP HB2 2 35 ALA MB 3.890 . 4.470 3.575 3.106 3.957 . 0 0 "[ . 1 . 2]" 1 454 1 43 THR HB 1 44 TRP H 4.200 . 4.830 4.184 4.118 4.236 . 0 0 "[ . 1 . 2]" 1 455 2 43 THR HB 2 44 TRP H 4.200 . 4.830 4.197 4.112 4.271 . 0 0 "[ . 1 . 2]" 1 456 1 43 THR HB 1 52 GLY H 4.640 . 5.340 4.207 3.746 5.251 . 0 0 "[ . 1 . 2]" 1 457 2 43 THR HB 2 52 GLY H 4.640 . 5.340 4.224 3.637 4.736 . 0 0 "[ . 1 . 2]" 1 458 1 43 THR HB 1 53 LYS H 5.480 . 6.300 4.243 3.546 6.018 . 0 0 "[ . 1 . 2]" 1 459 2 43 THR HB 2 53 LYS H 5.480 . 6.300 4.014 3.586 4.646 . 0 0 "[ . 1 . 2]" 1 460 1 43 THR H 1 43 THR HB 4.040 . 4.650 2.599 2.542 2.661 . 0 0 "[ . 1 . 2]" 1 461 2 43 THR H 2 43 THR HB 4.040 . 4.650 2.592 2.510 2.692 . 0 0 "[ . 1 . 2]" 1 462 1 23 TRP HE3 1 43 THR HB 3.650 . 4.200 3.137 2.963 3.404 . 0 0 "[ . 1 . 2]" 1 463 2 23 TRP HE3 2 43 THR HB 3.650 . 4.200 3.101 2.881 3.336 . 0 0 "[ . 1 . 2]" 1 464 1 23 TRP HZ3 1 43 THR HB 4.550 . 5.230 4.049 3.492 4.473 . 0 0 "[ . 1 . 2]" 1 465 2 23 TRP HZ3 2 43 THR HB 4.550 . 5.230 4.028 3.491 4.289 . 0 0 "[ . 1 . 2]" 1 466 1 25 LYS HA 1 43 THR HB 4.660 . 5.360 4.558 4.299 4.853 . 0 0 "[ . 1 . 2]" 1 467 2 25 LYS HA 2 43 THR HB 4.660 . 5.360 4.614 4.294 4.801 . 0 0 "[ . 1 . 2]" 1 468 1 42 ARG HA 1 43 THR HB 5.460 . 6.280 4.995 4.839 5.152 . 0 0 "[ . 1 . 2]" 1 469 2 42 ARG HA 2 43 THR HB 5.460 . 6.280 5.007 4.842 5.190 . 0 0 "[ . 1 . 2]" 1 470 1 23 TRP HB3 1 43 THR HB 4.280 . 4.920 4.301 4.147 4.716 . 0 0 "[ . 1 . 2]" 1 471 2 23 TRP HB3 2 43 THR HB 4.280 . 4.920 4.262 4.057 4.475 . 0 0 "[ . 1 . 2]" 1 472 1 55 ILE HB 1 56 THR H 4.180 . 4.810 3.946 3.879 4.016 . 0 0 "[ . 1 . 2]" 1 473 2 55 ILE HB 2 56 THR H 4.180 . 4.810 3.954 3.898 4.069 . 0 0 "[ . 1 . 2]" 1 474 1 56 THR HB 1 57 LEU H 3.800 . 4.370 3.206 2.781 3.728 . 0 0 "[ . 1 . 2]" 1 475 2 56 THR HB 2 57 LEU H 3.800 . 4.370 3.180 2.818 3.709 . 0 0 "[ . 1 . 2]" 1 476 1 56 THR H 1 56 THR HB 4.150 . 4.770 3.384 2.835 3.694 . 0 0 "[ . 1 . 2]" 1 477 2 56 THR H 2 56 THR HB 4.150 . 4.770 3.398 2.818 3.696 . 0 0 "[ . 1 . 2]" 1 478 1 38 LYS HE2 1 56 THR HB 6.000 . 6.900 5.351 4.107 6.492 . 0 0 "[ . 1 . 2]" 1 479 2 38 LYS HE2 2 56 THR HB 6.000 . 6.900 5.323 4.491 6.516 . 0 0 "[ . 1 . 2]" 1 480 1 38 LYS HE3 1 56 THR HB 6.000 . 6.900 5.391 3.687 6.608 . 0 0 "[ . 1 . 2]" 1 481 2 38 LYS HE3 2 56 THR HB 6.000 . 6.900 5.411 4.612 6.527 . 0 0 "[ . 1 . 2]" 1 482 1 38 LYS HD2 1 56 THR HB 3.810 . 4.380 3.216 2.426 4.262 . 0 0 "[ . 1 . 2]" 1 483 2 38 LYS HD2 2 56 THR HB 3.810 . 4.380 3.152 2.391 4.142 . 0 0 "[ . 1 . 2]" 1 484 1 38 LYS HD3 1 56 THR HB 4.150 . 4.770 2.981 1.911 4.048 . 0 0 "[ . 1 . 2]" 1 485 2 38 LYS HD3 2 56 THR HB 4.150 . 4.770 2.951 2.195 4.061 . 0 0 "[ . 1 . 2]" 1 486 1 16 LEU MD2 2 64 VAL HB 3.650 . 4.200 2.793 2.498 3.009 . 0 0 "[ . 1 . 2]" 1 487 1 64 VAL HB 2 16 LEU MD2 3.650 . 4.200 2.722 2.470 3.056 . 0 0 "[ . 1 . 2]" 1 488 1 4 LYS H 1 4 LYS HB2 3.770 . 4.340 3.062 2.372 3.702 . 0 0 "[ . 1 . 2]" 1 489 2 4 LYS H 2 4 LYS HB2 3.770 . 4.340 3.046 2.617 3.684 . 0 0 "[ . 1 . 2]" 1 490 1 5 LEU QB 1 32 TRP HE3 4.640 . 5.130 2.480 1.918 3.116 . 0 0 "[ . 1 . 2]" 1 491 2 5 LEU HB3 2 32 TRP HE3 4.640 . 5.340 2.558 2.136 3.845 . 0 0 "[ . 1 . 2]" 1 492 2 5 LEU HB2 2 32 TRP HE3 4.460 . 5.130 3.610 2.622 5.020 . 0 0 "[ . 1 . 2]" 1 493 1 5 LEU QB 1 32 TRP HZ3 4.490 . 5.000 3.020 2.397 3.550 . 0 0 "[ . 1 . 2]" 1 494 2 5 LEU HB3 2 32 TRP HZ3 4.490 . 5.160 3.481 2.828 4.666 . 0 0 "[ . 1 . 2]" 1 495 1 5 LEU QB 1 7 PHE QD 5.000 . 5.750 3.988 3.195 4.847 . 0 0 "[ . 1 . 2]" 1 496 2 5 LEU HB2 2 7 PHE HD1 5.000 . 5.750 4.237 3.105 5.305 . 0 0 "[ . 1 . 2]" 1 497 1 4 LYS HA 1 5 LEU QB 4.800 . 5.520 4.557 4.466 4.648 . 0 0 "[ . 1 . 2]" 1 498 2 4 LYS HA 2 5 LEU HB2 4.800 . 5.520 4.763 4.657 4.990 . 0 0 "[ . 1 . 2]" 1 499 1 5 LEU QB 1 6 LYS HD2 5.440 . 6.260 5.330 5.037 5.611 . 0 0 "[ . 1 . 2]" 1 500 2 5 LEU HB3 2 6 LYS HD2 5.440 . 6.260 6.002 5.726 6.214 . 0 0 "[ . 1 . 2]" 1 501 1 5 LEU QB 1 5 LEU MD2 3.240 . 3.270 2.448 2.364 2.532 . 0 0 "[ . 1 . 2]" 1 502 2 5 LEU HB2 2 5 LEU MD2 3.240 . 3.730 3.254 3.242 3.267 . 0 0 "[ . 1 . 2]" 1 503 1 6 LYS HB2 1 33 ASN H 4.150 . 4.770 2.603 2.125 3.005 . 0 0 "[ . 1 . 2]" 1 504 2 6 LYS HB2 2 33 ASN H 4.150 . 4.770 2.626 2.345 3.082 . 0 0 "[ . 1 . 2]" 1 505 1 6 LYS H 1 6 LYS HB2 3.410 . 3.920 2.611 2.508 2.712 . 0 0 "[ . 1 . 2]" 1 506 2 6 LYS H 2 6 LYS HB2 3.410 . 3.920 2.604 2.519 2.698 . 0 0 "[ . 1 . 2]" 1 507 1 6 LYS HB2 1 7 PHE H 4.020 . 4.620 3.952 3.571 4.209 . 0 0 "[ . 1 . 2]" 1 508 2 6 LYS HB2 2 7 PHE H 4.020 . 4.620 3.972 3.735 4.142 . 0 0 "[ . 1 . 2]" 1 509 1 6 LYS HB2 1 33 ASN HA 3.600 . 4.140 2.021 1.720 2.406 0.080 9 0 "[ . 1 . 2]" 1 510 2 6 LYS HB2 2 33 ASN HA 3.600 . 4.140 1.960 1.748 2.300 0.052 9 0 "[ . 1 . 2]" 1 511 1 6 LYS HB2 1 33 ASN HB3 4.660 . 5.360 4.366 3.528 5.235 . 0 0 "[ . 1 . 2]" 1 512 2 6 LYS HB2 2 33 ASN HB3 4.660 . 5.360 4.324 3.831 4.764 . 0 0 "[ . 1 . 2]" 1 513 1 6 LYS HB2 1 6 LYS HE2 4.900 . 5.640 4.095 3.764 4.407 . 0 0 "[ . 1 . 2]" 1 514 2 6 LYS HB2 2 6 LYS HE2 4.900 . 5.640 4.111 3.739 4.416 . 0 0 "[ . 1 . 2]" 1 515 1 6 LYS HB2 1 6 LYS HE3 4.900 . 5.640 4.281 3.658 5.160 . 0 0 "[ . 1 . 2]" 1 516 2 6 LYS HB2 2 6 LYS HE3 4.900 . 5.640 4.243 3.613 5.127 . 0 0 "[ . 1 . 2]" 1 517 1 6 LYS HB2 1 33 ASN HB2 4.610 . 5.300 4.655 4.276 5.028 . 0 0 "[ . 1 . 2]" 1 518 2 6 LYS HB2 2 33 ASN HB2 4.610 . 5.300 4.598 4.003 4.880 . 0 0 "[ . 1 . 2]" 1 519 1 6 LYS HB2 1 6 LYS HD2 3.760 . 4.320 3.789 3.740 3.834 . 0 0 "[ . 1 . 2]" 1 520 2 6 LYS HB2 2 6 LYS HD2 3.760 . 4.320 3.793 3.753 3.834 . 0 0 "[ . 1 . 2]" 1 521 1 69 LEU H 1 69 LEU HB3 3.710 . 4.270 3.653 3.635 3.665 . 0 0 "[ . 1 . 2]" 1 522 2 69 LEU H 2 69 LEU HB3 3.710 . 4.270 3.653 3.619 3.681 . 0 0 "[ . 1 . 2]" 1 523 1 7 PHE HB3 1 8 GLU H 4.270 . 4.910 4.144 3.924 4.307 . 0 0 "[ . 1 . 2]" 1 524 2 7 PHE HB3 2 8 GLU H 4.270 . 4.910 4.120 3.921 4.267 . 0 0 "[ . 1 . 2]" 1 525 1 73 LEU H 1 73 LEU HB3 3.600 . 4.140 3.653 3.614 3.751 . 0 0 "[ . 1 . 2]" 1 526 2 73 LEU H 2 73 LEU HB3 3.600 . 4.140 3.643 3.611 3.781 . 0 0 "[ . 1 . 2]" 1 527 1 7 PHE HB3 1 32 TRP HE3 3.210 . 3.690 3.040 2.768 3.411 . 0 0 "[ . 1 . 2]" 1 528 2 7 PHE HB3 2 32 TRP HE3 3.210 . 3.690 3.030 2.705 3.327 . 0 0 "[ . 1 . 2]" 1 529 1 7 PHE HB3 1 7 PHE QD 2.810 . 3.230 2.482 2.395 2.546 . 0 0 "[ . 1 . 2]" 1 530 2 7 PHE HB3 2 7 PHE HD1 2.810 . 3.230 2.520 2.463 2.590 . 0 0 "[ . 1 . 2]" 1 531 1 70 GLY HA2 1 73 LEU HB3 4.700 . 5.400 4.285 3.886 4.776 . 0 0 "[ . 1 . 2]" 1 532 2 70 GLY HA2 2 73 LEU HB3 4.700 . 5.400 4.289 3.860 4.845 . 0 0 "[ . 1 . 2]" 1 533 1 73 LEU HB3 1 73 LEU MD1 3.250 . 3.740 2.414 2.363 2.466 . 0 0 "[ . 1 . 2]" 1 534 2 73 LEU HB3 2 73 LEU MD1 3.250 . 3.740 2.426 2.384 2.475 . 0 0 "[ . 1 . 2]" 1 535 1 7 PHE HB3 1 30 VAL MG1 4.050 . 4.660 3.080 2.801 3.393 . 0 0 "[ . 1 . 2]" 1 536 2 7 PHE HB3 2 30 VAL MG1 4.050 . 4.660 3.045 2.808 3.250 . 0 0 "[ . 1 . 2]" 1 537 1 8 GLU HB3 1 31 SER H 4.380 . 5.040 3.530 3.136 4.314 . 0 0 "[ . 1 . 2]" 1 538 2 8 GLU HB3 2 31 SER H 4.380 . 5.040 3.557 3.251 4.149 . 0 0 "[ . 1 . 2]" 1 539 1 7 PHE QD 1 8 GLU HB2 5.490 . 6.310 5.722 5.105 6.015 . 0 0 "[ . 1 . 2]" 1 540 2 7 PHE HD2 2 8 GLU HB2 5.490 . 6.310 5.961 5.364 6.351 0.041 13 0 "[ . 1 . 2]" 1 541 1 7 PHE HA 1 8 GLU HB3 4.480 . 5.150 4.608 4.470 4.784 . 0 0 "[ . 1 . 2]" 1 542 2 7 PHE HA 2 8 GLU HB3 4.480 . 5.150 4.610 4.402 4.830 . 0 0 "[ . 1 . 2]" 1 543 1 8 GLU HB3 1 10 ILE MD 3.710 . 4.270 3.014 2.634 3.320 . 0 0 "[ . 1 . 2]" 1 544 2 8 GLU HB3 2 10 ILE MD 3.710 . 4.270 3.015 2.472 3.410 . 0 0 "[ . 1 . 2]" 1 545 1 8 GLU HB3 1 30 VAL MG1 4.510 . 5.190 4.301 4.066 4.587 . 0 0 "[ . 1 . 2]" 1 546 2 8 GLU HB3 2 30 VAL MG1 4.510 . 5.190 4.317 4.110 4.847 . 0 0 "[ . 1 . 2]" 1 547 1 11 GLU HB3 1 12 GLU H 4.260 . 4.900 3.932 3.840 4.105 . 0 0 "[ . 1 . 2]" 1 548 2 11 GLU HB3 2 12 GLU H 4.260 . 4.900 3.956 3.809 4.137 . 0 0 "[ . 1 . 2]" 1 549 1 6 LYS H 1 6 LYS HB3 3.780 . 4.350 3.732 3.584 3.814 . 0 0 "[ . 1 . 2]" 1 550 2 6 LYS H 2 6 LYS HB3 3.780 . 4.350 3.741 3.595 3.804 . 0 0 "[ . 1 . 2]" 1 551 1 6 LYS HB3 1 33 ASN HA 3.890 . 4.470 3.614 2.909 4.081 . 0 0 "[ . 1 . 2]" 1 552 2 6 LYS HB3 2 33 ASN HA 3.890 . 4.470 3.530 3.174 3.852 . 0 0 "[ . 1 . 2]" 1 553 1 9 ILE MG 1 12 GLU HB3 5.680 . 6.530 4.629 4.214 5.222 . 0 0 "[ . 1 . 2]" 1 554 2 9 ILE MG 2 12 GLU HB3 5.680 . 6.530 4.629 4.310 4.975 . 0 0 "[ . 1 . 2]" 1 555 1 13 LEU HB3 1 27 LEU HG 4.290 . 4.930 3.600 3.333 3.950 . 0 0 "[ . 1 . 2]" 1 556 2 13 LEU HB3 2 27 LEU HG 4.290 . 4.930 3.609 3.295 3.850 . 0 0 "[ . 1 . 2]" 1 557 1 13 LEU HB3 1 14 ILE HG13 4.400 . 5.060 2.531 2.287 2.713 . 0 0 "[ . 1 . 2]" 1 558 2 13 LEU HB3 2 14 ILE HG13 4.400 . 5.060 2.510 2.328 2.781 . 0 0 "[ . 1 . 2]" 1 559 1 13 LEU HB3 1 27 LEU QD 4.490 . 5.160 3.157 2.992 3.360 . 0 0 "[ . 1 . 2]" 1 560 2 13 LEU HB3 2 27 LEU QD 4.490 . 5.160 3.147 2.859 3.544 . 0 0 "[ . 1 . 2]" 1 561 1 17 SER HB2 1 18 GLU H 4.000 . 4.600 3.764 2.173 4.034 . 0 0 "[ . 1 . 2]" 1 562 2 17 SER HB2 2 18 GLU H 4.000 . 4.600 3.760 2.335 4.114 . 0 0 "[ . 1 . 2]" 1 563 1 18 GLU H 1 18 GLU HB2 4.060 . 4.670 3.257 3.141 3.366 . 0 0 "[ . 1 . 2]" 1 564 2 18 GLU H 2 18 GLU HB2 4.060 . 4.670 3.234 3.127 3.375 . 0 0 "[ . 1 . 2]" 1 565 1 18 GLU HB2 1 24 ARG HA 4.500 . 5.180 3.929 3.613 4.164 . 0 0 "[ . 1 . 2]" 1 566 2 18 GLU HB2 2 24 ARG HA 4.500 . 5.180 4.052 3.733 4.456 . 0 0 "[ . 1 . 2]" 1 567 1 15 VAL MG1 1 18 GLU HB2 4.300 . 4.950 3.255 2.580 3.753 . 0 0 "[ . 1 . 2]" 1 568 2 15 VAL MG1 2 18 GLU HB2 4.300 . 4.950 3.333 2.672 3.767 . 0 0 "[ . 1 . 2]" 1 569 1 19 ASN HD22 1 21 LYS HB2 4.610 . 5.300 3.727 2.538 4.987 . 0 0 "[ . 1 . 2]" 1 570 2 19 ASN HD22 2 21 LYS HB2 4.610 . 5.300 3.595 2.575 5.158 . 0 0 "[ . 1 . 2]" 1 571 1 23 TRP H 1 23 TRP HB3 4.200 . 4.830 3.618 3.597 3.658 . 0 0 "[ . 1 . 2]" 1 572 2 23 TRP H 2 23 TRP HB3 4.200 . 4.830 3.604 3.562 3.671 . 0 0 "[ . 1 . 2]" 1 573 1 23 TRP HB3 1 23 TRP HE3 4.040 . 4.650 2.414 2.347 2.455 . 0 0 "[ . 1 . 2]" 1 574 2 23 TRP HB3 2 23 TRP HE3 4.040 . 4.650 2.411 2.370 2.496 . 0 0 "[ . 1 . 2]" 1 575 1 19 ASN HD22 1 23 TRP HB3 5.470 . 6.290 5.233 4.850 6.196 . 0 0 "[ . 1 . 2]" 1 576 2 19 ASN HD22 2 23 TRP HB3 5.470 . 6.290 5.310 4.875 6.032 . 0 0 "[ . 1 . 2]" 1 577 1 23 TRP HB3 1 43 THR MG 4.320 . 4.970 1.949 1.833 2.230 . 0 0 "[ . 1 . 2]" 1 578 2 23 TRP HB3 2 43 THR MG 4.320 . 4.970 1.900 1.781 2.119 0.019 13 0 "[ . 1 . 2]" 1 579 1 15 VAL MG1 1 24 ARG HB2 5.090 . 5.850 3.752 3.316 4.166 . 0 0 "[ . 1 . 2]" 1 580 2 15 VAL MG1 2 24 ARG HB2 5.090 . 5.850 3.882 3.366 4.342 . 0 0 "[ . 1 . 2]" 1 581 1 13 LEU QD 1 27 LEU HB3 4.250 . 4.890 3.836 3.693 4.002 . 0 0 "[ . 1 . 2]" 1 582 2 13 LEU QD 2 27 LEU HB3 4.250 . 4.890 3.842 3.743 3.923 . 0 0 "[ . 1 . 2]" 1 583 1 14 ILE MD 1 27 LEU HB3 4.580 . 5.270 3.211 2.948 3.530 . 0 0 "[ . 1 . 2]" 1 584 2 14 ILE MD 2 27 LEU HB3 4.580 . 5.270 3.243 3.004 3.508 . 0 0 "[ . 1 . 2]" 1 585 1 11 GLU H 1 29 ARG HB2 4.620 . 5.310 3.080 2.546 4.709 . 0 0 "[ . 1 . 2]" 1 586 2 11 GLU H 2 29 ARG HB2 4.620 . 5.310 2.959 2.554 4.609 . 0 0 "[ . 1 . 2]" 1 587 1 11 GLU HB3 1 29 ARG HB2 4.490 . 5.160 2.361 1.867 3.393 . 0 0 "[ . 1 . 2]" 1 588 2 11 GLU HB3 2 29 ARG HB2 4.490 . 5.160 2.277 1.797 3.489 0.003 6 0 "[ . 1 . 2]" 1 589 1 11 GLU HB2 1 29 ARG HB2 4.540 . 5.220 3.717 3.185 5.003 . 0 0 "[ . 1 . 2]" 1 590 2 11 GLU HB2 2 29 ARG HB2 4.540 . 5.220 3.603 3.148 5.068 . 0 0 "[ . 1 . 2]" 1 591 1 10 ILE MG 1 29 ARG HB2 4.090 . 4.700 3.944 3.463 4.820 0.120 18 0 "[ . 1 . 2]" 1 592 2 10 ILE MG 2 29 ARG HB2 4.090 . 4.700 3.880 3.385 4.873 0.173 7 0 "[ . 1 . 2]" 1 593 1 10 ILE HG12 1 31 SER HB2 4.990 . 5.740 3.128 2.769 4.481 . 0 0 "[ . 1 . 2]" 1 594 2 10 ILE HG12 2 31 SER HB2 4.990 . 5.740 3.221 2.760 4.976 . 0 0 "[ . 1 . 2]" 1 595 1 10 ILE HG12 1 31 SER HB3 4.990 . 5.740 3.280 2.926 3.614 . 0 0 "[ . 1 . 2]" 1 596 2 10 ILE HG12 2 31 SER HB3 4.990 . 5.740 3.336 2.955 3.670 . 0 0 "[ . 1 . 2]" 1 597 1 33 ASN HB3 1 34 ASP H 4.490 . 5.160 4.464 4.346 4.507 . 0 0 "[ . 1 . 2]" 1 598 2 33 ASN HB3 2 34 ASP H 4.490 . 5.160 4.469 4.358 4.529 . 0 0 "[ . 1 . 2]" 1 599 1 6 LYS H 1 33 ASN HB3 4.830 . 5.550 4.540 4.153 4.841 . 0 0 "[ . 1 . 2]" 1 600 2 6 LYS H 2 33 ASN HB3 4.830 . 5.550 4.566 3.889 5.005 . 0 0 "[ . 1 . 2]" 1 601 1 32 TRP HA 1 33 ASN HB3 5.760 . 6.620 5.725 5.304 5.812 . 0 0 "[ . 1 . 2]" 1 602 2 32 TRP HA 2 33 ASN HB3 5.760 . 6.620 5.727 4.926 5.837 . 0 0 "[ . 1 . 2]" 1 603 1 33 ASN HB3 1 35 ALA MB 4.160 . 4.780 4.424 3.368 4.867 0.087 5 0 "[ . 1 . 2]" 1 604 2 33 ASN HB3 2 35 ALA MB 4.160 . 4.780 4.270 3.808 4.593 . 0 0 "[ . 1 . 2]" 1 605 1 6 LYS HG2 1 33 ASN HB3 5.490 . 6.310 5.006 4.567 5.612 . 0 0 "[ . 1 . 2]" 1 606 2 6 LYS HG2 2 33 ASN HB3 5.490 . 6.310 5.147 4.536 5.974 . 0 0 "[ . 1 . 2]" 1 607 1 34 ASP H 1 34 ASP HB3 4.160 . 4.780 3.882 3.536 4.143 . 0 0 "[ . 1 . 2]" 1 608 2 34 ASP H 2 34 ASP HB3 4.160 . 4.780 3.829 3.507 4.125 . 0 0 "[ . 1 . 2]" 1 609 1 34 ASP HB3 1 35 ALA H 4.570 . 5.260 4.382 4.142 4.534 . 0 0 "[ . 1 . 2]" 1 610 2 34 ASP HB3 2 35 ALA H 4.570 . 5.260 4.341 4.000 4.523 . 0 0 "[ . 1 . 2]" 1 611 1 34 ASP HB3 1 35 ALA MB 5.380 . 6.190 5.324 4.847 5.588 . 0 0 "[ . 1 . 2]" 1 612 2 34 ASP HB3 2 35 ALA MB 5.380 . 6.190 5.240 4.689 5.574 . 0 0 "[ . 1 . 2]" 1 613 1 10 ILE MD 1 37 PRO HG3 4.220 . 4.850 3.917 2.898 4.819 . 0 0 "[ . 1 . 2]" 1 614 2 10 ILE MD 2 37 PRO HG3 4.220 . 4.850 3.839 3.088 4.714 . 0 0 "[ . 1 . 2]" 1 615 1 37 PRO HB3 1 38 LYS H 4.250 . 4.890 3.853 3.465 4.163 . 0 0 "[ . 1 . 2]" 1 616 2 37 PRO HB3 2 38 LYS H 4.250 . 4.890 3.809 3.303 4.138 . 0 0 "[ . 1 . 2]" 1 617 1 10 ILE MG 1 37 PRO HB3 4.370 . 5.030 2.896 2.139 3.564 . 0 0 "[ . 1 . 2]" 1 618 2 10 ILE MG 2 37 PRO HB3 4.370 . 5.030 3.056 2.413 3.695 . 0 0 "[ . 1 . 2]" 1 619 1 10 ILE MD 1 37 PRO HB3 4.160 . 4.780 3.370 2.926 3.747 . 0 0 "[ . 1 . 2]" 1 620 2 10 ILE MD 2 37 PRO HB3 4.160 . 4.780 3.405 2.918 3.681 . 0 0 "[ . 1 . 2]" 1 621 1 38 LYS HB3 1 39 TYR H 4.600 . 5.290 3.640 3.492 3.840 . 0 0 "[ . 1 . 2]" 1 622 2 38 LYS HB3 2 39 TYR H 4.600 . 5.290 3.624 3.404 3.817 . 0 0 "[ . 1 . 2]" 1 623 1 38 LYS HB3 1 38 LYS HD3 3.490 . 4.010 3.127 2.921 3.376 . 0 0 "[ . 1 . 2]" 1 624 2 38 LYS HB3 2 38 LYS HD3 3.490 . 4.010 3.151 2.921 3.275 . 0 0 "[ . 1 . 2]" 1 625 1 38 LYS HB3 1 56 THR MG 5.020 . 5.770 5.235 4.278 5.814 0.044 9 0 "[ . 1 . 2]" 1 626 2 38 LYS HB3 2 56 THR MG 5.020 . 5.770 5.274 4.225 5.902 0.132 20 0 "[ . 1 . 2]" 1 627 1 30 VAL HB 1 40 ASP HB2 4.650 . 5.350 2.853 2.178 3.754 . 0 0 "[ . 1 . 2]" 1 628 2 30 VAL HB 2 40 ASP HB2 4.650 . 5.350 2.731 2.453 3.109 . 0 0 "[ . 1 . 2]" 1 629 1 40 ASP HB2 1 56 THR MG 4.680 . 5.380 2.953 2.103 5.040 . 0 0 "[ . 1 . 2]" 1 630 2 40 ASP HB2 2 56 THR MG 4.680 . 5.380 3.108 2.423 4.787 . 0 0 "[ . 1 . 2]" 1 631 1 21 LYS HB3 1 22 GLY H 4.360 . 5.010 4.186 3.844 4.416 . 0 0 "[ . 1 . 2]" 1 632 2 21 LYS HB3 2 22 GLY H 4.360 . 5.010 4.190 3.979 4.421 . 0 0 "[ . 1 . 2]" 1 633 1 49 GLU H 1 49 GLU HB3 3.730 . 4.290 2.816 2.582 3.266 . 0 0 "[ . 1 . 2]" 1 634 2 49 GLU H 2 49 GLU HB3 3.730 . 4.290 2.849 2.601 3.326 . 0 0 "[ . 1 . 2]" 1 635 1 50 LYS HB2 1 51 MET H 4.550 . 5.230 3.747 3.207 4.153 . 0 0 "[ . 1 . 2]" 1 636 2 50 LYS HB2 2 51 MET H 4.550 . 5.230 3.915 3.156 4.253 . 0 0 "[ . 1 . 2]" 1 637 1 50 LYS HB2 1 50 LYS HD3 4.070 . 4.680 3.310 2.483 3.631 . 0 0 "[ . 1 . 2]" 1 638 2 50 LYS HB2 2 50 LYS HD3 4.070 . 4.680 3.458 2.528 3.619 . 0 0 "[ . 1 . 2]" 1 639 1 51 MET HB3 1 51 MET ME 4.200 . 4.830 3.659 2.096 4.092 . 0 0 "[ . 1 . 2]" 1 640 2 51 MET HB3 2 51 MET ME 4.200 . 4.830 3.452 2.055 4.081 . 0 0 "[ . 1 . 2]" 1 641 1 18 GLU HB3 1 19 ASN H 4.190 . 4.820 4.118 4.010 4.234 . 0 0 "[ . 1 . 2]" 1 642 2 18 GLU HB3 2 19 ASN H 4.190 . 4.820 4.141 4.031 4.259 . 0 0 "[ . 1 . 2]" 1 643 1 59 GLU H 1 59 GLU HB3 3.600 . 4.140 3.596 3.530 3.646 . 0 0 "[ . 1 . 2]" 1 644 2 59 GLU H 2 59 GLU HB3 3.600 . 4.140 3.598 3.548 3.647 . 0 0 "[ . 1 . 2]" 1 645 1 59 GLU HB3 1 60 GLU H 3.710 . 4.270 3.706 3.119 3.894 . 0 0 "[ . 1 . 2]" 1 646 2 59 GLU HB3 2 60 GLU H 3.710 . 4.270 3.758 3.458 3.920 . 0 0 "[ . 1 . 2]" 1 647 1 39 TYR QE 1 59 GLU HB3 4.910 . 5.650 3.481 3.016 4.664 . 0 0 "[ . 1 . 2]" 1 648 2 39 TYR QE 2 59 GLU HB3 4.910 . 5.650 3.449 2.653 4.351 . 0 0 "[ . 1 . 2]" 1 649 1 60 GLU H 1 60 GLU HB2 3.490 . 4.010 2.568 2.441 2.754 . 0 0 "[ . 1 . 2]" 1 650 2 60 GLU H 2 60 GLU HB2 3.760 . 4.320 2.542 2.412 2.665 . 0 0 "[ . 1 . 2]" 1 651 1 62 PHE H 1 62 PHE HB2 4.130 . 4.750 2.452 2.343 2.537 . 0 0 "[ . 1 . 2]" 1 652 2 62 PHE H 2 62 PHE HB2 4.130 . 4.750 2.463 2.361 2.534 . 0 0 "[ . 1 . 2]" 1 653 1 66 LEU HB3 1 67 LYS HA 4.510 . 5.190 4.371 4.221 4.527 . 0 0 "[ . 1 . 2]" 1 654 2 66 LEU HB3 2 67 LYS HA 4.510 . 5.190 4.374 4.238 4.519 . 0 0 "[ . 1 . 2]" 1 655 1 66 LEU HB3 1 66 LEU MD1 3.340 . 3.840 2.425 2.379 2.471 . 0 0 "[ . 1 . 2]" 1 656 2 66 LEU HB3 2 66 LEU MD1 3.340 . 3.840 2.438 2.394 2.513 . 0 0 "[ . 1 . 2]" 1 657 1 67 LYS HB2 1 68 GLU H 3.510 . 4.040 2.337 2.190 2.474 . 0 0 "[ . 1 . 2]" 1 658 2 67 LYS HB2 2 68 GLU H 3.510 . 4.040 2.311 2.207 2.409 . 0 0 "[ . 1 . 2]" 1 659 1 67 LYS HB3 1 68 GLU HA 4.640 . 5.340 4.074 3.839 4.352 . 0 0 "[ . 1 . 2]" 1 660 2 67 LYS HB3 2 68 GLU HA 4.640 . 5.340 4.081 3.820 4.422 . 0 0 "[ . 1 . 2]" 1 661 1 67 LYS HB2 1 68 GLU HA 5.050 . 5.810 4.334 4.136 4.449 . 0 0 "[ . 1 . 2]" 1 662 2 67 LYS HB2 2 68 GLU HA 5.050 . 5.810 4.312 3.903 4.450 . 0 0 "[ . 1 . 2]" 1 663 1 60 GLU HB3 1 61 GLU H 3.990 . 4.590 3.482 3.335 3.902 . 0 0 "[ . 1 . 2]" 1 664 2 60 GLU HB3 2 61 GLU H 3.990 . 4.590 3.453 3.185 3.906 . 0 0 "[ . 1 . 2]" 1 665 1 69 LEU H 1 69 LEU HB2 4.020 . 4.620 2.470 2.441 2.499 . 0 0 "[ . 1 . 2]" 1 666 2 69 LEU H 2 69 LEU HB2 4.020 . 4.620 2.476 2.420 2.557 . 0 0 "[ . 1 . 2]" 1 667 1 63 GLY HA3 1 66 LEU HB2 4.890 . 5.620 4.389 4.186 4.612 . 0 0 "[ . 1 . 2]" 1 668 2 63 GLY HA3 2 66 LEU HB2 4.890 . 5.620 4.444 4.202 4.819 . 0 0 "[ . 1 . 2]" 1 669 1 66 LEU HB2 1 67 LYS HA 5.150 . 5.920 4.283 4.156 4.417 . 0 0 "[ . 1 . 2]" 1 670 2 66 LEU HB2 2 67 LYS HA 5.150 . 5.920 4.284 4.193 4.360 . 0 0 "[ . 1 . 2]" 1 671 1 66 LEU HB2 1 67 LYS HB2 4.880 . 5.610 4.726 4.549 4.889 . 0 0 "[ . 1 . 2]" 1 672 2 66 LEU HB2 2 67 LYS HB2 4.880 . 5.610 4.752 4.525 5.146 . 0 0 "[ . 1 . 2]" 1 673 1 73 LEU MD1 2 66 LEU HB2 4.030 . 4.630 4.351 3.563 4.863 0.233 19 0 "[ . 1 . 2]" 1 674 1 66 LEU HB2 2 73 LEU MD1 4.030 . 4.630 4.492 3.695 4.769 0.139 19 0 "[ . 1 . 2]" 1 675 1 73 LEU MD2 2 66 LEU HB2 4.350 . 5.000 3.326 3.065 4.006 . 0 0 "[ . 1 . 2]" 1 676 1 66 LEU HB2 2 73 LEU MD2 4.350 . 5.000 3.182 3.001 3.522 . 0 0 "[ . 1 . 2]" 1 677 1 66 LEU HB2 1 66 LEU MD1 3.310 . 3.810 2.387 2.348 2.418 . 0 0 "[ . 1 . 2]" 1 678 2 66 LEU HB2 2 66 LEU MD1 3.310 . 3.810 2.379 2.332 2.432 . 0 0 "[ . 1 . 2]" 1 679 1 71 ASN H 1 71 ASN HB2 3.250 . 3.740 2.535 2.380 2.632 . 0 0 "[ . 1 . 2]" 1 680 2 71 ASN H 2 71 ASN HB2 3.250 . 3.740 2.541 2.426 2.623 . 0 0 "[ . 1 . 2]" 1 681 1 68 GLU HB3 1 71 ASN HB2 4.450 . 5.120 4.132 3.855 4.568 . 0 0 "[ . 1 . 2]" 1 682 2 68 GLU HB3 2 71 ASN HB2 4.450 . 5.120 4.140 3.876 4.485 . 0 0 "[ . 1 . 2]" 1 683 1 71 ASN HB2 1 72 LYS HD2 5.490 . 6.310 5.457 5.061 6.201 . 0 0 "[ . 1 . 2]" 1 684 2 71 ASN HB2 2 72 LYS HD2 5.490 . 6.310 5.450 5.051 6.183 . 0 0 "[ . 1 . 2]" 1 685 1 71 ASN HB2 1 72 LYS HD3 5.490 . 6.310 5.813 5.171 6.395 0.085 6 0 "[ . 1 . 2]" 1 686 2 71 ASN HB2 2 72 LYS HD3 5.490 . 6.310 5.746 4.833 6.495 0.185 17 0 "[ . 1 . 2]" 1 687 1 14 ILE MD 2 71 ASN HB2 5.140 . 5.910 5.552 5.161 5.833 . 0 0 "[ . 1 . 2]" 1 688 1 71 ASN HB2 2 14 ILE MD 5.140 . 5.910 5.506 5.272 5.906 . 0 0 "[ . 1 . 2]" 1 689 1 68 GLU HB3 1 71 ASN H 5.250 . 6.040 5.204 5.066 5.298 . 0 0 "[ . 1 . 2]" 1 690 2 68 GLU HB3 2 71 ASN H 5.250 . 6.040 5.198 4.970 5.327 . 0 0 "[ . 1 . 2]" 1 691 1 50 LYS HA 1 50 LYS HD3 4.040 . 4.650 3.934 3.269 4.712 0.062 10 0 "[ . 1 . 2]" 1 692 2 50 LYS HA 2 50 LYS HD3 4.040 . 4.650 3.719 3.308 4.710 0.060 1 0 "[ . 1 . 2]" 1 693 2 5 LEU HB2 2 6 LYS HD2 5.450 . 6.270 5.963 5.692 6.301 0.031 18 0 "[ . 1 . 2]" 1 694 1 7 PHE HB2 1 32 TRP HE3 4.750 . 5.460 4.538 4.178 4.952 . 0 0 "[ . 1 . 2]" 1 695 2 7 PHE HB2 2 32 TRP HE3 4.750 . 5.460 4.551 4.244 4.896 . 0 0 "[ . 1 . 2]" 1 696 1 10 ILE MG 1 11 GLU HB2 3.840 . 4.420 2.933 2.597 3.217 . 0 0 "[ . 1 . 2]" 1 697 2 10 ILE MG 2 11 GLU HB2 3.840 . 4.420 2.964 2.399 3.532 . 0 0 "[ . 1 . 2]" 1 698 1 12 GLU HB2 1 13 LEU H 4.300 . 4.950 4.200 3.968 4.313 . 0 0 "[ . 1 . 2]" 1 699 2 12 GLU HB2 2 13 LEU H 4.300 . 4.950 4.231 4.048 4.326 . 0 0 "[ . 1 . 2]" 1 700 1 11 GLU HA 1 12 GLU HB2 4.990 . 5.740 4.691 4.576 4.908 . 0 0 "[ . 1 . 2]" 1 701 2 11 GLU HA 2 12 GLU HB2 4.990 . 5.740 4.706 4.557 4.854 . 0 0 "[ . 1 . 2]" 1 702 1 13 LEU HB2 1 27 LEU HG 4.300 . 4.950 2.475 2.330 2.787 . 0 0 "[ . 1 . 2]" 1 703 2 13 LEU HB2 2 27 LEU HG 4.300 . 4.950 2.479 2.265 2.685 . 0 0 "[ . 1 . 2]" 1 704 1 18 GLU HB3 1 24 ARG HA 5.130 . 5.900 4.994 4.766 5.155 . 0 0 "[ . 1 . 2]" 1 705 2 18 GLU HB3 2 24 ARG HA 5.130 . 5.900 5.086 4.831 5.388 . 0 0 "[ . 1 . 2]" 1 706 1 27 LEU HB2 1 41 ILE MD 3.650 . 4.200 3.193 2.861 3.477 . 0 0 "[ . 1 . 2]" 1 707 2 27 LEU HB2 2 41 ILE MD 3.650 . 4.200 3.273 2.976 3.555 . 0 0 "[ . 1 . 2]" 1 708 1 9 ILE MG 1 28 ASN HB3 4.470 . 5.140 3.652 3.324 4.014 . 0 0 "[ . 1 . 2]" 1 709 2 9 ILE MG 2 28 ASN HB3 4.470 . 5.140 3.595 3.165 4.013 . 0 0 "[ . 1 . 2]" 1 710 1 29 ARG HB3 1 30 VAL H 4.540 . 5.220 3.472 3.261 4.258 . 0 0 "[ . 1 . 2]" 1 711 2 29 ARG HB3 2 30 VAL H 4.540 . 5.220 3.421 3.205 4.228 . 0 0 "[ . 1 . 2]" 1 712 1 11 GLU H 1 29 ARG HB3 4.630 . 5.320 3.932 2.805 4.294 . 0 0 "[ . 1 . 2]" 1 713 2 11 GLU H 2 29 ARG HB3 4.630 . 5.320 3.965 2.955 4.315 . 0 0 "[ . 1 . 2]" 1 714 1 11 GLU HB3 1 29 ARG HB3 4.790 . 5.510 3.594 2.100 4.298 . 0 0 "[ . 1 . 2]" 1 715 2 11 GLU HB3 2 29 ARG HB3 4.790 . 5.510 3.667 2.095 4.155 . 0 0 "[ . 1 . 2]" 1 716 1 10 ILE MG 1 29 ARG HB3 4.190 . 4.820 3.882 3.490 4.332 . 0 0 "[ . 1 . 2]" 1 717 2 10 ILE MG 2 29 ARG HB3 4.190 . 4.820 3.860 3.398 4.433 . 0 0 "[ . 1 . 2]" 1 718 1 33 ASN HB2 1 34 ASP H 4.550 . 5.230 4.359 4.259 4.544 . 0 0 "[ . 1 . 2]" 1 719 2 33 ASN HB2 2 34 ASP H 4.550 . 5.230 4.359 4.255 4.587 . 0 0 "[ . 1 . 2]" 1 720 1 32 TRP HA 1 33 ASN HB2 4.570 . 5.260 4.578 4.177 4.763 . 0 0 "[ . 1 . 2]" 1 721 2 32 TRP HA 2 33 ASN HB2 4.570 . 5.260 4.570 4.136 4.773 . 0 0 "[ . 1 . 2]" 1 722 1 5 LEU QB 1 33 ASN HB2 4.650 . 5.350 4.969 2.533 5.302 . 0 0 "[ . 1 . 2]" 1 723 2 5 LEU HB3 2 33 ASN HB2 4.650 . 5.350 5.271 3.180 5.500 0.150 1 0 "[ . 1 . 2]" 1 724 1 33 ASN HB2 1 35 ALA MB 4.290 . 4.930 3.668 3.237 4.140 . 0 0 "[ . 1 . 2]" 1 725 2 33 ASN HB2 2 35 ALA MB 4.290 . 4.930 3.562 3.041 4.908 . 0 0 "[ . 1 . 2]" 1 726 1 5 LEU MD1 1 33 ASN HB2 4.980 . 5.730 5.503 3.194 5.897 0.167 19 0 "[ . 1 . 2]" 1 727 2 5 LEU MD1 2 33 ASN HB2 4.980 . 5.730 5.660 4.081 5.880 0.150 15 0 "[ . 1 . 2]" 1 728 1 37 PRO HB2 1 38 LYS H 4.190 . 4.820 3.627 3.041 4.048 . 0 0 "[ . 1 . 2]" 1 729 2 37 PRO HB2 2 38 LYS H 4.190 . 4.820 3.652 3.305 4.029 . 0 0 "[ . 1 . 2]" 1 730 1 29 ARG HB2 1 37 PRO HB2 4.840 . 5.570 5.123 4.603 5.608 0.038 10 0 "[ . 1 . 2]" 1 731 2 29 ARG HB2 2 37 PRO HB2 4.840 . 5.570 5.271 4.669 5.650 0.080 3 0 "[ . 1 . 2]" 1 732 1 29 ARG HB3 1 37 PRO HB2 4.460 . 5.130 3.919 3.213 5.170 0.040 6 0 "[ . 1 . 2]" 1 733 2 29 ARG HB3 2 37 PRO HB2 4.460 . 5.130 3.947 3.218 5.119 . 0 0 "[ . 1 . 2]" 1 734 1 10 ILE HG13 1 37 PRO HB2 4.230 . 4.860 3.223 2.616 3.747 . 0 0 "[ . 1 . 2]" 1 735 2 10 ILE HG13 2 37 PRO HB2 4.230 . 4.860 3.200 2.337 3.705 . 0 0 "[ . 1 . 2]" 1 736 1 10 ILE MG 1 37 PRO HB2 4.260 . 4.900 3.165 2.632 3.707 . 0 0 "[ . 1 . 2]" 1 737 2 10 ILE MG 2 37 PRO HB2 4.260 . 4.900 3.291 2.997 3.638 . 0 0 "[ . 1 . 2]" 1 738 1 10 ILE MD 1 37 PRO HB2 4.350 . 5.000 4.569 3.976 4.962 . 0 0 "[ . 1 . 2]" 1 739 2 10 ILE MD 2 37 PRO HB2 4.350 . 5.000 4.568 3.830 4.991 . 0 0 "[ . 1 . 2]" 1 740 1 38 LYS HB2 1 56 THR HB 4.800 . 5.520 4.896 4.174 5.745 0.225 20 0 "[ . 1 . 2]" 1 741 2 38 LYS HB2 2 56 THR HB 4.800 . 5.520 4.965 4.223 5.711 0.191 2 0 "[ . 1 . 2]" 1 742 1 38 LYS HB2 1 38 LYS HD3 3.480 . 4.000 2.550 2.483 2.654 . 0 0 "[ . 1 . 2]" 1 743 2 38 LYS HB2 2 38 LYS HD3 3.480 . 4.000 2.557 2.498 2.641 . 0 0 "[ . 1 . 2]" 1 744 1 38 LYS HB2 1 56 THR MG 4.390 . 5.050 4.458 3.288 5.165 0.115 19 0 "[ . 1 . 2]" 1 745 2 38 LYS HB2 2 56 THR MG 4.390 . 5.050 4.529 3.216 5.183 0.133 20 0 "[ . 1 . 2]" 1 746 1 40 ASP H 1 40 ASP HB3 4.200 . 4.830 2.888 2.666 3.814 . 0 0 "[ . 1 . 2]" 1 747 2 40 ASP H 2 40 ASP HB3 4.200 . 4.830 2.827 2.582 3.715 . 0 0 "[ . 1 . 2]" 1 748 1 30 VAL HB 1 40 ASP HB3 4.650 . 5.350 3.546 2.948 4.687 . 0 0 "[ . 1 . 2]" 1 749 2 30 VAL HB 2 40 ASP HB3 4.650 . 5.350 3.527 2.848 4.010 . 0 0 "[ . 1 . 2]" 1 750 1 49 GLU H 1 49 GLU HB2 3.870 . 4.450 3.674 3.594 3.821 . 0 0 "[ . 1 . 2]" 1 751 2 49 GLU H 2 49 GLU HB2 3.870 . 4.450 3.681 3.601 3.802 . 0 0 "[ . 1 . 2]" 1 752 1 49 GLU HB2 1 50 LYS HG2 4.400 . 5.060 4.049 3.411 4.741 . 0 0 "[ . 1 . 2]" 1 753 2 49 GLU HB2 2 50 LYS HG2 4.400 . 5.060 3.999 3.538 4.903 . 0 0 "[ . 1 . 2]" 1 754 1 50 LYS HB3 1 51 MET H 4.020 . 4.620 2.663 1.959 3.252 . 0 0 "[ . 1 . 2]" 1 755 2 50 LYS HB3 2 51 MET H 4.020 . 4.620 2.860 2.034 3.330 . 0 0 "[ . 1 . 2]" 1 756 1 53 LYS HB2 1 54 GLY H 4.540 . 5.220 4.302 3.235 4.470 . 0 0 "[ . 1 . 2]" 1 757 1 58 SER HB3 1 59 GLU HB2 4.280 . 4.920 4.319 3.743 4.541 . 0 0 "[ . 1 . 2]" 1 758 2 58 SER HB3 2 59 GLU HB2 4.280 . 4.920 4.349 3.986 4.530 . 0 0 "[ . 1 . 2]" 1 759 1 59 GLU HB2 1 60 GLU HA 4.320 . 4.970 4.456 4.232 4.571 . 0 0 "[ . 1 . 2]" 1 760 2 59 GLU HB2 2 60 GLU HA 4.320 . 4.970 4.426 4.226 4.747 . 0 0 "[ . 1 . 2]" 1 761 1 60 GLU H 1 60 GLU HB3 3.760 . 4.320 3.596 3.522 3.651 . 0 0 "[ . 1 . 2]" 1 762 2 60 GLU H 2 60 GLU HB3 3.760 . 4.320 3.599 3.545 3.667 . 0 0 "[ . 1 . 2]" 1 763 1 16 LEU MD2 2 61 GLU HB2 4.720 . 5.430 4.680 4.204 5.009 . 0 0 "[ . 1 . 2]" 1 764 1 61 GLU HB2 2 16 LEU MD2 4.720 . 5.430 4.726 4.157 5.023 . 0 0 "[ . 1 . 2]" 1 765 1 65 LEU HB2 1 65 LEU MD2 3.340 . 3.840 2.530 2.510 2.551 . 0 0 "[ . 1 . 2]" 1 766 2 65 LEU HB2 2 65 LEU MD2 3.340 . 3.840 2.536 2.503 2.577 . 0 0 "[ . 1 . 2]" 1 767 1 65 LEU H 1 66 LEU HB2 5.090 . 5.850 4.876 4.708 5.006 . 0 0 "[ . 1 . 2]" 1 768 2 65 LEU H 2 66 LEU HB2 5.090 . 5.850 4.911 4.802 5.096 . 0 0 "[ . 1 . 2]" 1 769 1 72 LYS HB2 1 73 LEU MD2 4.060 . 4.670 4.171 3.626 4.769 0.099 6 0 "[ . 1 . 2]" 1 770 2 72 LYS HB2 2 73 LEU MD2 4.060 . 4.670 4.280 3.826 4.591 . 0 0 "[ . 1 . 2]" 1 771 1 68 GLU HB3 1 72 LYS H 4.640 . 5.340 4.746 4.491 4.985 . 0 0 "[ . 1 . 2]" 1 772 2 68 GLU HB3 2 72 LYS H 4.640 . 5.340 4.786 4.477 5.021 . 0 0 "[ . 1 . 2]" 1 773 1 14 ILE HG12 2 68 GLU HB3 3.220 . 3.700 2.374 2.110 2.562 . 0 0 "[ . 1 . 2]" 1 774 1 68 GLU HB3 2 14 ILE HG12 3.220 . 3.700 2.386 2.252 2.583 . 0 0 "[ . 1 . 2]" 1 775 1 66 LEU HA 2 69 LEU HB3 5.210 . 5.990 3.994 3.688 4.616 . 0 0 "[ . 1 . 2]" 1 776 1 69 LEU HB3 2 66 LEU HA 5.210 . 5.990 4.037 3.652 4.562 . 0 0 "[ . 1 . 2]" 1 777 1 71 ASN HB3 1 72 LYS H 3.680 . 4.230 3.108 1.875 3.427 . 0 0 "[ . 1 . 2]" 1 778 2 71 ASN HB3 2 72 LYS H 3.680 . 4.230 3.184 3.018 3.338 . 0 0 "[ . 1 . 2]" 1 779 1 71 ASN H 1 71 ASN HB3 3.870 . 4.450 3.606 2.711 3.693 . 0 0 "[ . 1 . 2]" 1 780 2 71 ASN H 2 71 ASN HB3 3.870 . 4.450 3.661 3.625 3.699 . 0 0 "[ . 1 . 2]" 1 781 1 68 GLU HA 1 71 ASN HB3 4.290 . 4.930 4.042 2.419 4.414 . 0 0 "[ . 1 . 2]" 1 782 2 68 GLU HA 2 71 ASN HB3 4.290 . 4.930 4.173 3.888 4.510 . 0 0 "[ . 1 . 2]" 1 783 1 71 ASN HB3 1 72 LYS HA 4.500 . 5.180 4.488 4.157 4.628 . 0 0 "[ . 1 . 2]" 1 784 2 71 ASN HB3 2 72 LYS HA 4.500 . 5.180 4.489 4.370 4.635 . 0 0 "[ . 1 . 2]" 1 785 1 72 LYS H 1 73 LEU HB2 5.110 . 5.880 5.332 5.193 5.517 . 0 0 "[ . 1 . 2]" 1 786 2 72 LYS H 2 73 LEU HB2 5.110 . 5.880 5.292 5.123 5.481 . 0 0 "[ . 1 . 2]" 1 787 1 73 LEU HB2 1 74 GLU HA 4.750 . 5.460 4.903 4.514 5.286 . 0 0 "[ . 1 . 2]" 1 788 2 73 LEU HB2 2 74 GLU HA 4.750 . 5.460 4.910 4.592 5.122 . 0 0 "[ . 1 . 2]" 1 789 1 70 GLY HA2 1 73 LEU HB2 4.540 . 5.220 2.793 2.289 3.538 . 0 0 "[ . 1 . 2]" 1 790 2 70 GLY HA2 2 73 LEU HB2 4.540 . 5.220 2.811 2.287 3.462 . 0 0 "[ . 1 . 2]" 1 791 1 72 LYS HB2 1 73 LEU HB2 5.200 . 5.980 5.372 4.841 6.172 0.192 6 0 "[ . 1 . 2]" 1 792 2 72 LYS HB2 2 73 LEU HB2 5.200 . 5.980 5.354 4.587 5.731 . 0 0 "[ . 1 . 2]" 1 793 1 73 LEU HB2 1 73 LEU MD1 3.010 . 3.460 2.431 2.376 2.541 . 0 0 "[ . 1 . 2]" 1 794 2 73 LEU HB2 2 73 LEU MD1 3.010 . 3.460 2.423 2.359 2.476 . 0 0 "[ . 1 . 2]" 1 795 1 5 LEU HA 1 5 LEU HG 3.550 . 4.080 3.330 3.135 3.482 . 0 0 "[ . 1 . 2]" 1 796 2 5 LEU HA 2 5 LEU HG 3.550 . 4.080 3.340 3.194 3.524 . 0 0 "[ . 1 . 2]" 1 797 1 4 LYS HA 1 5 LEU HG 4.240 . 4.880 4.089 3.794 4.618 . 0 0 "[ . 1 . 2]" 1 798 2 4 LYS HA 2 5 LEU HG 4.240 . 4.880 4.098 3.759 4.571 . 0 0 "[ . 1 . 2]" 1 799 1 13 LEU HG 1 29 ARG H 4.660 . 5.360 3.083 2.704 4.304 . 0 0 "[ . 1 . 2]" 1 800 2 13 LEU HG 2 29 ARG H 4.660 . 5.360 3.135 2.608 4.051 . 0 0 "[ . 1 . 2]" 1 801 1 13 LEU HG 1 14 ILE H 4.550 . 5.230 4.157 3.980 4.275 . 0 0 "[ . 1 . 2]" 1 802 2 13 LEU HG 2 14 ILE H 4.550 . 5.230 4.179 4.064 4.367 . 0 0 "[ . 1 . 2]" 1 803 1 13 LEU HA 1 13 LEU HG 3.590 . 4.130 3.252 3.145 3.356 . 0 0 "[ . 1 . 2]" 1 804 2 13 LEU HA 2 13 LEU HG 3.590 . 4.130 3.244 3.123 3.374 . 0 0 "[ . 1 . 2]" 1 805 1 57 LEU H 1 57 LEU HG 4.050 . 4.660 3.089 2.955 3.206 . 0 0 "[ . 1 . 2]" 1 806 2 57 LEU H 2 57 LEU HG 4.050 . 4.660 3.078 2.975 3.151 . 0 0 "[ . 1 . 2]" 1 807 1 16 LEU HG 1 17 SER H 4.420 . 5.080 4.394 4.284 4.510 . 0 0 "[ . 1 . 2]" 1 808 2 16 LEU HG 2 17 SER H 4.420 . 5.080 4.368 4.220 4.548 . 0 0 "[ . 1 . 2]" 1 809 1 57 LEU HA 1 57 LEU HG 4.040 . 4.650 3.257 3.132 3.331 . 0 0 "[ . 1 . 2]" 1 810 2 57 LEU HA 2 57 LEU HG 4.040 . 4.650 3.294 3.248 3.343 . 0 0 "[ . 1 . 2]" 1 811 1 16 LEU HA 1 16 LEU HG 4.050 . 4.660 3.186 3.130 3.268 . 0 0 "[ . 1 . 2]" 1 812 2 16 LEU HA 2 16 LEU HG 4.050 . 4.660 3.233 3.121 3.336 . 0 0 "[ . 1 . 2]" 1 813 1 15 VAL HA 1 16 LEU HG 4.570 . 5.260 3.712 3.551 3.879 . 0 0 "[ . 1 . 2]" 1 814 2 15 VAL HA 2 16 LEU HG 4.570 . 5.260 3.702 3.486 3.864 . 0 0 "[ . 1 . 2]" 1 815 1 27 LEU H 1 27 LEU HG 4.390 . 5.050 4.375 4.314 4.425 . 0 0 "[ . 1 . 2]" 1 816 2 27 LEU H 2 27 LEU HG 4.390 . 5.050 4.369 4.319 4.426 . 0 0 "[ . 1 . 2]" 1 817 1 14 ILE H 1 27 LEU HG 4.570 . 5.260 4.000 3.762 4.258 . 0 0 "[ . 1 . 2]" 1 818 2 14 ILE H 2 27 LEU HG 4.570 . 5.260 4.009 3.886 4.171 . 0 0 "[ . 1 . 2]" 1 819 1 27 LEU HG 1 62 PHE HZ 5.080 . 5.840 4.415 4.094 4.820 . 0 0 "[ . 1 . 2]" 1 820 2 27 LEU HG 2 62 PHE HZ 5.080 . 5.840 4.425 4.141 4.819 . 0 0 "[ . 1 . 2]" 1 821 1 27 LEU HG 1 62 PHE HE1 5.540 . 6.370 4.239 3.975 4.508 . 0 0 "[ . 1 . 2]" 1 822 2 27 LEU HG 2 62 PHE HE1 5.540 . 6.370 4.188 4.000 4.494 . 0 0 "[ . 1 . 2]" 1 823 1 13 LEU QD 1 27 LEU HG 2.920 . 3.360 1.810 1.762 1.896 0.038 15 0 "[ . 1 . 2]" 1 824 2 13 LEU QD 2 27 LEU HG 2.920 . 3.360 1.814 1.763 1.904 0.037 18 0 "[ . 1 . 2]" 1 825 1 65 LEU HG 1 66 LEU H 4.550 . 5.230 3.916 3.816 4.011 . 0 0 "[ . 1 . 2]" 1 826 2 65 LEU HG 2 66 LEU H 4.550 . 5.230 3.896 3.805 4.005 . 0 0 "[ . 1 . 2]" 1 827 1 65 LEU H 1 65 LEU HG 4.510 . 5.190 4.560 4.525 4.583 . 0 0 "[ . 1 . 2]" 1 828 2 65 LEU H 2 65 LEU HG 4.510 . 5.190 4.555 4.533 4.581 . 0 0 "[ . 1 . 2]" 1 829 1 66 LEU HG 1 67 LYS H 4.370 . 5.030 4.342 4.196 4.446 . 0 0 "[ . 1 . 2]" 1 830 2 66 LEU HG 2 67 LYS H 4.370 . 5.030 4.346 4.255 4.445 . 0 0 "[ . 1 . 2]" 1 831 1 62 PHE HA 1 66 LEU HG 4.620 . 5.310 4.348 4.142 4.476 . 0 0 "[ . 1 . 2]" 1 832 2 62 PHE HA 2 66 LEU HG 4.620 . 5.310 4.370 4.187 4.546 . 0 0 "[ . 1 . 2]" 1 833 1 73 LEU MD2 2 66 LEU HG 4.190 . 4.820 4.003 3.791 4.156 . 0 0 "[ . 1 . 2]" 1 834 1 66 LEU HG 2 73 LEU MD2 4.190 . 4.820 4.009 3.859 4.167 . 0 0 "[ . 1 . 2]" 1 835 1 65 LEU HG 1 69 LEU HG 3.970 . 4.570 2.685 2.390 2.775 . 0 0 "[ . 1 . 2]" 1 836 2 65 LEU HG 2 69 LEU HG 3.970 . 4.570 2.691 2.564 2.798 . 0 0 "[ . 1 . 2]" 1 837 1 72 LYS H 1 73 LEU HG 5.080 . 5.840 5.020 4.699 5.217 . 0 0 "[ . 1 . 2]" 1 838 2 72 LYS H 2 73 LEU HG 5.080 . 5.840 5.017 4.714 5.158 . 0 0 "[ . 1 . 2]" 1 839 1 73 LEU HA 1 73 LEU HG 3.730 . 4.290 3.149 3.002 3.402 . 0 0 "[ . 1 . 2]" 1 840 2 73 LEU HA 2 73 LEU HG 3.730 . 4.290 3.118 2.978 3.278 . 0 0 "[ . 1 . 2]" 1 841 1 69 LEU HA 1 73 LEU HG 4.680 . 5.380 4.147 3.652 4.711 . 0 0 "[ . 1 . 2]" 1 842 2 69 LEU HA 2 73 LEU HG 4.680 . 5.380 4.222 3.813 4.507 . 0 0 "[ . 1 . 2]" 1 843 1 66 LEU MD1 2 73 LEU HG 4.340 . 4.990 4.033 3.567 4.402 . 0 0 "[ . 1 . 2]" 1 844 1 73 LEU HG 2 66 LEU MD1 4.340 . 4.990 4.086 3.657 4.777 . 0 0 "[ . 1 . 2]" 1 845 1 66 LEU MD2 2 73 LEU HG 4.570 . 5.260 3.198 2.723 3.521 . 0 0 "[ . 1 . 2]" 1 846 1 73 LEU HG 2 66 LEU MD2 4.570 . 5.260 3.158 2.537 3.853 . 0 0 "[ . 1 . 2]" 1 847 1 15 VAL MG2 1 16 LEU H 3.820 . 4.390 4.159 4.060 4.228 . 0 0 "[ . 1 . 2]" 1 848 2 15 VAL MG2 2 16 LEU H 3.820 . 4.390 4.141 4.000 4.263 . 0 0 "[ . 1 . 2]" 1 849 1 15 VAL MG2 1 26 GLU HA 4.550 . 5.230 4.365 3.579 4.821 . 0 0 "[ . 1 . 2]" 1 850 2 15 VAL MG2 2 26 GLU HA 4.550 . 5.230 4.420 3.825 5.362 0.132 16 0 "[ . 1 . 2]" 1 851 1 15 VAL HA 1 15 VAL MG2 3.210 . 3.690 2.472 2.402 2.540 . 0 0 "[ . 1 . 2]" 1 852 2 15 VAL HA 2 15 VAL MG2 3.210 . 3.690 2.466 2.398 2.521 . 0 0 "[ . 1 . 2]" 1 853 1 15 VAL MG2 1 26 GLU HG2 4.340 . 4.990 4.458 3.114 5.004 0.014 5 0 "[ . 1 . 2]" 1 854 2 15 VAL MG2 2 26 GLU HG2 4.340 . 4.990 4.615 3.621 4.835 . 0 0 "[ . 1 . 2]" 1 855 1 15 VAL MG2 1 26 GLU HB2 3.420 . 3.930 3.075 2.781 3.325 . 0 0 "[ . 1 . 2]" 1 856 2 15 VAL MG2 2 26 GLU HB2 3.420 . 3.930 3.131 2.774 3.658 . 0 0 "[ . 1 . 2]" 1 857 1 15 VAL MG2 1 26 GLU HB3 3.420 . 3.930 2.925 2.576 4.102 0.172 7 0 "[ . 1 . 2]" 1 858 2 15 VAL MG2 2 26 GLU HB3 3.420 . 3.930 2.904 2.528 3.593 . 0 0 "[ . 1 . 2]" 1 859 2 15 VAL MG2 2 24 ARG HG2 4.610 . 5.300 4.472 3.723 5.068 . 0 0 "[ . 1 . 2]" 1 860 1 30 VAL MG2 1 40 ASP H 4.140 . 4.760 4.071 3.577 4.728 . 0 0 "[ . 1 . 2]" 1 861 2 30 VAL MG2 2 40 ASP H 4.140 . 4.760 4.073 3.873 4.335 . 0 0 "[ . 1 . 2]" 1 862 1 30 VAL H 1 30 VAL MG2 3.510 . 4.040 2.819 2.595 3.153 . 0 0 "[ . 1 . 2]" 1 863 2 30 VAL H 2 30 VAL MG2 3.510 . 4.040 2.835 2.738 2.947 . 0 0 "[ . 1 . 2]" 1 864 1 30 VAL MG2 1 31 SER H 4.100 . 4.720 3.945 3.655 4.075 . 0 0 "[ . 1 . 2]" 1 865 2 30 VAL MG2 2 31 SER H 4.100 . 4.720 3.954 3.852 4.017 . 0 0 "[ . 1 . 2]" 1 866 1 10 ILE H 1 30 VAL MG2 3.760 . 4.320 3.718 3.400 3.933 . 0 0 "[ . 1 . 2]" 1 867 2 10 ILE H 2 30 VAL MG2 3.760 . 4.320 3.691 3.390 3.879 . 0 0 "[ . 1 . 2]" 1 868 1 30 VAL MG2 1 38 LYS H 5.430 . 6.240 5.379 5.222 5.543 . 0 0 "[ . 1 . 2]" 1 869 2 30 VAL MG2 2 38 LYS H 5.430 . 6.240 5.374 5.203 5.579 . 0 0 "[ . 1 . 2]" 1 870 1 8 GLU H 1 30 VAL MG2 5.020 . 5.770 4.476 3.867 4.868 . 0 0 "[ . 1 . 2]" 1 871 2 8 GLU H 2 30 VAL MG2 5.020 . 5.770 4.484 4.204 5.101 . 0 0 "[ . 1 . 2]" 1 872 1 30 VAL MG2 1 32 TRP HZ2 5.430 . 6.240 3.904 3.160 4.507 . 0 0 "[ . 1 . 2]" 1 873 2 30 VAL MG2 2 32 TRP HZ2 5.430 . 6.240 3.922 3.457 4.456 . 0 0 "[ . 1 . 2]" 1 874 1 30 VAL MG2 1 44 TRP HZ2 3.600 . 4.140 2.226 1.788 2.731 0.012 19 0 "[ . 1 . 2]" 1 875 2 30 VAL MG2 2 44 TRP HZ2 3.600 . 4.140 2.213 1.874 2.980 . 0 0 "[ . 1 . 2]" 1 876 1 7 PHE QD 1 30 VAL MG2 5.170 . 5.950 4.271 3.310 4.925 . 0 0 "[ . 1 . 2]" 1 877 2 7 PHE HD2 2 30 VAL MG2 5.170 . 5.950 4.301 3.695 4.982 . 0 0 "[ . 1 . 2]" 1 878 1 28 ASN HA 1 30 VAL MG2 5.190 . 5.970 4.988 4.676 5.463 . 0 0 "[ . 1 . 2]" 1 879 2 28 ASN HA 2 30 VAL MG2 5.190 . 5.970 5.005 4.559 5.441 . 0 0 "[ . 1 . 2]" 1 880 1 29 ARG HA 1 30 VAL MG2 4.260 . 4.900 3.634 3.398 4.062 . 0 0 "[ . 1 . 2]" 1 881 2 29 ARG HA 2 30 VAL MG2 4.260 . 4.900 3.644 3.496 3.821 . 0 0 "[ . 1 . 2]" 1 882 1 9 ILE HA 1 30 VAL MG2 3.830 . 4.400 2.466 1.989 2.944 . 0 0 "[ . 1 . 2]" 1 883 2 9 ILE HA 2 30 VAL MG2 3.830 . 4.400 2.432 2.094 2.705 . 0 0 "[ . 1 . 2]" 1 884 1 30 VAL MG2 1 40 ASP HB2 3.840 . 4.420 2.911 2.291 3.279 . 0 0 "[ . 1 . 2]" 1 885 2 30 VAL MG2 2 40 ASP HB2 3.840 . 4.420 2.832 2.360 3.287 . 0 0 "[ . 1 . 2]" 1 886 1 30 VAL MG2 1 40 ASP HB3 3.840 . 4.420 2.482 2.123 4.202 . 0 0 "[ . 1 . 2]" 1 887 2 30 VAL MG2 2 40 ASP HB3 3.840 . 4.420 2.420 2.142 3.262 . 0 0 "[ . 1 . 2]" 1 888 1 29 ARG HB2 1 30 VAL MG2 5.480 . 6.300 5.156 5.004 5.365 . 0 0 "[ . 1 . 2]" 1 889 2 29 ARG HB2 2 30 VAL MG2 5.480 . 6.300 5.130 5.010 5.398 . 0 0 "[ . 1 . 2]" 1 890 1 30 VAL MG2 1 56 THR MG 5.790 . 6.660 4.602 4.177 5.416 . 0 0 "[ . 1 . 2]" 1 891 2 30 VAL MG2 2 56 THR MG 5.790 . 6.660 4.652 4.083 5.143 . 0 0 "[ . 1 . 2]" 1 892 1 9 ILE QG 1 30 VAL MG2 4.160 . 4.220 2.125 1.766 2.916 0.034 4 0 "[ . 1 . 2]" 1 893 2 9 ILE HG13 2 30 VAL MG2 4.160 . 4.780 3.377 3.090 3.715 . 0 0 "[ . 1 . 2]" 1 894 2 9 ILE HG12 2 30 VAL MG2 3.670 . 4.220 2.082 1.765 2.511 0.035 18 0 "[ . 1 . 2]" 1 895 1 9 ILE MG 1 30 VAL MG2 3.370 . 3.880 3.019 2.609 3.368 . 0 0 "[ . 1 . 2]" 1 896 2 9 ILE MG 2 30 VAL MG2 3.370 . 3.880 2.931 2.472 3.430 . 0 0 "[ . 1 . 2]" 1 897 1 9 ILE MD 1 30 VAL MG2 3.900 . 4.490 3.457 3.103 4.158 . 0 0 "[ . 1 . 2]" 1 898 2 9 ILE MD 2 30 VAL MG2 3.900 . 4.490 3.381 2.836 3.816 . 0 0 "[ . 1 . 2]" 1 899 1 61 GLU H 1 64 VAL MG2 5.120 . 5.890 4.552 4.369 4.846 . 0 0 "[ . 1 . 2]" 1 900 2 61 GLU H 2 64 VAL MG2 5.120 . 5.890 4.548 4.310 4.738 . 0 0 "[ . 1 . 2]" 1 901 1 64 VAL H 1 64 VAL MG2 2.790 . 3.210 2.150 1.985 2.280 . 0 0 "[ . 1 . 2]" 1 902 2 64 VAL H 2 64 VAL MG2 2.790 . 3.210 2.122 2.026 2.230 . 0 0 "[ . 1 . 2]" 1 903 1 60 GLU HA 1 64 VAL MG2 4.290 . 4.930 3.922 3.649 4.305 . 0 0 "[ . 1 . 2]" 1 904 2 60 GLU HA 2 64 VAL MG2 4.290 . 4.930 3.886 3.521 4.221 . 0 0 "[ . 1 . 2]" 1 905 1 61 GLU HA 1 64 VAL MG2 4.160 . 4.780 3.074 2.724 3.694 . 0 0 "[ . 1 . 2]" 1 906 2 61 GLU HA 2 64 VAL MG2 4.160 . 4.780 3.084 2.592 3.714 . 0 0 "[ . 1 . 2]" 1 907 1 64 VAL HA 1 64 VAL MG2 2.740 . 3.150 2.435 2.380 2.528 . 0 0 "[ . 1 . 2]" 1 908 2 64 VAL HA 2 64 VAL MG2 2.740 . 3.150 2.440 2.396 2.486 . 0 0 "[ . 1 . 2]" 1 909 1 60 GLU HB3 1 64 VAL MG2 4.230 . 4.860 3.873 3.704 4.035 . 0 0 "[ . 1 . 2]" 1 910 1 64 VAL MG2 1 67 LYS HB2 4.620 . 5.310 4.525 4.346 4.767 . 0 0 "[ . 1 . 2]" 1 911 2 64 VAL MG2 2 67 LYS HB2 4.620 . 5.310 4.551 4.309 5.232 . 0 0 "[ . 1 . 2]" 1 912 1 64 VAL MG2 1 67 LYS HD3 3.760 . 4.320 3.333 3.082 3.785 . 0 0 "[ . 1 . 2]" 1 913 2 64 VAL MG2 2 67 LYS HD3 3.760 . 4.320 3.357 2.956 4.131 . 0 0 "[ . 1 . 2]" 1 914 1 7 PHE QE 1 9 ILE QG 5.500 . 6.330 4.435 3.439 5.572 . 0 0 "[ . 1 . 2]" 1 915 2 7 PHE HE2 2 9 ILE HG13 5.500 . 6.330 4.670 3.156 5.413 . 0 0 "[ . 1 . 2]" 1 916 1 7 PHE QD 1 9 ILE QG 4.810 . 5.530 3.324 2.585 4.148 . 0 0 "[ . 1 . 2]" 1 917 2 7 PHE HD2 2 9 ILE HG13 4.810 . 5.530 3.481 2.510 4.042 . 0 0 "[ . 1 . 2]" 1 918 1 10 ILE HG12 1 31 SER H 4.320 . 4.970 2.629 2.434 2.888 . 0 0 "[ . 1 . 2]" 1 919 2 10 ILE HG12 2 31 SER H 4.320 . 4.970 2.626 2.288 2.914 . 0 0 "[ . 1 . 2]" 1 920 1 10 ILE H 1 10 ILE HG12 4.220 . 4.850 2.334 2.176 2.457 . 0 0 "[ . 1 . 2]" 1 921 2 10 ILE H 2 10 ILE HG12 4.220 . 4.850 2.338 2.215 2.453 . 0 0 "[ . 1 . 2]" 1 922 1 10 ILE HG12 1 11 GLU H 4.640 . 5.340 4.217 4.085 4.368 . 0 0 "[ . 1 . 2]" 1 923 2 10 ILE HG12 2 11 GLU H 4.640 . 5.340 4.208 4.058 4.336 . 0 0 "[ . 1 . 2]" 1 924 1 8 GLU HG2 1 10 ILE HG12 5.030 . 5.780 4.206 3.821 4.914 . 0 0 "[ . 1 . 2]" 1 925 2 8 GLU HG2 2 10 ILE HG12 5.030 . 5.780 4.368 4.037 5.358 . 0 0 "[ . 1 . 2]" 1 926 1 10 ILE HG12 1 37 PRO HB3 4.230 . 4.860 3.445 3.107 3.811 . 0 0 "[ . 1 . 2]" 1 927 2 10 ILE HG12 2 37 PRO HB3 4.230 . 4.860 3.404 3.222 3.755 . 0 0 "[ . 1 . 2]" 1 928 1 10 ILE HG12 1 10 ILE MG 3.530 . 4.060 3.253 3.244 3.262 . 0 0 "[ . 1 . 2]" 1 929 2 10 ILE HG12 2 10 ILE MG 3.530 . 4.060 3.253 3.243 3.261 . 0 0 "[ . 1 . 2]" 1 930 1 14 ILE H 1 14 ILE HG12 4.260 . 4.900 4.087 3.984 4.161 . 0 0 "[ . 1 . 2]" 1 931 2 14 ILE H 2 14 ILE HG12 4.260 . 4.900 4.096 4.040 4.180 . 0 0 "[ . 1 . 2]" 1 932 1 27 LEU HA 1 41 ILE HG13 4.400 . 5.060 3.353 2.964 3.626 . 0 0 "[ . 1 . 2]" 1 933 2 27 LEU HA 2 41 ILE HG13 4.400 . 5.060 3.400 2.986 3.684 . 0 0 "[ . 1 . 2]" 1 934 1 41 ILE HA 1 41 ILE HG13 4.210 . 4.840 2.581 2.520 2.616 . 0 0 "[ . 1 . 2]" 1 935 2 41 ILE HA 2 41 ILE HG13 4.210 . 4.840 2.582 2.511 2.636 . 0 0 "[ . 1 . 2]" 1 936 1 55 ILE H 1 55 ILE HG13 4.790 . 5.510 4.858 4.827 4.883 . 0 0 "[ . 1 . 2]" 1 937 2 55 ILE H 2 55 ILE HG13 4.790 . 5.510 4.856 4.770 4.891 . 0 0 "[ . 1 . 2]" 1 938 1 55 ILE HA 1 55 ILE HG13 3.640 . 4.190 2.612 2.531 2.711 . 0 0 "[ . 1 . 2]" 1 939 2 55 ILE HA 2 55 ILE HG13 3.640 . 4.190 2.594 2.534 2.669 . 0 0 "[ . 1 . 2]" 1 940 1 9 ILE QG 1 10 ILE H 4.670 . 5.370 4.207 4.059 4.337 . 0 0 "[ . 1 . 2]" 1 941 2 9 ILE HG12 2 10 ILE H 4.670 . 5.370 4.480 4.288 4.637 . 0 0 "[ . 1 . 2]" 1 942 2 7 PHE HD2 2 9 ILE HG12 5.500 . 6.330 4.275 3.081 4.811 . 0 0 "[ . 1 . 2]" 1 943 2 8 GLU HA 2 9 ILE HG12 5.260 . 6.050 5.004 4.837 5.180 . 0 0 "[ . 1 . 2]" 1 944 1 9 ILE QG 1 30 VAL HB 5.800 . 6.670 4.914 4.559 5.591 . 0 0 "[ . 1 . 2]" 1 945 2 9 ILE HG12 2 30 VAL HB 5.800 . 6.670 5.078 4.520 5.612 . 0 0 "[ . 1 . 2]" 1 946 1 14 ILE HG13 1 15 VAL H 5.010 . 5.760 5.308 5.253 5.368 . 0 0 "[ . 1 . 2]" 1 947 2 14 ILE HG13 2 15 VAL H 5.010 . 5.760 5.298 5.223 5.360 . 0 0 "[ . 1 . 2]" 1 948 1 10 ILE HG13 1 31 SER H 4.480 . 5.150 3.809 3.585 4.168 . 0 0 "[ . 1 . 2]" 1 949 2 10 ILE HG13 2 31 SER H 4.480 . 5.150 3.802 3.438 4.159 . 0 0 "[ . 1 . 2]" 1 950 1 14 ILE H 1 14 ILE HG13 3.910 . 4.500 3.020 2.959 3.101 . 0 0 "[ . 1 . 2]" 1 951 2 14 ILE H 2 14 ILE HG13 3.910 . 4.500 3.027 2.951 3.110 . 0 0 "[ . 1 . 2]" 1 952 1 10 ILE HG13 1 37 PRO HA 4.530 . 5.210 3.483 2.981 4.225 . 0 0 "[ . 1 . 2]" 1 953 2 10 ILE HG13 2 37 PRO HA 4.530 . 5.210 3.634 3.234 4.205 . 0 0 "[ . 1 . 2]" 1 954 1 10 ILE HG13 1 37 PRO HG3 3.940 . 4.530 3.439 2.384 4.202 . 0 0 "[ . 1 . 2]" 1 955 2 10 ILE HG13 2 37 PRO HG3 3.940 . 4.530 3.321 2.484 4.084 . 0 0 "[ . 1 . 2]" 1 956 1 10 ILE HG13 1 37 PRO HB3 3.540 . 4.070 1.941 1.758 2.292 0.042 20 0 "[ . 1 . 2]" 1 957 2 10 ILE HG13 2 37 PRO HB3 3.540 . 4.070 1.972 1.709 2.278 0.091 8 0 "[ . 1 . 2]" 1 958 1 55 ILE H 1 55 ILE HG12 4.700 . 5.400 4.551 4.440 4.671 . 0 0 "[ . 1 . 2]" 1 959 2 55 ILE H 2 55 ILE HG12 4.700 . 5.400 4.577 4.517 4.662 . 0 0 "[ . 1 . 2]" 1 960 1 55 ILE HA 1 55 ILE HG12 4.020 . 4.620 3.176 3.092 3.260 . 0 0 "[ . 1 . 2]" 1 961 2 55 ILE HA 2 55 ILE HG12 4.020 . 4.620 3.167 3.130 3.219 . 0 0 "[ . 1 . 2]" 1 962 1 9 ILE H 1 9 ILE MG 3.820 . 4.390 3.837 3.807 3.875 . 0 0 "[ . 1 . 2]" 1 963 2 9 ILE H 2 9 ILE MG 3.820 . 4.390 3.844 3.803 3.869 . 0 0 "[ . 1 . 2]" 1 964 1 9 ILE MG 1 10 ILE H 3.570 . 4.110 3.085 2.936 3.230 . 0 0 "[ . 1 . 2]" 1 965 2 9 ILE MG 2 10 ILE H 3.570 . 4.110 3.019 2.862 3.189 . 0 0 "[ . 1 . 2]" 1 966 1 9 ILE MG 1 11 GLU H 3.500 . 4.030 2.701 2.510 2.841 . 0 0 "[ . 1 . 2]" 1 967 2 9 ILE MG 2 11 GLU H 3.500 . 4.030 2.671 2.464 2.880 . 0 0 "[ . 1 . 2]" 1 968 1 9 ILE MG 1 44 TRP HZ2 5.260 . 6.050 5.350 4.686 6.092 0.042 15 0 "[ . 1 . 2]" 1 969 2 9 ILE MG 2 44 TRP HZ2 5.260 . 6.050 5.461 4.471 6.075 0.025 9 0 "[ . 1 . 2]" 1 970 1 9 ILE MG 1 28 ASN HA 5.380 . 6.190 4.490 4.221 4.772 . 0 0 "[ . 1 . 2]" 1 971 2 9 ILE MG 2 28 ASN HA 5.380 . 6.190 4.492 4.233 4.733 . 0 0 "[ . 1 . 2]" 1 972 1 9 ILE MG 1 12 GLU HA 4.330 . 4.980 3.582 3.321 4.080 . 0 0 "[ . 1 . 2]" 1 973 2 9 ILE MG 2 12 GLU HA 4.330 . 4.980 3.601 3.338 3.785 . 0 0 "[ . 1 . 2]" 1 974 1 9 ILE MG 1 30 VAL HA 4.180 . 4.810 4.027 3.825 4.200 . 0 0 "[ . 1 . 2]" 1 975 2 9 ILE MG 2 30 VAL HA 4.180 . 4.810 3.972 3.502 4.332 . 0 0 "[ . 1 . 2]" 1 976 1 9 ILE MG 1 11 GLU HA 4.530 . 5.210 3.553 3.355 3.879 . 0 0 "[ . 1 . 2]" 1 977 2 9 ILE MG 2 11 GLU HA 4.530 . 5.210 3.596 3.304 3.900 . 0 0 "[ . 1 . 2]" 1 978 1 9 ILE HA 1 9 ILE MG 3.430 . 3.940 2.477 2.396 2.559 . 0 0 "[ . 1 . 2]" 1 979 2 9 ILE HA 2 9 ILE MG 3.430 . 3.940 2.467 2.401 2.519 . 0 0 "[ . 1 . 2]" 1 980 1 9 ILE MG 1 28 ASN HB2 4.470 . 5.140 2.496 2.195 2.833 . 0 0 "[ . 1 . 2]" 1 981 2 9 ILE MG 2 28 ASN HB2 4.470 . 5.140 2.485 2.227 2.911 . 0 0 "[ . 1 . 2]" 1 982 1 9 ILE MG 1 12 GLU HG3 4.030 . 4.630 2.624 2.204 3.196 . 0 0 "[ . 1 . 2]" 1 983 2 9 ILE MG 2 12 GLU HG3 4.030 . 4.630 2.616 2.034 3.125 . 0 0 "[ . 1 . 2]" 1 984 2 9 ILE HG13 2 9 ILE MG 3.490 . 4.010 3.260 3.249 3.274 . 0 0 "[ . 1 . 2]" 1 985 2 9 ILE HG12 2 9 ILE MG 3.430 . 3.940 2.486 2.428 2.571 . 0 0 "[ . 1 . 2]" 1 986 1 10 ILE MG 1 29 ARG H 5.210 . 5.990 5.566 5.287 5.825 . 0 0 "[ . 1 . 2]" 1 987 2 10 ILE MG 2 29 ARG H 5.210 . 5.990 5.551 5.280 5.898 . 0 0 "[ . 1 . 2]" 1 988 1 10 ILE MG 1 11 GLU H 3.710 . 4.270 3.612 3.384 3.727 . 0 0 "[ . 1 . 2]" 1 989 2 10 ILE MG 2 11 GLU H 3.710 . 4.270 3.635 3.421 3.840 . 0 0 "[ . 1 . 2]" 1 990 1 10 ILE MG 1 30 VAL HA 5.180 . 5.960 5.131 4.894 5.288 . 0 0 "[ . 1 . 2]" 1 991 2 10 ILE MG 2 30 VAL HA 5.180 . 5.960 5.141 4.934 5.291 . 0 0 "[ . 1 . 2]" 1 992 1 10 ILE HA 1 10 ILE MG 3.000 . 3.450 2.499 2.436 2.606 . 0 0 "[ . 1 . 2]" 1 993 2 10 ILE HA 2 10 ILE MG 3.000 . 3.450 2.489 2.401 2.589 . 0 0 "[ . 1 . 2]" 1 994 1 10 ILE MG 1 31 SER HB2 5.590 . 6.430 4.565 4.168 5.868 . 0 0 "[ . 1 . 2]" 1 995 2 10 ILE MG 2 31 SER HB2 5.590 . 6.430 4.648 4.153 6.006 . 0 0 "[ . 1 . 2]" 1 996 1 10 ILE MG 1 31 SER HB3 5.590 . 6.430 5.186 4.409 5.566 . 0 0 "[ . 1 . 2]" 1 997 2 10 ILE MG 2 31 SER HB3 5.590 . 6.430 5.166 4.351 5.575 . 0 0 "[ . 1 . 2]" 1 998 1 10 ILE MG 1 37 PRO HG3 3.550 . 4.080 3.427 2.584 4.078 . 0 0 "[ . 1 . 2]" 1 999 2 10 ILE MG 2 37 PRO HG3 3.550 . 4.080 3.645 3.009 4.073 . 0 0 "[ . 1 . 2]" 1 1000 1 10 ILE MG 1 11 GLU HB3 3.690 . 4.240 3.731 3.336 4.038 . 0 0 "[ . 1 . 2]" 1 1001 2 10 ILE MG 2 11 GLU HB3 3.690 . 4.240 3.768 3.276 4.267 0.027 9 0 "[ . 1 . 2]" 1 1002 1 10 ILE HG13 1 10 ILE MG 3.110 . 3.580 2.382 2.349 2.411 . 0 0 "[ . 1 . 2]" 1 1003 2 10 ILE HG13 2 10 ILE MG 3.110 . 3.580 2.377 2.349 2.397 . 0 0 "[ . 1 . 2]" 1 1004 1 9 ILE MG 1 10 ILE MG 4.750 . 5.460 5.105 4.995 5.257 . 0 0 "[ . 1 . 2]" 1 1005 2 9 ILE MG 2 10 ILE MG 4.750 . 5.460 5.086 4.982 5.271 . 0 0 "[ . 1 . 2]" 1 1006 1 69 LEU H 2 14 ILE MG 4.670 . 5.370 4.484 4.232 4.808 . 0 0 "[ . 1 . 2]" 1 1007 1 14 ILE MG 2 69 LEU H 4.670 . 5.370 4.565 4.154 4.880 . 0 0 "[ . 1 . 2]" 1 1008 1 66 LEU H 2 14 ILE MG 5.350 . 6.150 5.347 5.099 5.516 . 0 0 "[ . 1 . 2]" 1 1009 1 14 ILE MG 2 66 LEU H 5.350 . 6.150 5.412 5.044 5.764 . 0 0 "[ . 1 . 2]" 1 1010 1 65 LEU H 2 14 ILE MG 4.320 . 4.970 4.017 3.719 4.176 . 0 0 "[ . 1 . 2]" 1 1011 1 14 ILE MG 2 65 LEU H 4.320 . 4.970 4.016 3.778 4.290 . 0 0 "[ . 1 . 2]" 1 1012 1 14 ILE MG 1 16 LEU HA 4.480 . 5.150 3.241 3.065 3.549 . 0 0 "[ . 1 . 2]" 1 1013 2 14 ILE MG 2 16 LEU HA 4.480 . 5.150 3.335 3.048 3.496 . 0 0 "[ . 1 . 2]" 1 1014 1 64 VAL HB 2 14 ILE MG 3.980 . 4.580 3.923 3.453 4.334 . 0 0 "[ . 1 . 2]" 1 1015 1 14 ILE MG 2 64 VAL HB 3.980 . 4.580 3.854 3.573 4.132 . 0 0 "[ . 1 . 2]" 1 1016 1 68 GLU HB2 2 14 ILE MG 3.720 . 4.280 2.409 2.263 2.676 . 0 0 "[ . 1 . 2]" 1 1017 1 14 ILE MG 2 68 GLU HB2 3.720 . 4.280 2.479 2.250 2.739 . 0 0 "[ . 1 . 2]" 1 1018 1 68 GLU HB3 2 14 ILE MG 3.250 . 3.740 3.079 2.819 3.362 . 0 0 "[ . 1 . 2]" 1 1019 1 14 ILE MG 2 68 GLU HB3 3.250 . 3.740 3.136 2.883 3.412 . 0 0 "[ . 1 . 2]" 1 1020 1 14 ILE HG12 1 14 ILE MG 3.180 . 3.660 2.426 2.382 2.481 . 0 0 "[ . 1 . 2]" 1 1021 2 14 ILE HG12 2 14 ILE MG 3.180 . 3.660 2.424 2.381 2.453 . 0 0 "[ . 1 . 2]" 1 1022 1 15 VAL MG1 1 16 LEU H 3.610 . 4.150 2.842 2.690 2.967 . 0 0 "[ . 1 . 2]" 1 1023 2 15 VAL MG1 2 16 LEU H 3.610 . 4.150 2.818 2.616 2.986 . 0 0 "[ . 1 . 2]" 1 1024 1 15 VAL H 1 15 VAL MG1 3.750 . 4.310 3.884 3.845 3.911 . 0 0 "[ . 1 . 2]" 1 1025 2 15 VAL H 2 15 VAL MG1 3.750 . 4.310 3.874 3.842 3.898 . 0 0 "[ . 1 . 2]" 1 1026 1 15 VAL MG1 1 26 GLU HA 4.320 . 4.970 3.995 3.686 4.385 . 0 0 "[ . 1 . 2]" 1 1027 2 15 VAL MG1 2 26 GLU HA 4.320 . 4.970 4.108 3.829 4.750 . 0 0 "[ . 1 . 2]" 1 1028 1 15 VAL MG1 1 18 GLU HA 4.700 . 5.400 4.102 3.761 4.476 . 0 0 "[ . 1 . 2]" 1 1029 2 15 VAL MG1 2 18 GLU HA 4.700 . 5.400 4.150 3.640 4.560 . 0 0 "[ . 1 . 2]" 1 1030 1 15 VAL MG1 1 17 SER HA 4.050 . 4.660 3.636 3.375 4.033 . 0 0 "[ . 1 . 2]" 1 1031 2 15 VAL MG1 2 17 SER HA 4.050 . 4.660 3.662 3.432 3.969 . 0 0 "[ . 1 . 2]" 1 1032 1 15 VAL HA 1 15 VAL MG1 3.300 . 3.800 2.455 2.395 2.526 . 0 0 "[ . 1 . 2]" 1 1033 2 15 VAL HA 2 15 VAL MG1 3.300 . 3.800 2.457 2.400 2.502 . 0 0 "[ . 1 . 2]" 1 1034 1 15 VAL MG1 1 24 ARG HB3 3.560 . 4.090 2.335 1.976 2.756 . 0 0 "[ . 1 . 2]" 1 1035 2 15 VAL MG1 2 24 ARG HB3 3.560 . 4.090 2.480 2.024 3.042 . 0 0 "[ . 1 . 2]" 1 1036 1 15 VAL MG1 1 16 LEU HG 4.480 . 5.150 4.907 4.751 5.092 . 0 0 "[ . 1 . 2]" 1 1037 2 15 VAL MG1 2 16 LEU HG 4.480 . 5.150 4.880 4.671 5.059 . 0 0 "[ . 1 . 2]" 1 1038 2 15 VAL MG1 2 24 ARG HG2 3.690 . 4.240 2.838 2.321 3.247 . 0 0 "[ . 1 . 2]" 1 1039 1 30 VAL MG1 1 32 TRP HE1 4.020 . 4.620 3.374 3.065 3.725 . 0 0 "[ . 1 . 2]" 1 1040 2 30 VAL MG1 2 32 TRP HE1 4.020 . 4.620 3.356 3.105 3.706 . 0 0 "[ . 1 . 2]" 1 1041 1 9 ILE H 1 30 VAL MG1 4.490 . 5.160 4.080 3.812 4.350 . 0 0 "[ . 1 . 2]" 1 1042 2 9 ILE H 2 30 VAL MG1 4.490 . 5.160 4.070 3.867 4.263 . 0 0 "[ . 1 . 2]" 1 1043 1 30 VAL H 1 30 VAL MG1 4.120 . 4.740 3.907 3.773 3.946 . 0 0 "[ . 1 . 2]" 1 1044 2 30 VAL H 2 30 VAL MG1 4.120 . 4.740 3.912 3.859 3.955 . 0 0 "[ . 1 . 2]" 1 1045 1 30 VAL MG1 1 31 SER H 3.500 . 4.030 2.304 2.198 2.447 . 0 0 "[ . 1 . 2]" 1 1046 2 30 VAL MG1 2 31 SER H 3.500 . 4.030 2.337 2.245 2.538 . 0 0 "[ . 1 . 2]" 1 1047 1 10 ILE H 1 30 VAL MG1 4.100 . 4.720 4.246 3.911 4.546 . 0 0 "[ . 1 . 2]" 1 1048 2 10 ILE H 2 30 VAL MG1 4.100 . 4.720 4.274 4.157 4.362 . 0 0 "[ . 1 . 2]" 1 1049 1 7 PHE H 1 30 VAL MG1 5.700 . 6.560 4.900 4.659 5.106 . 0 0 "[ . 1 . 2]" 1 1050 2 7 PHE H 2 30 VAL MG1 5.700 . 6.560 4.895 4.715 5.183 . 0 0 "[ . 1 . 2]" 1 1051 1 30 VAL MG1 1 32 TRP HZ2 4.720 . 5.430 3.500 3.274 3.882 . 0 0 "[ . 1 . 2]" 1 1052 2 30 VAL MG1 2 32 TRP HZ2 4.720 . 5.430 3.510 3.319 3.856 . 0 0 "[ . 1 . 2]" 1 1053 1 30 VAL MG1 1 44 TRP HZ2 4.040 . 4.650 3.521 2.963 4.171 . 0 0 "[ . 1 . 2]" 1 1054 2 30 VAL MG1 2 44 TRP HZ2 4.040 . 4.650 3.480 2.941 4.053 . 0 0 "[ . 1 . 2]" 1 1055 1 7 PHE QD 1 30 VAL MG1 3.680 . 4.230 3.467 3.017 4.011 . 0 0 "[ . 1 . 2]" 1 1056 2 7 PHE HD2 2 30 VAL MG1 3.680 . 4.230 3.501 2.626 3.974 . 0 0 "[ . 1 . 2]" 1 1057 1 30 VAL MG1 1 44 TRP HH2 4.480 . 5.150 3.421 2.681 3.971 . 0 0 "[ . 1 . 2]" 1 1058 2 30 VAL MG1 2 44 TRP HH2 4.480 . 5.150 3.419 3.087 3.944 . 0 0 "[ . 1 . 2]" 1 1059 1 30 VAL MG1 1 32 TRP HA 4.420 . 5.080 3.485 3.237 3.896 . 0 0 "[ . 1 . 2]" 1 1060 2 30 VAL MG1 2 32 TRP HA 4.420 . 5.080 3.462 2.882 3.819 . 0 0 "[ . 1 . 2]" 1 1061 1 30 VAL HA 1 30 VAL MG1 3.510 . 4.040 2.501 2.422 2.647 . 0 0 "[ . 1 . 2]" 1 1062 2 30 VAL HA 2 30 VAL MG1 3.510 . 4.040 2.500 2.426 2.545 . 0 0 "[ . 1 . 2]" 1 1063 1 9 ILE HA 1 30 VAL MG1 4.090 . 4.700 3.195 2.703 3.601 . 0 0 "[ . 1 . 2]" 1 1064 2 9 ILE HA 2 30 VAL MG1 4.090 . 4.700 3.172 2.851 3.475 . 0 0 "[ . 1 . 2]" 1 1065 1 7 PHE HB2 1 30 VAL MG1 4.030 . 4.630 2.152 1.836 2.527 . 0 0 "[ . 1 . 2]" 1 1066 2 7 PHE HB2 2 30 VAL MG1 4.030 . 4.630 2.116 1.911 2.343 . 0 0 "[ . 1 . 2]" 1 1067 1 9 ILE QG 1 30 VAL MG1 4.350 . 4.910 3.303 2.825 3.737 . 0 0 "[ . 1 . 2]" 1 1068 2 9 ILE HG13 2 30 VAL MG1 4.350 . 5.000 3.886 3.344 4.340 . 0 0 "[ . 1 . 2]" 1 1069 2 9 ILE HG12 2 30 VAL MG1 4.270 . 4.910 3.505 2.637 4.101 . 0 0 "[ . 1 . 2]" 1 1070 1 9 ILE MG 1 30 VAL MG1 4.380 . 5.040 4.572 4.158 5.031 . 0 0 "[ . 1 . 2]" 1 1071 2 9 ILE MG 2 30 VAL MG1 4.380 . 5.040 4.524 4.038 4.936 . 0 0 "[ . 1 . 2]" 1 1072 1 9 ILE MD 1 30 VAL MG1 4.740 . 5.450 4.565 4.106 4.984 . 0 0 "[ . 1 . 2]" 1 1073 2 9 ILE MD 2 30 VAL MG1 4.740 . 5.450 4.517 3.777 5.025 . 0 0 "[ . 1 . 2]" 1 1074 1 55 ILE MG 1 56 THR H 3.510 . 4.040 3.842 3.619 4.014 . 0 0 "[ . 1 . 2]" 1 1075 2 55 ILE MG 2 56 THR H 3.510 . 4.040 3.797 3.687 3.903 . 0 0 "[ . 1 . 2]" 1 1076 1 55 ILE HA 1 55 ILE MG 3.240 . 3.730 3.269 3.245 3.281 . 0 0 "[ . 1 . 2]" 1 1077 2 55 ILE HA 2 55 ILE MG 3.240 . 3.730 3.271 3.265 3.279 . 0 0 "[ . 1 . 2]" 1 1078 1 41 ILE MG 1 54 GLY HA2 3.940 . 4.530 4.067 3.831 4.397 . 0 0 "[ . 1 . 2]" 1 1079 2 41 ILE MG 2 54 GLY HA2 3.940 . 4.530 4.114 3.861 4.450 . 0 0 "[ . 1 . 2]" 1 1080 1 54 GLY HA2 2 55 ILE MG 4.470 . 5.140 2.682 2.445 3.206 . 0 0 "[ . 1 . 2]" 1 1081 1 55 ILE MG 2 54 GLY HA2 4.470 . 5.140 2.584 2.324 2.971 . 0 0 "[ . 1 . 2]" 1 1082 1 41 ILE MG 1 54 GLY HA3 4.010 . 4.610 4.420 4.117 4.639 0.029 3 0 "[ . 1 . 2]" 1 1083 2 41 ILE MG 2 54 GLY HA3 4.010 . 4.610 4.499 4.232 4.694 0.084 3 0 "[ . 1 . 2]" 1 1084 1 55 ILE HG12 1 55 ILE MG 2.920 . 3.360 2.503 2.462 2.558 . 0 0 "[ . 1 . 2]" 1 1085 2 55 ILE HG12 2 55 ILE MG 2.920 . 3.360 2.498 2.432 2.532 . 0 0 "[ . 1 . 2]" 1 1086 1 41 ILE HG12 1 41 ILE MG 2.870 . 3.300 2.491 2.459 2.512 . 0 0 "[ . 1 . 2]" 1 1087 2 41 ILE HG12 2 41 ILE MG 2.870 . 3.300 2.491 2.473 2.511 . 0 0 "[ . 1 . 2]" 1 1088 1 43 THR MG 1 44 TRP H 3.300 . 3.800 2.903 2.789 2.990 . 0 0 "[ . 1 . 2]" 1 1089 2 43 THR MG 2 44 TRP H 3.300 . 3.800 2.941 2.828 3.034 . 0 0 "[ . 1 . 2]" 1 1090 1 24 ARG H 1 43 THR MG 4.020 . 4.620 3.398 3.291 3.546 . 0 0 "[ . 1 . 2]" 1 1091 2 24 ARG H 2 43 THR MG 4.020 . 4.620 3.446 3.226 3.598 . 0 0 "[ . 1 . 2]" 1 1092 1 23 TRP H 1 43 THR MG 4.540 . 5.220 4.869 4.751 5.120 . 0 0 "[ . 1 . 2]" 1 1093 2 23 TRP H 2 43 THR MG 4.540 . 5.220 4.831 4.695 5.002 . 0 0 "[ . 1 . 2]" 1 1094 1 43 THR H 1 43 THR MG 3.880 . 4.460 3.828 3.798 3.857 . 0 0 "[ . 1 . 2]" 1 1095 2 43 THR H 2 43 THR MG 3.880 . 4.460 3.814 3.771 3.836 . 0 0 "[ . 1 . 2]" 1 1096 1 23 TRP HE3 1 43 THR MG 3.170 . 3.650 1.971 1.760 2.207 0.040 5 0 "[ . 1 . 2]" 1 1097 2 23 TRP HE3 2 43 THR MG 3.170 . 3.650 1.961 1.782 2.203 0.018 4 0 "[ . 1 . 2]" 1 1098 1 23 TRP HZ3 1 43 THR MG 4.800 . 5.520 3.952 3.584 4.216 . 0 0 "[ . 1 . 2]" 1 1099 2 23 TRP HZ3 2 43 THR MG 4.800 . 5.520 3.962 3.675 4.250 . 0 0 "[ . 1 . 2]" 1 1100 1 43 THR HA 1 43 THR MG 3.270 . 3.760 2.359 2.314 2.408 . 0 0 "[ . 1 . 2]" 1 1101 2 43 THR HA 2 43 THR MG 3.270 . 3.760 2.353 2.300 2.403 . 0 0 "[ . 1 . 2]" 1 1102 1 25 LYS HA 1 43 THR MG 3.490 . 4.010 2.972 2.708 3.240 . 0 0 "[ . 1 . 2]" 1 1103 2 25 LYS HA 2 43 THR MG 3.490 . 4.010 3.020 2.838 3.254 . 0 0 "[ . 1 . 2]" 1 1104 1 23 TRP HA 1 43 THR MG 3.570 . 4.110 3.563 3.416 3.831 . 0 0 "[ . 1 . 2]" 1 1105 2 23 TRP HA 2 43 THR MG 3.570 . 4.110 3.588 3.357 3.734 . 0 0 "[ . 1 . 2]" 1 1106 1 23 TRP HB2 1 43 THR MG 3.140 . 3.610 3.240 3.097 3.547 . 0 0 "[ . 1 . 2]" 1 1107 2 23 TRP HB2 2 43 THR MG 3.140 . 3.610 3.176 3.002 3.496 . 0 0 "[ . 1 . 2]" 1 1108 1 24 ARG HB3 1 43 THR MG 4.430 . 5.090 5.172 5.060 5.250 0.160 6 0 "[ . 1 . 2]" 1 1109 2 24 ARG HB3 2 43 THR MG 4.430 . 5.090 5.160 4.899 5.275 0.185 16 0 "[ . 1 . 2]" 1 1110 1 32 TRP HE1 1 56 THR MG 3.390 . 3.900 2.124 1.795 2.692 0.005 6 0 "[ . 1 . 2]" 1 1111 2 32 TRP HE1 2 56 THR MG 3.390 . 3.900 2.085 1.777 2.696 0.023 3 0 "[ . 1 . 2]" 1 1112 1 56 THR MG 1 57 LEU H 3.480 . 4.000 3.196 2.174 3.856 . 0 0 "[ . 1 . 2]" 1 1113 2 56 THR MG 2 57 LEU H 3.480 . 4.000 3.184 2.079 3.792 . 0 0 "[ . 1 . 2]" 1 1114 1 56 THR H 1 56 THR MG 3.690 . 4.240 3.226 2.568 3.937 . 0 0 "[ . 1 . 2]" 1 1115 2 56 THR H 2 56 THR MG 3.690 . 4.240 3.226 2.715 3.935 . 0 0 "[ . 1 . 2]" 1 1116 1 32 TRP HZ2 1 56 THR MG 4.530 . 5.210 3.486 2.676 4.466 . 0 0 "[ . 1 . 2]" 1 1117 2 32 TRP HZ2 2 56 THR MG 4.530 . 5.210 3.411 2.718 4.492 . 0 0 "[ . 1 . 2]" 1 1118 1 38 LYS HE2 1 56 THR MG 5.140 . 5.910 5.032 4.210 5.717 . 0 0 "[ . 1 . 2]" 1 1119 2 38 LYS HE2 2 56 THR MG 5.140 . 5.910 5.107 4.266 5.847 . 0 0 "[ . 1 . 2]" 1 1120 1 38 LYS HE3 1 56 THR MG 5.140 . 5.910 4.778 4.319 5.409 . 0 0 "[ . 1 . 2]" 1 1121 2 38 LYS HE3 2 56 THR MG 5.140 . 5.910 4.832 4.262 5.481 . 0 0 "[ . 1 . 2]" 1 1122 1 40 ASP HB3 1 56 THR MG 4.680 . 5.380 4.198 3.703 4.769 . 0 0 "[ . 1 . 2]" 1 1123 2 40 ASP HB3 2 56 THR MG 4.680 . 5.380 4.397 3.959 4.902 . 0 0 "[ . 1 . 2]" 1 1124 1 38 LYS HD2 1 56 THR MG 3.050 . 3.510 2.813 2.322 3.416 . 0 0 "[ . 1 . 2]" 1 1125 2 38 LYS HD2 2 56 THR MG 3.050 . 3.510 2.843 2.258 3.466 . 0 0 "[ . 1 . 2]" 1 1126 1 30 VAL MG1 1 56 THR MG 5.200 . 5.980 4.499 4.204 4.911 . 0 0 "[ . 1 . 2]" 1 1127 2 30 VAL MG1 2 56 THR MG 5.200 . 5.980 4.489 4.123 4.844 . 0 0 "[ . 1 . 2]" 1 1128 1 15 VAL H 2 64 VAL MG1 4.440 . 5.110 4.350 3.922 4.697 . 0 0 "[ . 1 . 2]" 1 1129 1 64 VAL MG1 2 15 VAL H 4.440 . 5.110 4.393 4.002 4.784 . 0 0 "[ . 1 . 2]" 1 1130 1 64 VAL MG1 1 68 GLU H 3.930 . 4.520 4.009 3.940 4.087 . 0 0 "[ . 1 . 2]" 1 1131 2 64 VAL MG1 2 68 GLU H 3.930 . 4.520 3.979 3.839 4.160 . 0 0 "[ . 1 . 2]" 1 1132 1 64 VAL MG1 1 66 LEU H 5.170 . 5.950 5.279 5.170 5.385 . 0 0 "[ . 1 . 2]" 1 1133 2 64 VAL MG1 2 66 LEU H 5.170 . 5.950 5.303 5.202 5.405 . 0 0 "[ . 1 . 2]" 1 1134 1 64 VAL H 1 64 VAL MG1 3.840 . 4.420 3.812 3.791 3.830 . 0 0 "[ . 1 . 2]" 1 1135 2 64 VAL H 2 64 VAL MG1 3.840 . 4.420 3.813 3.793 3.835 . 0 0 "[ . 1 . 2]" 1 1136 1 64 VAL MG1 1 65 LEU H 3.670 . 4.220 3.506 3.341 3.599 . 0 0 "[ . 1 . 2]" 1 1137 2 64 VAL MG1 2 65 LEU H 3.670 . 4.220 3.525 3.430 3.583 . 0 0 "[ . 1 . 2]" 1 1138 1 61 GLU HA 1 64 VAL MG1 4.690 . 5.390 4.308 4.113 4.631 . 0 0 "[ . 1 . 2]" 1 1139 2 61 GLU HA 2 64 VAL MG1 4.690 . 5.390 4.325 4.189 4.459 . 0 0 "[ . 1 . 2]" 1 1140 1 64 VAL HA 1 64 VAL MG1 2.990 . 3.440 2.527 2.431 2.605 . 0 0 "[ . 1 . 2]" 1 1141 2 64 VAL HA 2 64 VAL MG1 2.990 . 3.440 2.514 2.467 2.561 . 0 0 "[ . 1 . 2]" 1 1142 1 15 VAL HB 2 64 VAL MG1 4.590 . 5.280 4.843 4.468 5.263 . 0 0 "[ . 1 . 2]" 1 1143 1 64 VAL MG1 2 15 VAL HB 4.590 . 5.280 4.872 4.364 5.207 . 0 0 "[ . 1 . 2]" 1 1144 1 64 VAL MG1 1 67 LYS HB2 4.050 . 4.660 3.814 3.667 4.019 . 0 0 "[ . 1 . 2]" 1 1145 2 64 VAL MG1 2 67 LYS HB2 4.050 . 4.660 3.798 3.515 4.246 . 0 0 "[ . 1 . 2]" 1 1146 1 14 ILE HB 2 64 VAL MG1 4.300 . 4.950 4.670 4.386 4.886 . 0 0 "[ . 1 . 2]" 1 1147 1 64 VAL MG1 2 14 ILE HB 4.300 . 4.950 4.699 4.385 4.920 . 0 0 "[ . 1 . 2]" 1 1148 1 64 VAL MG1 1 67 LYS HD3 4.750 . 5.460 4.066 3.719 4.424 . 0 0 "[ . 1 . 2]" 1 1149 2 64 VAL MG1 2 67 LYS HD3 4.750 . 5.460 4.082 3.731 4.899 . 0 0 "[ . 1 . 2]" 1 1150 1 64 VAL MG1 1 65 LEU HB2 4.110 . 4.730 4.672 4.415 4.805 0.075 8 0 "[ . 1 . 2]" 1 1151 2 64 VAL MG1 2 65 LEU HB2 4.110 . 4.730 4.713 4.596 4.785 0.055 10 0 "[ . 1 . 2]" 1 1152 1 14 ILE MG 2 64 VAL MG1 2.600 . 2.990 2.279 2.060 2.446 . 0 0 "[ . 1 . 2]" 1 1153 1 64 VAL MG1 2 14 ILE MG 2.600 . 2.990 2.314 2.072 2.525 . 0 0 "[ . 1 . 2]" 1 1154 1 73 LEU MD1 2 67 LYS HG3 4.980 . 5.730 5.686 5.114 5.883 0.153 18 0 "[ . 1 . 2]" 1 1155 1 67 LYS HG3 2 73 LEU MD1 4.980 . 5.730 5.723 5.431 5.855 0.125 17 0 "[ . 1 . 2]" 1 1156 1 6 LYS HG2 1 33 ASN H 4.690 . 5.390 4.734 4.176 5.290 . 0 0 "[ . 1 . 2]" 1 1157 2 6 LYS HG2 2 33 ASN H 4.690 . 5.390 4.834 4.395 5.270 . 0 0 "[ . 1 . 2]" 1 1158 1 21 LYS HG2 1 22 GLY H 5.030 . 5.780 4.473 4.085 4.893 . 0 0 "[ . 1 . 2]" 1 1159 2 21 LYS HG2 2 22 GLY H 5.030 . 5.780 4.433 4.255 4.761 . 0 0 "[ . 1 . 2]" 1 1160 1 67 LYS HG2 1 68 GLU H 5.500 . 6.330 4.956 4.885 5.074 . 0 0 "[ . 1 . 2]" 1 1161 2 67 LYS HG2 2 68 GLU H 5.500 . 6.330 4.936 4.722 5.045 . 0 0 "[ . 1 . 2]" 1 1162 1 67 LYS H 1 67 LYS HG2 3.850 . 4.430 3.755 3.667 3.989 . 0 0 "[ . 1 . 2]" 1 1163 2 67 LYS H 2 67 LYS HG2 3.850 . 4.430 3.735 3.196 3.907 . 0 0 "[ . 1 . 2]" 1 1164 1 6 LYS HG2 1 33 ASN HD22 4.550 . 5.230 4.892 4.230 5.282 0.052 16 0 "[ . 1 . 2]" 1 1165 2 6 LYS HG2 2 33 ASN HD22 4.550 . 5.230 4.898 4.357 5.324 0.094 4 0 "[ . 1 . 2]" 1 1166 1 6 LYS HA 1 6 LYS HG2 3.400 . 3.910 3.211 3.031 3.316 . 0 0 "[ . 1 . 2]" 1 1167 2 6 LYS HA 2 6 LYS HG2 3.400 . 3.910 3.165 3.053 3.304 . 0 0 "[ . 1 . 2]" 1 1168 1 6 LYS HG2 1 33 ASN HA 3.930 . 4.520 3.606 2.731 4.045 . 0 0 "[ . 1 . 2]" 1 1169 2 6 LYS HG2 2 33 ASN HA 3.930 . 4.520 3.714 3.153 4.167 . 0 0 "[ . 1 . 2]" 1 1170 1 6 LYS HG3 1 33 ASN HA 4.330 . 4.980 3.609 3.146 4.049 . 0 0 "[ . 1 . 2]" 1 1171 2 6 LYS HG3 2 33 ASN HA 4.330 . 4.980 3.621 3.267 4.125 . 0 0 "[ . 1 . 2]" 1 1172 1 67 LYS HA 1 67 LYS HG2 3.640 . 4.190 2.739 2.611 2.853 . 0 0 "[ . 1 . 2]" 1 1173 2 67 LYS HA 2 67 LYS HG2 3.640 . 4.190 2.756 2.689 2.844 . 0 0 "[ . 1 . 2]" 1 1174 1 6 LYS HD2 1 6 LYS HG2 2.890 . 3.320 2.484 2.442 2.533 . 0 0 "[ . 1 . 2]" 1 1175 2 6 LYS HD2 2 6 LYS HG2 2.890 . 3.320 2.482 2.440 2.515 . 0 0 "[ . 1 . 2]" 1 1176 1 8 GLU HG3 1 9 ILE H 3.870 . 4.450 3.207 2.315 3.608 . 0 0 "[ . 1 . 2]" 1 1177 2 8 GLU HG3 2 9 ILE H 3.870 . 4.450 3.218 2.657 3.653 . 0 0 "[ . 1 . 2]" 1 1178 1 8 GLU H 1 8 GLU HG3 4.720 . 5.430 4.784 4.713 4.881 . 0 0 "[ . 1 . 2]" 1 1179 2 8 GLU H 2 8 GLU HG3 4.720 . 5.430 4.784 4.571 4.848 . 0 0 "[ . 1 . 2]" 1 1180 1 8 GLU HA 1 8 GLU HG3 3.450 . 3.970 2.610 2.503 2.720 . 0 0 "[ . 1 . 2]" 1 1181 2 8 GLU HA 2 8 GLU HG3 3.450 . 3.970 2.638 2.532 3.114 . 0 0 "[ . 1 . 2]" 1 1182 1 8 GLU HG3 1 10 ILE MD 4.420 . 5.080 4.108 3.688 4.832 . 0 0 "[ . 1 . 2]" 1 1183 2 8 GLU HG3 2 10 ILE MD 4.420 . 5.080 4.082 2.642 4.571 . 0 0 "[ . 1 . 2]" 1 1184 1 74 GLU H 1 74 GLU HG2 4.020 . 4.620 3.207 2.002 4.080 . 0 0 "[ . 1 . 2]" 1 1185 2 74 GLU H 2 74 GLU HG2 4.020 . 4.620 2.995 2.081 3.809 . 0 0 "[ . 1 . 2]" 1 1186 1 11 GLU HA 1 11 GLU HG2 3.880 . 4.460 3.396 3.081 3.896 . 0 0 "[ . 1 . 2]" 1 1187 2 11 GLU HA 2 11 GLU HG2 3.880 . 4.460 3.557 3.088 3.909 . 0 0 "[ . 1 . 2]" 1 1188 1 74 GLU HA 1 74 GLU HG2 4.010 . 4.610 2.995 2.470 3.898 . 0 0 "[ . 1 . 2]" 1 1189 2 74 GLU HA 2 74 GLU HG2 4.010 . 4.610 3.067 2.539 3.829 . 0 0 "[ . 1 . 2]" 1 1190 1 12 GLU H 1 12 GLU HG2 4.210 . 4.840 3.999 3.750 4.384 . 0 0 "[ . 1 . 2]" 1 1191 2 12 GLU H 2 12 GLU HG2 4.210 . 4.840 4.038 3.704 4.298 . 0 0 "[ . 1 . 2]" 1 1192 1 12 GLU HG2 1 13 LEU H 5.250 . 6.040 4.524 4.215 5.228 . 0 0 "[ . 1 . 2]" 1 1193 2 12 GLU HG2 2 13 LEU H 5.250 . 6.040 4.687 4.147 5.465 . 0 0 "[ . 1 . 2]" 1 1194 1 12 GLU HA 1 12 GLU HG2 4.030 . 4.630 2.751 2.496 3.798 . 0 0 "[ . 1 . 2]" 1 1195 2 12 GLU HA 2 12 GLU HG2 4.030 . 4.630 2.912 2.583 3.801 . 0 0 "[ . 1 . 2]" 1 1196 1 9 ILE MG 1 12 GLU HG2 4.030 . 4.630 2.865 2.198 4.290 . 0 0 "[ . 1 . 2]" 1 1197 2 9 ILE MG 2 12 GLU HG2 4.030 . 4.630 3.016 2.366 4.257 . 0 0 "[ . 1 . 2]" 1 1198 1 18 GLU HA 1 18 GLU HG2 3.920 . 4.510 3.238 3.100 3.355 . 0 0 "[ . 1 . 2]" 1 1199 2 18 GLU HA 2 18 GLU HG2 3.920 . 4.510 3.257 3.051 3.424 . 0 0 "[ . 1 . 2]" 1 1200 2 18 GLU H 2 24 ARG HG3 4.920 . 5.660 5.807 5.634 6.006 0.346 9 0 "[ . 1 . 2]" 1 1201 1 18 GLU HA 1 24 ARG HG2 4.600 . 5.290 2.581 2.273 2.970 . 0 0 "[ . 1 . 2]" 1 1202 2 18 GLU HA 2 24 ARG HG3 4.600 . 5.290 3.059 2.874 3.221 . 0 0 "[ . 1 . 2]" 1 1203 2 15 VAL MG1 2 24 ARG HG3 5.080 . 5.840 4.080 3.722 4.292 . 0 0 "[ . 1 . 2]" 1 1204 1 59 GLU HG3 1 60 GLU H 4.180 . 4.810 4.398 4.063 4.844 0.034 7 0 "[ . 1 . 2]" 1 1205 2 59 GLU HG3 2 60 GLU H 4.180 . 4.810 4.355 4.178 4.739 . 0 0 "[ . 1 . 2]" 1 1206 1 29 ARG H 1 29 ARG HG2 4.680 . 5.380 4.005 3.757 4.619 . 0 0 "[ . 1 . 2]" 1 1207 2 29 ARG H 2 29 ARG HG2 4.680 . 5.380 4.027 3.745 4.857 . 0 0 "[ . 1 . 2]" 1 1208 1 45 SER HA 1 46 PRO HG2 5.130 . 5.900 4.607 4.455 4.771 . 0 0 "[ . 1 . 2]" 1 1209 2 45 SER HA 2 46 PRO HG2 5.130 . 5.900 4.580 4.346 4.838 . 0 0 "[ . 1 . 2]" 1 1210 1 49 GLU HG2 1 50 LYS H 4.500 . 5.180 3.281 2.898 4.826 . 0 0 "[ . 1 . 2]" 1 1211 2 49 GLU HG2 2 50 LYS H 4.500 . 5.180 3.401 2.833 5.009 . 0 0 "[ . 1 . 2]" 1 1212 1 49 GLU H 1 49 GLU HG2 3.730 . 4.290 2.218 1.895 3.764 . 0 0 "[ . 1 . 2]" 1 1213 2 49 GLU H 2 49 GLU HG2 3.730 . 4.290 2.299 1.954 3.710 . 0 0 "[ . 1 . 2]" 1 1214 1 49 GLU HG2 1 50 LYS HB2 5.300 . 6.100 4.587 4.088 6.237 0.137 7 0 "[ . 1 . 2]" 1 1215 2 49 GLU HG2 2 50 LYS HB2 5.300 . 6.100 4.623 4.021 6.236 0.136 12 0 "[ . 1 . 2]" 1 1216 1 49 GLU HG2 1 50 LYS HG2 5.680 . 6.530 3.958 3.199 5.370 . 0 0 "[ . 1 . 2]" 1 1217 2 49 GLU HG2 2 50 LYS HG2 5.680 . 6.530 3.815 3.258 5.221 . 0 0 "[ . 1 . 2]" 1 1218 1 15 VAL MG2 1 26 GLU HG3 4.340 . 4.990 4.492 2.206 4.901 . 0 0 "[ . 1 . 2]" 1 1219 2 15 VAL MG2 2 26 GLU HG3 4.340 . 4.990 4.745 4.388 4.989 . 0 0 "[ . 1 . 2]" 1 1220 1 38 LYS HG2 1 56 THR HB 5.100 . 5.870 5.086 4.127 6.012 0.142 17 0 "[ . 1 . 2]" 1 1221 2 38 LYS HG2 2 56 THR HB 5.100 . 5.870 5.054 4.100 5.958 0.088 15 0 "[ . 1 . 2]" 1 1222 1 38 LYS HG2 1 56 THR MG 4.500 . 5.180 4.028 3.370 4.602 . 0 0 "[ . 1 . 2]" 1 1223 2 38 LYS HG2 2 56 THR MG 4.500 . 5.180 4.020 3.346 4.493 . 0 0 "[ . 1 . 2]" 1 1224 1 51 MET H 1 51 MET HG2 3.880 . 4.460 2.569 2.229 2.808 . 0 0 "[ . 1 . 2]" 1 1225 2 51 MET H 2 51 MET HG2 3.880 . 4.460 2.446 2.070 2.782 . 0 0 "[ . 1 . 2]" 1 1226 1 51 MET ME 1 51 MET HG2 3.710 . 4.270 2.502 2.441 2.549 . 0 0 "[ . 1 . 2]" 1 1227 2 51 MET ME 2 51 MET HG2 3.710 . 4.270 2.510 2.440 2.550 . 0 0 "[ . 1 . 2]" 1 1228 1 67 LYS HG3 1 68 GLU H 4.480 . 5.150 4.413 4.296 4.551 . 0 0 "[ . 1 . 2]" 1 1229 2 67 LYS HG3 2 68 GLU H 4.480 . 5.150 4.384 3.781 4.558 . 0 0 "[ . 1 . 2]" 1 1230 1 23 TRP HH2 1 50 LYS HG3 5.490 . 6.310 4.503 4.085 4.928 . 0 0 "[ . 1 . 2]" 1 1231 2 23 TRP HH2 2 50 LYS HG3 5.490 . 6.310 4.469 4.217 4.832 . 0 0 "[ . 1 . 2]" 1 1232 1 50 LYS HA 1 50 LYS HG3 3.870 . 4.450 3.765 3.280 3.963 . 0 0 "[ . 1 . 2]" 1 1233 2 50 LYS HA 2 50 LYS HG3 3.870 . 4.450 3.834 3.349 3.934 . 0 0 "[ . 1 . 2]" 1 1234 1 67 LYS HD3 1 67 LYS HG3 2.640 . 3.040 2.410 2.358 2.457 . 0 0 "[ . 1 . 2]" 1 1235 2 67 LYS HD3 2 67 LYS HG3 2.640 . 3.040 2.396 2.313 2.432 . 0 0 "[ . 1 . 2]" 1 1236 1 14 ILE MD 2 72 LYS HG2 5.450 . 6.270 5.078 3.231 5.573 . 0 0 "[ . 1 . 2]" 1 1237 1 72 LYS HG2 2 14 ILE MD 5.450 . 6.270 4.962 4.061 5.367 . 0 0 "[ . 1 . 2]" 1 1238 1 14 ILE MD 2 72 LYS HG3 5.450 . 6.270 4.105 2.880 4.651 . 0 0 "[ . 1 . 2]" 1 1239 1 72 LYS HG3 2 14 ILE MD 5.450 . 6.270 4.050 3.572 5.082 . 0 0 "[ . 1 . 2]" 1 1240 1 58 SER HB3 1 59 GLU HG3 4.490 . 5.160 4.516 4.153 5.290 0.130 6 0 "[ . 1 . 2]" 1 1241 2 58 SER HB3 2 59 GLU HG3 4.490 . 5.160 4.347 3.906 5.286 0.126 4 0 "[ . 1 . 2]" 1 1242 1 60 GLU HG3 1 61 GLU H 4.290 . 4.930 4.233 3.855 4.985 0.055 17 0 "[ . 1 . 2]" 1 1243 2 60 GLU HG3 2 61 GLU H 4.290 . 4.930 4.220 3.990 4.550 . 0 0 "[ . 1 . 2]" 1 1244 1 60 GLU HA 1 60 GLU HG3 3.320 . 3.820 3.073 2.552 3.374 . 0 0 "[ . 1 . 2]" 1 1245 2 60 GLU HA 2 60 GLU HG3 3.320 . 3.820 3.126 2.923 3.285 . 0 0 "[ . 1 . 2]" 1 1246 1 63 GLY HA2 1 67 LYS HG3 5.060 . 5.820 4.284 4.179 4.507 . 0 0 "[ . 1 . 2]" 1 1247 2 63 GLY HA2 2 67 LYS HG3 5.060 . 5.820 4.314 4.062 4.493 . 0 0 "[ . 1 . 2]" 1 1248 1 64 VAL HA 1 67 LYS HG3 5.340 . 6.140 3.758 3.478 4.152 . 0 0 "[ . 1 . 2]" 1 1249 2 64 VAL HA 2 67 LYS HG3 5.340 . 6.140 3.730 3.218 4.277 . 0 0 "[ . 1 . 2]" 1 1250 1 66 LEU HB2 1 67 LYS HG3 4.120 . 4.740 3.392 3.141 3.865 . 0 0 "[ . 1 . 2]" 1 1251 2 66 LEU HB2 2 67 LYS HG3 4.120 . 4.740 3.393 3.101 3.650 . 0 0 "[ . 1 . 2]" 1 1252 1 66 LEU MD1 1 67 LYS HG3 5.000 . 5.750 4.803 4.569 5.259 . 0 0 "[ . 1 . 2]" 1 1253 2 66 LEU MD1 2 67 LYS HG3 5.000 . 5.750 4.805 4.428 5.040 . 0 0 "[ . 1 . 2]" 1 1254 1 8 GLU HA 1 8 GLU HG2 3.740 . 4.300 3.186 2.991 3.345 . 0 0 "[ . 1 . 2]" 1 1255 2 8 GLU HA 2 8 GLU HG2 3.740 . 4.300 3.182 3.010 3.781 . 0 0 "[ . 1 . 2]" 1 1256 1 11 GLU HG3 1 12 GLU H 4.070 . 4.680 2.769 2.587 2.965 . 0 0 "[ . 1 . 2]" 1 1257 2 11 GLU HG3 2 12 GLU H 4.070 . 4.680 2.752 2.459 3.133 . 0 0 "[ . 1 . 2]" 1 1258 1 12 GLU HG3 1 13 LEU H 5.250 . 6.040 5.047 4.372 5.264 . 0 0 "[ . 1 . 2]" 1 1259 2 12 GLU HG3 2 13 LEU H 5.250 . 6.040 4.978 4.433 5.324 . 0 0 "[ . 1 . 2]" 1 1260 1 12 GLU HA 1 12 GLU HG3 4.030 . 4.630 3.004 2.515 3.232 . 0 0 "[ . 1 . 2]" 1 1261 2 12 GLU HA 2 12 GLU HG3 4.030 . 4.630 2.940 2.560 3.284 . 0 0 "[ . 1 . 2]" 1 1262 1 18 GLU H 1 18 GLU HG3 5.020 . 5.770 4.794 4.725 4.831 . 0 0 "[ . 1 . 2]" 1 1263 2 18 GLU H 2 18 GLU HG3 5.020 . 5.770 4.767 4.721 4.826 . 0 0 "[ . 1 . 2]" 1 1264 1 18 GLU HA 1 18 GLU HG3 3.920 . 4.510 2.634 2.516 2.690 . 0 0 "[ . 1 . 2]" 1 1265 2 18 GLU HA 2 18 GLU HG3 3.920 . 4.510 2.619 2.524 2.734 . 0 0 "[ . 1 . 2]" 1 1266 2 24 ARG HA 2 24 ARG HG2 4.230 . 4.860 2.567 2.363 2.917 . 0 0 "[ . 1 . 2]" 1 1267 1 37 PRO HG2 1 38 LYS H 5.010 . 5.760 5.212 4.786 5.762 0.002 5 0 "[ . 1 . 2]" 1 1268 2 37 PRO HG2 2 38 LYS H 5.010 . 5.760 5.284 4.809 5.771 0.011 5 0 "[ . 1 . 2]" 1 1269 1 10 ILE HG13 1 37 PRO HG2 4.730 . 5.440 4.395 3.356 5.069 . 0 0 "[ . 1 . 2]" 1 1270 2 10 ILE HG13 2 37 PRO HG2 4.730 . 5.440 4.189 3.192 4.916 . 0 0 "[ . 1 . 2]" 1 1271 1 10 ILE MG 1 37 PRO HG2 4.470 . 5.140 3.932 2.914 4.742 . 0 0 "[ . 1 . 2]" 1 1272 2 10 ILE MG 2 37 PRO HG2 4.470 . 5.140 3.910 3.088 4.754 . 0 0 "[ . 1 . 2]" 1 1273 1 49 GLU HG3 1 50 LYS H 4.500 . 5.180 2.874 2.450 3.691 . 0 0 "[ . 1 . 2]" 1 1274 2 49 GLU HG3 2 50 LYS H 4.500 . 5.180 2.937 2.619 3.900 . 0 0 "[ . 1 . 2]" 1 1275 1 49 GLU H 1 49 GLU HG3 3.730 . 4.290 2.999 2.209 3.250 . 0 0 "[ . 1 . 2]" 1 1276 2 49 GLU H 2 49 GLU HG3 3.730 . 4.290 2.926 2.175 3.255 . 0 0 "[ . 1 . 2]" 1 1277 1 49 GLU HA 1 49 GLU HG3 3.910 . 4.500 3.770 3.692 3.842 . 0 0 "[ . 1 . 2]" 1 1278 2 49 GLU HA 2 49 GLU HG3 3.910 . 4.500 3.767 3.672 3.843 . 0 0 "[ . 1 . 2]" 1 1279 1 49 GLU HG3 1 50 LYS HB2 5.300 . 6.100 3.711 2.906 5.307 . 0 0 "[ . 1 . 2]" 1 1280 2 49 GLU HG3 2 50 LYS HB2 5.300 . 6.100 3.736 3.096 5.377 . 0 0 "[ . 1 . 2]" 1 1281 1 49 GLU HG3 1 50 LYS HG2 5.680 . 6.530 2.443 1.771 4.647 0.029 18 0 "[ . 1 . 2]" 1 1282 2 49 GLU HG3 2 50 LYS HG2 5.680 . 6.530 2.319 1.775 4.802 0.025 11 0 "[ . 1 . 2]" 1 1283 1 38 LYS HG3 1 39 TYR H 4.440 . 5.110 3.550 3.212 3.787 . 0 0 "[ . 1 . 2]" 1 1284 2 38 LYS HG3 2 39 TYR H 4.440 . 5.110 3.561 3.317 3.970 . 0 0 "[ . 1 . 2]" 1 1285 1 38 LYS HA 1 38 LYS HG3 3.950 . 4.540 3.827 3.768 3.881 . 0 0 "[ . 1 . 2]" 1 1286 2 38 LYS HA 2 38 LYS HG3 3.950 . 4.540 3.834 3.805 3.904 . 0 0 "[ . 1 . 2]" 1 1287 1 38 LYS HG3 1 56 THR MG 4.110 . 4.730 2.997 2.147 3.741 . 0 0 "[ . 1 . 2]" 1 1288 2 38 LYS HG3 2 56 THR MG 4.110 . 4.730 3.015 2.129 3.546 . 0 0 "[ . 1 . 2]" 1 1289 1 51 MET H 1 51 MET HG3 3.880 . 4.460 3.280 3.078 3.474 . 0 0 "[ . 1 . 2]" 1 1290 2 51 MET H 2 51 MET HG3 3.880 . 4.460 3.231 3.050 3.439 . 0 0 "[ . 1 . 2]" 1 1291 1 51 MET ME 1 51 MET HG3 3.710 . 4.270 2.727 2.480 3.438 . 0 0 "[ . 1 . 2]" 1 1292 2 51 MET ME 2 51 MET HG3 3.710 . 4.270 2.815 2.501 3.428 . 0 0 "[ . 1 . 2]" 1 1293 1 50 LYS HG2 1 51 MET H 4.500 . 5.180 4.637 3.920 4.932 . 0 0 "[ . 1 . 2]" 1 1294 2 50 LYS HG2 2 51 MET H 4.500 . 5.180 4.751 4.066 5.009 . 0 0 "[ . 1 . 2]" 1 1295 1 60 GLU H 1 60 GLU HG2 3.700 . 4.260 3.371 3.028 3.832 . 0 0 "[ . 1 . 2]" 1 1296 2 60 GLU H 2 60 GLU HG2 3.700 . 4.260 3.362 3.075 3.603 . 0 0 "[ . 1 . 2]" 1 1297 1 60 GLU HG2 1 61 GLU H 5.080 . 5.840 4.885 4.737 5.063 . 0 0 "[ . 1 . 2]" 1 1298 2 60 GLU HG2 2 61 GLU H 5.080 . 5.840 4.909 4.785 5.121 . 0 0 "[ . 1 . 2]" 1 1299 1 60 GLU HA 1 60 GLU HG2 3.260 . 3.750 2.766 2.480 3.755 0.005 17 0 "[ . 1 . 2]" 1 1300 2 60 GLU HA 2 60 GLU HG2 3.260 . 3.750 2.628 2.478 2.740 . 0 0 "[ . 1 . 2]" 1 1301 1 60 GLU HG2 1 64 VAL MG2 5.560 . 6.390 5.511 5.228 5.824 . 0 0 "[ . 1 . 2]" 1 1302 2 60 GLU HG2 2 64 VAL MG2 5.560 . 6.390 5.406 4.950 5.756 . 0 0 "[ . 1 . 2]" 1 1303 1 74 GLU H 1 74 GLU HG3 4.020 . 4.620 2.941 2.332 4.148 . 0 0 "[ . 1 . 2]" 1 1304 2 74 GLU H 2 74 GLU HG3 4.020 . 4.620 2.869 2.189 3.776 . 0 0 "[ . 1 . 2]" 1 1305 1 74 GLU HA 1 74 GLU HG3 4.010 . 4.610 3.311 2.611 3.894 . 0 0 "[ . 1 . 2]" 1 1306 2 74 GLU HA 2 74 GLU HG3 4.010 . 4.610 3.399 2.906 3.885 . 0 0 "[ . 1 . 2]" 1 1307 1 5 LEU MD1 1 32 TRP HE3 3.640 . 4.190 3.161 2.613 3.919 . 0 0 "[ . 1 . 2]" 1 1308 2 5 LEU MD1 2 32 TRP HE3 3.640 . 4.190 3.144 2.504 4.216 0.026 4 0 "[ . 1 . 2]" 1 1309 1 5 LEU MD1 1 33 ASN HD22 4.000 . 4.600 3.941 2.920 4.866 0.266 13 0 "[ . 1 . 2]" 1 1310 2 5 LEU MD1 2 33 ASN HD22 4.000 . 4.600 4.064 3.052 4.861 0.261 4 0 "[ . 1 . 2]" 1 1311 1 5 LEU MD1 1 32 TRP HZ3 4.190 . 4.820 3.474 2.874 4.868 0.048 11 0 "[ . 1 . 2]" 1 1312 2 5 LEU MD1 2 32 TRP HZ3 4.190 . 4.820 3.333 2.424 4.605 . 0 0 "[ . 1 . 2]" 1 1313 1 5 LEU QB 1 5 LEU MD1 2.840 . 3.270 2.140 2.125 2.157 . 0 0 "[ . 1 . 2]" 1 1314 2 5 LEU HB3 2 5 LEU MD1 2.840 . 3.270 2.375 2.331 2.427 . 0 0 "[ . 1 . 2]" 1 1315 1 9 ILE MD 1 10 ILE H 4.970 . 5.720 5.306 5.103 5.473 . 0 0 "[ . 1 . 2]" 1 1316 2 9 ILE MD 2 10 ILE H 4.970 . 5.720 5.275 5.111 5.404 . 0 0 "[ . 1 . 2]" 1 1317 1 9 ILE MD 1 44 TRP HD1 5.020 . 5.770 4.841 3.765 5.804 0.034 6 0 "[ . 1 . 2]" 1 1318 2 9 ILE MD 2 44 TRP HD1 5.020 . 5.770 4.792 3.837 5.536 . 0 0 "[ . 1 . 2]" 1 1319 1 9 ILE MD 1 44 TRP HZ3 4.270 . 4.910 4.036 2.897 4.542 . 0 0 "[ . 1 . 2]" 1 1320 2 9 ILE MD 2 44 TRP HZ3 4.270 . 4.910 4.117 3.266 4.840 . 0 0 "[ . 1 . 2]" 1 1321 1 9 ILE MD 1 44 TRP HH2 4.830 . 5.550 4.108 3.052 4.838 . 0 0 "[ . 1 . 2]" 1 1322 2 9 ILE MD 2 44 TRP HH2 4.830 . 5.550 4.248 3.365 4.990 . 0 0 "[ . 1 . 2]" 1 1323 1 9 ILE MD 1 48 HIS HD2 3.750 . 4.310 3.357 2.559 4.384 0.074 3 0 "[ . 1 . 2]" 1 1324 2 9 ILE MD 2 48 HIS HD2 3.750 . 4.310 3.319 2.599 4.234 . 0 0 "[ . 1 . 2]" 1 1325 1 9 ILE HA 1 9 ILE MD 3.960 . 4.550 3.851 3.761 3.930 . 0 0 "[ . 1 . 2]" 1 1326 2 9 ILE HA 2 9 ILE MD 3.960 . 4.550 3.850 3.766 3.928 . 0 0 "[ . 1 . 2]" 1 1327 1 9 ILE MD 1 48 HIS HB2 3.900 . 4.490 3.177 2.892 3.670 . 0 0 "[ . 1 . 2]" 1 1328 2 9 ILE MD 2 48 HIS HB2 3.900 . 4.490 3.235 2.793 3.757 . 0 0 "[ . 1 . 2]" 1 1329 1 9 ILE MD 1 48 HIS HB3 3.900 . 4.490 2.203 1.967 2.664 . 0 0 "[ . 1 . 2]" 1 1330 2 9 ILE MD 2 48 HIS HB3 3.900 . 4.490 2.190 1.799 2.719 0.001 12 0 "[ . 1 . 2]" 1 1331 1 9 ILE HB 1 9 ILE MD 3.120 . 3.590 2.514 2.446 2.627 . 0 0 "[ . 1 . 2]" 1 1332 2 9 ILE HB 2 9 ILE MD 3.120 . 3.590 2.519 2.462 2.605 . 0 0 "[ . 1 . 2]" 1 1333 1 9 ILE H 1 10 ILE MD 4.940 . 5.680 4.675 4.487 4.914 . 0 0 "[ . 1 . 2]" 1 1334 2 9 ILE H 2 10 ILE MD 4.940 . 5.680 4.603 4.122 4.881 . 0 0 "[ . 1 . 2]" 1 1335 1 10 ILE MD 1 31 SER H 3.760 . 4.320 3.456 3.272 3.658 . 0 0 "[ . 1 . 2]" 1 1336 2 10 ILE MD 2 31 SER H 3.760 . 4.320 3.408 3.113 3.664 . 0 0 "[ . 1 . 2]" 1 1337 1 10 ILE H 1 10 ILE MD 3.730 . 4.290 3.331 3.182 3.538 . 0 0 "[ . 1 . 2]" 1 1338 2 10 ILE H 2 10 ILE MD 3.730 . 4.290 3.306 3.181 3.465 . 0 0 "[ . 1 . 2]" 1 1339 1 8 GLU H 1 10 ILE MD 4.630 . 5.320 4.591 4.282 4.882 . 0 0 "[ . 1 . 2]" 1 1340 2 8 GLU H 2 10 ILE MD 4.630 . 5.320 4.572 4.151 4.813 . 0 0 "[ . 1 . 2]" 1 1341 1 10 ILE MD 1 30 VAL HA 4.030 . 4.630 4.225 4.015 4.393 . 0 0 "[ . 1 . 2]" 1 1342 2 10 ILE MD 2 30 VAL HA 4.030 . 4.630 4.179 3.852 4.397 . 0 0 "[ . 1 . 2]" 1 1343 1 10 ILE MD 1 37 PRO HA 4.630 . 5.320 4.545 4.077 5.133 . 0 0 "[ . 1 . 2]" 1 1344 2 10 ILE MD 2 37 PRO HA 4.630 . 5.320 4.625 4.288 5.023 . 0 0 "[ . 1 . 2]" 1 1345 1 10 ILE HA 1 10 ILE MD 2.810 . 3.230 2.115 2.009 2.189 . 0 0 "[ . 1 . 2]" 1 1346 2 10 ILE HA 2 10 ILE MD 2.810 . 3.230 2.120 2.032 2.246 . 0 0 "[ . 1 . 2]" 1 1347 1 10 ILE MD 1 31 SER HB2 3.750 . 4.310 2.470 2.054 3.621 . 0 0 "[ . 1 . 2]" 1 1348 2 10 ILE MD 2 31 SER HB2 3.750 . 4.310 2.535 2.094 3.742 . 0 0 "[ . 1 . 2]" 1 1349 1 10 ILE MD 1 31 SER HB3 3.750 . 4.310 2.409 2.162 2.776 . 0 0 "[ . 1 . 2]" 1 1350 2 10 ILE MD 2 31 SER HB3 3.750 . 4.310 2.422 2.227 2.698 . 0 0 "[ . 1 . 2]" 1 1351 1 8 GLU HG2 1 10 ILE MD 2.990 . 3.440 2.605 2.117 3.353 . 0 0 "[ . 1 . 2]" 1 1352 2 8 GLU HG2 2 10 ILE MD 2.990 . 3.440 2.681 2.323 3.195 . 0 0 "[ . 1 . 2]" 1 1353 1 10 ILE HB 1 10 ILE MD 3.300 . 3.800 3.279 3.270 3.290 . 0 0 "[ . 1 . 2]" 1 1354 2 10 ILE HB 2 10 ILE MD 3.300 . 3.800 3.280 3.268 3.290 . 0 0 "[ . 1 . 2]" 1 1355 1 9 ILE MG 1 10 ILE MD 4.580 . 5.270 5.066 4.937 5.251 . 0 0 "[ . 1 . 2]" 1 1356 2 9 ILE MG 2 10 ILE MD 4.580 . 5.270 4.993 4.770 5.200 . 0 0 "[ . 1 . 2]" 1 1357 1 10 ILE MD 1 30 VAL MG1 4.170 . 4.800 4.741 4.545 4.892 0.092 1 0 "[ . 1 . 2]" 1 1358 2 10 ILE MD 2 30 VAL MG1 4.170 . 4.800 4.709 4.398 4.891 0.091 5 0 "[ . 1 . 2]" 1 1359 1 13 LEU QD 1 40 ASP H 4.830 . 5.550 4.002 3.603 4.468 . 0 0 "[ . 1 . 2]" 1 1360 2 13 LEU QD 2 40 ASP H 4.830 . 5.550 4.030 3.658 4.353 . 0 0 "[ . 1 . 2]" 1 1361 1 13 LEU QD 1 29 ARG H 4.370 . 5.030 3.441 3.062 4.451 . 0 0 "[ . 1 . 2]" 1 1362 2 13 LEU QD 2 29 ARG H 4.370 . 5.030 3.482 2.956 4.152 . 0 0 "[ . 1 . 2]" 1 1363 1 13 LEU QD 1 14 ILE H 4.510 . 5.190 3.920 3.858 3.960 . 0 0 "[ . 1 . 2]" 1 1364 2 13 LEU QD 2 14 ILE H 4.510 . 5.190 3.928 3.858 3.974 . 0 0 "[ . 1 . 2]" 1 1365 1 13 LEU H 1 13 LEU QD 4.250 . 4.300 3.290 3.153 3.379 . 0 0 "[ . 1 . 2]" 1 1366 2 13 LEU H 2 13 LEU QD 4.250 . 4.300 3.288 3.187 3.407 . 0 0 "[ . 1 . 2]" 1 1367 1 13 LEU QD 1 62 PHE HE2 4.600 . 5.290 3.749 3.298 4.157 . 0 0 "[ . 1 . 2]" 1 1368 2 13 LEU QD 2 62 PHE HE2 4.600 . 5.290 3.807 3.460 4.135 . 0 0 "[ . 1 . 2]" 1 1369 1 13 LEU QD 1 29 ARG HA 4.430 . 5.090 3.790 3.214 4.396 . 0 0 "[ . 1 . 2]" 1 1370 2 13 LEU QD 2 29 ARG HA 4.430 . 5.090 3.825 3.159 4.138 . 0 0 "[ . 1 . 2]" 1 1371 1 13 LEU HA 1 13 LEU QD . . 3.430 2.122 2.073 2.207 . 0 0 "[ . 1 . 2]" 1 1372 2 13 LEU HA 2 13 LEU QD . . 3.430 2.113 2.032 2.190 . 0 0 "[ . 1 . 2]" 1 1373 1 13 LEU QD 1 29 ARG HD2 . . 4.150 2.765 2.200 4.341 0.191 18 0 "[ . 1 . 2]" 1 1374 2 13 LEU QD 2 29 ARG HD2 . . 4.150 2.708 2.072 4.270 0.120 7 0 "[ . 1 . 2]" 1 1375 1 14 ILE MD 1 15 VAL H 4.790 . 5.510 5.367 5.159 5.552 0.042 15 0 "[ . 1 . 2]" 1 1376 2 14 ILE MD 2 15 VAL H 4.790 . 5.510 5.381 5.154 5.529 0.019 6 0 "[ . 1 . 2]" 1 1377 1 68 GLU H 2 14 ILE MD 3.640 . 4.190 3.599 3.370 3.779 . 0 0 "[ . 1 . 2]" 1 1378 1 14 ILE MD 2 68 GLU H 3.640 . 4.190 3.631 3.361 3.871 . 0 0 "[ . 1 . 2]" 1 1379 1 66 LEU H 2 14 ILE MD 4.900 . 5.640 5.018 4.820 5.177 . 0 0 "[ . 1 . 2]" 1 1380 1 14 ILE MD 2 66 LEU H 4.900 . 5.640 5.020 4.848 5.361 . 0 0 "[ . 1 . 2]" 1 1381 1 67 LYS H 2 14 ILE MD 5.730 . 6.590 5.256 5.015 5.405 . 0 0 "[ . 1 . 2]" 1 1382 1 14 ILE MD 2 67 LYS H 5.730 . 6.590 5.275 5.016 5.622 . 0 0 "[ . 1 . 2]" 1 1383 1 14 ILE MD 1 62 PHE HZ 4.410 . 5.070 4.060 3.843 4.317 . 0 0 "[ . 1 . 2]" 1 1384 2 14 ILE MD 2 62 PHE HZ 4.410 . 5.070 4.104 3.798 4.520 . 0 0 "[ . 1 . 2]" 1 1385 1 14 ILE HA 1 14 ILE MD 3.950 . 4.540 3.996 3.956 4.050 . 0 0 "[ . 1 . 2]" 1 1386 2 14 ILE HA 2 14 ILE MD 3.950 . 4.540 3.992 3.946 4.031 . 0 0 "[ . 1 . 2]" 1 1387 1 65 LEU HA 2 14 ILE MD 3.410 . 3.920 2.341 2.155 2.555 . 0 0 "[ . 1 . 2]" 1 1388 1 14 ILE MD 2 65 LEU HA 3.410 . 3.920 2.284 2.072 2.500 . 0 0 "[ . 1 . 2]" 1 1389 1 68 GLU HB2 2 14 ILE MD 3.420 . 3.930 1.958 1.861 2.072 . 0 0 "[ . 1 . 2]" 1 1390 1 14 ILE MD 2 68 GLU HB2 3.420 . 3.930 1.988 1.866 2.098 . 0 0 "[ . 1 . 2]" 1 1391 1 68 GLU HB3 2 14 ILE MD 3.200 . 3.680 2.973 2.735 3.242 . 0 0 "[ . 1 . 2]" 1 1392 1 14 ILE MD 2 68 GLU HB3 3.200 . 3.680 2.988 2.710 3.288 . 0 0 "[ . 1 . 2]" 1 1393 1 14 ILE HB 1 14 ILE MD 2.980 . 3.430 2.455 2.431 2.494 . 0 0 "[ . 1 . 2]" 1 1394 2 14 ILE HB 2 14 ILE MD 2.980 . 3.430 2.453 2.434 2.469 . 0 0 "[ . 1 . 2]" 1 1395 1 65 LEU HG 2 14 ILE MD 3.460 . 3.980 3.367 3.220 3.569 . 0 0 "[ . 1 . 2]" 1 1396 1 14 ILE MD 2 65 LEU HG 3.460 . 3.980 3.410 3.266 3.732 . 0 0 "[ . 1 . 2]" 1 1397 1 16 LEU H 1 16 LEU MD1 3.920 . 4.510 3.781 3.660 3.864 . 0 0 "[ . 1 . 2]" 1 1398 2 16 LEU H 2 16 LEU MD1 3.920 . 4.510 3.816 3.514 3.907 . 0 0 "[ . 1 . 2]" 1 1399 1 16 LEU MD1 1 27 LEU H 4.560 . 5.240 3.762 3.418 4.128 . 0 0 "[ . 1 . 2]" 1 1400 2 16 LEU MD1 2 27 LEU H 4.560 . 5.240 3.820 3.210 4.282 . 0 0 "[ . 1 . 2]" 1 1401 1 16 LEU MD1 1 42 ARG H 4.600 . 5.290 4.836 4.438 5.112 . 0 0 "[ . 1 . 2]" 1 1402 2 16 LEU MD1 2 42 ARG H 4.600 . 5.290 4.972 4.379 5.266 . 0 0 "[ . 1 . 2]" 1 1403 1 16 LEU MD1 1 17 SER H 4.450 . 5.120 4.838 4.737 4.934 . 0 0 "[ . 1 . 2]" 1 1404 2 16 LEU MD1 2 17 SER H 4.450 . 5.120 4.850 4.588 4.965 . 0 0 "[ . 1 . 2]" 1 1405 1 16 LEU HA 1 16 LEU MD1 4.080 . 4.690 3.938 3.919 3.966 . 0 0 "[ . 1 . 2]" 1 1406 2 16 LEU HA 2 16 LEU MD1 4.080 . 4.690 3.938 3.910 3.983 . 0 0 "[ . 1 . 2]" 1 1407 1 16 LEU HB3 1 16 LEU MD1 3.120 . 3.590 2.463 2.415 2.524 . 0 0 "[ . 1 . 2]" 1 1408 2 16 LEU HB3 2 16 LEU MD1 3.120 . 3.590 2.451 2.419 2.529 . 0 0 "[ . 1 . 2]" 1 1409 1 16 LEU MD1 1 27 LEU HB2 4.290 . 4.930 3.111 2.722 3.610 . 0 0 "[ . 1 . 2]" 1 1410 2 16 LEU MD1 2 27 LEU HB2 4.290 . 4.930 3.309 2.634 3.740 . 0 0 "[ . 1 . 2]" 1 1411 1 65 LEU MD2 2 16 LEU MD1 4.110 . 4.730 3.046 2.747 3.909 . 0 0 "[ . 1 . 2]" 1 1412 1 16 LEU MD1 2 65 LEU MD2 4.110 . 4.730 3.137 2.874 3.560 . 0 0 "[ . 1 . 2]" 1 1413 1 27 LEU QD 1 28 ASN H . . 3.810 2.739 2.302 2.922 . 0 0 "[ . 1 . 2]" 1 1414 2 27 LEU QD 2 28 ASN H . . 3.810 2.744 2.410 2.948 . 0 0 "[ . 1 . 2]" 1 1415 1 27 LEU H 1 27 LEU QD 4.420 . 5.080 3.877 3.812 3.928 . 0 0 "[ . 1 . 2]" 1 1416 2 27 LEU H 2 27 LEU QD 4.420 . 5.080 3.867 3.813 3.918 . 0 0 "[ . 1 . 2]" 1 1417 1 14 ILE H 1 27 LEU QD 4.040 . 4.650 3.862 3.583 4.060 . 0 0 "[ . 1 . 2]" 1 1418 2 14 ILE H 2 27 LEU QD 4.040 . 4.650 3.855 3.628 4.077 . 0 0 "[ . 1 . 2]" 1 1419 1 13 LEU H 1 27 LEU QD 5.110 . 5.880 4.695 4.611 4.790 . 0 0 "[ . 1 . 2]" 1 1420 2 13 LEU H 2 27 LEU QD 5.110 . 5.880 4.684 4.612 4.799 . 0 0 "[ . 1 . 2]" 1 1421 1 27 LEU QD 1 62 PHE HZ 3.490 . 4.010 2.189 1.885 2.774 . 0 0 "[ . 1 . 2]" 1 1422 2 27 LEU QD 2 62 PHE HZ 3.490 . 4.010 2.180 1.869 2.623 . 0 0 "[ . 1 . 2]" 1 1423 1 27 LEU QD 1 62 PHE HD1 4.090 . 4.700 3.335 3.176 3.631 . 0 0 "[ . 1 . 2]" 1 1424 2 27 LEU QD 2 62 PHE HD1 4.090 . 4.700 3.277 3.166 3.472 . 0 0 "[ . 1 . 2]" 1 1425 1 27 LEU QD 1 39 TYR QD 4.340 . 4.580 3.189 2.854 3.488 . 0 0 "[ . 1 . 2]" 1 1426 2 27 LEU QD 2 39 TYR QD 4.340 . 4.580 3.201 2.883 3.496 . 0 0 "[ . 1 . 2]" 1 1427 1 27 LEU QD 1 39 TYR QE 5.750 . 6.610 4.555 4.227 4.869 . 0 0 "[ . 1 . 2]" 1 1428 2 27 LEU QD 2 39 TYR QE 5.750 . 6.610 4.561 4.198 4.941 . 0 0 "[ . 1 . 2]" 1 1429 1 27 LEU HA 1 27 LEU QD . . 3.730 2.255 2.197 2.309 . 0 0 "[ . 1 . 2]" 1 1430 2 27 LEU HA 2 27 LEU QD . . 3.730 2.250 2.216 2.320 . 0 0 "[ . 1 . 2]" 1 1431 1 13 LEU HA 1 27 LEU QD 5.180 . 5.960 5.015 4.888 5.194 . 0 0 "[ . 1 . 2]" 1 1432 2 13 LEU HA 2 27 LEU QD 5.180 . 5.960 5.012 4.812 5.318 . 0 0 "[ . 1 . 2]" 1 1433 1 13 LEU HB2 1 27 LEU QD 3.380 . 3.890 2.908 2.802 3.132 . 0 0 "[ . 1 . 2]" 1 1434 2 13 LEU HB2 2 27 LEU QD 3.380 . 3.890 2.902 2.754 3.160 . 0 0 "[ . 1 . 2]" 1 1435 1 13 LEU QD 1 27 LEU QD 2.430 . 2.790 2.329 2.263 2.393 . 0 0 "[ . 1 . 2]" 1 1436 2 13 LEU QD 2 27 LEU QD 2.430 . 2.790 2.327 2.221 2.460 . 0 0 "[ . 1 . 2]" 1 1437 1 65 LEU MD2 2 27 LEU QD 3.570 . 4.110 3.457 3.295 3.603 . 0 0 "[ . 1 . 2]" 1 1438 1 27 LEU QD 2 65 LEU MD2 3.570 . 4.110 3.547 3.418 3.843 . 0 0 "[ . 1 . 2]" 1 1439 1 27 LEU H 1 41 ILE MD 5.420 . 6.230 5.105 4.771 5.442 . 0 0 "[ . 1 . 2]" 1 1440 2 27 LEU H 2 41 ILE MD 5.420 . 6.230 5.169 4.667 5.592 . 0 0 "[ . 1 . 2]" 1 1441 1 41 ILE MD 1 42 ARG H 4.730 . 5.440 4.590 4.340 4.821 . 0 0 "[ . 1 . 2]" 1 1442 2 41 ILE MD 2 42 ARG H 4.730 . 5.440 4.604 4.352 4.792 . 0 0 "[ . 1 . 2]" 1 1443 1 62 PHE HE1 2 41 ILE MD 5.800 . 6.670 5.285 4.735 6.084 . 0 0 "[ . 1 . 2]" 1 1444 1 41 ILE MD 2 62 PHE HE1 5.800 . 6.670 5.480 4.948 6.062 . 0 0 "[ . 1 . 2]" 1 1445 1 27 LEU HA 1 41 ILE MD 4.490 . 5.160 4.279 3.943 4.562 . 0 0 "[ . 1 . 2]" 1 1446 2 27 LEU HA 2 41 ILE MD 4.490 . 5.160 4.318 3.993 4.556 . 0 0 "[ . 1 . 2]" 1 1447 1 41 ILE HA 1 41 ILE MD 3.850 . 4.430 3.872 3.832 3.895 . 0 0 "[ . 1 . 2]" 1 1448 2 41 ILE HA 2 41 ILE MD 3.850 . 4.430 3.874 3.830 3.910 . 0 0 "[ . 1 . 2]" 1 1449 1 27 LEU HB3 1 41 ILE MD 4.480 . 5.150 4.692 4.374 4.955 . 0 0 "[ . 1 . 2]" 1 1450 2 27 LEU HB3 2 41 ILE MD 4.480 . 5.150 4.773 4.480 5.069 . 0 0 "[ . 1 . 2]" 1 1451 1 41 ILE HB 1 41 ILE MD 3.190 . 3.670 2.485 2.443 2.504 . 0 0 "[ . 1 . 2]" 1 1452 2 41 ILE HB 2 41 ILE MD 3.190 . 3.670 2.489 2.459 2.516 . 0 0 "[ . 1 . 2]" 1 1453 1 55 ILE HG12 2 41 ILE MD 4.330 . 4.980 4.849 4.207 5.050 0.070 7 0 "[ . 1 . 2]" 1 1454 1 41 ILE MD 2 55 ILE HG12 4.330 . 4.980 4.806 4.393 5.021 0.041 1 0 "[ . 1 . 2]" 1 1455 1 65 LEU MD2 2 41 ILE MD 3.550 . 4.080 2.801 2.529 3.079 . 0 0 "[ . 1 . 2]" 1 1456 1 41 ILE MD 2 65 LEU MD2 3.550 . 4.080 2.921 2.633 3.279 . 0 0 "[ . 1 . 2]" 1 1457 1 42 ARG H 2 55 ILE MD 4.080 . 4.690 3.579 3.320 3.866 . 0 0 "[ . 1 . 2]" 1 1458 1 55 ILE MD 2 42 ARG H 4.080 . 4.690 3.562 3.170 3.991 . 0 0 "[ . 1 . 2]" 1 1459 1 43 THR H 2 55 ILE MD 3.960 . 4.550 3.010 2.662 3.273 . 0 0 "[ . 1 . 2]" 1 1460 1 55 ILE MD 2 43 THR H 3.960 . 4.550 2.955 2.625 3.415 . 0 0 "[ . 1 . 2]" 1 1461 1 41 ILE HA 2 55 ILE MD 5.060 . 5.820 4.712 4.158 4.904 . 0 0 "[ . 1 . 2]" 1 1462 1 55 ILE MD 2 41 ILE HA 5.060 . 5.820 4.718 4.053 5.082 . 0 0 "[ . 1 . 2]" 1 1463 1 42 ARG HA 2 55 ILE MD 3.010 . 3.460 2.205 1.831 3.175 . 0 0 "[ . 1 . 2]" 1 1464 1 55 ILE MD 2 42 ARG HA 3.010 . 3.460 2.189 1.950 2.776 . 0 0 "[ . 1 . 2]" 1 1465 1 54 GLY HA2 2 55 ILE MD 3.520 . 4.050 3.674 2.663 4.132 0.082 4 0 "[ . 1 . 2]" 1 1466 1 55 ILE MD 2 54 GLY HA2 3.520 . 4.050 3.721 3.121 4.098 0.048 19 0 "[ . 1 . 2]" 1 1467 1 55 ILE HB 1 55 ILE MD 2.980 . 3.430 2.500 2.447 2.566 . 0 0 "[ . 1 . 2]" 1 1468 2 55 ILE HB 2 55 ILE MD 2.980 . 3.430 2.483 2.381 2.533 . 0 0 "[ . 1 . 2]" 1 1469 1 57 LEU MD2 1 58 SER H 3.620 . 4.160 3.771 3.621 3.899 . 0 0 "[ . 1 . 2]" 1 1470 2 57 LEU MD2 2 58 SER H 3.620 . 4.160 3.818 3.706 3.929 . 0 0 "[ . 1 . 2]" 1 1471 1 57 LEU H 1 57 LEU MD1 4.500 . 5.180 4.168 4.038 4.283 . 0 0 "[ . 1 . 2]" 1 1472 2 57 LEU H 2 57 LEU MD1 4.500 . 5.180 4.186 4.106 4.250 . 0 0 "[ . 1 . 2]" 1 1473 1 57 LEU H 1 57 LEU MD2 4.860 . 5.590 3.790 3.643 3.950 . 0 0 "[ . 1 . 2]" 1 1474 2 57 LEU H 2 57 LEU MD2 4.860 . 5.590 3.755 3.656 3.832 . 0 0 "[ . 1 . 2]" 1 1475 1 57 LEU MD2 1 62 PHE H 3.820 . 4.390 4.367 4.186 4.704 0.314 6 0 "[ . 1 . 2]" 1 1476 2 57 LEU MD2 2 62 PHE H 3.820 . 4.390 4.374 4.192 4.477 0.087 4 0 "[ . 1 . 2]" 1 1477 1 41 ILE H 1 57 LEU MD1 4.620 . 5.310 4.869 3.969 5.247 . 0 0 "[ . 1 . 2]" 1 1478 2 41 ILE H 2 57 LEU MD1 4.620 . 5.310 4.826 4.595 5.050 . 0 0 "[ . 1 . 2]" 1 1479 1 57 LEU MD2 1 65 LEU H 5.340 . 6.140 5.909 5.639 6.229 0.089 6 0 "[ . 1 . 2]" 1 1480 2 57 LEU MD2 2 65 LEU H 5.340 . 6.140 5.890 5.604 6.162 0.022 15 0 "[ . 1 . 2]" 1 1481 1 57 LEU MD1 1 62 PHE HD1 3.050 . 3.510 2.148 1.937 2.686 . 0 0 "[ . 1 . 2]" 1 1482 2 57 LEU MD1 2 62 PHE HD1 3.050 . 3.510 2.149 1.924 2.687 . 0 0 "[ . 1 . 2]" 1 1483 1 40 ASP HA 1 57 LEU MD1 4.400 . 5.060 4.841 4.096 5.110 0.050 13 0 "[ . 1 . 2]" 1 1484 2 40 ASP HA 2 57 LEU MD1 4.400 . 5.060 4.852 4.537 5.082 0.022 13 0 "[ . 1 . 2]" 1 1485 1 56 THR HA 1 57 LEU MD1 5.190 . 5.970 4.943 4.306 5.247 . 0 0 "[ . 1 . 2]" 1 1486 2 56 THR HA 2 57 LEU MD1 5.190 . 5.970 4.999 4.665 5.229 . 0 0 "[ . 1 . 2]" 1 1487 1 56 THR HA 1 57 LEU MD2 5.620 . 6.460 4.439 4.278 4.573 . 0 0 "[ . 1 . 2]" 1 1488 2 56 THR HA 2 57 LEU MD2 5.620 . 6.460 4.401 4.266 4.517 . 0 0 "[ . 1 . 2]" 1 1489 1 57 LEU HA 1 57 LEU MD2 3.090 . 3.550 2.183 2.146 2.235 . 0 0 "[ . 1 . 2]" 1 1490 2 57 LEU HA 2 57 LEU MD2 3.090 . 3.550 2.200 2.137 2.244 . 0 0 "[ . 1 . 2]" 1 1491 1 57 LEU MD1 1 62 PHE HA 3.710 . 4.270 2.933 2.715 4.096 . 0 0 "[ . 1 . 2]" 1 1492 2 57 LEU MD1 2 62 PHE HA 3.710 . 4.270 2.894 2.591 3.208 . 0 0 "[ . 1 . 2]" 1 1493 1 57 LEU MD2 1 62 PHE HA 4.010 . 4.610 4.266 4.094 4.597 . 0 0 "[ . 1 . 2]" 1 1494 2 57 LEU MD2 2 62 PHE HA 4.010 . 4.610 4.297 3.986 4.607 . 0 0 "[ . 1 . 2]" 1 1495 1 39 TYR HB2 1 57 LEU MD1 3.720 . 4.280 3.427 3.181 3.597 . 0 0 "[ . 1 . 2]" 1 1496 2 39 TYR HB2 2 57 LEU MD1 3.720 . 4.280 3.447 3.217 3.576 . 0 0 "[ . 1 . 2]" 1 1497 1 57 LEU MD2 1 61 GLU HB3 3.530 . 4.060 2.891 2.133 3.602 . 0 0 "[ . 1 . 2]" 1 1498 2 57 LEU MD2 2 61 GLU HB3 3.530 . 4.060 2.775 2.058 3.522 . 0 0 "[ . 1 . 2]" 1 1499 1 39 TYR HB3 1 57 LEU MD1 3.720 . 4.280 3.648 3.390 4.011 . 0 0 "[ . 1 . 2]" 1 1500 2 39 TYR HB3 2 57 LEU MD1 3.720 . 4.280 3.668 3.494 3.992 . 0 0 "[ . 1 . 2]" 1 1501 1 27 LEU QD 1 57 LEU MD1 2.710 . 3.120 3.082 2.835 3.213 0.093 2 0 "[ . 1 . 2]" 1 1502 2 27 LEU QD 2 57 LEU MD1 2.710 . 3.120 3.093 2.808 3.227 0.107 15 0 "[ . 1 . 2]" 1 1503 1 57 LEU MD1 1 65 LEU MD2 2.770 . 3.190 2.375 2.082 3.006 . 0 0 "[ . 1 . 2]" 1 1504 2 57 LEU MD1 2 65 LEU MD2 2.770 . 3.190 2.310 2.088 2.515 . 0 0 "[ . 1 . 2]" 1 1505 1 65 LEU MD1 1 69 LEU H 5.180 . 5.960 4.635 4.376 4.841 . 0 0 "[ . 1 . 2]" 1 1506 2 65 LEU MD1 2 69 LEU H 5.180 . 5.960 4.637 4.374 4.826 . 0 0 "[ . 1 . 2]" 1 1507 1 65 LEU MD1 1 66 LEU H 4.990 . 5.740 4.660 4.599 4.709 . 0 0 "[ . 1 . 2]" 1 1508 2 65 LEU MD1 2 66 LEU H 4.990 . 5.740 4.657 4.611 4.704 . 0 0 "[ . 1 . 2]" 1 1509 1 65 LEU H 1 65 LEU MD1 4.070 . 4.680 4.038 3.988 4.098 . 0 0 "[ . 1 . 2]" 1 1510 2 65 LEU H 2 65 LEU MD1 4.070 . 4.680 4.038 3.995 4.086 . 0 0 "[ . 1 . 2]" 1 1511 1 62 PHE HE1 2 65 LEU MD1 4.220 . 4.850 3.813 3.493 4.099 . 0 0 "[ . 1 . 2]" 1 1512 1 65 LEU MD1 2 62 PHE HE1 4.220 . 4.850 3.863 3.523 4.239 . 0 0 "[ . 1 . 2]" 1 1513 1 62 PHE HD1 1 65 LEU MD1 5.060 . 5.820 5.000 4.849 5.312 . 0 0 "[ . 1 . 2]" 1 1514 2 62 PHE HD1 2 65 LEU MD1 5.060 . 5.820 4.922 4.672 5.196 . 0 0 "[ . 1 . 2]" 1 1515 1 65 LEU MD1 1 69 LEU HA 5.740 . 6.600 5.371 5.202 5.654 . 0 0 "[ . 1 . 2]" 1 1516 2 65 LEU MD1 2 69 LEU HA 5.740 . 6.600 5.372 5.209 5.621 . 0 0 "[ . 1 . 2]" 1 1517 1 62 PHE HA 1 65 LEU MD1 4.680 . 5.380 4.422 4.342 4.622 . 0 0 "[ . 1 . 2]" 1 1518 2 62 PHE HA 2 65 LEU MD1 4.680 . 5.380 4.369 4.270 4.481 . 0 0 "[ . 1 . 2]" 1 1519 1 65 LEU HA 1 65 LEU MD1 3.040 . 3.500 2.194 2.170 2.237 . 0 0 "[ . 1 . 2]" 1 1520 2 65 LEU HA 2 65 LEU MD1 3.040 . 3.500 2.204 2.179 2.228 . 0 0 "[ . 1 . 2]" 1 1521 1 65 LEU MD1 1 68 GLU HB2 4.530 . 5.210 4.334 4.165 4.604 . 0 0 "[ . 1 . 2]" 1 1522 2 65 LEU MD1 2 68 GLU HB2 4.530 . 5.210 4.366 4.093 4.595 . 0 0 "[ . 1 . 2]" 1 1523 1 65 LEU HB3 1 65 LEU MD1 3.430 . 3.940 3.244 3.237 3.251 . 0 0 "[ . 1 . 2]" 1 1524 2 65 LEU HB3 2 65 LEU MD1 3.430 . 3.940 3.245 3.239 3.251 . 0 0 "[ . 1 . 2]" 1 1525 1 65 LEU MD1 1 69 LEU HG 3.810 . 4.380 2.999 2.817 3.216 . 0 0 "[ . 1 . 2]" 1 1526 2 65 LEU MD1 2 69 LEU HG 3.810 . 4.380 2.959 2.776 3.093 . 0 0 "[ . 1 . 2]" 1 1527 1 27 LEU QD 2 65 LEU MD1 3.010 . 3.460 1.940 1.788 2.121 0.012 19 0 "[ . 1 . 2]" 1 1528 1 65 LEU MD1 2 27 LEU QD 3.010 . 3.460 1.908 1.808 2.042 . 0 0 "[ . 1 . 2]" 1 1529 1 69 LEU H 1 69 LEU MD1 3.620 . 4.160 3.850 3.744 4.002 . 0 0 "[ . 1 . 2]" 1 1530 2 69 LEU H 2 69 LEU MD1 3.620 . 4.160 3.862 3.742 4.010 . 0 0 "[ . 1 . 2]" 1 1531 1 66 LEU H 1 66 LEU MD1 3.830 . 4.400 3.668 3.571 3.757 . 0 0 "[ . 1 . 2]" 1 1532 2 66 LEU H 2 66 LEU MD1 3.830 . 4.400 3.650 3.535 3.766 . 0 0 "[ . 1 . 2]" 1 1533 1 66 LEU H 1 69 LEU MD1 4.080 . 4.690 4.329 4.112 4.490 . 0 0 "[ . 1 . 2]" 1 1534 2 66 LEU H 2 69 LEU MD1 4.080 . 4.690 4.351 4.073 4.568 . 0 0 "[ . 1 . 2]" 1 1535 1 66 LEU MD1 1 67 LYS H 4.290 . 4.930 4.486 4.357 4.713 . 0 0 "[ . 1 . 2]" 1 1536 2 66 LEU MD1 2 67 LYS H 4.290 . 4.930 4.474 4.300 4.619 . 0 0 "[ . 1 . 2]" 1 1537 1 73 LEU HA 2 66 LEU MD1 4.590 . 5.280 4.278 3.518 5.110 . 0 0 "[ . 1 . 2]" 1 1538 1 66 LEU MD1 2 73 LEU HA 4.590 . 5.280 4.146 3.787 5.107 . 0 0 "[ . 1 . 2]" 1 1539 1 69 LEU HA 1 69 LEU MD1 3.930 . 4.520 3.899 3.855 3.925 . 0 0 "[ . 1 . 2]" 1 1540 2 69 LEU HA 2 69 LEU MD1 3.930 . 4.520 3.898 3.883 3.926 . 0 0 "[ . 1 . 2]" 1 1541 1 62 PHE HA 1 65 LEU MD2 3.670 . 4.220 3.114 2.934 3.278 . 0 0 "[ . 1 . 2]" 1 1542 2 62 PHE HA 2 65 LEU MD2 3.670 . 4.220 3.071 2.854 3.270 . 0 0 "[ . 1 . 2]" 1 1543 1 63 GLY HA2 1 66 LEU MD1 3.430 . 3.940 2.490 2.053 2.850 . 0 0 "[ . 1 . 2]" 1 1544 2 63 GLY HA2 2 66 LEU MD1 3.430 . 3.940 2.496 2.068 3.003 . 0 0 "[ . 1 . 2]" 1 1545 1 69 LEU HB3 1 69 LEU MD1 3.120 . 3.590 2.413 2.352 2.454 . 0 0 "[ . 1 . 2]" 1 1546 2 69 LEU HB3 2 69 LEU MD1 3.120 . 3.590 2.405 2.373 2.449 . 0 0 "[ . 1 . 2]" 1 1547 1 65 LEU HG 1 69 LEU MD1 2.910 . 3.350 2.057 1.992 2.106 . 0 0 "[ . 1 . 2]" 1 1548 2 65 LEU HG 2 69 LEU MD1 2.910 . 3.350 2.035 1.971 2.081 . 0 0 "[ . 1 . 2]" 1 1549 1 70 GLY H 2 73 LEU MD1 4.370 . 5.030 3.757 3.124 4.459 . 0 0 "[ . 1 . 2]" 1 1550 1 73 LEU MD1 2 70 GLY H 4.370 . 5.030 3.900 3.328 4.894 . 0 0 "[ . 1 . 2]" 1 1551 1 73 LEU HA 1 73 LEU MD1 3.870 . 4.450 3.884 3.831 3.941 . 0 0 "[ . 1 . 2]" 1 1552 2 73 LEU HA 2 73 LEU MD1 3.870 . 4.450 3.889 3.861 3.938 . 0 0 "[ . 1 . 2]" 1 1553 1 69 LEU HA 1 73 LEU MD1 4.930 . 5.670 5.029 4.261 5.682 0.012 19 0 "[ . 1 . 2]" 1 1554 2 69 LEU HA 2 73 LEU MD1 4.930 . 5.670 5.121 4.283 5.556 . 0 0 "[ . 1 . 2]" 1 1555 1 5 LEU MD2 1 6 LYS H 4.040 . 4.650 3.629 3.318 3.897 . 0 0 "[ . 1 . 2]" 1 1556 2 5 LEU MD2 2 6 LYS H 4.040 . 4.650 3.604 3.446 3.860 . 0 0 "[ . 1 . 2]" 1 1557 1 5 LEU MD2 1 33 ASN HD22 4.020 . 4.620 1.925 1.673 2.478 0.127 5 0 "[ . 1 . 2]" 1 1558 2 5 LEU MD2 2 33 ASN HD22 4.020 . 4.620 1.895 1.639 2.336 0.161 14 0 "[ . 1 . 2]" 1 1559 1 5 LEU HA 1 5 LEU MD2 2.950 . 3.390 2.131 2.056 2.198 . 0 0 "[ . 1 . 2]" 1 1560 2 5 LEU HA 2 5 LEU MD2 2.950 . 3.390 2.130 2.049 2.209 . 0 0 "[ . 1 . 2]" 1 1561 1 5 LEU MD2 1 33 ASN HB2 4.490 . 5.160 4.146 2.485 4.798 . 0 0 "[ . 1 . 2]" 1 1562 2 5 LEU MD2 2 33 ASN HB2 4.490 . 5.160 4.262 2.992 4.907 . 0 0 "[ . 1 . 2]" 1 1563 2 5 LEU HB3 2 5 LEU MD2 2.840 . 3.270 2.537 2.467 2.653 . 0 0 "[ . 1 . 2]" 1 1564 1 5 LEU MD2 1 6 LYS HG2 5.120 . 5.890 5.236 4.953 5.480 . 0 0 "[ . 1 . 2]" 1 1565 2 5 LEU MD2 2 6 LYS HG2 5.120 . 5.890 5.279 4.991 5.511 . 0 0 "[ . 1 . 2]" 1 1566 1 16 LEU MD2 1 27 LEU H 4.850 . 5.580 4.082 3.708 4.550 . 0 0 "[ . 1 . 2]" 1 1567 2 16 LEU MD2 2 27 LEU H 4.850 . 5.580 4.057 3.580 4.365 . 0 0 "[ . 1 . 2]" 1 1568 1 65 LEU H 2 16 LEU MD2 3.410 . 3.920 2.613 2.419 3.027 . 0 0 "[ . 1 . 2]" 1 1569 1 16 LEU MD2 2 65 LEU H 3.410 . 3.920 2.663 2.511 2.820 . 0 0 "[ . 1 . 2]" 1 1570 1 65 LEU HA 2 16 LEU MD2 3.740 . 4.300 2.511 2.343 2.882 . 0 0 "[ . 1 . 2]" 1 1571 1 16 LEU MD2 2 65 LEU HA 3.740 . 4.300 2.531 2.381 2.799 . 0 0 "[ . 1 . 2]" 1 1572 1 65 LEU HB2 2 16 LEU MD2 2.860 . 3.290 2.119 2.032 2.386 . 0 0 "[ . 1 . 2]" 1 1573 1 16 LEU MD2 2 65 LEU HB2 2.860 . 3.290 2.077 1.970 2.155 . 0 0 "[ . 1 . 2]" 1 1574 1 27 LEU QD 1 40 ASP H 3.560 . 4.090 3.050 2.786 3.325 . 0 0 "[ . 1 . 2]" 1 1575 2 27 LEU QD 2 40 ASP H 3.560 . 4.090 3.078 2.899 3.293 . 0 0 "[ . 1 . 2]" 1 1576 1 27 LEU QD 1 41 ILE H 3.800 . 4.370 3.973 3.833 4.145 . 0 0 "[ . 1 . 2]" 1 1577 2 27 LEU QD 2 41 ILE H 3.800 . 4.370 4.018 3.943 4.135 . 0 0 "[ . 1 . 2]" 1 1578 1 27 LEU QD 1 42 ARG H 5.200 . 5.980 4.712 4.509 4.890 . 0 0 "[ . 1 . 2]" 1 1579 2 27 LEU QD 2 42 ARG H 5.200 . 5.980 4.733 4.632 4.903 . 0 0 "[ . 1 . 2]" 1 1580 1 27 LEU QD 1 62 PHE HE1 3.650 . 4.140 2.017 1.784 2.262 0.016 1 0 "[ . 1 . 2]" 1 1581 2 27 LEU QD 2 62 PHE HE1 3.650 . 4.140 1.996 1.837 2.208 . 0 0 "[ . 1 . 2]" 1 1582 1 27 LEU QD 1 41 ILE HA 3.700 . 4.260 3.085 2.867 3.258 . 0 0 "[ . 1 . 2]" 1 1583 2 27 LEU QD 2 41 ILE HA 3.700 . 4.260 3.103 3.000 3.249 . 0 0 "[ . 1 . 2]" 1 1584 1 27 LEU QD 1 28 ASN HA 4.310 . 4.960 4.212 3.965 4.347 . 0 0 "[ . 1 . 2]" 1 1585 2 27 LEU QD 2 28 ASN HA 4.310 . 4.960 4.197 4.084 4.362 . 0 0 "[ . 1 . 2]" 1 1586 1 27 LEU QD 1 39 TYR HA 3.980 . 4.580 3.815 3.599 4.111 . 0 0 "[ . 1 . 2]" 1 1587 2 27 LEU QD 2 39 TYR HA 3.980 . 4.580 3.812 3.568 4.103 . 0 0 "[ . 1 . 2]" 1 1588 1 27 LEU QD 1 39 TYR HB2 3.980 . 4.580 3.704 3.419 4.008 . 0 0 "[ . 1 . 2]" 1 1589 2 27 LEU QD 2 39 TYR HB2 3.980 . 4.580 3.713 3.519 3.919 . 0 0 "[ . 1 . 2]" 1 1590 1 27 LEU QD 1 39 TYR HB3 3.980 . 4.580 2.425 2.155 2.704 . 0 0 "[ . 1 . 2]" 1 1591 2 27 LEU QD 2 39 TYR HB3 3.980 . 4.580 2.432 2.188 2.659 . 0 0 "[ . 1 . 2]" 1 1592 1 13 LEU HG 1 27 LEU QD 4.440 . 5.110 4.078 3.978 4.215 . 0 0 "[ . 1 . 2]" 1 1593 2 13 LEU HG 2 27 LEU QD 4.440 . 5.110 4.078 3.877 4.290 . 0 0 "[ . 1 . 2]" 1 1594 1 66 LEU H 1 66 LEU MD2 3.610 . 4.150 3.230 3.072 3.342 . 0 0 "[ . 1 . 2]" 1 1595 2 66 LEU H 2 66 LEU MD2 3.610 . 4.150 3.255 3.129 3.512 . 0 0 "[ . 1 . 2]" 1 1596 1 66 LEU MD2 1 67 LYS H 4.850 . 5.580 4.640 4.556 4.683 . 0 0 "[ . 1 . 2]" 1 1597 2 66 LEU MD2 2 67 LYS H 4.850 . 5.580 4.653 4.582 4.711 . 0 0 "[ . 1 . 2]" 1 1598 1 62 PHE HE2 1 66 LEU MD2 3.770 . 4.340 2.798 2.474 3.286 . 0 0 "[ . 1 . 2]" 1 1599 2 62 PHE HE2 2 66 LEU MD2 3.770 . 4.340 2.753 2.499 3.053 . 0 0 "[ . 1 . 2]" 1 1600 1 62 PHE HZ 1 66 LEU MD2 4.020 . 4.620 2.841 2.669 3.205 . 0 0 "[ . 1 . 2]" 1 1601 2 62 PHE HZ 2 66 LEU MD2 4.020 . 4.620 2.805 2.609 3.068 . 0 0 "[ . 1 . 2]" 1 1602 1 62 PHE HD2 1 66 LEU MD2 4.340 . 4.990 4.012 3.779 4.393 . 0 0 "[ . 1 . 2]" 1 1603 2 62 PHE HD2 2 66 LEU MD2 4.340 . 4.990 4.014 3.778 4.171 . 0 0 "[ . 1 . 2]" 1 1604 1 62 PHE HD1 1 66 LEU MD2 4.760 . 5.470 4.822 4.388 5.341 . 0 0 "[ . 1 . 2]" 1 1605 2 62 PHE HD1 2 66 LEU MD2 4.760 . 5.470 4.859 4.607 5.233 . 0 0 "[ . 1 . 2]" 1 1606 1 73 LEU HA 2 66 LEU MD2 5.080 . 5.840 4.854 4.332 5.471 . 0 0 "[ . 1 . 2]" 1 1607 1 66 LEU MD2 2 73 LEU HA 5.080 . 5.840 4.843 4.410 5.579 . 0 0 "[ . 1 . 2]" 1 1608 1 69 LEU HA 2 66 LEU MD2 4.030 . 4.630 3.628 3.232 4.015 . 0 0 "[ . 1 . 2]" 1 1609 1 66 LEU MD2 2 69 LEU HA 4.030 . 4.630 3.560 3.330 3.958 . 0 0 "[ . 1 . 2]" 1 1610 1 62 PHE HA 1 66 LEU MD2 5.020 . 5.770 5.076 4.842 5.283 . 0 0 "[ . 1 . 2]" 1 1611 2 62 PHE HA 2 66 LEU MD2 5.020 . 5.770 5.119 4.878 5.555 . 0 0 "[ . 1 . 2]" 1 1612 1 66 LEU HA 1 66 LEU MD2 3.020 . 3.470 2.043 2.003 2.091 . 0 0 "[ . 1 . 2]" 1 1613 2 66 LEU HA 2 66 LEU MD2 3.020 . 3.470 2.055 2.006 2.135 . 0 0 "[ . 1 . 2]" 1 1614 1 72 LYS HB2 2 66 LEU MD2 4.410 . 5.070 4.140 3.355 5.095 0.025 6 0 "[ . 1 . 2]" 1 1615 1 66 LEU MD2 2 72 LYS HB2 4.410 . 5.070 3.990 3.107 4.905 . 0 0 "[ . 1 . 2]" 1 1616 1 69 LEU HB3 2 66 LEU MD2 3.360 . 3.860 2.398 2.161 2.937 . 0 0 "[ . 1 . 2]" 1 1617 1 66 LEU MD2 2 69 LEU HB3 3.360 . 3.860 2.324 2.099 2.829 . 0 0 "[ . 1 . 2]" 1 1618 1 66 LEU HB3 1 66 LEU MD2 3.410 . 3.920 2.457 2.416 2.517 . 0 0 "[ . 1 . 2]" 1 1619 2 66 LEU HB3 2 66 LEU MD2 3.410 . 3.920 2.446 2.385 2.500 . 0 0 "[ . 1 . 2]" 1 1620 1 73 LEU MD1 2 66 LEU MD2 3.390 . 3.900 3.111 1.802 3.952 0.052 19 0 "[ . 1 . 2]" 1 1621 1 66 LEU MD2 2 73 LEU MD1 3.390 . 3.900 3.331 1.958 3.858 . 0 0 "[ . 1 . 2]" 1 1622 1 69 LEU H 1 69 LEU MD2 3.790 . 4.360 3.518 3.416 3.663 . 0 0 "[ . 1 . 2]" 1 1623 2 69 LEU H 2 69 LEU MD2 3.790 . 4.360 3.490 3.332 3.618 . 0 0 "[ . 1 . 2]" 1 1624 1 69 LEU MD2 1 70 GLY H 4.610 . 5.300 4.718 4.658 4.782 . 0 0 "[ . 1 . 2]" 1 1625 2 69 LEU MD2 2 70 GLY H 4.610 . 5.300 4.710 4.660 4.780 . 0 0 "[ . 1 . 2]" 1 1626 1 62 PHE HZ 2 69 LEU MD2 3.380 . 3.890 2.059 1.915 2.239 . 0 0 "[ . 1 . 2]" 1 1627 1 69 LEU MD2 2 62 PHE HZ 3.380 . 3.890 2.084 1.908 2.383 . 0 0 "[ . 1 . 2]" 1 1628 1 62 PHE HE1 2 69 LEU MD2 3.890 . 4.470 3.097 2.505 3.668 . 0 0 "[ . 1 . 2]" 1 1629 1 69 LEU MD2 2 62 PHE HE1 3.890 . 4.470 3.098 2.686 3.621 . 0 0 "[ . 1 . 2]" 1 1630 1 62 PHE HD1 2 69 LEU MD2 4.820 . 5.540 4.943 4.445 5.478 . 0 0 "[ . 1 . 2]" 1 1631 1 69 LEU MD2 2 62 PHE HD1 4.820 . 5.540 4.962 4.561 5.423 . 0 0 "[ . 1 . 2]" 1 1632 1 69 LEU HA 1 69 LEU MD2 2.910 . 3.350 2.015 1.973 2.064 . 0 0 "[ . 1 . 2]" 1 1633 2 69 LEU HA 2 69 LEU MD2 2.910 . 3.350 2.021 1.970 2.078 . 0 0 "[ . 1 . 2]" 1 1634 1 69 LEU MD2 1 70 GLY HA2 5.470 . 6.290 5.862 5.756 6.012 . 0 0 "[ . 1 . 2]" 1 1635 2 69 LEU MD2 2 70 GLY HA2 5.470 . 6.290 5.883 5.748 6.014 . 0 0 "[ . 1 . 2]" 1 1636 1 66 LEU HA 2 69 LEU MD2 3.820 . 4.390 4.523 4.441 4.649 0.259 6 0 "[ . 1 . 2]" 1 1637 1 69 LEU MD2 2 66 LEU HA 3.820 . 4.390 4.492 4.239 4.567 0.177 18 0 "[ . 1 . 2]" 1 1638 1 69 LEU HB3 1 69 LEU MD2 2.980 . 3.430 2.475 2.428 2.564 . 0 0 "[ . 1 . 2]" 1 1639 2 69 LEU HB3 2 69 LEU MD2 2.980 . 3.430 2.484 2.430 2.529 . 0 0 "[ . 1 . 2]" 1 1640 1 65 LEU HG 1 69 LEU MD2 3.000 . 3.450 3.622 3.373 3.728 0.278 7 0 "[ . 1 . 2]" 1 1641 2 65 LEU HG 2 69 LEU MD2 3.000 . 3.450 3.636 3.551 3.769 0.319 6 0 "[ . 1 . 2]" 1 1642 1 14 ILE MD 2 69 LEU MD2 2.760 . 3.170 2.039 1.913 2.146 . 0 0 "[ . 1 . 2]" 1 1643 1 69 LEU MD2 2 14 ILE MD 2.760 . 3.170 2.036 1.887 2.180 . 0 0 "[ . 1 . 2]" 1 1644 1 73 LEU H 1 73 LEU MD2 3.720 . 4.280 3.485 3.051 3.738 . 0 0 "[ . 1 . 2]" 1 1645 2 73 LEU H 2 73 LEU MD2 3.720 . 4.280 3.499 3.238 3.799 . 0 0 "[ . 1 . 2]" 1 1646 1 62 PHE HD2 2 73 LEU MD2 5.410 . 6.220 6.007 5.684 6.354 0.134 14 0 "[ . 1 . 2]" 1 1647 1 73 LEU MD2 2 62 PHE HD2 5.410 . 6.220 5.911 5.117 6.176 . 0 0 "[ . 1 . 2]" 1 1648 1 73 LEU HA 1 73 LEU MD2 2.790 . 3.210 1.995 1.936 2.127 . 0 0 "[ . 1 . 2]" 1 1649 2 73 LEU HA 2 73 LEU MD2 2.790 . 3.210 1.982 1.921 2.130 . 0 0 "[ . 1 . 2]" 1 1650 1 70 GLY HA2 1 73 LEU MD2 4.930 . 5.670 4.471 3.816 5.159 . 0 0 "[ . 1 . 2]" 1 1651 2 70 GLY HA2 2 73 LEU MD2 4.930 . 5.670 4.426 4.071 5.140 . 0 0 "[ . 1 . 2]" 1 1652 1 66 LEU HA 2 73 LEU MD2 4.430 . 5.090 3.576 3.145 4.005 . 0 0 "[ . 1 . 2]" 1 1653 1 73 LEU MD2 2 66 LEU HA 4.430 . 5.090 3.729 2.838 4.720 . 0 0 "[ . 1 . 2]" 1 1654 1 66 LEU MD1 2 73 LEU MD2 2.960 . 3.400 2.187 1.917 2.476 . 0 0 "[ . 1 . 2]" 1 1655 1 73 LEU MD2 2 66 LEU MD1 2.960 . 3.400 2.098 1.794 2.401 0.006 2 0 "[ . 1 . 2]" 1 1656 1 66 LEU MD2 2 73 LEU MD2 3.240 . 3.730 2.440 2.010 2.759 . 0 0 "[ . 1 . 2]" 1 1657 1 73 LEU MD2 2 66 LEU MD2 3.240 . 3.730 2.315 2.015 2.702 . 0 0 "[ . 1 . 2]" 1 1658 1 72 LYS H 1 72 LYS HD2 4.380 . 5.040 4.335 4.001 4.532 . 0 0 "[ . 1 . 2]" 1 1659 2 72 LYS H 2 72 LYS HD2 4.380 . 5.040 4.337 3.867 4.684 . 0 0 "[ . 1 . 2]" 1 1660 1 72 LYS H 1 72 LYS HD3 4.380 . 5.040 4.328 3.812 4.904 . 0 0 "[ . 1 . 2]" 1 1661 2 72 LYS H 2 72 LYS HD3 4.380 . 5.040 4.343 3.682 4.859 . 0 0 "[ . 1 . 2]" 1 1662 1 21 LYS H 1 21 LYS HD2 4.230 . 4.860 4.164 3.072 4.927 0.067 13 0 "[ . 1 . 2]" 1 1663 2 21 LYS H 2 21 LYS HD2 4.230 . 4.860 4.164 3.414 4.848 . 0 0 "[ . 1 . 2]" 1 1664 1 24 ARG HA 1 24 ARG HD2 5.280 . 6.070 4.614 4.229 4.795 . 0 0 "[ . 1 . 2]" 1 1665 2 24 ARG HA 2 24 ARG HD2 5.280 . 6.070 4.541 4.282 4.711 . 0 0 "[ . 1 . 2]" 1 1666 1 24 ARG HA 1 24 ARG HD3 5.280 . 6.070 4.586 4.370 5.068 . 0 0 "[ . 1 . 2]" 1 1667 2 24 ARG HA 2 24 ARG HD3 5.280 . 6.070 4.630 4.409 4.979 . 0 0 "[ . 1 . 2]" 1 1668 1 29 ARG HD3 1 39 TYR QE 4.250 . 4.890 4.016 2.945 4.354 . 0 0 "[ . 1 . 2]" 1 1669 2 29 ARG HD3 2 39 TYR QE 4.250 . 4.890 4.092 2.735 4.457 . 0 0 "[ . 1 . 2]" 1 1670 1 13 LEU QD 1 29 ARG HD3 4.140 . 4.760 2.820 2.414 3.325 . 0 0 "[ . 1 . 2]" 1 1671 2 13 LEU QD 2 29 ARG HD3 4.140 . 4.760 2.745 2.214 3.189 . 0 0 "[ . 1 . 2]" 1 1672 1 45 SER H 1 46 PRO HD2 4.640 . 5.340 4.900 4.765 5.249 . 0 0 "[ . 1 . 2]" 1 1673 2 45 SER H 2 46 PRO HD2 4.640 . 5.340 4.869 4.785 5.078 . 0 0 "[ . 1 . 2]" 1 1674 1 67 LYS H 1 67 LYS HD3 3.580 . 4.120 3.642 3.448 3.893 . 0 0 "[ . 1 . 2]" 1 1675 2 67 LYS H 2 67 LYS HD3 3.580 . 4.120 3.642 3.371 4.135 0.015 15 0 "[ . 1 . 2]" 1 1676 1 63 GLY HA3 1 67 LYS HD3 3.890 . 4.470 4.205 3.865 4.550 0.080 9 0 "[ . 1 . 2]" 1 1677 2 63 GLY HA3 2 67 LYS HD3 3.890 . 4.470 4.176 3.861 4.533 0.063 15 0 "[ . 1 . 2]" 1 1678 1 64 VAL HB 1 67 LYS HD3 5.200 . 5.980 4.998 4.812 5.234 . 0 0 "[ . 1 . 2]" 1 1679 2 64 VAL HB 2 67 LYS HD3 5.200 . 5.980 5.022 4.659 6.072 0.092 15 0 "[ . 1 . 2]" 1 1680 1 67 LYS HB2 1 67 LYS HD3 3.160 . 3.630 2.589 2.499 2.707 . 0 0 "[ . 1 . 2]" 1 1681 2 67 LYS HB2 2 67 LYS HD3 3.160 . 3.630 2.651 2.522 3.614 . 0 0 "[ . 1 . 2]" 1 1682 1 67 LYS HD3 1 68 GLU H 4.560 . 5.240 4.790 4.586 4.895 . 0 0 "[ . 1 . 2]" 1 1683 2 67 LYS HD3 2 68 GLU H 4.560 . 5.240 4.811 4.579 5.449 0.209 15 0 "[ . 1 . 2]" 1 1684 1 21 LYS H 1 21 LYS HD3 4.230 . 4.860 3.888 3.052 4.832 . 0 0 "[ . 1 . 2]" 1 1685 2 21 LYS H 2 21 LYS HD3 4.230 . 4.860 3.921 3.059 4.896 0.036 3 0 "[ . 1 . 2]" 1 1686 1 29 ARG HD2 1 39 TYR QD 4.370 . 5.030 3.805 3.362 4.910 . 0 0 "[ . 1 . 2]" 1 1687 2 29 ARG HD2 2 39 TYR QD 4.370 . 5.030 3.746 3.263 4.932 . 0 0 "[ . 1 . 2]" 1 1688 1 29 ARG HD2 1 39 TYR QE 4.160 . 4.780 2.752 2.399 4.238 . 0 0 "[ . 1 . 2]" 1 1689 2 29 ARG HD2 2 39 TYR QE 4.160 . 4.780 2.681 2.357 4.107 . 0 0 "[ . 1 . 2]" 1 1690 1 11 GLU HB3 1 29 ARG HD2 4.400 . 5.060 4.334 3.613 5.305 0.245 18 0 "[ . 1 . 2]" 1 1691 2 11 GLU HB3 2 29 ARG HD2 4.400 . 5.060 4.255 3.800 5.322 0.262 7 0 "[ . 1 . 2]" 1 1692 1 11 GLU HB2 1 29 ARG HD2 5.100 . 5.870 5.451 4.799 6.207 0.337 2 0 "[ . 1 . 2]" 1 1693 2 11 GLU HB2 2 29 ARG HD2 5.100 . 5.870 5.357 4.743 6.044 0.174 7 0 "[ . 1 . 2]" 1 1694 1 29 ARG HB2 1 29 ARG HD2 3.980 . 4.580 3.751 3.641 3.822 . 0 0 "[ . 1 . 2]" 1 1695 2 29 ARG HB2 2 29 ARG HD2 3.980 . 4.580 3.753 3.661 3.820 . 0 0 "[ . 1 . 2]" 1 1696 1 36 GLU H 1 37 PRO HD2 4.720 . 5.430 4.919 4.631 5.408 . 0 0 "[ . 1 . 2]" 1 1697 2 36 GLU H 2 37 PRO HD2 4.720 . 5.430 5.018 4.647 5.332 . 0 0 "[ . 1 . 2]" 1 1698 1 23 TRP HD1 1 46 PRO HD3 4.530 . 5.210 3.970 3.130 4.892 . 0 0 "[ . 1 . 2]" 1 1699 2 23 TRP HD1 2 46 PRO HD3 4.530 . 5.210 3.915 3.195 4.859 . 0 0 "[ . 1 . 2]" 1 1700 1 23 TRP HA 1 46 PRO HD3 4.460 . 5.130 2.795 2.184 3.438 . 0 0 "[ . 1 . 2]" 1 1701 2 23 TRP HA 2 46 PRO HD3 4.460 . 5.130 2.774 2.278 3.411 . 0 0 "[ . 1 . 2]" 1 1702 1 50 LYS HD2 1 51 MET H 5.220 . 6.000 5.661 5.333 5.910 . 0 0 "[ . 1 . 2]" 1 1703 2 50 LYS HD2 2 51 MET H 5.220 . 6.000 5.638 5.225 5.935 . 0 0 "[ . 1 . 2]" 1 1704 1 23 TRP HH2 1 50 LYS HD2 4.540 . 5.220 4.999 4.447 5.325 0.105 8 0 "[ . 1 . 2]" 1 1705 2 23 TRP HH2 2 50 LYS HD2 4.540 . 5.220 5.098 4.557 5.314 0.094 19 0 "[ . 1 . 2]" 1 1706 1 50 LYS HB3 1 50 LYS HD2 3.720 . 4.280 3.652 3.612 3.717 . 0 0 "[ . 1 . 2]" 1 1707 2 50 LYS HB3 2 50 LYS HD2 3.720 . 4.280 3.636 3.609 3.719 . 0 0 "[ . 1 . 2]" 1 1708 1 38 LYS H 1 38 LYS HE2 5.490 . 6.310 5.004 4.395 6.038 . 0 0 "[ . 1 . 2]" 1 1709 2 38 LYS H 2 38 LYS HE2 5.490 . 6.310 5.057 4.409 6.241 . 0 0 "[ . 1 . 2]" 1 1710 1 38 LYS H 1 38 LYS HE3 5.490 . 6.310 4.987 4.198 6.277 . 0 0 "[ . 1 . 2]" 1 1711 2 38 LYS H 2 38 LYS HE3 5.490 . 6.310 4.900 4.336 5.304 . 0 0 "[ . 1 . 2]" 1 1712 1 72 LYS H 1 72 LYS HE2 6.000 . 6.900 5.547 4.307 6.159 . 0 0 "[ . 1 . 2]" 1 1713 2 72 LYS H 2 72 LYS HE2 6.000 . 6.900 5.428 4.295 6.177 . 0 0 "[ . 1 . 2]" 1 1714 1 72 LYS H 1 72 LYS HE3 6.000 . 6.900 5.600 5.058 6.225 . 0 0 "[ . 1 . 2]" 1 1715 2 72 LYS H 2 72 LYS HE3 6.000 . 6.900 5.461 5.076 6.024 . 0 0 "[ . 1 . 2]" 1 1716 1 13 LEU HA 2 72 LYS HE2 5.240 . 6.030 3.801 2.651 4.883 . 0 0 "[ . 1 . 2]" 1 1717 1 72 LYS HE2 2 13 LEU HA 5.240 . 6.030 3.836 2.632 5.239 . 0 0 "[ . 1 . 2]" 1 1718 1 13 LEU HA 2 72 LYS HE3 5.240 . 6.030 4.292 2.763 6.228 0.198 15 0 "[ . 1 . 2]" 1 1719 1 72 LYS HE3 2 13 LEU HA 5.240 . 6.030 4.433 3.087 5.781 . 0 0 "[ . 1 . 2]" 1 1720 1 6 LYS H 1 6 LYS HE2 6.000 . 6.900 5.632 4.820 6.140 . 0 0 "[ . 1 . 2]" 1 1721 2 6 LYS H 2 6 LYS HE2 6.000 . 6.900 5.733 4.762 6.252 . 0 0 "[ . 1 . 2]" 1 1722 1 6 LYS H 1 6 LYS HE3 6.000 . 6.900 5.539 4.621 6.321 . 0 0 "[ . 1 . 2]" 1 1723 2 6 LYS H 2 6 LYS HE3 6.000 . 6.900 5.623 5.013 6.452 . 0 0 "[ . 1 . 2]" 1 1724 1 6 LYS HE2 1 7 PHE H 4.730 . 5.440 4.513 2.913 5.470 0.030 2 0 "[ . 1 . 2]" 1 1725 2 6 LYS HE2 2 7 PHE H 4.730 . 5.440 4.462 3.148 5.481 0.041 8 0 "[ . 1 . 2]" 1 1726 1 6 LYS HE3 1 7 PHE H 4.730 . 5.440 4.083 3.233 5.261 . 0 0 "[ . 1 . 2]" 1 1727 2 6 LYS HE3 2 7 PHE H 4.730 . 5.440 4.021 3.119 5.039 . 0 0 "[ . 1 . 2]" 1 1728 1 6 LYS HB3 1 6 LYS HE2 3.840 . 4.420 2.750 2.173 3.196 . 0 0 "[ . 1 . 2]" 1 1729 2 6 LYS HB3 2 6 LYS HE2 3.840 . 4.420 2.768 2.129 3.274 . 0 0 "[ . 1 . 2]" 1 1730 1 6 LYS HB3 1 6 LYS HE3 3.840 . 4.420 2.796 2.052 3.852 . 0 0 "[ . 1 . 2]" 1 1731 2 6 LYS HB3 2 6 LYS HE3 3.840 . 4.420 2.747 2.000 3.802 . 0 0 "[ . 1 . 2]" 1 1732 1 21 LYS HA 1 21 LYS HE2 5.380 . 6.190 4.050 2.116 4.902 . 0 0 "[ . 1 . 2]" 1 1733 2 21 LYS HA 2 21 LYS HE2 5.380 . 6.190 4.356 1.797 5.015 0.003 3 0 "[ . 1 . 2]" 1 1734 1 21 LYS HA 1 21 LYS HE3 5.380 . 6.190 4.325 2.625 5.095 . 0 0 "[ . 1 . 2]" 1 1735 2 21 LYS HA 2 21 LYS HE3 5.380 . 6.190 4.009 2.735 5.104 . 0 0 "[ . 1 . 2]" 1 1736 1 21 LYS HB3 1 21 LYS HE2 5.280 . 6.070 3.905 2.175 4.865 . 0 0 "[ . 1 . 2]" 1 1737 2 21 LYS HB3 2 21 LYS HE2 5.280 . 6.070 4.050 3.032 4.959 . 0 0 "[ . 1 . 2]" 1 1738 1 21 LYS HB3 1 21 LYS HE3 5.280 . 6.070 4.043 1.988 4.870 . 0 0 "[ . 1 . 2]" 1 1739 2 21 LYS HB3 2 21 LYS HE3 5.280 . 6.070 3.605 2.039 4.927 . 0 0 "[ . 1 . 2]" 1 1740 1 50 LYS HE2 1 51 MET H 4.680 . 5.380 3.710 2.829 5.007 . 0 0 "[ . 1 . 2]" 1 1741 2 50 LYS HE2 2 51 MET H 4.680 . 5.380 3.305 2.778 4.798 . 0 0 "[ . 1 . 2]" 1 1742 1 50 LYS HE3 1 51 MET H 5.140 . 5.910 4.221 2.969 5.096 . 0 0 "[ . 1 . 2]" 1 1743 2 50 LYS HE3 2 51 MET H 5.140 . 5.910 4.534 3.083 5.058 . 0 0 "[ . 1 . 2]" 1 1744 1 50 LYS H 1 50 LYS HE2 5.890 . 6.770 5.361 4.467 6.322 . 0 0 "[ . 1 . 2]" 1 1745 2 50 LYS H 2 50 LYS HE2 5.890 . 6.770 4.891 4.404 6.203 . 0 0 "[ . 1 . 2]" 1 1746 1 50 LYS H 1 50 LYS HE3 6.000 . 6.900 5.168 4.448 6.302 . 0 0 "[ . 1 . 2]" 1 1747 2 50 LYS H 2 50 LYS HE3 6.000 . 6.900 5.031 4.608 6.305 . 0 0 "[ . 1 . 2]" 1 1748 1 23 TRP HZ2 1 50 LYS HE2 4.540 . 5.220 4.831 3.035 5.374 0.154 3 0 "[ . 1 . 2]" 1 1749 2 23 TRP HZ2 2 50 LYS HE2 4.540 . 5.220 5.144 4.005 5.376 0.156 11 0 "[ . 1 . 2]" 1 1750 1 23 TRP HH2 1 50 LYS HE2 4.210 . 4.840 4.163 2.708 5.028 0.188 3 0 "[ . 1 . 2]" 1 1751 2 23 TRP HH2 2 50 LYS HE2 4.210 . 4.840 4.343 2.792 4.939 0.099 20 0 "[ . 1 . 2]" 1 1752 1 50 LYS HB3 1 50 LYS HE2 4.320 . 4.970 2.974 1.960 4.347 . 0 0 "[ . 1 . 2]" 1 1753 2 50 LYS HB3 2 50 LYS HE2 4.320 . 4.970 2.916 2.043 4.122 . 0 0 "[ . 1 . 2]" 1 1754 1 50 LYS HB3 1 50 LYS HE3 4.700 . 5.400 3.414 2.447 4.108 . 0 0 "[ . 1 . 2]" 1 1755 2 50 LYS HB3 2 50 LYS HE3 4.700 . 5.400 3.803 2.672 4.201 . 0 0 "[ . 1 . 2]" 1 1756 1 50 LYS HD3 1 50 LYS HE2 2.880 . 3.310 2.468 2.409 2.516 . 0 0 "[ . 1 . 2]" 1 1757 2 50 LYS HD3 2 50 LYS HE2 2.880 . 3.310 2.472 2.429 2.529 . 0 0 "[ . 1 . 2]" 1 1758 1 50 LYS HE3 1 50 LYS HG2 2.870 . 3.300 2.712 2.458 3.223 . 0 0 "[ . 1 . 2]" 1 1759 2 50 LYS HE3 2 50 LYS HG2 2.870 . 3.300 2.608 2.474 3.090 . 0 0 "[ . 1 . 2]" 1 1760 1 67 LYS HE2 1 68 GLU H 5.470 . 6.290 5.329 4.178 6.355 0.065 11 0 "[ . 1 . 2]" 1 1761 2 67 LYS HE2 2 68 GLU H 5.120 . 5.890 5.076 4.161 5.968 0.078 1 0 "[ . 1 . 2]" 1 1762 1 67 LYS HE3 1 68 GLU H 5.470 . 6.290 5.098 4.075 6.300 0.010 15 0 "[ . 1 . 2]" 1 1763 2 67 LYS HE3 2 68 GLU H 5.470 . 6.290 5.018 3.664 5.827 . 0 0 "[ . 1 . 2]" 1 1764 2 64 VAL HB 2 67 LYS HE2 5.090 . 5.850 5.868 5.330 6.022 0.172 17 0 "[ . 1 . 2]" 1 1765 2 67 LYS HB3 2 67 LYS HE3 3.670 . 4.220 2.669 2.289 3.484 . 0 0 "[ . 1 . 2]" 1 1766 1 67 LYS HB2 1 67 LYS HE2 3.580 . 4.120 3.241 2.341 4.026 . 0 0 "[ . 1 . 2]" 1 1767 2 67 LYS HB2 2 67 LYS HE2 3.580 . 4.120 3.063 2.317 3.867 . 0 0 "[ . 1 . 2]" 1 1768 1 67 LYS HB2 1 67 LYS HE3 3.580 . 4.120 3.047 2.188 4.075 . 0 0 "[ . 1 . 2]" 1 1769 2 67 LYS HB2 2 67 LYS HE3 3.510 . 4.040 3.019 2.206 3.651 . 0 0 "[ . 1 . 2]" 1 1770 2 67 LYS HD3 2 67 LYS HE2 2.650 . 3.050 2.439 2.321 2.487 . 0 0 "[ . 1 . 2]" 1 1771 2 64 VAL MG2 2 67 LYS HE2 3.910 . 4.500 3.633 3.002 4.128 . 0 0 "[ . 1 . 2]" 1 1772 2 64 VAL MG1 2 67 LYS HE2 3.740 . 4.300 3.822 3.474 4.114 . 0 0 "[ . 1 . 2]" 1 1773 1 41 ILE HG13 2 55 ILE MD 3.790 . 4.360 3.710 3.278 3.990 . 0 0 "[ . 1 . 2]" 1 1774 1 55 ILE MD 2 41 ILE HG13 3.790 . 4.360 3.707 2.945 3.951 . 0 0 "[ . 1 . 2]" 1 1775 1 69 LEU HG 2 14 ILE MD 3.240 . 3.730 2.299 2.077 2.619 . 0 0 "[ . 1 . 2]" 1 1776 1 14 ILE MD 2 69 LEU HG 3.240 . 3.730 2.318 2.122 2.646 . 0 0 "[ . 1 . 2]" 1 1777 1 69 LEU MD1 2 14 ILE MD 3.630 . 4.170 3.329 3.169 3.562 . 0 0 "[ . 1 . 2]" 1 1778 1 14 ILE MD 2 69 LEU MD1 3.630 . 4.170 3.335 3.220 3.549 . 0 0 "[ . 1 . 2]" 1 1779 1 29 ARG HB3 1 37 PRO HB3 4.410 . 5.070 4.585 3.449 5.178 0.108 18 0 "[ . 1 . 2]" 1 1780 2 29 ARG HB3 2 37 PRO HB3 4.410 . 5.070 4.488 3.469 5.117 0.047 3 0 "[ . 1 . 2]" 1 1781 1 38 LYS HA 1 38 LYS HG2 3.940 . 4.530 3.819 3.751 3.902 . 0 0 "[ . 1 . 2]" 1 1782 2 38 LYS HA 2 38 LYS HG2 3.940 . 4.530 3.821 3.744 3.876 . 0 0 "[ . 1 . 2]" 1 1783 1 8 GLU HB3 1 8 GLU HG2 2.810 . 3.230 2.469 2.381 2.531 . 0 0 "[ . 1 . 2]" 1 1784 2 8 GLU HB3 2 8 GLU HG2 2.810 . 3.230 2.480 2.445 2.520 . 0 0 "[ . 1 . 2]" 1 1785 1 14 ILE MD 1 27 LEU QD 2.900 . 3.340 2.055 1.902 2.212 . 0 0 "[ . 1 . 2]" 1 1786 2 14 ILE MD 2 27 LEU QD 2.900 . 3.340 2.064 1.854 2.395 . 0 0 "[ . 1 . 2]" 1 1787 1 39 TYR QE 1 62 PHE H 4.880 . 5.610 5.071 4.745 5.518 . 0 0 "[ . 1 . 2]" 1 1788 2 39 TYR QE 2 62 PHE H 4.880 . 5.610 5.171 4.856 5.407 . 0 0 "[ . 1 . 2]" 1 1789 1 39 TYR H 1 39 TYR QE 4.630 . 5.320 4.110 3.981 4.240 . 0 0 "[ . 1 . 2]" 1 1790 2 39 TYR H 2 39 TYR QE 4.630 . 5.320 4.156 4.034 4.322 . 0 0 "[ . 1 . 2]" 1 1791 1 39 TYR QD 1 40 ASP H 4.460 . 5.130 4.204 4.074 4.352 . 0 0 "[ . 1 . 2]" 1 1792 2 39 TYR QD 2 40 ASP H 4.460 . 5.130 4.212 4.052 4.353 . 0 0 "[ . 1 . 2]" 1 1793 1 39 TYR H 1 39 TYR QD 3.550 . 4.080 2.218 2.101 2.339 . 0 0 "[ . 1 . 2]" 1 1794 2 39 TYR H 2 39 TYR QD 3.550 . 4.080 2.246 2.109 2.394 . 0 0 "[ . 1 . 2]" 1 1795 1 39 TYR QD 1 63 GLY H 5.080 . 5.840 5.376 5.118 5.775 . 0 0 "[ . 1 . 2]" 1 1796 2 39 TYR QD 2 63 GLY H 5.080 . 5.840 5.293 5.066 5.677 . 0 0 "[ . 1 . 2]" 1 1797 1 9 ILE MD 1 48 HIS HE1 4.120 . 4.740 3.842 3.045 4.922 0.182 2 0 "[ . 1 . 2]" 1 1798 2 9 ILE MD 2 48 HIS HE1 4.120 . 4.740 3.958 3.137 4.726 . 0 0 "[ . 1 . 2]" 1 1799 1 9 ILE MD 1 44 TRP HE3 3.910 . 4.500 3.982 3.111 4.526 0.026 6 0 "[ . 1 . 2]" 1 1800 2 9 ILE MD 2 44 TRP HE3 3.910 . 4.500 3.970 3.252 4.469 . 0 0 "[ . 1 . 2]" 1 1801 1 44 TRP HA 1 44 TRP HE3 4.000 . 4.600 3.215 2.914 3.496 . 0 0 "[ . 1 . 2]" 1 1802 2 44 TRP HA 2 44 TRP HE3 4.000 . 4.600 3.192 2.974 3.394 . 0 0 "[ . 1 . 2]" 1 1803 1 32 TRP H 1 32 TRP HD1 3.840 . 4.420 3.088 2.808 3.340 . 0 0 "[ . 1 . 2]" 1 1804 2 32 TRP H 2 32 TRP HD1 3.840 . 4.420 3.071 2.876 3.285 . 0 0 "[ . 1 . 2]" 1 1805 1 30 VAL MG1 1 32 TRP HD1 4.530 . 5.210 3.665 3.143 4.055 . 0 0 "[ . 1 . 2]" 1 1806 2 30 VAL MG1 2 32 TRP HD1 4.530 . 5.210 3.625 3.277 4.120 . 0 0 "[ . 1 . 2]" 1 1807 1 32 TRP HD1 1 56 THR MG 3.790 . 4.360 3.132 2.142 4.026 . 0 0 "[ . 1 . 2]" 1 1808 2 32 TRP HD1 2 56 THR MG 3.790 . 4.360 3.138 2.427 4.229 . 0 0 "[ . 1 . 2]" 1 1809 1 32 TRP HD1 1 38 LYS HD2 4.130 . 4.750 2.873 2.182 3.910 . 0 0 "[ . 1 . 2]" 1 1810 2 32 TRP HD1 2 38 LYS HD2 4.130 . 4.750 2.986 2.115 3.842 . 0 0 "[ . 1 . 2]" 1 1811 1 32 TRP HB2 1 32 TRP HD1 3.720 . 4.280 2.688 2.639 2.746 . 0 0 "[ . 1 . 2]" 1 1812 2 32 TRP HB2 2 32 TRP HD1 3.720 . 4.280 2.696 2.659 2.738 . 0 0 "[ . 1 . 2]" 1 1813 1 26 GLU H 1 44 TRP HD1 4.010 . 4.610 3.495 3.115 3.864 . 0 0 "[ . 1 . 2]" 1 1814 2 26 GLU H 2 44 TRP HD1 4.010 . 4.610 3.543 3.156 3.874 . 0 0 "[ . 1 . 2]" 1 1815 1 42 ARG H 1 44 TRP HD1 5.580 . 6.420 4.210 3.738 4.937 . 0 0 "[ . 1 . 2]" 1 1816 2 42 ARG H 2 44 TRP HD1 5.580 . 6.420 4.132 3.716 4.646 . 0 0 "[ . 1 . 2]" 1 1817 1 48 HIS H 1 48 HIS HD2 4.120 . 4.740 3.700 2.733 4.709 . 0 0 "[ . 1 . 2]" 1 1818 2 48 HIS H 2 48 HIS HD2 4.120 . 4.740 3.682 2.949 4.777 0.037 13 0 "[ . 1 . 2]" 1 1819 1 44 TRP HE3 1 48 HIS HD2 4.460 . 5.130 3.863 3.095 4.745 . 0 0 "[ . 1 . 2]" 1 1820 2 44 TRP HE3 2 48 HIS HD2 4.460 . 5.130 3.994 3.220 4.586 . 0 0 "[ . 1 . 2]" 1 1821 1 32 TRP HA 1 32 TRP HD1 4.320 . 4.970 4.269 4.098 4.387 . 0 0 "[ . 1 . 2]" 1 1822 2 32 TRP HA 2 32 TRP HD1 4.320 . 4.970 4.247 4.173 4.354 . 0 0 "[ . 1 . 2]" 1 1823 1 23 TRP HZ2 1 50 LYS HG3 3.840 . 4.420 3.620 2.867 4.474 0.054 11 0 "[ . 1 . 2]" 1 1824 2 23 TRP HZ2 2 50 LYS HG3 3.840 . 4.420 3.474 3.025 4.437 0.017 8 0 "[ . 1 . 2]" 1 1825 1 23 TRP HZ2 1 50 LYS HB3 4.000 . 4.600 3.163 2.801 4.075 . 0 0 "[ . 1 . 2]" 1 1826 2 23 TRP HZ2 2 50 LYS HB3 4.000 . 4.600 3.003 2.550 4.055 . 0 0 "[ . 1 . 2]" 1 1827 1 23 TRP HZ2 1 50 LYS HD3 4.040 . 4.650 2.919 2.206 3.407 . 0 0 "[ . 1 . 2]" 1 1828 2 23 TRP HZ2 2 50 LYS HD3 4.040 . 4.650 3.196 2.436 3.532 . 0 0 "[ . 1 . 2]" 1 1829 1 23 TRP HZ2 1 50 LYS HD2 3.880 . 4.460 4.275 3.594 4.566 0.106 5 0 "[ . 1 . 2]" 1 1830 2 23 TRP HZ2 2 50 LYS HD2 3.880 . 4.460 4.443 4.087 4.559 0.099 13 0 "[ . 1 . 2]" 1 1831 1 62 PHE H 1 62 PHE HD1 4.280 . 4.920 4.592 4.411 4.694 . 0 0 "[ . 1 . 2]" 1 1832 2 62 PHE H 2 62 PHE HD1 4.280 . 4.920 4.606 4.471 4.698 . 0 0 "[ . 1 . 2]" 1 1833 1 62 PHE HA 1 62 PHE HD1 3.540 . 4.070 2.736 2.547 2.891 . 0 0 "[ . 1 . 2]" 1 1834 2 62 PHE HA 2 62 PHE HD1 3.540 . 4.070 2.755 2.645 2.855 . 0 0 "[ . 1 . 2]" 1 1835 1 62 PHE HD1 1 65 LEU HB3 5.000 . 5.750 3.887 3.621 4.147 . 0 0 "[ . 1 . 2]" 1 1836 2 62 PHE HD1 2 65 LEU HB3 5.000 . 5.750 3.850 3.599 4.054 . 0 0 "[ . 1 . 2]" 1 1837 1 62 PHE HD2 1 66 LEU HG 4.470 . 5.140 3.546 3.251 3.944 . 0 0 "[ . 1 . 2]" 1 1838 2 62 PHE HD2 2 66 LEU HG 4.470 . 5.140 3.529 3.372 3.674 . 0 0 "[ . 1 . 2]" 1 1839 1 62 PHE HD1 1 66 LEU HG 4.890 . 5.620 5.019 4.604 5.327 . 0 0 "[ . 1 . 2]" 1 1840 2 62 PHE HD1 2 66 LEU HG 4.890 . 5.620 5.032 4.863 5.204 . 0 0 "[ . 1 . 2]" 1 1841 1 62 PHE HD1 1 65 LEU MD2 3.770 . 4.340 2.676 2.514 2.966 . 0 0 "[ . 1 . 2]" 1 1842 2 62 PHE HD1 2 65 LEU MD2 3.770 . 4.340 2.596 2.445 2.777 . 0 0 "[ . 1 . 2]" 1 1843 1 62 PHE HD2 1 66 LEU MD1 3.950 . 4.540 2.759 2.486 3.024 . 0 0 "[ . 1 . 2]" 1 1844 2 62 PHE HD2 2 66 LEU MD1 3.950 . 4.540 2.758 2.478 2.914 . 0 0 "[ . 1 . 2]" 1 1845 1 65 LEU HG 2 62 PHE HE1 5.210 . 5.990 5.401 5.150 5.726 . 0 0 "[ . 1 . 2]" 1 1846 1 62 PHE HE1 2 65 LEU HG 5.210 . 5.990 5.428 5.215 5.652 . 0 0 "[ . 1 . 2]" 1 1847 1 57 LEU MD1 1 62 PHE HE1 3.490 . 4.010 3.552 3.202 4.078 0.068 13 0 "[ . 1 . 2]" 1 1848 2 57 LEU MD1 2 62 PHE HE1 3.490 . 4.010 3.591 3.267 4.048 0.038 13 0 "[ . 1 . 2]" 1 1849 1 62 PHE HE1 1 65 LEU MD2 3.530 . 4.060 2.885 2.594 3.260 . 0 0 "[ . 1 . 2]" 1 1850 2 62 PHE HE1 2 65 LEU MD2 3.530 . 4.060 2.806 2.563 3.172 . 0 0 "[ . 1 . 2]" 1 1851 1 62 PHE HE2 1 66 LEU MD1 3.690 . 4.240 2.264 2.118 2.526 . 0 0 "[ . 1 . 2]" 1 1852 2 62 PHE HE2 2 66 LEU MD1 3.690 . 4.240 2.228 2.085 2.385 . 0 0 "[ . 1 . 2]" 1 1853 1 39 TYR QE 1 62 PHE HZ 5.480 . 6.300 4.648 4.186 4.960 . 0 0 "[ . 1 . 2]" 1 1854 2 39 TYR QE 2 62 PHE HZ 5.480 . 6.300 4.624 4.189 5.015 . 0 0 "[ . 1 . 2]" 1 1855 1 13 LEU QD 1 62 PHE HZ 3.430 . 3.940 3.179 2.673 3.627 . 0 0 "[ . 1 . 2]" 1 1856 2 13 LEU QD 2 62 PHE HZ 3.430 . 3.940 3.188 2.865 3.561 . 0 0 "[ . 1 . 2]" 1 1857 1 62 PHE HZ 1 66 LEU MD1 4.250 . 4.890 3.959 3.538 4.361 . 0 0 "[ . 1 . 2]" 1 1858 2 62 PHE HZ 2 66 LEU MD1 4.250 . 4.890 3.951 3.693 4.142 . 0 0 "[ . 1 . 2]" 1 1859 1 39 TYR QD 1 62 PHE HE2 4.630 . 5.320 4.200 3.782 4.749 . 0 0 "[ . 1 . 2]" 1 1860 2 39 TYR QD 2 62 PHE HE2 4.630 . 5.320 4.174 3.849 4.622 . 0 0 "[ . 1 . 2]" 1 1861 1 39 TYR HA 1 39 TYR QD 3.720 . 4.280 2.943 2.852 3.033 . 0 0 "[ . 1 . 2]" 1 1862 2 39 TYR HA 2 39 TYR QD 3.720 . 4.280 2.935 2.838 3.029 . 0 0 "[ . 1 . 2]" 1 1863 1 39 TYR QD 1 59 GLU HA 4.240 . 4.880 3.116 2.686 3.717 . 0 0 "[ . 1 . 2]" 1 1864 2 39 TYR QD 2 59 GLU HA 4.240 . 4.880 3.030 2.589 3.607 . 0 0 "[ . 1 . 2]" 1 1865 1 27 LEU HG 1 39 TYR QD 4.640 . 5.340 4.009 3.601 4.339 . 0 0 "[ . 1 . 2]" 1 1866 2 27 LEU HG 2 39 TYR QD 4.640 . 5.340 4.040 3.693 4.432 . 0 0 "[ . 1 . 2]" 1 1867 1 13 LEU QD 1 39 TYR QD 3.120 . 3.590 1.867 1.749 1.999 0.051 19 0 "[ . 1 . 2]" 1 1868 2 13 LEU QD 2 39 TYR QD 3.120 . 3.590 1.895 1.765 2.078 0.035 5 0 "[ . 1 . 2]" 1 1869 1 39 TYR QE 1 58 SER HA 4.370 . 5.030 4.793 4.205 5.135 0.105 2 0 "[ . 1 . 2]" 1 1870 2 39 TYR QE 2 58 SER HA 4.370 . 5.030 4.942 4.551 5.220 0.190 15 0 "[ . 1 . 2]" 1 1871 1 39 TYR QE 1 59 GLU HA 3.280 . 3.770 1.917 1.739 2.562 0.061 11 0 "[ . 1 . 2]" 1 1872 2 39 TYR QE 2 59 GLU HA 3.280 . 3.770 1.992 1.770 2.454 0.030 20 0 "[ . 1 . 2]" 1 1873 1 39 TYR QE 1 59 GLU HG2 3.570 . 4.110 2.259 1.795 3.670 0.005 13 0 "[ . 1 . 2]" 1 1874 2 39 TYR QE 2 59 GLU HG2 3.570 . 4.110 2.273 1.711 3.908 0.089 7 0 "[ . 1 . 2]" 1 1875 1 13 LEU QD 1 39 TYR QE 3.090 . 3.550 2.560 2.246 2.942 . 0 0 "[ . 1 . 2]" 1 1876 2 13 LEU QD 2 39 TYR QE 3.090 . 3.550 2.587 2.135 2.918 . 0 0 "[ . 1 . 2]" 1 1877 1 48 HIS HD2 1 49 GLU H 4.950 . 5.690 5.477 4.968 5.910 0.220 7 0 "[ . 1 . 2]" 1 1878 2 48 HIS HD2 2 49 GLU H 4.950 . 5.690 5.479 5.093 5.843 0.153 7 0 "[ . 1 . 2]" 1 1879 1 44 TRP HB2 1 48 HIS HD2 4.270 . 4.910 2.646 2.384 3.156 . 0 0 "[ . 1 . 2]" 1 1880 2 44 TRP HB2 2 48 HIS HD2 4.270 . 4.910 2.632 2.226 3.778 . 0 0 "[ . 1 . 2]" 1 1881 1 44 TRP HB3 1 48 HIS HD2 4.130 . 4.750 2.298 1.824 2.872 . 0 0 "[ . 1 . 2]" 1 1882 2 44 TRP HB3 2 48 HIS HD2 4.130 . 4.750 2.287 1.853 3.051 . 0 0 "[ . 1 . 2]" 1 1883 1 23 TRP HA 1 23 TRP HD1 4.020 . 4.620 3.528 3.284 3.781 . 0 0 "[ . 1 . 2]" 1 1884 2 23 TRP HA 2 23 TRP HD1 4.020 . 4.620 3.499 3.309 3.896 . 0 0 "[ . 1 . 2]" 1 1885 1 22 GLY HA3 1 23 TRP HD1 4.270 . 4.910 4.266 3.879 4.770 . 0 0 "[ . 1 . 2]" 1 1886 2 22 GLY HA3 2 23 TRP HD1 4.270 . 4.910 4.169 3.845 4.869 . 0 0 "[ . 1 . 2]" 1 1887 1 23 TRP HD1 1 46 PRO HD2 4.660 . 5.360 4.226 3.450 4.966 . 0 0 "[ . 1 . 2]" 1 1888 2 23 TRP HD1 2 46 PRO HD2 4.660 . 5.360 4.016 3.207 4.835 . 0 0 "[ . 1 . 2]" 1 1889 1 21 LYS HB3 1 23 TRP HD1 3.540 . 4.070 2.767 2.079 3.510 . 0 0 "[ . 1 . 2]" 1 1890 2 21 LYS HB3 2 23 TRP HD1 3.540 . 4.070 2.748 2.369 3.069 . 0 0 "[ . 1 . 2]" 1 1891 1 21 LYS HB2 1 23 TRP HD1 3.580 . 4.120 2.296 2.029 2.729 . 0 0 "[ . 1 . 2]" 1 1892 2 21 LYS HB2 2 23 TRP HD1 3.580 . 4.120 2.344 1.883 2.650 . 0 0 "[ . 1 . 2]" 1 1893 1 21 LYS HG2 1 23 TRP HD1 4.920 . 5.660 4.692 4.325 5.167 . 0 0 "[ . 1 . 2]" 1 1894 2 21 LYS HG2 2 23 TRP HD1 4.920 . 5.660 4.751 4.198 5.115 . 0 0 "[ . 1 . 2]" 1 1895 1 21 LYS HG3 1 23 TRP HD1 5.270 . 6.060 4.222 3.758 4.852 . 0 0 "[ . 1 . 2]" 1 1896 2 21 LYS HG3 2 23 TRP HD1 5.270 . 6.060 4.290 3.909 4.688 . 0 0 "[ . 1 . 2]" 1 1897 1 43 THR HA 1 44 TRP HD1 4.540 . 5.220 4.015 3.550 4.611 . 0 0 "[ . 1 . 2]" 1 1898 2 43 THR HA 2 44 TRP HD1 4.540 . 5.220 4.086 3.821 4.409 . 0 0 "[ . 1 . 2]" 1 1899 1 26 GLU HG2 1 44 TRP HD1 3.870 . 4.450 2.609 2.099 4.463 0.013 15 0 "[ . 1 . 2]" 1 1900 2 26 GLU HG2 2 44 TRP HD1 3.870 . 4.450 2.533 1.948 3.783 . 0 0 "[ . 1 . 2]" 1 1901 1 26 GLU HG3 1 44 TRP HD1 3.870 . 4.450 2.787 2.186 4.474 0.024 7 0 "[ . 1 . 2]" 1 1902 2 26 GLU HG3 2 44 TRP HD1 3.870 . 4.450 2.589 2.151 3.419 . 0 0 "[ . 1 . 2]" 1 1903 1 9 ILE MD 1 44 TRP HZ2 4.600 . 5.290 4.066 3.283 4.972 . 0 0 "[ . 1 . 2]" 1 1904 2 9 ILE MD 2 44 TRP HZ2 4.600 . 5.290 4.183 3.461 4.848 . 0 0 "[ . 1 . 2]" 1 1905 1 23 TRP HB3 1 23 TRP HZ3 4.970 . 5.720 4.837 4.768 4.874 . 0 0 "[ . 1 . 2]" 1 1906 2 23 TRP HB3 2 23 TRP HZ3 4.970 . 5.720 4.835 4.790 4.901 . 0 0 "[ . 1 . 2]" 1 1907 1 23 TRP HH2 1 50 LYS HB3 3.780 . 4.350 2.363 2.147 2.625 . 0 0 "[ . 1 . 2]" 1 1908 2 23 TRP HH2 2 50 LYS HB3 3.780 . 4.350 2.321 2.162 2.609 . 0 0 "[ . 1 . 2]" 1 1909 2 5 LEU HB2 2 32 TRP HZ3 4.350 . 5.000 3.263 2.456 5.022 0.022 4 0 "[ . 1 . 2]" 1 1910 1 7 PHE HB3 1 32 TRP HZ3 4.270 . 4.910 2.778 2.490 3.044 . 0 0 "[ . 1 . 2]" 1 1911 2 7 PHE HB3 2 32 TRP HZ3 4.270 . 4.910 2.820 2.449 3.174 . 0 0 "[ . 1 . 2]" 1 1912 1 30 VAL MG2 1 44 TRP HH2 4.390 . 5.050 3.470 2.787 4.221 . 0 0 "[ . 1 . 2]" 1 1913 2 30 VAL MG2 2 44 TRP HH2 4.390 . 5.050 3.521 2.990 4.284 . 0 0 "[ . 1 . 2]" 1 1914 1 7 PHE QD 1 32 TRP HE3 3.950 . 4.540 4.143 3.597 4.574 0.034 8 0 "[ . 1 . 2]" 1 1915 2 7 PHE HD1 2 32 TRP HE3 3.950 . 4.540 4.120 3.667 4.625 0.085 14 0 "[ . 1 . 2]" 1 1916 1 7 PHE HZ 1 51 MET ME 4.080 . 4.690 3.821 3.240 4.548 . 0 0 "[ . 1 . 2]" 1 1917 2 7 PHE HZ 2 51 MET ME 4.080 . 4.690 3.889 3.334 4.427 . 0 0 "[ . 1 . 2]" 1 1918 1 7 PHE QE 1 51 MET ME 4.570 . 5.260 2.908 2.458 3.417 . 0 0 "[ . 1 . 2]" 1 1919 2 7 PHE HE1 2 51 MET ME 4.570 . 5.260 2.967 2.495 3.843 . 0 0 "[ . 1 . 2]" 1 1920 2 7 PHE HE2 2 51 MET ME 4.880 . 5.610 4.947 4.159 5.641 0.031 10 0 "[ . 1 . 2]" 1 1921 1 62 PHE HD1 1 66 LEU H 5.350 . 6.150 5.660 5.296 5.899 . 0 0 "[ . 1 . 2]" 1 1922 2 62 PHE HD1 2 66 LEU H 5.350 . 6.150 5.639 5.405 5.801 . 0 0 "[ . 1 . 2]" 1 1923 1 8 GLU H 1 32 TRP H 5.260 . 6.050 5.153 4.981 5.269 . 0 0 "[ . 1 . 2]" 1 1924 2 8 GLU H 2 32 TRP H 5.260 . 6.050 5.145 5.008 5.242 . 0 0 "[ . 1 . 2]" 1 1925 1 31 SER HA 1 32 TRP H 3.560 . 4.090 2.187 2.145 2.246 . 0 0 "[ . 1 . 2]" 1 1926 2 31 SER HA 2 32 TRP H 3.560 . 4.090 2.193 2.167 2.237 . 0 0 "[ . 1 . 2]" 1 1927 1 31 SER HB2 1 32 TRP H 4.800 . 5.520 4.214 3.388 4.391 . 0 0 "[ . 1 . 2]" 1 1928 2 31 SER HB2 2 32 TRP H 4.800 . 5.520 4.195 3.389 4.407 . 0 0 "[ . 1 . 2]" 1 1929 1 31 SER HB3 1 32 TRP H 4.800 . 5.520 4.281 4.143 4.381 . 0 0 "[ . 1 . 2]" 1 1930 2 31 SER HB3 2 32 TRP H 4.800 . 5.520 4.281 4.120 4.395 . 0 0 "[ . 1 . 2]" 1 1931 1 32 TRP H 1 32 TRP HB2 3.800 . 4.370 2.485 2.375 2.566 . 0 0 "[ . 1 . 2]" 1 1932 2 32 TRP H 2 32 TRP HB2 3.800 . 4.370 2.472 2.396 2.541 . 0 0 "[ . 1 . 2]" 1 1933 1 32 TRP H 1 35 ALA MB 3.740 . 4.300 3.172 2.638 3.743 . 0 0 "[ . 1 . 2]" 1 1934 2 32 TRP H 2 35 ALA MB 3.740 . 4.300 3.327 2.749 3.921 . 0 0 "[ . 1 . 2]" 1 1935 1 10 ILE H 1 30 VAL H 4.650 . 5.350 4.513 4.422 4.604 . 0 0 "[ . 1 . 2]" 1 1936 2 10 ILE H 2 30 VAL H 4.650 . 5.350 4.514 4.418 4.632 . 0 0 "[ . 1 . 2]" 1 1937 1 10 ILE H 1 10 ILE HB 3.790 . 4.360 2.478 2.330 2.589 . 0 0 "[ . 1 . 2]" 1 1938 2 10 ILE H 2 10 ILE HB 3.790 . 4.360 2.489 2.373 2.621 . 0 0 "[ . 1 . 2]" 1 1939 1 10 ILE H 1 10 ILE HG13 4.110 . 4.730 3.755 3.646 3.853 . 0 0 "[ . 1 . 2]" 1 1940 2 10 ILE H 2 10 ILE HG13 4.110 . 4.730 3.768 3.674 3.848 . 0 0 "[ . 1 . 2]" 1 1941 1 10 ILE H 1 10 ILE MG 3.860 . 4.440 3.804 3.744 3.833 . 0 0 "[ . 1 . 2]" 1 1942 2 10 ILE H 2 10 ILE MG 3.860 . 4.440 3.807 3.765 3.852 . 0 0 "[ . 1 . 2]" 1 1943 1 14 ILE H 1 15 VAL H 4.500 . 5.180 4.175 4.012 4.319 . 0 0 "[ . 1 . 2]" 1 1944 2 14 ILE H 2 15 VAL H 4.500 . 5.180 4.151 4.042 4.288 . 0 0 "[ . 1 . 2]" 1 1945 1 14 ILE HA 1 15 VAL H 3.050 . 3.510 2.255 2.207 2.288 . 0 0 "[ . 1 . 2]" 1 1946 2 14 ILE HA 2 15 VAL H 3.050 . 3.510 2.240 2.200 2.267 . 0 0 "[ . 1 . 2]" 1 1947 1 15 VAL H 1 15 VAL HB 3.260 . 3.750 2.614 2.525 2.700 . 0 0 "[ . 1 . 2]" 1 1948 2 15 VAL H 2 15 VAL HB 3.260 . 3.750 2.598 2.523 2.654 . 0 0 "[ . 1 . 2]" 1 1949 1 14 ILE HB 1 15 VAL H 3.960 . 4.550 4.187 4.045 4.374 . 0 0 "[ . 1 . 2]" 1 1950 2 14 ILE HB 2 15 VAL H 3.960 . 4.550 4.207 4.025 4.356 . 0 0 "[ . 1 . 2]" 1 1951 1 14 ILE HG12 1 15 VAL H 4.500 . 5.180 4.850 4.688 4.971 . 0 0 "[ . 1 . 2]" 1 1952 2 14 ILE HG12 2 15 VAL H 4.500 . 5.180 4.842 4.684 4.953 . 0 0 "[ . 1 . 2]" 1 1953 1 15 VAL H 1 15 VAL MG2 3.080 . 3.540 2.452 2.312 2.665 . 0 0 "[ . 1 . 2]" 1 1954 2 15 VAL H 2 15 VAL MG2 3.080 . 3.540 2.449 2.237 2.633 . 0 0 "[ . 1 . 2]" 1 1955 1 14 ILE MG 1 15 VAL H 3.180 . 3.660 2.828 2.557 3.156 . 0 0 "[ . 1 . 2]" 1 1956 2 14 ILE MG 2 15 VAL H 3.180 . 3.660 2.860 2.528 3.146 . 0 0 "[ . 1 . 2]" 1 1957 1 12 GLU H 1 13 LEU H 4.720 . 5.430 4.484 4.399 4.523 . 0 0 "[ . 1 . 2]" 1 1958 2 12 GLU H 2 13 LEU H 4.720 . 5.430 4.453 4.377 4.523 . 0 0 "[ . 1 . 2]" 1 1959 1 11 GLU HA 1 12 GLU H 3.010 . 3.460 2.268 2.241 2.325 . 0 0 "[ . 1 . 2]" 1 1960 2 11 GLU HA 2 12 GLU H 3.010 . 3.460 2.261 2.193 2.299 . 0 0 "[ . 1 . 2]" 1 1961 1 11 GLU HG2 1 12 GLU H 4.070 . 4.680 3.119 2.503 4.309 . 0 0 "[ . 1 . 2]" 1 1962 2 11 GLU HG2 2 12 GLU H 4.070 . 4.680 3.508 2.512 4.275 . 0 0 "[ . 1 . 2]" 1 1963 1 12 GLU H 1 12 GLU HB3 3.720 . 4.280 3.716 3.678 3.786 . 0 0 "[ . 1 . 2]" 1 1964 2 12 GLU H 2 12 GLU HB3 3.720 . 4.280 3.727 3.680 3.767 . 0 0 "[ . 1 . 2]" 1 1965 1 12 GLU H 1 12 GLU HB2 3.170 . 3.650 2.538 2.454 2.725 . 0 0 "[ . 1 . 2]" 1 1966 2 12 GLU H 2 12 GLU HB2 3.170 . 3.650 2.565 2.477 2.657 . 0 0 "[ . 1 . 2]" 1 1967 1 12 GLU H 1 12 GLU HG3 4.210 . 4.840 2.898 2.593 3.786 . 0 0 "[ . 1 . 2]" 1 1968 2 12 GLU H 2 12 GLU HG3 4.210 . 4.840 3.036 2.555 3.791 . 0 0 "[ . 1 . 2]" 1 1969 1 12 GLU H 1 13 LEU QD 4.990 . 5.740 4.257 3.852 4.617 . 0 0 "[ . 1 . 2]" 1 1970 2 12 GLU H 2 13 LEU QD 4.990 . 5.740 4.251 3.906 4.540 . 0 0 "[ . 1 . 2]" 1 1971 1 9 ILE MG 1 12 GLU H 4.460 . 5.130 3.906 3.636 4.357 . 0 0 "[ . 1 . 2]" 1 1972 2 9 ILE MG 2 12 GLU H 4.460 . 5.130 3.943 3.705 4.180 . 0 0 "[ . 1 . 2]" 1 1973 1 7 PHE QD 1 9 ILE H 4.820 . 5.540 4.454 3.999 5.360 . 0 0 "[ . 1 . 2]" 1 1974 2 7 PHE HD2 2 9 ILE H 4.820 . 5.540 4.505 3.792 4.947 . 0 0 "[ . 1 . 2]" 1 1975 1 8 GLU HA 1 9 ILE H 3.090 . 3.550 2.188 2.145 2.245 . 0 0 "[ . 1 . 2]" 1 1976 2 8 GLU HA 2 9 ILE H 3.090 . 3.550 2.186 2.151 2.239 . 0 0 "[ . 1 . 2]" 1 1977 1 8 GLU HB3 1 9 ILE H 4.390 . 5.050 4.215 3.820 4.391 . 0 0 "[ . 1 . 2]" 1 1978 2 8 GLU HB3 2 9 ILE H 4.390 . 5.050 4.204 3.967 4.374 . 0 0 "[ . 1 . 2]" 1 1979 1 8 GLU HB2 1 9 ILE H 4.650 . 5.350 4.282 3.942 4.455 . 0 0 "[ . 1 . 2]" 1 1980 2 8 GLU HB2 2 9 ILE H 4.650 . 5.350 4.284 4.118 4.444 . 0 0 "[ . 1 . 2]" 1 1981 1 9 ILE H 1 9 ILE HB 3.460 . 3.980 2.536 2.457 2.661 . 0 0 "[ . 1 . 2]" 1 1982 2 9 ILE H 2 9 ILE HB 3.460 . 3.980 2.550 2.460 2.647 . 0 0 "[ . 1 . 2]" 1 1983 1 9 ILE H 1 9 ILE QG 3.790 . 4.360 2.390 2.148 2.622 . 0 0 "[ . 1 . 2]" 1 1984 2 9 ILE H 2 9 ILE HG13 3.790 . 4.360 2.431 2.241 2.646 . 0 0 "[ . 1 . 2]" 1 1985 2 9 ILE H 2 9 ILE HG12 3.970 . 4.570 3.578 3.467 3.675 . 0 0 "[ . 1 . 2]" 1 1986 1 9 ILE H 1 9 ILE MD 3.890 . 4.470 3.813 3.617 4.054 . 0 0 "[ . 1 . 2]" 1 1987 2 9 ILE H 2 9 ILE MD 3.890 . 4.470 3.828 3.673 4.036 . 0 0 "[ . 1 . 2]" 1 1988 1 15 VAL H 1 16 LEU H 4.910 . 5.650 4.431 4.343 4.511 . 0 0 "[ . 1 . 2]" 1 1989 2 15 VAL H 2 16 LEU H 4.910 . 5.650 4.434 4.390 4.497 . 0 0 "[ . 1 . 2]" 1 1990 1 16 LEU H 1 16 LEU HG 3.700 . 4.260 2.518 2.391 2.617 . 0 0 "[ . 1 . 2]" 1 1991 2 16 LEU H 2 16 LEU HG 3.700 . 4.260 2.512 2.293 2.655 . 0 0 "[ . 1 . 2]" 1 1992 1 16 LEU H 1 16 LEU MD2 3.830 . 4.400 3.464 3.346 3.564 . 0 0 "[ . 1 . 2]" 1 1993 2 16 LEU H 2 16 LEU MD2 3.830 . 4.400 3.402 3.210 3.554 . 0 0 "[ . 1 . 2]" 1 1994 1 40 ASP H 1 41 ILE H 4.450 . 5.120 4.367 4.297 4.435 . 0 0 "[ . 1 . 2]" 1 1995 2 40 ASP H 2 41 ILE H 4.450 . 5.120 4.386 4.328 4.447 . 0 0 "[ . 1 . 2]" 1 1996 1 40 ASP HA 1 41 ILE H 3.280 . 3.770 2.212 2.166 2.260 . 0 0 "[ . 1 . 2]" 1 1997 2 40 ASP HA 2 41 ILE H 3.280 . 3.770 2.218 2.179 2.255 . 0 0 "[ . 1 . 2]" 1 1998 1 40 ASP HB3 1 41 ILE H 4.600 . 5.290 3.934 3.054 4.197 . 0 0 "[ . 1 . 2]" 1 1999 2 40 ASP HB3 2 41 ILE H 4.600 . 5.290 3.975 3.139 4.211 . 0 0 "[ . 1 . 2]" 1 2000 1 41 ILE H 1 41 ILE HB 3.550 . 4.080 3.425 3.357 3.462 . 0 0 "[ . 1 . 2]" 1 2001 2 41 ILE H 2 41 ILE HB 3.550 . 4.080 3.421 3.366 3.502 . 0 0 "[ . 1 . 2]" 1 2002 1 41 ILE H 1 56 THR MG 4.580 . 5.270 4.461 4.027 5.023 . 0 0 "[ . 1 . 2]" 1 2003 2 41 ILE H 2 56 THR MG 4.580 . 5.270 4.485 4.109 4.725 . 0 0 "[ . 1 . 2]" 1 2004 1 41 ILE H 1 41 ILE MG 3.210 . 3.690 2.366 2.275 2.436 . 0 0 "[ . 1 . 2]" 1 2005 2 41 ILE H 2 41 ILE MG 3.210 . 3.690 2.355 2.308 2.406 . 0 0 "[ . 1 . 2]" 1 2006 1 39 TYR H 1 40 ASP H 5.300 . 6.100 4.478 4.378 4.557 . 0 0 "[ . 1 . 2]" 1 2007 2 39 TYR H 2 40 ASP H 5.300 . 6.100 4.466 4.340 4.583 . 0 0 "[ . 1 . 2]" 1 2008 1 29 ARG HA 1 40 ASP H 4.310 . 4.960 2.977 2.655 3.263 . 0 0 "[ . 1 . 2]" 1 2009 2 29 ARG HA 2 40 ASP H 4.310 . 4.960 2.941 2.605 3.158 . 0 0 "[ . 1 . 2]" 1 2010 1 40 ASP H 1 40 ASP HB2 4.200 . 4.830 3.055 2.584 3.376 . 0 0 "[ . 1 . 2]" 1 2011 2 40 ASP H 2 40 ASP HB2 4.200 . 4.830 3.008 2.564 3.263 . 0 0 "[ . 1 . 2]" 1 2012 1 27 LEU HG 1 40 ASP H 4.350 . 5.000 4.625 4.294 5.009 0.009 11 0 "[ . 1 . 2]" 1 2013 2 27 LEU HG 2 40 ASP H 4.350 . 5.000 4.644 4.326 4.934 . 0 0 "[ . 1 . 2]" 1 2014 1 40 ASP H 1 57 LEU MD1 4.900 . 5.640 5.318 4.822 5.448 . 0 0 "[ . 1 . 2]" 1 2015 2 40 ASP H 2 57 LEU MD1 4.900 . 5.640 5.324 5.110 5.490 . 0 0 "[ . 1 . 2]" 1 2016 1 26 GLU H 1 42 ARG H 3.950 . 4.540 3.330 3.159 3.547 . 0 0 "[ . 1 . 2]" 1 2017 2 26 GLU H 2 42 ARG H 3.950 . 4.540 3.326 3.183 3.444 . 0 0 "[ . 1 . 2]" 1 2018 1 26 GLU H 1 43 THR HA 4.030 . 4.630 3.126 2.878 3.386 . 0 0 "[ . 1 . 2]" 1 2019 2 26 GLU H 2 43 THR HA 4.030 . 4.630 3.167 2.937 3.370 . 0 0 "[ . 1 . 2]" 1 2020 1 26 GLU H 1 26 GLU HG3 4.460 . 5.130 3.213 2.137 4.732 . 0 0 "[ . 1 . 2]" 1 2021 2 26 GLU H 2 26 GLU HG3 4.460 . 5.130 3.115 2.181 3.535 . 0 0 "[ . 1 . 2]" 1 2022 1 16 LEU HB2 1 26 GLU H 4.960 . 5.700 4.907 4.613 5.265 . 0 0 "[ . 1 . 2]" 1 2023 2 16 LEU HB2 2 26 GLU H 4.960 . 5.700 4.960 4.630 5.161 . 0 0 "[ . 1 . 2]" 1 2024 1 26 GLU H 1 43 THR MG 4.610 . 5.300 4.630 4.367 4.829 . 0 0 "[ . 1 . 2]" 1 2025 2 26 GLU H 2 43 THR MG 4.610 . 5.300 4.671 4.502 4.848 . 0 0 "[ . 1 . 2]" 1 2026 1 16 LEU MD1 1 26 GLU H 4.020 . 4.620 4.409 4.108 4.660 0.040 16 0 "[ . 1 . 2]" 1 2027 2 16 LEU MD1 2 26 GLU H 4.020 . 4.620 4.420 3.800 4.680 0.060 2 0 "[ . 1 . 2]" 1 2028 1 33 ASN H 1 34 ASP H 3.790 . 4.360 2.751 2.636 2.904 . 0 0 "[ . 1 . 2]" 1 2029 2 33 ASN H 2 34 ASP H 3.790 . 4.360 2.731 2.634 2.847 . 0 0 "[ . 1 . 2]" 1 2030 1 32 TRP HE3 1 33 ASN H 4.640 . 5.340 3.975 3.715 4.405 . 0 0 "[ . 1 . 2]" 1 2031 2 32 TRP HE3 2 33 ASN H 4.640 . 5.340 3.975 3.423 4.300 . 0 0 "[ . 1 . 2]" 1 2032 1 7 PHE HA 1 33 ASN H 4.120 . 4.740 3.436 2.772 3.789 . 0 0 "[ . 1 . 2]" 1 2033 2 7 PHE HA 2 33 ASN H 4.120 . 4.740 3.374 2.721 3.761 . 0 0 "[ . 1 . 2]" 1 2034 1 32 TRP HA 1 33 ASN H 3.330 . 3.830 2.114 2.096 2.139 . 0 0 "[ . 1 . 2]" 1 2035 2 32 TRP HA 2 33 ASN H 3.330 . 3.830 2.118 2.091 2.164 . 0 0 "[ . 1 . 2]" 1 2036 1 6 LYS HA 1 33 ASN H 4.440 . 5.110 4.484 4.166 4.669 . 0 0 "[ . 1 . 2]" 1 2037 2 6 LYS HA 2 33 ASN H 4.440 . 5.110 4.484 4.272 4.615 . 0 0 "[ . 1 . 2]" 1 2038 1 32 TRP HB3 1 33 ASN H 3.750 . 4.310 3.560 3.450 3.691 . 0 0 "[ . 1 . 2]" 1 2039 2 32 TRP HB3 2 33 ASN H 3.750 . 4.310 3.558 3.295 3.697 . 0 0 "[ . 1 . 2]" 1 2040 1 33 ASN H 1 33 ASN HB2 3.780 . 4.350 3.446 3.078 3.601 . 0 0 "[ . 1 . 2]" 1 2041 2 33 ASN H 2 33 ASN HB2 3.780 . 4.350 3.446 2.928 3.615 . 0 0 "[ . 1 . 2]" 1 2042 1 6 LYS HB3 1 33 ASN H 3.880 . 4.460 3.791 3.491 4.103 . 0 0 "[ . 1 . 2]" 1 2043 2 6 LYS HB3 2 33 ASN H 3.880 . 4.460 3.730 3.472 4.094 . 0 0 "[ . 1 . 2]" 1 2044 1 6 LYS H 1 33 ASN H 4.100 . 4.720 3.161 2.686 4.413 . 0 0 "[ . 1 . 2]" 1 2045 2 6 LYS H 2 33 ASN H 4.100 . 4.720 3.155 2.791 3.975 . 0 0 "[ . 1 . 2]" 1 2046 1 6 LYS H 1 33 ASN HD22 4.590 . 5.280 3.259 2.332 4.255 . 0 0 "[ . 1 . 2]" 1 2047 2 6 LYS H 2 33 ASN HD22 4.590 . 5.280 3.272 2.269 4.294 . 0 0 "[ . 1 . 2]" 1 2048 1 6 LYS H 1 7 PHE QD 5.380 . 6.190 4.886 4.230 5.374 . 0 0 "[ . 1 . 2]" 1 2049 2 6 LYS H 2 7 PHE HD1 5.380 . 6.190 4.806 4.214 5.445 . 0 0 "[ . 1 . 2]" 1 2050 1 5 LEU HA 1 6 LYS H 2.430 . 2.790 2.258 2.105 2.405 . 0 0 "[ . 1 . 2]" 1 2051 2 5 LEU HA 2 6 LYS H 2.430 . 2.790 2.256 2.093 2.386 . 0 0 "[ . 1 . 2]" 1 2052 1 6 LYS H 1 33 ASN HA 3.930 . 4.520 3.328 2.402 3.950 . 0 0 "[ . 1 . 2]" 1 2053 2 6 LYS H 2 33 ASN HA 3.930 . 4.520 3.350 2.426 3.989 . 0 0 "[ . 1 . 2]" 1 2054 1 5 LEU QB 1 6 LYS H 2.640 . 3.040 2.666 2.292 3.244 0.204 11 0 "[ . 1 . 2]" 1 2055 2 5 LEU HB3 2 6 LYS H 2.640 . 3.040 2.657 2.364 3.491 0.451 19 0 "[ . 1 . 2]" 1 2056 1 6 LYS H 1 6 LYS HG2 3.420 . 3.930 2.819 2.130 3.271 . 0 0 "[ . 1 . 2]" 1 2057 2 6 LYS H 2 6 LYS HG2 3.420 . 3.930 2.957 2.077 3.147 . 0 0 "[ . 1 . 2]" 1 2058 1 4 LYS HA 1 5 LEU H 2.440 . 2.810 2.254 2.147 2.446 . 0 0 "[ . 1 . 2]" 1 2059 2 4 LYS HA 2 5 LEU H 2.440 . 2.810 2.223 2.151 2.415 . 0 0 "[ . 1 . 2]" 1 2060 1 5 LEU H 1 5 LEU QB 2.920 . 3.360 2.542 2.461 2.682 . 0 0 "[ . 1 . 2]" 1 2061 2 5 LEU H 2 5 LEU HB2 2.920 . 3.360 2.602 2.530 2.781 . 0 0 "[ . 1 . 2]" 1 2062 1 5 LEU H 1 5 LEU HG 3.210 . 3.690 2.724 2.526 3.019 . 0 0 "[ . 1 . 2]" 1 2063 2 5 LEU H 2 5 LEU HG 3.210 . 3.690 2.740 2.508 3.434 . 0 0 "[ . 1 . 2]" 1 2064 1 4 LYS HG2 1 5 LEU H 4.260 . 4.900 3.256 1.956 5.089 0.189 4 0 "[ . 1 . 2]" 1 2065 2 4 LYS HG2 2 5 LEU H 4.260 . 4.900 3.363 2.437 5.097 0.197 8 0 "[ . 1 . 2]" 1 2066 1 4 LYS HG3 1 5 LEU H 4.260 . 4.900 3.387 2.599 5.056 0.156 9 0 "[ . 1 . 2]" 1 2067 2 4 LYS HG3 2 5 LEU H 4.260 . 4.900 3.372 2.923 4.371 . 0 0 "[ . 1 . 2]" 1 2068 1 5 LEU H 1 5 LEU MD2 3.580 . 4.120 3.393 3.020 3.745 . 0 0 "[ . 1 . 2]" 1 2069 2 5 LEU H 2 5 LEU MD2 3.580 . 4.120 3.380 3.144 3.934 . 0 0 "[ . 1 . 2]" 1 2070 1 27 LEU HG 1 28 ASN H 4.120 . 4.740 3.464 3.310 3.595 . 0 0 "[ . 1 . 2]" 1 2071 2 27 LEU HG 2 28 ASN H 4.120 . 4.740 3.451 3.326 3.623 . 0 0 "[ . 1 . 2]" 1 2072 1 27 LEU HB2 1 28 ASN H 4.510 . 5.190 4.343 4.257 4.406 . 0 0 "[ . 1 . 2]" 1 2073 2 27 LEU HB2 2 28 ASN H 4.510 . 5.190 4.339 4.228 4.401 . 0 0 "[ . 1 . 2]" 1 2074 1 13 LEU QD 1 28 ASN H 4.120 . 4.740 3.889 3.621 4.310 . 0 0 "[ . 1 . 2]" 1 2075 2 13 LEU QD 2 28 ASN H 4.120 . 4.740 3.903 3.462 4.199 . 0 0 "[ . 1 . 2]" 1 2076 1 29 ARG HA 1 30 VAL H 3.370 . 3.880 2.127 2.085 2.177 . 0 0 "[ . 1 . 2]" 1 2077 2 29 ARG HA 2 30 VAL H 3.370 . 3.880 2.130 2.087 2.158 . 0 0 "[ . 1 . 2]" 1 2078 1 30 VAL H 1 30 VAL HB 3.500 . 4.030 2.688 2.574 2.753 . 0 0 "[ . 1 . 2]" 1 2079 2 30 VAL H 2 30 VAL HB 3.500 . 4.030 2.689 2.606 2.760 . 0 0 "[ . 1 . 2]" 1 2080 1 29 ARG HB2 1 30 VAL H 4.500 . 5.180 4.264 4.186 4.449 . 0 0 "[ . 1 . 2]" 1 2081 2 29 ARG HB2 2 30 VAL H 4.500 . 5.180 4.273 4.154 4.499 . 0 0 "[ . 1 . 2]" 1 2082 1 29 ARG HG2 1 30 VAL H 4.830 . 5.550 4.252 3.398 4.590 . 0 0 "[ . 1 . 2]" 1 2083 2 29 ARG HG2 2 30 VAL H 4.830 . 5.550 4.266 3.303 4.625 . 0 0 "[ . 1 . 2]" 1 2084 1 29 ARG HG3 1 30 VAL H 4.830 . 5.550 4.846 2.910 5.268 . 0 0 "[ . 1 . 2]" 1 2085 2 29 ARG HG3 2 30 VAL H 4.830 . 5.550 4.950 3.240 5.220 . 0 0 "[ . 1 . 2]" 1 2086 1 19 ASN H 1 20 ALA H 5.380 . 6.190 4.665 4.618 4.701 . 0 0 "[ . 1 . 2]" 1 2087 2 19 ASN H 2 20 ALA H 5.380 . 6.190 4.667 4.606 4.708 . 0 0 "[ . 1 . 2]" 1 2088 1 19 ASN H 1 23 TRP H 4.120 . 4.740 3.585 3.440 3.696 . 0 0 "[ . 1 . 2]" 1 2089 2 19 ASN H 2 23 TRP H 4.120 . 4.740 3.552 3.413 3.682 . 0 0 "[ . 1 . 2]" 1 2090 1 19 ASN H 1 19 ASN HD21 4.730 . 5.440 4.739 4.382 4.858 . 0 0 "[ . 1 . 2]" 1 2091 2 19 ASN H 2 19 ASN HD21 4.730 . 5.440 4.754 4.513 4.847 . 0 0 "[ . 1 . 2]" 1 2092 1 19 ASN H 1 24 ARG HA 3.950 . 4.540 3.325 3.065 3.482 . 0 0 "[ . 1 . 2]" 1 2093 2 19 ASN H 2 24 ARG HA 3.950 . 4.540 3.385 3.192 3.507 . 0 0 "[ . 1 . 2]" 1 2094 1 18 GLU HA 1 19 ASN H 3.120 . 3.590 2.254 2.240 2.285 . 0 0 "[ . 1 . 2]" 1 2095 2 18 GLU HA 2 19 ASN H 3.120 . 3.590 2.259 2.198 2.292 . 0 0 "[ . 1 . 2]" 1 2096 1 19 ASN H 1 19 ASN HB2 4.110 . 4.730 2.668 2.545 2.878 . 0 0 "[ . 1 . 2]" 1 2097 2 19 ASN H 2 19 ASN HB2 4.110 . 4.730 2.665 2.516 2.862 . 0 0 "[ . 1 . 2]" 1 2098 1 19 ASN H 1 19 ASN HB3 4.110 . 4.730 2.611 2.417 2.700 . 0 0 "[ . 1 . 2]" 1 2099 2 19 ASN H 2 19 ASN HB3 4.110 . 4.730 2.631 2.502 2.806 . 0 0 "[ . 1 . 2]" 1 2100 1 18 GLU HG2 1 19 ASN H 3.710 . 4.270 2.905 2.676 3.266 . 0 0 "[ . 1 . 2]" 1 2101 2 18 GLU HG2 2 19 ASN H 3.710 . 4.270 2.976 2.771 3.405 . 0 0 "[ . 1 . 2]" 1 2102 1 19 ASN H 1 24 ARG HG2 4.130 . 4.750 3.911 3.658 4.168 . 0 0 "[ . 1 . 2]" 1 2103 2 19 ASN H 2 24 ARG HG3 3.410 . 3.920 3.850 3.588 3.969 0.049 12 0 "[ . 1 . 2]" 1 2104 1 19 ASN H 1 24 ARG HG3 4.130 . 4.750 4.273 3.849 4.795 0.045 11 0 "[ . 1 . 2]" 1 2105 2 19 ASN H 2 24 ARG HG2 4.130 . 4.750 4.150 3.604 4.787 0.037 15 0 "[ . 1 . 2]" 1 2106 1 44 TRP H 1 44 TRP HD1 4.270 . 4.910 3.176 2.889 3.476 . 0 0 "[ . 1 . 2]" 1 2107 2 44 TRP H 2 44 TRP HD1 4.270 . 4.910 3.208 2.997 3.362 . 0 0 "[ . 1 . 2]" 1 2108 1 25 LYS HA 1 44 TRP H 4.060 . 4.670 3.477 3.191 3.794 . 0 0 "[ . 1 . 2]" 1 2109 2 25 LYS HA 2 44 TRP H 4.060 . 4.670 3.515 3.135 3.841 . 0 0 "[ . 1 . 2]" 1 2110 1 62 PHE H 1 64 VAL H 4.880 . 5.610 4.299 4.178 4.475 . 0 0 "[ . 1 . 2]" 1 2111 2 62 PHE H 2 64 VAL H 4.880 . 5.610 4.313 4.229 4.452 . 0 0 "[ . 1 . 2]" 1 2112 1 63 GLY H 1 64 VAL H 3.610 . 4.150 2.834 2.789 2.905 . 0 0 "[ . 1 . 2]" 1 2113 2 63 GLY H 2 64 VAL H 3.610 . 4.150 2.836 2.769 2.913 . 0 0 "[ . 1 . 2]" 1 2114 1 64 VAL H 1 66 LEU H 4.400 . 5.060 4.377 4.243 4.517 . 0 0 "[ . 1 . 2]" 1 2115 2 64 VAL H 2 66 LEU H 4.400 . 5.060 4.399 4.293 4.545 . 0 0 "[ . 1 . 2]" 1 2116 1 16 LEU HA 2 64 VAL H 5.320 . 6.120 5.359 5.038 5.850 . 0 0 "[ . 1 . 2]" 1 2117 1 64 VAL H 2 16 LEU HA 5.320 . 6.120 5.371 4.872 5.961 . 0 0 "[ . 1 . 2]" 1 2118 1 63 GLY HA3 1 64 VAL H 3.550 . 4.080 2.744 2.662 2.806 . 0 0 "[ . 1 . 2]" 1 2119 2 63 GLY HA3 2 64 VAL H 3.550 . 4.080 2.727 2.651 2.769 . 0 0 "[ . 1 . 2]" 1 2120 1 64 VAL H 1 64 VAL HB 3.260 . 3.750 2.527 2.429 2.686 . 0 0 "[ . 1 . 2]" 1 2121 2 64 VAL H 2 64 VAL HB 3.260 . 3.750 2.542 2.479 2.629 . 0 0 "[ . 1 . 2]" 1 2122 1 64 VAL H 1 66 LEU MD1 5.510 . 6.340 5.561 5.195 5.848 . 0 0 "[ . 1 . 2]" 1 2123 2 64 VAL H 2 66 LEU MD1 5.510 . 6.340 5.558 5.196 5.916 . 0 0 "[ . 1 . 2]" 1 2124 1 13 LEU H 1 28 ASN HA 3.710 . 4.270 2.197 1.994 2.362 . 0 0 "[ . 1 . 2]" 1 2125 2 13 LEU H 2 28 ASN HA 3.710 . 4.270 2.172 1.998 2.388 . 0 0 "[ . 1 . 2]" 1 2126 1 12 GLU HA 1 13 LEU H 3.380 . 3.890 2.222 2.147 2.273 . 0 0 "[ . 1 . 2]" 1 2127 2 12 GLU HA 2 13 LEU H 3.380 . 3.890 2.205 2.134 2.246 . 0 0 "[ . 1 . 2]" 1 2128 1 12 GLU HB3 1 13 LEU H 3.710 . 4.270 3.259 3.003 3.470 . 0 0 "[ . 1 . 2]" 1 2129 2 12 GLU HB3 2 13 LEU H 3.710 . 4.270 3.323 3.054 3.554 . 0 0 "[ . 1 . 2]" 1 2130 1 13 LEU H 1 27 LEU HG 4.840 . 5.570 4.438 4.277 4.633 . 0 0 "[ . 1 . 2]" 1 2131 2 13 LEU H 2 27 LEU HG 4.840 . 5.570 4.421 4.310 4.547 . 0 0 "[ . 1 . 2]" 1 2132 1 13 LEU H 1 13 LEU HG 3.810 . 4.380 2.711 2.534 2.851 . 0 0 "[ . 1 . 2]" 1 2133 2 13 LEU H 2 13 LEU HG 3.810 . 4.380 2.708 2.522 2.853 . 0 0 "[ . 1 . 2]" 1 2134 1 13 LEU H 1 15 VAL MG2 5.820 . 6.690 5.178 4.695 5.336 . 0 0 "[ . 1 . 2]" 1 2135 2 13 LEU H 2 15 VAL MG2 5.820 . 6.690 5.148 4.910 5.384 . 0 0 "[ . 1 . 2]" 1 2136 1 38 LYS HG3 1 57 LEU H 4.220 . 4.850 4.015 3.483 4.385 . 0 0 "[ . 1 . 2]" 1 2137 2 38 LYS HG3 2 57 LEU H 4.220 . 4.850 3.958 3.488 4.300 . 0 0 "[ . 1 . 2]" 1 2138 1 27 LEU H 1 28 ASN H 4.570 . 5.260 4.260 4.148 4.364 . 0 0 "[ . 1 . 2]" 1 2139 2 27 LEU H 2 28 ASN H 4.570 . 5.260 4.263 4.167 4.339 . 0 0 "[ . 1 . 2]" 1 2140 1 26 GLU HA 1 27 LEU H 3.540 . 4.070 2.246 2.078 2.367 . 0 0 "[ . 1 . 2]" 1 2141 2 26 GLU HA 2 27 LEU H 3.540 . 4.070 2.229 2.101 2.392 . 0 0 "[ . 1 . 2]" 1 2142 1 15 VAL HA 1 27 LEU H 4.430 . 5.090 3.548 3.157 3.860 . 0 0 "[ . 1 . 2]" 1 2143 2 15 VAL HA 2 27 LEU H 4.430 . 5.090 3.628 3.402 3.925 . 0 0 "[ . 1 . 2]" 1 2144 1 27 LEU H 1 27 LEU HB3 3.740 . 4.300 2.415 2.355 2.489 . 0 0 "[ . 1 . 2]" 1 2145 2 27 LEU H 2 27 LEU HB3 3.740 . 4.300 2.406 2.344 2.463 . 0 0 "[ . 1 . 2]" 1 2146 1 14 ILE HB 1 27 LEU H 4.190 . 4.820 3.211 2.858 3.575 . 0 0 "[ . 1 . 2]" 1 2147 2 14 ILE HB 2 27 LEU H 4.190 . 4.820 3.243 2.963 3.486 . 0 0 "[ . 1 . 2]" 1 2148 1 16 LEU HG 1 27 LEU H 4.550 . 5.230 3.143 2.748 3.636 . 0 0 "[ . 1 . 2]" 1 2149 2 16 LEU HG 2 27 LEU H 4.550 . 5.230 3.210 2.641 3.609 . 0 0 "[ . 1 . 2]" 1 2150 1 27 LEU H 1 27 LEU HB2 3.970 . 4.570 2.898 2.724 3.027 . 0 0 "[ . 1 . 2]" 1 2151 2 27 LEU H 2 27 LEU HB2 3.970 . 4.570 2.880 2.708 3.033 . 0 0 "[ . 1 . 2]" 1 2152 1 15 VAL MG2 1 27 LEU H 4.870 . 5.600 4.749 4.426 5.162 . 0 0 "[ . 1 . 2]" 1 2153 2 15 VAL MG2 2 27 LEU H 4.870 . 5.600 4.789 4.505 5.271 . 0 0 "[ . 1 . 2]" 1 2154 1 4 LYS H 1 4 LYS HB3 3.770 . 4.340 2.663 2.357 3.240 . 0 0 "[ . 1 . 2]" 1 2155 2 4 LYS H 2 4 LYS HB3 3.770 . 4.340 2.704 2.364 3.763 . 0 0 "[ . 1 . 2]" 1 2156 1 34 ASP H 1 35 ALA H 3.330 . 3.830 2.790 2.677 2.896 . 0 0 "[ . 1 . 2]" 1 2157 2 34 ASP H 2 35 ALA H 3.330 . 3.830 2.809 2.701 2.933 . 0 0 "[ . 1 . 2]" 1 2158 1 32 TRP H 1 35 ALA H 4.220 . 4.850 3.401 3.103 3.788 . 0 0 "[ . 1 . 2]" 1 2159 2 32 TRP H 2 35 ALA H 4.220 . 4.850 3.463 3.047 3.773 . 0 0 "[ . 1 . 2]" 1 2160 1 34 ASP HA 1 35 ALA H 3.370 . 3.880 2.922 2.768 3.062 . 0 0 "[ . 1 . 2]" 1 2161 2 34 ASP HA 2 35 ALA H 3.370 . 3.880 2.911 2.717 3.158 . 0 0 "[ . 1 . 2]" 1 2162 1 31 SER HB2 1 35 ALA H 5.750 . 6.610 4.900 3.746 5.590 . 0 0 "[ . 1 . 2]" 1 2163 2 31 SER HB2 2 35 ALA H 5.750 . 6.610 4.922 3.312 5.879 . 0 0 "[ . 1 . 2]" 1 2164 1 31 SER HB3 1 35 ALA H 5.750 . 6.610 4.922 4.390 5.488 . 0 0 "[ . 1 . 2]" 1 2165 2 31 SER HB3 2 35 ALA H 5.750 . 6.610 4.976 4.482 5.471 . 0 0 "[ . 1 . 2]" 1 2166 1 33 ASN HB3 1 35 ALA H 4.520 . 5.200 4.808 4.105 5.114 . 0 0 "[ . 1 . 2]" 1 2167 2 33 ASN HB3 2 35 ALA H 4.520 . 5.200 4.735 4.200 5.059 . 0 0 "[ . 1 . 2]" 1 2168 1 34 ASP HB2 1 35 ALA H 4.500 . 5.180 4.388 4.022 4.679 . 0 0 "[ . 1 . 2]" 1 2169 2 34 ASP HB2 2 35 ALA H 4.500 . 5.180 4.435 4.102 4.720 . 0 0 "[ . 1 . 2]" 1 2170 1 59 GLU H 1 61 GLU H 4.850 . 5.580 4.418 4.253 4.681 . 0 0 "[ . 1 . 2]" 1 2171 2 59 GLU H 2 61 GLU H 4.850 . 5.580 4.470 4.299 4.693 . 0 0 "[ . 1 . 2]" 1 2172 1 39 TYR QE 1 59 GLU H 4.430 . 5.090 3.769 3.197 4.509 . 0 0 "[ . 1 . 2]" 1 2173 2 39 TYR QE 2 59 GLU H 4.430 . 5.090 3.916 3.718 4.102 . 0 0 "[ . 1 . 2]" 1 2174 1 58 SER HB3 1 59 GLU H 3.860 . 4.440 2.455 2.185 2.575 . 0 0 "[ . 1 . 2]" 1 2175 2 58 SER HB3 2 59 GLU H 3.860 . 4.440 2.429 2.292 2.590 . 0 0 "[ . 1 . 2]" 1 2176 1 58 SER HB2 1 59 GLU H 3.730 . 4.290 3.483 3.277 3.615 . 0 0 "[ . 1 . 2]" 1 2177 2 58 SER HB2 2 59 GLU H 3.730 . 4.290 3.415 3.195 3.714 . 0 0 "[ . 1 . 2]" 1 2178 1 59 GLU H 1 59 GLU HG2 3.900 . 4.490 3.217 2.364 3.754 . 0 0 "[ . 1 . 2]" 1 2179 2 59 GLU H 2 59 GLU HG2 3.900 . 4.490 3.123 1.983 3.488 . 0 0 "[ . 1 . 2]" 1 2180 1 59 GLU H 1 59 GLU HG3 4.040 . 4.650 2.320 1.968 3.568 . 0 0 "[ . 1 . 2]" 1 2181 2 59 GLU H 2 59 GLU HG3 4.040 . 4.650 2.237 1.945 3.454 . 0 0 "[ . 1 . 2]" 1 2182 1 59 GLU H 1 59 GLU HB2 3.120 . 3.590 2.542 2.320 2.667 . 0 0 "[ . 1 . 2]" 1 2183 2 59 GLU H 2 59 GLU HB2 3.120 . 3.590 2.577 2.472 2.674 . 0 0 "[ . 1 . 2]" 1 2184 1 24 ARG H 1 44 TRP H 4.300 . 4.950 3.226 3.027 3.446 . 0 0 "[ . 1 . 2]" 1 2185 2 24 ARG H 2 44 TRP H 4.300 . 4.950 3.268 3.068 3.440 . 0 0 "[ . 1 . 2]" 1 2186 1 23 TRP HD1 1 24 ARG H 6.000 . 6.900 5.665 5.434 5.921 . 0 0 "[ . 1 . 2]" 1 2187 2 23 TRP HD1 2 24 ARG H 6.000 . 6.900 5.624 5.478 5.983 . 0 0 "[ . 1 . 2]" 1 2188 1 23 TRP HE3 1 24 ARG H 6.000 . 6.900 4.780 4.555 5.141 . 0 0 "[ . 1 . 2]" 1 2189 2 23 TRP HE3 2 24 ARG H 6.000 . 6.900 4.809 4.550 5.038 . 0 0 "[ . 1 . 2]" 1 2190 1 23 TRP HA 1 24 ARG H 3.560 . 4.090 2.168 2.128 2.214 . 0 0 "[ . 1 . 2]" 1 2191 2 23 TRP HA 2 24 ARG H 3.560 . 4.090 2.158 2.111 2.206 . 0 0 "[ . 1 . 2]" 1 2192 1 24 ARG H 1 24 ARG HD2 6.000 . 6.900 4.625 4.042 5.236 . 0 0 "[ . 1 . 2]" 1 2193 2 24 ARG H 2 24 ARG HD2 6.000 . 6.900 4.646 3.726 5.359 . 0 0 "[ . 1 . 2]" 1 2194 1 24 ARG H 1 24 ARG HD3 6.000 . 6.900 5.069 4.806 5.456 . 0 0 "[ . 1 . 2]" 1 2195 2 24 ARG H 2 24 ARG HD3 6.000 . 6.900 5.161 4.411 5.616 . 0 0 "[ . 1 . 2]" 1 2196 1 23 TRP HB3 1 24 ARG H 4.290 . 4.930 3.601 3.482 3.718 . 0 0 "[ . 1 . 2]" 1 2197 2 23 TRP HB3 2 24 ARG H 4.290 . 4.930 3.568 3.340 3.763 . 0 0 "[ . 1 . 2]" 1 2198 1 24 ARG H 1 44 TRP HB2 4.600 . 5.290 3.927 3.742 4.122 . 0 0 "[ . 1 . 2]" 1 2199 2 24 ARG H 2 44 TRP HB2 4.600 . 5.290 3.984 3.846 4.153 . 0 0 "[ . 1 . 2]" 1 2200 1 24 ARG H 1 45 SER HA 4.630 . 5.320 3.737 3.296 4.125 . 0 0 "[ . 1 . 2]" 1 2201 2 24 ARG H 2 45 SER HA 4.630 . 5.320 3.722 3.299 4.069 . 0 0 "[ . 1 . 2]" 1 2202 1 24 ARG H 1 24 ARG HG2 4.540 . 5.220 3.795 3.405 4.126 . 0 0 "[ . 1 . 2]" 1 2203 2 24 ARG H 2 24 ARG HG3 3.880 . 4.460 3.058 2.685 3.303 . 0 0 "[ . 1 . 2]" 1 2204 1 24 ARG H 1 24 ARG HG3 4.540 . 5.220 2.760 2.352 3.140 . 0 0 "[ . 1 . 2]" 1 2205 2 24 ARG H 2 24 ARG HG2 4.540 . 5.220 4.121 3.902 4.284 . 0 0 "[ . 1 . 2]" 1 2206 1 23 TRP H 1 24 ARG H 4.390 . 5.050 4.484 4.426 4.551 . 0 0 "[ . 1 . 2]" 1 2207 2 23 TRP H 2 24 ARG H 4.390 . 5.050 4.481 4.362 4.572 . 0 0 "[ . 1 . 2]" 1 2208 1 22 GLY H 1 23 TRP H 3.310 . 3.810 2.607 2.424 2.806 . 0 0 "[ . 1 . 2]" 1 2209 2 22 GLY H 2 23 TRP H 3.310 . 3.810 2.597 2.484 2.747 . 0 0 "[ . 1 . 2]" 1 2210 1 23 TRP H 1 23 TRP HD1 3.450 . 3.970 2.104 1.955 2.271 . 0 0 "[ . 1 . 2]" 1 2211 2 23 TRP H 2 23 TRP HD1 3.450 . 3.970 2.080 1.938 2.340 . 0 0 "[ . 1 . 2]" 1 2212 1 19 ASN HD22 1 23 TRP H 4.730 . 5.440 4.994 4.273 5.614 0.174 9 0 "[ . 1 . 2]" 1 2213 2 19 ASN HD22 2 23 TRP H 4.730 . 5.440 4.989 4.311 5.613 0.173 7 0 "[ . 1 . 2]" 1 2214 1 23 TRP H 1 23 TRP HB2 3.240 . 3.730 2.463 2.387 2.541 . 0 0 "[ . 1 . 2]" 1 2215 2 23 TRP H 2 23 TRP HB2 3.240 . 3.730 2.449 2.346 2.576 . 0 0 "[ . 1 . 2]" 1 2216 1 21 LYS HB2 1 23 TRP H 4.110 . 4.730 2.959 2.602 3.389 . 0 0 "[ . 1 . 2]" 1 2217 2 21 LYS HB2 2 23 TRP H 4.110 . 4.730 2.903 2.601 3.490 . 0 0 "[ . 1 . 2]" 1 2218 1 35 ALA H 1 36 GLU H 4.580 . 5.270 4.465 4.324 4.604 . 0 0 "[ . 1 . 2]" 1 2219 2 35 ALA H 2 36 GLU H 4.580 . 5.270 4.429 4.313 4.534 . 0 0 "[ . 1 . 2]" 1 2220 1 35 ALA HA 1 36 GLU H 2.770 . 3.190 2.603 2.314 2.789 . 0 0 "[ . 1 . 2]" 1 2221 2 35 ALA HA 2 36 GLU H 2.770 . 3.190 2.663 2.451 2.889 . 0 0 "[ . 1 . 2]" 1 2222 1 36 GLU H 1 37 PRO HD3 4.660 . 5.360 4.728 4.272 5.009 . 0 0 "[ . 1 . 2]" 1 2223 2 36 GLU H 2 37 PRO HD3 4.660 . 5.360 4.610 4.259 4.980 . 0 0 "[ . 1 . 2]" 1 2224 1 30 VAL H 1 38 LYS H 3.730 . 4.290 3.210 3.047 3.337 . 0 0 "[ . 1 . 2]" 1 2225 2 30 VAL H 2 38 LYS H 3.730 . 4.290 3.195 2.942 3.402 . 0 0 "[ . 1 . 2]" 1 2226 1 31 SER HA 1 38 LYS H 4.020 . 4.620 3.509 3.230 3.760 . 0 0 "[ . 1 . 2]" 1 2227 2 31 SER HA 2 38 LYS H 4.020 . 4.620 3.481 3.230 3.680 . 0 0 "[ . 1 . 2]" 1 2228 1 37 PRO HA 1 38 LYS H 3.300 . 3.800 2.200 2.174 2.258 . 0 0 "[ . 1 . 2]" 1 2229 2 37 PRO HA 2 38 LYS H 3.300 . 3.800 2.197 2.148 2.244 . 0 0 "[ . 1 . 2]" 1 2230 1 38 LYS H 1 38 LYS HB3 3.460 . 3.980 3.359 3.127 3.531 . 0 0 "[ . 1 . 2]" 1 2231 2 38 LYS H 2 38 LYS HB3 3.460 . 3.980 3.379 3.150 3.615 . 0 0 "[ . 1 . 2]" 1 2232 1 38 LYS H 1 38 LYS HG3 3.780 . 4.350 3.155 2.900 3.423 . 0 0 "[ . 1 . 2]" 1 2233 2 38 LYS H 2 38 LYS HG3 3.780 . 4.350 3.156 2.931 3.307 . 0 0 "[ . 1 . 2]" 1 2234 1 38 LYS H 1 56 THR MG 5.220 . 6.000 5.387 4.459 6.042 0.042 1 0 "[ . 1 . 2]" 1 2235 2 38 LYS H 2 56 THR MG 5.220 . 6.000 5.369 4.354 6.042 0.042 10 0 "[ . 1 . 2]" 1 2236 1 10 ILE MD 1 38 LYS H 5.720 . 6.580 5.823 5.436 6.350 . 0 0 "[ . 1 . 2]" 1 2237 2 10 ILE MD 2 38 LYS H 5.720 . 6.580 5.867 5.534 6.109 . 0 0 "[ . 1 . 2]" 1 2238 1 6 LYS H 1 7 PHE H 4.510 . 5.190 4.483 4.382 4.642 . 0 0 "[ . 1 . 2]" 1 2239 2 6 LYS H 2 7 PHE H 4.510 . 5.190 4.460 4.397 4.639 . 0 0 "[ . 1 . 2]" 1 2240 1 7 PHE H 1 8 GLU H 4.510 . 5.190 4.265 4.096 4.385 . 0 0 "[ . 1 . 2]" 1 2241 2 7 PHE H 2 8 GLU H 4.510 . 5.190 4.262 4.176 4.377 . 0 0 "[ . 1 . 2]" 1 2242 1 7 PHE H 1 32 TRP HE3 5.090 . 5.850 5.054 4.790 5.312 . 0 0 "[ . 1 . 2]" 1 2243 2 7 PHE H 2 32 TRP HE3 5.090 . 5.850 5.067 4.884 5.308 . 0 0 "[ . 1 . 2]" 1 2244 1 7 PHE H 1 7 PHE QE 4.940 . 5.680 4.272 4.074 4.476 . 0 0 "[ . 1 . 2]" 1 2245 2 7 PHE H 2 7 PHE HE1 4.940 . 5.680 4.488 4.267 4.668 . 0 0 "[ . 1 . 2]" 1 2246 1 7 PHE H 1 7 PHE QD 3.490 . 4.010 2.858 2.569 3.207 . 0 0 "[ . 1 . 2]" 1 2247 2 7 PHE H 2 7 PHE HD1 3.490 . 4.010 2.958 2.676 3.295 . 0 0 "[ . 1 . 2]" 1 2248 1 6 LYS HA 1 7 PHE H 2.630 . 3.020 2.332 2.209 2.469 . 0 0 "[ . 1 . 2]" 1 2249 2 6 LYS HA 2 7 PHE H 2.630 . 3.020 2.334 2.210 2.444 . 0 0 "[ . 1 . 2]" 1 2250 1 6 LYS HB3 1 7 PHE H 3.220 . 3.700 2.963 2.546 3.260 . 0 0 "[ . 1 . 2]" 1 2251 2 6 LYS HB3 2 7 PHE H 3.220 . 3.700 2.951 2.675 3.216 . 0 0 "[ . 1 . 2]" 1 2252 1 63 GLY H 1 65 LEU H 4.560 . 5.240 4.071 4.004 4.143 . 0 0 "[ . 1 . 2]" 1 2253 2 63 GLY H 2 65 LEU H 4.560 . 5.240 4.068 3.941 4.172 . 0 0 "[ . 1 . 2]" 1 2254 1 62 PHE HA 1 65 LEU H 4.180 . 4.810 3.209 3.093 3.454 . 0 0 "[ . 1 . 2]" 1 2255 2 62 PHE HA 2 65 LEU H 4.180 . 4.810 3.179 2.998 3.432 . 0 0 "[ . 1 . 2]" 1 2256 1 64 VAL HB 1 65 LEU H 3.940 . 4.530 2.734 2.595 2.852 . 0 0 "[ . 1 . 2]" 1 2257 2 64 VAL HB 2 65 LEU H 3.940 . 4.530 2.727 2.563 2.871 . 0 0 "[ . 1 . 2]" 1 2258 1 65 LEU H 1 65 LEU HB3 3.680 . 4.230 2.623 2.577 2.648 . 0 0 "[ . 1 . 2]" 1 2259 2 65 LEU H 2 65 LEU HB3 3.680 . 4.230 2.619 2.577 2.672 . 0 0 "[ . 1 . 2]" 1 2260 1 65 LEU H 1 65 LEU HB2 3.490 . 4.010 2.379 2.317 2.433 . 0 0 "[ . 1 . 2]" 1 2261 2 65 LEU H 2 65 LEU HB2 3.490 . 4.010 2.374 2.314 2.423 . 0 0 "[ . 1 . 2]" 1 2262 1 65 LEU H 1 65 LEU MD2 4.430 . 5.090 4.305 4.272 4.346 . 0 0 "[ . 1 . 2]" 1 2263 2 65 LEU H 2 65 LEU MD2 4.430 . 5.090 4.303 4.254 4.342 . 0 0 "[ . 1 . 2]" 1 2264 1 39 TYR H 1 57 LEU H 4.290 . 4.930 3.732 3.407 4.144 . 0 0 "[ . 1 . 2]" 1 2265 2 39 TYR H 2 57 LEU H 4.290 . 4.930 3.847 3.598 4.138 . 0 0 "[ . 1 . 2]" 1 2266 1 38 LYS HA 1 39 TYR H 3.550 . 4.080 2.500 2.394 2.567 . 0 0 "[ . 1 . 2]" 1 2267 2 38 LYS HA 2 39 TYR H 3.550 . 4.080 2.511 2.408 2.614 . 0 0 "[ . 1 . 2]" 1 2268 1 39 TYR H 1 39 TYR HB2 3.950 . 4.540 2.495 2.403 2.568 . 0 0 "[ . 1 . 2]" 1 2269 2 39 TYR H 2 39 TYR HB2 3.950 . 4.540 2.487 2.440 2.570 . 0 0 "[ . 1 . 2]" 1 2270 1 39 TYR H 1 39 TYR HB3 3.950 . 4.540 3.593 3.557 3.625 . 0 0 "[ . 1 . 2]" 1 2271 2 39 TYR H 2 39 TYR HB3 3.950 . 4.540 3.592 3.555 3.626 . 0 0 "[ . 1 . 2]" 1 2272 1 38 LYS HB2 1 39 TYR H 3.890 . 4.470 2.238 2.051 2.463 . 0 0 "[ . 1 . 2]" 1 2273 2 38 LYS HB2 2 39 TYR H 3.890 . 4.470 2.219 2.033 2.491 . 0 0 "[ . 1 . 2]" 1 2274 1 39 TYR H 1 56 THR MG 5.410 . 6.220 5.040 3.951 6.064 . 0 0 "[ . 1 . 2]" 1 2275 2 39 TYR H 2 56 THR MG 5.410 . 6.220 5.137 3.767 5.957 . 0 0 "[ . 1 . 2]" 1 2276 1 27 LEU QD 1 39 TYR H 5.410 . 6.220 5.307 5.081 5.562 . 0 0 "[ . 1 . 2]" 1 2277 2 27 LEU QD 2 39 TYR H 5.410 . 6.220 5.306 5.086 5.535 . 0 0 "[ . 1 . 2]" 1 2278 1 74 GLU H 1 75 HIS H 4.080 . 4.690 2.593 2.249 3.127 . 0 0 "[ . 1 . 2]" 1 2279 2 74 GLU H 2 75 HIS H 4.080 . 4.690 2.610 2.367 3.069 . 0 0 "[ . 1 . 2]" 1 2280 1 71 ASN HA 1 74 GLU H 4.460 . 5.130 4.046 3.400 4.958 . 0 0 "[ . 1 . 2]" 1 2281 2 71 ASN HA 2 74 GLU H 4.460 . 5.130 4.035 3.359 4.797 . 0 0 "[ . 1 . 2]" 1 2282 1 72 LYS HA 1 74 GLU H 3.790 . 4.360 3.675 2.740 4.407 0.047 9 0 "[ . 1 . 2]" 1 2283 2 72 LYS HA 2 74 GLU H 3.790 . 4.360 3.655 3.091 4.429 0.069 9 0 "[ . 1 . 2]" 1 2284 1 58 SER HB2 1 61 GLU H 3.140 . 3.610 2.737 2.357 3.638 0.028 6 0 "[ . 1 . 2]" 1 2285 2 58 SER HB2 2 61 GLU H 3.140 . 3.610 2.796 2.515 3.075 . 0 0 "[ . 1 . 2]" 1 2286 1 61 GLU H 1 61 GLU HG2 3.950 . 4.540 3.305 2.012 4.053 . 0 0 "[ . 1 . 2]" 1 2287 2 61 GLU H 2 61 GLU HG2 3.950 . 4.540 3.591 3.209 4.016 . 0 0 "[ . 1 . 2]" 1 2288 1 60 GLU HB2 1 61 GLU H 3.560 . 4.090 2.370 2.116 2.863 . 0 0 "[ . 1 . 2]" 1 2289 2 60 GLU HB2 2 61 GLU H 3.990 . 4.590 2.376 2.234 2.875 . 0 0 "[ . 1 . 2]" 1 2290 1 61 GLU H 1 61 GLU HG3 3.950 . 4.540 2.391 1.890 3.719 . 0 0 "[ . 1 . 2]" 1 2291 2 61 GLU H 2 61 GLU HG3 3.950 . 4.540 2.519 1.905 3.512 . 0 0 "[ . 1 . 2]" 1 2292 1 73 LEU HB2 1 74 GLU H 3.920 . 4.510 3.523 2.771 4.088 . 0 0 "[ . 1 . 2]" 1 2293 2 73 LEU HB2 2 74 GLU H 3.920 . 4.510 3.474 2.874 4.067 . 0 0 "[ . 1 . 2]" 1 2294 1 52 GLY H 1 53 LYS H 4.050 . 4.660 4.033 3.907 4.216 . 0 0 "[ . 1 . 2]" 1 2295 2 52 GLY H 2 53 LYS H 4.050 . 4.660 4.008 3.905 4.279 . 0 0 "[ . 1 . 2]" 1 2296 1 52 GLY HA2 1 53 LYS H 3.320 . 3.820 3.058 2.853 3.186 . 0 0 "[ . 1 . 2]" 1 2297 2 52 GLY HA2 2 53 LYS H 3.320 . 3.820 3.071 2.751 3.158 . 0 0 "[ . 1 . 2]" 1 2298 1 52 GLY HA3 1 53 LYS H 3.320 . 3.820 2.202 2.140 2.273 . 0 0 "[ . 1 . 2]" 1 2299 2 52 GLY HA3 2 53 LYS H 3.320 . 3.820 2.196 2.139 2.311 . 0 0 "[ . 1 . 2]" 1 2300 1 53 LYS H 1 53 LYS HB2 3.220 . 3.700 2.600 2.380 3.627 . 0 0 "[ . 1 . 2]" 1 2301 2 53 LYS H 2 53 LYS HB3 3.960 . 4.550 3.558 2.477 3.662 . 0 0 "[ . 1 . 2]" 1 2302 1 69 LEU H 1 69 LEU HG 3.420 . 3.930 2.635 2.565 2.778 . 0 0 "[ . 1 . 2]" 1 2303 2 69 LEU H 2 69 LEU HG 3.420 . 3.930 2.629 2.498 2.847 . 0 0 "[ . 1 . 2]" 1 2304 1 14 ILE MD 2 69 LEU H 3.740 . 4.300 2.895 2.495 3.245 . 0 0 "[ . 1 . 2]" 1 2305 1 69 LEU H 2 14 ILE MD 3.740 . 4.300 2.844 2.536 3.207 . 0 0 "[ . 1 . 2]" 1 2306 1 59 GLU H 1 60 GLU H 3.740 . 4.300 2.776 2.675 3.102 . 0 0 "[ . 1 . 2]" 1 2307 2 59 GLU H 2 60 GLU H 3.740 . 4.300 2.784 2.615 2.919 . 0 0 "[ . 1 . 2]" 1 2308 1 60 GLU H 1 61 GLU H 3.720 . 4.280 2.796 2.541 2.940 . 0 0 "[ . 1 . 2]" 1 2309 2 60 GLU H 2 61 GLU H 3.720 . 4.280 2.825 2.567 2.976 . 0 0 "[ . 1 . 2]" 1 2310 1 58 SER HB3 1 60 GLU H 3.810 . 4.380 3.204 2.996 3.912 . 0 0 "[ . 1 . 2]" 1 2311 2 58 SER HB3 2 60 GLU H 3.810 . 4.380 3.270 2.809 3.573 . 0 0 "[ . 1 . 2]" 1 2312 1 58 SER HB2 1 60 GLU H 3.720 . 4.280 3.232 2.798 3.900 . 0 0 "[ . 1 . 2]" 1 2313 2 58 SER HB2 2 60 GLU H 3.720 . 4.280 3.163 2.734 3.512 . 0 0 "[ . 1 . 2]" 1 2314 1 60 GLU H 1 63 GLY HA3 5.590 . 6.430 5.672 5.457 5.884 . 0 0 "[ . 1 . 2]" 1 2315 2 60 GLU H 2 63 GLY HA3 5.590 . 6.430 5.666 5.402 5.835 . 0 0 "[ . 1 . 2]" 1 2316 1 60 GLU H 1 60 GLU HG3 3.370 . 3.880 2.224 1.742 3.516 0.058 1 0 "[ . 1 . 2]" 1 2317 2 60 GLU H 2 60 GLU HG3 3.370 . 3.880 2.171 1.985 2.494 . 0 0 "[ . 1 . 2]" 1 2318 1 60 GLU H 1 61 GLU HB2 5.170 . 5.950 5.045 4.662 5.532 . 0 0 "[ . 1 . 2]" 1 2319 2 60 GLU H 2 61 GLU HB2 5.170 . 5.950 5.050 4.803 5.250 . 0 0 "[ . 1 . 2]" 1 2320 1 18 GLU H 1 19 ASN H 4.570 . 5.260 4.388 4.326 4.425 . 0 0 "[ . 1 . 2]" 1 2321 2 18 GLU H 2 19 ASN H 4.570 . 5.260 4.379 4.290 4.427 . 0 0 "[ . 1 . 2]" 1 2322 1 17 SER HA 1 18 GLU H 3.010 . 3.460 2.340 2.250 2.437 . 0 0 "[ . 1 . 2]" 1 2323 2 17 SER HA 2 18 GLU H 3.010 . 3.460 2.307 2.148 2.480 . 0 0 "[ . 1 . 2]" 1 2324 1 17 SER HB3 1 18 GLU H 4.000 . 4.600 3.598 3.407 3.831 . 0 0 "[ . 1 . 2]" 1 2325 2 17 SER HB3 2 18 GLU H 4.000 . 4.600 3.472 2.375 3.978 . 0 0 "[ . 1 . 2]" 1 2326 1 18 GLU H 1 18 GLU HG2 5.020 . 5.770 4.480 4.397 4.651 . 0 0 "[ . 1 . 2]" 1 2327 2 18 GLU H 2 18 GLU HG2 5.020 . 5.770 4.472 4.377 4.533 . 0 0 "[ . 1 . 2]" 1 2328 1 18 GLU H 1 18 GLU HB3 3.270 . 3.760 2.738 2.661 2.898 . 0 0 "[ . 1 . 2]" 1 2329 2 18 GLU H 2 18 GLU HB3 3.270 . 3.760 2.720 2.614 2.865 . 0 0 "[ . 1 . 2]" 1 2330 1 15 VAL MG1 1 18 GLU H 4.620 . 5.310 4.445 4.142 4.749 . 0 0 "[ . 1 . 2]" 1 2331 2 15 VAL MG1 2 18 GLU H 4.620 . 5.310 4.436 4.053 4.762 . 0 0 "[ . 1 . 2]" 1 2332 1 67 LYS H 1 68 GLU H 3.520 . 4.050 2.814 2.730 2.903 . 0 0 "[ . 1 . 2]" 1 2333 2 67 LYS H 2 68 GLU H 3.520 . 4.050 2.832 2.715 2.927 . 0 0 "[ . 1 . 2]" 1 2334 1 66 LEU H 1 67 LYS H 3.570 . 4.110 2.768 2.671 2.824 . 0 0 "[ . 1 . 2]" 1 2335 2 66 LEU H 2 67 LYS H 3.570 . 4.110 2.784 2.717 2.908 . 0 0 "[ . 1 . 2]" 1 2336 1 65 LEU H 1 67 LYS H 4.650 . 5.350 4.248 4.139 4.356 . 0 0 "[ . 1 . 2]" 1 2337 2 65 LEU H 2 67 LYS H 4.650 . 5.350 4.268 4.148 4.445 . 0 0 "[ . 1 . 2]" 1 2338 1 64 VAL HA 1 67 LYS H 3.750 . 4.310 3.602 3.439 3.757 . 0 0 "[ . 1 . 2]" 1 2339 2 64 VAL HA 2 67 LYS H 3.750 . 4.310 3.605 3.417 3.743 . 0 0 "[ . 1 . 2]" 1 2340 1 67 LYS H 1 67 LYS HB2 2.950 . 3.390 2.386 2.325 2.464 . 0 0 "[ . 1 . 2]" 1 2341 2 67 LYS H 2 67 LYS HB2 2.950 . 3.390 2.405 2.296 2.773 . 0 0 "[ . 1 . 2]" 1 2342 1 66 LEU HB3 1 67 LYS H 3.610 . 4.150 3.503 3.335 3.724 . 0 0 "[ . 1 . 2]" 1 2343 2 66 LEU HB3 2 67 LYS H 3.610 . 4.150 3.505 3.325 3.679 . 0 0 "[ . 1 . 2]" 1 2344 1 66 LEU HB2 1 67 LYS H 3.570 . 4.110 2.493 2.361 2.725 . 0 0 "[ . 1 . 2]" 1 2345 2 66 LEU HB2 2 67 LYS H 3.570 . 4.110 2.493 2.367 2.659 . 0 0 "[ . 1 . 2]" 1 2346 1 73 LEU MD1 2 67 LYS H 4.870 . 5.600 5.070 4.683 5.533 . 0 0 "[ . 1 . 2]" 1 2347 1 67 LYS H 2 73 LEU MD1 4.870 . 5.600 5.118 4.713 5.548 . 0 0 "[ . 1 . 2]" 1 2348 1 73 LEU MD2 2 67 LYS H 5.370 . 6.180 4.885 4.461 5.830 . 0 0 "[ . 1 . 2]" 1 2349 1 67 LYS H 2 73 LEU MD2 5.370 . 6.180 4.648 4.192 5.229 . 0 0 "[ . 1 . 2]" 1 2350 1 58 SER H 1 62 PHE H 4.570 . 5.260 3.752 3.290 4.183 . 0 0 "[ . 1 . 2]" 1 2351 2 58 SER H 2 62 PHE H 4.570 . 5.260 3.713 3.193 4.073 . 0 0 "[ . 1 . 2]" 1 2352 1 58 SER H 1 61 GLU H 4.350 . 5.000 3.562 3.198 4.212 . 0 0 "[ . 1 . 2]" 1 2353 2 58 SER H 2 61 GLU H 4.350 . 5.000 3.479 3.123 3.762 . 0 0 "[ . 1 . 2]" 1 2354 1 56 THR HB 1 58 SER H 5.390 . 6.200 5.717 5.035 6.277 0.077 6 0 "[ . 1 . 2]" 1 2355 2 56 THR HB 2 58 SER H 5.390 . 6.200 5.637 5.078 6.259 0.059 5 0 "[ . 1 . 2]" 1 2356 1 58 SER H 1 61 GLU HB3 4.000 . 4.600 3.796 3.538 4.087 . 0 0 "[ . 1 . 2]" 1 2357 2 58 SER H 2 61 GLU HB3 4.000 . 4.600 3.828 3.561 4.149 . 0 0 "[ . 1 . 2]" 1 2358 1 58 SER H 1 61 GLU HB2 3.720 . 4.280 2.361 1.995 2.903 . 0 0 "[ . 1 . 2]" 1 2359 2 58 SER H 2 61 GLU HB2 3.720 . 4.280 2.313 2.010 2.654 . 0 0 "[ . 1 . 2]" 1 2360 1 57 LEU HG 1 58 SER H 5.030 . 5.780 5.204 5.104 5.333 . 0 0 "[ . 1 . 2]" 1 2361 2 57 LEU HG 2 58 SER H 5.030 . 5.780 5.235 5.075 5.331 . 0 0 "[ . 1 . 2]" 1 2362 1 8 GLU H 1 34 ASP H 5.430 . 6.240 5.335 4.810 5.665 . 0 0 "[ . 1 . 2]" 1 2363 2 8 GLU H 2 34 ASP H 5.430 . 6.240 5.291 4.398 5.652 . 0 0 "[ . 1 . 2]" 1 2364 1 8 GLU H 1 31 SER H 4.070 . 4.680 2.676 2.466 2.954 . 0 0 "[ . 1 . 2]" 1 2365 2 8 GLU H 2 31 SER H 4.070 . 4.680 2.705 2.529 2.942 . 0 0 "[ . 1 . 2]" 1 2366 1 7 PHE QD 1 8 GLU H 4.040 . 4.650 4.282 3.877 4.624 . 0 0 "[ . 1 . 2]" 1 2367 2 7 PHE HD2 2 8 GLU H 4.040 . 4.650 4.388 3.883 4.690 0.040 16 0 "[ . 1 . 2]" 1 2368 1 7 PHE HA 1 8 GLU H 3.380 . 3.890 2.222 2.168 2.311 . 0 0 "[ . 1 . 2]" 1 2369 2 7 PHE HA 2 8 GLU H 3.380 . 3.890 2.219 2.172 2.307 . 0 0 "[ . 1 . 2]" 1 2370 1 8 GLU H 1 30 VAL HA 4.540 . 5.220 4.122 3.910 4.379 . 0 0 "[ . 1 . 2]" 1 2371 2 8 GLU H 2 30 VAL HA 4.540 . 5.220 4.132 3.999 4.518 . 0 0 "[ . 1 . 2]" 1 2372 1 7 PHE HB2 1 8 GLU H 3.960 . 4.550 3.180 2.774 3.557 . 0 0 "[ . 1 . 2]" 1 2373 2 7 PHE HB2 2 8 GLU H 3.960 . 4.550 3.156 2.714 3.444 . 0 0 "[ . 1 . 2]" 1 2374 1 8 GLU H 1 8 GLU HB3 3.110 . 3.580 2.768 2.630 3.116 . 0 0 "[ . 1 . 2]" 1 2375 2 8 GLU H 2 8 GLU HB3 3.110 . 3.580 2.780 2.595 2.898 . 0 0 "[ . 1 . 2]" 1 2376 1 8 GLU H 1 30 VAL MG1 3.620 . 4.160 2.297 1.854 2.607 . 0 0 "[ . 1 . 2]" 1 2377 2 8 GLU H 2 30 VAL MG1 3.620 . 4.160 2.303 2.083 2.867 . 0 0 "[ . 1 . 2]" 1 2378 1 71 ASN HA 1 73 LEU H 4.650 . 5.350 4.057 3.787 4.358 . 0 0 "[ . 1 . 2]" 1 2379 2 71 ASN HA 2 73 LEU H 4.650 . 5.350 4.063 3.843 4.469 . 0 0 "[ . 1 . 2]" 1 2380 1 72 LYS HB2 1 73 LEU H 3.450 . 3.970 3.244 2.807 3.927 . 0 0 "[ . 1 . 2]" 1 2381 2 72 LYS HB2 2 73 LEU H 3.450 . 3.970 3.192 2.585 3.488 . 0 0 "[ . 1 . 2]" 1 2382 1 73 LEU H 1 73 LEU HB2 3.120 . 3.590 2.460 2.382 2.619 . 0 0 "[ . 1 . 2]" 1 2383 2 73 LEU H 2 73 LEU HB2 3.120 . 3.590 2.449 2.390 2.638 . 0 0 "[ . 1 . 2]" 1 2384 1 73 LEU H 1 73 LEU MD1 4.030 . 4.630 3.911 3.733 4.111 . 0 0 "[ . 1 . 2]" 1 2385 2 73 LEU H 2 73 LEU MD1 4.030 . 4.630 3.875 3.769 4.131 . 0 0 "[ . 1 . 2]" 1 2386 1 69 LEU HA 1 71 ASN H 4.490 . 5.160 4.254 4.033 4.390 . 0 0 "[ . 1 . 2]" 1 2387 2 69 LEU HA 2 71 ASN H 4.490 . 5.160 4.229 3.956 4.362 . 0 0 "[ . 1 . 2]" 1 2388 1 14 ILE MD 2 71 ASN H 5.640 . 6.490 5.628 5.310 5.874 . 0 0 "[ . 1 . 2]" 1 2389 1 71 ASN H 2 14 ILE MD 5.640 . 6.490 5.568 5.384 5.817 . 0 0 "[ . 1 . 2]" 1 2390 1 71 ASN H 1 73 LEU MD1 6.000 . 6.900 5.372 5.139 5.720 . 0 0 "[ . 1 . 2]" 1 2391 2 71 ASN H 2 73 LEU MD1 6.000 . 6.900 5.318 5.063 5.819 . 0 0 "[ . 1 . 2]" 1 2392 1 10 ILE H 1 29 ARG H 4.500 . 5.180 4.544 4.289 4.690 . 0 0 "[ . 1 . 2]" 1 2393 2 10 ILE H 2 29 ARG H 4.500 . 5.180 4.463 4.054 4.595 . 0 0 "[ . 1 . 2]" 1 2394 1 29 ARG H 1 29 ARG HB2 3.910 . 4.500 2.586 2.417 2.913 . 0 0 "[ . 1 . 2]" 1 2395 2 29 ARG H 2 29 ARG HB2 3.910 . 4.500 2.567 2.441 3.089 . 0 0 "[ . 1 . 2]" 1 2396 1 29 ARG H 1 29 ARG HG3 4.680 . 5.380 3.161 2.745 4.588 . 0 0 "[ . 1 . 2]" 1 2397 2 29 ARG H 2 29 ARG HG3 4.680 . 5.380 3.103 2.783 4.716 . 0 0 "[ . 1 . 2]" 1 2398 1 9 ILE MG 1 29 ARG H 4.200 . 4.830 3.562 3.129 3.856 . 0 0 "[ . 1 . 2]" 1 2399 2 9 ILE MG 2 29 ARG H 4.200 . 4.830 3.517 3.033 3.816 . 0 0 "[ . 1 . 2]" 1 2400 1 74 GLU HB2 1 75 HIS H 5.160 . 5.930 3.236 2.282 4.487 . 0 0 "[ . 1 . 2]" 1 2401 2 74 GLU HB2 2 75 HIS H 5.160 . 5.930 3.085 2.026 4.202 . 0 0 "[ . 1 . 2]" 1 2402 1 74 GLU HB3 1 75 HIS H 5.160 . 5.930 3.895 3.062 4.470 . 0 0 "[ . 1 . 2]" 1 2403 2 74 GLU HB3 2 75 HIS H 5.160 . 5.930 3.788 2.915 4.522 . 0 0 "[ . 1 . 2]" 1 2404 1 50 LYS H 1 51 MET H 4.600 . 5.290 4.406 4.334 4.473 . 0 0 "[ . 1 . 2]" 1 2405 2 50 LYS H 2 51 MET H 4.600 . 5.290 4.381 4.251 4.435 . 0 0 "[ . 1 . 2]" 1 2406 1 45 SER H 1 50 LYS H 4.210 . 4.840 2.993 2.609 3.279 . 0 0 "[ . 1 . 2]" 1 2407 2 45 SER H 2 50 LYS H 4.210 . 4.840 3.135 2.814 3.385 . 0 0 "[ . 1 . 2]" 1 2408 1 49 GLU H 1 50 LYS H 3.490 . 4.010 2.276 2.007 2.674 . 0 0 "[ . 1 . 2]" 1 2409 2 49 GLU H 2 50 LYS H 3.490 . 4.010 2.226 1.947 2.633 . 0 0 "[ . 1 . 2]" 1 2410 1 45 SER HB2 1 50 LYS H 5.520 . 6.350 3.381 2.065 4.125 . 0 0 "[ . 1 . 2]" 1 2411 2 45 SER HB2 2 50 LYS H 5.520 . 6.350 3.431 2.211 4.316 . 0 0 "[ . 1 . 2]" 1 2412 1 45 SER HB3 1 50 LYS H 5.520 . 6.350 3.371 2.842 4.346 . 0 0 "[ . 1 . 2]" 1 2413 2 45 SER HB3 2 50 LYS H 5.520 . 6.350 3.515 2.864 4.360 . 0 0 "[ . 1 . 2]" 1 2414 1 49 GLU HB2 1 50 LYS H 4.240 . 4.880 4.115 3.918 4.286 . 0 0 "[ . 1 . 2]" 1 2415 2 49 GLU HB2 2 50 LYS H 4.240 . 4.880 4.146 3.976 4.385 . 0 0 "[ . 1 . 2]" 1 2416 1 49 GLU HB3 1 50 LYS H 4.580 . 5.270 4.219 4.097 4.428 . 0 0 "[ . 1 . 2]" 1 2417 2 49 GLU HB3 2 50 LYS H 4.580 . 5.270 4.238 4.076 4.537 . 0 0 "[ . 1 . 2]" 1 2418 1 50 LYS H 1 50 LYS HB2 3.360 . 3.860 2.653 2.474 2.883 . 0 0 "[ . 1 . 2]" 1 2419 2 50 LYS H 2 50 LYS HB2 3.360 . 3.860 2.612 2.497 2.866 . 0 0 "[ . 1 . 2]" 1 2420 1 11 GLU H 1 29 ARG H 3.790 . 4.360 3.146 3.000 3.271 . 0 0 "[ . 1 . 2]" 1 2421 2 11 GLU H 2 29 ARG H 3.790 . 4.360 3.083 2.964 3.245 . 0 0 "[ . 1 . 2]" 1 2422 1 11 GLU H 1 12 GLU H 4.400 . 5.060 4.275 4.240 4.300 . 0 0 "[ . 1 . 2]" 1 2423 2 11 GLU H 2 12 GLU H 4.400 . 5.060 4.275 4.204 4.327 . 0 0 "[ . 1 . 2]" 1 2424 1 10 ILE H 1 11 GLU H 3.510 . 4.040 2.320 2.213 2.392 . 0 0 "[ . 1 . 2]" 1 2425 2 10 ILE H 2 11 GLU H 3.510 . 4.040 2.305 2.131 2.392 . 0 0 "[ . 1 . 2]" 1 2426 1 9 ILE HA 1 11 GLU H 4.260 . 4.900 3.654 3.549 3.856 . 0 0 "[ . 1 . 2]" 1 2427 2 9 ILE HA 2 11 GLU H 4.260 . 4.900 3.691 3.525 3.940 . 0 0 "[ . 1 . 2]" 1 2428 1 10 ILE HB 1 11 GLU H 3.480 . 4.000 2.726 2.606 2.845 . 0 0 "[ . 1 . 2]" 1 2429 2 10 ILE HB 2 11 GLU H 3.480 . 4.000 2.737 2.609 2.870 . 0 0 "[ . 1 . 2]" 1 2430 1 10 ILE MD 1 11 GLU H 4.690 . 5.390 4.664 4.608 4.767 . 0 0 "[ . 1 . 2]" 1 2431 2 10 ILE MD 2 11 GLU H 4.690 . 5.390 4.654 4.551 4.714 . 0 0 "[ . 1 . 2]" 1 2432 1 23 TRP HH2 1 51 MET H 4.590 . 5.280 3.435 2.756 4.362 . 0 0 "[ . 1 . 2]" 1 2433 2 23 TRP HH2 2 51 MET H 4.590 . 5.280 3.554 3.013 4.120 . 0 0 "[ . 1 . 2]" 1 2434 1 50 LYS HA 1 51 MET H 3.050 . 3.510 2.304 2.116 2.544 . 0 0 "[ . 1 . 2]" 1 2435 2 50 LYS HA 2 51 MET H 3.050 . 3.510 2.242 2.135 2.514 . 0 0 "[ . 1 . 2]" 1 2436 1 50 LYS HD3 1 51 MET H 4.070 . 4.680 4.548 3.968 4.965 0.285 11 0 "[ . 1 . 2]" 1 2437 2 50 LYS HD3 2 51 MET H 4.070 . 4.680 4.451 3.861 4.845 0.165 1 0 "[ . 1 . 2]" 1 2438 1 41 ILE H 1 55 ILE H 4.030 . 4.630 3.079 2.829 3.492 . 0 0 "[ . 1 . 2]" 1 2439 2 41 ILE H 2 55 ILE H 4.030 . 4.630 3.158 2.952 3.375 . 0 0 "[ . 1 . 2]" 1 2440 1 55 ILE H 1 56 THR H 5.170 . 5.950 4.336 4.273 4.393 . 0 0 "[ . 1 . 2]" 1 2441 2 55 ILE H 2 56 THR H 5.170 . 5.950 4.331 4.271 4.375 . 0 0 "[ . 1 . 2]" 1 2442 1 55 ILE H 1 55 ILE HB 3.520 . 4.050 3.393 3.289 3.460 . 0 0 "[ . 1 . 2]" 1 2443 2 55 ILE H 2 55 ILE HB 3.520 . 4.050 3.384 3.246 3.486 . 0 0 "[ . 1 . 2]" 1 2444 1 41 ILE HG12 1 55 ILE H 4.650 . 5.350 4.596 4.348 4.785 . 0 0 "[ . 1 . 2]" 1 2445 2 41 ILE HG12 2 55 ILE H 4.650 . 5.350 4.614 4.386 4.759 . 0 0 "[ . 1 . 2]" 1 2446 1 55 ILE MD 2 55 ILE H 5.180 . 5.960 5.042 4.620 5.409 . 0 0 "[ . 1 . 2]" 1 2447 1 55 ILE H 2 55 ILE MD 5.180 . 5.960 4.986 4.179 5.380 . 0 0 "[ . 1 . 2]" 1 2448 1 41 ILE MG 1 55 ILE H 3.250 . 3.740 2.751 2.594 2.952 . 0 0 "[ . 1 . 2]" 1 2449 2 41 ILE MG 2 55 ILE H 3.250 . 3.740 2.841 2.711 2.961 . 0 0 "[ . 1 . 2]" 1 2450 1 44 TRP H 1 45 SER H 4.670 . 5.370 4.465 4.415 4.503 . 0 0 "[ . 1 . 2]" 1 2451 2 44 TRP H 2 45 SER H 4.670 . 5.370 4.463 4.437 4.493 . 0 0 "[ . 1 . 2]" 1 2452 1 44 TRP HE3 1 45 SER H 4.310 . 4.960 3.321 3.099 3.513 . 0 0 "[ . 1 . 2]" 1 2453 2 44 TRP HE3 2 45 SER H 4.310 . 4.960 3.328 3.144 3.590 . 0 0 "[ . 1 . 2]" 1 2454 1 44 TRP HA 1 45 SER H 3.470 . 3.990 2.384 2.281 2.505 . 0 0 "[ . 1 . 2]" 1 2455 2 44 TRP HA 2 45 SER H 3.470 . 3.990 2.361 2.280 2.472 . 0 0 "[ . 1 . 2]" 1 2456 1 44 TRP HB2 1 45 SER H 4.380 . 5.040 3.712 3.395 3.964 . 0 0 "[ . 1 . 2]" 1 2457 2 44 TRP HB2 2 45 SER H 4.380 . 5.040 3.757 3.575 3.981 . 0 0 "[ . 1 . 2]" 1 2458 1 45 SER H 1 50 LYS HB3 4.480 . 5.150 4.411 4.055 4.897 . 0 0 "[ . 1 . 2]" 1 2459 2 45 SER H 2 50 LYS HB3 4.480 . 5.150 4.395 3.965 4.919 . 0 0 "[ . 1 . 2]" 1 2460 1 45 SER H 1 50 LYS HB2 4.190 . 4.820 3.210 2.658 3.938 . 0 0 "[ . 1 . 2]" 1 2461 2 45 SER H 2 50 LYS HB2 4.190 . 4.820 3.265 2.805 3.841 . 0 0 "[ . 1 . 2]" 1 2462 1 64 VAL HA 1 68 GLU H 4.490 . 5.160 4.035 3.889 4.124 . 0 0 "[ . 1 . 2]" 1 2463 2 64 VAL HA 2 68 GLU H 4.490 . 5.160 4.019 3.914 4.175 . 0 0 "[ . 1 . 2]" 1 2464 1 14 ILE MG 2 68 GLU H 4.010 . 4.610 4.002 3.619 4.317 . 0 0 "[ . 1 . 2]" 1 2465 1 68 GLU H 2 14 ILE MG 4.010 . 4.610 3.948 3.696 4.194 . 0 0 "[ . 1 . 2]" 1 2466 1 68 GLU H 1 69 LEU MD1 5.390 . 6.200 5.560 5.421 5.659 . 0 0 "[ . 1 . 2]" 1 2467 2 68 GLU H 2 69 LEU MD1 5.390 . 6.200 5.586 5.424 5.723 . 0 0 "[ . 1 . 2]" 1 2468 1 63 GLY H 1 66 LEU H 5.160 . 5.930 4.766 4.704 4.831 . 0 0 "[ . 1 . 2]" 1 2469 2 63 GLY H 2 66 LEU H 5.160 . 5.930 4.779 4.703 4.908 . 0 0 "[ . 1 . 2]" 1 2470 1 66 LEU H 1 68 GLU H 5.530 . 6.360 4.502 4.347 4.582 . 0 0 "[ . 1 . 2]" 1 2471 2 66 LEU H 2 68 GLU H 5.530 . 6.360 4.534 4.433 4.597 . 0 0 "[ . 1 . 2]" 1 2472 1 65 LEU H 1 66 LEU H 3.730 . 4.290 2.822 2.756 2.895 . 0 0 "[ . 1 . 2]" 1 2473 2 65 LEU H 2 66 LEU H 3.730 . 4.290 2.846 2.796 2.917 . 0 0 "[ . 1 . 2]" 1 2474 1 62 PHE HA 1 66 LEU H 4.080 . 4.690 4.104 3.971 4.192 . 0 0 "[ . 1 . 2]" 1 2475 2 62 PHE HA 2 66 LEU H 4.080 . 4.690 4.080 3.979 4.160 . 0 0 "[ . 1 . 2]" 1 2476 1 65 LEU HB3 1 66 LEU H 3.750 . 4.310 2.382 2.270 2.456 . 0 0 "[ . 1 . 2]" 1 2477 2 65 LEU HB3 2 66 LEU H 3.750 . 4.310 2.372 2.302 2.437 . 0 0 "[ . 1 . 2]" 1 2478 1 66 LEU H 1 66 LEU HB3 3.600 . 4.140 3.582 3.531 3.604 . 0 0 "[ . 1 . 2]" 1 2479 2 66 LEU H 2 66 LEU HB3 3.600 . 4.140 3.592 3.573 3.620 . 0 0 "[ . 1 . 2]" 1 2480 1 66 LEU H 1 66 LEU HG 3.210 . 3.690 2.280 2.203 2.400 . 0 0 "[ . 1 . 2]" 1 2481 2 66 LEU H 2 66 LEU HG 3.210 . 3.690 2.273 2.187 2.342 . 0 0 "[ . 1 . 2]" 1 2482 1 55 ILE HA 1 56 THR H 3.270 . 3.760 2.225 2.174 2.294 . 0 0 "[ . 1 . 2]" 1 2483 2 55 ILE HA 2 56 THR H 3.270 . 3.760 2.246 2.212 2.280 . 0 0 "[ . 1 . 2]" 1 2484 1 55 ILE HG13 1 56 THR H 3.250 . 3.740 2.586 2.471 2.690 . 0 0 "[ . 1 . 2]" 1 2485 2 55 ILE HG13 2 56 THR H 3.250 . 3.740 2.584 2.506 2.718 . 0 0 "[ . 1 . 2]" 1 2486 1 55 ILE HG12 1 56 THR H 3.430 . 3.940 2.495 2.230 2.769 . 0 0 "[ . 1 . 2]" 1 2487 2 55 ILE HG12 2 56 THR H 3.430 . 3.940 2.446 2.311 2.742 . 0 0 "[ . 1 . 2]" 1 2488 1 55 ILE MD 1 56 THR H 3.820 . 4.390 3.938 3.774 4.108 . 0 0 "[ . 1 . 2]" 1 2489 2 55 ILE MD 2 56 THR H 3.820 . 4.390 3.915 3.832 4.112 . 0 0 "[ . 1 . 2]" 1 2490 1 21 LYS H 1 23 TRP H 4.040 . 4.650 3.954 3.527 4.263 . 0 0 "[ . 1 . 2]" 1 2491 2 21 LYS H 2 23 TRP H 4.040 . 4.650 3.920 3.431 4.219 . 0 0 "[ . 1 . 2]" 1 2492 1 21 LYS H 1 21 LYS HE2 6.000 . 6.900 4.916 3.600 6.041 . 0 0 "[ . 1 . 2]" 1 2493 2 21 LYS H 2 21 LYS HE2 6.000 . 6.900 5.231 3.810 6.154 . 0 0 "[ . 1 . 2]" 1 2494 1 21 LYS H 1 21 LYS HE3 6.000 . 6.900 5.298 3.821 6.080 . 0 0 "[ . 1 . 2]" 1 2495 2 21 LYS H 2 21 LYS HE3 6.000 . 6.900 4.908 4.007 5.786 . 0 0 "[ . 1 . 2]" 1 2496 1 21 LYS H 1 21 LYS HB3 3.800 . 4.370 3.640 3.584 3.701 . 0 0 "[ . 1 . 2]" 1 2497 2 21 LYS H 2 21 LYS HB3 3.800 . 4.370 3.645 3.608 3.735 . 0 0 "[ . 1 . 2]" 1 2498 1 21 LYS H 1 21 LYS HB2 3.410 . 3.920 2.560 2.341 2.727 . 0 0 "[ . 1 . 2]" 1 2499 2 21 LYS H 2 21 LYS HB2 3.410 . 3.920 2.567 2.440 2.756 . 0 0 "[ . 1 . 2]" 1 2500 1 20 ALA MB 1 21 LYS H 3.090 . 3.550 2.634 2.356 3.059 . 0 0 "[ . 1 . 2]" 1 2501 2 20 ALA MB 2 21 LYS H 3.090 . 3.550 2.695 2.343 3.055 . 0 0 "[ . 1 . 2]" 1 2502 1 14 ILE H 1 27 LEU H 3.980 . 4.580 3.291 3.091 3.485 . 0 0 "[ . 1 . 2]" 1 2503 2 14 ILE H 2 27 LEU H 3.980 . 4.580 3.304 3.167 3.467 . 0 0 "[ . 1 . 2]" 1 2504 1 13 LEU H 1 14 ILE H 3.660 . 4.210 2.396 2.271 2.518 . 0 0 "[ . 1 . 2]" 1 2505 2 13 LEU H 2 14 ILE H 3.660 . 4.210 2.420 2.284 2.531 . 0 0 "[ . 1 . 2]" 1 2506 1 14 ILE H 1 28 ASN HA 4.650 . 5.350 3.946 3.789 4.101 . 0 0 "[ . 1 . 2]" 1 2507 2 14 ILE H 2 28 ASN HA 4.650 . 5.350 3.954 3.870 4.044 . 0 0 "[ . 1 . 2]" 1 2508 1 12 GLU HA 1 14 ILE H 4.620 . 5.310 4.478 4.367 4.664 . 0 0 "[ . 1 . 2]" 1 2509 2 12 GLU HA 2 14 ILE H 4.620 . 5.310 4.470 4.375 4.558 . 0 0 "[ . 1 . 2]" 1 2510 1 13 LEU HB3 1 14 ILE H 3.860 . 4.440 3.380 3.258 3.456 . 0 0 "[ . 1 . 2]" 1 2511 2 13 LEU HB3 2 14 ILE H 3.860 . 4.440 3.375 3.272 3.472 . 0 0 "[ . 1 . 2]" 1 2512 1 14 ILE H 1 27 LEU HB3 4.080 . 4.690 2.962 2.699 3.162 . 0 0 "[ . 1 . 2]" 1 2513 2 14 ILE H 2 27 LEU HB3 4.080 . 4.690 2.963 2.780 3.242 . 0 0 "[ . 1 . 2]" 1 2514 1 14 ILE H 1 14 ILE HB 3.610 . 4.150 2.954 2.901 3.013 . 0 0 "[ . 1 . 2]" 1 2515 2 14 ILE H 2 14 ILE HB 3.610 . 4.150 2.954 2.892 3.030 . 0 0 "[ . 1 . 2]" 1 2516 1 14 ILE H 1 15 VAL MG2 4.700 . 5.400 4.512 4.318 4.599 . 0 0 "[ . 1 . 2]" 1 2517 2 14 ILE H 2 15 VAL MG2 4.700 . 5.400 4.474 4.333 4.726 . 0 0 "[ . 1 . 2]" 1 2518 1 14 ILE H 1 14 ILE MG 4.030 . 4.630 4.018 4.000 4.038 . 0 0 "[ . 1 . 2]" 1 2519 2 14 ILE H 2 14 ILE MG 4.030 . 4.630 4.017 3.993 4.046 . 0 0 "[ . 1 . 2]" 1 2520 1 43 THR H 1 52 GLY H 4.680 . 5.380 3.648 3.248 4.491 . 0 0 "[ . 1 . 2]" 1 2521 2 43 THR H 2 52 GLY H 4.680 . 5.380 3.735 3.349 4.107 . 0 0 "[ . 1 . 2]" 1 2522 1 34 ASP H 1 34 ASP HB2 3.420 . 3.930 3.326 2.935 3.710 . 0 0 "[ . 1 . 2]" 1 2523 2 34 ASP H 2 34 ASP HB2 3.420 . 3.930 3.281 2.971 3.621 . 0 0 "[ . 1 . 2]" 1 2524 1 6 LYS HB3 1 34 ASP H 4.890 . 5.620 4.619 4.057 5.257 . 0 0 "[ . 1 . 2]" 1 2525 2 6 LYS HB3 2 34 ASP H 4.890 . 5.620 4.540 3.982 5.216 . 0 0 "[ . 1 . 2]" 1 2526 1 34 ASP H 1 35 ALA MB 4.490 . 5.160 4.477 4.406 4.556 . 0 0 "[ . 1 . 2]" 1 2527 2 34 ASP H 2 35 ALA MB 4.490 . 5.160 4.494 4.415 4.603 . 0 0 "[ . 1 . 2]" 1 2528 1 45 SER H 1 48 HIS H 3.810 . 4.380 3.728 3.484 4.060 . 0 0 "[ . 1 . 2]" 1 2529 2 45 SER H 2 48 HIS H 3.810 . 4.380 3.749 3.568 3.950 . 0 0 "[ . 1 . 2]" 1 2530 1 48 HIS H 1 49 GLU H 3.810 . 4.380 2.757 2.631 2.944 . 0 0 "[ . 1 . 2]" 1 2531 2 48 HIS H 2 49 GLU H 3.810 . 4.380 2.770 2.638 2.881 . 0 0 "[ . 1 . 2]" 1 2532 1 46 PRO HA 1 48 HIS H 4.360 . 5.010 3.942 3.656 4.148 . 0 0 "[ . 1 . 2]" 1 2533 2 46 PRO HA 2 48 HIS H 4.360 . 5.010 3.932 3.797 4.108 . 0 0 "[ . 1 . 2]" 1 2534 1 44 TRP HB3 1 48 HIS H 4.450 . 5.120 3.841 3.559 4.270 . 0 0 "[ . 1 . 2]" 1 2535 2 44 TRP HB3 2 48 HIS H 4.450 . 5.120 3.928 3.600 4.440 . 0 0 "[ . 1 . 2]" 1 2536 1 46 PRO HG2 1 48 HIS H 5.110 . 5.880 5.162 4.661 5.975 0.095 18 0 "[ . 1 . 2]" 1 2537 2 46 PRO HG2 2 48 HIS H 5.110 . 5.880 5.057 4.760 5.954 0.074 12 0 "[ . 1 . 2]" 1 2538 1 23 TRP HZ3 1 52 GLY H 4.390 . 5.050 3.676 3.300 4.238 . 0 0 "[ . 1 . 2]" 1 2539 2 23 TRP HZ3 2 52 GLY H 4.390 . 5.050 3.520 3.190 3.851 . 0 0 "[ . 1 . 2]" 1 2540 1 51 MET HA 1 52 GLY H 3.490 . 4.010 2.451 2.387 2.518 . 0 0 "[ . 1 . 2]" 1 2541 2 51 MET HA 2 52 GLY H 3.490 . 4.010 2.440 2.394 2.507 . 0 0 "[ . 1 . 2]" 1 2542 1 51 MET HB3 1 52 GLY H 4.150 . 4.770 3.774 3.660 3.856 . 0 0 "[ . 1 . 2]" 1 2543 2 51 MET HB3 2 52 GLY H 4.150 . 4.770 3.793 3.658 3.878 . 0 0 "[ . 1 . 2]" 1 2544 1 51 MET HB2 1 52 GLY H 4.070 . 4.680 2.430 2.281 2.607 . 0 0 "[ . 1 . 2]" 1 2545 2 51 MET HB2 2 52 GLY H 4.070 . 4.680 2.450 2.266 2.544 . 0 0 "[ . 1 . 2]" 1 2546 1 54 GLY H 1 55 ILE H 4.530 . 5.210 4.324 4.296 4.391 . 0 0 "[ . 1 . 2]" 1 2547 2 54 GLY H 2 55 ILE H 4.530 . 5.210 4.309 4.265 4.352 . 0 0 "[ . 1 . 2]" 1 2548 1 53 LYS H 1 54 GLY H 4.780 . 5.500 4.509 4.261 4.612 . 0 0 "[ . 1 . 2]" 1 2549 2 53 LYS H 2 54 GLY H 4.780 . 5.500 4.515 4.460 4.622 . 0 0 "[ . 1 . 2]" 1 2550 1 53 LYS HA 1 54 GLY H 3.140 . 3.610 2.180 2.116 2.293 . 0 0 "[ . 1 . 2]" 1 2551 2 53 LYS HA 2 54 GLY H 3.140 . 3.610 2.204 2.147 2.292 . 0 0 "[ . 1 . 2]" 1 2552 1 53 LYS HB3 1 54 GLY H 3.660 . 4.210 3.575 3.357 4.219 0.009 6 0 "[ . 1 . 2]" 1 2553 1 55 ILE MD 2 54 GLY H 5.370 . 6.180 5.404 4.859 5.914 . 0 0 "[ . 1 . 2]" 1 2554 1 54 GLY H 2 55 ILE MD 5.370 . 6.180 5.388 4.689 5.947 . 0 0 "[ . 1 . 2]" 1 2555 1 21 LYS H 1 22 GLY H 3.180 . 3.660 2.443 2.019 2.761 . 0 0 "[ . 1 . 2]" 1 2556 2 21 LYS H 2 22 GLY H 3.180 . 3.660 2.405 2.124 2.720 . 0 0 "[ . 1 . 2]" 1 2557 1 22 GLY H 1 23 TRP HD1 4.480 . 5.150 4.030 3.660 4.430 . 0 0 "[ . 1 . 2]" 1 2558 2 22 GLY H 2 23 TRP HD1 4.480 . 5.150 3.998 3.738 4.296 . 0 0 "[ . 1 . 2]" 1 2559 1 22 GLY H 1 23 TRP HB2 4.890 . 5.620 4.417 4.255 4.601 . 0 0 "[ . 1 . 2]" 1 2560 2 22 GLY H 2 23 TRP HB2 4.890 . 5.620 4.405 4.303 4.551 . 0 0 "[ . 1 . 2]" 1 2561 1 18 GLU HG2 1 22 GLY H 4.610 . 5.300 4.278 3.933 4.659 . 0 0 "[ . 1 . 2]" 1 2562 2 18 GLU HG2 2 22 GLY H 4.610 . 5.300 4.354 3.819 4.665 . 0 0 "[ . 1 . 2]" 1 2563 1 21 LYS HB2 1 22 GLY H 3.850 . 4.430 3.314 3.010 3.640 . 0 0 "[ . 1 . 2]" 1 2564 2 21 LYS HB2 2 22 GLY H 3.850 . 4.430 3.286 3.057 3.735 . 0 0 "[ . 1 . 2]" 1 2565 1 16 LEU H 1 17 SER H 3.480 . 4.000 2.224 2.128 2.300 . 0 0 "[ . 1 . 2]" 1 2566 2 16 LEU H 2 17 SER H 3.480 . 4.000 2.208 2.120 2.315 . 0 0 "[ . 1 . 2]" 1 2567 1 17 SER H 1 18 GLU H 4.450 . 5.120 4.262 4.214 4.305 . 0 0 "[ . 1 . 2]" 1 2568 2 17 SER H 2 18 GLU H 4.450 . 5.120 4.233 4.106 4.319 . 0 0 "[ . 1 . 2]" 1 2569 1 17 SER H 1 24 ARG HB3 4.500 . 5.180 4.253 4.021 4.535 . 0 0 "[ . 1 . 2]" 1 2570 2 17 SER H 2 24 ARG HB3 4.500 . 5.180 4.260 3.806 4.806 . 0 0 "[ . 1 . 2]" 1 2571 1 16 LEU HB2 1 17 SER H 3.480 . 4.000 2.990 2.870 3.080 . 0 0 "[ . 1 . 2]" 1 2572 2 16 LEU HB2 2 17 SER H 3.480 . 4.000 2.992 2.828 3.137 . 0 0 "[ . 1 . 2]" 1 2573 1 16 LEU HB3 1 17 SER H 3.850 . 4.430 4.000 3.933 4.070 . 0 0 "[ . 1 . 2]" 1 2574 2 16 LEU HB3 2 17 SER H 3.850 . 4.430 4.019 3.923 4.124 . 0 0 "[ . 1 . 2]" 1 2575 1 15 VAL MG1 1 17 SER H 3.130 . 3.600 2.443 2.305 2.616 . 0 0 "[ . 1 . 2]" 1 2576 2 15 VAL MG1 2 17 SER H 3.130 . 3.600 2.435 2.186 2.698 . 0 0 "[ . 1 . 2]" 1 2577 1 69 LEU H 1 70 GLY H 3.550 . 4.080 2.600 2.439 2.744 . 0 0 "[ . 1 . 2]" 1 2578 2 69 LEU H 2 70 GLY H 3.550 . 4.080 2.583 2.385 2.735 . 0 0 "[ . 1 . 2]" 1 2579 1 66 LEU HA 1 70 GLY H 4.520 . 5.200 4.009 3.847 4.214 . 0 0 "[ . 1 . 2]" 1 2580 2 66 LEU HA 2 70 GLY H 4.520 . 5.200 3.993 3.756 4.167 . 0 0 "[ . 1 . 2]" 1 2581 1 69 LEU HB3 1 70 GLY H 3.680 . 4.230 3.556 3.472 3.634 . 0 0 "[ . 1 . 2]" 1 2582 2 69 LEU HB3 2 70 GLY H 3.680 . 4.230 3.573 3.437 3.756 . 0 0 "[ . 1 . 2]" 1 2583 1 69 LEU HB2 1 70 GLY H 3.920 . 4.510 2.652 2.557 2.741 . 0 0 "[ . 1 . 2]" 1 2584 2 69 LEU HB2 2 70 GLY H 3.920 . 4.510 2.655 2.538 2.893 . 0 0 "[ . 1 . 2]" 1 2585 1 70 GLY H 1 73 LEU MD1 4.150 . 4.770 4.356 4.113 4.701 . 0 0 "[ . 1 . 2]" 1 2586 2 70 GLY H 2 73 LEU MD1 4.150 . 4.770 4.331 3.981 4.669 . 0 0 "[ . 1 . 2]" 1 2587 1 69 LEU MD1 1 70 GLY H 4.210 . 4.840 4.635 4.560 4.703 . 0 0 "[ . 1 . 2]" 1 2588 2 69 LEU MD1 2 70 GLY H 4.210 . 4.840 4.643 4.516 4.863 0.023 7 0 "[ . 1 . 2]" 1 2589 1 62 PHE H 1 63 GLY H 3.670 . 4.220 2.713 2.657 2.768 . 0 0 "[ . 1 . 2]" 1 2590 2 62 PHE H 2 63 GLY H 3.670 . 4.220 2.718 2.650 2.794 . 0 0 "[ . 1 . 2]" 1 2591 1 61 GLU H 1 63 GLY H 4.510 . 5.190 3.933 3.702 4.268 . 0 0 "[ . 1 . 2]" 1 2592 2 61 GLU H 2 63 GLY H 4.510 . 5.190 3.971 3.641 4.359 . 0 0 "[ . 1 . 2]" 1 2593 1 62 PHE HD2 1 63 GLY H 4.290 . 4.930 3.943 3.796 4.224 . 0 0 "[ . 1 . 2]" 1 2594 2 62 PHE HD2 2 63 GLY H 4.290 . 4.930 3.934 3.783 4.066 . 0 0 "[ . 1 . 2]" 1 2595 1 60 GLU HA 1 63 GLY H 4.120 . 4.740 3.846 3.348 4.284 . 0 0 "[ . 1 . 2]" 1 2596 2 60 GLU HA 2 63 GLY H 4.120 . 4.740 3.818 3.313 3.997 . 0 0 "[ . 1 . 2]" 1 2597 1 62 PHE HB2 1 63 GLY H 4.000 . 4.600 3.958 3.798 4.028 . 0 0 "[ . 1 . 2]" 1 2598 2 62 PHE HB2 2 63 GLY H 4.000 . 4.600 3.977 3.886 4.061 . 0 0 "[ . 1 . 2]" 1 2599 1 62 PHE HB3 1 63 GLY H 4.000 . 4.600 2.742 2.547 2.841 . 0 0 "[ . 1 . 2]" 1 2600 2 62 PHE HB3 2 63 GLY H 4.000 . 4.600 2.762 2.621 2.832 . 0 0 "[ . 1 . 2]" 1 2601 1 59 GLU HB3 1 63 GLY H 5.320 . 6.120 5.024 4.739 5.213 . 0 0 "[ . 1 . 2]" 1 2602 2 59 GLU HB3 2 63 GLY H 5.320 . 6.120 5.024 4.665 5.266 . 0 0 "[ . 1 . 2]" 1 2603 1 63 GLY H 1 64 VAL HB 5.820 . 6.690 4.957 4.862 5.087 . 0 0 "[ . 1 . 2]" 1 2604 2 63 GLY H 2 64 VAL HB 5.820 . 6.690 4.968 4.879 5.141 . 0 0 "[ . 1 . 2]" 1 2605 1 63 GLY H 1 64 VAL MG2 5.380 . 6.190 4.339 4.157 4.547 . 0 0 "[ . 1 . 2]" 1 2606 2 63 GLY H 2 64 VAL MG2 5.380 . 6.190 4.313 4.172 4.457 . 0 0 "[ . 1 . 2]" 1 2607 1 63 GLY H 1 66 LEU HG 5.670 . 6.520 4.761 4.595 4.934 . 0 0 "[ . 1 . 2]" 1 2608 2 63 GLY H 2 66 LEU HG 5.670 . 6.520 4.814 4.619 5.014 . 0 0 "[ . 1 . 2]" 1 2609 1 16 LEU MD2 2 63 GLY H 5.540 . 6.370 5.417 5.249 5.505 . 0 0 "[ . 1 . 2]" 1 2610 1 63 GLY H 2 16 LEU MD2 5.540 . 6.370 5.410 5.214 5.795 . 0 0 "[ . 1 . 2]" 1 2611 1 63 GLY H 1 66 LEU MD1 4.520 . 5.200 4.460 4.078 4.688 . 0 0 "[ . 1 . 2]" 1 2612 2 63 GLY H 2 66 LEU MD1 4.520 . 5.200 4.474 4.164 4.828 . 0 0 "[ . 1 . 2]" 1 2613 1 10 ILE H 1 31 SER H 4.520 . 5.200 3.773 3.623 3.857 . 0 0 "[ . 1 . 2]" 1 2614 2 10 ILE H 2 31 SER H 4.520 . 5.200 3.806 3.577 4.081 . 0 0 "[ . 1 . 2]" 1 2615 1 8 GLU HA 1 31 SER H 5.300 . 6.100 4.772 4.620 4.934 . 0 0 "[ . 1 . 2]" 1 2616 2 8 GLU HA 2 31 SER H 5.300 . 6.100 4.790 4.663 4.903 . 0 0 "[ . 1 . 2]" 1 2617 1 31 SER H 1 37 PRO HA 5.630 . 6.470 4.364 4.083 4.668 . 0 0 "[ . 1 . 2]" 1 2618 2 31 SER H 2 37 PRO HA 5.630 . 6.470 4.300 3.936 4.523 . 0 0 "[ . 1 . 2]" 1 2619 1 42 ARG H 1 43 THR H 4.610 . 5.300 4.441 4.330 4.493 . 0 0 "[ . 1 . 2]" 1 2620 2 42 ARG H 2 43 THR H 4.610 . 5.300 4.453 4.412 4.489 . 0 0 "[ . 1 . 2]" 1 2621 1 41 ILE HG13 1 42 ARG H 4.290 . 4.930 3.202 2.922 3.474 . 0 0 "[ . 1 . 2]" 1 2622 2 41 ILE HG13 2 42 ARG H 4.290 . 4.930 3.216 2.959 3.440 . 0 0 "[ . 1 . 2]" 1 2623 1 27 LEU HB2 1 42 ARG H 5.100 . 5.870 5.332 5.160 5.537 . 0 0 "[ . 1 . 2]" 1 2624 2 27 LEU HB2 2 42 ARG H 5.100 . 5.870 5.357 5.150 5.785 . 0 0 "[ . 1 . 2]" 1 2625 1 41 ILE MG 1 42 ARG H 4.240 . 4.880 4.206 4.066 4.294 . 0 0 "[ . 1 . 2]" 1 2626 2 41 ILE MG 2 42 ARG H 4.240 . 4.880 4.215 4.099 4.277 . 0 0 "[ . 1 . 2]" 1 2627 1 72 LYS H 1 73 LEU H 3.270 . 3.760 3.076 2.948 3.174 . 0 0 "[ . 1 . 2]" 1 2628 2 72 LYS H 2 73 LEU H 3.270 . 3.760 3.063 2.894 3.189 . 0 0 "[ . 1 . 2]" 1 2629 1 71 ASN HB2 1 72 LYS H 3.560 . 4.090 2.199 2.026 3.334 . 0 0 "[ . 1 . 2]" 1 2630 2 71 ASN HB2 2 72 LYS H 3.560 . 4.090 2.159 2.026 2.306 . 0 0 "[ . 1 . 2]" 1 2631 1 72 LYS H 1 72 LYS HB2 3.070 . 3.530 2.703 2.513 3.662 0.132 6 0 "[ . 1 . 2]" 1 2632 2 72 LYS H 2 72 LYS HB2 3.070 . 3.530 2.627 2.562 2.754 . 0 0 "[ . 1 . 2]" 1 2633 1 14 ILE MD 2 72 LYS H 4.890 . 5.620 5.122 4.708 5.472 . 0 0 "[ . 1 . 2]" 1 2634 1 72 LYS H 2 14 ILE MD 4.890 . 5.620 5.039 4.731 5.270 . 0 0 "[ . 1 . 2]" 1 2635 1 61 GLU H 1 62 PHE H 3.790 . 4.360 2.702 2.524 2.923 . 0 0 "[ . 1 . 2]" 1 2636 2 61 GLU H 2 62 PHE H 3.790 . 4.360 2.727 2.549 2.912 . 0 0 "[ . 1 . 2]" 1 2637 1 62 PHE H 1 62 PHE HB3 4.130 . 4.750 2.551 2.471 2.746 . 0 0 "[ . 1 . 2]" 1 2638 2 62 PHE H 2 62 PHE HB3 4.130 . 4.750 2.552 2.480 2.641 . 0 0 "[ . 1 . 2]" 1 2639 1 61 GLU HB2 1 62 PHE H 3.830 . 4.400 2.341 2.229 2.523 . 0 0 "[ . 1 . 2]" 1 2640 2 61 GLU HB2 2 62 PHE H 3.830 . 4.400 2.370 2.243 2.513 . 0 0 "[ . 1 . 2]" 1 2641 1 16 LEU MD2 2 62 PHE H 4.170 . 4.800 4.727 4.470 4.872 0.072 2 0 "[ . 1 . 2]" 1 2642 1 62 PHE H 2 16 LEU MD2 4.170 . 4.800 4.775 4.594 5.000 0.200 6 0 "[ . 1 . 2]" 1 2643 1 62 PHE H 1 65 LEU MD2 5.850 . 6.730 5.373 5.170 5.532 . 0 0 "[ . 1 . 2]" 1 2644 2 62 PHE H 2 65 LEU MD2 5.850 . 6.730 5.325 5.062 5.536 . 0 0 "[ . 1 . 2]" 1 2645 1 62 PHE H 1 66 LEU MD1 6.000 . 6.900 6.127 5.854 6.260 . 0 0 "[ . 1 . 2]" 1 2646 2 62 PHE H 2 66 LEU MD1 6.000 . 6.900 6.142 5.935 6.392 . 0 0 "[ . 1 . 2]" 1 2647 1 19 ASN HD21 1 23 TRP HB2 3.760 . 4.320 2.466 1.882 4.244 . 0 0 "[ . 1 . 2]" 1 2648 2 19 ASN HD21 2 23 TRP HB2 3.760 . 4.320 2.510 1.940 4.334 0.014 7 0 "[ . 1 . 2]" 1 2649 1 19 ASN HD21 1 21 LYS HG2 4.600 . 5.290 4.490 3.083 5.403 0.113 8 0 "[ . 1 . 2]" 1 2650 2 19 ASN HD21 2 21 LYS HG2 4.600 . 5.290 4.226 2.932 5.324 0.034 7 0 "[ . 1 . 2]" 1 2651 1 13 LEU HB2 1 14 ILE H 3.880 . 4.460 2.250 2.190 2.300 . 0 0 "[ . 1 . 2]" 1 2652 2 13 LEU HB2 2 14 ILE H 3.880 . 4.460 2.260 2.200 2.318 . 0 0 "[ . 1 . 2]" 1 2653 1 13 LEU H 1 29 ARG H 4.530 . 5.210 4.163 3.821 4.770 . 0 0 "[ . 1 . 2]" 1 2654 2 13 LEU H 2 29 ARG H 4.530 . 5.210 4.190 3.946 4.798 . 0 0 "[ . 1 . 2]" 1 2655 1 19 ASN HD22 1 23 TRP HB2 4.480 . 5.150 3.804 3.433 4.695 . 0 0 "[ . 1 . 2]" 1 2656 2 19 ASN HD22 2 23 TRP HB2 4.480 . 5.150 3.869 3.594 4.662 . 0 0 "[ . 1 . 2]" 1 2657 1 19 ASN HD22 1 21 LYS HG2 4.720 . 5.430 3.643 2.594 4.259 . 0 0 "[ . 1 . 2]" 1 2658 2 19 ASN HD22 2 21 LYS HG2 4.720 . 5.430 3.401 2.266 4.118 . 0 0 "[ . 1 . 2]" 1 2659 1 32 TRP H 1 32 TRP HE1 5.430 . 6.240 5.333 5.010 5.520 . 0 0 "[ . 1 . 2]" 1 2660 2 32 TRP H 2 32 TRP HE1 5.430 . 6.240 5.337 5.183 5.552 . 0 0 "[ . 1 . 2]" 1 2661 1 30 VAL HB 1 32 TRP HE1 3.970 . 4.570 2.947 2.504 3.421 . 0 0 "[ . 1 . 2]" 1 2662 2 30 VAL HB 2 32 TRP HE1 3.970 . 4.570 2.901 2.554 3.214 . 0 0 "[ . 1 . 2]" 1 2663 1 30 VAL MG2 1 32 TRP HE1 4.890 . 5.620 4.052 3.373 4.488 . 0 0 "[ . 1 . 2]" 1 2664 2 30 VAL MG2 2 32 TRP HE1 4.890 . 5.620 4.042 3.528 4.489 . 0 0 "[ . 1 . 2]" 1 2665 1 23 TRP H 1 23 TRP HE1 4.400 . 5.060 4.589 4.458 4.726 . 0 0 "[ . 1 . 2]" 1 2666 2 23 TRP H 2 23 TRP HE1 4.400 . 5.060 4.569 4.441 4.809 . 0 0 "[ . 1 . 2]" 1 2667 1 23 TRP HE1 1 46 PRO HD3 5.230 . 6.010 5.272 4.278 6.050 0.040 6 0 "[ . 1 . 2]" 1 2668 2 23 TRP HE1 2 46 PRO HD3 5.230 . 6.010 5.245 4.443 6.094 0.084 16 0 "[ . 1 . 2]" 1 2669 1 21 LYS HB3 1 23 TRP HE1 4.270 . 4.910 3.630 3.174 4.415 . 0 0 "[ . 1 . 2]" 1 2670 2 21 LYS HB3 2 23 TRP HE1 4.270 . 4.910 3.573 3.153 4.009 . 0 0 "[ . 1 . 2]" 1 2671 1 21 LYS HB2 1 23 TRP HE1 4.110 . 4.730 4.055 3.532 4.434 . 0 0 "[ . 1 . 2]" 1 2672 2 21 LYS HB2 2 23 TRP HE1 4.110 . 4.730 4.096 3.572 4.513 . 0 0 "[ . 1 . 2]" 1 2673 1 23 TRP HE1 1 50 LYS HB2 4.760 . 5.470 4.981 4.528 5.448 . 0 0 "[ . 1 . 2]" 1 2674 2 23 TRP HE1 2 50 LYS HB2 4.760 . 5.470 4.941 4.406 5.390 . 0 0 "[ . 1 . 2]" 1 2675 1 26 GLU H 1 44 TRP HE1 5.240 . 6.030 5.272 4.920 5.758 . 0 0 "[ . 1 . 2]" 1 2676 2 26 GLU H 2 44 TRP HE1 5.240 . 6.030 5.360 5.015 5.721 . 0 0 "[ . 1 . 2]" 1 2677 1 28 ASN H 1 44 TRP HE1 5.460 . 6.280 4.595 4.129 5.052 . 0 0 "[ . 1 . 2]" 1 2678 2 28 ASN H 2 44 TRP HE1 5.460 . 6.280 4.619 4.376 5.260 . 0 0 "[ . 1 . 2]" 1 2679 1 28 ASN HD21 1 44 TRP HE1 4.370 . 5.030 3.268 2.664 4.164 . 0 0 "[ . 1 . 2]" 1 2680 2 28 ASN HD21 2 44 TRP HE1 4.370 . 5.030 3.362 2.279 3.926 . 0 0 "[ . 1 . 2]" 1 2681 1 28 ASN HD22 1 44 TRP HE1 4.370 . 5.030 1.978 1.706 2.652 0.094 10 0 "[ . 1 . 2]" 1 2682 2 28 ASN HD22 2 44 TRP HE1 4.370 . 5.030 1.966 1.743 2.311 0.057 20 0 "[ . 1 . 2]" 1 2683 1 33 ASN HB3 1 33 ASN HD21 3.450 . 3.970 3.016 2.270 3.516 . 0 0 "[ . 1 . 2]" 1 2684 2 33 ASN HB3 2 33 ASN HD21 3.450 . 3.970 2.954 2.268 3.508 . 0 0 "[ . 1 . 2]" 1 2685 1 33 ASN HB2 1 33 ASN HD21 3.350 . 3.850 2.317 2.153 2.862 . 0 0 "[ . 1 . 2]" 1 2686 2 33 ASN HB2 2 33 ASN HD21 3.350 . 3.850 2.298 2.160 2.924 . 0 0 "[ . 1 . 2]" 1 2687 1 33 ASN HB2 1 33 ASN HD22 3.540 . 4.070 3.521 3.457 3.748 . 0 0 "[ . 1 . 2]" 1 2688 2 33 ASN HB2 2 33 ASN HD22 3.540 . 4.070 3.514 3.437 3.767 . 0 0 "[ . 1 . 2]" 1 2689 1 5 LEU QB 1 33 ASN HD22 5.010 . 5.760 3.204 1.814 4.432 . 0 0 "[ . 1 . 2]" 1 2690 2 5 LEU HB2 2 33 ASN HD22 5.010 . 5.760 4.690 3.796 5.673 . 0 0 "[ . 1 . 2]" 1 2691 1 5 LEU HG 1 33 ASN HD22 5.420 . 6.230 4.389 4.049 5.145 . 0 0 "[ . 1 . 2]" 1 2692 2 5 LEU HG 2 33 ASN HD22 5.420 . 6.230 4.385 3.880 4.934 . 0 0 "[ . 1 . 2]" 1 2693 1 5 LEU QB 1 33 ASN HD21 4.300 . 4.950 4.104 3.321 4.638 . 0 0 "[ . 1 . 2]" 1 2694 2 5 LEU HB3 2 33 ASN HD21 4.300 . 4.950 4.371 3.333 4.722 . 0 0 "[ . 1 . 2]" 1 2695 1 5 LEU HA 1 33 ASN HD21 4.280 . 4.920 3.963 3.043 4.795 . 0 0 "[ . 1 . 2]" 1 2696 2 5 LEU HA 2 33 ASN HD21 4.280 . 4.920 3.880 2.946 4.618 . 0 0 "[ . 1 . 2]" 1 2697 1 5 LEU MD1 1 33 ASN HD21 3.980 . 4.580 4.383 3.786 4.741 0.161 5 0 "[ . 1 . 2]" 1 2698 2 5 LEU MD1 2 33 ASN HD21 3.980 . 4.580 4.526 3.851 4.866 0.286 14 0 "[ . 1 . 2]" 1 2699 1 71 ASN HB2 1 71 ASN HD22 3.960 . 4.550 3.492 3.468 3.511 . 0 0 "[ . 1 . 2]" 1 2700 2 71 ASN HB2 2 71 ASN HD22 3.960 . 4.550 3.498 3.473 3.517 . 0 0 "[ . 1 . 2]" 1 2701 1 68 GLU HA 1 71 ASN HD22 4.290 . 4.930 3.047 2.637 4.846 . 0 0 "[ . 1 . 2]" 1 2702 2 68 GLU HA 2 71 ASN HD22 4.290 . 4.930 3.008 2.687 3.674 . 0 0 "[ . 1 . 2]" 1 2703 1 68 GLU HA 1 71 ASN HD21 4.280 . 4.920 2.030 1.852 3.237 . 0 0 "[ . 1 . 2]" 1 2704 2 68 GLU HA 2 71 ASN HD21 4.280 . 4.920 1.983 1.677 2.279 0.123 17 0 "[ . 1 . 2]" 1 2705 1 70 GLY H 1 71 ASN H 3.680 . 4.230 2.694 2.609 2.774 . 0 0 "[ . 1 . 2]" 1 2706 2 70 GLY H 2 71 ASN H 3.680 . 4.230 2.705 2.628 2.810 . 0 0 "[ . 1 . 2]" 1 2707 1 21 LYS HA 1 22 GLY H 3.560 . 4.090 3.349 3.224 3.439 . 0 0 "[ . 1 . 2]" 1 2708 2 21 LYS HA 2 22 GLY H 3.560 . 4.090 3.356 3.214 3.442 . 0 0 "[ . 1 . 2]" 1 2709 1 18 GLU HG3 1 22 GLY H 4.610 . 5.300 4.809 4.586 5.218 . 0 0 "[ . 1 . 2]" 1 2710 2 18 GLU HG3 2 22 GLY H 4.610 . 5.300 4.826 4.449 5.193 . 0 0 "[ . 1 . 2]" 1 2711 1 33 ASN HA 1 34 ASP H 3.230 . 3.710 2.754 2.682 2.811 . 0 0 "[ . 1 . 2]" 1 2712 2 33 ASN HA 2 34 ASP H 3.230 . 3.710 2.765 2.639 2.855 . 0 0 "[ . 1 . 2]" 1 2713 1 66 LEU H 1 67 LYS HB2 5.060 . 5.820 4.770 4.628 4.878 . 0 0 "[ . 1 . 2]" 1 2714 2 66 LEU H 2 67 LYS HB2 5.060 . 5.820 4.804 4.578 5.369 . 0 0 "[ . 1 . 2]" 1 2715 1 73 LEU H 1 73 LEU HG 3.110 . 3.580 2.687 2.425 3.017 . 0 0 "[ . 1 . 2]" 1 2716 2 73 LEU H 2 73 LEU HG 3.110 . 3.580 2.652 2.407 3.064 . 0 0 "[ . 1 . 2]" 1 2717 1 59 GLU HB2 1 60 GLU H 3.160 . 3.630 2.706 2.460 2.948 . 0 0 "[ . 1 . 2]" 1 2718 2 59 GLU HB2 2 60 GLU H 3.160 . 3.630 2.710 2.458 3.005 . 0 0 "[ . 1 . 2]" 1 2719 1 32 TRP H 1 32 TRP HB3 3.930 . 4.520 3.683 3.614 3.722 . 0 0 "[ . 1 . 2]" 1 2720 2 32 TRP H 2 32 TRP HB3 3.930 . 4.520 3.675 3.634 3.711 . 0 0 "[ . 1 . 2]" 1 2721 1 9 ILE H 1 10 ILE H 4.670 . 5.370 4.286 4.206 4.362 . 0 0 "[ . 1 . 2]" 1 2722 2 9 ILE H 2 10 ILE H 4.670 . 5.370 4.313 4.209 4.404 . 0 0 "[ . 1 . 2]" 1 2723 1 8 GLU H 1 9 ILE H 4.410 . 5.070 4.196 4.084 4.301 . 0 0 "[ . 1 . 2]" 1 2724 2 8 GLU H 2 9 ILE H 4.410 . 5.070 4.200 4.100 4.303 . 0 0 "[ . 1 . 2]" 1 2725 1 8 GLU HG2 1 9 ILE H 3.850 . 4.430 3.175 2.670 3.491 . 0 0 "[ . 1 . 2]" 1 2726 2 8 GLU HG2 2 9 ILE H 3.850 . 4.430 3.186 2.787 4.121 . 0 0 "[ . 1 . 2]" 1 2727 1 6 LYS H 1 6 LYS HD2 3.890 . 4.470 3.955 3.142 4.307 . 0 0 "[ . 1 . 2]" 1 2728 2 6 LYS H 2 6 LYS HD2 3.890 . 4.470 4.103 3.195 4.334 . 0 0 "[ . 1 . 2]" 1 2729 1 18 GLU HG3 1 19 ASN H 3.710 . 4.270 2.870 2.611 3.084 . 0 0 "[ . 1 . 2]" 1 2730 2 18 GLU HG3 2 19 ASN H 3.710 . 4.270 2.879 2.532 3.310 . 0 0 "[ . 1 . 2]" 1 2731 1 19 ASN H 1 23 TRP HA 4.700 . 5.400 4.348 4.253 4.456 . 0 0 "[ . 1 . 2]" 1 2732 2 19 ASN H 2 23 TRP HA 4.700 . 5.400 4.328 4.221 4.481 . 0 0 "[ . 1 . 2]" 1 2733 1 64 VAL H 1 65 LEU HB2 5.100 . 5.870 4.912 4.826 4.989 . 0 0 "[ . 1 . 2]" 1 2734 2 64 VAL H 2 65 LEU HB2 5.100 . 5.870 4.910 4.839 4.984 . 0 0 "[ . 1 . 2]" 1 2735 1 13 LEU HB2 1 28 ASN H 4.570 . 5.260 4.534 4.274 4.740 . 0 0 "[ . 1 . 2]" 1 2736 2 13 LEU HB2 2 28 ASN H 4.570 . 5.260 4.530 4.255 4.771 . 0 0 "[ . 1 . 2]" 1 2737 1 9 ILE MD 1 44 TRP HE1 4.610 . 5.300 4.336 3.162 5.262 . 0 0 "[ . 1 . 2]" 1 2738 2 9 ILE MD 2 44 TRP HE1 4.610 . 5.300 4.369 3.316 4.995 . 0 0 "[ . 1 . 2]" 1 2739 1 31 SER H 1 32 TRP H 4.540 . 5.220 4.315 4.172 4.390 . 0 0 "[ . 1 . 2]" 1 2740 2 31 SER H 2 32 TRP H 4.540 . 5.220 4.329 4.250 4.386 . 0 0 "[ . 1 . 2]" 1 2741 1 30 VAL MG1 1 32 TRP H 4.690 . 5.390 3.882 3.587 4.161 . 0 0 "[ . 1 . 2]" 1 2742 2 30 VAL MG1 2 32 TRP H 4.690 . 5.390 3.883 3.390 4.211 . 0 0 "[ . 1 . 2]" 1 2743 1 30 VAL H 1 40 ASP H 4.290 . 4.930 3.873 3.456 4.051 . 0 0 "[ . 1 . 2]" 1 2744 2 30 VAL H 2 40 ASP H 4.290 . 4.930 3.838 3.630 4.057 . 0 0 "[ . 1 . 2]" 1 2745 1 32 TRP H 1 33 ASN H 4.390 . 5.050 4.292 4.244 4.372 . 0 0 "[ . 1 . 2]" 1 2746 2 32 TRP H 2 33 ASN H 4.390 . 5.050 4.300 4.213 4.449 . 0 0 "[ . 1 . 2]" 1 2747 1 8 GLU H 1 33 ASN H 4.960 . 5.700 4.903 4.584 5.189 . 0 0 "[ . 1 . 2]" 1 2748 2 8 GLU H 2 33 ASN H 4.960 . 5.700 4.869 4.618 5.330 . 0 0 "[ . 1 . 2]" 1 2749 1 26 GLU H 1 27 LEU H 4.560 . 5.240 4.396 4.349 4.446 . 0 0 "[ . 1 . 2]" 1 2750 2 26 GLU H 2 27 LEU H 4.560 . 5.240 4.390 4.327 4.434 . 0 0 "[ . 1 . 2]" 1 2751 1 41 ILE H 1 55 ILE HA 4.950 . 5.690 4.980 4.847 5.137 . 0 0 "[ . 1 . 2]" 1 2752 2 41 ILE H 2 55 ILE HA 4.950 . 5.690 5.048 4.941 5.164 . 0 0 "[ . 1 . 2]" 1 2753 1 40 ASP HB2 1 41 ILE H 4.600 . 5.290 4.214 3.902 4.434 . 0 0 "[ . 1 . 2]" 1 2754 2 40 ASP HB2 2 41 ILE H 4.600 . 5.290 4.258 4.075 4.394 . 0 0 "[ . 1 . 2]" 1 2755 1 26 GLU H 1 26 GLU HG2 4.460 . 5.130 2.691 2.135 4.391 . 0 0 "[ . 1 . 2]" 1 2756 2 26 GLU H 2 26 GLU HG2 4.460 . 5.130 2.392 2.183 3.771 . 0 0 "[ . 1 . 2]" 1 2757 1 5 LEU H 1 33 ASN HD22 4.950 . 5.690 5.036 4.223 5.798 0.108 13 0 "[ . 1 . 2]" 1 2758 2 5 LEU H 2 33 ASN HD22 4.950 . 5.690 4.997 4.127 5.621 . 0 0 "[ . 1 . 2]" 1 2759 1 6 LYS H 1 33 ASN HB2 4.500 . 5.180 4.332 3.426 5.165 . 0 0 "[ . 1 . 2]" 1 2760 2 6 LYS H 2 33 ASN HB2 4.500 . 5.180 4.293 2.445 5.073 . 0 0 "[ . 1 . 2]" 1 2761 1 28 ASN H 1 41 ILE HA 4.300 . 4.950 3.472 3.289 3.670 . 0 0 "[ . 1 . 2]" 1 2762 2 28 ASN H 2 41 ILE HA 4.300 . 4.950 3.498 3.307 3.687 . 0 0 "[ . 1 . 2]" 1 2763 1 30 VAL H 1 31 SER H 4.530 . 5.210 4.428 4.372 4.466 . 0 0 "[ . 1 . 2]" 1 2764 2 30 VAL H 2 31 SER H 4.530 . 5.210 4.423 4.398 4.467 . 0 0 "[ . 1 . 2]" 1 2765 1 19 ASN H 1 22 GLY H 4.280 . 4.920 3.521 3.375 3.677 . 0 0 "[ . 1 . 2]" 1 2766 2 19 ASN H 2 22 GLY H 4.280 . 4.920 3.480 3.346 3.646 . 0 0 "[ . 1 . 2]" 1 2767 1 19 ASN H 1 21 LYS H 5.540 . 6.370 5.127 4.633 5.602 . 0 0 "[ . 1 . 2]" 1 2768 2 19 ASN H 2 21 LYS H 5.540 . 6.370 5.040 4.637 5.450 . 0 0 "[ . 1 . 2]" 1 2769 1 19 ASN H 1 23 TRP HD1 5.830 . 6.700 5.610 5.432 5.744 . 0 0 "[ . 1 . 2]" 1 2770 2 19 ASN H 2 23 TRP HD1 5.830 . 6.700 5.570 5.395 5.722 . 0 0 "[ . 1 . 2]" 1 2771 1 27 LEU HB3 1 28 ASN H 4.630 . 5.320 4.329 4.293 4.379 . 0 0 "[ . 1 . 2]" 1 2772 2 27 LEU HB3 2 28 ASN H 4.630 . 5.320 4.325 4.275 4.395 . 0 0 "[ . 1 . 2]" 1 2773 1 64 VAL H 1 67 LYS HD3 4.440 . 5.110 3.910 3.663 4.061 . 0 0 "[ . 1 . 2]" 1 2774 2 64 VAL H 2 67 LYS HD3 4.440 . 5.110 3.903 3.629 4.701 . 0 0 "[ . 1 . 2]" 1 2775 1 39 TYR HA 1 57 LEU H 4.900 . 5.640 4.837 4.620 4.993 . 0 0 "[ . 1 . 2]" 1 2776 2 39 TYR HA 2 57 LEU H 4.900 . 5.640 4.933 4.749 5.013 . 0 0 "[ . 1 . 2]" 1 2777 1 39 TYR HB2 1 57 LEU H 4.630 . 5.320 3.450 2.992 3.901 . 0 0 "[ . 1 . 2]" 1 2778 2 39 TYR HB2 2 57 LEU H 4.630 . 5.320 3.632 3.243 3.906 . 0 0 "[ . 1 . 2]" 1 2779 1 39 TYR HB3 1 57 LEU H 4.630 . 5.320 4.623 4.132 4.996 . 0 0 "[ . 1 . 2]" 1 2780 2 39 TYR HB3 2 57 LEU H 4.630 . 5.320 4.766 4.390 4.976 . 0 0 "[ . 1 . 2]" 1 2781 1 16 LEU H 1 27 LEU H 4.720 . 5.430 4.060 3.799 4.337 . 0 0 "[ . 1 . 2]" 1 2782 2 16 LEU H 2 27 LEU H 4.720 . 5.430 4.164 3.817 4.541 . 0 0 "[ . 1 . 2]" 1 2783 1 13 LEU H 1 28 ASN H 4.570 . 5.260 4.527 4.426 4.656 . 0 0 "[ . 1 . 2]" 1 2784 2 13 LEU H 2 28 ASN H 4.570 . 5.260 4.505 4.385 4.621 . 0 0 "[ . 1 . 2]" 1 2785 1 41 ILE H 1 42 ARG H 4.550 . 5.230 4.039 3.867 4.176 . 0 0 "[ . 1 . 2]" 1 2786 2 41 ILE H 2 42 ARG H 4.550 . 5.230 4.044 3.924 4.206 . 0 0 "[ . 1 . 2]" 1 2787 1 33 ASN H 1 35 ALA H 4.430 . 5.090 4.246 4.152 4.347 . 0 0 "[ . 1 . 2]" 1 2788 2 33 ASN H 2 35 ALA H 4.430 . 5.090 4.231 4.120 4.368 . 0 0 "[ . 1 . 2]" 1 2789 1 10 ILE HB 1 31 SER H 5.370 . 6.180 4.763 4.497 5.068 . 0 0 "[ . 1 . 2]" 1 2790 2 10 ILE HB 2 31 SER H 5.370 . 6.180 4.781 4.308 5.158 . 0 0 "[ . 1 . 2]" 1 2791 1 6 LYS HD2 1 7 PHE H 4.190 . 4.820 4.228 3.809 4.497 . 0 0 "[ . 1 . 2]" 1 2792 2 6 LYS HD2 2 7 PHE H 4.190 . 4.820 4.142 3.880 4.390 . 0 0 "[ . 1 . 2]" 1 2793 1 53 LYS H 1 53 LYS HB3 3.960 . 4.550 3.555 2.494 3.643 . 0 0 "[ . 1 . 2]" 1 2794 2 53 LYS H 2 53 LYS HB2 3.960 . 4.550 2.613 2.390 3.627 . 0 0 "[ . 1 . 2]" 1 2795 1 68 GLU HB3 1 69 LEU H 4.220 . 4.850 3.939 3.741 4.123 . 0 0 "[ . 1 . 2]" 1 2796 2 68 GLU HB3 2 69 LEU H 4.220 . 4.850 3.924 3.686 4.097 . 0 0 "[ . 1 . 2]" 1 2797 1 68 GLU H 1 68 GLU HB2 3.530 . 4.060 2.504 2.398 2.617 . 0 0 "[ . 1 . 2]" 1 2798 2 68 GLU H 2 68 GLU HB2 3.530 . 4.060 2.510 2.349 2.649 . 0 0 "[ . 1 . 2]" 1 2799 1 66 LEU H 1 66 LEU HB2 3.240 . 3.730 2.484 2.390 2.545 . 0 0 "[ . 1 . 2]" 1 2800 2 66 LEU H 2 66 LEU HB2 3.240 . 3.730 2.498 2.440 2.553 . 0 0 "[ . 1 . 2]" 1 2801 1 21 LYS H 1 21 LYS HG2 3.110 . 3.580 2.340 1.969 2.732 . 0 0 "[ . 1 . 2]" 1 2802 2 21 LYS H 2 21 LYS HG2 3.110 . 3.580 2.321 2.086 2.664 . 0 0 "[ . 1 . 2]" 1 2803 1 63 GLY HA2 1 66 LEU H 3.940 . 4.530 3.485 3.366 3.671 . 0 0 "[ . 1 . 2]" 1 2804 2 63 GLY HA2 2 66 LEU H 3.940 . 4.530 3.515 3.362 3.702 . 0 0 "[ . 1 . 2]" 1 2805 1 41 ILE MG 2 55 ILE MD 3.940 . 4.530 4.293 3.746 4.568 0.038 1 0 "[ . 1 . 2]" 1 2806 1 55 ILE MD 2 41 ILE MG 3.940 . 4.530 4.377 3.764 4.576 0.046 14 0 "[ . 1 . 2]" 1 2807 1 41 ILE MD 2 55 ILE MD 4.070 . 4.680 3.629 3.309 3.960 . 0 0 "[ . 1 . 2]" 1 2808 1 55 ILE MD 2 41 ILE MD 4.070 . 4.680 3.661 3.062 4.035 . 0 0 "[ . 1 . 2]" 1 2809 1 16 LEU MD2 2 65 LEU MD2 3.870 . 4.450 3.515 3.367 3.644 . 0 0 "[ . 1 . 2]" 1 2810 1 65 LEU MD2 2 16 LEU MD2 3.870 . 4.450 3.552 3.475 3.657 . 0 0 "[ . 1 . 2]" 1 2811 1 14 ILE MG 2 64 VAL MG2 4.290 . 4.930 4.494 4.251 4.636 . 0 0 "[ . 1 . 2]" 1 2812 1 64 VAL MG2 2 14 ILE MG 4.290 . 4.930 4.545 4.235 4.787 . 0 0 "[ . 1 . 2]" 1 2813 1 16 LEU MD2 2 65 LEU MD1 3.510 . 4.040 1.998 1.909 2.113 . 0 0 "[ . 1 . 2]" 1 2814 1 65 LEU MD1 2 16 LEU MD2 3.510 . 4.040 2.024 1.954 2.137 . 0 0 "[ . 1 . 2]" 1 2815 1 69 LEU MD1 2 69 LEU MD2 3.870 . 4.450 4.031 3.715 4.139 . 0 0 "[ . 1 . 2]" 1 2816 1 69 LEU MD2 2 69 LEU MD1 3.870 . 4.450 4.023 3.745 4.134 . 0 0 "[ . 1 . 2]" 1 2817 1 66 LEU MD2 2 69 LEU MD2 3.890 . 4.470 1.832 1.789 1.912 0.011 9 0 "[ . 1 . 2]" 1 2818 1 69 LEU MD2 2 66 LEU MD2 3.890 . 4.470 1.864 1.794 1.943 0.006 8 0 "[ . 1 . 2]" 1 2819 1 64 VAL MG1 2 16 LEU MD2 3.700 . 4.260 2.579 2.262 2.761 . 0 0 "[ . 1 . 2]" 1 2820 1 16 LEU MD2 2 64 VAL MG1 3.700 . 4.260 2.658 2.367 2.966 . 0 0 "[ . 1 . 2]" 1 2821 1 69 LEU MD1 2 66 LEU MD2 3.890 . 4.470 2.137 1.929 2.488 . 0 0 "[ . 1 . 2]" 1 2822 1 66 LEU MD2 2 69 LEU MD1 3.890 . 4.470 2.086 1.859 2.474 . 0 0 "[ . 1 . 2]" 1 2823 1 66 LEU MD1 2 73 LEU MD1 4.320 . 4.970 4.157 3.215 4.574 . 0 0 "[ . 1 . 2]" 1 2824 1 73 LEU MD1 2 66 LEU MD1 4.320 . 4.970 3.986 2.909 4.613 . 0 0 "[ . 1 . 2]" 1 2825 1 27 LEU QD 2 69 LEU MD2 4.310 . 4.960 2.219 2.006 2.490 . 0 0 "[ . 1 . 2]" 1 2826 1 69 LEU MD2 2 27 LEU QD 4.310 . 4.960 2.184 2.033 2.572 . 0 0 "[ . 1 . 2]" 1 2827 1 65 LEU MD2 2 65 LEU MD1 4.430 . 5.090 3.872 3.498 4.302 . 0 0 "[ . 1 . 2]" 1 2828 1 65 LEU MD1 2 65 LEU MD2 4.430 . 5.090 3.920 3.482 4.298 . 0 0 "[ . 1 . 2]" 1 2829 1 65 LEU MD1 2 14 ILE MD 3.710 . 4.270 1.912 1.794 2.023 0.006 14 0 "[ . 1 . 2]" 1 2830 1 14 ILE MD 2 65 LEU MD1 3.710 . 4.270 1.892 1.797 1.995 0.003 4 0 "[ . 1 . 2]" 1 2831 1 65 LEU MD1 2 14 ILE MG 4.080 . 4.690 2.829 2.524 3.095 . 0 0 "[ . 1 . 2]" 1 2832 1 14 ILE MG 2 65 LEU MD1 4.080 . 4.690 2.921 2.465 3.127 . 0 0 "[ . 1 . 2]" 1 2833 1 3 ASP HA 1 4 LYS QB 5.140 . 5.910 4.981 4.504 5.261 . 0 0 "[ . 1 . 2]" 1 2834 1 3 ASP QB 1 4 LYS H 3.880 . 4.460 2.524 2.065 3.639 . 0 0 "[ . 1 . 2]" 1 2835 1 3 ASP QB 1 4 LYS QB 4.080 . 4.690 3.619 3.208 4.301 . 0 0 "[ . 1 . 2]" 1 2836 1 4 LYS H 1 4 LYS QB 3.110 . 3.580 2.498 2.189 3.021 . 0 0 "[ . 1 . 2]" 1 2837 1 4 LYS HA 1 4 LYS QG 3.400 . 3.910 2.642 2.402 3.392 . 0 0 "[ . 1 . 2]" 1 2838 1 4 LYS HA 1 4 LYS QD 4.790 . 5.510 3.981 2.289 4.631 . 0 0 "[ . 1 . 2]" 1 2839 1 4 LYS QB 1 5 LEU H 4.070 . 4.680 3.706 3.037 4.045 . 0 0 "[ . 1 . 2]" 1 2840 1 4 LYS QG 1 5 LEU H 3.690 . 4.240 2.872 1.916 4.023 . 0 0 "[ . 1 . 2]" 1 2841 1 6 LYS HA 1 6 LYS QE 4.260 . 4.900 2.845 2.526 3.178 . 0 0 "[ . 1 . 2]" 1 2842 1 6 LYS HB2 1 6 LYS QE 4.220 . 4.850 3.583 3.441 3.738 . 0 0 "[ . 1 . 2]" 1 2843 1 6 LYS HB3 1 6 LYS QE 3.340 . 3.840 2.139 2.025 2.260 . 0 0 "[ . 1 . 2]" 1 2844 1 6 LYS QE 1 6 LYS HG3 2.770 . 3.190 2.681 2.423 3.107 . 0 0 "[ . 1 . 2]" 1 2845 1 6 LYS HD2 1 6 LYS QE 2.570 . 2.960 2.311 2.191 2.420 . 0 0 "[ . 1 . 2]" 1 2846 1 6 LYS QE 1 7 PHE H 4.130 . 4.750 3.434 2.876 3.888 . 0 0 "[ . 1 . 2]" 1 2847 1 8 GLU H 1 31 SER QB 4.260 . 4.900 3.527 3.216 4.439 . 0 0 "[ . 1 . 2]" 1 2848 1 8 GLU HB3 1 31 SER QB 3.820 . 4.390 2.766 2.072 4.162 . 0 0 "[ . 1 . 2]" 1 2849 1 8 GLU HG2 1 31 SER QB 4.840 . 5.570 4.402 3.600 5.636 0.066 1 0 "[ . 1 . 2]" 1 2850 1 9 ILE MG 1 12 GLU QG 3.240 . 3.730 2.398 2.011 3.088 . 0 0 "[ . 1 . 2]" 1 2851 1 9 ILE MG 1 28 ASN QB 3.880 . 4.460 2.455 2.166 2.779 . 0 0 "[ . 1 . 2]" 1 2852 1 9 ILE MD 1 12 GLU QG 4.310 . 4.960 3.530 3.147 4.302 . 0 0 "[ . 1 . 2]" 1 2853 1 9 ILE MD 1 48 HIS QB 3.410 . 3.920 2.161 1.950 2.604 . 0 0 "[ . 1 . 2]" 1 2854 1 10 ILE MG 1 31 SER QB 4.710 . 5.420 4.216 3.974 4.514 . 0 0 "[ . 1 . 2]" 1 2855 1 10 ILE HG12 1 31 SER QB 4.290 . 4.930 2.788 2.578 2.968 . 0 0 "[ . 1 . 2]" 1 2856 1 10 ILE HG13 1 31 SER QB 4.030 . 4.630 2.506 2.188 2.857 . 0 0 "[ . 1 . 2]" 1 2857 1 10 ILE MD 1 31 SER QB 3.280 . 3.770 2.135 1.975 2.692 . 0 0 "[ . 1 . 2]" 1 2858 1 11 GLU HA 1 11 GLU QG 3.340 . 3.840 2.653 2.414 3.084 . 0 0 "[ . 1 . 2]" 1 2859 1 11 GLU HA 1 12 GLU QG 4.300 . 4.950 3.969 3.601 4.868 . 0 0 "[ . 1 . 2]" 1 2860 1 11 GLU QG 1 12 GLU H 3.430 . 3.940 2.500 2.304 2.830 . 0 0 "[ . 1 . 2]" 1 2861 1 11 GLU QG 1 13 LEU HG 5.070 . 5.830 3.818 3.095 4.312 . 0 0 "[ . 1 . 2]" 1 2862 1 11 GLU QG 1 13 LEU QD 3.530 . 4.060 2.311 2.018 2.842 . 0 0 "[ . 1 . 2]" 1 2863 1 12 GLU H 1 12 GLU QG 3.400 . 3.910 2.828 2.555 3.573 . 0 0 "[ . 1 . 2]" 1 2864 1 12 GLU HA 1 12 GLU QG 3.480 . 4.000 2.492 2.401 2.620 . 0 0 "[ . 1 . 2]" 1 2865 1 12 GLU QG 1 13 LEU H 4.540 . 5.220 4.191 3.989 4.320 . 0 0 "[ . 1 . 2]" 1 2866 1 12 GLU QG 1 48 HIS HE1 4.390 . 5.050 3.377 2.057 4.878 . 0 0 "[ . 1 . 2]" 1 2867 1 13 LEU HA 2 72 LYS QD 5.810 . 6.680 4.215 3.302 5.276 . 0 0 "[ . 1 . 2]" 1 2868 1 13 LEU HA 2 72 LYS QE 4.570 . 5.260 3.338 2.627 4.697 . 0 0 "[ . 1 . 2]" 1 2869 1 13 LEU QD 1 29 ARG QG 3.310 . 3.810 2.144 1.689 3.565 0.111 5 0 "[ . 1 . 2]" 1 2870 1 13 LEU QD 1 39 TYR QB 4.520 . 5.200 3.327 3.122 3.550 . 0 0 "[ . 1 . 2]" 1 2871 1 13 LEU QD 2 72 LYS QG 4.610 . 5.300 4.210 3.751 4.549 . 0 0 "[ . 1 . 2]" 1 2872 1 13 LEU QD 2 72 LYS QE 3.540 . 4.070 2.278 1.771 3.033 0.029 15 0 "[ . 1 . 2]" 1 2873 1 14 ILE MG 2 68 GLU QG 3.870 . 4.450 2.044 1.895 2.457 . 0 0 "[ . 1 . 2]" 1 2874 1 14 ILE MD 2 72 LYS QG 4.760 . 5.470 3.938 2.691 4.423 . 0 0 "[ . 1 . 2]" 1 2875 1 14 ILE MD 2 72 LYS QE 3.400 . 3.910 3.385 2.569 4.002 0.092 5 0 "[ . 1 . 2]" 1 2876 1 15 VAL HA 1 26 GLU QB 3.630 . 4.170 2.227 1.863 3.234 . 0 0 "[ . 1 . 2]" 1 2877 1 15 VAL HA 1 26 GLU QG 4.110 . 4.730 4.170 2.783 4.453 . 0 0 "[ . 1 . 2]" 1 2878 1 15 VAL MG1 1 24 ARG QG 3.610 . 4.150 3.169 2.696 3.765 . 0 0 "[ . 1 . 2]" 1 2879 1 15 VAL MG1 1 24 ARG QD 3.350 . 3.850 2.414 2.016 2.750 . 0 0 "[ . 1 . 2]" 1 2880 1 15 VAL MG1 1 26 GLU QB 3.990 . 4.590 2.706 2.277 3.164 . 0 0 "[ . 1 . 2]" 1 2881 1 15 VAL MG1 1 26 GLU QG 4.730 . 5.440 4.260 3.316 4.662 . 0 0 "[ . 1 . 2]" 1 2882 1 15 VAL MG2 1 24 ARG QG 4.510 . 5.190 4.448 3.840 4.981 . 0 0 "[ . 1 . 2]" 1 2883 1 15 VAL MG2 1 24 ARG QD 3.520 . 4.050 2.886 2.187 3.508 . 0 0 "[ . 1 . 2]" 1 2884 1 15 VAL MG2 1 26 GLU QB 2.940 . 3.380 2.641 2.432 2.840 . 0 0 "[ . 1 . 2]" 1 2885 1 15 VAL MG2 1 26 GLU QG 3.640 . 4.190 3.898 2.191 4.283 0.093 13 0 "[ . 1 . 2]" 1 2886 1 16 LEU H 1 26 GLU QB 4.480 . 5.150 3.154 2.611 4.114 . 0 0 "[ . 1 . 2]" 1 2887 1 16 LEU MD1 2 61 GLU QG 4.260 . 4.900 4.485 3.617 5.035 0.135 14 0 "[ . 1 . 2]" 1 2888 1 16 LEU MD2 2 61 GLU QG 4.400 . 5.060 4.692 4.163 5.096 0.036 3 0 "[ . 1 . 2]" 1 2889 1 17 SER QB 1 18 GLU H 3.380 . 3.890 3.245 2.156 3.495 . 0 0 "[ . 1 . 2]" 1 2890 1 18 GLU H 1 18 GLU QG 4.150 . 4.770 4.114 4.058 4.203 . 0 0 "[ . 1 . 2]" 1 2891 1 18 GLU H 1 24 ARG QG 4.800 . 5.520 4.871 4.398 5.386 . 0 0 "[ . 1 . 2]" 1 2892 1 18 GLU HA 1 18 GLU QG 3.430 . 3.940 2.524 2.425 2.572 . 0 0 "[ . 1 . 2]" 1 2893 1 18 GLU HA 1 24 ARG QG 3.970 . 4.570 2.535 2.223 2.891 . 0 0 "[ . 1 . 2]" 1 2894 1 18 GLU QG 1 19 ASN H 3.100 . 3.570 2.564 2.428 2.821 . 0 0 "[ . 1 . 2]" 1 2895 1 18 GLU QG 1 22 GLY H 3.970 . 4.570 3.994 3.761 4.257 . 0 0 "[ . 1 . 2]" 1 2896 1 18 GLU QG 1 22 GLY HA2 3.690 . 4.240 2.700 2.408 2.944 . 0 0 "[ . 1 . 2]" 1 2897 1 18 GLU QG 1 22 GLY HA3 5.000 . 5.750 3.951 3.644 4.140 . 0 0 "[ . 1 . 2]" 1 2898 1 18 GLU QG 1 23 TRP H 5.290 . 6.080 4.720 4.583 4.865 . 0 0 "[ . 1 . 2]" 1 2899 1 18 GLU QG 1 24 ARG HA 4.420 . 5.080 3.772 3.537 3.942 . 0 0 "[ . 1 . 2]" 1 2900 1 18 GLU QG 1 24 ARG QG 3.740 . 4.300 2.263 2.021 2.462 . 0 0 "[ . 1 . 2]" 1 2901 1 19 ASN H 1 19 ASN QB 3.460 . 3.980 2.344 2.297 2.400 . 0 0 "[ . 1 . 2]" 1 2902 1 19 ASN H 1 24 ARG QG 3.260 . 3.750 3.605 3.474 3.766 0.016 5 0 "[ . 1 . 2]" 1 2903 1 19 ASN QB 1 20 ALA MB 4.880 . 5.610 4.504 4.398 4.636 . 0 0 "[ . 1 . 2]" 1 2904 1 19 ASN QB 1 21 LYS H 4.580 . 5.270 3.032 2.477 3.794 . 0 0 "[ . 1 . 2]" 1 2905 1 19 ASN QB 1 22 GLY H 4.480 . 5.150 2.379 2.057 2.962 . 0 0 "[ . 1 . 2]" 1 2906 1 19 ASN HD22 1 21 LYS QD 5.090 . 5.850 5.413 4.408 6.004 0.154 8 0 "[ . 1 . 2]" 1 2907 1 21 LYS HA 1 21 LYS QD 3.580 . 4.120 2.202 1.968 3.019 . 0 0 "[ . 1 . 2]" 1 2908 1 21 LYS HA 1 21 LYS QE 4.640 . 5.340 3.618 2.102 4.337 . 0 0 "[ . 1 . 2]" 1 2909 1 21 LYS HB3 1 21 LYS QD 3.540 . 4.070 2.692 2.422 3.106 . 0 0 "[ . 1 . 2]" 1 2910 1 21 LYS HB3 1 21 LYS QE 4.550 . 5.230 3.388 1.969 4.265 . 0 0 "[ . 1 . 2]" 1 2911 1 22 GLY HA2 1 24 ARG QG 4.430 . 5.090 4.289 4.050 4.508 . 0 0 "[ . 1 . 2]" 1 2912 1 24 ARG H 1 24 ARG QG 3.670 . 4.220 2.696 2.323 3.049 . 0 0 "[ . 1 . 2]" 1 2913 1 24 ARG HA 1 24 ARG QD 4.550 . 5.230 4.065 3.933 4.173 . 0 0 "[ . 1 . 2]" 1 2914 1 24 ARG HB3 1 24 ARG QD 3.540 . 4.070 2.443 2.319 2.640 . 0 0 "[ . 1 . 2]" 1 2915 1 26 GLU H 1 26 GLU QG 3.900 . 4.490 2.390 2.112 4.044 . 0 0 "[ . 1 . 2]" 1 2916 1 26 GLU QB 1 27 LEU H 3.960 . 4.550 2.554 2.300 3.712 . 0 0 "[ . 1 . 2]" 1 2917 1 26 GLU QB 1 44 TRP HD1 4.840 . 5.570 4.226 1.753 5.037 0.047 7 0 "[ . 1 . 2]" 1 2918 1 26 GLU QG 1 27 LEU H 4.470 . 5.140 3.763 2.764 4.303 . 0 0 "[ . 1 . 2]" 1 2919 1 26 GLU QG 1 44 TRP HD1 3.390 . 3.900 2.302 1.997 3.365 . 0 0 "[ . 1 . 2]" 1 2920 1 27 LEU QD 1 28 ASN QD 4.530 . 5.210 4.298 3.669 5.250 0.040 17 0 "[ . 1 . 2]" 1 2921 1 27 LEU QD 1 39 TYR QB 3.330 . 3.830 2.394 2.134 2.663 . 0 0 "[ . 1 . 2]" 1 2922 1 28 ASN QB 1 29 ARG H 3.620 . 4.160 2.511 2.095 2.782 . 0 0 "[ . 1 . 2]" 1 2923 1 28 ASN QB 1 30 VAL MG2 4.070 . 4.680 3.583 3.300 3.988 . 0 0 "[ . 1 . 2]" 1 2924 1 28 ASN QD 1 30 VAL MG2 4.350 . 5.000 2.685 1.697 3.819 0.103 14 0 "[ . 1 . 2]" 1 2925 1 28 ASN QD 1 40 ASP H 4.570 . 5.260 4.143 3.477 5.396 0.136 18 0 "[ . 1 . 2]" 1 2926 1 28 ASN QD 1 44 TRP HD1 5.050 . 5.810 3.627 2.375 4.737 . 0 0 "[ . 1 . 2]" 1 2927 1 29 ARG H 1 29 ARG QG 4.050 . 4.660 3.019 2.695 4.074 . 0 0 "[ . 1 . 2]" 1 2928 1 29 ARG QG 1 30 VAL H 4.250 . 4.890 3.965 2.779 4.271 . 0 0 "[ . 1 . 2]" 1 2929 1 29 ARG QG 1 39 TYR QE 4.230 . 4.860 3.329 2.922 4.482 . 0 0 "[ . 1 . 2]" 1 2930 1 29 ARG QG 1 39 TYR QD 4.090 . 4.700 2.795 2.471 4.141 . 0 0 "[ . 1 . 2]" 1 2931 1 30 VAL H 1 40 ASP QB 4.570 . 5.260 3.289 2.700 4.036 . 0 0 "[ . 1 . 2]" 1 2932 1 30 VAL HB 1 40 ASP QB 3.900 . 4.490 2.730 2.124 3.610 . 0 0 "[ . 1 . 2]" 1 2933 1 30 VAL MG1 1 31 SER QB 4.310 . 4.960 3.925 3.778 4.375 . 0 0 "[ . 1 . 2]" 1 2934 1 30 VAL MG2 1 40 ASP QB 3.250 . 3.740 2.289 2.088 3.169 . 0 0 "[ . 1 . 2]" 1 2935 1 31 SER H 1 31 SER QB 3.450 . 3.970 2.471 2.361 2.917 . 0 0 "[ . 1 . 2]" 1 2936 1 31 SER QB 1 32 TRP H 4.070 . 4.680 3.771 3.264 3.900 . 0 0 "[ . 1 . 2]" 1 2937 1 31 SER QB 1 35 ALA H 4.920 . 5.660 4.330 3.682 4.898 . 0 0 "[ . 1 . 2]" 1 2938 1 31 SER QB 1 37 PRO HA 4.030 . 4.630 2.923 2.653 3.202 . 0 0 "[ . 1 . 2]" 1 2939 1 31 SER QB 1 37 PRO HB2 4.280 . 4.920 4.349 3.763 4.952 0.032 5 0 "[ . 1 . 2]" 1 2940 1 31 SER QB 1 37 PRO HB3 4.080 . 4.690 2.834 2.135 3.615 . 0 0 "[ . 1 . 2]" 1 2941 1 31 SER QB 1 37 PRO HG3 4.270 . 4.910 3.857 2.553 4.759 . 0 0 "[ . 1 . 2]" 1 2942 1 31 SER QB 1 37 PRO HD3 4.430 . 5.090 3.829 3.000 4.360 . 0 0 "[ . 1 . 2]" 1 2943 1 31 SER QB 1 38 LYS H 4.750 . 5.460 4.583 4.363 4.822 . 0 0 "[ . 1 . 2]" 1 2944 1 32 TRP HE1 1 40 ASP QB 5.160 . 5.930 3.150 2.346 4.325 . 0 0 "[ . 1 . 2]" 1 2945 1 35 ALA HA 1 36 GLU QG 4.620 . 5.310 4.288 3.897 4.769 . 0 0 "[ . 1 . 2]" 1 2946 1 35 ALA MB 1 36 GLU QB 4.070 . 4.680 3.736 3.437 4.027 . 0 0 "[ . 1 . 2]" 1 2947 1 35 ALA MB 1 36 GLU QG 3.620 . 4.160 3.427 2.527 4.246 0.086 1 0 "[ . 1 . 2]" 1 2948 1 36 GLU H 1 36 GLU QB 2.800 . 3.220 2.556 2.447 2.711 . 0 0 "[ . 1 . 2]" 1 2949 1 36 GLU H 1 36 GLU QG 3.040 . 3.500 2.205 1.920 3.016 . 0 0 "[ . 1 . 2]" 1 2950 1 36 GLU HA 1 36 GLU QG 3.690 . 4.240 2.882 2.421 3.404 . 0 0 "[ . 1 . 2]" 1 2951 1 36 GLU QB 1 36 GLU QG 2.340 . 2.690 2.080 1.988 2.116 . 0 0 "[ . 1 . 2]" 1 2952 1 36 GLU QB 1 37 PRO HD2 3.500 . 4.030 3.246 3.031 3.767 . 0 0 "[ . 1 . 2]" 1 2953 1 38 LYS H 1 38 LYS QE 4.750 . 5.460 4.417 3.830 4.778 . 0 0 "[ . 1 . 2]" 1 2954 1 38 LYS HB2 1 38 LYS QE 4.540 . 5.220 2.939 2.450 3.911 . 0 0 "[ . 1 . 2]" 1 2955 1 38 LYS QE 1 56 THR MG 4.460 . 5.130 4.350 3.817 4.876 . 0 0 "[ . 1 . 2]" 1 2956 1 39 TYR QB 1 40 ASP H 4.020 . 4.620 3.001 2.830 3.207 . 0 0 "[ . 1 . 2]" 1 2957 1 39 TYR QB 1 57 LEU H 4.070 . 4.680 3.358 2.925 3.768 . 0 0 "[ . 1 . 2]" 1 2958 1 39 TYR QB 1 57 LEU QB 3.920 . 4.510 2.015 1.757 2.294 0.043 17 0 "[ . 1 . 2]" 1 2959 1 39 TYR QD 1 57 LEU QB 3.810 . 4.380 3.455 3.202 3.791 . 0 0 "[ . 1 . 2]" 1 2960 1 39 TYR QD 1 62 PHE QB 3.730 . 4.290 2.708 2.566 2.988 . 0 0 "[ . 1 . 2]" 1 2961 1 39 TYR QE 1 62 PHE QB 4.590 . 5.280 3.248 3.099 3.485 . 0 0 "[ . 1 . 2]" 1 2962 1 40 ASP H 1 40 ASP QB 3.690 . 4.240 2.591 2.458 2.725 . 0 0 "[ . 1 . 2]" 1 2963 1 40 ASP QB 1 56 THR HA 4.560 . 5.240 3.764 3.161 4.426 . 0 0 "[ . 1 . 2]" 1 2964 1 40 ASP QB 1 56 THR MG 3.940 . 4.530 2.831 2.091 4.149 . 0 0 "[ . 1 . 2]" 1 2965 1 45 SER H 1 49 GLU QG 5.550 . 6.380 4.819 4.204 5.863 . 0 0 "[ . 1 . 2]" 1 2966 1 45 SER QB 1 46 PRO HD2 4.110 . 4.730 2.197 1.956 2.484 . 0 0 "[ . 1 . 2]" 1 2967 1 45 SER QB 1 46 PRO HD3 4.350 . 5.000 3.588 3.280 3.885 . 0 0 "[ . 1 . 2]" 1 2968 1 45 SER QB 1 50 LYS H 4.840 . 5.570 2.772 2.055 3.177 . 0 0 "[ . 1 . 2]" 1 2969 1 45 SER QB 1 50 LYS HB2 4.320 . 4.970 2.218 1.673 3.594 0.127 3 0 "[ . 1 . 2]" 1 2970 1 45 SER QB 1 50 LYS HB3 4.390 . 5.050 3.756 3.096 5.022 . 0 0 "[ . 1 . 2]" 1 2971 1 47 ASP QB 1 48 HIS H 4.050 . 4.660 3.322 3.184 3.446 . 0 0 "[ . 1 . 2]" 1 2972 1 47 ASP QB 1 49 GLU QG 3.470 . 3.990 2.195 1.772 3.058 0.028 13 0 "[ . 1 . 2]" 1 2973 1 48 HIS H 1 49 GLU QG 4.530 . 5.210 4.023 3.639 4.281 . 0 0 "[ . 1 . 2]" 1 2974 1 49 GLU QG 1 50 LYS H 3.830 . 4.400 2.680 2.351 3.580 . 0 0 "[ . 1 . 2]" 1 2975 1 49 GLU QG 1 50 LYS HB2 4.620 . 5.310 3.547 2.863 5.030 . 0 0 "[ . 1 . 2]" 1 2976 1 49 GLU QG 1 50 LYS HG2 4.980 . 5.730 2.402 1.764 4.221 0.036 18 0 "[ . 1 . 2]" 1 2977 1 50 LYS HA 1 51 MET QG 4.460 . 5.130 3.547 3.243 3.795 . 0 0 "[ . 1 . 2]" 1 2978 1 51 MET H 1 51 MET QG 3.260 . 3.750 2.478 2.179 2.682 . 0 0 "[ . 1 . 2]" 1 2979 1 51 MET HA 1 51 MET QG 3.730 . 4.290 3.408 3.396 3.422 . 0 0 "[ . 1 . 2]" 1 2980 1 52 GLY QA 1 53 LYS HA 4.400 . 5.060 3.948 3.890 4.017 . 0 0 "[ . 1 . 2]" 1 2981 1 53 LYS H 1 53 LYS QG 3.050 . 3.510 2.313 1.950 3.294 . 0 0 "[ . 1 . 2]" 1 2982 1 53 LYS HB3 1 53 LYS QD 2.860 . 3.290 2.571 2.358 3.330 0.040 13 0 "[ . 1 . 2]" 1 2983 1 53 LYS QD 1 54 GLY H 5.470 . 6.290 4.272 3.490 5.573 . 0 0 "[ . 1 . 2]" 1 2984 1 57 LEU H 1 57 LEU QB 3.660 . 4.210 2.640 2.581 2.686 . 0 0 "[ . 1 . 2]" 1 2985 1 57 LEU QB 1 57 LEU MD1 2.860 . 3.290 2.146 2.131 2.155 . 0 0 "[ . 1 . 2]" 1 2986 1 57 LEU QB 1 57 LEU MD2 3.090 . 3.550 2.372 2.283 2.414 . 0 0 "[ . 1 . 2]" 1 2987 1 57 LEU QB 1 62 PHE HD1 4.340 . 4.990 3.184 2.845 3.526 . 0 0 "[ . 1 . 2]" 1 2988 1 57 LEU MD1 1 62 PHE QB 4.430 . 5.090 3.070 2.801 3.929 . 0 0 "[ . 1 . 2]" 1 2989 1 57 LEU MD2 1 62 PHE QB 4.880 . 5.610 4.246 3.951 4.659 . 0 0 "[ . 1 . 2]" 1 2990 1 59 GLU HA 1 62 PHE QB 4.060 . 4.670 2.924 2.433 3.227 . 0 0 "[ . 1 . 2]" 1 2991 1 61 GLU HA 1 61 GLU QG 3.690 . 4.240 2.588 2.370 3.400 . 0 0 "[ . 1 . 2]" 1 2992 1 61 GLU QG 2 16 LEU MD1 4.260 . 4.900 4.559 3.517 5.056 0.156 2 0 "[ . 1 . 2]" 1 2993 1 61 GLU QG 2 16 LEU MD2 4.400 . 5.060 4.835 4.003 5.150 0.090 3 0 "[ . 1 . 2]" 1 2994 1 62 PHE H 1 62 PHE QB 3.310 . 3.810 2.223 2.176 2.249 . 0 0 "[ . 1 . 2]" 1 2995 1 62 PHE HZ 2 72 LYS QE 4.010 . 4.610 4.161 3.238 4.719 0.109 14 0 "[ . 1 . 2]" 1 2996 1 64 VAL HB 1 67 LYS QE 4.960 . 5.700 5.566 4.643 5.875 0.175 12 0 "[ . 1 . 2]" 1 2997 1 64 VAL MG1 1 67 LYS QE 3.680 . 4.230 3.641 3.004 4.243 0.013 15 0 "[ . 1 . 2]" 1 2998 1 64 VAL MG1 1 68 GLU QG 4.860 . 5.590 2.484 2.351 2.603 . 0 0 "[ . 1 . 2]" 1 2999 1 64 VAL MG2 1 67 LYS QE 3.840 . 4.420 3.556 2.630 4.100 . 0 0 "[ . 1 . 2]" 1 3000 1 66 LEU MD2 2 72 LYS QE 5.050 . 5.810 4.874 3.590 5.614 . 0 0 "[ . 1 . 2]" 1 3001 1 67 LYS HB3 1 67 LYS QE 3.610 . 4.150 2.345 2.180 2.954 . 0 0 "[ . 1 . 2]" 1 3002 1 67 LYS HD3 1 67 LYS QE 2.490 . 2.860 2.273 2.189 2.410 . 0 0 "[ . 1 . 2]" 1 3003 1 67 LYS QE 1 68 GLU H 4.700 . 5.400 4.379 3.996 5.394 . 0 0 "[ . 1 . 2]" 1 3004 1 68 GLU H 1 68 GLU QG 4.150 . 4.770 2.296 2.185 2.514 . 0 0 "[ . 1 . 2]" 1 3005 1 68 GLU HB3 1 68 GLU QG 2.620 . 3.010 2.339 2.294 2.386 . 0 0 "[ . 1 . 2]" 1 3006 1 68 GLU QG 2 14 ILE MG 3.870 . 4.450 2.058 1.890 2.279 . 0 0 "[ . 1 . 2]" 1 3007 1 69 LEU H 1 72 LYS QE 5.760 . 6.620 5.949 4.500 6.613 . 0 0 "[ . 1 . 2]" 1 3008 1 69 LEU HA 1 72 LYS QG 4.360 . 5.010 3.205 1.952 3.988 . 0 0 "[ . 1 . 2]" 1 3009 1 69 LEU HA 1 72 LYS QD 3.330 . 3.830 2.636 2.154 3.426 . 0 0 "[ . 1 . 2]" 1 3010 1 69 LEU MD2 1 72 LYS QE 3.630 . 4.170 3.316 2.880 3.825 . 0 0 "[ . 1 . 2]" 1 3011 1 71 ASN HB2 1 72 LYS QG 4.440 . 5.110 3.303 3.009 4.211 . 0 0 "[ . 1 . 2]" 1 3012 1 71 ASN HB2 1 72 LYS QD 4.680 . 5.380 4.988 4.643 5.514 0.134 11 0 "[ . 1 . 2]" 1 3013 1 71 ASN HB3 1 72 LYS QG 4.580 . 5.270 4.178 2.547 5.317 0.047 6 0 "[ . 1 . 2]" 1 3014 1 71 ASN HD21 1 72 LYS QG 5.070 . 5.830 4.740 4.413 5.891 0.061 6 0 "[ . 1 . 2]" 1 3015 1 72 LYS H 1 72 LYS QG 3.970 . 4.570 2.099 2.008 2.441 . 0 0 "[ . 1 . 2]" 1 3016 1 72 LYS H 1 72 LYS QD 3.710 . 4.270 3.816 3.576 4.004 . 0 0 "[ . 1 . 2]" 1 3017 1 72 LYS HA 1 72 LYS QG 3.230 . 3.710 2.491 2.392 3.369 . 0 0 "[ . 1 . 2]" 1 3018 1 72 LYS HA 1 72 LYS QE 5.450 . 6.270 4.587 4.257 5.142 . 0 0 "[ . 1 . 2]" 1 3019 1 72 LYS HB2 1 72 LYS QE 4.880 . 5.610 3.442 2.261 4.114 . 0 0 "[ . 1 . 2]" 1 3020 1 72 LYS HB3 1 72 LYS QE 4.390 . 5.050 2.981 2.142 4.302 . 0 0 "[ . 1 . 2]" 1 3021 1 72 LYS QD 1 72 LYS QG 2.350 . 2.700 2.054 2.016 2.114 . 0 0 "[ . 1 . 2]" 1 3022 1 72 LYS QE 1 72 LYS QG 2.750 . 3.160 2.643 2.381 2.861 . 0 0 "[ . 1 . 2]" 1 3023 1 72 LYS QG 1 73 LEU H 4.230 . 4.860 4.264 2.439 4.549 . 0 0 "[ . 1 . 2]" 1 3024 1 72 LYS QG 2 13 LEU QD 4.610 . 5.300 4.258 3.735 4.526 . 0 0 "[ . 1 . 2]" 1 3025 1 72 LYS QG 2 14 ILE MD 4.760 . 5.470 3.849 3.463 4.171 . 0 0 "[ . 1 . 2]" 1 3026 1 72 LYS QD 2 13 LEU HA 5.810 . 6.680 4.202 3.460 5.199 . 0 0 "[ . 1 . 2]" 1 3027 1 72 LYS QE 2 13 LEU HA 4.570 . 5.260 3.451 2.607 4.749 . 0 0 "[ . 1 . 2]" 1 3028 1 72 LYS QE 2 13 LEU QD 3.540 . 4.070 2.191 1.665 2.883 0.135 17 0 "[ . 1 . 2]" 1 3029 1 72 LYS QE 2 14 ILE MD 3.400 . 3.910 3.516 2.461 3.942 0.032 13 0 "[ . 1 . 2]" 1 3030 1 72 LYS QE 2 62 PHE HZ 4.010 . 4.610 4.094 3.135 4.653 0.043 2 0 "[ . 1 . 2]" 1 3031 1 72 LYS QE 2 66 LEU MD2 5.050 . 5.810 4.829 3.645 5.653 . 0 0 "[ . 1 . 2]" 1 3032 1 74 GLU H 1 74 GLU QB 2.780 . 3.200 2.473 2.288 2.630 . 0 0 "[ . 1 . 2]" 1 3033 1 74 GLU H 1 74 GLU QG 3.460 . 3.980 2.451 1.978 3.664 . 0 0 "[ . 1 . 2]" 1 3034 1 74 GLU HA 1 74 GLU QG 3.360 . 3.860 2.743 2.360 3.407 . 0 0 "[ . 1 . 2]" 1 3035 1 74 GLU QB 1 74 GLU QG 2.310 . 2.660 2.090 1.995 2.118 . 0 0 "[ . 1 . 2]" 1 3036 1 74 GLU QB 1 75 HIS H 4.330 . 4.980 3.054 2.241 3.963 . 0 0 "[ . 1 . 2]" 1 3037 2 3 ASP HA 2 4 LYS QB 5.140 . 5.910 5.068 4.425 5.596 . 0 0 "[ . 1 . 2]" 1 3038 2 3 ASP QB 2 4 LYS H 3.880 . 4.460 2.625 2.004 3.993 . 0 0 "[ . 1 . 2]" 1 3039 2 3 ASP QB 2 4 LYS QB 4.080 . 4.690 3.740 3.352 4.554 . 0 0 "[ . 1 . 2]" 1 3040 2 4 LYS H 2 4 LYS QB 3.110 . 3.580 2.498 2.222 3.060 . 0 0 "[ . 1 . 2]" 1 3041 2 4 LYS HA 2 4 LYS QG 3.400 . 3.910 2.599 2.422 3.392 . 0 0 "[ . 1 . 2]" 1 3042 2 4 LYS HA 2 4 LYS QD 4.790 . 5.510 4.071 2.353 4.383 . 0 0 "[ . 1 . 2]" 1 3043 2 4 LYS QB 2 5 LEU H 4.070 . 4.680 3.711 3.018 3.987 . 0 0 "[ . 1 . 2]" 1 3044 2 4 LYS QG 2 5 LEU H 3.690 . 4.240 2.958 2.322 4.134 . 0 0 "[ . 1 . 2]" 1 3045 2 6 LYS HA 2 6 LYS QE 4.260 . 4.900 2.891 2.586 3.091 . 0 0 "[ . 1 . 2]" 1 3046 2 6 LYS HB2 2 6 LYS QE 4.220 . 4.850 3.562 3.433 3.716 . 0 0 "[ . 1 . 2]" 1 3047 2 6 LYS HB3 2 6 LYS QE 3.340 . 3.840 2.097 1.979 2.236 . 0 0 "[ . 1 . 2]" 1 3048 2 6 LYS QE 2 6 LYS HG3 2.770 . 3.190 2.696 2.448 3.102 . 0 0 "[ . 1 . 2]" 1 3049 2 6 LYS HD2 2 6 LYS QE 2.570 . 2.960 2.322 2.192 2.427 . 0 0 "[ . 1 . 2]" 1 3050 2 6 LYS QE 2 7 PHE H 4.130 . 4.750 3.372 3.084 3.722 . 0 0 "[ . 1 . 2]" 1 3051 2 8 GLU H 2 31 SER QB 4.260 . 4.900 3.587 3.285 4.409 . 0 0 "[ . 1 . 2]" 1 3052 2 8 GLU HB3 2 31 SER QB 3.820 . 4.390 2.855 2.214 3.992 . 0 0 "[ . 1 . 2]" 1 3053 2 8 GLU HG2 2 31 SER QB 4.840 . 5.570 4.501 3.883 5.553 . 0 0 "[ . 1 . 2]" 1 3054 2 9 ILE MG 2 12 GLU QG 3.240 . 3.730 2.411 1.960 2.941 . 0 0 "[ . 1 . 2]" 1 3055 2 9 ILE MG 2 28 ASN QB 3.880 . 4.460 2.442 2.201 2.845 . 0 0 "[ . 1 . 2]" 1 3056 2 9 ILE MD 2 12 GLU QG 4.310 . 4.960 3.527 3.124 4.072 . 0 0 "[ . 1 . 2]" 1 3057 2 9 ILE MD 2 48 HIS QB 3.410 . 3.920 2.153 1.789 2.633 0.011 12 0 "[ . 1 . 2]" 1 3058 2 10 ILE MG 2 31 SER QB 4.710 . 5.420 4.232 3.969 4.450 . 0 0 "[ . 1 . 2]" 1 3059 2 10 ILE HG12 2 31 SER QB 4.290 . 4.930 2.829 2.632 3.416 . 0 0 "[ . 1 . 2]" 1 3060 2 10 ILE HG13 2 31 SER QB 4.030 . 4.630 2.527 2.271 2.816 . 0 0 "[ . 1 . 2]" 1 3061 2 10 ILE MD 2 31 SER QB 3.280 . 3.770 2.158 1.973 2.640 . 0 0 "[ . 1 . 2]" 1 3062 2 11 GLU HA 2 11 GLU QG 3.340 . 3.840 2.794 2.422 3.094 . 0 0 "[ . 1 . 2]" 1 3063 2 11 GLU HA 2 12 GLU QG 4.300 . 4.950 4.089 3.671 4.924 . 0 0 "[ . 1 . 2]" 1 3064 2 11 GLU QG 2 12 GLU H 3.430 . 3.940 2.571 2.312 2.797 . 0 0 "[ . 1 . 2]" 1 3065 2 11 GLU QG 2 13 LEU HG 5.070 . 5.830 3.689 2.931 4.322 . 0 0 "[ . 1 . 2]" 1 3066 2 11 GLU QG 2 13 LEU QD 3.530 . 4.060 2.205 1.961 2.754 . 0 0 "[ . 1 . 2]" 1 3067 2 12 GLU H 2 12 GLU QG 3.400 . 3.910 2.941 2.517 3.549 . 0 0 "[ . 1 . 2]" 1 3068 2 12 GLU HA 2 12 GLU QG 3.480 . 4.000 2.499 2.385 2.587 . 0 0 "[ . 1 . 2]" 1 3069 2 12 GLU QG 2 13 LEU H 4.540 . 5.220 4.229 3.916 4.426 . 0 0 "[ . 1 . 2]" 1 3070 2 12 GLU QG 2 48 HIS HE1 4.390 . 5.050 3.513 2.020 4.923 . 0 0 "[ . 1 . 2]" 1 3071 2 13 LEU QD 2 29 ARG QG 3.310 . 3.810 2.039 1.743 3.459 0.057 16 0 "[ . 1 . 2]" 1 3072 2 13 LEU QD 2 39 TYR QB 4.520 . 5.200 3.354 3.151 3.596 . 0 0 "[ . 1 . 2]" 1 3073 2 15 VAL HA 2 26 GLU QB 3.630 . 4.170 2.254 1.894 2.666 . 0 0 "[ . 1 . 2]" 1 3074 2 15 VAL HA 2 26 GLU QG 4.110 . 4.730 4.340 3.709 4.720 . 0 0 "[ . 1 . 2]" 1 3075 2 15 VAL MG1 2 24 ARG QD 3.350 . 3.850 2.382 1.870 3.225 . 0 0 "[ . 1 . 2]" 1 3076 2 15 VAL MG1 2 26 GLU QB 3.990 . 4.590 2.776 2.504 3.001 . 0 0 "[ . 1 . 2]" 1 3077 2 15 VAL MG1 2 26 GLU QG 4.730 . 5.440 4.380 3.563 4.824 . 0 0 "[ . 1 . 2]" 1 3078 2 15 VAL MG2 2 24 ARG QD 3.520 . 4.050 2.844 2.209 3.265 . 0 0 "[ . 1 . 2]" 1 3079 2 15 VAL MG2 2 26 GLU QB 2.940 . 3.380 2.671 2.344 3.229 . 0 0 "[ . 1 . 2]" 1 3080 2 15 VAL MG2 2 26 GLU QG 3.640 . 4.190 4.152 3.537 4.365 0.175 17 0 "[ . 1 . 2]" 1 3081 2 16 LEU H 2 26 GLU QB 4.480 . 5.150 3.127 2.349 3.639 . 0 0 "[ . 1 . 2]" 1 3082 2 17 SER QB 2 18 GLU H 3.380 . 3.890 3.148 2.310 3.565 . 0 0 "[ . 1 . 2]" 1 3083 2 18 GLU H 2 18 GLU QG 4.150 . 4.770 4.100 4.038 4.147 . 0 0 "[ . 1 . 2]" 1 3084 2 18 GLU HA 2 18 GLU QG 3.430 . 3.940 2.514 2.436 2.569 . 0 0 "[ . 1 . 2]" 1 3085 2 18 GLU QG 2 19 ASN H 3.100 . 3.570 2.590 2.402 2.782 . 0 0 "[ . 1 . 2]" 1 3086 2 18 GLU QG 2 22 GLY H 3.970 . 4.570 4.043 3.624 4.272 . 0 0 "[ . 1 . 2]" 1 3087 2 18 GLU QG 2 22 GLY HA2 3.690 . 4.240 2.718 2.276 2.922 . 0 0 "[ . 1 . 2]" 1 3088 2 18 GLU QG 2 22 GLY HA3 5.000 . 5.750 3.970 3.542 4.182 . 0 0 "[ . 1 . 2]" 1 3089 2 18 GLU QG 2 23 TRP H 5.290 . 6.080 4.756 4.497 4.958 . 0 0 "[ . 1 . 2]" 1 3090 2 18 GLU QG 2 24 ARG HA 4.420 . 5.080 3.922 3.683 4.277 . 0 0 "[ . 1 . 2]" 1 3091 2 18 GLU QG 2 24 ARG HG2 4.040 . 4.650 2.801 2.260 3.428 . 0 0 "[ . 1 . 2]" 1 3092 2 18 GLU QG 2 24 ARG HG3 4.390 . 5.050 2.563 2.317 2.823 . 0 0 "[ . 1 . 2]" 1 3093 2 19 ASN H 2 19 ASN QB 3.460 . 3.980 2.352 2.299 2.396 . 0 0 "[ . 1 . 2]" 1 3094 2 19 ASN QB 2 20 ALA MB 4.880 . 5.610 4.498 4.335 4.647 . 0 0 "[ . 1 . 2]" 1 3095 2 19 ASN QB 2 21 LYS H 4.580 . 5.270 2.913 2.487 3.482 . 0 0 "[ . 1 . 2]" 1 3096 2 19 ASN QB 2 22 GLY H 4.480 . 5.150 2.314 2.033 2.672 . 0 0 "[ . 1 . 2]" 1 3097 2 19 ASN HD22 2 21 LYS QD 5.090 . 5.850 5.184 4.405 5.938 0.088 8 0 "[ . 1 . 2]" 1 3098 2 21 LYS HA 2 21 LYS QD 3.580 . 4.120 2.227 2.010 3.251 . 0 0 "[ . 1 . 2]" 1 3099 2 21 LYS HA 2 21 LYS QE 4.640 . 5.340 3.596 1.776 4.325 0.024 3 0 "[ . 1 . 2]" 1 3100 2 21 LYS HB3 2 21 LYS QD 3.540 . 4.070 2.712 2.446 3.020 . 0 0 "[ . 1 . 2]" 1 3101 2 21 LYS HB3 2 21 LYS QE 4.550 . 5.230 3.295 2.016 4.319 . 0 0 "[ . 1 . 2]" 1 3102 2 24 ARG HA 2 24 ARG QD 4.550 . 5.230 4.073 3.966 4.194 . 0 0 "[ . 1 . 2]" 1 3103 2 24 ARG HB3 2 24 ARG QD 3.540 . 4.070 2.513 2.352 2.774 . 0 0 "[ . 1 . 2]" 1 3104 2 26 GLU H 2 26 GLU QG 3.900 . 4.490 2.256 2.156 2.369 . 0 0 "[ . 1 . 2]" 1 3105 2 26 GLU QB 2 27 LEU H 3.960 . 4.550 2.541 2.179 2.873 . 0 0 "[ . 1 . 2]" 1 3106 2 26 GLU QB 2 44 TRP HD1 4.840 . 5.570 4.373 4.120 5.047 . 0 0 "[ . 1 . 2]" 1 3107 2 26 GLU QG 2 27 LEU H 4.470 . 5.140 3.829 3.475 4.192 . 0 0 "[ . 1 . 2]" 1 3108 2 26 GLU QG 2 44 TRP HD1 3.390 . 3.900 2.240 1.910 2.964 . 0 0 "[ . 1 . 2]" 1 3109 2 27 LEU QD 2 28 ASN QD 4.530 . 5.210 4.373 3.671 5.225 0.015 6 0 "[ . 1 . 2]" 1 3110 2 27 LEU QD 2 39 TYR QB 3.330 . 3.830 2.401 2.168 2.617 . 0 0 "[ . 1 . 2]" 1 3111 2 28 ASN QB 2 29 ARG H 3.620 . 4.160 2.474 1.991 2.730 . 0 0 "[ . 1 . 2]" 1 3112 2 28 ASN QB 2 30 VAL MG2 4.070 . 4.680 3.536 2.774 3.952 . 0 0 "[ . 1 . 2]" 1 3113 2 28 ASN QD 2 30 VAL MG2 4.350 . 5.000 3.015 1.790 3.996 0.010 14 0 "[ . 1 . 2]" 1 3114 2 28 ASN QD 2 40 ASP H 4.570 . 5.260 4.393 2.945 5.343 0.083 6 0 "[ . 1 . 2]" 1 3115 2 28 ASN QD 2 44 TRP HD1 5.050 . 5.810 3.194 2.033 4.514 . 0 0 "[ . 1 . 2]" 1 3116 2 29 ARG H 2 29 ARG QG 4.050 . 4.660 2.986 2.716 4.261 . 0 0 "[ . 1 . 2]" 1 3117 2 29 ARG QG 2 30 VAL H 4.250 . 4.890 4.021 2.990 4.298 . 0 0 "[ . 1 . 2]" 1 3118 2 29 ARG QG 2 39 TYR QE 4.230 . 4.860 3.257 2.959 4.153 . 0 0 "[ . 1 . 2]" 1 3119 2 29 ARG QG 2 39 TYR QD 4.090 . 4.700 2.711 2.417 3.938 . 0 0 "[ . 1 . 2]" 1 3120 2 30 VAL H 2 40 ASP QB 4.570 . 5.260 3.177 2.692 3.501 . 0 0 "[ . 1 . 2]" 1 3121 2 30 VAL HB 2 40 ASP QB 3.900 . 4.490 2.637 2.336 3.009 . 0 0 "[ . 1 . 2]" 1 3122 2 30 VAL MG1 2 31 SER QB 4.310 . 4.960 3.954 3.807 4.295 . 0 0 "[ . 1 . 2]" 1 3123 2 30 VAL MG2 2 40 ASP QB 3.250 . 3.740 2.258 2.107 2.400 . 0 0 "[ . 1 . 2]" 1 3124 2 31 SER H 2 31 SER QB 3.450 . 3.970 2.492 2.341 2.918 . 0 0 "[ . 1 . 2]" 1 3125 2 31 SER QB 2 32 TRP H 4.070 . 4.680 3.757 3.269 3.897 . 0 0 "[ . 1 . 2]" 1 3126 2 31 SER QB 2 35 ALA H 4.920 . 5.660 4.340 3.267 5.002 . 0 0 "[ . 1 . 2]" 1 3127 2 31 SER QB 2 37 PRO HA 4.030 . 4.630 2.926 2.528 3.176 . 0 0 "[ . 1 . 2]" 1 3128 2 31 SER QB 2 37 PRO HB2 4.280 . 4.920 4.224 3.762 4.796 . 0 0 "[ . 1 . 2]" 1 3129 2 31 SER QB 2 37 PRO HB3 4.080 . 4.690 2.720 2.155 3.425 . 0 0 "[ . 1 . 2]" 1 3130 2 31 SER QB 2 37 PRO HG3 4.270 . 4.910 3.463 2.199 4.487 . 0 0 "[ . 1 . 2]" 1 3131 2 31 SER QB 2 37 PRO HD3 4.430 . 5.090 3.926 2.972 4.357 . 0 0 "[ . 1 . 2]" 1 3132 2 31 SER QB 2 38 LYS H 4.750 . 5.460 4.599 4.299 4.916 . 0 0 "[ . 1 . 2]" 1 3133 2 32 TRP HE1 2 40 ASP QB 5.160 . 5.930 3.125 2.362 4.037 . 0 0 "[ . 1 . 2]" 1 3134 2 35 ALA HA 2 36 GLU QG 4.620 . 5.310 4.377 3.878 4.839 . 0 0 "[ . 1 . 2]" 1 3135 2 35 ALA MB 2 36 GLU QB 4.070 . 4.680 3.756 3.441 4.006 . 0 0 "[ . 1 . 2]" 1 3136 2 35 ALA MB 2 36 GLU QG 3.620 . 4.160 3.200 2.507 4.218 0.058 5 0 "[ . 1 . 2]" 1 3137 2 36 GLU H 2 36 GLU QB 2.800 . 3.220 2.533 2.394 2.704 . 0 0 "[ . 1 . 2]" 1 3138 2 36 GLU H 2 36 GLU QG 3.040 . 3.500 2.205 1.916 2.876 . 0 0 "[ . 1 . 2]" 1 3139 2 36 GLU HA 2 36 GLU QG 3.690 . 4.240 3.051 2.405 3.405 . 0 0 "[ . 1 . 2]" 1 3140 2 36 GLU QB 2 36 GLU QG 2.340 . 2.690 2.082 1.997 2.118 . 0 0 "[ . 1 . 2]" 1 3141 2 36 GLU QB 2 37 PRO HD2 3.500 . 4.030 3.324 2.800 3.807 . 0 0 "[ . 1 . 2]" 1 3142 2 38 LYS H 2 38 LYS QE 4.750 . 5.460 4.426 3.914 5.029 . 0 0 "[ . 1 . 2]" 1 3143 2 38 LYS HB2 2 38 LYS QE 4.540 . 5.220 2.811 2.611 3.167 . 0 0 "[ . 1 . 2]" 1 3144 2 38 LYS QE 2 56 THR MG 4.460 . 5.130 4.407 3.826 5.019 . 0 0 "[ . 1 . 2]" 1 3145 2 39 TYR QB 2 40 ASP H 4.020 . 4.620 3.039 2.875 3.284 . 0 0 "[ . 1 . 2]" 1 3146 2 39 TYR QB 2 57 LEU H 4.070 . 4.680 3.525 3.163 3.772 . 0 0 "[ . 1 . 2]" 1 3147 2 39 TYR QB 2 57 LEU QB 3.920 . 4.510 2.086 1.933 2.285 . 0 0 "[ . 1 . 2]" 1 3148 2 39 TYR QD 2 57 LEU QB 3.810 . 4.380 3.564 3.387 3.731 . 0 0 "[ . 1 . 2]" 1 3149 2 39 TYR QD 2 62 PHE QB 3.730 . 4.290 2.662 2.540 2.790 . 0 0 "[ . 1 . 2]" 1 3150 2 39 TYR QE 2 62 PHE QB 4.590 . 5.280 3.290 2.934 3.470 . 0 0 "[ . 1 . 2]" 1 3151 2 40 ASP H 2 40 ASP QB 3.690 . 4.240 2.565 2.421 2.698 . 0 0 "[ . 1 . 2]" 1 3152 2 40 ASP QB 2 56 THR HA 4.560 . 5.240 3.881 3.525 4.373 . 0 0 "[ . 1 . 2]" 1 3153 2 40 ASP QB 2 56 THR MG 3.940 . 4.530 3.017 2.402 3.971 . 0 0 "[ . 1 . 2]" 1 3154 2 45 SER H 2 49 GLU QG 5.550 . 6.380 5.029 4.423 6.177 . 0 0 "[ . 1 . 2]" 1 3155 2 45 SER QB 2 46 PRO HD2 4.110 . 4.730 2.197 1.965 2.437 . 0 0 "[ . 1 . 2]" 1 3156 2 45 SER QB 2 46 PRO HD3 4.350 . 5.000 3.619 3.215 3.843 . 0 0 "[ . 1 . 2]" 1 3157 2 45 SER QB 2 50 LYS H 4.840 . 5.570 2.853 2.198 3.387 . 0 0 "[ . 1 . 2]" 1 3158 2 45 SER QB 2 50 LYS HB2 4.320 . 4.970 2.082 1.674 3.546 0.126 19 0 "[ . 1 . 2]" 1 3159 2 45 SER QB 2 50 LYS HB3 4.390 . 5.050 3.595 3.104 4.994 . 0 0 "[ . 1 . 2]" 1 3160 2 47 ASP QB 2 48 HIS H 4.050 . 4.660 3.289 3.162 3.466 . 0 0 "[ . 1 . 2]" 1 3161 2 47 ASP QB 2 49 GLU QG 3.470 . 3.990 2.156 1.840 2.582 . 0 0 "[ . 1 . 2]" 1 3162 2 48 HIS H 2 49 GLU QG 4.530 . 5.210 4.036 3.743 4.295 . 0 0 "[ . 1 . 2]" 1 3163 2 49 GLU QG 2 50 LYS H 3.830 . 4.400 2.745 2.451 3.771 . 0 0 "[ . 1 . 2]" 1 3164 2 49 GLU QG 2 50 LYS HB2 4.620 . 5.310 3.575 3.016 5.060 . 0 0 "[ . 1 . 2]" 1 3165 2 49 GLU QG 2 50 LYS HG2 4.980 . 5.730 2.277 1.768 4.288 0.032 11 0 "[ . 1 . 2]" 1 3166 2 50 LYS HA 2 51 MET QG 4.460 . 5.130 3.640 3.417 3.822 . 0 0 "[ . 1 . 2]" 1 3167 2 51 MET H 2 51 MET QG 3.260 . 3.750 2.373 2.040 2.664 . 0 0 "[ . 1 . 2]" 1 3168 2 51 MET HA 2 51 MET QG 3.730 . 4.290 3.408 3.392 3.419 . 0 0 "[ . 1 . 2]" 1 3169 2 52 GLY QA 2 53 LYS HA 4.400 . 5.060 3.953 3.866 4.048 . 0 0 "[ . 1 . 2]" 1 3170 2 53 LYS H 2 53 LYS QB 3.090 . 3.550 2.504 2.358 2.769 . 0 0 "[ . 1 . 2]" 1 3171 2 53 LYS H 2 53 LYS QG 3.050 . 3.510 2.477 2.015 3.396 . 0 0 "[ . 1 . 2]" 1 3172 2 53 LYS QB 2 53 LYS QD 2.780 . 3.200 2.432 2.150 2.875 . 0 0 "[ . 1 . 2]" 1 3173 2 53 LYS QB 2 54 GLY H 3.520 . 4.050 3.413 3.085 3.619 . 0 0 "[ . 1 . 2]" 1 3174 2 53 LYS QD 2 54 GLY H 5.470 . 6.290 4.580 3.573 5.815 . 0 0 "[ . 1 . 2]" 1 3175 2 57 LEU H 2 57 LEU QB 3.660 . 4.210 2.656 2.614 2.689 . 0 0 "[ . 1 . 2]" 1 3176 2 57 LEU QB 2 57 LEU MD1 2.860 . 3.290 2.143 2.130 2.159 . 0 0 "[ . 1 . 2]" 1 3177 2 57 LEU QB 2 57 LEU MD2 3.090 . 3.550 2.385 2.346 2.416 . 0 0 "[ . 1 . 2]" 1 3178 2 57 LEU QB 2 62 PHE HD1 4.340 . 4.990 3.202 2.998 3.452 . 0 0 "[ . 1 . 2]" 1 3179 2 57 LEU MD1 2 62 PHE QB 4.430 . 5.090 3.038 2.802 3.528 . 0 0 "[ . 1 . 2]" 1 3180 2 57 LEU MD2 2 62 PHE QB 4.880 . 5.610 4.269 4.021 4.620 . 0 0 "[ . 1 . 2]" 1 3181 2 59 GLU HA 2 62 PHE QB 4.060 . 4.670 2.948 2.560 3.470 . 0 0 "[ . 1 . 2]" 1 3182 2 60 GLU H 2 60 GLU QB 3.210 . 3.690 2.492 2.376 2.599 . 0 0 "[ . 1 . 2]" 1 3183 2 60 GLU QB 2 61 GLU H 3.330 . 3.830 2.335 2.204 2.805 . 0 0 "[ . 1 . 2]" 1 3184 2 60 GLU QB 2 64 VAL MG2 4.150 . 4.770 3.697 3.549 3.850 . 0 0 "[ . 1 . 2]" 1 3185 2 61 GLU HA 2 61 GLU QG 3.690 . 4.240 2.480 2.359 2.582 . 0 0 "[ . 1 . 2]" 1 3186 2 62 PHE H 2 62 PHE QB 3.310 . 3.810 2.230 2.178 2.256 . 0 0 "[ . 1 . 2]" 1 3187 2 64 VAL MG1 2 68 GLU QG 4.860 . 5.590 2.456 2.207 2.657 . 0 0 "[ . 1 . 2]" 1 3188 2 68 GLU H 2 68 GLU QG 4.150 . 4.770 2.304 2.169 2.466 . 0 0 "[ . 1 . 2]" 1 3189 2 68 GLU HB3 2 68 GLU QG 2.620 . 3.010 2.334 2.283 2.390 . 0 0 "[ . 1 . 2]" 1 3190 2 69 LEU H 2 72 LYS QE 5.760 . 6.620 5.712 4.331 6.424 . 0 0 "[ . 1 . 2]" 1 3191 2 69 LEU HA 2 72 LYS QG 4.360 . 5.010 3.274 2.098 3.985 . 0 0 "[ . 1 . 2]" 1 3192 2 69 LEU HA 2 72 LYS QD 3.330 . 3.830 2.735 2.182 4.115 0.285 7 0 "[ . 1 . 2]" 1 3193 2 69 LEU MD2 2 72 LYS QE 3.630 . 4.170 3.263 2.744 3.674 . 0 0 "[ . 1 . 2]" 1 3194 2 71 ASN HB2 2 72 LYS QG 4.440 . 5.110 3.216 3.012 3.465 . 0 0 "[ . 1 . 2]" 1 3195 2 71 ASN HB2 2 72 LYS QD 4.680 . 5.380 4.933 4.589 5.335 . 0 0 "[ . 1 . 2]" 1 3196 2 71 ASN HB3 2 72 LYS QG 4.580 . 5.270 4.187 3.910 4.719 . 0 0 "[ . 1 . 2]" 1 3197 2 71 ASN HD21 2 72 LYS QG 5.070 . 5.830 4.729 4.432 5.095 . 0 0 "[ . 1 . 2]" 1 3198 2 72 LYS H 2 72 LYS QG 3.970 . 4.570 2.111 1.967 2.225 . 0 0 "[ . 1 . 2]" 1 3199 2 72 LYS H 2 72 LYS QD 3.710 . 4.270 3.800 3.554 3.924 . 0 0 "[ . 1 . 2]" 1 3200 2 72 LYS HA 2 72 LYS QG 3.230 . 3.710 2.445 2.333 2.889 . 0 0 "[ . 1 . 2]" 1 3201 2 72 LYS HA 2 72 LYS QE 5.450 . 6.270 4.608 4.151 5.119 . 0 0 "[ . 1 . 2]" 1 3202 2 72 LYS HB2 2 72 LYS QE 4.880 . 5.610 3.501 2.830 4.522 . 0 0 "[ . 1 . 2]" 1 3203 2 72 LYS HB3 2 72 LYS QE 4.390 . 5.050 3.094 1.976 4.312 . 0 0 "[ . 1 . 2]" 1 3204 2 72 LYS QD 2 72 LYS QG 2.350 . 2.700 2.066 2.020 2.117 . 0 0 "[ . 1 . 2]" 1 3205 2 72 LYS QE 2 72 LYS QG 2.750 . 3.160 2.634 2.374 2.860 . 0 0 "[ . 1 . 2]" 1 3206 2 72 LYS QG 2 73 LEU H 4.230 . 4.860 4.374 4.127 4.516 . 0 0 "[ . 1 . 2]" 1 3207 2 74 GLU H 2 74 GLU QB 2.780 . 3.200 2.492 2.350 2.647 . 0 0 "[ . 1 . 2]" 1 3208 2 74 GLU H 2 74 GLU QG 3.460 . 3.980 2.291 2.060 2.549 . 0 0 "[ . 1 . 2]" 1 3209 2 74 GLU HA 2 74 GLU QG 3.360 . 3.860 2.838 2.398 3.413 . 0 0 "[ . 1 . 2]" 1 3210 2 74 GLU QB 2 74 GLU QG 2.310 . 2.660 2.096 2.013 2.119 . 0 0 "[ . 1 . 2]" 1 3211 2 74 GLU QB 2 75 HIS H 4.330 . 4.980 2.921 1.999 3.758 . 0 0 "[ . 1 . 2]" 1 stop_ save_ save_distance_constraint_statistics_2 _Distance_constraint_stats_list.Sf_category distance_constraint_statistics _Distance_constraint_stats_list.Constraint_list_ID 2 _Distance_constraint_stats_list.Constraint_count 130 _Distance_constraint_stats_list.Viol_count 404 _Distance_constraint_stats_list.Viol_total 521.701 _Distance_constraint_stats_list.Viol_max 0.426 _Distance_constraint_stats_list.Viol_rms 0.0327 _Distance_constraint_stats_list.Viol_average_all_restraints 0.0100 _Distance_constraint_stats_list.Viol_average_violations_only 0.0646 _Distance_constraint_stats_list.Cutoff_violation_report 0.500 _Distance_constraint_stats_list.Details . 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 8 GLU 1.004 0.142 4 0 "[ . 1 . 2]" 1 10 ILE 0.000 0.000 . 0 "[ . 1 . 2]" 1 11 GLU 1.432 0.123 1 0 "[ . 1 . 2]" 1 13 LEU 1.039 0.129 13 0 "[ . 1 . 2]" 1 14 ILE 0.000 0.000 . 0 "[ . 1 . 2]" 1 17 SER 1.200 0.102 1 0 "[ . 1 . 2]" 1 19 ASN 4.701 0.246 10 0 "[ . 1 . 2]" 1 22 GLY 4.701 0.246 10 0 "[ . 1 . 2]" 1 24 ARG 0.000 0.000 . 0 "[ . 1 . 2]" 1 25 LYS 1.200 0.102 1 0 "[ . 1 . 2]" 1 26 GLU 0.740 0.083 16 0 "[ . 1 . 2]" 1 27 LEU 1.039 0.129 13 0 "[ . 1 . 2]" 1 29 ARG 1.432 0.123 1 0 "[ . 1 . 2]" 1 30 VAL 0.032 0.017 15 0 "[ . 1 . 2]" 1 31 SER 1.004 0.142 4 0 "[ . 1 . 2]" 1 38 LYS 0.032 0.017 15 0 "[ . 1 . 2]" 1 39 TYR 0.000 0.000 . 0 "[ . 1 . 2]" 1 41 ILE 0.216 0.060 11 0 "[ . 1 . 2]" 1 42 ARG 1.780 0.426 20 0 "[ . 1 . 2]" 1 44 TRP 0.000 0.000 . 0 "[ . 1 . 2]" 1 45 SER 0.186 0.119 2 0 "[ . 1 . 2]" 1 50 LYS 0.186 0.119 2 0 "[ . 1 . 2]" 1 52 GLY 1.040 0.426 20 0 "[ . 1 . 2]" 1 55 ILE 0.216 0.060 11 0 "[ . 1 . 2]" 1 57 LEU 0.000 0.000 . 0 "[ . 1 . 2]" 1 58 SER 0.000 0.000 . 0 "[ . 1 . 2]" 1 59 GLU 0.032 0.018 4 0 "[ . 1 . 2]" 1 60 GLU 0.016 0.012 19 0 "[ . 1 . 2]" 1 61 GLU 0.339 0.060 9 0 "[ . 1 . 2]" 1 62 PHE 0.000 0.000 . 0 "[ . 1 . 2]" 1 63 GLY 0.138 0.026 19 0 "[ . 1 . 2]" 1 64 VAL 0.042 0.023 19 0 "[ . 1 . 2]" 1 65 LEU 0.339 0.060 9 0 "[ . 1 . 2]" 1 66 LEU 0.013 0.013 6 0 "[ . 1 . 2]" 1 67 LYS 0.905 0.123 19 0 "[ . 1 . 2]" 1 68 GLU 0.058 0.023 19 0 "[ . 1 . 2]" 1 69 LEU 0.000 0.000 . 0 "[ . 1 . 2]" 1 70 GLY 0.013 0.013 6 0 "[ . 1 . 2]" 1 71 ASN 0.798 0.123 19 0 "[ . 1 . 2]" 1 72 LYS 0.032 0.021 14 0 "[ . 1 . 2]" 2 8 GLU 0.726 0.081 14 0 "[ . 1 . 2]" 2 10 ILE 0.000 0.000 . 0 "[ . 1 . 2]" 2 11 GLU 1.738 0.124 18 0 "[ . 1 . 2]" 2 13 LEU 0.962 0.145 4 0 "[ . 1 . 2]" 2 14 ILE 0.005 0.005 16 0 "[ . 1 . 2]" 2 17 SER 1.578 0.112 12 0 "[ . 1 . 2]" 2 19 ASN 4.818 0.232 13 0 "[ . 1 . 2]" 2 22 GLY 4.818 0.232 13 0 "[ . 1 . 2]" 2 24 ARG 0.000 0.000 . 0 "[ . 1 . 2]" 2 25 LYS 1.578 0.112 12 0 "[ . 1 . 2]" 2 26 GLU 0.948 0.094 1 0 "[ . 1 . 2]" 2 27 LEU 0.967 0.145 4 0 "[ . 1 . 2]" 2 29 ARG 1.738 0.124 18 0 "[ . 1 . 2]" 2 30 VAL 0.000 0.000 . 0 "[ . 1 . 2]" 2 31 SER 0.726 0.081 14 0 "[ . 1 . 2]" 2 38 LYS 0.000 0.000 . 0 "[ . 1 . 2]" 2 39 TYR 0.000 0.000 . 0 "[ . 1 . 2]" 2 41 ILE 0.253 0.083 1 0 "[ . 1 . 2]" 2 42 ARG 1.231 0.198 5 0 "[ . 1 . 2]" 2 44 TRP 0.000 0.000 . 0 "[ . 1 . 2]" 2 45 SER 0.130 0.066 6 0 "[ . 1 . 2]" 2 50 LYS 0.130 0.066 6 0 "[ . 1 . 2]" 2 52 GLY 0.283 0.198 5 0 "[ . 1 . 2]" 2 55 ILE 0.253 0.083 1 0 "[ . 1 . 2]" 2 57 LEU 0.000 0.000 . 0 "[ . 1 . 2]" 2 58 SER 0.000 0.000 . 0 "[ . 1 . 2]" 2 59 GLU 0.056 0.016 7 0 "[ . 1 . 2]" 2 60 GLU 0.002 0.002 4 0 "[ . 1 . 2]" 2 61 GLU 0.300 0.064 5 0 "[ . 1 . 2]" 2 62 PHE 0.000 0.000 . 0 "[ . 1 . 2]" 2 63 GLY 0.345 0.060 15 0 "[ . 1 . 2]" 2 64 VAL 0.058 0.056 15 0 "[ . 1 . 2]" 2 65 LEU 0.300 0.064 5 0 "[ . 1 . 2]" 2 66 LEU 0.000 0.000 . 0 "[ . 1 . 2]" 2 67 LYS 1.234 0.111 7 0 "[ . 1 . 2]" 2 68 GLU 0.101 0.056 15 0 "[ . 1 . 2]" 2 69 LEU 0.000 0.000 . 0 "[ . 1 . 2]" 2 70 GLY 0.000 0.000 . 0 "[ . 1 . 2]" 2 71 ASN 0.945 0.111 7 0 "[ . 1 . 2]" 2 72 LYS 0.045 0.030 18 0 "[ . 1 . 2]" stop_ loop_ _Distance_constraint_stats.Restraint_ID _Distance_constraint_stats.Atom_1_entity_assembly_ID _Distance_constraint_stats.Atom_1_comp_index_ID _Distance_constraint_stats.Atom_1_comp_ID _Distance_constraint_stats.Atom_1_ID _Distance_constraint_stats.Atom_2_entity_assembly_ID _Distance_constraint_stats.Atom_2_comp_index_ID _Distance_constraint_stats.Atom_2_comp_ID _Distance_constraint_stats.Atom_2_ID _Distance_constraint_stats.Node_1_distance_val _Distance_constraint_stats.Node_1_distance_lower_bound_val _Distance_constraint_stats.Node_1_distance_upper_bound_val _Distance_constraint_stats.Distance_average _Distance_constraint_stats.Distance_minimum _Distance_constraint_stats.Distance_maximum _Distance_constraint_stats.Max_violation _Distance_constraint_stats.Max_violation_model_number _Distance_constraint_stats.Over_cutoff_violation_count _Distance_constraint_stats.Over_cutoff_viol_per_model _Distance_constraint_stats.Distance_constraint_stats_ID 1 1 42 ARG NE 1 52 GLY O 3.200 2.700 3.600 3.395 2.876 4.026 0.426 20 0 "[ . 1 . 2]" 2 2 2 42 ARG NE 2 52 GLY O 3.200 2.700 3.600 3.248 2.918 3.798 0.198 5 0 "[ . 1 . 2]" 2 3 1 19 ASN H 1 22 GLY O 1.900 . 2.100 2.293 2.241 2.346 0.246 10 0 "[ . 1 . 2]" 2 4 1 19 ASN N 1 22 GLY O 3.000 2.700 3.300 3.224 3.182 3.246 . 0 0 "[ . 1 . 2]" 2 5 1 19 ASN O 1 22 GLY H 1.900 . 2.100 2.140 2.063 2.219 0.119 7 0 "[ . 1 . 2]" 2 6 1 19 ASN O 1 22 GLY N 3.000 2.700 3.300 2.873 2.827 2.941 . 0 0 "[ . 1 . 2]" 2 7 1 14 ILE O 1 27 LEU H 1.900 . 2.100 1.969 1.883 2.064 . 0 0 "[ . 1 . 2]" 2 8 1 14 ILE O 1 27 LEU N 3.000 2.700 3.300 2.874 2.811 2.917 . 0 0 "[ . 1 . 2]" 2 9 1 14 ILE H 1 27 LEU O 1.900 . 2.100 1.987 1.922 2.056 . 0 0 "[ . 1 . 2]" 2 10 1 14 ILE N 1 27 LEU O 3.000 2.700 3.300 2.955 2.894 3.027 . 0 0 "[ . 1 . 2]" 2 11 1 13 LEU H 1 27 LEU O 1.900 . 2.100 2.151 2.082 2.229 0.129 13 0 "[ . 1 . 2]" 2 12 1 13 LEU N 1 27 LEU O 3.000 2.700 3.300 2.995 2.928 3.078 . 0 0 "[ . 1 . 2]" 2 13 1 17 SER O 1 25 LYS H 1.900 . 2.100 2.160 2.095 2.202 0.102 1 0 "[ . 1 . 2]" 2 14 1 17 SER O 1 25 LYS N 3.000 2.700 3.300 2.901 2.801 2.999 . 0 0 "[ . 1 . 2]" 2 15 1 24 ARG H 1 44 TRP O 1.900 . 2.100 2.041 1.967 2.081 . 0 0 "[ . 1 . 2]" 2 16 1 24 ARG N 1 44 TRP O 3.000 2.700 3.300 2.839 2.786 2.906 . 0 0 "[ . 1 . 2]" 2 17 1 24 ARG O 1 44 TRP H 1.900 . 2.100 1.987 1.922 2.065 . 0 0 "[ . 1 . 2]" 2 18 1 24 ARG O 1 44 TRP N 3.000 2.700 3.300 2.940 2.852 2.997 . 0 0 "[ . 1 . 2]" 2 19 1 26 GLU O 1 42 ARG H 1.900 . 2.100 2.131 2.053 2.183 0.083 16 0 "[ . 1 . 2]" 2 20 1 26 GLU O 1 42 ARG N 3.000 2.700 3.300 3.104 2.981 3.166 . 0 0 "[ . 1 . 2]" 2 21 1 26 GLU H 1 42 ARG O 1.900 . 2.100 2.026 1.964 2.121 0.021 16 0 "[ . 1 . 2]" 2 22 1 26 GLU N 1 42 ARG O 3.000 2.700 3.300 2.930 2.849 3.010 . 0 0 "[ . 1 . 2]" 2 23 1 8 GLU H 1 31 SER O 1.900 . 2.100 2.146 2.072 2.242 0.142 4 0 "[ . 1 . 2]" 2 24 1 8 GLU N 1 31 SER O 3.000 2.700 3.300 3.010 2.907 3.113 . 0 0 "[ . 1 . 2]" 2 25 1 8 GLU O 1 31 SER H 1.900 . 2.100 1.968 1.892 2.043 . 0 0 "[ . 1 . 2]" 2 26 1 8 GLU O 1 31 SER N 3.000 2.700 3.300 2.910 2.807 3.000 . 0 0 "[ . 1 . 2]" 2 27 1 10 ILE H 1 29 ARG O 1.900 . 2.100 1.974 1.928 2.022 . 0 0 "[ . 1 . 2]" 2 28 1 10 ILE N 1 29 ARG O 3.000 2.700 3.300 2.796 2.760 2.846 . 0 0 "[ . 1 . 2]" 2 29 1 11 GLU H 1 29 ARG O 1.900 . 2.100 2.172 2.103 2.223 0.123 1 0 "[ . 1 . 2]" 2 30 1 11 GLU N 1 29 ARG O 3.000 2.700 3.300 3.130 3.030 3.196 . 0 0 "[ . 1 . 2]" 2 31 1 11 GLU O 1 29 ARG H 1.900 . 2.100 1.907 1.859 1.979 . 0 0 "[ . 1 . 2]" 2 32 1 11 GLU O 1 29 ARG N 3.000 2.700 3.300 2.808 2.725 2.861 . 0 0 "[ . 1 . 2]" 2 33 1 30 VAL O 1 38 LYS H 1.900 . 2.100 2.029 1.960 2.117 0.017 15 0 "[ . 1 . 2]" 2 34 1 30 VAL O 1 38 LYS N 3.000 2.700 3.300 3.002 2.922 3.097 . 0 0 "[ . 1 . 2]" 2 35 1 30 VAL H 1 38 LYS O 1.900 . 2.100 2.021 1.934 2.074 . 0 0 "[ . 1 . 2]" 2 36 1 30 VAL N 1 38 LYS O 3.000 2.700 3.300 2.907 2.832 2.970 . 0 0 "[ . 1 . 2]" 2 37 1 39 TYR O 1 57 LEU H 1.900 . 2.100 1.889 1.841 1.959 . 0 0 "[ . 1 . 2]" 2 38 1 39 TYR O 1 57 LEU N 3.000 2.700 3.300 2.815 2.727 2.901 . 0 0 "[ . 1 . 2]" 2 39 1 41 ILE H 1 55 ILE O 1.900 . 2.100 2.094 2.043 2.160 0.060 11 0 "[ . 1 . 2]" 2 40 1 41 ILE N 1 55 ILE O 3.000 2.700 3.300 3.025 2.976 3.114 . 0 0 "[ . 1 . 2]" 2 41 1 41 ILE O 1 55 ILE H 1.900 . 2.100 2.033 1.917 2.150 0.050 2 0 "[ . 1 . 2]" 2 42 1 41 ILE O 1 55 ILE N 3.000 2.700 3.300 2.963 2.862 3.087 . 0 0 "[ . 1 . 2]" 2 43 1 45 SER H 1 50 LYS O 1.900 . 2.100 2.096 2.047 2.219 0.119 2 0 "[ . 1 . 2]" 2 44 1 45 SER N 1 50 LYS O 3.000 2.700 3.300 3.015 2.940 3.087 . 0 0 "[ . 1 . 2]" 2 45 2 19 ASN H 2 22 GLY O 1.900 . 2.100 2.289 2.230 2.332 0.232 13 0 "[ . 1 . 2]" 2 46 2 19 ASN N 2 22 GLY O 3.000 2.700 3.300 3.223 3.192 3.255 . 0 0 "[ . 1 . 2]" 2 47 2 19 ASN O 2 22 GLY H 1.900 . 2.100 2.150 2.086 2.217 0.117 20 0 "[ . 1 . 2]" 2 48 2 19 ASN O 2 22 GLY N 3.000 2.700 3.300 2.875 2.841 2.911 . 0 0 "[ . 1 . 2]" 2 49 2 14 ILE O 2 27 LEU H 1.900 . 2.100 1.975 1.888 2.105 0.005 16 0 "[ . 1 . 2]" 2 50 2 14 ILE O 2 27 LEU N 3.000 2.700 3.300 2.888 2.831 3.030 . 0 0 "[ . 1 . 2]" 2 51 2 14 ILE H 2 27 LEU O 1.900 . 2.100 1.993 1.920 2.041 . 0 0 "[ . 1 . 2]" 2 52 2 14 ILE N 2 27 LEU O 3.000 2.700 3.300 2.963 2.886 3.012 . 0 0 "[ . 1 . 2]" 2 53 2 13 LEU H 2 27 LEU O 1.900 . 2.100 2.148 2.099 2.245 0.145 4 0 "[ . 1 . 2]" 2 54 2 13 LEU N 2 27 LEU O 3.000 2.700 3.300 2.988 2.921 3.082 . 0 0 "[ . 1 . 2]" 2 55 2 17 SER O 2 25 LYS H 1.900 . 2.100 2.179 2.138 2.212 0.112 12 0 "[ . 1 . 2]" 2 56 2 17 SER O 2 25 LYS N 3.000 2.700 3.300 2.935 2.870 3.032 . 0 0 "[ . 1 . 2]" 2 57 2 24 ARG H 2 44 TRP O 1.900 . 2.100 2.022 1.945 2.086 . 0 0 "[ . 1 . 2]" 2 58 2 24 ARG N 2 44 TRP O 3.000 2.700 3.300 2.828 2.780 2.865 . 0 0 "[ . 1 . 2]" 2 59 2 24 ARG O 2 44 TRP H 1.900 . 2.100 1.982 1.922 2.035 . 0 0 "[ . 1 . 2]" 2 60 2 24 ARG O 2 44 TRP N 3.000 2.700 3.300 2.938 2.825 3.009 . 0 0 "[ . 1 . 2]" 2 61 2 26 GLU O 2 42 ARG H 1.900 . 2.100 2.147 2.099 2.194 0.094 1 0 "[ . 1 . 2]" 2 62 2 26 GLU O 2 42 ARG N 3.000 2.700 3.300 3.128 3.079 3.184 . 0 0 "[ . 1 . 2]" 2 63 2 26 GLU H 2 42 ARG O 1.900 . 2.100 2.024 1.963 2.098 . 0 0 "[ . 1 . 2]" 2 64 2 26 GLU N 2 42 ARG O 3.000 2.700 3.300 2.938 2.894 3.000 . 0 0 "[ . 1 . 2]" 2 65 2 8 GLU H 2 31 SER O 1.900 . 2.100 2.135 2.083 2.181 0.081 14 0 "[ . 1 . 2]" 2 66 2 8 GLU N 2 31 SER O 3.000 2.700 3.300 3.001 2.947 3.067 . 0 0 "[ . 1 . 2]" 2 67 2 8 GLU O 2 31 SER H 1.900 . 2.100 1.969 1.918 2.061 . 0 0 "[ . 1 . 2]" 2 68 2 8 GLU O 2 31 SER N 3.000 2.700 3.300 2.915 2.869 3.005 . 0 0 "[ . 1 . 2]" 2 69 2 10 ILE H 2 29 ARG O 1.900 . 2.100 1.951 1.920 1.993 . 0 0 "[ . 1 . 2]" 2 70 2 10 ILE N 2 29 ARG O 3.000 2.700 3.300 2.791 2.761 2.832 . 0 0 "[ . 1 . 2]" 2 71 2 11 GLU H 2 29 ARG O 1.900 . 2.100 2.187 2.138 2.224 0.124 18 0 "[ . 1 . 2]" 2 72 2 11 GLU N 2 29 ARG O 3.000 2.700 3.300 3.146 3.073 3.197 . 0 0 "[ . 1 . 2]" 2 73 2 11 GLU O 2 29 ARG H 1.900 . 2.100 1.920 1.859 2.051 . 0 0 "[ . 1 . 2]" 2 74 2 11 GLU O 2 29 ARG N 3.000 2.700 3.300 2.810 2.721 2.860 . 0 0 "[ . 1 . 2]" 2 75 2 30 VAL O 2 38 LYS H 1.900 . 2.100 2.022 1.963 2.084 . 0 0 "[ . 1 . 2]" 2 76 2 30 VAL O 2 38 LYS N 3.000 2.700 3.300 2.994 2.935 3.059 . 0 0 "[ . 1 . 2]" 2 77 2 30 VAL H 2 38 LYS O 1.900 . 2.100 2.033 1.916 2.099 . 0 0 "[ . 1 . 2]" 2 78 2 30 VAL N 2 38 LYS O 3.000 2.700 3.300 2.927 2.817 3.039 . 0 0 "[ . 1 . 2]" 2 79 2 39 TYR O 2 57 LEU H 1.900 . 2.100 1.890 1.836 2.002 . 0 0 "[ . 1 . 2]" 2 80 2 39 TYR O 2 57 LEU N 3.000 2.700 3.300 2.813 2.733 2.877 . 0 0 "[ . 1 . 2]" 2 81 2 41 ILE H 2 55 ILE O 1.900 . 2.100 2.106 2.072 2.183 0.083 1 0 "[ . 1 . 2]" 2 82 2 41 ILE N 2 55 ILE O 3.000 2.700 3.300 3.052 3.015 3.123 . 0 0 "[ . 1 . 2]" 2 83 2 41 ILE O 2 55 ILE H 1.900 . 2.100 2.004 1.925 2.082 . 0 0 "[ . 1 . 2]" 2 84 2 41 ILE O 2 55 ILE N 3.000 2.700 3.300 2.948 2.880 3.011 . 0 0 "[ . 1 . 2]" 2 85 2 45 SER H 2 50 LYS O 1.900 . 2.100 2.088 2.041 2.166 0.066 6 0 "[ . 1 . 2]" 2 86 2 45 SER N 2 50 LYS O 3.000 2.700 3.300 3.018 2.942 3.075 . 0 0 "[ . 1 . 2]" 2 87 1 58 SER O 1 62 PHE H 1.900 . 2.100 1.976 1.910 2.023 . 0 0 "[ . 1 . 2]" 2 88 1 58 SER O 1 62 PHE N 3.000 2.700 3.300 2.929 2.846 2.987 . 0 0 "[ . 1 . 2]" 2 89 1 59 GLU O 1 63 GLY H 1.900 . 2.100 2.076 1.958 2.118 0.018 4 0 "[ . 1 . 2]" 2 90 1 59 GLU O 1 63 GLY N 3.000 2.700 3.300 2.912 2.811 2.975 . 0 0 "[ . 1 . 2]" 2 91 1 60 GLU O 1 64 VAL H 1.900 . 2.100 2.050 1.944 2.112 0.012 19 0 "[ . 1 . 2]" 2 92 1 60 GLU O 1 64 VAL N 3.000 2.700 3.300 2.977 2.870 3.091 . 0 0 "[ . 1 . 2]" 2 93 1 61 GLU O 1 65 LEU H 1.900 . 2.100 2.098 1.991 2.160 0.060 9 0 "[ . 1 . 2]" 2 94 1 61 GLU O 1 65 LEU N 3.000 2.700 3.300 2.988 2.886 3.051 . 0 0 "[ . 1 . 2]" 2 95 1 62 PHE O 1 66 LEU H 1.900 . 2.100 2.009 1.963 2.062 . 0 0 "[ . 1 . 2]" 2 96 1 62 PHE O 1 66 LEU N 3.000 2.700 3.300 2.951 2.910 3.005 . 0 0 "[ . 1 . 2]" 2 97 1 63 GLY O 1 67 LYS H 1.900 . 2.100 2.091 2.054 2.126 0.026 19 0 "[ . 1 . 2]" 2 98 1 63 GLY O 1 67 LYS N 3.000 2.700 3.300 3.036 2.958 3.075 . 0 0 "[ . 1 . 2]" 2 99 1 64 VAL O 1 68 GLU H 1.900 . 2.100 2.078 2.033 2.123 0.023 19 0 "[ . 1 . 2]" 2 100 1 64 VAL O 1 68 GLU N 3.000 2.700 3.300 3.045 2.981 3.098 . 0 0 "[ . 1 . 2]" 2 101 1 65 LEU O 1 69 LEU H 1.900 . 2.100 1.961 1.916 2.021 . 0 0 "[ . 1 . 2]" 2 102 1 65 LEU O 1 69 LEU N 3.000 2.700 3.300 2.867 2.791 2.947 . 0 0 "[ . 1 . 2]" 2 103 1 66 LEU O 1 70 GLY H 1.900 . 2.100 2.047 1.958 2.113 0.013 6 0 "[ . 1 . 2]" 2 104 1 66 LEU O 1 70 GLY N 3.000 2.700 3.300 2.944 2.866 3.048 . 0 0 "[ . 1 . 2]" 2 105 1 67 LYS O 1 71 ASN H 1.900 . 2.100 2.140 2.107 2.223 0.123 19 0 "[ . 1 . 2]" 2 106 1 67 LYS O 1 71 ASN N 3.000 2.700 3.300 3.021 2.972 3.093 . 0 0 "[ . 1 . 2]" 2 107 1 68 GLU O 1 72 LYS H 1.900 . 2.100 2.035 1.916 2.121 0.021 14 0 "[ . 1 . 2]" 2 108 1 68 GLU O 1 72 LYS N 3.000 2.700 3.300 2.987 2.863 3.096 . 0 0 "[ . 1 . 2]" 2 109 2 58 SER O 2 62 PHE H 1.900 . 2.100 1.988 1.937 2.065 . 0 0 "[ . 1 . 2]" 2 110 2 58 SER O 2 62 PHE N 3.000 2.700 3.300 2.941 2.850 3.038 . 0 0 "[ . 1 . 2]" 2 111 2 59 GLU O 2 63 GLY H 1.900 . 2.100 2.081 2.025 2.116 0.016 7 0 "[ . 1 . 2]" 2 112 2 59 GLU O 2 63 GLY N 3.000 2.700 3.300 2.912 2.854 2.978 . 0 0 "[ . 1 . 2]" 2 113 2 60 GLU O 2 64 VAL H 1.900 . 2.100 2.051 1.968 2.102 0.002 4 0 "[ . 1 . 2]" 2 114 2 60 GLU O 2 64 VAL N 3.000 2.700 3.300 2.985 2.921 3.056 . 0 0 "[ . 1 . 2]" 2 115 2 61 GLU O 2 65 LEU H 1.900 . 2.100 2.090 2.010 2.164 0.064 5 0 "[ . 1 . 2]" 2 116 2 61 GLU O 2 65 LEU N 3.000 2.700 3.300 2.979 2.895 3.069 . 0 0 "[ . 1 . 2]" 2 117 2 62 PHE O 2 66 LEU H 1.900 . 2.100 2.008 1.966 2.085 . 0 0 "[ . 1 . 2]" 2 118 2 62 PHE O 2 66 LEU N 3.000 2.700 3.300 2.954 2.910 3.046 . 0 0 "[ . 1 . 2]" 2 119 2 63 GLY O 2 67 LYS H 1.900 . 2.100 2.105 2.023 2.160 0.060 15 0 "[ . 1 . 2]" 2 120 2 63 GLY O 2 67 LYS N 3.000 2.700 3.300 3.053 2.955 3.126 . 0 0 "[ . 1 . 2]" 2 121 2 64 VAL O 2 68 GLU H 1.900 . 2.100 2.069 1.977 2.156 0.056 15 0 "[ . 1 . 2]" 2 122 2 64 VAL O 2 68 GLU N 3.000 2.700 3.300 3.040 2.954 3.145 . 0 0 "[ . 1 . 2]" 2 123 2 65 LEU O 2 69 LEU H 1.900 . 2.100 1.966 1.911 2.015 . 0 0 "[ . 1 . 2]" 2 124 2 65 LEU O 2 69 LEU N 3.000 2.700 3.300 2.871 2.766 2.934 . 0 0 "[ . 1 . 2]" 2 125 2 66 LEU O 2 70 GLY H 1.900 . 2.100 2.047 1.989 2.082 . 0 0 "[ . 1 . 2]" 2 126 2 66 LEU O 2 70 GLY N 3.000 2.700 3.300 2.935 2.859 3.002 . 0 0 "[ . 1 . 2]" 2 127 2 67 LYS O 2 71 ASN H 1.900 . 2.100 2.146 2.090 2.211 0.111 7 0 "[ . 1 . 2]" 2 128 2 67 LYS O 2 71 ASN N 3.000 2.700 3.300 3.019 2.961 3.083 . 0 0 "[ . 1 . 2]" 2 129 2 68 GLU O 2 72 LYS H 1.900 . 2.100 2.030 1.956 2.130 0.030 18 0 "[ . 1 . 2]" 2 130 2 68 GLU O 2 72 LYS N 3.000 2.700 3.300 2.987 2.867 3.115 . 0 0 "[ . 1 . 2]" 2 stop_ save_
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