NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | cing | in_recoord | stage | program | type | subtype | subsubtype |
377854 | 1ggw | cing | recoord | 4-filtered-FRED | Wattos | check | violation | distance |
data_1ggw 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 1791 _Distance_constraint_stats_list.Viol_count 2133 _Distance_constraint_stats_list.Viol_total 2115.508 _Distance_constraint_stats_list.Viol_max 0.153 _Distance_constraint_stats_list.Viol_rms 0.0097 _Distance_constraint_stats_list.Viol_average_all_restraints 0.0017 _Distance_constraint_stats_list.Viol_average_violations_only 0.0381 _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 1 SER 0.015 0.010 2 0 "[ . 1 . 2 . ]" 1 2 THR 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 3 ASP 0.249 0.123 7 0 "[ . 1 . 2 . ]" 1 4 ASP 2.080 0.123 7 0 "[ . 1 . 2 . ]" 1 5 SER 0.567 0.047 20 0 "[ . 1 . 2 . ]" 1 6 PRO 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 7 TYR 1.432 0.145 18 0 "[ . 1 . 2 . ]" 1 8 LYS 2.466 0.145 18 0 "[ . 1 . 2 . ]" 1 9 GLN 0.435 0.068 18 0 "[ . 1 . 2 . ]" 1 10 ALA 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 11 PHE 4.407 0.132 8 0 "[ . 1 . 2 . ]" 1 12 SER 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 13 LEU 3.428 0.086 13 0 "[ . 1 . 2 . ]" 1 14 PHE 0.273 0.061 18 0 "[ . 1 . 2 . ]" 1 15 ASP 0.453 0.067 8 0 "[ . 1 . 2 . ]" 1 16 ARG 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 17 HIS 1.539 0.086 25 0 "[ . 1 . 2 . ]" 1 18 GLY 0.303 0.067 8 0 "[ . 1 . 2 . ]" 1 19 THR 0.172 0.035 26 0 "[ . 1 . 2 . ]" 1 20 GLY 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 21 ARG 1.233 0.058 7 0 "[ . 1 . 2 . ]" 1 22 ILE 0.142 0.035 25 0 "[ . 1 . 2 . ]" 1 23 PRO 0.007 0.007 13 0 "[ . 1 . 2 . ]" 1 24 LYS 4.013 0.087 9 0 "[ . 1 . 2 . ]" 1 25 THR 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 26 SER 0.212 0.061 18 0 "[ . 1 . 2 . ]" 1 27 ILE 1.835 0.069 11 0 "[ . 1 . 2 . ]" 1 28 GLY 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 29 ASP 3.161 0.142 25 0 "[ . 1 . 2 . ]" 1 30 LEU 1.436 0.056 7 0 "[ . 1 . 2 . ]" 1 31 LEU 0.664 0.057 19 0 "[ . 1 . 2 . ]" 1 32 ARG 3.921 0.099 6 0 "[ . 1 . 2 . ]" 1 33 ALA 0.037 0.020 26 0 "[ . 1 . 2 . ]" 1 34 CYS 1.438 0.091 8 0 "[ . 1 . 2 . ]" 1 35 GLY 0.018 0.018 15 0 "[ . 1 . 2 . ]" 1 36 GLN 3.360 0.091 8 0 "[ . 1 . 2 . ]" 1 37 ASN 1.433 0.073 18 0 "[ . 1 . 2 . ]" 1 38 PRO 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 39 THR 1.291 0.078 23 0 "[ . 1 . 2 . ]" 1 40 LEU 3.308 0.104 10 0 "[ . 1 . 2 . ]" 1 41 ALA 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 42 GLU 1.198 0.078 23 0 "[ . 1 . 2 . ]" 1 43 ILE 5.214 0.091 10 0 "[ . 1 . 2 . ]" 1 44 THR 1.411 0.063 18 0 "[ . 1 . 2 . ]" 1 45 GLU 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 46 ILE 0.755 0.067 26 0 "[ . 1 . 2 . ]" 1 47 GLU 4.338 0.129 3 0 "[ . 1 . 2 . ]" 1 48 SER 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 49 THR 1.050 0.092 21 0 "[ . 1 . 2 . ]" 1 50 LEU 2.559 0.115 26 0 "[ . 1 . 2 . ]" 1 51 PRO 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 52 ALA 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 53 GLU 2.611 0.125 21 0 "[ . 1 . 2 . ]" 1 54 VAL 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 55 ASP 1.458 0.125 21 0 "[ . 1 . 2 . ]" 1 56 MET 0.657 0.082 21 0 "[ . 1 . 2 . ]" 1 57 GLU 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 58 GLN 2.427 0.115 26 0 "[ . 1 . 2 . ]" 1 59 PHE 2.730 0.053 21 0 "[ . 1 . 2 . ]" 1 60 LEU 0.765 0.054 17 0 "[ . 1 . 2 . ]" 1 61 GLN 0.218 0.049 13 0 "[ . 1 . 2 . ]" 1 62 VAL 1.006 0.099 1 0 "[ . 1 . 2 . ]" 1 63 LEU 2.586 0.121 25 0 "[ . 1 . 2 . ]" 1 64 ASN 0.532 0.068 25 0 "[ . 1 . 2 . ]" 1 65 ARG 1.067 0.085 15 0 "[ . 1 . 2 . ]" 1 66 PRO 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 67 ASN 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 68 GLY 0.012 0.006 17 0 "[ . 1 . 2 . ]" 1 69 PHE 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 70 ASP 0.174 0.057 2 0 "[ . 1 . 2 . ]" 1 71 MET 0.044 0.022 19 0 "[ . 1 . 2 . ]" 1 72 PRO 0.188 0.062 22 0 "[ . 1 . 2 . ]" 1 73 GLY 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 74 ASP 0.820 0.057 2 0 "[ . 1 . 2 . ]" 1 75 PRO 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 76 GLU 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 77 GLU 1.086 0.069 10 0 "[ . 1 . 2 . ]" 1 78 PHE 2.430 0.153 5 0 "[ . 1 . 2 . ]" 1 79 VAL 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 80 LYS 0.623 0.036 21 0 "[ . 1 . 2 . ]" 1 81 GLY 1.017 0.074 15 0 "[ . 1 . 2 . ]" 1 82 PHE 0.910 0.074 5 0 "[ . 1 . 2 . ]" 1 83 GLN 0.581 0.060 14 0 "[ . 1 . 2 . ]" 1 84 VAL 0.508 0.074 5 0 "[ . 1 . 2 . ]" 1 85 PHE 0.047 0.047 6 0 "[ . 1 . 2 . ]" 1 86 ASP 0.580 0.088 18 0 "[ . 1 . 2 . ]" 1 87 LYS 0.061 0.020 24 0 "[ . 1 . 2 . ]" 1 88 ASP 0.872 0.096 12 0 "[ . 1 . 2 . ]" 1 89 ALA 0.145 0.034 12 0 "[ . 1 . 2 . ]" 1 90 THR 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 91 GLY 0.091 0.034 12 0 "[ . 1 . 2 . ]" 1 92 MET 1.009 0.100 4 0 "[ . 1 . 2 . ]" 1 93 ILE 1.841 0.100 4 0 "[ . 1 . 2 . ]" 1 94 GLY 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 95 VAL 0.832 0.066 6 0 "[ . 1 . 2 . ]" 1 96 GLY 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 97 GLU 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 98 LEU 0.258 0.039 8 0 "[ . 1 . 2 . ]" 1 99 ARG 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 100 TYR 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 101 VAL 1.493 0.076 16 0 "[ . 1 . 2 . ]" 1 102 LEU 1.493 0.076 16 0 "[ . 1 . 2 . ]" 1 103 THR 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 104 SER 0.305 0.042 9 0 "[ . 1 . 2 . ]" 1 105 LEU 2.038 0.058 23 0 "[ . 1 . 2 . ]" 1 106 GLY 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 107 GLU 4.119 0.098 6 0 "[ . 1 . 2 . ]" 1 108 LYS 1.732 0.053 25 0 "[ . 1 . 2 . ]" 1 109 LEU 1.396 0.052 9 0 "[ . 1 . 2 . ]" 1 110 SER 2.328 0.098 6 0 "[ . 1 . 2 . ]" 1 111 ASN 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 112 GLU 0.002 0.001 8 0 "[ . 1 . 2 . ]" 1 113 GLU 0.312 0.052 9 0 "[ . 1 . 2 . ]" 1 114 MET 1.130 0.059 4 0 "[ . 1 . 2 . ]" 1 115 ASP 0.097 0.029 4 0 "[ . 1 . 2 . ]" 1 116 GLU 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 117 LEU 1.857 0.059 4 0 "[ . 1 . 2 . ]" 1 118 LEU 1.832 0.066 6 0 "[ . 1 . 2 . ]" 1 119 LYS 0.554 0.035 3 0 "[ . 1 . 2 . ]" 1 120 GLY 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 121 VAL 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 122 PRO 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 123 VAL 0.803 0.045 19 0 "[ . 1 . 2 . ]" 1 124 LYS 0.690 0.079 6 0 "[ . 1 . 2 . ]" 1 125 ASP 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 126 GLY 0.368 0.079 25 0 "[ . 1 . 2 . ]" 1 127 MET 3.678 0.112 22 0 "[ . 1 . 2 . ]" 1 128 VAL 2.387 0.112 22 0 "[ . 1 . 2 . ]" 1 129 ASN 3.043 0.131 3 0 "[ . 1 . 2 . ]" 1 130 TYR 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 131 HIS 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 132 ASP 1.068 0.131 3 0 "[ . 1 . 2 . ]" 1 133 PHE 1.740 0.091 4 0 "[ . 1 . 2 . ]" 1 134 VAL 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 135 GLN 1.379 0.091 4 0 "[ . 1 . 2 . ]" 1 136 MET 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 137 ILE 0.160 0.047 6 0 "[ . 1 . 2 . ]" 1 138 LEU 0.056 0.036 25 0 "[ . 1 . 2 . ]" 1 139 ALA 0.474 0.084 9 0 "[ . 1 . 2 . ]" 1 140 ASN 0.418 0.084 9 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 1 SER QB 1 2 THR H 2.820 . 3.940 2.778 2.035 3.523 . 0 0 "[ . 1 . 2 . ]" 1 2 1 3 ASP H 1 4 ASP H 2.190 . 2.670 2.416 2.068 2.793 0.123 7 0 "[ . 1 . 2 . ]" 1 3 1 3 ASP H 1 3 ASP QB 2.960 . 4.210 2.812 2.287 3.436 . 0 0 "[ . 1 . 2 . ]" 1 4 1 3 ASP H 1 3 ASP HA 2.700 . 3.700 2.815 2.263 2.950 . 0 0 "[ . 1 . 2 . ]" 1 5 1 3 ASP HA 1 4 ASP H 2.870 . 4.040 3.194 2.488 3.577 . 0 0 "[ . 1 . 2 . ]" 1 6 1 4 ASP H 1 4 ASP HA 2.690 . 3.670 2.784 2.261 2.949 . 0 0 "[ . 1 . 2 . ]" 1 7 1 4 ASP H 1 4 ASP QB 3.350 . 5.000 2.632 2.260 3.431 . 0 0 "[ . 1 . 2 . ]" 1 8 1 1 SER HA 1 4 ASP H 3.850 . 6.000 5.356 3.696 6.010 0.010 2 0 "[ . 1 . 2 . ]" 1 9 1 4 ASP H 1 8 LYS QB 3.850 . 6.000 3.060 2.111 4.737 . 0 0 "[ . 1 . 2 . ]" 1 10 1 5 SER H 1 6 PRO QG 3.630 . 5.560 4.073 4.011 4.196 . 0 0 "[ . 1 . 2 . ]" 1 11 1 5 SER H 1 6 PRO QD 3.370 . 5.040 2.147 2.079 2.280 . 0 0 "[ . 1 . 2 . ]" 1 12 1 5 SER H 1 5 SER HB2 2.740 . 3.780 2.308 2.248 2.361 . 0 0 "[ . 1 . 2 . ]" 1 13 1 5 SER H 1 5 SER HB3 2.710 . 3.730 2.805 2.762 2.880 . 0 0 "[ . 1 . 2 . ]" 1 14 1 4 ASP HA 1 5 SER H 2.250 . 2.790 2.207 2.132 2.316 . 0 0 "[ . 1 . 2 . ]" 1 15 1 5 SER H 1 5 SER HA 2.860 . 4.020 2.818 2.778 2.833 . 0 0 "[ . 1 . 2 . ]" 1 16 1 4 ASP QB 1 5 SER H 3.400 . 5.100 3.681 3.430 3.961 . 0 0 "[ . 1 . 2 . ]" 1 17 1 6 PRO QG 1 7 TYR H 3.520 . 5.340 3.214 2.719 3.956 . 0 0 "[ . 1 . 2 . ]" 1 18 1 6 PRO QD 1 7 TYR H 3.210 . 4.710 2.532 2.309 2.718 . 0 0 "[ . 1 . 2 . ]" 1 19 1 7 TYR H 1 7 TYR QD 2.650 . 3.590 3.141 2.483 3.259 . 0 0 "[ . 1 . 2 . ]" 1 20 1 7 TYR H 1 8 LYS QB 3.730 . 5.760 4.193 4.079 4.426 . 0 0 "[ . 1 . 2 . ]" 1 21 1 6 PRO QB 1 7 TYR H 3.610 . 5.520 3.537 3.121 3.841 . 0 0 "[ . 1 . 2 . ]" 1 22 1 7 TYR H 1 7 TYR HB3 2.770 . 3.840 3.771 3.701 3.841 0.001 20 0 "[ . 1 . 2 . ]" 1 23 1 7 TYR H 1 8 LYS H 2.510 . 3.320 2.436 2.348 2.539 . 0 0 "[ . 1 . 2 . ]" 1 24 1 6 PRO HA 1 7 TYR H 3.090 . 4.480 3.456 3.303 3.521 . 0 0 "[ . 1 . 2 . ]" 1 25 1 7 TYR H 1 7 TYR HB2 2.600 . 3.500 2.714 2.506 2.857 . 0 0 "[ . 1 . 2 . ]" 1 26 1 7 TYR H 1 7 TYR HA 2.730 . 3.750 2.948 2.939 2.957 . 0 0 "[ . 1 . 2 . ]" 1 27 1 4 ASP HA 1 7 TYR H 2.870 . 4.040 4.018 3.769 4.131 0.091 7 0 "[ . 1 . 2 . ]" 1 28 1 8 LYS H 1 11 PHE H 3.040 . 4.370 4.441 4.418 4.465 0.095 7 0 "[ . 1 . 2 . ]" 1 29 1 8 LYS H 1 9 GLN H 2.770 . 3.850 2.780 2.692 2.872 . 0 0 "[ . 1 . 2 . ]" 1 30 1 7 TYR HB3 1 8 LYS H 3.280 . 4.860 3.354 3.021 3.525 . 0 0 "[ . 1 . 2 . ]" 1 31 1 8 LYS H 1 8 LYS HA 2.900 . 4.090 2.845 2.801 2.854 . 0 0 "[ . 1 . 2 . ]" 1 32 1 8 LYS H 1 8 LYS QB 3.000 . 4.290 2.201 2.062 2.380 . 0 0 "[ . 1 . 2 . ]" 1 33 1 8 LYS H 1 8 LYS QG 3.240 . 4.780 3.611 2.447 4.064 . 0 0 "[ . 1 . 2 . ]" 1 34 1 7 TYR HB2 1 8 LYS H 2.790 . 3.880 2.132 2.039 2.212 . 0 0 "[ . 1 . 2 . ]" 1 35 1 7 TYR HA 1 8 LYS H 3.230 . 4.760 3.576 3.560 3.583 . 0 0 "[ . 1 . 2 . ]" 1 36 1 8 LYS H 1 8 LYS QD 3.720 . 5.740 4.292 2.841 4.745 . 0 0 "[ . 1 . 2 . ]" 1 37 1 4 ASP HA 1 8 LYS H 3.510 . 5.320 4.167 4.057 4.290 . 0 0 "[ . 1 . 2 . ]" 1 38 1 9 GLN H 1 10 ALA H 2.890 . 4.080 2.775 2.720 2.836 . 0 0 "[ . 1 . 2 . ]" 1 39 1 9 GLN H 1 9 GLN HA 2.690 . 3.680 2.801 2.787 2.819 . 0 0 "[ . 1 . 2 . ]" 1 40 1 9 GLN H 1 9 GLN QG 3.420 . 5.130 3.852 3.326 4.071 . 0 0 "[ . 1 . 2 . ]" 1 41 1 9 GLN H 1 9 GLN QB 3.040 . 4.370 2.138 2.057 2.213 . 0 0 "[ . 1 . 2 . ]" 1 42 1 8 LYS QG 1 9 GLN H 3.670 . 5.630 3.829 2.981 4.270 . 0 0 "[ . 1 . 2 . ]" 1 43 1 4 ASP HA 1 9 GLN H 3.350 . 5.000 4.989 4.779 5.068 0.068 18 0 "[ . 1 . 2 . ]" 1 44 1 8 LYS QB 1 9 GLN H 3.480 . 5.260 2.233 2.113 2.382 . 0 0 "[ . 1 . 2 . ]" 1 45 1 10 ALA H 1 10 ALA MB 3.040 . 4.370 2.209 2.156 2.241 . 0 0 "[ . 1 . 2 . ]" 1 46 1 9 GLN HA 1 10 ALA H 2.690 . 3.670 3.563 3.553 3.570 . 0 0 "[ . 1 . 2 . ]" 1 47 1 10 ALA H 1 10 ALA HA 2.750 . 3.810 2.798 2.789 2.821 . 0 0 "[ . 1 . 2 . ]" 1 48 1 9 GLN QB 1 10 ALA H 3.350 . 5.000 2.456 2.398 2.585 . 0 0 "[ . 1 . 2 . ]" 1 49 1 9 GLN QG 1 10 ALA H 3.850 . 6.000 4.109 3.807 4.460 . 0 0 "[ . 1 . 2 . ]" 1 50 1 7 TYR HA 1 10 ALA H 3.160 . 4.620 4.475 4.304 4.583 . 0 0 "[ . 1 . 2 . ]" 1 51 1 11 PHE H 1 11 PHE HA 2.760 . 3.820 2.792 2.769 2.809 . 0 0 "[ . 1 . 2 . ]" 1 52 1 10 ALA HA 1 11 PHE H 2.900 . 4.100 3.551 3.535 3.567 . 0 0 "[ . 1 . 2 . ]" 1 53 1 8 LYS HA 1 11 PHE H 3.030 . 4.360 3.686 3.542 3.790 . 0 0 "[ . 1 . 2 . ]" 1 54 1 11 PHE H 1 11 PHE HB3 2.530 . 3.360 2.416 2.327 2.508 . 0 0 "[ . 1 . 2 . ]" 1 55 1 10 ALA MB 1 11 PHE H 2.990 . 4.280 2.595 2.466 2.689 . 0 0 "[ . 1 . 2 . ]" 1 56 1 11 PHE H 1 30 LEU MD1 3.320 . 4.940 3.774 3.383 4.014 . 0 0 "[ . 1 . 2 . ]" 1 57 1 11 PHE H 1 11 PHE HB2 2.540 . 3.380 2.643 2.566 2.741 . 0 0 "[ . 1 . 2 . ]" 1 58 1 11 PHE H 1 30 LEU MD2 3.850 . 6.000 4.856 4.352 5.021 . 0 0 "[ . 1 . 2 . ]" 1 59 1 11 PHE H 1 11 PHE QD 3.320 . 4.940 4.163 4.105 4.197 . 0 0 "[ . 1 . 2 . ]" 1 60 1 12 SER H 1 56 MET QG 3.850 . 6.000 5.174 5.026 5.303 . 0 0 "[ . 1 . 2 . ]" 1 61 1 11 PHE HA 1 12 SER H 3.260 . 4.820 3.555 3.546 3.575 . 0 0 "[ . 1 . 2 . ]" 1 62 1 12 SER H 1 12 SER HA 2.900 . 4.090 2.812 2.796 2.817 . 0 0 "[ . 1 . 2 . ]" 1 63 1 11 PHE HB3 1 12 SER H 2.730 . 3.750 2.583 2.510 2.662 . 0 0 "[ . 1 . 2 . ]" 1 64 1 9 GLN HA 1 12 SER H 2.690 . 3.670 3.585 3.499 3.653 . 0 0 "[ . 1 . 2 . ]" 1 65 1 12 SER H 1 12 SER QB 2.890 . 4.080 2.354 2.086 2.730 . 0 0 "[ . 1 . 2 . ]" 1 66 1 11 PHE HB2 1 12 SER H 3.100 . 4.500 3.928 3.868 3.988 . 0 0 "[ . 1 . 2 . ]" 1 67 1 12 SER H 1 13 LEU HG 3.680 . 5.660 4.058 3.911 4.917 . 0 0 "[ . 1 . 2 . ]" 1 68 1 12 SER H 1 13 LEU H 2.810 . 3.920 2.689 2.661 2.731 . 0 0 "[ . 1 . 2 . ]" 1 69 1 11 PHE QD 1 12 SER H 3.060 . 4.410 2.919 2.729 3.183 . 0 0 "[ . 1 . 2 . ]" 1 70 1 13 LEU H 1 13 LEU HA 2.730 . 3.750 2.802 2.782 2.826 . 0 0 "[ . 1 . 2 . ]" 1 71 1 13 LEU H 1 13 LEU MD1 3.480 . 5.260 3.703 3.623 4.081 . 0 0 "[ . 1 . 2 . ]" 1 72 1 12 SER HA 1 13 LEU H 3.020 . 4.340 3.529 3.513 3.541 . 0 0 "[ . 1 . 2 . ]" 1 73 1 13 LEU H 1 13 LEU HB3 2.600 . 3.500 3.577 3.566 3.586 0.086 13 0 "[ . 1 . 2 . ]" 1 74 1 13 LEU H 1 13 LEU HB2 2.380 . 3.050 2.763 2.436 2.875 . 0 0 "[ . 1 . 2 . ]" 1 75 1 10 ALA HA 1 13 LEU H 2.680 . 3.660 3.319 3.230 3.407 . 0 0 "[ . 1 . 2 . ]" 1 76 1 13 LEU H 1 13 LEU MD2 3.500 . 5.300 2.463 2.155 2.668 . 0 0 "[ . 1 . 2 . ]" 1 77 1 11 PHE HA 1 14 PHE H 3.400 . 5.100 3.666 3.513 3.833 . 0 0 "[ . 1 . 2 . ]" 1 78 1 14 PHE H 1 15 ASP H 2.350 . 3.000 2.935 2.750 3.050 0.050 23 0 "[ . 1 . 2 . ]" 1 79 1 13 LEU HB3 1 14 PHE H 3.270 . 4.840 3.960 3.639 4.153 . 0 0 "[ . 1 . 2 . ]" 1 80 1 14 PHE H 1 14 PHE HB2 2.590 . 3.480 2.440 2.300 2.628 . 0 0 "[ . 1 . 2 . ]" 1 81 1 14 PHE H 1 14 PHE HA 2.710 . 3.710 2.920 2.906 2.933 . 0 0 "[ . 1 . 2 . ]" 1 82 1 13 LEU HB2 1 14 PHE H 2.880 . 4.050 2.791 2.622 2.993 . 0 0 "[ . 1 . 2 . ]" 1 83 1 14 PHE H 1 14 PHE HB3 2.730 . 3.770 3.632 3.565 3.691 . 0 0 "[ . 1 . 2 . ]" 1 84 1 14 PHE H 1 22 ILE MG 3.470 . 5.240 4.086 3.816 4.343 . 0 0 "[ . 1 . 2 . ]" 1 85 1 13 LEU HA 1 14 PHE H 3.160 . 4.620 3.528 3.499 3.554 . 0 0 "[ . 1 . 2 . ]" 1 86 1 14 PHE HB2 1 15 ASP H 3.100 . 4.500 4.137 3.979 4.260 . 0 0 "[ . 1 . 2 . ]" 1 87 1 14 PHE HB3 1 15 ASP H 3.190 . 4.670 4.452 4.380 4.529 . 0 0 "[ . 1 . 2 . ]" 1 88 1 15 ASP H 1 15 ASP HA 2.700 . 3.700 2.899 2.811 2.942 . 0 0 "[ . 1 . 2 . ]" 1 89 1 15 ASP H 1 15 ASP QB 3.160 . 4.620 2.317 2.129 2.651 . 0 0 "[ . 1 . 2 . ]" 1 90 1 14 PHE HA 1 15 ASP H 2.540 . 3.370 2.960 2.824 3.107 . 0 0 "[ . 1 . 2 . ]" 1 91 1 15 ASP H 1 22 ILE MG 3.300 . 4.900 4.017 3.802 4.126 . 0 0 "[ . 1 . 2 . ]" 1 92 1 13 LEU HA 1 15 ASP H 3.380 . 5.060 3.729 3.571 3.911 . 0 0 "[ . 1 . 2 . ]" 1 93 1 15 ASP H 1 16 ARG H 3.160 . 4.620 4.239 3.625 4.585 . 0 0 "[ . 1 . 2 . ]" 1 94 1 16 ARG H 1 22 ILE MG 3.850 . 6.000 3.243 2.396 4.476 . 0 0 "[ . 1 . 2 . ]" 1 95 1 16 ARG H 1 16 ARG QG 3.100 . 4.500 3.414 2.166 4.058 . 0 0 "[ . 1 . 2 . ]" 1 96 1 16 ARG H 1 16 ARG QB 3.040 . 4.380 2.201 2.054 2.485 . 0 0 "[ . 1 . 2 . ]" 1 97 1 15 ASP HA 1 16 ARG H 2.370 . 3.040 2.198 2.126 2.340 . 0 0 "[ . 1 . 2 . ]" 1 98 1 16 ARG H 1 16 ARG HA 2.800 . 3.900 2.824 2.761 2.851 . 0 0 "[ . 1 . 2 . ]" 1 99 1 16 ARG H 1 17 HIS H 2.760 . 3.820 2.719 2.572 2.992 . 0 0 "[ . 1 . 2 . ]" 1 100 1 17 HIS H 1 17 HIS HB3 2.770 . 3.830 3.589 3.511 3.876 0.046 24 0 "[ . 1 . 2 . ]" 1 101 1 17 HIS H 1 17 HIS HB2 2.690 . 3.670 2.386 2.223 2.847 . 0 0 "[ . 1 . 2 . ]" 1 102 1 16 ARG QB 1 17 HIS H 3.140 . 4.580 2.586 2.136 3.183 . 0 0 "[ . 1 . 2 . ]" 1 103 1 17 HIS H 1 17 HIS HA 2.710 . 3.730 2.916 2.895 2.946 . 0 0 "[ . 1 . 2 . ]" 1 104 1 16 ARG HA 1 17 HIS H 2.920 . 4.130 3.544 3.429 3.585 . 0 0 "[ . 1 . 2 . ]" 1 105 1 18 GLY H 1 19 THR H 2.750 . 3.800 2.494 2.143 2.893 . 0 0 "[ . 1 . 2 . ]" 1 106 1 17 HIS HA 1 18 GLY H 3.080 . 4.460 3.401 2.978 3.547 . 0 0 "[ . 1 . 2 . ]" 1 107 1 18 GLY H 1 18 GLY QA 2.250 . 2.790 2.232 2.192 2.298 . 0 0 "[ . 1 . 2 . ]" 1 108 1 17 HIS H 1 18 GLY H 2.830 . 3.970 2.299 2.025 2.390 . 0 0 "[ . 1 . 2 . ]" 1 109 1 15 ASP HA 1 18 GLY H 2.870 . 4.040 3.887 3.606 4.107 0.067 8 0 "[ . 1 . 2 . ]" 1 110 1 19 THR H 1 20 GLY H 2.540 . 3.390 2.183 1.955 2.516 . 0 0 "[ . 1 . 2 . ]" 1 111 1 17 HIS HB2 1 19 THR H 3.850 . 6.000 3.516 2.594 4.358 . 0 0 "[ . 1 . 2 . ]" 1 112 1 19 THR H 1 20 GLY QA 3.580 . 5.460 4.146 4.008 4.318 . 0 0 "[ . 1 . 2 . ]" 1 113 1 19 THR H 1 21 ARG H 3.020 . 4.330 3.293 2.716 3.739 . 0 0 "[ . 1 . 2 . ]" 1 114 1 18 GLY QA 1 19 THR H 2.600 . 3.500 2.771 2.632 2.935 . 0 0 "[ . 1 . 2 . ]" 1 115 1 19 THR H 1 19 THR HA 2.930 . 4.160 2.937 2.903 2.950 . 0 0 "[ . 1 . 2 . ]" 1 116 1 19 THR H 1 19 THR MG 3.040 . 4.370 2.784 2.405 3.047 . 0 0 "[ . 1 . 2 . ]" 1 117 1 20 GLY H 1 21 ARG QG 3.850 . 6.000 4.372 3.007 4.928 . 0 0 "[ . 1 . 2 . ]" 1 118 1 19 THR MG 1 20 GLY H 3.850 . 6.000 4.149 3.847 4.386 . 0 0 "[ . 1 . 2 . ]" 1 119 1 20 GLY H 1 21 ARG H 2.580 . 3.460 2.180 1.949 2.653 . 0 0 "[ . 1 . 2 . ]" 1 120 1 20 GLY H 1 20 GLY QA 2.480 . 3.270 2.323 2.200 2.436 . 0 0 "[ . 1 . 2 . ]" 1 121 1 18 GLY QA 1 20 GLY H 3.080 . 4.460 3.613 3.241 3.995 . 0 0 "[ . 1 . 2 . ]" 1 122 1 20 GLY QA 1 21 ARG H 2.670 . 3.650 2.907 2.721 2.953 . 0 0 "[ . 1 . 2 . ]" 1 123 1 21 ARG H 1 22 ILE MG 3.850 . 6.000 4.141 3.961 4.412 . 0 0 "[ . 1 . 2 . ]" 1 124 1 21 ARG H 1 21 ARG QG 2.730 . 3.750 2.953 2.479 3.352 . 0 0 "[ . 1 . 2 . ]" 1 125 1 19 THR MG 1 21 ARG H 3.850 . 6.000 4.696 4.320 5.013 . 0 0 "[ . 1 . 2 . ]" 1 126 1 11 PHE QE 1 22 ILE H 3.250 . 4.790 3.982 3.771 4.269 . 0 0 "[ . 1 . 2 . ]" 1 127 1 22 ILE H 1 54 VAL MG2 3.700 . 5.700 4.611 4.517 4.747 . 0 0 "[ . 1 . 2 . ]" 1 128 1 22 ILE H 1 53 GLU HA 3.330 . 4.960 4.285 3.990 4.716 . 0 0 "[ . 1 . 2 . ]" 1 129 1 11 PHE HZ 1 22 ILE H 2.810 . 3.920 3.479 3.121 3.684 . 0 0 "[ . 1 . 2 . ]" 1 130 1 22 ILE H 1 54 VAL HB 2.890 . 4.080 3.559 3.452 3.827 . 0 0 "[ . 1 . 2 . ]" 1 131 1 22 ILE H 1 55 ASP HA 3.120 . 4.540 3.252 3.082 3.553 . 0 0 "[ . 1 . 2 . ]" 1 132 1 22 ILE H 1 22 ILE HB 2.790 . 3.890 3.870 3.793 3.906 0.016 21 0 "[ . 1 . 2 . ]" 1 133 1 22 ILE H 1 22 ILE MD 3.650 . 5.600 4.031 3.897 4.096 . 0 0 "[ . 1 . 2 . ]" 1 134 1 22 ILE H 1 22 ILE HA 2.900 . 4.100 2.925 2.910 2.947 . 0 0 "[ . 1 . 2 . ]" 1 135 1 22 ILE H 1 22 ILE QG 2.600 . 3.500 2.353 2.216 2.432 . 0 0 "[ . 1 . 2 . ]" 1 136 1 22 ILE H 1 22 ILE MG 2.940 . 4.170 3.241 3.012 3.336 . 0 0 "[ . 1 . 2 . ]" 1 137 1 21 ARG HA 1 22 ILE H 2.630 . 3.560 2.380 2.269 2.457 . 0 0 "[ . 1 . 2 . ]" 1 138 1 22 ILE H 1 54 VAL H 2.620 . 3.540 3.088 2.867 3.326 . 0 0 "[ . 1 . 2 . ]" 1 139 1 24 LYS H 1 25 THR H 2.960 . 4.210 2.974 2.949 3.020 . 0 0 "[ . 1 . 2 . ]" 1 140 1 24 LYS H 1 24 LYS HA 2.710 . 3.710 2.720 2.706 2.729 . 0 0 "[ . 1 . 2 . ]" 1 141 1 23 PRO HA 1 24 LYS H 2.490 . 3.280 2.443 2.413 2.470 . 0 0 "[ . 1 . 2 . ]" 1 142 1 24 LYS H 1 24 LYS QG 3.590 . 5.480 2.086 1.952 2.263 . 0 0 "[ . 1 . 2 . ]" 1 143 1 23 PRO QG 1 24 LYS H 3.620 . 5.540 4.071 4.022 4.416 . 0 0 "[ . 1 . 2 . ]" 1 144 1 24 LYS H 1 24 LYS HB2 2.890 . 4.080 3.608 3.590 3.616 . 0 0 "[ . 1 . 2 . ]" 1 145 1 23 PRO QB 1 24 LYS H 3.230 . 4.760 2.484 2.440 2.560 . 0 0 "[ . 1 . 2 . ]" 1 146 1 25 THR H 1 26 SER H 2.730 . 3.770 2.761 2.723 2.815 . 0 0 "[ . 1 . 2 . ]" 1 147 1 24 LYS QG 1 25 THR H 3.290 . 4.880 2.148 1.952 2.299 . 0 0 "[ . 1 . 2 . ]" 1 148 1 23 PRO QB 1 25 THR H 3.060 . 4.410 2.709 2.490 2.789 . 0 0 "[ . 1 . 2 . ]" 1 149 1 24 LYS HA 1 25 THR H 3.250 . 4.790 3.549 3.536 3.562 . 0 0 "[ . 1 . 2 . ]" 1 150 1 25 THR H 1 25 THR HB 3.140 . 4.580 3.600 3.587 3.620 . 0 0 "[ . 1 . 2 . ]" 1 151 1 25 THR H 1 25 THR MG 2.710 . 3.730 2.367 2.222 2.542 . 0 0 "[ . 1 . 2 . ]" 1 152 1 23 PRO QG 1 25 THR H 3.570 . 5.440 3.072 2.964 3.896 . 0 0 "[ . 1 . 2 . ]" 1 153 1 23 PRO HA 1 25 THR H 3.350 . 5.000 4.418 4.351 4.486 . 0 0 "[ . 1 . 2 . ]" 1 154 1 25 THR H 1 25 THR HA 2.720 . 3.740 2.806 2.796 2.814 . 0 0 "[ . 1 . 2 . ]" 1 155 1 24 LYS HB2 1 25 THR H 3.720 . 5.740 3.635 3.566 3.691 . 0 0 "[ . 1 . 2 . ]" 1 156 1 24 LYS H 1 26 SER H 3.170 . 4.640 4.561 4.482 4.656 0.016 25 0 "[ . 1 . 2 . ]" 1 157 1 26 SER H 1 27 ILE H 2.580 . 3.460 2.697 2.663 2.730 . 0 0 "[ . 1 . 2 . ]" 1 158 1 25 THR HA 1 26 SER H 3.160 . 4.620 3.559 3.548 3.575 . 0 0 "[ . 1 . 2 . ]" 1 159 1 26 SER H 1 26 SER QB 3.130 . 4.560 2.249 2.127 2.353 . 0 0 "[ . 1 . 2 . ]" 1 160 1 26 SER H 1 26 SER HA 2.700 . 3.700 2.844 2.834 2.851 . 0 0 "[ . 1 . 2 . ]" 1 161 1 25 THR MG 1 26 SER H 3.550 . 5.400 3.946 3.803 4.047 . 0 0 "[ . 1 . 2 . ]" 1 162 1 22 ILE MD 1 26 SER H 3.850 . 6.000 4.638 4.295 4.860 . 0 0 "[ . 1 . 2 . ]" 1 163 1 27 ILE H 1 27 ILE QG 3.160 . 4.620 1.766 1.739 1.793 . 0 0 "[ . 1 . 2 . ]" 1 164 1 22 ILE MD 1 27 ILE H 3.850 . 6.000 2.951 2.614 3.158 . 0 0 "[ . 1 . 2 . ]" 1 165 1 27 ILE H 1 28 GLY H 2.900 . 4.100 2.804 2.743 2.895 . 0 0 "[ . 1 . 2 . ]" 1 166 1 27 ILE H 1 27 ILE HA 2.720 . 3.740 2.787 2.754 2.808 . 0 0 "[ . 1 . 2 . ]" 1 167 1 27 ILE H 1 27 ILE MD 3.380 . 5.050 2.063 1.988 2.120 . 0 0 "[ . 1 . 2 . ]" 1 168 1 27 ILE H 1 27 ILE MG 3.060 . 4.420 3.438 3.390 3.478 . 0 0 "[ . 1 . 2 . ]" 1 169 1 27 ILE H 1 27 ILE HB 2.550 . 3.400 3.388 3.367 3.417 0.017 13 0 "[ . 1 . 2 . ]" 1 170 1 24 LYS HA 1 27 ILE H 3.230 . 4.760 3.578 3.505 3.667 . 0 0 "[ . 1 . 2 . ]" 1 171 1 25 THR HA 1 27 ILE H 3.410 . 5.120 4.834 4.722 5.004 . 0 0 "[ . 1 . 2 . ]" 1 172 1 28 GLY H 1 31 LEU MD1 3.850 . 6.000 4.274 4.070 4.569 . 0 0 "[ . 1 . 2 . ]" 1 173 1 27 ILE HB 1 28 GLY H 3.380 . 5.050 3.125 3.066 3.170 . 0 0 "[ . 1 . 2 . ]" 1 174 1 28 GLY H 1 29 ASP H 2.980 . 4.250 3.130 3.061 3.234 . 0 0 "[ . 1 . 2 . ]" 1 175 1 27 ILE MG 1 28 GLY H 3.530 . 5.360 4.269 4.244 4.289 . 0 0 "[ . 1 . 2 . ]" 1 176 1 28 GLY H 1 28 GLY QA 2.670 . 3.640 2.194 2.190 2.199 . 0 0 "[ . 1 . 2 . ]" 1 177 1 27 ILE HA 1 28 GLY H 3.020 . 4.340 3.531 3.521 3.545 . 0 0 "[ . 1 . 2 . ]" 1 178 1 27 ILE QG 1 28 GLY H 3.850 . 6.000 3.006 2.956 3.054 . 0 0 "[ . 1 . 2 . ]" 1 179 1 29 ASP H 1 29 ASP HA 2.670 . 3.650 2.824 2.801 2.835 . 0 0 "[ . 1 . 2 . ]" 1 180 1 29 ASP H 1 29 ASP HB3 2.690 . 3.670 2.936 2.624 3.121 . 0 0 "[ . 1 . 2 . ]" 1 181 1 29 ASP H 1 29 ASP HB2 2.620 . 3.540 3.558 3.509 3.602 0.062 20 0 "[ . 1 . 2 . ]" 1 182 1 28 GLY QA 1 29 ASP H 2.670 . 3.630 2.431 2.368 2.472 . 0 0 "[ . 1 . 2 . ]" 1 183 1 30 LEU H 1 30 LEU MD2 3.710 . 5.710 4.170 4.133 4.203 . 0 0 "[ . 1 . 2 . ]" 1 184 1 29 ASP HB2 1 30 LEU H 3.270 . 4.830 3.711 3.558 4.066 . 0 0 "[ . 1 . 2 . ]" 1 185 1 30 LEU H 1 30 LEU MD1 3.460 . 5.210 4.263 4.227 4.293 . 0 0 "[ . 1 . 2 . ]" 1 186 1 30 LEU H 1 30 LEU HG 3.210 . 4.710 4.231 4.161 4.284 . 0 0 "[ . 1 . 2 . ]" 1 187 1 29 ASP HB3 1 30 LEU H 3.020 . 4.340 4.297 4.240 4.361 0.021 18 0 "[ . 1 . 2 . ]" 1 188 1 30 LEU H 1 30 LEU HB2 2.600 . 3.500 2.845 2.773 2.918 . 0 0 "[ . 1 . 2 . ]" 1 189 1 30 LEU H 1 30 LEU HB3 2.500 . 3.300 2.229 2.190 2.264 . 0 0 "[ . 1 . 2 . ]" 1 190 1 27 ILE HA 1 30 LEU H 2.690 . 3.680 3.530 3.446 3.610 . 0 0 "[ . 1 . 2 . ]" 1 191 1 30 LEU H 1 31 LEU H 2.730 . 3.770 2.717 2.655 2.784 . 0 0 "[ . 1 . 2 . ]" 1 192 1 30 LEU H 1 30 LEU HA 2.750 . 3.790 2.817 2.802 2.835 . 0 0 "[ . 1 . 2 . ]" 1 193 1 29 ASP HA 1 30 LEU H 3.580 . 5.460 3.493 3.459 3.513 . 0 0 "[ . 1 . 2 . ]" 1 194 1 31 LEU H 1 32 ARG H 2.790 . 3.880 2.661 2.632 2.690 . 0 0 "[ . 1 . 2 . ]" 1 195 1 30 LEU HG 1 31 LEU H 2.980 . 4.260 3.018 2.920 3.121 . 0 0 "[ . 1 . 2 . ]" 1 196 1 31 LEU H 1 31 LEU HA 2.770 . 3.850 2.809 2.797 2.815 . 0 0 "[ . 1 . 2 . ]" 1 197 1 30 LEU HB3 1 31 LEU H 2.680 . 3.660 2.621 2.533 2.734 . 0 0 "[ . 1 . 2 . ]" 1 198 1 30 LEU HB2 1 31 LEU H 3.060 . 4.420 3.960 3.906 4.027 . 0 0 "[ . 1 . 2 . ]" 1 199 1 30 LEU MD1 1 31 LEU H 3.520 . 5.340 4.064 3.973 4.123 . 0 0 "[ . 1 . 2 . ]" 1 200 1 31 LEU H 1 31 LEU MD2 3.080 . 4.460 3.720 3.608 3.756 . 0 0 "[ . 1 . 2 . ]" 1 201 1 31 LEU H 1 31 LEU MD1 3.080 . 4.460 3.278 3.067 3.484 . 0 0 "[ . 1 . 2 . ]" 1 202 1 30 LEU HA 1 31 LEU H 2.810 . 3.930 3.559 3.547 3.567 . 0 0 "[ . 1 . 2 . ]" 1 203 1 28 GLY QA 1 31 LEU H 3.850 . 6.000 3.820 3.723 3.971 . 0 0 "[ . 1 . 2 . ]" 1 204 1 31 LEU H 1 31 LEU HB3 2.640 . 3.580 3.577 3.552 3.587 0.007 25 0 "[ . 1 . 2 . ]" 1 205 1 31 LEU H 1 31 LEU HB2 2.500 . 3.300 2.424 2.341 2.497 . 0 0 "[ . 1 . 2 . ]" 1 206 1 31 LEU H 1 31 LEU HG 2.390 . 3.080 2.377 2.264 2.512 . 0 0 "[ . 1 . 2 . ]" 1 207 1 30 LEU MD2 1 31 LEU H 3.640 . 5.580 3.939 3.840 4.075 . 0 0 "[ . 1 . 2 . ]" 1 208 1 32 ARG H 1 32 ARG QG 3.060 . 4.420 3.419 3.388 3.457 . 0 0 "[ . 1 . 2 . ]" 1 209 1 31 LEU HA 1 32 ARG H 3.220 . 4.740 3.510 3.491 3.525 . 0 0 "[ . 1 . 2 . ]" 1 210 1 32 ARG H 1 32 ARG HB3 2.520 . 3.330 2.027 2.014 2.038 . 0 0 "[ . 1 . 2 . ]" 1 211 1 29 ASP HA 1 32 ARG H 3.020 . 4.330 3.252 3.171 3.333 . 0 0 "[ . 1 . 2 . ]" 1 212 1 31 LEU MD1 1 32 ARG H 3.850 . 6.000 4.521 4.246 4.677 . 0 0 "[ . 1 . 2 . ]" 1 213 1 32 ARG H 1 32 ARG HA 2.850 . 4.000 2.774 2.750 2.787 . 0 0 "[ . 1 . 2 . ]" 1 214 1 31 LEU HB3 1 32 ARG H 3.080 . 4.460 3.776 3.640 3.882 . 0 0 "[ . 1 . 2 . ]" 1 215 1 32 ARG H 1 33 ALA H 2.730 . 3.750 2.767 2.714 2.830 . 0 0 "[ . 1 . 2 . ]" 1 216 1 32 ARG H 1 32 ARG HB2 2.420 . 3.130 3.221 3.202 3.229 0.099 6 0 "[ . 1 . 2 . ]" 1 217 1 31 LEU H 1 33 ALA H 3.850 . 6.000 4.378 4.188 4.476 . 0 0 "[ . 1 . 2 . ]" 1 218 1 32 ARG HB2 1 33 ALA H 2.980 . 4.250 4.187 4.134 4.270 0.020 26 0 "[ . 1 . 2 . ]" 1 219 1 33 ALA H 1 34 CYS QB 3.850 . 6.000 4.747 4.489 5.005 . 0 0 "[ . 1 . 2 . ]" 1 220 1 33 ALA H 1 33 ALA HA 2.600 . 3.500 2.808 2.758 2.844 . 0 0 "[ . 1 . 2 . ]" 1 221 1 33 ALA H 1 33 ALA MB 2.650 . 3.610 2.189 2.069 2.234 . 0 0 "[ . 1 . 2 . ]" 1 222 1 33 ALA H 1 34 CYS H 2.680 . 3.660 2.697 2.589 2.919 . 0 0 "[ . 1 . 2 . ]" 1 223 1 30 LEU MD1 1 33 ALA H 3.850 . 6.000 4.324 4.207 4.445 . 0 0 "[ . 1 . 2 . ]" 1 224 1 30 LEU HA 1 33 ALA H 2.940 . 4.170 3.725 3.590 3.821 . 0 0 "[ . 1 . 2 . ]" 1 225 1 32 ARG HA 1 33 ALA H 3.300 . 4.900 3.535 3.512 3.546 . 0 0 "[ . 1 . 2 . ]" 1 226 1 33 ALA HA 1 34 CYS H 2.830 . 3.970 3.522 3.496 3.575 . 0 0 "[ . 1 . 2 . ]" 1 227 1 34 CYS H 1 35 GLY H 2.650 . 3.590 2.745 2.310 3.459 . 0 0 "[ . 1 . 2 . ]" 1 228 1 31 LEU HA 1 34 CYS H 2.790 . 3.880 3.363 3.193 3.775 . 0 0 "[ . 1 . 2 . ]" 1 229 1 34 CYS H 1 34 CYS QB 3.190 . 4.670 2.472 2.239 2.876 . 0 0 "[ . 1 . 2 . ]" 1 230 1 33 ALA MB 1 34 CYS H 3.030 . 4.360 2.750 2.446 2.912 . 0 0 "[ . 1 . 2 . ]" 1 231 1 34 CYS H 1 34 CYS HA 2.700 . 3.700 2.910 2.821 2.950 . 0 0 "[ . 1 . 2 . ]" 1 232 1 30 LEU MD1 1 34 CYS H 3.730 . 5.750 4.635 4.143 4.805 . 0 0 "[ . 1 . 2 . ]" 1 233 1 32 ARG QG 1 34 CYS H 3.650 . 5.590 4.569 4.485 4.869 . 0 0 "[ . 1 . 2 . ]" 1 234 1 32 ARG QG 1 35 GLY H 3.850 . 6.000 5.064 4.676 5.356 . 0 0 "[ . 1 . 2 . ]" 1 235 1 34 CYS QB 1 35 GLY H 3.710 . 5.710 3.320 2.428 4.068 . 0 0 "[ . 1 . 2 . ]" 1 236 1 33 ALA H 1 35 GLY H 3.620 . 5.540 4.435 4.158 5.091 . 0 0 "[ . 1 . 2 . ]" 1 237 1 35 GLY H 1 36 GLN HA 3.620 . 5.540 4.568 4.291 5.052 . 0 0 "[ . 1 . 2 . ]" 1 238 1 35 GLY H 1 35 GLY QA 2.430 . 3.160 2.438 2.282 2.502 . 0 0 "[ . 1 . 2 . ]" 1 239 1 34 CYS HA 1 35 GLY H 3.060 . 4.410 3.139 2.580 3.566 . 0 0 "[ . 1 . 2 . ]" 1 240 1 33 ALA MB 1 35 GLY H 3.850 . 6.000 4.593 4.403 4.761 . 0 0 "[ . 1 . 2 . ]" 1 241 1 32 ARG HA 1 35 GLY H 3.270 . 4.840 3.788 3.291 4.858 0.018 15 0 "[ . 1 . 2 . ]" 1 242 1 35 GLY QA 1 36 GLN H 3.250 . 4.800 2.252 2.129 2.454 . 0 0 "[ . 1 . 2 . ]" 1 243 1 36 GLN H 1 36 GLN HA 2.700 . 3.700 2.943 2.938 2.948 . 0 0 "[ . 1 . 2 . ]" 1 244 1 36 GLN H 1 36 GLN HB2 2.630 . 3.560 2.605 2.566 2.630 . 0 0 "[ . 1 . 2 . ]" 1 245 1 32 ARG HA 1 36 GLN H 2.890 . 4.080 3.575 3.329 4.048 . 0 0 "[ . 1 . 2 . ]" 1 246 1 36 GLN H 1 36 GLN HB3 2.540 . 3.390 3.375 3.330 3.442 0.052 16 0 "[ . 1 . 2 . ]" 1 247 1 36 GLN H 1 36 GLN QG 3.310 . 4.910 3.954 3.872 4.258 . 0 0 "[ . 1 . 2 . ]" 1 248 1 34 CYS H 1 36 GLN H 3.350 . 5.000 5.055 5.010 5.091 0.091 8 0 "[ . 1 . 2 . ]" 1 249 1 36 GLN HA 1 37 ASN H 2.690 . 3.690 2.509 2.375 2.623 . 0 0 "[ . 1 . 2 . ]" 1 250 1 37 ASN H 1 37 ASN QB 3.390 . 5.080 2.623 2.388 3.122 . 0 0 "[ . 1 . 2 . ]" 1 251 1 36 GLN QG 1 37 ASN H 2.870 . 4.040 2.785 2.318 3.556 . 0 0 "[ . 1 . 2 . ]" 1 252 1 37 ASN H 1 38 PRO QD 3.620 . 5.540 4.087 3.731 4.389 . 0 0 "[ . 1 . 2 . ]" 1 253 1 36 GLN HB2 1 37 ASN H 2.900 . 4.090 3.845 3.686 4.070 . 0 0 "[ . 1 . 2 . ]" 1 254 1 38 PRO HA 1 39 THR H 2.300 . 2.900 2.744 2.730 2.761 . 0 0 "[ . 1 . 2 . ]" 1 255 1 38 PRO QB 1 39 THR H 3.530 . 5.360 1.880 1.868 1.901 . 0 0 "[ . 1 . 2 . ]" 1 256 1 38 PRO QG 1 39 THR H 2.760 . 3.820 3.440 3.418 3.461 . 0 0 "[ . 1 . 2 . ]" 1 257 1 39 THR H 1 42 GLU QG 2.980 . 4.260 3.552 2.689 3.787 . 0 0 "[ . 1 . 2 . ]" 1 258 1 39 THR H 1 39 THR MG 2.760 . 3.820 3.016 2.932 3.151 . 0 0 "[ . 1 . 2 . ]" 1 259 1 39 THR H 1 39 THR HA 2.960 . 4.220 2.931 2.914 2.944 . 0 0 "[ . 1 . 2 . ]" 1 260 1 40 LEU H 1 40 LEU MD2 3.450 . 5.200 1.989 1.942 2.036 . 0 0 "[ . 1 . 2 . ]" 1 261 1 39 THR HB 1 40 LEU H 2.420 . 3.130 2.389 2.320 2.477 . 0 0 "[ . 1 . 2 . ]" 1 262 1 39 THR MG 1 40 LEU H 3.180 . 4.660 3.295 3.102 3.457 . 0 0 "[ . 1 . 2 . ]" 1 263 1 39 THR HA 1 40 LEU H 2.640 . 3.580 2.432 2.390 2.472 . 0 0 "[ . 1 . 2 . ]" 1 264 1 40 LEU H 1 40 LEU HA 2.920 . 4.130 2.783 2.765 2.794 . 0 0 "[ . 1 . 2 . ]" 1 265 1 40 LEU H 1 40 LEU QB 2.890 . 4.080 2.266 2.243 2.291 . 0 0 "[ . 1 . 2 . ]" 1 266 1 40 LEU H 1 41 ALA H 2.810 . 3.930 2.759 2.719 2.822 . 0 0 "[ . 1 . 2 . ]" 1 267 1 39 THR HB 1 41 ALA H 2.480 . 3.260 2.514 2.370 2.646 . 0 0 "[ . 1 . 2 . ]" 1 268 1 41 ALA H 1 41 ALA MB 2.600 . 3.500 2.201 2.064 2.242 . 0 0 "[ . 1 . 2 . ]" 1 269 1 40 LEU QB 1 41 ALA H 3.230 . 4.760 2.760 2.700 2.865 . 0 0 "[ . 1 . 2 . ]" 1 270 1 41 ALA H 1 42 GLU H 2.650 . 3.610 2.686 2.643 2.733 . 0 0 "[ . 1 . 2 . ]" 1 271 1 40 LEU MD2 1 41 ALA H 3.850 . 6.000 4.115 4.073 4.164 . 0 0 "[ . 1 . 2 . ]" 1 272 1 41 ALA H 1 41 ALA HA 2.640 . 3.580 2.806 2.793 2.818 . 0 0 "[ . 1 . 2 . ]" 1 273 1 39 THR HA 1 41 ALA H 3.640 . 5.580 4.295 4.193 4.368 . 0 0 "[ . 1 . 2 . ]" 1 274 1 42 GLU H 1 43 ILE QG 3.800 . 5.900 3.673 3.614 3.765 . 0 0 "[ . 1 . 2 . ]" 1 275 1 42 GLU H 1 43 ILE H 2.480 . 3.270 2.790 2.749 2.851 . 0 0 "[ . 1 . 2 . ]" 1 276 1 42 GLU H 1 42 GLU QB 3.270 . 4.830 2.130 2.059 2.225 . 0 0 "[ . 1 . 2 . ]" 1 277 1 39 THR HB 1 42 GLU H 2.670 . 3.650 3.696 3.671 3.728 0.078 23 0 "[ . 1 . 2 . ]" 1 278 1 39 THR H 1 42 GLU H 3.480 . 5.250 3.534 3.400 3.634 . 0 0 "[ . 1 . 2 . ]" 1 279 1 42 GLU H 1 42 GLU QG 2.980 . 4.260 3.681 2.767 3.896 . 0 0 "[ . 1 . 2 . ]" 1 280 1 41 ALA MB 1 42 GLU H 2.820 . 3.940 2.637 2.555 2.768 . 0 0 "[ . 1 . 2 . ]" 1 281 1 42 GLU H 1 42 GLU HA 2.690 . 3.680 2.831 2.811 2.845 . 0 0 "[ . 1 . 2 . ]" 1 282 1 41 ALA HA 1 42 GLU H 2.690 . 3.670 3.539 3.529 3.552 . 0 0 "[ . 1 . 2 . ]" 1 283 1 41 ALA MB 1 43 ILE H 3.850 . 6.000 4.844 4.792 4.939 . 0 0 "[ . 1 . 2 . ]" 1 284 1 42 GLU HA 1 43 ILE H 2.670 . 3.650 3.587 3.576 3.593 . 0 0 "[ . 1 . 2 . ]" 1 285 1 40 LEU HA 1 43 ILE H 3.040 . 4.370 3.484 3.411 3.596 . 0 0 "[ . 1 . 2 . ]" 1 286 1 43 ILE H 1 46 ILE MD 3.850 . 6.000 3.795 3.489 4.110 . 0 0 "[ . 1 . 2 . ]" 1 287 1 43 ILE H 1 43 ILE HA 2.970 . 4.240 2.799 2.774 2.815 . 0 0 "[ . 1 . 2 . ]" 1 288 1 43 ILE H 1 43 ILE QG 2.810 . 3.920 1.811 1.769 1.838 . 0 0 "[ . 1 . 2 . ]" 1 289 1 43 ILE H 1 43 ILE MG 2.890 . 4.080 3.055 2.959 3.156 . 0 0 "[ . 1 . 2 . ]" 1 290 1 42 GLU QB 1 43 ILE H 3.150 . 4.590 2.398 2.275 2.509 . 0 0 "[ . 1 . 2 . ]" 1 291 1 43 ILE H 1 43 ILE HB 2.600 . 3.500 3.535 3.507 3.553 0.053 20 0 "[ . 1 . 2 . ]" 1 292 1 43 ILE H 1 43 ILE MD 3.270 . 4.840 2.144 2.062 2.238 . 0 0 "[ . 1 . 2 . ]" 1 293 1 44 THR H 1 46 ILE H 3.650 . 5.600 4.184 4.104 4.274 . 0 0 "[ . 1 . 2 . ]" 1 294 1 44 THR H 1 45 GLU QB 3.850 . 6.000 4.437 4.332 4.565 . 0 0 "[ . 1 . 2 . ]" 1 295 1 43 ILE MD 1 44 THR H 3.850 . 6.000 3.965 3.884 4.055 . 0 0 "[ . 1 . 2 . ]" 1 296 1 43 ILE MG 1 44 THR H 3.350 . 5.000 4.171 4.138 4.189 . 0 0 "[ . 1 . 2 . ]" 1 297 1 44 THR H 1 45 GLU H 2.790 . 3.890 2.710 2.649 2.787 . 0 0 "[ . 1 . 2 . ]" 1 298 1 44 THR H 1 44 THR HB 2.600 . 3.500 2.588 2.502 2.657 . 0 0 "[ . 1 . 2 . ]" 1 299 1 43 ILE HB 1 44 THR H 2.670 . 3.650 3.101 3.014 3.175 . 0 0 "[ . 1 . 2 . ]" 1 300 1 44 THR H 1 44 THR MG 3.400 . 5.090 3.765 3.759 3.770 . 0 0 "[ . 1 . 2 . ]" 1 301 1 43 ILE QG 1 44 THR H 3.850 . 6.000 2.323 2.204 2.448 . 0 0 "[ . 1 . 2 . ]" 1 302 1 41 ALA HA 1 44 THR H 2.900 . 4.100 3.815 3.700 3.919 . 0 0 "[ . 1 . 2 . ]" 1 303 1 44 THR H 1 44 THR HA 2.790 . 3.880 2.805 2.785 2.822 . 0 0 "[ . 1 . 2 . ]" 1 304 1 41 ALA MB 1 44 THR H 3.850 . 6.000 4.885 4.791 4.969 . 0 0 "[ . 1 . 2 . ]" 1 305 1 43 ILE HA 1 44 THR H 3.580 . 5.460 3.563 3.553 3.572 . 0 0 "[ . 1 . 2 . ]" 1 306 1 45 GLU H 1 46 ILE H 2.810 . 3.920 2.718 2.688 2.750 . 0 0 "[ . 1 . 2 . ]" 1 307 1 44 THR MG 1 45 GLU H 3.580 . 5.460 3.598 3.442 3.692 . 0 0 "[ . 1 . 2 . ]" 1 308 1 44 THR HA 1 45 GLU H 3.270 . 4.840 3.547 3.535 3.558 . 0 0 "[ . 1 . 2 . ]" 1 309 1 45 GLU H 1 45 GLU QG 3.480 . 5.260 3.441 2.622 4.062 . 0 0 "[ . 1 . 2 . ]" 1 310 1 44 THR HB 1 45 GLU H 2.750 . 3.810 2.619 2.543 2.693 . 0 0 "[ . 1 . 2 . ]" 1 311 1 42 GLU HA 1 45 GLU H 2.690 . 3.680 3.542 3.415 3.640 . 0 0 "[ . 1 . 2 . ]" 1 312 1 45 GLU H 1 45 GLU HA 2.830 . 3.950 2.798 2.788 2.806 . 0 0 "[ . 1 . 2 . ]" 1 313 1 45 GLU H 1 45 GLU QB 2.890 . 4.080 2.185 2.052 2.270 . 0 0 "[ . 1 . 2 . ]" 1 314 1 45 GLU H 1 46 ILE HB 3.410 . 5.120 4.934 4.875 4.999 . 0 0 "[ . 1 . 2 . ]" 1 315 1 46 ILE H 1 46 ILE MG 3.540 . 5.370 3.770 3.760 3.783 . 0 0 "[ . 1 . 2 . ]" 1 316 1 46 ILE H 1 46 ILE QG 3.020 . 4.340 2.178 2.082 2.297 . 0 0 "[ . 1 . 2 . ]" 1 317 1 45 GLU QB 1 46 ILE H 3.080 . 4.460 2.673 2.552 2.786 . 0 0 "[ . 1 . 2 . ]" 1 318 1 46 ILE H 1 46 ILE HB 2.330 . 2.960 2.522 2.466 2.576 . 0 0 "[ . 1 . 2 . ]" 1 319 1 46 ILE H 1 47 GLU H 2.790 . 3.870 2.694 2.600 2.771 . 0 0 "[ . 1 . 2 . ]" 1 320 1 46 ILE H 1 46 ILE MD 3.390 . 5.080 3.202 3.063 3.384 . 0 0 "[ . 1 . 2 . ]" 1 321 1 43 ILE HA 1 46 ILE H 3.070 . 4.440 3.394 3.328 3.507 . 0 0 "[ . 1 . 2 . ]" 1 322 1 46 ILE H 1 46 ILE HA 2.790 . 3.870 2.827 2.812 2.842 . 0 0 "[ . 1 . 2 . ]" 1 323 1 45 GLU HA 1 46 ILE H 3.230 . 4.750 3.541 3.527 3.558 . 0 0 "[ . 1 . 2 . ]" 1 324 1 45 GLU QG 1 46 ILE H 3.500 . 5.300 4.191 3.605 4.555 . 0 0 "[ . 1 . 2 . ]" 1 325 1 46 ILE HB 1 47 GLU H 2.670 . 3.650 2.452 2.390 2.630 . 0 0 "[ . 1 . 2 . ]" 1 326 1 43 ILE HA 1 47 GLU H 3.560 . 5.420 4.369 4.218 4.494 . 0 0 "[ . 1 . 2 . ]" 1 327 1 47 GLU H 1 48 SER H 2.890 . 4.080 2.734 2.708 2.761 . 0 0 "[ . 1 . 2 . ]" 1 328 1 47 GLU H 1 47 GLU HG3 2.960 . 4.220 2.574 2.423 2.714 . 0 0 "[ . 1 . 2 . ]" 1 329 1 47 GLU H 1 47 GLU HG2 2.660 . 3.620 3.651 3.593 3.701 0.081 6 0 "[ . 1 . 2 . ]" 1 330 1 44 THR HA 1 47 GLU H 3.270 . 4.840 3.394 3.290 3.528 . 0 0 "[ . 1 . 2 . ]" 1 331 1 46 ILE MG 1 47 GLU H 3.200 . 4.700 3.308 3.148 3.562 . 0 0 "[ . 1 . 2 . ]" 1 332 1 47 GLU H 1 47 GLU QB 3.240 . 4.780 2.256 2.207 2.295 . 0 0 "[ . 1 . 2 . ]" 1 333 1 46 ILE QG 1 47 GLU H 3.430 . 5.160 4.046 3.966 4.131 . 0 0 "[ . 1 . 2 . ]" 1 334 1 46 ILE HA 1 47 GLU H 2.930 . 4.160 3.564 3.550 3.576 . 0 0 "[ . 1 . 2 . ]" 1 335 1 47 GLU H 1 47 GLU HA 2.920 . 4.140 2.786 2.780 2.790 . 0 0 "[ . 1 . 2 . ]" 1 336 1 46 ILE MD 1 47 GLU H 3.850 . 6.000 4.179 4.089 4.405 . 0 0 "[ . 1 . 2 . ]" 1 337 1 44 THR MG 1 48 SER H 3.850 . 6.000 4.343 4.226 4.449 . 0 0 "[ . 1 . 2 . ]" 1 338 1 48 SER H 1 49 THR H 2.810 . 3.910 2.782 2.738 2.824 . 0 0 "[ . 1 . 2 . ]" 1 339 1 47 GLU QB 1 48 SER H 3.450 . 5.200 2.963 2.755 3.026 . 0 0 "[ . 1 . 2 . ]" 1 340 1 48 SER H 1 48 SER HA 2.890 . 4.080 2.815 2.809 2.828 . 0 0 "[ . 1 . 2 . ]" 1 341 1 48 SER H 1 48 SER QB 3.040 . 4.370 2.243 2.126 2.579 . 0 0 "[ . 1 . 2 . ]" 1 342 1 47 GLU HA 1 48 SER H 3.250 . 4.800 3.488 3.471 3.527 . 0 0 "[ . 1 . 2 . ]" 1 343 1 44 THR HA 1 48 SER H 3.680 . 5.660 4.531 4.414 4.591 . 0 0 "[ . 1 . 2 . ]" 1 344 1 49 THR H 1 49 THR MG 3.080 . 4.460 3.086 2.952 3.722 . 0 0 "[ . 1 . 2 . ]" 1 345 1 49 THR H 1 49 THR HA 2.690 . 3.680 2.944 2.939 2.947 . 0 0 "[ . 1 . 2 . ]" 1 346 1 49 THR H 1 50 LEU H 2.420 . 3.150 2.099 1.968 2.235 . 0 0 "[ . 1 . 2 . ]" 1 347 1 49 THR H 1 49 THR HB 2.690 . 3.680 3.661 2.435 3.729 0.049 21 0 "[ . 1 . 2 . ]" 1 348 1 49 THR H 1 50 LEU MD2 3.500 . 5.300 3.694 3.118 4.431 . 0 0 "[ . 1 . 2 . ]" 1 349 1 49 THR H 1 50 LEU HB2 3.290 . 4.880 4.805 4.664 4.972 0.092 21 0 "[ . 1 . 2 . ]" 1 350 1 48 SER QB 1 49 THR H 3.290 . 4.880 3.391 3.207 3.827 . 0 0 "[ . 1 . 2 . ]" 1 351 1 46 ILE HA 1 49 THR H 2.990 . 4.280 4.056 3.813 4.179 . 0 0 "[ . 1 . 2 . ]" 1 352 1 48 SER HA 1 49 THR H 3.060 . 4.420 3.390 3.323 3.426 . 0 0 "[ . 1 . 2 . ]" 1 353 1 49 THR MG 1 50 LEU H 3.850 . 6.000 4.042 3.277 4.348 . 0 0 "[ . 1 . 2 . ]" 1 354 1 50 LEU H 1 50 LEU HG 3.520 . 5.340 3.036 1.832 3.921 . 0 0 "[ . 1 . 2 . ]" 1 355 1 49 THR HA 1 50 LEU H 2.940 . 4.170 3.525 3.223 3.596 . 0 0 "[ . 1 . 2 . ]" 1 356 1 47 GLU HA 1 50 LEU H 3.020 . 4.340 3.263 3.047 3.532 . 0 0 "[ . 1 . 2 . ]" 1 357 1 50 LEU H 1 50 LEU MD2 3.120 . 4.540 2.578 1.902 3.722 . 0 0 "[ . 1 . 2 . ]" 1 358 1 50 LEU H 1 50 LEU HB3 3.120 . 4.540 3.715 3.642 3.926 . 0 0 "[ . 1 . 2 . ]" 1 359 1 50 LEU H 1 50 LEU HB2 2.940 . 4.170 2.944 2.759 3.260 . 0 0 "[ . 1 . 2 . ]" 1 360 1 50 LEU H 1 50 LEU HA 2.700 . 3.700 2.924 2.910 2.947 . 0 0 "[ . 1 . 2 . ]" 1 361 1 51 PRO QG 1 52 ALA H 3.850 . 6.000 4.517 4.428 4.607 . 0 0 "[ . 1 . 2 . ]" 1 362 1 52 ALA H 1 52 ALA HA 2.640 . 3.580 2.635 2.585 2.714 . 0 0 "[ . 1 . 2 . ]" 1 363 1 52 ALA H 1 53 GLU H 2.810 . 3.910 3.366 3.209 3.533 . 0 0 "[ . 1 . 2 . ]" 1 364 1 52 ALA H 1 52 ALA MB 2.690 . 3.680 2.242 2.118 2.303 . 0 0 "[ . 1 . 2 . ]" 1 365 1 51 PRO HA 1 52 ALA H 2.560 . 3.410 2.214 2.176 2.348 . 0 0 "[ . 1 . 2 . ]" 1 366 1 51 PRO QB 1 52 ALA H 3.220 . 4.740 3.009 2.733 3.151 . 0 0 "[ . 1 . 2 . ]" 1 367 1 53 GLU H 1 53 GLU QB 3.360 . 5.020 2.157 2.086 2.206 . 0 0 "[ . 1 . 2 . ]" 1 368 1 52 ALA MB 1 53 GLU H 3.060 . 4.410 2.180 2.032 2.408 . 0 0 "[ . 1 . 2 . ]" 1 369 1 53 GLU H 1 53 GLU HA 2.690 . 3.680 2.909 2.853 2.932 . 0 0 "[ . 1 . 2 . ]" 1 370 1 53 GLU H 1 53 GLU HG3 2.810 . 3.920 3.829 3.556 3.931 0.011 24 0 "[ . 1 . 2 . ]" 1 371 1 51 PRO QB 1 53 GLU H 3.180 . 4.660 3.461 3.150 3.759 . 0 0 "[ . 1 . 2 . ]" 1 372 1 52 ALA HA 1 53 GLU H 2.920 . 4.140 3.586 3.578 3.592 . 0 0 "[ . 1 . 2 . ]" 1 373 1 53 GLU H 1 53 GLU HG2 3.190 . 4.670 4.604 4.482 4.650 . 0 0 "[ . 1 . 2 . ]" 1 374 1 53 GLU H 1 54 VAL MG2 3.850 . 6.000 4.988 4.903 5.024 . 0 0 "[ . 1 . 2 . ]" 1 375 1 22 ILE MD 1 54 VAL H 3.850 . 6.000 4.995 4.858 5.050 . 0 0 "[ . 1 . 2 . ]" 1 376 1 22 ILE QG 1 54 VAL H 3.400 . 5.090 3.645 3.483 3.737 . 0 0 "[ . 1 . 2 . ]" 1 377 1 53 GLU QB 1 54 VAL H 3.420 . 5.140 3.498 3.416 3.561 . 0 0 "[ . 1 . 2 . ]" 1 378 1 54 VAL H 1 54 VAL MG2 2.670 . 3.630 2.305 2.240 2.414 . 0 0 "[ . 1 . 2 . ]" 1 379 1 54 VAL H 1 54 VAL MG1 3.220 . 4.740 3.800 3.785 3.813 . 0 0 "[ . 1 . 2 . ]" 1 380 1 53 GLU HA 1 54 VAL H 2.500 . 3.300 2.154 2.117 2.176 . 0 0 "[ . 1 . 2 . ]" 1 381 1 54 VAL H 1 54 VAL HB 2.380 . 3.070 2.527 2.485 2.566 . 0 0 "[ . 1 . 2 . ]" 1 382 1 54 VAL H 1 54 VAL HA 2.770 . 3.850 2.902 2.894 2.912 . 0 0 "[ . 1 . 2 . ]" 1 383 1 54 VAL H 1 55 ASP H 2.940 . 4.170 4.044 3.963 4.169 . 0 0 "[ . 1 . 2 . ]" 1 384 1 21 ARG QB 1 54 VAL H 3.150 . 4.590 3.645 3.389 3.934 . 0 0 "[ . 1 . 2 . ]" 1 385 1 55 ASP H 1 55 ASP HB2 2.810 . 3.920 3.614 3.594 3.643 . 0 0 "[ . 1 . 2 . ]" 1 386 1 54 VAL MG2 1 55 ASP H 3.420 . 5.140 4.283 4.215 4.302 . 0 0 "[ . 1 . 2 . ]" 1 387 1 55 ASP H 1 58 GLN H 2.500 . 3.310 3.310 3.268 3.365 0.055 21 0 "[ . 1 . 2 . ]" 1 388 1 55 ASP H 1 58 GLN HB3 2.600 . 3.500 3.482 3.378 3.542 0.042 21 0 "[ . 1 . 2 . ]" 1 389 1 55 ASP H 1 55 ASP HA 2.870 . 4.040 2.897 2.888 2.909 . 0 0 "[ . 1 . 2 . ]" 1 390 1 54 VAL HB 1 55 ASP H 3.200 . 4.700 4.476 4.461 4.490 . 0 0 "[ . 1 . 2 . ]" 1 391 1 54 VAL MG1 1 55 ASP H 3.090 . 4.480 3.495 3.341 3.603 . 0 0 "[ . 1 . 2 . ]" 1 392 1 55 ASP H 1 58 GLN HB2 2.520 . 3.340 2.046 1.952 2.208 . 0 0 "[ . 1 . 2 . ]" 1 393 1 55 ASP H 1 55 ASP HB3 2.600 . 3.500 2.945 2.889 2.987 . 0 0 "[ . 1 . 2 . ]" 1 394 1 54 VAL HA 1 55 ASP H 2.250 . 2.790 2.256 2.195 2.293 . 0 0 "[ . 1 . 2 . ]" 1 395 1 56 MET H 1 58 GLN H 3.500 . 5.300 4.620 4.496 4.678 . 0 0 "[ . 1 . 2 . ]" 1 396 1 55 ASP H 1 56 MET H 3.220 . 4.740 4.531 4.509 4.552 . 0 0 "[ . 1 . 2 . ]" 1 397 1 55 ASP HB3 1 56 MET H 2.560 . 3.420 3.445 3.414 3.502 0.082 21 0 "[ . 1 . 2 . ]" 1 398 1 56 MET H 1 56 MET QG 3.120 . 4.540 2.666 2.175 3.301 . 0 0 "[ . 1 . 2 . ]" 1 399 1 11 PHE HZ 1 56 MET H 3.100 . 4.500 2.794 2.546 3.011 . 0 0 "[ . 1 . 2 . ]" 1 400 1 55 ASP HA 1 56 MET H 2.610 . 3.520 2.588 2.514 2.638 . 0 0 "[ . 1 . 2 . ]" 1 401 1 56 MET H 1 56 MET QB 3.320 . 4.940 2.338 2.081 2.519 . 0 0 "[ . 1 . 2 . ]" 1 402 1 56 MET H 1 56 MET HA 2.890 . 4.080 2.705 2.699 2.714 . 0 0 "[ . 1 . 2 . ]" 1 403 1 56 MET H 1 57 GLU H 2.790 . 3.880 3.023 2.981 3.059 . 0 0 "[ . 1 . 2 . ]" 1 404 1 57 GLU H 1 58 GLN H 2.650 . 3.600 2.764 2.707 2.834 . 0 0 "[ . 1 . 2 . ]" 1 405 1 57 GLU H 1 57 GLU QB 2.900 . 4.090 2.216 2.142 2.249 . 0 0 "[ . 1 . 2 . ]" 1 406 1 55 ASP HB3 1 57 GLU H 3.540 . 5.380 4.695 4.584 4.792 . 0 0 "[ . 1 . 2 . ]" 1 407 1 57 GLU H 1 57 GLU HA 2.880 . 4.050 2.829 2.812 2.838 . 0 0 "[ . 1 . 2 . ]" 1 408 1 56 MET QG 1 57 GLU H 3.590 . 5.480 4.335 4.102 4.448 . 0 0 "[ . 1 . 2 . ]" 1 409 1 57 GLU H 1 57 GLU QG 3.140 . 4.580 3.919 2.971 4.040 . 0 0 "[ . 1 . 2 . ]" 1 410 1 57 GLU HA 1 58 GLN H 3.350 . 5.000 3.576 3.563 3.583 . 0 0 "[ . 1 . 2 . ]" 1 411 1 57 GLU QG 1 58 GLN H 3.550 . 5.400 3.794 3.482 4.304 . 0 0 "[ . 1 . 2 . ]" 1 412 1 54 VAL MG1 1 58 GLN H 3.850 . 6.000 4.159 3.953 4.274 . 0 0 "[ . 1 . 2 . ]" 1 413 1 58 GLN H 1 58 GLN HA 2.810 . 3.910 2.787 2.783 2.792 . 0 0 "[ . 1 . 2 . ]" 1 414 1 58 GLN H 1 58 GLN QG 3.210 . 4.710 3.398 2.207 3.568 . 0 0 "[ . 1 . 2 . ]" 1 415 1 58 GLN H 1 58 GLN HB2 2.530 . 3.360 2.213 2.157 2.529 . 0 0 "[ . 1 . 2 . ]" 1 416 1 57 GLU QB 1 58 GLN H 3.230 . 4.750 2.324 2.279 2.540 . 0 0 "[ . 1 . 2 . ]" 1 417 1 58 GLN H 1 58 GLN HB3 2.650 . 3.610 3.506 3.472 3.579 . 0 0 "[ . 1 . 2 . ]" 1 418 1 59 PHE H 1 59 PHE QD 2.970 . 4.240 3.476 3.434 3.498 . 0 0 "[ . 1 . 2 . ]" 1 419 1 59 PHE H 1 59 PHE HB2 2.460 . 3.230 3.275 3.266 3.283 0.053 21 0 "[ . 1 . 2 . ]" 1 420 1 59 PHE H 1 59 PHE HB3 2.420 . 3.130 2.054 2.047 2.062 . 0 0 "[ . 1 . 2 . ]" 1 421 1 59 PHE H 1 59 PHE HA 2.700 . 3.700 2.805 2.794 2.812 . 0 0 "[ . 1 . 2 . ]" 1 422 1 54 VAL MG1 1 59 PHE H 3.080 . 4.460 2.316 2.188 2.438 . 0 0 "[ . 1 . 2 . ]" 1 423 1 54 VAL MG2 1 59 PHE H 3.850 . 6.000 4.640 4.594 4.712 . 0 0 "[ . 1 . 2 . ]" 1 424 1 56 MET HA 1 59 PHE H 3.170 . 4.640 4.112 4.040 4.164 . 0 0 "[ . 1 . 2 . ]" 1 425 1 58 GLN HB3 1 59 PHE H 2.890 . 4.080 3.047 2.950 3.444 . 0 0 "[ . 1 . 2 . ]" 1 426 1 58 GLN HB2 1 59 PHE H 2.790 . 3.870 2.658 2.352 2.747 . 0 0 "[ . 1 . 2 . ]" 1 427 1 58 GLN HA 1 59 PHE H 3.170 . 4.640 3.572 3.567 3.576 . 0 0 "[ . 1 . 2 . ]" 1 428 1 57 GLU QB 1 59 PHE H 3.530 . 5.360 4.808 4.784 4.838 . 0 0 "[ . 1 . 2 . ]" 1 429 1 59 PHE H 1 60 LEU HB2 3.350 . 5.000 4.797 4.734 4.879 . 0 0 "[ . 1 . 2 . ]" 1 430 1 57 GLU QG 1 60 LEU H 3.850 . 6.000 5.291 5.192 5.405 . 0 0 "[ . 1 . 2 . ]" 1 431 1 60 LEU H 1 61 GLN H 2.810 . 3.920 2.688 2.656 2.720 . 0 0 "[ . 1 . 2 . ]" 1 432 1 60 LEU H 1 60 LEU MD1 3.270 . 4.840 3.721 3.615 3.899 . 0 0 "[ . 1 . 2 . ]" 1 433 1 57 GLU HA 1 60 LEU H 3.080 . 4.460 3.825 3.656 3.898 . 0 0 "[ . 1 . 2 . ]" 1 434 1 60 LEU H 1 60 LEU HG 2.370 . 3.040 2.574 2.464 2.751 . 0 0 "[ . 1 . 2 . ]" 1 435 1 56 MET HA 1 60 LEU H 3.460 . 5.220 3.877 3.746 3.986 . 0 0 "[ . 1 . 2 . ]" 1 436 1 60 LEU H 1 60 LEU HB3 2.620 . 3.540 3.565 3.544 3.584 0.044 17 0 "[ . 1 . 2 . ]" 1 437 1 60 LEU H 1 60 LEU HB2 2.390 . 3.080 2.340 2.273 2.400 . 0 0 "[ . 1 . 2 . ]" 1 438 1 57 GLU QB 1 60 LEU H 3.850 . 6.000 5.183 5.001 5.226 . 0 0 "[ . 1 . 2 . ]" 1 439 1 59 PHE HB3 1 60 LEU H 2.690 . 3.690 3.185 3.163 3.211 . 0 0 "[ . 1 . 2 . ]" 1 440 1 60 LEU H 1 60 LEU HA 2.710 . 3.710 2.810 2.806 2.816 . 0 0 "[ . 1 . 2 . ]" 1 441 1 60 LEU H 1 60 LEU MD2 3.460 . 5.220 3.544 3.531 3.564 . 0 0 "[ . 1 . 2 . ]" 1 442 1 59 PHE QD 1 60 LEU H 2.980 . 4.260 2.998 2.918 3.035 . 0 0 "[ . 1 . 2 . ]" 1 443 1 59 PHE HB2 1 60 LEU H 3.070 . 4.440 4.071 4.052 4.111 . 0 0 "[ . 1 . 2 . ]" 1 444 1 59 PHE HA 1 60 LEU H 3.360 . 5.020 3.573 3.568 3.581 . 0 0 "[ . 1 . 2 . ]" 1 445 1 60 LEU MD1 1 61 GLN H 3.850 . 6.000 4.796 4.622 4.912 . 0 0 "[ . 1 . 2 . ]" 1 446 1 60 LEU HA 1 61 GLN H 3.260 . 4.820 3.516 3.490 3.542 . 0 0 "[ . 1 . 2 . ]" 1 447 1 58 GLN HA 1 61 GLN H 3.120 . 4.540 3.617 3.549 3.708 . 0 0 "[ . 1 . 2 . ]" 1 448 1 61 GLN H 1 61 GLN HA 2.770 . 3.840 2.807 2.775 2.830 . 0 0 "[ . 1 . 2 . ]" 1 449 1 61 GLN H 1 61 GLN QG 3.440 . 5.180 3.592 2.861 4.046 . 0 0 "[ . 1 . 2 . ]" 1 450 1 60 LEU HB3 1 61 GLN H 3.400 . 5.090 3.661 3.441 3.854 . 0 0 "[ . 1 . 2 . ]" 1 451 1 61 GLN H 1 61 GLN QB 3.100 . 4.500 2.173 2.048 2.259 . 0 0 "[ . 1 . 2 . ]" 1 452 1 60 LEU HB2 1 61 GLN H 2.850 . 4.000 2.914 2.747 3.059 . 0 0 "[ . 1 . 2 . ]" 1 453 1 62 VAL H 1 63 LEU H 2.540 . 3.380 2.586 2.442 2.693 . 0 0 "[ . 1 . 2 . ]" 1 454 1 59 PHE HA 1 62 VAL H 3.070 . 4.440 3.712 3.573 3.810 . 0 0 "[ . 1 . 2 . ]" 1 455 1 61 GLN HA 1 62 VAL H 3.150 . 4.600 3.567 3.548 3.578 . 0 0 "[ . 1 . 2 . ]" 1 456 1 62 VAL H 1 62 VAL MG2 3.250 . 4.800 1.814 1.807 1.831 . 0 0 "[ . 1 . 2 . ]" 1 457 1 62 VAL H 1 62 VAL HB 2.740 . 3.780 3.424 3.393 3.490 . 0 0 "[ . 1 . 2 . ]" 1 458 1 62 VAL H 1 62 VAL HA 2.600 . 3.500 2.853 2.825 2.887 . 0 0 "[ . 1 . 2 . ]" 1 459 1 62 VAL H 1 62 VAL MG1 2.840 . 3.980 3.323 3.193 3.351 . 0 0 "[ . 1 . 2 . ]" 1 460 1 61 GLN QB 1 62 VAL H 3.210 . 4.720 2.432 2.254 2.688 . 0 0 "[ . 1 . 2 . ]" 1 461 1 62 VAL H 1 63 LEU HB2 3.560 . 5.420 4.645 4.341 4.949 . 0 0 "[ . 1 . 2 . ]" 1 462 1 63 LEU H 1 63 LEU MD2 3.850 . 6.000 4.348 4.106 4.453 . 0 0 "[ . 1 . 2 . ]" 1 463 1 63 LEU H 1 63 LEU HA 2.830 . 3.960 2.815 2.774 2.858 . 0 0 "[ . 1 . 2 . ]" 1 464 1 60 LEU HA 1 63 LEU H 2.800 . 3.900 3.469 3.293 3.622 . 0 0 "[ . 1 . 2 . ]" 1 465 1 63 LEU H 1 63 LEU HB3 2.460 . 3.210 2.790 2.445 3.015 . 0 0 "[ . 1 . 2 . ]" 1 466 1 63 LEU H 1 63 LEU HB2 2.390 . 3.080 2.270 2.136 2.569 . 0 0 "[ . 1 . 2 . ]" 1 467 1 63 LEU H 1 63 LEU HG 3.010 . 4.320 4.380 4.310 4.441 0.121 25 0 "[ . 1 . 2 . ]" 1 468 1 62 VAL HB 1 63 LEU H 2.910 . 4.120 3.140 2.978 3.477 . 0 0 "[ . 1 . 2 . ]" 1 469 1 62 VAL MG2 1 63 LEU H 3.320 . 4.940 2.570 2.375 2.730 . 0 0 "[ . 1 . 2 . ]" 1 470 1 63 LEU H 1 63 LEU MD1 3.370 . 5.040 3.834 3.542 4.203 . 0 0 "[ . 1 . 2 . ]" 1 471 1 63 LEU H 1 64 ASN H 2.860 . 4.020 2.749 2.573 2.896 . 0 0 "[ . 1 . 2 . ]" 1 472 1 64 ASN H 1 64 ASN HB3 2.690 . 3.690 3.627 3.470 3.733 0.043 24 0 "[ . 1 . 2 . ]" 1 473 1 63 LEU HG 1 64 ASN H 3.290 . 4.880 4.347 3.606 4.835 . 0 0 "[ . 1 . 2 . ]" 1 474 1 64 ASN H 1 65 ARG H 2.810 . 3.920 3.306 2.741 3.616 . 0 0 "[ . 1 . 2 . ]" 1 475 1 61 GLN HA 1 64 ASN H 3.200 . 4.700 3.975 3.548 4.286 . 0 0 "[ . 1 . 2 . ]" 1 476 1 63 LEU HB3 1 64 ASN H 2.540 . 3.390 2.442 2.040 2.900 . 0 0 "[ . 1 . 2 . ]" 1 477 1 60 LEU HA 1 64 ASN H 3.250 . 4.800 3.476 3.009 4.532 . 0 0 "[ . 1 . 2 . ]" 1 478 1 64 ASN H 1 64 ASN HB2 2.540 . 3.370 2.452 2.215 2.814 . 0 0 "[ . 1 . 2 . ]" 1 479 1 63 LEU HA 1 64 ASN H 3.250 . 4.800 3.561 3.523 3.580 . 0 0 "[ . 1 . 2 . ]" 1 480 1 63 LEU HB2 1 64 ASN H 2.670 . 3.630 3.563 3.429 3.698 0.068 25 0 "[ . 1 . 2 . ]" 1 481 1 64 ASN H 1 64 ASN HA 2.690 . 3.690 2.921 2.892 2.948 . 0 0 "[ . 1 . 2 . ]" 1 482 1 63 LEU MD2 1 64 ASN H 3.480 . 5.260 3.739 2.852 4.384 . 0 0 "[ . 1 . 2 . ]" 1 483 1 62 VAL HA 1 65 ARG H 3.370 . 5.040 4.526 3.733 5.046 0.006 1 0 "[ . 1 . 2 . ]" 1 484 1 65 ARG H 1 65 ARG QB 2.930 . 4.160 2.128 2.048 2.255 . 0 0 "[ . 1 . 2 . ]" 1 485 1 64 ASN HA 1 65 ARG H 3.040 . 4.380 2.644 2.498 2.842 . 0 0 "[ . 1 . 2 . ]" 1 486 1 65 ARG H 1 72 PRO HA 3.290 . 4.880 4.556 3.958 4.942 0.062 22 0 "[ . 1 . 2 . ]" 1 487 1 65 ARG H 1 72 PRO QD 3.850 . 6.000 5.140 4.821 5.370 . 0 0 "[ . 1 . 2 . ]" 1 488 1 65 ARG H 1 72 PRO QG 3.160 . 4.620 3.219 2.975 3.419 . 0 0 "[ . 1 . 2 . ]" 1 489 1 63 LEU HB3 1 65 ARG H 3.350 . 5.000 5.030 4.966 5.085 0.085 15 0 "[ . 1 . 2 . ]" 1 490 1 67 ASN H 1 68 GLY H 3.350 . 5.000 3.373 3.061 3.738 . 0 0 "[ . 1 . 2 . ]" 1 491 1 66 PRO QB 1 67 ASN H 3.850 . 6.000 3.932 3.915 4.018 . 0 0 "[ . 1 . 2 . ]" 1 492 1 66 PRO HA 1 67 ASN H 2.670 . 3.650 3.156 2.944 3.207 . 0 0 "[ . 1 . 2 . ]" 1 493 1 67 ASN H 1 67 ASN QB 3.650 . 5.590 3.125 2.867 3.410 . 0 0 "[ . 1 . 2 . ]" 1 494 1 64 ASN HA 1 67 ASN H 3.210 . 4.710 3.928 3.648 4.402 . 0 0 "[ . 1 . 2 . ]" 1 495 1 67 ASN H 1 67 ASN HA 2.830 . 3.960 2.293 2.255 2.664 . 0 0 "[ . 1 . 2 . ]" 1 496 1 68 GLY H 1 69 PHE H 3.200 . 4.700 4.310 2.903 4.492 . 0 0 "[ . 1 . 2 . ]" 1 497 1 64 ASN HA 1 68 GLY H 2.920 . 4.130 3.523 2.783 4.136 0.006 17 0 "[ . 1 . 2 . ]" 1 498 1 67 ASN HA 1 68 GLY H 3.100 . 4.500 2.388 2.142 3.573 . 0 0 "[ . 1 . 2 . ]" 1 499 1 68 GLY H 1 68 GLY QA 2.460 . 3.210 2.427 2.300 2.504 . 0 0 "[ . 1 . 2 . ]" 1 500 1 67 ASN QB 1 68 GLY H 3.850 . 6.000 3.742 2.072 4.058 . 0 0 "[ . 1 . 2 . ]" 1 501 1 69 PHE H 1 69 PHE HB3 2.810 . 3.930 3.680 3.467 3.844 . 0 0 "[ . 1 . 2 . ]" 1 502 1 69 PHE H 1 69 PHE HB2 2.480 . 3.250 2.578 2.259 2.913 . 0 0 "[ . 1 . 2 . ]" 1 503 1 69 PHE H 1 69 PHE QD 2.730 . 3.770 3.057 2.513 3.436 . 0 0 "[ . 1 . 2 . ]" 1 504 1 68 GLY QA 1 69 PHE H 2.460 . 3.220 2.276 2.255 2.427 . 0 0 "[ . 1 . 2 . ]" 1 505 1 69 PHE H 1 69 PHE HA 2.710 . 3.710 2.940 2.932 2.951 . 0 0 "[ . 1 . 2 . ]" 1 506 1 69 PHE HB3 1 70 ASP H 3.850 . 6.000 2.885 2.183 3.689 . 0 0 "[ . 1 . 2 . ]" 1 507 1 70 ASP H 1 71 MET H 3.220 . 4.740 3.238 2.537 4.081 . 0 0 "[ . 1 . 2 . ]" 1 508 1 69 PHE HB2 1 70 ASP H 3.850 . 6.000 3.005 2.215 3.885 . 0 0 "[ . 1 . 2 . ]" 1 509 1 69 PHE HA 1 70 ASP H 2.880 . 4.050 2.970 2.308 3.592 . 0 0 "[ . 1 . 2 . ]" 1 510 1 70 ASP H 1 70 ASP QB 3.330 . 4.960 2.884 2.324 3.376 . 0 0 "[ . 1 . 2 . ]" 1 511 1 71 MET H 1 71 MET HA 3.000 . 4.300 2.804 2.741 2.918 . 0 0 "[ . 1 . 2 . ]" 1 512 1 70 ASP QB 1 71 MET H 3.110 . 4.520 3.913 3.698 4.027 . 0 0 "[ . 1 . 2 . ]" 1 513 1 70 ASP HA 1 71 MET H 2.490 . 3.280 2.495 2.201 3.079 . 0 0 "[ . 1 . 2 . ]" 1 514 1 71 MET H 1 71 MET QB 2.820 . 3.940 2.991 2.311 3.419 . 0 0 "[ . 1 . 2 . ]" 1 515 1 71 MET HA 1 73 GLY H 3.600 . 5.500 4.518 4.159 4.938 . 0 0 "[ . 1 . 2 . ]" 1 516 1 72 PRO HA 1 73 GLY H 2.900 . 4.090 3.534 2.303 3.595 . 0 0 "[ . 1 . 2 . ]" 1 517 1 72 PRO QB 1 73 GLY H 3.850 . 6.000 2.398 2.100 3.811 . 0 0 "[ . 1 . 2 . ]" 1 518 1 70 ASP HA 1 74 ASP H 3.480 . 5.260 4.735 3.825 5.317 0.057 2 0 "[ . 1 . 2 . ]" 1 519 1 74 ASP H 1 74 ASP HB2 3.350 . 5.000 2.343 2.106 3.644 . 0 0 "[ . 1 . 2 . ]" 1 520 1 72 PRO QB 1 74 ASP H 3.850 . 6.000 4.582 3.744 5.375 . 0 0 "[ . 1 . 2 . ]" 1 521 1 74 ASP H 1 78 PHE H 3.350 . 5.000 4.857 4.335 5.042 0.042 19 0 "[ . 1 . 2 . ]" 1 522 1 73 GLY QA 1 74 ASP H 2.750 . 3.810 2.497 2.123 2.862 . 0 0 "[ . 1 . 2 . ]" 1 523 1 74 ASP H 1 74 ASP HB3 3.540 . 5.380 3.409 2.752 3.633 . 0 0 "[ . 1 . 2 . ]" 1 524 1 73 GLY H 1 74 ASP H 3.140 . 4.580 2.671 2.117 3.521 . 0 0 "[ . 1 . 2 . ]" 1 525 1 75 PRO HA 1 76 GLU H 3.000 . 4.300 3.567 3.550 3.584 . 0 0 "[ . 1 . 2 . ]" 1 526 1 75 PRO QD 1 76 GLU H 3.660 . 5.620 2.617 2.131 2.879 . 0 0 "[ . 1 . 2 . ]" 1 527 1 76 GLU H 1 77 GLU H 2.730 . 3.760 2.610 2.501 2.670 . 0 0 "[ . 1 . 2 . ]" 1 528 1 76 GLU H 1 76 GLU HA 2.800 . 3.900 2.833 2.817 2.862 . 0 0 "[ . 1 . 2 . ]" 1 529 1 76 GLU H 1 76 GLU QB 2.920 . 4.140 2.320 2.061 2.628 . 0 0 "[ . 1 . 2 . ]" 1 530 1 76 GLU H 1 76 GLU QG 3.450 . 5.200 3.040 2.087 4.031 . 0 0 "[ . 1 . 2 . ]" 1 531 1 76 GLU HA 1 77 GLU H 2.910 . 4.120 3.504 3.453 3.542 . 0 0 "[ . 1 . 2 . ]" 1 532 1 77 GLU H 1 77 GLU HA 2.690 . 3.690 2.833 2.813 2.851 . 0 0 "[ . 1 . 2 . ]" 1 533 1 77 GLU H 1 78 PHE H 2.170 . 2.630 2.672 2.650 2.699 0.069 10 0 "[ . 1 . 2 . ]" 1 534 1 77 GLU H 1 77 GLU QG 3.180 . 4.660 3.680 1.985 4.062 . 0 0 "[ . 1 . 2 . ]" 1 535 1 77 GLU H 1 77 GLU QB 2.960 . 4.210 2.198 2.055 2.584 . 0 0 "[ . 1 . 2 . ]" 1 536 1 77 GLU HA 1 78 PHE H 2.750 . 3.800 3.564 3.542 3.577 . 0 0 "[ . 1 . 2 . ]" 1 537 1 78 PHE H 1 78 PHE HB3 2.460 . 3.230 2.130 2.088 2.254 . 0 0 "[ . 1 . 2 . ]" 1 538 1 78 PHE H 1 78 PHE HB2 2.540 . 3.370 3.410 3.310 3.523 0.153 5 0 "[ . 1 . 2 . ]" 1 539 1 77 GLU QG 1 78 PHE H 3.850 . 6.000 4.052 3.445 4.470 . 0 0 "[ . 1 . 2 . ]" 1 540 1 77 GLU QB 1 78 PHE H 3.250 . 4.800 2.493 2.325 2.685 . 0 0 "[ . 1 . 2 . ]" 1 541 1 78 PHE H 1 78 PHE QD 3.000 . 4.300 3.183 2.769 3.502 . 0 0 "[ . 1 . 2 . ]" 1 542 1 78 PHE H 1 78 PHE HA 2.910 . 4.120 2.830 2.805 2.858 . 0 0 "[ . 1 . 2 . ]" 1 543 1 78 PHE HB2 1 79 VAL H 2.960 . 4.220 4.149 4.103 4.195 . 0 0 "[ . 1 . 2 . ]" 1 544 1 79 VAL H 1 79 VAL MG1 3.280 . 4.860 3.770 3.755 3.785 . 0 0 "[ . 1 . 2 . ]" 1 545 1 79 VAL H 1 79 VAL MG2 2.610 . 3.530 2.251 2.147 2.363 . 0 0 "[ . 1 . 2 . ]" 1 546 1 79 VAL H 1 79 VAL HB 2.440 . 3.170 2.494 2.416 2.600 . 0 0 "[ . 1 . 2 . ]" 1 547 1 78 PHE HB3 1 79 VAL H 2.830 . 3.960 3.443 3.222 3.720 . 0 0 "[ . 1 . 2 . ]" 1 548 1 79 VAL H 1 79 VAL HA 2.600 . 3.500 2.820 2.798 2.835 . 0 0 "[ . 1 . 2 . ]" 1 549 1 76 GLU HA 1 79 VAL H 2.900 . 4.090 3.522 3.399 3.704 . 0 0 "[ . 1 . 2 . ]" 1 550 1 78 PHE HA 1 79 VAL H 2.900 . 4.090 3.544 3.533 3.568 . 0 0 "[ . 1 . 2 . ]" 1 551 1 79 VAL MG2 1 80 LYS H 3.850 . 6.000 3.864 3.714 3.957 . 0 0 "[ . 1 . 2 . ]" 1 552 1 80 LYS H 1 80 LYS HA 2.870 . 4.040 2.814 2.791 2.834 . 0 0 "[ . 1 . 2 . ]" 1 553 1 79 VAL MG1 1 80 LYS H 3.850 . 6.000 3.251 2.806 3.515 . 0 0 "[ . 1 . 2 . ]" 1 554 1 80 LYS H 1 80 LYS QB 3.000 . 4.290 2.069 2.044 2.136 . 0 0 "[ . 1 . 2 . ]" 1 555 1 79 VAL HA 1 80 LYS H 3.100 . 4.500 3.564 3.543 3.582 . 0 0 "[ . 1 . 2 . ]" 1 556 1 80 LYS H 1 80 LYS HG3 3.090 . 4.480 4.390 3.995 4.502 0.022 21 0 "[ . 1 . 2 . ]" 1 557 1 80 LYS H 1 80 LYS HG2 3.080 . 4.460 4.354 4.104 4.484 0.024 21 0 "[ . 1 . 2 . ]" 1 558 1 79 VAL HB 1 80 LYS H 2.980 . 4.260 2.521 2.138 2.716 . 0 0 "[ . 1 . 2 . ]" 1 559 1 78 PHE HA 1 81 GLY H 3.260 . 4.820 3.527 3.367 3.772 . 0 0 "[ . 1 . 2 . ]" 1 560 1 80 LYS HA 1 81 GLY H 3.050 . 4.400 3.525 3.480 3.570 . 0 0 "[ . 1 . 2 . ]" 1 561 1 81 GLY H 1 81 GLY QA 2.530 . 3.360 2.201 2.195 2.212 . 0 0 "[ . 1 . 2 . ]" 1 562 1 80 LYS QB 1 81 GLY H 3.270 . 4.840 2.832 2.515 3.046 . 0 0 "[ . 1 . 2 . ]" 1 563 1 81 GLY H 1 83 GLN H 2.830 . 3.960 3.966 3.776 4.020 0.060 14 0 "[ . 1 . 2 . ]" 1 564 1 82 PHE H 1 83 GLN H 2.570 . 3.440 2.545 2.468 2.771 . 0 0 "[ . 1 . 2 . ]" 1 565 1 79 VAL MG1 1 82 PHE H 3.850 . 6.000 4.913 4.714 5.013 . 0 0 "[ . 1 . 2 . ]" 1 566 1 82 PHE H 1 82 PHE QD 2.790 . 3.870 2.752 2.189 3.384 . 0 0 "[ . 1 . 2 . ]" 1 567 1 81 GLY QA 1 82 PHE H 3.020 . 4.340 2.639 2.571 2.722 . 0 0 "[ . 1 . 2 . ]" 1 568 1 82 PHE H 1 82 PHE HB2 2.620 . 3.540 2.289 2.099 2.527 . 0 0 "[ . 1 . 2 . ]" 1 569 1 82 PHE H 1 82 PHE HA 2.730 . 3.760 2.858 2.794 2.881 . 0 0 "[ . 1 . 2 . ]" 1 570 1 82 PHE H 1 82 PHE HB3 2.950 . 4.200 3.543 3.375 3.632 . 0 0 "[ . 1 . 2 . ]" 1 571 1 82 PHE H 1 101 VAL MG1 3.850 . 6.000 4.139 3.344 4.764 . 0 0 "[ . 1 . 2 . ]" 1 572 1 81 GLY H 1 82 PHE H 2.220 . 2.740 2.751 2.634 2.814 0.074 15 0 "[ . 1 . 2 . ]" 1 573 1 83 GLN H 1 84 VAL H 3.270 . 4.840 3.519 2.582 3.915 . 0 0 "[ . 1 . 2 . ]" 1 574 1 80 LYS HA 1 83 GLN H 2.990 . 4.280 3.579 3.281 4.033 . 0 0 "[ . 1 . 2 . ]" 1 575 1 83 GLN H 1 83 GLN QB 2.720 . 3.740 2.245 2.118 2.512 . 0 0 "[ . 1 . 2 . ]" 1 576 1 83 GLN H 1 83 GLN QG 3.300 . 4.900 3.677 2.366 4.093 . 0 0 "[ . 1 . 2 . ]" 1 577 1 82 PHE HA 1 83 GLN H 2.810 . 3.920 3.524 3.464 3.560 . 0 0 "[ . 1 . 2 . ]" 1 578 1 84 VAL H 1 84 VAL MG2 3.810 . 5.920 3.160 2.076 3.953 . 0 0 "[ . 1 . 2 . ]" 1 579 1 84 VAL H 1 86 ASP H 3.110 . 4.520 3.360 2.690 4.585 0.065 6 0 "[ . 1 . 2 . ]" 1 580 1 84 VAL H 1 84 VAL HB 2.850 . 4.000 2.777 2.383 3.343 . 0 0 "[ . 1 . 2 . ]" 1 581 1 84 VAL HB 1 85 PHE H 2.830 . 3.960 2.915 2.076 4.007 0.047 6 0 "[ . 1 . 2 . ]" 1 582 1 85 PHE H 1 85 PHE QB 3.080 . 4.460 2.530 2.263 2.956 . 0 0 "[ . 1 . 2 . ]" 1 583 1 85 PHE H 1 101 VAL MG2 3.710 . 5.710 4.695 4.233 4.824 . 0 0 "[ . 1 . 2 . ]" 1 584 1 84 VAL MG2 1 85 PHE H 3.160 . 4.620 3.685 3.388 3.878 . 0 0 "[ . 1 . 2 . ]" 1 585 1 85 PHE H 1 85 PHE HA 2.780 . 3.860 2.907 2.271 2.950 . 0 0 "[ . 1 . 2 . ]" 1 586 1 85 PHE QB 1 86 ASP H 3.580 . 5.460 3.843 3.699 3.936 . 0 0 "[ . 1 . 2 . ]" 1 587 1 86 ASP H 1 86 ASP HB3 2.690 . 3.690 3.434 2.814 3.735 0.045 1 0 "[ . 1 . 2 . ]" 1 588 1 86 ASP H 1 86 ASP HB2 2.680 . 3.660 2.799 2.397 3.748 0.088 18 0 "[ . 1 . 2 . ]" 1 589 1 85 PHE HA 1 86 ASP H 3.000 . 4.290 2.856 2.566 3.081 . 0 0 "[ . 1 . 2 . ]" 1 590 1 86 ASP H 1 87 LYS H 2.560 . 3.430 3.202 2.783 3.450 0.020 24 0 "[ . 1 . 2 . ]" 1 591 1 83 GLN HA 1 86 ASP H 2.980 . 4.260 3.729 2.688 4.301 0.041 19 0 "[ . 1 . 2 . ]" 1 592 1 86 ASP H 1 86 ASP HA 2.730 . 3.760 2.935 2.917 2.947 . 0 0 "[ . 1 . 2 . ]" 1 593 1 86 ASP HA 1 87 LYS H 2.600 . 3.500 2.499 2.331 2.686 . 0 0 "[ . 1 . 2 . ]" 1 594 1 87 LYS H 1 87 LYS QD 3.730 . 5.760 3.980 2.478 4.581 . 0 0 "[ . 1 . 2 . ]" 1 595 1 87 LYS H 1 87 LYS QB 3.000 . 4.290 2.244 2.057 2.442 . 0 0 "[ . 1 . 2 . ]" 1 596 1 87 LYS H 1 87 LYS HA 2.890 . 4.080 2.822 2.787 2.855 . 0 0 "[ . 1 . 2 . ]" 1 597 1 87 LYS H 1 87 LYS QG 3.380 . 5.050 3.290 2.210 4.065 . 0 0 "[ . 1 . 2 . ]" 1 598 1 87 LYS H 1 88 ASP H 2.730 . 3.770 2.773 2.552 3.749 . 0 0 "[ . 1 . 2 . ]" 1 599 1 88 ASP H 1 88 ASP HB2 2.710 . 3.730 2.592 2.229 3.093 . 0 0 "[ . 1 . 2 . ]" 1 600 1 88 ASP H 1 88 ASP HA 2.870 . 4.040 2.916 2.885 2.949 . 0 0 "[ . 1 . 2 . ]" 1 601 1 88 ASP H 1 89 ALA H 2.840 . 3.980 2.480 2.184 2.806 . 0 0 "[ . 1 . 2 . ]" 1 602 1 87 LYS HA 1 88 ASP H 3.070 . 4.440 3.507 2.507 3.581 . 0 0 "[ . 1 . 2 . ]" 1 603 1 88 ASP H 1 88 ASP HB3 2.860 . 4.020 2.804 2.271 3.143 . 0 0 "[ . 1 . 2 . ]" 1 604 1 87 LYS QB 1 88 ASP H 3.440 . 5.170 2.649 2.265 3.914 . 0 0 "[ . 1 . 2 . ]" 1 605 1 87 LYS QG 1 88 ASP H 3.500 . 5.300 3.976 2.046 4.556 . 0 0 "[ . 1 . 2 . ]" 1 606 1 88 ASP HB2 1 89 ALA H 3.850 . 6.000 3.456 3.055 3.886 . 0 0 "[ . 1 . 2 . ]" 1 607 1 89 ALA H 1 89 ALA HA 2.460 . 3.210 2.270 2.263 2.280 . 0 0 "[ . 1 . 2 . ]" 1 608 1 88 ASP HB3 1 89 ALA H 3.600 . 5.500 2.282 1.915 2.762 . 0 0 "[ . 1 . 2 . ]" 1 609 1 89 ALA H 1 90 THR H 3.740 . 5.780 3.418 2.758 4.639 . 0 0 "[ . 1 . 2 . ]" 1 610 1 89 ALA H 1 89 ALA MB 2.980 . 4.260 2.856 2.746 2.940 . 0 0 "[ . 1 . 2 . ]" 1 611 1 88 ASP HA 1 89 ALA H 2.940 . 4.180 3.574 3.532 3.584 . 0 0 "[ . 1 . 2 . ]" 1 612 1 89 ALA H 1 91 GLY H 3.830 . 5.960 5.558 4.869 5.994 0.034 12 0 "[ . 1 . 2 . ]" 1 613 1 89 ALA HA 1 90 THR H 2.900 . 4.090 2.686 2.241 3.588 . 0 0 "[ . 1 . 2 . ]" 1 614 1 91 GLY QA 1 92 MET H 3.040 . 4.380 2.698 2.471 2.952 . 0 0 "[ . 1 . 2 . ]" 1 615 1 89 ALA HA 1 92 MET H 2.900 . 4.100 3.914 3.362 4.128 0.028 10 0 "[ . 1 . 2 . ]" 1 616 1 92 MET H 1 93 ILE HB 3.350 . 5.000 5.017 4.853 5.100 0.100 4 0 "[ . 1 . 2 . ]" 1 617 1 92 MET H 1 92 MET HA 2.760 . 3.820 2.824 2.722 2.880 . 0 0 "[ . 1 . 2 . ]" 1 618 1 92 MET H 1 92 MET QB 2.870 . 4.040 3.253 2.834 3.467 . 0 0 "[ . 1 . 2 . ]" 1 619 1 92 MET H 1 92 MET QG 3.310 . 4.920 3.031 2.426 4.345 . 0 0 "[ . 1 . 2 . ]" 1 620 1 93 ILE H 1 129 ASN HA 2.810 . 3.930 3.550 3.046 3.927 . 0 0 "[ . 1 . 2 . ]" 1 621 1 93 ILE H 1 93 ILE HB 2.580 . 3.470 2.699 2.461 2.826 . 0 0 "[ . 1 . 2 . ]" 1 622 1 93 ILE H 1 128 VAL H 2.600 . 3.500 2.937 2.534 3.262 . 0 0 "[ . 1 . 2 . ]" 1 623 1 92 MET HA 1 93 ILE H 2.740 . 3.780 2.203 2.152 2.290 . 0 0 "[ . 1 . 2 . ]" 1 624 1 93 ILE H 1 93 ILE MG 2.900 . 4.100 2.464 2.255 2.895 . 0 0 "[ . 1 . 2 . ]" 1 625 1 92 MET QB 1 93 ILE H 2.970 . 4.240 3.085 2.703 3.694 . 0 0 "[ . 1 . 2 . ]" 1 626 1 93 ILE H 1 93 ILE QG 3.490 . 5.280 4.134 3.943 4.205 . 0 0 "[ . 1 . 2 . ]" 1 627 1 93 ILE H 1 93 ILE MD 3.850 . 6.000 4.322 4.257 4.454 . 0 0 "[ . 1 . 2 . ]" 1 628 1 93 ILE H 1 93 ILE HA 2.790 . 3.880 2.942 2.936 2.948 . 0 0 "[ . 1 . 2 . ]" 1 629 1 93 ILE MD 1 94 GLY H 3.850 . 6.000 3.389 1.947 3.905 . 0 0 "[ . 1 . 2 . ]" 1 630 1 94 GLY H 1 94 GLY QA 2.650 . 3.610 2.220 2.192 2.321 . 0 0 "[ . 1 . 2 . ]" 1 631 1 93 ILE HA 1 94 GLY H 2.890 . 4.080 3.356 2.198 3.577 . 0 0 "[ . 1 . 2 . ]" 1 632 1 93 ILE QG 1 94 GLY H 3.850 . 6.000 4.306 3.159 4.577 . 0 0 "[ . 1 . 2 . ]" 1 633 1 93 ILE MG 1 94 GLY H 3.850 . 6.000 2.197 1.958 3.086 . 0 0 "[ . 1 . 2 . ]" 1 634 1 93 ILE HB 1 94 GLY H 3.020 . 4.340 3.810 3.587 4.325 . 0 0 "[ . 1 . 2 . ]" 1 635 1 95 VAL H 1 125 ASP QB 3.350 . 5.000 4.386 4.140 4.489 . 0 0 "[ . 1 . 2 . ]" 1 636 1 94 GLY QA 1 95 VAL H 2.310 . 2.920 2.324 2.302 2.351 . 0 0 "[ . 1 . 2 . ]" 1 637 1 93 ILE MD 1 95 VAL H 3.680 . 5.660 3.835 3.267 4.235 . 0 0 "[ . 1 . 2 . ]" 1 638 1 95 VAL H 1 95 VAL HB 2.540 . 3.390 2.612 2.526 2.703 . 0 0 "[ . 1 . 2 . ]" 1 639 1 95 VAL H 1 95 VAL MG2 2.630 . 3.560 2.164 2.031 2.283 . 0 0 "[ . 1 . 2 . ]" 1 640 1 95 VAL H 1 95 VAL HA 2.800 . 3.900 2.714 2.676 2.726 . 0 0 "[ . 1 . 2 . ]" 1 641 1 95 VAL H 1 96 GLY H 2.960 . 4.210 2.971 2.934 3.088 . 0 0 "[ . 1 . 2 . ]" 1 642 1 95 VAL HB 1 96 GLY H 2.650 . 3.610 2.841 2.680 2.954 . 0 0 "[ . 1 . 2 . ]" 1 643 1 96 GLY H 1 96 GLY QA 2.250 . 2.790 2.192 2.188 2.199 . 0 0 "[ . 1 . 2 . ]" 1 644 1 96 GLY H 1 97 GLU H 2.840 . 3.980 2.918 2.842 3.024 . 0 0 "[ . 1 . 2 . ]" 1 645 1 95 VAL MG1 1 96 GLY H 3.120 . 4.540 3.507 3.304 3.665 . 0 0 "[ . 1 . 2 . ]" 1 646 1 95 VAL HA 1 96 GLY H 3.190 . 4.670 3.545 3.526 3.565 . 0 0 "[ . 1 . 2 . ]" 1 647 1 94 GLY QA 1 96 GLY H 3.050 . 4.400 3.308 3.231 3.413 . 0 0 "[ . 1 . 2 . ]" 1 648 1 97 GLU H 1 97 GLU HB2 3.360 . 5.020 2.881 2.201 3.646 . 0 0 "[ . 1 . 2 . ]" 1 649 1 97 GLU H 1 98 LEU H 2.830 . 3.970 2.530 2.425 2.631 . 0 0 "[ . 1 . 2 . ]" 1 650 1 97 GLU H 1 97 GLU HB3 3.130 . 4.560 3.074 2.241 3.636 . 0 0 "[ . 1 . 2 . ]" 1 651 1 98 LEU H 1 99 ARG H 3.350 . 5.000 2.716 2.633 2.811 . 0 0 "[ . 1 . 2 . ]" 1 652 1 93 ILE MG 1 98 LEU H 3.850 . 6.000 4.776 4.361 5.032 . 0 0 "[ . 1 . 2 . ]" 1 653 1 98 LEU H 1 98 LEU HB3 2.510 . 3.320 2.136 2.068 2.225 . 0 0 "[ . 1 . 2 . ]" 1 654 1 97 GLU HA 1 98 LEU H 2.710 . 3.730 3.563 3.534 3.578 . 0 0 "[ . 1 . 2 . ]" 1 655 1 98 LEU H 1 98 LEU HG 2.560 . 3.410 3.220 2.984 3.439 0.029 17 0 "[ . 1 . 2 . ]" 1 656 1 98 LEU H 1 98 LEU HB2 2.640 . 3.580 3.438 3.342 3.516 . 0 0 "[ . 1 . 2 . ]" 1 657 1 98 LEU H 1 98 LEU HA 2.730 . 3.760 2.802 2.785 2.833 . 0 0 "[ . 1 . 2 . ]" 1 658 1 93 ILE MD 1 98 LEU H 3.660 . 5.620 3.453 3.237 3.804 . 0 0 "[ . 1 . 2 . ]" 1 659 1 98 LEU H 1 98 LEU MD2 3.690 . 5.680 3.538 3.406 3.768 . 0 0 "[ . 1 . 2 . ]" 1 660 1 95 VAL HA 1 98 LEU H 3.160 . 4.620 3.198 3.097 3.323 . 0 0 "[ . 1 . 2 . ]" 1 661 1 98 LEU MD2 1 99 ARG H 3.850 . 6.000 3.781 3.695 3.871 . 0 0 "[ . 1 . 2 . ]" 1 662 1 99 ARG H 1 100 TYR H 3.030 . 4.360 2.596 2.485 2.776 . 0 0 "[ . 1 . 2 . ]" 1 663 1 98 LEU HB3 1 99 ARG H 3.080 . 4.460 3.538 3.299 3.681 . 0 0 "[ . 1 . 2 . ]" 1 664 1 99 ARG H 1 99 ARG QB 3.180 . 4.660 2.355 2.074 2.617 . 0 0 "[ . 1 . 2 . ]" 1 665 1 99 ARG H 1 99 ARG QG 3.180 . 4.660 3.236 2.039 4.040 . 0 0 "[ . 1 . 2 . ]" 1 666 1 95 VAL MG1 1 99 ARG H 3.850 . 6.000 3.139 2.971 3.419 . 0 0 "[ . 1 . 2 . ]" 1 667 1 99 ARG H 1 101 VAL H 3.060 . 4.420 4.147 4.008 4.299 . 0 0 "[ . 1 . 2 . ]" 1 668 1 99 ARG H 1 99 ARG HA 2.870 . 4.040 2.848 2.817 2.872 . 0 0 "[ . 1 . 2 . ]" 1 669 1 100 TYR H 1 100 TYR QD 3.240 . 4.780 4.193 4.143 4.209 . 0 0 "[ . 1 . 2 . ]" 1 670 1 100 TYR H 1 101 VAL MG2 3.500 . 5.290 4.127 3.976 4.295 . 0 0 "[ . 1 . 2 . ]" 1 671 1 100 TYR H 1 101 VAL H 2.670 . 3.630 2.786 2.689 2.887 . 0 0 "[ . 1 . 2 . ]" 1 672 1 100 TYR H 1 100 TYR QB 3.040 . 4.380 2.241 2.199 2.257 . 0 0 "[ . 1 . 2 . ]" 1 673 1 100 TYR H 1 100 TYR HA 2.980 . 4.250 2.779 2.761 2.803 . 0 0 "[ . 1 . 2 . ]" 1 674 1 99 ARG QB 1 100 TYR H 3.010 . 4.320 2.914 2.292 3.535 . 0 0 "[ . 1 . 2 . ]" 1 675 1 97 GLU HA 1 100 TYR H 3.120 . 4.540 3.447 3.244 3.726 . 0 0 "[ . 1 . 2 . ]" 1 676 1 99 ARG HA 1 100 TYR H 2.710 . 3.720 3.553 3.529 3.579 . 0 0 "[ . 1 . 2 . ]" 1 677 1 101 VAL H 1 101 VAL HB 2.360 . 3.020 2.640 2.555 2.816 . 0 0 "[ . 1 . 2 . ]" 1 678 1 101 VAL H 1 101 VAL MG2 2.580 . 3.460 2.146 2.032 2.305 . 0 0 "[ . 1 . 2 . ]" 1 679 1 101 VAL H 1 101 VAL MG1 3.660 . 5.620 3.782 3.768 3.798 . 0 0 "[ . 1 . 2 . ]" 1 680 1 101 VAL H 1 101 VAL HA 2.630 . 3.560 2.865 2.808 2.894 . 0 0 "[ . 1 . 2 . ]" 1 681 1 100 TYR QB 1 101 VAL H 3.380 . 5.060 2.672 2.493 2.793 . 0 0 "[ . 1 . 2 . ]" 1 682 1 100 TYR HA 1 101 VAL H 3.440 . 5.170 3.537 3.510 3.558 . 0 0 "[ . 1 . 2 . ]" 1 683 1 101 VAL HB 1 102 LEU H 2.390 . 3.080 2.403 2.223 2.646 . 0 0 "[ . 1 . 2 . ]" 1 684 1 102 LEU H 1 102 LEU HB2 2.400 . 3.100 2.136 2.100 2.194 . 0 0 "[ . 1 . 2 . ]" 1 685 1 102 LEU H 1 102 LEU HB3 2.660 . 3.620 3.455 3.422 3.500 . 0 0 "[ . 1 . 2 . ]" 1 686 1 102 LEU H 1 102 LEU MD1 3.060 . 4.420 3.450 3.215 3.699 . 0 0 "[ . 1 . 2 . ]" 1 687 1 101 VAL MG1 1 102 LEU H 3.420 . 5.140 3.511 3.272 3.728 . 0 0 "[ . 1 . 2 . ]" 1 688 1 101 VAL MG2 1 102 LEU H 3.650 . 5.600 3.644 3.419 3.776 . 0 0 "[ . 1 . 2 . ]" 1 689 1 102 LEU H 1 102 LEU HA 2.880 . 4.060 2.818 2.773 2.873 . 0 0 "[ . 1 . 2 . ]" 1 690 1 102 LEU MD1 1 103 THR H 3.850 . 6.000 4.612 4.369 4.840 . 0 0 "[ . 1 . 2 . ]" 1 691 1 102 LEU HA 1 103 THR H 3.230 . 4.760 3.555 3.499 3.586 . 0 0 "[ . 1 . 2 . ]" 1 692 1 102 LEU HB3 1 103 THR H 3.270 . 4.840 3.237 3.014 3.572 . 0 0 "[ . 1 . 2 . ]" 1 693 1 102 LEU H 1 103 THR H 2.820 . 3.940 2.739 2.608 2.903 . 0 0 "[ . 1 . 2 . ]" 1 694 1 103 THR H 1 103 THR MG 3.270 . 4.830 3.466 2.405 3.770 . 0 0 "[ . 1 . 2 . ]" 1 695 1 102 LEU HB2 1 103 THR H 2.910 . 4.120 2.911 2.661 3.179 . 0 0 "[ . 1 . 2 . ]" 1 696 1 103 THR H 1 104 SER H 2.850 . 4.000 2.705 2.622 2.832 . 0 0 "[ . 1 . 2 . ]" 1 697 1 99 ARG HA 1 103 THR H 3.730 . 5.760 3.489 2.920 4.079 . 0 0 "[ . 1 . 2 . ]" 1 698 1 103 THR H 1 103 THR HA 2.690 . 3.680 2.808 2.769 2.835 . 0 0 "[ . 1 . 2 . ]" 1 699 1 104 SER H 1 105 LEU H 2.750 . 3.810 2.614 2.517 2.730 . 0 0 "[ . 1 . 2 . ]" 1 700 1 104 SER H 1 104 SER HA 2.930 . 4.160 2.843 2.799 2.872 . 0 0 "[ . 1 . 2 . ]" 1 701 1 103 THR HA 1 104 SER H 2.690 . 3.680 3.529 3.506 3.552 . 0 0 "[ . 1 . 2 . ]" 1 702 1 104 SER H 1 104 SER QB 3.440 . 5.170 2.377 2.255 2.572 . 0 0 "[ . 1 . 2 . ]" 1 703 1 104 SER H 1 105 LEU HG 3.660 . 5.620 5.485 4.951 5.662 0.042 9 0 "[ . 1 . 2 . ]" 1 704 1 103 THR MG 1 104 SER H 3.840 . 5.980 3.706 3.349 4.134 . 0 0 "[ . 1 . 2 . ]" 1 705 1 102 LEU HA 1 105 LEU H 2.950 . 4.200 3.477 3.334 3.656 . 0 0 "[ . 1 . 2 . ]" 1 706 1 103 THR H 1 105 LEU H 3.160 . 4.620 4.067 3.918 4.247 . 0 0 "[ . 1 . 2 . ]" 1 707 1 102 LEU MD2 1 105 LEU H 3.850 . 6.000 4.750 4.446 4.978 . 0 0 "[ . 1 . 2 . ]" 1 708 1 105 LEU H 1 105 LEU HB2 2.320 . 2.940 2.094 2.057 2.235 . 0 0 "[ . 1 . 2 . ]" 1 709 1 105 LEU H 1 105 LEU HG 2.830 . 3.960 3.436 2.848 3.678 . 0 0 "[ . 1 . 2 . ]" 1 710 1 105 LEU H 1 105 LEU HA 2.850 . 4.000 2.837 2.819 2.871 . 0 0 "[ . 1 . 2 . ]" 1 711 1 104 SER QB 1 105 LEU H 3.360 . 5.020 3.222 2.969 3.798 . 0 0 "[ . 1 . 2 . ]" 1 712 1 105 LEU H 1 106 GLY H 2.690 . 3.690 2.868 2.624 3.212 . 0 0 "[ . 1 . 2 . ]" 1 713 1 105 LEU H 1 105 LEU MD2 3.380 . 5.050 4.179 3.930 4.235 . 0 0 "[ . 1 . 2 . ]" 1 714 1 105 LEU H 1 105 LEU HB3 2.670 . 3.630 3.338 3.220 3.521 . 0 0 "[ . 1 . 2 . ]" 1 715 1 105 LEU H 1 108 LYS H 2.980 . 4.260 4.293 4.257 4.313 0.053 25 0 "[ . 1 . 2 . ]" 1 716 1 105 LEU H 1 105 LEU MD1 3.380 . 5.050 3.828 3.471 4.005 . 0 0 "[ . 1 . 2 . ]" 1 717 1 102 LEU MD2 1 106 GLY H 3.850 . 6.000 4.868 4.322 5.013 . 0 0 "[ . 1 . 2 . ]" 1 718 1 105 LEU HA 1 106 GLY H 3.040 . 4.380 3.576 3.558 3.583 . 0 0 "[ . 1 . 2 . ]" 1 719 1 106 GLY H 1 106 GLY QA 2.460 . 3.230 2.487 2.407 2.504 . 0 0 "[ . 1 . 2 . ]" 1 720 1 106 GLY H 1 108 LYS H 2.870 . 4.040 2.905 2.680 3.258 . 0 0 "[ . 1 . 2 . ]" 1 721 1 105 LEU HB2 1 106 GLY H 3.050 . 4.400 2.706 2.195 3.005 . 0 0 "[ . 1 . 2 . ]" 1 722 1 105 LEU HB3 1 106 GLY H 3.230 . 4.750 2.465 2.250 2.711 . 0 0 "[ . 1 . 2 . ]" 1 723 1 105 LEU MD1 1 106 GLY H 3.850 . 6.000 4.251 3.856 4.527 . 0 0 "[ . 1 . 2 . ]" 1 724 1 106 GLY H 1 107 GLU H 2.750 . 3.790 2.496 2.239 2.784 . 0 0 "[ . 1 . 2 . ]" 1 725 1 104 SER HA 1 107 GLU H 3.170 . 4.630 4.475 4.146 4.640 0.010 8 0 "[ . 1 . 2 . ]" 1 726 1 105 LEU HB3 1 107 GLU H 3.300 . 4.900 4.934 4.918 4.958 0.058 23 0 "[ . 1 . 2 . ]" 1 727 1 106 GLY QA 1 107 GLU H 2.730 . 3.750 2.616 2.535 2.697 . 0 0 "[ . 1 . 2 . ]" 1 728 1 107 GLU H 1 107 GLU HB2 2.760 . 3.820 3.355 3.229 3.663 . 0 0 "[ . 1 . 2 . ]" 1 729 1 107 GLU H 1 107 GLU HB3 2.950 . 4.200 4.086 4.034 4.111 . 0 0 "[ . 1 . 2 . ]" 1 730 1 107 GLU H 1 107 GLU HA 2.790 . 3.890 2.270 2.262 2.275 . 0 0 "[ . 1 . 2 . ]" 1 731 1 107 GLU H 1 107 GLU QG 3.400 . 5.090 3.191 2.556 3.796 . 0 0 "[ . 1 . 2 . ]" 1 732 1 107 GLU H 1 108 LYS H 3.020 . 4.340 2.743 2.635 2.878 . 0 0 "[ . 1 . 2 . ]" 1 733 1 108 LYS H 1 108 LYS HA 2.840 . 3.980 2.843 2.837 2.847 . 0 0 "[ . 1 . 2 . ]" 1 734 1 108 LYS H 1 109 LEU H 2.910 . 4.120 4.153 4.142 4.170 0.050 8 0 "[ . 1 . 2 . ]" 1 735 1 108 LYS H 1 108 LYS QB 3.150 . 4.600 2.300 2.054 2.504 . 0 0 "[ . 1 . 2 . ]" 1 736 1 108 LYS H 1 108 LYS QG 3.600 . 5.500 3.063 2.080 4.062 . 0 0 "[ . 1 . 2 . ]" 1 737 1 108 LYS HA 1 109 LEU H 2.480 . 3.270 3.169 3.155 3.194 . 0 0 "[ . 1 . 2 . ]" 1 738 1 108 LYS QB 1 109 LEU H 3.290 . 4.870 1.821 1.693 1.920 0.007 8 0 "[ . 1 . 2 . ]" 1 739 1 109 LEU H 1 109 LEU MD1 3.000 . 4.300 3.466 2.929 3.681 . 0 0 "[ . 1 . 2 . ]" 1 740 1 109 LEU H 1 110 SER H 2.830 . 3.950 3.958 3.912 3.997 0.047 16 0 "[ . 1 . 2 . ]" 1 741 1 110 SER H 1 110 SER HA 2.710 . 3.730 2.824 2.800 2.897 . 0 0 "[ . 1 . 2 . ]" 1 742 1 110 SER H 1 110 SER HB3 2.710 . 3.730 2.523 2.387 3.458 . 0 0 "[ . 1 . 2 . ]" 1 743 1 109 LEU HA 1 110 SER H 2.650 . 3.600 2.343 2.275 2.378 . 0 0 "[ . 1 . 2 . ]" 1 744 1 107 GLU HA 1 110 SER H 3.350 . 5.000 5.070 5.033 5.098 0.098 6 0 "[ . 1 . 2 . ]" 1 745 1 109 LEU QB 1 110 SER H 3.350 . 5.000 3.841 3.817 4.039 . 0 0 "[ . 1 . 2 . ]" 1 746 1 110 SER H 1 110 SER HB2 2.730 . 3.750 3.573 3.249 3.600 . 0 0 "[ . 1 . 2 . ]" 1 747 1 110 SER H 1 113 GLU QB 3.290 . 4.880 3.289 2.731 3.999 . 0 0 "[ . 1 . 2 . ]" 1 748 1 109 LEU MD2 1 110 SER H 3.720 . 5.740 4.230 3.017 4.612 . 0 0 "[ . 1 . 2 . ]" 1 749 1 111 ASN H 1 111 ASN QB 3.410 . 5.120 2.390 2.232 2.535 . 0 0 "[ . 1 . 2 . ]" 1 750 1 111 ASN H 1 112 GLU H 3.020 . 4.330 2.880 2.826 2.934 . 0 0 "[ . 1 . 2 . ]" 1 751 1 110 SER HA 1 111 ASN H 2.750 . 3.790 2.674 2.572 2.770 . 0 0 "[ . 1 . 2 . ]" 1 752 1 110 SER HB2 1 111 ASN H 2.950 . 4.200 2.006 1.874 2.130 . 0 0 "[ . 1 . 2 . ]" 1 753 1 110 SER HB3 1 111 ASN H 2.710 . 3.720 3.511 2.691 3.630 . 0 0 "[ . 1 . 2 . ]" 1 754 1 112 GLU H 1 112 GLU QB 3.210 . 4.710 2.210 2.153 2.253 . 0 0 "[ . 1 . 2 . ]" 1 755 1 112 GLU H 1 113 GLU H 2.860 . 4.020 2.831 2.689 3.005 . 0 0 "[ . 1 . 2 . ]" 1 756 1 112 GLU H 1 115 ASP H 3.120 . 4.540 4.489 4.415 4.541 0.001 8 0 "[ . 1 . 2 . ]" 1 757 1 111 ASN HA 1 112 GLU H 3.280 . 4.860 3.536 3.510 3.560 . 0 0 "[ . 1 . 2 . ]" 1 758 1 112 GLU H 1 112 GLU QG 3.560 . 5.420 3.980 3.894 4.058 . 0 0 "[ . 1 . 2 . ]" 1 759 1 110 SER HB2 1 112 GLU H 2.860 . 4.020 3.437 2.576 3.746 . 0 0 "[ . 1 . 2 . ]" 1 760 1 112 GLU H 1 112 GLU HA 2.830 . 3.950 2.810 2.784 2.839 . 0 0 "[ . 1 . 2 . ]" 1 761 1 112 GLU H 1 114 MET H 3.650 . 5.600 4.330 4.061 4.543 . 0 0 "[ . 1 . 2 . ]" 1 762 1 111 ASN QB 1 112 GLU H 3.500 . 5.300 3.083 2.569 3.598 . 0 0 "[ . 1 . 2 . ]" 1 763 1 110 SER HB2 1 113 GLU H 3.400 . 5.090 4.938 4.454 5.122 0.032 6 0 "[ . 1 . 2 . ]" 1 764 1 112 GLU QB 1 113 GLU H 2.850 . 4.000 2.295 2.034 2.400 . 0 0 "[ . 1 . 2 . ]" 1 765 1 113 GLU H 1 114 MET H 2.660 . 3.620 2.841 2.718 2.922 . 0 0 "[ . 1 . 2 . ]" 1 766 1 113 GLU H 1 113 GLU QB 3.200 . 4.700 2.274 2.069 2.564 . 0 0 "[ . 1 . 2 . ]" 1 767 1 109 LEU HA 1 113 GLU H 3.020 . 4.330 4.291 4.166 4.382 0.052 9 0 "[ . 1 . 2 . ]" 1 768 1 113 GLU H 1 113 GLU HA 2.830 . 3.960 2.790 2.773 2.808 . 0 0 "[ . 1 . 2 . ]" 1 769 1 111 ASN HA 1 114 MET H 3.310 . 4.920 3.773 3.627 3.926 . 0 0 "[ . 1 . 2 . ]" 1 770 1 109 LEU QB 1 114 MET H 3.710 . 5.710 3.860 3.522 5.128 . 0 0 "[ . 1 . 2 . ]" 1 771 1 114 MET H 1 115 ASP H 2.730 . 3.750 2.618 2.569 2.657 . 0 0 "[ . 1 . 2 . ]" 1 772 1 114 MET H 1 114 MET HA 2.700 . 3.700 2.834 2.826 2.840 . 0 0 "[ . 1 . 2 . ]" 1 773 1 114 MET H 1 114 MET QB 3.120 . 4.540 2.527 2.349 2.673 . 0 0 "[ . 1 . 2 . ]" 1 774 1 114 MET H 1 114 MET QG 2.570 . 3.440 2.204 1.875 2.522 . 0 0 "[ . 1 . 2 . ]" 1 775 1 113 GLU QB 1 114 MET H 3.320 . 4.940 2.390 2.226 2.677 . 0 0 "[ . 1 . 2 . ]" 1 776 1 115 ASP H 1 117 LEU H 3.480 . 5.260 4.091 4.038 4.128 . 0 0 "[ . 1 . 2 . ]" 1 777 1 114 MET QB 1 115 ASP H 3.450 . 5.200 3.536 2.718 3.673 . 0 0 "[ . 1 . 2 . ]" 1 778 1 112 GLU HA 1 115 ASP H 3.080 . 4.460 3.475 3.421 3.602 . 0 0 "[ . 1 . 2 . ]" 1 779 1 115 ASP H 1 115 ASP HB2 2.670 . 3.640 2.111 2.089 2.151 . 0 0 "[ . 1 . 2 . ]" 1 780 1 115 ASP H 1 115 ASP HA 2.690 . 3.680 2.804 2.793 2.809 . 0 0 "[ . 1 . 2 . ]" 1 781 1 115 ASP H 1 115 ASP HB3 2.660 . 3.620 3.370 3.304 3.459 . 0 0 "[ . 1 . 2 . ]" 1 782 1 115 ASP H 1 116 GLU H 2.880 . 4.060 2.757 2.727 2.816 . 0 0 "[ . 1 . 2 . ]" 1 783 1 114 MET QG 1 115 ASP H 2.960 . 4.210 2.492 2.127 3.830 . 0 0 "[ . 1 . 2 . ]" 1 784 1 115 ASP H 1 116 GLU QG 3.850 . 6.000 4.647 4.211 5.353 . 0 0 "[ . 1 . 2 . ]" 1 785 1 112 GLU QB 1 115 ASP H 3.500 . 5.300 4.787 4.768 4.842 . 0 0 "[ . 1 . 2 . ]" 1 786 1 115 ASP H 1 118 LEU MD1 3.850 . 6.000 4.526 4.173 4.755 . 0 0 "[ . 1 . 2 . ]" 1 787 1 115 ASP HB2 1 116 GLU H 2.960 . 4.210 2.979 2.803 3.124 . 0 0 "[ . 1 . 2 . ]" 1 788 1 115 ASP HB3 1 116 GLU H 2.940 . 4.180 2.880 2.800 3.013 . 0 0 "[ . 1 . 2 . ]" 1 789 1 116 GLU H 1 117 LEU H 2.770 . 3.850 2.627 2.563 2.679 . 0 0 "[ . 1 . 2 . ]" 1 790 1 116 GLU H 1 116 GLU HA 2.830 . 3.950 2.837 2.818 2.857 . 0 0 "[ . 1 . 2 . ]" 1 791 1 116 GLU H 1 116 GLU QG 3.290 . 4.870 2.470 2.035 3.274 . 0 0 "[ . 1 . 2 . ]" 1 792 1 116 GLU H 1 116 GLU QB 2.980 . 4.250 2.382 2.077 2.550 . 0 0 "[ . 1 . 2 . ]" 1 793 1 115 ASP HA 1 116 GLU H 3.290 . 4.870 3.556 3.547 3.563 . 0 0 "[ . 1 . 2 . ]" 1 794 1 116 GLU H 1 117 LEU HB3 3.450 . 5.200 4.492 4.429 4.547 . 0 0 "[ . 1 . 2 . ]" 1 795 1 117 LEU H 1 117 LEU HB2 2.670 . 3.630 3.392 3.366 3.409 . 0 0 "[ . 1 . 2 . ]" 1 796 1 116 GLU QB 1 117 LEU H 3.000 . 4.300 2.585 2.454 3.184 . 0 0 "[ . 1 . 2 . ]" 1 797 1 117 LEU H 1 117 LEU MD2 3.480 . 5.260 3.655 3.602 3.775 . 0 0 "[ . 1 . 2 . ]" 1 798 1 116 GLU HA 1 117 LEU H 2.980 . 4.250 3.552 3.533 3.561 . 0 0 "[ . 1 . 2 . ]" 1 799 1 117 LEU H 1 117 LEU HB3 2.550 . 3.400 2.097 2.086 2.109 . 0 0 "[ . 1 . 2 . ]" 1 800 1 116 GLU QG 1 117 LEU H 3.830 . 5.960 4.034 2.335 4.393 . 0 0 "[ . 1 . 2 . ]" 1 801 1 117 LEU H 1 117 LEU HG 2.770 . 3.850 3.350 3.297 3.417 . 0 0 "[ . 1 . 2 . ]" 1 802 1 117 LEU H 1 117 LEU HA 2.710 . 3.710 2.811 2.801 2.825 . 0 0 "[ . 1 . 2 . ]" 1 803 1 117 LEU H 1 118 LEU H 2.740 . 3.780 2.704 2.672 2.729 . 0 0 "[ . 1 . 2 . ]" 1 804 1 118 LEU H 1 118 LEU HB3 2.700 . 3.700 3.426 3.387 3.518 . 0 0 "[ . 1 . 2 . ]" 1 805 1 118 LEU H 1 118 LEU HB2 2.540 . 3.390 2.128 2.098 2.229 . 0 0 "[ . 1 . 2 . ]" 1 806 1 118 LEU H 1 118 LEU MD1 3.580 . 5.460 3.482 3.362 3.615 . 0 0 "[ . 1 . 2 . ]" 1 807 1 118 LEU H 1 119 LYS H 3.080 . 4.460 2.567 2.517 2.660 . 0 0 "[ . 1 . 2 . ]" 1 808 1 117 LEU HA 1 118 LEU H 2.810 . 3.920 3.543 3.532 3.551 . 0 0 "[ . 1 . 2 . ]" 1 809 1 118 LEU H 1 118 LEU HA 2.810 . 3.920 2.840 2.813 2.858 . 0 0 "[ . 1 . 2 . ]" 1 810 1 115 ASP HA 1 118 LEU H 3.180 . 4.660 3.669 3.528 3.853 . 0 0 "[ . 1 . 2 . ]" 1 811 1 118 LEU H 1 118 LEU MD2 3.710 . 5.710 4.249 4.096 4.307 . 0 0 "[ . 1 . 2 . ]" 1 812 1 118 LEU MD1 1 119 LYS H 3.850 . 6.000 4.773 4.706 4.847 . 0 0 "[ . 1 . 2 . ]" 1 813 1 119 LYS H 1 119 LYS QB 3.250 . 4.800 2.172 2.061 2.400 . 0 0 "[ . 1 . 2 . ]" 1 814 1 118 LEU HA 1 119 LYS H 3.090 . 4.480 3.512 3.490 3.535 . 0 0 "[ . 1 . 2 . ]" 1 815 1 117 LEU HA 1 119 LYS H 3.010 . 4.320 4.280 4.212 4.338 0.018 8 0 "[ . 1 . 2 . ]" 1 816 1 119 LYS H 1 119 LYS QG 3.850 . 6.000 3.559 2.466 4.051 . 0 0 "[ . 1 . 2 . ]" 1 817 1 119 LYS H 1 120 GLY H 3.410 . 5.120 2.678 2.647 2.716 . 0 0 "[ . 1 . 2 . ]" 1 818 1 118 LEU HG 1 119 LYS H 3.330 . 4.950 4.966 4.872 4.985 0.035 3 0 "[ . 1 . 2 . ]" 1 819 1 120 GLY H 1 121 VAL MG2 3.850 . 6.000 4.128 4.018 4.311 . 0 0 "[ . 1 . 2 . ]" 1 820 1 120 GLY H 1 121 VAL H 2.970 . 4.240 2.651 2.552 2.726 . 0 0 "[ . 1 . 2 . ]" 1 821 1 119 LYS QB 1 120 GLY H 3.850 . 6.000 2.649 2.516 2.783 . 0 0 "[ . 1 . 2 . ]" 1 822 1 119 LYS HA 1 120 GLY H 3.020 . 4.340 3.548 3.534 3.565 . 0 0 "[ . 1 . 2 . ]" 1 823 1 118 LEU MD2 1 121 VAL H 3.850 . 6.000 5.007 4.957 5.021 . 0 0 "[ . 1 . 2 . ]" 1 824 1 120 GLY QA 1 121 VAL H 2.750 . 3.790 2.684 2.641 2.751 . 0 0 "[ . 1 . 2 . ]" 1 825 1 118 LEU HA 1 121 VAL H 2.650 . 3.590 3.443 3.367 3.571 . 0 0 "[ . 1 . 2 . ]" 1 826 1 121 VAL H 1 121 VAL HA 2.810 . 3.920 2.893 2.868 2.914 . 0 0 "[ . 1 . 2 . ]" 1 827 1 121 VAL H 1 121 VAL MG2 2.610 . 3.530 2.231 2.117 2.425 . 0 0 "[ . 1 . 2 . ]" 1 828 1 121 VAL H 1 121 VAL HB 2.420 . 3.150 2.607 2.488 2.701 . 0 0 "[ . 1 . 2 . ]" 1 829 1 119 LYS QB 1 121 VAL H 3.850 . 6.000 4.871 4.748 4.963 . 0 0 "[ . 1 . 2 . ]" 1 830 1 121 VAL MG2 1 123 VAL H 3.850 . 6.000 4.983 4.878 5.026 . 0 0 "[ . 1 . 2 . ]" 1 831 1 122 PRO QB 1 123 VAL H 3.550 . 5.400 3.996 3.955 4.015 . 0 0 "[ . 1 . 2 . ]" 1 832 1 123 VAL H 1 123 VAL MG1 3.630 . 5.560 2.970 2.325 3.209 . 0 0 "[ . 1 . 2 . ]" 1 833 1 122 PRO HA 1 123 VAL H 2.620 . 3.540 2.614 2.568 2.671 . 0 0 "[ . 1 . 2 . ]" 1 834 1 123 VAL H 1 123 VAL HA 2.830 . 3.950 2.942 2.938 2.944 . 0 0 "[ . 1 . 2 . ]" 1 835 1 123 VAL H 1 123 VAL HB 2.740 . 3.780 3.686 2.936 3.825 0.045 19 0 "[ . 1 . 2 . ]" 1 836 1 123 VAL H 1 124 LYS H 3.710 . 5.720 4.429 4.398 4.471 . 0 0 "[ . 1 . 2 . ]" 1 837 1 123 VAL H 1 123 VAL MG2 3.630 . 5.560 2.405 2.066 3.959 . 0 0 "[ . 1 . 2 . ]" 1 838 1 124 LYS H 1 124 LYS QG 3.700 . 5.700 3.598 2.990 4.204 . 0 0 "[ . 1 . 2 . ]" 1 839 1 124 LYS H 1 124 LYS QD 3.330 . 4.950 3.926 2.247 4.433 . 0 0 "[ . 1 . 2 . ]" 1 840 1 124 LYS H 1 127 MET QG 3.850 . 6.000 4.938 4.387 5.370 . 0 0 "[ . 1 . 2 . ]" 1 841 1 124 LYS H 1 127 MET H 3.020 . 4.330 3.920 3.522 4.409 0.079 6 0 "[ . 1 . 2 . ]" 1 842 1 123 VAL HA 1 124 LYS H 2.350 . 3.000 2.578 2.468 2.662 . 0 0 "[ . 1 . 2 . ]" 1 843 1 123 VAL MG2 1 124 LYS H 2.830 . 3.950 2.983 1.917 3.305 . 0 0 "[ . 1 . 2 . ]" 1 844 1 124 LYS H 1 124 LYS QB 3.340 . 4.980 2.480 2.376 2.640 . 0 0 "[ . 1 . 2 . ]" 1 845 1 124 LYS H 1 124 LYS HA 2.980 . 4.250 2.948 2.944 2.952 . 0 0 "[ . 1 . 2 . ]" 1 846 1 123 VAL MG1 1 124 LYS H 3.150 . 4.590 3.403 2.795 3.529 . 0 0 "[ . 1 . 2 . ]" 1 847 1 124 LYS HA 1 125 ASP H 3.070 . 4.440 2.396 2.138 3.084 . 0 0 "[ . 1 . 2 . ]" 1 848 1 126 GLY H 1 127 MET H 2.800 . 3.900 2.514 2.043 3.001 . 0 0 "[ . 1 . 2 . ]" 1 849 1 125 ASP HA 1 126 GLY H 2.930 . 4.160 3.317 3.012 3.573 . 0 0 "[ . 1 . 2 . ]" 1 850 1 126 GLY H 1 126 GLY QA 2.510 . 3.320 2.257 2.184 2.413 . 0 0 "[ . 1 . 2 . ]" 1 851 1 124 LYS HA 1 126 GLY H 3.080 . 4.460 3.851 3.330 4.539 0.079 25 0 "[ . 1 . 2 . ]" 1 852 1 123 VAL MG2 1 126 GLY H 2.900 . 4.100 2.444 1.964 3.086 . 0 0 "[ . 1 . 2 . ]" 1 853 1 127 MET H 1 127 MET QG 2.830 . 3.960 3.473 3.252 3.562 . 0 0 "[ . 1 . 2 . ]" 1 854 1 127 MET H 1 127 MET HB2 2.580 . 3.470 3.449 3.402 3.538 0.068 6 0 "[ . 1 . 2 . ]" 1 855 1 127 MET H 1 127 MET HA 2.750 . 3.790 2.935 2.929 2.940 . 0 0 "[ . 1 . 2 . ]" 1 856 1 123 VAL MG1 1 127 MET H 3.340 . 4.980 3.273 2.236 3.955 . 0 0 "[ . 1 . 2 . ]" 1 857 1 126 GLY QA 1 127 MET H 3.140 . 4.580 2.646 2.500 2.785 . 0 0 "[ . 1 . 2 . ]" 1 858 1 123 VAL MG2 1 127 MET H 2.810 . 3.930 2.217 1.918 2.538 . 0 0 "[ . 1 . 2 . ]" 1 859 1 127 MET H 1 127 MET HB3 2.600 . 3.500 2.300 2.284 2.361 . 0 0 "[ . 1 . 2 . ]" 1 860 1 123 VAL HA 1 127 MET H 3.450 . 5.200 5.126 4.894 5.221 0.021 14 0 "[ . 1 . 2 . ]" 1 861 1 93 ILE MG 1 128 VAL H 3.310 . 4.910 2.437 2.097 2.743 . 0 0 "[ . 1 . 2 . ]" 1 862 1 128 VAL H 1 128 VAL MG2 2.820 . 3.940 2.874 2.834 2.921 . 0 0 "[ . 1 . 2 . ]" 1 863 1 128 VAL H 1 128 VAL MG1 3.320 . 4.940 3.949 3.934 3.956 . 0 0 "[ . 1 . 2 . ]" 1 864 1 128 VAL H 1 128 VAL HA 2.790 . 3.870 2.926 2.923 2.930 . 0 0 "[ . 1 . 2 . ]" 1 865 1 128 VAL H 1 129 ASN H 2.650 . 3.590 2.164 2.031 2.297 . 0 0 "[ . 1 . 2 . ]" 1 866 1 127 MET HA 1 128 VAL H 2.320 . 2.940 2.096 2.080 2.109 . 0 0 "[ . 1 . 2 . ]" 1 867 1 128 VAL H 1 128 VAL HB 2.510 . 3.320 2.869 2.841 2.882 . 0 0 "[ . 1 . 2 . ]" 1 868 1 93 ILE HB 1 128 VAL H 2.830 . 3.970 3.797 3.535 3.990 0.020 2 0 "[ . 1 . 2 . ]" 1 869 1 127 MET HB3 1 128 VAL H 3.130 . 4.560 4.546 4.514 4.573 0.013 14 0 "[ . 1 . 2 . ]" 1 870 1 127 MET QG 1 128 VAL H 3.230 . 4.750 3.358 3.116 4.053 . 0 0 "[ . 1 . 2 . ]" 1 871 1 129 ASN H 1 129 ASN HA 2.810 . 3.930 2.271 2.263 2.279 . 0 0 "[ . 1 . 2 . ]" 1 872 1 127 MET HB2 1 129 ASN H 3.060 . 4.420 4.423 4.216 4.511 0.091 14 0 "[ . 1 . 2 . ]" 1 873 1 128 VAL HB 1 129 ASN H 2.940 . 4.180 4.031 3.943 4.135 . 0 0 "[ . 1 . 2 . ]" 1 874 1 128 VAL MG1 1 129 ASN H 3.310 . 4.920 4.167 4.145 4.183 . 0 0 "[ . 1 . 2 . ]" 1 875 1 93 ILE HB 1 129 ASN H 2.810 . 3.910 3.868 3.599 3.982 0.072 24 0 "[ . 1 . 2 . ]" 1 876 1 128 VAL HA 1 129 ASN H 2.560 . 3.420 3.008 2.917 3.081 . 0 0 "[ . 1 . 2 . ]" 1 877 1 129 ASN H 1 129 ASN HB3 2.690 . 3.690 3.698 3.577 3.776 0.086 6 0 "[ . 1 . 2 . ]" 1 878 1 129 ASN H 1 129 ASN HB2 2.500 . 3.310 3.055 3.018 3.114 . 0 0 "[ . 1 . 2 . ]" 1 879 1 93 ILE MG 1 129 ASN H 3.850 . 6.000 3.646 3.174 4.022 . 0 0 "[ . 1 . 2 . ]" 1 880 1 129 ASN HA 1 130 TYR H 2.730 . 3.770 3.045 2.986 3.111 . 0 0 "[ . 1 . 2 . ]" 1 881 1 127 MET HA 1 130 TYR H 3.290 . 4.880 4.622 4.452 4.854 . 0 0 "[ . 1 . 2 . ]" 1 882 1 130 TYR H 1 130 TYR QD 3.520 . 5.330 3.698 3.417 4.191 . 0 0 "[ . 1 . 2 . ]" 1 883 1 129 ASN HB2 1 130 TYR H 3.670 . 5.630 4.516 4.446 4.584 . 0 0 "[ . 1 . 2 . ]" 1 884 1 131 HIS H 1 133 PHE H 3.100 . 4.500 3.504 3.135 3.949 . 0 0 "[ . 1 . 2 . ]" 1 885 1 131 HIS H 1 131 HIS HA 2.940 . 4.170 2.739 2.261 2.950 . 0 0 "[ . 1 . 2 . ]" 1 886 1 130 TYR HA 1 131 HIS H 2.520 . 3.330 2.777 2.665 2.920 . 0 0 "[ . 1 . 2 . ]" 1 887 1 131 HIS H 1 131 HIS QB 3.310 . 4.920 2.691 2.337 3.475 . 0 0 "[ . 1 . 2 . ]" 1 888 1 132 ASP H 1 132 ASP QB 3.250 . 4.790 2.236 2.106 2.434 . 0 0 "[ . 1 . 2 . ]" 1 889 1 131 HIS QB 1 132 ASP H 3.160 . 4.620 2.470 2.187 3.485 . 0 0 "[ . 1 . 2 . ]" 1 890 1 132 ASP H 1 133 PHE H 2.620 . 3.540 2.777 2.596 2.876 . 0 0 "[ . 1 . 2 . ]" 1 891 1 132 ASP H 1 132 ASP HA 2.830 . 3.970 2.788 2.764 2.842 . 0 0 "[ . 1 . 2 . ]" 1 892 1 129 ASN HB3 1 132 ASP H 3.250 . 4.800 4.816 4.518 4.931 0.131 3 0 "[ . 1 . 2 . ]" 1 893 1 133 PHE H 1 133 PHE HZ 3.640 . 5.580 5.127 4.968 5.361 . 0 0 "[ . 1 . 2 . ]" 1 894 1 132 ASP QB 1 133 PHE H 3.700 . 5.700 2.677 2.494 2.819 . 0 0 "[ . 1 . 2 . ]" 1 895 1 133 PHE H 1 133 PHE QB 3.330 . 4.950 2.746 2.628 2.831 . 0 0 "[ . 1 . 2 . ]" 1 896 1 133 PHE H 1 133 PHE QD 3.620 . 5.540 2.809 2.636 2.952 . 0 0 "[ . 1 . 2 . ]" 1 897 1 133 PHE H 1 133 PHE HA 2.920 . 4.140 2.840 2.833 2.847 . 0 0 "[ . 1 . 2 . ]" 1 898 1 128 VAL MG1 1 133 PHE H 3.850 . 6.000 3.730 3.352 4.287 . 0 0 "[ . 1 . 2 . ]" 1 899 1 132 ASP HA 1 133 PHE H 3.410 . 5.120 3.536 3.515 3.559 . 0 0 "[ . 1 . 2 . ]" 1 900 1 131 HIS HA 1 134 VAL H 3.060 . 4.410 3.781 3.568 3.900 . 0 0 "[ . 1 . 2 . ]" 1 901 1 134 VAL H 1 135 GLN QB 3.350 . 5.000 4.417 4.377 4.449 . 0 0 "[ . 1 . 2 . ]" 1 902 1 134 VAL H 1 134 VAL HB 2.340 . 2.980 2.705 2.660 2.782 . 0 0 "[ . 1 . 2 . ]" 1 903 1 134 VAL H 1 134 VAL MG2 2.690 . 3.680 2.054 1.942 2.157 . 0 0 "[ . 1 . 2 . ]" 1 904 1 133 PHE H 1 134 VAL H 2.650 . 3.610 2.734 2.627 2.812 . 0 0 "[ . 1 . 2 . ]" 1 905 1 134 VAL H 1 134 VAL HA 2.630 . 3.570 2.815 2.801 2.821 . 0 0 "[ . 1 . 2 . ]" 1 906 1 133 PHE QB 1 134 VAL H 3.410 . 5.120 2.252 2.155 2.395 . 0 0 "[ . 1 . 2 . ]" 1 907 1 134 VAL H 1 134 VAL MG1 3.460 . 5.210 3.767 3.750 3.774 . 0 0 "[ . 1 . 2 . ]" 1 908 1 133 PHE HA 1 134 VAL H 3.290 . 4.880 3.567 3.548 3.577 . 0 0 "[ . 1 . 2 . ]" 1 909 1 133 PHE QD 1 134 VAL H 3.020 . 4.340 3.445 3.217 3.876 . 0 0 "[ . 1 . 2 . ]" 1 910 1 134 VAL H 1 135 GLN H 2.790 . 3.870 2.667 2.643 2.705 . 0 0 "[ . 1 . 2 . ]" 1 911 1 132 ASP HA 1 135 GLN H 3.250 . 4.790 3.627 3.539 3.727 . 0 0 "[ . 1 . 2 . ]" 1 912 1 135 GLN H 1 135 GLN QB 2.910 . 4.120 2.248 2.235 2.262 . 0 0 "[ . 1 . 2 . ]" 1 913 1 133 PHE H 1 135 GLN H 2.730 . 3.770 3.817 3.782 3.861 0.091 4 0 "[ . 1 . 2 . ]" 1 914 1 135 GLN H 1 135 GLN QG 3.230 . 4.760 3.995 3.965 4.045 . 0 0 "[ . 1 . 2 . ]" 1 915 1 134 VAL HA 1 135 GLN H 3.120 . 4.540 3.516 3.490 3.532 . 0 0 "[ . 1 . 2 . ]" 1 916 1 135 GLN H 1 135 GLN HA 2.820 . 3.940 2.814 2.796 2.855 . 0 0 "[ . 1 . 2 . ]" 1 917 1 134 VAL MG1 1 135 GLN H 3.740 . 5.780 3.831 3.742 3.967 . 0 0 "[ . 1 . 2 . ]" 1 918 1 134 VAL HB 1 135 GLN H 2.590 . 3.480 2.854 2.781 2.969 . 0 0 "[ . 1 . 2 . ]" 1 919 1 134 VAL MG2 1 135 GLN H 3.500 . 5.300 3.778 3.682 3.840 . 0 0 "[ . 1 . 2 . ]" 1 920 1 133 PHE HA 1 136 MET H 3.130 . 4.560 3.837 3.545 3.983 . 0 0 "[ . 1 . 2 . ]" 1 921 1 136 MET H 1 136 MET HB2 3.040 . 4.380 2.417 2.311 2.521 . 0 0 "[ . 1 . 2 . ]" 1 922 1 136 MET H 1 136 MET HA 2.580 . 3.460 2.835 2.812 2.863 . 0 0 "[ . 1 . 2 . ]" 1 923 1 136 MET H 1 136 MET QG 3.080 . 4.460 3.977 3.938 4.028 . 0 0 "[ . 1 . 2 . ]" 1 924 1 136 MET H 1 136 MET HB3 3.080 . 4.460 2.648 2.512 2.765 . 0 0 "[ . 1 . 2 . ]" 1 925 1 135 GLN HA 1 136 MET H 3.060 . 4.420 3.570 3.550 3.579 . 0 0 "[ . 1 . 2 . ]" 1 926 1 136 MET H 1 137 ILE QG 3.850 . 6.000 4.846 4.383 5.373 . 0 0 "[ . 1 . 2 . ]" 1 927 1 134 VAL HA 1 137 ILE H 2.970 . 4.240 3.390 3.240 3.618 . 0 0 "[ . 1 . 2 . ]" 1 928 1 137 ILE H 1 137 ILE QG 2.750 . 3.790 2.859 2.462 3.393 . 0 0 "[ . 1 . 2 . ]" 1 929 1 137 ILE H 1 137 ILE HB 2.550 . 3.400 2.175 2.144 2.262 . 0 0 "[ . 1 . 2 . ]" 1 930 1 137 ILE H 1 137 ILE HA 2.760 . 3.820 2.815 2.788 2.882 . 0 0 "[ . 1 . 2 . ]" 1 931 1 137 ILE H 1 137 ILE MG 2.940 . 4.180 3.585 3.542 3.657 . 0 0 "[ . 1 . 2 . ]" 1 932 1 136 MET QG 1 137 ILE H 3.130 . 4.560 4.028 3.820 4.105 . 0 0 "[ . 1 . 2 . ]" 1 933 1 136 MET HA 1 137 ILE H 3.070 . 4.440 3.510 3.476 3.530 . 0 0 "[ . 1 . 2 . ]" 1 934 1 135 GLN HA 1 138 LEU H 2.940 . 4.180 3.743 3.515 4.018 . 0 0 "[ . 1 . 2 . ]" 1 935 1 137 ILE HA 1 138 LEU H 2.940 . 4.180 3.558 3.514 3.588 . 0 0 "[ . 1 . 2 . ]" 1 936 1 138 LEU H 1 138 LEU HB2 2.690 . 3.690 2.293 2.170 2.510 . 0 0 "[ . 1 . 2 . ]" 1 937 1 138 LEU H 1 138 LEU HB3 2.790 . 3.870 3.544 3.457 3.685 . 0 0 "[ . 1 . 2 . ]" 1 938 1 137 ILE MG 1 138 LEU H 3.080 . 4.460 2.808 2.459 3.061 . 0 0 "[ . 1 . 2 . ]" 1 939 1 138 LEU H 1 138 LEU HA 2.750 . 3.790 2.915 2.833 2.941 . 0 0 "[ . 1 . 2 . ]" 1 940 1 136 MET HA 1 138 LEU H 3.450 . 5.200 4.421 4.069 5.084 . 0 0 "[ . 1 . 2 . ]" 1 941 1 137 ILE H 1 138 LEU H 2.290 . 2.880 2.678 2.592 2.777 . 0 0 "[ . 1 . 2 . ]" 1 942 1 138 LEU H 1 138 LEU MD2 3.520 . 5.330 4.351 4.211 4.448 . 0 0 "[ . 1 . 2 . ]" 1 943 1 138 LEU H 1 138 LEU MD1 3.500 . 5.300 2.642 2.349 3.341 . 0 0 "[ . 1 . 2 . ]" 1 944 1 137 ILE QG 1 138 LEU H 3.600 . 5.500 4.381 4.173 4.587 . 0 0 "[ . 1 . 2 . ]" 1 945 1 138 LEU HA 1 139 ALA H 3.470 . 5.240 2.911 2.492 3.577 . 0 0 "[ . 1 . 2 . ]" 1 946 1 138 LEU H 1 139 ALA H 2.630 . 3.570 3.120 2.345 3.606 0.036 25 0 "[ . 1 . 2 . ]" 1 947 1 139 ALA H 1 139 ALA HA 2.550 . 3.400 2.779 2.266 2.949 . 0 0 "[ . 1 . 2 . ]" 1 948 1 139 ALA H 1 140 ASN HD22 2.450 . 3.200 3.109 2.773 3.284 0.084 9 0 "[ . 1 . 2 . ]" 1 949 1 139 ALA H 1 139 ALA MB 2.600 . 3.500 2.689 2.345 2.947 . 0 0 "[ . 1 . 2 . ]" 1 950 1 138 LEU HB2 1 139 ALA H 3.120 . 4.540 3.914 2.095 4.530 . 0 0 "[ . 1 . 2 . ]" 1 951 1 138 LEU MD1 1 139 ALA H 3.850 . 6.000 4.719 3.738 5.016 . 0 0 "[ . 1 . 2 . ]" 1 952 1 138 LEU HB3 1 139 ALA H 3.330 . 4.960 3.977 2.145 4.443 . 0 0 "[ . 1 . 2 . ]" 1 953 1 139 ALA MB 1 140 ASN H 3.120 . 4.540 3.594 3.329 3.731 . 0 0 "[ . 1 . 2 . ]" 1 954 1 140 ASN H 1 140 ASN QB 2.890 . 4.080 2.884 2.609 3.344 . 0 0 "[ . 1 . 2 . ]" 1 955 1 140 ASN H 1 140 ASN HA 2.960 . 4.220 2.932 2.893 2.950 . 0 0 "[ . 1 . 2 . ]" 1 956 1 139 ALA HA 1 140 ASN H 2.400 . 3.090 2.383 2.148 2.912 . 0 0 "[ . 1 . 2 . ]" 1 957 1 31 LEU HB3 1 37 ASN HD21 3.850 . 6.000 5.842 5.024 6.057 0.057 19 0 "[ . 1 . 2 . ]" 1 958 1 60 LEU MD2 1 64 ASN HD21 3.850 . 6.000 2.975 2.165 4.441 . 0 0 "[ . 1 . 2 . ]" 1 959 1 64 ASN HB2 1 64 ASN HD22 2.920 . 4.130 3.589 3.439 4.098 . 0 0 "[ . 1 . 2 . ]" 1 960 1 63 LEU MD2 1 64 ASN HD22 3.730 . 5.760 2.796 2.030 3.581 . 0 0 "[ . 1 . 2 . ]" 1 961 1 60 LEU MD2 1 64 ASN HD22 3.850 . 6.000 2.720 1.943 4.435 . 0 0 "[ . 1 . 2 . ]" 1 962 1 63 LEU MD2 1 64 ASN HD21 3.490 . 5.280 3.229 2.261 4.388 . 0 0 "[ . 1 . 2 . ]" 1 963 1 60 LEU HB3 1 64 ASN HD21 3.480 . 5.250 3.562 2.288 5.304 0.054 17 0 "[ . 1 . 2 . ]" 1 964 1 83 GLN QB 1 83 GLN HE22 3.500 . 5.300 3.877 3.394 4.380 . 0 0 "[ . 1 . 2 . ]" 1 965 1 111 ASN QB 1 111 ASN HD22 3.620 . 5.540 3.279 3.214 3.381 . 0 0 "[ . 1 . 2 . ]" 1 966 1 129 ASN HB2 1 129 ASN HD22 2.840 . 3.980 3.656 3.436 3.959 . 0 0 "[ . 1 . 2 . ]" 1 967 1 129 ASN HB3 1 129 ASN HD21 2.710 . 3.730 2.714 2.127 3.560 . 0 0 "[ . 1 . 2 . ]" 1 968 1 129 ASN HB2 1 129 ASN HD21 2.540 . 3.370 2.639 2.125 3.292 . 0 0 "[ . 1 . 2 . ]" 1 969 1 10 ALA HA 1 10 ALA MB 2.480 . 3.270 2.123 2.111 2.130 . 0 0 "[ . 1 . 2 . ]" 1 970 1 10 ALA HA 1 13 LEU MD2 2.870 . 4.040 3.401 3.389 3.424 . 0 0 "[ . 1 . 2 . ]" 1 971 1 10 ALA HA 1 13 LEU HG 2.500 . 3.300 1.835 1.784 1.931 . 0 0 "[ . 1 . 2 . ]" 1 972 1 10 ALA MB 1 30 LEU MD1 3.520 . 5.340 2.789 2.312 3.158 . 0 0 "[ . 1 . 2 . ]" 1 973 1 139 ALA HA 1 139 ALA MB 2.340 . 2.980 2.124 2.108 2.131 . 0 0 "[ . 1 . 2 . ]" 1 974 1 33 ALA HA 1 33 ALA MB 2.420 . 3.140 2.118 2.091 2.128 . 0 0 "[ . 1 . 2 . ]" 1 975 1 30 LEU HA 1 33 ALA MB 3.030 . 4.360 3.442 3.143 3.615 . 0 0 "[ . 1 . 2 . ]" 1 976 1 41 ALA HA 1 41 ALA MB 2.310 . 2.920 2.123 2.092 2.131 . 0 0 "[ . 1 . 2 . ]" 1 977 1 52 ALA HA 1 52 ALA MB 2.330 . 2.960 2.117 2.101 2.124 . 0 0 "[ . 1 . 2 . ]" 1 978 1 89 ALA HA 1 89 ALA MB 2.430 . 3.160 2.117 2.096 2.129 . 0 0 "[ . 1 . 2 . ]" 1 979 1 34 CYS HA 1 34 CYS QB 2.240 . 2.780 2.360 2.173 2.456 . 0 0 "[ . 1 . 2 . ]" 1 980 1 31 LEU HA 1 34 CYS QB 3.160 . 4.620 3.376 2.870 4.133 . 0 0 "[ . 1 . 2 . ]" 1 981 1 115 ASP HA 1 115 ASP HB3 2.310 . 2.910 2.815 2.750 2.856 . 0 0 "[ . 1 . 2 . ]" 1 982 1 115 ASP HA 1 118 LEU HB2 2.770 . 3.850 2.877 2.683 3.141 . 0 0 "[ . 1 . 2 . ]" 1 983 1 115 ASP HA 1 118 LEU MD1 3.210 . 4.720 3.239 2.905 3.573 . 0 0 "[ . 1 . 2 . ]" 1 984 1 112 GLU HA 1 115 ASP HB3 3.170 . 4.630 3.601 3.403 3.991 . 0 0 "[ . 1 . 2 . ]" 1 985 1 115 ASP HA 1 115 ASP HB2 2.310 . 2.910 2.893 2.856 2.939 0.029 4 0 "[ . 1 . 2 . ]" 1 986 1 112 GLU HA 1 115 ASP HB2 2.670 . 3.630 2.282 2.148 2.588 . 0 0 "[ . 1 . 2 . ]" 1 987 1 125 ASP HA 1 125 ASP QB 2.400 . 3.090 2.367 2.175 2.547 . 0 0 "[ . 1 . 2 . ]" 1 988 1 124 LYS HA 1 125 ASP HA 3.250 . 4.800 4.370 4.319 4.414 . 0 0 "[ . 1 . 2 . ]" 1 989 1 132 ASP HA 1 136 MET H 3.540 . 5.370 4.054 3.792 4.329 . 0 0 "[ . 1 . 2 . ]" 1 990 1 132 ASP HA 1 135 GLN QB 2.980 . 4.250 2.484 2.303 2.688 . 0 0 "[ . 1 . 2 . ]" 1 991 1 132 ASP HA 1 135 GLN QG 3.240 . 4.780 4.070 3.621 4.274 . 0 0 "[ . 1 . 2 . ]" 1 992 1 15 ASP HA 1 15 ASP QB 2.290 . 2.880 2.421 2.183 2.543 . 0 0 "[ . 1 . 2 . ]" 1 993 1 12 SER HA 1 15 ASP QB 3.040 . 4.370 2.912 2.419 3.608 . 0 0 "[ . 1 . 2 . ]" 1 994 1 29 ASP HA 1 29 ASP HB3 1.980 . 2.250 2.301 2.259 2.392 0.142 25 0 "[ . 1 . 2 . ]" 1 995 1 29 ASP HA 1 32 ARG HB3 2.960 . 4.210 2.227 2.124 2.343 . 0 0 "[ . 1 . 2 . ]" 1 996 1 29 ASP HA 1 32 ARG HB2 2.620 . 3.540 3.587 3.569 3.632 0.092 4 0 "[ . 1 . 2 . ]" 1 997 1 29 ASP HA 1 29 ASP HB2 2.210 . 2.710 2.625 2.461 2.713 0.003 8 0 "[ . 1 . 2 . ]" 1 998 1 55 ASP HA 1 55 ASP HB3 2.250 . 2.790 2.364 2.342 2.386 . 0 0 "[ . 1 . 2 . ]" 1 999 1 55 ASP HA 1 55 ASP HB2 2.230 . 2.770 2.556 2.519 2.581 . 0 0 "[ . 1 . 2 . ]" 1 1000 1 11 PHE HZ 1 55 ASP HA 2.620 . 3.790 1.777 1.714 1.851 . 0 0 "[ . 1 . 2 . ]" 1 1001 1 21 ARG HA 1 55 ASP HA 2.440 . 3.180 1.933 1.767 2.113 . 0 0 "[ . 1 . 2 . ]" 1 1002 1 21 ARG QB 1 55 ASP HA 3.730 . 5.760 3.544 3.279 3.816 . 0 0 "[ . 1 . 2 . ]" 1 1003 1 21 ARG QG 1 55 ASP HA 3.390 . 5.080 3.472 3.161 4.170 . 0 0 "[ . 1 . 2 . ]" 1 1004 1 55 ASP HB2 1 56 MET H 2.420 . 3.150 2.054 1.985 2.119 . 0 0 "[ . 1 . 2 . ]" 1 1005 1 70 ASP HA 1 70 ASP QB 2.200 . 2.700 2.355 2.171 2.472 . 0 0 "[ . 1 . 2 . ]" 1 1006 1 74 ASP HA 1 74 ASP HB3 2.290 . 2.880 2.654 2.359 2.923 0.043 22 0 "[ . 1 . 2 . ]" 1 1007 1 74 ASP HA 1 74 ASP HB2 2.340 . 2.980 2.923 2.464 3.023 0.043 25 0 "[ . 1 . 2 . ]" 1 1008 1 74 ASP H 1 74 ASP HA 2.950 . 4.200 2.877 2.808 2.890 . 0 0 "[ . 1 . 2 . ]" 1 1009 1 74 ASP HA 1 75 PRO QD 2.400 . 3.100 1.968 1.831 2.213 . 0 0 "[ . 1 . 2 . ]" 1 1010 1 86 ASP HA 1 86 ASP HB3 2.890 . 4.080 2.724 2.317 3.026 . 0 0 "[ . 1 . 2 . ]" 1 1011 1 86 ASP HA 1 86 ASP HB2 2.400 . 3.090 2.837 2.528 3.013 . 0 0 "[ . 1 . 2 . ]" 1 1012 1 88 ASP HA 1 88 ASP HB2 2.190 . 2.690 2.607 2.343 2.786 0.096 12 0 "[ . 1 . 2 . ]" 1 1013 1 88 ASP HA 1 88 ASP HB3 2.330 . 2.970 2.986 2.896 3.022 0.052 13 0 "[ . 1 . 2 . ]" 1 1014 1 107 GLU HA 1 107 GLU HB3 2.210 . 2.720 2.633 2.409 2.744 0.024 22 0 "[ . 1 . 2 . ]" 1 1015 1 107 GLU HA 1 107 GLU HB2 2.310 . 2.930 2.977 2.936 3.018 0.088 16 0 "[ . 1 . 2 . ]" 1 1016 1 107 GLU HA 1 107 GLU QG 2.380 . 3.060 2.325 2.070 2.644 . 0 0 "[ . 1 . 2 . ]" 1 1017 1 107 GLU HA 1 108 LYS H 2.630 . 3.560 2.699 2.607 2.799 . 0 0 "[ . 1 . 2 . ]" 1 1018 1 107 GLU HA 1 110 SER HB3 2.780 . 3.860 3.788 3.608 3.894 0.034 17 0 "[ . 1 . 2 . ]" 1 1019 1 112 GLU HA 1 112 GLU QB 2.210 . 2.730 2.417 2.342 2.463 . 0 0 "[ . 1 . 2 . ]" 1 1020 1 112 GLU HA 1 112 GLU QG 2.460 . 3.220 2.377 2.198 2.883 . 0 0 "[ . 1 . 2 . ]" 1 1021 1 112 GLU HA 1 113 GLU H 3.560 . 5.410 3.577 3.566 3.590 . 0 0 "[ . 1 . 2 . ]" 1 1022 1 112 GLU QG 1 113 GLU H 3.570 . 5.440 3.716 3.205 3.975 . 0 0 "[ . 1 . 2 . ]" 1 1023 1 113 GLU HA 1 114 MET H 3.370 . 5.040 3.568 3.535 3.582 . 0 0 "[ . 1 . 2 . ]" 1 1024 1 113 GLU HA 1 113 GLU QB 2.220 . 2.740 2.432 2.336 2.529 . 0 0 "[ . 1 . 2 . ]" 1 1025 1 109 LEU HG 1 113 GLU QB 3.850 . 6.000 4.374 3.479 4.729 . 0 0 "[ . 1 . 2 . ]" 1 1026 1 116 GLU HA 1 116 GLU QB 2.230 . 2.760 2.386 2.149 2.469 . 0 0 "[ . 1 . 2 . ]" 1 1027 1 116 GLU HA 1 116 GLU QG 2.550 . 3.400 2.493 2.198 3.096 . 0 0 "[ . 1 . 2 . ]" 1 1028 1 116 GLU HA 1 119 LYS QB 3.070 . 4.440 2.515 2.324 2.695 . 0 0 "[ . 1 . 2 . ]" 1 1029 1 42 GLU HA 1 42 GLU QB 2.460 . 3.220 2.497 2.269 2.539 . 0 0 "[ . 1 . 2 . ]" 1 1030 1 42 GLU HA 1 42 GLU QG 3.280 . 4.860 2.310 2.080 3.151 . 0 0 "[ . 1 . 2 . ]" 1 1031 1 42 GLU QG 1 43 ILE H 3.850 . 6.000 4.264 2.871 4.401 . 0 0 "[ . 1 . 2 . ]" 1 1032 1 44 THR MG 1 45 GLU HA 3.420 . 5.130 3.752 3.535 3.930 . 0 0 "[ . 1 . 2 . ]" 1 1033 1 47 GLU HA 1 47 GLU QB 2.440 . 3.190 2.451 2.426 2.473 . 0 0 "[ . 1 . 2 . ]" 1 1034 1 47 GLU HA 1 47 GLU HG3 2.260 . 2.820 2.883 2.858 2.903 0.083 15 0 "[ . 1 . 2 . ]" 1 1035 1 47 GLU HA 1 47 GLU HG2 1.970 . 2.240 2.311 2.252 2.369 0.129 3 0 "[ . 1 . 2 . ]" 1 1036 1 47 GLU HA 1 50 LEU HB2 3.120 . 4.540 3.529 3.340 3.851 . 0 0 "[ . 1 . 2 . ]" 1 1037 1 47 GLU HA 1 54 VAL MG2 3.250 . 4.800 3.090 2.834 3.347 . 0 0 "[ . 1 . 2 . ]" 1 1038 1 53 GLU HA 1 55 ASP H 3.430 . 5.160 5.128 4.973 5.285 0.125 21 0 "[ . 1 . 2 . ]" 1 1039 1 53 GLU HA 1 53 GLU QB 2.270 . 2.840 2.537 2.532 2.540 . 0 0 "[ . 1 . 2 . ]" 1 1040 1 53 GLU HA 1 53 GLU HG3 1.960 . 2.220 2.226 2.184 2.243 0.023 20 0 "[ . 1 . 2 . ]" 1 1041 1 53 GLU HA 1 53 GLU HG2 2.210 . 2.730 2.762 2.731 2.814 0.084 13 0 "[ . 1 . 2 . ]" 1 1042 1 53 GLU QB 1 53 GLU HG3 2.330 . 2.970 2.443 2.428 2.460 . 0 0 "[ . 1 . 2 . ]" 1 1043 1 53 GLU QB 1 53 GLU HG2 2.330 . 2.950 2.239 2.216 2.256 . 0 0 "[ . 1 . 2 . ]" 1 1044 1 21 ARG QB 1 53 GLU HG3 3.020 . 4.330 3.263 3.183 3.343 . 0 0 "[ . 1 . 2 . ]" 1 1045 1 21 ARG H 1 53 GLU HG2 3.340 . 4.980 4.851 4.503 5.026 0.046 9 0 "[ . 1 . 2 . ]" 1 1046 1 57 GLU HA 1 57 GLU QB 2.210 . 2.720 2.423 2.380 2.487 . 0 0 "[ . 1 . 2 . ]" 1 1047 1 57 GLU HA 1 60 LEU MD1 3.520 . 5.340 3.304 3.096 3.491 . 0 0 "[ . 1 . 2 . ]" 1 1048 1 76 GLU HA 1 76 GLU QB 2.500 . 3.310 2.381 2.174 2.538 . 0 0 "[ . 1 . 2 . ]" 1 1049 1 76 GLU HA 1 79 VAL HB 2.690 . 3.680 2.653 2.398 3.013 . 0 0 "[ . 1 . 2 . ]" 1 1050 1 76 GLU HA 1 79 VAL MG2 3.250 . 4.800 2.999 2.562 3.564 . 0 0 "[ . 1 . 2 . ]" 1 1051 1 76 GLU HA 1 76 GLU QG 2.750 . 3.800 2.631 2.008 3.400 . 0 0 "[ . 1 . 2 . ]" 1 1052 1 77 GLU HA 1 77 GLU QB 2.450 . 3.200 2.446 2.311 2.543 . 0 0 "[ . 1 . 2 . ]" 1 1053 1 77 GLU HA 1 80 LYS QB 3.460 . 5.210 3.078 2.542 3.675 . 0 0 "[ . 1 . 2 . ]" 1 1054 1 77 GLU HA 1 80 LYS H 3.100 . 4.500 3.772 3.451 4.416 . 0 0 "[ . 1 . 2 . ]" 1 1055 1 97 GLU HA 1 100 TYR QB 3.700 . 5.700 2.576 2.218 3.030 . 0 0 "[ . 1 . 2 . ]" 1 1056 1 11 PHE HA 1 11 PHE HB3 2.470 . 3.240 3.018 3.011 3.021 . 0 0 "[ . 1 . 2 . ]" 1 1057 1 11 PHE HA 1 11 PHE HB2 1.990 . 2.280 2.378 2.345 2.412 0.132 8 0 "[ . 1 . 2 . ]" 1 1058 1 11 PHE HA 1 11 PHE QD 2.660 . 3.870 3.129 3.079 3.181 . 0 0 "[ . 1 . 2 . ]" 1 1059 1 11 PHE HA 1 30 LEU MD1 2.750 . 3.810 2.691 2.339 3.101 . 0 0 "[ . 1 . 2 . ]" 1 1060 1 11 PHE HB3 1 11 PHE QD 2.360 . 3.280 2.466 2.436 2.511 . 0 0 "[ . 1 . 2 . ]" 1 1061 1 11 PHE HB2 1 11 PHE QD 2.310 . 3.180 2.320 2.297 2.346 . 0 0 "[ . 1 . 2 . ]" 1 1062 1 11 PHE QD 1 30 LEU MD2 3.130 . 4.810 2.736 2.367 3.136 . 0 0 "[ . 1 . 2 . ]" 1 1063 1 11 PHE QD 1 13 LEU H 3.790 . 5.880 4.993 4.883 5.122 . 0 0 "[ . 1 . 2 . ]" 1 1064 1 133 PHE HA 1 133 PHE QB 2.470 . 3.240 2.258 2.226 2.305 . 0 0 "[ . 1 . 2 . ]" 1 1065 1 133 PHE HA 1 133 PHE QD 2.600 . 3.750 2.708 2.368 2.911 . 0 0 "[ . 1 . 2 . ]" 1 1066 1 133 PHE HA 1 137 ILE QG 3.660 . 5.620 4.362 3.784 5.018 . 0 0 "[ . 1 . 2 . ]" 1 1067 1 133 PHE QB 1 133 PHE QD 2.680 . 3.910 2.132 2.122 2.188 . 0 0 "[ . 1 . 2 . ]" 1 1068 1 117 LEU MD1 1 133 PHE QD 3.730 . 6.000 3.159 2.348 3.873 . 0 0 "[ . 1 . 2 . ]" 1 1069 1 121 VAL MG2 1 133 PHE QD 3.730 . 6.000 4.096 3.377 4.454 . 0 0 "[ . 1 . 2 . ]" 1 1070 1 128 VAL MG1 1 133 PHE QD 3.850 . 6.000 4.349 3.946 4.476 . 0 0 "[ . 1 . 2 . ]" 1 1071 1 117 LEU MD1 1 133 PHE QE 3.250 . 4.800 2.247 1.825 3.298 . 0 0 "[ . 1 . 2 . ]" 1 1072 1 121 VAL MG2 1 133 PHE QE 3.730 . 6.000 2.970 2.273 3.380 . 0 0 "[ . 1 . 2 . ]" 1 1073 1 128 VAL MG1 1 133 PHE QE 3.560 . 5.420 3.708 2.911 3.928 . 0 0 "[ . 1 . 2 . ]" 1 1074 1 132 ASP QB 1 133 PHE HZ 3.850 . 6.000 4.798 4.637 4.954 . 0 0 "[ . 1 . 2 . ]" 1 1075 1 93 ILE HB 1 133 PHE HZ 3.250 . 5.040 5.060 5.035 5.083 0.043 21 0 "[ . 1 . 2 . ]" 1 1076 1 117 LEU MD1 1 133 PHE HZ 3.230 . 5.010 3.599 3.222 3.926 . 0 0 "[ . 1 . 2 . ]" 1 1077 1 121 VAL MG2 1 133 PHE HZ 3.560 . 5.660 4.403 3.964 4.728 . 0 0 "[ . 1 . 2 . ]" 1 1078 1 128 VAL HA 1 133 PHE HZ 3.580 . 5.460 4.543 4.169 4.871 . 0 0 "[ . 1 . 2 . ]" 1 1079 1 128 VAL MG1 1 133 PHE HZ 3.210 . 4.970 3.948 3.724 4.136 . 0 0 "[ . 1 . 2 . ]" 1 1080 1 14 PHE HA 1 14 PHE HB3 2.270 . 2.840 2.507 2.402 2.625 . 0 0 "[ . 1 . 2 . ]" 1 1081 1 14 PHE HA 1 14 PHE HB2 2.630 . 3.560 3.019 2.994 3.027 . 0 0 "[ . 1 . 2 . ]" 1 1082 1 14 PHE HA 1 14 PHE QD 2.570 . 3.690 2.581 2.015 3.138 . 0 0 "[ . 1 . 2 . ]" 1 1083 1 14 PHE HB3 1 14 PHE QD 2.500 . 3.550 2.503 2.254 2.760 . 0 0 "[ . 1 . 2 . ]" 1 1084 1 14 PHE HB3 1 22 ILE MG 3.380 . 5.050 3.185 2.865 3.594 . 0 0 "[ . 1 . 2 . ]" 1 1085 1 14 PHE HB2 1 14 PHE QD 2.480 . 3.500 2.381 2.267 2.736 . 0 0 "[ . 1 . 2 . ]" 1 1086 1 14 PHE HB2 1 22 ILE MG 3.120 . 4.540 2.808 2.179 3.425 . 0 0 "[ . 1 . 2 . ]" 1 1087 1 59 PHE HA 1 59 PHE HB2 2.010 . 2.320 2.226 2.222 2.229 . 0 0 "[ . 1 . 2 . ]" 1 1088 1 59 PHE HA 1 59 PHE QD 2.500 . 3.550 3.204 3.190 3.225 . 0 0 "[ . 1 . 2 . ]" 1 1089 1 59 PHE HA 1 62 VAL HB 3.180 . 4.660 4.683 4.655 4.701 0.041 16 0 "[ . 1 . 2 . ]" 1 1090 1 59 PHE HB3 1 59 PHE QD 2.260 . 3.070 2.280 2.270 2.302 . 0 0 "[ . 1 . 2 . ]" 1 1091 1 56 MET HA 1 59 PHE HB3 2.960 . 4.220 3.574 3.490 3.680 . 0 0 "[ . 1 . 2 . ]" 1 1092 1 59 PHE HB2 1 59 PHE QD 2.230 . 3.020 2.543 2.492 2.567 . 0 0 "[ . 1 . 2 . ]" 1 1093 1 30 LEU MD2 1 59 PHE QD 3.730 . 6.000 3.670 2.810 4.340 . 0 0 "[ . 1 . 2 . ]" 1 1094 1 69 PHE HA 1 69 PHE HB3 2.210 . 2.720 2.479 2.304 2.716 . 0 0 "[ . 1 . 2 . ]" 1 1095 1 69 PHE HA 1 69 PHE HB2 2.470 . 3.240 3.007 2.958 3.029 . 0 0 "[ . 1 . 2 . ]" 1 1096 1 69 PHE HA 1 69 PHE QD 2.540 . 3.380 2.651 2.118 3.058 . 0 0 "[ . 1 . 2 . ]" 1 1097 1 69 PHE HA 1 72 PRO QG 3.220 . 4.740 3.277 2.830 4.114 . 0 0 "[ . 1 . 2 . ]" 1 1098 1 69 PHE HB3 1 69 PHE QD 2.590 . 3.730 2.520 2.275 2.754 . 0 0 "[ . 1 . 2 . ]" 1 1099 1 69 PHE HB2 1 69 PHE QD 2.300 . 3.150 2.349 2.261 2.717 . 0 0 "[ . 1 . 2 . ]" 1 1100 1 78 PHE HA 1 78 PHE HB3 2.560 . 3.410 2.765 2.654 2.837 . 0 0 "[ . 1 . 2 . ]" 1 1101 1 78 PHE HB3 1 78 PHE QD 2.740 . 3.780 2.299 2.280 2.316 . 0 0 "[ . 1 . 2 . ]" 1 1102 1 78 PHE HB2 1 78 PHE QD 2.700 . 3.700 2.514 2.481 2.563 . 0 0 "[ . 1 . 2 . ]" 1 1103 1 82 PHE HA 1 82 PHE HB3 2.730 . 3.750 2.609 2.457 2.798 . 0 0 "[ . 1 . 2 . ]" 1 1104 1 82 PHE HA 1 82 PHE HB2 2.770 . 3.850 2.996 2.903 3.029 . 0 0 "[ . 1 . 2 . ]" 1 1105 1 82 PHE HA 1 82 PHE QD 2.540 . 3.620 2.627 1.960 3.050 . 0 0 "[ . 1 . 2 . ]" 1 1106 1 82 PHE HA 1 93 ILE MD 3.500 . 5.300 4.404 4.244 4.457 . 0 0 "[ . 1 . 2 . ]" 1 1107 1 82 PHE HA 1 101 VAL MG2 3.210 . 4.720 3.614 2.663 3.983 . 0 0 "[ . 1 . 2 . ]" 1 1108 1 82 PHE HA 1 84 VAL H 2.950 . 4.200 4.079 3.578 4.274 0.074 5 0 "[ . 1 . 2 . ]" 1 1109 1 85 PHE HA 1 85 PHE QD 2.520 . 3.580 2.733 2.337 3.032 . 0 0 "[ . 1 . 2 . ]" 1 1110 1 85 PHE QB 1 85 PHE QD 2.810 . 4.160 2.131 2.112 2.152 . 0 0 "[ . 1 . 2 . ]" 1 1111 1 84 VAL H 1 85 PHE QB 3.850 . 6.000 4.650 4.220 5.283 . 0 0 "[ . 1 . 2 . ]" 1 1112 1 106 GLY QA 1 108 LYS H 3.260 . 4.820 4.204 4.033 4.346 . 0 0 "[ . 1 . 2 . ]" 1 1113 1 123 VAL MG2 1 126 GLY QA 3.330 . 4.960 2.436 1.905 3.688 . 0 0 "[ . 1 . 2 . ]" 1 1114 1 27 ILE HB 1 28 GLY QA 2.940 . 4.180 3.704 3.676 3.726 . 0 0 "[ . 1 . 2 . ]" 1 1115 1 28 GLY QA 1 43 ILE MD 3.140 . 4.580 2.138 1.998 2.268 . 0 0 "[ . 1 . 2 . ]" 1 1116 1 28 GLY QA 1 43 ILE MG 2.970 . 4.240 2.618 2.435 2.756 . 0 0 "[ . 1 . 2 . ]" 1 1117 1 94 GLY QA 1 126 GLY QA 3.600 . 5.500 3.947 3.531 4.395 . 0 0 "[ . 1 . 2 . ]" 1 1118 1 94 GLY QA 1 127 MET HA 3.080 . 4.460 3.342 2.749 4.018 . 0 0 "[ . 1 . 2 . ]" 1 1119 1 96 GLY QA 1 97 GLU H 2.420 . 3.150 2.715 2.593 2.778 . 0 0 "[ . 1 . 2 . ]" 1 1120 1 131 HIS HA 1 131 HIS QB 2.260 . 2.820 2.456 2.170 2.538 . 0 0 "[ . 1 . 2 . ]" 1 1121 1 131 HIS HA 1 134 VAL MG1 3.750 . 5.790 4.583 4.102 4.842 . 0 0 "[ . 1 . 2 . ]" 1 1122 1 131 HIS HA 1 134 VAL MG2 3.240 . 4.780 3.304 2.814 3.605 . 0 0 "[ . 1 . 2 . ]" 1 1123 1 17 HIS HA 1 17 HIS HB3 2.190 . 2.670 2.603 2.369 2.682 0.012 11 0 "[ . 1 . 2 . ]" 1 1124 1 17 HIS HA 1 17 HIS HB2 2.310 . 2.930 2.986 2.964 3.016 0.086 25 0 "[ . 1 . 2 . ]" 1 1125 1 17 HIS HB3 1 19 THR MG 3.290 . 4.880 2.638 2.096 3.346 . 0 0 "[ . 1 . 2 . ]" 1 1126 1 137 ILE HA 1 137 ILE HB 2.480 . 3.270 2.971 2.948 3.003 . 0 0 "[ . 1 . 2 . ]" 1 1127 1 137 ILE HA 1 137 ILE QG 3.250 . 4.800 2.361 2.121 2.730 . 0 0 "[ . 1 . 2 . ]" 1 1128 1 137 ILE HA 1 137 ILE MG 2.680 . 3.660 2.693 2.563 2.764 . 0 0 "[ . 1 . 2 . ]" 1 1129 1 135 GLN H 1 137 ILE HB 3.200 . 4.700 4.607 4.391 4.747 0.047 6 0 "[ . 1 . 2 . ]" 1 1130 1 137 ILE HB 1 137 ILE MD 3.030 . 4.360 2.651 2.136 3.227 . 0 0 "[ . 1 . 2 . ]" 1 1131 1 137 ILE QG 1 137 ILE MG 3.050 . 4.400 2.270 2.106 2.419 . 0 0 "[ . 1 . 2 . ]" 1 1132 1 22 ILE HA 1 22 ILE HB 2.560 . 3.420 2.512 2.473 2.538 . 0 0 "[ . 1 . 2 . ]" 1 1133 1 22 ILE HA 1 22 ILE MD 3.850 . 6.000 4.131 4.106 4.149 . 0 0 "[ . 1 . 2 . ]" 1 1134 1 22 ILE HA 1 22 ILE QG 3.760 . 5.820 3.309 3.298 3.319 . 0 0 "[ . 1 . 2 . ]" 1 1135 1 22 ILE HA 1 22 ILE MG 2.810 . 3.930 2.214 2.155 2.310 . 0 0 "[ . 1 . 2 . ]" 1 1136 1 22 ILE HA 1 23 PRO QB 3.780 . 5.860 4.476 4.443 4.656 . 0 0 "[ . 1 . 2 . ]" 1 1137 1 22 ILE HB 1 22 ILE MD 2.930 . 4.160 2.122 2.089 2.182 . 0 0 "[ . 1 . 2 . ]" 1 1138 1 22 ILE HB 1 22 ILE QG 2.630 . 3.560 2.480 2.460 2.494 . 0 0 "[ . 1 . 2 . ]" 1 1139 1 22 ILE HB 1 27 ILE HA 3.230 . 4.760 4.581 4.420 4.795 0.035 25 0 "[ . 1 . 2 . ]" 1 1140 1 22 ILE HB 1 26 SER HA 3.170 . 4.640 4.559 4.384 4.661 0.021 19 0 "[ . 1 . 2 . ]" 1 1141 1 11 PHE QD 1 22 ILE MD 3.270 . 5.090 2.744 2.512 2.946 . 0 0 "[ . 1 . 2 . ]" 1 1142 1 22 ILE MD 1 22 ILE MG 3.290 . 4.880 2.465 2.374 2.527 . 0 0 "[ . 1 . 2 . ]" 1 1143 1 22 ILE MD 1 27 ILE HA 2.990 . 4.280 2.580 2.441 2.678 . 0 0 "[ . 1 . 2 . ]" 1 1144 1 22 ILE MD 1 27 ILE MD 3.460 . 5.210 1.803 1.717 1.911 . 0 0 "[ . 1 . 2 . ]" 1 1145 1 22 ILE MD 1 30 LEU MD2 3.270 . 4.830 1.915 1.790 2.179 . 0 0 "[ . 1 . 2 . ]" 1 1146 1 22 ILE QG 1 22 ILE MG 3.080 . 4.460 2.116 2.048 2.171 . 0 0 "[ . 1 . 2 . ]" 1 1147 1 22 ILE QG 1 27 ILE MD 2.470 . 3.240 2.274 2.163 2.403 . 0 0 "[ . 1 . 2 . ]" 1 1148 1 22 ILE QG 1 27 ILE QG 3.660 . 5.620 4.284 4.166 4.412 . 0 0 "[ . 1 . 2 . ]" 1 1149 1 22 ILE QG 1 54 VAL HB 2.780 . 3.860 2.365 2.273 2.512 . 0 0 "[ . 1 . 2 . ]" 1 1150 1 11 PHE HA 1 22 ILE MG 3.390 . 5.080 4.020 3.654 4.227 . 0 0 "[ . 1 . 2 . ]" 1 1151 1 11 PHE HZ 1 22 ILE MG 3.320 . 5.190 3.206 2.907 3.460 . 0 0 "[ . 1 . 2 . ]" 1 1152 1 27 ILE HA 1 27 ILE HB 2.360 . 3.030 2.860 2.855 2.866 . 0 0 "[ . 1 . 2 . ]" 1 1153 1 27 ILE HA 1 27 ILE MD 2.830 . 3.950 3.017 2.987 3.062 . 0 0 "[ . 1 . 2 . ]" 1 1154 1 27 ILE HA 1 27 ILE QG 2.950 . 4.200 3.356 3.343 3.366 . 0 0 "[ . 1 . 2 . ]" 1 1155 1 27 ILE HA 1 30 LEU HB2 3.150 . 4.590 3.353 3.110 3.479 . 0 0 "[ . 1 . 2 . ]" 1 1156 1 27 ILE HA 1 30 LEU MD2 3.000 . 4.300 2.187 2.034 2.491 . 0 0 "[ . 1 . 2 . ]" 1 1157 1 27 ILE HA 1 27 ILE MG 2.890 . 4.080 2.076 2.036 2.124 . 0 0 "[ . 1 . 2 . ]" 1 1158 1 27 ILE QG 1 27 ILE MG 2.850 . 4.000 2.396 2.375 2.415 . 0 0 "[ . 1 . 2 . ]" 1 1159 1 27 ILE MG 1 46 ILE HB 3.850 . 6.000 4.661 4.490 4.942 . 0 0 "[ . 1 . 2 . ]" 1 1160 1 27 ILE HB 1 43 ILE HA 2.880 . 4.060 4.081 4.039 4.113 0.053 14 0 "[ . 1 . 2 . ]" 1 1161 1 43 ILE HA 1 43 ILE QG 3.240 . 4.780 3.370 3.359 3.384 . 0 0 "[ . 1 . 2 . ]" 1 1162 1 43 ILE HA 1 43 ILE MG 2.630 . 3.570 2.133 2.095 2.151 . 0 0 "[ . 1 . 2 . ]" 1 1163 1 43 ILE HA 1 46 ILE MD 2.940 . 4.170 1.941 1.836 2.075 . 0 0 "[ . 1 . 2 . ]" 1 1164 1 31 LEU MD1 1 43 ILE HA 3.680 . 5.660 4.149 3.902 4.362 . 0 0 "[ . 1 . 2 . ]" 1 1165 1 43 ILE HB 1 43 ILE MG 2.480 . 3.270 2.115 2.102 2.120 . 0 0 "[ . 1 . 2 . ]" 1 1166 1 24 LYS H 1 43 ILE HB 2.970 . 4.240 4.293 4.264 4.327 0.087 9 0 "[ . 1 . 2 . ]" 1 1167 1 40 LEU HA 1 43 ILE HB 3.000 . 4.290 4.352 4.322 4.381 0.091 10 0 "[ . 1 . 2 . ]" 1 1168 1 43 ILE HA 1 43 ILE MD 2.930 . 4.160 3.397 3.275 3.475 . 0 0 "[ . 1 . 2 . ]" 1 1169 1 43 ILE HB 1 43 ILE MD 2.850 . 4.000 3.148 3.120 3.178 . 0 0 "[ . 1 . 2 . ]" 1 1170 1 40 LEU HA 1 43 ILE MD 2.900 . 4.100 2.103 1.922 2.319 . 0 0 "[ . 1 . 2 . ]" 1 1171 1 43 ILE QG 1 43 ILE MG 3.100 . 4.500 2.550 2.505 2.581 . 0 0 "[ . 1 . 2 . ]" 1 1172 1 40 LEU HA 1 43 ILE QG 2.970 . 4.240 1.956 1.936 1.987 . 0 0 "[ . 1 . 2 . ]" 1 1173 1 28 GLY H 1 43 ILE MG 2.890 . 4.080 2.326 2.192 2.466 . 0 0 "[ . 1 . 2 . ]" 1 1174 1 27 ILE QG 1 43 ILE MG 3.190 . 4.670 2.001 1.936 2.078 . 0 0 "[ . 1 . 2 . ]" 1 1175 1 46 ILE HA 1 46 ILE HB 2.730 . 3.750 3.030 3.027 3.033 . 0 0 "[ . 1 . 2 . ]" 1 1176 1 46 ILE HA 1 46 ILE MD 3.850 . 6.000 3.889 3.862 3.915 . 0 0 "[ . 1 . 2 . ]" 1 1177 1 46 ILE HA 1 46 ILE QG 2.880 . 4.050 2.457 2.414 2.503 . 0 0 "[ . 1 . 2 . ]" 1 1178 1 46 ILE HA 1 46 ILE MG 2.610 . 3.530 2.357 2.317 2.416 . 0 0 "[ . 1 . 2 . ]" 1 1179 1 46 ILE HA 1 49 THR MG 3.400 . 5.100 4.100 3.699 4.311 . 0 0 "[ . 1 . 2 . ]" 1 1180 1 43 ILE HA 1 46 ILE HB 2.350 . 3.000 3.023 2.888 3.067 0.067 26 0 "[ . 1 . 2 . ]" 1 1181 1 46 ILE HB 1 46 ILE MD 2.910 . 4.120 2.163 2.087 2.326 . 0 0 "[ . 1 . 2 . ]" 1 1182 1 46 ILE HB 1 46 ILE QG 2.550 . 3.400 2.477 2.434 2.504 . 0 0 "[ . 1 . 2 . ]" 1 1183 1 93 ILE HA 1 93 ILE HB 2.610 . 3.530 2.618 2.549 2.760 . 0 0 "[ . 1 . 2 . ]" 1 1184 1 93 ILE HB 1 93 ILE MD 3.160 . 4.620 3.230 3.217 3.241 . 0 0 "[ . 1 . 2 . ]" 1 1185 1 82 PHE QD 1 93 ILE MD 3.330 . 5.210 2.996 2.256 3.649 . 0 0 "[ . 1 . 2 . ]" 1 1186 1 93 ILE MD 1 93 ILE MG 3.160 . 4.620 1.775 1.687 1.936 0.013 13 0 "[ . 1 . 2 . ]" 1 1187 1 93 ILE MD 1 98 LEU HA 3.270 . 4.840 4.009 3.544 4.096 . 0 0 "[ . 1 . 2 . ]" 1 1188 1 93 ILE MD 1 98 LEU MD2 3.850 . 6.000 2.297 1.975 2.803 . 0 0 "[ . 1 . 2 . ]" 1 1189 1 93 ILE MD 1 130 TYR QD 3.440 . 5.420 3.515 3.221 3.786 . 0 0 "[ . 1 . 2 . ]" 1 1190 1 93 ILE QG 1 93 ILE MG 3.100 . 4.500 2.371 2.277 2.451 . 0 0 "[ . 1 . 2 . ]" 1 1191 1 93 ILE HA 1 93 ILE MG 3.040 . 4.380 3.181 3.092 3.210 . 0 0 "[ . 1 . 2 . ]" 1 1192 1 93 ILE HB 1 93 ILE MG 2.480 . 3.270 2.122 2.119 2.125 . 0 0 "[ . 1 . 2 . ]" 1 1193 1 93 ILE MG 1 130 TYR QD 3.220 . 4.990 2.716 1.871 3.717 . 0 0 "[ . 1 . 2 . ]" 1 1194 1 108 LYS HA 1 108 LYS QB 2.290 . 2.880 2.428 2.345 2.533 . 0 0 "[ . 1 . 2 . ]" 1 1195 1 108 LYS HA 1 108 LYS QD 2.430 . 3.160 2.283 1.914 2.803 . 0 0 "[ . 1 . 2 . ]" 1 1196 1 108 LYS HA 1 108 LYS QG 2.460 . 3.210 2.667 2.306 2.892 . 0 0 "[ . 1 . 2 . ]" 1 1197 1 108 LYS QD 1 108 LYS QE 2.370 . 3.040 2.045 2.013 2.090 . 0 0 "[ . 1 . 2 . ]" 1 1198 1 119 LYS H 1 119 LYS HA 2.970 . 4.240 2.817 2.808 2.833 . 0 0 "[ . 1 . 2 . ]" 1 1199 1 119 LYS HA 1 121 VAL H 3.700 . 5.700 4.789 4.613 4.875 . 0 0 "[ . 1 . 2 . ]" 1 1200 1 119 LYS HA 1 119 LYS QG 2.250 . 2.810 2.273 2.032 2.523 . 0 0 "[ . 1 . 2 . ]" 1 1201 1 124 LYS HA 1 124 LYS QB 2.230 . 2.770 2.463 2.329 2.535 . 0 0 "[ . 1 . 2 . ]" 1 1202 1 24 LYS HA 1 27 ILE MD 2.960 . 4.220 3.044 2.953 3.194 . 0 0 "[ . 1 . 2 . ]" 1 1203 1 24 LYS HA 1 27 ILE QG 3.100 . 4.500 1.881 1.841 1.958 . 0 0 "[ . 1 . 2 . ]" 1 1204 1 24 LYS HA 1 24 LYS HB3 2.190 . 2.670 2.364 2.325 2.412 . 0 0 "[ . 1 . 2 . ]" 1 1205 1 24 LYS HA 1 24 LYS HB2 2.210 . 2.720 2.540 2.494 2.581 . 0 0 "[ . 1 . 2 . ]" 1 1206 1 24 LYS HA 1 24 LYS QG 3.220 . 4.740 3.338 3.317 3.349 . 0 0 "[ . 1 . 2 . ]" 1 1207 1 24 LYS HB3 1 24 LYS QD 2.610 . 3.530 2.497 2.039 3.091 . 0 0 "[ . 1 . 2 . ]" 1 1208 1 24 LYS H 1 24 LYS HB3 2.720 . 3.740 2.651 2.551 2.722 . 0 0 "[ . 1 . 2 . ]" 1 1209 1 24 LYS HB3 1 44 THR H 2.620 . 3.540 3.569 3.525 3.599 0.059 15 0 "[ . 1 . 2 . ]" 1 1210 1 24 LYS HB2 1 43 ILE QG 2.470 . 3.240 1.876 1.796 1.984 . 0 0 "[ . 1 . 2 . ]" 1 1211 1 24 LYS HB2 1 43 ILE MG 2.900 . 4.100 3.399 3.330 3.437 . 0 0 "[ . 1 . 2 . ]" 1 1212 1 24 LYS HB2 1 24 LYS QG 2.590 . 3.480 2.370 2.214 2.525 . 0 0 "[ . 1 . 2 . ]" 1 1213 1 24 LYS HB2 1 44 THR H 2.500 . 3.290 3.314 3.290 3.353 0.063 18 0 "[ . 1 . 2 . ]" 1 1214 1 8 LYS HA 1 11 PHE HB3 3.290 . 4.880 2.831 2.605 2.980 . 0 0 "[ . 1 . 2 . ]" 1 1215 1 8 LYS HA 1 11 PHE HB2 3.390 . 5.080 3.650 3.407 3.932 . 0 0 "[ . 1 . 2 . ]" 1 1216 1 8 LYS HA 1 8 LYS QD 3.850 . 6.000 3.499 2.085 4.165 . 0 0 "[ . 1 . 2 . ]" 1 1217 1 8 LYS HA 1 8 LYS QE 3.020 . 4.340 3.668 2.853 3.891 . 0 0 "[ . 1 . 2 . ]" 1 1218 1 8 LYS HA 1 8 LYS QG 2.330 . 2.960 2.316 2.070 2.623 . 0 0 "[ . 1 . 2 . ]" 1 1219 1 8 LYS HA 1 60 LEU MD1 3.850 . 6.000 4.808 4.461 5.010 . 0 0 "[ . 1 . 2 . ]" 1 1220 1 8 LYS HA 1 9 GLN H 3.330 . 4.960 3.581 3.572 3.588 . 0 0 "[ . 1 . 2 . ]" 1 1221 1 80 LYS HA 1 80 LYS QB 2.240 . 2.780 2.523 2.503 2.534 . 0 0 "[ . 1 . 2 . ]" 1 1222 1 79 VAL MG1 1 80 LYS QD 3.850 . 6.000 3.202 2.435 3.819 . 0 0 "[ . 1 . 2 . ]" 1 1223 1 80 LYS QD 1 80 LYS HG3 2.120 . 2.540 2.203 2.172 2.434 . 0 0 "[ . 1 . 2 . ]" 1 1224 1 80 LYS QE 1 80 LYS HG3 2.650 . 3.600 3.166 2.181 3.296 . 0 0 "[ . 1 . 2 . ]" 1 1225 1 80 LYS HA 1 80 LYS HG2 2.630 . 3.560 3.580 3.560 3.596 0.036 21 0 "[ . 1 . 2 . ]" 1 1226 1 80 LYS QB 1 80 LYS HG2 2.280 . 2.860 2.162 2.158 2.165 . 0 0 "[ . 1 . 2 . ]" 1 1227 1 80 LYS QE 1 80 LYS HG2 2.350 . 3.000 2.314 2.201 2.638 . 0 0 "[ . 1 . 2 . ]" 1 1228 1 87 LYS HA 1 87 LYS QG 3.230 . 4.760 2.510 2.030 3.368 . 0 0 "[ . 1 . 2 . ]" 1 1229 1 87 LYS QD 1 87 LYS QG 2.180 . 2.660 2.037 2.002 2.074 . 0 0 "[ . 1 . 2 . ]" 1 1230 1 102 LEU HA 1 102 LEU HB3 2.290 . 2.870 2.698 2.664 2.726 . 0 0 "[ . 1 . 2 . ]" 1 1231 1 102 LEU HA 1 102 LEU HB2 2.790 . 3.890 2.947 2.934 2.966 . 0 0 "[ . 1 . 2 . ]" 1 1232 1 102 LEU HA 1 102 LEU MD1 3.090 . 4.480 3.751 3.710 3.779 . 0 0 "[ . 1 . 2 . ]" 1 1233 1 102 LEU HB3 1 102 LEU MD1 3.230 . 4.760 2.588 2.466 2.680 . 0 0 "[ . 1 . 2 . ]" 1 1234 1 102 LEU HB2 1 102 LEU MD1 2.500 . 3.290 2.146 2.017 2.281 . 0 0 "[ . 1 . 2 . ]" 1 1235 1 105 LEU HA 1 105 LEU HB3 2.410 . 3.120 2.791 2.630 2.861 . 0 0 "[ . 1 . 2 . ]" 1 1236 1 105 LEU HA 1 105 LEU MD2 2.520 . 3.340 2.183 2.059 2.354 . 0 0 "[ . 1 . 2 . ]" 1 1237 1 102 LEU MD2 1 105 LEU MD1 3.100 . 4.500 2.456 1.932 2.904 . 0 0 "[ . 1 . 2 . ]" 1 1238 1 105 LEU HB3 1 105 LEU MD1 2.870 . 4.040 2.476 2.328 2.616 . 0 0 "[ . 1 . 2 . ]" 1 1239 1 105 LEU MD1 1 105 LEU MD2 2.510 . 3.320 2.064 1.969 2.094 . 0 0 "[ . 1 . 2 . ]" 1 1240 1 109 LEU HA 1 109 LEU QB 2.220 . 2.740 2.329 2.267 2.440 . 0 0 "[ . 1 . 2 . ]" 1 1241 1 109 LEU HA 1 109 LEU MD2 2.500 . 3.300 2.275 1.969 2.762 . 0 0 "[ . 1 . 2 . ]" 1 1242 1 109 LEU QB 1 109 LEU MD1 2.560 . 3.430 2.090 1.942 2.328 . 0 0 "[ . 1 . 2 . ]" 1 1243 1 109 LEU H 1 109 LEU QB 3.350 . 5.000 2.521 2.139 2.671 . 0 0 "[ . 1 . 2 . ]" 1 1244 1 117 LEU HA 1 117 LEU HB3 2.250 . 2.790 2.749 2.736 2.771 . 0 0 "[ . 1 . 2 . ]" 1 1245 1 117 LEU HA 1 117 LEU HB2 2.600 . 3.500 2.234 2.227 2.241 . 0 0 "[ . 1 . 2 . ]" 1 1246 1 117 LEU HA 1 117 LEU MD1 2.790 . 3.880 3.089 2.963 3.183 . 0 0 "[ . 1 . 2 . ]" 1 1247 1 117 LEU HA 1 117 LEU MD2 3.380 . 5.050 4.128 4.123 4.135 . 0 0 "[ . 1 . 2 . ]" 1 1248 1 117 LEU HA 1 117 LEU HG 2.710 . 3.720 3.703 3.692 3.721 0.001 8 0 "[ . 1 . 2 . ]" 1 1249 1 117 LEU HB3 1 117 LEU MD1 2.790 . 3.880 3.162 3.154 3.173 . 0 0 "[ . 1 . 2 . ]" 1 1250 1 117 LEU HB3 1 117 LEU MD2 2.520 . 3.340 2.074 2.035 2.180 . 0 0 "[ . 1 . 2 . ]" 1 1251 1 117 LEU HB2 1 117 LEU MD2 2.480 . 3.250 2.555 2.462 2.591 . 0 0 "[ . 1 . 2 . ]" 1 1252 1 117 LEU HB2 1 117 LEU MD1 2.420 . 3.150 2.151 2.099 2.238 . 0 0 "[ . 1 . 2 . ]" 1 1253 1 117 LEU MD1 1 118 LEU H 2.830 . 3.950 3.293 3.214 3.311 . 0 0 "[ . 1 . 2 . ]" 1 1254 1 117 LEU MD1 1 121 VAL MG2 2.790 . 3.870 2.540 2.154 2.694 . 0 0 "[ . 1 . 2 . ]" 1 1255 1 117 LEU HB3 1 117 LEU HG 2.770 . 3.830 2.590 2.570 2.608 . 0 0 "[ . 1 . 2 . ]" 1 1256 1 117 LEU HB2 1 117 LEU HG 2.670 . 3.640 3.005 3.000 3.011 . 0 0 "[ . 1 . 2 . ]" 1 1257 1 117 LEU HG 1 118 LEU HA 2.800 . 3.900 3.270 3.185 3.338 . 0 0 "[ . 1 . 2 . ]" 1 1258 1 117 LEU HG 1 118 LEU H 3.120 . 4.540 2.136 2.082 2.188 . 0 0 "[ . 1 . 2 . ]" 1 1259 1 118 LEU HA 1 118 LEU HB3 2.250 . 2.810 2.726 2.632 2.755 . 0 0 "[ . 1 . 2 . ]" 1 1260 1 118 LEU HA 1 118 LEU HB2 2.330 . 2.970 2.941 2.923 2.984 0.014 6 0 "[ . 1 . 2 . ]" 1 1261 1 118 LEU HA 1 118 LEU MD1 3.410 . 5.120 3.739 3.699 3.809 . 0 0 "[ . 1 . 2 . ]" 1 1262 1 118 LEU HA 1 118 LEU MD2 2.600 . 3.500 2.489 2.275 2.636 . 0 0 "[ . 1 . 2 . ]" 1 1263 1 118 LEU HA 1 121 VAL MG2 3.120 . 4.540 3.753 3.598 3.790 . 0 0 "[ . 1 . 2 . ]" 1 1264 1 118 LEU HB3 1 118 LEU MD1 2.610 . 3.530 2.628 2.572 2.699 . 0 0 "[ . 1 . 2 . ]" 1 1265 1 118 LEU HB3 1 118 LEU MD2 2.400 . 3.110 2.097 2.008 2.248 . 0 0 "[ . 1 . 2 . ]" 1 1266 1 118 LEU HB2 1 118 LEU MD1 2.610 . 3.520 2.141 2.029 2.225 . 0 0 "[ . 1 . 2 . ]" 1 1267 1 118 LEU HB2 1 118 LEU MD2 2.700 . 3.700 3.125 3.108 3.155 . 0 0 "[ . 1 . 2 . ]" 1 1268 1 118 LEU HG 1 126 GLY QA 3.750 . 5.800 2.788 2.502 3.205 . 0 0 "[ . 1 . 2 . ]" 1 1269 1 13 LEU HA 1 13 LEU HB3 2.250 . 2.790 2.363 2.316 2.519 . 0 0 "[ . 1 . 2 . ]" 1 1270 1 13 LEU HA 1 13 LEU HB2 2.640 . 3.580 3.002 2.987 3.020 . 0 0 "[ . 1 . 2 . ]" 1 1271 1 13 LEU HA 1 13 LEU MD1 3.330 . 4.950 3.804 3.227 3.907 . 0 0 "[ . 1 . 2 . ]" 1 1272 1 13 LEU HA 1 13 LEU MD2 2.520 . 3.350 2.167 1.893 2.356 . 0 0 "[ . 1 . 2 . ]" 1 1273 1 13 LEU HB3 1 13 LEU MD1 2.290 . 2.870 2.287 2.075 2.373 . 0 0 "[ . 1 . 2 . ]" 1 1274 1 13 LEU HB3 1 13 LEU MD2 2.690 . 3.690 2.498 2.407 2.919 . 0 0 "[ . 1 . 2 . ]" 1 1275 1 13 LEU HB2 1 13 LEU MD1 2.920 . 4.130 2.430 2.310 2.869 . 0 0 "[ . 1 . 2 . ]" 1 1276 1 13 LEU HB3 1 13 LEU HG 2.320 . 2.940 2.990 2.865 3.004 0.064 10 0 "[ . 1 . 2 . ]" 1 1277 1 13 LEU H 1 13 LEU HG 2.460 . 3.210 2.092 1.943 2.910 . 0 0 "[ . 1 . 2 . ]" 1 1278 1 137 ILE HA 1 138 LEU HA 3.250 . 4.790 4.643 4.593 4.774 . 0 0 "[ . 1 . 2 . ]" 1 1279 1 137 ILE MG 1 138 LEU HA 3.660 . 5.620 3.180 3.016 3.338 . 0 0 "[ . 1 . 2 . ]" 1 1280 1 138 LEU HA 1 138 LEU HB3 2.210 . 2.710 2.619 2.476 2.698 . 0 0 "[ . 1 . 2 . ]" 1 1281 1 138 LEU HA 1 138 LEU HB2 2.730 . 3.750 2.989 2.959 3.022 . 0 0 "[ . 1 . 2 . ]" 1 1282 1 138 LEU HA 1 138 LEU MD1 3.080 . 4.460 3.310 2.988 3.746 . 0 0 "[ . 1 . 2 . ]" 1 1283 1 138 LEU HA 1 138 LEU MD2 2.970 . 4.240 3.320 2.541 3.539 . 0 0 "[ . 1 . 2 . ]" 1 1284 1 138 LEU HB3 1 138 LEU MD2 3.050 . 4.400 2.120 2.053 2.185 . 0 0 "[ . 1 . 2 . ]" 1 1285 1 138 LEU HB2 1 138 LEU MD1 2.270 . 2.850 2.129 1.919 2.218 . 0 0 "[ . 1 . 2 . ]" 1 1286 1 134 VAL MG1 1 138 LEU MD1 3.680 . 5.660 1.898 1.765 2.062 . 0 0 "[ . 1 . 2 . ]" 1 1287 1 138 LEU HB2 1 138 LEU MD2 3.170 . 4.640 2.783 2.639 3.109 . 0 0 "[ . 1 . 2 . ]" 1 1288 1 14 PHE QD 1 30 LEU HA 2.970 . 4.240 3.384 2.610 3.798 . 0 0 "[ . 1 . 2 . ]" 1 1289 1 30 LEU HA 1 30 LEU HB3 2.520 . 3.330 2.986 2.975 2.995 . 0 0 "[ . 1 . 2 . ]" 1 1290 1 30 LEU HA 1 30 LEU HB2 1.980 . 2.270 2.312 2.294 2.326 0.056 7 0 "[ . 1 . 2 . ]" 1 1291 1 30 LEU HA 1 30 LEU MD1 2.580 . 3.460 2.380 2.185 2.509 . 0 0 "[ . 1 . 2 . ]" 1 1292 1 30 LEU HB3 1 30 LEU MD2 2.970 . 4.240 2.297 2.208 2.387 . 0 0 "[ . 1 . 2 . ]" 1 1293 1 30 LEU HB3 1 30 LEU HG 2.540 . 3.370 2.484 2.449 2.503 . 0 0 "[ . 1 . 2 . ]" 1 1294 1 30 LEU HB2 1 30 LEU MD2 3.060 . 4.420 2.402 2.278 2.473 . 0 0 "[ . 1 . 2 . ]" 1 1295 1 30 LEU MD1 1 33 ALA MB 3.600 . 5.500 3.207 3.009 3.392 . 0 0 "[ . 1 . 2 . ]" 1 1296 1 14 PHE QD 1 30 LEU MD1 3.730 . 6.000 2.613 1.918 3.487 . 0 0 "[ . 1 . 2 . ]" 1 1297 1 30 LEU HB3 1 30 LEU MD1 3.140 . 4.580 3.196 3.190 3.202 . 0 0 "[ . 1 . 2 . ]" 1 1298 1 30 LEU MD1 1 30 LEU MD2 2.860 . 4.020 2.049 1.972 2.089 . 0 0 "[ . 1 . 2 . ]" 1 1299 1 14 PHE QD 1 30 LEU MD2 3.730 . 6.000 3.629 3.112 4.206 . 0 0 "[ . 1 . 2 . ]" 1 1300 1 30 LEU MD2 1 30 LEU HG 2.430 . 3.160 2.120 2.101 2.128 . 0 0 "[ . 1 . 2 . ]" 1 1301 1 30 LEU MD1 1 31 LEU HA 3.270 . 4.830 3.959 3.738 4.038 . 0 0 "[ . 1 . 2 . ]" 1 1302 1 31 LEU HA 1 31 LEU HB3 2.350 . 3.000 2.517 2.480 2.569 . 0 0 "[ . 1 . 2 . ]" 1 1303 1 31 LEU HA 1 31 LEU HB2 2.650 . 3.610 3.016 3.006 3.024 . 0 0 "[ . 1 . 2 . ]" 1 1304 1 31 LEU HA 1 31 LEU MD2 2.550 . 3.400 2.267 2.041 2.440 . 0 0 "[ . 1 . 2 . ]" 1 1305 1 31 LEU HA 1 31 LEU HG 2.830 . 3.960 2.790 2.736 2.882 . 0 0 "[ . 1 . 2 . ]" 1 1306 1 31 LEU HB3 1 31 LEU MD1 2.660 . 3.620 2.597 2.466 2.699 . 0 0 "[ . 1 . 2 . ]" 1 1307 1 31 LEU HB3 1 31 LEU MD2 2.460 . 3.230 2.224 2.135 2.342 . 0 0 "[ . 1 . 2 . ]" 1 1308 1 31 LEU HB2 1 31 LEU MD1 2.330 . 2.960 2.161 2.076 2.288 . 0 0 "[ . 1 . 2 . ]" 1 1309 1 40 LEU HA 1 40 LEU QB 2.230 . 2.750 2.459 2.451 2.468 . 0 0 "[ . 1 . 2 . ]" 1 1310 1 40 LEU HA 1 40 LEU MD2 2.850 . 4.000 2.187 2.087 2.351 . 0 0 "[ . 1 . 2 . ]" 1 1311 1 40 LEU QB 1 40 LEU MD2 2.580 . 3.470 2.454 2.407 2.488 . 0 0 "[ . 1 . 2 . ]" 1 1312 1 40 LEU QB 1 40 LEU MD1 2.640 . 3.580 2.188 2.099 2.237 . 0 0 "[ . 1 . 2 . ]" 1 1313 1 40 LEU H 1 40 LEU HG 2.650 . 3.600 3.665 3.624 3.704 0.104 10 0 "[ . 1 . 2 . ]" 1 1314 1 50 LEU HA 1 50 LEU MD2 3.470 . 5.240 3.180 2.570 3.651 . 0 0 "[ . 1 . 2 . ]" 1 1315 1 50 LEU HA 1 51 PRO QD 2.670 . 3.630 2.119 2.041 2.161 . 0 0 "[ . 1 . 2 . ]" 1 1316 1 46 ILE HA 1 50 LEU MD1 3.850 . 6.000 4.590 3.783 5.038 . 0 0 "[ . 1 . 2 . ]" 1 1317 1 50 LEU MD1 1 50 LEU MD2 2.670 . 3.640 2.028 1.956 2.089 . 0 0 "[ . 1 . 2 . ]" 1 1318 1 46 ILE HA 1 50 LEU MD2 3.650 . 5.590 3.975 3.229 4.695 . 0 0 "[ . 1 . 2 . ]" 1 1319 1 50 LEU HB3 1 50 LEU HG 2.460 . 3.210 2.612 2.267 3.014 . 0 0 "[ . 1 . 2 . ]" 1 1320 1 60 LEU HA 1 60 LEU HB3 2.240 . 2.780 2.571 2.531 2.621 . 0 0 "[ . 1 . 2 . ]" 1 1321 1 60 LEU HA 1 60 LEU HB2 2.490 . 3.280 3.004 2.992 3.011 . 0 0 "[ . 1 . 2 . ]" 1 1322 1 60 LEU HA 1 60 LEU MD2 2.600 . 3.500 1.938 1.878 2.004 . 0 0 "[ . 1 . 2 . ]" 1 1323 1 60 LEU HA 1 63 LEU HB2 2.800 . 3.900 3.125 2.317 3.598 . 0 0 "[ . 1 . 2 . ]" 1 1324 1 60 LEU HA 1 63 LEU MD2 3.810 . 5.920 3.446 2.790 4.051 . 0 0 "[ . 1 . 2 . ]" 1 1325 1 60 LEU HB3 1 60 LEU MD1 2.420 . 3.130 2.380 2.196 2.464 . 0 0 "[ . 1 . 2 . ]" 1 1326 1 60 LEU HB3 1 60 LEU MD2 2.520 . 3.340 2.370 2.337 2.433 . 0 0 "[ . 1 . 2 . ]" 1 1327 1 60 LEU HB2 1 60 LEU MD1 2.610 . 3.520 2.325 2.220 2.470 . 0 0 "[ . 1 . 2 . ]" 1 1328 1 60 LEU HB2 1 60 LEU MD2 2.980 . 4.260 3.202 3.200 3.205 . 0 0 "[ . 1 . 2 . ]" 1 1329 1 60 LEU MD2 1 63 LEU MD2 3.480 . 5.260 2.741 2.000 3.348 . 0 0 "[ . 1 . 2 . ]" 1 1330 1 60 LEU HA 1 60 LEU HG 2.350 . 3.000 2.950 2.927 2.979 . 0 0 "[ . 1 . 2 . ]" 1 1331 1 60 LEU MD1 1 60 LEU HG 2.380 . 3.070 2.117 2.097 2.125 . 0 0 "[ . 1 . 2 . ]" 1 1332 1 63 LEU HA 1 63 LEU HB3 2.950 . 4.200 2.989 2.938 3.017 . 0 0 "[ . 1 . 2 . ]" 1 1333 1 63 LEU HA 1 63 LEU HB2 2.290 . 2.880 2.604 2.451 2.729 . 0 0 "[ . 1 . 2 . ]" 1 1334 1 63 LEU HA 1 63 LEU MD1 2.710 . 3.710 2.853 2.476 3.086 . 0 0 "[ . 1 . 2 . ]" 1 1335 1 63 LEU HA 1 63 LEU MD2 3.850 . 6.000 3.680 3.486 3.896 . 0 0 "[ . 1 . 2 . ]" 1 1336 1 63 LEU HA 1 63 LEU HG 3.090 . 4.480 2.362 2.158 2.762 . 0 0 "[ . 1 . 2 . ]" 1 1337 1 60 LEU HA 1 63 LEU HB3 2.370 . 3.040 2.624 2.202 2.943 . 0 0 "[ . 1 . 2 . ]" 1 1338 1 63 LEU HB2 1 63 LEU MD1 2.330 . 2.950 2.063 1.961 2.164 . 0 0 "[ . 1 . 2 . ]" 1 1339 1 63 LEU HB2 1 63 LEU MD2 2.830 . 3.960 2.842 2.661 2.945 . 0 0 "[ . 1 . 2 . ]" 1 1340 1 63 LEU HB2 1 63 LEU HG 2.350 . 3.000 2.902 2.836 2.979 . 0 0 "[ . 1 . 2 . ]" 1 1341 1 59 PHE QD 1 63 LEU MD1 3.370 . 5.290 2.644 2.085 3.393 . 0 0 "[ . 1 . 2 . ]" 1 1342 1 63 LEU MD2 1 63 LEU HG 2.480 . 3.270 2.121 2.090 2.129 . 0 0 "[ . 1 . 2 . ]" 1 1343 1 7 TYR QD 1 63 LEU MD2 3.850 . 6.000 3.612 2.620 4.346 . 0 0 "[ . 1 . 2 . ]" 1 1344 1 98 LEU HA 1 98 LEU HB3 2.880 . 4.050 2.704 2.644 2.772 . 0 0 "[ . 1 . 2 . ]" 1 1345 1 98 LEU HA 1 98 LEU HB2 2.330 . 2.970 2.247 2.227 2.269 . 0 0 "[ . 1 . 2 . ]" 1 1346 1 98 LEU HA 1 98 LEU MD1 3.060 . 4.420 3.200 2.982 3.360 . 0 0 "[ . 1 . 2 . ]" 1 1347 1 98 LEU HB3 1 98 LEU MD2 2.740 . 3.780 2.077 2.053 2.129 . 0 0 "[ . 1 . 2 . ]" 1 1348 1 98 LEU HB2 1 98 LEU MD1 2.350 . 3.000 2.137 2.077 2.222 . 0 0 "[ . 1 . 2 . ]" 1 1349 1 98 LEU MD1 1 102 LEU MD1 3.850 . 6.000 1.850 1.736 2.058 . 0 0 "[ . 1 . 2 . ]" 1 1350 1 93 ILE MG 1 98 LEU MD2 3.850 . 6.000 2.738 2.402 3.079 . 0 0 "[ . 1 . 2 . ]" 1 1351 1 98 LEU HB2 1 98 LEU MD2 2.480 . 3.270 2.603 2.516 2.649 . 0 0 "[ . 1 . 2 . ]" 1 1352 1 98 LEU HB3 1 98 LEU HG 2.750 . 3.810 2.595 2.530 2.628 . 0 0 "[ . 1 . 2 . ]" 1 1353 1 95 VAL HB 1 98 LEU HG 3.240 . 4.780 4.759 4.623 4.819 0.039 8 0 "[ . 1 . 2 . ]" 1 1354 1 95 VAL MG1 1 98 LEU HG 3.100 . 4.500 2.256 2.039 2.573 . 0 0 "[ . 1 . 2 . ]" 1 1355 1 114 MET HA 1 117 LEU MD2 3.270 . 4.840 1.892 1.792 2.031 . 0 0 "[ . 1 . 2 . ]" 1 1356 1 111 ASN HA 1 114 MET QB 3.690 . 5.670 3.820 2.498 4.104 . 0 0 "[ . 1 . 2 . ]" 1 1357 1 95 VAL MG1 1 114 MET QB 3.850 . 6.000 2.024 1.754 2.493 . 0 0 "[ . 1 . 2 . ]" 1 1358 1 127 MET HA 1 127 MET HB3 2.330 . 2.970 2.903 2.839 2.933 . 0 0 "[ . 1 . 2 . ]" 1 1359 1 127 MET HA 1 127 MET QG 3.080 . 4.460 2.998 2.891 3.426 . 0 0 "[ . 1 . 2 . ]" 1 1360 1 123 VAL MG2 1 127 MET HA 3.540 . 5.380 4.279 3.956 4.487 . 0 0 "[ . 1 . 2 . ]" 1 1361 1 127 MET HA 1 128 VAL HB 3.140 . 4.580 4.669 4.649 4.692 0.112 22 0 "[ . 1 . 2 . ]" 1 1362 1 127 MET HB3 1 127 MET QG 2.450 . 3.200 2.316 2.159 2.392 . 0 0 "[ . 1 . 2 . ]" 1 1363 1 127 MET HA 1 127 MET HB2 2.830 . 3.950 2.241 2.226 2.253 . 0 0 "[ . 1 . 2 . ]" 1 1364 1 127 MET HB2 1 127 MET QG 2.550 . 3.400 2.355 2.293 2.412 . 0 0 "[ . 1 . 2 . ]" 1 1365 1 136 MET HA 1 139 ALA MB 3.200 . 4.700 2.884 2.085 3.906 . 0 0 "[ . 1 . 2 . ]" 1 1366 1 136 MET HA 1 136 MET HB3 2.460 . 3.220 3.018 3.009 3.025 . 0 0 "[ . 1 . 2 . ]" 1 1367 1 136 MET HA 1 136 MET HB2 2.720 . 3.740 2.532 2.459 2.591 . 0 0 "[ . 1 . 2 . ]" 1 1368 1 136 MET HA 1 136 MET QG 2.850 . 4.000 2.378 2.192 3.027 . 0 0 "[ . 1 . 2 . ]" 1 1369 1 55 ASP HB2 1 56 MET HA 3.270 . 4.840 4.572 4.542 4.622 . 0 0 "[ . 1 . 2 . ]" 1 1370 1 11 PHE QE 1 56 MET HA 3.020 . 4.590 3.481 3.057 3.635 . 0 0 "[ . 1 . 2 . ]" 1 1371 1 56 MET HA 1 59 PHE QD 3.270 . 4.830 1.892 1.825 1.966 . 0 0 "[ . 1 . 2 . ]" 1 1372 1 56 MET HA 1 56 MET QG 2.250 . 2.800 2.240 2.095 2.359 . 0 0 "[ . 1 . 2 . ]" 1 1373 1 56 MET QB 1 60 LEU MD1 3.850 . 6.000 2.957 2.586 3.338 . 0 0 "[ . 1 . 2 . ]" 1 1374 1 71 MET H 1 71 MET QG 3.850 . 6.000 3.934 1.920 4.366 . 0 0 "[ . 1 . 2 . ]" 1 1375 1 92 MET HA 1 93 ILE HB 3.450 . 5.200 4.232 4.020 4.330 . 0 0 "[ . 1 . 2 . ]" 1 1376 1 92 MET HA 1 129 ASN HA 2.270 . 2.850 2.659 2.038 2.876 0.026 3 0 "[ . 1 . 2 . ]" 1 1377 1 91 GLY QA 1 92 MET QB 3.850 . 6.000 3.997 3.721 4.164 . 0 0 "[ . 1 . 2 . ]" 1 1378 1 111 ASN HA 1 115 ASP H 3.060 . 4.420 3.948 3.758 4.041 . 0 0 "[ . 1 . 2 . ]" 1 1379 1 111 ASN HA 1 111 ASN QB 2.150 . 2.610 2.281 2.178 2.404 . 0 0 "[ . 1 . 2 . ]" 1 1380 1 129 ASN HA 1 129 ASN HB3 2.450 . 3.200 3.013 2.991 3.028 . 0 0 "[ . 1 . 2 . ]" 1 1381 1 129 ASN HA 1 129 ASN HB2 2.350 . 3.000 2.566 2.471 2.629 . 0 0 "[ . 1 . 2 . ]" 1 1382 1 140 ASN HA 1 140 ASN QB 2.220 . 2.740 2.289 2.164 2.416 . 0 0 "[ . 1 . 2 . ]" 1 1383 1 37 ASN HA 1 37 ASN QB 2.300 . 2.900 2.257 2.178 2.504 . 0 0 "[ . 1 . 2 . ]" 1 1384 1 37 ASN HA 1 38 PRO QD 2.750 . 3.790 1.991 1.958 2.070 . 0 0 "[ . 1 . 2 . ]" 1 1385 1 64 ASN HA 1 64 ASN HB3 2.210 . 2.710 2.525 2.331 2.707 . 0 0 "[ . 1 . 2 . ]" 1 1386 1 64 ASN HA 1 64 ASN HB2 2.480 . 3.250 3.016 2.967 3.032 . 0 0 "[ . 1 . 2 . ]" 1 1387 1 67 ASN HA 1 67 ASN QB 2.150 . 2.600 2.337 2.170 2.417 . 0 0 "[ . 1 . 2 . ]" 1 1388 1 122 PRO HA 1 122 PRO QB 2.020 . 2.350 2.172 2.169 2.176 . 0 0 "[ . 1 . 2 . ]" 1 1389 1 121 VAL HA 1 122 PRO QD 2.540 . 3.380 1.972 1.774 1.999 . 0 0 "[ . 1 . 2 . ]" 1 1390 1 121 VAL MG1 1 122 PRO QD 3.850 . 6.000 2.160 1.984 2.404 . 0 0 "[ . 1 . 2 . ]" 1 1391 1 121 VAL MG2 1 122 PRO QD 3.850 . 6.000 3.582 3.375 3.733 . 0 0 "[ . 1 . 2 . ]" 1 1392 1 23 PRO HA 1 23 PRO QB 2.400 . 3.100 2.186 2.179 2.189 . 0 0 "[ . 1 . 2 . ]" 1 1393 1 23 PRO HA 1 23 PRO QG 2.930 . 4.160 3.520 3.364 3.535 . 0 0 "[ . 1 . 2 . ]" 1 1394 1 38 PRO HA 1 38 PRO QB 2.240 . 2.780 2.190 2.187 2.193 . 0 0 "[ . 1 . 2 . ]" 1 1395 1 51 PRO HA 1 51 PRO QB 2.210 . 2.730 2.245 2.231 2.253 . 0 0 "[ . 1 . 2 . ]" 1 1396 1 51 PRO QB 1 52 ALA HA 3.700 . 5.700 4.797 4.622 4.865 . 0 0 "[ . 1 . 2 . ]" 1 1397 1 50 LEU HB3 1 51 PRO QD 3.700 . 5.700 2.081 1.913 2.293 . 0 0 "[ . 1 . 2 . ]" 1 1398 1 50 LEU HB2 1 51 PRO QD 3.850 . 6.000 3.074 2.673 3.307 . 0 0 "[ . 1 . 2 . ]" 1 1399 1 51 PRO QD 1 58 GLN HB3 3.850 . 6.000 3.921 3.689 4.398 . 0 0 "[ . 1 . 2 . ]" 1 1400 1 6 PRO HA 1 6 PRO QB 2.340 . 2.980 2.178 2.170 2.189 . 0 0 "[ . 1 . 2 . ]" 1 1401 1 6 PRO HA 1 6 PRO QG 2.950 . 4.200 3.428 3.083 3.521 . 0 0 "[ . 1 . 2 . ]" 1 1402 1 5 SER HA 1 6 PRO QD 2.840 . 3.980 3.535 3.499 3.551 . 0 0 "[ . 1 . 2 . ]" 1 1403 1 5 SER HB3 1 6 PRO QD 3.060 . 4.420 1.944 1.872 2.009 . 0 0 "[ . 1 . 2 . ]" 1 1404 1 5 SER HB2 1 6 PRO QD 3.850 . 6.000 3.015 2.877 3.121 . 0 0 "[ . 1 . 2 . ]" 1 1405 1 72 PRO HA 1 72 PRO QB 2.190 . 2.690 2.238 2.210 2.249 . 0 0 "[ . 1 . 2 . ]" 1 1406 1 71 MET HA 1 72 PRO QD 2.950 . 4.200 3.556 3.524 3.582 . 0 0 "[ . 1 . 2 . ]" 1 1407 1 68 GLY H 1 72 PRO QG 3.650 . 5.590 4.007 2.732 4.752 . 0 0 "[ . 1 . 2 . ]" 1 1408 1 71 MET H 1 72 PRO QG 3.850 . 6.000 3.815 3.746 4.047 . 0 0 "[ . 1 . 2 . ]" 1 1409 1 72 PRO HA 1 72 PRO QG 2.570 . 3.440 2.859 2.801 2.989 . 0 0 "[ . 1 . 2 . ]" 1 1410 1 75 PRO HA 1 75 PRO QB 2.270 . 2.850 2.219 2.182 2.236 . 0 0 "[ . 1 . 2 . ]" 1 1411 1 75 PRO QB 1 76 GLU H 3.850 . 6.000 2.481 2.092 2.651 . 0 0 "[ . 1 . 2 . ]" 1 1412 1 75 PRO HA 1 75 PRO QG 2.670 . 3.630 2.944 2.843 3.219 . 0 0 "[ . 1 . 2 . ]" 1 1413 1 135 GLN HA 1 137 ILE HB 3.560 . 5.420 5.211 4.923 5.423 0.003 6 0 "[ . 1 . 2 . ]" 1 1414 1 135 GLN HA 1 138 LEU MD1 3.850 . 6.000 4.081 3.244 4.915 . 0 0 "[ . 1 . 2 . ]" 1 1415 1 135 GLN HA 1 135 GLN QB 2.310 . 2.930 2.361 2.321 2.400 . 0 0 "[ . 1 . 2 . ]" 1 1416 1 135 GLN HA 1 135 GLN QG 3.360 . 5.020 2.581 2.287 3.118 . 0 0 "[ . 1 . 2 . ]" 1 1417 1 36 GLN HA 1 36 GLN QG 2.500 . 3.310 2.184 2.001 2.633 . 0 0 "[ . 1 . 2 . ]" 1 1418 1 32 ARG HB2 1 36 GLN HA 2.830 . 3.960 3.849 3.523 4.015 0.055 10 0 "[ . 1 . 2 . ]" 1 1419 1 36 GLN HB3 1 37 ASN H 3.440 . 5.170 2.512 2.277 2.863 . 0 0 "[ . 1 . 2 . ]" 1 1420 1 36 GLN HB2 1 36 GLN QG 2.570 . 3.440 2.239 2.129 2.457 . 0 0 "[ . 1 . 2 . ]" 1 1421 1 50 LEU HB2 1 58 GLN HA 3.070 . 4.440 4.490 4.456 4.555 0.115 26 0 "[ . 1 . 2 . ]" 1 1422 1 58 GLN HA 1 58 GLN HB3 2.580 . 3.460 2.674 2.464 2.727 . 0 0 "[ . 1 . 2 . ]" 1 1423 1 58 GLN HA 1 58 GLN QG 2.440 . 3.180 2.342 2.129 2.840 . 0 0 "[ . 1 . 2 . ]" 1 1424 1 50 LEU HB3 1 58 GLN HB3 2.420 . 3.150 3.167 3.054 3.220 0.070 4 0 "[ . 1 . 2 . ]" 1 1425 1 58 GLN HB3 1 58 GLN QG 2.580 . 3.460 2.166 2.132 2.517 . 0 0 "[ . 1 . 2 . ]" 1 1426 1 54 VAL MG1 1 58 GLN HB3 2.730 . 3.750 2.089 1.901 2.377 . 0 0 "[ . 1 . 2 . ]" 1 1427 1 54 VAL MG2 1 58 GLN HB3 2.730 . 3.750 2.908 2.843 3.004 . 0 0 "[ . 1 . 2 . ]" 1 1428 1 58 GLN HA 1 58 GLN HB2 2.480 . 3.250 2.969 2.950 3.021 . 0 0 "[ . 1 . 2 . ]" 1 1429 1 58 GLN HB2 1 58 GLN QG 2.220 . 2.740 2.355 2.130 2.458 . 0 0 "[ . 1 . 2 . ]" 1 1430 1 54 VAL MG1 1 58 GLN HB2 2.970 . 4.240 2.773 2.178 2.929 . 0 0 "[ . 1 . 2 . ]" 1 1431 1 55 ASP H 1 58 GLN QG 3.850 . 6.000 3.206 1.775 3.544 . 0 0 "[ . 1 . 2 . ]" 1 1432 1 61 GLN QB 1 61 GLN QG 2.210 . 2.710 2.028 1.997 2.080 . 0 0 "[ . 1 . 2 . ]" 1 1433 1 61 GLN HA 1 61 GLN QG 2.510 . 3.320 2.371 2.066 2.966 . 0 0 "[ . 1 . 2 . ]" 1 1434 1 83 GLN HA 1 83 GLN QG 3.690 . 5.670 2.420 2.064 3.384 . 0 0 "[ . 1 . 2 . ]" 1 1435 1 83 GLN HA 1 84 VAL H 3.580 . 5.460 2.665 2.364 3.501 . 0 0 "[ . 1 . 2 . ]" 1 1436 1 9 GLN HA 1 9 GLN QG 2.500 . 3.310 2.305 2.066 2.900 . 0 0 "[ . 1 . 2 . ]" 1 1437 1 16 ARG HA 1 16 ARG QG 2.560 . 3.410 2.602 2.298 3.037 . 0 0 "[ . 1 . 2 . ]" 1 1438 1 16 ARG HA 1 16 ARG QB 2.460 . 3.220 2.456 2.351 2.541 . 0 0 "[ . 1 . 2 . ]" 1 1439 1 11 PHE HZ 1 21 ARG HA 2.810 . 4.170 2.271 2.025 2.568 . 0 0 "[ . 1 . 2 . ]" 1 1440 1 21 ARG HA 1 21 ARG QB 2.290 . 2.870 2.291 2.188 2.338 . 0 0 "[ . 1 . 2 . ]" 1 1441 1 21 ARG HA 1 21 ARG QG 2.560 . 3.430 2.594 2.475 2.905 . 0 0 "[ . 1 . 2 . ]" 1 1442 1 32 ARG HA 1 34 CYS H 3.350 . 5.000 4.146 4.031 4.363 . 0 0 "[ . 1 . 2 . ]" 1 1443 1 32 ARG HA 1 32 ARG HB3 2.720 . 3.740 2.834 2.826 2.840 . 0 0 "[ . 1 . 2 . ]" 1 1444 1 32 ARG HB3 1 33 ALA H 3.380 . 5.060 3.282 3.215 3.377 . 0 0 "[ . 1 . 2 . ]" 1 1445 1 31 LEU H 1 32 ARG HB3 3.520 . 5.330 4.405 4.359 4.438 . 0 0 "[ . 1 . 2 . ]" 1 1446 1 32 ARG HB3 1 38 PRO QD 3.850 . 6.000 5.049 4.623 5.368 . 0 0 "[ . 1 . 2 . ]" 1 1447 1 32 ARG HB3 1 32 ARG QD 2.920 . 4.140 2.764 2.251 3.374 . 0 0 "[ . 1 . 2 . ]" 1 1448 1 99 ARG HA 1 102 LEU HB2 2.750 . 3.810 2.683 2.401 3.152 . 0 0 "[ . 1 . 2 . ]" 1 1449 1 99 ARG HA 1 99 ARG QB 2.480 . 3.250 2.282 2.176 2.539 . 0 0 "[ . 1 . 2 . ]" 1 1450 1 99 ARG HA 1 99 ARG QG 2.810 . 3.930 2.864 2.201 3.462 . 0 0 "[ . 1 . 2 . ]" 1 1451 1 99 ARG QB 1 99 ARG QD 3.100 . 4.500 2.130 1.921 2.604 . 0 0 "[ . 1 . 2 . ]" 1 1452 1 104 SER HA 1 104 SER QB 2.150 . 2.600 2.323 2.183 2.368 . 0 0 "[ . 1 . 2 . ]" 1 1453 1 110 SER HA 1 110 SER HB3 2.120 . 2.540 2.478 2.243 2.531 . 0 0 "[ . 1 . 2 . ]" 1 1454 1 11 PHE QD 1 12 SER HA 3.170 . 4.880 2.786 2.679 2.883 . 0 0 "[ . 1 . 2 . ]" 1 1455 1 12 SER QB 1 13 LEU H 3.810 . 5.920 2.823 2.696 3.453 . 0 0 "[ . 1 . 2 . ]" 1 1456 1 14 PHE QD 1 26 SER QB 3.220 . 4.990 3.899 3.026 4.005 . 0 0 "[ . 1 . 2 . ]" 1 1457 1 22 ILE MD 1 26 SER QB 3.850 . 6.000 2.686 2.280 3.164 . 0 0 "[ . 1 . 2 . ]" 1 1458 1 5 SER HA 1 5 SER HB3 2.370 . 3.040 3.005 2.999 3.013 . 0 0 "[ . 1 . 2 . ]" 1 1459 1 5 SER HA 1 7 TYR H 3.070 . 4.440 4.171 3.952 4.428 . 0 0 "[ . 1 . 2 . ]" 1 1460 1 4 ASP HA 1 5 SER HB3 3.290 . 4.880 4.889 4.840 4.922 0.042 20 0 "[ . 1 . 2 . ]" 1 1461 1 4 ASP HA 1 5 SER HB2 3.120 . 4.540 4.474 4.356 4.587 0.047 20 0 "[ . 1 . 2 . ]" 1 1462 1 5 SER HA 1 5 SER HB2 2.170 . 2.650 2.595 2.575 2.613 . 0 0 "[ . 1 . 2 . ]" 1 1463 1 103 THR HB 1 104 SER H 2.970 . 4.240 2.975 2.596 3.739 . 0 0 "[ . 1 . 2 . ]" 1 1464 1 103 THR HB 1 103 THR MG 2.370 . 3.040 2.101 2.069 2.119 . 0 0 "[ . 1 . 2 . ]" 1 1465 1 103 THR H 1 103 THR HB 2.960 . 4.220 2.774 2.392 3.618 . 0 0 "[ . 1 . 2 . ]" 1 1466 1 103 THR HA 1 103 THR MG 2.590 . 3.480 2.386 2.202 2.531 . 0 0 "[ . 1 . 2 . ]" 1 1467 1 19 THR HA 1 20 GLY H 3.440 . 5.170 3.363 2.910 3.537 . 0 0 "[ . 1 . 2 . ]" 1 1468 1 19 THR HA 1 19 THR MG 2.340 . 2.980 2.364 2.226 2.459 . 0 0 "[ . 1 . 2 . ]" 1 1469 1 19 THR HB 1 19 THR MG 2.440 . 3.170 2.099 2.079 2.120 . 0 0 "[ . 1 . 2 . ]" 1 1470 1 17 HIS HB2 1 19 THR MG 3.310 . 4.910 3.169 2.273 4.107 . 0 0 "[ . 1 . 2 . ]" 1 1471 1 1 SER QB 1 2 THR HA 3.850 . 6.000 4.317 3.954 5.090 . 0 0 "[ . 1 . 2 . ]" 1 1472 1 25 THR HA 1 29 ASP H 3.430 . 5.160 4.898 4.649 5.082 . 0 0 "[ . 1 . 2 . ]" 1 1473 1 25 THR HA 1 28 GLY QA 3.580 . 5.460 4.189 3.993 4.359 . 0 0 "[ . 1 . 2 . ]" 1 1474 1 25 THR HA 1 25 THR HB 2.250 . 2.800 2.510 2.432 2.568 . 0 0 "[ . 1 . 2 . ]" 1 1475 1 25 THR HA 1 25 THR MG 2.440 . 3.170 2.326 2.213 2.392 . 0 0 "[ . 1 . 2 . ]" 1 1476 1 25 THR HB 1 25 THR MG 2.440 . 3.190 2.098 2.074 2.118 . 0 0 "[ . 1 . 2 . ]" 1 1477 1 39 THR HA 1 39 THR HB 2.170 . 2.630 2.619 2.583 2.668 0.038 6 0 "[ . 1 . 2 . ]" 1 1478 1 39 THR HA 1 39 THR MG 2.460 . 3.220 2.277 2.141 2.321 . 0 0 "[ . 1 . 2 . ]" 1 1479 1 39 THR HB 1 39 THR MG 2.350 . 3.000 2.111 2.081 2.118 . 0 0 "[ . 1 . 2 . ]" 1 1480 1 43 ILE HB 1 44 THR HA 3.140 . 4.580 3.940 3.894 3.982 . 0 0 "[ . 1 . 2 . ]" 1 1481 1 44 THR HA 1 44 THR HB 2.530 . 3.360 3.030 3.028 3.033 . 0 0 "[ . 1 . 2 . ]" 1 1482 1 44 THR HA 1 44 THR MG 2.490 . 3.280 2.393 2.303 2.452 . 0 0 "[ . 1 . 2 . ]" 1 1483 1 49 THR HA 1 49 THR MG 2.380 . 3.060 2.275 2.160 2.554 . 0 0 "[ . 1 . 2 . ]" 1 1484 1 90 THR HA 1 90 THR MG 3.100 . 4.500 2.509 2.124 3.242 . 0 0 "[ . 1 . 2 . ]" 1 1485 1 81 GLY QA 1 101 VAL HA 3.450 . 5.200 4.643 4.304 4.728 . 0 0 "[ . 1 . 2 . ]" 1 1486 1 101 VAL HA 1 104 SER QB 3.290 . 4.880 3.357 2.665 4.121 . 0 0 "[ . 1 . 2 . ]" 1 1487 1 101 VAL HA 1 101 VAL HB 2.770 . 3.830 3.018 3.001 3.025 . 0 0 "[ . 1 . 2 . ]" 1 1488 1 101 VAL HA 1 101 VAL MG1 2.770 . 3.830 2.301 2.130 2.438 . 0 0 "[ . 1 . 2 . ]" 1 1489 1 101 VAL HB 1 101 VAL MG2 2.490 . 3.280 2.095 2.088 2.111 . 0 0 "[ . 1 . 2 . ]" 1 1490 1 101 VAL MG1 1 101 VAL MG2 2.700 . 3.700 1.947 1.876 2.071 . 0 0 "[ . 1 . 2 . ]" 1 1491 1 84 VAL MG2 1 101 VAL MG1 3.850 . 6.000 3.370 2.242 4.174 . 0 0 "[ . 1 . 2 . ]" 1 1492 1 81 GLY QA 1 101 VAL MG2 3.850 . 6.000 2.875 2.093 3.328 . 0 0 "[ . 1 . 2 . ]" 1 1493 1 101 VAL HA 1 101 VAL MG2 2.570 . 3.440 2.483 2.415 2.591 . 0 0 "[ . 1 . 2 . ]" 1 1494 1 84 VAL MG2 1 101 VAL MG2 3.470 . 5.240 2.353 1.790 3.230 . 0 0 "[ . 1 . 2 . ]" 1 1495 1 100 TYR QD 1 101 VAL MG2 3.440 . 5.420 2.526 2.271 2.822 . 0 0 "[ . 1 . 2 . ]" 1 1496 1 121 VAL HA 1 122 PRO QG 3.040 . 4.370 3.879 3.665 3.914 . 0 0 "[ . 1 . 2 . ]" 1 1497 1 121 VAL HA 1 121 VAL HB 2.580 . 3.460 3.022 3.014 3.027 . 0 0 "[ . 1 . 2 . ]" 1 1498 1 121 VAL HA 1 121 VAL MG2 2.690 . 3.670 2.419 2.279 2.490 . 0 0 "[ . 1 . 2 . ]" 1 1499 1 121 VAL HB 1 128 VAL MG2 3.420 . 5.130 3.484 3.281 3.704 . 0 0 "[ . 1 . 2 . ]" 1 1500 1 121 VAL H 1 121 VAL MG1 3.110 . 4.520 3.796 3.773 3.813 . 0 0 "[ . 1 . 2 . ]" 1 1501 1 123 VAL HA 1 123 VAL HB 2.660 . 3.620 2.507 2.478 2.599 . 0 0 "[ . 1 . 2 . ]" 1 1502 1 123 VAL HA 1 123 VAL MG1 2.730 . 3.770 2.435 2.160 3.195 . 0 0 "[ . 1 . 2 . ]" 1 1503 1 123 VAL HA 1 123 VAL MG2 2.790 . 3.890 3.041 2.061 3.214 . 0 0 "[ . 1 . 2 . ]" 1 1504 1 123 VAL MG1 1 123 VAL MG2 2.330 . 2.960 2.059 2.017 2.075 . 0 0 "[ . 1 . 2 . ]" 1 1505 1 128 VAL HA 1 128 VAL HB 2.520 . 3.350 3.021 3.018 3.024 . 0 0 "[ . 1 . 2 . ]" 1 1506 1 128 VAL HA 1 128 VAL MG1 2.590 . 3.480 2.248 2.213 2.280 . 0 0 "[ . 1 . 2 . ]" 1 1507 1 121 VAL MG1 1 128 VAL MG2 3.850 . 6.000 1.880 1.796 2.017 . 0 0 "[ . 1 . 2 . ]" 1 1508 1 134 VAL HA 1 137 ILE HB 2.840 . 3.980 2.178 1.842 2.484 . 0 0 "[ . 1 . 2 . ]" 1 1509 1 134 VAL HA 1 137 ILE MG 3.070 . 4.440 3.228 2.902 3.561 . 0 0 "[ . 1 . 2 . ]" 1 1510 1 134 VAL HA 1 134 VAL HB 2.760 . 3.820 3.021 3.015 3.025 . 0 0 "[ . 1 . 2 . ]" 1 1511 1 134 VAL HA 1 134 VAL MG1 2.940 . 4.170 2.273 2.143 2.378 . 0 0 "[ . 1 . 2 . ]" 1 1512 1 134 VAL HA 1 134 VAL MG2 2.650 . 3.600 2.432 2.393 2.503 . 0 0 "[ . 1 . 2 . ]" 1 1513 1 134 VAL HB 1 138 LEU MD1 3.290 . 4.880 3.973 3.681 4.084 . 0 0 "[ . 1 . 2 . ]" 1 1514 1 134 VAL MG1 1 138 LEU MD2 3.670 . 5.630 3.613 3.115 3.925 . 0 0 "[ . 1 . 2 . ]" 1 1515 1 133 PHE QD 1 134 VAL MG2 3.410 . 5.370 3.497 3.196 3.861 . 0 0 "[ . 1 . 2 . ]" 1 1516 1 54 VAL HA 1 54 VAL HB 2.650 . 3.610 3.026 3.024 3.027 . 0 0 "[ . 1 . 2 . ]" 1 1517 1 54 VAL HA 1 54 VAL MG1 2.560 . 3.430 2.421 2.370 2.481 . 0 0 "[ . 1 . 2 . ]" 1 1518 1 50 LEU HB3 1 54 VAL MG2 3.350 . 5.000 4.182 4.165 4.202 . 0 0 "[ . 1 . 2 . ]" 1 1519 1 50 LEU HB2 1 54 VAL MG2 2.910 . 4.120 2.919 2.818 3.002 . 0 0 "[ . 1 . 2 . ]" 1 1520 1 54 VAL HA 1 54 VAL MG2 2.620 . 3.540 2.398 2.367 2.445 . 0 0 "[ . 1 . 2 . ]" 1 1521 1 54 VAL MG1 1 54 VAL MG2 2.560 . 3.420 2.085 2.067 2.095 . 0 0 "[ . 1 . 2 . ]" 1 1522 1 62 VAL HA 1 62 VAL HB 2.740 . 3.780 2.797 2.737 2.826 . 0 0 "[ . 1 . 2 . ]" 1 1523 1 62 VAL HA 1 62 VAL MG1 2.600 . 3.500 2.103 1.918 2.155 . 0 0 "[ . 1 . 2 . ]" 1 1524 1 62 VAL HA 1 62 VAL MG2 2.660 . 3.620 3.048 3.024 3.098 . 0 0 "[ . 1 . 2 . ]" 1 1525 1 62 VAL HB 1 62 VAL MG1 2.490 . 3.280 2.117 2.083 2.125 . 0 0 "[ . 1 . 2 . ]" 1 1526 1 50 LEU HB3 1 62 VAL MG2 3.310 . 4.920 4.062 3.860 4.135 . 0 0 "[ . 1 . 2 . ]" 1 1527 1 50 LEU MD1 1 62 VAL MG2 3.050 . 4.400 2.400 1.601 3.071 0.099 1 0 "[ . 1 . 2 . ]" 1 1528 1 62 VAL MG2 1 63 LEU HB2 3.490 . 5.280 3.891 3.702 4.087 . 0 0 "[ . 1 . 2 . ]" 1 1529 1 78 PHE QD 1 79 VAL HA 2.810 . 4.170 3.614 3.332 3.746 . 0 0 "[ . 1 . 2 . ]" 1 1530 1 79 VAL HA 1 82 PHE QD 3.480 . 5.500 4.232 3.252 4.909 . 0 0 "[ . 1 . 2 . ]" 1 1531 1 79 VAL HA 1 79 VAL HB 2.710 . 3.730 3.025 3.019 3.029 . 0 0 "[ . 1 . 2 . ]" 1 1532 1 79 VAL HA 1 79 VAL MG1 2.890 . 4.080 2.412 2.339 2.462 . 0 0 "[ . 1 . 2 . ]" 1 1533 1 79 VAL HA 1 79 VAL MG2 2.970 . 4.240 2.374 2.274 2.439 . 0 0 "[ . 1 . 2 . ]" 1 1534 1 79 VAL MG1 1 79 VAL MG2 2.520 . 3.350 2.058 1.926 2.093 . 0 0 "[ . 1 . 2 . ]" 1 1535 1 84 VAL HA 1 84 VAL HB 2.500 . 3.290 2.815 2.432 3.030 . 0 0 "[ . 1 . 2 . ]" 1 1536 1 84 VAL HB 1 84 VAL MG2 2.460 . 3.210 2.120 2.082 2.130 . 0 0 "[ . 1 . 2 . ]" 1 1537 1 84 VAL MG1 1 84 VAL MG2 2.460 . 3.220 2.078 1.990 2.096 . 0 0 "[ . 1 . 2 . ]" 1 1538 1 93 ILE MD 1 95 VAL HA 3.290 . 4.880 3.171 2.780 3.442 . 0 0 "[ . 1 . 2 . ]" 1 1539 1 95 VAL HA 1 98 LEU HB3 2.810 . 3.910 2.771 2.340 3.008 . 0 0 "[ . 1 . 2 . ]" 1 1540 1 95 VAL HA 1 98 LEU MD1 3.670 . 5.640 3.937 3.762 4.023 . 0 0 "[ . 1 . 2 . ]" 1 1541 1 95 VAL HA 1 98 LEU HG 3.010 . 4.320 2.540 2.275 2.680 . 0 0 "[ . 1 . 2 . ]" 1 1542 1 95 VAL HA 1 95 VAL HB 2.520 . 3.350 3.021 3.015 3.027 . 0 0 "[ . 1 . 2 . ]" 1 1543 1 95 VAL HA 1 95 VAL MG1 2.620 . 3.540 2.374 2.283 2.447 . 0 0 "[ . 1 . 2 . ]" 1 1544 1 94 GLY QA 1 95 VAL HB 3.500 . 5.300 4.411 4.339 4.480 . 0 0 "[ . 1 . 2 . ]" 1 1545 1 95 VAL MG1 1 95 VAL MG2 2.540 . 3.390 1.994 1.911 2.085 . 0 0 "[ . 1 . 2 . ]" 1 1546 1 100 TYR HA 1 103 THR H 3.650 . 5.600 4.011 3.581 4.410 . 0 0 "[ . 1 . 2 . ]" 1 1547 1 100 TYR HA 1 100 TYR QB 2.350 . 3.000 2.323 2.262 2.361 . 0 0 "[ . 1 . 2 . ]" 1 1548 1 100 TYR HA 1 100 TYR QD 2.440 . 3.420 2.760 2.644 2.938 . 0 0 "[ . 1 . 2 . ]" 1 1549 1 100 TYR QB 1 100 TYR QD 2.920 . 4.380 2.139 2.137 2.144 . 0 0 "[ . 1 . 2 . ]" 1 1550 1 130 TYR HA 1 133 PHE QE 3.280 . 4.860 2.319 2.081 2.779 . 0 0 "[ . 1 . 2 . ]" 1 1551 1 93 ILE MG 1 130 TYR QE 3.850 . 6.000 4.086 3.216 4.487 . 0 0 "[ . 1 . 2 . ]" 1 1552 1 130 TYR QE 1 134 VAL MG1 3.850 . 6.000 4.438 4.322 4.475 . 0 0 "[ . 1 . 2 . ]" 1 1553 1 130 TYR QE 1 134 VAL MG2 3.850 . 6.000 2.766 2.125 3.035 . 0 0 "[ . 1 . 2 . ]" 1 1554 1 130 TYR HA 1 130 TYR QE 3.140 . 4.580 4.147 4.110 4.212 . 0 0 "[ . 1 . 2 . ]" 1 1555 1 7 TYR HA 1 10 ALA MB 3.180 . 4.660 3.161 2.931 3.358 . 0 0 "[ . 1 . 2 . ]" 1 1556 1 7 TYR HA 1 7 TYR HB3 2.570 . 3.440 2.406 2.325 2.532 . 0 0 "[ . 1 . 2 . ]" 1 1557 1 7 TYR HA 1 7 TYR HB2 2.670 . 3.630 3.017 2.996 3.024 . 0 0 "[ . 1 . 2 . ]" 1 1558 1 7 TYR HA 1 7 TYR QD 2.360 . 3.270 2.463 2.059 2.988 . 0 0 "[ . 1 . 2 . ]" 1 1559 1 7 TYR HB3 1 7 TYR QD 2.400 . 3.350 2.632 2.280 2.771 . 0 0 "[ . 1 . 2 . ]" 1 1560 1 7 TYR HB2 1 7 TYR QD 2.260 . 3.070 2.357 2.296 2.712 . 0 0 "[ . 1 . 2 . ]" 1 1561 1 7 TYR QD 1 60 LEU MD2 3.850 . 6.000 3.960 2.974 4.457 . 0 0 "[ . 1 . 2 . ]" 1 1562 1 10 ALA HA 1 13 LEU HB2 2.570 . 3.440 3.203 2.616 3.434 . 0 0 "[ . 1 . 2 . ]" 1 1563 1 10 ALA HA 1 13 LEU MD1 2.860 . 4.020 2.250 2.084 3.340 . 0 0 "[ . 1 . 2 . ]" 1 1564 1 59 PHE HA 1 59 PHE HB3 2.250 . 2.790 2.827 2.822 2.831 0.041 25 0 "[ . 1 . 2 . ]" 1 1565 1 27 ILE HB 1 27 ILE MD 2.880 . 4.050 3.211 3.203 3.218 . 0 0 "[ . 1 . 2 . ]" 1 1566 1 8 LYS QE 1 8 LYS QG 2.790 . 3.880 2.127 1.965 2.301 . 0 0 "[ . 1 . 2 . ]" 1 1567 1 30 LEU HA 1 30 LEU MD2 3.340 . 4.980 3.968 3.928 3.989 . 0 0 "[ . 1 . 2 . ]" 1 1568 1 63 LEU HB3 1 63 LEU MD2 2.810 . 3.920 2.092 1.927 2.160 . 0 0 "[ . 1 . 2 . ]" 1 1569 1 16 ARG HA 1 16 ARG QD 2.440 . 3.170 2.373 2.064 2.786 . 0 0 "[ . 1 . 2 . ]" 1 1570 1 21 ARG HA 1 21 ARG QD 3.580 . 5.460 3.749 2.727 4.160 . 0 0 "[ . 1 . 2 . ]" 1 1571 1 32 ARG HB2 1 32 ARG QD 2.340 . 2.980 2.347 2.042 2.544 . 0 0 "[ . 1 . 2 . ]" 1 1572 1 26 SER HA 1 26 SER QB 2.640 . 3.580 2.386 2.199 2.481 . 0 0 "[ . 1 . 2 . ]" 1 1573 1 2 THR HA 1 2 THR MG 2.950 . 4.200 2.609 2.064 3.245 . 0 0 "[ . 1 . 2 . ]" 1 1574 1 2 THR HB 1 2 THR MG 2.480 . 3.250 2.100 2.071 2.118 . 0 0 "[ . 1 . 2 . ]" 1 1575 1 118 LEU MD2 1 125 ASP HA 3.020 . 4.340 3.209 2.770 3.507 . 0 0 "[ . 1 . 2 . ]" 1 1576 1 23 PRO QB 1 24 LYS QG 3.670 . 5.640 2.872 2.771 3.014 . 0 0 "[ . 1 . 2 . ]" 1 1577 1 117 LEU MD1 1 118 LEU HA 2.950 . 4.200 2.614 2.487 2.701 . 0 0 "[ . 1 . 2 . ]" 1 1578 1 66 PRO QD 1 72 PRO QB 3.850 . 6.000 2.625 1.983 3.132 . 0 0 "[ . 1 . 2 . ]" 1 1579 1 66 PRO QG 1 71 MET QG 2.700 . 3.700 2.415 2.020 2.986 . 0 0 "[ . 1 . 2 . ]" 1 1580 1 79 VAL HB 1 80 LYS QE 3.370 . 5.040 3.378 2.338 4.516 . 0 0 "[ . 1 . 2 . ]" 1 1581 1 63 LEU HG 1 72 PRO QB 3.040 . 4.370 3.884 3.635 3.957 . 0 0 "[ . 1 . 2 . ]" 1 1582 1 114 MET QB 1 118 LEU HB2 3.520 . 5.330 4.355 4.173 4.697 . 0 0 "[ . 1 . 2 . ]" 1 1583 1 118 LEU HA 1 121 VAL HB 2.770 . 3.850 3.095 2.850 3.376 . 0 0 "[ . 1 . 2 . ]" 1 1584 1 118 LEU HA 1 118 LEU HG 2.690 . 3.690 2.390 2.304 2.558 . 0 0 "[ . 1 . 2 . ]" 1 1585 1 80 LYS QB 1 80 LYS QE 3.600 . 5.500 2.304 2.007 3.675 . 0 0 "[ . 1 . 2 . ]" 1 1586 1 8 LYS QB 1 8 LYS QD 2.620 . 3.540 2.190 1.919 2.642 . 0 0 "[ . 1 . 2 . ]" 1 1587 1 75 PRO QB 1 76 GLU HA 3.230 . 4.760 3.795 3.755 3.833 . 0 0 "[ . 1 . 2 . ]" 1 1588 1 87 LYS QB 1 87 LYS QD 2.610 . 3.520 2.222 1.950 2.656 . 0 0 "[ . 1 . 2 . ]" 1 1589 1 87 LYS QB 1 87 LYS QE 3.700 . 5.700 2.976 1.958 3.678 . 0 0 "[ . 1 . 2 . ]" 1 1590 1 109 LEU QB 1 114 MET QB 3.850 . 6.000 4.002 3.114 4.786 . 0 0 "[ . 1 . 2 . ]" 1 1591 1 135 GLN QG 1 136 MET HB2 3.330 . 4.960 4.356 4.191 4.447 . 0 0 "[ . 1 . 2 . ]" 1 1592 1 71 MET QB 1 72 PRO QD 3.480 . 5.260 1.829 1.678 2.440 0.022 19 0 "[ . 1 . 2 . ]" 1 1593 1 29 ASP HA 1 32 ARG QG 2.980 . 4.250 3.535 2.914 3.787 . 0 0 "[ . 1 . 2 . ]" 1 1594 1 71 MET HA 1 71 MET QB 2.280 . 2.860 2.330 2.144 2.526 . 0 0 "[ . 1 . 2 . ]" 1 1595 1 13 LEU HA 1 13 LEU HG 2.830 . 3.970 3.488 3.403 3.649 . 0 0 "[ . 1 . 2 . ]" 1 1596 1 82 PHE QD 1 98 LEU HB3 3.850 . 6.000 4.382 3.277 5.209 . 0 0 "[ . 1 . 2 . ]" 1 1597 1 78 PHE QD 1 82 PHE QD 3.850 . 6.000 2.722 2.043 3.413 . 0 0 "[ . 1 . 2 . ]" 1 1598 1 58 GLN HA 1 61 GLN QG 3.270 . 4.830 3.925 3.222 4.340 . 0 0 "[ . 1 . 2 . ]" 1 1599 1 40 LEU HA 1 40 LEU HG 2.850 . 4.000 3.718 3.699 3.736 . 0 0 "[ . 1 . 2 . ]" 1 1600 1 114 MET HA 1 117 LEU HB2 2.830 . 3.970 4.013 3.997 4.029 0.059 4 0 "[ . 1 . 2 . ]" 1 1601 1 84 VAL MG1 1 85 PHE HA 3.530 . 5.360 3.733 3.412 4.029 . 0 0 "[ . 1 . 2 . ]" 1 1602 1 128 VAL MG2 1 133 PHE QE 3.390 . 5.080 2.619 2.119 2.926 . 0 0 "[ . 1 . 2 . ]" 1 1603 1 87 LYS HA 1 87 LYS QE 2.760 . 3.820 3.063 2.156 3.528 . 0 0 "[ . 1 . 2 . ]" 1 1604 1 80 LYS HA 1 80 LYS QD 2.310 . 2.920 2.013 1.884 2.493 . 0 0 "[ . 1 . 2 . ]" 1 1605 1 98 LEU HA 1 98 LEU MD2 3.330 . 4.960 4.134 4.121 4.142 . 0 0 "[ . 1 . 2 . ]" 1 1606 1 112 GLU QG 1 113 GLU HA 3.270 . 4.840 4.001 3.640 4.343 . 0 0 "[ . 1 . 2 . ]" 1 1607 1 42 GLU HA 1 45 GLU QG 3.060 . 4.420 3.761 3.037 3.972 . 0 0 "[ . 1 . 2 . ]" 1 1608 1 24 LYS HA 1 27 ILE HB 2.700 . 3.700 3.745 3.717 3.769 0.069 11 0 "[ . 1 . 2 . ]" 1 1609 1 24 LYS HA 1 43 ILE HB 2.670 . 3.640 2.051 1.998 2.107 . 0 0 "[ . 1 . 2 . ]" 1 1610 1 24 LYS HA 1 27 ILE MG 3.590 . 5.480 4.362 4.316 4.439 . 0 0 "[ . 1 . 2 . ]" 1 1611 1 21 ARG HA 1 53 GLU HG2 2.880 . 4.050 4.091 4.067 4.108 0.058 7 0 "[ . 1 . 2 . ]" 1 1612 1 131 HIS HA 1 134 VAL HB 2.770 . 3.850 3.189 2.686 3.469 . 0 0 "[ . 1 . 2 . ]" 1 1613 1 78 PHE HA 1 78 PHE HB2 2.250 . 2.790 2.246 2.232 2.279 . 0 0 "[ . 1 . 2 . ]" 1 1614 1 69 PHE HB2 1 69 PHE QE 3.350 . 5.000 4.393 4.368 4.483 . 0 0 "[ . 1 . 2 . ]" 1 1615 1 7 TYR HB2 1 8 LYS HA 2.960 . 4.220 4.189 4.020 4.365 0.145 18 0 "[ . 1 . 2 . ]" 1 1616 1 99 ARG HA 1 102 LEU MD1 3.110 . 4.520 3.412 2.960 3.780 . 0 0 "[ . 1 . 2 . ]" 1 1617 1 57 GLU HA 1 57 GLU QG 2.300 . 2.900 2.286 2.060 2.548 . 0 0 "[ . 1 . 2 . ]" 1 1618 1 121 VAL MG2 1 128 VAL HB 3.560 . 5.420 4.451 4.202 4.532 . 0 0 "[ . 1 . 2 . ]" 1 1619 1 57 GLU HA 1 60 LEU HB2 2.820 . 3.940 2.808 2.621 2.927 . 0 0 "[ . 1 . 2 . ]" 1 1620 1 14 PHE HB3 1 26 SER HA 2.630 . 3.570 3.383 2.952 3.631 0.061 18 0 "[ . 1 . 2 . ]" 1 1621 1 59 PHE HA 1 62 VAL MG2 2.800 . 3.900 2.309 2.255 2.361 . 0 0 "[ . 1 . 2 . ]" 1 1622 1 52 ALA MB 1 53 GLU HG3 3.670 . 5.640 4.179 4.029 4.314 . 0 0 "[ . 1 . 2 . ]" 1 1623 1 63 LEU MD2 1 69 PHE QD 3.730 . 6.000 3.821 2.658 4.457 . 0 0 "[ . 1 . 2 . ]" 1 1624 1 11 PHE QD 1 59 PHE QD 3.730 . 6.000 2.910 2.685 3.089 . 0 0 "[ . 1 . 2 . ]" 1 1625 1 46 ILE MD 1 46 ILE MG 3.320 . 4.940 2.368 2.148 2.499 . 0 0 "[ . 1 . 2 . ]" 1 1626 1 137 ILE HA 1 137 ILE MD 3.040 . 4.380 2.940 1.903 3.722 . 0 0 "[ . 1 . 2 . ]" 1 1627 1 134 VAL HA 1 137 ILE MD 3.460 . 5.210 3.439 2.385 4.387 . 0 0 "[ . 1 . 2 . ]" 1 1628 1 42 GLU QB 1 43 ILE MD 3.850 . 6.000 2.953 2.672 3.163 . 0 0 "[ . 1 . 2 . ]" 1 1629 1 40 LEU MD2 1 43 ILE MD 3.750 . 5.800 2.488 2.304 2.734 . 0 0 "[ . 1 . 2 . ]" 1 1630 1 40 LEU QB 1 43 ILE MD 3.850 . 6.000 3.996 3.844 4.184 . 0 0 "[ . 1 . 2 . ]" 1 1631 1 38 PRO QG 1 43 ILE MD 3.730 . 5.760 2.255 1.985 2.424 . 0 0 "[ . 1 . 2 . ]" 1 1632 1 31 LEU MD1 1 46 ILE MD 3.850 . 6.000 2.869 2.487 3.304 . 0 0 "[ . 1 . 2 . ]" 1 1633 1 27 ILE MD 1 27 ILE MG 3.330 . 4.960 1.902 1.857 1.929 . 0 0 "[ . 1 . 2 . ]" 1 1634 1 27 ILE QG 1 43 ILE HB 2.790 . 3.880 2.972 2.871 3.121 . 0 0 "[ . 1 . 2 . ]" 1 1635 1 27 ILE MD 1 30 LEU MD2 3.850 . 6.000 3.475 3.340 3.616 . 0 0 "[ . 1 . 2 . ]" 1 1636 1 48 SER HA 1 48 SER QB 2.330 . 2.960 2.386 2.164 2.498 . 0 0 "[ . 1 . 2 . ]" 1 1637 1 42 GLU QB 1 46 ILE MD 3.540 . 5.380 3.383 2.645 4.007 . 0 0 "[ . 1 . 2 . ]" 1 1638 1 27 ILE MG 1 46 ILE MD 3.690 . 5.670 3.462 3.236 3.917 . 0 0 "[ . 1 . 2 . ]" 1 1639 1 43 ILE HA 1 43 ILE HB 2.770 . 3.850 2.726 2.697 2.758 . 0 0 "[ . 1 . 2 . ]" 1 1640 1 42 GLU QG 1 46 ILE MD 3.850 . 6.000 4.068 2.215 4.464 . 0 0 "[ . 1 . 2 . ]" 1 1641 1 19 THR HA 1 19 THR HB 2.100 . 2.500 2.479 2.417 2.535 0.035 26 0 "[ . 1 . 2 . ]" 1 1642 1 27 ILE HA 1 30 LEU MD1 3.520 . 5.330 4.453 4.419 4.481 . 0 0 "[ . 1 . 2 . ]" 1 1643 1 54 VAL MG1 1 59 PHE HB3 3.550 . 5.400 2.190 2.153 2.277 . 0 0 "[ . 1 . 2 . ]" 1 1644 1 11 PHE HA 1 30 LEU MD2 3.020 . 4.340 2.976 2.518 3.256 . 0 0 "[ . 1 . 2 . ]" 1 1645 1 61 GLN HA 1 64 ASN HB2 2.890 . 4.080 3.933 3.254 4.129 0.049 13 0 "[ . 1 . 2 . ]" 1 1646 1 22 ILE MD 1 54 VAL HB 3.620 . 5.540 3.204 3.107 3.244 . 0 0 "[ . 1 . 2 . ]" 1 1647 1 22 ILE MD 1 27 ILE QG 3.850 . 6.000 3.427 3.333 3.507 . 0 0 "[ . 1 . 2 . ]" 1 1648 1 22 ILE MD 1 27 ILE HB 3.780 . 5.860 4.120 4.040 4.177 . 0 0 "[ . 1 . 2 . ]" 1 1649 1 12 SER QB 1 13 LEU HA 3.190 . 4.670 3.949 3.859 4.184 . 0 0 "[ . 1 . 2 . ]" 1 1650 1 66 PRO QB 1 72 PRO HA 3.040 . 4.380 3.918 3.825 3.943 . 0 0 "[ . 1 . 2 . ]" 1 1651 1 27 ILE HA 1 30 LEU HB3 2.680 . 3.660 2.005 1.948 2.051 . 0 0 "[ . 1 . 2 . ]" 1 1652 1 66 PRO HA 1 66 PRO QG 2.830 . 3.950 3.515 3.505 3.521 . 0 0 "[ . 1 . 2 . ]" 1 1653 1 88 ASP HA 1 89 ALA MB 3.850 . 6.000 4.191 3.968 4.343 . 0 0 "[ . 1 . 2 . ]" 1 1654 1 101 VAL HB 1 102 LEU HB2 2.930 . 4.160 4.208 4.172 4.236 0.076 16 0 "[ . 1 . 2 . ]" 1 1655 1 13 LEU HB2 1 13 LEU MD2 2.740 . 3.780 3.176 3.014 3.195 . 0 0 "[ . 1 . 2 . ]" 1 1656 1 95 VAL MG1 1 98 LEU HB3 3.310 . 4.920 4.123 4.103 4.139 . 0 0 "[ . 1 . 2 . ]" 1 1657 1 13 LEU HB2 1 13 LEU HG 2.440 . 3.190 2.372 2.223 2.408 . 0 0 "[ . 1 . 2 . ]" 1 1658 1 6 PRO QB 1 33 ALA MB 3.850 . 6.000 4.174 3.553 4.481 . 0 0 "[ . 1 . 2 . ]" 1 1659 1 102 LEU HB2 1 102 LEU MD2 2.720 . 3.740 3.150 3.120 3.173 . 0 0 "[ . 1 . 2 . ]" 1 1660 1 138 LEU HB3 1 139 ALA HA 3.380 . 5.060 4.620 4.058 5.011 . 0 0 "[ . 1 . 2 . ]" 1 1661 1 102 LEU HB3 1 102 LEU MD2 2.230 . 2.760 2.221 2.164 2.266 . 0 0 "[ . 1 . 2 . ]" 1 1662 1 118 LEU HB3 1 118 LEU HG 2.440 . 3.190 2.987 2.970 3.007 . 0 0 "[ . 1 . 2 . ]" 1 1663 1 87 LYS QE 1 87 LYS QG 3.330 . 4.950 2.150 1.931 2.699 . 0 0 "[ . 1 . 2 . ]" 1 1664 1 15 ASP HA 1 22 ILE MG 2.920 . 4.130 2.390 1.856 2.920 . 0 0 "[ . 1 . 2 . ]" 1 1665 1 80 LYS HA 1 80 LYS QE 2.710 . 3.720 3.250 2.876 3.363 . 0 0 "[ . 1 . 2 . ]" 1 1666 1 76 GLU QB 1 80 LYS QE 3.740 . 5.780 3.374 2.550 4.585 . 0 0 "[ . 1 . 2 . ]" 1 1667 1 105 LEU HB3 1 105 LEU MD2 2.440 . 3.180 2.296 2.204 2.361 . 0 0 "[ . 1 . 2 . ]" 1 1668 1 95 VAL HA 1 95 VAL MG2 2.990 . 4.280 2.325 2.238 2.375 . 0 0 "[ . 1 . 2 . ]" 1 1669 1 41 ALA MB 1 44 THR HB 3.730 . 5.750 4.279 4.163 4.423 . 0 0 "[ . 1 . 2 . ]" 1 1670 1 117 LEU HB2 1 118 LEU HA 3.450 . 5.200 5.221 5.202 5.243 0.043 3 0 "[ . 1 . 2 . ]" 1 1671 1 105 LEU HA 1 105 LEU HB2 2.500 . 3.310 2.898 2.838 2.988 . 0 0 "[ . 1 . 2 . ]" 1 1672 1 39 THR HB 1 41 ALA MB 3.830 . 5.960 3.307 3.126 3.500 . 0 0 "[ . 1 . 2 . ]" 1 1673 1 93 ILE MG 1 98 LEU HB3 3.390 . 5.080 3.854 3.289 4.232 . 0 0 "[ . 1 . 2 . ]" 1 1674 1 27 ILE MG 1 31 LEU HG 3.710 . 5.720 2.716 2.273 3.129 . 0 0 "[ . 1 . 2 . ]" 1 1675 1 94 GLY QA 1 95 VAL HA 3.350 . 5.000 4.221 4.213 4.239 . 0 0 "[ . 1 . 2 . ]" 1 1676 1 50 LEU HB2 1 51 PRO QG 3.580 . 5.460 4.812 4.498 4.927 . 0 0 "[ . 1 . 2 . ]" 1 1677 1 27 ILE MG 1 31 LEU MD1 3.850 . 6.000 2.611 2.144 2.947 . 0 0 "[ . 1 . 2 . ]" 1 1678 1 50 LEU HB2 1 62 VAL MG2 3.390 . 5.080 4.112 3.901 4.293 . 0 0 "[ . 1 . 2 . ]" 1 1679 1 109 LEU QB 1 109 LEU MD2 2.610 . 3.520 2.254 2.047 2.549 . 0 0 "[ . 1 . 2 . ]" 1 1680 1 41 ALA HA 1 44 THR HB 2.390 . 3.080 2.810 2.676 2.986 . 0 0 "[ . 1 . 2 . ]" 1 1681 1 95 VAL MG2 1 126 GLY QA 3.850 . 6.000 1.923 1.807 2.221 . 0 0 "[ . 1 . 2 . ]" 1 1682 1 121 VAL MG1 1 126 GLY QA 3.850 . 6.000 4.053 3.434 4.440 . 0 0 "[ . 1 . 2 . ]" 1 1683 1 95 VAL MG1 1 98 LEU MD2 3.850 . 6.000 2.213 1.975 2.612 . 0 0 "[ . 1 . 2 . ]" 1 1684 1 103 THR MG 1 110 SER HA 3.210 . 4.710 2.494 1.796 3.779 . 0 0 "[ . 1 . 2 . ]" 1 1685 1 49 THR HB 1 49 THR MG 2.400 . 3.100 2.090 2.072 2.110 . 0 0 "[ . 1 . 2 . ]" 1 1686 1 54 VAL MG1 1 58 GLN QG 3.850 . 6.000 3.671 3.508 3.830 . 0 0 "[ . 1 . 2 . ]" 1 1687 1 121 VAL HA 1 121 VAL MG1 2.780 . 3.860 2.377 2.159 2.461 . 0 0 "[ . 1 . 2 . ]" 1 1688 1 117 LEU HG 1 121 VAL MG2 3.810 . 5.920 4.674 4.272 4.855 . 0 0 "[ . 1 . 2 . ]" 1 1689 1 49 THR HA 1 49 THR HB 2.340 . 2.980 2.556 2.497 3.005 0.025 24 0 "[ . 1 . 2 . ]" 1 1690 1 22 ILE MD 1 54 VAL MG2 3.850 . 6.000 4.174 4.143 4.191 . 0 0 "[ . 1 . 2 . ]" 1 1691 1 53 GLU HA 1 54 VAL MG2 3.450 . 5.200 3.602 3.514 3.700 . 0 0 "[ . 1 . 2 . ]" 1 1692 1 54 VAL MG2 1 58 GLN QG 3.850 . 6.000 3.545 3.345 4.186 . 0 0 "[ . 1 . 2 . ]" 1 1693 1 54 VAL MG2 1 58 GLN HB2 3.850 . 6.000 3.892 3.547 3.993 . 0 0 "[ . 1 . 2 . ]" 1 1694 1 105 LEU HB2 1 105 LEU MD2 2.850 . 4.000 3.187 3.157 3.198 . 0 0 "[ . 1 . 2 . ]" 1 1695 1 58 GLN HB3 1 62 VAL MG2 3.380 . 5.050 3.942 3.803 4.047 . 0 0 "[ . 1 . 2 . ]" 1 1696 1 59 PHE QD 1 60 LEU MD2 3.170 . 4.890 3.648 3.637 3.657 . 0 0 "[ . 1 . 2 . ]" 1 1697 1 118 LEU MD2 1 124 LYS HA 2.700 . 3.700 3.061 2.890 3.106 . 0 0 "[ . 1 . 2 . ]" 1 1698 1 98 LEU HA 1 101 VAL MG2 3.790 . 5.880 2.977 2.503 3.355 . 0 0 "[ . 1 . 2 . ]" 1 1699 1 60 LEU MD2 1 63 LEU MD1 3.850 . 6.000 3.972 3.348 4.170 . 0 0 "[ . 1 . 2 . ]" 1 1700 1 109 LEU MD2 1 113 GLU QB 3.850 . 6.000 2.597 1.743 3.871 . 0 0 "[ . 1 . 2 . ]" 1 1701 1 124 LYS HA 1 124 LYS QG 2.280 . 2.860 2.314 2.059 2.562 . 0 0 "[ . 1 . 2 . ]" 1 1702 1 80 LYS HA 1 80 LYS HG3 2.210 . 2.710 2.531 2.305 2.641 . 0 0 "[ . 1 . 2 . ]" 1 1703 1 80 LYS QB 1 80 LYS HG3 2.460 . 3.220 2.346 2.306 2.378 . 0 0 "[ . 1 . 2 . ]" 1 1704 1 27 ILE QG 1 31 LEU MD1 3.850 . 6.000 4.239 3.936 4.448 . 0 0 "[ . 1 . 2 . ]" 1 1705 1 117 LEU MD1 1 118 LEU HG 2.850 . 4.000 2.911 2.611 3.225 . 0 0 "[ . 1 . 2 . ]" 1 1706 1 118 LEU MD1 1 118 LEU HG 2.480 . 3.260 2.117 2.097 2.127 . 0 0 "[ . 1 . 2 . ]" 1 1707 1 102 LEU HA 1 102 LEU MD2 3.850 . 6.000 2.359 2.201 2.532 . 0 0 "[ . 1 . 2 . ]" 1 1708 1 137 ILE MG 1 138 LEU MD1 3.850 . 6.000 2.116 1.841 3.816 . 0 0 "[ . 1 . 2 . ]" 1 1709 1 102 LEU HA 1 105 LEU MD1 3.850 . 6.000 2.549 2.101 3.064 . 0 0 "[ . 1 . 2 . ]" 1 1710 1 60 LEU HA 1 60 LEU MD1 3.850 . 6.000 3.816 3.766 3.847 . 0 0 "[ . 1 . 2 . ]" 1 1711 1 105 LEU HB2 1 105 LEU MD1 3.140 . 4.580 2.228 2.080 2.383 . 0 0 "[ . 1 . 2 . ]" 1 1712 1 63 LEU HB3 1 63 LEU HG 2.730 . 3.770 2.774 2.616 2.856 . 0 0 "[ . 1 . 2 . ]" 1 1713 1 30 LEU HG 1 31 LEU HG 2.460 . 3.210 3.220 3.180 3.248 0.038 7 0 "[ . 1 . 2 . ]" 1 1714 1 50 LEU HB3 1 51 PRO QG 3.160 . 4.620 4.064 3.910 4.189 . 0 0 "[ . 1 . 2 . ]" 1 1715 1 98 LEU MD2 1 102 LEU MD1 3.850 . 6.000 3.922 3.709 4.137 . 0 0 "[ . 1 . 2 . ]" 1 1716 1 70 ASP HA 1 72 PRO QD 3.350 . 5.000 3.598 3.190 3.833 . 0 0 "[ . 1 . 2 . ]" 1 1717 1 109 LEU HA 1 109 LEU MD1 3.260 . 4.820 3.760 1.958 3.972 . 0 0 "[ . 1 . 2 . ]" 1 1718 1 51 PRO HA 1 51 PRO QG 2.560 . 3.410 2.843 2.797 2.934 . 0 0 "[ . 1 . 2 . ]" 1 1719 1 50 LEU HA 1 51 PRO QG 3.130 . 4.560 4.024 3.944 4.066 . 0 0 "[ . 1 . 2 . ]" 1 1720 1 50 LEU HG 1 62 VAL MG2 3.540 . 5.380 2.857 2.059 3.784 . 0 0 "[ . 1 . 2 . ]" 1 1721 1 105 LEU HA 1 105 LEU HG 2.770 . 3.830 2.514 2.422 2.711 . 0 0 "[ . 1 . 2 . ]" 1 1722 1 60 LEU HB3 1 60 LEU HG 2.850 . 4.000 3.020 3.017 3.022 . 0 0 "[ . 1 . 2 . ]" 1 1723 1 24 LYS HB2 1 40 LEU MD1 3.730 . 5.750 2.934 2.717 3.219 . 0 0 "[ . 1 . 2 . ]" 1 1724 1 6 PRO QD 1 9 GLN QB 3.730 . 5.760 4.558 4.496 4.610 . 0 0 "[ . 1 . 2 . ]" 1 1725 1 65 ARG HA 1 65 ARG QB 2.310 . 2.920 2.479 2.253 2.541 . 0 0 "[ . 1 . 2 . ]" 1 1726 1 24 LYS HB3 1 40 LEU MD1 3.620 . 5.540 4.280 3.969 4.609 . 0 0 "[ . 1 . 2 . ]" 1 1727 1 36 GLN HB3 1 37 ASN HA 2.890 . 4.080 4.123 4.071 4.153 0.073 18 0 "[ . 1 . 2 . ]" 1 1728 1 25 THR MG 1 40 LEU MD1 3.250 . 4.790 2.338 1.923 2.625 . 0 0 "[ . 1 . 2 . ]" 1 1729 1 40 LEU MD1 1 43 ILE HB 3.690 . 5.680 4.338 4.211 4.464 . 0 0 "[ . 1 . 2 . ]" 1 1730 1 95 VAL HB 1 118 LEU HG 2.810 . 3.910 3.927 3.806 3.976 0.066 6 0 "[ . 1 . 2 . ]" 1 1731 1 40 LEU MD1 1 43 ILE QG 3.290 . 4.880 2.502 2.372 2.656 . 0 0 "[ . 1 . 2 . ]" 1 1732 1 101 VAL HB 1 102 LEU HG 2.770 . 3.830 3.816 3.684 3.864 0.034 17 0 "[ . 1 . 2 . ]" 1 1733 1 24 LYS QD 1 40 LEU MD1 3.850 . 6.000 2.348 1.769 3.376 . 0 0 "[ . 1 . 2 . ]" 1 1734 1 117 LEU HG 1 118 LEU HG 2.340 . 2.980 2.893 2.448 3.010 0.030 2 0 "[ . 1 . 2 . ]" 1 1735 1 109 LEU HA 1 109 LEU HG 2.810 . 3.910 3.210 2.759 3.725 . 0 0 "[ . 1 . 2 . ]" 1 1736 1 122 PRO HA 1 122 PRO QG 2.960 . 4.220 3.480 3.146 3.512 . 0 0 "[ . 1 . 2 . ]" 1 1737 1 66 PRO QG 1 72 PRO HA 3.190 . 4.670 2.070 1.861 2.190 . 0 0 "[ . 1 . 2 . ]" 1 1738 1 24 LYS QD 1 44 THR MG 3.850 . 6.000 3.303 2.593 4.124 . 0 0 "[ . 1 . 2 . ]" 1 1739 1 36 GLN HA 1 36 GLN HB2 2.270 . 2.840 2.853 2.837 2.883 0.043 22 0 "[ . 1 . 2 . ]" 1 1740 1 42 GLU HA 1 45 GLU QB 2.510 . 3.320 2.556 2.391 2.758 . 0 0 "[ . 1 . 2 . ]" 1 1741 1 24 LYS QD 1 43 ILE QG 3.190 . 4.680 3.274 2.768 3.732 . 0 0 "[ . 1 . 2 . ]" 1 1742 1 113 GLU HA 1 116 GLU QB 3.240 . 4.780 3.634 3.200 3.911 . 0 0 "[ . 1 . 2 . ]" 1 1743 1 32 ARG HA 1 32 ARG QG 2.750 . 3.800 3.209 3.083 3.408 . 0 0 "[ . 1 . 2 . ]" 1 1744 1 91 GLY QA 1 129 ASN HA 3.470 . 5.240 3.505 3.112 4.053 . 0 0 "[ . 1 . 2 . ]" 1 1745 1 127 MET HA 1 128 VAL MG2 3.730 . 5.760 3.608 3.546 3.730 . 0 0 "[ . 1 . 2 . ]" 1 1746 1 109 LEU QB 1 113 GLU QB 3.850 . 6.000 2.281 2.029 3.519 . 0 0 "[ . 1 . 2 . ]" 1 1747 1 32 ARG HA 1 32 ARG HB2 2.000 . 2.300 2.230 2.225 2.234 . 0 0 "[ . 1 . 2 . ]" 1 1748 1 36 GLN HA 1 36 GLN HB3 2.760 . 3.820 2.843 2.801 2.866 . 0 0 "[ . 1 . 2 . ]" 1 1749 1 23 PRO HA 1 24 LYS HB3 3.350 . 5.000 4.933 4.838 5.007 0.007 13 0 "[ . 1 . 2 . ]" 1 1750 1 132 ASP QB 1 133 PHE QD 3.080 . 4.960 3.840 3.182 3.960 . 0 0 "[ . 1 . 2 . ]" 1 1751 1 132 ASP QB 1 133 PHE QE 3.220 . 5.240 4.036 3.508 4.184 . 0 0 "[ . 1 . 2 . ]" 1 1752 1 11 PHE QE 1 55 ASP HA 2.620 . 4.040 3.025 2.740 3.306 . 0 0 "[ . 1 . 2 . ]" 1 1753 1 11 PHE HZ 1 55 ASP HB2 2.540 . 3.880 3.654 3.503 3.847 . 0 0 "[ . 1 . 2 . ]" 1 1754 1 11 PHE HB2 1 11 PHE QE 3.120 . 5.040 4.380 4.374 4.391 . 0 0 "[ . 1 . 2 . ]" 1 1755 1 130 TYR QD 1 133 PHE QE 3.600 . 6.000 2.872 2.134 3.932 . 0 0 "[ . 1 . 2 . ]" 1 1756 1 11 PHE QD 1 59 PHE HB3 3.470 . 5.740 3.684 3.403 4.010 . 0 0 "[ . 1 . 2 . ]" 1 1757 1 11 PHE QE 1 59 PHE HB3 3.220 . 5.240 2.739 2.518 3.224 . 0 0 "[ . 1 . 2 . ]" 1 1758 1 7 TYR QE 1 69 PHE QD 3.580 . 5.960 4.110 2.445 4.738 . 0 0 "[ . 1 . 2 . ]" 1 1759 1 78 PHE QD 1 82 PHE HB2 3.490 . 5.780 3.934 3.242 4.447 . 0 0 "[ . 1 . 2 . ]" 1 1760 1 82 PHE HB2 1 82 PHE QD 2.520 . 3.840 2.453 2.264 2.742 . 0 0 "[ . 1 . 2 . ]" 1 1761 1 11 PHE QE 1 20 GLY QA 3.600 . 6.000 2.534 2.200 3.080 . 0 0 "[ . 1 . 2 . ]" 1 1762 1 130 TYR QD 1 131 HIS HA 3.540 . 5.870 4.772 3.820 5.240 . 0 0 "[ . 1 . 2 . ]" 1 1763 1 11 PHE QE 1 22 ILE MD 3.120 . 5.040 2.714 2.532 2.944 . 0 0 "[ . 1 . 2 . ]" 1 1764 1 11 PHE QE 1 22 ILE QG 2.950 . 4.700 2.044 1.935 2.212 . 0 0 "[ . 1 . 2 . ]" 1 1765 1 11 PHE HZ 1 22 ILE QG 3.040 . 4.880 2.851 2.598 3.095 . 0 0 "[ . 1 . 2 . ]" 1 1766 1 11 PHE QE 1 22 ILE MG 2.930 . 4.660 3.206 2.996 3.396 . 0 0 "[ . 1 . 2 . ]" 1 1767 1 93 ILE HB 1 133 PHE QE 3.500 . 5.800 3.303 3.082 4.018 . 0 0 "[ . 1 . 2 . ]" 1 1768 1 93 ILE HB 1 130 TYR QD 2.650 . 4.090 3.358 2.858 3.686 . 0 0 "[ . 1 . 2 . ]" 1 1769 1 117 LEU MD2 1 133 PHE QE 3.560 . 5.920 3.731 3.201 4.413 . 0 0 "[ . 1 . 2 . ]" 1 1770 1 117 LEU MD2 1 133 PHE HZ 3.580 . 5.960 4.793 4.473 4.984 . 0 0 "[ . 1 . 2 . ]" 1 1771 1 13 LEU HB2 1 14 PHE QD 2.870 . 4.540 3.250 2.089 3.877 . 0 0 "[ . 1 . 2 . ]" 1 1772 1 11 PHE QD 1 30 LEU MD1 3.600 . 6.000 3.918 3.437 4.308 . 0 0 "[ . 1 . 2 . ]" 1 1773 1 11 PHE QE 1 30 LEU MD2 3.600 . 6.000 3.947 3.589 4.438 . 0 0 "[ . 1 . 2 . ]" 1 1774 1 82 PHE QD 1 98 LEU HB2 3.120 . 5.040 3.569 2.307 4.505 . 0 0 "[ . 1 . 2 . ]" 1 1775 1 11 PHE QD 1 56 MET HA 2.810 . 4.420 3.775 3.434 3.957 . 0 0 "[ . 1 . 2 . ]" 1 1776 1 6 PRO QG 1 7 TYR QD 3.600 . 6.000 3.164 2.463 4.465 . 0 0 "[ . 1 . 2 . ]" 1 1777 1 75 PRO QB 1 78 PHE QD 3.600 . 6.000 3.583 3.162 4.322 . 0 0 "[ . 1 . 2 . ]" 1 1778 1 11 PHE QE 1 21 ARG HA 2.690 . 4.180 3.571 3.428 3.669 . 0 0 "[ . 1 . 2 . ]" 1 1779 1 11 PHE QE 1 12 SER HA 3.290 . 5.380 3.991 3.758 4.303 . 0 0 "[ . 1 . 2 . ]" 1 1780 1 14 PHE QD 1 26 SER HA 2.830 . 4.450 3.719 2.973 4.017 . 0 0 "[ . 1 . 2 . ]" 1 1781 1 100 TYR QD 1 101 VAL HA 3.600 . 6.000 3.615 3.275 3.980 . 0 0 "[ . 1 . 2 . ]" 1 1782 1 100 TYR QE 1 101 VAL HA 3.330 . 5.450 4.685 4.366 4.861 . 0 0 "[ . 1 . 2 . ]" 1 1783 1 100 TYR QD 1 101 VAL HB 3.600 . 6.000 5.127 4.961 5.312 . 0 0 "[ . 1 . 2 . ]" 1 1784 1 128 VAL HB 1 133 PHE QD 2.950 . 4.700 4.011 3.851 4.198 . 0 0 "[ . 1 . 2 . ]" 1 1785 1 128 VAL HB 1 133 PHE HZ 2.750 . 4.290 2.415 2.113 2.639 . 0 0 "[ . 1 . 2 . ]" 1 1786 1 130 TYR QD 1 134 VAL MG2 2.790 . 4.370 2.995 1.905 3.295 . 0 0 "[ . 1 . 2 . ]" 1 1787 1 11 PHE QE 1 54 VAL MG1 3.600 . 6.000 3.205 2.919 3.429 . 0 0 "[ . 1 . 2 . ]" 1 1788 1 54 VAL MG1 1 59 PHE QD 3.110 . 5.020 3.756 3.746 3.769 . 0 0 "[ . 1 . 2 . ]" 1 1789 1 84 VAL MG1 1 85 PHE QD 3.020 . 4.830 2.740 1.906 3.640 . 0 0 "[ . 1 . 2 . ]" 1 1790 1 84 VAL MG1 1 100 TYR QD 3.600 . 6.000 3.604 2.602 4.268 . 0 0 "[ . 1 . 2 . ]" 1 1791 1 130 TYR QB 1 130 TYR QD 2.890 . 4.580 2.195 2.157 2.314 . 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 62 _Distance_constraint_stats_list.Viol_count 236 _Distance_constraint_stats_list.Viol_total 147.526 _Distance_constraint_stats_list.Viol_max 0.088 _Distance_constraint_stats_list.Viol_rms 0.0105 _Distance_constraint_stats_list.Viol_average_all_restraints 0.0035 _Distance_constraint_stats_list.Viol_average_violations_only 0.0240 _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 LYS 0.133 0.035 18 0 "[ . 1 . 2 . ]" 1 9 GLN 0.955 0.071 8 0 "[ . 1 . 2 . ]" 1 12 SER 0.133 0.035 18 0 "[ . 1 . 2 . ]" 1 13 LEU 0.955 0.071 8 0 "[ . 1 . 2 . ]" 1 27 ILE 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 31 LEU 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 40 LEU 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 41 ALA 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 42 GLU 0.013 0.009 25 0 "[ . 1 . 2 . ]" 1 43 ILE 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 44 THR 0.347 0.034 26 0 "[ . 1 . 2 . ]" 1 45 GLU 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 46 ILE 0.013 0.009 25 0 "[ . 1 . 2 . ]" 1 47 GLU 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 48 SER 0.347 0.034 26 0 "[ . 1 . 2 . ]" 1 56 MET 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 57 GLU 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 58 GLN 0.555 0.062 3 0 "[ . 1 . 2 . ]" 1 59 PHE 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 60 LEU 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 61 GLN 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 62 VAL 0.555 0.062 3 0 "[ . 1 . 2 . ]" 1 63 LEU 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 75 PRO 0.107 0.023 19 0 "[ . 1 . 2 . ]" 1 76 GLU 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 77 GLU 0.092 0.021 23 0 "[ . 1 . 2 . ]" 1 78 PHE 0.168 0.042 23 0 "[ . 1 . 2 . ]" 1 79 VAL 0.107 0.023 19 0 "[ . 1 . 2 . ]" 1 80 LYS 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 81 GLY 0.092 0.021 23 0 "[ . 1 . 2 . ]" 1 82 PHE 0.168 0.042 23 0 "[ . 1 . 2 . ]" 1 83 GLN 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 95 VAL 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 96 GLY 0.445 0.049 17 0 "[ . 1 . 2 . ]" 1 97 GLU 0.276 0.049 11 0 "[ . 1 . 2 . ]" 1 98 LEU 0.109 0.041 17 0 "[ . 1 . 2 . ]" 1 99 ARG 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 100 TYR 0.445 0.049 17 0 "[ . 1 . 2 . ]" 1 101 VAL 0.276 0.049 11 0 "[ . 1 . 2 . ]" 1 102 LEU 0.109 0.041 17 0 "[ . 1 . 2 . ]" 1 103 THR 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 111 ASN 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 112 GLU 1.060 0.088 16 0 "[ . 1 . 2 . ]" 1 113 GLU 0.604 0.047 7 0 "[ . 1 . 2 . ]" 1 114 MET 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 115 ASP 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 116 GLU 1.724 0.088 16 0 "[ . 1 . 2 . ]" 1 117 LEU 0.604 0.047 7 0 "[ . 1 . 2 . ]" 1 118 LEU 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 119 LYS 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 120 GLY 0.663 0.061 26 0 "[ . 1 . 2 . ]" 1 131 HIS 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 132 ASP 0.140 0.028 9 0 "[ . 1 . 2 . ]" 1 133 PHE 0.006 0.006 3 0 "[ . 1 . 2 . ]" 1 135 GLN 0.000 0.000 . 0 "[ . 1 . 2 . ]" 1 136 MET 0.140 0.028 9 0 "[ . 1 . 2 . ]" 1 137 ILE 0.006 0.006 3 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 8 LYS O 1 12 SER N 2.800 2.400 3.300 3.198 3.028 3.259 . 0 0 "[ . 1 . 2 . ]" 2 2 1 8 LYS O 1 12 SER H 1.800 . 2.300 2.271 2.089 2.335 0.035 18 0 "[ . 1 . 2 . ]" 2 3 1 9 GLN O 1 13 LEU N 2.800 2.400 3.300 3.190 3.127 3.245 . 0 0 "[ . 1 . 2 . ]" 2 4 1 9 GLN O 1 13 LEU H 1.800 . 2.300 2.337 2.316 2.371 0.071 8 0 "[ . 1 . 2 . ]" 2 5 1 27 ILE O 1 31 LEU N 2.800 2.400 3.300 2.839 2.753 2.977 . 0 0 "[ . 1 . 2 . ]" 2 6 1 27 ILE O 1 31 LEU H 1.800 . 2.300 1.892 1.790 2.041 . 0 0 "[ . 1 . 2 . ]" 2 7 1 40 LEU O 1 44 THR N 2.800 2.400 3.300 2.884 2.790 3.053 . 0 0 "[ . 1 . 2 . ]" 2 8 1 40 LEU O 1 44 THR H 1.800 . 2.300 1.925 1.837 2.090 . 0 0 "[ . 1 . 2 . ]" 2 9 1 41 ALA O 1 45 GLU N 2.800 2.400 3.300 2.922 2.774 3.076 . 0 0 "[ . 1 . 2 . ]" 2 10 1 41 ALA O 1 45 GLU H 1.800 . 2.300 2.064 1.910 2.194 . 0 0 "[ . 1 . 2 . ]" 2 11 1 42 GLU O 1 46 ILE N 2.800 2.400 3.300 3.055 2.858 3.210 . 0 0 "[ . 1 . 2 . ]" 2 12 1 42 GLU O 1 46 ILE H 1.800 . 2.300 2.177 1.945 2.309 0.009 25 0 "[ . 1 . 2 . ]" 2 13 1 43 ILE O 1 47 GLU N 2.800 2.400 3.300 3.086 2.993 3.187 . 0 0 "[ . 1 . 2 . ]" 2 14 1 43 ILE O 1 47 GLU H 1.800 . 2.300 2.132 2.028 2.236 . 0 0 "[ . 1 . 2 . ]" 2 15 1 44 THR O 1 48 SER N 2.800 2.400 3.300 3.045 2.968 3.116 . 0 0 "[ . 1 . 2 . ]" 2 16 1 44 THR O 1 48 SER H 1.800 . 2.300 2.304 2.242 2.334 0.034 26 0 "[ . 1 . 2 . ]" 2 17 1 56 MET O 1 60 LEU N 2.800 2.400 3.300 3.002 2.878 3.094 . 0 0 "[ . 1 . 2 . ]" 2 18 1 56 MET O 1 60 LEU H 1.800 . 2.300 2.087 1.968 2.165 . 0 0 "[ . 1 . 2 . ]" 2 19 1 57 GLU O 1 61 GLN N 2.800 2.400 3.300 2.783 2.731 2.874 . 0 0 "[ . 1 . 2 . ]" 2 20 1 57 GLU O 1 61 GLN H 1.800 . 2.300 1.950 1.848 2.031 . 0 0 "[ . 1 . 2 . ]" 2 21 1 58 GLN O 1 62 VAL N 2.800 2.400 3.300 3.263 3.166 3.305 0.005 3 0 "[ . 1 . 2 . ]" 2 22 1 58 GLN O 1 62 VAL H 1.800 . 2.300 2.314 2.211 2.362 0.062 3 0 "[ . 1 . 2 . ]" 2 23 1 59 PHE O 1 63 LEU N 2.800 2.400 3.300 2.923 2.744 3.086 . 0 0 "[ . 1 . 2 . ]" 2 24 1 59 PHE O 1 63 LEU H 1.800 . 2.300 1.985 1.839 2.185 . 0 0 "[ . 1 . 2 . ]" 2 25 1 75 PRO O 1 79 VAL N 2.800 2.400 3.300 3.133 2.885 3.263 . 0 0 "[ . 1 . 2 . ]" 2 26 1 75 PRO O 1 79 VAL H 1.800 . 2.300 2.198 1.932 2.323 0.023 19 0 "[ . 1 . 2 . ]" 2 27 1 76 GLU O 1 80 LYS N 2.800 2.400 3.300 3.013 2.826 3.133 . 0 0 "[ . 1 . 2 . ]" 2 28 1 76 GLU O 1 80 LYS H 1.800 . 2.300 2.089 1.976 2.184 . 0 0 "[ . 1 . 2 . ]" 2 29 1 77 GLU O 1 81 GLY N 2.800 2.400 3.300 3.080 2.863 3.279 . 0 0 "[ . 1 . 2 . ]" 2 30 1 77 GLU O 1 81 GLY H 1.800 . 2.300 2.237 2.076 2.321 0.021 23 0 "[ . 1 . 2 . ]" 2 31 1 78 PHE O 1 82 PHE N 2.800 2.400 3.300 3.195 2.821 3.307 0.007 15 0 "[ . 1 . 2 . ]" 2 32 1 78 PHE O 1 82 PHE H 1.800 . 2.300 2.235 1.867 2.342 0.042 23 0 "[ . 1 . 2 . ]" 2 33 1 79 VAL O 1 83 GLN N 2.800 2.400 3.300 2.883 2.728 3.162 . 0 0 "[ . 1 . 2 . ]" 2 34 1 79 VAL O 1 83 GLN H 1.800 . 2.300 2.003 1.827 2.283 . 0 0 "[ . 1 . 2 . ]" 2 35 1 95 VAL O 1 99 ARG N 2.800 2.400 3.300 2.665 2.552 2.771 . 0 0 "[ . 1 . 2 . ]" 2 36 1 95 VAL O 1 99 ARG H 1.800 . 2.300 1.712 1.621 1.820 . 0 0 "[ . 1 . 2 . ]" 2 37 1 96 GLY O 1 100 TYR N 2.800 2.400 3.300 3.175 2.944 3.285 . 0 0 "[ . 1 . 2 . ]" 2 38 1 96 GLY O 1 100 TYR H 1.800 . 2.300 2.296 2.101 2.349 0.049 17 0 "[ . 1 . 2 . ]" 2 39 1 97 GLU O 1 101 VAL N 2.800 2.400 3.300 3.186 3.056 3.266 . 0 0 "[ . 1 . 2 . ]" 2 40 1 97 GLU O 1 101 VAL H 1.800 . 2.300 2.284 2.143 2.349 0.049 11 0 "[ . 1 . 2 . ]" 2 41 1 98 LEU O 1 102 LEU N 2.800 2.400 3.300 3.121 2.941 3.311 0.011 17 0 "[ . 1 . 2 . ]" 2 42 1 98 LEU O 1 102 LEU H 1.800 . 2.300 2.169 1.975 2.341 0.041 17 0 "[ . 1 . 2 . ]" 2 43 1 99 ARG O 1 103 THR N 2.800 2.400 3.300 2.703 2.598 2.765 . 0 0 "[ . 1 . 2 . ]" 2 44 1 99 ARG O 1 103 THR H 1.800 . 2.300 1.779 1.636 1.895 . 0 0 "[ . 1 . 2 . ]" 2 45 1 111 ASN O 1 115 ASP N 2.800 2.400 3.300 2.699 2.619 2.832 . 0 0 "[ . 1 . 2 . ]" 2 46 1 111 ASN O 1 115 ASP H 1.800 . 2.300 1.962 1.831 2.124 . 0 0 "[ . 1 . 2 . ]" 2 47 1 112 GLU O 1 116 GLU N 2.800 2.400 3.300 3.265 3.223 3.312 0.012 16 0 "[ . 1 . 2 . ]" 2 48 1 112 GLU O 1 116 GLU H 1.800 . 2.300 2.340 2.305 2.388 0.088 16 0 "[ . 1 . 2 . ]" 2 49 1 113 GLU O 1 117 LEU N 2.800 2.400 3.300 3.273 3.189 3.301 0.001 10 0 "[ . 1 . 2 . ]" 2 50 1 113 GLU O 1 117 LEU H 1.800 . 2.300 2.321 2.263 2.347 0.047 7 0 "[ . 1 . 2 . ]" 2 51 1 114 MET O 1 118 LEU N 2.800 2.400 3.300 2.731 2.630 2.863 . 0 0 "[ . 1 . 2 . ]" 2 52 1 114 MET O 1 118 LEU H 1.800 . 2.300 1.804 1.694 1.949 . 0 0 "[ . 1 . 2 . ]" 2 53 1 115 ASP O 1 119 LYS N 2.800 2.400 3.300 2.984 2.864 3.068 . 0 0 "[ . 1 . 2 . ]" 2 54 1 115 ASP O 1 119 LYS H 1.800 . 2.300 2.164 2.042 2.281 . 0 0 "[ . 1 . 2 . ]" 2 55 1 116 GLU O 1 120 GLY N 2.800 2.400 3.300 3.223 3.176 3.255 . 0 0 "[ . 1 . 2 . ]" 2 56 1 116 GLU O 1 120 GLY H 1.800 . 2.300 2.324 2.274 2.361 0.061 26 0 "[ . 1 . 2 . ]" 2 57 1 131 HIS O 1 135 GLN N 2.800 2.400 3.300 2.708 2.576 2.888 . 0 0 "[ . 1 . 2 . ]" 2 58 1 131 HIS O 1 135 GLN H 1.800 . 2.300 1.842 1.724 2.053 . 0 0 "[ . 1 . 2 . ]" 2 59 1 132 ASP O 1 136 MET N 2.800 2.400 3.300 3.204 3.055 3.304 0.004 16 0 "[ . 1 . 2 . ]" 2 60 1 132 ASP O 1 136 MET H 1.800 . 2.300 2.247 2.087 2.328 0.028 9 0 "[ . 1 . 2 . ]" 2 61 1 133 PHE O 1 137 ILE N 2.800 2.400 3.300 2.996 2.833 3.206 . 0 0 "[ . 1 . 2 . ]" 2 62 1 133 PHE O 1 137 ILE H 1.800 . 2.300 2.124 1.923 2.306 0.006 3 0 "[ . 1 . 2 . ]" 2 stop_ save_
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