NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | in_recoord | in_dress | stage | program | type | subtype | subsubtype |
376654 | 1fo7 | 4641 | cing | recoord | dress | 4-filtered-FRED | Wattos | check | violation | distance |
data_1fo7 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 11 _Distance_constraint_stats_list.Viol_count 15 _Distance_constraint_stats_list.Viol_total 3.865 _Distance_constraint_stats_list.Viol_max 0.029 _Distance_constraint_stats_list.Viol_rms 0.0023 _Distance_constraint_stats_list.Viol_average_all_restraints 0.0004 _Distance_constraint_stats_list.Viol_average_violations_only 0.0086 _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 98 HIS 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 100 VAL 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 101 THR 0.099 0.015 21 0 "[ . 1 . 2 . 3]" 1 102 THR 0.099 0.015 21 0 "[ . 1 . 2 . 3]" 1 103 THR 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 104 THR 0.029 0.029 15 0 "[ . 1 . 2 . 3]" 1 105 LYS 0.029 0.029 15 0 "[ . 1 . 2 . 3]" 1 108 ASN 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 109 PHE 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 110 THR 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 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 1 110 THR HB 1 110 THR MG 2.000 . 2.700 2.110 2.089 2.134 . 0 0 "[ . 1 . 2 . 3]" 1 2 1 98 HIS HA 1 101 THR HB 2.500 . 6.000 5.216 5.022 5.536 . 0 0 "[ . 1 . 2 . 3]" 1 3 1 101 THR HB 1 101 THR MG 1.800 . 2.400 2.108 2.090 2.132 . 0 0 "[ . 1 . 2 . 3]" 1 4 1 104 THR HB 1 105 LYS QG 3.400 2.200 4.800 3.904 3.504 4.829 0.029 15 0 "[ . 1 . 2 . 3]" 1 5 1 103 THR HB 1 108 ASN HA 2.900 . 6.000 4.798 3.093 5.795 . 0 0 "[ . 1 . 2 . 3]" 1 6 1 104 THR HB 1 104 THR MG 1.800 . 2.400 2.114 2.090 2.135 . 0 0 "[ . 1 . 2 . 3]" 1 7 1 100 VAL HA 1 103 THR HB 2.500 . 6.000 4.285 3.901 5.678 . 0 0 "[ . 1 . 2 . 3]" 1 8 1 101 THR MG 1 102 THR HB 2.800 . 4.000 3.961 3.815 4.015 0.015 21 0 "[ . 1 . 2 . 3]" 1 9 1 102 THR HB 1 105 LYS HB2 3.200 . 6.000 5.030 4.625 5.190 . 0 0 "[ . 1 . 2 . 3]" 1 10 1 102 THR HB 1 109 PHE QD 2.800 . 4.000 3.248 2.999 3.476 . 0 0 "[ . 1 . 2 . 3]" 1 11 1 102 THR HB 1 102 THR MG 1.900 . 2.600 2.111 2.092 2.132 . 0 0 "[ . 1 . 2 . 3]" 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 2945 _Distance_constraint_stats_list.Viol_count 3204 _Distance_constraint_stats_list.Viol_total 5830.517 _Distance_constraint_stats_list.Viol_max 0.991 _Distance_constraint_stats_list.Viol_rms 0.0257 _Distance_constraint_stats_list.Viol_average_all_restraints 0.0022 _Distance_constraint_stats_list.Viol_average_violations_only 0.0607 _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 36 LEU 10.711 0.800 21 6 "[ . * 1 * * 2+ - * 3]" 1 37 GLY 7.418 0.267 24 0 "[ . 1 . 2 . 3]" 1 38 GLY 0.675 0.076 27 0 "[ . 1 . 2 . 3]" 1 39 TYR 9.925 0.631 25 1 "[ . 1 . 2 + 3]" 1 40 MET 3.755 0.127 27 0 "[ . 1 . 2 . 3]" 1 41 LEU 4.687 0.127 27 0 "[ . 1 . 2 . 3]" 1 42 GLY 4.366 0.520 16 1 "[ . 1 .+ 2 . 3]" 1 43 SER 8.592 0.620 14 3 "[ . 1 +.- 2 . * 3]" 1 44 ALA 1.206 0.145 14 0 "[ . 1 . 2 . 3]" 1 45 MET 12.642 0.892 16 2 "[ . - 1 .+ 2 . 3]" 1 46 SER 0.673 0.233 8 0 "[ . 1 . 2 . 3]" 1 47 ARG 1.669 0.175 27 0 "[ . 1 . 2 . 3]" 1 48 PRO 4.243 0.175 27 0 "[ . 1 . 2 . 3]" 1 49 ILE 1.162 0.376 1 0 "[ . 1 . 2 . 3]" 1 50 ILE 4.649 0.487 3 0 "[ . 1 . 2 . 3]" 1 51 HIS 0.120 0.030 25 0 "[ . 1 . 2 . 3]" 1 52 PHE 1.769 0.217 20 0 "[ . 1 . 2 . 3]" 1 53 GLY 1.137 0.044 23 0 "[ . 1 . 2 . 3]" 1 54 SER 4.862 0.249 18 0 "[ . 1 . 2 . 3]" 1 55 ASP 1.271 0.152 18 0 "[ . 1 . 2 . 3]" 1 56 TYR 6.254 0.300 24 0 "[ . 1 . 2 . 3]" 1 57 GLU 2.954 0.300 24 0 "[ . 1 . 2 . 3]" 1 58 ASP 0.345 0.032 21 0 "[ . 1 . 2 . 3]" 1 59 ARG 8.431 0.991 17 2 "[ . 1 . + *2 . 3]" 1 60 TYR 8.654 0.991 17 2 "[ . 1 . + -2 . 3]" 1 61 TYR 4.907 0.866 24 1 "[ . 1 . 2 +. 3]" 1 62 ARG 4.540 0.866 24 2 "[ . 1 . - 2 +. 3]" 1 63 GLU 1.221 0.317 24 0 "[ . 1 . 2 . 3]" 1 64 ASN 0.539 0.083 29 0 "[ . 1 . 2 . 3]" 1 65 MET 2.138 0.070 20 0 "[ . 1 . 2 . 3]" 1 66 HIS 1.097 0.052 24 0 "[ . 1 . 2 . 3]" 1 67 ARG 1.303 0.282 27 0 "[ . 1 . 2 . 3]" 1 68 TYR 3.044 0.413 3 0 "[ . 1 . 2 . 3]" 1 69 PRO 2.264 0.233 6 0 "[ . 1 . 2 . 3]" 1 70 ASN 1.192 0.233 8 0 "[ . 1 . 2 . 3]" 1 71 GLN 3.437 0.397 25 0 "[ . 1 . 2 . 3]" 1 72 VAL 5.660 0.397 25 0 "[ . 1 . 2 . 3]" 1 73 TYR 4.735 0.095 13 0 "[ . 1 . 2 . 3]" 1 74 TYR 1.026 0.189 19 0 "[ . 1 . 2 . 3]" 1 75 ARG 3.120 0.170 17 0 "[ . 1 . 2 . 3]" 1 76 PRO 1.373 0.085 18 0 "[ . 1 . 2 . 3]" 1 77 MET 3.007 0.830 18 1 "[ . 1 . + 2 . 3]" 1 78 ASP 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 79 GLU 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 81 SER 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 82 ASN 10.541 0.849 15 5 "[ . * 1 * + * - . 3]" 1 83 GLN 5.501 0.918 30 1 "[ . 1 . 2 . +]" 1 84 ASN 3.431 0.839 12 2 "[ . 1 + . 2 - . 3]" 1 85 ASN 7.474 0.849 15 3 "[ . * 1 + - . 3]" 1 86 PHE 4.326 0.524 26 1 "[ . 1 . 2 .+ 3]" 1 87 VAL 6.613 0.350 4 0 "[ . 1 . 2 . 3]" 1 88 HIS 0.978 0.076 21 0 "[ . 1 . 2 . 3]" 1 89 ASP 0.081 0.019 4 0 "[ . 1 . 2 . 3]" 1 90 CYS 0.348 0.086 22 0 "[ . 1 . 2 . 3]" 1 91 VAL 0.320 0.032 14 0 "[ . 1 . 2 . 3]" 1 92 ASN 7.453 0.546 20 1 "[ . 1 . + . 3]" 1 93 ILE 16.805 0.957 26 11 "[ .** 1 * ** ** *-+ * 3]" 1 94 THR 1.021 0.043 28 0 "[ . 1 . 2 . 3]" 1 95 ILE 1.275 0.076 25 0 "[ . 1 . 2 . 3]" 1 96 LYS 5.756 0.684 6 1 "[ .+ 1 . 2 . 3]" 1 97 GLN 9.458 0.957 26 5 "[ . 1 . * * *-+ 3]" 1 98 HIS 3.393 0.397 25 0 "[ . 1 . 2 . 3]" 1 99 THR 0.411 0.042 27 0 "[ . 1 . 2 . 3]" 1 100 VAL 0.176 0.051 6 0 "[ . 1 . 2 . 3]" 1 101 THR 2.741 0.510 25 1 "[ . 1 . 2 + 3]" 1 102 THR 2.242 0.233 6 0 "[ . 1 . 2 . 3]" 1 103 THR 0.468 0.038 6 0 "[ . 1 . 2 . 3]" 1 104 THR 0.284 0.047 6 0 "[ . 1 . 2 . 3]" 1 105 LYS 2.317 0.510 25 1 "[ . 1 . 2 + 3]" 1 106 GLY 0.043 0.024 12 0 "[ . 1 . 2 . 3]" 1 107 GLU 2.716 0.484 14 0 "[ . 1 . 2 . 3]" 1 108 ASN 8.959 0.495 11 0 "[ . 1 . 2 . 3]" 1 109 PHE 2.857 0.484 14 0 "[ . 1 . 2 . 3]" 1 110 THR 1.076 0.495 11 0 "[ . 1 . 2 . 3]" 1 111 LYS 4.260 0.470 2 0 "[ . 1 . 2 . 3]" 1 112 THR 8.018 0.340 17 0 "[ . 1 . 2 . 3]" 1 113 ASP 0.417 0.031 30 0 "[ . 1 . 2 . 3]" 1 114 VAL 1.342 0.051 21 0 "[ . 1 . 2 . 3]" 1 115 LYS 9.334 0.487 3 0 "[ . 1 . 2 . 3]" 1 116 MET 6.117 0.487 3 0 "[ . 1 . 2 . 3]" 1 117 MET 5.917 0.487 3 0 "[ . 1 . 2 . 3]" 1 118 GLU 1.656 0.376 18 0 "[ . 1 . 2 . 3]" 1 119 ARG 4.331 0.423 7 0 "[ . 1 . 2 . 3]" 1 120 VAL 5.375 0.117 8 0 "[ . 1 . 2 . 3]" 1 121 VAL 3.443 0.233 6 0 "[ . 1 . 2 . 3]" 1 122 GLU 1.272 0.068 30 0 "[ . 1 . 2 . 3]" 1 123 GLN 2.395 0.065 12 0 "[ . 1 . 2 . 3]" 1 124 MET 3.350 0.622 14 1 "[ . 1 +. 2 . 3]" 1 125 CYS 4.429 0.350 4 0 "[ . 1 . 2 . 3]" 1 126 ILE 3.186 0.918 30 1 "[ . 1 . 2 . +]" 1 127 THR 7.275 0.816 3 5 "[ + . 1 * ** 2 . - 3]" 1 128 GLN 11.845 0.892 16 7 "[ . * * *.+ 2 *.-* 3]" 1 129 TYR 2.782 0.469 26 0 "[ . 1 . 2 . 3]" 1 130 GLU 10.750 0.816 3 3 "[ + . 1 - * 2 . 3]" 1 131 ARG 17.352 0.572 24 5 "[ . * .* 2 +.-* 3]" 1 132 GLU 11.515 0.864 28 10 "[ * . ** * * ** .- + *]" 1 133 SER 3.607 0.522 15 2 "[ . 1 - + 2 . 3]" 1 134 GLN 3.326 0.213 3 0 "[ . 1 . 2 . 3]" 1 135 ALA 1.430 0.466 7 0 "[ . 1 . 2 . 3]" 1 136 TYR 1.263 0.830 18 1 "[ . 1 . + 2 . 3]" 1 137 TYR 0.819 0.086 20 0 "[ . 1 . 2 . 3]" 1 138 GLN 2.972 0.522 15 2 "[ . 1 - + 2 . 3]" 1 139 ARG 1.801 0.321 4 0 "[ . 1 . 2 . 3]" 1 140 GLY 0.033 0.021 16 0 "[ . 1 . 2 . 3]" 1 141 SER 0.021 0.021 16 0 "[ . 1 . 2 . 3]" 1 142 SER 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 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 1 102 THR HB 1 107 GLU QB 2.300 . 6.000 3.644 3.335 4.115 . 0 0 "[ . 1 . 2 . 3]" 2 2 1 99 THR HA 1 99 THR HB 2.200 . 3.000 2.539 2.490 2.580 . 0 0 "[ . 1 . 2 . 3]" 2 3 1 99 THR HB 1 109 PHE QD 2.900 . 6.000 4.830 4.468 5.178 . 0 0 "[ . 1 . 2 . 3]" 2 4 1 99 THR HB 1 99 THR MG 1.900 . 2.500 2.114 2.090 2.134 . 0 0 "[ . 1 . 2 . 3]" 2 5 1 99 THR HB 1 100 VAL MG1 2.800 . 6.000 5.867 5.711 5.982 . 0 0 "[ . 1 . 2 . 3]" 2 6 1 94 THR HA 1 94 THR HB 2.800 . 4.000 3.023 3.020 3.025 . 0 0 "[ . 1 . 2 . 3]" 2 7 1 94 THR HA 1 98 HIS HD2 2.500 . 3.500 3.302 3.091 3.505 0.005 13 0 "[ . 1 . 2 . 3]" 2 8 1 91 VAL HA 1 94 THR HB 2.700 . 3.800 2.901 2.712 3.099 . 0 0 "[ . 1 . 2 . 3]" 2 9 1 95 ILE HG13 1 114 VAL HA 3.200 . 6.000 4.772 4.539 4.907 . 0 0 "[ . 1 . 2 . 3]" 2 10 1 99 THR MG 1 114 VAL HA 3.200 . 4.700 4.202 3.834 4.390 . 0 0 "[ . 1 . 2 . 3]" 2 11 1 86 PHE QD 1 87 VAL HA 2.700 . 3.800 3.098 2.822 3.252 . 0 0 "[ . 1 . 2 . 3]" 2 12 1 114 VAL HA 1 114 VAL HB 2.600 . 3.600 2.405 2.392 2.420 . 0 0 "[ . 1 . 2 . 3]" 2 13 1 114 VAL HA 1 117 MET HA 3.400 . 5.000 4.846 4.708 4.990 . 0 0 "[ . 1 . 2 . 3]" 2 14 1 127 THR HA 1 127 THR HB 2.600 . 3.600 3.020 3.004 3.029 . 0 0 "[ . 1 . 2 . 3]" 2 15 1 127 THR HA 1 130 GLU HG3 3.000 . 4.300 4.211 3.653 5.116 0.816 3 3 "[ + . 1 - * 2 . 3]" 2 16 1 87 VAL MG1 1 126 ILE HA 2.500 . 3.500 2.166 1.946 2.462 . 0 0 "[ . 1 . 2 . 3]" 2 17 1 87 VAL HB 1 126 ILE HA 3.400 . 5.100 4.370 3.950 4.868 . 0 0 "[ . 1 . 2 . 3]" 2 18 1 126 ILE HA 1 126 ILE HG13 2.500 . 3.500 2.563 2.447 2.822 . 0 0 "[ . 1 . 2 . 3]" 2 19 1 126 ILE HA 1 126 ILE HG12 2.200 . 3.000 2.328 2.235 2.393 . 0 0 "[ . 1 . 2 . 3]" 2 20 1 112 THR HA 1 112 THR MG 2.000 . 2.700 2.243 2.161 2.393 . 0 0 "[ . 1 . 2 . 3]" 2 21 1 91 VAL HA 1 121 VAL MG1 2.000 . 2.700 1.666 1.488 1.837 0.012 12 0 "[ . 1 . 2 . 3]" 2 22 1 99 THR HA 1 109 PHE QD 2.300 . 3.100 2.662 2.260 2.973 . 0 0 "[ . 1 . 2 . 3]" 2 23 1 99 THR HA 1 109 PHE QE 2.700 . 6.000 4.251 3.926 4.605 . 0 0 "[ . 1 . 2 . 3]" 2 24 1 99 THR HA 1 99 THR MG 2.100 . 2.800 2.253 2.118 2.327 . 0 0 "[ . 1 . 2 . 3]" 2 25 1 98 HIS HA 1 99 THR HA 3.100 . 6.000 4.808 4.742 4.837 . 0 0 "[ . 1 . 2 . 3]" 2 26 1 120 VAL HA 1 120 VAL HB 2.400 . 3.300 3.019 3.017 3.021 . 0 0 "[ . 1 . 2 . 3]" 2 27 1 120 VAL HA 1 120 VAL QG 2.200 . 3.000 2.100 2.042 2.176 . 0 0 "[ . 1 . 2 . 3]" 2 28 1 50 ILE MG 1 120 VAL HA 3.300 . 4.900 4.454 4.302 4.679 . 0 0 "[ . 1 . 2 . 3]" 2 29 1 103 THR HA 1 103 THR MG 1.900 . 2.600 2.229 2.087 2.337 . 0 0 "[ . 1 . 2 . 3]" 2 30 1 102 THR MG 1 103 THR HA 3.000 . 4.300 3.960 3.775 4.085 . 0 0 "[ . 1 . 2 . 3]" 2 31 1 100 VAL HB 1 101 THR HA 3.400 . 5.000 4.384 4.205 4.488 . 0 0 "[ . 1 . 2 . 3]" 2 32 1 101 THR HA 1 101 THR MG 1.900 . 6.000 3.187 3.173 3.207 . 0 0 "[ . 1 . 2 . 3]" 2 33 1 102 THR HA 1 102 THR MG 1.900 . 2.600 2.147 2.074 2.244 . 0 0 "[ . 1 . 2 . 3]" 2 34 1 102 THR HA 1 105 LYS QD 2.600 . 6.000 4.331 1.615 4.886 . 0 0 "[ . 1 . 2 . 3]" 2 35 1 102 THR HA 1 105 LYS QG 2.700 . 3.800 2.882 2.181 3.544 . 0 0 "[ . 1 . 2 . 3]" 2 36 1 102 THR HA 1 105 LYS QE 3.100 . 4.500 3.969 3.002 4.515 0.015 15 0 "[ . 1 . 2 . 3]" 2 37 1 41 LEU HB3 1 43 SER HB3 3.100 . 6.000 6.032 6.008 6.051 0.051 24 0 "[ . 1 . 2 . 3]" 2 38 1 104 THR HA 1 104 THR MG 1.900 . 2.500 2.226 2.116 2.331 . 0 0 "[ . 1 . 2 . 3]" 2 39 1 141 SER HA 1 141 SER QB 2.200 . 3.000 2.330 2.161 2.536 . 0 0 "[ . 1 . 2 . 3]" 2 40 1 43 SER HA 1 43 SER HB3 2.000 . 2.700 2.394 2.342 2.449 . 0 0 "[ . 1 . 2 . 3]" 2 41 1 69 PRO HA 1 102 THR MG 3.300 . 4.900 4.575 4.366 4.910 0.010 6 0 "[ . 1 . 2 . 3]" 2 42 1 46 SER HA 1 46 SER HB2 2.000 . 2.700 2.435 2.343 2.675 . 0 0 "[ . 1 . 2 . 3]" 2 43 1 48 PRO HA 1 48 PRO HB3 2.000 . 2.700 2.299 2.289 2.307 . 0 0 "[ . 1 . 2 . 3]" 2 44 1 48 PRO HA 1 49 ILE HB 2.300 . 6.000 4.888 4.800 4.978 . 0 0 "[ . 1 . 2 . 3]" 2 45 1 61 TYR HA 1 116 MET ME 3.200 . 4.600 3.814 3.497 4.039 . 0 0 "[ . 1 . 2 . 3]" 2 46 1 60 TYR QD 1 61 TYR HA 2.500 . 3.500 3.452 3.304 3.532 0.032 27 0 "[ . 1 . 2 . 3]" 2 47 1 61 TYR HA 1 61 TYR HB3 2.600 . 3.600 3.005 2.988 3.010 . 0 0 "[ . 1 . 2 . 3]" 2 48 1 61 TYR HA 1 61 TYR QE 2.600 . 6.000 4.762 4.691 4.856 . 0 0 "[ . 1 . 2 . 3]" 2 49 1 130 GLU HA 1 133 SER HB3 2.400 . 3.300 2.472 2.152 2.998 . 0 0 "[ . 1 . 2 . 3]" 2 50 1 130 GLU HB3 1 133 SER HB3 3.300 . 4.900 4.050 3.652 4.884 . 0 0 "[ . 1 . 2 . 3]" 2 51 1 133 SER HA 1 133 SER HB3 2.300 . 3.200 2.703 2.597 2.949 . 0 0 "[ . 1 . 2 . 3]" 2 52 1 48 PRO HA 1 49 ILE HG13 3.300 . 6.000 5.241 5.163 5.313 . 0 0 "[ . 1 . 2 . 3]" 2 53 1 48 PRO HA 1 120 VAL MG1 3.200 . 6.000 4.473 4.393 4.575 . 0 0 "[ . 1 . 2 . 3]" 2 54 1 93 ILE HA 1 93 ILE HG12 2.400 . 3.300 2.847 2.687 3.116 . 0 0 "[ . 1 . 2 . 3]" 2 55 1 93 ILE HA 1 93 ILE MD 2.300 . 3.100 1.822 1.680 2.088 0.020 26 0 "[ . 1 . 2 . 3]" 2 56 1 86 PHE HA 1 86 PHE HB3 2.900 . 4.200 3.020 3.009 3.026 . 0 0 "[ . 1 . 2 . 3]" 2 57 1 86 PHE HA 1 129 TYR QD 3.200 . 6.000 4.855 4.610 5.237 . 0 0 "[ . 1 . 2 . 3]" 2 58 1 56 TYR HA 1 59 ARG HG3 3.100 . 6.000 4.456 4.040 5.711 . 0 0 "[ . 1 . 2 . 3]" 2 59 1 55 ASP HA 1 56 TYR HA 3.300 . 6.000 4.844 4.834 4.854 . 0 0 "[ . 1 . 2 . 3]" 2 60 1 56 TYR HA 1 56 TYR HB2 2.300 . 3.200 2.341 2.315 2.382 . 0 0 "[ . 1 . 2 . 3]" 2 61 1 56 TYR HA 1 56 TYR QD 2.500 . 3.500 2.793 2.610 2.879 . 0 0 "[ . 1 . 2 . 3]" 2 62 1 133 SER HA 1 133 SER HB2 2.400 . 3.300 2.288 2.244 2.346 . 0 0 "[ . 1 . 2 . 3]" 2 63 1 133 SER HA 1 136 TYR QD 2.900 . 4.200 3.765 3.321 4.174 . 0 0 "[ . 1 . 2 . 3]" 2 64 1 121 VAL MG1 1 122 GLU HA 3.100 . 4.500 3.368 3.200 3.530 . 0 0 "[ . 1 . 2 . 3]" 2 65 1 91 VAL QG 1 122 GLU HA 2.200 . 6.000 1.924 1.779 2.172 . 0 0 "[ . 1 . 2 . 3]" 2 66 1 122 GLU HA 1 122 GLU HB2 2.200 . 3.000 2.237 2.229 2.266 . 0 0 "[ . 1 . 2 . 3]" 2 67 1 91 VAL QG 1 118 GLU HA 2.800 . 4.000 2.523 2.192 2.771 . 0 0 "[ . 1 . 2 . 3]" 2 68 1 49 ILE HA 1 61 TYR QE 2.200 . 3.000 2.567 2.421 2.680 . 0 0 "[ . 1 . 2 . 3]" 2 69 1 49 ILE HA 1 49 ILE HG13 2.800 . 6.000 3.835 3.789 3.888 . 0 0 "[ . 1 . 2 . 3]" 2 70 1 118 GLU HA 1 121 VAL MG1 3.000 . 4.400 4.284 4.136 4.402 0.002 20 0 "[ . 1 . 2 . 3]" 2 71 1 118 GLU HA 1 118 GLU QG 2.600 . 3.200 2.266 2.128 2.987 . 0 0 "[ . 1 . 2 . 3]" 2 72 1 118 GLU HA 1 118 GLU HB3 2.300 . 3.200 2.657 2.613 2.688 . 0 0 "[ . 1 . 2 . 3]" 2 73 1 118 GLU HA 1 118 GLU HB2 2.300 . 3.200 2.980 2.967 2.997 . 0 0 "[ . 1 . 2 . 3]" 2 74 1 95 ILE HG12 1 118 GLU HA 3.100 . 4.500 3.792 3.633 4.143 . 0 0 "[ . 1 . 2 . 3]" 2 75 1 117 MET HB2 1 118 GLU HA 3.300 . 4.900 4.658 4.586 4.684 . 0 0 "[ . 1 . 2 . 3]" 2 76 1 110 THR HA 1 110 THR MG 2.000 . 2.700 2.059 1.908 2.260 . 0 0 "[ . 1 . 2 . 3]" 2 77 1 136 TYR HA 1 136 TYR QD 2.400 . 3.300 2.533 2.215 2.806 . 0 0 "[ . 1 . 2 . 3]" 2 78 1 136 TYR HA 1 139 ARG QD 3.000 . 4.300 3.624 2.427 4.288 . 0 0 "[ . 1 . 2 . 3]" 2 79 1 136 TYR HA 1 136 TYR HB2 2.300 . 3.200 2.449 2.376 2.525 . 0 0 "[ . 1 . 2 . 3]" 2 80 1 110 THR HA 1 114 VAL MG1 3.300 . 4.800 4.171 3.919 4.387 . 0 0 "[ . 1 . 2 . 3]" 2 81 1 96 LYS HA 1 96 LYS HG3 2.500 . 3.500 2.967 2.592 3.261 . 0 0 "[ . 1 . 2 . 3]" 2 82 1 92 ASN HA 1 96 LYS HA 2.600 . 6.000 6.033 5.958 6.076 0.076 24 0 "[ . 1 . 2 . 3]" 2 83 1 96 LYS HA 1 96 LYS QE 3.300 . 4.900 4.415 3.903 4.764 . 0 0 "[ . 1 . 2 . 3]" 2 84 1 111 LYS HA 1 114 VAL MG2 2.500 . 3.500 2.253 1.994 2.477 . 0 0 "[ . 1 . 2 . 3]" 2 85 1 116 MET HA 1 116 MET HB3 2.500 . 3.500 2.321 2.303 2.359 . 0 0 "[ . 1 . 2 . 3]" 2 86 1 124 MET HB3 1 125 CYS HA 2.800 . 6.000 4.357 4.257 4.469 . 0 0 "[ . 1 . 2 . 3]" 2 87 1 57 GLU HA 1 116 MET ME 2.500 . 3.500 2.915 2.547 3.209 . 0 0 "[ . 1 . 2 . 3]" 2 88 1 111 LYS HA 1 114 VAL MG1 2.400 . 3.300 3.299 3.144 3.322 0.022 24 0 "[ . 1 . 2 . 3]" 2 89 1 57 GLU HA 1 60 TYR QD 2.800 . 4.000 3.898 3.546 4.017 0.017 15 0 "[ . 1 . 2 . 3]" 2 90 1 87 VAL MG1 1 125 CYS HA 3.200 . 4.700 4.020 3.816 4.359 . 0 0 "[ . 1 . 2 . 3]" 2 91 1 117 MET HA 1 117 MET HB3 2.200 . 3.000 2.516 2.158 2.558 . 0 0 "[ . 1 . 2 . 3]" 2 92 1 95 ILE MD 1 117 MET HA 3.100 . 4.500 4.117 3.763 4.346 . 0 0 "[ . 1 . 2 . 3]" 2 93 1 117 MET HA 1 117 MET HG2 2.300 . 3.100 2.197 2.110 2.916 . 0 0 "[ . 1 . 2 . 3]" 2 94 1 117 MET HA 1 120 VAL QG 2.300 . 6.000 3.114 2.984 3.227 . 0 0 "[ . 1 . 2 . 3]" 2 95 1 117 MET HA 1 121 VAL MG2 2.800 . 3.900 3.138 2.965 3.256 . 0 0 "[ . 1 . 2 . 3]" 2 96 1 59 ARG HA 1 62 ARG HD3 3.200 . 6.000 5.770 4.359 6.023 0.023 17 0 "[ . 1 . 2 . 3]" 2 97 1 130 GLU HA 1 134 GLN QG 3.100 . 6.000 4.961 4.208 5.741 . 0 0 "[ . 1 . 2 . 3]" 2 98 1 130 GLU HA 1 130 GLU HB2 2.300 . 3.200 2.993 2.951 3.019 . 0 0 "[ . 1 . 2 . 3]" 2 99 1 130 GLU HA 1 130 GLU HB3 2.200 . 3.000 2.149 2.015 2.528 . 0 0 "[ . 1 . 2 . 3]" 2 100 1 88 HIS HA 1 91 VAL QG 2.600 . 4.000 2.923 2.194 3.411 . 0 0 "[ . 1 . 2 . 3]" 2 101 1 131 ARG HA 1 131 ARG HB2 2.100 . 6.000 2.740 2.389 2.837 . 0 0 "[ . 1 . 2 . 3]" 2 102 1 98 HIS HA 1 98 HIS HB2 2.400 . 3.300 3.005 2.995 3.017 . 0 0 "[ . 1 . 2 . 3]" 2 103 1 98 HIS HA 1 98 HIS HB3 2.400 . 3.300 2.581 2.531 2.613 . 0 0 "[ . 1 . 2 . 3]" 2 104 1 131 ARG HA 1 131 ARG HD3 3.000 . 4.300 4.300 3.940 4.821 0.521 27 2 "[ . 1 . 2 .-+ 3]" 2 105 1 98 HIS HA 1 102 THR HB 3.000 . 4.300 3.417 2.731 3.783 . 0 0 "[ . 1 . 2 . 3]" 2 106 1 137 TYR HA 1 137 TYR QE 3.000 . 6.000 4.358 4.179 4.520 . 0 0 "[ . 1 . 2 . 3]" 2 107 1 65 MET HA 1 65 MET HB2 2.300 . 3.200 3.023 3.020 3.024 . 0 0 "[ . 1 . 2 . 3]" 2 108 1 65 MET HA 1 65 MET HB3 2.400 . 3.300 2.433 2.415 2.445 . 0 0 "[ . 1 . 2 . 3]" 2 109 1 131 ARG HA 1 131 ARG HG2 2.300 . 3.200 2.478 2.344 2.743 . 0 0 "[ . 1 . 2 . 3]" 2 110 1 128 GLN HA 1 131 ARG HA 3.300 . 4.800 4.791 4.467 4.849 0.049 15 0 "[ . 1 . 2 . 3]" 2 111 1 65 MET HA 1 68 TYR QE 2.700 . 6.000 4.710 4.390 4.873 . 0 0 "[ . 1 . 2 . 3]" 2 112 1 131 ARG HA 1 131 ARG HD2 3.800 2.600 5.300 4.607 3.874 4.826 . 0 0 "[ . 1 . 2 . 3]" 2 113 1 115 LYS HA 1 115 LYS QD 2.800 . 4.000 3.551 3.257 3.866 . 0 0 "[ . 1 . 2 . 3]" 2 114 1 115 LYS HA 1 115 LYS HG2 2.700 . 3.800 2.569 2.226 4.168 0.368 28 0 "[ . 1 . 2 . 3]" 2 115 1 123 GLN HA 1 123 GLN HG2 2.400 . 3.300 2.772 2.672 2.874 . 0 0 "[ . 1 . 2 . 3]" 2 116 1 123 GLN HA 1 126 ILE MD 2.200 . 3.000 2.002 1.676 2.344 . 0 0 "[ . 1 . 2 . 3]" 2 117 1 140 GLY QA 1 141 SER HA 3.100 . 4.500 4.048 3.932 4.521 0.021 16 0 "[ . 1 . 2 . 3]" 2 118 1 50 ILE HA 1 50 ILE HB 2.400 . 3.300 2.992 2.979 3.003 . 0 0 "[ . 1 . 2 . 3]" 2 119 1 50 ILE HA 1 50 ILE MD 2.500 . 3.500 2.669 2.307 2.973 . 0 0 "[ . 1 . 2 . 3]" 2 120 1 72 VAL HA 1 121 VAL MG1 3.100 . 4.500 3.837 3.670 4.125 . 0 0 "[ . 1 . 2 . 3]" 2 121 1 50 ILE HA 1 50 ILE HG12 2.400 . 3.300 2.963 2.863 3.200 . 0 0 "[ . 1 . 2 . 3]" 2 122 1 72 VAL HA 1 94 THR MG 2.200 . 3.000 1.886 1.686 2.092 . 0 0 "[ . 1 . 2 . 3]" 2 123 1 72 VAL HA 1 72 VAL HB 2.300 . 3.200 2.494 2.459 2.547 . 0 0 "[ . 1 . 2 . 3]" 2 124 1 50 ILE HA 1 50 ILE MG 2.200 . 3.000 2.227 2.058 2.320 . 0 0 "[ . 1 . 2 . 3]" 2 125 1 72 VAL HA 1 72 VAL MG1 2.300 . 3.100 2.235 2.131 2.386 . 0 0 "[ . 1 . 2 . 3]" 2 126 1 72 VAL MG2 1 128 GLN HA 3.200 . 6.000 4.904 4.594 5.503 . 0 0 "[ . 1 . 2 . 3]" 2 127 1 45 MET ME 1 128 GLN HA 2.600 . 6.000 4.115 3.694 4.574 . 0 0 "[ . 1 . 2 . 3]" 2 128 1 128 GLN HA 1 131 ARG HG2 2.700 . 3.800 3.775 3.443 4.038 0.238 15 0 "[ . 1 . 2 . 3]" 2 129 1 72 VAL HA 1 73 TYR QD 2.900 . 4.200 2.847 2.592 3.048 . 0 0 "[ . 1 . 2 . 3]" 2 130 1 128 GLN HA 1 131 ARG HD3 2.800 . 6.000 3.477 1.702 4.210 . 0 0 "[ . 1 . 2 . 3]" 2 131 1 58 ASP HA 1 116 MET ME 3.100 . 6.000 4.631 4.421 4.923 . 0 0 "[ . 1 . 2 . 3]" 2 132 1 128 GLN HA 1 131 ARG HD2 2.500 . 3.500 2.350 1.700 4.072 0.572 24 3 "[ . * . 2 +.- 3]" 2 133 1 52 PHE QE 1 58 ASP HA 2.900 . 4.100 3.615 3.401 3.929 . 0 0 "[ . 1 . 2 . 3]" 2 134 1 43 SER HA 1 71 GLN HG2 3.000 . 4.300 2.532 2.157 3.044 . 0 0 "[ . 1 . 2 . 3]" 2 135 1 43 SER HA 1 71 GLN HG3 3.000 . 4.300 4.142 3.887 4.322 0.022 8 0 "[ . 1 . 2 . 3]" 2 136 1 43 SER HA 1 44 ALA MB 2.800 . 6.000 4.165 4.105 4.246 . 0 0 "[ . 1 . 2 . 3]" 2 137 1 119 ARG HA 1 119 ARG HB2 2.400 . 3.300 3.017 3.007 3.020 . 0 0 "[ . 1 . 2 . 3]" 2 138 1 119 ARG HA 1 119 ARG HG2 2.500 . 3.500 2.984 2.816 3.162 . 0 0 "[ . 1 . 2 . 3]" 2 139 1 45 MET QB 1 46 SER HA 3.200 . 4.700 4.393 4.282 4.498 . 0 0 "[ . 1 . 2 . 3]" 2 140 1 134 GLN HA 1 134 GLN QG 3.000 2.300 3.600 2.492 2.087 3.341 0.213 3 0 "[ . 1 . 2 . 3]" 2 141 1 113 ASP HA 1 117 MET ME 3.200 . 6.000 5.023 4.756 5.442 . 0 0 "[ . 1 . 2 . 3]" 2 142 1 39 TYR HA 1 40 MET HB2 3.300 . 4.900 4.365 4.265 4.557 . 0 0 "[ . 1 . 2 . 3]" 2 143 1 112 THR MG 1 113 ASP HA 2.900 . 4.100 3.940 3.640 4.070 . 0 0 "[ . 1 . 2 . 3]" 2 144 1 39 TYR HA 1 75 ARG QB 3.100 . 4.500 3.944 1.906 4.431 . 0 0 "[ . 1 . 2 . 3]" 2 145 1 39 TYR HA 1 39 TYR QD 2.600 . 3.600 3.161 3.111 3.212 . 0 0 "[ . 1 . 2 . 3]" 2 146 1 60 TYR QE 1 113 ASP HA 2.600 . 6.000 3.905 3.550 4.188 . 0 0 "[ . 1 . 2 . 3]" 2 147 1 39 TYR HA 1 73 TYR QD 2.600 . 6.000 5.603 5.232 5.915 . 0 0 "[ . 1 . 2 . 3]" 2 148 1 113 ASP HA 1 113 ASP HB3 2.500 . 3.500 2.621 2.548 2.676 . 0 0 "[ . 1 . 2 . 3]" 2 149 1 132 GLU HA 1 132 GLU HB2 2.400 . 3.300 2.989 2.976 3.009 . 0 0 "[ . 1 . 2 . 3]" 2 150 1 97 GLN HA 1 101 THR MG 2.900 . 4.100 3.901 3.622 4.084 . 0 0 "[ . 1 . 2 . 3]" 2 151 1 132 GLU HA 1 132 GLU HB3 2.100 . 2.900 2.641 2.581 2.677 . 0 0 "[ . 1 . 2 . 3]" 2 152 1 97 GLN HA 1 100 VAL MG2 2.700 . 3.800 3.358 3.117 3.774 . 0 0 "[ . 1 . 2 . 3]" 2 153 1 97 GLN HA 1 100 VAL MG1 2.400 . 6.000 4.664 4.465 4.910 . 0 0 "[ . 1 . 2 . 3]" 2 154 1 119 ARG HA 1 119 ARG HD3 2.300 . 3.200 2.629 1.980 3.623 0.423 7 0 "[ . 1 . 2 . 3]" 2 155 1 89 ASP HA 1 93 ILE QG 3.300 . 4.900 4.580 4.351 4.851 . 0 0 "[ . 1 . 2 . 3]" 2 156 1 41 LEU HB2 1 73 TYR HA 3.100 . 4.500 4.558 4.532 4.595 0.095 13 0 "[ . 1 . 2 . 3]" 2 157 1 41 LEU MD1 1 73 TYR HA 3.300 . 6.000 5.098 5.012 5.176 . 0 0 "[ . 1 . 2 . 3]" 2 158 1 39 TYR QD 1 73 TYR HA 2.700 . 6.000 4.946 4.719 5.134 . 0 0 "[ . 1 . 2 . 3]" 2 159 1 39 TYR HB3 1 73 TYR HA 3.300 . 4.800 4.104 3.956 4.242 . 0 0 "[ . 1 . 2 . 3]" 2 160 1 72 VAL MG2 1 73 TYR HA 3.400 . 5.000 3.999 3.863 4.120 . 0 0 "[ . 1 . 2 . 3]" 2 161 1 73 TYR HA 1 73 TYR QB 2.400 . 3.300 2.343 2.327 2.359 . 0 0 "[ . 1 . 2 . 3]" 2 162 1 73 TYR HA 1 93 ILE MG 3.200 . 4.700 4.336 4.255 4.416 . 0 0 "[ . 1 . 2 . 3]" 2 163 1 73 TYR HA 1 74 TYR QD 2.600 . 3.600 3.174 2.877 3.325 . 0 0 "[ . 1 . 2 . 3]" 2 164 1 41 LEU MD2 1 73 TYR HA 2.700 . 6.000 4.067 3.781 4.295 . 0 0 "[ . 1 . 2 . 3]" 2 165 1 139 ARG HA 1 139 ARG QD 2.800 . 6.000 3.799 3.103 4.317 . 0 0 "[ . 1 . 2 . 3]" 2 166 1 139 ARG HA 1 139 ARG QG 2.800 . 3.800 2.194 2.013 3.250 . 0 0 "[ . 1 . 2 . 3]" 2 167 1 109 PHE HA 1 109 PHE QE 2.600 . 6.000 4.432 4.386 4.512 . 0 0 "[ . 1 . 2 . 3]" 2 168 1 109 PHE HA 1 113 ASP HB3 3.200 . 4.600 2.570 2.377 2.723 . 0 0 "[ . 1 . 2 . 3]" 2 169 1 109 PHE HA 1 113 ASP HB2 3.300 . 4.900 2.532 2.194 2.710 . 0 0 "[ . 1 . 2 . 3]" 2 170 1 109 PHE HA 1 110 THR MG 3.200 . 6.000 4.866 4.131 5.318 . 0 0 "[ . 1 . 2 . 3]" 2 171 1 92 ASN HA 1 95 ILE MD 3.000 . 4.300 3.801 3.407 4.299 . 0 0 "[ . 1 . 2 . 3]" 2 172 1 92 ASN HA 1 92 ASN HB3 2.200 . 3.000 2.645 2.335 2.960 . 0 0 "[ . 1 . 2 . 3]" 2 173 1 84 ASN HA 1 84 ASN HB2 2.200 . 3.000 2.422 2.296 2.672 . 0 0 "[ . 1 . 2 . 3]" 2 174 1 84 ASN HA 1 84 ASN HB3 2.200 . 3.000 2.504 2.278 2.638 . 0 0 "[ . 1 . 2 . 3]" 2 175 1 84 ASN HA 1 87 VAL MG2 2.600 . 3.600 2.449 1.988 2.732 . 0 0 "[ . 1 . 2 . 3]" 2 176 1 138 GLN HA 1 138 GLN QG 2.100 . 6.000 3.346 3.325 3.390 . 0 0 "[ . 1 . 2 . 3]" 2 177 1 105 LYS HA 1 105 LYS QG 2.200 . 3.000 2.251 2.089 2.754 . 0 0 "[ . 1 . 2 . 3]" 2 178 1 105 LYS HA 1 105 LYS QD 2.500 . 3.500 3.084 2.078 3.668 0.168 30 0 "[ . 1 . 2 . 3]" 2 179 1 104 THR MG 1 105 LYS HA 3.000 . 4.300 4.199 3.971 4.312 0.012 10 0 "[ . 1 . 2 . 3]" 2 180 1 67 ARG HA 1 67 ARG HB3 2.400 . 3.300 2.445 2.341 2.583 . 0 0 "[ . 1 . 2 . 3]" 2 181 1 107 GLU HA 1 108 ASN HA 2.900 . 6.000 4.593 4.513 4.642 . 0 0 "[ . 1 . 2 . 3]" 2 182 1 67 ARG HA 1 67 ARG HB2 2.300 . 3.200 2.513 2.179 2.741 . 0 0 "[ . 1 . 2 . 3]" 2 183 1 67 ARG HA 1 67 ARG HG2 2.700 . 3.800 3.038 2.673 3.464 . 0 0 "[ . 1 . 2 . 3]" 2 184 1 85 ASN HA 1 85 ASN HB3 2.300 . 3.200 2.369 2.301 2.665 . 0 0 "[ . 1 . 2 . 3]" 2 185 1 107 GLU HA 1 107 GLU QB 2.000 . 6.000 2.525 2.475 2.540 . 0 0 "[ . 1 . 2 . 3]" 2 186 1 64 ASN HA 1 64 ASN QB 2.300 . 3.200 2.479 2.450 2.519 . 0 0 "[ . 1 . 2 . 3]" 2 187 1 64 ASN HA 1 67 ARG HD2 3.000 . 4.300 2.962 1.983 4.065 . 0 0 "[ . 1 . 2 . 3]" 2 188 1 64 ASN HA 1 67 ARG HD3 3.100 . 4.500 3.348 2.031 4.392 . 0 0 "[ . 1 . 2 . 3]" 2 189 1 63 GLU QB 1 64 ASN HA 3.100 . 4.700 4.177 4.043 4.783 0.083 29 0 "[ . 1 . 2 . 3]" 2 190 1 36 LEU HA 1 73 TYR QE 2.800 . 6.000 4.857 3.929 5.445 . 0 0 "[ . 1 . 2 . 3]" 2 191 1 36 LEU HA 1 93 ILE HG13 3.200 . 4.700 4.624 3.986 4.727 0.027 28 0 "[ . 1 . 2 . 3]" 2 192 1 36 LEU HA 1 73 TYR QD 3.100 2.100 4.300 4.006 3.383 4.342 0.042 28 0 "[ . 1 . 2 . 3]" 2 193 1 36 LEU HA 1 36 LEU HB3 2.200 . 3.000 2.489 2.220 2.692 . 0 0 "[ . 1 . 2 . 3]" 2 194 1 36 LEU HA 1 39 TYR QD 2.700 . 3.800 3.261 2.510 3.804 0.004 2 0 "[ . 1 . 2 . 3]" 2 195 1 47 ARG HA 1 124 MET ME 2.500 . 6.000 4.191 3.786 4.560 . 0 0 "[ . 1 . 2 . 3]" 2 196 1 47 ARG HA 1 48 PRO QD 2.400 . 3.300 1.952 1.936 1.976 . 0 0 "[ . 1 . 2 . 3]" 2 197 1 36 LEU HA 1 93 ILE MD 3.200 . 4.700 3.844 2.841 4.504 . 0 0 "[ . 1 . 2 . 3]" 2 198 1 47 ARG HA 1 47 ARG HB3 2.400 . 3.300 2.403 2.276 3.007 . 0 0 "[ . 1 . 2 . 3]" 2 199 1 47 ARG HA 1 68 TYR QB 3.300 . 6.000 5.656 5.434 5.863 . 0 0 "[ . 1 . 2 . 3]" 2 200 1 47 ARG HA 1 70 ASN HB3 2.400 . 6.000 3.912 3.707 4.334 . 0 0 "[ . 1 . 2 . 3]" 2 201 1 71 GLN HA 1 72 VAL HB 3.100 . 6.000 5.660 5.630 5.670 . 0 0 "[ . 1 . 2 . 3]" 2 202 1 44 ALA MB 1 71 GLN HA 3.000 . 6.000 4.376 4.142 4.506 . 0 0 "[ . 1 . 2 . 3]" 2 203 1 51 HIS HA 1 52 PHE QD 2.700 . 6.000 3.944 3.664 4.150 . 0 0 "[ . 1 . 2 . 3]" 2 204 1 51 HIS HA 1 51 HIS HB2 2.400 . 3.300 3.012 2.977 3.031 . 0 0 "[ . 1 . 2 . 3]" 2 205 1 51 HIS HA 1 51 HIS HB3 2.400 . 3.300 2.575 2.474 2.671 . 0 0 "[ . 1 . 2 . 3]" 2 206 1 135 ALA HA 1 138 GLN HG3 2.700 . 3.800 2.971 2.344 3.335 . 0 0 "[ . 1 . 2 . 3]" 2 207 1 135 ALA HA 1 135 ALA MB 1.800 . 2.400 2.106 2.084 2.128 . 0 0 "[ . 1 . 2 . 3]" 2 208 1 50 ILE MG 1 51 HIS HA 3.100 . 4.500 3.912 3.672 4.201 . 0 0 "[ . 1 . 2 . 3]" 2 209 1 45 MET HA 1 45 MET QB 2.400 . 3.300 2.157 2.152 2.162 . 0 0 "[ . 1 . 2 . 3]" 2 210 1 40 MET HA 1 40 MET HG3 2.800 . 4.000 2.987 2.823 3.095 . 0 0 "[ . 1 . 2 . 3]" 2 211 1 40 MET HA 1 40 MET HB2 2.300 . 3.200 2.994 2.972 3.020 . 0 0 "[ . 1 . 2 . 3]" 2 212 1 40 MET HA 1 40 MET HB3 2.300 . 3.100 2.623 2.481 2.676 . 0 0 "[ . 1 . 2 . 3]" 2 213 1 41 LEU HA 1 41 LEU HG 2.900 . 4.200 2.430 2.362 2.521 . 0 0 "[ . 1 . 2 . 3]" 2 214 1 40 MET QG 1 75 ARG HA 3.200 . 4.700 4.309 3.802 4.705 0.005 26 0 "[ . 1 . 2 . 3]" 2 215 1 41 LEU HA 1 73 TYR QE 3.000 . 6.000 4.572 4.490 4.808 . 0 0 "[ . 1 . 2 . 3]" 2 216 1 75 ARG HA 1 75 ARG QG 2.600 . 3.600 2.244 2.006 3.342 . 0 0 "[ . 1 . 2 . 3]" 2 217 1 75 ARG HA 1 75 ARG QB 2.500 . 3.500 2.482 2.157 2.540 . 0 0 "[ . 1 . 2 . 3]" 2 218 1 75 ARG HA 1 76 PRO HG3 2.900 . 6.000 4.630 4.603 4.656 . 0 0 "[ . 1 . 2 . 3]" 2 219 1 75 ARG HA 1 76 PRO HD2 2.400 . 3.300 2.269 2.203 2.311 . 0 0 "[ . 1 . 2 . 3]" 2 220 1 44 ALA HA 1 71 GLN HG2 2.200 . 3.000 2.780 2.226 3.036 0.036 25 0 "[ . 1 . 2 . 3]" 2 221 1 44 ALA HA 1 70 ASN HB2 3.100 . 4.500 2.635 2.504 2.835 . 0 0 "[ . 1 . 2 . 3]" 2 222 1 108 ASN HA 1 108 ASN QB 2.000 . 6.000 2.445 2.303 2.538 . 0 0 "[ . 1 . 2 . 3]" 2 223 1 68 TYR HA 1 68 TYR QB 2.400 . 3.300 2.500 2.468 2.532 . 0 0 "[ . 1 . 2 . 3]" 2 224 1 61 TYR QE 1 68 TYR HA 2.500 . 6.000 5.321 5.163 5.542 . 0 0 "[ . 1 . 2 . 3]" 2 225 1 68 TYR HA 1 69 PRO HG3 3.300 . 4.800 3.977 3.874 4.149 . 0 0 "[ . 1 . 2 . 3]" 2 226 1 70 ASN HA 1 71 GLN HB2 3.100 . 6.000 5.722 5.636 5.850 . 0 0 "[ . 1 . 2 . 3]" 2 227 1 48 PRO QD 1 70 ASN HB3 2.400 . 6.000 4.831 4.534 5.261 . 0 0 "[ . 1 . 2 . 3]" 2 228 1 48 PRO HB3 1 48 PRO QD 3.200 . 4.700 3.532 3.528 3.538 . 0 0 "[ . 1 . 2 . 3]" 2 229 1 48 PRO HD2 1 120 VAL MG1 3.000 . 6.000 1.729 1.542 1.806 . 0 0 "[ . 1 . 2 . 3]" 2 230 1 69 PRO HD3 1 102 THR MG 3.200 . 4.700 4.366 3.897 4.613 . 0 0 "[ . 1 . 2 . 3]" 2 231 1 67 ARG HB2 1 67 ARG HD3 2.600 . 3.600 2.343 1.930 3.322 . 0 0 "[ . 1 . 2 . 3]" 2 232 1 67 ARG HD2 1 67 ARG HG3 2.500 . 3.500 2.362 2.217 2.814 . 0 0 "[ . 1 . 2 . 3]" 2 233 1 131 ARG HD2 1 131 ARG HG2 2.500 . 3.500 2.910 2.276 3.016 . 0 0 "[ . 1 . 2 . 3]" 2 234 1 131 ARG HB3 1 131 ARG HD3 2.500 . 3.500 2.565 2.278 3.693 0.193 27 0 "[ . 1 . 2 . 3]" 2 235 1 131 ARG HB3 1 131 ARG HD2 2.700 . 3.900 2.994 2.502 3.791 . 0 0 "[ . 1 . 2 . 3]" 2 236 1 131 ARG HB2 1 131 ARG HD2 2.200 . 3.000 2.304 2.155 2.846 . 0 0 "[ . 1 . 2 . 3]" 2 237 1 131 ARG HB2 1 131 ARG HD3 2.100 . 6.000 2.627 2.089 2.828 . 0 0 "[ . 1 . 2 . 3]" 2 238 1 131 ARG HD3 1 131 ARG HG2 2.400 . 3.300 2.509 2.346 2.761 . 0 0 "[ . 1 . 2 . 3]" 2 239 1 127 THR MG 1 131 ARG HD2 2.700 . 6.000 3.404 1.538 4.219 . 0 0 "[ . 1 . 2 . 3]" 2 240 1 41 LEU HB2 1 41 LEU MD2 2.600 . 3.600 3.191 3.174 3.205 . 0 0 "[ . 1 . 2 . 3]" 2 241 1 41 LEU HA 1 41 LEU HB2 2.700 . 3.800 2.637 2.622 2.658 . 0 0 "[ . 1 . 2 . 3]" 2 242 1 41 LEU HB2 1 41 LEU HG 2.700 . 3.800 2.489 2.417 2.538 . 0 0 "[ . 1 . 2 . 3]" 2 243 1 41 LEU HB3 1 41 LEU HG 2.600 . 3.700 3.019 3.012 3.024 . 0 0 "[ . 1 . 2 . 3]" 2 244 1 41 LEU HB2 1 73 TYR QD 3.000 . 4.300 3.472 3.273 3.743 . 0 0 "[ . 1 . 2 . 3]" 2 245 1 56 TYR HA 1 59 ARG QD 3.200 . 6.000 5.822 3.067 6.031 0.031 28 0 "[ . 1 . 2 . 3]" 2 246 1 139 ARG HB2 1 139 ARG HD2 2.200 . 3.000 2.299 1.911 2.744 . 0 0 "[ . 1 . 2 . 3]" 2 247 1 59 ARG HB3 1 59 ARG QD 2.200 . 3.000 2.308 1.918 3.236 0.236 17 0 "[ . 1 . 2 . 3]" 2 248 1 59 ARG QD 1 59 ARG HG3 2.200 . 3.000 2.340 2.140 2.531 . 0 0 "[ . 1 . 2 . 3]" 2 249 1 59 ARG QD 1 59 ARG HG2 2.100 . 2.900 2.310 2.140 2.528 . 0 0 "[ . 1 . 2 . 3]" 2 250 1 62 ARG HB3 1 62 ARG HD3 2.300 . 3.100 2.174 1.997 2.464 . 0 0 "[ . 1 . 2 . 3]" 2 251 1 62 ARG HD3 1 62 ARG QG 2.300 . 3.100 2.214 2.139 2.514 . 0 0 "[ . 1 . 2 . 3]" 2 252 1 62 ARG HB3 1 62 ARG HD2 2.200 . 3.000 2.127 2.021 2.306 . 0 0 "[ . 1 . 2 . 3]" 2 253 1 49 ILE MD 1 62 ARG HD2 3.200 . 4.700 3.822 2.945 4.456 . 0 0 "[ . 1 . 2 . 3]" 2 254 1 75 ARG HA 1 75 ARG QD 3.000 . 4.300 3.744 3.178 4.384 0.084 26 0 "[ . 1 . 2 . 3]" 2 255 1 39 TYR QD 1 75 ARG QD 3.000 . 4.300 3.798 3.232 4.319 0.019 19 0 "[ . 1 . 2 . 3]" 2 256 1 75 ARG QB 1 75 ARG HD2 2.500 . 3.500 2.371 1.942 2.808 . 0 0 "[ . 1 . 2 . 3]" 2 257 1 75 ARG QD 1 75 ARG QG 2.300 . 3.100 2.017 1.926 2.087 . 0 0 "[ . 1 . 2 . 3]" 2 258 1 39 TYR QE 1 75 ARG QD 2.800 . 4.000 3.441 2.475 4.007 0.007 13 0 "[ . 1 . 2 . 3]" 2 259 1 39 TYR HA 1 75 ARG QD 3.300 . 4.900 3.863 3.190 4.852 . 0 0 "[ . 1 . 2 . 3]" 2 260 1 36 LEU HB3 1 93 ILE MD 3.400 . 5.100 4.587 3.961 5.223 0.123 26 0 "[ . 1 . 2 . 3]" 2 261 1 36 LEU HB2 1 93 ILE MD 3.700 2.200 5.200 4.139 3.473 5.242 0.042 27 0 "[ . 1 . 2 . 3]" 2 262 1 36 LEU HB3 1 93 ILE QG 3.200 . 6.000 6.086 5.134 6.800 0.800 21 6 "[ . * 1 * * 2+ - * 3]" 2 263 1 36 LEU HB2 1 39 TYR QB 3.300 . 4.900 4.703 2.790 5.531 0.631 25 1 "[ . 1 . 2 + 3]" 2 264 1 36 LEU HA 1 36 LEU HB2 2.500 . 3.500 2.620 2.388 3.024 . 0 0 "[ . 1 . 2 . 3]" 2 265 1 36 LEU HB3 1 36 LEU MD1 2.400 . 3.300 2.699 1.904 3.181 . 0 0 "[ . 1 . 2 . 3]" 2 266 1 36 LEU HA 1 36 LEU HB3 2.500 . 3.500 2.858 2.250 3.024 . 0 0 "[ . 1 . 2 . 3]" 2 267 1 50 ILE MD 1 119 ARG HD2 3.200 . 4.700 4.022 3.689 4.430 . 0 0 "[ . 1 . 2 . 3]" 2 268 1 50 ILE MD 1 119 ARG HD3 3.400 . 5.000 4.814 4.178 5.047 0.047 15 0 "[ . 1 . 2 . 3]" 2 269 1 119 ARG HD2 1 119 ARG QG 2.300 . 3.200 2.424 2.204 2.524 . 0 0 "[ . 1 . 2 . 3]" 2 270 1 119 ARG HA 1 119 ARG HD2 2.600 . 3.600 3.013 2.033 3.615 0.015 19 0 "[ . 1 . 2 . 3]" 2 271 1 119 ARG HB2 1 119 ARG HD2 2.700 . 6.000 3.544 3.390 3.867 . 0 0 "[ . 1 . 2 . 3]" 2 272 1 119 ARG HB3 1 119 ARG HD2 2.700 . 3.800 2.293 2.038 2.975 . 0 0 "[ . 1 . 2 . 3]" 2 273 1 50 ILE MG 1 119 ARG HD2 3.000 . 4.300 3.148 2.717 3.879 . 0 0 "[ . 1 . 2 . 3]" 2 274 1 50 ILE MG 1 119 ARG HD3 3.100 . 4.500 4.227 3.725 4.495 . 0 0 "[ . 1 . 2 . 3]" 2 275 1 52 PHE QE 1 119 ARG HD3 2.900 . 6.000 5.056 4.774 5.347 . 0 0 "[ . 1 . 2 . 3]" 2 276 1 52 PHE QE 1 119 ARG HD2 2.700 . 6.000 4.563 4.290 5.303 . 0 0 "[ . 1 . 2 . 3]" 2 277 1 73 TYR HB2 1 94 THR HA 3.400 . 5.100 3.779 3.588 4.047 . 0 0 "[ . 1 . 2 . 3]" 2 278 1 73 TYR HB3 1 94 THR HA 3.400 . 6.000 5.202 5.069 5.458 . 0 0 "[ . 1 . 2 . 3]" 2 279 1 73 TYR HB3 1 74 TYR QD 2.900 . 6.000 5.125 4.769 5.318 . 0 0 "[ . 1 . 2 . 3]" 2 280 1 39 TYR QD 1 73 TYR HB2 2.700 . 3.800 3.710 3.418 3.828 0.028 14 0 "[ . 1 . 2 . 3]" 2 281 1 87 VAL MG1 1 125 CYS HB3 2.800 . 4.000 2.587 2.243 2.968 . 0 0 "[ . 1 . 2 . 3]" 2 282 1 109 PHE HB3 1 113 ASP HB3 3.000 . 4.300 2.782 2.453 3.021 . 0 0 "[ . 1 . 2 . 3]" 2 283 1 111 LYS QE 1 111 LYS HG3 2.200 . 3.000 2.434 1.928 3.116 0.116 13 0 "[ . 1 . 2 . 3]" 2 284 1 111 LYS QD 1 111 LYS QE 2.000 . 2.700 2.049 2.010 2.091 . 0 0 "[ . 1 . 2 . 3]" 2 285 1 111 LYS QE 1 111 LYS HG2 2.300 . 3.100 2.491 1.921 3.079 . 0 0 "[ . 1 . 2 . 3]" 2 286 1 111 LYS QB 1 111 LYS QE 2.900 . 4.200 3.416 2.910 3.777 . 0 0 "[ . 1 . 2 . 3]" 2 287 1 87 VAL QG 1 125 CYS HB2 2.500 . 3.500 2.833 2.420 3.191 . 0 0 "[ . 1 . 2 . 3]" 2 288 1 113 ASP HB3 1 117 MET ME 3.400 . 5.000 3.494 3.222 3.983 . 0 0 "[ . 1 . 2 . 3]" 2 289 1 93 ILE MD 1 96 LYS HE2 2.800 . 4.000 3.440 2.204 4.684 0.684 6 1 "[ .+ 1 . 2 . 3]" 2 290 1 112 THR HA 1 115 LYS QE 2.900 . 4.100 3.896 3.044 4.115 0.015 18 0 "[ . 1 . 2 . 3]" 2 291 1 115 LYS QB 1 115 LYS HE2 2.400 . 3.300 2.864 2.540 3.338 0.038 18 0 "[ . 1 . 2 . 3]" 2 292 1 115 LYS HD2 1 115 LYS HE2 1.900 . 2.600 2.060 1.943 2.372 . 0 0 "[ . 1 . 2 . 3]" 2 293 1 121 VAL MG1 1 125 CYS HB2 3.000 . 4.300 4.027 3.651 4.221 . 0 0 "[ . 1 . 2 . 3]" 2 294 1 68 TYR QE 1 113 ASP HB2 3.000 . 6.000 4.949 4.570 5.243 . 0 0 "[ . 1 . 2 . 3]" 2 295 1 109 PHE QD 1 113 ASP HB3 2.700 . 6.000 1.677 1.464 2.084 . 0 0 "[ . 1 . 2 . 3]" 2 296 1 109 PHE HB3 1 113 ASP HB2 2.900 . 4.200 3.043 2.736 3.211 . 0 0 "[ . 1 . 2 . 3]" 2 297 1 112 THR MG 1 115 LYS QE 2.900 . 4.100 3.055 1.901 3.489 . 0 0 "[ . 1 . 2 . 3]" 2 298 1 113 ASP HB3 1 114 VAL MG1 3.300 . 4.800 3.633 3.456 3.854 . 0 0 "[ . 1 . 2 . 3]" 2 299 1 52 PHE HB3 1 115 LYS HE3 3.000 . 4.300 2.777 2.252 4.517 0.217 20 0 "[ . 1 . 2 . 3]" 2 300 1 113 ASP HB2 1 117 MET ME 3.100 . 4.500 4.370 4.166 4.514 0.014 29 0 "[ . 1 . 2 . 3]" 2 301 1 52 PHE HB3 1 57 GLU HB3 3.200 . 4.700 3.568 3.159 4.131 . 0 0 "[ . 1 . 2 . 3]" 2 302 1 52 PHE QD 1 115 LYS QE 3.000 . 4.400 3.258 2.916 4.172 . 0 0 "[ . 1 . 2 . 3]" 2 303 1 52 PHE QE 1 115 LYS QE 2.900 . 6.000 4.493 4.198 5.304 . 0 0 "[ . 1 . 2 . 3]" 2 304 1 61 TYR HA 1 64 ASN HB2 3.300 . 4.900 2.451 2.263 2.708 . 0 0 "[ . 1 . 2 . 3]" 2 305 1 64 ASN QB 1 67 ARG HB2 3.300 . 4.900 3.284 2.826 4.432 . 0 0 "[ . 1 . 2 . 3]" 2 306 1 64 ASN HB3 1 68 TYR QD 3.000 . 4.300 2.585 2.244 3.059 . 0 0 "[ . 1 . 2 . 3]" 2 307 1 64 ASN QB 1 68 TYR QD 2.900 . 4.200 2.471 2.200 2.904 . 0 0 "[ . 1 . 2 . 3]" 2 308 1 89 ASP HA 1 89 ASP HB2 2.400 . 3.300 2.595 2.365 2.655 . 0 0 "[ . 1 . 2 . 3]" 2 309 1 55 ASP QB 1 56 TYR HA 3.200 . 4.700 4.109 3.800 4.623 . 0 0 "[ . 1 . 2 . 3]" 2 310 1 55 ASP HA 1 55 ASP QB 1.900 . 2.600 2.326 2.164 2.541 . 0 0 "[ . 1 . 2 . 3]" 2 311 1 108 ASN HA 1 108 ASN HB3 2.200 . 6.000 2.970 2.756 3.027 . 0 0 "[ . 1 . 2 . 3]" 2 312 1 55 ASP HA 1 58 ASP HB3 2.600 . 3.600 3.375 3.155 3.526 . 0 0 "[ . 1 . 2 . 3]" 2 313 1 74 TYR HA 1 74 TYR QB 3.000 . 4.300 2.184 2.181 2.186 . 0 0 "[ . 1 . 2 . 3]" 2 314 1 39 TYR QB 1 73 TYR QD 2.500 . 3.500 3.102 2.796 3.325 . 0 0 "[ . 1 . 2 . 3]" 2 315 1 82 ASN HA 1 82 ASN HB2 2.500 . 3.500 2.632 2.457 2.661 . 0 0 "[ . 1 . 2 . 3]" 2 316 1 82 ASN HA 1 82 ASN HB3 2.500 . 3.500 2.992 2.983 3.028 . 0 0 "[ . 1 . 2 . 3]" 2 317 1 50 ILE HB 1 50 ILE MD 2.400 . 3.300 3.172 3.104 3.226 . 0 0 "[ . 1 . 2 . 3]" 2 318 1 77 MET HB2 1 136 TYR HB3 3.300 . 6.000 5.382 4.556 6.830 0.830 18 1 "[ . 1 . + 2 . 3]" 2 319 1 136 TYR HA 1 136 TYR HB3 2.400 . 3.300 3.026 3.017 3.030 . 0 0 "[ . 1 . 2 . 3]" 2 320 1 133 SER HA 1 136 TYR HB2 2.700 . 3.800 3.552 3.280 3.814 0.014 27 0 "[ . 1 . 2 . 3]" 2 321 1 92 ASN HB3 1 93 ILE MD 3.400 . 6.000 5.358 4.730 6.003 0.003 27 0 "[ . 1 . 2 . 3]" 2 322 1 92 ASN HB2 1 93 ILE MD 3.600 2.200 5.200 4.932 3.851 5.746 0.546 20 1 "[ . 1 . + . 3]" 2 323 1 92 ASN HA 1 92 ASN HB2 2.200 . 3.000 2.390 2.234 2.575 . 0 0 "[ . 1 . 2 . 3]" 2 324 1 78 ASP HA 1 78 ASP HB2 2.300 . 3.200 2.793 2.413 3.026 . 0 0 "[ . 1 . 2 . 3]" 2 325 1 89 ASP HA 1 92 ASN HB2 2.500 . 6.000 4.743 4.058 5.239 . 0 0 "[ . 1 . 2 . 3]" 2 326 1 89 ASP HA 1 92 ASN HB3 2.500 . 6.000 3.713 2.627 4.717 . 0 0 "[ . 1 . 2 . 3]" 2 327 1 136 TYR HB3 1 137 TYR HA 3.300 . 4.800 4.343 4.133 4.523 . 0 0 "[ . 1 . 2 . 3]" 2 328 1 129 TYR HA 1 129 TYR HB2 2.500 . 3.500 2.393 2.343 2.438 . 0 0 "[ . 1 . 2 . 3]" 2 329 1 57 GLU QG 1 60 TYR QD 3.000 . 6.000 4.526 4.013 5.257 . 0 0 "[ . 1 . 2 . 3]" 2 330 1 57 GLU HB3 1 57 GLU QG 2.400 . 3.300 2.185 2.129 2.323 . 0 0 "[ . 1 . 2 . 3]" 2 331 1 57 GLU HA 1 57 GLU QG 2.900 . 3.300 2.341 2.165 2.889 . 0 0 "[ . 1 . 2 . 3]" 2 332 1 57 GLU HB2 1 57 GLU QG 2.600 . 3.600 2.443 2.157 2.524 . 0 0 "[ . 1 . 2 . 3]" 2 333 1 57 GLU QG 1 116 MET ME 2.800 . 3.000 2.653 2.317 2.968 . 0 0 "[ . 1 . 2 . 3]" 2 334 1 57 GLU QG 1 112 THR MG 3.300 . 4.800 3.709 3.454 4.036 . 0 0 "[ . 1 . 2 . 3]" 2 335 1 56 TYR QD 1 60 TYR HB2 2.900 . 6.000 4.572 4.322 5.044 . 0 0 "[ . 1 . 2 . 3]" 2 336 1 52 PHE HB2 1 57 GLU QG 3.100 . 4.500 3.136 2.678 3.582 . 0 0 "[ . 1 . 2 . 3]" 2 337 1 60 TYR HB3 1 116 MET ME 3.100 . 4.500 2.599 2.225 3.315 . 0 0 "[ . 1 . 2 . 3]" 2 338 1 134 GLN HA 1 137 TYR HB3 3.100 . 4.500 4.401 4.152 4.529 0.029 30 0 "[ . 1 . 2 . 3]" 2 339 1 52 PHE QE 1 61 TYR HB3 2.700 . 3.800 2.174 2.027 2.415 . 0 0 "[ . 1 . 2 . 3]" 2 340 1 60 TYR HB2 1 116 MET ME 3.300 . 4.900 3.999 3.697 4.593 . 0 0 "[ . 1 . 2 . 3]" 2 341 1 87 VAL MG1 1 126 ILE HB 3.100 . 4.500 3.929 3.728 4.308 . 0 0 "[ . 1 . 2 . 3]" 2 342 1 56 TYR HA 1 56 TYR HB3 2.400 . 3.300 3.004 2.991 3.019 . 0 0 "[ . 1 . 2 . 3]" 2 343 1 126 ILE HB 1 126 ILE MD 2.300 . 3.100 1.896 1.836 1.950 . 0 0 "[ . 1 . 2 . 3]" 2 344 1 123 GLN HA 1 126 ILE HB 2.800 . 4.000 3.135 2.823 3.459 . 0 0 "[ . 1 . 2 . 3]" 2 345 1 61 TYR HB3 1 116 MET ME 3.200 . 4.700 3.307 3.092 3.533 . 0 0 "[ . 1 . 2 . 3]" 2 346 1 60 TYR QD 1 61 TYR HB2 2.700 . 3.800 3.625 3.422 3.798 . 0 0 "[ . 1 . 2 . 3]" 2 347 1 85 ASN HB2 1 86 PHE QD 2.700 . 6.000 5.489 5.279 5.988 . 0 0 "[ . 1 . 2 . 3]" 2 348 1 85 ASN HA 1 85 ASN HB2 2.500 . 3.500 2.992 2.981 3.024 . 0 0 "[ . 1 . 2 . 3]" 2 349 1 86 PHE HA 1 86 PHE HB2 2.700 . 3.800 2.518 2.458 2.572 . 0 0 "[ . 1 . 2 . 3]" 2 350 1 86 PHE HB2 1 87 VAL MG1 3.300 . 4.800 4.393 4.116 4.732 . 0 0 "[ . 1 . 2 . 3]" 2 351 1 86 PHE HB3 1 129 TYR QD 3.000 . 4.300 2.543 1.917 2.913 . 0 0 "[ . 1 . 2 . 3]" 2 352 1 86 PHE HB3 1 87 VAL MG1 3.400 . 5.100 2.858 2.543 3.256 . 0 0 "[ . 1 . 2 . 3]" 2 353 1 94 THR HB 1 95 ILE HB 3.300 . 4.900 4.380 4.196 4.514 . 0 0 "[ . 1 . 2 . 3]" 2 354 1 45 MET HA 1 45 MET HB3 2.400 . 3.300 2.263 2.245 2.286 . 0 0 "[ . 1 . 2 . 3]" 2 355 1 95 ILE HB 1 95 ILE MD 2.400 . 3.300 2.103 1.986 2.213 . 0 0 "[ . 1 . 2 . 3]" 2 356 1 45 MET HB2 1 45 MET QG 2.300 . 3.200 2.279 2.126 2.500 . 0 0 "[ . 1 . 2 . 3]" 2 357 1 45 MET HB3 1 45 MET QG 2.300 . 3.200 2.386 2.172 2.525 . 0 0 "[ . 1 . 2 . 3]" 2 358 1 45 MET HA 1 45 MET HB2 2.400 . 3.300 2.719 2.666 2.769 . 0 0 "[ . 1 . 2 . 3]" 2 359 1 93 ILE HA 1 93 ILE HB 2.400 . 3.300 2.985 2.963 3.003 . 0 0 "[ . 1 . 2 . 3]" 2 360 1 90 CYS HA 1 93 ILE HB 3.100 . 4.500 3.207 2.906 3.490 . 0 0 "[ . 1 . 2 . 3]" 2 361 1 93 ILE HB 1 93 ILE QG 2.200 . 3.000 2.185 2.164 2.188 . 0 0 "[ . 1 . 2 . 3]" 2 362 1 73 TYR HB2 1 93 ILE HB 3.100 . 4.500 3.168 2.857 3.516 . 0 0 "[ . 1 . 2 . 3]" 2 363 1 39 TYR QE 1 93 ILE HB 3.000 . 4.300 3.822 3.493 4.072 . 0 0 "[ . 1 . 2 . 3]" 2 364 1 45 MET HB2 1 127 THR MG 3.200 . 4.700 3.807 3.202 4.011 . 0 0 "[ . 1 . 2 . 3]" 2 365 1 86 PHE QE 1 132 GLU HG3 3.000 . 4.300 3.738 1.936 4.824 0.524 26 1 "[ . 1 . 2 .+ 3]" 2 366 1 86 PHE QE 1 132 GLU HG2 3.000 . 6.000 4.218 2.975 5.207 . 0 0 "[ . 1 . 2 . 3]" 2 367 1 95 ILE HB 1 95 ILE HG13 2.700 . 3.800 2.881 2.818 2.932 . 0 0 "[ . 1 . 2 . 3]" 2 368 1 86 PHE HZ 1 132 GLU HG2 3.000 . 4.300 3.487 2.196 4.311 0.011 4 0 "[ . 1 . 2 . 3]" 2 369 1 132 GLU HB2 1 132 GLU HG3 2.500 . 3.500 2.517 2.206 3.010 . 0 0 "[ . 1 . 2 . 3]" 2 370 1 132 GLU HB2 1 132 GLU HG2 2.500 . 3.500 2.551 2.329 2.857 . 0 0 "[ . 1 . 2 . 3]" 2 371 1 63 GLU QB 1 63 GLU QG 2.200 . 2.800 2.038 1.989 2.085 . 0 0 "[ . 1 . 2 . 3]" 2 372 1 63 GLU HA 1 63 GLU QG 2.500 . 3.500 2.451 2.125 3.339 . 0 0 "[ . 1 . 2 . 3]" 2 373 1 95 ILE MD 1 118 GLU QG 2.600 . 3.600 2.402 2.047 3.404 . 0 0 "[ . 1 . 2 . 3]" 2 374 1 114 VAL MG2 1 118 GLU QG 2.600 . 6.000 3.946 3.650 4.183 . 0 0 "[ . 1 . 2 . 3]" 2 375 1 118 GLU HB2 1 118 GLU QG 2.400 . 3.300 2.273 2.116 2.400 . 0 0 "[ . 1 . 2 . 3]" 2 376 1 49 ILE HB 1 49 ILE HG12 2.500 . 3.500 2.451 2.427 2.470 . 0 0 "[ . 1 . 2 . 3]" 2 377 1 91 VAL QG 1 118 GLU QG 2.200 . 3.000 2.784 2.541 3.022 0.022 22 0 "[ . 1 . 2 . 3]" 2 378 1 107 GLU QB 1 107 GLU HG2 2.200 . 3.000 2.167 2.128 2.382 . 0 0 "[ . 1 . 2 . 3]" 2 379 1 107 GLU HA 1 107 GLU HG2 2.600 . 6.000 3.421 2.399 3.633 . 0 0 "[ . 1 . 2 . 3]" 2 380 1 107 GLU QB 1 107 GLU HG3 2.200 . 3.000 2.398 2.158 2.526 . 0 0 "[ . 1 . 2 . 3]" 2 381 1 107 GLU HG2 1 109 PHE QD 3.000 . 6.000 4.725 3.976 6.015 0.015 25 0 "[ . 1 . 2 . 3]" 2 382 1 107 GLU HG3 1 109 PHE QE 3.000 . 6.000 4.409 3.147 5.047 . 0 0 "[ . 1 . 2 . 3]" 2 383 1 107 GLU HA 1 107 GLU HG3 2.400 . 3.300 2.454 2.040 3.579 0.279 25 0 "[ . 1 . 2 . 3]" 2 384 1 107 GLU HG2 1 109 PHE QE 3.000 . 4.300 3.511 2.899 4.784 0.484 14 0 "[ . 1 . 2 . 3]" 2 385 1 107 GLU HG3 1 109 PHE QD 3.000 . 6.000 5.213 4.306 5.899 . 0 0 "[ . 1 . 2 . 3]" 2 386 1 130 GLU HA 1 130 GLU HG3 2.700 . 3.800 3.288 2.268 3.706 . 0 0 "[ . 1 . 2 . 3]" 2 387 1 61 TYR QE 1 68 TYR QB 2.900 . 4.200 2.851 2.679 3.080 . 0 0 "[ . 1 . 2 . 3]" 2 388 1 65 MET HB3 1 68 TYR QB 3.200 . 4.700 3.905 3.537 4.125 . 0 0 "[ . 1 . 2 . 3]" 2 389 1 40 MET HB2 1 40 MET ME 3.200 . 4.700 3.789 3.749 3.850 . 0 0 "[ . 1 . 2 . 3]" 2 390 1 40 MET HB2 1 40 MET QG 2.400 . 3.300 2.143 2.125 2.155 . 0 0 "[ . 1 . 2 . 3]" 2 391 1 113 ASP HA 1 116 MET QG 3.400 . 5.100 3.077 2.747 3.267 . 0 0 "[ . 1 . 2 . 3]" 2 392 1 52 PHE QE 1 116 MET QG 2.700 . 3.700 3.457 3.289 3.607 . 0 0 "[ . 1 . 2 . 3]" 2 393 1 60 TYR QD 1 116 MET QG 2.800 . 6.000 4.063 3.127 4.300 . 0 0 "[ . 1 . 2 . 3]" 2 394 1 116 MET ME 1 116 MET QG 2.600 . 2.800 2.097 1.970 2.190 . 0 0 "[ . 1 . 2 . 3]" 2 395 1 116 MET HA 1 116 MET QG 2.700 . 3.500 2.689 2.620 3.233 . 0 0 "[ . 1 . 2 . 3]" 2 396 1 116 MET HB3 1 116 MET QG 2.500 . 3.200 2.393 2.189 2.448 . 0 0 "[ . 1 . 2 . 3]" 2 397 1 41 LEU MD2 1 71 GLN HG3 3.000 . 4.300 4.105 3.986 4.248 . 0 0 "[ . 1 . 2 . 3]" 2 398 1 71 GLN HA 1 71 GLN HG3 2.600 . 3.700 3.155 2.906 3.422 . 0 0 "[ . 1 . 2 . 3]" 2 399 1 120 VAL HB 1 124 MET HB2 2.300 . 6.000 6.021 6.007 6.043 0.043 19 0 "[ . 1 . 2 . 3]" 2 400 1 71 GLN HB2 1 71 GLN HG3 2.500 . 3.500 2.457 2.335 2.588 . 0 0 "[ . 1 . 2 . 3]" 2 401 1 50 ILE HG12 1 123 GLN HG3 3.200 . 4.700 4.129 3.971 4.557 . 0 0 "[ . 1 . 2 . 3]" 2 402 1 72 VAL HB 1 121 VAL MG1 3.300 . 4.800 3.296 3.126 3.477 . 0 0 "[ . 1 . 2 . 3]" 2 403 1 122 GLU HA 1 123 GLN QG 3.300 . 6.000 4.848 4.773 4.928 . 0 0 "[ . 1 . 2 . 3]" 2 404 1 41 LEU MD1 1 97 GLN HG3 3.100 . 6.000 4.962 4.707 5.381 . 0 0 "[ . 1 . 2 . 3]" 2 405 1 93 ILE MG 1 97 GLN HG2 3.100 . 4.500 2.264 2.011 2.548 . 0 0 "[ . 1 . 2 . 3]" 2 406 1 95 ILE MD 1 117 MET HB3 2.900 . 4.200 2.705 2.457 2.949 . 0 0 "[ . 1 . 2 . 3]" 2 407 1 73 TYR QE 1 97 GLN HG3 2.800 . 4.000 3.230 2.700 3.489 . 0 0 "[ . 1 . 2 . 3]" 2 408 1 97 GLN HA 1 97 GLN HG3 2.500 . 3.500 3.224 2.778 3.492 . 0 0 "[ . 1 . 2 . 3]" 2 409 1 71 GLN HA 1 71 GLN HB2 2.500 . 3.500 3.022 3.009 3.025 . 0 0 "[ . 1 . 2 . 3]" 2 410 1 71 GLN HA 1 71 GLN HB3 2.500 . 3.500 2.424 2.363 2.468 . 0 0 "[ . 1 . 2 . 3]" 2 411 1 73 TYR QE 1 97 GLN HG2 2.800 . 4.000 3.694 3.261 4.016 0.016 25 0 "[ . 1 . 2 . 3]" 2 412 1 36 LEU MD1 1 97 GLN HG3 3.300 . 4.900 2.383 1.875 3.314 0.025 20 0 "[ . 1 . 2 . 3]" 2 413 1 73 TYR QD 1 97 GLN HG2 3.000 . 4.400 3.922 3.417 4.294 . 0 0 "[ . 1 . 2 . 3]" 2 414 1 95 ILE MD 1 117 MET HB2 2.800 . 4.000 3.727 3.517 3.901 . 0 0 "[ . 1 . 2 . 3]" 2 415 1 41 LEU MD1 1 71 GLN HB3 3.100 . 4.500 3.843 3.660 4.068 . 0 0 "[ . 1 . 2 . 3]" 2 416 1 48 PRO HB2 1 124 MET HG2 2.800 . 6.000 5.308 4.930 5.514 . 0 0 "[ . 1 . 2 . 3]" 2 417 1 48 PRO HB2 1 50 ILE HG12 2.900 . 4.100 3.352 3.297 3.469 . 0 0 "[ . 1 . 2 . 3]" 2 418 1 105 LYS HA 1 105 LYS HB2 2.400 . 3.300 2.990 2.959 3.022 . 0 0 "[ . 1 . 2 . 3]" 2 419 1 105 LYS HB2 1 105 LYS QG 2.100 . 2.900 2.159 2.131 2.518 . 0 0 "[ . 1 . 2 . 3]" 2 420 1 105 LYS HA 1 105 LYS HB3 2.200 . 3.000 2.626 2.514 2.684 . 0 0 "[ . 1 . 2 . 3]" 2 421 1 48 PRO HB2 1 50 ILE HG13 2.900 . 4.100 4.129 4.056 4.159 0.059 10 0 "[ . 1 . 2 . 3]" 2 422 1 124 MET ME 1 124 MET HG2 2.000 . 6.000 3.371 3.347 3.394 . 0 0 "[ . 1 . 2 . 3]" 2 423 1 48 PRO HB2 1 48 PRO HD2 3.000 . 4.300 2.921 2.891 2.945 . 0 0 "[ . 1 . 2 . 3]" 2 424 1 121 VAL HA 1 124 MET HG2 2.800 . 6.000 4.744 4.331 4.877 . 0 0 "[ . 1 . 2 . 3]" 2 425 1 116 MET HB3 1 116 MET ME 2.900 . 4.100 3.433 3.231 3.614 . 0 0 "[ . 1 . 2 . 3]" 2 426 1 48 PRO HB2 1 120 VAL HA 3.200 . 4.700 2.693 2.486 2.838 . 0 0 "[ . 1 . 2 . 3]" 2 427 1 48 PRO HB2 1 123 GLN HG3 3.000 . 4.300 2.527 2.401 2.761 . 0 0 "[ . 1 . 2 . 3]" 2 428 1 52 PHE QE 1 116 MET HB3 2.800 . 4.000 2.945 2.710 3.407 . 0 0 "[ . 1 . 2 . 3]" 2 429 1 121 VAL HA 1 124 MET HG3 3.100 . 4.500 3.308 2.744 3.501 . 0 0 "[ . 1 . 2 . 3]" 2 430 1 124 MET QB 1 124 MET HG3 2.600 . 3.600 2.253 2.207 2.290 . 0 0 "[ . 1 . 2 . 3]" 2 431 1 111 LYS QB 1 114 VAL MG2 2.800 . 4.000 3.824 3.472 4.036 0.036 28 0 "[ . 1 . 2 . 3]" 2 432 1 69 PRO HB2 1 69 PRO HG2 2.500 . 3.500 2.314 2.292 2.331 . 0 0 "[ . 1 . 2 . 3]" 2 433 1 52 PHE HZ 1 116 MET HB3 2.700 . 3.800 2.072 1.965 2.315 . 0 0 "[ . 1 . 2 . 3]" 2 434 1 40 MET QG 1 74 TYR QE 2.900 . 4.200 3.839 3.431 4.204 0.004 29 0 "[ . 1 . 2 . 3]" 2 435 1 52 PHE QD 1 116 MET HB3 2.700 . 6.000 4.547 4.245 5.143 . 0 0 "[ . 1 . 2 . 3]" 2 436 1 50 ILE MD 1 120 VAL HB 2.800 . 6.000 4.357 4.223 4.783 . 0 0 "[ . 1 . 2 . 3]" 2 437 1 48 PRO QD 1 124 MET HG3 3.300 . 4.900 2.519 2.343 2.813 . 0 0 "[ . 1 . 2 . 3]" 2 438 1 40 MET HB3 1 40 MET QG 2.100 . 2.900 2.362 2.124 2.465 . 0 0 "[ . 1 . 2 . 3]" 2 439 1 120 VAL HB 1 120 VAL QG 2.100 . 2.900 1.878 1.861 1.891 . 0 0 "[ . 1 . 2 . 3]" 2 440 1 69 PRO HB3 1 69 PRO HD2 3.100 . 4.500 3.880 3.872 3.903 . 0 0 "[ . 1 . 2 . 3]" 2 441 1 93 ILE HA 1 96 LYS QB 2.400 . 3.300 2.450 2.268 2.558 . 0 0 "[ . 1 . 2 . 3]" 2 442 1 87 VAL HB 1 125 CYS HB2 3.200 . 4.700 2.398 1.963 2.700 . 0 0 "[ . 1 . 2 . 3]" 2 443 1 72 VAL MG1 1 124 MET HG2 3.000 . 4.300 4.082 3.906 4.280 . 0 0 "[ . 1 . 2 . 3]" 2 444 1 69 PRO HB3 1 69 PRO HG3 2.500 . 3.500 2.309 2.289 2.323 . 0 0 "[ . 1 . 2 . 3]" 2 445 1 48 PRO HD3 1 124 MET HG2 3.200 . 4.700 2.734 2.577 2.871 . 0 0 "[ . 1 . 2 . 3]" 2 446 1 120 VAL MG1 1 124 MET HG2 3.000 . 4.300 4.141 3.772 4.309 0.009 2 0 "[ . 1 . 2 . 3]" 2 447 1 69 PRO HB3 1 69 PRO HG2 2.600 . 3.600 2.682 2.654 2.720 . 0 0 "[ . 1 . 2 . 3]" 2 448 1 48 PRO HG3 1 124 MET HG2 2.200 . 3.000 2.977 2.785 3.019 0.019 16 0 "[ . 1 . 2 . 3]" 2 449 1 100 VAL HB 1 101 THR MG 2.800 . 4.000 3.426 3.274 3.637 . 0 0 "[ . 1 . 2 . 3]" 2 450 1 105 LYS HB3 1 105 LYS QG 2.200 . 3.000 2.484 2.147 2.525 . 0 0 "[ . 1 . 2 . 3]" 2 451 1 100 VAL HB 1 101 THR HB 2.700 . 6.000 4.164 4.043 4.261 . 0 0 "[ . 1 . 2 . 3]" 2 452 1 115 LYS HA 1 115 LYS QB 2.000 . 2.700 2.350 2.124 2.446 . 0 0 "[ . 1 . 2 . 3]" 2 453 1 111 LYS HA 1 114 VAL HB 2.300 . 6.000 5.171 4.955 5.411 . 0 0 "[ . 1 . 2 . 3]" 2 454 1 69 PRO HG3 1 98 HIS HB3 3.200 . 4.700 3.057 2.864 3.336 . 0 0 "[ . 1 . 2 . 3]" 2 455 1 69 PRO HG2 1 98 HIS HB3 3.100 . 4.500 3.256 2.738 3.471 . 0 0 "[ . 1 . 2 . 3]" 2 456 1 45 MET HG3 1 48 PRO QD 3.400 . 5.000 4.692 4.305 5.012 0.012 28 0 "[ . 1 . 2 . 3]" 2 457 1 95 ILE HA 1 98 HIS HB3 3.100 . 6.000 4.690 4.547 4.876 . 0 0 "[ . 1 . 2 . 3]" 2 458 1 98 HIS HB3 1 109 PHE HB2 3.400 . 6.000 5.937 5.632 6.025 0.025 10 0 "[ . 1 . 2 . 3]" 2 459 1 45 MET HA 1 45 MET HG3 2.800 . 4.000 3.890 3.505 4.203 0.203 16 0 "[ . 1 . 2 . 3]" 2 460 1 45 MET QB 1 45 MET HG2 2.300 . 3.100 2.387 2.172 2.527 . 0 0 "[ . 1 . 2 . 3]" 2 461 1 45 MET QB 1 45 MET HG3 2.200 . 3.000 2.279 2.125 2.502 . 0 0 "[ . 1 . 2 . 3]" 2 462 1 45 MET ME 1 45 MET HG3 2.400 . 3.300 2.428 2.021 2.910 . 0 0 "[ . 1 . 2 . 3]" 2 463 1 45 MET HA 1 45 MET HG2 3.300 2.300 4.500 3.523 3.346 3.708 . 0 0 "[ . 1 . 2 . 3]" 2 464 1 102 THR MG 1 107 GLU HB3 2.600 . 3.600 2.810 2.418 3.337 . 0 0 "[ . 1 . 2 . 3]" 2 465 1 107 GLU HA 1 107 GLU HB2 2.300 . 3.200 2.817 2.661 2.987 . 0 0 "[ . 1 . 2 . 3]" 2 466 1 102 THR MG 1 107 GLU HB2 2.700 . 3.800 2.363 2.057 3.008 . 0 0 "[ . 1 . 2 . 3]" 2 467 1 107 GLU HA 1 107 GLU HB3 2.300 . 3.200 2.868 2.642 2.980 . 0 0 "[ . 1 . 2 . 3]" 2 468 1 107 GLU HB3 1 107 GLU HG3 2.400 . 3.300 2.569 2.273 2.823 . 0 0 "[ . 1 . 2 . 3]" 2 469 1 107 GLU HB2 1 107 GLU HG3 2.400 . 3.300 2.913 2.366 3.011 . 0 0 "[ . 1 . 2 . 3]" 2 470 1 103 THR HA 1 107 GLU QB 3.000 . 4.300 2.580 2.088 2.765 . 0 0 "[ . 1 . 2 . 3]" 2 471 1 87 VAL MG1 1 126 ILE HG13 2.800 . 6.000 1.966 1.600 2.350 . 0 0 "[ . 1 . 2 . 3]" 2 472 1 107 GLU HB3 1 107 GLU HG2 2.400 . 3.300 2.389 2.207 3.011 . 0 0 "[ . 1 . 2 . 3]" 2 473 1 65 MET ME 1 65 MET HG3 2.800 . 4.000 3.306 3.116 3.385 . 0 0 "[ . 1 . 2 . 3]" 2 474 1 107 GLU HB3 1 109 PHE QD 2.800 . 4.000 3.711 3.464 3.999 . 0 0 "[ . 1 . 2 . 3]" 2 475 1 139 ARG HA 1 139 ARG QB 2.300 . 3.100 2.494 2.155 2.540 . 0 0 "[ . 1 . 2 . 3]" 2 476 1 67 ARG HB2 1 67 ARG HG2 2.800 . 4.000 2.910 2.692 3.004 . 0 0 "[ . 1 . 2 . 3]" 2 477 1 139 ARG HB3 1 139 ARG HD3 2.400 . 3.300 2.673 1.937 3.336 0.036 17 0 "[ . 1 . 2 . 3]" 2 478 1 75 ARG QB 1 76 PRO HG2 2.500 . 3.500 3.509 3.192 3.565 0.065 8 0 "[ . 1 . 2 . 3]" 2 479 1 67 ARG HA 1 67 ARG HB2 2.900 . 4.200 3.017 3.003 3.023 . 0 0 "[ . 1 . 2 . 3]" 2 480 1 52 PHE QD 1 119 ARG HB3 2.800 . 6.000 4.750 4.054 5.172 . 0 0 "[ . 1 . 2 . 3]" 2 481 1 52 PHE QD 1 57 GLU HB2 2.800 . 4.000 3.116 2.689 3.473 . 0 0 "[ . 1 . 2 . 3]" 2 482 1 67 ARG HB2 1 67 ARG HD2 2.900 . 4.100 2.847 1.982 3.571 . 0 0 "[ . 1 . 2 . 3]" 2 483 1 65 MET HG2 1 68 TYR QB 3.100 . 4.500 4.139 3.688 4.423 . 0 0 "[ . 1 . 2 . 3]" 2 484 1 65 MET HB2 1 65 MET ME 3.100 . 4.500 3.575 3.224 3.887 . 0 0 "[ . 1 . 2 . 3]" 2 485 1 95 ILE HA 1 95 ILE HG13 2.700 . 3.800 2.095 2.008 2.160 . 0 0 "[ . 1 . 2 . 3]" 2 486 1 95 ILE HG13 1 117 MET HB2 3.100 . 4.500 3.619 3.275 3.695 . 0 0 "[ . 1 . 2 . 3]" 2 487 1 131 ARG HB2 1 131 ARG HD2 3.000 2.100 4.100 2.759 2.453 3.552 . 0 0 "[ . 1 . 2 . 3]" 2 488 1 128 GLN HA 1 131 ARG HB3 2.700 . 3.800 3.745 3.181 3.831 0.031 24 0 "[ . 1 . 2 . 3]" 2 489 1 52 PHE QD 1 57 GLU HB3 2.900 . 4.100 2.030 1.900 2.223 . 0 0 "[ . 1 . 2 . 3]" 2 490 1 52 PHE HB2 1 57 GLU HB3 3.100 . 4.500 2.284 2.075 2.701 . 0 0 "[ . 1 . 2 . 3]" 2 491 1 65 MET HB3 1 68 TYR HB2 3.200 . 4.700 4.044 3.680 4.287 . 0 0 "[ . 1 . 2 . 3]" 2 492 1 61 TYR QE 1 65 MET HB3 3.400 2.400 4.600 4.581 4.361 4.632 0.032 24 0 "[ . 1 . 2 . 3]" 2 493 1 131 ARG HA 1 131 ARG HB2 2.400 . 3.300 3.020 2.988 3.027 . 0 0 "[ . 1 . 2 . 3]" 2 494 1 119 ARG HB2 1 120 VAL MG2 3.000 . 4.300 3.043 2.811 3.190 . 0 0 "[ . 1 . 2 . 3]" 2 495 1 57 GLU HA 1 57 GLU HB2 2.800 . 4.000 2.994 2.972 3.020 . 0 0 "[ . 1 . 2 . 3]" 2 496 1 52 PHE HB3 1 57 GLU HB2 3.100 . 4.500 4.038 3.544 4.396 . 0 0 "[ . 1 . 2 . 3]" 2 497 1 65 MET HB3 1 68 TYR QD 2.700 . 6.000 4.847 4.553 5.083 . 0 0 "[ . 1 . 2 . 3]" 2 498 1 75 ARG QB 1 76 PRO HD3 3.000 . 4.300 3.817 3.503 3.969 . 0 0 "[ . 1 . 2 . 3]" 2 499 1 52 PHE HB2 1 57 GLU HB2 3.000 . 4.300 2.507 2.200 2.776 . 0 0 "[ . 1 . 2 . 3]" 2 500 1 52 PHE QE 1 119 ARG HB3 2.800 . 4.000 3.559 3.253 3.820 . 0 0 "[ . 1 . 2 . 3]" 2 501 1 56 TYR QE 1 57 GLU HB3 3.000 . 6.000 5.499 5.253 5.861 . 0 0 "[ . 1 . 2 . 3]" 2 502 1 52 PHE QE 1 119 ARG HB2 2.700 . 3.800 2.445 1.943 2.833 . 0 0 "[ . 1 . 2 . 3]" 2 503 1 62 ARG HB3 1 62 ARG HD2 2.800 . 4.000 2.502 2.128 4.182 0.182 14 0 "[ . 1 . 2 . 3]" 2 504 1 62 ARG HB3 1 62 ARG HD3 3.100 . 4.500 3.410 2.112 3.787 . 0 0 "[ . 1 . 2 . 3]" 2 505 1 59 ARG HA 1 62 ARG HB3 2.500 . 6.000 3.811 3.336 4.263 . 0 0 "[ . 1 . 2 . 3]" 2 506 1 47 ARG HB3 1 68 TYR QB 2.700 . 6.000 4.435 3.994 5.948 . 0 0 "[ . 1 . 2 . 3]" 2 507 1 51 HIS HB3 1 52 PHE QD 2.800 . 6.000 5.616 5.261 5.785 . 0 0 "[ . 1 . 2 . 3]" 2 508 1 51 HIS HB2 1 51 HIS HD2 3.000 . 4.300 3.927 3.843 3.972 . 0 0 "[ . 1 . 2 . 3]" 2 509 1 51 HIS HB3 1 51 HIS HD2 2.600 . 3.700 3.331 3.141 3.538 . 0 0 "[ . 1 . 2 . 3]" 2 510 1 122 GLU HB2 1 126 ILE MD 3.100 . 4.500 4.358 4.086 4.507 0.007 22 0 "[ . 1 . 2 . 3]" 2 511 1 91 VAL QG 1 122 GLU HB2 2.600 . 3.700 2.446 2.018 2.657 . 0 0 "[ . 1 . 2 . 3]" 2 512 1 96 LYS HB2 1 96 LYS HD2 2.400 . 3.300 2.059 1.912 2.675 . 0 0 "[ . 1 . 2 . 3]" 2 513 1 96 LYS HA 1 96 LYS QD 2.700 . 6.000 4.120 4.027 4.322 . 0 0 "[ . 1 . 2 . 3]" 2 514 1 91 VAL QG 1 122 GLU HB3 2.600 . 3.600 2.901 2.541 3.137 . 0 0 "[ . 1 . 2 . 3]" 2 515 1 96 LYS QD 1 96 LYS HE3 2.200 . 3.000 2.112 2.083 2.132 . 0 0 "[ . 1 . 2 . 3]" 2 516 1 115 LYS QD 1 118 GLU HB3 2.400 . 6.000 6.033 5.979 6.376 0.376 18 0 "[ . 1 . 2 . 3]" 2 517 1 112 THR MG 1 115 LYS HD2 2.800 . 4.000 3.926 3.292 4.041 0.041 28 0 "[ . 1 . 2 . 3]" 2 518 1 93 ILE HA 1 96 LYS HD3 3.100 . 4.500 3.228 2.718 4.439 . 0 0 "[ . 1 . 2 . 3]" 2 519 1 132 GLU HB3 1 135 ALA MB 2.900 . 6.000 4.520 4.212 4.924 . 0 0 "[ . 1 . 2 . 3]" 2 520 1 115 LYS QD 1 116 MET HA 2.600 . 3.700 2.905 2.593 3.760 0.060 25 0 "[ . 1 . 2 . 3]" 2 521 1 95 ILE MD 1 118 GLU HB2 3.000 . 4.300 4.007 3.807 4.229 . 0 0 "[ . 1 . 2 . 3]" 2 522 1 95 ILE MD 1 118 GLU HB3 2.900 . 4.200 3.958 3.770 4.155 . 0 0 "[ . 1 . 2 . 3]" 2 523 1 138 GLN HA 1 138 GLN HB2 2.300 . 3.100 2.393 2.357 2.444 . 0 0 "[ . 1 . 2 . 3]" 2 524 1 49 ILE MG 1 62 ARG QG 3.300 . 4.700 3.792 3.305 4.092 . 0 0 "[ . 1 . 2 . 3]" 2 525 1 134 GLN QB 1 135 ALA MB 3.100 . 4.400 3.914 3.708 4.472 0.072 18 0 "[ . 1 . 2 . 3]" 2 526 1 126 ILE MG 1 130 GLU HB3 3.400 . 6.000 5.602 5.316 5.855 . 0 0 "[ . 1 . 2 . 3]" 2 527 1 127 THR MG 1 130 GLU HB3 3.200 . 6.000 5.164 4.694 5.667 . 0 0 "[ . 1 . 2 . 3]" 2 528 1 127 THR MG 1 130 GLU HB2 3.100 . 4.500 4.093 3.681 4.336 . 0 0 "[ . 1 . 2 . 3]" 2 529 1 130 GLU HA 1 130 GLU HB3 2.500 . 3.500 2.626 2.534 2.722 . 0 0 "[ . 1 . 2 . 3]" 2 530 1 130 GLU HB3 1 134 GLN QG 2.800 . 6.000 4.543 3.950 5.689 . 0 0 "[ . 1 . 2 . 3]" 2 531 1 130 GLU HB3 1 130 GLU HG3 2.300 . 3.200 2.831 2.588 3.010 . 0 0 "[ . 1 . 2 . 3]" 2 532 1 97 GLN HB2 1 101 THR MG 3.000 . 6.000 4.939 4.808 5.043 . 0 0 "[ . 1 . 2 . 3]" 2 533 1 134 GLN HA 1 134 GLN QB 2.000 . 2.700 2.449 2.163 2.541 . 0 0 "[ . 1 . 2 . 3]" 2 534 1 133 SER HB3 1 134 GLN QB 2.600 . 6.000 5.322 4.651 5.621 . 0 0 "[ . 1 . 2 . 3]" 2 535 1 73 TYR QD 1 97 GLN HB3 3.000 . 6.000 4.472 4.240 4.817 . 0 0 "[ . 1 . 2 . 3]" 2 536 1 73 TYR QD 1 97 GLN HB2 2.900 . 4.200 3.787 3.617 4.008 . 0 0 "[ . 1 . 2 . 3]" 2 537 1 97 GLN HA 1 97 GLN HB3 2.400 . 3.300 2.771 2.671 2.801 . 0 0 "[ . 1 . 2 . 3]" 2 538 1 93 ILE MG 1 97 GLN HB3 3.400 . 5.100 4.298 4.121 4.457 . 0 0 "[ . 1 . 2 . 3]" 2 539 1 123 GLN HB2 1 123 GLN HG3 2.100 . 2.800 2.207 2.206 2.210 . 0 0 "[ . 1 . 2 . 3]" 2 540 1 120 VAL QG 1 123 GLN HB3 3.300 . 6.000 5.176 5.031 5.292 . 0 0 "[ . 1 . 2 . 3]" 2 541 1 48 PRO HA 1 123 GLN HB3 3.400 . 5.100 4.931 4.697 5.093 . 0 0 "[ . 1 . 2 . 3]" 2 542 1 120 VAL QG 1 123 GLN HB2 3.200 . 4.700 3.957 3.764 4.075 . 0 0 "[ . 1 . 2 . 3]" 2 543 1 59 ARG QB 1 59 ARG HG3 1.900 . 2.600 2.176 2.129 2.516 . 0 0 "[ . 1 . 2 . 3]" 2 544 1 120 VAL HA 1 123 GLN HB3 2.900 . 6.000 5.008 4.896 5.120 . 0 0 "[ . 1 . 2 . 3]" 2 545 1 50 ILE MD 1 123 GLN HB3 3.000 . 4.300 4.133 4.026 4.305 0.005 20 0 "[ . 1 . 2 . 3]" 2 546 1 123 GLN HB3 1 123 GLN QG 2.100 . 2.800 2.524 2.521 2.526 . 0 0 "[ . 1 . 2 . 3]" 2 547 1 123 GLN HA 1 123 GLN HB3 2.400 . 3.300 2.351 2.321 2.384 . 0 0 "[ . 1 . 2 . 3]" 2 548 1 50 ILE MD 1 123 GLN HB2 2.900 . 4.100 3.651 3.529 3.808 . 0 0 "[ . 1 . 2 . 3]" 2 549 1 73 TYR QD 1 93 ILE QG 3.000 . 6.000 5.288 5.093 5.483 . 0 0 "[ . 1 . 2 . 3]" 2 550 1 59 ARG QB 1 59 ARG HG2 2.100 . 2.900 2.448 2.126 2.527 . 0 0 "[ . 1 . 2 . 3]" 2 551 1 75 ARG QG 1 93 ILE MD 3.300 . 6.000 5.873 5.491 6.036 0.036 24 0 "[ . 1 . 2 . 3]" 2 552 1 75 ARG HG3 1 76 PRO HD2 3.400 . 5.000 3.757 3.315 4.775 . 0 0 "[ . 1 . 2 . 3]" 2 553 1 97 GLN HB3 1 101 THR MG 2.600 . 3.700 3.604 3.500 3.708 0.008 7 0 "[ . 1 . 2 . 3]" 2 554 1 39 TYR QE 1 75 ARG QG 2.800 . 4.000 3.028 2.382 3.462 . 0 0 "[ . 1 . 2 . 3]" 2 555 1 48 PRO QG 1 50 ILE MD 3.000 . 4.300 3.789 3.651 3.851 . 0 0 "[ . 1 . 2 . 3]" 2 556 1 39 TYR QD 1 75 ARG QG 3.000 . 4.300 2.643 2.348 2.875 . 0 0 "[ . 1 . 2 . 3]" 2 557 1 67 ARG HB3 1 67 ARG HG2 3.000 . 4.300 2.262 2.209 2.369 . 0 0 "[ . 1 . 2 . 3]" 2 558 1 59 ARG HG2 1 62 ARG HB3 3.000 . 6.000 4.789 4.104 6.505 0.505 17 1 "[ . 1 . + 2 . 3]" 2 559 1 69 PRO HD3 1 69 PRO HG2 2.600 . 3.700 2.678 2.672 2.701 . 0 0 "[ . 1 . 2 . 3]" 2 560 1 69 PRO HD2 1 69 PRO HG3 2.600 . 3.700 2.995 2.986 2.998 . 0 0 "[ . 1 . 2 . 3]" 2 561 1 67 ARG HB3 1 67 ARG HG3 2.700 . 3.800 2.917 2.703 3.006 . 0 0 "[ . 1 . 2 . 3]" 2 562 1 127 THR MG 1 131 ARG HG2 2.600 . 3.700 3.568 3.369 3.755 0.055 16 0 "[ . 1 . 2 . 3]" 2 563 1 69 PRO HG3 1 102 THR MG 2.600 . 3.600 3.161 2.876 3.408 . 0 0 "[ . 1 . 2 . 3]" 2 564 1 49 ILE HG12 1 49 ILE MG 2.500 . 3.500 3.198 3.187 3.207 . 0 0 "[ . 1 . 2 . 3]" 2 565 1 139 ARG QD 1 139 ARG HG3 2.300 . 3.200 2.344 2.140 2.531 . 0 0 "[ . 1 . 2 . 3]" 2 566 1 139 ARG HA 1 139 ARG HG2 2.500 . 3.500 2.347 2.036 3.818 0.318 17 0 "[ . 1 . 2 . 3]" 2 567 1 139 ARG HA 1 139 ARG HG3 2.800 . 3.800 2.969 2.562 3.519 . 0 0 "[ . 1 . 2 . 3]" 2 568 1 139 ARG QD 1 139 ARG HG2 2.300 . 3.200 2.313 2.137 2.530 . 0 0 "[ . 1 . 2 . 3]" 2 569 1 128 GLN HA 1 131 ARG HG3 3.000 . 6.000 2.286 1.698 3.219 . 0 0 "[ . 1 . 2 . 3]" 2 570 1 36 LEU MD1 1 36 LEU HG 2.400 . 3.300 2.101 2.075 2.126 . 0 0 "[ . 1 . 2 . 3]" 2 571 1 131 ARG HD2 1 131 ARG HG3 2.500 . 3.500 2.482 2.211 3.005 . 0 0 "[ . 1 . 2 . 3]" 2 572 1 36 LEU HG 1 41 LEU MD1 2.400 . 6.000 5.634 4.188 6.014 0.014 12 0 "[ . 1 . 2 . 3]" 2 573 1 131 ARG HD3 1 131 ARG HG3 2.500 . 3.500 2.910 2.274 3.017 . 0 0 "[ . 1 . 2 . 3]" 2 574 1 119 ARG HB3 1 119 ARG HG2 2.300 . 3.200 2.994 2.962 3.010 . 0 0 "[ . 1 . 2 . 3]" 2 575 1 119 ARG HB3 1 119 ARG HG3 2.200 . 3.000 2.553 2.473 2.649 . 0 0 "[ . 1 . 2 . 3]" 2 576 1 119 ARG HD3 1 119 ARG HG3 2.500 . 3.500 2.954 2.439 3.017 . 0 0 "[ . 1 . 2 . 3]" 2 577 1 119 ARG HD2 1 119 ARG HG3 2.500 . 3.500 2.600 2.274 3.016 . 0 0 "[ . 1 . 2 . 3]" 2 578 1 52 PHE QE 1 119 ARG HG3 2.600 . 3.600 2.251 1.908 2.712 . 0 0 "[ . 1 . 2 . 3]" 2 579 1 116 MET HA 1 119 ARG HG3 3.000 . 4.300 3.250 2.828 3.788 . 0 0 "[ . 1 . 2 . 3]" 2 580 1 119 ARG HA 1 119 ARG HG3 2.600 . 6.000 3.836 3.712 3.896 . 0 0 "[ . 1 . 2 . 3]" 2 581 1 50 ILE MD 1 119 ARG HG3 2.900 . 6.000 4.154 3.838 4.478 . 0 0 "[ . 1 . 2 . 3]" 2 582 1 52 PHE QE 1 119 ARG HG2 2.700 . 3.800 3.373 2.940 3.620 . 0 0 "[ . 1 . 2 . 3]" 2 583 1 50 ILE HG13 1 52 PHE QE 3.000 . 4.400 3.691 2.927 4.053 . 0 0 "[ . 1 . 2 . 3]" 2 584 1 50 ILE MD 1 119 ARG HG2 3.000 . 6.000 4.592 4.368 4.960 . 0 0 "[ . 1 . 2 . 3]" 2 585 1 50 ILE HA 1 50 ILE HG13 3.200 2.200 4.400 3.922 3.872 3.977 . 0 0 "[ . 1 . 2 . 3]" 2 586 1 50 ILE HG13 1 50 ILE MG 2.500 . 3.500 2.706 2.530 2.882 . 0 0 "[ . 1 . 2 . 3]" 2 587 1 50 ILE HG12 1 50 ILE MG 2.500 . 3.500 3.146 3.064 3.187 . 0 0 "[ . 1 . 2 . 3]" 2 588 1 50 ILE HG12 1 120 VAL MG2 3.200 . 4.600 2.688 2.384 2.864 . 0 0 "[ . 1 . 2 . 3]" 2 589 1 50 ILE HG12 1 119 ARG HB2 3.400 . 6.000 4.600 4.230 4.817 . 0 0 "[ . 1 . 2 . 3]" 2 590 1 50 ILE HG13 1 120 VAL MG1 3.000 . 4.300 3.824 3.549 4.284 . 0 0 "[ . 1 . 2 . 3]" 2 591 1 50 ILE HG13 1 119 ARG HB2 3.300 . 4.900 3.044 2.478 3.275 . 0 0 "[ . 1 . 2 . 3]" 2 592 1 41 LEU MD1 1 73 TYR QD 2.800 . 4.000 3.763 3.554 3.958 . 0 0 "[ . 1 . 2 . 3]" 2 593 1 41 LEU MD1 1 41 LEU MD2 1.900 . 2.600 2.031 1.878 2.083 . 0 0 "[ . 1 . 2 . 3]" 2 594 1 41 LEU MD1 1 73 TYR QE 2.600 . 3.700 2.456 2.043 2.846 . 0 0 "[ . 1 . 2 . 3]" 2 595 1 41 LEU HB2 1 41 LEU MD1 2.200 . 3.000 2.241 2.120 2.357 . 0 0 "[ . 1 . 2 . 3]" 2 596 1 41 LEU HB3 1 41 LEU MD1 2.100 . 2.900 2.429 2.340 2.538 . 0 0 "[ . 1 . 2 . 3]" 2 597 1 41 LEU MD1 1 41 LEU HG 2.100 . 2.800 2.108 2.081 2.126 . 0 0 "[ . 1 . 2 . 3]" 2 598 1 41 LEU MD1 1 43 SER HB3 3.400 . 6.000 6.023 6.007 6.034 0.034 26 0 "[ . 1 . 2 . 3]" 2 599 1 41 LEU MD1 1 71 GLN HG3 3.400 . 6.000 5.531 5.270 5.776 . 0 0 "[ . 1 . 2 . 3]" 2 600 1 41 LEU MD1 1 71 GLN HB2 3.100 . 4.500 4.048 3.775 4.351 . 0 0 "[ . 1 . 2 . 3]" 2 601 1 93 ILE MD 1 96 LYS HG2 3.500 2.200 5.000 4.634 3.356 4.993 . 0 0 "[ . 1 . 2 . 3]" 2 602 1 93 ILE MD 1 96 LYS HG3 3.300 . 4.800 4.776 4.317 4.936 0.136 11 0 "[ . 1 . 2 . 3]" 2 603 1 96 LYS QB 1 96 LYS HG3 2.400 . 3.300 2.193 2.137 2.332 . 0 0 "[ . 1 . 2 . 3]" 2 604 1 96 LYS QE 1 96 LYS HG3 2.600 . 3.600 3.101 2.028 3.493 . 0 0 "[ . 1 . 2 . 3]" 2 605 1 121 VAL MG1 1 124 MET ME 2.500 . 3.500 3.301 3.069 3.489 . 0 0 "[ . 1 . 2 . 3]" 2 606 1 93 ILE HA 1 96 LYS HG3 3.200 . 6.000 5.107 4.747 5.258 . 0 0 "[ . 1 . 2 . 3]" 2 607 1 121 VAL HB 1 121 VAL MG1 2.200 . 3.000 2.107 2.084 2.129 . 0 0 "[ . 1 . 2 . 3]" 2 608 1 94 THR HB 1 121 VAL MG1 2.300 . 3.200 1.851 1.612 2.052 . 0 0 "[ . 1 . 2 . 3]" 2 609 1 95 ILE MD 1 121 VAL MG1 2.400 . 3.300 2.538 2.296 2.888 . 0 0 "[ . 1 . 2 . 3]" 2 610 1 112 THR HA 1 115 LYS HG3 3.400 . 5.000 4.175 3.547 4.660 . 0 0 "[ . 1 . 2 . 3]" 2 611 1 94 THR HA 1 121 VAL MG1 3.300 . 4.800 4.340 4.303 4.386 . 0 0 "[ . 1 . 2 . 3]" 2 612 1 115 LYS QB 1 115 LYS HG2 2.200 . 3.000 2.455 2.100 2.514 . 0 0 "[ . 1 . 2 . 3]" 2 613 1 91 VAL QG 1 121 VAL MG1 2.000 . 2.700 2.191 1.978 2.427 . 0 0 "[ . 1 . 2 . 3]" 2 614 1 115 LYS HE2 1 115 LYS HG3 2.700 . 3.800 2.648 2.100 3.564 . 0 0 "[ . 1 . 2 . 3]" 2 615 1 96 LYS QD 1 96 LYS HG3 2.000 . 2.700 2.190 2.142 2.478 . 0 0 "[ . 1 . 2 . 3]" 2 616 1 36 LEU MD1 1 73 TYR QE 2.600 . 3.600 2.409 1.872 3.676 0.076 14 0 "[ . 1 . 2 . 3]" 2 617 1 112 THR HA 1 115 LYS HG2 3.100 . 6.000 5.006 2.483 5.479 . 0 0 "[ . 1 . 2 . 3]" 2 618 1 36 LEU MD1 1 37 GLY HA3 3.200 . 6.000 5.211 3.486 5.888 . 0 0 "[ . 1 . 2 . 3]" 2 619 1 87 VAL MG1 1 129 TYR HB2 2.900 . 4.100 2.795 2.230 3.079 . 0 0 "[ . 1 . 2 . 3]" 2 620 1 36 LEU HA 1 36 LEU MD1 2.400 . 3.300 3.071 2.102 3.655 0.355 21 0 "[ . 1 . 2 . 3]" 2 621 1 36 LEU MD1 1 40 MET ME 3.100 . 6.000 5.692 5.311 5.998 . 0 0 "[ . 1 . 2 . 3]" 2 622 1 96 LYS HG3 1 100 VAL MG2 2.700 . 6.000 4.309 3.133 4.716 . 0 0 "[ . 1 . 2 . 3]" 2 623 1 87 VAL MG1 1 88 HIS HD2 2.700 . 6.000 5.570 4.530 6.076 0.076 21 0 "[ . 1 . 2 . 3]" 2 624 1 86 PHE QD 1 87 VAL MG1 2.200 . 3.000 2.545 2.045 2.882 . 0 0 "[ . 1 . 2 . 3]" 2 625 1 36 LEU MD1 1 39 TYR QB 3.100 . 4.500 4.357 2.789 4.552 0.052 11 0 "[ . 1 . 2 . 3]" 2 626 1 86 PHE QE 1 87 VAL MG1 2.800 . 6.000 4.199 3.717 4.542 . 0 0 "[ . 1 . 2 . 3]" 2 627 1 87 VAL MG1 1 90 CYS HB3 3.000 . 4.300 4.103 3.880 4.312 0.012 11 0 "[ . 1 . 2 . 3]" 2 628 1 87 VAL MG1 1 126 ILE MD 2.000 . 2.700 2.474 2.265 2.621 . 0 0 "[ . 1 . 2 . 3]" 2 629 1 87 VAL HB 1 87 VAL MG1 2.100 . 2.800 2.107 2.083 2.129 . 0 0 "[ . 1 . 2 . 3]" 2 630 1 84 ASN HA 1 87 VAL MG1 2.800 . 6.000 3.991 3.036 4.466 . 0 0 "[ . 1 . 2 . 3]" 2 631 1 120 VAL HA 1 121 VAL MG2 3.200 . 6.000 5.084 5.011 5.153 . 0 0 "[ . 1 . 2 . 3]" 2 632 1 69 PRO HD2 1 121 VAL MG2 2.800 . 6.000 4.277 4.052 4.645 . 0 0 "[ . 1 . 2 . 3]" 2 633 1 121 VAL HB 1 121 VAL MG2 2.200 . 3.000 2.117 2.086 2.130 . 0 0 "[ . 1 . 2 . 3]" 2 634 1 47 ARG HA 1 120 VAL MG1 2.500 . 3.500 3.258 3.128 3.406 . 0 0 "[ . 1 . 2 . 3]" 2 635 1 68 TYR HB3 1 120 VAL MG1 2.600 . 3.700 3.711 3.648 3.756 0.056 18 0 "[ . 1 . 2 . 3]" 2 636 1 50 ILE MG 1 120 VAL MG1 2.800 . 6.000 5.361 5.159 5.639 . 0 0 "[ . 1 . 2 . 3]" 2 637 1 120 VAL MG1 1 124 MET HG3 2.700 . 3.800 2.800 2.603 2.971 . 0 0 "[ . 1 . 2 . 3]" 2 638 1 120 VAL HA 1 120 VAL MG1 2.200 . 3.000 2.423 2.340 2.505 . 0 0 "[ . 1 . 2 . 3]" 2 639 1 117 MET HA 1 120 VAL MG1 2.200 . 6.000 4.131 3.975 4.326 . 0 0 "[ . 1 . 2 . 3]" 2 640 1 50 ILE MD 1 120 VAL MG1 2.200 . 6.000 3.476 3.275 3.803 . 0 0 "[ . 1 . 2 . 3]" 2 641 1 52 PHE QE 1 120 VAL MG1 2.300 . 6.000 5.896 5.429 6.050 0.050 29 0 "[ . 1 . 2 . 3]" 2 642 1 120 VAL HB 1 120 VAL MG1 2.100 . 2.800 2.121 2.097 2.131 . 0 0 "[ . 1 . 2 . 3]" 2 643 1 61 TYR QD 1 120 VAL MG1 2.900 . 6.000 4.891 4.727 5.032 . 0 0 "[ . 1 . 2 . 3]" 2 644 1 72 VAL MG1 1 125 CYS HA 2.700 . 3.800 3.692 3.443 3.829 0.029 27 0 "[ . 1 . 2 . 3]" 2 645 1 72 VAL MG1 1 124 MET QB 2.100 . 2.800 1.864 1.742 2.086 . 0 0 "[ . 1 . 2 . 3]" 2 646 1 72 VAL MG1 1 124 MET HG3 3.000 . 4.400 3.850 3.696 4.023 . 0 0 "[ . 1 . 2 . 3]" 2 647 1 72 VAL HB 1 72 VAL MG1 2.100 . 2.800 2.097 2.083 2.126 . 0 0 "[ . 1 . 2 . 3]" 2 648 1 91 VAL QG 1 94 THR HB 3.000 . 6.000 3.777 3.534 3.992 . 0 0 "[ . 1 . 2 . 3]" 2 649 1 72 VAL MG1 1 124 MET HA 3.000 . 4.300 4.177 4.034 4.324 0.024 16 0 "[ . 1 . 2 . 3]" 2 650 1 91 VAL HB 1 91 VAL QG 1.900 . 2.500 1.868 1.858 1.878 . 0 0 "[ . 1 . 2 . 3]" 2 651 1 114 VAL HB 1 114 VAL MG1 1.900 . 2.600 2.095 2.081 2.123 . 0 0 "[ . 1 . 2 . 3]" 2 652 1 109 PHE HA 1 114 VAL MG1 3.200 . 4.700 4.388 4.198 4.586 . 0 0 "[ . 1 . 2 . 3]" 2 653 1 109 PHE QD 1 114 VAL MG1 2.600 . 6.000 4.010 3.695 4.318 . 0 0 "[ . 1 . 2 . 3]" 2 654 1 109 PHE HB2 1 114 VAL MG1 2.600 . 3.700 3.666 3.563 3.717 0.017 22 0 "[ . 1 . 2 . 3]" 2 655 1 114 VAL HA 1 114 VAL MG1 2.100 . 2.800 2.347 2.297 2.443 . 0 0 "[ . 1 . 2 . 3]" 2 656 1 94 THR MG 1 98 HIS HD2 2.400 . 3.300 2.070 1.842 2.487 . 0 0 "[ . 1 . 2 . 3]" 2 657 1 73 TYR QD 1 94 THR MG 2.400 . 3.300 2.900 2.592 3.116 . 0 0 "[ . 1 . 2 . 3]" 2 658 1 94 THR HA 1 94 THR MG 2.300 . 3.100 2.430 2.329 2.493 . 0 0 "[ . 1 . 2 . 3]" 2 659 1 72 VAL HB 1 94 THR MG 2.500 . 3.500 3.361 3.050 3.507 0.007 25 0 "[ . 1 . 2 . 3]" 2 660 1 69 PRO HB3 1 94 THR MG 2.800 . 6.000 4.336 3.783 4.543 . 0 0 "[ . 1 . 2 . 3]" 2 661 1 87 VAL MG2 1 88 HIS QB 2.900 . 4.200 3.258 2.890 3.499 . 0 0 "[ . 1 . 2 . 3]" 2 662 1 94 THR MG 1 121 VAL HB 3.300 . 4.800 3.865 3.752 4.038 . 0 0 "[ . 1 . 2 . 3]" 2 663 1 94 THR MG 1 98 HIS HB2 3.000 . 4.300 3.951 3.837 4.053 . 0 0 "[ . 1 . 2 . 3]" 2 664 1 94 THR MG 1 98 HIS HB3 3.500 2.100 5.100 5.103 4.999 5.143 0.043 13 0 "[ . 1 . 2 . 3]" 2 665 1 102 THR MG 1 105 LYS HB2 2.800 . 4.000 3.364 3.112 3.668 . 0 0 "[ . 1 . 2 . 3]" 2 666 1 69 PRO HA 1 94 THR MG 2.800 . 6.000 5.915 5.523 6.026 0.026 3 0 "[ . 1 . 2 . 3]" 2 667 1 45 MET QB 1 127 THR MG 2.500 . 3.500 3.432 2.908 3.554 0.054 19 0 "[ . 1 . 2 . 3]" 2 668 1 99 THR MG 1 109 PHE HB2 2.600 . 3.700 2.874 2.481 3.215 . 0 0 "[ . 1 . 2 . 3]" 2 669 1 127 THR MG 1 131 ARG HD3 2.900 . 4.200 3.935 2.589 4.249 0.049 3 0 "[ . 1 . 2 . 3]" 2 670 1 127 THR HB 1 127 THR MG 1.900 . 2.500 2.110 2.090 2.137 . 0 0 "[ . 1 . 2 . 3]" 2 671 1 127 THR MG 1 131 ARG HG3 2.500 . 3.500 2.723 2.402 3.079 . 0 0 "[ . 1 . 2 . 3]" 2 672 1 86 PHE QD 1 87 VAL MG2 2.800 . 6.000 4.581 4.243 4.894 . 0 0 "[ . 1 . 2 . 3]" 2 673 1 41 LEU MD2 1 73 TYR QD 2.600 . 6.000 4.288 3.952 4.445 . 0 0 "[ . 1 . 2 . 3]" 2 674 1 41 LEU HA 1 41 LEU MD2 2.100 . 2.900 2.640 2.416 2.828 . 0 0 "[ . 1 . 2 . 3]" 2 675 1 41 LEU MD2 1 41 LEU HG 2.200 . 3.000 2.108 2.083 2.129 . 0 0 "[ . 1 . 2 . 3]" 2 676 1 41 LEU MD2 1 72 VAL HA 3.400 . 5.100 4.206 3.646 4.542 . 0 0 "[ . 1 . 2 . 3]" 2 677 1 41 LEU MD2 1 73 TYR QE 2.500 . 6.000 4.016 3.787 4.133 . 0 0 "[ . 1 . 2 . 3]" 2 678 1 91 VAL HA 1 91 VAL QG 2.000 . 2.700 2.092 2.043 2.147 . 0 0 "[ . 1 . 2 . 3]" 2 679 1 41 LEU HB3 1 41 LEU MD2 2.400 . 3.300 2.292 2.172 2.426 . 0 0 "[ . 1 . 2 . 3]" 2 680 1 41 LEU MD2 1 71 GLN HB2 2.500 . 3.500 2.730 2.482 3.045 . 0 0 "[ . 1 . 2 . 3]" 2 681 1 41 LEU MD2 1 71 GLN HB3 2.400 . 3.300 1.853 1.699 2.063 0.001 28 0 "[ . 1 . 2 . 3]" 2 682 1 110 THR MG 1 112 THR HB 3.000 . 6.000 5.277 4.972 5.573 . 0 0 "[ . 1 . 2 . 3]" 2 683 1 103 THR MG 1 109 PHE HB2 2.600 . 3.700 3.131 2.450 3.584 . 0 0 "[ . 1 . 2 . 3]" 2 684 1 87 VAL MG2 1 126 ILE HG13 2.500 . 3.500 3.435 3.077 3.663 0.163 30 0 "[ . 1 . 2 . 3]" 2 685 1 98 HIS HA 1 101 THR MG 2.700 . 3.800 2.334 2.181 2.741 . 0 0 "[ . 1 . 2 . 3]" 2 686 1 103 THR MG 1 108 ASN HA 2.700 . 3.800 2.233 1.792 2.857 0.008 10 0 "[ . 1 . 2 . 3]" 2 687 1 103 THR MG 1 109 PHE QE 2.900 . 6.000 4.732 3.234 5.087 . 0 0 "[ . 1 . 2 . 3]" 2 688 1 103 THR HA 1 103 THR MG 1.600 . 2.400 1.924 1.861 1.976 . 0 0 "[ . 1 . 2 . 3]" 2 689 1 102 THR MG 1 107 GLU QB 2.300 . 3.100 2.237 1.990 2.658 . 0 0 "[ . 1 . 2 . 3]" 2 690 1 103 THR MG 1 109 PHE QD 2.500 . 3.500 3.194 1.785 3.510 0.010 29 0 "[ . 1 . 2 . 3]" 2 691 1 102 THR MG 1 109 PHE QE 2.400 . 3.300 1.999 1.704 2.288 . 0 0 "[ . 1 . 2 . 3]" 2 692 1 102 THR HA 1 102 THR MG 1.600 . 2.400 1.896 1.861 1.945 . 0 0 "[ . 1 . 2 . 3]" 2 693 1 102 THR MG 1 109 PHE HZ 3.000 . 4.300 2.848 2.461 3.154 . 0 0 "[ . 1 . 2 . 3]" 2 694 1 99 THR MG 1 109 PHE QE 2.500 . 6.000 4.668 4.445 5.008 . 0 0 "[ . 1 . 2 . 3]" 2 695 1 99 THR MG 1 109 PHE QD 2.100 . 6.000 3.436 3.099 3.824 . 0 0 "[ . 1 . 2 . 3]" 2 696 1 112 THR MG 1 116 MET QG 2.700 . 3.300 2.940 2.730 3.073 . 0 0 "[ . 1 . 2 . 3]" 2 697 1 112 THR MG 1 115 LYS QB 2.500 . 3.500 3.173 2.985 3.416 . 0 0 "[ . 1 . 2 . 3]" 2 698 1 60 TYR QE 1 112 THR MG 2.200 . 3.000 2.653 2.235 3.004 0.004 25 0 "[ . 1 . 2 . 3]" 2 699 1 112 THR HB 1 112 THR MG 1.900 . 2.500 2.106 2.090 2.135 . 0 0 "[ . 1 . 2 . 3]" 2 700 1 100 VAL HB 1 100 VAL MG2 1.800 . 2.400 2.111 2.084 2.130 . 0 0 "[ . 1 . 2 . 3]" 2 701 1 100 VAL HA 1 100 VAL MG2 2.000 . 2.700 2.374 2.238 2.446 . 0 0 "[ . 1 . 2 . 3]" 2 702 1 96 LYS QE 1 100 VAL MG2 3.100 . 4.500 3.381 2.614 4.551 0.051 6 0 "[ . 1 . 2 . 3]" 2 703 1 61 TYR QE 1 120 VAL MG2 2.300 . 3.200 2.344 2.171 2.483 . 0 0 "[ . 1 . 2 . 3]" 2 704 1 120 VAL HA 1 120 VAL MG2 2.300 . 3.200 2.305 2.223 2.435 . 0 0 "[ . 1 . 2 . 3]" 2 705 1 52 PHE QE 1 120 VAL MG2 2.300 . 6.000 3.637 3.040 3.887 . 0 0 "[ . 1 . 2 . 3]" 2 706 1 117 MET HA 1 120 VAL MG2 2.000 . 6.000 3.223 3.049 3.358 . 0 0 "[ . 1 . 2 . 3]" 2 707 1 65 MET HA 1 120 VAL MG2 3.000 . 6.000 5.370 5.198 5.642 . 0 0 "[ . 1 . 2 . 3]" 2 708 1 120 VAL MG2 1 123 GLN QG 2.800 . 4.000 4.045 4.029 4.065 0.065 12 0 "[ . 1 . 2 . 3]" 2 709 1 48 PRO HB2 1 120 VAL MG2 2.800 . 4.000 3.622 3.306 3.841 . 0 0 "[ . 1 . 2 . 3]" 2 710 1 120 VAL MG2 1 124 MET HG3 3.000 . 6.000 5.381 5.182 5.506 . 0 0 "[ . 1 . 2 . 3]" 2 711 1 42 GLY HA3 1 72 VAL MG2 3.100 . 6.000 3.450 3.182 3.588 . 0 0 "[ . 1 . 2 . 3]" 2 712 1 72 VAL MG2 1 94 THR MG 2.900 . 6.000 4.066 3.906 4.187 . 0 0 "[ . 1 . 2 . 3]" 2 713 1 72 VAL MG2 1 86 PHE QE 3.000 . 6.000 5.030 4.685 5.490 . 0 0 "[ . 1 . 2 . 3]" 2 714 1 71 GLN HB2 1 72 VAL MG2 2.500 . 6.000 5.429 5.309 5.555 . 0 0 "[ . 1 . 2 . 3]" 2 715 1 72 VAL MG2 1 74 TYR QE 2.900 . 6.000 4.723 4.246 4.945 . 0 0 "[ . 1 . 2 . 3]" 2 716 1 72 VAL HB 1 72 VAL MG2 2.000 . 2.700 2.118 2.083 2.131 . 0 0 "[ . 1 . 2 . 3]" 2 717 1 72 VAL HA 1 72 VAL MG2 2.500 . 3.500 3.198 3.184 3.206 . 0 0 "[ . 1 . 2 . 3]" 2 718 1 72 VAL MG2 1 125 CYS HA 2.400 . 3.300 2.659 2.553 2.959 . 0 0 "[ . 1 . 2 . 3]" 2 719 1 72 VAL MG1 1 72 VAL MG2 1.900 . 2.600 2.027 1.880 2.084 . 0 0 "[ . 1 . 2 . 3]" 2 720 1 72 VAL MG2 1 74 TYR QD 2.500 . 3.500 3.378 2.977 3.536 0.036 27 0 "[ . 1 . 2 . 3]" 2 721 1 93 ILE MG 1 97 GLN HB2 2.700 . 3.800 3.170 3.024 3.461 . 0 0 "[ . 1 . 2 . 3]" 2 722 1 93 ILE HB 1 93 ILE MG 2.000 . 2.700 2.118 2.102 2.127 . 0 0 "[ . 1 . 2 . 3]" 2 723 1 135 ALA MB 1 138 GLN QG 2.900 . 4.100 3.346 3.186 3.521 . 0 0 "[ . 1 . 2 . 3]" 2 724 1 93 ILE MG 1 97 GLN HG3 2.700 . 6.000 3.686 3.070 4.003 . 0 0 "[ . 1 . 2 . 3]" 2 725 1 93 ILE MD 1 93 ILE MG 2.000 . 2.700 2.132 1.896 2.536 . 0 0 "[ . 1 . 2 . 3]" 2 726 1 44 ALA MB 1 71 GLN HG2 2.300 . 3.200 2.970 2.372 3.309 0.109 25 0 "[ . 1 . 2 . 3]" 2 727 1 73 TYR HB2 1 93 ILE MG 2.200 . 3.000 1.812 1.623 2.038 . 0 0 "[ . 1 . 2 . 3]" 2 728 1 44 ALA MB 1 70 ASN HB3 3.200 . 4.700 3.448 3.216 3.632 . 0 0 "[ . 1 . 2 . 3]" 2 729 1 39 TYR QB 1 93 ILE MG 2.600 . 3.600 2.983 2.598 3.168 . 0 0 "[ . 1 . 2 . 3]" 2 730 1 93 ILE HA 1 93 ILE MG 2.200 . 3.000 2.631 2.520 2.735 . 0 0 "[ . 1 . 2 . 3]" 2 731 1 93 ILE HG13 1 93 ILE MG 2.000 . 2.700 2.243 2.017 2.354 . 0 0 "[ . 1 . 2 . 3]" 2 732 1 73 TYR QD 1 93 ILE MG 2.300 . 3.200 2.713 2.518 2.881 . 0 0 "[ . 1 . 2 . 3]" 2 733 1 90 CYS HA 1 93 ILE MG 2.600 . 6.000 4.156 3.794 4.552 . 0 0 "[ . 1 . 2 . 3]" 2 734 1 39 TYR QE 1 93 ILE MG 2.300 . 6.000 3.962 3.687 4.180 . 0 0 "[ . 1 . 2 . 3]" 2 735 1 44 ALA HA 1 44 ALA MB 1.800 . 2.400 2.116 2.081 2.126 . 0 0 "[ . 1 . 2 . 3]" 2 736 1 44 ALA MB 1 70 ASN HB2 3.000 . 4.300 2.292 1.985 2.554 . 0 0 "[ . 1 . 2 . 3]" 2 737 1 132 GLU HA 1 135 ALA MB 2.200 . 3.000 2.917 2.739 3.017 0.017 30 0 "[ . 1 . 2 . 3]" 2 738 1 57 GLU HB3 1 116 MET ME 2.200 . 3.000 2.544 2.145 2.807 . 0 0 "[ . 1 . 2 . 3]" 2 739 1 52 PHE QD 1 116 MET ME 2.400 . 3.300 2.866 2.560 3.192 . 0 0 "[ . 1 . 2 . 3]" 2 740 1 112 THR MG 1 116 MET ME 1.900 . 2.600 2.522 2.209 2.633 0.033 21 0 "[ . 1 . 2 . 3]" 2 741 1 115 LYS QD 1 116 MET ME 2.700 . 3.800 3.454 3.055 3.712 . 0 0 "[ . 1 . 2 . 3]" 2 742 1 45 MET ME 1 131 ARG HD2 2.600 . 6.000 4.254 3.636 5.307 . 0 0 "[ . 1 . 2 . 3]" 2 743 1 45 MET ME 1 124 MET HG3 3.000 . 4.300 3.953 3.663 4.359 0.059 16 0 "[ . 1 . 2 . 3]" 2 744 1 45 MET ME 1 72 VAL MG1 2.300 . 3.200 3.201 3.100 3.229 0.029 8 0 "[ . 1 . 2 . 3]" 2 745 1 45 MET ME 1 72 VAL MG2 2.100 . 2.900 2.344 1.904 2.699 . 0 0 "[ . 1 . 2 . 3]" 2 746 1 45 MET ME 1 124 MET HA 2.300 . 3.200 2.512 2.056 2.924 . 0 0 "[ . 1 . 2 . 3]" 2 747 1 45 MET ME 1 71 GLN HA 2.500 . 6.000 4.079 3.713 4.319 . 0 0 "[ . 1 . 2 . 3]" 2 748 1 45 MET ME 1 127 THR HB 2.100 . 2.900 2.271 1.933 2.559 . 0 0 "[ . 1 . 2 . 3]" 2 749 1 45 MET ME 1 45 MET QG 1.900 . 2.600 2.113 1.994 2.209 . 0 0 "[ . 1 . 2 . 3]" 2 750 1 49 ILE HA 1 65 MET ME 2.500 . 3.500 3.253 2.921 3.473 . 0 0 "[ . 1 . 2 . 3]" 2 751 1 65 MET ME 1 68 TYR QB 2.400 . 6.000 4.667 4.497 4.848 . 0 0 "[ . 1 . 2 . 3]" 2 752 1 62 ARG HD2 1 65 MET ME 2.700 . 3.800 3.517 2.919 3.817 0.017 5 0 "[ . 1 . 2 . 3]" 2 753 1 47 ARG HB3 1 65 MET ME 1.800 . 6.000 2.568 2.076 3.456 . 0 0 "[ . 1 . 2 . 3]" 2 754 1 61 TYR QE 1 65 MET ME 2.200 . 3.000 2.310 2.085 2.863 . 0 0 "[ . 1 . 2 . 3]" 2 755 1 49 ILE MD 1 65 MET ME 2.000 . 2.700 2.165 1.925 2.429 . 0 0 "[ . 1 . 2 . 3]" 2 756 1 49 ILE MG 1 52 PHE QE 2.800 . 6.000 5.738 5.382 6.006 0.006 30 0 "[ . 1 . 2 . 3]" 2 757 1 49 ILE MG 1 61 TYR QE 2.600 . 3.700 3.552 3.147 3.712 0.012 12 0 "[ . 1 . 2 . 3]" 2 758 1 49 ILE MD 1 49 ILE MG 1.900 . 2.600 2.094 1.862 2.224 . 0 0 "[ . 1 . 2 . 3]" 2 759 1 49 ILE MG 1 62 ARG HD2 3.100 . 4.500 4.172 2.501 4.510 0.010 27 0 "[ . 1 . 2 . 3]" 2 760 1 49 ILE MG 1 50 ILE MG 2.900 . 6.000 5.127 4.952 5.257 . 0 0 "[ . 1 . 2 . 3]" 2 761 1 49 ILE HG13 1 49 ILE MG 2.100 . 2.900 2.322 2.252 2.452 . 0 0 "[ . 1 . 2 . 3]" 2 762 1 49 ILE HA 1 49 ILE MG 2.100 . 2.800 2.205 2.114 2.336 . 0 0 "[ . 1 . 2 . 3]" 2 763 1 49 ILE MG 1 62 ARG HD3 3.000 . 4.300 3.309 2.539 4.175 . 0 0 "[ . 1 . 2 . 3]" 2 764 1 49 ILE HB 1 49 ILE MG 1.800 . 2.400 2.105 2.081 2.127 . 0 0 "[ . 1 . 2 . 3]" 2 765 1 49 ILE MG 1 61 TYR QD 3.100 . 4.500 4.142 3.852 4.399 . 0 0 "[ . 1 . 2 . 3]" 2 766 1 50 ILE MG 1 52 PHE HA 3.000 . 6.000 3.872 2.970 4.423 . 0 0 "[ . 1 . 2 . 3]" 2 767 1 50 ILE MG 1 120 VAL MG2 2.900 . 4.200 3.596 3.355 3.841 . 0 0 "[ . 1 . 2 . 3]" 2 768 1 50 ILE MG 1 119 ARG HB2 2.500 . 3.500 2.357 2.142 2.780 . 0 0 "[ . 1 . 2 . 3]" 2 769 1 126 ILE MG 1 129 TYR HB3 3.200 . 4.700 3.232 3.066 3.401 . 0 0 "[ . 1 . 2 . 3]" 2 770 1 50 ILE HB 1 50 ILE MG 2.000 . 2.700 2.118 2.080 2.126 . 0 0 "[ . 1 . 2 . 3]" 2 771 1 50 ILE MG 1 119 ARG HG3 2.500 . 3.500 2.729 2.441 3.036 . 0 0 "[ . 1 . 2 . 3]" 2 772 1 50 ILE MD 1 50 ILE MG 2.000 . 2.700 1.832 1.687 1.940 . 0 0 "[ . 1 . 2 . 3]" 2 773 1 50 ILE MG 1 119 ARG HB3 2.700 . 3.800 1.929 1.788 2.147 0.012 8 0 "[ . 1 . 2 . 3]" 2 774 1 50 ILE MG 1 52 PHE QE 2.200 . 3.000 2.688 2.373 2.987 . 0 0 "[ . 1 . 2 . 3]" 2 775 1 40 MET ME 1 74 TYR QE 2.500 . 6.000 5.121 4.764 5.419 . 0 0 "[ . 1 . 2 . 3]" 2 776 1 40 MET ME 1 41 LEU HG 2.300 . 6.000 6.028 5.992 6.127 0.127 27 0 "[ . 1 . 2 . 3]" 2 777 1 40 MET ME 1 74 TYR QD 2.800 . 6.000 5.934 5.776 6.031 0.031 27 0 "[ . 1 . 2 . 3]" 2 778 1 40 MET ME 1 40 MET QG 2.300 . 3.100 2.268 2.172 2.336 . 0 0 "[ . 1 . 2 . 3]" 2 779 1 126 ILE MG 1 130 GLU HG2 2.700 . 6.000 4.406 3.619 4.835 . 0 0 "[ . 1 . 2 . 3]" 2 780 1 126 ILE HA 1 126 ILE MG 2.200 . 3.000 2.467 2.398 2.528 . 0 0 "[ . 1 . 2 . 3]" 2 781 1 77 MET ME 1 136 TYR HA 3.100 . 6.000 5.484 4.884 5.722 . 0 0 "[ . 1 . 2 . 3]" 2 782 1 77 MET ME 1 136 TYR QD 2.200 . 6.000 3.495 2.861 4.030 . 0 0 "[ . 1 . 2 . 3]" 2 783 1 77 MET ME 1 129 TYR QE 2.100 . 6.000 2.973 2.313 3.794 . 0 0 "[ . 1 . 2 . 3]" 2 784 1 77 MET ME 1 136 TYR HB2 2.600 . 3.700 3.454 2.782 3.709 0.009 10 0 "[ . 1 . 2 . 3]" 2 785 1 77 MET ME 1 130 GLU HA 3.400 . 5.000 4.795 4.526 5.015 0.015 29 0 "[ . 1 . 2 . 3]" 2 786 1 77 MET ME 1 137 TYR QE 2.400 . 6.000 4.372 3.363 5.433 . 0 0 "[ . 1 . 2 . 3]" 2 787 1 126 ILE MG 1 127 THR HA 2.400 . 3.300 3.321 3.306 3.348 0.048 21 0 "[ . 1 . 2 . 3]" 2 788 1 126 ILE HB 1 126 ILE MG 1.900 . 2.600 2.123 2.086 2.128 . 0 0 "[ . 1 . 2 . 3]" 2 789 1 77 MET ME 1 129 TYR QD 2.700 . 3.800 3.354 2.799 3.770 . 0 0 "[ . 1 . 2 . 3]" 2 790 1 77 MET ME 1 86 PHE QD 2.500 . 6.000 3.878 3.080 4.492 . 0 0 "[ . 1 . 2 . 3]" 2 791 1 95 ILE MG 1 96 LYS HA 2.700 . 3.800 3.100 2.903 3.245 . 0 0 "[ . 1 . 2 . 3]" 2 792 1 95 ILE HB 1 95 ILE MG 1.900 . 2.600 2.112 2.090 2.130 . 0 0 "[ . 1 . 2 . 3]" 2 793 1 95 ILE MG 1 99 THR MG 2.400 . 3.300 2.052 1.856 2.388 . 0 0 "[ . 1 . 2 . 3]" 2 794 1 95 ILE HG12 1 95 ILE MG 2.300 . 3.200 2.034 1.915 2.141 . 0 0 "[ . 1 . 2 . 3]" 2 795 1 95 ILE HA 1 95 ILE MG 2.100 . 2.900 2.616 2.541 2.709 . 0 0 "[ . 1 . 2 . 3]" 2 796 1 95 ILE MG 1 114 VAL HA 3.100 . 4.500 3.548 3.054 3.887 . 0 0 "[ . 1 . 2 . 3]" 2 797 1 72 VAL HA 1 124 MET ME 2.900 . 6.000 4.321 4.001 4.623 . 0 0 "[ . 1 . 2 . 3]" 2 798 1 71 GLN HA 1 124 MET ME 2.600 . 6.000 4.192 3.779 4.566 . 0 0 "[ . 1 . 2 . 3]" 2 799 1 94 THR MG 1 124 MET ME 2.400 . 3.300 3.201 3.014 3.294 . 0 0 "[ . 1 . 2 . 3]" 2 800 1 121 VAL HA 1 124 MET ME 2.000 . 2.700 2.085 1.720 2.397 . 0 0 "[ . 1 . 2 . 3]" 2 801 1 120 VAL MG1 1 124 MET ME 1.900 . 2.500 2.196 1.841 2.492 . 0 0 "[ . 1 . 2 . 3]" 2 802 1 48 PRO QD 1 124 MET ME 2.800 . 4.000 3.175 2.901 3.445 . 0 0 "[ . 1 . 2 . 3]" 2 803 1 68 TYR HB3 1 124 MET ME 2.800 . 6.000 4.933 4.698 5.194 . 0 0 "[ . 1 . 2 . 3]" 2 804 1 72 VAL HB 1 124 MET ME 2.900 . 6.000 4.690 4.457 4.953 . 0 0 "[ . 1 . 2 . 3]" 2 805 1 117 MET HB2 1 117 MET ME 2.100 . 2.900 2.434 2.143 2.582 . 0 0 "[ . 1 . 2 . 3]" 2 806 1 95 ILE MG 1 117 MET ME 1.900 . 2.600 2.176 1.608 2.532 . 0 0 "[ . 1 . 2 . 3]" 2 807 1 109 PHE QD 1 117 MET ME 2.000 . 6.000 3.076 2.748 3.446 . 0 0 "[ . 1 . 2 . 3]" 2 808 1 109 PHE QE 1 117 MET ME 2.300 . 6.000 3.838 3.543 4.112 . 0 0 "[ . 1 . 2 . 3]" 2 809 1 114 VAL HB 1 117 MET ME 2.600 . 3.600 3.291 3.046 3.532 . 0 0 "[ . 1 . 2 . 3]" 2 810 1 99 THR HA 1 117 MET ME 2.900 . 4.200 3.771 3.562 4.062 . 0 0 "[ . 1 . 2 . 3]" 2 811 1 114 VAL MG1 1 117 MET ME 2.000 . 2.700 2.309 2.013 2.524 . 0 0 "[ . 1 . 2 . 3]" 2 812 1 114 VAL HA 1 117 MET ME 2.000 . 2.700 2.127 1.637 2.371 . 0 0 "[ . 1 . 2 . 3]" 2 813 1 109 PHE HB3 1 117 MET ME 2.300 . 3.100 2.733 2.557 2.990 . 0 0 "[ . 1 . 2 . 3]" 2 814 1 109 PHE HA 1 117 MET ME 3.000 . 6.000 4.594 4.381 4.892 . 0 0 "[ . 1 . 2 . 3]" 2 815 1 117 MET HB3 1 117 MET ME 1.900 . 2.600 2.201 2.144 2.336 . 0 0 "[ . 1 . 2 . 3]" 2 816 1 99 THR HB 1 117 MET ME 3.200 . 4.700 4.516 4.288 4.690 . 0 0 "[ . 1 . 2 . 3]" 2 817 1 109 PHE HB2 1 117 MET ME 2.600 . 6.000 3.600 3.384 3.766 . 0 0 "[ . 1 . 2 . 3]" 2 818 1 95 ILE HG13 1 117 MET ME 2.200 . 3.000 2.722 2.432 3.012 0.012 25 0 "[ . 1 . 2 . 3]" 2 819 1 68 TYR QD 1 117 MET ME 2.500 . 6.000 4.595 4.235 4.977 . 0 0 "[ . 1 . 2 . 3]" 2 820 1 95 ILE HA 1 117 MET ME 2.600 . 3.700 2.886 2.673 3.210 . 0 0 "[ . 1 . 2 . 3]" 2 821 1 68 TYR QE 1 117 MET ME 2.700 . 6.000 4.023 3.761 4.205 . 0 0 "[ . 1 . 2 . 3]" 2 822 1 126 ILE HB 1 126 ILE MD 1.900 . 2.600 1.882 1.817 1.947 . 0 0 "[ . 1 . 2 . 3]" 2 823 1 122 GLU HG3 1 126 ILE MD 2.200 . 3.000 2.542 2.236 2.895 . 0 0 "[ . 1 . 2 . 3]" 2 824 1 87 VAL QG 1 126 ILE MD 2.200 . 6.000 3.129 2.859 3.274 . 0 0 "[ . 1 . 2 . 3]" 2 825 1 123 GLN HG2 1 126 ILE MD 3.100 . 4.500 3.848 3.610 4.183 . 0 0 "[ . 1 . 2 . 3]" 2 826 1 94 THR HB 1 95 ILE MD 3.100 . 4.500 3.139 2.779 3.423 . 0 0 "[ . 1 . 2 . 3]" 2 827 1 95 ILE MD 1 117 MET HB2 2.400 . 6.000 3.601 3.407 3.771 . 0 0 "[ . 1 . 2 . 3]" 2 828 1 95 ILE MD 1 118 GLU HA 1.900 . 2.600 1.836 1.667 2.085 . 0 0 "[ . 1 . 2 . 3]" 2 829 1 95 ILE MD 1 95 ILE HG12 2.100 . 2.900 2.094 2.070 2.117 . 0 0 "[ . 1 . 2 . 3]" 2 830 1 95 ILE MD 1 121 VAL HB 2.400 . 3.300 2.257 2.043 2.669 . 0 0 "[ . 1 . 2 . 3]" 2 831 1 95 ILE MD 1 117 MET ME 2.600 . 3.700 3.675 3.558 3.720 0.020 10 0 "[ . 1 . 2 . 3]" 2 832 1 94 THR MG 1 95 ILE MD 2.900 . 4.100 3.489 3.172 3.843 . 0 0 "[ . 1 . 2 . 3]" 2 833 1 95 ILE MD 1 114 VAL HA 3.200 . 4.700 4.639 4.405 4.722 0.022 28 0 "[ . 1 . 2 . 3]" 2 834 1 50 ILE MD 1 119 ARG HA 3.000 . 4.400 3.472 3.282 3.746 . 0 0 "[ . 1 . 2 . 3]" 2 835 1 50 ILE MD 1 61 TYR QE 2.500 . 6.000 4.794 4.598 5.031 . 0 0 "[ . 1 . 2 . 3]" 2 836 1 50 ILE MD 1 123 GLN HG3 2.200 . 3.000 1.878 1.745 2.159 . 0 0 "[ . 1 . 2 . 3]" 2 837 1 48 PRO HB2 1 50 ILE MD 2.300 . 3.200 2.395 2.112 2.534 . 0 0 "[ . 1 . 2 . 3]" 2 838 1 48 PRO HA 1 50 ILE MD 3.500 2.200 5.000 4.734 4.325 4.883 . 0 0 "[ . 1 . 2 . 3]" 2 839 1 50 ILE MD 1 119 ARG HB3 2.300 . 3.200 2.126 1.605 2.416 . 0 0 "[ . 1 . 2 . 3]" 2 840 1 48 PRO HB3 1 50 ILE MD 2.500 . 3.500 3.406 3.037 3.522 0.022 5 0 "[ . 1 . 2 . 3]" 2 841 1 50 ILE MD 1 120 VAL MG2 2.200 . 3.000 2.567 2.408 2.866 . 0 0 "[ . 1 . 2 . 3]" 2 842 1 50 ILE MD 1 119 ARG HB2 2.200 . 3.000 2.599 2.353 3.029 0.029 3 0 "[ . 1 . 2 . 3]" 2 843 1 50 ILE MD 1 120 VAL HA 2.200 . 3.000 2.029 1.760 2.413 . 0 0 "[ . 1 . 2 . 3]" 2 844 1 50 ILE MD 1 50 ILE HG13 2.100 . 2.800 2.109 2.086 2.121 . 0 0 "[ . 1 . 2 . 3]" 2 845 1 73 TYR QE 1 93 ILE MD 2.600 . 6.000 5.932 5.586 6.047 0.047 18 0 "[ . 1 . 2 . 3]" 2 846 1 73 TYR QB 1 93 ILE MD 3.400 . 5.000 4.483 4.304 4.791 . 0 0 "[ . 1 . 2 . 3]" 2 847 1 93 ILE MD 1 93 ILE QG 1.900 . 2.500 1.880 1.850 1.889 . 0 0 "[ . 1 . 2 . 3]" 2 848 1 90 CYS HA 1 93 ILE MD 3.000 . 6.000 5.760 5.535 5.959 . 0 0 "[ . 1 . 2 . 3]" 2 849 1 93 ILE MD 1 96 LYS HD3 2.100 . 2.900 2.567 2.277 3.308 0.408 6 0 "[ . 1 . 2 . 3]" 2 850 1 93 ILE MD 1 96 LYS QB 2.700 . 3.800 3.019 2.656 3.299 . 0 0 "[ . 1 . 2 . 3]" 2 851 1 93 ILE MD 1 96 LYS QE 2.500 . 3.500 3.215 2.183 3.531 0.031 6 0 "[ . 1 . 2 . 3]" 2 852 1 49 ILE MD 1 50 ILE MD 2.700 . 6.000 5.529 5.210 5.654 . 0 0 "[ . 1 . 2 . 3]" 2 853 1 49 ILE MD 1 61 TYR QE 2.500 . 3.500 3.249 2.903 3.487 . 0 0 "[ . 1 . 2 . 3]" 2 854 1 49 ILE MD 1 49 ILE HG13 2.100 . 2.800 2.096 2.075 2.122 . 0 0 "[ . 1 . 2 . 3]" 2 855 1 49 ILE MD 1 62 ARG HD3 3.000 . 4.300 3.289 2.845 4.676 0.376 1 0 "[ . 1 . 2 . 3]" 2 856 1 48 PRO HA 1 49 ILE MD 3.200 . 4.600 3.808 3.608 4.055 . 0 0 "[ . 1 . 2 . 3]" 2 857 1 49 ILE HA 1 49 ILE MD 2.200 . 3.000 2.116 1.960 2.332 . 0 0 "[ . 1 . 2 . 3]" 2 858 1 49 ILE MD 1 49 ILE HG12 2.100 . 2.900 2.092 2.073 2.118 . 0 0 "[ . 1 . 2 . 3]" 2 859 1 94 THR HA 1 97 GLN HB3 2.900 . 6.000 4.042 3.926 4.341 . 0 0 "[ . 1 . 2 . 3]" 2 860 1 94 THR HA 1 97 GLN HB2 2.900 . 4.200 2.825 2.728 2.896 . 0 0 "[ . 1 . 2 . 3]" 2 861 1 114 VAL HA 1 117 MET HB3 2.500 . 3.500 3.323 3.221 3.510 0.010 25 0 "[ . 1 . 2 . 3]" 2 862 1 114 VAL HA 1 117 MET HB2 2.700 . 6.000 1.915 1.807 2.047 . 0 0 "[ . 1 . 2 . 3]" 2 863 1 87 VAL HA 1 90 CYS HB2 2.900 . 4.200 3.457 3.178 3.776 . 0 0 "[ . 1 . 2 . 3]" 2 864 1 87 VAL HA 1 90 CYS HB3 2.800 . 4.000 2.166 1.958 2.341 . 0 0 "[ . 1 . 2 . 3]" 2 865 1 127 THR HA 1 130 GLU HB2 2.700 . 3.800 3.260 2.793 3.741 . 0 0 "[ . 1 . 2 . 3]" 2 866 1 127 THR HA 1 130 GLU HB3 2.400 . 6.000 4.893 4.392 5.414 . 0 0 "[ . 1 . 2 . 3]" 2 867 1 112 THR HA 1 115 LYS QB 2.200 . 3.000 2.551 2.328 2.657 . 0 0 "[ . 1 . 2 . 3]" 2 868 1 121 VAL HA 1 124 MET HB2 2.400 . 3.300 2.344 2.252 2.433 . 0 0 "[ . 1 . 2 . 3]" 2 869 1 121 VAL HA 1 124 MET HB3 2.400 . 6.000 3.972 3.865 4.072 . 0 0 "[ . 1 . 2 . 3]" 2 870 1 95 ILE HA 1 98 HIS HB2 2.800 . 4.000 3.035 2.930 3.166 . 0 0 "[ . 1 . 2 . 3]" 2 871 1 120 VAL HA 1 123 GLN HB2 2.700 . 3.800 3.665 3.476 3.804 0.004 18 0 "[ . 1 . 2 . 3]" 2 872 1 100 VAL HA 1 100 VAL MG1 2.000 . 2.700 2.380 2.254 2.487 . 0 0 "[ . 1 . 2 . 3]" 2 873 1 101 THR HA 1 104 THR HB 2.000 . 6.000 3.111 2.943 3.303 . 0 0 "[ . 1 . 2 . 3]" 2 874 1 102 THR HA 1 105 LYS HB2 2.500 . 3.500 2.273 1.702 2.439 . 0 0 "[ . 1 . 2 . 3]" 2 875 1 102 THR HA 1 105 LYS HB3 2.800 . 6.000 3.801 3.174 3.996 . 0 0 "[ . 1 . 2 . 3]" 2 876 1 43 SER HB3 1 44 ALA MB 3.000 . 6.000 5.123 4.987 5.251 . 0 0 "[ . 1 . 2 . 3]" 2 877 1 69 PRO HA 1 69 PRO HD3 3.000 . 4.300 3.816 3.652 3.911 . 0 0 "[ . 1 . 2 . 3]" 2 878 1 69 PRO HA 1 69 PRO HB2 2.500 . 3.500 2.946 2.906 2.980 . 0 0 "[ . 1 . 2 . 3]" 2 879 1 69 PRO HA 1 69 PRO HB3 2.200 . 3.000 2.277 2.261 2.302 . 0 0 "[ . 1 . 2 . 3]" 2 880 1 45 MET HA 1 46 SER HB2 3.200 . 6.000 5.996 5.887 6.091 0.091 23 0 "[ . 1 . 2 . 3]" 2 881 1 61 TYR HA 1 64 ASN HB3 2.800 . 4.000 3.839 3.490 4.019 0.019 28 0 "[ . 1 . 2 . 3]" 2 882 1 60 TYR HA 1 60 TYR QE 2.600 . 6.000 4.598 4.518 4.675 . 0 0 "[ . 1 . 2 . 3]" 2 883 1 56 TYR HA 1 59 ARG HB2 2.400 . 6.000 3.919 3.400 5.681 . 0 0 "[ . 1 . 2 . 3]" 2 884 1 122 GLU HA 1 125 CYS HB3 2.100 . 6.000 4.257 4.018 4.449 . 0 0 "[ . 1 . 2 . 3]" 2 885 1 122 GLU HA 1 125 CYS HB2 3.200 . 4.700 2.748 2.503 2.957 . 0 0 "[ . 1 . 2 . 3]" 2 886 1 133 SER HA 1 136 TYR HB3 2.700 . 3.800 2.491 2.146 2.794 . 0 0 "[ . 1 . 2 . 3]" 2 887 1 118 GLU HA 1 121 VAL HB 2.300 . 6.000 3.167 3.046 3.322 . 0 0 "[ . 1 . 2 . 3]" 2 888 1 136 TYR HA 1 136 TYR QE 2.500 . 6.000 4.561 4.423 4.672 . 0 0 "[ . 1 . 2 . 3]" 2 889 1 52 PHE QD 1 116 MET HA 2.400 . 6.000 3.763 3.188 4.118 . 0 0 "[ . 1 . 2 . 3]" 2 890 1 136 TYR HA 1 139 ARG HB3 2.800 . 4.000 3.640 2.109 4.015 0.015 23 0 "[ . 1 . 2 . 3]" 2 891 1 96 LYS HA 1 99 THR HB 2.500 . 6.000 4.603 4.337 4.756 . 0 0 "[ . 1 . 2 . 3]" 2 892 1 136 TYR HA 1 139 ARG HB2 2.700 . 3.800 2.585 2.290 3.818 0.018 17 0 "[ . 1 . 2 . 3]" 2 893 1 62 ARG HA 1 65 MET HB2 3.200 . 4.700 4.248 4.042 4.377 . 0 0 "[ . 1 . 2 . 3]" 2 894 1 124 MET HA 1 127 THR HB 2.300 . 3.200 2.814 2.767 2.866 . 0 0 "[ . 1 . 2 . 3]" 2 895 1 116 MET HA 1 119 ARG HB2 2.300 . 3.200 3.145 2.894 3.220 0.020 3 0 "[ . 1 . 2 . 3]" 2 896 1 117 MET HA 1 120 VAL HB 2.600 . 3.600 2.733 2.604 2.898 . 0 0 "[ . 1 . 2 . 3]" 2 897 1 116 MET HA 1 119 ARG HB3 2.200 . 6.000 4.712 4.563 4.856 . 0 0 "[ . 1 . 2 . 3]" 2 898 1 88 HIS HA 1 91 VAL H 3.000 . 4.300 3.638 3.364 3.891 . 0 0 "[ . 1 . 2 . 3]" 2 899 1 130 GLU HA 1 133 SER HB2 3.000 . 4.300 3.800 3.575 4.107 . 0 0 "[ . 1 . 2 . 3]" 2 900 1 88 HIS HA 1 91 VAL HB 2.500 . 3.500 3.402 3.145 3.532 0.032 14 0 "[ . 1 . 2 . 3]" 2 901 1 52 PHE HA 1 52 PHE HB3 2.200 . 3.000 2.375 2.346 2.421 . 0 0 "[ . 1 . 2 . 3]" 2 902 1 52 PHE HA 1 52 PHE HB2 2.800 . 4.000 3.014 3.005 3.022 . 0 0 "[ . 1 . 2 . 3]" 2 903 1 65 MET HA 1 68 TYR HB2 2.700 . 6.000 2.030 1.623 2.274 . 0 0 "[ . 1 . 2 . 3]" 2 904 1 136 TYR QD 1 137 TYR HA 2.900 . 6.000 3.927 3.410 4.356 . 0 0 "[ . 1 . 2 . 3]" 2 905 1 137 TYR HA 1 137 TYR HB3 2.200 . 3.000 2.677 2.666 2.685 . 0 0 "[ . 1 . 2 . 3]" 2 906 1 115 LYS HA 1 118 GLU HB3 2.500 . 6.000 4.681 4.263 4.841 . 0 0 "[ . 1 . 2 . 3]" 2 907 1 119 ARG HA 1 122 GLU HB2 2.300 . 6.000 4.284 4.056 4.545 . 0 0 "[ . 1 . 2 . 3]" 2 908 1 58 ASP HA 1 61 TYR HB3 3.200 . 4.700 3.629 3.368 3.815 . 0 0 "[ . 1 . 2 . 3]" 2 909 1 58 ASP HA 1 61 TYR HB2 3.000 . 6.000 5.095 4.844 5.275 . 0 0 "[ . 1 . 2 . 3]" 2 910 1 119 ARG HA 1 122 GLU HB3 2.600 . 3.700 2.774 2.608 3.050 . 0 0 "[ . 1 . 2 . 3]" 2 911 1 113 ASP HA 1 116 MET HB2 2.700 . 6.000 3.966 3.794 4.178 . 0 0 "[ . 1 . 2 . 3]" 2 912 1 113 ASP HA 1 116 MET HB3 2.700 . 6.000 5.449 5.276 5.625 . 0 0 "[ . 1 . 2 . 3]" 2 913 1 97 GLN HA 1 100 VAL HB 2.100 . 6.000 3.419 3.217 3.698 . 0 0 "[ . 1 . 2 . 3]" 2 914 1 55 ASP HA 1 58 ASP HB2 2.200 . 3.000 1.965 1.778 2.141 . 0 0 "[ . 1 . 2 . 3]" 2 915 1 73 TYR HA 1 73 TYR QE 2.600 . 6.000 4.809 4.774 4.870 . 0 0 "[ . 1 . 2 . 3]" 2 916 1 92 ASN HA 1 95 ILE HB 2.600 . 3.700 3.512 3.259 3.724 0.024 13 0 "[ . 1 . 2 . 3]" 2 917 1 84 ASN HA 1 87 VAL HB 2.400 . 6.000 5.380 4.745 5.692 . 0 0 "[ . 1 . 2 . 3]" 2 918 1 85 ASN HA 1 88 HIS QB 2.400 . 3.300 2.647 2.133 3.265 . 0 0 "[ . 1 . 2 . 3]" 2 919 1 36 LEU HA 1 39 TYR HB2 3.200 . 4.700 2.683 2.289 3.332 . 0 0 "[ . 1 . 2 . 3]" 2 920 1 135 ALA HA 1 138 GLN HB2 2.500 . 6.000 4.689 4.515 4.948 . 0 0 "[ . 1 . 2 . 3]" 2 921 1 135 ALA HA 1 138 GLN HB3 2.500 . 6.000 3.916 3.678 4.128 . 0 0 "[ . 1 . 2 . 3]" 2 922 1 41 LEU HA 1 41 LEU MD1 2.800 . 4.000 3.753 3.703 3.793 . 0 0 "[ . 1 . 2 . 3]" 2 923 1 44 ALA HA 1 71 GLN HB2 2.700 . 6.000 5.171 4.721 5.336 . 0 0 "[ . 1 . 2 . 3]" 2 924 1 41 LEU HA 1 41 LEU HB3 2.600 . 3.600 2.979 2.970 2.986 . 0 0 "[ . 1 . 2 . 3]" 2 925 1 44 ALA HA 1 71 GLN HG3 2.200 . 6.000 3.440 2.993 3.686 . 0 0 "[ . 1 . 2 . 3]" 2 926 1 70 ASN HA 1 70 ASN HB2 2.300 . 3.200 2.661 2.632 2.674 . 0 0 "[ . 1 . 2 . 3]" 2 927 1 70 ASN HA 1 70 ASN HB3 2.300 . 3.200 2.294 2.285 2.311 . 0 0 "[ . 1 . 2 . 3]" 2 928 1 68 TYR QD 1 69 PRO HD3 3.100 . 6.000 2.772 2.411 3.164 . 0 0 "[ . 1 . 2 . 3]" 2 929 1 69 PRO HB2 1 69 PRO HD3 2.900 . 4.200 3.896 3.864 3.948 . 0 0 "[ . 1 . 2 . 3]" 2 930 1 69 PRO HB3 1 69 PRO HD3 3.500 . 5.200 4.047 4.018 4.056 . 0 0 "[ . 1 . 2 . 3]" 2 931 1 68 TYR HA 1 69 PRO HD3 2.700 . 3.800 1.847 1.797 1.960 0.003 20 0 "[ . 1 . 2 . 3]" 2 932 1 69 PRO HB2 1 69 PRO HD2 2.900 . 4.100 2.961 2.933 3.045 . 0 0 "[ . 1 . 2 . 3]" 2 933 1 68 TYR HA 1 69 PRO HD2 2.800 . 4.000 2.782 2.539 2.938 . 0 0 "[ . 1 . 2 . 3]" 2 934 1 69 PRO HD2 1 69 PRO HG2 2.800 . 4.000 2.321 2.311 2.327 . 0 0 "[ . 1 . 2 . 3]" 2 935 1 136 TYR HB2 1 136 TYR QD 2.500 . 3.500 2.575 2.457 2.699 . 0 0 "[ . 1 . 2 . 3]" 2 936 1 88 HIS HA 1 88 HIS QB 2.400 . 3.300 2.439 2.149 2.540 . 0 0 "[ . 1 . 2 . 3]" 2 937 1 68 TYR HA 1 69 PRO HG2 3.400 . 5.100 4.438 4.403 4.486 . 0 0 "[ . 1 . 2 . 3]" 2 938 1 69 PRO HA 1 69 PRO HG2 3.100 . 4.500 3.990 3.911 4.050 . 0 0 "[ . 1 . 2 . 3]" 2 939 1 120 VAL HB 1 120 VAL MG2 2.100 . 2.800 2.095 2.082 2.124 . 0 0 "[ . 1 . 2 . 3]" 2 940 1 44 ALA MB 1 71 GLN HG3 2.400 . 3.300 2.970 2.733 3.210 . 0 0 "[ . 1 . 2 . 3]" 2 941 1 43 SER HB2 1 44 ALA MB 2.800 . 4.000 3.766 3.635 3.893 . 0 0 "[ . 1 . 2 . 3]" 2 942 1 116 MET HA 1 116 MET ME 2.400 . 6.000 4.239 3.875 4.464 . 0 0 "[ . 1 . 2 . 3]" 2 943 1 45 MET HA 1 45 MET ME 2.800 . 6.000 5.259 5.113 5.308 . 0 0 "[ . 1 . 2 . 3]" 2 944 1 65 MET HA 1 65 MET ME 2.600 . 6.000 3.848 3.626 4.179 . 0 0 "[ . 1 . 2 . 3]" 2 945 1 40 MET HA 1 40 MET ME 2.300 . 3.100 1.816 1.659 2.096 0.041 27 0 "[ . 1 . 2 . 3]" 2 946 1 124 MET ME 1 124 MET HG3 2.400 . 3.300 2.362 2.228 2.546 . 0 0 "[ . 1 . 2 . 3]" 2 947 1 124 MET HA 1 124 MET ME 2.700 . 6.000 4.524 4.403 4.618 . 0 0 "[ . 1 . 2 . 3]" 2 948 1 124 MET HB2 1 124 MET ME 2.000 . 2.700 2.343 1.987 2.567 . 0 0 "[ . 1 . 2 . 3]" 2 949 1 117 MET HA 1 117 MET ME 2.900 . 6.000 4.392 4.308 4.451 . 0 0 "[ . 1 . 2 . 3]" 2 950 1 50 ILE H 1 61 TYR QD 3.100 . 4.500 3.489 3.336 3.674 . 0 0 "[ . 1 . 2 . 3]" 2 951 1 50 ILE H 1 52 PHE QE 3.400 . 5.100 4.556 4.076 4.905 . 0 0 "[ . 1 . 2 . 3]" 2 952 1 50 ILE H 1 61 TYR QE 2.500 . 3.500 2.750 2.480 3.070 . 0 0 "[ . 1 . 2 . 3]" 2 953 1 50 ILE H 1 50 ILE MG 3.000 . 4.300 3.912 3.863 3.948 . 0 0 "[ . 1 . 2 . 3]" 2 954 1 49 ILE HB 1 50 ILE H 3.200 . 4.600 4.090 4.010 4.190 . 0 0 "[ . 1 . 2 . 3]" 2 955 1 50 ILE H 1 50 ILE MD 3.300 . 4.800 3.812 3.415 3.976 . 0 0 "[ . 1 . 2 . 3]" 2 956 1 50 ILE H 1 50 ILE HB 2.400 . 3.300 2.742 2.686 2.790 . 0 0 "[ . 1 . 2 . 3]" 2 957 1 50 ILE H 1 120 VAL MG1 3.400 . 6.000 5.379 5.140 5.603 . 0 0 "[ . 1 . 2 . 3]" 2 958 1 49 ILE HG13 1 50 ILE H 3.600 . 6.000 5.589 5.449 5.717 . 0 0 "[ . 1 . 2 . 3]" 2 959 1 46 SER H 1 47 ARG H 3.200 2.100 4.700 3.983 3.904 4.487 . 0 0 "[ . 1 . 2 . 3]" 2 960 1 47 ARG H 1 70 ASN HB3 3.100 . 4.500 4.237 4.012 4.509 0.009 8 0 "[ . 1 . 2 . 3]" 2 961 1 46 SER HB2 1 47 ARG H 2.600 . 3.700 3.441 3.322 3.554 . 0 0 "[ . 1 . 2 . 3]" 2 962 1 43 SER HB2 1 44 ALA H 2.300 . 3.200 2.259 2.136 2.393 . 0 0 "[ . 1 . 2 . 3]" 2 963 1 44 ALA H 1 71 GLN HB2 3.700 . 5.400 5.366 4.978 5.414 0.014 23 0 "[ . 1 . 2 . 3]" 2 964 1 44 ALA H 1 71 GLN HG2 3.000 . 4.300 2.417 2.256 2.483 . 0 0 "[ . 1 . 2 . 3]" 2 965 1 44 ALA H 1 71 GLN HG3 3.000 . 4.400 3.615 3.315 3.769 . 0 0 "[ . 1 . 2 . 3]" 2 966 1 44 ALA H 1 44 ALA MB 2.000 . 2.700 2.181 2.016 2.231 . 0 0 "[ . 1 . 2 . 3]" 2 967 1 43 SER H 1 44 ALA H 3.100 . 6.000 4.619 4.606 4.630 . 0 0 "[ . 1 . 2 . 3]" 2 968 1 91 VAL H 1 91 VAL QG 2.800 . 4.000 2.202 2.063 2.349 . 0 0 "[ . 1 . 2 . 3]" 2 969 1 91 VAL H 1 121 VAL MG1 3.200 . 4.700 3.863 3.689 3.957 . 0 0 "[ . 1 . 2 . 3]" 2 970 1 90 CYS HA 1 91 VAL H 3.200 . 4.700 3.531 3.502 3.556 . 0 0 "[ . 1 . 2 . 3]" 2 971 1 91 VAL H 1 91 VAL HB 2.500 . 3.500 2.533 2.474 2.657 . 0 0 "[ . 1 . 2 . 3]" 2 972 1 90 CYS HB3 1 91 VAL H 3.000 . 4.300 2.820 2.640 3.066 . 0 0 "[ . 1 . 2 . 3]" 2 973 1 55 ASP H 1 56 TYR H 2.500 . 3.500 2.671 2.639 2.706 . 0 0 "[ . 1 . 2 . 3]" 2 974 1 55 ASP H 1 57 GLU H 3.600 . 5.200 4.735 4.696 4.789 . 0 0 "[ . 1 . 2 . 3]" 2 975 1 55 ASP H 1 56 TYR HB3 3.600 2.100 5.400 4.689 4.625 4.760 . 0 0 "[ . 1 . 2 . 3]" 2 976 1 55 ASP H 1 55 ASP QB 2.100 . 2.900 2.367 2.041 2.791 . 0 0 "[ . 1 . 2 . 3]" 2 977 1 55 ASP H 1 58 ASP HB3 3.700 . 6.000 5.991 5.893 6.021 0.021 7 0 "[ . 1 . 2 . 3]" 2 978 1 54 SER H 1 55 ASP H 3.200 . 4.700 4.240 4.185 4.310 . 0 0 "[ . 1 . 2 . 3]" 2 979 1 125 CYS HA 1 126 ILE H 2.000 . 6.000 3.519 3.495 3.537 . 0 0 "[ . 1 . 2 . 3]" 2 980 1 124 MET HA 1 126 ILE H 3.400 . 5.000 4.275 4.144 4.421 . 0 0 "[ . 1 . 2 . 3]" 2 981 1 52 PHE H 1 53 GLY H 2.900 . 4.100 3.503 3.019 4.129 0.029 3 0 "[ . 1 . 2 . 3]" 2 982 1 50 ILE MG 1 52 PHE H 3.900 . 5.800 3.774 1.963 4.889 0.037 15 0 "[ . 1 . 2 . 3]" 2 983 1 52 PHE H 1 53 GLY HA2 3.700 . 5.400 5.264 4.789 5.444 0.044 23 0 "[ . 1 . 2 . 3]" 2 984 1 52 PHE H 1 52 PHE HB2 2.800 . 4.000 2.933 2.663 3.689 . 0 0 "[ . 1 . 2 . 3]" 2 985 1 52 PHE H 1 52 PHE QD 2.600 . 3.600 2.853 2.424 3.533 . 0 0 "[ . 1 . 2 . 3]" 2 986 1 52 PHE H 1 52 PHE QE 3.600 . 5.200 4.368 4.145 4.820 . 0 0 "[ . 1 . 2 . 3]" 2 987 1 126 ILE H 1 126 ILE HB 2.300 . 3.200 2.148 2.089 2.210 . 0 0 "[ . 1 . 2 . 3]" 2 988 1 87 VAL MG1 1 126 ILE H 2.800 . 4.000 2.969 2.662 3.505 . 0 0 "[ . 1 . 2 . 3]" 2 989 1 52 PHE H 1 57 GLU HB3 3.800 . 5.600 4.376 3.768 5.646 0.046 23 0 "[ . 1 . 2 . 3]" 2 990 1 126 ILE H 1 126 ILE MD 2.400 . 3.300 2.938 2.780 3.232 . 0 0 "[ . 1 . 2 . 3]" 2 991 1 125 CYS HB2 1 126 ILE H 3.200 . 4.700 2.729 2.590 2.851 . 0 0 "[ . 1 . 2 . 3]" 2 992 1 96 LYS H 1 96 LYS HG3 2.800 . 6.000 4.492 4.288 4.615 . 0 0 "[ . 1 . 2 . 3]" 2 993 1 96 LYS H 1 96 LYS QB 2.200 . 3.000 2.230 2.116 2.256 . 0 0 "[ . 1 . 2 . 3]" 2 994 1 95 ILE HB 1 96 LYS H 2.600 . 3.600 2.794 2.701 2.967 . 0 0 "[ . 1 . 2 . 3]" 2 995 1 97 GLN HA 1 100 VAL H 2.400 . 6.000 3.826 3.690 3.926 . 0 0 "[ . 1 . 2 . 3]" 2 996 1 98 HIS HB2 1 100 VAL H 3.600 . 5.200 4.991 4.876 5.208 0.008 30 0 "[ . 1 . 2 . 3]" 2 997 1 98 HIS HA 1 100 VAL H 3.500 . 5.200 3.864 3.792 4.019 . 0 0 "[ . 1 . 2 . 3]" 2 998 1 100 VAL H 1 100 VAL MG1 2.200 . 6.000 3.780 3.764 3.801 . 0 0 "[ . 1 . 2 . 3]" 2 999 1 99 THR MG 1 100 VAL H 2.600 . 6.000 4.139 4.076 4.171 . 0 0 "[ . 1 . 2 . 3]" 2 1000 1 99 THR HB 1 100 VAL H 2.500 . 6.000 3.836 3.723 3.901 . 0 0 "[ . 1 . 2 . 3]" 2 1001 1 100 VAL H 1 100 VAL HA 2.400 . 3.300 2.896 2.894 2.899 . 0 0 "[ . 1 . 2 . 3]" 2 1002 1 100 VAL H 1 100 VAL HB 2.200 . 3.000 2.489 2.438 2.602 . 0 0 "[ . 1 . 2 . 3]" 2 1003 1 99 THR H 1 100 VAL H 2.400 . 3.300 2.670 2.523 2.747 . 0 0 "[ . 1 . 2 . 3]" 2 1004 1 98 HIS HB3 1 100 VAL H 3.800 . 5.600 5.164 5.036 5.407 . 0 0 "[ . 1 . 2 . 3]" 2 1005 1 49 ILE H 1 61 TYR QE 3.600 . 5.200 5.097 4.979 5.214 0.014 29 0 "[ . 1 . 2 . 3]" 2 1006 1 49 ILE H 1 49 ILE HG12 2.600 . 3.600 2.088 1.944 2.227 . 0 0 "[ . 1 . 2 . 3]" 2 1007 1 49 ILE H 1 50 ILE H 3.300 . 4.900 4.449 4.343 4.511 . 0 0 "[ . 1 . 2 . 3]" 2 1008 1 49 ILE H 1 49 ILE HB 2.200 . 3.000 2.714 2.615 2.803 . 0 0 "[ . 1 . 2 . 3]" 2 1009 1 49 ILE H 1 49 ILE MD 2.800 . 4.000 3.092 2.879 3.248 . 0 0 "[ . 1 . 2 . 3]" 2 1010 1 49 ILE H 1 49 ILE MG 2.600 . 6.000 3.814 3.802 3.820 . 0 0 "[ . 1 . 2 . 3]" 2 1011 1 49 ILE H 1 123 GLN HB3 2.600 . 6.000 5.744 5.495 5.998 . 0 0 "[ . 1 . 2 . 3]" 2 1012 1 128 GLN H 1 128 GLN QB 2.600 . 3.600 2.228 2.051 2.755 . 0 0 "[ . 1 . 2 . 3]" 2 1013 1 128 GLN H 1 130 GLU HB2 2.500 . 6.000 5.420 5.134 5.702 . 0 0 "[ . 1 . 2 . 3]" 2 1014 1 72 VAL MG2 1 128 GLN H 3.100 . 4.500 4.048 3.870 4.292 . 0 0 "[ . 1 . 2 . 3]" 2 1015 1 128 GLN H 1 131 ARG HG2 3.000 . 6.000 5.937 5.599 6.130 0.130 20 0 "[ . 1 . 2 . 3]" 2 1016 1 127 THR MG 1 128 GLN H 2.800 . 4.000 3.243 2.962 3.423 . 0 0 "[ . 1 . 2 . 3]" 2 1017 1 86 PHE QE 1 128 GLN H 3.800 . 5.600 4.557 4.238 4.957 . 0 0 "[ . 1 . 2 . 3]" 2 1018 1 109 PHE H 1 113 ASP HB3 3.500 . 6.000 5.289 5.174 5.410 . 0 0 "[ . 1 . 2 . 3]" 2 1019 1 82 ASN H 1 82 ASN HA 2.800 . 4.000 2.806 2.267 2.948 . 0 0 "[ . 1 . 2 . 3]" 2 1020 1 51 HIS H 1 51 HIS HD2 3.300 . 4.800 4.528 4.242 4.797 . 0 0 "[ . 1 . 2 . 3]" 2 1021 1 50 ILE HB 1 51 HIS H 2.800 . 4.000 3.455 3.112 3.754 . 0 0 "[ . 1 . 2 . 3]" 2 1022 1 50 ILE MD 1 51 HIS H 3.200 . 4.700 4.062 3.824 4.243 . 0 0 "[ . 1 . 2 . 3]" 2 1023 1 50 ILE MG 1 51 HIS H 2.400 . 3.300 1.925 1.749 2.251 . 0 0 "[ . 1 . 2 . 3]" 2 1024 1 51 HIS H 1 51 HIS HB2 2.400 . 3.300 2.495 2.293 2.642 . 0 0 "[ . 1 . 2 . 3]" 2 1025 1 108 ASN QB 1 109 PHE H 2.400 . 6.000 3.886 3.375 4.036 . 0 0 "[ . 1 . 2 . 3]" 2 1026 1 108 ASN HD22 1 109 PHE H 3.600 . 5.200 4.711 3.687 5.509 0.309 14 0 "[ . 1 . 2 . 3]" 2 1027 1 94 THR MG 1 121 VAL H 3.900 . 5.800 5.117 5.037 5.214 . 0 0 "[ . 1 . 2 . 3]" 2 1028 1 121 VAL H 1 122 GLU H 2.800 . 4.000 2.538 2.503 2.568 . 0 0 "[ . 1 . 2 . 3]" 2 1029 1 95 ILE MD 1 121 VAL H 3.300 . 4.800 3.723 3.447 4.031 . 0 0 "[ . 1 . 2 . 3]" 2 1030 1 121 VAL H 1 121 VAL HA 2.600 . 3.700 2.841 2.835 2.848 . 0 0 "[ . 1 . 2 . 3]" 2 1031 1 121 VAL H 1 121 VAL MG2 2.400 . 3.300 2.454 2.335 2.576 . 0 0 "[ . 1 . 2 . 3]" 2 1032 1 39 TYR QB 1 41 LEU H 3.600 . 6.000 5.398 5.333 5.531 . 0 0 "[ . 1 . 2 . 3]" 2 1033 1 129 TYR H 1 132 GLU HB2 3.800 . 5.600 5.490 5.274 5.613 0.013 27 0 "[ . 1 . 2 . 3]" 2 1034 1 121 VAL H 1 121 VAL HB 2.400 . 3.300 2.392 2.340 2.437 . 0 0 "[ . 1 . 2 . 3]" 2 1035 1 41 LEU H 1 73 TYR QE 3.600 . 6.000 5.660 5.359 6.004 0.004 14 0 "[ . 1 . 2 . 3]" 2 1036 1 40 MET QG 1 41 LEU H 3.200 2.200 4.400 4.020 3.669 4.323 . 0 0 "[ . 1 . 2 . 3]" 2 1037 1 41 LEU H 1 41 LEU HB2 2.400 . 3.300 2.615 2.508 2.647 . 0 0 "[ . 1 . 2 . 3]" 2 1038 1 41 LEU H 1 73 TYR QD 3.600 . 5.200 4.719 4.555 5.044 . 0 0 "[ . 1 . 2 . 3]" 2 1039 1 127 THR HB 1 130 GLU H 3.500 . 6.000 5.719 5.509 5.885 . 0 0 "[ . 1 . 2 . 3]" 2 1040 1 41 LEU H 1 41 LEU MD1 2.900 . 6.000 4.413 4.372 4.473 . 0 0 "[ . 1 . 2 . 3]" 2 1041 1 41 LEU H 1 41 LEU HG 2.900 . 6.000 4.517 4.438 4.542 . 0 0 "[ . 1 . 2 . 3]" 2 1042 1 61 TYR QE 1 68 TYR H 3.500 . 6.000 5.439 5.261 5.739 . 0 0 "[ . 1 . 2 . 3]" 2 1043 1 59 ARG HB2 1 60 TYR H 2.300 . 3.200 2.944 2.529 4.191 0.991 17 2 "[ . 1 . + -2 . 3]" 2 1044 1 56 TYR HA 1 60 TYR H 3.200 . 4.600 4.461 4.294 4.610 0.010 30 0 "[ . 1 . 2 . 3]" 2 1045 1 60 TYR H 1 61 TYR H 2.600 . 3.700 2.838 2.765 2.958 . 0 0 "[ . 1 . 2 . 3]" 2 1046 1 60 TYR H 1 116 MET ME 2.900 . 6.000 4.443 4.270 4.910 . 0 0 "[ . 1 . 2 . 3]" 2 1047 1 68 TYR H 1 68 TYR HB2 2.300 . 3.100 2.210 2.162 2.378 . 0 0 "[ . 1 . 2 . 3]" 2 1048 1 126 ILE MG 1 130 GLU H 3.200 . 4.700 4.075 3.888 4.216 . 0 0 "[ . 1 . 2 . 3]" 2 1049 1 93 ILE MG 1 95 ILE H 3.500 . 5.200 4.853 4.624 4.988 . 0 0 "[ . 1 . 2 . 3]" 2 1050 1 93 ILE H 1 95 ILE H 3.600 . 5.200 4.465 4.216 4.676 . 0 0 "[ . 1 . 2 . 3]" 2 1051 1 129 TYR H 1 130 GLU H 2.800 . 4.000 2.689 2.623 2.729 . 0 0 "[ . 1 . 2 . 3]" 2 1052 1 129 TYR HB2 1 130 GLU H 3.000 . 4.300 3.951 3.867 4.038 . 0 0 "[ . 1 . 2 . 3]" 2 1053 1 130 GLU H 1 130 GLU HB3 2.300 . 3.200 3.063 2.622 3.353 0.153 15 0 "[ . 1 . 2 . 3]" 2 1054 1 130 GLU H 1 130 GLU HB2 2.600 . 3.600 2.239 2.136 2.352 . 0 0 "[ . 1 . 2 . 3]" 2 1055 1 130 GLU H 1 131 ARG H 2.900 . 4.100 2.451 2.411 2.478 . 0 0 "[ . 1 . 2 . 3]" 2 1056 1 86 PHE QE 1 130 GLU H 3.700 . 5.400 5.372 5.209 5.424 0.024 9 0 "[ . 1 . 2 . 3]" 2 1057 1 95 ILE H 1 121 VAL HB 3.700 . 5.400 5.080 5.026 5.241 . 0 0 "[ . 1 . 2 . 3]" 2 1058 1 95 ILE H 1 95 ILE MG 2.500 . 6.000 3.658 3.600 3.700 . 0 0 "[ . 1 . 2 . 3]" 2 1059 1 94 THR H 1 95 ILE H 2.700 . 3.800 2.909 2.837 2.999 . 0 0 "[ . 1 . 2 . 3]" 2 1060 1 95 ILE H 1 95 ILE HG13 2.700 . 3.800 3.257 3.124 3.419 . 0 0 "[ . 1 . 2 . 3]" 2 1061 1 95 ILE H 1 121 VAL MG1 3.000 . 4.300 3.503 3.357 3.706 . 0 0 "[ . 1 . 2 . 3]" 2 1062 1 95 ILE H 1 95 ILE MD 2.700 . 3.800 2.637 2.397 2.871 . 0 0 "[ . 1 . 2 . 3]" 2 1063 1 40 MET H 1 40 MET HB2 2.800 . 4.000 2.449 2.369 2.547 . 0 0 "[ . 1 . 2 . 3]" 2 1064 1 95 ILE H 1 95 ILE HA 2.500 . 3.500 2.844 2.835 2.854 . 0 0 "[ . 1 . 2 . 3]" 2 1065 1 40 MET H 1 40 MET HB3 3.100 . 4.500 3.621 3.553 3.713 . 0 0 "[ . 1 . 2 . 3]" 2 1066 1 40 MET H 1 73 TYR HB2 3.700 . 5.400 5.216 5.100 5.418 0.018 27 0 "[ . 1 . 2 . 3]" 2 1067 1 45 MET H 1 70 ASN HD22 3.600 . 6.000 5.834 5.622 6.016 0.016 27 0 "[ . 1 . 2 . 3]" 2 1068 1 39 TYR QD 1 40 MET H 3.200 . 4.700 3.788 3.637 4.199 . 0 0 "[ . 1 . 2 . 3]" 2 1069 1 45 MET H 1 46 SER H 3.100 . 4.500 2.523 2.319 4.379 . 0 0 "[ . 1 . 2 . 3]" 2 1070 1 95 ILE H 1 95 ILE HB 2.300 . 3.200 2.259 2.197 2.311 . 0 0 "[ . 1 . 2 . 3]" 2 1071 1 39 TYR HB3 1 40 MET H 2.700 . 3.800 2.286 2.020 2.867 . 0 0 "[ . 1 . 2 . 3]" 2 1072 1 77 MET H 1 77 MET HB2 2.600 . 3.600 2.188 2.062 3.063 . 0 0 "[ . 1 . 2 . 3]" 2 1073 1 45 MET H 1 70 ASN HD21 3.600 . 5.200 4.976 4.595 5.216 0.016 25 0 "[ . 1 . 2 . 3]" 2 1074 1 95 ILE H 1 96 LYS H 2.700 . 3.800 2.597 2.544 2.635 . 0 0 "[ . 1 . 2 . 3]" 2 1075 1 45 MET H 1 45 MET QB 2.400 . 6.000 3.203 3.162 3.214 . 0 0 "[ . 1 . 2 . 3]" 2 1076 1 44 ALA MB 1 45 MET H 2.300 . 3.200 2.692 2.569 2.911 . 0 0 "[ . 1 . 2 . 3]" 2 1077 1 45 MET H 1 70 ASN HB3 2.900 . 4.200 4.153 3.645 4.214 0.014 20 0 "[ . 1 . 2 . 3]" 2 1078 1 135 ALA H 1 138 GLN QG 3.500 . 5.200 4.149 4.034 4.237 . 0 0 "[ . 1 . 2 . 3]" 2 1079 1 135 ALA H 1 139 ARG H 3.800 . 6.000 5.956 5.848 6.013 0.013 23 0 "[ . 1 . 2 . 3]" 2 1080 1 139 ARG H 1 139 ARG QB 2.200 . 3.000 2.093 2.044 2.173 . 0 0 "[ . 1 . 2 . 3]" 2 1081 1 139 ARG H 1 139 ARG QG 2.800 . 4.000 3.326 2.879 3.793 . 0 0 "[ . 1 . 2 . 3]" 2 1082 1 139 ARG H 1 140 GLY H 2.600 . 3.600 2.564 2.269 2.738 . 0 0 "[ . 1 . 2 . 3]" 2 1083 1 77 MET H 1 86 PHE QE 3.400 . 5.100 3.638 3.105 4.233 . 0 0 "[ . 1 . 2 . 3]" 2 1084 1 132 GLU HA 1 135 ALA H 2.700 . 3.800 3.362 3.234 3.559 . 0 0 "[ . 1 . 2 . 3]" 2 1085 1 95 ILE MD 1 122 GLU H 3.600 . 5.200 4.345 4.220 4.524 . 0 0 "[ . 1 . 2 . 3]" 2 1086 1 138 GLN HG2 1 139 ARG H 3.200 . 4.700 3.302 2.567 4.082 . 0 0 "[ . 1 . 2 . 3]" 2 1087 1 119 ARG H 1 122 GLU H 4.000 . 6.000 4.678 4.606 4.763 . 0 0 "[ . 1 . 2 . 3]" 2 1088 1 136 TYR H 1 139 ARG H 2.800 . 6.000 4.593 4.385 4.722 . 0 0 "[ . 1 . 2 . 3]" 2 1089 1 137 TYR HB2 1 139 ARG H 3.900 . 5.800 4.998 4.837 5.117 . 0 0 "[ . 1 . 2 . 3]" 2 1090 1 135 ALA MB 1 139 ARG H 3.800 . 5.600 4.828 4.656 5.005 . 0 0 "[ . 1 . 2 . 3]" 2 1091 1 121 VAL MG1 1 122 GLU H 3.100 . 4.500 3.399 3.236 3.533 . 0 0 "[ . 1 . 2 . 3]" 2 1092 1 139 ARG H 1 140 GLY QA 3.800 . 5.600 4.467 4.207 4.696 . 0 0 "[ . 1 . 2 . 3]" 2 1093 1 122 GLU H 1 122 GLU HB3 2.400 . 3.300 2.075 2.053 2.141 . 0 0 "[ . 1 . 2 . 3]" 2 1094 1 134 GLN QG 1 135 ALA H 3.800 . 5.600 3.991 1.823 4.596 0.177 30 0 "[ . 1 . 2 . 3]" 2 1095 1 59 ARG H 1 60 TYR HB2 3.400 . 6.000 4.833 4.690 5.019 . 0 0 "[ . 1 . 2 . 3]" 2 1096 1 59 ARG H 1 59 ARG HE 3.700 . 5.400 5.012 3.839 5.426 0.026 19 0 "[ . 1 . 2 . 3]" 2 1097 1 59 ARG H 1 59 ARG HA 2.400 . 3.300 2.848 2.832 2.855 . 0 0 "[ . 1 . 2 . 3]" 2 1098 1 59 ARG H 1 62 ARG QG 3.000 . 6.000 4.838 4.523 5.742 . 0 0 "[ . 1 . 2 . 3]" 2 1099 1 59 ARG H 1 60 TYR HA 3.500 . 6.000 5.130 5.074 5.204 . 0 0 "[ . 1 . 2 . 3]" 2 1100 1 111 LYS H 1 113 ASP H 3.500 . 5.200 3.984 3.862 4.121 . 0 0 "[ . 1 . 2 . 3]" 2 1101 1 59 ARG H 1 59 ARG HB2 2.000 . 2.700 2.539 2.187 3.353 0.653 19 2 "[ . 1 . - +2 . 3]" 2 1102 1 59 ARG H 1 59 ARG HG3 3.000 . 4.200 3.211 2.771 3.630 . 0 0 "[ . 1 . 2 . 3]" 2 1103 1 59 ARG H 1 59 ARG QD 2.900 . 6.000 4.003 2.673 4.630 . 0 0 "[ . 1 . 2 . 3]" 2 1104 1 113 ASP H 1 113 ASP HB3 2.600 . 6.000 3.530 3.489 3.571 . 0 0 "[ . 1 . 2 . 3]" 2 1105 1 112 THR MG 1 113 ASP H 2.900 . 4.100 3.858 3.682 3.968 . 0 0 "[ . 1 . 2 . 3]" 2 1106 1 110 THR H 1 113 ASP H 3.000 . 4.300 3.145 2.958 3.243 . 0 0 "[ . 1 . 2 . 3]" 2 1107 1 113 ASP H 1 114 VAL H 2.600 . 3.600 2.696 2.661 2.725 . 0 0 "[ . 1 . 2 . 3]" 2 1108 1 113 ASP H 1 113 ASP HA 2.600 . 3.700 2.828 2.821 2.835 . 0 0 "[ . 1 . 2 . 3]" 2 1109 1 113 ASP H 1 113 ASP HB2 2.800 . 4.000 2.252 2.179 2.354 . 0 0 "[ . 1 . 2 . 3]" 2 1110 1 112 THR HB 1 113 ASP H 2.500 . 3.500 2.861 2.736 2.995 . 0 0 "[ . 1 . 2 . 3]" 2 1111 1 60 TYR QE 1 113 ASP H 3.400 . 5.000 4.948 4.749 5.027 0.027 24 0 "[ . 1 . 2 . 3]" 2 1112 1 113 ASP H 1 114 VAL MG1 3.000 . 4.400 4.207 4.093 4.287 . 0 0 "[ . 1 . 2 . 3]" 2 1113 1 134 GLN H 1 134 GLN QB 2.300 . 3.200 2.158 2.048 2.459 . 0 0 "[ . 1 . 2 . 3]" 2 1114 1 83 GLN H 1 84 ASN H 2.700 . 3.800 2.479 2.324 2.776 . 0 0 "[ . 1 . 2 . 3]" 2 1115 1 83 GLN H 1 83 GLN QB 2.900 . 4.100 2.508 2.236 2.797 . 0 0 "[ . 1 . 2 . 3]" 2 1116 1 59 ARG H 1 59 ARG HG2 2.700 . 3.800 2.589 1.898 4.255 0.455 23 0 "[ . 1 . 2 . 3]" 2 1117 1 83 GLN H 1 129 TYR QE 3.400 . 5.100 4.009 3.632 4.655 . 0 0 "[ . 1 . 2 . 3]" 2 1118 1 82 ASN HB2 1 83 GLN H 2.400 . 6.000 4.240 3.711 4.650 . 0 0 "[ . 1 . 2 . 3]" 2 1119 1 133 SER H 1 134 GLN H 2.800 . 4.000 2.491 2.471 2.516 . 0 0 "[ . 1 . 2 . 3]" 2 1120 1 87 VAL H 1 87 VAL HB 2.600 . 6.000 3.630 3.607 3.659 . 0 0 "[ . 1 . 2 . 3]" 2 1121 1 134 GLN H 1 138 GLN H 2.600 . 6.000 5.991 5.909 6.041 0.041 28 0 "[ . 1 . 2 . 3]" 2 1122 1 105 LYS H 1 106 GLY H 2.500 . 3.500 2.374 2.129 2.613 . 0 0 "[ . 1 . 2 . 3]" 2 1123 1 78 ASP HA 1 79 GLU H 3.600 . 5.200 2.874 2.147 3.555 . 0 0 "[ . 1 . 2 . 3]" 2 1124 1 105 LYS H 1 105 LYS HB2 2.500 . 3.500 2.263 2.180 2.397 . 0 0 "[ . 1 . 2 . 3]" 2 1125 1 87 VAL H 1 87 VAL QG 2.600 . 3.600 1.929 1.816 2.073 . 0 0 "[ . 1 . 2 . 3]" 2 1126 1 79 GLU H 1 79 GLU HB3 3.800 . 5.600 3.573 2.636 4.076 . 0 0 "[ . 1 . 2 . 3]" 2 1127 1 103 THR HA 1 107 GLU H 2.500 . 3.500 3.232 2.834 3.462 . 0 0 "[ . 1 . 2 . 3]" 2 1128 1 103 THR MG 1 107 GLU H 3.200 . 4.600 4.506 3.900 4.638 0.038 6 0 "[ . 1 . 2 . 3]" 2 1129 1 107 GLU H 1 108 ASN H 2.900 . 6.000 4.438 4.339 4.542 . 0 0 "[ . 1 . 2 . 3]" 2 1130 1 102 THR HA 1 107 GLU H 2.500 . 6.000 4.740 4.309 5.691 . 0 0 "[ . 1 . 2 . 3]" 2 1131 1 107 GLU H 1 107 GLU HB2 2.200 . 3.000 2.380 2.168 3.017 0.017 10 0 "[ . 1 . 2 . 3]" 2 1132 1 106 GLY HA2 1 107 GLU H 2.600 . 3.600 3.191 2.636 3.386 . 0 0 "[ . 1 . 2 . 3]" 2 1133 1 58 ASP H 1 58 ASP HB3 2.300 . 6.000 3.530 3.500 3.561 . 0 0 "[ . 1 . 2 . 3]" 2 1134 1 58 ASP H 1 58 ASP HA 2.400 . 3.300 2.778 2.769 2.790 . 0 0 "[ . 1 . 2 . 3]" 2 1135 1 57 GLU HB2 1 58 ASP H 2.700 . 3.800 2.858 2.706 3.031 . 0 0 "[ . 1 . 2 . 3]" 2 1136 1 57 GLU H 1 58 ASP H 2.500 . 3.500 2.522 2.453 2.569 . 0 0 "[ . 1 . 2 . 3]" 2 1137 1 58 ASP H 1 58 ASP HB2 2.300 . 3.200 2.254 2.195 2.329 . 0 0 "[ . 1 . 2 . 3]" 2 1138 1 57 GLU HA 1 58 ASP H 2.800 . 4.000 3.503 3.465 3.528 . 0 0 "[ . 1 . 2 . 3]" 2 1139 1 54 SER HA 1 58 ASP H 3.300 . 6.000 4.923 4.782 5.109 . 0 0 "[ . 1 . 2 . 3]" 2 1140 1 107 GLU HA 1 108 ASN H 1.800 . 6.000 2.649 2.487 2.775 . 0 0 "[ . 1 . 2 . 3]" 2 1141 1 136 TYR H 1 138 GLN H 2.800 . 4.000 3.882 3.726 4.002 0.002 17 0 "[ . 1 . 2 . 3]" 2 1142 1 108 ASN H 1 108 ASN QB 2.300 . 3.100 2.789 2.663 2.867 . 0 0 "[ . 1 . 2 . 3]" 2 1143 1 72 VAL HB 1 125 CYS H 3.800 . 5.600 5.185 5.056 5.342 . 0 0 "[ . 1 . 2 . 3]" 2 1144 1 102 THR MG 1 108 ASN H 3.400 . 5.000 4.733 4.191 5.017 0.017 10 0 "[ . 1 . 2 . 3]" 2 1145 1 111 LYS H 1 111 LYS QB 2.300 . 3.200 2.336 2.042 2.791 . 0 0 "[ . 1 . 2 . 3]" 2 1146 1 122 GLU H 1 125 CYS H 3.700 . 5.500 4.676 4.609 4.723 . 0 0 "[ . 1 . 2 . 3]" 2 1147 1 110 THR MG 1 111 LYS H 2.600 . 3.600 2.536 1.877 3.417 . 0 0 "[ . 1 . 2 . 3]" 2 1148 1 138 GLN H 1 138 GLN HB2 2.300 . 6.000 3.627 3.605 3.645 . 0 0 "[ . 1 . 2 . 3]" 2 1149 1 87 VAL QG 1 125 CYS H 2.800 . 6.000 4.298 3.993 4.667 . 0 0 "[ . 1 . 2 . 3]" 2 1150 1 110 THR H 1 111 LYS H 3.600 . 5.200 4.396 4.349 4.432 . 0 0 "[ . 1 . 2 . 3]" 2 1151 1 125 CYS H 1 126 ILE H 2.700 . 3.800 2.512 2.454 2.549 . 0 0 "[ . 1 . 2 . 3]" 2 1152 1 72 VAL MG1 1 125 CYS H 2.800 . 3.900 3.581 3.394 3.820 . 0 0 "[ . 1 . 2 . 3]" 2 1153 1 137 TYR QD 1 138 GLN H 3.300 . 4.800 4.568 4.487 4.729 . 0 0 "[ . 1 . 2 . 3]" 2 1154 1 121 VAL HA 1 124 MET H 2.800 . 3.900 3.235 3.157 3.298 . 0 0 "[ . 1 . 2 . 3]" 2 1155 1 124 MET QB 1 125 CYS H 2.500 . 3.500 2.874 2.779 2.950 . 0 0 "[ . 1 . 2 . 3]" 2 1156 1 124 MET H 1 125 CYS H 2.600 . 3.700 2.610 2.580 2.639 . 0 0 "[ . 1 . 2 . 3]" 2 1157 1 123 GLN QG 1 125 CYS H 3.200 . 6.000 5.160 5.066 5.228 . 0 0 "[ . 1 . 2 . 3]" 2 1158 1 123 GLN H 1 125 CYS H 3.500 . 5.200 3.869 3.790 3.972 . 0 0 "[ . 1 . 2 . 3]" 2 1159 1 121 VAL MG1 1 125 CYS H 3.100 . 4.500 3.706 3.557 3.887 . 0 0 "[ . 1 . 2 . 3]" 2 1160 1 72 VAL MG2 1 125 CYS H 3.200 . 4.600 4.062 3.924 4.197 . 0 0 "[ . 1 . 2 . 3]" 2 1161 1 138 GLN H 1 138 GLN QG 2.500 . 3.500 2.293 2.041 2.459 . 0 0 "[ . 1 . 2 . 3]" 2 1162 1 135 ALA MB 1 138 GLN H 3.400 . 5.000 4.707 4.548 4.818 . 0 0 "[ . 1 . 2 . 3]" 2 1163 1 137 TYR HB2 1 138 GLN H 2.800 . 4.000 2.981 2.857 3.119 . 0 0 "[ . 1 . 2 . 3]" 2 1164 1 137 TYR HB3 1 138 GLN H 2.800 . 4.000 3.460 3.323 3.586 . 0 0 "[ . 1 . 2 . 3]" 2 1165 1 125 CYS H 1 128 GLN H 3.900 . 5.800 4.884 4.686 5.132 . 0 0 "[ . 1 . 2 . 3]" 2 1166 1 64 ASN H 1 65 MET H 2.400 . 3.300 2.329 2.268 2.561 . 0 0 "[ . 1 . 2 . 3]" 2 1167 1 65 MET H 1 65 MET HB2 2.600 . 3.600 2.642 2.615 2.670 . 0 0 "[ . 1 . 2 . 3]" 2 1168 1 64 ASN HA 1 65 MET H 3.000 . 4.300 3.239 3.147 3.350 . 0 0 "[ . 1 . 2 . 3]" 2 1169 1 65 MET H 1 68 TYR QD 3.200 . 4.700 3.595 3.375 3.801 . 0 0 "[ . 1 . 2 . 3]" 2 1170 1 65 MET H 1 65 MET HG3 2.600 . 3.700 2.005 1.926 2.106 . 0 0 "[ . 1 . 2 . 3]" 2 1171 1 65 MET H 1 65 MET HB3 2.700 . 3.800 3.599 3.592 3.605 . 0 0 "[ . 1 . 2 . 3]" 2 1172 1 123 GLN H 1 124 MET H 2.800 . 4.000 2.595 2.551 2.629 . 0 0 "[ . 1 . 2 . 3]" 2 1173 1 63 GLU QB 1 65 MET H 3.300 . 4.900 4.698 4.646 4.882 . 0 0 "[ . 1 . 2 . 3]" 2 1174 1 114 VAL MG2 1 115 LYS H 2.700 . 3.800 2.116 1.912 2.359 . 0 0 "[ . 1 . 2 . 3]" 2 1175 1 113 ASP HB2 1 114 VAL H 2.800 . 4.000 2.649 2.541 2.772 . 0 0 "[ . 1 . 2 . 3]" 2 1176 1 138 GLN H 1 139 ARG QB 3.200 . 4.700 4.074 3.956 4.211 . 0 0 "[ . 1 . 2 . 3]" 2 1177 1 65 MET H 1 65 MET HA 2.500 . 3.500 2.777 2.764 2.807 . 0 0 "[ . 1 . 2 . 3]" 2 1178 1 130 GLU HB3 1 132 GLU H 2.900 . 6.000 5.265 4.951 5.576 . 0 0 "[ . 1 . 2 . 3]" 2 1179 1 131 ARG H 1 132 GLU H 3.100 . 4.500 2.574 2.413 2.691 . 0 0 "[ . 1 . 2 . 3]" 2 1180 1 115 LYS H 1 115 LYS QB 2.100 . 2.900 2.231 2.104 2.253 . 0 0 "[ . 1 . 2 . 3]" 2 1181 1 136 TYR H 1 136 TYR HB2 2.400 . 3.300 2.676 2.533 2.842 . 0 0 "[ . 1 . 2 . 3]" 2 1182 1 90 CYS H 1 90 CYS HB3 2.500 . 3.500 2.219 2.154 2.296 . 0 0 "[ . 1 . 2 . 3]" 2 1183 1 89 ASP H 1 90 CYS H 2.800 . 4.000 2.533 2.343 2.654 . 0 0 "[ . 1 . 2 . 3]" 2 1184 1 90 CYS H 1 91 VAL H 2.700 . 3.800 2.539 2.462 2.679 . 0 0 "[ . 1 . 2 . 3]" 2 1185 1 112 THR MG 1 115 LYS H 3.500 . 5.100 4.497 4.287 4.582 . 0 0 "[ . 1 . 2 . 3]" 2 1186 1 124 MET H 1 127 THR HB 3.800 2.200 5.400 5.418 5.393 5.440 0.040 15 0 "[ . 1 . 2 . 3]" 2 1187 1 87 VAL QG 1 90 CYS H 3.000 . 6.000 4.394 4.317 4.483 . 0 0 "[ . 1 . 2 . 3]" 2 1188 1 109 PHE HA 1 114 VAL H 3.800 . 5.600 4.863 4.582 5.060 . 0 0 "[ . 1 . 2 . 3]" 2 1189 1 114 VAL H 1 114 VAL MG1 2.200 . 3.000 2.242 2.109 2.312 . 0 0 "[ . 1 . 2 . 3]" 2 1190 1 90 CYS H 1 90 CYS HA 2.500 . 3.500 2.856 2.816 2.880 . 0 0 "[ . 1 . 2 . 3]" 2 1191 1 113 ASP HA 1 115 LYS H 3.900 . 5.800 4.136 4.035 4.246 . 0 0 "[ . 1 . 2 . 3]" 2 1192 1 131 ARG H 1 131 ARG HG2 3.400 . 5.000 3.402 2.898 4.119 . 0 0 "[ . 1 . 2 . 3]" 2 1193 1 131 ARG H 1 131 ARG HB3 3.000 . 4.300 3.584 3.523 3.607 . 0 0 "[ . 1 . 2 . 3]" 2 1194 1 89 ASP HA 1 90 CYS H 3.000 . 4.300 3.451 3.394 3.491 . 0 0 "[ . 1 . 2 . 3]" 2 1195 1 86 PHE QD 1 90 CYS H 3.600 . 5.300 5.267 5.136 5.327 0.027 3 0 "[ . 1 . 2 . 3]" 2 1196 1 50 ILE MG 1 120 VAL H 3.600 . 5.200 4.249 4.058 4.520 . 0 0 "[ . 1 . 2 . 3]" 2 1197 1 130 GLU HB3 1 131 ARG H 3.100 . 4.500 3.700 3.539 3.927 . 0 0 "[ . 1 . 2 . 3]" 2 1198 1 61 TYR QE 1 120 VAL H 3.800 . 5.600 5.504 5.429 5.602 0.002 23 0 "[ . 1 . 2 . 3]" 2 1199 1 56 TYR HA 1 57 GLU H 2.800 . 4.000 3.569 3.564 3.577 . 0 0 "[ . 1 . 2 . 3]" 2 1200 1 112 THR H 1 114 VAL H 3.100 . 6.000 4.396 4.230 4.498 . 0 0 "[ . 1 . 2 . 3]" 2 1201 1 131 ARG HD2 1 132 GLU H 3.300 . 6.000 5.290 4.965 5.918 . 0 0 "[ . 1 . 2 . 3]" 2 1202 1 131 ARG H 1 131 ARG HB2 2.800 . 4.000 2.126 1.980 2.205 . 0 0 "[ . 1 . 2 . 3]" 2 1203 1 110 THR H 1 114 VAL H 3.400 . 5.000 4.201 4.082 4.336 . 0 0 "[ . 1 . 2 . 3]" 2 1204 1 120 VAL H 1 122 GLU H 3.500 . 5.200 4.047 3.930 4.151 . 0 0 "[ . 1 . 2 . 3]" 2 1205 1 56 TYR QD 1 57 GLU H 3.000 . 4.300 2.760 2.647 3.012 . 0 0 "[ . 1 . 2 . 3]" 2 1206 1 57 GLU H 1 57 GLU HB2 2.600 . 3.700 2.248 2.167 2.391 . 0 0 "[ . 1 . 2 . 3]" 2 1207 1 54 SER H 1 57 GLU H 3.200 . 4.700 2.884 2.775 3.016 . 0 0 "[ . 1 . 2 . 3]" 2 1208 1 57 GLU H 1 59 ARG QB 2.500 . 6.000 5.625 5.284 5.905 . 0 0 "[ . 1 . 2 . 3]" 2 1209 1 120 VAL H 1 120 VAL HB 2.400 . 3.300 2.537 2.453 2.622 . 0 0 "[ . 1 . 2 . 3]" 2 1210 1 50 ILE MD 1 120 VAL H 3.100 . 4.500 3.186 2.924 3.714 . 0 0 "[ . 1 . 2 . 3]" 2 1211 1 120 VAL H 1 121 VAL H 2.500 . 3.500 2.665 2.626 2.712 . 0 0 "[ . 1 . 2 . 3]" 2 1212 1 120 VAL H 1 120 VAL MG2 2.300 . 3.100 2.218 1.990 2.359 . 0 0 "[ . 1 . 2 . 3]" 2 1213 1 57 GLU H 1 57 GLU QG 2.600 . 3.600 2.939 2.656 3.132 . 0 0 "[ . 1 . 2 . 3]" 2 1214 1 119 ARG H 1 120 VAL H 2.500 . 3.500 2.593 2.559 2.662 . 0 0 "[ . 1 . 2 . 3]" 2 1215 1 119 ARG HB3 1 120 VAL H 2.600 . 3.600 3.642 3.431 3.677 0.077 4 0 "[ . 1 . 2 . 3]" 2 1216 1 98 HIS H 1 98 HIS HB2 2.500 . 3.500 2.303 2.249 2.389 . 0 0 "[ . 1 . 2 . 3]" 2 1217 1 119 ARG HB2 1 120 VAL H 2.600 . 3.600 2.464 2.349 2.545 . 0 0 "[ . 1 . 2 . 3]" 2 1218 1 97 GLN HA 1 98 HIS H 2.900 . 4.200 3.555 3.516 3.568 . 0 0 "[ . 1 . 2 . 3]" 2 1219 1 56 TYR HB3 1 57 GLU H 2.800 . 4.100 2.448 2.358 2.518 . 0 0 "[ . 1 . 2 . 3]" 2 1220 1 56 TYR QE 1 57 GLU H 3.700 . 5.400 4.723 4.601 4.958 . 0 0 "[ . 1 . 2 . 3]" 2 1221 1 97 GLN HB2 1 98 HIS H 2.800 . 4.000 2.858 2.544 2.968 . 0 0 "[ . 1 . 2 . 3]" 2 1222 1 89 ASP H 1 89 ASP HB3 2.400 . 3.300 2.772 2.338 2.891 . 0 0 "[ . 1 . 2 . 3]" 2 1223 1 131 ARG H 1 131 ARG HD2 3.600 . 5.200 4.293 3.877 5.071 . 0 0 "[ . 1 . 2 . 3]" 2 1224 1 52 PHE QE 1 120 VAL H 3.900 . 5.800 4.304 3.620 4.698 . 0 0 "[ . 1 . 2 . 3]" 2 1225 1 94 THR MG 1 98 HIS H 3.600 . 5.300 4.087 3.995 4.217 . 0 0 "[ . 1 . 2 . 3]" 2 1226 1 95 ILE MG 1 98 HIS H 3.700 . 5.400 4.792 4.712 4.915 . 0 0 "[ . 1 . 2 . 3]" 2 1227 1 93 ILE H 1 93 ILE MG 3.100 . 4.500 3.663 3.595 3.710 . 0 0 "[ . 1 . 2 . 3]" 2 1228 1 93 ILE H 1 93 ILE MD 3.400 . 5.000 3.650 3.386 3.851 . 0 0 "[ . 1 . 2 . 3]" 2 1229 1 92 ASN HB2 1 93 ILE H 3.000 . 4.400 3.770 3.306 4.077 . 0 0 "[ . 1 . 2 . 3]" 2 1230 1 92 ASN HA 1 93 ILE H 3.700 . 5.400 3.568 3.519 3.584 . 0 0 "[ . 1 . 2 . 3]" 2 1231 1 56 TYR H 1 57 GLU H 2.500 . 3.500 2.879 2.858 2.906 . 0 0 "[ . 1 . 2 . 3]" 2 1232 1 93 ILE H 1 93 ILE HG12 2.800 . 4.000 2.797 2.617 3.142 . 0 0 "[ . 1 . 2 . 3]" 2 1233 1 54 SER HB3 1 56 TYR H 3.000 . 4.300 4.381 4.160 4.549 0.249 18 0 "[ . 1 . 2 . 3]" 2 1234 1 92 ASN H 1 93 ILE H 3.200 . 4.700 2.637 2.473 2.819 . 0 0 "[ . 1 . 2 . 3]" 2 1235 1 56 TYR H 1 56 TYR HB3 2.200 . 3.000 2.296 2.242 2.375 . 0 0 "[ . 1 . 2 . 3]" 2 1236 1 56 TYR H 1 57 GLU HA 3.300 . 6.000 5.426 5.411 5.448 . 0 0 "[ . 1 . 2 . 3]" 2 1237 1 56 TYR H 1 57 GLU QG 3.400 . 6.000 5.423 5.075 5.632 . 0 0 "[ . 1 . 2 . 3]" 2 1238 1 125 CYS H 1 127 THR H 3.600 . 5.200 4.058 3.943 4.162 . 0 0 "[ . 1 . 2 . 3]" 2 1239 1 118 GLU H 1 119 ARG HG2 3.400 . 5.000 4.194 3.888 4.664 . 0 0 "[ . 1 . 2 . 3]" 2 1240 1 116 MET H 1 118 GLU H 3.500 . 5.200 4.165 3.995 4.241 . 0 0 "[ . 1 . 2 . 3]" 2 1241 1 65 MET HA 1 67 ARG H 3.300 . 4.900 4.062 3.442 4.254 . 0 0 "[ . 1 . 2 . 3]" 2 1242 1 67 ARG H 1 67 ARG HB3 2.700 . 6.000 3.647 3.574 3.883 . 0 0 "[ . 1 . 2 . 3]" 2 1243 1 118 GLU H 1 118 GLU QG 2.500 . 3.500 2.767 2.583 3.065 . 0 0 "[ . 1 . 2 . 3]" 2 1244 1 127 THR H 1 130 GLU H 2.800 . 6.000 5.026 4.850 5.161 . 0 0 "[ . 1 . 2 . 3]" 2 1245 1 66 HIS HD2 1 67 ARG H 3.600 . 5.200 4.883 4.420 5.212 0.012 24 0 "[ . 1 . 2 . 3]" 2 1246 1 126 ILE H 1 127 THR H 2.600 . 3.700 2.615 2.489 2.692 . 0 0 "[ . 1 . 2 . 3]" 2 1247 1 95 ILE MD 1 118 GLU H 2.800 . 4.000 3.257 3.097 3.444 . 0 0 "[ . 1 . 2 . 3]" 2 1248 1 118 GLU H 1 119 ARG H 2.700 . 3.800 2.710 2.683 2.740 . 0 0 "[ . 1 . 2 . 3]" 2 1249 1 118 GLU H 1 118 GLU HA 2.500 . 3.500 2.796 2.789 2.802 . 0 0 "[ . 1 . 2 . 3]" 2 1250 1 66 HIS H 1 67 ARG H 2.800 . 3.900 2.672 2.628 2.703 . 0 0 "[ . 1 . 2 . 3]" 2 1251 1 67 ARG H 1 67 ARG HB2 2.400 . 3.300 2.227 1.956 2.522 . 0 0 "[ . 1 . 2 . 3]" 2 1252 1 67 ARG H 1 67 ARG HD2 2.900 . 4.100 3.449 2.156 4.382 0.282 27 0 "[ . 1 . 2 . 3]" 2 1253 1 117 MET H 1 118 GLU H 2.700 . 3.800 2.700 2.637 2.789 . 0 0 "[ . 1 . 2 . 3]" 2 1254 1 126 ILE HB 1 127 THR H 2.500 . 3.500 2.596 2.480 2.718 . 0 0 "[ . 1 . 2 . 3]" 2 1255 1 67 ARG H 1 68 TYR QD 3.300 . 4.900 4.198 3.991 4.421 . 0 0 "[ . 1 . 2 . 3]" 2 1256 1 118 GLU H 1 120 VAL QG 3.300 . 6.000 4.885 4.765 4.983 . 0 0 "[ . 1 . 2 . 3]" 2 1257 1 127 THR H 1 128 GLN H 2.600 . 3.600 2.755 2.662 2.885 . 0 0 "[ . 1 . 2 . 3]" 2 1258 1 126 ILE MG 1 127 THR H 2.600 . 3.600 3.313 3.222 3.372 . 0 0 "[ . 1 . 2 . 3]" 2 1259 1 67 ARG H 1 68 TYR QE 3.800 . 6.000 5.923 5.698 6.017 0.017 29 0 "[ . 1 . 2 . 3]" 2 1260 1 67 ARG H 1 68 TYR HA 3.800 . 5.600 4.869 4.382 4.972 . 0 0 "[ . 1 . 2 . 3]" 2 1261 1 85 ASN H 1 85 ASN QD 3.100 . 4.500 2.778 1.924 4.165 . 0 0 "[ . 1 . 2 . 3]" 2 1262 1 82 ASN HA 1 85 ASN H 3.500 . 5.200 4.665 3.288 5.208 0.008 6 0 "[ . 1 . 2 . 3]" 2 1263 1 84 ASN H 1 85 ASN H 2.600 . 3.600 2.665 2.483 2.828 . 0 0 "[ . 1 . 2 . 3]" 2 1264 1 85 ASN H 1 85 ASN HB2 2.500 . 3.500 2.746 2.189 2.899 . 0 0 "[ . 1 . 2 . 3]" 2 1265 1 85 ASN H 1 85 ASN HB3 2.600 . 6.000 3.557 3.498 3.601 . 0 0 "[ . 1 . 2 . 3]" 2 1266 1 82 ASN HD22 1 85 ASN H 3.700 . 5.400 4.908 2.431 6.249 0.849 15 3 "[ . * 1 + - . 3]" 2 1267 1 85 ASN H 1 87 VAL H 3.600 . 5.200 4.454 4.127 4.660 . 0 0 "[ . 1 . 2 . 3]" 2 1268 1 116 MET H 1 117 MET HA 3.400 . 6.000 5.166 5.103 5.203 . 0 0 "[ . 1 . 2 . 3]" 2 1269 1 61 TYR HB2 1 116 MET H 3.600 . 6.000 6.021 5.632 6.074 0.074 23 0 "[ . 1 . 2 . 3]" 2 1270 1 116 MET H 1 116 MET QG 2.600 . 3.300 1.870 1.769 2.236 0.031 13 0 "[ . 1 . 2 . 3]" 2 1271 1 115 LYS H 1 116 MET H 2.500 . 3.500 2.791 2.718 2.826 . 0 0 "[ . 1 . 2 . 3]" 2 1272 1 112 THR MG 1 116 MET H 3.100 . 4.500 4.028 3.884 4.164 . 0 0 "[ . 1 . 2 . 3]" 2 1273 1 116 MET H 1 117 MET H 2.500 . 3.500 2.552 2.479 2.594 . 0 0 "[ . 1 . 2 . 3]" 2 1274 1 117 MET H 1 120 VAL H 3.500 . 5.200 4.777 4.730 4.822 . 0 0 "[ . 1 . 2 . 3]" 2 1275 1 68 TYR QE 1 116 MET H 3.700 . 5.400 4.334 4.203 4.676 . 0 0 "[ . 1 . 2 . 3]" 2 1276 1 73 TYR HB2 1 94 THR H 3.200 . 4.600 3.820 3.571 4.066 . 0 0 "[ . 1 . 2 . 3]" 2 1277 1 73 TYR QD 1 94 THR H 3.500 . 5.100 3.664 3.350 4.023 . 0 0 "[ . 1 . 2 . 3]" 2 1278 1 93 ILE MG 1 94 THR H 2.700 . 3.800 2.897 2.617 3.152 . 0 0 "[ . 1 . 2 . 3]" 2 1279 1 94 THR H 1 94 THR HB 2.500 . 3.500 2.588 2.512 2.638 . 0 0 "[ . 1 . 2 . 3]" 2 1280 1 115 LYS H 1 117 MET H 3.300 . 4.800 3.814 3.711 3.950 . 0 0 "[ . 1 . 2 . 3]" 2 1281 1 93 ILE HB 1 94 THR H 2.700 . 3.800 2.789 2.696 2.985 . 0 0 "[ . 1 . 2 . 3]" 2 1282 1 117 MET H 1 117 MET HB2 2.400 . 3.300 2.203 2.185 2.249 . 0 0 "[ . 1 . 2 . 3]" 2 1283 1 68 TYR QD 1 117 MET H 3.600 . 5.200 4.690 4.530 5.041 . 0 0 "[ . 1 . 2 . 3]" 2 1284 1 117 MET H 1 119 ARG HG2 3.400 . 6.000 5.517 5.047 6.013 0.013 7 0 "[ . 1 . 2 . 3]" 2 1285 1 117 MET H 1 118 GLU QG 3.500 . 5.200 4.906 4.662 5.093 . 0 0 "[ . 1 . 2 . 3]" 2 1286 1 95 ILE HG13 1 117 MET H 3.900 . 5.800 5.808 5.673 5.835 0.035 2 0 "[ . 1 . 2 . 3]" 2 1287 1 116 MET QG 1 117 MET H 3.200 . 4.700 3.540 3.436 3.780 . 0 0 "[ . 1 . 2 . 3]" 2 1288 1 117 MET H 1 120 VAL MG2 2.900 . 6.000 4.334 4.190 4.494 . 0 0 "[ . 1 . 2 . 3]" 2 1289 1 115 LYS HA 1 117 MET H 2.900 . 6.000 4.409 4.231 4.486 . 0 0 "[ . 1 . 2 . 3]" 2 1290 1 116 MET HB3 1 117 MET H 2.600 . 6.000 4.020 3.848 4.149 . 0 0 "[ . 1 . 2 . 3]" 2 1291 1 93 ILE H 1 94 THR H 2.700 . 3.800 2.702 2.513 2.819 . 0 0 "[ . 1 . 2 . 3]" 2 1292 1 68 TYR QE 1 117 MET H 3.600 . 5.200 2.985 2.784 3.300 . 0 0 "[ . 1 . 2 . 3]" 2 1293 1 61 TYR H 1 62 ARG H 2.700 . 3.800 2.694 2.650 2.758 . 0 0 "[ . 1 . 2 . 3]" 2 1294 1 61 TYR QD 1 62 ARG H 2.600 . 3.700 3.189 2.692 3.337 . 0 0 "[ . 1 . 2 . 3]" 2 1295 1 52 PHE QE 1 62 ARG H 3.200 . 4.700 4.659 4.533 4.731 0.031 2 0 "[ . 1 . 2 . 3]" 2 1296 1 135 ALA H 1 137 TYR H 3.200 . 4.700 3.941 3.794 4.174 . 0 0 "[ . 1 . 2 . 3]" 2 1297 1 62 ARG H 1 116 MET ME 3.500 . 5.200 5.054 4.847 5.241 0.041 10 0 "[ . 1 . 2 . 3]" 2 1298 1 61 TYR HB3 1 62 ARG H 2.800 . 4.000 2.644 2.553 2.712 . 0 0 "[ . 1 . 2 . 3]" 2 1299 1 62 ARG H 1 62 ARG QG 2.800 . 4.000 2.551 2.054 3.666 . 0 0 "[ . 1 . 2 . 3]" 2 1300 1 134 GLN H 1 137 TYR H 3.500 . 5.200 4.665 4.538 4.760 . 0 0 "[ . 1 . 2 . 3]" 2 1301 1 137 TYR H 1 138 GLN H 2.300 . 3.200 2.501 2.329 2.682 . 0 0 "[ . 1 . 2 . 3]" 2 1302 1 62 ARG H 1 62 ARG HB3 2.200 . 6.000 2.473 2.042 3.134 . 0 0 "[ . 1 . 2 . 3]" 2 1303 1 135 ALA MB 1 137 TYR H 3.500 . 5.200 4.621 4.453 4.860 . 0 0 "[ . 1 . 2 . 3]" 2 1304 1 136 TYR QE 1 137 TYR H 2.900 . 6.000 5.810 5.517 6.002 0.002 17 0 "[ . 1 . 2 . 3]" 2 1305 1 137 TYR H 1 138 GLN QG 3.500 . 5.200 4.023 3.806 4.326 . 0 0 "[ . 1 . 2 . 3]" 2 1306 1 58 ASP HA 1 62 ARG H 3.400 . 5.100 4.208 4.056 4.366 . 0 0 "[ . 1 . 2 . 3]" 2 1307 1 62 ARG H 1 63 GLU QG 3.400 . 6.000 5.016 4.365 5.738 . 0 0 "[ . 1 . 2 . 3]" 2 1308 1 62 ARG H 1 65 MET HG3 3.600 . 5.200 4.203 4.103 4.319 . 0 0 "[ . 1 . 2 . 3]" 2 1309 1 103 THR H 1 107 GLU H 3.100 . 6.000 5.142 4.868 5.557 . 0 0 "[ . 1 . 2 . 3]" 2 1310 1 103 THR H 1 109 PHE QD 3.700 . 5.400 3.601 3.450 3.763 . 0 0 "[ . 1 . 2 . 3]" 2 1311 1 102 THR H 1 103 THR H 2.400 . 3.300 2.846 2.782 2.909 . 0 0 "[ . 1 . 2 . 3]" 2 1312 1 39 TYR H 1 40 MET ME 3.700 . 5.400 4.948 3.868 5.391 . 0 0 "[ . 1 . 2 . 3]" 2 1313 1 103 THR H 1 103 THR HA 2.500 . 3.200 2.511 2.416 2.751 . 0 0 "[ . 1 . 2 . 3]" 2 1314 1 103 THR H 1 104 THR H 2.400 . 3.300 2.545 2.495 2.599 . 0 0 "[ . 1 . 2 . 3]" 2 1315 1 37 GLY H 1 39 TYR H 3.500 . 5.200 3.035 2.736 3.662 . 0 0 "[ . 1 . 2 . 3]" 2 1316 1 39 TYR H 1 73 TYR HB3 3.500 . 5.400 5.425 5.314 5.480 0.080 26 0 "[ . 1 . 2 . 3]" 2 1317 1 39 TYR H 1 40 MET H 3.200 . 4.700 4.466 4.415 4.495 . 0 0 "[ . 1 . 2 . 3]" 2 1318 1 39 TYR H 1 75 ARG QG 3.900 . 5.800 4.550 4.156 5.836 0.036 26 0 "[ . 1 . 2 . 3]" 2 1319 1 39 TYR H 1 39 TYR QE 3.200 . 6.000 4.694 4.548 4.827 . 0 0 "[ . 1 . 2 . 3]" 2 1320 1 39 TYR H 1 39 TYR HB2 2.200 . 3.000 2.513 2.457 2.586 . 0 0 "[ . 1 . 2 . 3]" 2 1321 1 39 TYR H 1 93 ILE MG 3.900 . 5.800 5.230 5.066 5.474 . 0 0 "[ . 1 . 2 . 3]" 2 1322 1 64 ASN HA 1 64 ASN HD21 3.800 . 5.600 2.953 2.452 4.093 . 0 0 "[ . 1 . 2 . 3]" 2 1323 1 64 ASN HA 1 64 ASN HD22 3.600 . 5.300 3.729 3.486 4.348 . 0 0 "[ . 1 . 2 . 3]" 2 1324 1 63 GLU QB 1 64 ASN HD22 3.000 . 4.400 3.842 3.361 4.428 0.028 29 0 "[ . 1 . 2 . 3]" 2 1325 1 64 ASN H 1 64 ASN HD22 3.200 . 4.700 4.371 4.015 4.680 . 0 0 "[ . 1 . 2 . 3]" 2 1326 1 60 TYR HA 1 64 ASN HD22 3.300 . 4.900 4.546 4.141 4.881 . 0 0 "[ . 1 . 2 . 3]" 2 1327 1 60 TYR QD 1 64 ASN HD22 3.200 . 4.700 4.295 3.696 4.626 . 0 0 "[ . 1 . 2 . 3]" 2 1328 1 64 ASN HD21 1 68 TYR QD 3.300 . 6.000 5.444 4.997 5.875 . 0 0 "[ . 1 . 2 . 3]" 2 1329 1 60 TYR HA 1 64 ASN HD21 3.500 . 5.200 3.895 3.541 4.336 . 0 0 "[ . 1 . 2 . 3]" 2 1330 1 64 ASN HB2 1 64 ASN HD21 2.900 . 4.100 2.533 2.114 2.763 . 0 0 "[ . 1 . 2 . 3]" 2 1331 1 82 ASN HD22 1 84 ASN H 3.800 . 5.600 4.128 2.663 6.439 0.839 12 2 "[ . 1 + . 2 - . 3]" 2 1332 1 52 PHE HZ 1 119 ARG H 3.800 . 5.600 5.595 5.308 5.637 0.037 21 0 "[ . 1 . 2 . 3]" 2 1333 1 84 ASN H 1 84 ASN HB3 2.200 . 3.000 2.526 2.222 3.046 0.046 20 0 "[ . 1 . 2 . 3]" 2 1334 1 52 PHE QE 1 119 ARG H 3.700 . 5.400 4.022 3.617 4.405 . 0 0 "[ . 1 . 2 . 3]" 2 1335 1 84 ASN H 1 129 TYR QE 3.700 . 5.400 5.422 5.356 5.479 0.079 30 0 "[ . 1 . 2 . 3]" 2 1336 1 84 ASN H 1 84 ASN HA 2.400 . 3.300 2.834 2.789 2.893 . 0 0 "[ . 1 . 2 . 3]" 2 1337 1 95 ILE MD 1 119 ARG H 3.500 . 5.200 4.594 4.470 4.772 . 0 0 "[ . 1 . 2 . 3]" 2 1338 1 116 MET HA 1 119 ARG H 2.800 . 4.000 3.362 3.297 3.509 . 0 0 "[ . 1 . 2 . 3]" 2 1339 1 119 ARG H 1 119 ARG HB2 2.300 . 3.200 2.567 2.346 2.682 . 0 0 "[ . 1 . 2 . 3]" 2 1340 1 119 ARG H 1 119 ARG HG2 2.500 . 3.500 2.051 1.826 2.487 . 0 0 "[ . 1 . 2 . 3]" 2 1341 1 119 ARG H 1 120 VAL MG2 3.200 . 4.600 4.045 3.909 4.155 . 0 0 "[ . 1 . 2 . 3]" 2 1342 1 118 GLU QG 1 119 ARG H 3.400 . 5.000 4.322 4.237 4.368 . 0 0 "[ . 1 . 2 . 3]" 2 1343 1 50 ILE MD 1 119 ARG H 3.600 . 5.200 4.465 4.290 4.945 . 0 0 "[ . 1 . 2 . 3]" 2 1344 1 119 ARG H 1 121 VAL H 3.500 . 5.200 4.079 4.030 4.132 . 0 0 "[ . 1 . 2 . 3]" 2 1345 1 87 VAL HA 1 88 HIS H 3.200 . 4.700 3.521 3.478 3.561 . 0 0 "[ . 1 . 2 . 3]" 2 1346 1 117 MET H 1 119 ARG H 3.400 . 5.000 4.255 4.184 4.363 . 0 0 "[ . 1 . 2 . 3]" 2 1347 1 82 ASN HA 1 84 ASN H 2.900 . 4.200 3.871 3.229 4.211 0.011 25 0 "[ . 1 . 2 . 3]" 2 1348 1 87 VAL MG2 1 88 HIS H 2.600 . 6.000 2.028 1.612 2.372 . 0 0 "[ . 1 . 2 . 3]" 2 1349 1 88 HIS H 1 90 CYS H 3.300 . 4.900 3.849 3.680 4.029 . 0 0 "[ . 1 . 2 . 3]" 2 1350 1 88 HIS H 1 88 HIS HA 2.500 . 3.500 2.800 2.742 2.839 . 0 0 "[ . 1 . 2 . 3]" 2 1351 1 88 HIS H 1 88 HIS QB 2.200 . 3.000 2.097 2.048 2.259 . 0 0 "[ . 1 . 2 . 3]" 2 1352 1 87 VAL HB 1 88 HIS H 2.600 . 6.000 3.888 3.539 4.121 . 0 0 "[ . 1 . 2 . 3]" 2 1353 1 96 LYS H 1 97 GLN H 2.600 . 3.600 2.597 2.537 2.653 . 0 0 "[ . 1 . 2 . 3]" 2 1354 1 50 ILE MG 1 119 ARG H 3.700 . 5.500 4.591 4.417 4.881 . 0 0 "[ . 1 . 2 . 3]" 2 1355 1 88 HIS H 1 91 VAL H 3.800 . 5.600 4.799 4.748 4.866 . 0 0 "[ . 1 . 2 . 3]" 2 1356 1 97 GLN H 1 97 GLN HG2 2.700 . 3.800 3.782 3.231 3.846 0.046 26 0 "[ . 1 . 2 . 3]" 2 1357 1 93 ILE MG 1 97 GLN H 3.600 . 5.200 4.023 3.809 4.260 . 0 0 "[ . 1 . 2 . 3]" 2 1358 1 97 GLN H 1 97 GLN HB2 2.100 . 2.900 2.135 2.110 2.190 . 0 0 "[ . 1 . 2 . 3]" 2 1359 1 95 ILE MG 1 97 GLN H 3.200 . 4.700 4.451 4.313 4.556 . 0 0 "[ . 1 . 2 . 3]" 2 1360 1 110 THR H 1 112 THR H 3.800 . 5.600 4.745 4.461 4.917 . 0 0 "[ . 1 . 2 . 3]" 2 1361 1 111 LYS H 1 112 THR H 2.600 . 3.600 2.790 2.719 2.832 . 0 0 "[ . 1 . 2 . 3]" 2 1362 1 111 LYS QB 1 112 THR H 2.500 . 3.500 2.804 2.407 3.416 . 0 0 "[ . 1 . 2 . 3]" 2 1363 1 112 THR H 1 113 ASP H 2.400 . 3.300 2.554 2.511 2.573 . 0 0 "[ . 1 . 2 . 3]" 2 1364 1 112 THR H 1 113 ASP HB2 3.900 . 5.800 4.536 4.448 4.649 . 0 0 "[ . 1 . 2 . 3]" 2 1365 1 110 THR MG 1 112 THR H 2.800 . 6.000 4.129 3.585 4.553 . 0 0 "[ . 1 . 2 . 3]" 2 1366 1 111 LYS HG2 1 112 THR H 3.400 . 5.100 4.157 2.297 4.927 . 0 0 "[ . 1 . 2 . 3]" 2 1367 1 112 THR H 1 112 THR HB 2.200 . 3.000 2.674 2.580 2.722 . 0 0 "[ . 1 . 2 . 3]" 2 1368 1 63 GLU H 1 64 ASN HA 3.700 . 5.400 5.017 4.972 5.147 . 0 0 "[ . 1 . 2 . 3]" 2 1369 1 61 TYR H 1 63 GLU H 3.800 . 5.600 4.154 3.983 4.487 . 0 0 "[ . 1 . 2 . 3]" 2 1370 1 70 ASN H 1 70 ASN HD22 3.800 . 5.600 3.572 2.775 4.114 . 0 0 "[ . 1 . 2 . 3]" 2 1371 1 70 ASN H 1 71 GLN H 2.300 . 3.100 2.080 1.939 2.418 . 0 0 "[ . 1 . 2 . 3]" 2 1372 1 70 ASN H 1 71 GLN HA 3.200 . 6.000 4.608 4.546 4.786 . 0 0 "[ . 1 . 2 . 3]" 2 1373 1 62 ARG QG 1 63 GLU H 3.100 . 6.000 4.340 4.103 4.597 . 0 0 "[ . 1 . 2 . 3]" 2 1374 1 63 GLU H 1 64 ASN HD21 3.400 . 5.000 3.860 3.536 4.568 . 0 0 "[ . 1 . 2 . 3]" 2 1375 1 63 GLU H 1 64 ASN H 2.500 . 3.500 2.367 2.274 2.555 . 0 0 "[ . 1 . 2 . 3]" 2 1376 1 63 GLU H 1 63 GLU QG 2.600 . 3.500 2.914 2.407 3.373 . 0 0 "[ . 1 . 2 . 3]" 2 1377 1 69 PRO HB2 1 70 ASN H 2.900 . 4.200 3.552 3.303 3.955 . 0 0 "[ . 1 . 2 . 3]" 2 1378 1 70 ASN H 1 71 GLN HG3 3.500 . 5.200 3.092 2.905 3.281 . 0 0 "[ . 1 . 2 . 3]" 2 1379 1 63 GLU H 1 63 GLU QB 2.200 . 3.000 2.247 2.113 2.489 . 0 0 "[ . 1 . 2 . 3]" 2 1380 1 70 ASN H 1 70 ASN HB3 3.200 . 4.700 3.438 3.348 3.491 . 0 0 "[ . 1 . 2 . 3]" 2 1381 1 69 PRO HG2 1 70 ASN H 3.400 . 6.000 5.456 5.301 5.676 . 0 0 "[ . 1 . 2 . 3]" 2 1382 1 70 ASN H 1 94 THR MG 3.600 . 6.000 5.762 5.520 6.000 0.000 29 0 "[ . 1 . 2 . 3]" 2 1383 1 45 MET HB2 1 46 SER H 2.200 . 3.000 2.459 2.020 2.652 . 0 0 "[ . 1 . 2 . 3]" 2 1384 1 68 TYR QB 1 70 ASN H 3.700 . 6.000 5.599 5.374 5.721 . 0 0 "[ . 1 . 2 . 3]" 2 1385 1 70 ASN H 1 124 MET ME 3.400 . 5.000 4.052 3.756 4.369 . 0 0 "[ . 1 . 2 . 3]" 2 1386 1 70 ASN H 1 71 GLN HB3 3.400 . 5.000 4.365 4.075 4.548 . 0 0 "[ . 1 . 2 . 3]" 2 1387 1 70 ASN H 1 98 HIS HE1 3.700 . 5.400 4.377 3.863 5.043 . 0 0 "[ . 1 . 2 . 3]" 2 1388 1 46 SER H 1 46 SER HB2 2.200 . 6.000 4.004 3.600 4.082 . 0 0 "[ . 1 . 2 . 3]" 2 1389 1 46 SER H 1 127 THR MG 3.400 . 6.000 5.282 4.914 5.588 . 0 0 "[ . 1 . 2 . 3]" 2 1390 1 92 ASN H 1 95 ILE MD 3.500 . 5.100 4.652 4.386 4.921 . 0 0 "[ . 1 . 2 . 3]" 2 1391 1 91 VAL HA 1 92 ASN H 3.200 . 4.700 3.558 3.530 3.581 . 0 0 "[ . 1 . 2 . 3]" 2 1392 1 91 VAL H 1 92 ASN H 2.700 . 3.800 2.755 2.653 2.843 . 0 0 "[ . 1 . 2 . 3]" 2 1393 1 91 VAL HB 1 92 ASN H 2.500 . 3.500 2.457 2.284 2.623 . 0 0 "[ . 1 . 2 . 3]" 2 1394 1 91 VAL QG 1 92 ASN H 2.900 . 4.100 3.129 3.008 3.246 . 0 0 "[ . 1 . 2 . 3]" 2 1395 1 92 ASN H 1 93 ILE H 2.900 . 4.100 2.867 2.792 2.921 . 0 0 "[ . 1 . 2 . 3]" 2 1396 1 104 THR H 1 109 PHE QD 3.800 . 6.000 5.810 5.506 6.024 0.024 19 0 "[ . 1 . 2 . 3]" 2 1397 1 92 ASN H 1 92 ASN HB2 2.300 . 6.000 3.333 2.959 3.602 . 0 0 "[ . 1 . 2 . 3]" 2 1398 1 92 ASN H 1 92 ASN HA 2.400 . 3.300 2.784 2.775 2.794 . 0 0 "[ . 1 . 2 . 3]" 2 1399 1 92 ASN H 1 93 ILE HB 3.700 . 5.400 4.880 4.821 4.957 . 0 0 "[ . 1 . 2 . 3]" 2 1400 1 92 ASN H 1 92 ASN HD21 3.900 . 5.800 3.853 3.560 4.122 . 0 0 "[ . 1 . 2 . 3]" 2 1401 1 109 PHE H 1 110 THR H 3.600 . 5.200 4.256 3.903 4.349 . 0 0 "[ . 1 . 2 . 3]" 2 1402 1 90 CYS H 1 92 ASN H 3.500 . 5.200 4.303 3.953 4.595 . 0 0 "[ . 1 . 2 . 3]" 2 1403 1 110 THR H 1 113 ASP HB2 2.900 . 6.000 1.833 1.708 1.997 . 0 0 "[ . 1 . 2 . 3]" 2 1404 1 109 PHE QD 1 110 THR H 2.900 . 4.200 4.005 3.879 4.208 0.008 30 0 "[ . 1 . 2 . 3]" 2 1405 1 110 THR H 1 110 THR MG 2.400 . 6.000 3.445 2.801 3.735 . 0 0 "[ . 1 . 2 . 3]" 2 1406 1 92 ASN H 1 121 VAL MG1 3.800 . 5.600 4.715 4.627 4.799 . 0 0 "[ . 1 . 2 . 3]" 2 1407 1 110 THR H 1 114 VAL MG1 3.600 . 5.200 4.347 4.195 4.502 . 0 0 "[ . 1 . 2 . 3]" 2 1408 1 104 THR H 1 105 LYS HB2 3.500 . 5.200 4.079 3.661 4.426 . 0 0 "[ . 1 . 2 . 3]" 2 1409 1 104 THR H 1 105 LYS H 2.400 . 3.300 2.190 1.963 2.366 . 0 0 "[ . 1 . 2 . 3]" 2 1410 1 104 THR H 1 105 LYS QG 3.300 . 4.800 4.171 3.790 4.806 0.006 15 0 "[ . 1 . 2 . 3]" 2 1411 1 102 THR MG 1 104 THR H 3.000 . 6.000 4.959 4.746 5.160 . 0 0 "[ . 1 . 2 . 3]" 2 1412 1 130 GLU HB3 1 133 SER H 3.300 . 4.900 4.696 4.535 5.087 0.187 12 0 "[ . 1 . 2 . 3]" 2 1413 1 131 ARG H 1 133 SER H 3.800 . 5.600 3.699 3.552 3.872 . 0 0 "[ . 1 . 2 . 3]" 2 1414 1 133 SER H 1 133 SER HB3 2.900 . 4.100 2.227 2.095 2.365 . 0 0 "[ . 1 . 2 . 3]" 2 1415 1 50 ILE H 1 123 GLN HE22 3.900 . 5.800 5.707 5.442 5.808 0.008 16 0 "[ . 1 . 2 . 3]" 2 1416 1 50 ILE H 1 123 GLN HE21 3.600 . 5.300 5.113 4.930 5.304 0.004 18 0 "[ . 1 . 2 . 3]" 2 1417 1 123 GLN HA 1 123 GLN HE22 3.900 . 5.800 5.441 5.346 5.550 . 0 0 "[ . 1 . 2 . 3]" 2 1418 1 123 GLN HB2 1 123 GLN HE21 3.600 . 5.200 3.354 3.185 3.631 . 0 0 "[ . 1 . 2 . 3]" 2 1419 1 65 MET HB2 1 66 HIS H 3.200 . 4.600 2.672 2.514 2.929 . 0 0 "[ . 1 . 2 . 3]" 2 1420 1 66 HIS H 1 66 HIS HB2 2.500 . 3.500 2.401 2.229 2.768 . 0 0 "[ . 1 . 2 . 3]" 2 1421 1 65 MET HB3 1 66 HIS H 3.500 . 5.100 3.788 3.645 4.004 . 0 0 "[ . 1 . 2 . 3]" 2 1422 1 66 HIS H 1 66 HIS HB3 2.600 . 6.000 3.567 3.523 3.592 . 0 0 "[ . 1 . 2 . 3]" 2 1423 1 65 MET HG3 1 66 HIS H 2.900 . 4.100 4.136 4.123 4.152 0.052 24 0 "[ . 1 . 2 . 3]" 2 1424 1 66 HIS H 1 66 HIS HD2 3.000 . 4.300 2.531 2.134 3.262 . 0 0 "[ . 1 . 2 . 3]" 2 1425 1 64 ASN HA 1 66 HIS H 3.400 . 5.000 3.665 3.495 3.863 . 0 0 "[ . 1 . 2 . 3]" 2 1426 1 48 PRO HA 1 123 GLN HE21 3.700 . 5.400 3.893 3.620 4.351 . 0 0 "[ . 1 . 2 . 3]" 2 1427 1 123 GLN HB2 1 123 GLN HE22 3.800 . 5.600 4.575 4.479 4.736 . 0 0 "[ . 1 . 2 . 3]" 2 1428 1 123 GLN HA 1 123 GLN HE21 3.600 . 5.200 5.076 4.944 5.179 . 0 0 "[ . 1 . 2 . 3]" 2 1429 1 59 ARG QD 1 59 ARG HE 2.500 . 3.500 2.400 2.198 2.492 . 0 0 "[ . 1 . 2 . 3]" 2 1430 1 59 ARG HE 1 59 ARG HG2 3.100 . 4.500 2.976 2.098 3.962 . 0 0 "[ . 1 . 2 . 3]" 2 1431 1 59 ARG HE 1 59 ARG HG3 3.200 . 4.600 2.804 2.087 3.721 . 0 0 "[ . 1 . 2 . 3]" 2 1432 1 59 ARG QB 1 59 ARG HE 3.100 . 4.500 3.561 2.120 4.230 . 0 0 "[ . 1 . 2 . 3]" 2 1433 1 100 VAL MG2 1 101 THR H 2.500 . 6.000 3.778 3.635 3.860 . 0 0 "[ . 1 . 2 . 3]" 2 1434 1 101 THR H 1 101 THR MG 2.400 . 3.300 1.956 1.708 2.128 . 0 0 "[ . 1 . 2 . 3]" 2 1435 1 100 VAL HB 1 101 THR H 2.300 . 3.200 2.345 2.293 2.388 . 0 0 "[ . 1 . 2 . 3]" 2 1436 1 121 VAL H 1 123 GLN H 3.600 . 5.300 4.212 4.154 4.291 . 0 0 "[ . 1 . 2 . 3]" 2 1437 1 42 GLY H 1 72 VAL MG2 3.500 . 5.100 3.427 3.236 3.574 . 0 0 "[ . 1 . 2 . 3]" 2 1438 1 42 GLY H 1 74 TYR QD 3.400 . 5.000 3.281 2.892 3.734 . 0 0 "[ . 1 . 2 . 3]" 2 1439 1 123 GLN H 1 123 GLN QG 2.500 . 3.500 1.939 1.792 2.106 . 0 0 "[ . 1 . 2 . 3]" 2 1440 1 47 ARG HE 1 65 MET HB3 3.000 . 4.400 3.206 1.830 4.352 . 0 0 "[ . 1 . 2 . 3]" 2 1441 1 41 LEU HG 1 42 GLY H 3.500 . 5.200 3.562 3.193 3.900 . 0 0 "[ . 1 . 2 . 3]" 2 1442 1 122 GLU H 1 123 GLN H 2.800 . 4.000 2.734 2.660 2.783 . 0 0 "[ . 1 . 2 . 3]" 2 1443 1 42 GLY H 1 74 TYR QE 3.100 . 4.500 3.295 2.760 3.749 . 0 0 "[ . 1 . 2 . 3]" 2 1444 1 41 LEU MD1 1 42 GLY H 3.600 . 5.200 4.609 4.377 4.809 . 0 0 "[ . 1 . 2 . 3]" 2 1445 1 41 LEU HB3 1 42 GLY H 3.500 . 5.200 3.928 3.737 4.069 . 0 0 "[ . 1 . 2 . 3]" 2 1446 1 42 GLY H 1 71 GLN HB3 3.800 . 5.600 4.063 3.770 4.344 . 0 0 "[ . 1 . 2 . 3]" 2 1447 1 123 GLN H 1 124 MET HG3 3.200 . 4.700 4.662 4.398 4.737 0.037 16 0 "[ . 1 . 2 . 3]" 2 1448 1 50 ILE MD 1 123 GLN H 3.400 . 5.100 3.849 3.742 4.092 . 0 0 "[ . 1 . 2 . 3]" 2 1449 1 123 GLN H 1 126 ILE MD 3.100 . 4.500 4.001 3.784 4.333 . 0 0 "[ . 1 . 2 . 3]" 2 1450 1 64 ASN H 1 65 MET HB3 3.300 . 6.000 5.790 5.739 5.971 . 0 0 "[ . 1 . 2 . 3]" 2 1451 1 64 ASN H 1 64 ASN HD21 2.900 . 4.100 2.730 2.315 3.491 . 0 0 "[ . 1 . 2 . 3]" 2 1452 1 64 ASN H 1 65 MET HG3 3.300 . 4.900 3.401 3.315 3.569 . 0 0 "[ . 1 . 2 . 3]" 2 1453 1 63 GLU QB 1 64 ASN H 2.600 . 3.700 3.172 3.054 3.513 . 0 0 "[ . 1 . 2 . 3]" 2 1454 1 139 ARG HE 1 139 ARG QG 3.000 . 4.400 2.427 2.069 2.960 . 0 0 "[ . 1 . 2 . 3]" 2 1455 1 64 ASN H 1 65 MET HA 3.200 . 6.000 4.584 4.460 4.754 . 0 0 "[ . 1 . 2 . 3]" 2 1456 1 139 ARG QB 1 139 ARG HE 3.200 . 4.700 3.414 1.903 4.137 . 0 0 "[ . 1 . 2 . 3]" 2 1457 1 64 ASN H 1 64 ASN HB2 2.400 . 3.300 2.316 2.240 2.377 . 0 0 "[ . 1 . 2 . 3]" 2 1458 1 139 ARG QD 1 139 ARG HE 2.600 . 3.700 2.389 2.218 2.492 . 0 0 "[ . 1 . 2 . 3]" 2 1459 1 64 ASN H 1 65 MET HB2 3.100 . 6.000 4.881 4.791 5.127 . 0 0 "[ . 1 . 2 . 3]" 2 1460 1 100 VAL HA 1 102 THR H 3.300 . 6.000 5.400 5.342 5.468 . 0 0 "[ . 1 . 2 . 3]" 2 1461 1 102 THR H 1 104 THR H 2.900 . 4.200 4.102 4.016 4.217 0.017 11 0 "[ . 1 . 2 . 3]" 2 1462 1 100 VAL HB 1 102 THR H 3.600 . 5.300 4.920 4.855 4.975 . 0 0 "[ . 1 . 2 . 3]" 2 1463 1 102 THR H 1 102 THR HA 2.100 . 2.800 2.493 2.454 2.522 . 0 0 "[ . 1 . 2 . 3]" 2 1464 1 101 THR H 1 102 THR H 2.300 . 3.200 2.620 2.574 2.696 . 0 0 "[ . 1 . 2 . 3]" 2 1465 1 139 ARG HE 1 139 ARG HG2 3.100 . 4.500 2.964 2.096 3.729 . 0 0 "[ . 1 . 2 . 3]" 2 1466 1 102 THR H 1 102 THR MG 2.300 . 6.000 3.717 3.675 3.750 . 0 0 "[ . 1 . 2 . 3]" 2 1467 1 101 THR MG 1 102 THR H 2.600 . 6.000 1.554 1.473 1.872 . 0 0 "[ . 1 . 2 . 3]" 2 1468 1 101 THR HB 1 102 THR H 2.400 . 6.000 3.893 3.871 3.920 . 0 0 "[ . 1 . 2 . 3]" 2 1469 1 102 THR H 1 105 LYS H 3.600 . 5.200 4.748 4.626 5.104 . 0 0 "[ . 1 . 2 . 3]" 2 1470 1 102 THR H 1 109 PHE QD 3.700 . 5.400 5.401 5.295 5.433 0.033 26 0 "[ . 1 . 2 . 3]" 2 1471 1 50 ILE H 1 62 ARG HE 3.000 . 6.000 5.363 4.356 6.027 0.027 30 0 "[ . 1 . 2 . 3]" 2 1472 1 67 ARG HB2 1 67 ARG HE 2.800 . 4.000 2.969 2.169 3.634 . 0 0 "[ . 1 . 2 . 3]" 2 1473 1 67 ARG HE 1 67 ARG HG2 3.300 . 4.900 2.773 2.146 3.594 . 0 0 "[ . 1 . 2 . 3]" 2 1474 1 62 ARG HD2 1 62 ARG HE 2.700 . 3.800 2.829 2.267 2.950 . 0 0 "[ . 1 . 2 . 3]" 2 1475 1 62 ARG HE 1 62 ARG QG 3.300 . 4.800 2.728 2.238 3.355 . 0 0 "[ . 1 . 2 . 3]" 2 1476 1 131 ARG HE 1 131 ARG HG2 2.900 . 4.100 3.225 2.699 3.885 . 0 0 "[ . 1 . 2 . 3]" 2 1477 1 99 THR H 1 100 VAL HB 3.600 . 5.200 4.959 4.824 5.139 . 0 0 "[ . 1 . 2 . 3]" 2 1478 1 131 ARG HD3 1 131 ARG HE 3.000 . 4.300 2.822 2.265 2.950 . 0 0 "[ . 1 . 2 . 3]" 2 1479 1 98 HIS HB3 1 99 THR H 3.000 . 4.300 3.558 3.334 3.899 . 0 0 "[ . 1 . 2 . 3]" 2 1480 1 99 THR H 1 100 VAL MG1 3.400 . 6.000 5.956 5.842 6.027 0.027 23 0 "[ . 1 . 2 . 3]" 2 1481 1 99 THR H 1 99 THR MG 2.700 . 3.800 2.439 2.269 2.669 . 0 0 "[ . 1 . 2 . 3]" 2 1482 1 94 THR MG 1 99 THR H 3.900 . 5.800 5.786 5.732 5.837 0.037 30 0 "[ . 1 . 2 . 3]" 2 1483 1 98 HIS HB2 1 99 THR H 2.900 . 4.100 2.820 2.685 3.077 . 0 0 "[ . 1 . 2 . 3]" 2 1484 1 95 ILE MG 1 99 THR H 3.600 . 5.200 3.823 3.655 4.130 . 0 0 "[ . 1 . 2 . 3]" 2 1485 1 71 GLN H 1 71 GLN HG3 2.900 . 4.100 2.691 2.464 2.840 . 0 0 "[ . 1 . 2 . 3]" 2 1486 1 69 PRO HA 1 71 GLN H 2.500 . 6.000 3.641 3.446 3.733 . 0 0 "[ . 1 . 2 . 3]" 2 1487 1 71 GLN H 1 94 THR MG 3.200 . 6.000 4.400 4.276 4.572 . 0 0 "[ . 1 . 2 . 3]" 2 1488 1 71 GLN H 1 71 GLN HA 2.500 . 3.500 2.947 2.946 2.949 . 0 0 "[ . 1 . 2 . 3]" 2 1489 1 41 LEU MD2 1 71 GLN H 3.700 . 5.400 4.848 4.632 5.118 . 0 0 "[ . 1 . 2 . 3]" 2 1490 1 71 GLN H 1 72 VAL MG1 3.300 . 4.900 4.202 4.042 4.380 . 0 0 "[ . 1 . 2 . 3]" 2 1491 1 98 HIS HA 1 99 THR H 3.000 . 4.300 3.531 3.469 3.558 . 0 0 "[ . 1 . 2 . 3]" 2 1492 1 43 SER H 1 71 GLN HB3 3.600 . 5.200 5.031 4.812 5.232 0.032 8 0 "[ . 1 . 2 . 3]" 2 1493 1 43 SER H 1 43 SER HB3 2.200 . 3.000 2.578 2.460 2.710 . 0 0 "[ . 1 . 2 . 3]" 2 1494 1 43 SER H 1 74 TYR QE 2.900 . 6.000 5.046 4.512 5.488 . 0 0 "[ . 1 . 2 . 3]" 2 1495 1 43 SER H 1 72 VAL MG2 3.800 . 6.000 5.880 5.634 5.975 . 0 0 "[ . 1 . 2 . 3]" 2 1496 1 50 ILE MG 1 119 ARG HE 3.400 . 5.100 4.136 2.592 5.062 . 0 0 "[ . 1 . 2 . 3]" 2 1497 1 119 ARG HE 1 119 ARG HG2 3.000 . 4.300 3.039 2.339 3.910 . 0 0 "[ . 1 . 2 . 3]" 2 1498 1 119 ARG HD3 1 119 ARG HE 2.700 . 3.800 2.775 2.285 2.949 . 0 0 "[ . 1 . 2 . 3]" 2 1499 1 50 ILE MD 1 119 ARG HE 3.800 . 6.000 5.642 2.845 6.036 0.036 29 0 "[ . 1 . 2 . 3]" 2 1500 1 119 ARG HA 1 119 ARG HE 3.400 . 5.100 4.809 3.088 5.111 0.011 18 0 "[ . 1 . 2 . 3]" 2 1501 1 82 ASN HA 1 82 ASN HD22 3.500 . 5.100 3.997 3.325 4.534 . 0 0 "[ . 1 . 2 . 3]" 2 1502 1 82 ASN HB2 1 82 ASN HD22 2.800 . 4.000 3.808 3.458 4.090 0.090 30 0 "[ . 1 . 2 . 3]" 2 1503 1 103 THR MG 1 108 ASN HD21 3.900 . 5.800 4.121 2.637 5.582 . 0 0 "[ . 1 . 2 . 3]" 2 1504 1 82 ASN HD22 1 85 ASN QD 3.600 . 5.200 4.378 1.807 5.909 0.709 15 2 "[ . 1 + - . 3]" 2 1505 1 82 ASN HB2 1 82 ASN HD21 2.800 . 4.000 2.954 2.178 3.547 . 0 0 "[ . 1 . 2 . 3]" 2 1506 1 45 MET HG2 1 128 GLN HE21 2.700 . 6.000 5.180 3.706 6.424 0.424 16 0 "[ . 1 . 2 . 3]" 2 1507 1 108 ASN HD21 1 110 THR MG 3.400 . 5.000 3.859 2.338 4.995 . 0 0 "[ . 1 . 2 . 3]" 2 1508 1 45 MET ME 1 128 GLN HE22 3.000 . 4.400 2.478 1.849 3.530 . 0 0 "[ . 1 . 2 . 3]" 2 1509 1 108 ASN QB 1 108 ASN HD21 2.900 . 4.100 2.362 2.094 2.693 . 0 0 "[ . 1 . 2 . 3]" 2 1510 1 124 MET HB3 1 128 GLN HE21 3.400 . 5.000 4.556 3.426 5.622 0.622 14 1 "[ . 1 +. 2 . 3]" 2 1511 1 45 MET HG2 1 128 GLN HE22 2.400 . 6.000 4.658 3.349 6.892 0.892 16 2 "[ . - 1 .+ 2 . 3]" 2 1512 1 108 ASN HA 1 108 ASN HD21 3.500 . 5.200 3.040 2.018 4.418 . 0 0 "[ . 1 . 2 . 3]" 2 1513 1 82 ASN HA 1 82 ASN HD21 3.300 . 4.900 3.363 1.885 4.391 0.015 10 0 "[ . 1 . 2 . 3]" 2 1514 1 108 ASN HA 1 108 ASN HD22 3.600 . 5.200 3.857 3.348 4.686 . 0 0 "[ . 1 . 2 . 3]" 2 1515 1 42 GLY HA3 1 72 VAL H 3.400 . 5.100 3.781 3.675 3.916 . 0 0 "[ . 1 . 2 . 3]" 2 1516 1 72 VAL H 1 72 VAL HB 3.200 . 4.700 3.825 3.770 3.860 . 0 0 "[ . 1 . 2 . 3]" 2 1517 1 84 ASN HB2 1 84 ASN HD22 3.000 . 4.300 3.583 3.431 4.089 . 0 0 "[ . 1 . 2 . 3]" 2 1518 1 135 ALA HA 1 138 GLN HE22 3.600 . 5.200 3.982 3.070 4.799 . 0 0 "[ . 1 . 2 . 3]" 2 1519 1 71 GLN HB2 1 72 VAL H 2.900 . 4.200 3.857 3.701 3.990 . 0 0 "[ . 1 . 2 . 3]" 2 1520 1 71 GLN HB3 1 72 VAL H 2.800 . 4.000 2.879 2.809 2.957 . 0 0 "[ . 1 . 2 . 3]" 2 1521 1 72 VAL H 1 94 THR MG 3.600 . 5.200 4.279 4.117 4.450 . 0 0 "[ . 1 . 2 . 3]" 2 1522 1 84 ASN HD21 1 85 ASN H 3.600 . 5.300 3.766 1.900 4.848 . 0 0 "[ . 1 . 2 . 3]" 2 1523 1 84 ASN H 1 84 ASN HD21 3.500 . 5.200 4.142 2.148 4.911 . 0 0 "[ . 1 . 2 . 3]" 2 1524 1 84 ASN HB3 1 84 ASN HD21 2.600 . 6.000 3.100 2.115 3.515 . 0 0 "[ . 1 . 2 . 3]" 2 1525 1 71 GLN HE22 1 71 GLN HG3 3.000 . 4.300 4.081 3.798 4.100 . 0 0 "[ . 1 . 2 . 3]" 2 1526 1 71 GLN HB3 1 71 GLN HE22 2.900 . 4.100 3.226 3.180 3.297 . 0 0 "[ . 1 . 2 . 3]" 2 1527 1 71 GLN HB2 1 71 GLN HE22 3.200 . 4.700 4.124 3.709 4.308 . 0 0 "[ . 1 . 2 . 3]" 2 1528 1 71 GLN HB2 1 71 GLN HE21 3.300 . 4.800 3.431 2.069 3.668 . 0 0 "[ . 1 . 2 . 3]" 2 1529 1 41 LEU HG 1 71 GLN HE21 3.100 . 6.000 4.854 4.321 5.568 . 0 0 "[ . 1 . 2 . 3]" 2 1530 1 71 GLN HB3 1 71 GLN HE21 2.900 . 4.200 2.141 2.035 2.246 . 0 0 "[ . 1 . 2 . 3]" 2 1531 1 41 LEU HG 1 71 GLN HE22 2.900 . 6.000 5.445 5.188 5.913 . 0 0 "[ . 1 . 2 . 3]" 2 1532 1 41 LEU MD1 1 71 GLN HE22 2.800 . 4.000 3.326 3.045 3.713 . 0 0 "[ . 1 . 2 . 3]" 2 1533 1 43 SER HA 1 71 GLN HE21 3.000 . 6.000 1.887 1.547 3.676 . 0 0 "[ . 1 . 2 . 3]" 2 1534 1 71 GLN HE21 1 71 GLN HG3 3.100 . 4.500 3.516 2.953 3.554 . 0 0 "[ . 1 . 2 . 3]" 2 1535 1 92 ASN HD21 1 93 ILE MD 3.800 . 5.600 3.238 2.485 3.929 . 0 0 "[ . 1 . 2 . 3]" 2 1536 1 77 MET QG 1 85 ASN QD 3.600 . 6.000 5.429 4.926 5.593 . 0 0 "[ . 1 . 2 . 3]" 2 1537 1 85 ASN HB3 1 85 ASN QD 3.000 . 4.100 3.079 2.451 3.306 . 0 0 "[ . 1 . 2 . 3]" 2 1538 1 85 ASN HB2 1 85 ASN QD 3.100 . 4.000 2.176 2.088 2.524 . 0 0 "[ . 1 . 2 . 3]" 2 1539 1 85 ASN HA 1 85 ASN QD 3.200 . 6.000 4.024 3.801 4.159 . 0 0 "[ . 1 . 2 . 3]" 2 1540 1 89 ASP HA 1 92 ASN HD22 3.100 . 4.500 3.655 2.583 4.519 0.019 4 0 "[ . 1 . 2 . 3]" 2 1541 1 82 ASN HA 1 85 ASN QD 3.500 . 6.000 3.846 1.915 4.880 . 0 0 "[ . 1 . 2 . 3]" 2 1542 1 89 ASP HA 1 92 ASN HD21 3.400 . 5.000 3.581 2.545 4.631 . 0 0 "[ . 1 . 2 . 3]" 2 1543 1 90 CYS HA 1 92 ASN HD21 3.700 . 6.000 5.418 4.851 6.001 0.001 9 0 "[ . 1 . 2 . 3]" 2 1544 1 92 ASN HB2 1 92 ASN HD21 3.100 2.100 4.300 2.846 2.259 3.455 . 0 0 "[ . 1 . 2 . 3]" 2 1545 1 92 ASN HD22 1 93 ILE MD 3.500 . 5.200 3.114 2.203 3.943 . 0 0 "[ . 1 . 2 . 3]" 2 1546 1 92 ASN HD22 1 93 ILE HG12 3.800 . 5.600 2.293 1.990 2.842 0.010 9 0 "[ . 1 . 2 . 3]" 2 1547 1 92 ASN HA 1 92 ASN HD21 3.600 . 5.200 4.202 3.873 4.515 . 0 0 "[ . 1 . 2 . 3]" 2 1548 1 92 ASN HB2 1 92 ASN HD22 2.700 . 3.800 3.757 3.490 4.046 0.246 24 0 "[ . 1 . 2 . 3]" 2 1549 1 92 ASN HD21 1 93 ILE HG12 3.600 . 5.200 2.360 2.039 2.744 . 0 0 "[ . 1 . 2 . 3]" 2 1550 1 92 ASN HA 1 92 ASN HD22 3.500 . 5.200 5.039 4.905 5.117 . 0 0 "[ . 1 . 2 . 3]" 2 1551 1 134 GLN HE21 1 134 GLN QG 2.600 . 3.700 2.502 2.104 2.674 . 0 0 "[ . 1 . 2 . 3]" 2 1552 1 134 GLN HE21 1 135 ALA MB 3.900 . 5.800 5.260 2.610 5.798 . 0 0 "[ . 1 . 2 . 3]" 2 1553 1 134 GLN QB 1 134 GLN HE22 3.700 . 5.400 3.455 3.130 4.135 . 0 0 "[ . 1 . 2 . 3]" 2 1554 1 134 GLN QB 1 134 GLN HE21 3.100 . 4.500 2.410 1.903 3.911 . 0 0 "[ . 1 . 2 . 3]" 2 1555 1 134 GLN HE21 1 135 ALA HA 3.700 . 6.000 5.401 4.127 5.989 . 0 0 "[ . 1 . 2 . 3]" 2 1556 1 53 GLY HA2 1 54 SER H 2.600 . 6.000 3.553 3.526 3.576 . 0 0 "[ . 1 . 2 . 3]" 2 1557 1 92 ASN HD22 1 93 ILE MG 3.700 . 5.400 4.832 4.641 5.204 . 0 0 "[ . 1 . 2 . 3]" 2 1558 1 54 SER H 1 57 GLU HB3 2.800 . 6.000 4.298 4.144 4.442 . 0 0 "[ . 1 . 2 . 3]" 2 1559 1 54 SER H 1 55 ASP HA 3.400 . 6.000 5.153 5.040 5.253 . 0 0 "[ . 1 . 2 . 3]" 2 1560 1 52 PHE HB2 1 54 SER H 2.700 . 6.000 3.953 3.575 4.311 . 0 0 "[ . 1 . 2 . 3]" 2 1561 1 52 PHE HB3 1 54 SER H 2.700 . 6.000 5.279 4.787 5.654 . 0 0 "[ . 1 . 2 . 3]" 2 1562 1 54 SER H 1 58 ASP H 3.100 . 4.500 3.804 3.691 3.974 . 0 0 "[ . 1 . 2 . 3]" 2 1563 1 54 SER H 1 57 GLU HB2 3.100 . 4.500 2.595 2.451 2.714 . 0 0 "[ . 1 . 2 . 3]" 2 1564 1 54 SER H 1 54 SER HA 2.400 . 3.300 2.901 2.843 2.934 . 0 0 "[ . 1 . 2 . 3]" 2 1565 1 53 GLY HA3 1 54 SER H 2.500 . 3.500 2.487 2.351 2.673 . 0 0 "[ . 1 . 2 . 3]" 2 1566 1 52 PHE H 1 54 SER H 3.000 . 6.000 5.125 4.198 6.023 0.023 16 0 "[ . 1 . 2 . 3]" 2 1567 1 54 SER H 1 57 GLU HA 3.600 . 5.200 5.187 5.065 5.234 0.034 3 0 "[ . 1 . 2 . 3]" 2 1568 1 54 SER H 1 56 TYR H 3.500 . 5.200 3.946 3.795 4.139 . 0 0 "[ . 1 . 2 . 3]" 2 1569 1 74 TYR H 1 74 TYR QE 3.700 . 5.400 3.897 3.805 4.191 . 0 0 "[ . 1 . 2 . 3]" 2 1570 1 40 MET QG 1 74 TYR H 3.800 . 5.600 5.138 4.973 5.210 . 0 0 "[ . 1 . 2 . 3]" 2 1571 1 40 MET HB3 1 74 TYR H 3.700 . 5.400 4.188 3.861 4.806 . 0 0 "[ . 1 . 2 . 3]" 2 1572 1 41 LEU H 1 74 TYR H 3.600 . 5.200 4.841 4.727 4.988 . 0 0 "[ . 1 . 2 . 3]" 2 1573 1 40 MET HB2 1 74 TYR H 3.400 . 5.000 3.515 3.394 3.671 . 0 0 "[ . 1 . 2 . 3]" 2 1574 1 39 TYR HB3 1 74 TYR H 3.100 . 4.500 3.682 2.818 3.904 . 0 0 "[ . 1 . 2 . 3]" 2 1575 1 39 TYR QD 1 74 TYR H 3.100 . 4.500 4.287 3.517 4.517 0.017 19 0 "[ . 1 . 2 . 3]" 2 1576 1 41 LEU HA 1 74 TYR H 2.900 . 4.100 3.631 3.472 3.929 . 0 0 "[ . 1 . 2 . 3]" 2 1577 1 73 TYR QB 1 74 TYR H 2.800 . 4.000 3.191 2.673 3.359 . 0 0 "[ . 1 . 2 . 3]" 2 1578 1 74 TYR H 1 93 ILE MG 3.900 . 5.800 5.203 4.756 5.425 . 0 0 "[ . 1 . 2 . 3]" 2 1579 1 83 GLN QE 1 126 ILE HG13 3.700 . 5.400 4.640 3.327 6.318 0.918 30 1 "[ . 1 . 2 . +]" 2 1580 1 83 GLN QE 1 129 TYR QE 3.600 . 5.200 4.240 3.026 5.176 . 0 0 "[ . 1 . 2 . 3]" 2 1581 1 83 GLN QE 1 129 TYR QD 3.800 . 5.600 4.141 2.357 5.324 . 0 0 "[ . 1 . 2 . 3]" 2 1582 1 83 GLN QE 1 87 VAL MG1 3.200 . 4.700 3.706 2.342 4.681 . 0 0 "[ . 1 . 2 . 3]" 2 1583 1 83 GLN QE 1 126 ILE HG12 2.700 . 3.800 2.747 1.891 3.590 . 0 0 "[ . 1 . 2 . 3]" 2 1584 1 97 GLN HE21 1 98 HIS H 3.900 . 6.000 5.635 5.315 5.956 . 0 0 "[ . 1 . 2 . 3]" 2 1585 1 37 GLY H 1 40 MET ME 3.900 . 5.800 5.838 5.816 5.905 0.105 27 0 "[ . 1 . 2 . 3]" 2 1586 1 96 LYS HG2 1 97 GLN HE21 3.800 . 5.600 4.278 2.135 5.194 . 0 0 "[ . 1 . 2 . 3]" 2 1587 1 97 GLN HA 1 97 GLN HE21 3.500 . 5.100 2.907 1.990 3.252 . 0 0 "[ . 1 . 2 . 3]" 2 1588 1 36 LEU HB3 1 37 GLY H 2.700 . 6.000 3.253 1.671 4.652 . 0 0 "[ . 1 . 2 . 3]" 2 1589 1 36 LEU MD2 1 97 GLN HE21 4.000 . 6.000 4.553 2.927 5.676 . 0 0 "[ . 1 . 2 . 3]" 2 1590 1 37 GLY H 1 39 TYR HB2 3.700 . 5.400 3.896 3.517 4.794 . 0 0 "[ . 1 . 2 . 3]" 2 1591 1 36 LEU MD1 1 37 GLY H 3.100 . 4.500 3.164 2.152 4.291 . 0 0 "[ . 1 . 2 . 3]" 2 1592 1 36 LEU MD2 1 37 GLY H 3.300 2.200 4.600 3.069 2.172 3.675 0.028 21 0 "[ . 1 . 2 . 3]" 2 1593 1 37 GLY H 1 39 TYR QD 3.500 . 5.200 4.095 3.520 4.460 . 0 0 "[ . 1 . 2 . 3]" 2 1594 1 97 GLN HE22 1 100 VAL HB 3.900 . 5.800 5.103 4.862 5.472 . 0 0 "[ . 1 . 2 . 3]" 2 1595 1 97 GLN HA 1 97 GLN HE22 3.500 . 5.200 3.039 2.875 3.246 . 0 0 "[ . 1 . 2 . 3]" 2 1596 1 36 LEU MD2 1 97 GLN HE22 3.800 . 5.600 4.484 3.602 6.020 0.420 20 0 "[ . 1 . 2 . 3]" 2 1597 1 97 GLN HE21 1 97 GLN HG2 2.800 . 4.000 2.396 2.120 3.490 . 0 0 "[ . 1 . 2 . 3]" 2 1598 1 97 GLN HE21 1 97 GLN HG3 2.900 . 4.100 3.291 2.189 3.519 . 0 0 "[ . 1 . 2 . 3]" 2 1599 1 93 ILE QG 1 97 GLN HE21 3.500 . 5.100 4.899 4.564 6.057 0.957 26 4 "[ . 1 . - * *.+ 3]" 2 1600 1 97 GLN HE22 1 101 THR MG 3.300 . 6.000 5.937 5.407 6.366 0.366 26 0 "[ . 1 . 2 . 3]" 2 1601 1 93 ILE QG 1 97 GLN HE22 3.200 . 6.000 5.822 5.159 6.027 0.027 25 0 "[ . 1 . 2 . 3]" 2 1602 1 97 GLN HE22 1 100 VAL MG2 3.200 . 4.700 4.094 3.833 4.468 . 0 0 "[ . 1 . 2 . 3]" 2 1603 1 70 ASN HA 1 70 ASN HD22 3.700 . 5.400 5.083 4.848 5.257 . 0 0 "[ . 1 . 2 . 3]" 2 1604 1 44 ALA HA 1 70 ASN HD21 3.700 . 5.400 4.462 2.938 5.377 . 0 0 "[ . 1 . 2 . 3]" 2 1605 1 139 ARG QG 1 140 GLY H 3.100 . 6.000 4.423 2.538 4.681 . 0 0 "[ . 1 . 2 . 3]" 2 1606 1 138 GLN HB2 1 140 GLY H 3.800 . 5.600 5.335 4.905 5.606 0.006 24 0 "[ . 1 . 2 . 3]" 2 1607 1 70 ASN HB2 1 70 ASN HD22 2.900 . 4.200 3.780 3.684 3.845 . 0 0 "[ . 1 . 2 . 3]" 2 1608 1 139 ARG QB 1 140 GLY H 2.600 . 3.700 3.097 2.788 3.564 . 0 0 "[ . 1 . 2 . 3]" 2 1609 1 70 ASN H 1 70 ASN HD21 3.700 . 5.400 3.478 2.065 4.333 . 0 0 "[ . 1 . 2 . 3]" 2 1610 1 70 ASN HA 1 70 ASN HD21 3.400 . 5.100 4.101 3.625 4.426 . 0 0 "[ . 1 . 2 . 3]" 2 1611 1 70 ASN HB3 1 70 ASN HD21 2.900 . 4.100 2.632 2.156 3.543 . 0 0 "[ . 1 . 2 . 3]" 2 1612 1 70 ASN HB2 1 70 ASN HD21 2.900 . 4.200 2.921 2.715 3.056 . 0 0 "[ . 1 . 2 . 3]" 2 1613 1 38 GLY H 1 39 TYR QB 3.300 . 4.800 4.027 3.570 4.299 . 0 0 "[ . 1 . 2 . 3]" 2 1614 1 38 GLY H 1 39 TYR H 2.400 . 3.300 2.338 1.686 2.574 0.014 20 0 "[ . 1 . 2 . 3]" 2 1615 1 38 GLY H 1 39 TYR QD 3.100 . 4.500 2.332 2.022 2.542 . 0 0 "[ . 1 . 2 . 3]" 2 1616 1 38 GLY H 1 39 TYR QE 3.700 . 5.400 3.847 3.479 4.008 . 0 0 "[ . 1 . 2 . 3]" 2 1617 1 38 GLY H 1 39 TYR HA 3.100 . 6.000 4.726 4.284 4.961 . 0 0 "[ . 1 . 2 . 3]" 2 1618 1 38 GLY H 1 93 ILE QG 3.300 . 6.000 6.001 5.561 6.076 0.076 27 0 "[ . 1 . 2 . 3]" 2 1619 1 36 LEU HB3 1 38 GLY H 3.300 . 6.000 5.207 3.242 5.923 . 0 0 "[ . 1 . 2 . 3]" 2 1620 1 53 GLY H 1 115 LYS QE 3.400 . 5.000 4.643 3.950 4.980 . 0 0 "[ . 1 . 2 . 3]" 2 1621 1 53 GLY H 1 57 GLU HA 3.800 . 5.600 5.291 5.097 5.609 0.009 24 0 "[ . 1 . 2 . 3]" 2 1622 1 52 PHE HA 1 53 GLY H 2.600 . 3.600 3.470 3.337 3.533 . 0 0 "[ . 1 . 2 . 3]" 2 1623 1 52 PHE HB3 1 53 GLY H 2.600 . 3.700 2.670 2.310 2.912 . 0 0 "[ . 1 . 2 . 3]" 2 1624 1 52 PHE HB2 1 53 GLY H 2.400 . 3.600 1.653 1.573 1.753 . 0 0 "[ . 1 . 2 . 3]" 2 1625 1 53 GLY H 1 54 SER H 2.000 . 2.800 2.696 2.222 2.838 0.038 7 0 "[ . 1 . 2 . 3]" 2 1626 1 53 GLY H 1 53 GLY HA2 2.300 . 3.100 2.912 2.823 2.955 . 0 0 "[ . 1 . 2 . 3]" 2 1627 1 53 GLY H 1 116 MET ME 3.600 . 5.200 4.902 4.465 5.171 . 0 0 "[ . 1 . 2 . 3]" 2 1628 1 53 GLY H 1 57 GLU HB3 3.500 . 5.200 3.228 2.909 3.673 . 0 0 "[ . 1 . 2 . 3]" 2 1629 1 53 GLY H 1 53 GLY HA3 2.300 . 3.100 2.379 2.294 2.521 . 0 0 "[ . 1 . 2 . 3]" 2 1630 1 52 PHE QE 1 53 GLY H 3.900 . 6.000 5.735 5.616 5.834 . 0 0 "[ . 1 . 2 . 3]" 2 1631 1 102 THR MG 1 106 GLY H 3.700 . 5.400 4.861 4.480 5.233 . 0 0 "[ . 1 . 2 . 3]" 2 1632 1 104 THR H 1 106 GLY H 2.800 . 6.000 3.985 3.816 4.178 . 0 0 "[ . 1 . 2 . 3]" 2 1633 1 105 LYS HB2 1 106 GLY H 3.000 . 4.300 3.338 2.883 3.733 . 0 0 "[ . 1 . 2 . 3]" 2 1634 1 105 LYS QG 1 106 GLY H 3.000 . 6.000 4.491 4.254 5.002 . 0 0 "[ . 1 . 2 . 3]" 2 1635 1 105 LYS HB3 1 106 GLY H 3.000 . 4.300 3.893 3.491 4.215 . 0 0 "[ . 1 . 2 . 3]" 2 1636 1 106 GLY H 1 106 GLY HA3 2.300 . 6.000 2.939 2.901 2.957 . 0 0 "[ . 1 . 2 . 3]" 2 1637 1 106 GLY H 1 106 GLY HA2 2.100 . 2.900 2.578 2.445 2.689 . 0 0 "[ . 1 . 2 . 3]" 2 1638 1 106 GLY H 1 107 GLU H 2.200 . 3.000 1.913 1.631 2.228 . 0 0 "[ . 1 . 2 . 3]" 2 1639 1 50 ILE H 1 50 ILE HA 2.700 . 3.800 2.949 2.945 2.951 . 0 0 "[ . 1 . 2 . 3]" 2 1640 1 49 ILE HA 1 50 ILE H 2.200 . 3.000 2.158 2.143 2.180 . 0 0 "[ . 1 . 2 . 3]" 2 1641 1 47 ARG H 1 47 ARG HA 2.800 . 4.000 2.811 2.801 2.820 . 0 0 "[ . 1 . 2 . 3]" 2 1642 1 46 SER HA 1 47 ARG H 2.000 . 2.700 2.150 2.139 2.163 . 0 0 "[ . 1 . 2 . 3]" 2 1643 1 44 ALA H 1 71 GLN HE22 3.200 . 4.600 4.332 3.946 4.578 . 0 0 "[ . 1 . 2 . 3]" 2 1644 1 44 ALA H 1 71 GLN HE21 3.100 . 4.500 3.589 3.148 4.645 0.145 14 0 "[ . 1 . 2 . 3]" 2 1645 1 54 SER HB2 1 55 ASP H 2.500 . 3.500 1.768 1.548 2.032 0.152 18 0 "[ . 1 . 2 . 3]" 2 1646 1 55 ASP H 1 55 ASP HA 2.400 . 3.300 2.797 2.791 2.800 . 0 0 "[ . 1 . 2 . 3]" 2 1647 1 54 SER HB3 1 55 ASP H 2.600 . 6.000 3.319 3.088 3.491 . 0 0 "[ . 1 . 2 . 3]" 2 1648 1 54 SER HA 1 55 ASP H 2.200 . 6.000 2.865 2.764 2.937 . 0 0 "[ . 1 . 2 . 3]" 2 1649 1 52 PHE H 1 52 PHE HA 2.900 . 4.200 2.774 2.262 2.940 . 0 0 "[ . 1 . 2 . 3]" 2 1650 1 51 HIS HA 1 52 PHE H 2.600 . 3.500 2.470 2.150 3.494 . 0 0 "[ . 1 . 2 . 3]" 2 1651 1 122 GLU HA 1 126 ILE H 2.600 . 6.000 4.530 4.393 4.713 . 0 0 "[ . 1 . 2 . 3]" 2 1652 1 125 CYS HB3 1 126 ILE H 2.600 . 6.000 3.651 3.511 3.811 . 0 0 "[ . 1 . 2 . 3]" 2 1653 1 93 ILE HA 1 96 LYS H 2.900 . 4.200 3.563 3.322 3.763 . 0 0 "[ . 1 . 2 . 3]" 2 1654 1 142 SER H 1 142 SER HA 2.900 . 4.200 2.797 2.271 2.947 . 0 0 "[ . 1 . 2 . 3]" 2 1655 1 49 ILE H 1 49 ILE HA 2.600 . 3.700 2.914 2.911 2.918 . 0 0 "[ . 1 . 2 . 3]" 2 1656 1 48 PRO HA 1 49 ILE H 2.000 . 2.700 2.199 2.166 2.236 . 0 0 "[ . 1 . 2 . 3]" 2 1657 1 125 CYS HA 1 128 GLN H 2.700 . 3.800 3.484 3.346 3.651 . 0 0 "[ . 1 . 2 . 3]" 2 1658 1 128 GLN H 1 128 GLN HA 2.700 . 3.800 2.830 2.806 2.855 . 0 0 "[ . 1 . 2 . 3]" 2 1659 1 127 THR HB 1 128 GLN H 2.600 . 3.600 2.595 2.378 2.719 . 0 0 "[ . 1 . 2 . 3]" 2 1660 1 127 THR HA 1 128 GLN H 3.100 . 4.500 3.544 3.518 3.574 . 0 0 "[ . 1 . 2 . 3]" 2 1661 1 124 MET HA 1 128 GLN H 3.100 . 4.500 4.429 4.291 4.520 0.020 27 0 "[ . 1 . 2 . 3]" 2 1662 1 126 ILE H 1 128 GLN H 3.400 . 5.000 4.175 3.942 4.428 . 0 0 "[ . 1 . 2 . 3]" 2 1663 1 51 HIS H 1 52 PHE H 3.300 . 4.900 3.722 1.935 4.468 . 0 0 "[ . 1 . 2 . 3]" 2 1664 1 50 ILE H 1 51 HIS H 3.300 . 4.800 4.491 4.454 4.525 . 0 0 "[ . 1 . 2 . 3]" 2 1665 1 51 HIS H 1 51 HIS HA 2.600 . 3.600 2.946 2.934 2.949 . 0 0 "[ . 1 . 2 . 3]" 2 1666 1 109 PHE H 1 109 PHE HB3 2.500 . 6.000 3.661 3.610 3.829 . 0 0 "[ . 1 . 2 . 3]" 2 1667 1 109 PHE H 1 109 PHE HB2 2.300 . 3.200 2.453 2.365 2.732 . 0 0 "[ . 1 . 2 . 3]" 2 1668 1 50 ILE HA 1 51 HIS H 2.000 . 2.700 2.304 2.192 2.462 . 0 0 "[ . 1 . 2 . 3]" 2 1669 1 109 PHE H 1 109 PHE QD 2.600 . 6.000 3.167 2.837 3.726 . 0 0 "[ . 1 . 2 . 3]" 2 1670 1 109 PHE H 1 109 PHE HA 2.600 . 3.600 2.930 2.925 2.937 . 0 0 "[ . 1 . 2 . 3]" 2 1671 1 108 ASN HA 1 109 PHE H 2.000 . 2.700 2.195 2.152 2.273 . 0 0 "[ . 1 . 2 . 3]" 2 1672 1 128 GLN H 1 129 TYR H 2.900 . 4.100 2.570 2.492 2.649 . 0 0 "[ . 1 . 2 . 3]" 2 1673 1 86 PHE QD 1 129 TYR H 3.700 . 5.400 3.979 3.714 4.413 . 0 0 "[ . 1 . 2 . 3]" 2 1674 1 120 VAL HA 1 121 VAL H 3.300 . 4.900 3.537 3.525 3.553 . 0 0 "[ . 1 . 2 . 3]" 2 1675 1 117 MET HA 1 121 VAL H 2.700 . 3.800 3.574 3.431 3.689 . 0 0 "[ . 1 . 2 . 3]" 2 1676 1 128 GLN QB 1 129 TYR H 3.200 . 4.700 2.860 2.657 3.602 . 0 0 "[ . 1 . 2 . 3]" 2 1677 1 87 VAL MG1 1 129 TYR H 3.700 . 5.400 3.992 3.740 4.395 . 0 0 "[ . 1 . 2 . 3]" 2 1678 1 72 VAL HA 1 73 TYR H 2.500 . 3.500 2.429 2.418 2.444 . 0 0 "[ . 1 . 2 . 3]" 2 1679 1 129 TYR H 1 130 GLU HB2 3.200 . 4.700 4.667 4.556 4.723 0.023 8 0 "[ . 1 . 2 . 3]" 2 1680 1 129 TYR H 1 129 TYR HB3 2.900 . 4.100 2.401 2.285 2.495 . 0 0 "[ . 1 . 2 . 3]" 2 1681 1 129 TYR H 1 129 TYR HB2 2.900 . 4.200 2.677 2.583 2.793 . 0 0 "[ . 1 . 2 . 3]" 2 1682 1 126 ILE HA 1 129 TYR H 3.200 . 4.700 3.251 3.160 3.395 . 0 0 "[ . 1 . 2 . 3]" 2 1683 1 73 TYR H 1 73 TYR QD 2.900 . 6.000 2.239 2.073 2.345 . 0 0 "[ . 1 . 2 . 3]" 2 1684 1 86 PHE QE 1 129 TYR H 3.200 . 4.700 3.246 2.996 3.482 . 0 0 "[ . 1 . 2 . 3]" 2 1685 1 129 TYR H 1 129 TYR QD 3.500 . 5.200 4.173 4.095 4.205 . 0 0 "[ . 1 . 2 . 3]" 2 1686 1 41 LEU H 1 73 TYR HA 3.800 . 5.600 4.705 4.663 4.740 . 0 0 "[ . 1 . 2 . 3]" 2 1687 1 41 LEU H 1 42 GLY H 3.400 . 5.100 4.373 4.286 4.455 . 0 0 "[ . 1 . 2 . 3]" 2 1688 1 60 TYR H 1 60 TYR HA 2.600 . 3.600 2.799 2.755 2.826 . 0 0 "[ . 1 . 2 . 3]" 2 1689 1 59 ARG QD 1 60 TYR H 3.000 . 6.000 5.087 4.256 5.518 . 0 0 "[ . 1 . 2 . 3]" 2 1690 1 125 CYS HA 1 129 TYR H 3.600 . 5.200 4.418 4.119 4.597 . 0 0 "[ . 1 . 2 . 3]" 2 1691 1 60 TYR H 1 60 TYR QD 2.700 . 6.000 4.192 4.163 4.202 . 0 0 "[ . 1 . 2 . 3]" 2 1692 1 59 ARG HA 1 60 TYR H 2.900 . 4.200 3.497 3.450 3.549 . 0 0 "[ . 1 . 2 . 3]" 2 1693 1 65 MET HA 1 68 TYR H 3.000 . 4.300 3.142 2.854 3.650 . 0 0 "[ . 1 . 2 . 3]" 2 1694 1 68 TYR H 1 68 TYR QE 3.300 . 6.000 5.254 4.993 5.705 . 0 0 "[ . 1 . 2 . 3]" 2 1695 1 68 TYR H 1 68 TYR HA 2.700 . 3.800 2.893 2.857 2.945 . 0 0 "[ . 1 . 2 . 3]" 2 1696 1 68 TYR H 1 68 TYR QD 2.700 . 6.000 3.266 2.974 3.742 . 0 0 "[ . 1 . 2 . 3]" 2 1697 1 67 ARG HA 1 68 TYR H 2.800 . 4.000 3.354 3.123 3.453 . 0 0 "[ . 1 . 2 . 3]" 2 1698 1 129 TYR QE 1 130 GLU H 3.800 . 5.600 5.329 5.039 5.543 . 0 0 "[ . 1 . 2 . 3]" 2 1699 1 130 GLU H 1 130 GLU HA 2.600 . 3.700 2.857 2.854 2.863 . 0 0 "[ . 1 . 2 . 3]" 2 1700 1 127 THR HA 1 130 GLU H 2.800 . 4.000 3.646 3.417 3.877 . 0 0 "[ . 1 . 2 . 3]" 2 1701 1 129 TYR QD 1 130 GLU H 3.100 . 4.500 3.274 2.980 3.451 . 0 0 "[ . 1 . 2 . 3]" 2 1702 1 129 TYR HA 1 130 GLU H 3.300 . 4.900 3.530 3.514 3.544 . 0 0 "[ . 1 . 2 . 3]" 2 1703 1 126 ILE HA 1 130 GLU H 3.100 . 4.500 4.516 4.430 4.553 0.053 29 0 "[ . 1 . 2 . 3]" 2 1704 1 92 ASN HA 1 95 ILE H 3.100 . 4.500 4.037 3.894 4.184 . 0 0 "[ . 1 . 2 . 3]" 2 1705 1 94 THR HA 1 95 ILE H 3.000 . 4.300 3.572 3.560 3.582 . 0 0 "[ . 1 . 2 . 3]" 2 1706 1 94 THR HB 1 95 ILE H 2.700 . 3.800 2.432 2.348 2.512 . 0 0 "[ . 1 . 2 . 3]" 2 1707 1 40 MET H 1 41 LEU H 3.600 . 5.200 4.501 4.469 4.522 . 0 0 "[ . 1 . 2 . 3]" 2 1708 1 39 TYR HA 1 40 MET H 2.400 . 3.300 2.455 2.234 2.589 . 0 0 "[ . 1 . 2 . 3]" 2 1709 1 40 MET H 1 73 TYR HA 3.600 . 5.200 4.165 4.044 4.266 . 0 0 "[ . 1 . 2 . 3]" 2 1710 1 40 MET H 1 74 TYR H 3.000 . 4.300 2.950 2.368 3.147 . 0 0 "[ . 1 . 2 . 3]" 2 1711 1 44 ALA HA 1 45 MET H 2.100 . 2.800 2.244 2.145 2.274 . 0 0 "[ . 1 . 2 . 3]" 2 1712 1 45 MET H 1 45 MET HA 2.500 . 3.500 2.939 2.934 2.945 . 0 0 "[ . 1 . 2 . 3]" 2 1713 1 121 VAL HA 1 122 GLU H 2.900 . 4.100 3.516 3.497 3.538 . 0 0 "[ . 1 . 2 . 3]" 2 1714 1 134 GLN QB 1 135 ALA H 2.500 . 3.500 2.972 2.701 3.514 0.014 18 0 "[ . 1 . 2 . 3]" 2 1715 1 131 ARG HA 1 135 ALA H 3.100 . 6.000 5.088 4.570 5.540 . 0 0 "[ . 1 . 2 . 3]" 2 1716 1 122 GLU H 1 122 GLU HA 2.600 . 3.700 2.789 2.774 2.808 . 0 0 "[ . 1 . 2 . 3]" 2 1717 1 60 TYR QD 1 61 TYR H 2.700 . 3.800 3.206 2.995 3.338 . 0 0 "[ . 1 . 2 . 3]" 2 1718 1 58 ASP HA 1 59 ARG H 2.800 . 4.000 3.561 3.542 3.571 . 0 0 "[ . 1 . 2 . 3]" 2 1719 1 112 THR HA 1 113 ASP H 2.700 . 3.800 3.491 3.468 3.518 . 0 0 "[ . 1 . 2 . 3]" 2 1720 1 56 TYR HA 1 59 ARG H 3.100 . 4.500 4.068 3.769 4.199 . 0 0 "[ . 1 . 2 . 3]" 2 1721 1 60 TYR HA 1 61 TYR H 3.100 . 4.500 3.565 3.556 3.572 . 0 0 "[ . 1 . 2 . 3]" 2 1722 1 61 TYR H 1 61 TYR QD 2.800 . 6.000 4.108 4.007 4.145 . 0 0 "[ . 1 . 2 . 3]" 2 1723 1 61 TYR H 1 61 TYR HA 2.700 . 3.800 2.819 2.809 2.829 . 0 0 "[ . 1 . 2 . 3]" 2 1724 1 60 TYR HB3 1 61 TYR H 2.600 . 3.700 2.294 2.245 2.353 . 0 0 "[ . 1 . 2 . 3]" 2 1725 1 61 TYR H 1 61 TYR HB3 2.400 . 3.300 2.285 2.209 2.321 . 0 0 "[ . 1 . 2 . 3]" 2 1726 1 60 TYR HB2 1 61 TYR H 2.800 . 4.000 3.711 3.640 3.786 . 0 0 "[ . 1 . 2 . 3]" 2 1727 1 58 ASP HA 1 61 TYR H 3.200 . 4.700 4.071 3.981 4.242 . 0 0 "[ . 1 . 2 . 3]" 2 1728 1 61 TYR H 1 61 TYR HB2 2.500 . 3.500 2.822 2.784 2.905 . 0 0 "[ . 1 . 2 . 3]" 2 1729 1 86 PHE QD 1 87 VAL H 3.200 . 4.700 3.347 3.017 3.596 . 0 0 "[ . 1 . 2 . 3]" 2 1730 1 109 PHE HA 1 113 ASP H 3.100 . 6.000 4.648 4.347 4.814 . 0 0 "[ . 1 . 2 . 3]" 2 1731 1 82 ASN HA 1 83 GLN H 2.300 . 3.100 2.395 2.133 3.092 . 0 0 "[ . 1 . 2 . 3]" 2 1732 1 133 SER HB2 1 134 GLN H 3.200 . 4.700 4.206 4.057 4.353 . 0 0 "[ . 1 . 2 . 3]" 2 1733 1 87 VAL H 1 88 HIS H 2.800 . 4.000 2.569 2.440 2.758 . 0 0 "[ . 1 . 2 . 3]" 2 1734 1 134 GLN H 1 134 GLN HA 2.400 . 3.300 2.851 2.823 2.881 . 0 0 "[ . 1 . 2 . 3]" 2 1735 1 133 SER HB3 1 134 GLN H 3.200 . 4.700 3.669 3.231 3.857 . 0 0 "[ . 1 . 2 . 3]" 2 1736 1 130 GLU HA 1 134 GLN H 3.200 . 4.700 4.101 3.695 4.632 . 0 0 "[ . 1 . 2 . 3]" 2 1737 1 84 ASN HA 1 87 VAL H 3.600 . 5.200 3.856 3.320 4.142 . 0 0 "[ . 1 . 2 . 3]" 2 1738 1 55 ASP HA 1 58 ASP H 2.600 . 3.700 3.380 3.222 3.544 . 0 0 "[ . 1 . 2 . 3]" 2 1739 1 111 LYS H 1 112 THR HB 3.600 . 5.200 5.185 5.079 5.233 0.033 25 0 "[ . 1 . 2 . 3]" 2 1740 1 122 GLU HA 1 125 CYS H 2.600 . 3.700 3.487 3.395 3.546 . 0 0 "[ . 1 . 2 . 3]" 2 1741 1 121 VAL HA 1 125 CYS H 2.900 . 6.000 4.115 4.007 4.207 . 0 0 "[ . 1 . 2 . 3]" 2 1742 1 111 LYS H 1 111 LYS HA 2.600 . 3.600 2.787 2.783 2.793 . 0 0 "[ . 1 . 2 . 3]" 2 1743 1 110 THR HB 1 111 LYS H 2.200 . 3.000 1.998 1.705 2.354 . 0 0 "[ . 1 . 2 . 3]" 2 1744 1 90 CYS HB3 1 125 CYS H 3.500 . 6.000 5.555 5.432 5.693 . 0 0 "[ . 1 . 2 . 3]" 2 1745 1 110 THR HA 1 111 LYS H 2.300 . 3.200 2.734 2.681 2.789 . 0 0 "[ . 1 . 2 . 3]" 2 1746 1 124 MET HA 1 125 CYS H 3.100 . 4.500 3.476 3.448 3.503 . 0 0 "[ . 1 . 2 . 3]" 2 1747 1 137 TYR HA 1 138 GLN H 2.500 . 6.000 3.505 3.477 3.531 . 0 0 "[ . 1 . 2 . 3]" 2 1748 1 125 CYS H 1 125 CYS HB2 2.700 . 3.800 2.394 2.288 2.465 . 0 0 "[ . 1 . 2 . 3]" 2 1749 1 125 CYS H 1 125 CYS HB3 2.500 . 6.000 3.588 3.551 3.606 . 0 0 "[ . 1 . 2 . 3]" 2 1750 1 125 CYS H 1 125 CYS HA 2.600 . 3.700 2.850 2.845 2.855 . 0 0 "[ . 1 . 2 . 3]" 2 1751 1 120 VAL HA 1 124 MET H 3.100 . 4.500 4.460 4.390 4.503 0.003 18 0 "[ . 1 . 2 . 3]" 2 1752 1 124 MET H 1 124 MET HA 2.700 . 3.800 2.813 2.807 2.820 . 0 0 "[ . 1 . 2 . 3]" 2 1753 1 133 SER HA 1 136 TYR H 3.100 . 4.500 3.257 3.043 3.432 . 0 0 "[ . 1 . 2 . 3]" 2 1754 1 128 GLN HA 1 132 GLU H 3.300 . 4.800 4.204 3.895 4.390 . 0 0 "[ . 1 . 2 . 3]" 2 1755 1 123 GLN HA 1 124 MET H 2.700 . 3.800 3.534 3.525 3.545 . 0 0 "[ . 1 . 2 . 3]" 2 1756 1 112 THR HA 1 115 LYS H 2.800 . 4.000 3.447 3.282 3.544 . 0 0 "[ . 1 . 2 . 3]" 2 1757 1 87 VAL HA 1 90 CYS H 2.800 . 4.000 3.353 3.185 3.499 . 0 0 "[ . 1 . 2 . 3]" 2 1758 1 135 ALA H 1 136 TYR H 2.600 . 3.600 2.339 2.292 2.456 . 0 0 "[ . 1 . 2 . 3]" 2 1759 1 111 LYS HA 1 115 LYS H 2.400 . 6.000 4.495 4.373 4.731 . 0 0 "[ . 1 . 2 . 3]" 2 1760 1 136 TYR H 1 136 TYR QD 3.000 . 6.000 4.207 4.149 4.230 . 0 0 "[ . 1 . 2 . 3]" 2 1761 1 62 ARG HA 1 65 MET H 3.100 . 4.500 3.727 3.606 3.830 . 0 0 "[ . 1 . 2 . 3]" 2 1762 1 136 TYR H 1 136 TYR HA 2.400 . 3.300 2.876 2.854 2.894 . 0 0 "[ . 1 . 2 . 3]" 2 1763 1 115 LYS H 1 115 LYS HA 2.400 . 3.300 2.811 2.805 2.820 . 0 0 "[ . 1 . 2 . 3]" 2 1764 1 115 LYS H 1 115 LYS QE 3.500 . 6.000 5.225 4.913 5.494 . 0 0 "[ . 1 . 2 . 3]" 2 1765 1 109 PHE HB3 1 114 VAL H 3.100 . 4.500 3.924 3.772 4.011 . 0 0 "[ . 1 . 2 . 3]" 2 1766 1 114 VAL HA 1 115 LYS H 3.000 . 4.300 3.474 3.451 3.496 . 0 0 "[ . 1 . 2 . 3]" 2 1767 1 114 VAL H 1 114 VAL HA 2.500 . 3.500 2.829 2.821 2.836 . 0 0 "[ . 1 . 2 . 3]" 2 1768 1 113 ASP HA 1 114 VAL H 3.000 . 4.300 3.563 3.554 3.568 . 0 0 "[ . 1 . 2 . 3]" 2 1769 1 57 GLU H 1 57 GLU HA 2.600 . 3.700 2.847 2.841 2.859 . 0 0 "[ . 1 . 2 . 3]" 2 1770 1 119 ARG HA 1 120 VAL H 2.900 . 4.200 3.539 3.526 3.555 . 0 0 "[ . 1 . 2 . 3]" 2 1771 1 90 CYS HA 1 93 ILE H 3.800 . 5.600 3.854 3.756 3.991 . 0 0 "[ . 1 . 2 . 3]" 2 1772 1 120 VAL H 1 120 VAL HA 2.600 . 3.700 2.822 2.813 2.828 . 0 0 "[ . 1 . 2 . 3]" 2 1773 1 117 MET HA 1 120 VAL H 2.900 . 4.100 3.518 3.460 3.573 . 0 0 "[ . 1 . 2 . 3]" 2 1774 1 54 SER HA 1 57 GLU H 2.900 . 6.000 5.005 4.955 5.039 . 0 0 "[ . 1 . 2 . 3]" 2 1775 1 98 HIS H 1 98 HIS HD2 3.500 . 5.200 2.891 2.574 3.155 . 0 0 "[ . 1 . 2 . 3]" 2 1776 1 116 MET HA 1 120 VAL H 3.100 . 4.500 4.058 3.982 4.109 . 0 0 "[ . 1 . 2 . 3]" 2 1777 1 54 SER HB3 1 57 GLU H 3.200 . 6.000 5.388 5.071 5.642 . 0 0 "[ . 1 . 2 . 3]" 2 1778 1 95 ILE HA 1 98 HIS H 3.100 . 4.500 3.494 3.389 3.591 . 0 0 "[ . 1 . 2 . 3]" 2 1779 1 56 TYR H 1 56 TYR QD 2.800 . 6.000 4.116 4.068 4.173 . 0 0 "[ . 1 . 2 . 3]" 2 1780 1 56 TYR H 1 56 TYR HA 2.300 . 3.200 2.791 2.783 2.797 . 0 0 "[ . 1 . 2 . 3]" 2 1781 1 55 ASP HA 1 56 TYR H 2.800 . 4.000 3.486 3.448 3.509 . 0 0 "[ . 1 . 2 . 3]" 2 1782 1 67 ARG H 1 67 ARG HA 2.700 . 3.800 2.913 2.910 2.936 . 0 0 "[ . 1 . 2 . 3]" 2 1783 1 115 LYS HA 1 118 GLU H 2.900 . 4.100 3.669 3.540 3.741 . 0 0 "[ . 1 . 2 . 3]" 2 1784 1 86 PHE HA 1 89 ASP H 2.800 . 6.000 4.209 4.044 4.353 . 0 0 "[ . 1 . 2 . 3]" 2 1785 1 88 HIS HA 1 89 ASP H 3.500 . 5.200 3.558 3.523 3.573 . 0 0 "[ . 1 . 2 . 3]" 2 1786 1 64 ASN HA 1 67 ARG H 3.500 . 5.200 3.300 3.139 3.795 . 0 0 "[ . 1 . 2 . 3]" 2 1787 1 114 VAL HA 1 118 GLU H 3.200 . 4.700 3.949 3.880 4.016 . 0 0 "[ . 1 . 2 . 3]" 2 1788 1 124 MET HA 1 127 THR H 2.600 . 3.600 3.420 3.342 3.494 . 0 0 "[ . 1 . 2 . 3]" 2 1789 1 126 ILE HA 1 127 THR H 2.900 . 4.200 3.532 3.504 3.552 . 0 0 "[ . 1 . 2 . 3]" 2 1790 1 127 THR H 1 127 THR HA 2.500 . 3.500 2.784 2.762 2.794 . 0 0 "[ . 1 . 2 . 3]" 2 1791 1 127 THR H 1 127 THR HB 2.300 . 3.200 2.424 2.311 2.498 . 0 0 "[ . 1 . 2 . 3]" 2 1792 1 85 ASN H 1 85 ASN HA 2.600 . 3.600 2.846 2.825 2.859 . 0 0 "[ . 1 . 2 . 3]" 2 1793 1 84 ASN HA 1 85 ASN H 2.900 . 4.200 3.543 3.428 3.576 . 0 0 "[ . 1 . 2 . 3]" 2 1794 1 91 VAL HA 1 94 THR H 3.300 . 4.800 3.765 3.620 3.971 . 0 0 "[ . 1 . 2 . 3]" 2 1795 1 113 ASP HA 1 116 MET H 3.000 . 4.300 3.789 3.657 3.876 . 0 0 "[ . 1 . 2 . 3]" 2 1796 1 112 THR HA 1 116 MET H 3.200 . 4.700 4.368 4.240 4.510 . 0 0 "[ . 1 . 2 . 3]" 2 1797 1 113 ASP HA 1 117 MET H 3.200 . 4.700 4.240 4.111 4.356 . 0 0 "[ . 1 . 2 . 3]" 2 1798 1 117 MET H 1 117 MET HA 2.600 . 3.600 2.791 2.777 2.809 . 0 0 "[ . 1 . 2 . 3]" 2 1799 1 116 MET HA 1 117 MET H 2.900 . 4.200 3.508 3.479 3.521 . 0 0 "[ . 1 . 2 . 3]" 2 1800 1 114 VAL HA 1 117 MET H 2.900 . 4.200 3.298 3.214 3.413 . 0 0 "[ . 1 . 2 . 3]" 2 1801 1 61 TYR HA 1 62 ARG H 2.800 . 4.000 3.551 3.543 3.567 . 0 0 "[ . 1 . 2 . 3]" 2 1802 1 137 TYR H 1 137 TYR HB2 2.400 . 3.300 2.185 2.165 2.206 . 0 0 "[ . 1 . 2 . 3]" 2 1803 1 137 TYR H 1 137 TYR QD 2.800 . 4.000 2.828 2.275 3.539 . 0 0 "[ . 1 . 2 . 3]" 2 1804 1 137 TYR H 1 137 TYR HB3 2.500 . 6.000 3.488 3.476 3.507 . 0 0 "[ . 1 . 2 . 3]" 2 1805 1 62 ARG H 1 62 ARG HA 2.400 . 3.300 2.765 2.741 2.781 . 0 0 "[ . 1 . 2 . 3]" 2 1806 1 136 TYR HB2 1 137 TYR H 2.600 . 6.000 3.962 3.785 4.113 . 0 0 "[ . 1 . 2 . 3]" 2 1807 1 133 SER HA 1 137 TYR H 3.200 . 4.700 3.769 3.479 4.026 . 0 0 "[ . 1 . 2 . 3]" 2 1808 1 100 VAL HA 1 103 THR H 3.000 . 6.000 4.660 4.582 4.725 . 0 0 "[ . 1 . 2 . 3]" 2 1809 1 39 TYR H 1 39 TYR QD 2.400 . 3.300 2.401 2.267 2.541 . 0 0 "[ . 1 . 2 . 3]" 2 1810 1 38 GLY HA3 1 39 TYR H 2.500 . 6.000 3.392 3.275 3.418 . 0 0 "[ . 1 . 2 . 3]" 2 1811 1 39 TYR H 1 39 TYR HA 2.600 . 3.700 2.945 2.940 2.948 . 0 0 "[ . 1 . 2 . 3]" 2 1812 1 38 GLY HA2 1 39 TYR H 2.600 . 3.600 3.104 3.061 3.242 . 0 0 "[ . 1 . 2 . 3]" 2 1813 1 119 ARG H 1 119 ARG HD2 3.500 . 5.200 4.447 3.970 4.798 . 0 0 "[ . 1 . 2 . 3]" 2 1814 1 119 ARG H 1 119 ARG HA 2.500 . 3.500 2.854 2.844 2.860 . 0 0 "[ . 1 . 2 . 3]" 2 1815 1 85 ASN HA 1 88 HIS H 2.900 . 4.200 3.646 3.361 4.086 . 0 0 "[ . 1 . 2 . 3]" 2 1816 1 88 HIS H 1 89 ASP H 2.700 . 3.800 2.820 2.599 3.018 . 0 0 "[ . 1 . 2 . 3]" 2 1817 1 94 THR HA 1 97 GLN H 2.500 . 6.000 3.724 3.672 3.814 . 0 0 "[ . 1 . 2 . 3]" 2 1818 1 110 THR HA 1 112 THR H 2.800 . 6.000 4.777 4.537 4.947 . 0 0 "[ . 1 . 2 . 3]" 2 1819 1 111 LYS HA 1 112 THR H 2.900 . 4.100 3.551 3.518 3.565 . 0 0 "[ . 1 . 2 . 3]" 2 1820 1 110 THR HB 1 112 THR H 2.300 . 3.100 2.731 2.417 3.092 . 0 0 "[ . 1 . 2 . 3]" 2 1821 1 69 PRO HA 1 70 ASN H 2.200 . 3.000 2.213 2.151 2.271 . 0 0 "[ . 1 . 2 . 3]" 2 1822 1 63 GLU H 1 63 GLU HA 2.400 . 3.300 2.893 2.842 2.901 . 0 0 "[ . 1 . 2 . 3]" 2 1823 1 70 ASN H 1 70 ASN HA 2.700 . 3.800 2.946 2.943 2.949 . 0 0 "[ . 1 . 2 . 3]" 2 1824 1 45 MET HA 1 46 SER H 1.900 . 6.000 3.520 2.659 3.558 . 0 0 "[ . 1 . 2 . 3]" 2 1825 1 46 SER H 1 46 SER HA 2.300 . 3.200 2.844 2.815 2.901 . 0 0 "[ . 1 . 2 . 3]" 2 1826 1 89 ASP HA 1 92 ASN H 3.000 . 4.300 3.755 3.533 3.923 . 0 0 "[ . 1 . 2 . 3]" 2 1827 1 109 PHE HB2 1 110 THR H 3.100 . 6.000 4.433 4.395 4.471 . 0 0 "[ . 1 . 2 . 3]" 2 1828 1 109 PHE HB3 1 110 THR H 2.900 . 4.200 3.663 3.565 3.829 . 0 0 "[ . 1 . 2 . 3]" 2 1829 1 110 THR H 1 110 THR HA 2.800 . 4.000 2.926 2.921 2.932 . 0 0 "[ . 1 . 2 . 3]" 2 1830 1 110 THR H 1 113 ASP HB3 2.800 . 4.000 3.165 3.040 3.346 . 0 0 "[ . 1 . 2 . 3]" 2 1831 1 109 PHE HA 1 110 THR H 2.300 . 3.200 2.146 2.134 2.178 . 0 0 "[ . 1 . 2 . 3]" 2 1832 1 110 THR H 1 110 THR HB 3.000 . 4.300 3.305 3.046 3.647 . 0 0 "[ . 1 . 2 . 3]" 2 1833 1 133 SER H 1 133 SER HA 2.800 . 4.000 2.850 2.847 2.855 . 0 0 "[ . 1 . 2 . 3]" 2 1834 1 133 SER H 1 133 SER HB2 2.800 . 4.000 3.497 3.100 3.583 . 0 0 "[ . 1 . 2 . 3]" 2 1835 1 130 GLU HA 1 133 SER H 3.100 . 4.500 3.201 3.088 3.343 . 0 0 "[ . 1 . 2 . 3]" 2 1836 1 132 GLU HA 1 133 SER H 3.200 . 4.700 3.448 3.410 3.500 . 0 0 "[ . 1 . 2 . 3]" 2 1837 1 129 TYR HA 1 133 SER H 2.600 . 6.000 4.275 4.126 4.403 . 0 0 "[ . 1 . 2 . 3]" 2 1838 1 140 GLY QA 1 141 SER H 2.300 . 3.100 2.319 2.109 2.915 . 0 0 "[ . 1 . 2 . 3]" 2 1839 1 66 HIS H 1 66 HIS HA 2.500 . 3.500 2.801 2.795 2.808 . 0 0 "[ . 1 . 2 . 3]" 2 1840 1 65 MET HA 1 66 HIS H 3.100 . 4.500 3.513 3.452 3.540 . 0 0 "[ . 1 . 2 . 3]" 2 1841 1 141 SER H 1 141 SER HA 2.600 . 3.700 2.729 2.269 2.929 . 0 0 "[ . 1 . 2 . 3]" 2 1842 1 98 HIS HA 1 101 THR H 2.800 . 4.000 3.504 3.385 3.764 . 0 0 "[ . 1 . 2 . 3]" 2 1843 1 97 GLN HA 1 101 THR H 2.500 . 6.000 4.370 4.089 4.463 . 0 0 "[ . 1 . 2 . 3]" 2 1844 1 101 THR H 1 101 THR HA 2.300 . 3.100 2.890 2.875 2.894 . 0 0 "[ . 1 . 2 . 3]" 2 1845 1 42 GLY H 1 42 GLY HA3 2.800 . 4.000 2.389 2.344 2.459 . 0 0 "[ . 1 . 2 . 3]" 2 1846 1 42 GLY H 1 43 SER H 3.500 . 5.100 4.340 4.256 4.405 . 0 0 "[ . 1 . 2 . 3]" 2 1847 1 42 GLY H 1 73 TYR HA 3.500 . 5.200 3.275 3.054 3.418 . 0 0 "[ . 1 . 2 . 3]" 2 1848 1 41 LEU HA 1 42 GLY H 2.500 . 3.500 2.119 2.105 2.157 . 0 0 "[ . 1 . 2 . 3]" 2 1849 1 123 GLN H 1 123 GLN HA 2.600 . 3.700 2.837 2.829 2.842 . 0 0 "[ . 1 . 2 . 3]" 2 1850 1 120 VAL HA 1 123 GLN H 3.000 . 4.300 3.649 3.569 3.712 . 0 0 "[ . 1 . 2 . 3]" 2 1851 1 119 ARG HA 1 123 GLN H 3.500 . 5.100 4.579 4.451 4.717 . 0 0 "[ . 1 . 2 . 3]" 2 1852 1 122 GLU HA 1 123 GLN H 3.000 . 4.300 3.536 3.528 3.549 . 0 0 "[ . 1 . 2 . 3]" 2 1853 1 64 ASN H 1 64 ASN HA 2.700 . 3.800 2.934 2.911 2.943 . 0 0 "[ . 1 . 2 . 3]" 2 1854 1 63 GLU HA 1 64 ASN H 2.900 . 4.100 3.401 3.385 3.460 . 0 0 "[ . 1 . 2 . 3]" 2 1855 1 61 TYR HA 1 64 ASN H 2.900 . 4.200 3.206 3.112 3.394 . 0 0 "[ . 1 . 2 . 3]" 2 1856 1 98 HIS HA 1 102 THR H 3.000 . 4.400 2.570 2.464 2.657 . 0 0 "[ . 1 . 2 . 3]" 2 1857 1 95 ILE HA 1 99 THR H 3.800 . 5.600 3.800 3.621 4.002 . 0 0 "[ . 1 . 2 . 3]" 2 1858 1 70 ASN HB3 1 71 GLN H 3.300 . 4.900 4.583 4.549 4.629 . 0 0 "[ . 1 . 2 . 3]" 2 1859 1 70 ASN HA 1 71 GLN H 2.600 . 3.600 3.165 3.058 3.211 . 0 0 "[ . 1 . 2 . 3]" 2 1860 1 96 LYS HA 1 99 THR H 2.600 . 6.000 3.958 3.790 4.116 . 0 0 "[ . 1 . 2 . 3]" 2 1861 1 43 SER H 1 71 GLN HA 3.100 . 6.000 5.618 5.516 5.764 . 0 0 "[ . 1 . 2 . 3]" 2 1862 1 43 SER HA 1 72 VAL H 2.900 . 6.000 5.174 5.056 5.270 . 0 0 "[ . 1 . 2 . 3]" 2 1863 1 71 GLN H 1 72 VAL H 3.600 . 5.200 4.483 4.455 4.499 . 0 0 "[ . 1 . 2 . 3]" 2 1864 1 71 GLN HA 1 72 VAL H 2.300 . 3.100 2.249 2.216 2.272 . 0 0 "[ . 1 . 2 . 3]" 2 1865 1 42 GLY H 1 72 VAL H 3.300 . 4.800 3.192 3.086 3.391 . 0 0 "[ . 1 . 2 . 3]" 2 1866 1 73 TYR HA 1 74 TYR H 2.400 . 3.300 2.173 2.124 2.342 . 0 0 "[ . 1 . 2 . 3]" 2 1867 1 74 TYR H 1 74 TYR HA 3.000 . 4.400 2.945 2.906 2.950 . 0 0 "[ . 1 . 2 . 3]" 2 1868 1 37 GLY H 1 37 GLY QA 2.100 . 2.800 2.302 2.202 2.397 . 0 0 "[ . 1 . 2 . 3]" 2 1869 1 36 LEU HA 1 37 GLY H 2.500 . 3.200 2.512 2.281 3.295 0.095 14 0 "[ . 1 . 2 . 3]" 2 1870 1 139 ARG HA 1 140 GLY H 2.200 . 6.000 3.413 3.150 3.517 . 0 0 "[ . 1 . 2 . 3]" 2 1871 1 140 GLY H 1 140 GLY QA 2.000 . 2.700 2.331 2.200 2.491 . 0 0 "[ . 1 . 2 . 3]" 2 1872 1 37 GLY HA3 1 38 GLY H 2.200 . 3.600 2.651 2.446 3.042 . 0 0 "[ . 1 . 2 . 3]" 2 1873 1 38 GLY H 1 38 GLY HA3 2.000 . 2.700 2.450 2.352 2.743 0.043 20 0 "[ . 1 . 2 . 3]" 2 1874 1 71 GLN HA 1 71 GLN HG2 2.700 . 3.800 2.643 2.516 2.877 . 0 0 "[ . 1 . 2 . 3]" 2 1875 1 71 GLN HB2 1 71 GLN HG2 2.300 . 6.000 3.006 2.984 3.010 . 0 0 "[ . 1 . 2 . 3]" 2 1876 1 134 GLN QB 1 134 GLN QG 2.100 . 2.700 2.031 1.983 2.085 . 0 0 "[ . 1 . 2 . 3]" 2 1877 1 50 ILE MG 1 123 GLN QG 2.900 . 4.100 4.104 4.040 4.131 0.031 8 0 "[ . 1 . 2 . 3]" 2 1878 1 49 ILE MD 1 62 ARG QG 6.000 . 6.000 4.350 3.354 4.792 . 0 0 "[ . 1 . 2 . 3]" 2 1879 1 48 PRO HA 1 48 PRO HB2 2.400 . 3.300 2.980 2.967 2.990 . 0 0 "[ . 1 . 2 . 3]" 2 1880 1 124 MET HB3 1 124 MET HG3 2.700 . 3.800 2.990 2.965 3.004 . 0 0 "[ . 1 . 2 . 3]" 2 1881 1 69 PRO HB2 1 102 THR MG 2.800 . 6.000 5.506 5.357 5.848 . 0 0 "[ . 1 . 2 . 3]" 2 1882 1 44 ALA MB 1 45 MET HA 6.000 . 6.000 3.983 3.898 4.059 . 0 0 "[ . 1 . 2 . 3]" 2 1883 1 45 MET HB3 1 45 MET HG3 2.200 . 6.000 2.890 2.750 2.993 . 0 0 "[ . 1 . 2 . 3]" 2 1884 1 75 ARG HA 1 76 PRO HD3 6.000 . 6.000 2.643 2.571 2.726 . 0 0 "[ . 1 . 2 . 3]" 2 1885 1 126 ILE HA 1 126 ILE HG12 2.800 . 4.000 2.863 2.574 3.023 . 0 0 "[ . 1 . 2 . 3]" 2 1886 1 87 VAL MG1 1 126 ILE HG12 2.600 . 3.600 2.555 2.314 2.778 . 0 0 "[ . 1 . 2 . 3]" 2 1887 1 139 ARG HB2 1 139 ARG QD 2.500 . 3.500 2.670 2.149 3.127 . 0 0 "[ . 1 . 2 . 3]" 2 1888 1 36 LEU HB2 1 73 TYR QE 3.100 . 6.000 4.628 3.282 5.958 . 0 0 "[ . 1 . 2 . 3]" 2 1889 1 39 TYR QE 1 93 ILE QG 2.900 . 4.100 2.830 2.630 3.035 . 0 0 "[ . 1 . 2 . 3]" 2 1890 1 65 MET HB2 1 65 MET HG2 2.300 . 3.200 3.006 2.999 3.009 . 0 0 "[ . 1 . 2 . 3]" 2 1891 1 65 MET HB3 1 65 MET HG3 2.700 . 3.800 3.004 2.996 3.007 . 0 0 "[ . 1 . 2 . 3]" 2 1892 1 65 MET HB2 1 65 MET HG3 2.600 . 3.600 2.418 2.356 2.501 . 0 0 "[ . 1 . 2 . 3]" 2 1893 1 65 MET HB3 1 65 MET HG2 2.600 . 3.600 2.458 2.377 2.526 . 0 0 "[ . 1 . 2 . 3]" 2 1894 1 39 TYR QE 1 93 ILE MD 3.000 . 4.300 3.579 3.256 3.905 . 0 0 "[ . 1 . 2 . 3]" 2 1895 1 61 TYR QE 1 62 ARG HD3 3.200 . 4.700 3.538 2.996 5.566 0.866 24 1 "[ . 1 . 2 +. 3]" 2 1896 1 83 GLN HB3 1 129 TYR QE 3.000 . 6.000 3.438 2.775 4.703 . 0 0 "[ . 1 . 2 . 3]" 2 1897 1 62 ARG HB2 1 62 ARG HD2 3.200 2.300 4.300 3.562 3.458 3.861 . 0 0 "[ . 1 . 2 . 3]" 2 1898 1 62 ARG HA 1 62 ARG HB2 2.500 . 3.500 2.994 2.914 3.021 . 0 0 "[ . 1 . 2 . 3]" 2 1899 1 60 TYR HA 1 63 GLU QB 2.700 . 3.800 3.287 3.050 3.675 . 0 0 "[ . 1 . 2 . 3]" 2 1900 1 68 TYR QE 1 116 MET HB2 3.000 . 4.300 2.918 2.749 3.227 . 0 0 "[ . 1 . 2 . 3]" 2 1901 1 68 TYR QE 1 116 MET HB3 3.100 . 6.000 4.232 4.042 4.453 . 0 0 "[ . 1 . 2 . 3]" 2 1902 1 118 GLU HB3 1 118 GLU QG 2.500 . 3.500 2.379 2.125 2.479 . 0 0 "[ . 1 . 2 . 3]" 2 1903 1 45 MET HB2 1 48 PRO HD3 6.000 . 6.000 5.976 4.893 6.031 0.031 26 0 "[ . 1 . 2 . 3]" 2 1904 1 62 ARG HD2 1 62 ARG QG 2.600 . 3.500 2.454 2.139 2.530 . 0 0 "[ . 1 . 2 . 3]" 2 1905 1 62 ARG HA 1 62 ARG QG 2.600 . 6.000 2.667 2.202 2.976 . 0 0 "[ . 1 . 2 . 3]" 2 1906 1 131 ARG HA 1 134 GLN QB 2.500 . 3.500 3.318 2.945 3.467 . 0 0 "[ . 1 . 2 . 3]" 2 1907 1 97 GLN HA 1 97 GLN HB2 2.500 . 3.500 2.913 2.893 2.973 . 0 0 "[ . 1 . 2 . 3]" 2 1908 1 123 GLN HA 1 123 GLN HB2 2.500 . 3.500 3.006 2.992 3.016 . 0 0 "[ . 1 . 2 . 3]" 2 1909 1 59 ARG HA 1 59 ARG HG3 2.600 . 6.000 3.668 2.126 3.878 . 0 0 "[ . 1 . 2 . 3]" 2 1910 1 48 PRO HG2 1 50 ILE MD 2.800 . 4.000 3.947 3.806 4.008 0.008 7 0 "[ . 1 . 2 . 3]" 2 1911 1 48 PRO HA 1 48 PRO HG2 2.600 . 6.000 3.928 3.900 3.955 . 0 0 "[ . 1 . 2 . 3]" 2 1912 1 48 PRO HG2 1 120 VAL MG1 2.600 . 3.600 2.732 2.395 2.940 . 0 0 "[ . 1 . 2 . 3]" 2 1913 1 69 PRO HD3 1 69 PRO HG3 2.700 . 3.800 2.318 2.307 2.323 . 0 0 "[ . 1 . 2 . 3]" 2 1914 1 69 PRO HG3 1 121 VAL MG2 2.500 . 6.000 5.545 5.320 5.877 . 0 0 "[ . 1 . 2 . 3]" 2 1915 1 49 ILE HA 1 49 ILE HG12 2.600 . 3.600 3.282 3.191 3.350 . 0 0 "[ . 1 . 2 . 3]" 2 1916 1 131 ARG HA 1 131 ARG HG3 2.600 . 3.700 3.153 2.512 3.439 . 0 0 "[ . 1 . 2 . 3]" 2 1917 1 76 PRO HB2 1 76 PRO HG3 2.900 . 4.200 2.690 2.665 2.799 . 0 0 "[ . 1 . 2 . 3]" 2 1918 1 36 LEU HB2 1 36 LEU MD1 2.400 . 3.300 2.345 1.906 3.164 . 0 0 "[ . 1 . 2 . 3]" 2 1919 1 121 VAL MG2 1 124 MET ME 2.300 . 3.100 2.316 2.078 2.576 . 0 0 "[ . 1 . 2 . 3]" 2 1920 1 121 VAL HA 1 121 VAL MG2 2.100 . 2.800 2.241 2.163 2.343 . 0 0 "[ . 1 . 2 . 3]" 2 1921 1 94 THR MG 1 121 VAL MG2 2.100 . 2.900 1.811 1.676 1.974 . 0 0 "[ . 1 . 2 . 3]" 2 1922 1 68 TYR QD 1 120 VAL MG1 3.000 . 6.000 4.503 4.348 4.723 . 0 0 "[ . 1 . 2 . 3]" 2 1923 1 61 TYR QD 1 62 ARG HB2 6.000 . 6.000 4.767 4.250 5.010 . 0 0 "[ . 1 . 2 . 3]" 2 1924 1 45 MET HG3 1 72 VAL MG1 2.700 . 6.000 5.523 4.759 5.783 . 0 0 "[ . 1 . 2 . 3]" 2 1925 1 72 VAL MG1 1 94 THR HB 2.800 . 4.000 3.480 3.187 3.689 . 0 0 "[ . 1 . 2 . 3]" 2 1926 1 72 VAL MG1 1 124 MET HB3 2.200 . 3.000 2.040 1.830 2.397 . 0 0 "[ . 1 . 2 . 3]" 2 1927 1 72 VAL MG1 1 94 THR MG 2.300 . 3.100 2.025 1.779 2.275 . 0 0 "[ . 1 . 2 . 3]" 2 1928 1 72 VAL MG1 1 121 VAL HA 2.700 . 3.800 2.823 2.651 2.938 . 0 0 "[ . 1 . 2 . 3]" 2 1929 1 36 LEU MD2 1 36 LEU HG 2.300 . 3.200 2.107 2.079 2.129 . 0 0 "[ . 1 . 2 . 3]" 2 1930 1 72 VAL MG1 1 121 VAL MG1 2.300 . 3.200 1.848 1.614 2.087 . 0 0 "[ . 1 . 2 . 3]" 2 1931 1 121 VAL HA 1 121 VAL HB 2.500 . 3.500 3.018 3.010 3.022 . 0 0 "[ . 1 . 2 . 3]" 2 1932 1 94 THR HB 1 94 THR MG 2.100 . 2.800 2.114 2.092 2.134 . 0 0 "[ . 1 . 2 . 3]" 2 1933 1 127 THR HA 1 127 THR MG 2.100 . 2.800 2.523 2.461 2.597 . 0 0 "[ . 1 . 2 . 3]" 2 1934 1 45 MET ME 1 131 ARG HD3 6.000 . 6.000 5.001 3.503 5.761 . 0 0 "[ . 1 . 2 . 3]" 2 1935 1 59 ARG HA 1 62 ARG HD2 6.000 . 6.000 5.596 5.340 5.804 . 0 0 "[ . 1 . 2 . 3]" 2 1936 1 38 GLY HA3 1 75 ARG QD 6.000 . 6.000 4.284 3.167 5.901 . 0 0 "[ . 1 . 2 . 3]" 2 1937 1 81 SER HA 1 81 SER HB2 2.300 . 3.200 2.677 2.240 3.017 . 0 0 "[ . 1 . 2 . 3]" 2 1938 1 87 VAL MG2 1 125 CYS HB2 6.000 . 6.000 4.041 3.608 4.303 . 0 0 "[ . 1 . 2 . 3]" 2 1939 1 69 PRO HA 1 69 PRO HD2 2.900 . 4.200 3.921 3.911 3.930 . 0 0 "[ . 1 . 2 . 3]" 2 1940 1 46 SER HA 1 46 SER HB3 2.200 . 3.000 2.499 2.297 2.603 . 0 0 "[ . 1 . 2 . 3]" 2 1941 1 61 TYR HA 1 65 MET HG2 2.900 . 6.000 4.915 4.814 5.117 . 0 0 "[ . 1 . 2 . 3]" 2 1942 1 72 VAL MG2 1 124 MET HB3 2.300 . 3.200 2.571 2.290 2.737 . 0 0 "[ . 1 . 2 . 3]" 2 1943 1 48 PRO HA 1 120 VAL MG2 2.200 . 6.000 5.619 5.389 5.831 . 0 0 "[ . 1 . 2 . 3]" 2 1944 1 77 MET QG 1 86 PHE HA 6.000 . 6.000 4.887 4.061 5.515 . 0 0 "[ . 1 . 2 . 3]" 2 1945 1 45 MET ME 1 127 THR HA 2.800 . 6.000 4.811 4.583 5.012 . 0 0 "[ . 1 . 2 . 3]" 2 1946 1 45 MET ME 1 131 ARG HG2 2.400 . 6.000 5.891 5.479 6.439 0.439 19 0 "[ . 1 . 2 . 3]" 2 1947 1 45 MET ME 1 127 THR MG 1.900 . 2.500 2.414 2.101 2.523 0.023 21 0 "[ . 1 . 2 . 3]" 2 1948 1 45 MET ME 1 45 MET HG2 1.900 . 2.600 2.581 2.072 3.060 0.460 16 0 "[ . 1 . 2 . 3]" 2 1949 1 62 ARG HA 1 65 MET ME 2.200 . 6.000 3.449 2.657 3.718 . 0 0 "[ . 1 . 2 . 3]" 2 1950 1 61 TYR QD 1 65 MET ME 3.200 . 4.700 3.787 3.542 4.334 . 0 0 "[ . 1 . 2 . 3]" 2 1951 1 50 ILE HB 1 61 TYR QE 6.000 . 6.000 4.462 3.896 5.018 . 0 0 "[ . 1 . 2 . 3]" 2 1952 1 49 ILE MG 1 50 ILE HB 2.000 . 6.000 4.999 4.872 5.184 . 0 0 "[ . 1 . 2 . 3]" 2 1953 1 50 ILE HB 1 52 PHE QE 6.000 . 6.000 3.033 2.860 3.180 . 0 0 "[ . 1 . 2 . 3]" 2 1954 1 50 ILE MG 1 52 PHE HZ 2.900 . 4.100 3.580 2.998 3.917 . 0 0 "[ . 1 . 2 . 3]" 2 1955 1 50 ILE MG 1 116 MET QG 2.700 . 6.000 5.550 5.238 5.725 . 0 0 "[ . 1 . 2 . 3]" 2 1956 1 40 MET HB3 1 40 MET ME 2.200 . 3.000 3.010 2.833 3.058 0.058 27 0 "[ . 1 . 2 . 3]" 2 1957 1 77 MET ME 1 133 SER HA 2.000 . 2.700 2.416 1.949 2.715 0.015 2 0 "[ . 1 . 2 . 3]" 2 1958 1 77 MET HB2 1 77 MET ME 2.000 . 6.000 2.656 1.915 3.687 . 0 0 "[ . 1 . 2 . 3]" 2 1959 1 77 MET ME 1 136 TYR HB3 2.400 . 3.300 3.234 2.920 3.329 0.029 18 0 "[ . 1 . 2 . 3]" 2 1960 1 49 ILE HA 1 49 ILE HB 2.700 . 3.800 3.009 2.995 3.021 . 0 0 "[ . 1 . 2 . 3]" 2 1961 1 70 ASN HA 1 124 MET ME 2.200 . 3.000 2.336 1.977 2.698 . 0 0 "[ . 1 . 2 . 3]" 2 1962 1 142 SER HA 1 142 SER QB 2.400 . 3.300 2.367 2.158 2.540 . 0 0 "[ . 1 . 2 . 3]" 2 1963 1 57 GLU HA 1 60 TYR HB2 2.600 . 3.700 2.996 2.659 3.342 . 0 0 "[ . 1 . 2 . 3]" 2 1964 1 124 MET HA 1 124 MET HG3 2.500 . 3.500 3.152 3.056 3.334 . 0 0 "[ . 1 . 2 . 3]" 2 1965 1 62 ARG HA 1 62 ARG HD2 2.800 . 4.000 2.601 1.849 4.468 0.468 24 0 "[ . 1 . 2 . 3]" 2 1966 1 125 CYS HA 1 125 CYS HB2 2.600 . 3.700 3.021 3.009 3.027 . 0 0 "[ . 1 . 2 . 3]" 2 1967 1 57 GLU HA 1 57 GLU HB3 2.300 . 3.200 2.617 2.525 2.678 . 0 0 "[ . 1 . 2 . 3]" 2 1968 1 124 MET HA 1 124 MET HB3 2.100 . 2.900 2.564 2.501 2.595 . 0 0 "[ . 1 . 2 . 3]" 2 1969 1 117 MET HA 1 117 MET HB2 2.200 . 6.000 2.977 2.971 2.990 . 0 0 "[ . 1 . 2 . 3]" 2 1970 1 62 ARG HA 1 65 MET HG3 2.800 . 4.000 2.053 1.957 2.166 . 0 0 "[ . 1 . 2 . 3]" 2 1971 1 124 MET HA 1 124 MET HG2 2.400 . 3.300 2.316 2.272 2.383 . 0 0 "[ . 1 . 2 . 3]" 2 1972 1 59 ARG HA 1 59 ARG QB 2.000 . 2.700 2.351 2.153 2.478 . 0 0 "[ . 1 . 2 . 3]" 2 1973 1 52 PHE HA 1 52 PHE QD 3.100 . 6.000 2.726 2.447 2.920 . 0 0 "[ . 1 . 2 . 3]" 2 1974 1 137 TYR HA 1 137 TYR HB2 2.300 . 3.200 2.975 2.969 2.980 . 0 0 "[ . 1 . 2 . 3]" 2 1975 1 90 CYS HA 1 90 CYS HB2 2.400 . 3.300 2.319 2.285 2.350 . 0 0 "[ . 1 . 2 . 3]" 2 1976 1 90 CYS HA 1 90 CYS HB3 2.700 . 3.800 2.992 2.970 3.007 . 0 0 "[ . 1 . 2 . 3]" 2 1977 1 45 MET HB2 1 70 ASN HB2 6.000 . 6.000 5.992 5.427 6.050 0.050 22 0 "[ . 1 . 2 . 3]" 2 1978 1 58 ASP HA 1 58 ASP HB3 2.600 . 3.600 2.639 2.588 2.677 . 0 0 "[ . 1 . 2 . 3]" 2 1979 1 58 ASP HA 1 58 ASP HB2 2.400 . 3.300 2.989 2.971 3.006 . 0 0 "[ . 1 . 2 . 3]" 2 1980 1 119 ARG HA 1 119 ARG HB3 2.200 . 3.000 2.415 2.359 2.532 . 0 0 "[ . 1 . 2 . 3]" 2 1981 1 38 GLY HA3 1 39 TYR HA 2.200 . 6.000 4.516 4.495 4.528 . 0 0 "[ . 1 . 2 . 3]" 2 1982 1 39 TYR HA 1 75 ARG QG 2.700 . 3.800 2.397 1.861 3.820 0.020 19 0 "[ . 1 . 2 . 3]" 2 1983 1 39 TYR HA 1 39 TYR QB 2.200 . 3.000 2.396 2.364 2.421 . 0 0 "[ . 1 . 2 . 3]" 2 1984 1 63 GLU HA 1 63 GLU QB 1.900 . 2.600 2.407 2.144 2.506 . 0 0 "[ . 1 . 2 . 3]" 2 1985 1 132 GLU HA 1 132 GLU HG2 2.100 . 2.800 2.851 2.234 3.664 0.864 28 10 "[ * . ** * - ** .* + *]" 2 1986 1 113 ASP HA 1 113 ASP HB2 2.400 . 3.300 2.994 2.972 3.015 . 0 0 "[ . 1 . 2 . 3]" 2 1987 1 126 ILE HA 1 126 ILE MD 2.500 . 6.000 3.835 3.790 3.868 . 0 0 "[ . 1 . 2 . 3]" 2 1988 1 66 HIS HA 1 66 HIS HB2 2.400 . 3.300 3.012 2.987 3.026 . 0 0 "[ . 1 . 2 . 3]" 2 1989 1 77 MET HA 1 77 MET QG 2.400 . 2.700 2.167 2.021 2.497 . 0 0 "[ . 1 . 2 . 3]" 2 1990 1 73 TYR HA 1 73 TYR HB3 2.400 . 3.300 2.440 2.419 2.461 . 0 0 "[ . 1 . 2 . 3]" 2 1991 1 73 TYR HA 1 73 TYR HB2 2.400 . 3.300 3.028 3.024 3.031 . 0 0 "[ . 1 . 2 . 3]" 2 1992 1 68 TYR QB 1 69 PRO HG3 6.000 . 6.000 5.220 5.052 5.456 . 0 0 "[ . 1 . 2 . 3]" 2 1993 1 54 SER HA 1 54 SER HB3 2.100 . 2.800 2.436 2.298 2.584 . 0 0 "[ . 1 . 2 . 3]" 2 1994 1 54 SER HA 1 54 SER HB2 2.000 . 2.700 2.497 2.353 2.669 . 0 0 "[ . 1 . 2 . 3]" 2 1995 1 53 GLY HA2 1 54 SER HA 2.800 . 6.000 4.615 4.569 4.687 . 0 0 "[ . 1 . 2 . 3]" 2 1996 1 50 ILE MD 1 52 PHE HZ 2.900 . 6.000 4.474 4.155 4.627 . 0 0 "[ . 1 . 2 . 3]" 2 1997 1 50 ILE MD 1 50 ILE HG12 2.100 . 2.800 2.103 2.081 2.116 . 0 0 "[ . 1 . 2 . 3]" 2 1998 1 138 GLN HA 1 138 GLN HB3 2.100 . 2.800 2.507 2.449 2.553 . 0 0 "[ . 1 . 2 . 3]" 2 1999 1 67 ARG HA 1 67 ARG HG3 2.300 . 3.200 2.713 2.236 3.148 . 0 0 "[ . 1 . 2 . 3]" 2 2000 1 93 ILE H 1 93 ILE HB 2.600 . 3.700 2.271 2.217 2.328 . 0 0 "[ . 1 . 2 . 3]" 2 2001 1 45 MET H 1 45 MET HB3 3.100 . 4.500 3.614 3.540 3.687 . 0 0 "[ . 1 . 2 . 3]" 2 2002 1 45 MET H 1 45 MET HB2 3.100 . 4.500 3.579 3.515 3.650 . 0 0 "[ . 1 . 2 . 3]" 2 2003 1 93 ILE HB 1 93 ILE MD 2.500 . 3.500 3.230 3.182 3.239 . 0 0 "[ . 1 . 2 . 3]" 2 2004 1 132 GLU H 1 132 GLU HG2 2.900 . 4.200 3.408 2.927 4.075 . 0 0 "[ . 1 . 2 . 3]" 2 2005 1 132 GLU H 1 132 GLU HG3 3.000 . 4.300 3.878 3.224 4.200 . 0 0 "[ . 1 . 2 . 3]" 2 2006 1 115 LYS HA 1 118 GLU QG 2.800 . 4.000 3.642 3.056 3.895 . 0 0 "[ . 1 . 2 . 3]" 2 2007 1 98 HIS HD2 1 117 MET ME 6.000 . 6.000 5.291 4.851 5.879 . 0 0 "[ . 1 . 2 . 3]" 2 2008 1 114 VAL H 1 117 MET ME 6.000 . 6.000 3.848 3.605 4.133 . 0 0 "[ . 1 . 2 . 3]" 2 2009 1 117 MET H 1 117 MET ME 6.000 . 6.000 4.154 3.849 4.351 . 0 0 "[ . 1 . 2 . 3]" 2 2010 1 49 ILE HB 1 49 ILE MD 2.600 . 3.600 3.231 3.223 3.239 . 0 0 "[ . 1 . 2 . 3]" 2 2011 1 122 GLU H 1 122 GLU HG2 2.800 . 4.000 3.484 3.110 3.992 . 0 0 "[ . 1 . 2 . 3]" 2 2012 1 122 GLU HG2 1 123 GLN H 3.000 . 4.400 2.403 2.101 3.609 . 0 0 "[ . 1 . 2 . 3]" 2 2013 1 107 GLU H 1 107 GLU HG2 2.900 . 6.000 4.620 3.807 5.130 . 0 0 "[ . 1 . 2 . 3]" 2 2014 1 107 GLU HG2 1 108 ASN H 3.000 . 4.400 3.331 2.725 4.068 . 0 0 "[ . 1 . 2 . 3]" 2 2015 1 107 GLU H 1 107 GLU HG3 3.000 . 6.000 4.457 4.121 5.023 . 0 0 "[ . 1 . 2 . 3]" 2 2016 1 107 GLU HG3 1 108 ASN H 2.700 . 3.800 2.552 1.828 3.690 . 0 0 "[ . 1 . 2 . 3]" 2 2017 1 127 THR HA 1 130 GLU HG2 2.900 . 6.000 5.346 4.311 5.859 . 0 0 "[ . 1 . 2 . 3]" 2 2018 1 130 GLU HA 1 130 GLU HG2 2.400 . 3.300 2.362 2.077 3.570 0.270 3 0 "[ . 1 . 2 . 3]" 2 2019 1 126 ILE MG 1 130 GLU HG3 2.800 . 4.000 3.568 3.235 4.223 0.223 12 0 "[ . 1 . 2 . 3]" 2 2020 1 130 GLU HB2 1 130 GLU HG3 2.200 . 3.000 2.313 2.205 2.989 . 0 0 "[ . 1 . 2 . 3]" 2 2021 1 130 GLU H 1 130 GLU HG2 2.600 . 3.700 3.414 2.699 4.120 0.420 15 0 "[ . 1 . 2 . 3]" 2 2022 1 130 GLU H 1 130 GLU HG3 2.600 . 6.000 3.232 2.490 3.559 . 0 0 "[ . 1 . 2 . 3]" 2 2023 1 105 LYS HA 1 106 GLY H 6.000 . 6.000 3.376 3.202 3.497 . 0 0 "[ . 1 . 2 . 3]" 2 2024 1 85 ASN HA 1 89 ASP H 6.000 . 6.000 3.881 3.531 4.433 . 0 0 "[ . 1 . 2 . 3]" 2 2025 1 107 GLU HA 1 108 ASN HB3 6.000 . 6.000 4.830 4.275 5.470 . 0 0 "[ . 1 . 2 . 3]" 2 2026 1 126 ILE MD 1 127 THR H 6.000 . 6.000 4.234 3.996 4.479 . 0 0 "[ . 1 . 2 . 3]" 2 2027 1 123 GLN HE22 1 126 ILE MD 6.000 . 6.000 5.778 5.549 6.003 0.003 21 0 "[ . 1 . 2 . 3]" 2 2028 1 40 MET HB3 1 41 LEU H 2.900 . 4.100 2.673 2.576 2.739 . 0 0 "[ . 1 . 2 . 3]" 2 2029 1 41 LEU MD2 1 71 GLN HG2 2.900 . 4.100 3.511 3.266 3.938 . 0 0 "[ . 1 . 2 . 3]" 2 2030 1 116 MET HB2 1 116 MET QG 2.600 . 3.600 2.279 2.141 2.325 . 0 0 "[ . 1 . 2 . 3]" 2 2031 1 71 GLN HE21 1 71 GLN HG2 3.200 . 4.600 2.469 2.237 3.474 . 0 0 "[ . 1 . 2 . 3]" 2 2032 1 134 GLN H 1 134 GLN QG 2.600 . 3.700 3.045 2.365 3.451 . 0 0 "[ . 1 . 2 . 3]" 2 2033 1 123 GLN QG 1 124 MET H 3.100 . 4.500 3.620 3.505 3.724 . 0 0 "[ . 1 . 2 . 3]" 2 2034 1 50 ILE HG13 1 123 GLN HG3 2.600 . 6.000 4.362 4.182 4.629 . 0 0 "[ . 1 . 2 . 3]" 2 2035 1 120 VAL HA 1 123 GLN HG3 2.800 . 4.000 2.517 2.404 2.624 . 0 0 "[ . 1 . 2 . 3]" 2 2036 1 51 HIS HA 1 53 GLY H 6.000 . 6.000 5.262 4.714 5.777 . 0 0 "[ . 1 . 2 . 3]" 2 2037 1 71 GLN HA 1 71 GLN HE22 6.000 . 6.000 5.635 5.432 5.918 . 0 0 "[ . 1 . 2 . 3]" 2 2038 1 97 GLN HA 1 97 GLN HG2 2.700 . 3.800 3.347 3.126 3.622 . 0 0 "[ . 1 . 2 . 3]" 2 2039 1 97 GLN H 1 97 GLN HG3 2.800 . 6.000 4.555 4.327 4.613 . 0 0 "[ . 1 . 2 . 3]" 2 2040 1 135 ALA HA 1 138 GLN H 6.000 . 6.000 3.563 3.357 3.813 . 0 0 "[ . 1 . 2 . 3]" 2 2041 1 135 ALA HA 1 136 TYR H 6.000 . 6.000 3.479 3.433 3.516 . 0 0 "[ . 1 . 2 . 3]" 2 2042 1 71 GLN H 1 71 GLN HB3 3.300 . 4.900 3.764 3.735 3.795 . 0 0 "[ . 1 . 2 . 3]" 2 2043 1 71 GLN HB3 1 71 GLN HE21 3.300 . 4.900 2.414 2.126 2.946 . 0 0 "[ . 1 . 2 . 3]" 2 2044 1 40 MET HA 1 41 LEU H 6.000 . 6.000 2.359 2.347 2.379 . 0 0 "[ . 1 . 2 . 3]" 2 2045 1 116 MET H 1 116 MET HB3 3.200 . 4.700 3.555 3.536 3.585 . 0 0 "[ . 1 . 2 . 3]" 2 2046 1 117 MET H 1 117 MET HB3 3.000 . 4.300 3.503 3.490 3.528 . 0 0 "[ . 1 . 2 . 3]" 2 2047 1 117 MET HA 1 117 MET HG3 2.700 . 3.800 3.136 2.278 3.263 . 0 0 "[ . 1 . 2 . 3]" 2 2048 1 105 LYS H 1 105 LYS HB3 2.800 . 4.000 3.529 3.468 3.610 . 0 0 "[ . 1 . 2 . 3]" 2 2049 1 124 MET H 1 124 MET HG2 3.200 . 4.700 3.433 3.117 3.555 . 0 0 "[ . 1 . 2 . 3]" 2 2050 1 124 MET HB2 1 124 MET HG3 2.600 . 3.700 2.330 2.277 2.375 . 0 0 "[ . 1 . 2 . 3]" 2 2051 1 124 MET H 1 124 MET HG3 3.100 . 4.500 2.562 2.430 2.634 . 0 0 "[ . 1 . 2 . 3]" 2 2052 1 48 PRO HB2 1 49 ILE H 3.000 . 4.300 3.699 3.574 3.816 . 0 0 "[ . 1 . 2 . 3]" 2 2053 1 52 PHE HZ 1 120 VAL HB 3.100 . 6.000 5.678 5.185 5.921 . 0 0 "[ . 1 . 2 . 3]" 2 2054 1 96 LYS QB 1 97 GLN H 2.900 . 4.200 3.003 2.954 3.061 . 0 0 "[ . 1 . 2 . 3]" 2 2055 1 120 VAL HB 1 121 VAL H 3.000 . 4.300 2.644 2.557 2.715 . 0 0 "[ . 1 . 2 . 3]" 2 2056 1 39 TYR QD 1 93 ILE MD 6.000 . 6.000 4.095 3.667 4.430 . 0 0 "[ . 1 . 2 . 3]" 2 2057 1 93 ILE MD 1 94 THR H 6.000 . 6.000 4.638 4.537 4.709 . 0 0 "[ . 1 . 2 . 3]" 2 2058 1 69 PRO HB3 1 70 ASN H 3.100 . 4.500 3.292 3.134 3.591 . 0 0 "[ . 1 . 2 . 3]" 2 2059 1 40 MET H 1 40 MET QG 2.700 . 3.800 3.370 2.786 3.766 . 0 0 "[ . 1 . 2 . 3]" 2 2060 1 69 PRO HB2 1 71 GLN H 3.100 . 4.500 3.305 3.029 3.824 . 0 0 "[ . 1 . 2 . 3]" 2 2061 1 69 PRO HB3 1 71 GLN H 2.900 . 4.100 3.341 3.265 3.493 . 0 0 "[ . 1 . 2 . 3]" 2 2062 1 69 PRO HB3 1 102 THR MG 2.700 . 6.000 4.266 4.121 4.671 . 0 0 "[ . 1 . 2 . 3]" 2 2063 1 68 TYR HA 1 68 TYR QE 6.000 . 6.000 4.348 4.270 4.410 . 0 0 "[ . 1 . 2 . 3]" 2 2064 1 100 VAL HA 1 100 VAL HB 2.400 . 3.300 3.018 3.015 3.020 . 0 0 "[ . 1 . 2 . 3]" 2 2065 1 115 LYS HB3 1 116 MET H 2.700 . 3.800 2.375 2.233 3.437 . 0 0 "[ . 1 . 2 . 3]" 2 2066 1 49 ILE MD 1 61 TYR QD 6.000 . 6.000 4.743 4.406 5.053 . 0 0 "[ . 1 . 2 . 3]" 2 2067 1 49 ILE MD 1 50 ILE H 6.000 . 6.000 3.918 3.764 4.138 . 0 0 "[ . 1 . 2 . 3]" 2 2068 1 98 HIS HB2 1 99 THR MG 3.100 . 4.500 3.747 3.616 3.958 . 0 0 "[ . 1 . 2 . 3]" 2 2069 1 114 VAL HB 1 115 LYS H 2.900 . 6.000 4.024 3.946 4.080 . 0 0 "[ . 1 . 2 . 3]" 2 2070 1 114 VAL H 1 114 VAL HB 2.700 . 6.000 3.630 3.624 3.635 . 0 0 "[ . 1 . 2 . 3]" 2 2071 1 98 HIS H 1 98 HIS HB3 3.000 . 4.300 3.555 3.532 3.581 . 0 0 "[ . 1 . 2 . 3]" 2 2072 1 45 MET H 1 45 MET HG3 2.900 . 4.200 2.759 1.888 3.462 . 0 0 "[ . 1 . 2 . 3]" 2 2073 1 45 MET H 1 45 MET HG2 2.900 . 4.200 2.351 1.779 3.174 0.021 16 0 "[ . 1 . 2 . 3]" 2 2074 1 45 MET HG2 1 46 SER H 3.300 . 4.900 2.979 2.139 4.352 . 0 0 "[ . 1 . 2 . 3]" 2 2075 1 107 GLU HB2 1 108 ASN H 2.800 . 4.000 3.664 3.346 3.874 . 0 0 "[ . 1 . 2 . 3]" 2 2076 1 126 ILE H 1 126 ILE HG13 3.100 . 4.500 2.374 2.250 2.546 . 0 0 "[ . 1 . 2 . 3]" 2 2077 1 126 ILE H 1 126 ILE HG12 3.100 . 4.500 3.816 3.655 3.942 . 0 0 "[ . 1 . 2 . 3]" 2 2078 1 139 ARG HB2 1 140 GLY H 3.300 . 4.900 3.541 3.069 4.263 . 0 0 "[ . 1 . 2 . 3]" 2 2079 1 139 ARG HA 1 139 ARG HB2 2.400 . 3.300 2.827 2.272 2.961 . 0 0 "[ . 1 . 2 . 3]" 2 2080 1 139 ARG HA 1 139 ARG HB3 2.400 . 3.300 2.808 2.679 2.983 . 0 0 "[ . 1 . 2 . 3]" 2 2081 1 139 ARG H 1 139 ARG HB3 2.600 . 3.600 3.205 2.159 3.458 . 0 0 "[ . 1 . 2 . 3]" 2 2082 1 139 ARG H 1 139 ARG HB2 2.600 . 3.700 2.210 2.070 3.472 . 0 0 "[ . 1 . 2 . 3]" 2 2083 1 65 MET HA 1 65 MET HG3 3.000 . 4.300 3.194 3.082 3.294 . 0 0 "[ . 1 . 2 . 3]" 2 2084 1 62 ARG HA 1 65 MET HG2 3.000 . 4.300 2.855 2.623 3.256 . 0 0 "[ . 1 . 2 . 3]" 2 2085 1 95 ILE H 1 95 ILE HG12 2.900 . 6.000 4.249 4.182 4.322 . 0 0 "[ . 1 . 2 . 3]" 2 2086 1 95 ILE HG13 1 95 ILE MG 2.500 . 3.500 2.918 2.828 3.009 . 0 0 "[ . 1 . 2 . 3]" 2 2087 1 57 GLU H 1 57 GLU HB3 3.000 . 4.400 3.529 3.480 3.582 . 0 0 "[ . 1 . 2 . 3]" 2 2088 1 95 ILE HA 1 95 ILE HG12 2.500 . 3.500 3.197 3.056 3.313 . 0 0 "[ . 1 . 2 . 3]" 2 2089 1 119 ARG H 1 119 ARG HB3 2.700 . 3.800 3.588 3.568 3.596 . 0 0 "[ . 1 . 2 . 3]" 2 2090 1 63 GLU QB 1 64 ASN HD21 3.000 . 4.300 2.893 2.534 4.054 . 0 0 "[ . 1 . 2 . 3]" 2 2091 1 62 ARG H 1 62 ARG HB3 3.100 . 4.500 3.552 3.400 3.599 . 0 0 "[ . 1 . 2 . 3]" 2 2092 1 47 ARG H 1 47 ARG HB3 3.000 . 4.300 3.416 2.748 3.591 . 0 0 "[ . 1 . 2 . 3]" 2 2093 1 51 HIS H 1 51 HIS HB3 2.900 . 4.200 3.676 3.525 3.777 . 0 0 "[ . 1 . 2 . 3]" 2 2094 1 132 GLU H 1 132 GLU HB2 2.700 . 3.800 2.225 2.183 2.298 . 0 0 "[ . 1 . 2 . 3]" 2 2095 1 111 LYS QD 1 115 LYS H 3.200 . 6.000 5.498 4.540 6.016 0.016 5 0 "[ . 1 . 2 . 3]" 2 2096 1 68 TYR QD 1 69 PRO HD2 6.000 . 6.000 2.206 1.651 2.595 . 0 0 "[ . 1 . 2 . 3]" 2 2097 1 69 PRO HD2 1 102 THR MG 6.000 . 6.000 5.550 5.110 5.802 . 0 0 "[ . 1 . 2 . 3]" 2 2098 1 118 GLU HB2 1 119 ARG H 3.000 . 4.400 2.761 2.647 2.853 . 0 0 "[ . 1 . 2 . 3]" 2 2099 1 122 GLU H 1 122 GLU HB2 3.000 . 4.300 3.309 3.109 3.450 . 0 0 "[ . 1 . 2 . 3]" 2 2100 1 118 GLU HB3 1 119 ARG H 3.100 . 4.500 3.293 3.196 3.396 . 0 0 "[ . 1 . 2 . 3]" 2 2101 1 115 LYS HA 1 118 GLU HB2 3.000 . 4.200 3.095 2.731 3.248 . 0 0 "[ . 1 . 2 . 3]" 2 2102 1 118 GLU H 1 118 GLU HB2 2.800 . 4.000 2.209 2.149 2.270 . 0 0 "[ . 1 . 2 . 3]" 2 2103 1 118 GLU H 1 118 GLU HB3 2.800 . 4.000 3.505 3.468 3.534 . 0 0 "[ . 1 . 2 . 3]" 2 2104 1 138 GLN H 1 138 GLN HB3 2.600 . 3.700 2.570 2.511 2.639 . 0 0 "[ . 1 . 2 . 3]" 2 2105 1 130 GLU H 1 130 GLU HB3 2.900 . 4.100 3.519 3.434 3.571 . 0 0 "[ . 1 . 2 . 3]" 2 2106 1 88 HIS QB 1 89 ASP H 3.100 2.300 4.500 2.666 2.403 3.344 . 0 0 "[ . 1 . 2 . 3]" 2 2107 1 97 GLN H 1 97 GLN HB3 2.800 . 4.000 3.350 3.303 3.478 . 0 0 "[ . 1 . 2 . 3]" 2 2108 1 72 VAL MG2 1 128 GLN QB 2.900 . 4.100 2.918 2.574 3.480 . 0 0 "[ . 1 . 2 . 3]" 2 2109 1 100 VAL MG2 1 101 THR HB 2.600 . 6.000 5.503 5.431 5.561 . 0 0 "[ . 1 . 2 . 3]" 2 2110 1 101 THR H 1 101 THR HB 2.500 . 3.500 2.907 2.797 2.949 . 0 0 "[ . 1 . 2 . 3]" 2 2111 1 123 GLN H 1 123 GLN HB3 2.800 . 4.000 3.579 3.559 3.592 . 0 0 "[ . 1 . 2 . 3]" 2 2112 1 123 GLN HB3 1 124 MET H 3.100 . 4.500 3.816 3.756 3.912 . 0 0 "[ . 1 . 2 . 3]" 2 2113 1 123 GLN HB2 1 124 MET H 3.200 . 4.700 2.514 2.423 2.609 . 0 0 "[ . 1 . 2 . 3]" 2 2114 1 104 THR HB 1 105 LYS H 2.700 . 3.800 3.376 3.117 3.784 . 0 0 "[ . 1 . 2 . 3]" 2 2115 1 103 THR HB 1 104 THR H 2.700 . 3.800 3.200 2.894 3.806 0.006 19 0 "[ . 1 . 2 . 3]" 2 2116 1 104 THR H 1 104 THR HB 2.500 . 3.500 2.735 2.633 2.838 . 0 0 "[ . 1 . 2 . 3]" 2 2117 1 123 GLN H 1 123 GLN HB2 2.900 . 4.100 2.764 2.682 2.842 . 0 0 "[ . 1 . 2 . 3]" 2 2118 1 99 THR H 1 99 THR HB 2.700 . 6.000 3.609 3.592 3.619 . 0 0 "[ . 1 . 2 . 3]" 2 2119 1 110 THR HB 1 112 THR HB 2.600 . 6.000 4.173 3.660 4.743 . 0 0 "[ . 1 . 2 . 3]" 2 2120 1 94 THR H 1 94 THR HA 3.000 . 4.300 2.773 2.735 2.807 . 0 0 "[ . 1 . 2 . 3]" 2 2121 1 67 ARG H 1 67 ARG HG3 3.200 . 4.600 2.588 2.002 3.377 . 0 0 "[ . 1 . 2 . 3]" 2 2122 1 49 ILE H 1 49 ILE HG13 2.900 . 4.200 3.634 3.539 3.711 . 0 0 "[ . 1 . 2 . 3]" 2 2123 1 139 ARG H 1 139 ARG HG3 2.900 . 4.100 3.610 3.099 4.421 0.321 4 0 "[ . 1 . 2 . 3]" 2 2124 1 139 ARG H 1 139 ARG HG2 2.800 . 6.000 4.026 2.952 4.339 . 0 0 "[ . 1 . 2 . 3]" 2 2125 1 131 ARG H 1 131 ARG HG3 3.000 . 4.300 2.383 2.051 2.881 . 0 0 "[ . 1 . 2 . 3]" 2 2126 1 67 ARG H 1 67 ARG HG2 3.200 . 4.700 3.925 3.475 4.335 . 0 0 "[ . 1 . 2 . 3]" 2 2127 1 36 LEU HA 1 36 LEU HG 3.600 2.600 4.800 2.937 2.508 4.275 0.092 20 0 "[ . 1 . 2 . 3]" 2 2128 1 131 ARG HE 1 131 ARG HG3 2.600 . 3.700 2.861 2.421 3.883 0.183 16 0 "[ . 1 . 2 . 3]" 2 2129 1 119 ARG H 1 119 ARG HG3 2.700 . 6.000 3.384 3.179 3.703 . 0 0 "[ . 1 . 2 . 3]" 2 2130 1 119 ARG HD3 1 119 ARG HG2 2.600 . 3.700 2.352 2.225 2.670 . 0 0 "[ . 1 . 2 . 3]" 2 2131 1 119 ARG HD2 1 119 ARG HG2 2.600 . 3.600 2.953 2.437 3.016 . 0 0 "[ . 1 . 2 . 3]" 2 2132 1 50 ILE MG 1 119 ARG HG2 2.900 . 4.200 3.898 3.713 4.164 . 0 0 "[ . 1 . 2 . 3]" 2 2133 1 50 ILE H 1 50 ILE HG13 3.000 . 4.300 3.508 3.275 3.658 . 0 0 "[ . 1 . 2 . 3]" 2 2134 1 87 VAL HA 1 87 VAL HB 2.900 . 4.100 2.418 2.322 2.495 . 0 0 "[ . 1 . 2 . 3]" 2 2135 1 50 ILE H 1 50 ILE HG12 3.300 . 4.900 2.318 2.013 2.477 . 0 0 "[ . 1 . 2 . 3]" 2 2136 1 87 VAL HA 1 125 CYS HB2 2.600 . 3.600 3.158 2.875 3.446 . 0 0 "[ . 1 . 2 . 3]" 2 2137 1 41 LEU MD1 1 71 GLN HE21 3.000 . 4.300 3.586 2.926 4.003 . 0 0 "[ . 1 . 2 . 3]" 2 2138 1 112 THR H 1 112 THR HA 2.800 . 4.000 2.837 2.830 2.850 . 0 0 "[ . 1 . 2 . 3]" 2 2139 1 126 ILE HA 1 129 TYR HB3 2.700 . 3.800 2.577 2.228 2.842 . 0 0 "[ . 1 . 2 . 3]" 2 2140 1 126 ILE HA 1 129 TYR HB2 2.800 . 4.000 3.021 2.794 3.306 . 0 0 "[ . 1 . 2 . 3]" 2 2141 1 126 ILE H 1 126 ILE HA 2.800 . 4.000 2.826 2.808 2.854 . 0 0 "[ . 1 . 2 . 3]" 2 2142 1 87 VAL MG2 1 126 ILE HA 2.500 . 6.000 4.494 4.323 4.834 . 0 0 "[ . 1 . 2 . 3]" 2 2143 1 37 GLY HA2 1 38 GLY H 6.000 . 6.000 3.542 3.409 3.568 . 0 0 "[ . 1 . 2 . 3]" 2 2144 1 111 LYS H 1 111 LYS HG3 3.200 . 4.600 3.339 1.530 4.583 0.470 2 0 "[ . 1 . 2 . 3]" 2 2145 1 91 VAL H 1 91 VAL HA 2.700 . 3.800 2.817 2.811 2.823 . 0 0 "[ . 1 . 2 . 3]" 2 2146 1 105 LYS QE 1 105 LYS QG 2.700 . 3.800 2.128 1.938 2.508 . 0 0 "[ . 1 . 2 . 3]" 2 2147 1 73 TYR H 1 121 VAL MG1 2.900 . 6.000 4.262 4.088 4.385 . 0 0 "[ . 1 . 2 . 3]" 2 2148 1 121 VAL HA 1 121 VAL MG1 2.000 . 6.000 2.513 2.429 2.592 . 0 0 "[ . 1 . 2 . 3]" 2 2149 1 121 VAL H 1 121 VAL MG1 2.900 . 4.200 3.739 3.716 3.755 . 0 0 "[ . 1 . 2 . 3]" 2 2150 1 105 LYS H 1 105 LYS QG 3.100 . 4.500 3.004 2.500 3.878 . 0 0 "[ . 1 . 2 . 3]" 2 2151 1 115 LYS HA 1 115 LYS HG3 2.700 . 3.800 3.497 3.411 3.606 . 0 0 "[ . 1 . 2 . 3]" 2 2152 1 54 SER H 1 54 SER HB3 2.900 . 4.200 3.407 3.060 3.696 . 0 0 "[ . 1 . 2 . 3]" 2 2153 1 106 GLY HA3 1 107 GLU H 6.000 . 6.000 3.303 3.174 3.567 . 0 0 "[ . 1 . 2 . 3]" 2 2154 1 94 THR H 1 121 VAL MG1 3.000 . 4.300 3.792 3.623 3.955 . 0 0 "[ . 1 . 2 . 3]" 2 2155 1 99 THR H 1 99 THR HA 2.700 . 3.800 2.801 2.776 2.852 . 0 0 "[ . 1 . 2 . 3]" 2 2156 1 54 SER H 1 54 SER HB2 2.600 . 6.000 3.897 3.718 4.060 . 0 0 "[ . 1 . 2 . 3]" 2 2157 1 54 SER HB2 1 56 TYR H 2.900 . 6.000 3.348 2.775 3.808 . 0 0 "[ . 1 . 2 . 3]" 2 2158 1 115 LYS QE 1 115 LYS HG2 2.700 . 3.800 3.265 1.937 3.572 . 0 0 "[ . 1 . 2 . 3]" 2 2159 1 87 VAL MG1 1 88 HIS H 2.900 . 4.100 3.899 3.691 4.013 . 0 0 "[ . 1 . 2 . 3]" 2 2160 1 87 VAL HA 1 87 VAL MG1 2.200 . 3.000 2.365 2.182 2.517 . 0 0 "[ . 1 . 2 . 3]" 2 2161 1 87 VAL H 1 87 VAL MG1 2.600 . 3.600 2.211 1.875 2.489 . 0 0 "[ . 1 . 2 . 3]" 2 2162 1 87 VAL MG1 1 125 CYS HB2 2.500 . 3.500 2.903 2.444 3.398 . 0 0 "[ . 1 . 2 . 3]" 2 2163 1 50 ILE HG13 1 120 VAL HA 2.700 . 3.800 3.093 2.945 3.380 . 0 0 "[ . 1 . 2 . 3]" 2 2164 1 95 ILE HG12 1 121 VAL MG2 2.200 . 6.000 3.769 3.571 3.975 . 0 0 "[ . 1 . 2 . 3]" 2 2165 1 121 VAL MG2 1 122 GLU H 3.100 . 4.500 4.024 3.997 4.061 . 0 0 "[ . 1 . 2 . 3]" 2 2166 1 42 GLY HA3 1 43 SER H 6.000 . 6.000 3.280 3.261 3.302 . 0 0 "[ . 1 . 2 . 3]" 2 2167 1 42 GLY HA2 1 43 SER H 6.000 . 6.000 2.136 2.131 2.145 . 0 0 "[ . 1 . 2 . 3]" 2 2168 1 119 ARG H 1 120 VAL MG1 3.200 . 6.000 5.847 5.799 5.910 . 0 0 "[ . 1 . 2 . 3]" 2 2169 1 120 VAL MG1 1 121 VAL H 3.000 . 4.300 3.509 3.367 3.631 . 0 0 "[ . 1 . 2 . 3]" 2 2170 1 70 ASN HA 1 120 VAL MG1 2.900 . 6.000 4.163 3.911 4.325 . 0 0 "[ . 1 . 2 . 3]" 2 2171 1 120 VAL H 1 120 VAL MG1 2.500 . 6.000 3.757 3.743 3.764 . 0 0 "[ . 1 . 2 . 3]" 2 2172 1 103 THR H 1 103 THR HA 2.500 . 3.500 2.845 2.838 2.850 . 0 0 "[ . 1 . 2 . 3]" 2 2173 1 103 THR HA 1 106 GLY H 2.900 . 6.000 4.031 3.673 4.456 . 0 0 "[ . 1 . 2 . 3]" 2 2174 1 103 THR HA 1 104 THR H 2.700 . 3.800 3.443 3.378 3.495 . 0 0 "[ . 1 . 2 . 3]" 2 2175 1 72 VAL MG1 1 124 MET HB2 2.200 . 3.000 2.178 1.949 2.302 . 0 0 "[ . 1 . 2 . 3]" 2 2176 1 72 VAL H 1 72 VAL MG1 2.500 . 3.500 3.117 2.929 3.222 . 0 0 "[ . 1 . 2 . 3]" 2 2177 1 72 VAL MG1 1 124 MET ME 2.200 . 3.000 2.143 1.900 2.421 . 0 0 "[ . 1 . 2 . 3]" 2 2178 1 72 VAL MG1 1 124 MET H 3.100 . 4.500 4.070 3.965 4.168 . 0 0 "[ . 1 . 2 . 3]" 2 2179 1 91 VAL QG 1 122 GLU H 2.700 . 3.800 2.897 2.662 3.040 . 0 0 "[ . 1 . 2 . 3]" 2 2180 1 91 VAL QG 1 125 CYS HB2 2.700 . 6.000 3.050 2.793 3.291 . 0 0 "[ . 1 . 2 . 3]" 2 2181 1 103 THR H 1 104 THR HA 3.200 . 6.000 5.192 5.153 5.229 . 0 0 "[ . 1 . 2 . 3]" 2 2182 1 104 THR HA 1 106 GLY H 3.000 . 4.300 3.675 3.399 4.035 . 0 0 "[ . 1 . 2 . 3]" 2 2183 1 104 THR H 1 104 THR HA 2.400 . 3.300 2.929 2.888 2.949 . 0 0 "[ . 1 . 2 . 3]" 2 2184 1 104 THR HA 1 105 LYS H 2.500 . 6.000 3.337 3.155 3.434 . 0 0 "[ . 1 . 2 . 3]" 2 2185 1 43 SER HB3 1 44 ALA H 2.500 . 6.000 3.598 3.483 3.745 . 0 0 "[ . 1 . 2 . 3]" 2 2186 1 141 SER H 1 141 SER QB 2.900 . 4.100 2.885 2.319 3.428 . 0 0 "[ . 1 . 2 . 3]" 2 2187 1 136 TYR QE 1 139 ARG QD 6.000 . 6.000 4.918 3.009 5.893 . 0 0 "[ . 1 . 2 . 3]" 2 2188 1 43 SER H 1 43 SER HB2 2.500 . 6.000 3.582 3.565 3.587 . 0 0 "[ . 1 . 2 . 3]" 2 2189 1 109 PHE H 1 114 VAL MG1 3.200 . 6.000 5.394 5.293 5.504 . 0 0 "[ . 1 . 2 . 3]" 2 2190 1 114 VAL MG1 1 115 LYS H 2.700 . 6.000 3.921 3.860 3.957 . 0 0 "[ . 1 . 2 . 3]" 2 2191 1 109 PHE HB3 1 114 VAL MG1 2.400 . 3.300 2.567 2.439 2.726 . 0 0 "[ . 1 . 2 . 3]" 2 2192 1 69 PRO HA 1 69 PRO HG3 2.700 . 3.800 3.122 2.952 3.297 . 0 0 "[ . 1 . 2 . 3]" 2 2193 1 94 THR H 1 94 THR MG 2.800 . 4.000 3.776 3.771 3.787 . 0 0 "[ . 1 . 2 . 3]" 2 2194 1 94 THR MG 1 95 ILE HA 2.500 . 6.000 3.391 3.299 3.567 . 0 0 "[ . 1 . 2 . 3]" 2 2195 1 73 TYR H 1 94 THR MG 2.500 . 3.500 3.333 3.178 3.518 0.018 25 0 "[ . 1 . 2 . 3]" 2 2196 1 127 THR MG 1 130 GLU H 3.300 . 4.800 4.577 4.428 4.700 . 0 0 "[ . 1 . 2 . 3]" 2 2197 1 127 THR H 1 127 THR MG 2.800 . 4.000 3.747 3.713 3.763 . 0 0 "[ . 1 . 2 . 3]" 2 2198 1 127 THR MG 1 131 ARG H 3.300 . 4.900 4.278 4.079 4.489 . 0 0 "[ . 1 . 2 . 3]" 2 2199 1 127 THR MG 1 131 ARG HE 2.900 . 4.100 2.312 1.879 4.127 0.027 10 0 "[ . 1 . 2 . 3]" 2 2200 1 46 SER H 1 46 SER HB3 2.300 . 6.000 3.409 2.522 3.805 . 0 0 "[ . 1 . 2 . 3]" 2 2201 1 45 MET HA 1 46 SER HB3 2.500 . 6.000 4.537 4.394 4.931 . 0 0 "[ . 1 . 2 . 3]" 2 2202 1 46 SER HB3 1 47 ARG H 2.700 . 6.000 4.322 4.033 4.424 . 0 0 "[ . 1 . 2 . 3]" 2 2203 1 100 VAL HB 1 100 VAL MG1 1.900 . 2.500 2.100 2.084 2.130 . 0 0 "[ . 1 . 2 . 3]" 2 2204 1 87 VAL H 1 87 VAL MG2 3.000 . 4.300 2.177 1.923 2.453 . 0 0 "[ . 1 . 2 . 3]" 2 2205 1 41 LEU H 1 41 LEU MD2 3.100 . 4.500 4.261 4.218 4.308 . 0 0 "[ . 1 . 2 . 3]" 2 2206 1 41 LEU MD2 1 42 GLY H 2.700 . 3.800 2.209 1.858 2.604 . 0 0 "[ . 1 . 2 . 3]" 2 2207 1 41 LEU MD2 1 71 GLN HE22 2.900 . 4.200 2.748 2.384 3.217 . 0 0 "[ . 1 . 2 . 3]" 2 2208 1 87 VAL MG2 1 125 CYS H 3.300 . 6.000 5.864 5.459 6.021 0.021 21 0 "[ . 1 . 2 . 3]" 2 2209 1 41 LEU MD2 1 72 VAL H 3.300 . 4.800 3.018 2.678 3.234 . 0 0 "[ . 1 . 2 . 3]" 2 2210 1 41 LEU MD2 1 71 GLN HE21 3.200 . 4.700 2.094 1.875 2.684 0.025 30 0 "[ . 1 . 2 . 3]" 2 2211 1 61 TYR HA 1 61 TYR HB2 2.500 . 3.500 2.341 2.307 2.355 . 0 0 "[ . 1 . 2 . 3]" 2 2212 1 61 TYR HA 1 65 MET H 3.300 . 4.900 4.533 4.398 4.704 . 0 0 "[ . 1 . 2 . 3]" 2 2213 1 108 ASN HD22 1 110 THR MG 3.100 . 4.500 3.584 2.035 4.995 0.495 11 0 "[ . 1 . 2 . 3]" 2 2214 1 103 THR H 1 103 THR MG 2.600 . 6.000 3.594 2.328 3.782 . 0 0 "[ . 1 . 2 . 3]" 2 2215 1 102 THR MG 1 103 THR H 3.000 . 4.300 3.835 3.747 3.912 . 0 0 "[ . 1 . 2 . 3]" 2 2216 1 102 THR MG 1 109 PHE QD 2.900 . 6.000 3.855 3.703 4.095 . 0 0 "[ . 1 . 2 . 3]" 2 2217 1 114 VAL HA 1 114 VAL MG2 2.200 . 6.000 3.194 3.187 3.205 . 0 0 "[ . 1 . 2 . 3]" 2 2218 1 114 VAL HB 1 114 VAL MG2 1.900 . 2.500 2.101 2.084 2.130 . 0 0 "[ . 1 . 2 . 3]" 2 2219 1 112 THR MG 1 115 LYS HB3 2.500 . 3.500 3.286 3.087 3.551 0.051 25 0 "[ . 1 . 2 . 3]" 2 2220 1 112 THR H 1 112 THR MG 3.000 . 4.300 3.765 3.753 3.776 . 0 0 "[ . 1 . 2 . 3]" 2 2221 1 93 ILE H 1 93 ILE HA 2.800 . 4.000 2.830 2.795 2.882 . 0 0 "[ . 1 . 2 . 3]" 2 2222 1 114 VAL H 1 114 VAL MG2 2.700 . 3.800 2.353 2.214 2.460 . 0 0 "[ . 1 . 2 . 3]" 2 2223 1 60 TYR HA 1 60 TYR HB3 2.400 . 3.300 3.026 3.022 3.029 . 0 0 "[ . 1 . 2 . 3]" 2 2224 1 48 PRO HA 1 48 PRO QD 2.700 . 3.800 3.390 3.355 3.417 . 0 0 "[ . 1 . 2 . 3]" 2 2225 1 93 ILE HA 1 94 THR H 3.000 . 4.300 3.560 3.544 3.582 . 0 0 "[ . 1 . 2 . 3]" 2 2226 1 60 TYR HA 1 60 TYR HB2 2.400 . 3.300 2.460 2.406 2.503 . 0 0 "[ . 1 . 2 . 3]" 2 2227 1 60 TYR HA 1 63 GLU H 3.000 . 4.300 3.864 3.779 4.088 . 0 0 "[ . 1 . 2 . 3]" 2 2228 1 113 ASP HB3 1 114 VAL H 6.000 . 6.000 3.264 3.125 3.425 . 0 0 "[ . 1 . 2 . 3]" 2 2229 1 60 TYR HA 1 64 ASN H 3.300 . 4.800 4.766 4.576 4.828 0.028 15 0 "[ . 1 . 2 . 3]" 2 2230 1 120 VAL MG2 1 121 VAL H 2.500 . 6.000 3.826 3.718 3.916 . 0 0 "[ . 1 . 2 . 3]" 2 2231 1 68 TYR QD 1 120 VAL MG2 2.700 . 6.000 4.290 4.158 4.442 . 0 0 "[ . 1 . 2 . 3]" 2 2232 1 89 ASP HB2 1 90 CYS H 6.000 . 6.000 3.890 3.749 4.195 . 0 0 "[ . 1 . 2 . 3]" 2 2233 1 89 ASP HB3 1 90 CYS H 6.000 . 6.000 3.030 2.814 3.264 . 0 0 "[ . 1 . 2 . 3]" 2 2234 1 64 ASN HB3 1 65 MET H 6.000 . 6.000 4.118 3.940 4.238 . 0 0 "[ . 1 . 2 . 3]" 2 2235 1 133 SER HA 1 134 GLN H 3.000 . 4.300 3.473 3.424 3.515 . 0 0 "[ . 1 . 2 . 3]" 2 2236 1 54 SER HA 1 55 ASP QB 6.000 . 6.000 4.809 4.529 5.221 . 0 0 "[ . 1 . 2 . 3]" 2 2237 1 55 ASP QB 1 56 TYR H 6.000 . 6.000 3.183 2.822 3.624 . 0 0 "[ . 1 . 2 . 3]" 2 2238 1 108 ASN HB3 1 109 PHE H 6.000 . 6.000 4.243 3.519 4.510 . 0 0 "[ . 1 . 2 . 3]" 2 2239 1 108 ASN HB2 1 109 PHE H 6.000 . 6.000 4.540 4.140 4.657 . 0 0 "[ . 1 . 2 . 3]" 2 2240 1 108 ASN HB2 1 108 ASN HD22 . . 3.700 3.922 3.542 4.097 0.397 28 0 "[ . 1 . 2 . 3]" 2 2241 1 48 PRO HA 1 49 ILE HA 2.900 . 6.000 4.378 4.370 4.382 . 0 0 "[ . 1 . 2 . 3]" 2 2242 1 49 ILE HA 1 61 TYR QD 3.200 . 4.700 4.329 4.073 4.551 . 0 0 "[ . 1 . 2 . 3]" 2 2243 1 118 GLU HA 1 122 GLU H 3.200 . 4.700 4.155 4.053 4.264 . 0 0 "[ . 1 . 2 . 3]" 2 2244 1 118 GLU HA 1 119 ARG H 3.000 . 4.400 3.533 3.517 3.548 . 0 0 "[ . 1 . 2 . 3]" 2 2245 1 118 GLU HA 1 121 VAL H 3.200 . 4.700 3.965 3.862 4.093 . 0 0 "[ . 1 . 2 . 3]" 2 2246 1 114 VAL HB 1 118 GLU HA 2.300 . 6.000 6.019 5.971 6.051 0.051 21 0 "[ . 1 . 2 . 3]" 2 2247 1 118 GLU HA 1 121 VAL MG2 2.300 . 6.000 3.961 3.785 4.169 . 0 0 "[ . 1 . 2 . 3]" 2 2248 1 136 TYR HA 1 138 GLN QG 3.000 . 6.000 4.408 4.091 4.632 . 0 0 "[ . 1 . 2 . 3]" 2 2249 1 136 TYR HA 1 137 TYR H 2.600 . 6.000 3.512 3.469 3.555 . 0 0 "[ . 1 . 2 . 3]" 2 2250 1 96 LYS HA 1 99 THR MG 2.700 . 3.800 3.571 3.341 3.775 . 0 0 "[ . 1 . 2 . 3]" 2 2251 1 96 LYS H 1 96 LYS HA 2.600 . 3.600 2.820 2.801 2.843 . 0 0 "[ . 1 . 2 . 3]" 2 2252 1 96 LYS HA 1 97 GLN H 3.000 . 4.400 3.436 3.414 3.468 . 0 0 "[ . 1 . 2 . 3]" 2 2253 1 96 LYS HA 1 96 LYS HG2 2.400 . 3.300 2.701 2.457 3.468 0.168 10 0 "[ . 1 . 2 . 3]" 2 2254 1 86 PHE QE 1 125 CYS HA 3.200 . 4.700 4.300 3.834 4.614 . 0 0 "[ . 1 . 2 . 3]" 2 2255 1 57 GLU HA 1 60 TYR HB3 2.500 . 3.500 2.410 2.113 2.553 . 0 0 "[ . 1 . 2 . 3]" 2 2256 1 125 CYS HA 1 128 GLN QB 2.700 . 3.800 2.992 2.561 3.776 . 0 0 "[ . 1 . 2 . 3]" 2 2257 1 57 GLU HA 1 60 TYR H 2.700 . 3.800 3.351 3.214 3.493 . 0 0 "[ . 1 . 2 . 3]" 2 2258 1 125 CYS HA 1 127 THR H 3.200 . 4.700 4.389 4.247 4.570 . 0 0 "[ . 1 . 2 . 3]" 2 2259 1 116 MET H 1 116 MET HA 2.500 . 3.500 2.829 2.818 2.845 . 0 0 "[ . 1 . 2 . 3]" 2 2260 1 125 CYS HA 1 125 CYS HB3 2.500 . 3.500 2.527 2.488 2.590 . 0 0 "[ . 1 . 2 . 3]" 2 2261 1 135 ALA MB 1 136 TYR H 2.400 . 3.300 2.853 2.708 2.988 . 0 0 "[ . 1 . 2 . 3]" 2 2262 1 44 ALA MB 1 70 ASN HD22 2.600 . 3.600 2.910 2.354 3.231 . 0 0 "[ . 1 . 2 . 3]" 2 2263 1 44 ALA MB 1 71 GLN HE21 3.100 . 6.000 4.698 4.266 4.981 . 0 0 "[ . 1 . 2 . 3]" 2 2264 1 135 ALA H 1 135 ALA MB 2.100 . 2.800 2.176 2.058 2.290 . 0 0 "[ . 1 . 2 . 3]" 2 2265 1 135 ALA MB 1 138 GLN HE21 3.300 . 4.900 3.656 2.274 5.366 0.466 7 0 "[ . 1 . 2 . 3]" 2 2266 1 44 ALA MB 1 70 ASN HD21 2.700 . 3.800 2.955 2.204 3.419 . 0 0 "[ . 1 . 2 . 3]" 2 2267 1 72 VAL MG2 1 74 TYR HA 2.700 . 6.000 5.054 4.807 5.305 . 0 0 "[ . 1 . 2 . 3]" 2 2268 1 72 VAL H 1 72 VAL MG2 2.400 . 3.300 2.203 1.929 2.346 . 0 0 "[ . 1 . 2 . 3]" 2 2269 1 71 GLN HA 1 72 VAL MG2 2.700 . 3.800 3.571 3.339 3.772 . 0 0 "[ . 1 . 2 . 3]" 2 2270 1 73 TYR HB3 1 93 ILE MG 2.200 . 3.000 2.680 2.499 2.782 . 0 0 "[ . 1 . 2 . 3]" 2 2271 1 59 ARG HA 1 59 ARG HG2 2.800 2.100 4.000 2.791 2.188 4.195 0.195 19 0 "[ . 1 . 2 . 3]" 2 2272 1 59 ARG HA 1 59 ARG QD 2.600 . 3.600 2.805 1.936 3.465 . 0 0 "[ . 1 . 2 . 3]" 2 2273 1 72 VAL HA 1 93 ILE MG 3.000 . 6.000 5.183 4.990 5.341 . 0 0 "[ . 1 . 2 . 3]" 2 2274 1 37 GLY H 1 93 ILE MG 3.000 . 6.000 5.364 4.923 5.941 . 0 0 "[ . 1 . 2 . 3]" 2 2275 1 57 GLU H 1 116 MET ME 3.100 . 6.000 4.973 4.687 5.216 . 0 0 "[ . 1 . 2 . 3]" 2 2276 1 61 TYR HB2 1 116 MET ME 2.500 . 3.500 2.635 2.340 2.866 . 0 0 "[ . 1 . 2 . 3]" 2 2277 1 61 TYR H 1 116 MET ME 2.600 . 3.600 2.910 2.635 3.307 . 0 0 "[ . 1 . 2 . 3]" 2 2278 1 116 MET H 1 116 MET ME 2.800 . 6.000 4.206 4.089 4.285 . 0 0 "[ . 1 . 2 . 3]" 2 2279 1 130 GLU HA 1 131 ARG H 3.200 . 4.700 3.455 3.405 3.486 . 0 0 "[ . 1 . 2 . 3]" 2 2280 1 98 HIS H 1 98 HIS HA 2.500 . 3.500 2.829 2.822 2.837 . 0 0 "[ . 1 . 2 . 3]" 2 2281 1 92 ASN HB3 1 93 ILE H 6.000 . 6.000 3.442 2.671 4.149 . 0 0 "[ . 1 . 2 . 3]" 2 2282 1 131 ARG H 1 131 ARG HA 2.600 . 3.700 2.839 2.817 2.877 . 0 0 "[ . 1 . 2 . 3]" 2 2283 1 131 ARG HA 1 134 GLN H 3.100 . 4.500 3.820 3.596 3.958 . 0 0 "[ . 1 . 2 . 3]" 2 2284 1 137 TYR HA 1 137 TYR QD 2.400 . 3.300 2.561 2.058 3.046 . 0 0 "[ . 1 . 2 . 3]" 2 2285 1 65 MET HA 1 65 MET HG2 2.700 . 3.800 2.583 2.500 2.719 . 0 0 "[ . 1 . 2 . 3]" 2 2286 1 137 TYR H 1 137 TYR HA 2.300 . 3.200 2.852 2.792 2.895 . 0 0 "[ . 1 . 2 . 3]" 2 2287 1 115 LYS HA 1 116 MET H 3.100 . 4.500 3.565 3.553 3.579 . 0 0 "[ . 1 . 2 . 3]" 2 2288 1 47 ARG H 1 70 ASN HB2 6.000 . 6.000 4.897 4.699 5.238 . 0 0 "[ . 1 . 2 . 3]" 2 2289 1 114 VAL MG2 1 115 LYS HA 2.700 . 3.800 3.132 3.016 3.296 . 0 0 "[ . 1 . 2 . 3]" 2 2290 1 123 GLN HA 1 126 ILE H 2.800 . 4.000 3.430 3.317 3.506 . 0 0 "[ . 1 . 2 . 3]" 2 2291 1 45 MET ME 1 72 VAL H 2.800 . 6.000 3.963 3.636 4.236 . 0 0 "[ . 1 . 2 . 3]" 2 2292 1 45 MET ME 1 128 GLN HE21 3.000 . 4.300 2.214 1.838 3.722 0.062 19 0 "[ . 1 . 2 . 3]" 2 2293 1 45 MET ME 1 131 ARG HE 2.800 . 4.000 3.581 2.788 4.040 0.040 27 0 "[ . 1 . 2 . 3]" 2 2294 1 45 MET ME 1 127 THR H 3.000 . 4.300 4.066 3.732 4.303 0.003 12 0 "[ . 1 . 2 . 3]" 2 2295 1 65 MET H 1 65 MET ME 2.800 . 6.000 4.693 4.634 4.737 . 0 0 "[ . 1 . 2 . 3]" 2 2296 1 47 ARG HA 1 65 MET ME 2.500 . 6.000 4.145 3.956 4.409 . 0 0 "[ . 1 . 2 . 3]" 2 2297 1 72 VAL H 1 72 VAL HA 2.400 . 3.300 2.945 2.942 2.949 . 0 0 "[ . 1 . 2 . 3]" 2 2298 1 50 ILE HA 1 51 HIS HA 2.800 . 6.000 4.414 4.371 4.443 . 0 0 "[ . 1 . 2 . 3]" 2 2299 1 49 ILE MG 1 50 ILE H 2.600 . 3.700 2.704 2.435 3.011 . 0 0 "[ . 1 . 2 . 3]" 2 2300 1 49 ILE MG 1 50 ILE HA 2.900 . 4.200 4.015 3.714 4.207 0.007 21 0 "[ . 1 . 2 . 3]" 2 2301 1 84 ASN HB2 1 85 ASN HA 6.000 . 6.000 4.599 3.979 5.031 . 0 0 "[ . 1 . 2 . 3]" 2 2302 1 56 TYR HB2 1 57 GLU H 6.000 . 6.000 3.850 3.800 3.883 . 0 0 "[ . 1 . 2 . 3]" 2 2303 1 84 ASN HB2 1 85 ASN H 6.000 . 6.000 3.719 3.012 4.284 . 0 0 "[ . 1 . 2 . 3]" 2 2304 1 84 ASN HB3 1 85 ASN H 6.000 . 6.000 3.800 3.545 4.181 . 0 0 "[ . 1 . 2 . 3]" 2 2305 1 128 GLN HA 1 128 GLN QB 2.500 . 3.500 2.440 2.155 2.539 . 0 0 "[ . 1 . 2 . 3]" 2 2306 1 128 GLN HA 1 131 ARG HB2 2.400 . 3.300 2.341 1.678 2.556 0.022 16 0 "[ . 1 . 2 . 3]" 2 2307 1 43 SER HA 1 71 GLN HE22 2.800 . 4.000 3.098 2.670 3.629 . 0 0 "[ . 1 . 2 . 3]" 2 2308 1 128 GLN HA 1 131 ARG H 3.000 . 4.400 3.070 2.886 3.157 . 0 0 "[ . 1 . 2 . 3]" 2 2309 1 50 ILE MG 1 116 MET HA 2.900 . 6.000 4.306 4.010 4.593 . 0 0 "[ . 1 . 2 . 3]" 2 2310 1 43 SER HA 1 44 ALA H 2.000 . 6.000 2.458 2.394 2.533 . 0 0 "[ . 1 . 2 . 3]" 2 2311 1 127 THR MG 1 128 GLN HA 2.700 . 3.800 3.321 3.175 3.484 . 0 0 "[ . 1 . 2 . 3]" 2 2312 1 40 MET H 1 40 MET ME 3.100 . 6.000 4.207 3.673 4.478 . 0 0 "[ . 1 . 2 . 3]" 2 2313 1 40 MET ME 1 41 LEU H 2.800 . 3.900 2.426 2.274 3.004 . 0 0 "[ . 1 . 2 . 3]" 2 2314 1 126 ILE H 1 126 ILE MG 2.800 . 6.000 3.755 3.731 3.767 . 0 0 "[ . 1 . 2 . 3]" 2 2315 1 83 GLN QE 1 126 ILE MG 2.800 . 4.000 3.071 1.944 3.823 . 0 0 "[ . 1 . 2 . 3]" 2 2316 1 43 SER H 1 43 SER HA 2.600 . 3.600 2.748 2.732 2.764 . 0 0 "[ . 1 . 2 . 3]" 2 2317 1 77 MET H 1 77 MET ME 3.200 . 4.700 4.200 3.380 4.685 . 0 0 "[ . 1 . 2 . 3]" 2 2318 1 77 MET ME 1 136 TYR H 3.000 . 6.000 4.558 4.163 4.826 . 0 0 "[ . 1 . 2 . 3]" 2 2319 1 77 MET ME 1 133 SER H 2.500 . 6.000 3.399 2.756 4.071 . 0 0 "[ . 1 . 2 . 3]" 2 2320 1 77 MET ME 1 133 SER HB3 2.300 . 3.100 2.875 2.345 3.104 0.004 20 0 "[ . 1 . 2 . 3]" 2 2321 1 77 MET ME 1 133 SER HB2 2.300 . 3.100 2.926 2.436 3.111 0.011 29 0 "[ . 1 . 2 . 3]" 2 2322 1 119 ARG HA 1 122 GLU H 3.200 . 4.700 3.666 3.591 3.760 . 0 0 "[ . 1 . 2 . 3]" 2 2323 1 77 MET ME 1 137 TYR H 3.100 . 6.000 5.237 4.754 5.600 . 0 0 "[ . 1 . 2 . 3]" 2 2324 1 134 GLN HA 1 137 TYR H 3.000 . 4.300 3.692 3.460 3.856 . 0 0 "[ . 1 . 2 . 3]" 2 2325 1 134 GLN HA 1 137 TYR QD 3.300 . 4.900 4.178 3.040 4.710 . 0 0 "[ . 1 . 2 . 3]" 2 2326 1 134 GLN HA 1 137 TYR HB2 2.800 . 4.000 2.955 2.711 3.141 . 0 0 "[ . 1 . 2 . 3]" 2 2327 1 132 GLU HA 1 136 TYR H 2.500 . 6.000 4.290 4.034 4.604 . 0 0 "[ . 1 . 2 . 3]" 2 2328 1 95 ILE MG 1 96 LYS H 2.900 . 4.100 3.004 2.797 3.147 . 0 0 "[ . 1 . 2 . 3]" 2 2329 1 97 GLN H 1 97 GLN HA 2.300 . 3.100 2.891 2.873 2.895 . 0 0 "[ . 1 . 2 . 3]" 2 2330 1 124 MET H 1 124 MET ME 2.700 . 6.000 3.760 3.417 4.071 . 0 0 "[ . 1 . 2 . 3]" 2 2331 1 121 VAL H 1 124 MET ME 2.900 . 4.200 3.846 3.614 4.137 . 0 0 "[ . 1 . 2 . 3]" 2 2332 1 124 MET ME 1 125 CYS H 3.100 . 6.000 4.832 4.573 5.052 . 0 0 "[ . 1 . 2 . 3]" 2 2333 1 71 GLN H 1 124 MET ME 2.600 . 3.600 3.333 2.955 3.595 . 0 0 "[ . 1 . 2 . 3]" 2 2334 1 72 VAL H 1 124 MET ME 2.900 . 6.000 4.663 4.244 5.048 . 0 0 "[ . 1 . 2 . 3]" 2 2335 1 66 HIS HA 1 66 HIS HB3 2.200 . 3.000 2.545 2.367 2.650 . 0 0 "[ . 1 . 2 . 3]" 2 2336 1 73 TYR HA 1 73 TYR QD 2.600 . 3.600 3.199 3.159 3.260 . 0 0 "[ . 1 . 2 . 3]" 2 2337 1 109 PHE HA 1 109 PHE QD 2.100 . 2.900 2.475 2.295 2.708 . 0 0 "[ . 1 . 2 . 3]" 2 2338 1 68 TYR HA 1 68 TYR QD 2.300 . 3.200 2.603 2.361 2.770 . 0 0 "[ . 1 . 2 . 3]" 2 2339 1 61 TYR QE 1 68 TYR QE 2.900 . 4.100 4.116 4.014 4.161 0.061 24 0 "[ . 1 . 2 . 3]" 2 2340 1 74 TYR QD 1 86 PHE HZ 3.100 . 4.500 2.483 1.993 2.832 . 0 0 "[ . 1 . 2 . 3]" 2 2341 1 61 TYR QE 1 68 TYR QD 2.500 . 3.500 3.254 3.098 3.378 . 0 0 "[ . 1 . 2 . 3]" 2 2342 1 136 TYR QD 1 137 TYR QD 3.100 . 4.500 3.089 2.136 4.393 . 0 0 "[ . 1 . 2 . 3]" 2 2343 1 68 TYR QE 1 109 PHE QD 2.700 . 3.800 3.695 3.407 3.814 0.014 24 0 "[ . 1 . 2 . 3]" 2 2344 1 61 TYR QD 1 68 TYR QE 2.800 . 4.000 2.526 2.316 2.664 . 0 0 "[ . 1 . 2 . 3]" 2 2345 1 74 TYR QD 1 86 PHE QE 2.800 . 4.000 3.431 2.728 3.793 . 0 0 "[ . 1 . 2 . 3]" 2 2346 1 41 LEU HA 1 73 TYR HA 2.200 . 3.000 2.394 2.340 2.460 . 0 0 "[ . 1 . 2 . 3]" 2 2347 1 42 GLY HA2 1 74 TYR QE 2.500 . 3.500 2.953 2.399 3.400 . 0 0 "[ . 1 . 2 . 3]" 2 2348 1 42 GLY HA3 1 74 TYR QE 2.600 . 3.600 3.009 2.315 3.358 . 0 0 "[ . 1 . 2 . 3]" 2 2349 1 61 TYR HA 1 68 TYR QE 2.800 . 4.000 2.489 2.310 2.636 . 0 0 "[ . 1 . 2 . 3]" 2 2350 1 60 TYR HA 1 60 TYR QD 2.500 . 3.500 2.680 2.584 2.793 . 0 0 "[ . 1 . 2 . 3]" 2 2351 1 73 TYR QE 1 94 THR HA 2.600 . 3.600 2.629 2.320 2.953 . 0 0 "[ . 1 . 2 . 3]" 2 2352 1 68 TYR QE 1 113 ASP HA 2.900 . 4.100 3.184 2.751 3.496 . 0 0 "[ . 1 . 2 . 3]" 2 2353 1 74 TYR HA 1 74 TYR QD 2.900 . 4.100 3.722 3.711 3.733 . 0 0 "[ . 1 . 2 . 3]" 2 2354 1 52 PHE QD 1 58 ASP HA 2.400 . 3.300 3.241 3.096 3.332 0.032 21 0 "[ . 1 . 2 . 3]" 2 2355 1 41 LEU HA 1 74 TYR QD 2.700 . 3.800 3.795 3.704 3.825 0.025 19 0 "[ . 1 . 2 . 3]" 2 2356 1 86 PHE QD 1 125 CYS HA 2.800 . 6.000 4.795 4.581 4.980 . 0 0 "[ . 1 . 2 . 3]" 2 2357 1 109 PHE QD 1 113 ASP HA 3.000 . 4.300 3.976 3.765 4.230 . 0 0 "[ . 1 . 2 . 3]" 2 2358 1 98 HIS HA 1 98 HIS HD2 3.000 . 4.300 4.141 3.811 4.333 0.033 29 0 "[ . 1 . 2 . 3]" 2 2359 1 61 TYR HA 1 61 TYR QD 2.300 . 3.200 2.699 2.588 2.835 . 0 0 "[ . 1 . 2 . 3]" 2 2360 1 102 THR HB 1 109 PHE QE 2.800 . 4.000 1.872 1.788 2.038 0.012 20 0 "[ . 1 . 2 . 3]" 2 2361 1 73 TYR QD 1 94 THR HA 2.200 . 3.000 1.896 1.786 2.096 . 0 0 "[ . 1 . 2 . 3]" 2 2362 1 52 PHE QE 1 116 MET HA 2.600 . 3.600 2.059 1.821 2.332 . 0 0 "[ . 1 . 2 . 3]" 2 2363 1 61 TYR QD 1 62 ARG HA 2.900 . 4.200 3.572 3.392 3.742 . 0 0 "[ . 1 . 2 . 3]" 2 2364 1 133 SER HA 1 137 TYR QD 3.000 . 4.400 3.568 2.740 4.322 . 0 0 "[ . 1 . 2 . 3]" 2 2365 1 109 PHE HA 1 109 PHE HB3 2.400 . 3.300 2.530 2.487 2.567 . 0 0 "[ . 1 . 2 . 3]" 2 2366 1 109 PHE HA 1 109 PHE HB2 2.500 . 3.500 3.020 3.013 3.027 . 0 0 "[ . 1 . 2 . 3]" 2 2367 1 39 TYR QD 1 93 ILE MG 2.700 . 3.800 3.267 2.897 3.513 . 0 0 "[ . 1 . 2 . 3]" 2 2368 1 50 ILE MD 1 52 PHE QE 2.900 . 4.200 4.099 3.654 4.217 0.017 30 0 "[ . 1 . 2 . 3]" 2 2369 1 60 TYR QD 1 112 THR MG 2.600 . 3.700 3.388 3.158 3.597 . 0 0 "[ . 1 . 2 . 3]" 2 2370 1 50 ILE HB 1 52 PHE QE 2.500 . 3.500 2.893 2.578 3.061 . 0 0 "[ . 1 . 2 . 3]" 2 2371 1 39 TYR QD 1 93 ILE HG13 2.900 . 4.100 3.417 3.208 3.625 . 0 0 "[ . 1 . 2 . 3]" 2 2372 1 40 MET HB2 1 74 TYR QE 3.000 . 4.400 3.464 3.063 3.745 . 0 0 "[ . 1 . 2 . 3]" 2 2373 1 41 LEU HB2 1 73 TYR QE 2.800 . 4.000 3.469 3.270 3.859 . 0 0 "[ . 1 . 2 . 3]" 2 2374 1 50 ILE HB 1 52 PHE QD 3.100 . 4.500 4.007 3.445 4.318 . 0 0 "[ . 1 . 2 . 3]" 2 2375 1 61 TYR HB3 1 61 TYR QD 2.500 . 3.500 2.302 2.286 2.318 . 0 0 "[ . 1 . 2 . 3]" 2 2376 1 56 TYR QD 1 57 GLU HA 2.800 . 4.000 3.616 3.424 3.889 . 0 0 "[ . 1 . 2 . 3]" 2 2377 1 61 TYR QD 1 116 MET HB2 2.700 . 3.800 3.390 3.283 3.494 . 0 0 "[ . 1 . 2 . 3]" 2 2378 1 129 TYR HB3 1 129 TYR QD 2.700 . 3.800 2.342 2.309 2.397 . 0 0 "[ . 1 . 2 . 3]" 2 2379 1 86 PHE HB2 1 129 TYR QD 2.800 . 4.000 2.824 2.420 3.265 . 0 0 "[ . 1 . 2 . 3]" 2 2380 1 41 LEU HG 1 73 TYR QE 2.800 . 4.000 3.053 2.925 3.219 . 0 0 "[ . 1 . 2 . 3]" 2 2381 1 61 TYR QE 1 120 VAL MG1 2.700 . 3.800 3.112 2.909 3.230 . 0 0 "[ . 1 . 2 . 3]" 2 2382 1 61 TYR QD 1 116 MET HB3 3.000 . 4.300 3.345 2.966 3.553 . 0 0 "[ . 1 . 2 . 3]" 2 2383 1 74 TYR QB 1 86 PHE QE 3.000 . 4.300 2.656 2.376 2.877 . 0 0 "[ . 1 . 2 . 3]" 2 2384 1 109 PHE QD 1 113 ASP HB2 2.600 . 3.600 3.157 2.993 3.452 . 0 0 "[ . 1 . 2 . 3]" 2 2385 1 52 PHE HB2 1 52 PHE QD 2.300 . 3.200 2.311 2.273 2.362 . 0 0 "[ . 1 . 2 . 3]" 2 2386 1 109 PHE HB2 1 109 PHE QD 2.300 . 3.200 2.282 2.264 2.324 . 0 0 "[ . 1 . 2 . 3]" 2 2387 1 109 PHE HB3 1 109 PHE QD 2.400 . 3.300 2.562 2.472 2.636 . 0 0 "[ . 1 . 2 . 3]" 2 2388 1 52 PHE HB3 1 52 PHE QD 2.300 . 3.200 2.490 2.415 2.591 . 0 0 "[ . 1 . 2 . 3]" 2 2389 1 137 TYR HB3 1 137 TYR QD 2.500 . 3.500 2.427 2.278 2.731 . 0 0 "[ . 1 . 2 . 3]" 2 2390 1 137 TYR HB2 1 137 TYR QD 2.500 . 3.500 2.550 2.276 2.770 . 0 0 "[ . 1 . 2 . 3]" 2 2391 1 56 TYR HB2 1 56 TYR QD 2.400 . 3.300 2.520 2.475 2.591 . 0 0 "[ . 1 . 2 . 3]" 2 2392 1 56 TYR HB3 1 56 TYR QD 2.400 . 3.300 2.312 2.283 2.337 . 0 0 "[ . 1 . 2 . 3]" 2 2393 1 98 HIS HB2 1 98 HIS HD2 2.500 . 3.500 2.776 2.713 2.876 . 0 0 "[ . 1 . 2 . 3]" 2 2394 1 65 MET HA 1 68 TYR QD 2.400 . 3.300 2.505 2.179 2.719 . 0 0 "[ . 1 . 2 . 3]" 2 2395 1 74 TYR QB 1 74 TYR QD 2.500 . 3.500 2.139 2.137 2.141 . 0 0 "[ . 1 . 2 . 3]" 2 2396 1 39 TYR QD 1 73 TYR HB3 2.700 . 3.800 3.394 3.153 3.610 . 0 0 "[ . 1 . 2 . 3]" 2 2397 1 56 TYR QD 1 57 GLU QG 2.600 . 3.700 2.273 2.010 2.608 . 0 0 "[ . 1 . 2 . 3]" 2 2398 1 61 TYR QE 1 65 MET HG2 3.000 . 4.300 3.250 3.043 3.391 . 0 0 "[ . 1 . 2 . 3]" 2 2399 1 73 TYR QD 1 97 GLN HG3 3.000 . 4.300 4.264 3.951 4.351 0.051 26 0 "[ . 1 . 2 . 3]" 2 2400 1 68 TYR QB 1 68 TYR QD 2.300 . 3.200 2.139 2.135 2.147 . 0 0 "[ . 1 . 2 . 3]" 2 2401 1 60 TYR HB3 1 60 TYR QD 2.400 . 3.300 2.318 2.302 2.350 . 0 0 "[ . 1 . 2 . 3]" 2 2402 1 136 TYR HB3 1 136 TYR QD 2.400 . 3.300 2.295 2.277 2.350 . 0 0 "[ . 1 . 2 . 3]" 2 2403 1 39 TYR QB 1 39 TYR QD 2.200 . 3.000 2.144 2.138 2.151 . 0 0 "[ . 1 . 2 . 3]" 2 2404 1 61 TYR HB2 1 61 TYR QD 2.500 . 3.500 2.547 2.493 2.591 . 0 0 "[ . 1 . 2 . 3]" 2 2405 1 60 TYR HB2 1 60 TYR QD 2.300 . 3.200 2.506 2.457 2.537 . 0 0 "[ . 1 . 2 . 3]" 2 2406 1 73 TYR QB 1 73 TYR QD 2.300 . 3.200 2.140 2.136 2.150 . 0 0 "[ . 1 . 2 . 3]" 2 2407 1 50 ILE MG 1 52 PHE QD 2.900 . 4.100 3.301 2.754 3.698 . 0 0 "[ . 1 . 2 . 3]" 2 2408 1 68 TYR QE 1 117 MET HG2 2.400 . 3.300 2.653 2.344 3.613 0.313 27 0 "[ . 1 . 2 . 3]" 2 2409 1 68 TYR QE 1 117 MET HG3 2.700 . 3.800 1.943 1.788 2.080 0.012 29 0 "[ . 1 . 2 . 3]" 2 2410 1 64 ASN QB 1 68 TYR QE 2.900 . 4.100 2.181 2.024 2.423 . 0 0 "[ . 1 . 2 . 3]" 2 2411 1 74 TYR QE 1 132 GLU HG2 2.800 . 4.000 2.915 2.265 3.510 . 0 0 "[ . 1 . 2 . 3]" 2 2412 1 73 TYR QE 1 97 GLN HB3 2.600 . 3.600 2.893 2.683 3.218 . 0 0 "[ . 1 . 2 . 3]" 2 2413 1 73 TYR QE 1 97 GLN HB2 2.700 . 3.800 3.002 2.827 3.261 . 0 0 "[ . 1 . 2 . 3]" 2 2414 1 86 PHE HZ 1 132 GLU HB2 2.900 . 4.100 3.155 2.704 3.473 . 0 0 "[ . 1 . 2 . 3]" 2 2415 1 68 TYR QD 1 117 MET HG2 2.400 . 3.300 2.189 1.908 2.994 . 0 0 "[ . 1 . 2 . 3]" 2 2416 1 61 TYR QD 1 116 MET ME 3.100 . 4.500 4.260 3.999 4.420 . 0 0 "[ . 1 . 2 . 3]" 2 2417 1 51 HIS HD2 1 58 ASP HA 3.000 . 4.400 4.332 4.004 4.430 0.030 25 0 "[ . 1 . 2 . 3]" 2 2418 1 74 TYR QB 1 74 TYR QE 3.000 . 4.400 3.940 3.938 3.943 . 0 0 "[ . 1 . 2 . 3]" 2 2419 1 68 TYR QE 1 117 MET HA 3.000 . 4.300 3.527 3.243 3.987 . 0 0 "[ . 1 . 2 . 3]" 2 2420 1 56 TYR QE 1 57 GLU HA 3.100 . 4.500 4.196 4.094 4.512 0.012 8 0 "[ . 1 . 2 . 3]" 2 2421 1 74 TYR QE 1 131 ARG HB3 3.000 . 6.000 5.745 5.131 6.006 0.006 23 0 "[ . 1 . 2 . 3]" 2 2422 1 74 TYR HB2 1 86 PHE HZ 3.000 . 4.300 2.243 1.711 2.758 0.189 19 0 "[ . 1 . 2 . 3]" 2 2423 1 136 TYR QD 1 139 ARG HD2 3.100 . 4.500 3.831 2.482 4.514 0.014 27 0 "[ . 1 . 2 . 3]" 2 2424 1 83 GLN QB 1 129 TYR QE 2.600 . 3.700 2.932 2.723 3.450 . 0 0 "[ . 1 . 2 . 3]" 2 2425 1 61 TYR QE 1 65 MET HA 3.000 . 4.400 3.513 3.283 3.787 . 0 0 "[ . 1 . 2 . 3]" 2 2426 1 61 TYR HB2 1 68 TYR QE 2.900 . 4.200 3.734 3.524 3.936 . 0 0 "[ . 1 . 2 . 3]" 2 2427 1 88 HIS QB 1 88 HIS HD2 3.000 . 4.300 2.995 2.648 3.304 . 0 0 "[ . 1 . 2 . 3]" 2 2428 1 86 PHE HA 1 86 PHE QD 2.800 . 4.000 3.007 2.845 3.080 . 0 0 "[ . 1 . 2 . 3]" 2 2429 1 66 HIS HA 1 66 HIS HD2 3.000 . 4.300 3.354 2.274 4.276 . 0 0 "[ . 1 . 2 . 3]" 2 2430 1 86 PHE QD 1 129 TYR QD 3.300 . 4.900 2.974 2.684 3.232 . 0 0 "[ . 1 . 2 . 3]" 2 2431 1 93 ILE MG 1 94 THR HA 2.600 . 3.600 2.985 2.783 3.184 . 0 0 "[ . 1 . 2 . 3]" 2 2432 1 67 ARG HD3 1 67 ARG HG2 2.600 . 3.700 2.674 2.220 3.012 . 0 0 "[ . 1 . 2 . 3]" 2 2433 1 67 ARG HD2 1 67 ARG HG2 2.700 . 3.800 2.865 2.381 3.016 . 0 0 "[ . 1 . 2 . 3]" 2 2434 1 60 TYR QE 1 116 MET ME 2.500 . 3.500 3.393 3.221 3.511 0.011 8 0 "[ . 1 . 2 . 3]" 2 2435 1 60 TYR QD 1 116 MET ME 2.300 . 3.200 1.988 1.781 2.293 . 0 0 "[ . 1 . 2 . 3]" 2 2436 1 100 VAL MG2 1 101 THR HB 2.600 . 6.000 5.240 5.190 5.275 . 0 0 "[ . 1 . 2 . 3]" 2 2437 1 100 VAL MG2 1 103 THR HB 3.000 . 6.000 5.132 4.975 5.641 . 0 0 "[ . 1 . 2 . 3]" 2 2438 1 97 GLN HB3 1 102 THR HB 2.600 . 6.000 4.615 4.178 5.429 . 0 0 "[ . 1 . 2 . 3]" 2 2439 1 67 ARG HB3 1 102 THR HB 2.700 . 6.000 5.733 4.369 6.007 0.007 9 0 "[ . 1 . 2 . 3]" 2 2440 1 69 PRO HG2 1 94 THR HA 3.100 . 6.000 5.780 5.691 5.896 . 0 0 "[ . 1 . 2 . 3]" 2 2441 1 96 LYS QB 1 99 THR HB 3.300 . 6.000 5.954 5.832 6.042 0.042 27 0 "[ . 1 . 2 . 3]" 2 2442 1 72 VAL HB 1 94 THR HA 2.800 . 4.000 3.679 3.508 3.925 . 0 0 "[ . 1 . 2 . 3]" 2 2443 1 110 THR MG 1 112 THR HB 3.100 . 4.500 4.431 4.273 4.534 0.034 21 0 "[ . 1 . 2 . 3]" 2 2444 1 112 THR HB 1 115 LYS QB 3.000 . 6.000 4.818 4.639 5.034 . 0 0 "[ . 1 . 2 . 3]" 2 2445 1 91 VAL QG 1 94 THR HB 3.000 . 4.300 3.500 3.376 3.694 . 0 0 "[ . 1 . 2 . 3]" 2 2446 1 45 MET HG3 1 127 THR HB 3.300 . 4.900 4.173 3.599 4.529 . 0 0 "[ . 1 . 2 . 3]" 2 2447 1 72 VAL MG1 1 94 THR HB 2.700 . 3.800 2.729 2.551 2.897 . 0 0 "[ . 1 . 2 . 3]" 2 2448 1 45 MET HB3 1 127 THR HB 3.100 . 4.500 4.372 4.271 4.469 . 0 0 "[ . 1 . 2 . 3]" 2 2449 1 94 THR HB 1 95 ILE HG12 3.300 . 4.900 4.495 4.390 4.554 . 0 0 "[ . 1 . 2 . 3]" 2 2450 1 95 ILE MG 1 114 VAL HA 2.200 . 6.000 2.969 2.777 3.051 . 0 0 "[ . 1 . 2 . 3]" 2 2451 1 112 THR HA 1 115 LYS QE 2.900 . 4.200 3.572 2.981 3.752 . 0 0 "[ . 1 . 2 . 3]" 2 2452 1 112 THR HA 1 115 LYS HG2 2.900 . 6.000 4.298 2.476 4.619 . 0 0 "[ . 1 . 2 . 3]" 2 2453 1 111 LYS HD3 1 112 THR HA 2.900 . 4.100 3.913 3.015 4.440 0.340 17 0 "[ . 1 . 2 . 3]" 2 2454 1 121 VAL HA 1 123 GLN HG3 3.400 . 5.000 4.545 4.216 4.654 . 0 0 "[ . 1 . 2 . 3]" 2 2455 1 111 LYS HG2 1 112 THR HA 3.100 . 4.500 3.954 2.922 4.238 . 0 0 "[ . 1 . 2 . 3]" 2 2456 1 91 VAL HA 1 91 VAL QG 2.000 . 2.700 1.921 1.874 1.965 . 0 0 "[ . 1 . 2 . 3]" 2 2457 1 91 VAL HA 1 91 VAL QG 2.200 . 3.000 1.864 1.816 1.897 . 0 0 "[ . 1 . 2 . 3]" 2 2458 1 69 PRO HB2 1 95 ILE HA 3.300 . 4.900 4.270 4.005 4.359 . 0 0 "[ . 1 . 2 . 3]" 2 2459 1 88 HIS HA 1 91 VAL HA 3.400 2.200 4.800 4.471 4.377 4.536 . 0 0 "[ . 1 . 2 . 3]" 2 2460 1 91 VAL HA 1 95 ILE MD 2.400 . 3.300 2.939 2.807 3.042 . 0 0 "[ . 1 . 2 . 3]" 2 2461 1 91 VAL HA 1 94 THR HA 3.000 . 6.000 4.350 4.309 4.385 . 0 0 "[ . 1 . 2 . 3]" 2 2462 1 54 SER HB2 1 57 GLU HB3 3.300 . 6.000 5.813 5.560 6.035 0.035 14 0 "[ . 1 . 2 . 3]" 2 2463 1 100 VAL HA 1 101 THR MG 2.600 . 6.000 4.351 3.997 4.462 . 0 0 "[ . 1 . 2 . 3]" 2 2464 1 130 GLU HB3 1 133 SER HB2 3.300 . 4.900 4.634 4.291 5.084 0.184 15 0 "[ . 1 . 2 . 3]" 2 2465 1 93 ILE HA 1 93 ILE HB 2.300 . 3.200 2.733 2.525 2.956 . 0 0 "[ . 1 . 2 . 3]" 2 2466 1 92 ASN HB3 1 93 ILE HA 3.100 . 4.500 4.136 3.227 4.524 0.024 15 0 "[ . 1 . 2 . 3]" 2 2467 1 39 TYR QE 1 86 PHE HA 3.300 . 6.000 5.555 5.420 5.740 . 0 0 "[ . 1 . 2 . 3]" 2 2468 1 56 TYR HA 1 57 GLU HB2 3.300 . 4.900 4.714 3.984 5.200 0.300 24 0 "[ . 1 . 2 . 3]" 2 2469 1 130 GLU HB3 1 133 SER HA 3.200 . 6.000 6.035 5.692 6.522 0.522 15 2 "[ . 1 - + 2 . 3]" 2 2470 1 91 VAL QG 1 118 GLU HA 2.400 . 6.000 2.494 2.183 2.712 . 0 0 "[ . 1 . 2 . 3]" 2 2471 1 96 LYS HA 1 96 LYS HG2 3.200 2.400 4.200 2.582 2.313 3.026 0.087 18 0 "[ . 1 . 2 . 3]" 2 2472 1 96 LYS HA 1 96 LYS HD2 2.400 . 6.000 3.003 2.051 3.898 . 0 0 "[ . 1 . 2 . 3]" 2 2473 1 88 HIS HA 1 89 ASP HA 2.500 . 6.000 4.104 4.002 4.470 . 0 0 "[ . 1 . 2 . 3]" 2 2474 1 116 MET HA 1 120 VAL MG2 2.900 . 4.100 3.430 3.330 3.525 . 0 0 "[ . 1 . 2 . 3]" 2 2475 1 96 LYS HA 1 96 LYS HB2 1.900 . 2.600 2.133 1.999 2.279 . 0 0 "[ . 1 . 2 . 3]" 2 2476 1 57 GLU HA 1 116 MET QG 3.100 . 6.000 4.577 4.506 4.746 . 0 0 "[ . 1 . 2 . 3]" 2 2477 1 52 PHE HB3 1 57 GLU HA 3.200 . 6.000 4.650 4.524 4.768 . 0 0 "[ . 1 . 2 . 3]" 2 2478 1 68 TYR HB3 1 117 MET HA 3.100 . 4.500 4.141 4.035 4.431 . 0 0 "[ . 1 . 2 . 3]" 2 2479 1 59 ARG HA 1 59 ARG HB3 1.900 . 2.500 2.016 1.909 2.183 . 0 0 "[ . 1 . 2 . 3]" 2 2480 1 59 ARG HA 1 59 ARG HG3 2.200 . 6.000 3.062 2.103 3.377 . 0 0 "[ . 1 . 2 . 3]" 2 2481 1 123 GLN HA 1 127 THR HB 2.900 . 6.000 6.006 5.891 6.060 0.060 27 0 "[ . 1 . 2 . 3]" 2 2482 1 59 ARG HA 1 62 ARG HB2 2.100 . 2.900 2.139 2.015 2.250 . 0 0 "[ . 1 . 2 . 3]" 2 2483 1 98 HIS HA 1 100 VAL MG2 3.200 2.100 4.500 4.083 3.776 4.190 . 0 0 "[ . 1 . 2 . 3]" 2 2484 1 115 LYS HA 1 115 LYS HB2 1.900 . 2.600 2.366 2.147 2.480 . 0 0 "[ . 1 . 2 . 3]" 2 2485 1 122 GLU HA 1 123 GLN HA 3.100 . 4.500 4.365 4.318 4.440 . 0 0 "[ . 1 . 2 . 3]" 2 2486 1 42 GLY HA2 1 128 GLN HA 3.200 . 6.000 5.398 5.108 5.692 . 0 0 "[ . 1 . 2 . 3]" 2 2487 1 45 MET QB 1 46 SER HA 3.100 . 4.500 4.278 4.177 4.349 . 0 0 "[ . 1 . 2 . 3]" 2 2488 1 119 ARG HA 1 119 ARG HB3 2.200 . 3.000 2.370 2.291 2.442 . 0 0 "[ . 1 . 2 . 3]" 2 2489 1 64 ASN HB3 1 113 ASP HA 3.100 . 6.000 3.069 2.744 3.251 . 0 0 "[ . 1 . 2 . 3]" 2 2490 1 39 TYR HA 1 39 TYR HB3 2.100 . 2.900 1.896 1.740 2.030 . 0 0 "[ . 1 . 2 . 3]" 2 2491 1 41 LEU HB3 1 73 TYR HA 3.100 . 6.000 4.865 4.774 4.956 . 0 0 "[ . 1 . 2 . 3]" 2 2492 1 91 VAL QG 1 92 ASN HA 2.700 . 6.000 3.417 3.238 3.596 . 0 0 "[ . 1 . 2 . 3]" 2 2493 1 135 ALA MB 1 138 GLN HA 2.500 . 6.000 5.464 5.087 5.791 . 0 0 "[ . 1 . 2 . 3]" 2 2494 1 92 ASN HA 1 93 ILE HB 3.100 . 6.000 5.126 4.977 5.212 . 0 0 "[ . 1 . 2 . 3]" 2 2495 1 66 HIS HB3 1 67 ARG HA 3.200 . 4.600 3.979 3.821 4.136 . 0 0 "[ . 1 . 2 . 3]" 2 2496 1 67 ARG HA 1 67 ARG HD2 3.200 . 4.600 4.340 3.675 4.697 0.097 9 0 "[ . 1 . 2 . 3]" 2 2497 1 45 MET ME 1 47 ARG HA 3.300 . 6.000 4.871 4.749 4.964 . 0 0 "[ . 1 . 2 . 3]" 2 2498 1 45 MET QG 1 71 GLN HA 2.900 . 4.200 3.911 3.541 4.068 . 0 0 "[ . 1 . 2 . 3]" 2 2499 1 49 ILE MG 1 51 HIS HA 3.400 . 4.900 4.755 4.557 4.862 . 0 0 "[ . 1 . 2 . 3]" 2 2500 1 40 MET HA 1 40 MET ME 2.100 . 2.900 1.763 1.631 1.977 . 0 0 "[ . 1 . 2 . 3]" 2 2501 1 40 MET HA 1 73 TYR QD 3.000 . 4.300 3.471 3.303 3.714 . 0 0 "[ . 1 . 2 . 3]" 2 2502 1 39 TYR HB3 1 75 ARG HA 2.900 . 4.200 3.549 3.124 4.082 . 0 0 "[ . 1 . 2 . 3]" 2 2503 1 68 TYR HA 1 69 PRO HB2 3.200 . 4.700 4.234 4.044 4.503 . 0 0 "[ . 1 . 2 . 3]" 2 2504 1 44 ALA MB 1 70 ASN HA 3.100 . 4.500 3.830 3.699 3.935 . 0 0 "[ . 1 . 2 . 3]" 2 2505 1 47 ARG HB3 1 48 PRO HD2 2.900 . 4.200 2.763 2.734 2.817 . 0 0 "[ . 1 . 2 . 3]" 2 2506 1 69 PRO HD3 1 117 MET HG3 3.400 . 5.000 4.253 3.873 4.652 . 0 0 "[ . 1 . 2 . 3]" 2 2507 1 69 PRO HD2 1 117 MET HB3 3.300 . 4.800 3.581 2.963 3.807 . 0 0 "[ . 1 . 2 . 3]" 2 2508 1 69 PRO HD2 1 102 THR MG 2.900 . 6.000 4.139 3.972 4.396 . 0 0 "[ . 1 . 2 . 3]" 2 2509 1 52 PHE HA 1 53 GLY HA2 2.800 . 6.000 4.126 4.110 4.148 . 0 0 "[ . 1 . 2 . 3]" 2 2510 1 64 ASN HB3 1 67 ARG HD2 2.600 . 6.000 3.461 2.656 3.939 . 0 0 "[ . 1 . 2 . 3]" 2 2511 1 42 GLY HA3 1 131 ARG HD2 3.200 2.100 4.500 4.303 3.833 4.502 0.002 8 0 "[ . 1 . 2 . 3]" 2 2512 1 45 MET ME 1 131 ARG HD2 2.900 . 6.000 4.218 3.627 5.134 . 0 0 "[ . 1 . 2 . 3]" 2 2513 1 42 GLY HA2 1 131 ARG HD3 3.100 . 6.000 6.132 5.790 6.520 0.520 16 1 "[ . 1 .+ 2 . 3]" 2 2514 1 91 VAL HB 1 125 CYS HB3 3.300 . 4.900 4.759 4.651 4.854 . 0 0 "[ . 1 . 2 . 3]" 2 2515 1 73 TYR HB2 1 74 TYR QD 2.800 . 6.000 5.402 5.123 5.572 . 0 0 "[ . 1 . 2 . 3]" 2 2516 1 96 LYS QD 1 96 LYS HE3 1.900 . 2.600 2.008 1.878 2.111 . 0 0 "[ . 1 . 2 . 3]" 2 2517 1 96 LYS HA 1 96 LYS QE 2.800 . 4.000 3.616 2.997 3.993 . 0 0 "[ . 1 . 2 . 3]" 2 2518 1 96 LYS QE 1 96 LYS HG3 3.000 2.400 3.800 2.814 1.940 3.283 0.460 28 0 "[ . 1 . 2 . 3]" 2 2519 1 96 LYS QE 1 96 LYS HG2 2.300 . 3.100 2.232 1.907 3.061 . 0 0 "[ . 1 . 2 . 3]" 2 2520 1 72 VAL MG1 1 125 CYS HB2 2.700 . 6.000 4.212 3.859 4.357 . 0 0 "[ . 1 . 2 . 3]" 2 2521 1 56 TYR HB3 1 115 LYS HE3 3.000 . 6.000 5.972 5.708 6.242 0.242 19 0 "[ . 1 . 2 . 3]" 2 2522 1 64 ASN HB2 1 68 TYR HB2 3.200 . 4.600 3.690 2.950 4.068 . 0 0 "[ . 1 . 2 . 3]" 2 2523 1 55 ASP QB 1 58 ASP HB3 2.600 . 6.000 4.757 4.322 5.271 . 0 0 "[ . 1 . 2 . 3]" 2 2524 1 132 GLU HB2 1 136 TYR HB3 3.200 . 6.000 5.698 5.100 5.978 . 0 0 "[ . 1 . 2 . 3]" 2 2525 1 92 ASN HB3 1 93 ILE HG12 3.100 . 6.000 4.719 4.057 5.404 . 0 0 "[ . 1 . 2 . 3]" 2 2526 1 92 ASN HB2 1 93 ILE HG12 3.000 . 6.000 4.710 4.239 5.240 . 0 0 "[ . 1 . 2 . 3]" 2 2527 1 56 TYR HB2 1 57 GLU QG 3.400 . 6.000 4.933 4.289 5.152 . 0 0 "[ . 1 . 2 . 3]" 2 2528 1 56 TYR HA 1 56 TYR HB2 2.500 . 3.500 2.130 2.100 2.172 . 0 0 "[ . 1 . 2 . 3]" 2 2529 1 56 TYR HB2 1 59 ARG HB2 3.300 . 4.900 3.793 3.606 4.144 . 0 0 "[ . 1 . 2 . 3]" 2 2530 1 56 TYR HB2 1 57 GLU QG 3.300 2.100 4.700 3.996 3.760 4.470 . 0 0 "[ . 1 . 2 . 3]" 2 2531 1 86 PHE HB3 1 125 CYS HB3 3.100 . 6.000 4.810 4.544 5.036 . 0 0 "[ . 1 . 2 . 3]" 2 2532 1 93 ILE HB 1 96 LYS QB 3.100 . 6.000 4.765 4.681 4.913 . 0 0 "[ . 1 . 2 . 3]" 2 2533 1 39 TYR QB 1 93 ILE HB 3.400 . 4.900 4.490 4.086 4.868 . 0 0 "[ . 1 . 2 . 3]" 2 2534 1 95 ILE HB 1 99 THR MG 3.100 . 4.500 4.070 3.923 4.175 . 0 0 "[ . 1 . 2 . 3]" 2 2535 1 59 ARG HG2 1 63 GLU QG 3.000 . 6.000 4.590 4.247 5.018 . 0 0 "[ . 1 . 2 . 3]" 2 2536 1 63 GLU HA 1 63 GLU QG 2.300 . 3.200 2.237 1.964 3.070 . 0 0 "[ . 1 . 2 . 3]" 2 2537 1 118 GLU QG 1 121 VAL MG1 3.100 . 6.000 4.730 4.582 5.051 . 0 0 "[ . 1 . 2 . 3]" 2 2538 1 48 PRO HB2 1 49 ILE HB 3.000 . 6.000 5.579 5.287 5.685 . 0 0 "[ . 1 . 2 . 3]" 2 2539 1 102 THR HA 1 107 GLU HG2 2.600 . 6.000 4.557 3.946 5.441 . 0 0 "[ . 1 . 2 . 3]" 2 2540 1 48 PRO HB2 1 122 GLU HG2 2.400 . 6.000 5.434 5.111 5.714 . 0 0 "[ . 1 . 2 . 3]" 2 2541 1 68 TYR QB 1 116 MET HB2 3.300 . 4.900 4.232 3.869 4.438 . 0 0 "[ . 1 . 2 . 3]" 2 2542 1 65 MET HB2 1 68 TYR HB2 3.000 . 4.400 3.442 3.398 3.475 . 0 0 "[ . 1 . 2 . 3]" 2 2543 1 116 MET HA 1 116 MET QG 2.400 . 3.300 2.333 2.296 2.467 . 0 0 "[ . 1 . 2 . 3]" 2 2544 1 44 ALA MB 1 71 GLN HG3 2.700 . 3.800 2.911 2.703 3.117 . 0 0 "[ . 1 . 2 . 3]" 2 2545 1 115 LYS HB3 1 116 MET QG 2.500 . 3.500 2.209 2.120 2.263 . 0 0 "[ . 1 . 2 . 3]" 2 2546 1 43 SER HA 1 71 GLN HG3 2.400 . 3.300 3.201 2.869 3.326 0.026 14 0 "[ . 1 . 2 . 3]" 2 2547 1 134 GLN HA 1 134 GLN QG 2.300 . 3.200 2.298 1.983 2.785 . 0 0 "[ . 1 . 2 . 3]" 2 2548 1 138 GLN HA 1 138 GLN HG2 2.200 . 6.000 3.286 3.222 3.352 . 0 0 "[ . 1 . 2 . 3]" 2 2549 1 43 SER HA 1 71 GLN HG2 2.400 . 3.300 2.321 2.114 2.419 . 0 0 "[ . 1 . 2 . 3]" 2 2550 1 45 MET ME 1 72 VAL HB 2.900 . 4.200 3.873 3.722 4.019 . 0 0 "[ . 1 . 2 . 3]" 2 2551 1 50 ILE HG13 1 123 GLN HG3 2.800 . 4.000 3.533 3.376 3.739 . 0 0 "[ . 1 . 2 . 3]" 2 2552 1 41 LEU MD1 1 71 GLN HG2 3.200 . 4.700 4.545 4.326 4.721 0.021 24 0 "[ . 1 . 2 . 3]" 2 2553 1 94 THR HA 1 97 GLN HG2 2.800 . 4.000 3.200 3.001 3.322 . 0 0 "[ . 1 . 2 . 3]" 2 2554 1 41 LEU HG 1 97 GLN HG3 2.600 . 6.000 5.782 5.470 6.038 0.038 18 0 "[ . 1 . 2 . 3]" 2 2555 1 94 THR HB 1 117 MET HB3 2.200 . 6.000 5.770 5.655 5.881 . 0 0 "[ . 1 . 2 . 3]" 2 2556 1 68 TYR HB3 1 117 MET HG3 3.100 . 4.500 3.700 2.955 4.016 . 0 0 "[ . 1 . 2 . 3]" 2 2557 1 60 TYR QD 1 116 MET HB2 3.000 . 4.300 4.271 4.152 4.331 0.031 24 0 "[ . 1 . 2 . 3]" 2 2558 1 52 PHE QE 1 116 MET HB2 2.900 . 4.100 2.801 2.049 3.194 . 0 0 "[ . 1 . 2 . 3]" 2 2559 1 115 LYS QB 1 118 GLU QG 2.200 . 6.000 4.175 4.043 4.511 . 0 0 "[ . 1 . 2 . 3]" 2 2560 1 60 TYR HB3 1 116 MET HB3 3.000 . 6.000 5.175 4.889 5.736 . 0 0 "[ . 1 . 2 . 3]" 2 2561 1 47 ARG HB3 1 69 PRO HB2 1.800 . 6.000 6.013 5.895 6.175 0.175 27 0 "[ . 1 . 2 . 3]" 2 2562 1 48 PRO HB2 1 121 VAL HA 2.600 . 6.000 6.040 6.017 6.068 0.068 30 0 "[ . 1 . 2 . 3]" 2 2563 1 44 ALA HA 1 69 PRO HB2 2.700 . 6.000 5.509 5.357 5.592 . 0 0 "[ . 1 . 2 . 3]" 2 2564 1 69 PRO HB2 1 121 VAL MG2 2.600 . 3.600 3.134 2.962 3.231 . 0 0 "[ . 1 . 2 . 3]" 2 2565 1 69 PRO HB2 1 69 PRO HD2 2.800 . 4.000 2.520 2.382 2.664 . 0 0 "[ . 1 . 2 . 3]" 2 2566 1 72 VAL MG1 1 124 MET HG3 3.300 . 4.900 3.664 3.463 3.821 . 0 0 "[ . 1 . 2 . 3]" 2 2567 1 40 MET ME 1 40 MET QG 2.100 . 2.900 2.218 2.133 2.280 . 0 0 "[ . 1 . 2 . 3]" 2 2568 1 68 TYR QE 1 116 MET HB3 2.700 . 6.000 4.090 3.938 4.300 . 0 0 "[ . 1 . 2 . 3]" 2 2569 1 48 PRO HB3 1 50 ILE MD 3.200 . 4.700 3.285 2.983 3.385 . 0 0 "[ . 1 . 2 . 3]" 2 2570 1 47 ARG HA 1 124 MET HG3 3.300 . 4.900 4.219 4.004 4.535 . 0 0 "[ . 1 . 2 . 3]" 2 2571 1 61 TYR QE 1 116 MET HB3 2.700 . 3.800 3.805 3.706 3.832 0.032 1 0 "[ . 1 . 2 . 3]" 2 2572 1 47 ARG HB3 1 120 VAL HB 2.200 . 6.000 4.603 4.494 4.753 . 0 0 "[ . 1 . 2 . 3]" 2 2573 1 69 PRO HB2 1 120 VAL HB 2.300 . 6.000 4.073 3.957 4.655 . 0 0 "[ . 1 . 2 . 3]" 2 2574 1 50 ILE MD 1 115 LYS HB3 3.200 . 6.000 6.087 6.020 6.487 0.487 3 0 "[ . 1 . 2 . 3]" 2 2575 1 48 PRO HB3 1 49 ILE HB 1.600 . 6.000 5.025 4.907 5.161 . 0 0 "[ . 1 . 2 . 3]" 2 2576 1 69 PRO HB3 1 69 PRO HD3 3.100 . 4.500 3.791 3.685 3.857 . 0 0 "[ . 1 . 2 . 3]" 2 2577 1 50 ILE HG12 1 120 VAL HB 3.100 . 6.000 4.808 4.587 4.985 . 0 0 "[ . 1 . 2 . 3]" 2 2578 1 87 VAL HB 1 91 VAL HA 2.700 . 6.000 5.838 5.674 6.006 0.006 23 0 "[ . 1 . 2 . 3]" 2 2579 1 50 ILE HG13 1 120 VAL HB 2.700 . 3.800 3.254 3.132 3.364 . 0 0 "[ . 1 . 2 . 3]" 2 2580 1 69 PRO HB3 1 102 THR MG 2.800 . 4.000 4.035 3.966 4.233 0.233 6 0 "[ . 1 . 2 . 3]" 2 2581 1 40 MET QG 1 73 TYR QB 2.900 . 6.000 5.934 5.724 6.094 0.094 8 0 "[ . 1 . 2 . 3]" 2 2582 1 115 LYS HB3 1 115 LYS QE 2.600 . 3.700 2.681 2.428 3.431 . 0 0 "[ . 1 . 2 . 3]" 2 2583 1 87 VAL HB 1 87 VAL QG 1.900 . 2.600 1.753 1.737 1.771 . 0 0 "[ . 1 . 2 . 3]" 2 2584 1 44 ALA MB 1 45 MET HG3 3.100 . 4.500 3.699 3.111 4.031 . 0 0 "[ . 1 . 2 . 3]" 2 2585 1 69 PRO HG2 1 98 HIS HB2 3.100 . 4.500 3.127 2.964 3.277 . 0 0 "[ . 1 . 2 . 3]" 2 2586 1 118 GLU HA 1 121 VAL HB 2.600 . 3.600 2.749 2.697 2.802 . 0 0 "[ . 1 . 2 . 3]" 2 2587 1 102 THR HA 1 107 GLU HB2 2.500 . 6.000 3.537 3.248 3.912 . 0 0 "[ . 1 . 2 . 3]" 2 2588 1 102 THR HA 1 107 GLU HB3 2.500 . 6.000 3.870 3.566 4.485 . 0 0 "[ . 1 . 2 . 3]" 2 2589 1 122 GLU HA 1 126 ILE HG13 2.700 . 3.800 3.614 3.133 3.699 . 0 0 "[ . 1 . 2 . 3]" 2 2590 1 65 MET HA 1 65 MET HB3 2.800 . 4.000 2.214 2.074 2.345 . 0 0 "[ . 1 . 2 . 3]" 2 2591 1 95 ILE HG12 1 99 THR MG 2.600 . 6.000 3.761 3.624 3.920 . 0 0 "[ . 1 . 2 . 3]" 2 2592 1 63 GLU QB 1 65 MET HB2 3.200 . 6.000 5.867 5.515 6.020 0.020 24 0 "[ . 1 . 2 . 3]" 2 2593 1 67 ARG HB3 1 67 ARG HD3 2.700 . 3.800 2.699 2.285 3.016 . 0 0 "[ . 1 . 2 . 3]" 2 2594 1 59 ARG HB2 1 60 TYR HA 2.600 . 3.700 3.190 2.977 3.528 . 0 0 "[ . 1 . 2 . 3]" 2 2595 1 59 ARG HA 1 59 ARG QB 2.100 . 2.800 2.112 1.992 2.194 . 0 0 "[ . 1 . 2 . 3]" 2 2596 1 95 ILE HB 1 95 ILE HG12 2.300 . 3.200 2.743 2.674 2.782 . 0 0 "[ . 1 . 2 . 3]" 2 2597 1 42 GLY HA2 1 131 ARG HB2 3.400 . 6.000 5.425 5.337 5.529 . 0 0 "[ . 1 . 2 . 3]" 2 2598 1 47 ARG HB3 1 70 ASN HB3 3.000 . 4.300 3.984 3.165 4.315 0.015 6 0 "[ . 1 . 2 . 3]" 2 2599 1 111 LYS HA 1 111 LYS HD2 2.500 . 3.500 2.819 2.034 2.968 . 0 0 "[ . 1 . 2 . 3]" 2 2600 1 115 LYS HA 1 115 LYS HD2 2.600 . 3.700 2.832 2.554 3.604 . 0 0 "[ . 1 . 2 . 3]" 2 2601 1 95 ILE HG12 1 118 GLU HB3 2.500 . 6.000 5.420 5.305 5.607 . 0 0 "[ . 1 . 2 . 3]" 2 2602 1 91 VAL QG 1 118 GLU HB2 3.000 . 6.000 4.297 4.031 4.413 . 0 0 "[ . 1 . 2 . 3]" 2 2603 1 49 ILE MG 1 62 ARG QG 3.000 . 4.400 3.457 3.175 3.690 . 0 0 "[ . 1 . 2 . 3]" 2 2604 1 115 LYS HA 1 118 GLU HB3 2.600 . 6.000 4.191 3.953 4.279 . 0 0 "[ . 1 . 2 . 3]" 2 2605 1 97 GLN HB3 1 100 VAL MG2 3.400 . 6.000 5.411 5.304 5.733 . 0 0 "[ . 1 . 2 . 3]" 2 2606 1 127 THR HA 1 130 GLU HB3 2.600 . 6.000 4.015 3.784 4.231 . 0 0 "[ . 1 . 2 . 3]" 2 2607 1 85 ASN HA 1 88 HIS QB 2.600 . 6.000 2.606 2.121 3.209 . 0 0 "[ . 1 . 2 . 3]" 2 2608 1 72 VAL MG1 1 97 GLN HB2 3.100 . 6.000 6.027 5.908 6.075 0.075 29 0 "[ . 1 . 2 . 3]" 2 2609 1 123 GLN HA 1 123 GLN HB2 2.400 . 3.300 2.788 2.652 2.836 . 0 0 "[ . 1 . 2 . 3]" 2 2610 1 50 ILE HG13 1 123 GLN HB2 3.200 . 4.600 4.391 4.229 4.595 . 0 0 "[ . 1 . 2 . 3]" 2 2611 1 94 THR HA 1 97 GLN HB2 2.400 . 3.300 2.553 2.522 2.602 . 0 0 "[ . 1 . 2 . 3]" 2 2612 1 39 TYR QB 1 93 ILE HG13 3.300 . 4.800 3.767 3.424 4.140 . 0 0 "[ . 1 . 2 . 3]" 2 2613 1 72 VAL MG1 1 97 GLN HB3 3.400 . 6.000 5.993 5.950 6.076 0.076 25 0 "[ . 1 . 2 . 3]" 2 2614 1 66 HIS HB3 1 67 ARG HG3 2.800 . 4.000 2.771 2.359 2.955 . 0 0 "[ . 1 . 2 . 3]" 2 2615 1 49 ILE HA 1 49 ILE HG12 2.500 . 3.500 2.579 2.199 2.861 . 0 0 "[ . 1 . 2 . 3]" 2 2616 1 69 PRO HG2 1 102 THR MG 2.800 . 4.000 3.858 3.737 3.935 . 0 0 "[ . 1 . 2 . 3]" 2 2617 1 48 PRO QG 1 72 VAL MG1 3.500 2.100 4.900 4.824 4.719 4.908 0.008 30 0 "[ . 1 . 2 . 3]" 2 2618 1 49 ILE HA 1 49 ILE HG13 2.800 . 4.000 3.678 3.206 3.802 . 0 0 "[ . 1 . 2 . 3]" 2 2619 1 130 GLU HB2 1 131 ARG HG2 3.000 . 6.000 4.694 4.168 5.348 . 0 0 "[ . 1 . 2 . 3]" 2 2620 1 36 LEU HA 1 36 LEU HG 2.700 . 3.800 2.638 2.420 3.103 . 0 0 "[ . 1 . 2 . 3]" 2 2621 1 50 ILE HG13 1 116 MET HB3 3.300 . 4.800 3.989 3.899 4.158 . 0 0 "[ . 1 . 2 . 3]" 2 2622 1 41 LEU MD1 1 71 GLN HB3 2.800 . 4.000 3.744 3.576 3.931 . 0 0 "[ . 1 . 2 . 3]" 2 2623 1 105 LYS HB2 1 105 LYS QG 2.100 . 2.800 1.963 1.900 2.047 . 0 0 "[ . 1 . 2 . 3]" 2 2624 1 105 LYS QE 1 105 LYS QG 2.500 . 3.500 1.971 1.775 2.284 . 0 0 "[ . 1 . 2 . 3]" 2 2625 1 111 LYS HB3 1 111 LYS HG2 2.200 . 3.000 2.055 1.933 2.361 . 0 0 "[ . 1 . 2 . 3]" 2 2626 1 96 LYS HG2 1 100 VAL MG1 2.600 . 6.000 5.166 4.945 5.343 . 0 0 "[ . 1 . 2 . 3]" 2 2627 1 91 VAL HB 1 121 VAL MG1 2.500 . 3.500 3.159 2.969 3.261 . 0 0 "[ . 1 . 2 . 3]" 2 2628 1 105 LYS QG 1 106 GLY HA2 3.200 . 6.000 5.059 3.801 5.748 . 0 0 "[ . 1 . 2 . 3]" 2 2629 1 69 PRO HB2 1 121 VAL MG1 2.800 . 6.000 5.019 4.775 5.148 . 0 0 "[ . 1 . 2 . 3]" 2 2630 1 69 PRO HB2 1 121 VAL MG1 3.100 . 6.000 5.402 5.126 5.595 . 0 0 "[ . 1 . 2 . 3]" 2 2631 1 36 LEU MD1 1 94 THR HA 3.500 2.100 4.900 4.562 3.845 4.943 0.043 28 0 "[ . 1 . 2 . 3]" 2 2632 1 36 LEU HB2 1 36 LEU MD1 2.200 . 3.000 2.257 1.875 2.829 . 0 0 "[ . 1 . 2 . 3]" 2 2633 1 86 PHE HB3 1 87 VAL MG1 3.000 . 4.300 2.725 2.478 3.045 . 0 0 "[ . 1 . 2 . 3]" 2 2634 1 75 ARG HB2 1 87 VAL MG1 2.900 . 6.000 6.046 5.744 6.170 0.170 17 0 "[ . 1 . 2 . 3]" 2 2635 1 98 HIS HA 1 105 LYS QG 3.000 . 6.000 5.206 4.147 6.217 0.217 30 0 "[ . 1 . 2 . 3]" 2 2636 1 83 GLN HB3 1 87 VAL MG1 2.500 . 3.500 2.866 2.435 3.359 . 0 0 "[ . 1 . 2 . 3]" 2 2637 1 87 VAL MG1 1 125 CYS HB3 2.100 . 2.900 2.049 1.905 2.310 . 0 0 "[ . 1 . 2 . 3]" 2 2638 1 69 PRO HB2 1 121 VAL MG2 2.600 . 3.500 3.303 3.047 3.445 . 0 0 "[ . 1 . 2 . 3]" 2 2639 1 72 VAL MG1 1 121 VAL HA 2.100 . 2.800 2.158 2.072 2.240 . 0 0 "[ . 1 . 2 . 3]" 2 2640 1 72 VAL MG1 1 121 VAL MG1 1.900 . 2.500 1.710 1.555 1.827 . 0 0 "[ . 1 . 2 . 3]" 2 2641 1 50 ILE HG12 1 120 VAL MG1 2.600 . 6.000 3.910 3.718 4.212 . 0 0 "[ . 1 . 2 . 3]" 2 2642 1 49 ILE HA 1 120 VAL MG1 2.700 . 6.000 4.580 4.490 4.732 . 0 0 "[ . 1 . 2 . 3]" 2 2643 1 120 VAL MG1 1 123 GLN HG3 3.000 2.200 4.000 3.640 3.415 3.745 . 0 0 "[ . 1 . 2 . 3]" 2 2644 1 120 VAL MG1 1 123 GLN HB2 2.500 . 6.000 3.615 3.534 3.694 . 0 0 "[ . 1 . 2 . 3]" 2 2645 1 72 VAL MG1 1 94 THR MG 2.100 . 2.800 1.682 1.580 1.820 0.020 19 0 "[ . 1 . 2 . 3]" 2 2646 1 47 ARG HB3 1 121 VAL MG2 3.000 . 6.000 5.643 5.567 5.711 . 0 0 "[ . 1 . 2 . 3]" 2 2647 1 45 MET HG3 1 72 VAL MG1 2.700 . 6.000 3.911 3.778 4.076 . 0 0 "[ . 1 . 2 . 3]" 2 2648 1 91 VAL QG 1 92 ASN HB3 2.700 . 6.000 2.987 2.770 3.168 . 0 0 "[ . 1 . 2 . 3]" 2 2649 1 72 VAL MG1 1 72 VAL MG2 1.900 . 2.500 1.862 1.731 1.974 . 0 0 "[ . 1 . 2 . 3]" 2 2650 1 88 HIS QB 1 91 VAL QG 2.900 . 6.000 3.344 3.175 3.515 . 0 0 "[ . 1 . 2 . 3]" 2 2651 1 88 HIS HA 1 91 VAL QG 2.600 . 3.600 2.744 2.173 3.090 . 0 0 "[ . 1 . 2 . 3]" 2 2652 1 91 VAL HA 1 91 VAL QG 2.000 . 2.700 1.993 1.904 2.048 . 0 0 "[ . 1 . 2 . 3]" 2 2653 1 111 LYS QB 1 114 VAL MG1 3.000 2.100 4.100 3.847 3.679 4.119 0.019 27 0 "[ . 1 . 2 . 3]" 2 2654 1 99 THR HA 1 114 VAL MG1 2.700 . 6.000 4.503 4.219 4.633 . 0 0 "[ . 1 . 2 . 3]" 2 2655 1 110 THR HA 1 114 VAL MG1 3.300 . 4.900 3.953 3.776 4.102 . 0 0 "[ . 1 . 2 . 3]" 2 2656 1 94 THR MG 1 95 ILE HA 2.500 . 3.500 3.175 3.086 3.333 . 0 0 "[ . 1 . 2 . 3]" 2 2657 1 94 THR MG 1 97 GLN HB2 2.600 . 3.700 3.115 2.956 3.199 . 0 0 "[ . 1 . 2 . 3]" 2 2658 1 72 VAL MG2 1 94 THR MG 2.500 . 6.000 3.296 3.068 3.554 . 0 0 "[ . 1 . 2 . 3]" 2 2659 1 94 THR MG 1 95 ILE HB 3.000 . 6.000 4.625 4.486 4.714 . 0 0 "[ . 1 . 2 . 3]" 2 2660 1 95 ILE HA 1 99 THR MG 2.800 . 4.000 3.029 2.885 3.129 . 0 0 "[ . 1 . 2 . 3]" 2 2661 1 87 VAL HB 1 87 VAL MG2 1.700 . 2.400 1.875 1.859 1.897 . 0 0 "[ . 1 . 2 . 3]" 2 2662 1 83 GLN HB3 1 87 VAL MG2 2.800 . 3.800 3.901 3.561 4.150 0.350 4 0 "[ . 1 . 2 . 3]" 2 2663 1 41 LEU MD2 1 74 TYR QD 2.800 . 6.000 4.779 4.544 5.012 . 0 0 "[ . 1 . 2 . 3]" 2 2664 1 83 GLN HA 1 87 VAL MG2 2.200 . 6.000 3.633 3.528 3.798 . 0 0 "[ . 1 . 2 . 3]" 2 2665 1 108 ASN HB3 1 110 THR MG 3.000 . 6.000 4.315 3.645 4.778 . 0 0 "[ . 1 . 2 . 3]" 2 2666 1 87 VAL MG2 1 88 HIS HA 2.600 . 3.700 3.004 2.814 3.182 . 0 0 "[ . 1 . 2 . 3]" 2 2667 1 41 LEU MD2 1 72 VAL HB 3.300 . 4.900 4.711 4.392 4.901 0.001 13 0 "[ . 1 . 2 . 3]" 2 2668 1 48 PRO QD 1 120 VAL MG2 2.700 . 3.800 3.679 3.439 3.788 . 0 0 "[ . 1 . 2 . 3]" 2 2669 1 88 HIS HD2 1 91 VAL QG 2.800 2.100 3.700 3.611 3.117 3.717 0.017 21 0 "[ . 1 . 2 . 3]" 2 2670 1 98 HIS HB2 1 99 THR MG 2.900 . 4.100 2.925 2.662 3.095 . 0 0 "[ . 1 . 2 . 3]" 2 2671 1 61 TYR HA 1 112 THR MG 3.100 . 6.000 4.834 4.680 4.963 . 0 0 "[ . 1 . 2 . 3]" 2 2672 1 112 THR MG 1 115 LYS HE3 2.300 . 3.200 2.860 2.661 2.991 . 0 0 "[ . 1 . 2 . 3]" 2 2673 1 68 TYR HB3 1 120 VAL MG2 2.300 . 6.000 3.962 3.561 4.185 . 0 0 "[ . 1 . 2 . 3]" 2 2674 1 52 PHE HB3 1 120 VAL MG2 3.300 . 6.000 5.339 4.583 5.762 . 0 0 "[ . 1 . 2 . 3]" 2 2675 1 49 ILE HB 1 120 VAL MG2 2.100 . 6.000 4.425 4.207 4.683 . 0 0 "[ . 1 . 2 . 3]" 2 2676 1 118 GLU HA 1 120 VAL MG2 2.400 . 6.000 5.033 4.985 5.061 . 0 0 "[ . 1 . 2 . 3]" 2 2677 1 103 THR MG 1 107 GLU HB3 2.500 . 6.000 3.663 2.970 3.987 . 0 0 "[ . 1 . 2 . 3]" 2 2678 1 65 MET HG2 1 120 VAL MG2 2.600 . 6.000 4.117 3.969 4.195 . 0 0 "[ . 1 . 2 . 3]" 2 2679 1 72 VAL MG2 1 74 TYR HA 3.400 . 5.000 4.718 4.551 4.878 . 0 0 "[ . 1 . 2 . 3]" 2 2680 1 39 TYR HB3 1 72 VAL MG2 3.400 . 4.900 4.925 4.882 5.042 0.142 4 0 "[ . 1 . 2 . 3]" 2 2681 1 36 LEU HG 1 93 ILE MG 2.600 . 6.000 3.899 3.131 4.232 . 0 0 "[ . 1 . 2 . 3]" 2 2682 1 45 MET ME 1 72 VAL MG2 2.200 . 3.000 2.160 1.846 2.410 . 0 0 "[ . 1 . 2 . 3]" 2 2683 1 41 LEU HA 1 72 VAL MG2 2.800 . 4.000 3.469 3.284 3.607 . 0 0 "[ . 1 . 2 . 3]" 2 2684 1 44 ALA MB 1 45 MET HA 2.800 . 4.000 3.725 3.649 3.792 . 0 0 "[ . 1 . 2 . 3]" 2 2685 1 72 VAL MG2 1 121 VAL HA 2.900 . 6.000 4.376 4.251 4.491 . 0 0 "[ . 1 . 2 . 3]" 2 2686 1 39 TYR HA 1 93 ILE MG 2.900 . 6.000 4.313 4.136 4.460 . 0 0 "[ . 1 . 2 . 3]" 2 2687 1 57 GLU QG 1 116 MET ME 2.400 . 3.300 2.559 2.284 2.793 . 0 0 "[ . 1 . 2 . 3]" 2 2688 1 60 TYR HA 1 116 MET ME 2.700 . 6.000 4.417 4.265 4.583 . 0 0 "[ . 1 . 2 . 3]" 2 2689 1 57 GLU HA 1 116 MET ME 2.100 . 2.800 2.717 2.482 2.832 0.032 27 0 "[ . 1 . 2 . 3]" 2 2690 1 45 MET ME 1 129 TYR HB3 2.900 . 6.000 4.896 3.495 5.531 . 0 0 "[ . 1 . 2 . 3]" 2 2691 1 45 MET ME 1 48 PRO QD 2.700 . 6.000 4.217 4.069 4.487 . 0 0 "[ . 1 . 2 . 3]" 2 2692 1 45 MET ME 1 121 VAL HA 2.400 . 6.000 3.997 3.643 4.322 . 0 0 "[ . 1 . 2 . 3]" 2 2693 1 48 PRO HD2 1 65 MET ME 2.100 . 6.000 3.378 2.646 3.623 . 0 0 "[ . 1 . 2 . 3]" 2 2694 1 65 MET ME 1 70 ASN HB3 3.000 . 6.000 5.988 5.895 6.049 0.049 24 0 "[ . 1 . 2 . 3]" 2 2695 1 47 ARG HA 1 65 MET ME 2.500 . 6.000 3.919 3.731 4.152 . 0 0 "[ . 1 . 2 . 3]" 2 2696 1 49 ILE MG 1 65 MET ME 2.500 . 6.000 3.613 3.430 3.939 . 0 0 "[ . 1 . 2 . 3]" 2 2697 1 49 ILE MG 1 50 ILE HA 2.900 . 4.200 3.904 3.657 4.046 . 0 0 "[ . 1 . 2 . 3]" 2 2698 1 50 ILE MG 1 51 HIS HB3 3.000 . 4.300 3.981 3.612 4.142 . 0 0 "[ . 1 . 2 . 3]" 2 2699 1 48 PRO HB3 1 50 ILE MG 3.100 . 6.000 4.691 4.514 4.884 . 0 0 "[ . 1 . 2 . 3]" 2 2700 1 49 ILE HA 1 50 ILE MG 3.100 . 4.500 4.142 3.909 4.353 . 0 0 "[ . 1 . 2 . 3]" 2 2701 1 76 PRO HB3 1 77 MET ME 2.200 . 6.000 5.529 5.331 6.055 0.055 12 0 "[ . 1 . 2 . 3]" 2 2702 1 87 VAL MG1 1 126 ILE MG 2.300 . 3.100 2.760 2.682 2.826 . 0 0 "[ . 1 . 2 . 3]" 2 2703 1 92 ASN HA 1 95 ILE MG 2.900 . 4.200 4.118 3.930 4.206 0.006 10 0 "[ . 1 . 2 . 3]" 2 2704 1 94 THR HB 1 95 ILE MG 3.000 . 6.000 4.241 4.064 4.414 . 0 0 "[ . 1 . 2 . 3]" 2 2705 1 95 ILE MG 1 98 HIS HB2 3.200 . 4.700 4.243 4.081 4.431 . 0 0 "[ . 1 . 2 . 3]" 2 2706 1 72 VAL MG1 1 124 MET ME 1.800 . 2.400 1.961 1.830 2.162 . 0 0 "[ . 1 . 2 . 3]" 2 2707 1 70 ASN HB2 1 124 MET ME 2.100 . 6.000 3.279 3.233 3.318 . 0 0 "[ . 1 . 2 . 3]" 2 2708 1 44 ALA HA 1 124 MET ME 2.500 . 6.000 3.992 3.691 4.234 . 0 0 "[ . 1 . 2 . 3]" 2 2709 1 98 HIS HA 1 117 MET ME 2.900 . 6.000 4.688 4.513 4.852 . 0 0 "[ . 1 . 2 . 3]" 2 2710 1 122 GLU HA 1 126 ILE MD 2.400 . 6.000 3.591 3.512 3.687 . 0 0 "[ . 1 . 2 . 3]" 2 2711 1 94 THR HA 1 95 ILE MD 3.300 . 6.000 4.930 4.798 5.027 . 0 0 "[ . 1 . 2 . 3]" 2 2712 1 91 VAL QG 1 95 ILE MD 2.100 . 2.900 1.782 1.684 1.930 . 0 0 "[ . 1 . 2 . 3]" 2 2713 1 95 ILE HB 1 95 ILE MD 2.100 . 2.800 1.955 1.819 2.076 . 0 0 "[ . 1 . 2 . 3]" 2 2714 1 49 ILE HA 1 50 ILE MD 2.900 . 6.000 4.243 4.046 4.325 . 0 0 "[ . 1 . 2 . 3]" 2 2715 1 50 ILE MD 1 117 MET HA 3.100 . 6.000 5.548 5.426 5.897 . 0 0 "[ . 1 . 2 . 3]" 2 2716 1 50 ILE MD 1 118 GLU HA 3.300 . 6.000 5.569 5.461 5.902 . 0 0 "[ . 1 . 2 . 3]" 2 2717 1 93 ILE MD 1 94 THR HA 3.200 . 4.700 4.486 4.264 4.607 . 0 0 "[ . 1 . 2 . 3]" 2 2718 1 41 LEU HA 1 93 ILE MD 3.200 . 6.000 5.704 5.376 5.999 . 0 0 "[ . 1 . 2 . 3]" 2 2719 1 48 PRO HD2 1 49 ILE MD 3.300 . 4.900 4.660 4.399 4.902 0.002 12 0 "[ . 1 . 2 . 3]" 2 2720 1 47 ARG HB3 1 49 ILE MD 2.700 . 6.000 3.876 3.264 4.213 . 0 0 "[ . 1 . 2 . 3]" 2 2721 1 48 PRO HB2 1 50 ILE H 3.800 . 5.600 4.580 4.117 4.878 . 0 0 "[ . 1 . 2 . 3]" 2 2722 1 49 ILE MG 1 50 ILE H 2.500 . 3.500 2.179 1.983 2.264 . 0 0 "[ . 1 . 2 . 3]" 2 2723 1 45 MET HB2 1 47 ARG H 3.000 . 4.300 4.136 3.996 4.305 0.005 18 0 "[ . 1 . 2 . 3]" 2 2724 1 44 ALA MB 1 47 ARG H 3.400 . 4.900 4.919 4.852 5.017 0.117 8 0 "[ . 1 . 2 . 3]" 2 2725 1 45 MET HG3 1 47 ARG H 3.500 . 5.000 4.688 4.532 5.007 0.007 8 0 "[ . 1 . 2 . 3]" 2 2726 1 45 MET ME 1 47 ARG H 3.700 . 6.000 5.908 5.762 6.019 0.019 13 0 "[ . 1 . 2 . 3]" 2 2727 1 43 SER HA 1 44 ALA H 1.900 . 2.600 2.306 2.262 2.348 . 0 0 "[ . 1 . 2 . 3]" 2 2728 1 89 ASP HA 1 91 VAL H 3.700 . 5.400 4.164 4.027 4.279 . 0 0 "[ . 1 . 2 . 3]" 2 2729 1 87 VAL MG2 1 91 VAL H 2.400 . 6.000 2.199 2.060 2.344 . 0 0 "[ . 1 . 2 . 3]" 2 2730 1 89 ASP HB3 1 91 VAL H 3.200 . 4.700 4.118 3.908 4.330 . 0 0 "[ . 1 . 2 . 3]" 2 2731 1 89 ASP HB2 1 91 VAL H 3.000 . 4.400 4.022 3.932 4.134 . 0 0 "[ . 1 . 2 . 3]" 2 2732 1 55 ASP H 1 58 ASP H 3.800 . 5.600 4.583 4.556 4.607 . 0 0 "[ . 1 . 2 . 3]" 2 2733 1 52 PHE H 1 53 GLY HA3 4.000 2.300 5.700 5.344 5.067 5.677 . 0 0 "[ . 1 . 2 . 3]" 2 2734 1 51 HIS HB3 1 52 PHE H 2.700 . 3.800 3.239 2.781 3.437 . 0 0 "[ . 1 . 2 . 3]" 2 2735 1 51 HIS H 1 52 PHE H 3.200 . 4.700 3.482 1.935 4.095 . 0 0 "[ . 1 . 2 . 3]" 2 2736 1 51 HIS HB2 1 52 PHE H 3.100 . 4.500 3.929 2.831 4.332 . 0 0 "[ . 1 . 2 . 3]" 2 2737 1 93 ILE HB 1 96 LYS H 3.300 . 4.800 4.219 4.060 4.384 . 0 0 "[ . 1 . 2 . 3]" 2 2738 1 92 ASN HB3 1 96 LYS H 3.900 . 5.800 4.972 4.553 5.236 . 0 0 "[ . 1 . 2 . 3]" 2 2739 1 100 VAL H 1 101 THR HB 3.100 . 6.000 5.297 5.231 5.345 . 0 0 "[ . 1 . 2 . 3]" 2 2740 1 141 SER HB3 1 142 SER H 2.600 . 3.600 2.548 1.866 3.167 . 0 0 "[ . 1 . 2 . 3]" 2 2741 1 48 PRO HG3 1 49 ILE H 3.000 . 4.300 4.293 4.145 4.370 0.070 20 0 "[ . 1 . 2 . 3]" 2 2742 1 72 VAL MG1 1 128 GLN H 3.100 . 6.000 5.328 5.160 5.594 . 0 0 "[ . 1 . 2 . 3]" 2 2743 1 118 GLU QG 1 121 VAL H 3.400 2.200 4.800 4.489 4.277 4.688 . 0 0 "[ . 1 . 2 . 3]" 2 2744 1 120 VAL MG2 1 121 VAL H 2.500 . 6.000 3.368 3.325 3.402 . 0 0 "[ . 1 . 2 . 3]" 2 2745 1 83 GLN QB 1 129 TYR H 3.000 . 6.000 5.291 4.770 6.469 0.469 26 0 "[ . 1 . 2 . 3]" 2 2746 1 72 VAL HB 1 73 TYR H 2.500 . 3.500 2.165 2.141 2.199 . 0 0 "[ . 1 . 2 . 3]" 2 2747 1 40 MET HB3 1 41 LEU H 2.300 . 3.100 2.461 2.402 2.503 . 0 0 "[ . 1 . 2 . 3]" 2 2748 1 69 PRO HB2 1 121 VAL H 3.800 . 5.600 4.804 4.659 4.946 . 0 0 "[ . 1 . 2 . 3]" 2 2749 1 40 MET HA 1 41 LEU H 2.100 . 2.800 2.268 2.260 2.284 . 0 0 "[ . 1 . 2 . 3]" 2 2750 1 73 TYR H 1 94 THR MG 2.700 . 3.800 2.953 2.862 3.096 . 0 0 "[ . 1 . 2 . 3]" 2 2751 1 65 MET HB2 1 68 TYR H 2.800 . 6.000 4.217 3.879 4.464 . 0 0 "[ . 1 . 2 . 3]" 2 2752 1 65 MET H 1 68 TYR H 3.200 . 4.700 3.707 3.603 3.912 . 0 0 "[ . 1 . 2 . 3]" 2 2753 1 65 MET HG2 1 68 TYR H 3.200 . 4.700 4.087 3.822 4.402 . 0 0 "[ . 1 . 2 . 3]" 2 2754 1 95 ILE H 1 95 ILE HG12 2.500 . 6.000 4.000 3.942 4.051 . 0 0 "[ . 1 . 2 . 3]" 2 2755 1 45 MET H 1 45 MET QG 2.500 . 3.500 1.837 1.708 2.007 . 0 0 "[ . 1 . 2 . 3]" 2 2756 1 45 MET H 1 45 MET ME 2.800 . 6.000 4.160 4.012 4.267 . 0 0 "[ . 1 . 2 . 3]" 2 2757 1 39 TYR QE 1 40 MET H 3.900 . 5.800 5.619 5.526 5.806 0.006 27 0 "[ . 1 . 2 . 3]" 2 2758 1 134 GLN HA 1 135 ALA H 2.400 . 3.300 2.760 2.742 2.767 . 0 0 "[ . 1 . 2 . 3]" 2 2759 1 43 SER HB2 1 45 MET H 3.900 . 5.800 5.294 5.213 5.358 . 0 0 "[ . 1 . 2 . 3]" 2 2760 1 138 GLN HA 1 139 ARG H 2.100 . 6.000 2.711 2.648 2.764 . 0 0 "[ . 1 . 2 . 3]" 2 2761 1 137 TYR HB3 1 139 ARG H 3.200 . 4.600 4.203 3.796 4.425 . 0 0 "[ . 1 . 2 . 3]" 2 2762 1 57 GLU QG 1 61 TYR H 2.700 . 6.000 4.987 4.827 5.253 . 0 0 "[ . 1 . 2 . 3]" 2 2763 1 91 VAL QG 1 122 GLU H 2.900 . 4.200 2.834 2.626 2.956 . 0 0 "[ . 1 . 2 . 3]" 2 2764 1 132 GLU H 1 135 ALA H 3.700 . 5.400 3.901 3.765 4.002 . 0 0 "[ . 1 . 2 . 3]" 2 2765 1 122 GLU H 1 122 GLU QG 2.400 . 3.300 3.178 2.927 3.356 0.056 22 0 "[ . 1 . 2 . 3]" 2 2766 1 83 GLN H 1 87 VAL H 3.700 . 5.400 4.356 4.090 4.509 . 0 0 "[ . 1 . 2 . 3]" 2 2767 1 58 ASP HB3 1 61 TYR H 3.200 . 6.000 5.345 5.054 5.508 . 0 0 "[ . 1 . 2 . 3]" 2 2768 1 113 ASP H 1 116 MET QG 3.600 . 5.200 4.346 4.276 4.417 . 0 0 "[ . 1 . 2 . 3]" 2 2769 1 109 PHE HB3 1 113 ASP H 3.500 . 5.000 4.976 4.829 5.031 0.031 30 0 "[ . 1 . 2 . 3]" 2 2770 1 83 GLN H 1 84 ASN HB3 3.500 . 5.000 4.401 4.139 4.827 . 0 0 "[ . 1 . 2 . 3]" 2 2771 1 87 VAL H 1 89 ASP HB3 2.800 . 6.000 5.087 4.827 5.311 . 0 0 "[ . 1 . 2 . 3]" 2 2772 1 103 THR MG 1 105 LYS H 2.900 . 4.200 3.962 3.855 4.059 . 0 0 "[ . 1 . 2 . 3]" 2 2773 1 53 GLY H 1 58 ASP H 3.200 . 4.700 3.998 3.827 4.123 . 0 0 "[ . 1 . 2 . 3]" 2 2774 1 52 PHE QE 1 58 ASP H 3.900 . 5.800 5.143 4.978 5.372 . 0 0 "[ . 1 . 2 . 3]" 2 2775 1 69 PRO HD3 1 108 ASN H 2.600 . 6.000 5.812 5.583 5.994 . 0 0 "[ . 1 . 2 . 3]" 2 2776 1 52 PHE QD 1 58 ASP H 2.800 . 4.000 3.419 3.297 3.533 . 0 0 "[ . 1 . 2 . 3]" 2 2777 1 67 ARG HB2 1 108 ASN H 3.200 . 6.000 5.770 5.286 6.199 0.199 23 0 "[ . 1 . 2 . 3]" 2 2778 1 135 ALA H 1 138 GLN H 3.300 . 4.900 4.526 4.320 4.634 . 0 0 "[ . 1 . 2 . 3]" 2 2779 1 137 TYR QE 1 138 GLN H 3.800 . 5.600 4.671 3.547 5.120 . 0 0 "[ . 1 . 2 . 3]" 2 2780 1 48 PRO QD 1 125 CYS H 3.500 . 6.000 5.874 5.807 5.962 . 0 0 "[ . 1 . 2 . 3]" 2 2781 1 135 ALA HA 1 138 GLN H 2.200 . 3.000 2.764 2.720 2.813 . 0 0 "[ . 1 . 2 . 3]" 2 2782 1 123 GLN HG3 1 124 MET H 2.600 . 3.700 3.255 3.020 3.339 . 0 0 "[ . 1 . 2 . 3]" 2 2783 1 77 MET ME 1 138 GLN H 3.500 . 6.000 5.840 4.891 6.018 0.018 7 0 "[ . 1 . 2 . 3]" 2 2784 1 111 LYS HB2 1 114 VAL H 2.600 . 6.000 3.714 3.389 4.006 . 0 0 "[ . 1 . 2 . 3]" 2 2785 1 64 ASN HB2 1 65 MET H 2.500 . 3.500 2.965 2.873 3.082 . 0 0 "[ . 1 . 2 . 3]" 2 2786 1 131 ARG HA 1 132 GLU H 2.700 . 3.800 2.765 2.752 2.773 . 0 0 "[ . 1 . 2 . 3]" 2 2787 1 99 THR MG 1 114 VAL H 2.900 . 6.000 4.060 3.981 4.146 . 0 0 "[ . 1 . 2 . 3]" 2 2788 1 114 VAL H 1 115 LYS H 2.400 . 3.300 2.375 2.348 2.403 . 0 0 "[ . 1 . 2 . 3]" 2 2789 1 48 PRO HG3 1 124 MET H 2.200 . 6.000 3.329 3.231 3.373 . 0 0 "[ . 1 . 2 . 3]" 2 2790 1 89 ASP HB2 1 90 CYS H 2.300 . 3.100 2.321 2.214 2.419 . 0 0 "[ . 1 . 2 . 3]" 2 2791 1 113 ASP H 1 114 VAL H 2.300 . 3.200 2.342 2.321 2.364 . 0 0 "[ . 1 . 2 . 3]" 2 2792 1 50 ILE HG12 1 120 VAL H 3.600 . 5.200 4.501 4.361 4.623 . 0 0 "[ . 1 . 2 . 3]" 2 2793 1 69 PRO HB2 1 98 HIS H 3.300 . 4.900 4.794 4.606 4.883 . 0 0 "[ . 1 . 2 . 3]" 2 2794 1 48 PRO HB2 1 120 VAL H 3.000 . 6.000 3.974 3.770 4.233 . 0 0 "[ . 1 . 2 . 3]" 2 2795 1 53 GLY H 1 57 GLU H 3.400 . 4.900 4.013 3.934 4.177 . 0 0 "[ . 1 . 2 . 3]" 2 2796 1 50 ILE HG13 1 120 VAL H 3.000 . 4.300 3.363 3.215 3.521 . 0 0 "[ . 1 . 2 . 3]" 2 2797 1 96 LYS H 1 98 HIS H 3.300 . 4.800 3.786 3.701 3.889 . 0 0 "[ . 1 . 2 . 3]" 2 2798 1 56 TYR H 1 58 ASP H 3.100 . 4.500 3.747 3.636 3.831 . 0 0 "[ . 1 . 2 . 3]" 2 2799 1 56 TYR H 1 57 GLU QG 3.100 . 6.000 4.959 4.695 5.378 . 0 0 "[ . 1 . 2 . 3]" 2 2800 1 56 TYR H 1 57 GLU HB2 3.500 . 5.100 4.625 4.418 4.778 . 0 0 "[ . 1 . 2 . 3]" 2 2801 1 85 ASN HA 1 89 ASP H 2.900 . 4.200 2.769 2.698 2.842 . 0 0 "[ . 1 . 2 . 3]" 2 2802 1 117 MET HB3 1 118 GLU H 2.300 . 6.000 3.220 3.178 3.273 . 0 0 "[ . 1 . 2 . 3]" 2 2803 1 91 VAL QG 1 118 GLU H 3.900 . 5.800 4.299 4.138 4.412 . 0 0 "[ . 1 . 2 . 3]" 2 2804 1 66 HIS HB3 1 67 ARG H 2.900 . 4.100 3.301 2.594 3.753 . 0 0 "[ . 1 . 2 . 3]" 2 2805 1 95 ILE MG 1 118 GLU H 2.900 . 6.000 4.318 4.234 4.414 . 0 0 "[ . 1 . 2 . 3]" 2 2806 1 84 ASN HB3 1 85 ASN H 2.600 . 6.000 3.646 3.424 3.975 . 0 0 "[ . 1 . 2 . 3]" 2 2807 1 52 PHE QE 1 116 MET H 3.300 . 4.900 4.481 4.320 4.594 . 0 0 "[ . 1 . 2 . 3]" 2 2808 1 52 PHE QD 1 116 MET H 3.700 . 5.400 4.686 4.521 4.785 . 0 0 "[ . 1 . 2 . 3]" 2 2809 1 115 LYS HB3 1 116 MET H 2.200 . 3.000 2.231 2.142 2.718 . 0 0 "[ . 1 . 2 . 3]" 2 2810 1 115 LYS HA 1 116 MET H 2.400 . 3.300 2.726 2.717 2.737 . 0 0 "[ . 1 . 2 . 3]" 2 2811 1 115 LYS HG3 1 116 MET H 3.000 . 4.300 3.819 1.682 4.123 0.218 28 0 "[ . 1 . 2 . 3]" 2 2812 1 73 TYR H 1 94 THR H 2.600 . 3.600 2.838 2.785 2.911 . 0 0 "[ . 1 . 2 . 3]" 2 2813 1 91 VAL HA 1 94 THR H 3.100 . 4.500 3.701 3.570 3.885 . 0 0 "[ . 1 . 2 . 3]" 2 2814 1 52 PHE HB2 1 116 MET H 3.600 . 6.000 5.746 5.329 5.997 . 0 0 "[ . 1 . 2 . 3]" 2 2815 1 94 THR H 1 94 THR MG 2.800 . 4.000 3.520 3.484 3.546 . 0 0 "[ . 1 . 2 . 3]" 2 2816 1 109 PHE QD 1 117 MET H 3.500 . 5.000 4.147 4.091 4.228 . 0 0 "[ . 1 . 2 . 3]" 2 2817 1 95 ILE HB 1 117 MET H 2.900 . 6.000 4.782 4.577 4.922 . 0 0 "[ . 1 . 2 . 3]" 2 2818 1 116 MET HB2 1 117 MET H 2.200 . 3.000 2.544 2.393 2.677 . 0 0 "[ . 1 . 2 . 3]" 2 2819 1 68 TYR HB3 1 117 MET H 3.700 . 6.000 5.750 5.614 5.946 . 0 0 "[ . 1 . 2 . 3]" 2 2820 1 134 GLN HA 1 137 TYR H 2.500 . 3.500 3.200 3.106 3.282 . 0 0 "[ . 1 . 2 . 3]" 2 2821 1 61 TYR HB2 1 62 ARG H 2.500 . 6.000 3.686 3.123 3.796 . 0 0 "[ . 1 . 2 . 3]" 2 2822 1 99 THR HA 1 103 THR H 2.200 . 3.000 2.632 2.500 2.776 . 0 0 "[ . 1 . 2 . 3]" 2 2823 1 101 THR MG 1 103 THR H 2.300 . 6.000 3.335 2.315 3.496 . 0 0 "[ . 1 . 2 . 3]" 2 2824 1 36 LEU HB3 1 39 TYR H 3.200 . 6.000 5.277 3.057 5.926 . 0 0 "[ . 1 . 2 . 3]" 2 2825 1 39 TYR H 1 40 MET HB2 3.300 . 6.000 5.579 5.312 5.715 . 0 0 "[ . 1 . 2 . 3]" 2 2826 1 63 GLU H 1 64 ASN HD22 3.800 . 5.600 5.112 4.830 5.450 . 0 0 "[ . 1 . 2 . 3]" 2 2827 1 63 GLU H 1 64 ASN HD21 3.800 . 5.600 3.689 3.402 4.351 . 0 0 "[ . 1 . 2 . 3]" 2 2828 1 83 GLN H 1 84 ASN H 2.300 . 3.200 2.275 2.138 2.488 . 0 0 "[ . 1 . 2 . 3]" 2 2829 1 82 ASN HB2 1 84 ASN H 2.800 . 6.000 4.485 3.888 5.389 . 0 0 "[ . 1 . 2 . 3]" 2 2830 1 82 ASN HD21 1 84 ASN H 3.300 . 4.900 3.000 1.872 4.414 0.028 14 0 "[ . 1 . 2 . 3]" 2 2831 1 84 ASN H 1 126 ILE MD 3.900 . 5.800 5.632 5.293 5.819 0.019 12 0 "[ . 1 . 2 . 3]" 2 2832 1 83 GLN HE21 1 84 ASN H 3.600 . 5.200 4.096 2.721 4.908 . 0 0 "[ . 1 . 2 . 3]" 2 2833 1 83 GLN QB 1 84 ASN H 2.900 . 4.100 3.274 2.322 3.681 . 0 0 "[ . 1 . 2 . 3]" 2 2834 1 84 ASN H 1 86 PHE QD 3.600 . 5.200 5.144 4.999 5.241 0.041 29 0 "[ . 1 . 2 . 3]" 2 2835 1 50 ILE HG13 1 119 ARG H 3.400 . 4.900 4.692 4.474 4.783 . 0 0 "[ . 1 . 2 . 3]" 2 2836 1 73 TYR QE 1 97 GLN H 3.400 . 5.000 4.207 4.035 4.457 . 0 0 "[ . 1 . 2 . 3]" 2 2837 1 61 TYR HB2 1 63 GLU H 3.500 . 5.000 4.930 4.751 5.317 0.317 24 0 "[ . 1 . 2 . 3]" 2 2838 1 69 PRO HB3 1 70 ASN H 2.600 . 3.600 3.050 2.953 3.183 . 0 0 "[ . 1 . 2 . 3]" 2 2839 1 63 GLU H 1 64 ASN HD22 3.400 . 6.000 5.077 4.832 5.349 . 0 0 "[ . 1 . 2 . 3]" 2 2840 1 63 GLU H 1 63 GLU QG 3.000 2.200 4.000 2.862 2.397 3.259 . 0 0 "[ . 1 . 2 . 3]" 2 2841 1 88 HIS QB 1 92 ASN H 4.000 . 6.000 4.776 4.570 4.983 . 0 0 "[ . 1 . 2 . 3]" 2 2842 1 45 MET HG2 1 46 SER H 2.800 . 4.000 2.859 2.130 4.233 0.233 8 0 "[ . 1 . 2 . 3]" 2 2843 1 103 THR MG 1 110 THR H 3.500 . 5.000 4.924 4.754 5.006 0.006 1 0 "[ . 1 . 2 . 3]" 2 2844 1 103 THR MG 1 104 THR H 2.200 . 6.000 3.496 3.425 3.548 . 0 0 "[ . 1 . 2 . 3]" 2 2845 1 103 THR HB 1 104 THR H 2.100 . 2.800 2.580 2.463 2.707 . 0 0 "[ . 1 . 2 . 3]" 2 2846 1 101 THR HA 1 104 THR H 2.300 . 3.100 2.790 2.727 2.825 . 0 0 "[ . 1 . 2 . 3]" 2 2847 1 104 THR H 1 105 LYS HB3 3.800 . 5.600 5.442 5.136 5.647 0.047 6 0 "[ . 1 . 2 . 3]" 2 2848 1 83 GLN HB2 1 133 SER H 3.500 . 6.000 6.007 5.946 6.086 0.086 20 0 "[ . 1 . 2 . 3]" 2 2849 1 64 ASN QB 1 66 HIS H 2.700 . 6.000 4.330 4.277 4.400 . 0 0 "[ . 1 . 2 . 3]" 2 2850 1 97 GLN HG3 1 101 THR H 3.400 . 6.000 6.055 6.019 6.510 0.510 25 1 "[ . 1 . 2 + 3]" 2 2851 1 101 THR H 1 103 THR HB 1.900 . 6.000 5.019 4.886 5.640 . 0 0 "[ . 1 . 2 . 3]" 2 2852 1 122 GLU HG2 1 123 GLN H 2.200 . 3.000 2.243 2.043 2.664 . 0 0 "[ . 1 . 2 . 3]" 2 2853 1 87 VAL QG 1 123 GLN H 3.200 . 6.000 4.318 4.201 4.463 . 0 0 "[ . 1 . 2 . 3]" 2 2854 1 42 GLY H 1 72 VAL HB 3.900 . 5.800 4.553 4.372 4.702 . 0 0 "[ . 1 . 2 . 3]" 2 2855 1 41 LEU HB2 1 42 GLY H 3.300 . 4.900 4.206 4.106 4.286 . 0 0 "[ . 1 . 2 . 3]" 2 2856 1 120 VAL MG2 1 123 GLN H 3.200 . 4.700 4.509 4.463 4.554 . 0 0 "[ . 1 . 2 . 3]" 2 2857 1 61 TYR HB2 1 64 ASN H 3.400 . 6.000 4.987 4.449 5.312 . 0 0 "[ . 1 . 2 . 3]" 2 2858 1 63 GLU H 1 64 ASN H 2.300 . 3.100 2.089 2.060 2.149 . 0 0 "[ . 1 . 2 . 3]" 2 2859 1 64 ASN H 1 64 ASN HD22 2.900 . 4.200 3.860 3.698 4.061 . 0 0 "[ . 1 . 2 . 3]" 2 2860 1 98 HIS H 1 102 THR H 3.700 . 5.400 4.530 4.435 4.587 . 0 0 "[ . 1 . 2 . 3]" 2 2861 1 97 GLN HG3 1 102 THR H 3.700 . 6.000 5.925 5.587 6.032 0.032 19 0 "[ . 1 . 2 . 3]" 2 2862 1 99 THR H 1 100 VAL MG2 3.600 . 5.200 3.984 3.796 4.113 . 0 0 "[ . 1 . 2 . 3]" 2 2863 1 69 PRO HB3 1 71 GLN H 2.600 . 3.600 3.212 3.151 3.330 . 0 0 "[ . 1 . 2 . 3]" 2 2864 1 96 LYS QB 1 99 THR H 3.500 . 5.100 4.697 4.525 4.791 . 0 0 "[ . 1 . 2 . 3]" 2 2865 1 44 ALA MB 1 71 GLN H 3.200 . 4.700 4.339 4.142 4.455 . 0 0 "[ . 1 . 2 . 3]" 2 2866 1 42 GLY HA2 1 43 SER H 2.100 . 6.000 2.066 2.061 2.072 . 0 0 "[ . 1 . 2 . 3]" 2 2867 1 43 SER H 1 45 MET ME 3.500 . 6.000 5.630 5.340 5.815 . 0 0 "[ . 1 . 2 . 3]" 2 2868 1 82 ASN HD22 1 84 ASN HB3 3.600 . 5.200 3.917 2.362 5.310 0.110 20 0 "[ . 1 . 2 . 3]" 2 2869 1 43 SER QB 1 128 GLN HE21 3.500 . 6.000 5.876 5.223 6.620 0.620 14 2 "[ . 1 +. 2 . - 3]" 2 2870 1 45 MET ME 1 72 VAL H 3.000 . 4.300 3.672 3.464 3.836 . 0 0 "[ . 1 . 2 . 3]" 2 2871 1 71 GLN HE22 1 72 VAL H 3.900 . 5.800 5.872 5.717 6.197 0.397 25 0 "[ . 1 . 2 . 3]" 2 2872 1 45 MET QG 1 72 VAL H 3.700 . 5.400 5.107 4.612 5.363 . 0 0 "[ . 1 . 2 . 3]" 2 2873 1 72 VAL H 1 121 VAL MG1 3.600 . 6.000 5.486 5.349 5.679 . 0 0 "[ . 1 . 2 . 3]" 2 2874 1 82 ASN HA 1 85 ASN QD 3.500 . 5.000 3.730 1.914 4.709 0.086 22 0 "[ . 1 . 2 . 3]" 2 2875 1 92 ASN HD21 1 93 ILE HB 3.900 . 5.800 3.691 3.292 4.255 . 0 0 "[ . 1 . 2 . 3]" 2 2876 1 39 TYR QE 1 74 TYR H 3.800 . 5.600 5.414 5.187 5.637 0.037 16 0 "[ . 1 . 2 . 3]" 2 2877 1 40 MET ME 1 74 TYR H 3.800 . 5.600 5.597 5.516 5.631 0.031 11 0 "[ . 1 . 2 . 3]" 2 2878 1 36 LEU HG 1 97 GLN HE22 3.600 . 5.200 3.730 2.332 4.610 . 0 0 "[ . 1 . 2 . 3]" 2 2879 1 96 LYS HD3 1 97 GLN HE22 3.000 . 4.300 3.157 2.460 3.806 . 0 0 "[ . 1 . 2 . 3]" 2 2880 1 137 TYR HB3 1 140 GLY H 3.700 . 5.400 4.961 4.562 5.271 . 0 0 "[ . 1 . 2 . 3]" 2 2881 1 43 SER HA 1 70 ASN HD22 3.700 . 5.400 4.629 4.085 4.987 . 0 0 "[ . 1 . 2 . 3]" 2 2882 1 103 THR MG 1 106 GLY H 3.100 . 4.500 4.374 4.188 4.524 0.024 12 0 "[ . 1 . 2 . 3]" 2 2883 1 103 THR HA 1 106 GLY H 2.400 . 6.000 3.206 3.092 3.290 . 0 0 "[ . 1 . 2 . 3]" 2 2884 1 52 PHE QE 1 61 TYR QD 2.800 . 4.000 2.655 2.428 2.790 . 0 0 "[ . 1 . 2 . 3]" 2 2885 1 61 TYR QE 1 109 PHE QE 2.800 . 6.000 5.841 5.650 6.002 0.002 29 0 "[ . 1 . 2 . 3]" 2 2886 1 52 PHE QD 1 60 TYR QD 2.800 . 6.000 5.266 5.070 5.426 . 0 0 "[ . 1 . 2 . 3]" 2 2887 1 52 PHE HZ 1 68 TYR QE 2.600 . 6.000 5.438 5.142 5.665 . 0 0 "[ . 1 . 2 . 3]" 2 2888 1 40 MET HA 1 74 TYR QE 2.400 . 6.000 3.794 3.577 4.024 . 0 0 "[ . 1 . 2 . 3]" 2 2889 1 38 GLY HA3 1 39 TYR QE 2.800 . 4.000 3.533 3.216 3.789 . 0 0 "[ . 1 . 2 . 3]" 2 2890 1 37 GLY HA2 1 39 TYR QD 2.800 . 4.000 4.203 4.158 4.267 0.267 24 0 "[ . 1 . 2 . 3]" 2 2891 1 53 GLY HA3 1 56 TYR QE 2.700 . 6.000 5.987 5.746 6.039 0.039 25 0 "[ . 1 . 2 . 3]" 2 2892 1 36 LEU HA 1 39 TYR QE 2.900 . 4.100 3.746 3.314 4.075 . 0 0 "[ . 1 . 2 . 3]" 2 2893 1 39 TYR QE 1 90 CYS HA 2.800 . 4.000 3.755 3.541 3.937 . 0 0 "[ . 1 . 2 . 3]" 2 2894 1 39 TYR QD 1 74 TYR HA 2.700 . 3.800 3.290 2.918 3.564 . 0 0 "[ . 1 . 2 . 3]" 2 2895 1 40 MET HA 1 73 TYR QD 2.800 . 4.000 3.292 3.149 3.459 . 0 0 "[ . 1 . 2 . 3]" 2 2896 1 39 TYR QD 1 75 ARG HA 2.500 . 6.000 3.618 3.384 3.829 . 0 0 "[ . 1 . 2 . 3]" 2 2897 1 40 MET HA 1 73 TYR QE 3.000 . 6.000 4.210 4.124 4.334 . 0 0 "[ . 1 . 2 . 3]" 2 2898 1 52 PHE HA 1 52 PHE QD 2.400 . 3.300 2.633 2.405 2.817 . 0 0 "[ . 1 . 2 . 3]" 2 2899 1 99 THR HA 1 109 PHE QD 2.200 . 3.000 2.538 2.228 2.752 . 0 0 "[ . 1 . 2 . 3]" 2 2900 1 48 PRO HD2 1 61 TYR QE 3.000 . 4.300 4.015 3.664 4.110 . 0 0 "[ . 1 . 2 . 3]" 2 2901 1 38 GLY HA2 1 39 TYR QD 2.900 . 4.200 3.386 3.228 3.701 . 0 0 "[ . 1 . 2 . 3]" 2 2902 1 49 ILE MG 1 61 TYR QE 2.500 . 3.500 2.916 2.720 3.036 . 0 0 "[ . 1 . 2 . 3]" 2 2903 1 40 MET HB2 1 74 TYR QD 2.600 . 3.600 2.958 2.780 3.091 . 0 0 "[ . 1 . 2 . 3]" 2 2904 1 40 MET HB2 1 73 TYR QE 2.600 . 6.000 5.931 5.786 6.029 0.029 11 0 "[ . 1 . 2 . 3]" 2 2905 1 39 TYR QE 1 93 ILE HG13 2.700 . 3.800 2.378 2.267 2.526 . 0 0 "[ . 1 . 2 . 3]" 2 2906 1 102 THR MG 1 109 PHE QD 2.500 . 6.000 3.494 3.304 3.710 . 0 0 "[ . 1 . 2 . 3]" 2 2907 1 86 PHE QD 1 87 VAL HA 2.700 . 3.800 2.952 2.748 3.072 . 0 0 "[ . 1 . 2 . 3]" 2 2908 1 68 TYR QE 1 117 MET ME 2.700 . 6.000 3.934 3.706 4.071 . 0 0 "[ . 1 . 2 . 3]" 2 2909 1 65 MET HB2 1 68 TYR QD 2.500 . 6.000 3.901 3.821 3.954 . 0 0 "[ . 1 . 2 . 3]" 2 2910 1 69 PRO HG2 1 109 PHE QD 2.400 . 6.000 3.391 3.081 3.748 . 0 0 "[ . 1 . 2 . 3]" 2 2911 1 103 THR MG 1 109 PHE QD 2.300 . 3.200 2.728 1.775 3.096 . 0 0 "[ . 1 . 2 . 3]" 2 2912 1 61 TYR QD 1 62 ARG QG 3.000 . 4.300 2.872 2.370 3.409 . 0 0 "[ . 1 . 2 . 3]" 2 2913 1 76 PRO HB3 1 86 PHE QE 2.900 . 6.000 5.903 5.600 6.085 0.085 18 0 "[ . 1 . 2 . 3]" 2 2914 1 86 PHE HB2 1 86 PHE QE 3.000 . 4.300 3.287 2.881 3.512 . 0 0 "[ . 1 . 2 . 3]" 2 2915 1 86 PHE HA 1 86 PHE QE 3.000 . 4.300 3.982 3.841 4.124 . 0 0 "[ . 1 . 2 . 3]" 2 2916 1 86 PHE HB2 1 86 PHE QD 2.900 . 4.200 2.144 2.013 2.196 . 0 0 "[ . 1 . 2 . 3]" 2 2917 1 61 TYR HB2 1 61 TYR QE 2.900 . 4.200 4.009 2.944 4.223 0.023 19 0 "[ . 1 . 2 . 3]" 2 2918 1 61 TYR QE 1 62 ARG HD3 2.800 . 4.000 3.240 2.892 3.735 . 0 0 "[ . 1 . 2 . 3]" 2 2919 1 57 GLU HA 1 60 TYR QD 2.800 . 4.000 3.685 3.371 3.809 . 0 0 "[ . 1 . 2 . 3]" 2 2920 1 60 TYR QD 1 64 ASN QB 2.900 . 4.200 3.696 3.060 3.880 . 0 0 "[ . 1 . 2 . 3]" 2 2921 1 52 PHE QE 1 116 MET QG 2.500 . 3.500 2.417 2.170 2.790 . 0 0 "[ . 1 . 2 . 3]" 2 2922 1 49 ILE HB 1 61 TYR QE 3.200 2.200 4.400 4.137 4.008 4.209 . 0 0 "[ . 1 . 2 . 3]" 2 2923 1 47 ARG HB3 1 61 TYR QE 3.200 . 4.600 3.527 2.790 3.732 . 0 0 "[ . 1 . 2 . 3]" 2 2924 1 68 TYR QB 1 68 TYR QE 2.700 . 3.800 3.261 2.841 3.466 . 0 0 "[ . 1 . 2 . 3]" 2 2925 1 52 PHE HZ 1 116 MET HA 2.400 . 3.300 2.428 2.162 2.611 . 0 0 "[ . 1 . 2 . 3]" 2 2926 1 39 TYR QE 1 75 ARG HD2 2.300 . 3.200 2.517 2.388 2.651 . 0 0 "[ . 1 . 2 . 3]" 2 2927 1 39 TYR HB2 1 73 TYR QE 2.800 . 6.000 4.071 3.985 4.142 . 0 0 "[ . 1 . 2 . 3]" 2 2928 1 56 TYR QE 1 60 TYR HB2 2.800 . 4.000 3.698 3.618 3.770 . 0 0 "[ . 1 . 2 . 3]" 2 2929 1 72 VAL MG1 1 98 HIS HD2 3.000 . 4.300 3.996 3.707 4.300 0.000 18 0 "[ . 1 . 2 . 3]" 2 2930 1 61 TYR QD 1 65 MET HB2 3.000 . 6.000 4.692 4.584 4.779 . 0 0 "[ . 1 . 2 . 3]" 2 2931 1 68 TYR QE 1 95 ILE HG12 3.000 . 6.000 5.950 5.630 6.016 0.016 29 0 "[ . 1 . 2 . 3]" 2 2932 1 40 MET ME 1 74 TYR QE 2.900 . 6.000 5.006 4.688 5.277 . 0 0 "[ . 1 . 2 . 3]" 2 2933 1 68 TYR QE 1 116 MET HB3 2.600 . 3.700 3.589 3.152 4.113 0.413 3 0 "[ . 1 . 2 . 3]" 2 2934 1 45 MET ME 1 73 TYR QE 2.800 . 6.000 5.874 5.629 5.973 . 0 0 "[ . 1 . 2 . 3]" 2 2935 1 86 PHE HZ 1 131 ARG HB2 3.000 . 4.300 4.087 3.418 4.478 0.178 18 0 "[ . 1 . 2 . 3]" 2 2936 1 39 TYR QE 1 93 ILE HB 2.500 . 3.500 3.213 2.785 3.468 . 0 0 "[ . 1 . 2 . 3]" 2 2937 1 36 LEU HG 1 73 TYR QE 2.700 . 3.800 2.913 2.095 3.257 . 0 0 "[ . 1 . 2 . 3]" 2 2938 1 36 LEU HB2 1 73 TYR QE 2.700 . 6.000 4.114 3.224 4.599 . 0 0 "[ . 1 . 2 . 3]" 2 2939 1 52 PHE QE 1 116 MET ME 2.400 . 3.300 2.559 2.355 2.795 . 0 0 "[ . 1 . 2 . 3]" 2 2940 1 103 THR MG 1 109 PHE QE 3.000 . 4.400 3.645 3.114 3.905 . 0 0 "[ . 1 . 2 . 3]" 2 2941 1 68 TYR QE 1 113 ASP HB3 2.500 . 3.500 3.368 3.097 3.521 0.021 19 0 "[ . 1 . 2 . 3]" 2 2942 1 39 TYR QD 1 89 ASP HB2 2.400 . 6.000 3.091 2.863 3.227 . 0 0 "[ . 1 . 2 . 3]" 2 2943 1 61 TYR HB3 1 61 TYR QE 3.000 . 4.300 3.961 3.910 4.004 . 0 0 "[ . 1 . 2 . 3]" 2 2944 1 38 GLY HA3 1 39 TYR QD 3.000 . 4.400 3.327 3.154 3.663 . 0 0 "[ . 1 . 2 . 3]" 2 2945 1 41 LEU MD1 1 42 GLY HA2 2.600 . 6.000 4.691 4.574 4.782 . 0 0 "[ . 1 . 2 . 3]" 2 stop_ save_ save_distance_constraint_statistics_3 _Distance_constraint_stats_list.Sf_category distance_constraint_statistics _Distance_constraint_stats_list.Constraint_list_ID 3 _Distance_constraint_stats_list.Constraint_count 84 _Distance_constraint_stats_list.Viol_count 337 _Distance_constraint_stats_list.Viol_total 14717.504 _Distance_constraint_stats_list.Viol_max 4.058 _Distance_constraint_stats_list.Viol_rms 0.7220 _Distance_constraint_stats_list.Viol_average_all_restraints 0.1947 _Distance_constraint_stats_list.Viol_average_violations_only 1.4557 _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 40 MET 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 42 GLY 2.026 0.097 27 0 "[ . 1 . 2 . 3]" 1 53 GLY 218.562 4.058 21 30 [********************+-********] 1 55 ASP 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 56 TYR 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 57 GLU 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 58 ASP 218.562 4.058 21 30 [********************+-********] 1 59 ARG 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 60 TYR 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 61 TYR 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 62 ARG 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 63 GLU 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 64 ASN 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 72 VAL 2.026 0.097 27 0 "[ . 1 . 2 . 3]" 1 74 TYR 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 82 ASN 132.051 3.179 29 30 [**********************-*****+*] 1 84 ASN 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 85 ASN 0.223 0.028 9 0 "[ . 1 . 2 . 3]" 1 86 PHE 0.245 0.043 11 0 "[ . 1 . 2 . 3]" 1 87 VAL 132.051 3.179 29 30 [**********************-*****+*] 1 88 HIS 0.273 0.045 22 0 "[ . 1 . 2 . 3]" 1 89 ASP 0.584 0.036 27 0 "[ . 1 . 2 . 3]" 1 90 CYS 0.245 0.043 11 0 "[ . 1 . 2 . 3]" 1 91 VAL 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 92 ASN 0.273 0.045 22 0 "[ . 1 . 2 . 3]" 1 93 ILE 0.361 0.036 27 0 "[ . 1 . 2 . 3]" 1 94 THR 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 95 ILE 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 96 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 97 GLN 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 98 HIS 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 109 PHE 135.783 2.539 8 30 [*******+*****************-****] 1 111 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 112 THR 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 113 ASP 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 114 VAL 135.783 2.539 8 30 [*******+*****************-****] 1 115 LYS 1.039 0.038 27 0 "[ . 1 . 2 . 3]" 1 116 MET 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 117 MET 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 118 GLU 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 119 ARG 1.039 0.038 27 0 "[ . 1 . 2 . 3]" 1 120 VAL 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 121 VAL 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 122 GLU 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 123 GLN 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 124 MET 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 125 CYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 126 ILE 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 127 THR 0.020 0.007 18 0 "[ . 1 . 2 . 3]" 1 128 GLN 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 129 TYR 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 130 GLU 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 131 ARG 0.020 0.007 18 0 "[ . 1 . 2 . 3]" 1 132 GLU 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 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 53 GLY O 1 58 ASP N 3.000 2.500 3.500 7.083 6.652 7.440 3.940 19 30 [******************+**-********] 3 2 1 53 GLY O 1 58 ASP H 2.100 . 2.600 6.303 5.852 6.658 4.058 21 30 [********************+-********] 3 3 1 55 ASP O 1 59 ARG N 3.000 2.500 3.500 2.930 2.854 3.022 . 0 0 "[ . 1 . 2 . 3]" 3 4 1 55 ASP O 1 59 ARG H 2.100 . 2.600 1.974 1.912 2.064 . 0 0 "[ . 1 . 2 . 3]" 3 5 1 56 TYR O 1 60 TYR N 3.000 2.500 3.500 3.163 3.034 3.304 . 0 0 "[ . 1 . 2 . 3]" 3 6 1 56 TYR O 1 60 TYR H 2.100 . 2.600 2.315 2.190 2.470 . 0 0 "[ . 1 . 2 . 3]" 3 7 1 57 GLU O 1 61 TYR N 3.000 2.500 3.500 3.015 2.882 3.094 . 0 0 "[ . 1 . 2 . 3]" 3 8 1 57 GLU O 1 61 TYR H 2.100 . 2.600 2.039 1.908 2.119 . 0 0 "[ . 1 . 2 . 3]" 3 9 1 58 ASP O 1 62 ARG N 3.000 2.500 3.500 3.136 3.040 3.221 . 0 0 "[ . 1 . 2 . 3]" 3 10 1 58 ASP O 1 62 ARG H 2.100 . 2.600 2.205 2.112 2.278 . 0 0 "[ . 1 . 2 . 3]" 3 11 1 59 ARG O 1 63 GLU N 3.000 2.500 3.500 3.012 2.879 3.182 . 0 0 "[ . 1 . 2 . 3]" 3 12 1 59 ARG O 1 63 GLU H 2.100 . 2.600 2.170 2.010 2.309 . 0 0 "[ . 1 . 2 . 3]" 3 13 1 60 TYR O 1 64 ASN N 3.000 2.500 3.500 3.112 3.032 3.202 . 0 0 "[ . 1 . 2 . 3]" 3 14 1 60 TYR O 1 64 ASN H 2.100 . 2.600 2.482 2.291 2.600 . 0 0 "[ . 1 . 2 . 3]" 3 15 1 82 ASN O 1 87 VAL N 3.000 2.500 3.500 5.607 4.787 6.530 3.030 29 30 [**********************-*****+*] 3 16 1 82 ASN O 1 87 VAL H 2.100 . 2.600 4.894 4.096 5.779 3.179 29 30 [**********************-*****+*] 3 17 1 84 ASN O 1 88 HIS N 3.000 2.500 3.500 3.016 2.863 3.138 . 0 0 "[ . 1 . 2 . 3]" 3 18 1 84 ASN O 1 88 HIS H 2.100 . 2.600 2.146 1.991 2.326 . 0 0 "[ . 1 . 2 . 3]" 3 19 1 85 ASN O 1 89 ASP N 3.000 2.500 3.500 3.326 3.015 3.526 0.026 29 0 "[ . 1 . 2 . 3]" 3 20 1 85 ASN O 1 89 ASP H 2.100 . 2.600 2.385 2.038 2.628 0.028 9 0 "[ . 1 . 2 . 3]" 3 21 1 86 PHE O 1 90 CYS N 3.000 2.500 3.500 3.321 3.148 3.432 . 0 0 "[ . 1 . 2 . 3]" 3 22 1 86 PHE O 1 90 CYS H 2.100 . 2.600 2.577 2.295 2.643 0.043 11 0 "[ . 1 . 2 . 3]" 3 23 1 87 VAL O 1 91 VAL N 3.000 2.500 3.500 2.927 2.862 3.068 . 0 0 "[ . 1 . 2 . 3]" 3 24 1 87 VAL O 1 91 VAL H 2.100 . 2.600 2.040 1.928 2.207 . 0 0 "[ . 1 . 2 . 3]" 3 25 1 88 HIS O 1 92 ASN N 3.000 2.500 3.500 3.465 3.239 3.545 0.045 22 0 "[ . 1 . 2 . 3]" 3 26 1 88 HIS O 1 92 ASN H 2.100 . 2.600 2.506 2.276 2.606 0.006 21 0 "[ . 1 . 2 . 3]" 3 27 1 89 ASP O 1 93 ILE N 3.000 2.500 3.500 3.470 3.189 3.536 0.036 27 0 "[ . 1 . 2 . 3]" 3 28 1 89 ASP O 1 93 ILE H 2.100 . 2.600 2.524 2.230 2.612 0.012 28 0 "[ . 1 . 2 . 3]" 3 29 1 90 CYS O 1 94 THR N 3.000 2.500 3.500 3.003 2.936 3.104 . 0 0 "[ . 1 . 2 . 3]" 3 30 1 90 CYS O 1 94 THR H 2.100 . 2.600 2.073 2.005 2.228 . 0 0 "[ . 1 . 2 . 3]" 3 31 1 91 VAL O 1 95 ILE N 3.000 2.500 3.500 3.127 3.046 3.232 . 0 0 "[ . 1 . 2 . 3]" 3 32 1 91 VAL O 1 95 ILE H 2.100 . 2.600 2.152 2.070 2.265 . 0 0 "[ . 1 . 2 . 3]" 3 33 1 92 ASN O 1 96 LYS N 3.000 2.500 3.500 2.951 2.846 3.226 . 0 0 "[ . 1 . 2 . 3]" 3 34 1 92 ASN O 1 96 LYS H 2.100 . 2.600 2.053 1.958 2.378 . 0 0 "[ . 1 . 2 . 3]" 3 35 1 93 ILE O 1 97 GLN N 3.000 2.500 3.500 2.745 2.610 2.922 . 0 0 "[ . 1 . 2 . 3]" 3 36 1 93 ILE O 1 97 GLN H 2.100 . 2.600 2.050 1.894 2.294 . 0 0 "[ . 1 . 2 . 3]" 3 37 1 94 THR O 1 98 HIS N 3.000 2.500 3.500 3.097 3.046 3.204 . 0 0 "[ . 1 . 2 . 3]" 3 38 1 94 THR O 1 98 HIS H 2.100 . 2.600 2.133 2.085 2.252 . 0 0 "[ . 1 . 2 . 3]" 3 39 1 109 PHE O 1 114 VAL N 3.000 2.500 3.500 5.640 5.443 5.781 2.281 8 30 [*******+*****************-****] 3 40 1 109 PHE O 1 114 VAL H 2.100 . 2.600 4.986 4.799 5.139 2.539 8 30 [*******+*****************-****] 3 41 1 111 LYS O 1 115 LYS N 3.000 2.500 3.500 3.202 3.043 3.374 . 0 0 "[ . 1 . 2 . 3]" 3 42 1 111 LYS O 1 115 LYS H 2.100 . 2.600 2.387 2.267 2.540 . 0 0 "[ . 1 . 2 . 3]" 3 43 1 112 THR O 1 116 MET N 3.000 2.500 3.500 3.341 3.256 3.435 . 0 0 "[ . 1 . 2 . 3]" 3 44 1 112 THR O 1 116 MET H 2.100 . 2.600 2.377 2.289 2.466 . 0 0 "[ . 1 . 2 . 3]" 3 45 1 113 ASP O 1 117 MET N 3.000 2.500 3.500 2.967 2.910 3.068 . 0 0 "[ . 1 . 2 . 3]" 3 46 1 113 ASP O 1 117 MET H 2.100 . 2.600 2.066 2.004 2.154 . 0 0 "[ . 1 . 2 . 3]" 3 47 1 114 VAL O 1 118 GLU N 3.000 2.500 3.500 2.887 2.816 2.911 . 0 0 "[ . 1 . 2 . 3]" 3 48 1 114 VAL O 1 118 GLU H 2.100 . 2.600 2.028 1.989 2.072 . 0 0 "[ . 1 . 2 . 3]" 3 49 1 115 LYS O 1 119 ARG N 3.000 2.500 3.500 3.510 3.376 3.538 0.038 27 0 "[ . 1 . 2 . 3]" 3 50 1 115 LYS O 1 119 ARG H 2.100 . 2.600 2.609 2.488 2.631 0.031 6 0 "[ . 1 . 2 . 3]" 3 51 1 116 MET O 1 120 VAL N 3.000 2.500 3.500 2.843 2.804 2.882 . 0 0 "[ . 1 . 2 . 3]" 3 52 1 116 MET O 1 120 VAL H 2.100 . 2.600 1.873 1.837 1.916 . 0 0 "[ . 1 . 2 . 3]" 3 53 1 117 MET O 1 121 VAL N 3.000 2.500 3.500 2.783 2.749 2.821 . 0 0 "[ . 1 . 2 . 3]" 3 54 1 117 MET O 1 121 VAL H 2.100 . 2.600 1.861 1.819 1.907 . 0 0 "[ . 1 . 2 . 3]" 3 55 1 118 GLU O 1 122 GLU N 3.000 2.500 3.500 3.199 3.063 3.311 . 0 0 "[ . 1 . 2 . 3]" 3 56 1 118 GLU O 1 122 GLU H 2.100 . 2.600 2.366 2.232 2.495 . 0 0 "[ . 1 . 2 . 3]" 3 57 1 119 ARG O 1 123 GLN N 3.000 2.500 3.500 3.382 3.283 3.498 . 0 0 "[ . 1 . 2 . 3]" 3 58 1 119 ARG O 1 123 GLN H 2.100 . 2.600 2.482 2.371 2.595 . 0 0 "[ . 1 . 2 . 3]" 3 59 1 120 VAL O 1 124 MET N 3.000 2.500 3.500 3.199 3.120 3.251 . 0 0 "[ . 1 . 2 . 3]" 3 60 1 120 VAL O 1 124 MET H 2.100 . 2.600 2.260 2.187 2.317 . 0 0 "[ . 1 . 2 . 3]" 3 61 1 121 VAL O 1 125 CYS N 3.000 2.500 3.500 2.763 2.692 2.852 . 0 0 "[ . 1 . 2 . 3]" 3 62 1 121 VAL O 1 125 CYS H 2.100 . 2.600 1.975 1.926 2.062 . 0 0 "[ . 1 . 2 . 3]" 3 63 1 122 GLU O 1 126 ILE N 3.000 2.500 3.500 3.253 3.130 3.376 . 0 0 "[ . 1 . 2 . 3]" 3 64 1 122 GLU O 1 126 ILE H 2.100 . 2.600 2.394 2.240 2.545 . 0 0 "[ . 1 . 2 . 3]" 3 65 1 123 GLN O 1 127 THR N 3.000 2.500 3.500 3.215 3.057 3.356 . 0 0 "[ . 1 . 2 . 3]" 3 66 1 123 GLN O 1 127 THR H 2.100 . 2.600 2.282 2.128 2.393 . 0 0 "[ . 1 . 2 . 3]" 3 67 1 124 MET O 1 128 GLN N 3.000 2.500 3.500 3.308 3.139 3.440 . 0 0 "[ . 1 . 2 . 3]" 3 68 1 124 MET O 1 128 GLN H 2.100 . 2.600 2.393 2.235 2.494 . 0 0 "[ . 1 . 2 . 3]" 3 69 1 125 CYS O 1 129 TYR N 3.000 2.500 3.500 3.022 2.815 3.232 . 0 0 "[ . 1 . 2 . 3]" 3 70 1 125 CYS O 1 129 TYR H 2.100 . 2.600 2.210 2.033 2.471 . 0 0 "[ . 1 . 2 . 3]" 3 71 1 126 ILE O 1 130 GLU N 3.000 2.500 3.500 3.205 3.043 3.325 . 0 0 "[ . 1 . 2 . 3]" 3 72 1 126 ILE O 1 130 GLU H 2.100 . 2.600 2.313 2.168 2.446 . 0 0 "[ . 1 . 2 . 3]" 3 73 1 127 THR O 1 131 ARG N 3.000 2.500 3.500 3.187 2.913 3.436 . 0 0 "[ . 1 . 2 . 3]" 3 74 1 127 THR O 1 131 ARG H 2.100 . 2.600 2.418 2.121 2.607 0.007 18 0 "[ . 1 . 2 . 3]" 3 75 1 128 GLN O 1 132 GLU N 3.000 2.500 3.500 2.969 2.808 3.048 . 0 0 "[ . 1 . 2 . 3]" 3 76 1 128 GLN O 1 132 GLU H 2.100 . 2.600 2.069 1.908 2.168 . 0 0 "[ . 1 . 2 . 3]" 3 77 1 40 MET N 1 74 TYR O 3.000 2.300 3.500 2.824 2.732 2.892 . 0 0 "[ . 1 . 2 . 3]" 3 78 1 40 MET H 1 74 TYR O 2.000 . 2.500 1.937 1.871 1.991 . 0 0 "[ . 1 . 2 . 3]" 3 79 1 40 MET O 1 74 TYR N 3.000 2.300 3.500 2.840 2.743 2.900 . 0 0 "[ . 1 . 2 . 3]" 3 80 1 40 MET O 1 74 TYR H 2.000 . 2.500 2.018 1.950 2.101 . 0 0 "[ . 1 . 2 . 3]" 3 81 1 42 GLY N 1 72 VAL O 3.000 2.300 3.500 2.841 2.778 2.882 . 0 0 "[ . 1 . 2 . 3]" 3 82 1 42 GLY H 1 72 VAL O 2.000 . 2.500 1.877 1.826 1.921 . 0 0 "[ . 1 . 2 . 3]" 3 83 1 42 GLY O 1 72 VAL N 3.000 2.300 3.500 3.438 3.395 3.474 . 0 0 "[ . 1 . 2 . 3]" 3 84 1 42 GLY O 1 72 VAL H 2.000 . 2.500 2.568 2.524 2.597 0.097 27 0 "[ . 1 . 2 . 3]" 3 stop_ save_
Contact the webmaster for help, if required. Thursday, May 9, 2024 9:03:05 PM GMT (wattos1)