NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
416313 | 2dj0 | 11105 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2dj0 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 2574 _Distance_constraint_stats_list.Viol_count 539 _Distance_constraint_stats_list.Viol_total 160.163 _Distance_constraint_stats_list.Viol_max 0.170 _Distance_constraint_stats_list.Viol_rms 0.0032 _Distance_constraint_stats_list.Viol_average_all_restraints 0.0002 _Distance_constraint_stats_list.Viol_average_violations_only 0.0149 _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 6 SER 0.005 0.004 5 0 "[ . 1 . 2]" 1 7 GLY 0.000 0.000 11 0 "[ . 1 . 2]" 1 8 TYR 0.080 0.013 3 0 "[ . 1 . 2]" 1 9 ILE 0.111 0.054 7 0 "[ . 1 . 2]" 1 10 LYS 0.106 0.041 9 0 "[ . 1 . 2]" 1 11 TYR 0.067 0.041 9 0 "[ . 1 . 2]" 1 12 PHE 0.164 0.052 9 0 "[ . 1 . 2]" 1 13 ASN 0.136 0.034 9 0 "[ . 1 . 2]" 1 14 ASP 0.048 0.032 7 0 "[ . 1 . 2]" 1 15 LYS 0.351 0.119 14 0 "[ . 1 . 2]" 1 16 THR 0.310 0.119 14 0 "[ . 1 . 2]" 1 17 ILE 0.024 0.009 20 0 "[ . 1 . 2]" 1 18 ASP 0.047 0.010 16 0 "[ . 1 . 2]" 1 19 GLU 0.754 0.170 16 0 "[ . 1 . 2]" 1 20 GLU 0.068 0.052 9 0 "[ . 1 . 2]" 1 21 LEU 0.005 0.005 15 0 "[ . 1 . 2]" 1 22 GLU 0.203 0.093 15 0 "[ . 1 . 2]" 1 23 ARG 0.282 0.039 1 0 "[ . 1 . 2]" 1 24 ASP 0.002 0.002 18 0 "[ . 1 . 2]" 1 25 LYS 0.152 0.093 15 0 "[ . 1 . 2]" 1 26 ARG 0.299 0.105 10 0 "[ . 1 . 2]" 1 27 VAL 0.017 0.004 14 0 "[ . 1 . 2]" 1 28 THR 0.013 0.005 20 0 "[ . 1 . 2]" 1 29 TRP 0.039 0.006 20 0 "[ . 1 . 2]" 1 30 ILE 0.013 0.008 6 0 "[ . 1 . 2]" 1 31 VAL 0.021 0.006 2 0 "[ . 1 . 2]" 1 32 GLU 0.010 0.006 7 0 "[ . 1 . 2]" 1 33 PHE 0.016 0.008 18 0 "[ . 1 . 2]" 1 34 PHE 0.057 0.023 18 0 "[ . 1 . 2]" 1 35 ALA 0.005 0.005 20 0 "[ . 1 . 2]" 1 36 ASN 0.000 0.000 . 0 "[ . 1 . 2]" 1 37 TRP 0.119 0.036 18 0 "[ . 1 . 2]" 1 38 SER 0.000 0.000 . 0 "[ . 1 . 2]" 1 39 ASN 0.026 0.008 2 0 "[ . 1 . 2]" 1 40 ASP 0.011 0.011 17 0 "[ . 1 . 2]" 1 41 CYS 0.070 0.031 18 0 "[ . 1 . 2]" 1 42 GLN 0.738 0.150 17 0 "[ . 1 . 2]" 1 43 SER 0.602 0.150 17 0 "[ . 1 . 2]" 1 44 PHE 0.026 0.016 18 0 "[ . 1 . 2]" 1 45 ALA 0.087 0.031 16 0 "[ . 1 . 2]" 1 46 PRO 0.000 0.000 . 0 "[ . 1 . 2]" 1 47 ILE 0.023 0.008 16 0 "[ . 1 . 2]" 1 48 TYR 0.179 0.059 17 0 "[ . 1 . 2]" 1 49 ALA 0.000 0.000 16 0 "[ . 1 . 2]" 1 50 ASP 0.000 0.000 6 0 "[ . 1 . 2]" 1 51 LEU 0.007 0.005 1 0 "[ . 1 . 2]" 1 52 SER 0.008 0.004 12 0 "[ . 1 . 2]" 1 53 LEU 0.016 0.007 16 0 "[ . 1 . 2]" 1 54 LYS 0.101 0.034 17 0 "[ . 1 . 2]" 1 55 TYR 0.006 0.005 19 0 "[ . 1 . 2]" 1 56 ASN 0.191 0.159 16 0 "[ . 1 . 2]" 1 57 CYS 0.005 0.003 2 0 "[ . 1 . 2]" 1 58 THR 0.529 0.124 7 0 "[ . 1 . 2]" 1 59 GLY 0.538 0.124 7 0 "[ . 1 . 2]" 1 60 LEU 0.195 0.107 12 0 "[ . 1 . 2]" 1 61 ASN 0.000 0.000 . 0 "[ . 1 . 2]" 1 62 PHE 0.009 0.004 5 0 "[ . 1 . 2]" 1 63 GLY 0.001 0.001 12 0 "[ . 1 . 2]" 1 64 LYS 0.236 0.059 17 0 "[ . 1 . 2]" 1 65 VAL 0.050 0.021 13 0 "[ . 1 . 2]" 1 66 ASP 0.036 0.021 13 0 "[ . 1 . 2]" 1 67 VAL 0.050 0.014 2 0 "[ . 1 . 2]" 1 68 GLY 0.054 0.017 18 0 "[ . 1 . 2]" 1 69 ARG 0.312 0.054 13 0 "[ . 1 . 2]" 1 70 TYR 0.064 0.015 20 0 "[ . 1 . 2]" 1 71 THR 0.120 0.120 4 0 "[ . 1 . 2]" 1 72 ASP 0.000 0.000 . 0 "[ . 1 . 2]" 1 73 VAL 0.002 0.002 18 0 "[ . 1 . 2]" 1 74 SER 0.088 0.015 2 0 "[ . 1 . 2]" 1 75 THR 0.000 0.000 . 0 "[ . 1 . 2]" 1 76 ARG 0.018 0.013 6 0 "[ . 1 . 2]" 1 77 TYR 0.023 0.013 18 0 "[ . 1 . 2]" 1 78 LYS 0.104 0.044 18 0 "[ . 1 . 2]" 1 79 VAL 0.021 0.008 18 0 "[ . 1 . 2]" 1 80 SER 0.007 0.006 11 0 "[ . 1 . 2]" 1 81 THR 0.066 0.041 11 0 "[ . 1 . 2]" 1 82 SER 0.009 0.009 20 0 "[ . 1 . 2]" 1 83 PRO 0.019 0.009 18 0 "[ . 1 . 2]" 1 84 LEU 0.043 0.019 13 0 "[ . 1 . 2]" 1 85 THR 0.210 0.043 15 0 "[ . 1 . 2]" 1 86 LYS 0.010 0.005 18 0 "[ . 1 . 2]" 1 87 GLN 0.164 0.043 15 0 "[ . 1 . 2]" 1 88 LEU 0.191 0.041 11 0 "[ . 1 . 2]" 1 89 PRO 0.000 0.000 . 0 "[ . 1 . 2]" 1 90 THR 0.032 0.022 9 0 "[ . 1 . 2]" 1 91 LEU 0.003 0.003 13 0 "[ . 1 . 2]" 1 92 ILE 0.012 0.005 9 0 "[ . 1 . 2]" 1 93 LEU 0.113 0.063 20 0 "[ . 1 . 2]" 1 94 PHE 0.020 0.006 20 0 "[ . 1 . 2]" 1 95 GLN 0.089 0.063 20 0 "[ . 1 . 2]" 1 96 GLY 0.001 0.001 9 0 "[ . 1 . 2]" 1 97 GLY 0.000 0.000 . 0 "[ . 1 . 2]" 1 98 LYS 0.002 0.001 2 0 "[ . 1 . 2]" 1 99 GLU 0.031 0.016 18 0 "[ . 1 . 2]" 1 100 ALA 0.058 0.024 20 0 "[ . 1 . 2]" 1 101 MET 0.043 0.014 19 0 "[ . 1 . 2]" 1 102 ARG 0.173 0.022 9 0 "[ . 1 . 2]" 1 103 ARG 0.180 0.064 6 0 "[ . 1 . 2]" 1 104 PRO 0.093 0.046 12 0 "[ . 1 . 2]" 1 105 GLN 0.117 0.019 9 0 "[ . 1 . 2]" 1 106 ILE 0.190 0.070 13 0 "[ . 1 . 2]" 1 107 ASP 0.222 0.070 13 0 "[ . 1 . 2]" 1 108 LYS 0.063 0.046 6 0 "[ . 1 . 2]" 1 109 LYS 0.343 0.138 19 0 "[ . 1 . 2]" 1 110 GLY 0.000 0.000 . 0 "[ . 1 . 2]" 1 111 ARG 0.061 0.039 13 0 "[ . 1 . 2]" 1 112 ALA 0.071 0.039 13 0 "[ . 1 . 2]" 1 113 VAL 0.002 0.002 13 0 "[ . 1 . 2]" 1 114 SER 0.017 0.008 6 0 "[ . 1 . 2]" 1 115 TRP 0.105 0.031 19 0 "[ . 1 . 2]" 1 116 THR 0.010 0.004 19 0 "[ . 1 . 2]" 1 117 PHE 0.034 0.028 19 0 "[ . 1 . 2]" 1 118 SER 0.021 0.011 2 0 "[ . 1 . 2]" 1 119 GLU 0.018 0.008 16 0 "[ . 1 . 2]" 1 120 GLU 0.609 0.130 15 0 "[ . 1 . 2]" 1 121 ASN 0.028 0.011 13 0 "[ . 1 . 2]" 1 122 VAL 0.047 0.031 19 0 "[ . 1 . 2]" 1 123 ILE 0.026 0.009 6 0 "[ . 1 . 2]" 1 124 ARG 0.109 0.015 14 0 "[ . 1 . 2]" 1 125 GLU 0.266 0.117 10 0 "[ . 1 . 2]" 1 126 PHE 0.058 0.021 19 0 "[ . 1 . 2]" 1 127 ASN 0.014 0.007 19 0 "[ . 1 . 2]" 1 128 LEU 0.012 0.009 19 0 "[ . 1 . 2]" 1 129 ASN 0.000 0.000 . 0 "[ . 1 . 2]" 1 130 GLU 0.008 0.008 11 0 "[ . 1 . 2]" 1 131 LEU 0.027 0.009 19 0 "[ . 1 . 2]" 1 132 SER 0.029 0.029 19 0 "[ . 1 . 2]" 1 133 GLY 0.024 0.020 11 0 "[ . 1 . 2]" 1 134 PRO 0.024 0.020 11 0 "[ . 1 . 2]" stop_ loop_ _Distance_constraint_stats.Restraint_ID _Distance_constraint_stats.Atom_1_entity_assembly_ID _Distance_constraint_stats.Atom_1_comp_index_ID _Distance_constraint_stats.Atom_1_comp_ID _Distance_constraint_stats.Atom_1_ID _Distance_constraint_stats.Atom_2_entity_assembly_ID _Distance_constraint_stats.Atom_2_comp_index_ID _Distance_constraint_stats.Atom_2_comp_ID _Distance_constraint_stats.Atom_2_ID _Distance_constraint_stats.Node_1_distance_val _Distance_constraint_stats.Node_1_distance_lower_bound_val _Distance_constraint_stats.Node_1_distance_upper_bound_val _Distance_constraint_stats.Distance_average _Distance_constraint_stats.Distance_minimum _Distance_constraint_stats.Distance_maximum _Distance_constraint_stats.Max_violation _Distance_constraint_stats.Max_violation_model_number _Distance_constraint_stats.Over_cutoff_violation_count _Distance_constraint_stats.Over_cutoff_viol_per_model _Distance_constraint_stats.Distance_constraint_stats_ID 1 1 6 SER HA 1 8 TYR QD . . 4.910 4.501 3.790 4.914 0.004 5 0 "[ . 1 . 2]" 1 2 1 6 SER HA 1 53 LEU MD2 . . 4.810 3.070 1.976 4.238 . 0 0 "[ . 1 . 2]" 1 3 1 6 SER QB 1 8 TYR QD . . 5.500 5.110 3.262 5.501 0.001 2 0 "[ . 1 . 2]" 1 4 1 7 GLY H 1 53 LEU MD2 . . 3.780 2.152 1.753 3.378 . 0 0 "[ . 1 . 2]" 1 5 1 7 GLY QA 1 8 TYR QD . . 5.140 3.929 3.544 4.401 . 0 0 "[ . 1 . 2]" 1 6 1 7 GLY QA 1 49 ALA MB . . 4.450 2.860 2.407 3.290 . 0 0 "[ . 1 . 2]" 1 7 1 7 GLY QA 1 52 SER HG . . 4.520 4.168 3.516 4.520 0.000 11 0 "[ . 1 . 2]" 1 8 1 7 GLY QA 1 53 LEU H . . 5.340 4.524 4.061 4.796 . 0 0 "[ . 1 . 2]" 1 9 1 7 GLY QA 1 53 LEU MD1 . . 3.520 2.157 1.896 2.665 . 0 0 "[ . 1 . 2]" 1 10 1 7 GLY QA 1 53 LEU MD2 . . 3.730 2.255 1.962 3.014 . 0 0 "[ . 1 . 2]" 1 11 1 7 GLY QA 1 53 LEU HG . . 3.820 2.579 2.092 2.910 . 0 0 "[ . 1 . 2]" 1 12 1 7 GLY HA2 1 53 LEU MD2 . . 4.360 2.284 1.977 3.123 . 0 0 "[ . 1 . 2]" 1 13 1 7 GLY HA2 1 53 LEU HG . . 4.620 2.602 2.116 2.945 . 0 0 "[ . 1 . 2]" 1 14 1 7 GLY HA3 1 53 LEU MD2 . . 4.360 3.545 3.314 3.970 . 0 0 "[ . 1 . 2]" 1 15 1 7 GLY HA3 1 53 LEU HG . . 4.620 4.243 3.296 4.594 . 0 0 "[ . 1 . 2]" 1 16 1 8 TYR H 1 8 TYR HB2 . . 3.940 3.826 3.777 3.851 . 0 0 "[ . 1 . 2]" 1 17 1 8 TYR H 1 8 TYR HB3 . . 3.940 2.898 2.795 3.020 . 0 0 "[ . 1 . 2]" 1 18 1 8 TYR H 1 8 TYR QD . . 4.030 2.173 1.905 2.638 . 0 0 "[ . 1 . 2]" 1 19 1 8 TYR H 1 9 ILE H . . 4.540 4.323 4.185 4.456 . 0 0 "[ . 1 . 2]" 1 20 1 8 TYR H 1 52 SER HG . . 4.650 4.396 3.733 4.651 0.001 6 0 "[ . 1 . 2]" 1 21 1 8 TYR H 1 53 LEU MD2 . . 4.850 2.172 1.887 3.320 . 0 0 "[ . 1 . 2]" 1 22 1 8 TYR H 1 53 LEU HG . . 4.360 3.313 2.950 3.605 . 0 0 "[ . 1 . 2]" 1 23 1 8 TYR H 1 56 ASN QD . . 4.240 3.842 3.317 4.241 0.001 11 0 "[ . 1 . 2]" 1 24 1 8 TYR HA 1 8 TYR QD . . 3.720 3.707 3.669 3.733 0.013 3 0 "[ . 1 . 2]" 1 25 1 8 TYR HA 1 9 ILE H . . 3.280 2.164 2.138 2.243 . 0 0 "[ . 1 . 2]" 1 26 1 8 TYR QB 1 9 ILE H . . 3.870 3.215 2.918 3.440 . 0 0 "[ . 1 . 2]" 1 27 1 8 TYR QB 1 56 ASN QD . . 5.180 4.640 4.173 5.006 . 0 0 "[ . 1 . 2]" 1 28 1 8 TYR HB2 1 9 ILE H . . 4.440 3.317 2.977 3.586 . 0 0 "[ . 1 . 2]" 1 29 1 8 TYR HB3 1 9 ILE H . . 4.440 4.337 4.187 4.444 0.004 20 0 "[ . 1 . 2]" 1 30 1 8 TYR QD 1 9 ILE H . . 4.390 4.067 3.274 4.392 0.002 2 0 "[ . 1 . 2]" 1 31 1 8 TYR QD 1 53 LEU HA . . 4.520 4.444 4.258 4.527 0.007 16 0 "[ . 1 . 2]" 1 32 1 8 TYR QD 1 53 LEU MD2 . . 3.950 2.346 1.953 3.302 . 0 0 "[ . 1 . 2]" 1 33 1 8 TYR QD 1 53 LEU HG . . 4.700 4.272 3.818 4.677 . 0 0 "[ . 1 . 2]" 1 34 1 8 TYR QD 1 56 ASN QB . . 4.790 4.589 3.939 4.797 0.007 5 0 "[ . 1 . 2]" 1 35 1 8 TYR QD 1 56 ASN QD . . 4.670 3.269 2.708 3.774 . 0 0 "[ . 1 . 2]" 1 36 1 8 TYR QE 1 10 LYS QB . . 4.940 4.600 3.820 4.943 0.003 20 0 "[ . 1 . 2]" 1 37 1 8 TYR QE 1 10 LYS QD . . 5.340 4.978 4.217 5.328 . 0 0 "[ . 1 . 2]" 1 38 1 8 TYR QE 1 53 LEU HA . . 4.030 3.694 3.118 4.037 0.007 16 0 "[ . 1 . 2]" 1 39 1 8 TYR QE 1 53 LEU MD2 . . 3.890 2.935 2.104 3.803 . 0 0 "[ . 1 . 2]" 1 40 1 8 TYR QE 1 56 ASN QB . . 4.150 2.994 2.006 3.555 . 0 0 "[ . 1 . 2]" 1 41 1 9 ILE H 1 9 ILE HB . . 3.280 2.623 2.470 2.805 . 0 0 "[ . 1 . 2]" 1 42 1 9 ILE H 1 9 ILE QG . . 3.700 2.939 2.731 3.242 . 0 0 "[ . 1 . 2]" 1 43 1 9 ILE H 1 9 ILE HG13 . . 3.670 2.997 2.775 3.323 . 0 0 "[ . 1 . 2]" 1 44 1 9 ILE H 1 9 ILE MG . . 4.230 3.819 3.736 3.911 . 0 0 "[ . 1 . 2]" 1 45 1 9 ILE H 1 10 LYS H . . 4.740 4.428 4.320 4.516 . 0 0 "[ . 1 . 2]" 1 46 1 9 ILE HA 1 9 ILE QG . . 2.500 2.404 2.321 2.482 . 0 0 "[ . 1 . 2]" 1 47 1 9 ILE HA 1 9 ILE MG . . 3.620 2.412 2.316 2.518 . 0 0 "[ . 1 . 2]" 1 48 1 9 ILE HA 1 10 LYS H . . 3.230 2.217 2.146 2.279 . 0 0 "[ . 1 . 2]" 1 49 1 9 ILE HA 1 62 PHE HB2 . . 4.320 4.142 3.794 4.306 . 0 0 "[ . 1 . 2]" 1 50 1 9 ILE HA 1 62 PHE HB3 . . 4.750 4.536 4.283 4.754 0.004 5 0 "[ . 1 . 2]" 1 51 1 9 ILE HA 1 63 GLY HA2 . . 4.930 4.502 4.210 4.813 . 0 0 "[ . 1 . 2]" 1 52 1 9 ILE HB 1 10 LYS H . . 4.490 4.029 3.884 4.250 . 0 0 "[ . 1 . 2]" 1 53 1 9 ILE HB 1 11 TYR QD . . 4.750 4.185 3.458 4.705 . 0 0 "[ . 1 . 2]" 1 54 1 9 ILE HB 1 11 TYR QE . . 3.660 3.213 2.258 3.662 0.002 11 0 "[ . 1 . 2]" 1 55 1 9 ILE MD 1 9 ILE MG . . 3.800 2.275 1.948 2.473 . 0 0 "[ . 1 . 2]" 1 56 1 9 ILE MD 1 45 ALA HA . . 5.500 5.354 5.011 5.511 0.011 2 0 "[ . 1 . 2]" 1 57 1 9 ILE MD 1 48 TYR HA . . 5.500 5.266 4.934 5.463 . 0 0 "[ . 1 . 2]" 1 58 1 9 ILE MD 1 48 TYR HB2 . . 5.260 4.814 4.467 5.029 . 0 0 "[ . 1 . 2]" 1 59 1 9 ILE MD 1 48 TYR QB . . 4.590 3.446 3.047 3.655 . 0 0 "[ . 1 . 2]" 1 60 1 9 ILE MD 1 48 TYR HB3 . . 5.260 3.531 3.097 3.757 . 0 0 "[ . 1 . 2]" 1 61 1 9 ILE MD 1 48 TYR QD . . 3.450 2.190 1.929 2.449 . 0 0 "[ . 1 . 2]" 1 62 1 9 ILE MD 1 48 TYR QE . . 3.900 2.574 2.076 3.353 . 0 0 "[ . 1 . 2]" 1 63 1 9 ILE MD 1 49 ALA H . . 4.340 4.101 3.513 4.294 . 0 0 "[ . 1 . 2]" 1 64 1 9 ILE MD 1 49 ALA HA . . 3.250 2.931 2.522 3.239 . 0 0 "[ . 1 . 2]" 1 65 1 9 ILE MD 1 49 ALA MB . . 3.580 3.208 2.833 3.438 . 0 0 "[ . 1 . 2]" 1 66 1 9 ILE MD 1 52 SER QB . . 3.870 3.748 3.341 3.874 0.004 12 0 "[ . 1 . 2]" 1 67 1 9 ILE MD 1 52 SER HG . . 4.290 3.406 2.819 4.093 . 0 0 "[ . 1 . 2]" 1 68 1 9 ILE MD 1 62 PHE HB2 . . 5.480 5.061 4.564 5.388 . 0 0 "[ . 1 . 2]" 1 69 1 9 ILE MD 1 62 PHE HB3 . . 4.690 4.318 4.033 4.609 . 0 0 "[ . 1 . 2]" 1 70 1 9 ILE MD 1 64 LYS HD2 . . 4.760 3.047 1.956 4.480 . 0 0 "[ . 1 . 2]" 1 71 1 9 ILE MD 1 64 LYS HD3 . . 4.760 2.582 1.805 4.211 . 0 0 "[ . 1 . 2]" 1 72 1 9 ILE HG12 1 9 ILE MG . . 3.140 2.225 2.083 2.353 . 0 0 "[ . 1 . 2]" 1 73 1 9 ILE HG12 1 10 LYS H . . 4.840 4.180 3.901 4.454 . 0 0 "[ . 1 . 2]" 1 74 1 9 ILE HG12 1 52 SER HB2 . . 4.560 3.488 3.070 3.836 . 0 0 "[ . 1 . 2]" 1 75 1 9 ILE HG12 1 52 SER QB . . 4.010 3.079 2.838 3.345 . 0 0 "[ . 1 . 2]" 1 76 1 9 ILE HG12 1 52 SER HB3 . . 4.560 3.436 3.225 3.707 . 0 0 "[ . 1 . 2]" 1 77 1 9 ILE HG12 1 62 PHE HB2 . . 4.520 3.830 3.331 4.129 . 0 0 "[ . 1 . 2]" 1 78 1 9 ILE HG12 1 62 PHE HB3 . . 4.710 3.429 3.145 3.651 . 0 0 "[ . 1 . 2]" 1 79 1 9 ILE HG13 1 49 ALA HA . . 4.760 3.901 3.489 4.320 . 0 0 "[ . 1 . 2]" 1 80 1 9 ILE HG13 1 52 SER HB2 . . 4.830 4.300 3.996 4.581 . 0 0 "[ . 1 . 2]" 1 81 1 9 ILE HG13 1 52 SER QB . . 4.070 3.925 3.699 4.071 0.001 13 0 "[ . 1 . 2]" 1 82 1 9 ILE HG13 1 52 SER HB3 . . 4.830 4.547 4.157 4.810 . 0 0 "[ . 1 . 2]" 1 83 1 9 ILE HG13 1 62 PHE HB2 . . 5.490 5.153 4.652 5.442 . 0 0 "[ . 1 . 2]" 1 84 1 9 ILE MG 1 10 LYS H . . 3.720 2.098 1.872 2.607 . 0 0 "[ . 1 . 2]" 1 85 1 9 ILE MG 1 10 LYS HB2 . . 4.960 4.235 3.508 4.540 . 0 0 "[ . 1 . 2]" 1 86 1 9 ILE MG 1 10 LYS QB . . 4.320 3.545 3.340 3.906 . 0 0 "[ . 1 . 2]" 1 87 1 9 ILE MG 1 10 LYS HB3 . . 4.960 3.885 3.507 4.386 . 0 0 "[ . 1 . 2]" 1 88 1 9 ILE MG 1 11 TYR QD . . 4.620 3.488 2.639 4.215 . 0 0 "[ . 1 . 2]" 1 89 1 9 ILE MG 1 11 TYR QE . . 4.300 3.654 2.995 4.232 . 0 0 "[ . 1 . 2]" 1 90 1 9 ILE MG 1 48 TYR QD . . 4.180 3.955 3.465 4.182 0.002 15 0 "[ . 1 . 2]" 1 91 1 9 ILE MG 1 48 TYR QE . . 3.470 2.667 2.230 2.994 . 0 0 "[ . 1 . 2]" 1 92 1 9 ILE MG 1 62 PHE HB2 . . 4.530 3.858 3.238 4.429 . 0 0 "[ . 1 . 2]" 1 93 1 9 ILE MG 1 62 PHE QD . . 5.060 4.579 3.997 4.977 . 0 0 "[ . 1 . 2]" 1 94 1 9 ILE MG 1 63 GLY H . . 5.010 3.762 3.349 4.113 . 0 0 "[ . 1 . 2]" 1 95 1 9 ILE MG 1 63 GLY HA2 . . 4.170 2.240 1.910 2.560 . 0 0 "[ . 1 . 2]" 1 96 1 9 ILE MG 1 63 GLY HA3 . . 4.400 3.649 3.350 3.951 . 0 0 "[ . 1 . 2]" 1 97 1 9 ILE MG 1 64 LYS H . . 4.200 2.667 1.813 3.265 . 0 0 "[ . 1 . 2]" 1 98 1 9 ILE MG 1 64 LYS HB2 . . 4.290 2.151 1.878 2.671 . 0 0 "[ . 1 . 2]" 1 99 1 9 ILE MG 1 64 LYS QB . . 3.660 2.102 1.832 2.638 . 0 0 "[ . 1 . 2]" 1 100 1 9 ILE MG 1 64 LYS HB3 . . 4.290 3.131 2.189 4.091 . 0 0 "[ . 1 . 2]" 1 101 1 9 ILE MG 1 64 LYS QD . . 3.770 2.916 1.936 3.768 . 0 0 "[ . 1 . 2]" 1 102 1 9 ILE MG 1 64 LYS HE2 . . 5.350 3.831 2.417 4.868 . 0 0 "[ . 1 . 2]" 1 103 1 9 ILE MG 1 64 LYS QE . . 4.490 3.449 2.228 4.287 . 0 0 "[ . 1 . 2]" 1 104 1 9 ILE MG 1 64 LYS HE3 . . 5.350 4.242 2.323 5.159 . 0 0 "[ . 1 . 2]" 1 105 1 9 ILE MG 1 64 LYS HG2 . . 4.360 4.152 3.463 4.414 0.054 7 0 "[ . 1 . 2]" 1 106 1 9 ILE MG 1 64 LYS HG3 . . 4.360 3.404 2.105 4.274 . 0 0 "[ . 1 . 2]" 1 107 1 10 LYS H 1 10 LYS HB2 . . 3.730 2.568 2.171 2.841 . 0 0 "[ . 1 . 2]" 1 108 1 10 LYS H 1 10 LYS HB3 . . 3.730 2.683 2.341 3.474 . 0 0 "[ . 1 . 2]" 1 109 1 10 LYS H 1 10 LYS HG2 . . 5.210 4.381 3.258 4.623 . 0 0 "[ . 1 . 2]" 1 110 1 10 LYS H 1 10 LYS QG . . 4.470 3.853 3.089 4.026 . 0 0 "[ . 1 . 2]" 1 111 1 10 LYS H 1 10 LYS HG3 . . 5.210 4.303 3.817 4.494 . 0 0 "[ . 1 . 2]" 1 112 1 10 LYS H 1 29 TRP HZ3 . . 4.490 4.403 3.895 4.491 0.001 9 0 "[ . 1 . 2]" 1 113 1 10 LYS H 1 63 GLY HA2 . . 3.810 2.968 2.464 3.347 . 0 0 "[ . 1 . 2]" 1 114 1 10 LYS H 1 63 GLY HA3 . . 4.810 4.524 3.937 4.805 . 0 0 "[ . 1 . 2]" 1 115 1 10 LYS H 1 64 LYS H . . 5.000 4.621 4.186 4.961 . 0 0 "[ . 1 . 2]" 1 116 1 10 LYS HA 1 10 LYS HD2 . . 4.850 3.425 2.383 4.567 . 0 0 "[ . 1 . 2]" 1 117 1 10 LYS HA 1 10 LYS QD . . 4.050 3.207 2.356 4.064 0.014 5 0 "[ . 1 . 2]" 1 118 1 10 LYS HA 1 10 LYS HD3 . . 4.850 4.142 3.487 4.598 . 0 0 "[ . 1 . 2]" 1 119 1 10 LYS HA 1 10 LYS QE . . 5.180 3.632 1.979 4.999 . 0 0 "[ . 1 . 2]" 1 120 1 10 LYS HA 1 10 LYS HG2 . . 4.240 3.316 2.306 3.889 . 0 0 "[ . 1 . 2]" 1 121 1 10 LYS HA 1 10 LYS QG . . 3.650 2.515 2.207 2.915 . 0 0 "[ . 1 . 2]" 1 122 1 10 LYS HA 1 10 LYS HG3 . . 4.240 2.778 2.256 3.602 . 0 0 "[ . 1 . 2]" 1 123 1 10 LYS HA 1 11 TYR H . . 3.030 2.186 2.143 2.237 . 0 0 "[ . 1 . 2]" 1 124 1 10 LYS HA 1 11 TYR QD . . 4.780 4.075 3.399 4.695 . 0 0 "[ . 1 . 2]" 1 125 1 10 LYS QB 1 11 TYR H . . 4.140 3.862 3.276 4.014 . 0 0 "[ . 1 . 2]" 1 126 1 10 LYS QB 1 29 TRP HZ3 . . 3.650 2.675 2.137 3.026 . 0 0 "[ . 1 . 2]" 1 127 1 10 LYS QB 1 63 GLY HA2 . . 4.490 3.084 2.660 3.658 . 0 0 "[ . 1 . 2]" 1 128 1 10 LYS HB2 1 11 TYR H . . 4.760 4.496 4.372 4.626 . 0 0 "[ . 1 . 2]" 1 129 1 10 LYS HB2 1 29 TRP HH2 . . 4.210 3.628 2.815 4.049 . 0 0 "[ . 1 . 2]" 1 130 1 10 LYS HB2 1 29 TRP HZ3 . . 4.340 3.795 2.506 4.334 . 0 0 "[ . 1 . 2]" 1 131 1 10 LYS HB3 1 11 TYR H . . 4.760 4.246 3.380 4.526 . 0 0 "[ . 1 . 2]" 1 132 1 10 LYS HB3 1 29 TRP HH2 . . 4.210 3.358 2.640 3.888 . 0 0 "[ . 1 . 2]" 1 133 1 10 LYS HB3 1 29 TRP HZ3 . . 4.340 2.850 2.156 3.789 . 0 0 "[ . 1 . 2]" 1 134 1 10 LYS QD 1 12 PHE QE . . 4.280 3.480 2.643 4.281 0.001 13 0 "[ . 1 . 2]" 1 135 1 10 LYS HD2 1 29 TRP HH2 . . 4.340 3.983 2.498 4.342 0.002 14 0 "[ . 1 . 2]" 1 136 1 10 LYS HD3 1 29 TRP HH2 . . 4.340 3.100 2.083 4.323 . 0 0 "[ . 1 . 2]" 1 137 1 10 LYS QE 1 10 LYS QG . . 3.320 2.221 2.038 2.736 . 0 0 "[ . 1 . 2]" 1 138 1 10 LYS QE 1 12 PHE QD . . 4.550 4.134 3.427 4.556 0.006 20 0 "[ . 1 . 2]" 1 139 1 10 LYS HE2 1 12 PHE QE . . 4.850 3.386 2.197 4.542 . 0 0 "[ . 1 . 2]" 1 140 1 10 LYS HE3 1 12 PHE QE . . 4.850 3.713 2.120 4.854 0.004 12 0 "[ . 1 . 2]" 1 141 1 10 LYS QG 1 11 TYR H . . 4.110 3.523 3.155 4.151 0.041 9 0 "[ . 1 . 2]" 1 142 1 10 LYS QG 1 12 PHE QE . . 4.140 3.066 2.512 4.142 0.002 11 0 "[ . 1 . 2]" 1 143 1 10 LYS QG 1 12 PHE HZ . . 4.650 2.923 1.965 4.392 . 0 0 "[ . 1 . 2]" 1 144 1 10 LYS QG 1 29 TRP HH2 . . 4.310 3.074 2.012 4.313 0.003 16 0 "[ . 1 . 2]" 1 145 1 10 LYS QG 1 29 TRP HZ3 . . 4.790 3.672 2.498 4.729 . 0 0 "[ . 1 . 2]" 1 146 1 10 LYS QG 1 63 GLY HA2 . . 5.340 4.472 3.967 4.997 . 0 0 "[ . 1 . 2]" 1 147 1 11 TYR H 1 11 TYR HB2 . . 3.740 2.509 2.228 2.721 . 0 0 "[ . 1 . 2]" 1 148 1 11 TYR H 1 11 TYR QB . . 3.190 2.462 2.205 2.642 . 0 0 "[ . 1 . 2]" 1 149 1 11 TYR H 1 11 TYR HB3 . . 3.740 3.598 3.522 3.697 . 0 0 "[ . 1 . 2]" 1 150 1 11 TYR H 1 11 TYR QD . . 3.820 2.567 1.966 3.192 . 0 0 "[ . 1 . 2]" 1 151 1 11 TYR H 1 11 TYR QE . . 4.700 4.317 4.064 4.695 . 0 0 "[ . 1 . 2]" 1 152 1 11 TYR H 1 12 PHE H . . 4.880 4.574 4.294 4.632 . 0 0 "[ . 1 . 2]" 1 153 1 11 TYR HA 1 12 PHE H . . 3.190 2.327 2.141 2.439 . 0 0 "[ . 1 . 2]" 1 154 1 11 TYR HA 1 64 LYS H . . 3.400 2.534 2.074 3.289 . 0 0 "[ . 1 . 2]" 1 155 1 11 TYR QB 1 12 PHE H . . 3.960 2.658 2.315 3.497 . 0 0 "[ . 1 . 2]" 1 156 1 11 TYR HB2 1 12 PHE H . . 4.640 3.774 3.353 4.289 . 0 0 "[ . 1 . 2]" 1 157 1 11 TYR HB3 1 12 PHE H . . 4.640 2.726 2.343 3.705 . 0 0 "[ . 1 . 2]" 1 158 1 11 TYR QD 1 64 LYS QB . . 4.500 2.912 1.914 3.997 . 0 0 "[ . 1 . 2]" 1 159 1 11 TYR QD 1 64 LYS QE . . 4.890 4.272 3.421 4.893 0.003 12 0 "[ . 1 . 2]" 1 160 1 11 TYR QE 1 64 LYS QB . . 4.100 3.152 2.269 3.955 . 0 0 "[ . 1 . 2]" 1 161 1 11 TYR QE 1 64 LYS QD . . 4.690 3.930 1.995 4.690 . 15 0 "[ . 1 . 2]" 1 162 1 11 TYR QE 1 64 LYS QE . . 3.990 3.077 2.021 3.956 . 0 0 "[ . 1 . 2]" 1 163 1 12 PHE H 1 12 PHE HB2 . . 3.710 2.698 2.435 2.855 . 0 0 "[ . 1 . 2]" 1 164 1 12 PHE H 1 12 PHE HB3 . . 4.090 3.805 3.649 3.893 . 0 0 "[ . 1 . 2]" 1 165 1 12 PHE H 1 12 PHE QD . . 4.160 3.703 3.335 4.003 . 0 0 "[ . 1 . 2]" 1 166 1 12 PHE H 1 65 VAL HB . . 4.220 3.501 3.000 3.844 . 0 0 "[ . 1 . 2]" 1 167 1 12 PHE H 1 65 VAL MG2 . . 4.530 4.075 3.794 4.400 . 0 0 "[ . 1 . 2]" 1 168 1 12 PHE HB2 1 13 ASN H . . 4.120 3.923 3.621 4.147 0.027 9 0 "[ . 1 . 2]" 1 169 1 12 PHE HB2 1 17 ILE H . . 5.030 4.806 4.528 4.987 . 0 0 "[ . 1 . 2]" 1 170 1 12 PHE HB2 1 17 ILE HB . . 4.430 3.297 2.980 3.555 . 0 0 "[ . 1 . 2]" 1 171 1 12 PHE HB2 1 17 ILE MG . . 5.020 4.791 4.518 5.020 . 0 0 "[ . 1 . 2]" 1 172 1 12 PHE HB2 1 65 VAL HB . . 3.830 3.029 2.730 3.181 . 0 0 "[ . 1 . 2]" 1 173 1 12 PHE HB2 1 65 VAL MG1 . . 4.900 4.074 3.366 4.399 . 0 0 "[ . 1 . 2]" 1 174 1 12 PHE HB2 1 65 VAL MG2 . . 3.970 3.875 3.642 3.974 0.004 13 0 "[ . 1 . 2]" 1 175 1 12 PHE HB3 1 13 ASN H . . 3.700 2.759 2.343 3.100 . 0 0 "[ . 1 . 2]" 1 176 1 12 PHE HB3 1 17 ILE H . . 3.990 3.237 3.015 3.414 . 0 0 "[ . 1 . 2]" 1 177 1 12 PHE HB3 1 17 ILE HA . . 4.480 2.338 2.000 2.676 . 0 0 "[ . 1 . 2]" 1 178 1 12 PHE HB3 1 17 ILE HB . . 4.020 2.508 2.112 2.853 . 0 0 "[ . 1 . 2]" 1 179 1 12 PHE HB3 1 17 ILE MG . . 4.480 4.010 3.741 4.209 . 0 0 "[ . 1 . 2]" 1 180 1 12 PHE HB3 1 65 VAL HB . . 4.540 4.422 4.026 4.542 0.002 15 0 "[ . 1 . 2]" 1 181 1 12 PHE HB3 1 65 VAL MG2 . . 4.670 4.528 4.173 4.664 . 0 0 "[ . 1 . 2]" 1 182 1 12 PHE QD 1 13 ASN H . . 4.270 3.513 3.283 3.720 . 0 0 "[ . 1 . 2]" 1 183 1 12 PHE QD 1 16 THR HB . . 4.780 3.771 3.193 4.207 . 0 0 "[ . 1 . 2]" 1 184 1 12 PHE QD 1 17 ILE H . . 4.720 4.611 4.281 4.729 0.009 20 0 "[ . 1 . 2]" 1 185 1 12 PHE QD 1 17 ILE HA . . 4.220 3.559 3.347 3.766 . 0 0 "[ . 1 . 2]" 1 186 1 12 PHE QD 1 17 ILE HB . . 4.660 4.436 4.118 4.661 0.001 16 0 "[ . 1 . 2]" 1 187 1 12 PHE QD 1 20 GLU QG . . 4.700 3.704 3.319 4.458 . 0 0 "[ . 1 . 2]" 1 188 1 12 PHE QD 1 31 VAL MG1 . . 4.100 2.843 2.412 3.055 . 0 0 "[ . 1 . 2]" 1 189 1 12 PHE QD 1 65 VAL HB . . 4.400 4.246 4.000 4.405 0.005 20 0 "[ . 1 . 2]" 1 190 1 12 PHE QD 1 65 VAL MG2 . . 5.500 5.181 4.959 5.271 . 0 0 "[ . 1 . 2]" 1 191 1 12 PHE QE 1 17 ILE HA . . 5.070 4.831 4.522 5.059 . 0 0 "[ . 1 . 2]" 1 192 1 12 PHE QE 1 20 GLU HB2 . . 4.280 3.628 3.209 4.062 . 0 0 "[ . 1 . 2]" 1 193 1 12 PHE QE 1 20 GLU QB . . 3.700 3.355 3.013 3.603 . 0 0 "[ . 1 . 2]" 1 194 1 12 PHE QE 1 20 GLU HB3 . . 4.280 3.985 3.654 4.204 . 0 0 "[ . 1 . 2]" 1 195 1 12 PHE QE 1 20 GLU HG2 . . 4.230 2.570 1.995 3.892 . 0 0 "[ . 1 . 2]" 1 196 1 12 PHE QE 1 20 GLU HG3 . . 4.230 3.746 2.254 4.282 0.052 9 0 "[ . 1 . 2]" 1 197 1 12 PHE QE 1 29 TRP HH2 . . 4.920 3.940 3.687 4.385 . 0 0 "[ . 1 . 2]" 1 198 1 12 PHE QE 1 31 VAL MG1 . . 4.450 4.226 3.662 4.452 0.002 6 0 "[ . 1 . 2]" 1 199 1 12 PHE QE 1 31 VAL MG2 . . 3.570 3.035 2.558 3.389 . 0 0 "[ . 1 . 2]" 1 200 1 12 PHE QE 1 62 PHE HA . . 5.500 5.304 4.976 5.501 0.001 14 0 "[ . 1 . 2]" 1 201 1 12 PHE QE 1 63 GLY H . . 4.950 4.190 3.627 4.487 . 0 0 "[ . 1 . 2]" 1 202 1 12 PHE QE 1 63 GLY HA2 . . 4.690 3.635 3.163 4.059 . 0 0 "[ . 1 . 2]" 1 203 1 12 PHE QE 1 63 GLY HA3 . . 4.430 2.377 2.144 2.762 . 0 0 "[ . 1 . 2]" 1 204 1 12 PHE HZ 1 20 GLU HB2 . . 5.500 5.114 4.547 5.504 0.004 16 0 "[ . 1 . 2]" 1 205 1 12 PHE HZ 1 20 GLU HB3 . . 5.500 4.821 4.043 5.249 . 0 0 "[ . 1 . 2]" 1 206 1 12 PHE HZ 1 20 GLU HG2 . . 4.850 3.061 2.495 4.533 . 0 0 "[ . 1 . 2]" 1 207 1 12 PHE HZ 1 20 GLU QG . . 4.240 2.877 2.468 3.558 . 0 0 "[ . 1 . 2]" 1 208 1 12 PHE HZ 1 20 GLU HG3 . . 4.850 4.099 2.933 4.833 . 0 0 "[ . 1 . 2]" 1 209 1 12 PHE HZ 1 29 TRP HE3 . . 4.760 3.842 3.416 4.293 . 0 0 "[ . 1 . 2]" 1 210 1 12 PHE HZ 1 29 TRP HH2 . . 4.730 2.763 2.446 3.264 . 0 0 "[ . 1 . 2]" 1 211 1 12 PHE HZ 1 29 TRP HZ3 . . 4.470 2.821 2.476 3.194 . 0 0 "[ . 1 . 2]" 1 212 1 12 PHE HZ 1 31 VAL MG2 . . 5.490 4.984 4.489 5.245 . 0 0 "[ . 1 . 2]" 1 213 1 13 ASN H 1 16 THR H . . 4.000 3.852 3.469 4.034 0.034 9 0 "[ . 1 . 2]" 1 214 1 13 ASN H 1 16 THR HG1 . . 2.300 1.980 1.875 2.270 . 0 0 "[ . 1 . 2]" 1 215 1 13 ASN H 1 17 ILE H . . 4.310 3.013 2.489 3.473 . 0 0 "[ . 1 . 2]" 1 216 1 13 ASN H 1 17 ILE HB . . 4.930 3.872 3.193 4.369 . 0 0 "[ . 1 . 2]" 1 217 1 13 ASN H 1 65 VAL MG2 . . 5.110 4.914 4.681 5.099 . 0 0 "[ . 1 . 2]" 1 218 1 13 ASN HA 1 14 ASP H . . 2.600 2.546 2.310 2.606 0.006 9 0 "[ . 1 . 2]" 1 219 1 13 ASN HA 1 65 VAL MG2 . . 4.130 3.606 3.160 3.894 . 0 0 "[ . 1 . 2]" 1 220 1 13 ASN HA 1 70 TYR QD . . 4.750 4.517 3.727 4.745 . 0 0 "[ . 1 . 2]" 1 221 1 13 ASN HA 1 70 TYR QE . . 4.010 3.505 2.381 4.010 . 0 0 "[ . 1 . 2]" 1 222 1 13 ASN QB 1 14 ASP H . . 3.140 2.366 2.007 2.821 . 0 0 "[ . 1 . 2]" 1 223 1 13 ASN QB 1 70 TYR QE . . 4.180 3.826 3.232 4.188 0.008 14 0 "[ . 1 . 2]" 1 224 1 13 ASN HB2 1 14 ASP H . . 3.800 3.451 3.115 3.784 . 0 0 "[ . 1 . 2]" 1 225 1 13 ASN HB3 1 14 ASP H . . 3.800 2.415 2.020 2.924 . 0 0 "[ . 1 . 2]" 1 226 1 13 ASN QD 1 16 THR MG . . 3.710 2.756 1.912 3.713 0.003 12 0 "[ . 1 . 2]" 1 227 1 13 ASN HD21 1 16 THR MG . . 4.510 2.873 1.949 4.161 . 0 0 "[ . 1 . 2]" 1 228 1 13 ASN HD22 1 16 THR MG . . 4.510 3.804 2.769 4.516 0.006 9 0 "[ . 1 . 2]" 1 229 1 14 ASP H 1 14 ASP QB . . 3.650 2.459 2.153 2.726 . 0 0 "[ . 1 . 2]" 1 230 1 14 ASP H 1 15 LYS H . . 3.540 2.555 2.449 2.791 . 0 0 "[ . 1 . 2]" 1 231 1 14 ASP HA 1 17 ILE MG . . 3.760 2.387 1.987 2.619 . 0 0 "[ . 1 . 2]" 1 232 1 14 ASP HA 1 65 VAL MG2 . . 4.860 3.826 3.514 4.195 . 0 0 "[ . 1 . 2]" 1 233 1 14 ASP HA 1 73 VAL MG2 . . 3.010 2.006 1.897 2.316 . 0 0 "[ . 1 . 2]" 1 234 1 14 ASP QB 1 15 LYS H . . 3.730 3.468 2.893 3.728 . 0 0 "[ . 1 . 2]" 1 235 1 14 ASP QB 1 70 TYR QD . . 4.100 2.207 1.941 3.803 . 0 0 "[ . 1 . 2]" 1 236 1 14 ASP QB 1 73 VAL MG2 . . 3.280 1.926 1.681 2.223 . 0 0 "[ . 1 . 2]" 1 237 1 14 ASP HB2 1 15 LYS H . . 4.300 4.026 2.955 4.332 0.032 7 0 "[ . 1 . 2]" 1 238 1 14 ASP HB2 1 73 VAL MG2 . . 3.850 2.274 1.849 3.564 . 0 0 "[ . 1 . 2]" 1 239 1 14 ASP HB3 1 15 LYS H . . 4.300 3.917 2.994 4.290 . 0 0 "[ . 1 . 2]" 1 240 1 14 ASP HB3 1 73 VAL MG2 . . 3.850 2.344 1.881 3.393 . 0 0 "[ . 1 . 2]" 1 241 1 15 LYS H 1 15 LYS QB . . 3.060 2.443 2.327 3.004 . 0 0 "[ . 1 . 2]" 1 242 1 15 LYS H 1 15 LYS QD . . 4.740 4.197 1.988 4.651 . 0 0 "[ . 1 . 2]" 1 243 1 15 LYS H 1 15 LYS HG2 . . 5.030 4.215 1.894 4.780 . 0 0 "[ . 1 . 2]" 1 244 1 15 LYS H 1 15 LYS QG . . 4.160 3.756 1.885 4.135 . 0 0 "[ . 1 . 2]" 1 245 1 15 LYS H 1 15 LYS HG3 . . 5.030 4.348 2.494 4.781 . 0 0 "[ . 1 . 2]" 1 246 1 15 LYS H 1 16 THR H . . 3.180 2.383 2.092 2.536 . 0 0 "[ . 1 . 2]" 1 247 1 15 LYS H 1 16 THR MG . . 4.460 3.899 3.396 4.342 . 0 0 "[ . 1 . 2]" 1 248 1 15 LYS H 1 17 ILE H . . 4.620 3.561 3.353 3.749 . 0 0 "[ . 1 . 2]" 1 249 1 15 LYS HA 1 15 LYS QD . . 3.560 2.905 2.055 3.654 0.094 14 0 "[ . 1 . 2]" 1 250 1 15 LYS HA 1 15 LYS QE . . 5.050 3.893 1.984 4.982 . 0 0 "[ . 1 . 2]" 1 251 1 15 LYS HA 1 15 LYS QG . . 3.590 2.616 2.180 3.450 . 0 0 "[ . 1 . 2]" 1 252 1 15 LYS QB 1 15 LYS QE . . 4.520 3.233 2.098 3.798 . 0 0 "[ . 1 . 2]" 1 253 1 15 LYS QB 1 16 THR H . . 3.480 2.265 2.004 3.460 . 0 0 "[ . 1 . 2]" 1 254 1 15 LYS QB 1 16 THR MG . . 3.440 3.120 2.683 3.430 . 0 0 "[ . 1 . 2]" 1 255 1 15 LYS QE 1 15 LYS QG . . 3.290 2.205 2.047 2.584 . 0 0 "[ . 1 . 2]" 1 256 1 15 LYS QG 1 16 THR HA . . 5.180 4.288 3.102 5.299 0.119 14 0 "[ . 1 . 2]" 1 257 1 16 THR H 1 16 THR HG1 . . 4.870 2.877 1.990 3.934 . 0 0 "[ . 1 . 2]" 1 258 1 16 THR H 1 16 THR MG . . 3.210 2.140 1.856 2.465 . 0 0 "[ . 1 . 2]" 1 259 1 16 THR H 1 17 ILE H . . 3.600 2.795 2.260 2.957 . 0 0 "[ . 1 . 2]" 1 260 1 16 THR H 1 17 ILE MG . . 4.740 3.832 3.445 4.076 . 0 0 "[ . 1 . 2]" 1 261 1 16 THR HA 1 16 THR MG . . 3.080 2.342 2.156 2.549 . 0 0 "[ . 1 . 2]" 1 262 1 16 THR HA 1 19 GLU H . . 3.920 3.304 3.010 3.571 . 0 0 "[ . 1 . 2]" 1 263 1 16 THR HA 1 19 GLU HA . . 5.500 5.195 4.711 5.363 . 0 0 "[ . 1 . 2]" 1 264 1 16 THR HA 1 19 GLU HB3 . . 3.270 3.109 2.252 3.276 0.006 2 0 "[ . 1 . 2]" 1 265 1 16 THR HA 1 19 GLU HG2 . . 4.490 2.193 1.983 2.443 . 0 0 "[ . 1 . 2]" 1 266 1 16 THR HA 1 19 GLU QG . . 3.900 2.137 1.928 2.388 . 0 0 "[ . 1 . 2]" 1 267 1 16 THR HA 1 19 GLU HG3 . . 4.490 3.516 2.091 4.068 . 0 0 "[ . 1 . 2]" 1 268 1 16 THR HA 1 20 GLU H . . 4.480 3.711 3.439 3.949 . 0 0 "[ . 1 . 2]" 1 269 1 16 THR HB 1 17 ILE H . . 4.920 3.743 3.528 3.941 . 0 0 "[ . 1 . 2]" 1 270 1 16 THR HB 1 19 GLU QG . . 4.750 2.998 2.658 3.241 . 0 0 "[ . 1 . 2]" 1 271 1 16 THR HB 1 20 GLU H . . 5.220 4.236 3.943 4.505 . 0 0 "[ . 1 . 2]" 1 272 1 17 ILE H 1 17 ILE HB . . 3.970 2.539 2.397 2.649 . 0 0 "[ . 1 . 2]" 1 273 1 17 ILE H 1 17 ILE MD . . 4.600 4.368 4.238 4.430 . 0 0 "[ . 1 . 2]" 1 274 1 17 ILE H 1 17 ILE MG . . 3.080 2.166 1.915 2.462 . 0 0 "[ . 1 . 2]" 1 275 1 17 ILE H 1 18 ASP H . . 3.800 2.889 2.816 2.956 . 0 0 "[ . 1 . 2]" 1 276 1 17 ILE HA 1 17 ILE HG12 . . 3.830 3.359 3.136 3.485 . 0 0 "[ . 1 . 2]" 1 277 1 17 ILE HA 1 17 ILE QG . . 3.270 2.355 2.222 2.462 . 0 0 "[ . 1 . 2]" 1 278 1 17 ILE HA 1 17 ILE HG13 . . 3.830 2.406 2.260 2.522 . 0 0 "[ . 1 . 2]" 1 279 1 17 ILE HA 1 17 ILE MG . . 3.700 3.187 3.170 3.200 . 0 0 "[ . 1 . 2]" 1 280 1 17 ILE HA 1 20 GLU QB . . 4.480 3.226 2.993 3.692 . 0 0 "[ . 1 . 2]" 1 281 1 17 ILE HA 1 21 LEU MD1 . . 4.880 4.090 3.569 4.538 . 0 0 "[ . 1 . 2]" 1 282 1 17 ILE HA 1 21 LEU HG . . 5.130 4.233 3.838 4.838 . 0 0 "[ . 1 . 2]" 1 283 1 17 ILE MD 1 17 ILE MG . . 3.180 2.297 1.963 2.491 . 0 0 "[ . 1 . 2]" 1 284 1 17 ILE MD 1 21 LEU MD1 . . 3.770 3.219 2.921 3.617 . 0 0 "[ . 1 . 2]" 1 285 1 17 ILE MD 1 31 VAL MG1 . . 3.560 2.642 2.341 3.104 . 0 0 "[ . 1 . 2]" 1 286 1 17 ILE MD 1 31 VAL MG2 . . 4.130 2.955 2.381 3.462 . 0 0 "[ . 1 . 2]" 1 287 1 17 ILE MD 1 33 PHE QD . . 5.500 4.524 4.133 4.905 . 0 0 "[ . 1 . 2]" 1 288 1 17 ILE MD 1 33 PHE QE . . 4.360 3.039 2.513 3.727 . 0 0 "[ . 1 . 2]" 1 289 1 17 ILE MD 1 33 PHE HZ . . 3.900 3.178 2.765 3.725 . 0 0 "[ . 1 . 2]" 1 290 1 17 ILE MD 1 65 VAL MG1 . . 3.290 2.580 2.281 2.911 . 0 0 "[ . 1 . 2]" 1 291 1 17 ILE MD 1 65 VAL MG2 . . 3.820 3.097 2.742 3.635 . 0 0 "[ . 1 . 2]" 1 292 1 17 ILE MD 1 73 VAL MG1 . . 3.550 2.800 2.340 3.308 . 0 0 "[ . 1 . 2]" 1 293 1 17 ILE MD 1 73 VAL MG2 . . 4.530 3.485 3.063 3.936 . 0 0 "[ . 1 . 2]" 1 294 1 17 ILE MD 1 77 TYR QD . . 4.610 4.151 3.825 4.576 . 0 0 "[ . 1 . 2]" 1 295 1 17 ILE MD 1 77 TYR QE . . 4.020 2.784 2.336 3.114 . 0 0 "[ . 1 . 2]" 1 296 1 17 ILE MD 1 94 PHE HZ . . 5.500 4.523 3.894 5.093 . 0 0 "[ . 1 . 2]" 1 297 1 17 ILE QG 1 17 ILE MG . . 3.280 2.108 2.030 2.284 . 0 0 "[ . 1 . 2]" 1 298 1 17 ILE QG 1 21 LEU MD1 . . 3.470 2.371 1.874 2.644 . 0 0 "[ . 1 . 2]" 1 299 1 17 ILE HG12 1 21 LEU MD1 . . 3.970 2.692 2.309 3.022 . 0 0 "[ . 1 . 2]" 1 300 1 17 ILE HG13 1 21 LEU MD1 . . 3.970 2.670 1.971 3.046 . 0 0 "[ . 1 . 2]" 1 301 1 17 ILE MG 1 18 ASP H . . 3.210 2.151 1.905 2.415 . 0 0 "[ . 1 . 2]" 1 302 1 17 ILE MG 1 18 ASP HA . . 3.950 3.583 3.297 3.816 . 0 0 "[ . 1 . 2]" 1 303 1 17 ILE MG 1 19 GLU H . . 4.600 4.407 4.126 4.600 . 1 0 "[ . 1 . 2]" 1 304 1 17 ILE MG 1 21 LEU MD1 . . 4.570 3.978 3.579 4.320 . 0 0 "[ . 1 . 2]" 1 305 1 17 ILE MG 1 73 VAL MG1 . . 3.730 3.535 3.122 3.716 . 0 0 "[ . 1 . 2]" 1 306 1 17 ILE MG 1 73 VAL MG2 . . 3.310 3.146 2.825 3.307 . 0 0 "[ . 1 . 2]" 1 307 1 17 ILE MG 1 76 ARG QD . . 4.870 3.779 3.320 4.340 . 0 0 "[ . 1 . 2]" 1 308 1 17 ILE MG 1 77 TYR QD . . 5.420 5.033 4.819 5.304 . 0 0 "[ . 1 . 2]" 1 309 1 17 ILE MG 1 77 TYR QE . . 3.550 3.189 2.860 3.528 . 0 0 "[ . 1 . 2]" 1 310 1 18 ASP H 1 18 ASP QB . . 3.450 2.407 2.208 2.905 . 0 0 "[ . 1 . 2]" 1 311 1 18 ASP H 1 19 GLU H . . 3.470 2.642 2.435 2.768 . 0 0 "[ . 1 . 2]" 1 312 1 18 ASP H 1 19 GLU HB3 . . 4.890 4.563 4.225 4.681 . 0 0 "[ . 1 . 2]" 1 313 1 18 ASP HA 1 19 GLU QG . . 5.340 5.332 5.294 5.350 0.010 16 0 "[ . 1 . 2]" 1 314 1 18 ASP HA 1 21 LEU H . . 4.440 3.492 3.141 3.740 . 0 0 "[ . 1 . 2]" 1 315 1 18 ASP HA 1 21 LEU QB . . 4.370 2.767 2.119 2.991 . 0 0 "[ . 1 . 2]" 1 316 1 18 ASP HA 1 21 LEU MD1 . . 4.020 3.084 2.372 3.655 . 0 0 "[ . 1 . 2]" 1 317 1 18 ASP QB 1 19 GLU H . . 3.370 2.285 1.929 3.079 . 0 0 "[ . 1 . 2]" 1 318 1 18 ASP QB 1 19 GLU HA . . 4.410 3.911 3.717 4.324 . 0 0 "[ . 1 . 2]" 1 319 1 19 GLU H 1 19 GLU HB3 . . 3.160 2.211 2.155 2.285 . 0 0 "[ . 1 . 2]" 1 320 1 19 GLU H 1 19 GLU HG2 . . 4.100 3.078 2.648 3.832 . 0 0 "[ . 1 . 2]" 1 321 1 19 GLU H 1 19 GLU QG . . 3.400 2.856 2.594 3.076 . 0 0 "[ . 1 . 2]" 1 322 1 19 GLU H 1 19 GLU HG3 . . 4.100 3.797 2.955 4.113 0.013 20 0 "[ . 1 . 2]" 1 323 1 19 GLU H 1 20 GLU H . . 3.560 2.931 2.827 3.046 . 0 0 "[ . 1 . 2]" 1 324 1 19 GLU HA 1 19 GLU HG2 . . 4.070 3.884 3.697 4.240 0.170 16 0 "[ . 1 . 2]" 1 325 1 19 GLU HA 1 19 GLU QG . . 3.570 3.318 3.245 3.467 . 0 0 "[ . 1 . 2]" 1 326 1 19 GLU HA 1 19 GLU HG3 . . 4.070 3.612 3.502 3.699 . 0 0 "[ . 1 . 2]" 1 327 1 19 GLU HA 1 22 GLU H . . 4.340 3.647 3.397 3.889 . 0 0 "[ . 1 . 2]" 1 328 1 19 GLU HA 1 22 GLU HA . . 5.500 5.348 5.146 5.511 0.011 9 0 "[ . 1 . 2]" 1 329 1 19 GLU HA 1 22 GLU QB . . 3.310 2.516 2.287 2.850 . 0 0 "[ . 1 . 2]" 1 330 1 19 GLU HB3 1 20 GLU H . . 3.860 3.653 3.507 3.773 . 0 0 "[ . 1 . 2]" 1 331 1 19 GLU QG 1 20 GLU H . . 3.840 2.009 1.843 2.193 . 0 0 "[ . 1 . 2]" 1 332 1 19 GLU QG 1 20 GLU HA . . 4.390 3.034 2.873 3.556 . 0 0 "[ . 1 . 2]" 1 333 1 19 GLU HG2 1 20 GLU H . . 4.670 2.433 1.894 3.842 . 0 0 "[ . 1 . 2]" 1 334 1 19 GLU HG3 1 20 GLU H . . 4.670 2.482 1.898 3.106 . 0 0 "[ . 1 . 2]" 1 335 1 20 GLU H 1 20 GLU HB2 . . 3.880 2.499 2.172 2.743 . 0 0 "[ . 1 . 2]" 1 336 1 20 GLU H 1 20 GLU QB . . 3.290 2.224 2.152 2.256 . 0 0 "[ . 1 . 2]" 1 337 1 20 GLU H 1 20 GLU HB3 . . 3.880 2.632 2.344 3.484 . 0 0 "[ . 1 . 2]" 1 338 1 20 GLU H 1 21 LEU H . . 3.630 2.764 2.520 2.924 . 0 0 "[ . 1 . 2]" 1 339 1 20 GLU HA 1 20 GLU QG . . 3.670 2.672 2.241 3.032 . 0 0 "[ . 1 . 2]" 1 340 1 20 GLU HA 1 22 GLU H . . 4.400 3.867 3.638 4.389 . 0 0 "[ . 1 . 2]" 1 341 1 20 GLU HA 1 23 ARG H . . 4.170 3.482 3.299 3.740 . 0 0 "[ . 1 . 2]" 1 342 1 20 GLU HA 1 23 ARG QB . . 4.340 4.060 3.698 4.343 0.003 20 0 "[ . 1 . 2]" 1 343 1 20 GLU HA 1 23 ARG QD . . 3.910 3.093 2.406 3.840 . 0 0 "[ . 1 . 2]" 1 344 1 20 GLU HA 1 23 ARG HG2 . . 3.980 2.190 1.997 2.882 . 0 0 "[ . 1 . 2]" 1 345 1 20 GLU HA 1 23 ARG QG . . 3.410 2.130 1.979 2.384 . 0 0 "[ . 1 . 2]" 1 346 1 20 GLU HA 1 23 ARG HG3 . . 3.980 3.330 2.247 3.717 . 0 0 "[ . 1 . 2]" 1 347 1 20 GLU HA 1 24 ASP H . . 4.850 4.185 3.639 4.597 . 0 0 "[ . 1 . 2]" 1 348 1 20 GLU QB 1 21 LEU H . . 3.760 2.309 2.063 2.715 . 0 0 "[ . 1 . 2]" 1 349 1 20 GLU QG 1 29 TRP HZ2 . . 4.140 4.022 3.792 4.143 0.003 6 0 "[ . 1 . 2]" 1 350 1 20 GLU HG2 1 21 LEU H . . 4.840 4.207 3.705 4.772 . 0 0 "[ . 1 . 2]" 1 351 1 20 GLU HG2 1 29 TRP HZ2 . . 4.770 4.546 4.288 4.767 . 0 0 "[ . 1 . 2]" 1 352 1 20 GLU HG3 1 21 LEU H . . 4.840 3.834 3.045 4.809 . 0 0 "[ . 1 . 2]" 1 353 1 20 GLU HG3 1 29 TRP HZ2 . . 4.770 4.493 4.206 4.709 . 0 0 "[ . 1 . 2]" 1 354 1 21 LEU H 1 21 LEU HB2 . . 3.720 2.353 2.250 2.597 . 0 0 "[ . 1 . 2]" 1 355 1 21 LEU H 1 21 LEU QB . . 3.140 2.321 2.226 2.540 . 0 0 "[ . 1 . 2]" 1 356 1 21 LEU H 1 21 LEU HB3 . . 3.720 3.560 3.531 3.585 . 0 0 "[ . 1 . 2]" 1 357 1 21 LEU H 1 21 LEU MD1 . . 4.030 3.535 3.275 3.693 . 0 0 "[ . 1 . 2]" 1 358 1 21 LEU H 1 21 LEU MD2 . . 4.410 3.696 3.442 3.958 . 0 0 "[ . 1 . 2]" 1 359 1 21 LEU H 1 21 LEU HG . . 3.330 2.529 2.040 2.777 . 0 0 "[ . 1 . 2]" 1 360 1 21 LEU H 1 22 GLU H . . 3.520 2.648 2.476 2.856 . 0 0 "[ . 1 . 2]" 1 361 1 21 LEU HA 1 21 LEU MD1 . . 4.140 3.868 3.830 3.940 . 0 0 "[ . 1 . 2]" 1 362 1 21 LEU HA 1 21 LEU MD2 . . 3.140 2.177 2.001 2.405 . 0 0 "[ . 1 . 2]" 1 363 1 21 LEU HA 1 21 LEU HG . . 3.830 2.861 2.705 2.981 . 0 0 "[ . 1 . 2]" 1 364 1 21 LEU HA 1 29 TRP HD1 . . 4.430 3.743 3.286 4.153 . 0 0 "[ . 1 . 2]" 1 365 1 21 LEU HA 1 29 TRP HE1 . . 4.960 4.812 4.593 4.954 . 0 0 "[ . 1 . 2]" 1 366 1 21 LEU QB 1 22 GLU H . . 3.570 3.051 2.594 3.253 . 0 0 "[ . 1 . 2]" 1 367 1 21 LEU HB2 1 21 LEU MD1 . . 3.440 2.146 2.064 2.297 . 0 0 "[ . 1 . 2]" 1 368 1 21 LEU HB2 1 22 GLU H . . 4.220 3.186 2.673 3.426 . 0 0 "[ . 1 . 2]" 1 369 1 21 LEU HB3 1 21 LEU MD1 . . 3.440 2.516 2.427 2.612 . 0 0 "[ . 1 . 2]" 1 370 1 21 LEU HB3 1 22 GLU H . . 4.220 3.914 3.504 4.116 . 0 0 "[ . 1 . 2]" 1 371 1 21 LEU MD1 1 22 GLU H . . 5.440 4.880 4.455 5.057 . 0 0 "[ . 1 . 2]" 1 372 1 21 LEU MD1 1 31 VAL MG1 . . 4.850 4.539 4.087 4.840 . 0 0 "[ . 1 . 2]" 1 373 1 21 LEU MD1 1 77 TYR QE . . 3.850 3.723 3.506 3.844 . 0 0 "[ . 1 . 2]" 1 374 1 21 LEU MD1 1 94 PHE QD . . 4.080 3.167 2.888 3.780 . 0 0 "[ . 1 . 2]" 1 375 1 21 LEU MD1 1 94 PHE QE . . 4.270 3.350 2.920 3.639 . 0 0 "[ . 1 . 2]" 1 376 1 21 LEU MD1 1 94 PHE HZ . . 4.460 3.960 3.348 4.436 . 0 0 "[ . 1 . 2]" 1 377 1 21 LEU MD2 1 22 GLU H . . 5.500 4.845 4.739 4.935 . 0 0 "[ . 1 . 2]" 1 378 1 21 LEU MD2 1 29 TRP HB2 . . 3.840 2.044 1.829 2.365 . 0 0 "[ . 1 . 2]" 1 379 1 21 LEU MD2 1 29 TRP HB3 . . 3.900 2.374 2.064 2.602 . 0 0 "[ . 1 . 2]" 1 380 1 21 LEU MD2 1 29 TRP HD1 . . 3.490 2.983 2.615 3.258 . 0 0 "[ . 1 . 2]" 1 381 1 21 LEU MD2 1 29 TRP HE1 . . 4.720 4.531 4.330 4.716 . 0 0 "[ . 1 . 2]" 1 382 1 21 LEU MD2 1 31 VAL MG2 . . 3.690 3.086 2.623 3.406 . 0 0 "[ . 1 . 2]" 1 383 1 21 LEU MD2 1 94 PHE HB2 . . 4.240 2.592 2.228 3.051 . 0 0 "[ . 1 . 2]" 1 384 1 21 LEU MD2 1 94 PHE HB3 . . 3.990 2.762 2.140 3.260 . 0 0 "[ . 1 . 2]" 1 385 1 21 LEU MD2 1 94 PHE QD . . 3.920 3.035 2.734 3.350 . 0 0 "[ . 1 . 2]" 1 386 1 21 LEU MD2 1 97 GLY QA . . 4.410 3.860 3.025 4.406 . 0 0 "[ . 1 . 2]" 1 387 1 21 LEU HG 1 29 TRP HB3 . . 5.240 4.386 4.013 4.781 . 0 0 "[ . 1 . 2]" 1 388 1 21 LEU HG 1 29 TRP HD1 . . 5.500 5.257 4.684 5.505 0.005 15 0 "[ . 1 . 2]" 1 389 1 22 GLU H 1 22 GLU HB2 . . 3.560 2.452 2.194 2.879 . 0 0 "[ . 1 . 2]" 1 390 1 22 GLU H 1 22 GLU QB . . 3.030 2.258 2.172 2.326 . 0 0 "[ . 1 . 2]" 1 391 1 22 GLU H 1 22 GLU HB3 . . 3.560 2.897 2.396 3.559 . 0 0 "[ . 1 . 2]" 1 392 1 22 GLU H 1 22 GLU QG . . 4.060 3.714 2.718 4.098 0.038 11 0 "[ . 1 . 2]" 1 393 1 22 GLU H 1 23 ARG H . . 3.310 2.422 2.161 2.831 . 0 0 "[ . 1 . 2]" 1 394 1 22 GLU HA 1 22 GLU QG . . 3.540 2.457 2.267 2.737 . 0 0 "[ . 1 . 2]" 1 395 1 22 GLU HA 1 25 LYS QE . . 3.650 2.869 1.995 3.743 0.093 15 0 "[ . 1 . 2]" 1 396 1 22 GLU HA 1 25 LYS QG . . 4.220 2.366 1.968 3.994 . 0 0 "[ . 1 . 2]" 1 397 1 22 GLU QB 1 23 ARG H . . 3.710 2.639 2.267 2.900 . 0 0 "[ . 1 . 2]" 1 398 1 22 GLU HB2 1 23 ARG H . . 4.300 3.478 2.376 4.043 . 0 0 "[ . 1 . 2]" 1 399 1 22 GLU HB3 1 23 ARG H . . 4.300 2.883 2.498 3.546 . 0 0 "[ . 1 . 2]" 1 400 1 22 GLU QG 1 23 ARG H . . 4.510 4.077 3.510 4.520 0.010 19 0 "[ . 1 . 2]" 1 401 1 22 GLU QG 1 25 LYS QE . . 4.360 3.277 2.222 4.302 . 0 0 "[ . 1 . 2]" 1 402 1 23 ARG H 1 23 ARG HB2 . . 3.630 3.633 3.583 3.669 0.039 1 0 "[ . 1 . 2]" 1 403 1 23 ARG H 1 23 ARG QB . . 3.090 2.583 2.394 2.727 . 0 0 "[ . 1 . 2]" 1 404 1 23 ARG H 1 23 ARG HB3 . . 3.630 2.645 2.430 2.819 . 0 0 "[ . 1 . 2]" 1 405 1 23 ARG H 1 23 ARG QD . . 4.560 3.987 3.522 4.341 . 0 0 "[ . 1 . 2]" 1 406 1 23 ARG H 1 23 ARG HG2 . . 4.470 2.309 1.932 3.358 . 0 0 "[ . 1 . 2]" 1 407 1 23 ARG H 1 23 ARG QG . . 3.710 2.188 1.909 2.444 . 0 0 "[ . 1 . 2]" 1 408 1 23 ARG H 1 23 ARG HG3 . . 4.470 3.073 2.022 3.561 . 0 0 "[ . 1 . 2]" 1 409 1 23 ARG HA 1 23 ARG QD . . 4.680 4.335 3.645 4.579 . 0 0 "[ . 1 . 2]" 1 410 1 23 ARG QB 1 23 ARG QD . . 3.150 2.206 2.069 2.422 . 0 0 "[ . 1 . 2]" 1 411 1 23 ARG QB 1 24 ASP H . . 3.780 3.622 3.256 3.778 . 0 0 "[ . 1 . 2]" 1 412 1 23 ARG HB2 1 23 ARG QD . . 3.630 2.479 2.100 2.902 . 0 0 "[ . 1 . 2]" 1 413 1 23 ARG HB2 1 24 ASP H . . 4.540 4.064 3.508 4.383 . 0 0 "[ . 1 . 2]" 1 414 1 23 ARG HB3 1 23 ARG QD . . 3.630 2.624 2.220 3.251 . 0 0 "[ . 1 . 2]" 1 415 1 23 ARG HB3 1 24 ASP H . . 4.540 4.075 3.814 4.256 . 0 0 "[ . 1 . 2]" 1 416 1 23 ARG QG 1 24 ASP H . . 4.630 2.482 1.845 2.938 . 0 0 "[ . 1 . 2]" 1 417 1 23 ARG QG 1 24 ASP QB . . 4.050 3.127 2.688 3.441 . 0 0 "[ . 1 . 2]" 1 418 1 24 ASP H 1 24 ASP QB . . 3.690 2.459 2.199 2.894 . 0 0 "[ . 1 . 2]" 1 419 1 24 ASP QB 1 26 ARG QG . . 5.340 4.555 3.757 5.340 . 0 0 "[ . 1 . 2]" 1 420 1 24 ASP QB 1 27 VAL MG1 . . 4.730 3.332 2.800 4.015 . 0 0 "[ . 1 . 2]" 1 421 1 24 ASP QB 1 27 VAL MG2 . . 3.550 3.347 2.814 3.552 0.002 18 0 "[ . 1 . 2]" 1 422 1 24 ASP QB 1 29 TRP HD1 . . 4.980 2.593 2.152 3.471 . 0 0 "[ . 1 . 2]" 1 423 1 24 ASP HB2 1 27 VAL HB . . 4.850 3.772 2.090 4.530 . 0 0 "[ . 1 . 2]" 1 424 1 24 ASP HB3 1 27 VAL HB . . 4.850 2.587 2.036 4.057 . 0 0 "[ . 1 . 2]" 1 425 1 25 LYS HA 1 25 LYS HG2 . . 3.800 2.578 2.207 3.798 . 0 0 "[ . 1 . 2]" 1 426 1 25 LYS HA 1 25 LYS QG . . 3.320 2.446 2.166 3.344 0.024 13 0 "[ . 1 . 2]" 1 427 1 25 LYS HA 1 25 LYS HG3 . . 3.800 3.151 2.735 3.800 . 0 0 "[ . 1 . 2]" 1 428 1 25 LYS QB 1 26 ARG H . . 3.780 2.240 1.912 3.338 . 0 0 "[ . 1 . 2]" 1 429 1 25 LYS QB 1 96 GLY H . . 5.030 4.297 3.382 4.753 . 0 0 "[ . 1 . 2]" 1 430 1 25 LYS QB 1 96 GLY HA2 . . 4.020 2.621 2.031 3.073 . 0 0 "[ . 1 . 2]" 1 431 1 25 LYS QB 1 96 GLY HA3 . . 5.340 3.894 3.037 4.610 . 0 0 "[ . 1 . 2]" 1 432 1 25 LYS HB2 1 96 GLY HA2 . . 4.850 4.024 2.119 4.795 . 0 0 "[ . 1 . 2]" 1 433 1 25 LYS HB3 1 96 GLY HA2 . . 4.850 2.807 2.042 4.845 . 0 0 "[ . 1 . 2]" 1 434 1 25 LYS QE 1 25 LYS QG . . 3.130 2.189 2.023 2.546 . 0 0 "[ . 1 . 2]" 1 435 1 26 ARG H 1 26 ARG HA . . 2.700 2.698 2.664 2.733 0.033 13 0 "[ . 1 . 2]" 1 436 1 26 ARG H 1 26 ARG HB2 . . 4.110 3.570 3.061 3.612 . 0 0 "[ . 1 . 2]" 1 437 1 26 ARG H 1 26 ARG HB3 . . 4.110 2.564 2.231 3.508 . 0 0 "[ . 1 . 2]" 1 438 1 26 ARG H 1 26 ARG QG . . 3.430 2.273 1.820 3.271 . 0 0 "[ . 1 . 2]" 1 439 1 26 ARG H 1 27 VAL H . . 3.340 2.966 2.804 3.216 . 0 0 "[ . 1 . 2]" 1 440 1 26 ARG HA 1 26 ARG HD2 . . 5.370 4.752 3.909 5.475 0.105 10 0 "[ . 1 . 2]" 1 441 1 26 ARG HA 1 26 ARG QD . . 4.500 4.153 3.545 4.540 0.040 10 0 "[ . 1 . 2]" 1 442 1 26 ARG HA 1 26 ARG HD3 . . 5.370 4.801 3.628 5.388 0.018 19 0 "[ . 1 . 2]" 1 443 1 26 ARG HA 1 26 ARG QG . . 3.430 3.316 2.685 3.438 0.008 2 0 "[ . 1 . 2]" 1 444 1 26 ARG HA 1 27 VAL MG2 . . 5.180 4.827 4.645 4.991 . 0 0 "[ . 1 . 2]" 1 445 1 26 ARG QB 1 26 ARG QD . . 3.200 2.158 2.038 2.595 . 0 0 "[ . 1 . 2]" 1 446 1 26 ARG QB 1 27 VAL H . . 3.610 3.303 2.125 3.606 . 0 0 "[ . 1 . 2]" 1 447 1 26 ARG QG 1 27 VAL H . . 4.490 2.116 1.841 3.341 . 0 0 "[ . 1 . 2]" 1 448 1 26 ARG QG 1 27 VAL MG2 . . 4.710 2.245 1.929 4.135 . 0 0 "[ . 1 . 2]" 1 449 1 27 VAL H 1 27 VAL HB . . 3.440 2.505 2.363 2.609 . 0 0 "[ . 1 . 2]" 1 450 1 27 VAL H 1 27 VAL MG1 . . 4.080 3.769 3.719 3.799 . 0 0 "[ . 1 . 2]" 1 451 1 27 VAL H 1 27 VAL MG2 . . 3.310 2.393 2.032 2.726 . 0 0 "[ . 1 . 2]" 1 452 1 27 VAL H 1 28 THR H . . 4.710 4.571 4.528 4.634 . 0 0 "[ . 1 . 2]" 1 453 1 27 VAL HA 1 27 VAL MG1 . . 3.480 2.405 2.297 2.475 . 0 0 "[ . 1 . 2]" 1 454 1 27 VAL HA 1 27 VAL MG2 . . 3.260 2.328 2.222 2.457 . 0 0 "[ . 1 . 2]" 1 455 1 27 VAL HA 1 28 THR H . . 3.070 2.196 2.162 2.286 . 0 0 "[ . 1 . 2]" 1 456 1 27 VAL HA 1 28 THR HB . . 4.820 4.773 4.637 4.824 0.004 14 0 "[ . 1 . 2]" 1 457 1 27 VAL HB 1 28 THR H . . 4.240 4.032 3.751 4.173 . 0 0 "[ . 1 . 2]" 1 458 1 27 VAL HB 1 29 TRP HD1 . . 4.440 3.326 2.784 3.707 . 0 0 "[ . 1 . 2]" 1 459 1 27 VAL HB 1 29 TRP HE1 . . 4.060 3.292 3.123 3.503 . 0 0 "[ . 1 . 2]" 1 460 1 27 VAL MG1 1 28 THR H . . 3.710 2.217 1.882 2.557 . 0 0 "[ . 1 . 2]" 1 461 1 27 VAL MG1 1 29 TRP HD1 . . 4.070 3.344 2.691 3.832 . 0 0 "[ . 1 . 2]" 1 462 1 27 VAL MG1 1 29 TRP HE1 . . 4.020 3.134 2.481 3.703 . 0 0 "[ . 1 . 2]" 1 463 1 27 VAL MG1 1 29 TRP HZ2 . . 4.820 4.516 4.254 4.821 0.001 12 0 "[ . 1 . 2]" 1 464 1 27 VAL MG1 1 59 GLY HA2 . . 4.990 3.596 2.191 4.880 . 0 0 "[ . 1 . 2]" 1 465 1 27 VAL MG1 1 59 GLY QA . . 4.330 3.366 2.019 4.161 . 0 0 "[ . 1 . 2]" 1 466 1 27 VAL MG1 1 59 GLY HA3 . . 4.990 4.297 2.363 4.979 . 0 0 "[ . 1 . 2]" 1 467 1 27 VAL MG1 1 61 ASN H . . 4.420 3.732 3.295 4.053 . 0 0 "[ . 1 . 2]" 1 468 1 27 VAL MG1 1 61 ASN QB . . 4.500 3.994 3.594 4.261 . 0 0 "[ . 1 . 2]" 1 469 1 27 VAL MG1 1 61 ASN HD21 . . 4.830 3.512 2.375 4.786 . 0 0 "[ . 1 . 2]" 1 470 1 27 VAL MG1 1 61 ASN QD . . 4.060 3.124 2.258 3.676 . 0 0 "[ . 1 . 2]" 1 471 1 27 VAL MG1 1 61 ASN HD22 . . 4.830 3.854 2.825 4.523 . 0 0 "[ . 1 . 2]" 1 472 1 27 VAL MG2 1 28 THR H . . 4.040 3.927 3.783 4.033 . 0 0 "[ . 1 . 2]" 1 473 1 27 VAL MG2 1 29 TRP HD1 . . 5.500 4.812 4.338 5.146 . 0 0 "[ . 1 . 2]" 1 474 1 27 VAL MG2 1 29 TRP HE1 . . 4.530 4.259 3.861 4.462 . 0 0 "[ . 1 . 2]" 1 475 1 27 VAL MG2 1 59 GLY QA . . 4.500 4.032 2.907 4.503 0.003 12 0 "[ . 1 . 2]" 1 476 1 27 VAL MG2 1 61 ASN QD . . 4.950 4.586 4.049 4.893 . 0 0 "[ . 1 . 2]" 1 477 1 28 THR H 1 28 THR HB . . 3.340 2.590 2.469 2.645 . 0 0 "[ . 1 . 2]" 1 478 1 28 THR H 1 28 THR HG1 . . 4.380 3.072 2.308 3.723 . 0 0 "[ . 1 . 2]" 1 479 1 28 THR H 1 28 THR MG . . 4.180 3.782 3.767 3.799 . 0 0 "[ . 1 . 2]" 1 480 1 28 THR H 1 29 TRP H . . 4.810 4.544 4.201 4.612 . 0 0 "[ . 1 . 2]" 1 481 1 28 THR HA 1 28 THR MG . . 3.440 2.328 2.214 2.403 . 0 0 "[ . 1 . 2]" 1 482 1 28 THR HB 1 29 TRP H . . 4.860 4.023 3.819 4.453 . 0 0 "[ . 1 . 2]" 1 483 1 28 THR HB 1 60 LEU HA . . 4.270 3.821 3.181 4.268 . 0 0 "[ . 1 . 2]" 1 484 1 28 THR HB 1 60 LEU QB . . 5.290 4.286 3.762 4.892 . 0 0 "[ . 1 . 2]" 1 485 1 28 THR HB 1 60 LEU MD1 . . 3.620 2.198 1.861 2.720 . 0 0 "[ . 1 . 2]" 1 486 1 28 THR HB 1 60 LEU MD2 . . 4.900 4.469 4.092 4.803 . 0 0 "[ . 1 . 2]" 1 487 1 28 THR HB 1 93 LEU MD1 . . 4.670 4.201 3.891 4.675 0.005 20 0 "[ . 1 . 2]" 1 488 1 28 THR HB 1 131 LEU MD2 . . 5.290 4.449 3.246 5.023 . 0 0 "[ . 1 . 2]" 1 489 1 28 THR MG 1 29 TRP H . . 3.550 2.273 1.904 3.352 . 0 0 "[ . 1 . 2]" 1 490 1 28 THR MG 1 29 TRP HA . . 4.670 3.698 3.483 3.993 . 0 0 "[ . 1 . 2]" 1 491 1 28 THR MG 1 60 LEU MD1 . . 2.990 2.378 1.978 2.815 . 0 0 "[ . 1 . 2]" 1 492 1 28 THR MG 1 60 LEU MD2 . . 4.380 3.991 3.588 4.382 0.002 7 0 "[ . 1 . 2]" 1 493 1 28 THR MG 1 93 LEU HA . . 4.640 3.998 3.605 4.337 . 0 0 "[ . 1 . 2]" 1 494 1 28 THR MG 1 93 LEU MD1 . . 2.730 2.073 1.828 2.445 . 0 0 "[ . 1 . 2]" 1 495 1 28 THR MG 1 93 LEU MD2 . . 3.410 2.943 2.624 3.276 . 0 0 "[ . 1 . 2]" 1 496 1 28 THR MG 1 93 LEU HG . . 3.340 2.592 2.352 2.816 . 0 0 "[ . 1 . 2]" 1 497 1 28 THR MG 1 94 PHE H . . 4.430 3.333 2.871 3.910 . 0 0 "[ . 1 . 2]" 1 498 1 28 THR MG 1 95 GLN HA . . 4.040 3.353 2.909 3.921 . 0 0 "[ . 1 . 2]" 1 499 1 28 THR MG 1 95 GLN HE21 . . 4.560 3.064 2.243 4.062 . 0 0 "[ . 1 . 2]" 1 500 1 28 THR MG 1 95 GLN QE . . 3.830 2.938 2.228 3.438 . 0 0 "[ . 1 . 2]" 1 501 1 28 THR MG 1 95 GLN HE22 . . 4.560 4.008 3.263 4.560 0.000 14 0 "[ . 1 . 2]" 1 502 1 28 THR MG 1 95 GLN HG2 . . 3.930 2.330 1.973 3.252 . 0 0 "[ . 1 . 2]" 1 503 1 28 THR MG 1 95 GLN QG . . 3.380 2.141 1.876 2.409 . 0 0 "[ . 1 . 2]" 1 504 1 28 THR MG 1 95 GLN HG3 . . 3.930 2.897 2.104 3.584 . 0 0 "[ . 1 . 2]" 1 505 1 28 THR MG 1 128 LEU MD2 . . 4.740 4.369 3.738 4.604 . 0 0 "[ . 1 . 2]" 1 506 1 28 THR MG 1 131 LEU MD1 . . 3.490 2.823 2.018 3.217 . 0 0 "[ . 1 . 2]" 1 507 1 28 THR MG 1 131 LEU MD2 . . 3.730 3.179 2.043 3.628 . 0 0 "[ . 1 . 2]" 1 508 1 29 TRP H 1 29 TRP HB2 . . 3.730 2.528 2.243 2.647 . 0 0 "[ . 1 . 2]" 1 509 1 29 TRP H 1 29 TRP HD1 . . 4.460 3.878 3.417 4.084 . 0 0 "[ . 1 . 2]" 1 510 1 29 TRP H 1 93 LEU MD1 . . 4.770 4.316 3.842 4.719 . 0 0 "[ . 1 . 2]" 1 511 1 29 TRP H 1 94 PHE H . . 4.190 3.372 2.976 3.752 . 0 0 "[ . 1 . 2]" 1 512 1 29 TRP H 1 94 PHE HB2 . . 4.020 3.050 2.704 3.550 . 0 0 "[ . 1 . 2]" 1 513 1 29 TRP H 1 95 GLN HA . . 4.430 4.185 3.908 4.374 . 0 0 "[ . 1 . 2]" 1 514 1 29 TRP HA 1 29 TRP HD1 . . 4.900 3.969 3.851 4.054 . 0 0 "[ . 1 . 2]" 1 515 1 29 TRP HA 1 29 TRP HE3 . . 4.050 3.141 2.993 3.355 . 0 0 "[ . 1 . 2]" 1 516 1 29 TRP HA 1 30 ILE H . . 3.060 2.158 2.140 2.219 . 0 0 "[ . 1 . 2]" 1 517 1 29 TRP HA 1 60 LEU MD1 . . 4.230 3.555 3.238 3.945 . 0 0 "[ . 1 . 2]" 1 518 1 29 TRP HA 1 61 ASN H . . 3.900 3.483 3.070 3.726 . 0 0 "[ . 1 . 2]" 1 519 1 29 TRP HA 1 61 ASN QB . . 4.050 3.763 3.334 4.035 . 0 0 "[ . 1 . 2]" 1 520 1 29 TRP HB2 1 30 ILE H . . 4.680 4.399 4.227 4.506 . 0 0 "[ . 1 . 2]" 1 521 1 29 TRP HB2 1 31 VAL MG2 . . 4.410 4.221 3.972 4.398 . 0 0 "[ . 1 . 2]" 1 522 1 29 TRP HB2 1 94 PHE H . . 4.710 4.565 4.223 4.714 0.004 18 0 "[ . 1 . 2]" 1 523 1 29 TRP HB2 1 94 PHE HB3 . . 4.340 4.100 3.680 4.346 0.006 20 0 "[ . 1 . 2]" 1 524 1 29 TRP HB2 1 94 PHE QD . . 4.510 4.117 3.719 4.516 0.006 20 0 "[ . 1 . 2]" 1 525 1 29 TRP HB3 1 29 TRP HE3 . . 3.680 2.658 2.574 2.725 . 0 0 "[ . 1 . 2]" 1 526 1 29 TRP HB3 1 30 ILE H . . 4.320 3.389 3.051 3.629 . 0 0 "[ . 1 . 2]" 1 527 1 29 TRP HB3 1 31 VAL MG2 . . 3.570 3.028 2.878 3.156 . 0 0 "[ . 1 . 2]" 1 528 1 29 TRP HB3 1 94 PHE HB3 . . 5.400 5.223 4.966 5.388 . 0 0 "[ . 1 . 2]" 1 529 1 29 TRP HB3 1 94 PHE QD . . 4.300 3.937 3.429 4.289 . 0 0 "[ . 1 . 2]" 1 530 1 29 TRP HE3 1 30 ILE H . . 4.260 3.141 2.786 3.521 . 0 0 "[ . 1 . 2]" 1 531 1 29 TRP HE3 1 31 VAL MG2 . . 3.740 3.369 3.129 3.659 . 0 0 "[ . 1 . 2]" 1 532 1 29 TRP HE3 1 61 ASN HB2 . . 4.910 3.501 3.040 4.098 . 0 0 "[ . 1 . 2]" 1 533 1 29 TRP HE3 1 61 ASN HB3 . . 4.910 4.034 3.645 4.461 . 0 0 "[ . 1 . 2]" 1 534 1 29 TRP HE3 1 62 PHE HA . . 4.680 3.844 3.489 4.255 . 0 0 "[ . 1 . 2]" 1 535 1 29 TRP HE3 1 63 GLY H . . 4.240 3.757 3.226 4.240 . 0 0 "[ . 1 . 2]" 1 536 1 29 TRP HE3 1 63 GLY HA3 . . 4.500 3.734 3.341 3.901 . 0 0 "[ . 1 . 2]" 1 537 1 29 TRP HH2 1 61 ASN QB . . 4.770 2.527 2.269 2.978 . 0 0 "[ . 1 . 2]" 1 538 1 29 TRP HZ3 1 31 VAL MG2 . . 5.270 4.759 4.460 5.152 . 0 0 "[ . 1 . 2]" 1 539 1 29 TRP HZ3 1 61 ASN HB2 . . 4.860 3.270 2.948 3.811 . 0 0 "[ . 1 . 2]" 1 540 1 29 TRP HZ3 1 61 ASN HB3 . . 4.860 2.723 2.143 3.334 . 0 0 "[ . 1 . 2]" 1 541 1 29 TRP HZ3 1 62 PHE H . . 4.460 3.548 2.958 4.125 . 0 0 "[ . 1 . 2]" 1 542 1 29 TRP HZ3 1 62 PHE HA . . 5.090 4.092 3.780 4.508 . 0 0 "[ . 1 . 2]" 1 543 1 29 TRP HZ3 1 63 GLY H . . 4.750 4.055 3.678 4.470 . 0 0 "[ . 1 . 2]" 1 544 1 29 TRP HZ3 1 63 GLY HA2 . . 4.330 3.754 3.207 4.117 . 0 0 "[ . 1 . 2]" 1 545 1 29 TRP HZ3 1 63 GLY HA3 . . 4.180 3.441 3.022 3.836 . 0 0 "[ . 1 . 2]" 1 546 1 30 ILE H 1 30 ILE HB . . 3.990 2.993 2.786 3.221 . 0 0 "[ . 1 . 2]" 1 547 1 30 ILE H 1 30 ILE QG . . 4.700 4.023 3.974 4.054 . 0 0 "[ . 1 . 2]" 1 548 1 30 ILE H 1 30 ILE MG . . 3.570 1.949 1.879 2.013 . 0 0 "[ . 1 . 2]" 1 549 1 30 ILE H 1 31 VAL MG2 . . 4.520 4.101 3.823 4.358 . 0 0 "[ . 1 . 2]" 1 550 1 30 ILE H 1 60 LEU MD1 . . 4.380 3.814 3.209 4.224 . 0 0 "[ . 1 . 2]" 1 551 1 30 ILE H 1 61 ASN H . . 4.740 4.252 3.799 4.701 . 0 0 "[ . 1 . 2]" 1 552 1 30 ILE H 1 93 LEU MD1 . . 4.730 4.521 4.246 4.738 0.008 6 0 "[ . 1 . 2]" 1 553 1 30 ILE HA 1 30 ILE MD . . 4.220 3.625 3.524 3.723 . 0 0 "[ . 1 . 2]" 1 554 1 30 ILE HA 1 30 ILE HG12 . . 3.860 3.303 3.197 3.380 . 0 0 "[ . 1 . 2]" 1 555 1 30 ILE HA 1 30 ILE HG13 . . 3.860 2.358 2.281 2.450 . 0 0 "[ . 1 . 2]" 1 556 1 30 ILE HA 1 31 VAL H . . 3.120 2.165 2.151 2.172 . 0 0 "[ . 1 . 2]" 1 557 1 30 ILE HA 1 31 VAL MG2 . . 4.160 3.737 3.586 3.939 . 0 0 "[ . 1 . 2]" 1 558 1 30 ILE HA 1 93 LEU HB2 . . 5.500 4.915 4.598 5.290 . 0 0 "[ . 1 . 2]" 1 559 1 30 ILE HA 1 93 LEU MD1 . . 4.250 3.423 3.046 3.776 . 0 0 "[ . 1 . 2]" 1 560 1 30 ILE HA 1 93 LEU HG . . 5.500 5.044 4.664 5.473 . 0 0 "[ . 1 . 2]" 1 561 1 30 ILE HA 1 94 PHE H . . 4.330 3.411 3.199 3.617 . 0 0 "[ . 1 . 2]" 1 562 1 30 ILE HB 1 30 ILE MD . . 3.680 2.258 2.114 2.383 . 0 0 "[ . 1 . 2]" 1 563 1 30 ILE HB 1 31 VAL H . . 4.690 4.427 4.365 4.479 . 0 0 "[ . 1 . 2]" 1 564 1 30 ILE HB 1 60 LEU MD2 . . 4.990 4.439 3.544 4.995 0.005 2 0 "[ . 1 . 2]" 1 565 1 30 ILE HB 1 62 PHE QD . . 5.480 5.194 4.857 5.435 . 0 0 "[ . 1 . 2]" 1 566 1 30 ILE HB 1 93 LEU HA . . 4.910 3.840 3.498 4.077 . 0 0 "[ . 1 . 2]" 1 567 1 30 ILE HB 1 93 LEU MD1 . . 4.040 2.629 2.245 3.141 . 0 0 "[ . 1 . 2]" 1 568 1 30 ILE HB 1 128 LEU MD2 . . 4.970 3.882 3.372 4.226 . 0 0 "[ . 1 . 2]" 1 569 1 30 ILE MD 1 30 ILE MG . . 3.070 2.338 2.167 2.510 . 0 0 "[ . 1 . 2]" 1 570 1 30 ILE MD 1 31 VAL H . . 4.920 4.751 4.691 4.832 . 0 0 "[ . 1 . 2]" 1 571 1 30 ILE MD 1 48 TYR QE . . 4.220 3.230 2.181 3.975 . 0 0 "[ . 1 . 2]" 1 572 1 30 ILE MD 1 60 LEU MD2 . . 4.570 4.145 3.243 4.551 . 0 0 "[ . 1 . 2]" 1 573 1 30 ILE MD 1 62 PHE QD . . 4.690 4.167 3.543 4.478 . 0 0 "[ . 1 . 2]" 1 574 1 30 ILE MD 1 62 PHE QE . . 4.080 3.268 2.648 3.632 . 0 0 "[ . 1 . 2]" 1 575 1 30 ILE MD 1 91 LEU MD1 . . 3.980 2.915 2.358 3.236 . 0 0 "[ . 1 . 2]" 1 576 1 30 ILE MD 1 91 LEU MD2 . . 3.720 2.638 2.296 3.058 . 0 0 "[ . 1 . 2]" 1 577 1 30 ILE MD 1 93 LEU MD1 . . 3.580 2.736 2.462 3.506 . 0 0 "[ . 1 . 2]" 1 578 1 30 ILE MD 1 122 VAL MG1 . . 3.880 3.384 3.174 3.644 . 0 0 "[ . 1 . 2]" 1 579 1 30 ILE MD 1 126 PHE HB2 . . 4.440 4.123 3.663 4.378 . 0 0 "[ . 1 . 2]" 1 580 1 30 ILE MD 1 126 PHE QB . . 3.830 3.435 3.015 3.739 . 0 0 "[ . 1 . 2]" 1 581 1 30 ILE MD 1 126 PHE HB3 . . 4.440 3.681 3.208 4.075 . 0 0 "[ . 1 . 2]" 1 582 1 30 ILE MD 1 126 PHE QD . . 3.960 3.256 2.533 3.813 . 0 0 "[ . 1 . 2]" 1 583 1 30 ILE MD 1 126 PHE QE . . 4.620 3.515 2.505 3.951 . 0 0 "[ . 1 . 2]" 1 584 1 30 ILE MD 1 128 LEU MD1 . . 4.100 3.226 2.808 3.731 . 0 0 "[ . 1 . 2]" 1 585 1 30 ILE MD 1 128 LEU MD2 . . 3.140 2.498 2.033 2.846 . 0 0 "[ . 1 . 2]" 1 586 1 30 ILE QG 1 30 ILE MG . . 3.220 2.084 2.024 2.161 . 0 0 "[ . 1 . 2]" 1 587 1 30 ILE QG 1 31 VAL H . . 3.690 3.123 3.049 3.205 . 0 0 "[ . 1 . 2]" 1 588 1 30 ILE QG 1 48 TYR QE . . 4.520 3.201 2.677 3.617 . 0 0 "[ . 1 . 2]" 1 589 1 30 ILE QG 1 91 LEU MD2 . . 3.580 2.506 2.220 2.763 . 0 0 "[ . 1 . 2]" 1 590 1 30 ILE QG 1 92 ILE H . . 4.630 3.438 3.123 3.746 . 0 0 "[ . 1 . 2]" 1 591 1 30 ILE HG12 1 31 VAL H . . 4.380 3.895 3.735 4.029 . 0 0 "[ . 1 . 2]" 1 592 1 30 ILE HG13 1 31 VAL H . . 4.380 3.292 3.206 3.435 . 0 0 "[ . 1 . 2]" 1 593 1 30 ILE MG 1 31 VAL H . . 4.190 4.139 4.094 4.184 . 0 0 "[ . 1 . 2]" 1 594 1 30 ILE MG 1 48 TYR QE . . 3.760 3.319 2.874 3.608 . 0 0 "[ . 1 . 2]" 1 595 1 30 ILE MG 1 48 TYR HH . . 4.480 3.162 2.383 3.715 . 0 0 "[ . 1 . 2]" 1 596 1 30 ILE MG 1 62 PHE H . . 4.710 4.267 3.996 4.430 . 0 0 "[ . 1 . 2]" 1 597 1 30 ILE MG 1 62 PHE HA . . 3.420 2.030 1.887 2.207 . 0 0 "[ . 1 . 2]" 1 598 1 30 ILE MG 1 62 PHE HB2 . . 5.000 4.083 3.861 4.247 . 0 0 "[ . 1 . 2]" 1 599 1 30 ILE MG 1 62 PHE HB3 . . 5.120 3.493 3.332 3.732 . 0 0 "[ . 1 . 2]" 1 600 1 30 ILE MG 1 62 PHE QD . . 3.690 2.687 2.482 2.886 . 0 0 "[ . 1 . 2]" 1 601 1 30 ILE MG 1 62 PHE QE . . 3.940 2.866 2.563 3.062 . 0 0 "[ . 1 . 2]" 1 602 1 30 ILE MG 1 62 PHE HZ . . 4.550 3.430 3.172 3.655 . 0 0 "[ . 1 . 2]" 1 603 1 30 ILE MG 1 63 GLY H . . 4.470 3.062 2.840 3.340 . 0 0 "[ . 1 . 2]" 1 604 1 30 ILE MG 1 91 LEU MD1 . . 5.260 5.054 4.603 5.260 . 0 0 "[ . 1 . 2]" 1 605 1 30 ILE MG 1 91 LEU MD2 . . 4.290 3.992 3.754 4.268 . 0 0 "[ . 1 . 2]" 1 606 1 31 VAL H 1 31 VAL HB . . 3.810 2.624 2.527 2.723 . 0 0 "[ . 1 . 2]" 1 607 1 31 VAL H 1 31 VAL MG1 . . 4.410 3.832 3.800 3.861 . 0 0 "[ . 1 . 2]" 1 608 1 31 VAL H 1 31 VAL MG2 . . 3.700 2.408 2.260 2.577 . 0 0 "[ . 1 . 2]" 1 609 1 31 VAL H 1 33 PHE QE . . 4.870 4.408 3.872 4.746 . 0 0 "[ . 1 . 2]" 1 610 1 31 VAL H 1 92 ILE H . . 4.000 3.808 3.538 3.959 . 0 0 "[ . 1 . 2]" 1 611 1 31 VAL H 1 92 ILE MG . . 4.910 4.699 4.423 4.904 . 0 0 "[ . 1 . 2]" 1 612 1 31 VAL H 1 94 PHE QD . . 4.200 3.188 2.692 3.527 . 0 0 "[ . 1 . 2]" 1 613 1 31 VAL H 1 94 PHE QE . . 4.430 3.573 2.540 4.309 . 0 0 "[ . 1 . 2]" 1 614 1 31 VAL HB 1 33 PHE QE . . 3.770 2.977 2.312 3.423 . 0 0 "[ . 1 . 2]" 1 615 1 31 VAL HB 1 33 PHE HZ . . 4.640 3.444 3.040 3.785 . 0 0 "[ . 1 . 2]" 1 616 1 31 VAL HB 1 92 ILE H . . 4.770 4.541 4.312 4.737 . 0 0 "[ . 1 . 2]" 1 617 1 31 VAL HB 1 92 ILE HB . . 4.560 3.987 3.650 4.217 . 0 0 "[ . 1 . 2]" 1 618 1 31 VAL HB 1 92 ILE MG . . 5.500 4.911 4.563 5.173 . 0 0 "[ . 1 . 2]" 1 619 1 31 VAL HB 1 94 PHE QE . . 3.640 2.810 2.014 3.431 . 0 0 "[ . 1 . 2]" 1 620 1 31 VAL MG1 1 32 GLU H . . 3.780 2.200 1.901 2.497 . 0 0 "[ . 1 . 2]" 1 621 1 31 VAL MG1 1 33 PHE QD . . 4.180 3.710 3.451 3.926 . 0 0 "[ . 1 . 2]" 1 622 1 31 VAL MG1 1 33 PHE QE . . 3.710 3.298 2.933 3.574 . 0 0 "[ . 1 . 2]" 1 623 1 31 VAL MG1 1 33 PHE HZ . . 4.160 3.524 2.944 4.109 . 0 0 "[ . 1 . 2]" 1 624 1 31 VAL MG1 1 63 GLY HA3 . . 4.660 3.445 2.870 4.268 . 0 0 "[ . 1 . 2]" 1 625 1 31 VAL MG1 1 64 LYS HA . . 3.830 2.820 2.209 3.694 . 0 0 "[ . 1 . 2]" 1 626 1 31 VAL MG1 1 65 VAL H . . 4.080 3.038 2.487 3.771 . 0 0 "[ . 1 . 2]" 1 627 1 31 VAL MG1 1 65 VAL HB . . 4.180 3.101 2.698 3.569 . 0 0 "[ . 1 . 2]" 1 628 1 31 VAL MG1 1 65 VAL MG2 . . 4.100 3.942 3.732 4.106 0.006 2 0 "[ . 1 . 2]" 1 629 1 31 VAL MG1 1 94 PHE QE . . 4.580 4.135 3.633 4.577 . 0 0 "[ . 1 . 2]" 1 630 1 31 VAL MG2 1 32 GLU H . . 4.550 4.025 3.883 4.143 . 0 0 "[ . 1 . 2]" 1 631 1 31 VAL MG2 1 33 PHE QD . . 5.500 5.411 5.217 5.502 0.002 5 0 "[ . 1 . 2]" 1 632 1 31 VAL MG2 1 33 PHE QE . . 5.500 4.220 3.827 4.509 . 0 0 "[ . 1 . 2]" 1 633 1 31 VAL MG2 1 33 PHE HZ . . 4.920 4.211 3.947 4.577 . 0 0 "[ . 1 . 2]" 1 634 1 31 VAL MG2 1 63 GLY H . . 4.430 3.721 3.436 4.079 . 0 0 "[ . 1 . 2]" 1 635 1 31 VAL MG2 1 63 GLY HA2 . . 4.920 4.645 4.058 4.921 0.001 12 0 "[ . 1 . 2]" 1 636 1 31 VAL MG2 1 63 GLY HA3 . . 4.140 3.120 2.455 3.445 . 0 0 "[ . 1 . 2]" 1 637 1 31 VAL MG2 1 65 VAL HB . . 5.180 4.829 4.615 5.097 . 0 0 "[ . 1 . 2]" 1 638 1 31 VAL MG2 1 92 ILE HB . . 5.500 4.846 4.474 5.091 . 0 0 "[ . 1 . 2]" 1 639 1 31 VAL MG2 1 94 PHE QD . . 3.500 2.867 2.367 3.249 . 0 0 "[ . 1 . 2]" 1 640 1 31 VAL MG2 1 94 PHE QE . . 3.840 2.976 2.085 3.523 . 0 0 "[ . 1 . 2]" 1 641 1 31 VAL MG2 1 94 PHE HZ . . 5.500 4.817 3.943 5.500 . 0 0 "[ . 1 . 2]" 1 642 1 32 GLU H 1 32 GLU HB2 . . 3.890 2.959 2.774 3.129 . 0 0 "[ . 1 . 2]" 1 643 1 32 GLU H 1 32 GLU HB3 . . 4.080 2.548 2.441 2.710 . 0 0 "[ . 1 . 2]" 1 644 1 32 GLU H 1 32 GLU QG . . 4.850 4.045 3.940 4.209 . 0 0 "[ . 1 . 2]" 1 645 1 32 GLU H 1 48 TYR QE . . 4.400 4.015 3.277 4.347 . 0 0 "[ . 1 . 2]" 1 646 1 32 GLU H 1 48 TYR HH . . 3.920 3.481 2.992 3.923 0.003 13 0 "[ . 1 . 2]" 1 647 1 32 GLU H 1 63 GLY H . . 4.930 4.095 3.877 4.419 . 0 0 "[ . 1 . 2]" 1 648 1 32 GLU H 1 64 LYS HA . . 3.720 2.414 2.079 2.716 . 0 0 "[ . 1 . 2]" 1 649 1 32 GLU H 1 65 VAL H . . 4.610 3.745 3.179 4.256 . 0 0 "[ . 1 . 2]" 1 650 1 32 GLU H 1 91 LEU MD2 . . 4.710 3.968 3.765 4.122 . 0 0 "[ . 1 . 2]" 1 651 1 32 GLU HA 1 33 PHE H . . 3.430 2.150 2.139 2.171 . 0 0 "[ . 1 . 2]" 1 652 1 32 GLU HA 1 33 PHE QD . . 4.740 3.206 2.784 3.667 . 0 0 "[ . 1 . 2]" 1 653 1 32 GLU HA 1 90 THR H . . 4.880 4.323 3.941 4.638 . 0 0 "[ . 1 . 2]" 1 654 1 32 GLU HA 1 91 LEU HA . . 3.840 2.731 2.551 2.889 . 0 0 "[ . 1 . 2]" 1 655 1 32 GLU HA 1 91 LEU MD1 . . 5.070 4.922 4.757 5.065 . 0 0 "[ . 1 . 2]" 1 656 1 32 GLU HA 1 91 LEU MD2 . . 3.490 2.218 2.025 2.503 . 0 0 "[ . 1 . 2]" 1 657 1 32 GLU HA 1 92 ILE H . . 4.630 3.805 3.554 4.081 . 0 0 "[ . 1 . 2]" 1 658 1 32 GLU HB2 1 48 TYR QD . . 4.660 4.127 3.609 4.347 . 0 0 "[ . 1 . 2]" 1 659 1 32 GLU HB2 1 48 TYR QE . . 4.180 3.130 2.691 3.403 . 0 0 "[ . 1 . 2]" 1 660 1 32 GLU HB2 1 64 LYS HA . . 5.360 4.446 3.941 4.790 . 0 0 "[ . 1 . 2]" 1 661 1 32 GLU HB2 1 64 LYS QG . . 4.910 3.764 3.077 4.497 . 0 0 "[ . 1 . 2]" 1 662 1 32 GLU HB2 1 91 LEU MD1 . . 4.840 4.329 3.983 4.788 . 0 0 "[ . 1 . 2]" 1 663 1 32 GLU HB2 1 91 LEU MD2 . . 3.720 2.089 1.879 2.485 . 0 0 "[ . 1 . 2]" 1 664 1 32 GLU HB3 1 48 TYR QE . . 3.910 3.074 2.415 3.676 . 0 0 "[ . 1 . 2]" 1 665 1 32 GLU HB3 1 64 LYS HG2 . . 4.810 3.239 1.997 4.563 . 0 0 "[ . 1 . 2]" 1 666 1 32 GLU HB3 1 64 LYS QG . . 4.030 2.274 1.886 2.902 . 0 0 "[ . 1 . 2]" 1 667 1 32 GLU HB3 1 64 LYS HG3 . . 4.810 2.594 2.007 3.556 . 0 0 "[ . 1 . 2]" 1 668 1 32 GLU HB3 1 91 LEU MD2 . . 4.280 3.479 3.290 3.825 . 0 0 "[ . 1 . 2]" 1 669 1 32 GLU QG 1 33 PHE H . . 3.970 3.031 2.595 3.310 . 0 0 "[ . 1 . 2]" 1 670 1 32 GLU QG 1 34 PHE QB . . 4.200 3.075 2.610 4.082 . 0 0 "[ . 1 . 2]" 1 671 1 32 GLU QG 1 34 PHE QD . . 4.270 3.707 2.698 4.276 0.006 7 0 "[ . 1 . 2]" 1 672 1 32 GLU QG 1 44 PHE QE . . 4.830 3.755 2.603 4.559 . 0 0 "[ . 1 . 2]" 1 673 1 32 GLU QG 1 48 TYR QD . . 5.340 4.284 3.348 4.791 . 0 0 "[ . 1 . 2]" 1 674 1 32 GLU QG 1 64 LYS HA . . 5.340 4.678 4.095 5.182 . 0 0 "[ . 1 . 2]" 1 675 1 32 GLU QG 1 64 LYS QG . . 4.910 3.432 2.659 4.014 . 0 0 "[ . 1 . 2]" 1 676 1 32 GLU QG 1 89 PRO QB . . 4.130 2.912 2.513 3.227 . 0 0 "[ . 1 . 2]" 1 677 1 32 GLU QG 1 91 LEU MD1 . . 5.050 4.008 3.620 4.841 . 0 0 "[ . 1 . 2]" 1 678 1 32 GLU QG 1 91 LEU MD2 . . 3.890 2.306 1.951 3.335 . 0 0 "[ . 1 . 2]" 1 679 1 32 GLU HG2 1 33 PHE H . . 4.610 3.462 2.829 4.602 . 0 0 "[ . 1 . 2]" 1 680 1 32 GLU HG2 1 44 PHE QE . . 5.500 4.816 2.626 5.474 . 0 0 "[ . 1 . 2]" 1 681 1 32 GLU HG2 1 91 LEU MD2 . . 4.610 3.287 1.972 3.761 . 0 0 "[ . 1 . 2]" 1 682 1 32 GLU HG3 1 33 PHE H . . 4.610 3.700 2.686 4.513 . 0 0 "[ . 1 . 2]" 1 683 1 32 GLU HG3 1 44 PHE QE . . 5.500 4.071 2.964 5.285 . 0 0 "[ . 1 . 2]" 1 684 1 32 GLU HG3 1 91 LEU MD2 . . 4.610 2.527 1.967 3.827 . 0 0 "[ . 1 . 2]" 1 685 1 33 PHE H 1 33 PHE HB2 . . 4.080 2.563 2.472 2.660 . 0 0 "[ . 1 . 2]" 1 686 1 33 PHE H 1 33 PHE QD . . 3.730 1.988 1.897 2.217 . 0 0 "[ . 1 . 2]" 1 687 1 33 PHE H 1 65 VAL MG1 . . 4.950 4.309 3.957 4.674 . 0 0 "[ . 1 . 2]" 1 688 1 33 PHE H 1 90 THR H . . 4.080 3.114 2.780 3.454 . 0 0 "[ . 1 . 2]" 1 689 1 33 PHE H 1 90 THR HB . . 4.670 3.464 3.032 3.932 . 0 0 "[ . 1 . 2]" 1 690 1 33 PHE H 1 91 LEU HA . . 4.580 3.580 3.160 3.833 . 0 0 "[ . 1 . 2]" 1 691 1 33 PHE H 1 91 LEU MD2 . . 4.440 3.787 3.307 4.079 . 0 0 "[ . 1 . 2]" 1 692 1 33 PHE HA 1 33 PHE QD . . 4.180 3.131 2.977 3.215 . 0 0 "[ . 1 . 2]" 1 693 1 33 PHE HA 1 34 PHE H . . 3.120 2.151 2.139 2.168 . 0 0 "[ . 1 . 2]" 1 694 1 33 PHE HA 1 34 PHE QD . . 4.400 3.681 3.190 4.211 . 0 0 "[ . 1 . 2]" 1 695 1 33 PHE HA 1 65 VAL H . . 4.100 3.388 2.970 3.807 . 0 0 "[ . 1 . 2]" 1 696 1 33 PHE HA 1 65 VAL MG1 . . 3.680 2.605 2.251 2.881 . 0 0 "[ . 1 . 2]" 1 697 1 33 PHE HA 1 67 VAL MG1 . . 4.180 3.056 2.616 3.583 . 0 0 "[ . 1 . 2]" 1 698 1 33 PHE HA 1 67 VAL MG2 . . 4.340 3.429 3.116 4.004 . 0 0 "[ . 1 . 2]" 1 699 1 33 PHE HA 1 79 VAL MG1 . . 5.500 5.342 5.018 5.498 . 0 0 "[ . 1 . 2]" 1 700 1 33 PHE HB2 1 34 PHE H . . 4.880 4.282 4.055 4.400 . 0 0 "[ . 1 . 2]" 1 701 1 33 PHE HB2 1 67 VAL MG1 . . 4.150 3.584 3.256 4.046 . 0 0 "[ . 1 . 2]" 1 702 1 33 PHE HB2 1 67 VAL MG2 . . 4.590 3.534 3.237 3.887 . 0 0 "[ . 1 . 2]" 1 703 1 33 PHE HB2 1 79 VAL MG1 . . 3.700 3.309 3.057 3.605 . 0 0 "[ . 1 . 2]" 1 704 1 33 PHE HB2 1 79 VAL MG2 . . 4.230 3.630 3.105 3.993 . 0 0 "[ . 1 . 2]" 1 705 1 33 PHE HB2 1 90 THR H . . 4.210 3.401 2.937 3.788 . 0 0 "[ . 1 . 2]" 1 706 1 33 PHE HB2 1 90 THR HB . . 3.610 2.011 1.990 2.095 . 0 0 "[ . 1 . 2]" 1 707 1 33 PHE HB2 1 90 THR MG . . 4.030 3.113 2.750 3.447 . 0 0 "[ . 1 . 2]" 1 708 1 33 PHE HB3 1 34 PHE H . . 4.500 3.567 3.182 3.792 . 0 0 "[ . 1 . 2]" 1 709 1 33 PHE HB3 1 65 VAL MG1 . . 4.350 3.710 3.270 4.084 . 0 0 "[ . 1 . 2]" 1 710 1 33 PHE HB3 1 67 VAL MG1 . . 4.000 2.093 1.854 2.571 . 0 0 "[ . 1 . 2]" 1 711 1 33 PHE HB3 1 67 VAL MG2 . . 4.040 2.344 2.022 2.705 . 0 0 "[ . 1 . 2]" 1 712 1 33 PHE HB3 1 79 VAL MG1 . . 3.620 3.282 2.811 3.459 . 0 0 "[ . 1 . 2]" 1 713 1 33 PHE HB3 1 79 VAL MG2 . . 4.700 3.815 3.449 4.257 . 0 0 "[ . 1 . 2]" 1 714 1 33 PHE HB3 1 88 LEU MD2 . . 4.630 3.286 2.995 3.661 . 0 0 "[ . 1 . 2]" 1 715 1 33 PHE HB3 1 90 THR HB . . 3.990 3.581 3.163 3.803 . 0 0 "[ . 1 . 2]" 1 716 1 33 PHE HB3 1 90 THR MG . . 4.820 4.422 3.958 4.739 . 0 0 "[ . 1 . 2]" 1 717 1 33 PHE QD 1 65 VAL MG1 . . 3.710 2.575 1.974 3.254 . 0 0 "[ . 1 . 2]" 1 718 1 33 PHE QD 1 65 VAL MG2 . . 4.820 3.941 3.351 4.661 . 0 0 "[ . 1 . 2]" 1 719 1 33 PHE QD 1 67 VAL MG1 . . 3.200 1.873 1.781 2.015 . 0 0 "[ . 1 . 2]" 1 720 1 33 PHE QD 1 67 VAL MG2 . . 4.220 3.535 3.278 3.766 . 0 0 "[ . 1 . 2]" 1 721 1 33 PHE QD 1 73 VAL MG1 . . 3.690 2.744 2.440 3.040 . 0 0 "[ . 1 . 2]" 1 722 1 33 PHE QD 1 79 VAL HB . . 5.050 4.610 3.706 5.045 . 0 0 "[ . 1 . 2]" 1 723 1 33 PHE QD 1 79 VAL MG1 . . 4.150 4.010 3.280 4.158 0.008 18 0 "[ . 1 . 2]" 1 724 1 33 PHE QD 1 79 VAL MG2 . . 4.230 3.561 2.972 3.944 . 0 0 "[ . 1 . 2]" 1 725 1 33 PHE QD 1 90 THR HB . . 4.420 3.250 2.763 4.023 . 0 0 "[ . 1 . 2]" 1 726 1 33 PHE QD 1 90 THR MG . . 3.970 2.675 2.135 3.395 . 0 0 "[ . 1 . 2]" 1 727 1 33 PHE QD 1 91 LEU HA . . 4.560 3.630 3.297 4.114 . 0 0 "[ . 1 . 2]" 1 728 1 33 PHE QD 1 92 ILE H . . 4.480 3.919 3.615 4.360 . 0 0 "[ . 1 . 2]" 1 729 1 33 PHE QD 1 92 ILE HB . . 4.940 4.104 3.743 4.487 . 0 0 "[ . 1 . 2]" 1 730 1 33 PHE QD 1 92 ILE MD . . 3.860 3.150 2.767 3.566 . 0 0 "[ . 1 . 2]" 1 731 1 33 PHE QE 1 65 VAL MG1 . . 3.840 2.884 2.436 3.512 . 0 0 "[ . 1 . 2]" 1 732 1 33 PHE QE 1 65 VAL MG2 . . 5.430 4.172 3.310 4.879 . 0 0 "[ . 1 . 2]" 1 733 1 33 PHE QE 1 67 VAL MG1 . . 4.280 3.496 3.353 3.654 . 0 0 "[ . 1 . 2]" 1 734 1 33 PHE QE 1 73 VAL MG1 . . 3.380 2.469 2.289 2.644 . 0 0 "[ . 1 . 2]" 1 735 1 33 PHE QE 1 77 TYR QB . . 4.360 3.406 2.670 3.966 . 0 0 "[ . 1 . 2]" 1 736 1 33 PHE QE 1 77 TYR QD . . 4.610 3.251 2.678 3.799 . 0 0 "[ . 1 . 2]" 1 737 1 33 PHE QE 1 90 THR MG . . 4.580 3.771 3.370 4.379 . 0 0 "[ . 1 . 2]" 1 738 1 33 PHE QE 1 92 ILE H . . 4.290 3.524 3.183 3.893 . 0 0 "[ . 1 . 2]" 1 739 1 33 PHE QE 1 92 ILE HB . . 3.760 2.272 1.998 2.590 . 0 0 "[ . 1 . 2]" 1 740 1 33 PHE QE 1 92 ILE MD . . 3.600 2.219 1.959 2.553 . 0 0 "[ . 1 . 2]" 1 741 1 33 PHE QE 1 92 ILE QG . . 4.020 3.030 2.069 3.867 . 0 0 "[ . 1 . 2]" 1 742 1 33 PHE QE 1 92 ILE MG . . 4.400 3.665 3.377 3.986 . 0 0 "[ . 1 . 2]" 1 743 1 33 PHE QE 1 94 PHE QE . . 4.040 3.238 2.728 3.716 . 0 0 "[ . 1 . 2]" 1 744 1 33 PHE HZ 1 65 VAL MG1 . . 4.840 3.922 3.414 4.275 . 0 0 "[ . 1 . 2]" 1 745 1 33 PHE HZ 1 73 VAL MG1 . . 4.530 4.331 4.156 4.509 . 0 0 "[ . 1 . 2]" 1 746 1 33 PHE HZ 1 77 TYR QB . . 4.760 4.065 3.610 4.576 . 0 0 "[ . 1 . 2]" 1 747 1 33 PHE HZ 1 77 TYR QD . . 4.310 2.968 2.203 3.735 . 0 0 "[ . 1 . 2]" 1 748 1 33 PHE HZ 1 90 THR MG . . 5.500 5.334 5.124 5.483 . 0 0 "[ . 1 . 2]" 1 749 1 33 PHE HZ 1 92 ILE HB . . 4.570 3.919 3.645 4.336 . 0 0 "[ . 1 . 2]" 1 750 1 33 PHE HZ 1 92 ILE MD . . 3.760 2.987 2.508 3.422 . 0 0 "[ . 1 . 2]" 1 751 1 33 PHE HZ 1 94 PHE QE . . 4.060 3.085 2.656 3.357 . 0 0 "[ . 1 . 2]" 1 752 1 33 PHE HZ 1 94 PHE HZ . . 4.520 3.096 2.084 4.081 . 0 0 "[ . 1 . 2]" 1 753 1 34 PHE H 1 34 PHE QD . . 3.390 2.403 1.905 3.139 . 0 0 "[ . 1 . 2]" 1 754 1 34 PHE H 1 34 PHE QE . . 4.480 4.227 3.980 4.482 0.002 14 0 "[ . 1 . 2]" 1 755 1 34 PHE H 1 35 ALA H . . 4.870 4.437 4.375 4.477 . 0 0 "[ . 1 . 2]" 1 756 1 34 PHE H 1 65 VAL H . . 4.510 4.002 3.594 4.483 . 0 0 "[ . 1 . 2]" 1 757 1 34 PHE H 1 65 VAL MG1 . . 4.450 3.870 3.545 4.219 . 0 0 "[ . 1 . 2]" 1 758 1 34 PHE H 1 66 ASP HA . . 4.100 3.053 2.626 3.385 . 0 0 "[ . 1 . 2]" 1 759 1 34 PHE H 1 67 VAL MG1 . . 4.600 3.677 3.128 4.238 . 0 0 "[ . 1 . 2]" 1 760 1 34 PHE H 1 67 VAL MG2 . . 4.490 3.028 2.380 3.443 . 0 0 "[ . 1 . 2]" 1 761 1 34 PHE H 1 88 LEU MD2 . . 5.260 3.801 3.448 4.104 . 0 0 "[ . 1 . 2]" 1 762 1 34 PHE HA 1 34 PHE QD . . 4.310 3.702 3.655 3.726 . 0 0 "[ . 1 . 2]" 1 763 1 34 PHE HA 1 35 ALA H . . 3.340 2.462 2.333 2.638 . 0 0 "[ . 1 . 2]" 1 764 1 34 PHE HA 1 67 VAL MG2 . . 4.850 3.480 3.270 3.830 . 0 0 "[ . 1 . 2]" 1 765 1 34 PHE HA 1 88 LEU HB3 . . 5.110 3.627 3.156 4.050 . 0 0 "[ . 1 . 2]" 1 766 1 34 PHE HA 1 88 LEU MD2 . . 3.780 2.117 1.864 2.456 . 0 0 "[ . 1 . 2]" 1 767 1 34 PHE QB 1 35 ALA H . . 3.280 2.413 2.149 2.596 . 0 0 "[ . 1 . 2]" 1 768 1 34 PHE QB 1 41 CYS QB . . 4.360 2.602 2.111 3.358 . 0 0 "[ . 1 . 2]" 1 769 1 34 PHE QB 1 88 LEU MD2 . . 4.880 3.696 3.335 4.042 . 0 0 "[ . 1 . 2]" 1 770 1 34 PHE HB2 1 35 ALA H . . 3.930 2.439 2.164 2.634 . 0 0 "[ . 1 . 2]" 1 771 1 34 PHE HB3 1 35 ALA H . . 3.930 3.845 3.653 3.935 0.005 20 0 "[ . 1 . 2]" 1 772 1 34 PHE QD 1 35 ALA H . . 3.760 2.873 2.519 3.339 . 0 0 "[ . 1 . 2]" 1 773 1 34 PHE QD 1 35 ALA HA . . 4.550 3.931 3.084 4.417 . 0 0 "[ . 1 . 2]" 1 774 1 34 PHE QD 1 36 ASN HA . . 4.530 3.964 3.651 4.311 . 0 0 "[ . 1 . 2]" 1 775 1 34 PHE QD 1 41 CYS HB2 . . 4.770 3.692 2.306 4.658 . 0 0 "[ . 1 . 2]" 1 776 1 34 PHE QD 1 41 CYS QB . . 4.180 3.285 2.171 4.046 . 0 0 "[ . 1 . 2]" 1 777 1 34 PHE QD 1 41 CYS HB3 . . 4.770 3.704 2.649 4.534 . 0 0 "[ . 1 . 2]" 1 778 1 34 PHE QD 1 64 LYS HB2 . . 5.430 5.174 4.690 5.432 0.002 7 0 "[ . 1 . 2]" 1 779 1 34 PHE QD 1 64 LYS QB . . 4.620 4.020 3.078 4.626 0.006 12 0 "[ . 1 . 2]" 1 780 1 34 PHE QD 1 64 LYS HB3 . . 5.430 4.254 3.121 5.123 . 0 0 "[ . 1 . 2]" 1 781 1 34 PHE QD 1 64 LYS HG2 . . 4.640 2.789 2.142 3.405 . 0 0 "[ . 1 . 2]" 1 782 1 34 PHE QD 1 64 LYS QG . . 3.840 2.705 2.103 3.323 . 0 0 "[ . 1 . 2]" 1 783 1 34 PHE QD 1 64 LYS HG3 . . 4.640 3.822 2.974 4.663 0.023 18 0 "[ . 1 . 2]" 1 784 1 34 PHE QD 1 65 VAL H . . 3.970 3.558 3.120 3.955 . 0 0 "[ . 1 . 2]" 1 785 1 34 PHE QD 1 66 ASP HA . . 4.520 3.541 3.042 4.069 . 0 0 "[ . 1 . 2]" 1 786 1 34 PHE QE 1 36 ASN HA . . 4.670 3.500 2.926 4.010 . 0 0 "[ . 1 . 2]" 1 787 1 34 PHE QE 1 64 LYS QB . . 4.120 2.911 1.983 4.059 . 0 0 "[ . 1 . 2]" 1 788 1 34 PHE QE 1 64 LYS QE . . 4.700 2.747 2.010 4.354 . 0 0 "[ . 1 . 2]" 1 789 1 34 PHE QE 1 64 LYS HG2 . . 4.880 2.611 1.999 3.989 . 0 0 "[ . 1 . 2]" 1 790 1 34 PHE QE 1 64 LYS QG . . 4.030 2.562 1.991 3.715 . 0 0 "[ . 1 . 2]" 1 791 1 34 PHE QE 1 64 LYS HG3 . . 4.880 4.018 3.513 4.725 . 0 0 "[ . 1 . 2]" 1 792 1 34 PHE QE 1 65 VAL H . . 4.420 3.796 3.068 4.327 . 0 0 "[ . 1 . 2]" 1 793 1 34 PHE QE 1 66 ASP H . . 4.360 3.830 3.174 4.360 . 0 0 "[ . 1 . 2]" 1 794 1 34 PHE QE 1 66 ASP HA . . 4.260 3.609 3.087 4.162 . 0 0 "[ . 1 . 2]" 1 795 1 34 PHE QE 1 66 ASP QB . . 4.060 3.203 2.496 3.791 . 0 0 "[ . 1 . 2]" 1 796 1 34 PHE HZ 1 66 ASP HA . . 5.360 4.471 4.035 4.969 . 0 0 "[ . 1 . 2]" 1 797 1 34 PHE HZ 1 66 ASP QB . . 4.020 3.186 2.782 3.781 . 0 0 "[ . 1 . 2]" 1 798 1 35 ALA H 1 35 ALA MB . . 3.650 2.421 2.328 2.560 . 0 0 "[ . 1 . 2]" 1 799 1 35 ALA H 1 37 TRP H . . 5.430 5.074 4.578 5.422 . 0 0 "[ . 1 . 2]" 1 800 1 35 ALA H 1 38 SER HB2 . . 4.910 3.048 2.149 4.066 . 0 0 "[ . 1 . 2]" 1 801 1 35 ALA H 1 38 SER HB3 . . 4.910 2.890 2.314 3.729 . 0 0 "[ . 1 . 2]" 1 802 1 35 ALA H 1 41 CYS QB . . 4.770 3.566 3.141 3.920 . 0 0 "[ . 1 . 2]" 1 803 1 35 ALA H 1 67 VAL MG2 . . 5.040 4.129 3.831 4.661 . 0 0 "[ . 1 . 2]" 1 804 1 35 ALA H 1 88 LEU HB3 . . 5.220 3.686 3.008 4.382 . 0 0 "[ . 1 . 2]" 1 805 1 35 ALA H 1 88 LEU MD1 . . 4.410 3.572 3.127 4.329 . 0 0 "[ . 1 . 2]" 1 806 1 35 ALA H 1 88 LEU MD2 . . 4.190 3.138 2.388 3.909 . 0 0 "[ . 1 . 2]" 1 807 1 35 ALA HA 1 37 TRP H . . 4.560 4.112 3.880 4.342 . 0 0 "[ . 1 . 2]" 1 808 1 35 ALA HA 1 66 ASP HA . . 4.490 3.809 3.509 4.220 . 0 0 "[ . 1 . 2]" 1 809 1 35 ALA HA 1 67 VAL H . . 5.090 3.488 3.117 3.887 . 0 0 "[ . 1 . 2]" 1 810 1 35 ALA HA 1 67 VAL MG2 . . 4.090 3.372 3.045 3.833 . 0 0 "[ . 1 . 2]" 1 811 1 35 ALA HA 1 68 GLY H . . 4.070 2.302 1.965 2.945 . 0 0 "[ . 1 . 2]" 1 812 1 35 ALA HA 1 88 LEU MD1 . . 4.880 4.030 3.732 4.413 . 0 0 "[ . 1 . 2]" 1 813 1 35 ALA HA 1 88 LEU MD2 . . 4.910 4.146 3.655 4.691 . 0 0 "[ . 1 . 2]" 1 814 1 35 ALA MB 1 36 ASN H . . 4.150 2.505 2.095 2.883 . 0 0 "[ . 1 . 2]" 1 815 1 35 ALA MB 1 36 ASN HA . . 5.160 4.300 4.117 4.490 . 0 0 "[ . 1 . 2]" 1 816 1 35 ALA MB 1 37 TRP H . . 3.700 2.437 2.169 2.695 . 0 0 "[ . 1 . 2]" 1 817 1 35 ALA MB 1 37 TRP HD1 . . 4.530 4.421 4.245 4.528 . 0 0 "[ . 1 . 2]" 1 818 1 35 ALA MB 1 37 TRP HE1 . . 3.950 3.748 3.582 3.882 . 0 0 "[ . 1 . 2]" 1 819 1 35 ALA MB 1 37 TRP HE3 . . 4.940 3.062 2.839 3.382 . 0 0 "[ . 1 . 2]" 1 820 1 35 ALA MB 1 37 TRP HH2 . . 4.780 2.883 2.628 3.156 . 0 0 "[ . 1 . 2]" 1 821 1 35 ALA MB 1 37 TRP HZ2 . . 4.200 3.055 2.915 3.184 . 0 0 "[ . 1 . 2]" 1 822 1 35 ALA MB 1 38 SER H . . 4.130 3.013 2.626 3.499 . 0 0 "[ . 1 . 2]" 1 823 1 35 ALA MB 1 38 SER HB2 . . 4.670 2.454 1.978 3.661 . 0 0 "[ . 1 . 2]" 1 824 1 35 ALA MB 1 38 SER HB3 . . 4.670 2.875 1.982 3.534 . 0 0 "[ . 1 . 2]" 1 825 1 35 ALA MB 1 67 VAL MG2 . . 3.910 2.897 2.607 3.265 . 0 0 "[ . 1 . 2]" 1 826 1 35 ALA MB 1 68 GLY H . . 4.050 2.669 2.354 3.002 . 0 0 "[ . 1 . 2]" 1 827 1 35 ALA MB 1 68 GLY HA2 . . 4.270 2.715 2.271 3.232 . 0 0 "[ . 1 . 2]" 1 828 1 35 ALA MB 1 68 GLY QA . . 3.660 2.021 1.789 2.501 . 0 0 "[ . 1 . 2]" 1 829 1 35 ALA MB 1 68 GLY HA3 . . 4.270 2.091 1.842 2.604 . 0 0 "[ . 1 . 2]" 1 830 1 35 ALA MB 1 81 THR HA . . 5.500 4.333 3.814 4.638 . 0 0 "[ . 1 . 2]" 1 831 1 35 ALA MB 1 81 THR MG . . 4.600 3.697 3.206 4.319 . 0 0 "[ . 1 . 2]" 1 832 1 35 ALA MB 1 88 LEU HB3 . . 4.410 3.415 3.035 3.725 . 0 0 "[ . 1 . 2]" 1 833 1 35 ALA MB 1 88 LEU MD1 . . 3.170 1.975 1.756 2.386 . 0 0 "[ . 1 . 2]" 1 834 1 35 ALA MB 1 88 LEU MD2 . . 3.860 2.930 2.456 3.351 . 0 0 "[ . 1 . 2]" 1 835 1 36 ASN H 1 36 ASN HB2 . . 4.140 2.926 2.202 3.649 . 0 0 "[ . 1 . 2]" 1 836 1 36 ASN H 1 36 ASN HB3 . . 4.140 2.789 2.206 3.651 . 0 0 "[ . 1 . 2]" 1 837 1 36 ASN H 1 37 TRP H . . 3.850 2.492 2.219 2.737 . 0 0 "[ . 1 . 2]" 1 838 1 36 ASN HA 1 38 SER H . . 4.430 3.668 3.495 3.932 . 0 0 "[ . 1 . 2]" 1 839 1 36 ASN QB 1 37 TRP H . . 4.120 3.117 2.723 3.728 . 0 0 "[ . 1 . 2]" 1 840 1 36 ASN HB2 1 37 TRP H . . 4.700 3.764 2.815 4.367 . 0 0 "[ . 1 . 2]" 1 841 1 36 ASN HB3 1 37 TRP H . . 4.700 3.558 2.778 4.189 . 0 0 "[ . 1 . 2]" 1 842 1 37 TRP H 1 37 TRP HB2 . . 3.770 3.533 3.508 3.597 . 0 0 "[ . 1 . 2]" 1 843 1 37 TRP H 1 37 TRP HB3 . . 3.770 3.207 3.053 3.444 . 0 0 "[ . 1 . 2]" 1 844 1 37 TRP H 1 37 TRP HD1 . . 3.790 3.369 3.122 3.791 0.001 15 0 "[ . 1 . 2]" 1 845 1 37 TRP H 1 37 TRP HE3 . . 4.420 3.605 3.328 3.815 . 0 0 "[ . 1 . 2]" 1 846 1 37 TRP H 1 37 TRP HZ3 . . 5.500 5.199 4.881 5.428 . 0 0 "[ . 1 . 2]" 1 847 1 37 TRP HA 1 37 TRP HD1 . . 4.660 4.362 4.291 4.453 . 0 0 "[ . 1 . 2]" 1 848 1 37 TRP QB 1 37 TRP HD1 . . 3.390 2.518 2.506 2.537 . 0 0 "[ . 1 . 2]" 1 849 1 37 TRP QB 1 37 TRP HE3 . . 3.620 2.785 2.714 2.840 . 0 0 "[ . 1 . 2]" 1 850 1 37 TRP HB2 1 37 TRP HD1 . . 3.880 3.682 3.648 3.724 . 0 0 "[ . 1 . 2]" 1 851 1 37 TRP HB3 1 37 TRP HD1 . . 3.880 2.564 2.553 2.582 . 0 0 "[ . 1 . 2]" 1 852 1 37 TRP HE1 1 68 GLY HA2 . . 4.600 3.564 3.279 3.972 . 0 0 "[ . 1 . 2]" 1 853 1 37 TRP HE1 1 68 GLY QA . . 4.010 3.056 2.894 3.333 . 0 0 "[ . 1 . 2]" 1 854 1 37 TRP HE1 1 68 GLY HA3 . . 4.600 3.338 3.099 3.632 . 0 0 "[ . 1 . 2]" 1 855 1 37 TRP HE1 1 88 LEU MD1 . . 5.500 5.497 5.456 5.536 0.036 18 0 "[ . 1 . 2]" 1 856 1 37 TRP HE3 1 38 SER H . . 4.540 3.436 3.016 3.749 . 0 0 "[ . 1 . 2]" 1 857 1 37 TRP HH2 1 68 GLY HA2 . . 4.580 3.548 3.382 3.753 . 0 0 "[ . 1 . 2]" 1 858 1 37 TRP HH2 1 68 GLY HA3 . . 4.580 4.321 4.005 4.550 . 0 0 "[ . 1 . 2]" 1 859 1 37 TRP HH2 1 81 THR MG . . 4.460 3.271 2.450 3.914 . 0 0 "[ . 1 . 2]" 1 860 1 37 TRP HH2 1 85 THR MG . . 5.090 4.530 3.806 4.928 . 0 0 "[ . 1 . 2]" 1 861 1 37 TRP HH2 1 88 LEU MD1 . . 3.740 1.877 1.805 2.049 . 0 0 "[ . 1 . 2]" 1 862 1 37 TRP HZ2 1 68 GLY QA . . 4.720 2.004 1.927 2.160 . 0 0 "[ . 1 . 2]" 1 863 1 37 TRP HZ2 1 81 THR HA . . 4.620 3.786 3.042 4.625 0.005 11 0 "[ . 1 . 2]" 1 864 1 37 TRP HZ2 1 81 THR MG . . 4.230 3.141 2.058 3.829 . 0 0 "[ . 1 . 2]" 1 865 1 37 TRP HZ2 1 88 LEU MD1 . . 3.990 3.544 3.425 3.707 . 0 0 "[ . 1 . 2]" 1 866 1 37 TRP HZ3 1 68 GLY HA2 . . 5.500 5.398 5.101 5.513 0.013 20 0 "[ . 1 . 2]" 1 867 1 37 TRP HZ3 1 68 GLY HA3 . . 5.500 5.477 5.364 5.517 0.017 18 0 "[ . 1 . 2]" 1 868 1 37 TRP HZ3 1 85 THR MG . . 5.430 4.663 4.087 5.244 . 0 0 "[ . 1 . 2]" 1 869 1 37 TRP HZ3 1 88 LEU MD1 . . 4.440 2.115 1.926 2.460 . 0 0 "[ . 1 . 2]" 1 870 1 38 SER H 1 38 SER HB2 . . 3.760 2.940 2.216 3.674 . 0 0 "[ . 1 . 2]" 1 871 1 38 SER H 1 38 SER QB . . 3.190 2.429 2.193 2.769 . 0 0 "[ . 1 . 2]" 1 872 1 38 SER H 1 38 SER HB3 . . 3.760 2.781 2.360 3.553 . 0 0 "[ . 1 . 2]" 1 873 1 38 SER H 1 41 CYS H . . 5.500 5.312 5.104 5.451 . 0 0 "[ . 1 . 2]" 1 874 1 38 SER H 1 41 CYS QB . . 4.920 4.450 4.125 4.896 . 0 0 "[ . 1 . 2]" 1 875 1 38 SER H 1 88 LEU MD1 . . 5.500 5.046 4.410 5.440 . 0 0 "[ . 1 . 2]" 1 876 1 38 SER QB 1 41 CYS H . . 4.900 3.247 2.552 3.835 . 0 0 "[ . 1 . 2]" 1 877 1 38 SER QB 1 88 LEU MD1 . . 4.030 3.063 2.577 3.764 . 0 0 "[ . 1 . 2]" 1 878 1 38 SER HB2 1 88 LEU MD1 . . 4.690 3.398 2.664 4.349 . 0 0 "[ . 1 . 2]" 1 879 1 38 SER HB3 1 88 LEU MD1 . . 4.690 3.964 2.634 4.644 . 0 0 "[ . 1 . 2]" 1 880 1 39 ASN HA 1 42 GLN H . . 3.880 3.297 3.124 3.483 . 0 0 "[ . 1 . 2]" 1 881 1 39 ASN HA 1 42 GLN QB . . 3.540 3.255 2.872 3.545 0.005 12 0 "[ . 1 . 2]" 1 882 1 39 ASN HA 1 42 GLN HE21 . . 4.920 3.204 2.232 4.845 . 0 0 "[ . 1 . 2]" 1 883 1 39 ASN HA 1 42 GLN QE . . 4.220 3.088 2.212 4.168 . 0 0 "[ . 1 . 2]" 1 884 1 39 ASN HA 1 42 GLN HE22 . . 4.920 4.378 3.610 4.813 . 0 0 "[ . 1 . 2]" 1 885 1 39 ASN HA 1 42 GLN QG . . 4.070 3.308 1.960 4.078 0.008 2 0 "[ . 1 . 2]" 1 886 1 39 ASN QB 1 42 GLN H . . 4.890 4.511 4.342 4.862 . 0 0 "[ . 1 . 2]" 1 887 1 40 ASP HA 1 42 GLN H . . 5.230 4.222 3.762 4.630 . 0 0 "[ . 1 . 2]" 1 888 1 40 ASP HA 1 43 SER H . . 3.980 3.749 3.608 3.991 0.011 17 0 "[ . 1 . 2]" 1 889 1 40 ASP HA 1 43 SER QB . . 3.840 3.509 3.068 3.777 . 0 0 "[ . 1 . 2]" 1 890 1 40 ASP QB 1 41 CYS H . . 3.970 2.933 2.595 3.457 . 0 0 "[ . 1 . 2]" 1 891 1 41 CYS H 1 41 CYS HB2 . . 3.890 2.834 2.426 3.569 . 0 0 "[ . 1 . 2]" 1 892 1 41 CYS H 1 41 CYS QB . . 3.310 2.278 2.223 2.451 . 0 0 "[ . 1 . 2]" 1 893 1 41 CYS H 1 41 CYS HB3 . . 3.890 2.546 2.247 3.609 . 0 0 "[ . 1 . 2]" 1 894 1 41 CYS H 1 42 GLN H . . 3.500 2.616 2.283 2.812 . 0 0 "[ . 1 . 2]" 1 895 1 41 CYS H 1 42 GLN QB . . 4.670 4.545 4.347 4.701 0.031 18 0 "[ . 1 . 2]" 1 896 1 41 CYS H 1 43 SER H . . 4.850 4.259 3.786 4.865 0.015 17 0 "[ . 1 . 2]" 1 897 1 41 CYS H 1 89 PRO HD3 . . 4.370 3.495 2.555 4.043 . 0 0 "[ . 1 . 2]" 1 898 1 41 CYS HA 1 44 PHE QB . . 3.740 2.982 2.057 3.478 . 0 0 "[ . 1 . 2]" 1 899 1 41 CYS HA 1 89 PRO HD2 . . 4.680 4.382 3.955 4.658 . 0 0 "[ . 1 . 2]" 1 900 1 41 CYS HA 1 89 PRO HD3 . . 3.880 3.017 2.738 3.351 . 0 0 "[ . 1 . 2]" 1 901 1 41 CYS HA 1 89 PRO QG . . 4.100 2.808 2.407 3.265 . 0 0 "[ . 1 . 2]" 1 902 1 41 CYS QB 1 42 GLN H . . 3.690 2.857 2.486 3.633 . 0 0 "[ . 1 . 2]" 1 903 1 41 CYS HB2 1 42 GLN H . . 4.230 3.844 2.798 4.231 0.001 12 0 "[ . 1 . 2]" 1 904 1 41 CYS HB3 1 42 GLN H . . 4.230 3.072 2.516 4.085 . 0 0 "[ . 1 . 2]" 1 905 1 42 GLN H 1 42 GLN HB2 . . 3.840 3.135 2.255 3.523 . 0 0 "[ . 1 . 2]" 1 906 1 42 GLN H 1 42 GLN QB . . 3.170 2.316 2.158 2.677 . 0 0 "[ . 1 . 2]" 1 907 1 42 GLN H 1 42 GLN HB3 . . 3.840 2.748 2.179 3.594 . 0 0 "[ . 1 . 2]" 1 908 1 42 GLN H 1 42 GLN QG . . 3.360 2.614 2.005 3.379 0.019 17 0 "[ . 1 . 2]" 1 909 1 42 GLN HA 1 42 GLN HG2 . . 3.840 3.352 2.375 3.874 0.034 20 0 "[ . 1 . 2]" 1 910 1 42 GLN HA 1 42 GLN QG . . 3.310 2.972 2.333 3.299 . 0 0 "[ . 1 . 2]" 1 911 1 42 GLN HA 1 42 GLN HG3 . . 3.840 3.535 2.822 3.842 0.002 8 0 "[ . 1 . 2]" 1 912 1 42 GLN HA 1 45 ALA H . . 4.050 3.338 3.107 3.626 . 0 0 "[ . 1 . 2]" 1 913 1 42 GLN HA 1 45 ALA MB . . 3.660 2.331 2.014 2.796 . 0 0 "[ . 1 . 2]" 1 914 1 42 GLN QB 1 43 SER H . . 3.540 3.111 2.163 3.541 0.001 20 0 "[ . 1 . 2]" 1 915 1 42 GLN QB 1 45 ALA MB . . 4.270 3.706 3.424 4.282 0.012 17 0 "[ . 1 . 2]" 1 916 1 42 GLN HB2 1 43 SER H . . 4.210 3.525 2.197 4.207 . 0 0 "[ . 1 . 2]" 1 917 1 42 GLN HB2 1 43 SER HA . . 5.500 4.699 4.187 5.016 . 0 0 "[ . 1 . 2]" 1 918 1 42 GLN HB3 1 43 SER H . . 4.210 3.698 2.626 4.131 . 0 0 "[ . 1 . 2]" 1 919 1 42 GLN HB3 1 43 SER HA . . 5.500 5.096 3.886 5.555 0.055 20 0 "[ . 1 . 2]" 1 920 1 42 GLN QG 1 43 SER H . . 3.980 2.968 2.155 4.130 0.150 17 0 "[ . 1 . 2]" 1 921 1 42 GLN QG 1 45 ALA MB . . 5.200 4.258 3.827 4.858 . 0 0 "[ . 1 . 2]" 1 922 1 42 GLN HG2 1 43 SER H . . 4.630 3.306 2.217 4.676 0.046 18 0 "[ . 1 . 2]" 1 923 1 42 GLN HG3 1 43 SER H . . 4.630 3.495 2.728 4.698 0.068 17 0 "[ . 1 . 2]" 1 924 1 43 SER H 1 43 SER QB . . 3.130 2.248 2.165 2.428 . 0 0 "[ . 1 . 2]" 1 925 1 43 SER H 1 44 PHE H . . 3.480 2.550 2.260 2.736 . 0 0 "[ . 1 . 2]" 1 926 1 43 SER H 1 45 ALA H . . 4.660 3.834 3.654 4.233 . 0 0 "[ . 1 . 2]" 1 927 1 43 SER HA 1 45 ALA H . . 4.630 4.024 3.742 4.433 . 0 0 "[ . 1 . 2]" 1 928 1 43 SER HA 1 46 PRO QD . . 4.180 3.642 3.395 3.853 . 0 0 "[ . 1 . 2]" 1 929 1 43 SER HA 1 46 PRO QG . . 4.670 4.151 3.566 4.532 . 0 0 "[ . 1 . 2]" 1 930 1 43 SER QB 1 44 PHE H . . 3.460 2.868 2.383 3.476 0.016 18 0 "[ . 1 . 2]" 1 931 1 43 SER QB 1 44 PHE QB . . 5.080 3.765 3.482 4.370 . 0 0 "[ . 1 . 2]" 1 932 1 44 PHE H 1 44 PHE HB2 . . 3.380 2.608 2.457 2.926 . 0 0 "[ . 1 . 2]" 1 933 1 44 PHE H 1 44 PHE HB3 . . 3.380 2.731 2.638 2.822 . 0 0 "[ . 1 . 2]" 1 934 1 44 PHE H 1 45 ALA H . . 3.280 2.301 2.123 2.612 . 0 0 "[ . 1 . 2]" 1 935 1 44 PHE H 1 45 ALA MB . . 4.200 3.861 3.616 4.110 . 0 0 "[ . 1 . 2]" 1 936 1 44 PHE H 1 89 PRO QG . . 5.030 4.691 3.987 5.028 . 0 0 "[ . 1 . 2]" 1 937 1 44 PHE QB 1 45 ALA H . . 3.840 3.268 2.768 3.621 . 0 0 "[ . 1 . 2]" 1 938 1 44 PHE QB 1 45 ALA MB . . 5.340 4.509 4.226 4.683 . 0 0 "[ . 1 . 2]" 1 939 1 44 PHE QB 1 89 PRO QG . . 4.080 2.943 2.554 3.124 . 0 0 "[ . 1 . 2]" 1 940 1 44 PHE HB2 1 45 ALA H . . 4.620 4.137 3.754 4.416 . 0 0 "[ . 1 . 2]" 1 941 1 44 PHE HB3 1 45 ALA H . . 4.620 3.429 2.849 3.851 . 0 0 "[ . 1 . 2]" 1 942 1 44 PHE QD 1 47 ILE HB . . 4.110 2.945 2.576 3.224 . 0 0 "[ . 1 . 2]" 1 943 1 44 PHE QD 1 47 ILE MD . . 3.570 2.277 1.961 2.739 . 0 0 "[ . 1 . 2]" 1 944 1 44 PHE QD 1 47 ILE MG . . 4.120 2.940 2.506 3.165 . 0 0 "[ . 1 . 2]" 1 945 1 44 PHE QD 1 89 PRO QG . . 5.340 3.844 3.151 4.215 . 0 0 "[ . 1 . 2]" 1 946 1 44 PHE QD 1 117 PHE QB . . 3.850 2.957 2.328 3.685 . 0 0 "[ . 1 . 2]" 1 947 1 44 PHE QD 1 117 PHE QD . . 4.320 3.735 3.045 4.243 . 0 0 "[ . 1 . 2]" 1 948 1 44 PHE QE 1 47 ILE HB . . 3.940 3.634 3.391 3.942 0.002 17 0 "[ . 1 . 2]" 1 949 1 44 PHE QE 1 47 ILE MD . . 4.440 3.364 2.904 3.879 . 0 0 "[ . 1 . 2]" 1 950 1 44 PHE QE 1 47 ILE MG . . 3.520 2.250 1.867 2.769 . 0 0 "[ . 1 . 2]" 1 951 1 44 PHE QE 1 48 TYR H . . 4.540 4.178 3.869 4.531 . 0 0 "[ . 1 . 2]" 1 952 1 44 PHE QE 1 48 TYR HA . . 4.740 3.361 2.868 3.975 . 0 0 "[ . 1 . 2]" 1 953 1 44 PHE QE 1 48 TYR HB2 . . 4.500 2.577 2.052 2.857 . 0 0 "[ . 1 . 2]" 1 954 1 44 PHE QE 1 48 TYR QB . . 3.680 2.552 2.042 2.823 . 0 0 "[ . 1 . 2]" 1 955 1 44 PHE QE 1 48 TYR HB3 . . 4.500 4.134 3.668 4.396 . 0 0 "[ . 1 . 2]" 1 956 1 44 PHE QE 1 51 LEU MD1 . . 3.890 3.314 2.931 3.772 . 0 0 "[ . 1 . 2]" 1 957 1 44 PHE QE 1 91 LEU MD1 . . 3.830 2.995 2.607 3.357 . 0 0 "[ . 1 . 2]" 1 958 1 44 PHE QE 1 91 LEU MD2 . . 3.930 3.265 2.861 3.672 . 0 0 "[ . 1 . 2]" 1 959 1 44 PHE QE 1 117 PHE QB . . 4.310 3.655 3.025 4.230 . 0 0 "[ . 1 . 2]" 1 960 1 44 PHE QE 1 117 PHE QD . . 4.060 3.587 2.672 4.049 . 0 0 "[ . 1 . 2]" 1 961 1 44 PHE QE 1 119 GLU HA . . 4.880 3.945 3.472 4.803 . 0 0 "[ . 1 . 2]" 1 962 1 44 PHE QE 1 122 VAL MG1 . . 4.310 4.122 3.831 4.311 0.001 18 0 "[ . 1 . 2]" 1 963 1 44 PHE QE 1 122 VAL MG2 . . 3.510 2.637 2.036 2.985 . 0 0 "[ . 1 . 2]" 1 964 1 44 PHE HZ 1 47 ILE MG . . 4.020 3.201 2.746 4.023 0.003 17 0 "[ . 1 . 2]" 1 965 1 44 PHE HZ 1 48 TYR HA . . 4.590 3.817 3.432 4.150 . 0 0 "[ . 1 . 2]" 1 966 1 44 PHE HZ 1 51 LEU MD1 . . 4.230 2.818 2.356 3.707 . 0 0 "[ . 1 . 2]" 1 967 1 44 PHE HZ 1 91 LEU MD1 . . 3.610 2.801 2.000 3.327 . 0 0 "[ . 1 . 2]" 1 968 1 44 PHE HZ 1 91 LEU MD2 . . 4.930 4.207 3.097 4.728 . 0 0 "[ . 1 . 2]" 1 969 1 44 PHE HZ 1 117 PHE QD . . 4.690 4.241 3.394 4.694 0.004 2 0 "[ . 1 . 2]" 1 970 1 44 PHE HZ 1 122 VAL MG1 . . 4.420 3.277 2.824 3.870 . 0 0 "[ . 1 . 2]" 1 971 1 44 PHE HZ 1 122 VAL MG2 . . 3.520 2.677 2.069 3.362 . 0 0 "[ . 1 . 2]" 1 972 1 45 ALA H 1 45 ALA MB . . 3.010 2.066 2.024 2.190 . 0 0 "[ . 1 . 2]" 1 973 1 45 ALA H 1 46 PRO HD2 . . 3.720 2.233 1.941 2.465 . 0 0 "[ . 1 . 2]" 1 974 1 45 ALA H 1 46 PRO QD . . 3.030 2.197 1.919 2.416 . 0 0 "[ . 1 . 2]" 1 975 1 45 ALA H 1 46 PRO HD3 . . 3.720 3.271 3.017 3.467 . 0 0 "[ . 1 . 2]" 1 976 1 45 ALA H 1 46 PRO QG . . 4.660 4.120 3.861 4.327 . 0 0 "[ . 1 . 2]" 1 977 1 45 ALA HA 1 48 TYR QB . . 4.270 3.606 3.447 3.789 . 0 0 "[ . 1 . 2]" 1 978 1 45 ALA HA 1 49 ALA MB . . 5.500 5.019 4.661 5.471 . 0 0 "[ . 1 . 2]" 1 979 1 45 ALA MB 1 46 PRO HA . . 4.190 3.719 3.711 3.766 . 0 0 "[ . 1 . 2]" 1 980 1 45 ALA MB 1 46 PRO HB3 . . 4.400 3.986 3.964 4.066 . 0 0 "[ . 1 . 2]" 1 981 1 45 ALA MB 1 46 PRO HD2 . . 3.520 2.515 2.382 2.586 . 0 0 "[ . 1 . 2]" 1 982 1 45 ALA MB 1 46 PRO QD . . 2.880 1.860 1.830 1.891 . 0 0 "[ . 1 . 2]" 1 983 1 45 ALA MB 1 46 PRO HD3 . . 3.520 1.917 1.895 1.963 . 0 0 "[ . 1 . 2]" 1 984 1 45 ALA MB 1 46 PRO QG . . 3.920 3.579 3.533 3.602 . 0 0 "[ . 1 . 2]" 1 985 1 45 ALA MB 1 47 ILE H . . 4.860 4.335 4.180 4.478 . 0 0 "[ . 1 . 2]" 1 986 1 45 ALA MB 1 48 TYR H . . 5.140 4.950 4.717 5.171 0.031 16 0 "[ . 1 . 2]" 1 987 1 46 PRO HA 1 49 ALA H . . 3.980 3.462 3.211 3.773 . 0 0 "[ . 1 . 2]" 1 988 1 46 PRO HA 1 49 ALA MB . . 3.240 2.505 2.237 2.900 . 0 0 "[ . 1 . 2]" 1 989 1 46 PRO HB2 1 47 ILE QG . . 5.130 3.842 3.738 3.965 . 0 0 "[ . 1 . 2]" 1 990 1 46 PRO HB2 1 49 ALA MB . . 4.650 4.441 4.217 4.623 . 0 0 "[ . 1 . 2]" 1 991 1 46 PRO HB3 1 47 ILE H . . 4.270 4.024 3.881 4.191 . 0 0 "[ . 1 . 2]" 1 992 1 46 PRO HB3 1 49 ALA MB . . 4.730 4.400 4.156 4.588 . 0 0 "[ . 1 . 2]" 1 993 1 46 PRO QD 1 47 ILE H . . 3.710 2.638 2.602 2.707 . 0 0 "[ . 1 . 2]" 1 994 1 46 PRO HD2 1 47 ILE H . . 4.380 2.686 2.647 2.764 . 0 0 "[ . 1 . 2]" 1 995 1 46 PRO HD3 1 47 ILE H . . 4.380 3.849 3.836 3.878 . 0 0 "[ . 1 . 2]" 1 996 1 46 PRO QG 1 47 ILE H . . 3.730 2.137 1.900 2.456 . 0 0 "[ . 1 . 2]" 1 997 1 47 ILE H 1 47 ILE HB . . 3.200 2.549 2.457 2.661 . 0 0 "[ . 1 . 2]" 1 998 1 47 ILE H 1 47 ILE HG12 . . 3.810 3.381 3.161 3.624 . 0 0 "[ . 1 . 2]" 1 999 1 47 ILE H 1 47 ILE QG . . 3.260 2.064 1.913 2.221 . 0 0 "[ . 1 . 2]" 1 1000 1 47 ILE H 1 47 ILE HG13 . . 3.810 2.082 1.929 2.242 . 0 0 "[ . 1 . 2]" 1 1001 1 47 ILE H 1 47 ILE MG . . 3.970 3.763 3.751 3.771 . 0 0 "[ . 1 . 2]" 1 1002 1 47 ILE H 1 48 TYR H . . 3.390 2.826 2.590 3.046 . 0 0 "[ . 1 . 2]" 1 1003 1 47 ILE H 1 49 ALA H . . 4.440 4.199 4.022 4.381 . 0 0 "[ . 1 . 2]" 1 1004 1 47 ILE HA 1 47 ILE HG12 . . 3.700 2.543 2.436 2.640 . 0 0 "[ . 1 . 2]" 1 1005 1 47 ILE HA 1 47 ILE QG . . 3.210 2.396 2.354 2.432 . 0 0 "[ . 1 . 2]" 1 1006 1 47 ILE HA 1 47 ILE HG13 . . 3.700 2.942 2.759 3.120 . 0 0 "[ . 1 . 2]" 1 1007 1 47 ILE HA 1 47 ILE MG . . 3.200 2.387 2.307 2.469 . 0 0 "[ . 1 . 2]" 1 1008 1 47 ILE HA 1 50 ASP H . . 4.120 3.735 3.562 3.998 . 0 0 "[ . 1 . 2]" 1 1009 1 47 ILE HA 1 50 ASP QB . . 3.570 3.096 2.822 3.360 . 0 0 "[ . 1 . 2]" 1 1010 1 47 ILE HB 1 47 ILE MD . . 3.000 2.374 2.193 2.482 . 0 0 "[ . 1 . 2]" 1 1011 1 47 ILE HB 1 48 TYR H . . 3.540 2.523 2.200 2.977 . 0 0 "[ . 1 . 2]" 1 1012 1 47 ILE MD 1 47 ILE MG . . 2.950 2.008 1.901 2.250 . 0 0 "[ . 1 . 2]" 1 1013 1 47 ILE MD 1 118 SER HA . . 3.280 3.058 2.643 3.286 0.006 2 0 "[ . 1 . 2]" 1 1014 1 47 ILE MD 1 119 GLU H . . 4.140 3.644 3.242 4.100 . 0 0 "[ . 1 . 2]" 1 1015 1 47 ILE MD 1 119 GLU HA . . 5.150 4.812 4.154 5.129 . 0 0 "[ . 1 . 2]" 1 1016 1 47 ILE MD 1 119 GLU QB . . 4.320 3.999 3.590 4.316 . 0 0 "[ . 1 . 2]" 1 1017 1 47 ILE QG 1 47 ILE MG . . 3.150 2.282 2.184 2.347 . 0 0 "[ . 1 . 2]" 1 1018 1 47 ILE QG 1 48 TYR H . . 4.440 4.016 3.866 4.178 . 0 0 "[ . 1 . 2]" 1 1019 1 47 ILE HG12 1 47 ILE MG . . 3.690 2.338 2.225 2.414 . 0 0 "[ . 1 . 2]" 1 1020 1 47 ILE HG13 1 47 ILE MG . . 3.690 3.190 3.178 3.200 . 0 0 "[ . 1 . 2]" 1 1021 1 47 ILE MG 1 48 TYR H . . 4.100 3.325 2.971 3.699 . 0 0 "[ . 1 . 2]" 1 1022 1 47 ILE MG 1 48 TYR HA . . 4.330 3.419 3.185 3.653 . 0 0 "[ . 1 . 2]" 1 1023 1 47 ILE MG 1 51 LEU H . . 4.690 4.017 3.642 4.408 . 0 0 "[ . 1 . 2]" 1 1024 1 47 ILE MG 1 51 LEU MD1 . . 3.080 2.267 1.999 2.633 . 0 0 "[ . 1 . 2]" 1 1025 1 47 ILE MG 1 51 LEU HG . . 3.650 3.327 2.993 3.621 . 0 0 "[ . 1 . 2]" 1 1026 1 47 ILE MG 1 119 GLU H . . 3.990 3.183 2.725 3.836 . 0 0 "[ . 1 . 2]" 1 1027 1 47 ILE MG 1 119 GLU HA . . 3.430 3.063 2.609 3.435 0.005 16 0 "[ . 1 . 2]" 1 1028 1 47 ILE MG 1 119 GLU QB . . 3.220 2.618 2.136 3.228 0.008 16 0 "[ . 1 . 2]" 1 1029 1 47 ILE MG 1 119 GLU QG . . 3.530 2.970 1.821 3.518 . 0 0 "[ . 1 . 2]" 1 1030 1 48 TYR H 1 48 TYR HB2 . . 3.550 2.402 2.290 2.555 . 0 0 "[ . 1 . 2]" 1 1031 1 48 TYR H 1 48 TYR QB . . 3.090 2.237 2.193 2.293 . 0 0 "[ . 1 . 2]" 1 1032 1 48 TYR H 1 48 TYR HB3 . . 3.550 2.689 2.557 2.802 . 0 0 "[ . 1 . 2]" 1 1033 1 48 TYR H 1 48 TYR QD . . 4.350 4.126 4.043 4.206 . 0 0 "[ . 1 . 2]" 1 1034 1 48 TYR H 1 49 ALA H . . 3.680 2.657 2.386 2.860 . 0 0 "[ . 1 . 2]" 1 1035 1 48 TYR H 1 49 ALA MB . . 4.420 4.257 4.067 4.405 . 0 0 "[ . 1 . 2]" 1 1036 1 48 TYR HA 1 48 TYR QD . . 3.260 2.119 1.999 2.341 . 0 0 "[ . 1 . 2]" 1 1037 1 48 TYR HA 1 48 TYR QE . . 4.560 4.299 4.225 4.429 . 0 0 "[ . 1 . 2]" 1 1038 1 48 TYR HA 1 49 ALA MB . . 5.500 5.011 4.993 5.032 . 0 0 "[ . 1 . 2]" 1 1039 1 48 TYR HA 1 51 LEU H . . 4.000 3.636 3.462 3.916 . 0 0 "[ . 1 . 2]" 1 1040 1 48 TYR HA 1 51 LEU HB2 . . 4.020 2.681 2.508 2.844 . 0 0 "[ . 1 . 2]" 1 1041 1 48 TYR HA 1 51 LEU HB3 . . 4.430 4.181 4.022 4.428 . 0 0 "[ . 1 . 2]" 1 1042 1 48 TYR HA 1 51 LEU MD1 . . 3.470 2.757 2.440 3.097 . 0 0 "[ . 1 . 2]" 1 1043 1 48 TYR HA 1 51 LEU HG . . 4.650 4.508 4.220 4.650 . 12 0 "[ . 1 . 2]" 1 1044 1 48 TYR HA 1 52 SER H . . 4.980 3.828 3.584 4.073 . 0 0 "[ . 1 . 2]" 1 1045 1 48 TYR QB 1 49 ALA MB . . 4.550 3.867 3.769 3.976 . 0 0 "[ . 1 . 2]" 1 1046 1 48 TYR HB2 1 49 ALA H . . 4.010 3.767 3.627 3.891 . 0 0 "[ . 1 . 2]" 1 1047 1 48 TYR HB2 1 49 ALA MB . . 5.350 5.240 5.121 5.350 . 0 0 "[ . 1 . 2]" 1 1048 1 48 TYR HB3 1 49 ALA H . . 4.010 2.597 2.325 2.730 . 0 0 "[ . 1 . 2]" 1 1049 1 48 TYR HB3 1 49 ALA MB . . 5.350 3.982 3.879 4.100 . 0 0 "[ . 1 . 2]" 1 1050 1 48 TYR QD 1 49 ALA H . . 4.390 4.177 3.796 4.361 . 0 0 "[ . 1 . 2]" 1 1051 1 48 TYR QD 1 51 LEU MD1 . . 4.010 3.209 2.808 3.675 . 0 0 "[ . 1 . 2]" 1 1052 1 48 TYR QD 1 64 LYS QD . . 3.840 2.579 1.988 3.899 0.059 17 0 "[ . 1 . 2]" 1 1053 1 48 TYR QD 1 91 LEU MD1 . . 4.000 3.733 3.245 3.998 . 0 0 "[ . 1 . 2]" 1 1054 1 48 TYR QD 1 91 LEU MD2 . . 4.350 3.550 3.251 3.835 . 0 0 "[ . 1 . 2]" 1 1055 1 48 TYR QE 1 48 TYR HH . . 3.230 2.371 2.194 2.626 . 0 0 "[ . 1 . 2]" 1 1056 1 48 TYR QE 1 62 PHE HA . . 5.500 4.829 4.435 5.111 . 0 0 "[ . 1 . 2]" 1 1057 1 48 TYR QE 1 62 PHE HB2 . . 5.260 4.937 4.496 5.261 0.001 10 0 "[ . 1 . 2]" 1 1058 1 48 TYR QE 1 62 PHE QD . . 3.770 2.557 2.131 2.891 . 0 0 "[ . 1 . 2]" 1 1059 1 48 TYR QE 1 63 GLY H . . 4.670 4.225 3.887 4.644 . 0 0 "[ . 1 . 2]" 1 1060 1 48 TYR QE 1 64 LYS HA . . 4.710 3.917 3.312 4.592 . 0 0 "[ . 1 . 2]" 1 1061 1 48 TYR QE 1 64 LYS HB2 . . 4.950 3.191 2.021 4.396 . 0 0 "[ . 1 . 2]" 1 1062 1 48 TYR QE 1 64 LYS QB . . 4.150 3.079 2.012 4.093 . 0 0 "[ . 1 . 2]" 1 1063 1 48 TYR QE 1 64 LYS HB3 . . 4.950 4.434 3.680 4.954 0.004 6 0 "[ . 1 . 2]" 1 1064 1 48 TYR QE 1 64 LYS QD . . 4.080 2.826 2.102 4.078 . 0 0 "[ . 1 . 2]" 1 1065 1 48 TYR QE 1 64 LYS HG2 . . 4.470 3.939 2.590 4.477 0.007 12 0 "[ . 1 . 2]" 1 1066 1 48 TYR QE 1 64 LYS QG . . 3.730 2.596 1.996 3.290 . 0 0 "[ . 1 . 2]" 1 1067 1 48 TYR QE 1 64 LYS HG3 . . 4.470 2.639 2.007 3.386 . 0 0 "[ . 1 . 2]" 1 1068 1 48 TYR QE 1 91 LEU MD1 . . 4.240 3.591 3.224 4.029 . 0 0 "[ . 1 . 2]" 1 1069 1 48 TYR QE 1 91 LEU MD2 . . 3.500 2.612 2.315 2.964 . 0 0 "[ . 1 . 2]" 1 1070 1 48 TYR HH 1 62 PHE HA . . 4.170 3.643 3.091 4.114 . 0 0 "[ . 1 . 2]" 1 1071 1 48 TYR HH 1 62 PHE QD . . 4.550 2.994 2.445 3.465 . 0 0 "[ . 1 . 2]" 1 1072 1 48 TYR HH 1 63 GLY H . . 3.840 2.755 2.201 3.587 . 0 0 "[ . 1 . 2]" 1 1073 1 48 TYR HH 1 91 LEU MD2 . . 4.800 3.911 2.689 4.554 . 0 0 "[ . 1 . 2]" 1 1074 1 49 ALA H 1 49 ALA MB . . 3.050 2.142 2.024 2.232 . 0 0 "[ . 1 . 2]" 1 1075 1 49 ALA H 1 53 LEU MD1 . . 5.500 5.367 5.082 5.499 . 0 0 "[ . 1 . 2]" 1 1076 1 49 ALA HA 1 52 SER QB . . 4.410 3.680 3.187 4.050 . 0 0 "[ . 1 . 2]" 1 1077 1 49 ALA HA 1 52 SER HG . . 2.600 2.443 2.017 2.600 0.000 16 0 "[ . 1 . 2]" 1 1078 1 49 ALA HA 1 53 LEU HG . . 5.180 4.056 3.693 4.569 . 0 0 "[ . 1 . 2]" 1 1079 1 49 ALA MB 1 50 ASP H . . 3.520 2.481 2.356 2.584 . 0 0 "[ . 1 . 2]" 1 1080 1 49 ALA MB 1 50 ASP QB . . 4.620 4.040 3.717 4.451 . 0 0 "[ . 1 . 2]" 1 1081 1 49 ALA MB 1 52 SER HG . . 4.490 3.878 3.623 4.125 . 0 0 "[ . 1 . 2]" 1 1082 1 49 ALA MB 1 53 LEU H . . 4.710 4.602 4.361 4.700 . 0 0 "[ . 1 . 2]" 1 1083 1 49 ALA MB 1 53 LEU QB . . 5.340 4.779 4.406 4.992 . 0 0 "[ . 1 . 2]" 1 1084 1 49 ALA MB 1 53 LEU MD1 . . 3.120 2.767 2.425 3.000 . 0 0 "[ . 1 . 2]" 1 1085 1 50 ASP H 1 50 ASP HB2 . . 3.710 2.415 2.209 2.912 . 0 0 "[ . 1 . 2]" 1 1086 1 50 ASP H 1 50 ASP QB . . 3.120 2.301 2.147 2.678 . 0 0 "[ . 1 . 2]" 1 1087 1 50 ASP H 1 50 ASP HB3 . . 3.710 3.179 2.214 3.594 . 0 0 "[ . 1 . 2]" 1 1088 1 50 ASP H 1 51 LEU H . . 3.610 2.792 2.676 2.912 . 0 0 "[ . 1 . 2]" 1 1089 1 50 ASP H 1 51 LEU HB2 . . 4.730 4.652 4.529 4.727 . 0 0 "[ . 1 . 2]" 1 1090 1 50 ASP HA 1 53 LEU H . . 4.160 4.024 3.750 4.160 0.000 6 0 "[ . 1 . 2]" 1 1091 1 50 ASP HA 1 53 LEU HB2 . . 4.790 3.063 2.825 3.210 . 0 0 "[ . 1 . 2]" 1 1092 1 50 ASP HA 1 53 LEU QB . . 3.930 3.022 2.787 3.163 . 0 0 "[ . 1 . 2]" 1 1093 1 50 ASP HA 1 53 LEU HB3 . . 4.790 4.634 4.247 4.788 . 0 0 "[ . 1 . 2]" 1 1094 1 50 ASP HA 1 53 LEU MD1 . . 3.630 2.553 2.284 2.983 . 0 0 "[ . 1 . 2]" 1 1095 1 50 ASP HA 1 53 LEU MD2 . . 5.320 5.002 4.838 5.161 . 0 0 "[ . 1 . 2]" 1 1096 1 50 ASP HA 1 53 LEU HG . . 4.830 4.276 3.932 4.684 . 0 0 "[ . 1 . 2]" 1 1097 1 50 ASP HA 1 54 LYS H . . 4.840 4.361 4.028 4.737 . 0 0 "[ . 1 . 2]" 1 1098 1 50 ASP QB 1 51 LEU H . . 3.480 2.431 2.260 2.629 . 0 0 "[ . 1 . 2]" 1 1099 1 50 ASP QB 1 51 LEU HA . . 5.340 3.898 3.769 4.393 . 0 0 "[ . 1 . 2]" 1 1100 1 50 ASP HB2 1 51 LEU H . . 3.970 3.029 2.373 3.913 . 0 0 "[ . 1 . 2]" 1 1101 1 50 ASP HB3 1 51 LEU H . . 3.970 2.980 2.285 3.706 . 0 0 "[ . 1 . 2]" 1 1102 1 51 LEU H 1 51 LEU HB2 . . 3.240 2.221 2.161 2.303 . 0 0 "[ . 1 . 2]" 1 1103 1 51 LEU H 1 51 LEU HB3 . . 3.800 3.514 3.478 3.553 . 0 0 "[ . 1 . 2]" 1 1104 1 51 LEU H 1 51 LEU MD1 . . 3.810 3.473 3.300 3.731 . 0 0 "[ . 1 . 2]" 1 1105 1 51 LEU H 1 51 LEU MD2 . . 4.280 3.983 3.857 4.107 . 0 0 "[ . 1 . 2]" 1 1106 1 51 LEU H 1 51 LEU HG . . 3.850 2.839 2.642 3.019 . 0 0 "[ . 1 . 2]" 1 1107 1 51 LEU H 1 52 SER H . . 3.710 2.891 2.726 3.036 . 0 0 "[ . 1 . 2]" 1 1108 1 51 LEU HA 1 51 LEU MD1 . . 4.150 3.822 3.797 3.852 . 0 0 "[ . 1 . 2]" 1 1109 1 51 LEU HA 1 51 LEU MD2 . . 3.120 2.253 2.000 2.476 . 0 0 "[ . 1 . 2]" 1 1110 1 51 LEU HA 1 51 LEU HG . . 4.150 2.625 2.515 2.745 . 0 0 "[ . 1 . 2]" 1 1111 1 51 LEU HA 1 54 LYS H . . 4.480 3.677 3.450 3.864 . 0 0 "[ . 1 . 2]" 1 1112 1 51 LEU HA 1 54 LYS HB2 . . 4.390 3.187 2.654 3.936 . 0 0 "[ . 1 . 2]" 1 1113 1 51 LEU HA 1 54 LYS QB . . 3.710 2.802 2.587 2.957 . 0 0 "[ . 1 . 2]" 1 1114 1 51 LEU HA 1 54 LYS HB3 . . 4.390 3.467 2.638 4.392 0.002 12 0 "[ . 1 . 2]" 1 1115 1 51 LEU HA 1 54 LYS QD . . 4.400 3.501 2.094 4.236 . 0 0 "[ . 1 . 2]" 1 1116 1 51 LEU HA 1 54 LYS QE . . 5.500 4.260 2.202 5.444 . 0 0 "[ . 1 . 2]" 1 1117 1 51 LEU HA 1 55 TYR QD . . 3.770 3.324 2.993 3.676 . 0 0 "[ . 1 . 2]" 1 1118 1 51 LEU HA 1 55 TYR QE . . 4.620 3.772 3.417 4.093 . 0 0 "[ . 1 . 2]" 1 1119 1 51 LEU HB2 1 51 LEU MD1 . . 3.110 2.152 2.043 2.275 . 0 0 "[ . 1 . 2]" 1 1120 1 51 LEU HB2 1 52 SER H . . 4.260 2.487 2.348 2.724 . 0 0 "[ . 1 . 2]" 1 1121 1 51 LEU HB2 1 55 TYR QD . . 5.500 4.891 4.485 5.211 . 0 0 "[ . 1 . 2]" 1 1122 1 51 LEU HB2 1 62 PHE QE . . 4.430 3.737 3.224 4.340 . 0 0 "[ . 1 . 2]" 1 1123 1 51 LEU HB3 1 51 LEU MD2 . . 3.540 2.225 2.106 2.352 . 0 0 "[ . 1 . 2]" 1 1124 1 51 LEU HB3 1 52 SER H . . 4.060 2.951 2.730 3.224 . 0 0 "[ . 1 . 2]" 1 1125 1 51 LEU HB3 1 55 TYR QD . . 4.900 3.384 2.895 3.734 . 0 0 "[ . 1 . 2]" 1 1126 1 51 LEU HB3 1 62 PHE QE . . 4.340 2.933 2.440 3.494 . 0 0 "[ . 1 . 2]" 1 1127 1 51 LEU HB3 1 62 PHE HZ . . 4.470 3.561 3.133 4.044 . 0 0 "[ . 1 . 2]" 1 1128 1 51 LEU HB3 1 128 LEU MD1 . . 4.780 3.658 3.290 3.992 . 0 0 "[ . 1 . 2]" 1 1129 1 51 LEU MD1 1 52 SER H . . 4.720 4.233 4.116 4.427 . 0 0 "[ . 1 . 2]" 1 1130 1 51 LEU MD1 1 62 PHE QE . . 4.190 3.749 3.286 4.182 . 0 0 "[ . 1 . 2]" 1 1131 1 51 LEU MD1 1 119 GLU HA . . 3.480 2.339 1.948 2.646 . 0 0 "[ . 1 . 2]" 1 1132 1 51 LEU MD1 1 119 GLU HB2 . . 4.720 3.649 3.091 4.379 . 0 0 "[ . 1 . 2]" 1 1133 1 51 LEU MD1 1 119 GLU QB . . 4.020 3.449 3.014 3.885 . 0 0 "[ . 1 . 2]" 1 1134 1 51 LEU MD1 1 119 GLU HB3 . . 4.720 4.371 3.858 4.700 . 0 0 "[ . 1 . 2]" 1 1135 1 51 LEU MD1 1 122 VAL H . . 5.330 4.834 4.430 5.107 . 0 0 "[ . 1 . 2]" 1 1136 1 51 LEU MD1 1 122 VAL HB . . 3.670 2.936 2.687 3.273 . 0 0 "[ . 1 . 2]" 1 1137 1 51 LEU MD1 1 122 VAL MG1 . . 3.000 2.521 1.957 2.984 . 0 0 "[ . 1 . 2]" 1 1138 1 51 LEU MD1 1 122 VAL MG2 . . 3.550 3.116 2.831 3.450 . 0 0 "[ . 1 . 2]" 1 1139 1 51 LEU MD2 1 52 SER H . . 5.180 4.519 4.380 4.709 . 0 0 "[ . 1 . 2]" 1 1140 1 51 LEU MD2 1 54 LYS HB2 . . 4.900 4.310 3.684 4.899 . 0 0 "[ . 1 . 2]" 1 1141 1 51 LEU MD2 1 54 LYS QB . . 4.140 3.630 3.347 3.884 . 0 0 "[ . 1 . 2]" 1 1142 1 51 LEU MD2 1 54 LYS HB3 . . 4.900 4.066 3.441 4.884 . 0 0 "[ . 1 . 2]" 1 1143 1 51 LEU MD2 1 54 LYS QD . . 4.170 3.474 2.950 4.082 . 0 0 "[ . 1 . 2]" 1 1144 1 51 LEU MD2 1 55 TYR QD . . 3.430 2.952 2.574 3.395 . 0 0 "[ . 1 . 2]" 1 1145 1 51 LEU MD2 1 55 TYR QE . . 2.920 2.186 1.961 2.557 . 0 0 "[ . 1 . 2]" 1 1146 1 51 LEU MD2 1 119 GLU QB . . 4.840 3.929 3.182 4.537 . 0 0 "[ . 1 . 2]" 1 1147 1 51 LEU MD2 1 119 GLU QG . . 3.290 2.162 1.815 2.888 . 0 0 "[ . 1 . 2]" 1 1148 1 51 LEU MD2 1 122 VAL MG1 . . 3.650 3.206 2.743 3.632 . 0 0 "[ . 1 . 2]" 1 1149 1 51 LEU MD2 1 123 ILE H . . 4.650 3.965 3.500 4.352 . 0 0 "[ . 1 . 2]" 1 1150 1 51 LEU MD2 1 123 ILE HA . . 4.610 4.158 3.859 4.490 . 0 0 "[ . 1 . 2]" 1 1151 1 51 LEU MD2 1 123 ILE HG12 . . 3.770 2.558 2.226 2.875 . 0 0 "[ . 1 . 2]" 1 1152 1 51 LEU MD2 1 123 ILE HG13 . . 3.770 2.445 2.106 2.965 . 0 0 "[ . 1 . 2]" 1 1153 1 51 LEU MD2 1 128 LEU MD1 . . 3.350 2.458 2.039 3.095 . 0 0 "[ . 1 . 2]" 1 1154 1 51 LEU HG 1 55 TYR QD . . 5.500 5.187 4.896 5.469 . 0 0 "[ . 1 . 2]" 1 1155 1 51 LEU HG 1 119 GLU HA . . 4.490 4.017 3.374 4.495 0.005 1 0 "[ . 1 . 2]" 1 1156 1 51 LEU HG 1 119 GLU QG . . 4.370 2.209 1.954 2.705 . 0 0 "[ . 1 . 2]" 1 1157 1 52 SER H 1 52 SER HB2 . . 3.880 3.585 3.504 3.606 . 0 0 "[ . 1 . 2]" 1 1158 1 52 SER H 1 52 SER QB . . 3.320 2.490 2.176 2.643 . 0 0 "[ . 1 . 2]" 1 1159 1 52 SER H 1 52 SER HB3 . . 3.880 2.542 2.197 2.721 . 0 0 "[ . 1 . 2]" 1 1160 1 52 SER H 1 52 SER HG . . 3.570 3.384 2.612 3.570 0.000 3 0 "[ . 1 . 2]" 1 1161 1 52 SER H 1 53 LEU H . . 3.640 3.057 2.890 3.170 . 0 0 "[ . 1 . 2]" 1 1162 1 52 SER H 1 54 LYS H . . 4.930 4.282 3.944 4.605 . 0 0 "[ . 1 . 2]" 1 1163 1 52 SER H 1 62 PHE QD . . 4.810 3.937 3.429 4.331 . 0 0 "[ . 1 . 2]" 1 1164 1 52 SER H 1 62 PHE QE . . 4.530 3.822 3.395 4.344 . 0 0 "[ . 1 . 2]" 1 1165 1 52 SER HA 1 55 TYR H . . 4.570 3.500 3.211 3.748 . 0 0 "[ . 1 . 2]" 1 1166 1 52 SER HA 1 56 ASN H . . 5.090 4.497 3.898 4.836 . 0 0 "[ . 1 . 2]" 1 1167 1 52 SER HA 1 56 ASN QB . . 4.760 4.232 3.328 4.761 0.001 9 0 "[ . 1 . 2]" 1 1168 1 52 SER HA 1 62 PHE QD . . 4.470 3.045 2.714 3.359 . 0 0 "[ . 1 . 2]" 1 1169 1 52 SER HA 1 62 PHE QE . . 4.040 3.156 2.828 3.598 . 0 0 "[ . 1 . 2]" 1 1170 1 52 SER HA 1 62 PHE HZ . . 4.670 3.640 3.016 4.168 . 0 0 "[ . 1 . 2]" 1 1171 1 52 SER QB 1 53 LEU H . . 3.930 3.012 2.838 3.250 . 0 0 "[ . 1 . 2]" 1 1172 1 52 SER QB 1 56 ASN QD . . 3.920 2.878 1.869 3.867 . 0 0 "[ . 1 . 2]" 1 1173 1 52 SER QB 1 62 PHE HB2 . . 4.330 2.296 1.918 2.723 . 0 0 "[ . 1 . 2]" 1 1174 1 52 SER QB 1 62 PHE HB3 . . 4.020 2.659 2.303 3.095 . 0 0 "[ . 1 . 2]" 1 1175 1 52 SER QB 1 62 PHE QD . . 4.010 2.471 2.022 3.162 . 0 0 "[ . 1 . 2]" 1 1176 1 52 SER QB 1 62 PHE QE . . 4.920 3.710 3.364 4.285 . 0 0 "[ . 1 . 2]" 1 1177 1 52 SER HB2 1 53 LEU H . . 4.470 3.229 2.942 3.738 . 0 0 "[ . 1 . 2]" 1 1178 1 52 SER HB2 1 62 PHE HB3 . . 4.590 3.228 2.505 3.732 . 0 0 "[ . 1 . 2]" 1 1179 1 52 SER HB2 1 62 PHE QD . . 4.870 3.455 2.751 4.021 . 0 0 "[ . 1 . 2]" 1 1180 1 52 SER HB3 1 53 LEU H . . 4.470 3.677 3.387 3.829 . 0 0 "[ . 1 . 2]" 1 1181 1 52 SER HB3 1 62 PHE HB3 . . 4.590 2.911 2.415 3.414 . 0 0 "[ . 1 . 2]" 1 1182 1 52 SER HB3 1 62 PHE QD . . 4.870 2.555 2.036 3.307 . 0 0 "[ . 1 . 2]" 1 1183 1 52 SER HG 1 53 LEU H . . 3.610 2.725 1.940 3.153 . 0 0 "[ . 1 . 2]" 1 1184 1 53 LEU H 1 53 LEU HB2 . . 3.790 2.497 2.321 2.624 . 0 0 "[ . 1 . 2]" 1 1185 1 53 LEU H 1 53 LEU QB . . 3.210 2.452 2.292 2.564 . 0 0 "[ . 1 . 2]" 1 1186 1 53 LEU H 1 53 LEU HB3 . . 3.790 3.590 3.562 3.603 . 0 0 "[ . 1 . 2]" 1 1187 1 53 LEU H 1 53 LEU MD1 . . 4.450 3.290 3.187 3.469 . 0 0 "[ . 1 . 2]" 1 1188 1 53 LEU H 1 53 LEU MD2 . . 4.500 3.656 3.380 3.876 . 0 0 "[ . 1 . 2]" 1 1189 1 53 LEU H 1 53 LEU HG . . 3.780 2.278 2.036 2.641 . 0 0 "[ . 1 . 2]" 1 1190 1 53 LEU H 1 54 LYS H . . 3.530 2.921 2.791 3.088 . 0 0 "[ . 1 . 2]" 1 1191 1 53 LEU H 1 55 TYR H . . 5.000 4.501 4.068 4.765 . 0 0 "[ . 1 . 2]" 1 1192 1 53 LEU H 1 56 ASN H . . 5.170 4.885 4.673 5.012 . 0 0 "[ . 1 . 2]" 1 1193 1 53 LEU H 1 56 ASN QB . . 4.270 3.977 3.664 4.266 . 0 0 "[ . 1 . 2]" 1 1194 1 53 LEU HA 1 53 LEU MD1 . . 4.030 3.890 3.834 3.931 . 0 0 "[ . 1 . 2]" 1 1195 1 53 LEU HA 1 53 LEU MD2 . . 3.280 2.291 2.080 2.466 . 0 0 "[ . 1 . 2]" 1 1196 1 53 LEU HA 1 53 LEU HG . . 4.030 2.791 2.619 2.951 . 0 0 "[ . 1 . 2]" 1 1197 1 53 LEU HA 1 56 ASN H . . 4.840 3.607 3.134 3.799 . 0 0 "[ . 1 . 2]" 1 1198 1 53 LEU HA 1 56 ASN QB . . 4.500 2.140 1.968 3.278 . 0 0 "[ . 1 . 2]" 1 1199 1 53 LEU HA 1 56 ASN QD . . 4.670 2.659 1.935 4.253 . 0 0 "[ . 1 . 2]" 1 1200 1 53 LEU QB 1 53 LEU MD1 . . 2.940 2.026 1.941 2.100 . 0 0 "[ . 1 . 2]" 1 1201 1 53 LEU QB 1 54 LYS QB . . 5.180 3.956 3.713 4.421 . 0 0 "[ . 1 . 2]" 1 1202 1 53 LEU HB2 1 53 LEU MD1 . . 3.390 2.134 1.997 2.299 . 0 0 "[ . 1 . 2]" 1 1203 1 53 LEU HB2 1 54 LYS H . . 4.140 2.580 2.290 3.135 . 0 0 "[ . 1 . 2]" 1 1204 1 53 LEU HB3 1 53 LEU MD1 . . 3.390 2.549 2.429 2.644 . 0 0 "[ . 1 . 2]" 1 1205 1 53 LEU HB3 1 54 LYS H . . 4.140 3.500 3.176 3.715 . 0 0 "[ . 1 . 2]" 1 1206 1 53 LEU MD2 1 56 ASN H . . 5.500 5.338 4.967 5.492 . 0 0 "[ . 1 . 2]" 1 1207 1 53 LEU MD2 1 56 ASN QB . . 4.720 3.584 3.189 4.465 . 0 0 "[ . 1 . 2]" 1 1208 1 53 LEU HG 1 54 LYS H . . 4.930 4.486 4.288 4.854 . 0 0 "[ . 1 . 2]" 1 1209 1 54 LYS H 1 54 LYS HB2 . . 3.690 2.345 2.175 2.782 . 0 0 "[ . 1 . 2]" 1 1210 1 54 LYS H 1 54 LYS QB . . 3.090 2.208 2.121 2.383 . 0 0 "[ . 1 . 2]" 1 1211 1 54 LYS H 1 54 LYS HB3 . . 3.690 2.975 2.312 3.583 . 0 0 "[ . 1 . 2]" 1 1212 1 54 LYS H 1 54 LYS HG2 . . 4.590 4.269 3.582 4.600 0.010 3 0 "[ . 1 . 2]" 1 1213 1 54 LYS H 1 54 LYS QG . . 3.900 3.494 2.307 3.934 0.034 17 0 "[ . 1 . 2]" 1 1214 1 54 LYS H 1 54 LYS HG3 . . 4.590 3.787 2.336 4.535 . 0 0 "[ . 1 . 2]" 1 1215 1 54 LYS H 1 55 TYR H . . 3.470 2.756 2.453 2.962 . 0 0 "[ . 1 . 2]" 1 1216 1 54 LYS H 1 56 ASN H . . 5.130 3.795 3.360 3.982 . 0 0 "[ . 1 . 2]" 1 1217 1 54 LYS HA 1 54 LYS QD . . 4.610 4.023 3.690 4.281 . 0 0 "[ . 1 . 2]" 1 1218 1 54 LYS HA 1 54 LYS HG2 . . 3.770 2.748 2.363 3.620 . 0 0 "[ . 1 . 2]" 1 1219 1 54 LYS HA 1 54 LYS QG . . 3.280 2.360 2.221 2.612 . 0 0 "[ . 1 . 2]" 1 1220 1 54 LYS HA 1 54 LYS HG3 . . 3.770 2.668 2.291 2.977 . 0 0 "[ . 1 . 2]" 1 1221 1 54 LYS QB 1 54 LYS QE . . 4.360 2.596 2.038 3.482 . 0 0 "[ . 1 . 2]" 1 1222 1 54 LYS QB 1 55 TYR H . . 3.520 2.396 2.153 2.869 . 0 0 "[ . 1 . 2]" 1 1223 1 54 LYS QB 1 55 TYR QD . . 3.670 2.652 2.129 2.951 . 0 0 "[ . 1 . 2]" 1 1224 1 54 LYS QB 1 55 TYR QE . . 3.890 3.464 3.156 3.646 . 0 0 "[ . 1 . 2]" 1 1225 1 54 LYS HB2 1 54 LYS QD . . 3.780 2.564 2.135 3.065 . 0 0 "[ . 1 . 2]" 1 1226 1 54 LYS HB2 1 54 LYS QE . . 4.990 3.153 2.095 4.159 . 0 0 "[ . 1 . 2]" 1 1227 1 54 LYS HB2 1 55 TYR H . . 4.020 3.278 2.222 3.939 . 0 0 "[ . 1 . 2]" 1 1228 1 54 LYS HB2 1 55 TYR QD . . 4.320 3.769 2.674 4.320 . 0 0 "[ . 1 . 2]" 1 1229 1 54 LYS HB3 1 54 LYS QD . . 3.780 2.442 2.124 2.857 . 0 0 "[ . 1 . 2]" 1 1230 1 54 LYS HB3 1 54 LYS QE . . 4.990 3.013 2.188 3.871 . 0 0 "[ . 1 . 2]" 1 1231 1 54 LYS HB3 1 55 TYR H . . 4.020 2.647 2.177 3.582 . 0 0 "[ . 1 . 2]" 1 1232 1 54 LYS HB3 1 55 TYR QD . . 4.320 2.903 2.140 3.776 . 0 0 "[ . 1 . 2]" 1 1233 1 54 LYS QD 1 55 TYR QD . . 4.720 3.860 3.031 4.370 . 0 0 "[ . 1 . 2]" 1 1234 1 54 LYS QD 1 55 TYR QE . . 3.830 3.259 2.173 3.826 . 0 0 "[ . 1 . 2]" 1 1235 1 54 LYS QE 1 54 LYS HG2 . . 3.600 2.756 2.135 3.480 . 0 0 "[ . 1 . 2]" 1 1236 1 54 LYS QE 1 54 LYS HG3 . . 3.600 2.861 2.169 3.497 . 0 0 "[ . 1 . 2]" 1 1237 1 54 LYS QE 1 55 TYR QD . . 5.140 4.440 2.808 5.101 . 0 0 "[ . 1 . 2]" 1 1238 1 54 LYS QE 1 55 TYR QE . . 4.560 3.591 2.289 4.280 . 0 0 "[ . 1 . 2]" 1 1239 1 54 LYS QG 1 55 TYR H . . 5.140 3.905 3.156 4.418 . 0 0 "[ . 1 . 2]" 1 1240 1 55 TYR H 1 55 TYR HB2 . . 3.850 2.417 2.348 2.513 . 0 0 "[ . 1 . 2]" 1 1241 1 55 TYR H 1 55 TYR QB . . 3.360 2.383 2.319 2.470 . 0 0 "[ . 1 . 2]" 1 1242 1 55 TYR H 1 55 TYR HB3 . . 3.850 3.620 3.596 3.698 . 0 0 "[ . 1 . 2]" 1 1243 1 55 TYR H 1 55 TYR QD . . 3.640 2.405 1.998 2.789 . 0 0 "[ . 1 . 2]" 1 1244 1 55 TYR H 1 56 ASN H . . 3.430 2.635 2.295 2.758 . 0 0 "[ . 1 . 2]" 1 1245 1 55 TYR H 1 60 LEU MD2 . . 5.500 4.970 4.591 5.288 . 0 0 "[ . 1 . 2]" 1 1246 1 55 TYR H 1 62 PHE QE . . 4.660 4.256 3.934 4.591 . 0 0 "[ . 1 . 2]" 1 1247 1 55 TYR H 1 62 PHE HZ . . 5.180 4.633 4.125 5.020 . 0 0 "[ . 1 . 2]" 1 1248 1 55 TYR HA 1 55 TYR QD . . 3.480 2.981 2.828 3.148 . 0 0 "[ . 1 . 2]" 1 1249 1 55 TYR QB 1 60 LEU MD2 . . 3.630 2.003 1.843 2.233 . 0 0 "[ . 1 . 2]" 1 1250 1 55 TYR QB 1 62 PHE HZ . . 3.520 2.677 2.107 2.993 . 0 0 "[ . 1 . 2]" 1 1251 1 55 TYR QB 1 128 LEU MD1 . . 4.400 4.065 3.703 4.398 . 0 0 "[ . 1 . 2]" 1 1252 1 55 TYR QB 1 128 LEU MD2 . . 5.340 4.143 3.609 4.590 . 0 0 "[ . 1 . 2]" 1 1253 1 55 TYR HB2 1 60 LEU MD1 . . 5.500 5.385 5.101 5.505 0.005 19 0 "[ . 1 . 2]" 1 1254 1 55 TYR HB2 1 60 LEU MD2 . . 4.290 3.036 2.415 3.348 . 0 0 "[ . 1 . 2]" 1 1255 1 55 TYR HB2 1 62 PHE QE . . 3.760 2.129 1.995 2.425 . 0 0 "[ . 1 . 2]" 1 1256 1 55 TYR HB2 1 62 PHE HZ . . 4.060 2.754 2.137 3.100 . 0 0 "[ . 1 . 2]" 1 1257 1 55 TYR HB3 1 60 LEU MD1 . . 5.500 4.458 4.074 4.739 . 0 0 "[ . 1 . 2]" 1 1258 1 55 TYR HB3 1 60 LEU MD2 . . 4.290 2.042 1.856 2.444 . 0 0 "[ . 1 . 2]" 1 1259 1 55 TYR HB3 1 62 PHE QE . . 3.760 2.323 1.997 2.939 . 0 0 "[ . 1 . 2]" 1 1260 1 55 TYR HB3 1 62 PHE HZ . . 4.060 3.680 3.189 4.061 0.001 20 0 "[ . 1 . 2]" 1 1261 1 55 TYR QD 1 60 LEU MD1 . . 5.190 4.767 4.323 5.135 . 0 0 "[ . 1 . 2]" 1 1262 1 55 TYR QD 1 60 LEU MD2 . . 4.150 2.387 1.936 3.362 . 0 0 "[ . 1 . 2]" 1 1263 1 55 TYR QD 1 62 PHE HZ . . 4.480 3.274 2.701 3.876 . 0 0 "[ . 1 . 2]" 1 1264 1 55 TYR QD 1 123 ILE MD . . 5.500 5.009 4.184 5.468 . 0 0 "[ . 1 . 2]" 1 1265 1 55 TYR QD 1 123 ILE QG . . 5.340 4.752 4.334 5.014 . 0 0 "[ . 1 . 2]" 1 1266 1 55 TYR QD 1 123 ILE MG . . 5.500 5.259 4.752 5.461 . 0 0 "[ . 1 . 2]" 1 1267 1 55 TYR QD 1 128 LEU QB . . 4.730 3.291 2.678 3.682 . 0 0 "[ . 1 . 2]" 1 1268 1 55 TYR QD 1 128 LEU MD1 . . 3.730 3.512 3.097 3.696 . 0 0 "[ . 1 . 2]" 1 1269 1 55 TYR QD 1 132 SER HB2 . . 4.030 2.662 2.022 3.682 . 0 0 "[ . 1 . 2]" 1 1270 1 55 TYR QD 1 132 SER QB . . 3.320 2.130 1.910 2.954 . 0 0 "[ . 1 . 2]" 1 1271 1 55 TYR QD 1 132 SER HB3 . . 4.030 2.607 1.996 3.721 . 0 0 "[ . 1 . 2]" 1 1272 1 55 TYR QE 1 123 ILE MD . . 3.730 3.144 2.166 3.650 . 0 0 "[ . 1 . 2]" 1 1273 1 55 TYR QE 1 123 ILE QG . . 3.230 2.945 2.541 3.205 . 0 0 "[ . 1 . 2]" 1 1274 1 55 TYR QE 1 123 ILE MG . . 4.240 3.578 3.082 3.810 . 0 0 "[ . 1 . 2]" 1 1275 1 55 TYR QE 1 128 LEU MD1 . . 3.830 3.004 2.624 3.600 . 0 0 "[ . 1 . 2]" 1 1276 1 55 TYR QE 1 129 ASN HA . . 3.530 2.637 2.002 3.225 . 0 0 "[ . 1 . 2]" 1 1277 1 55 TYR QE 1 132 SER QB . . 4.780 2.929 2.063 4.170 . 0 0 "[ . 1 . 2]" 1 1278 1 56 ASN H 1 56 ASN HB2 . . 3.530 2.482 2.180 3.689 0.159 16 0 "[ . 1 . 2]" 1 1279 1 56 ASN H 1 56 ASN QB . . 3.050 2.302 2.159 2.593 . 0 0 "[ . 1 . 2]" 1 1280 1 56 ASN H 1 56 ASN HB3 . . 3.530 3.111 2.599 3.544 0.014 18 0 "[ . 1 . 2]" 1 1281 1 56 ASN HB2 1 57 CYS H . . 4.760 4.571 4.292 4.668 . 0 0 "[ . 1 . 2]" 1 1282 1 56 ASN HB3 1 57 CYS H . . 4.760 4.223 3.222 4.496 . 0 0 "[ . 1 . 2]" 1 1283 1 56 ASN QD 1 62 PHE HB2 . . 4.550 3.673 2.301 4.543 . 0 0 "[ . 1 . 2]" 1 1284 1 57 CYS H 1 60 LEU H . . 4.900 4.397 3.479 4.903 0.003 2 0 "[ . 1 . 2]" 1 1285 1 58 THR H 1 58 THR HB . . 4.030 3.078 2.451 3.632 . 0 0 "[ . 1 . 2]" 1 1286 1 58 THR H 1 58 THR MG . . 4.530 3.067 1.809 4.051 . 0 0 "[ . 1 . 2]" 1 1287 1 58 THR HA 1 58 THR MG . . 3.280 2.552 2.178 3.204 . 0 0 "[ . 1 . 2]" 1 1288 1 58 THR HB 1 59 GLY H . . 4.570 3.498 1.901 4.387 . 0 0 "[ . 1 . 2]" 1 1289 1 58 THR MG 1 59 GLY H . . 4.340 3.103 1.920 3.942 . 0 0 "[ . 1 . 2]" 1 1290 1 58 THR MG 1 59 GLY QA . . 4.550 3.732 2.965 4.674 0.124 7 0 "[ . 1 . 2]" 1 1291 1 59 GLY H 1 60 LEU H . . 3.410 3.038 1.767 3.412 0.002 17 0 "[ . 1 . 2]" 1 1292 1 60 LEU H 1 60 LEU HB2 . . 3.630 2.631 2.150 3.108 . 0 0 "[ . 1 . 2]" 1 1293 1 60 LEU H 1 60 LEU HB3 . . 3.630 2.687 2.459 3.039 . 0 0 "[ . 1 . 2]" 1 1294 1 60 LEU H 1 60 LEU MD1 . . 4.320 4.030 3.354 4.327 0.007 17 0 "[ . 1 . 2]" 1 1295 1 60 LEU H 1 60 LEU MD2 . . 4.480 4.316 4.168 4.587 0.107 12 0 "[ . 1 . 2]" 1 1296 1 60 LEU HA 1 60 LEU MD1 . . 3.390 2.108 1.965 2.436 . 0 0 "[ . 1 . 2]" 1 1297 1 60 LEU HA 1 60 LEU MD2 . . 4.700 3.872 3.798 3.931 . 0 0 "[ . 1 . 2]" 1 1298 1 60 LEU HA 1 61 ASN H . . 3.290 2.166 2.142 2.243 . 0 0 "[ . 1 . 2]" 1 1299 1 60 LEU QB 1 61 ASN H . . 4.380 3.726 3.536 3.936 . 0 0 "[ . 1 . 2]" 1 1300 1 60 LEU QB 1 62 PHE QE . . 4.680 3.562 2.236 4.253 . 0 0 "[ . 1 . 2]" 1 1301 1 60 LEU QB 1 132 SER QB . . 5.180 3.104 1.994 4.182 . 0 0 "[ . 1 . 2]" 1 1302 1 60 LEU MD1 1 61 ASN H . . 3.690 2.834 2.241 3.425 . 0 0 "[ . 1 . 2]" 1 1303 1 60 LEU MD1 1 93 LEU MD1 . . 3.440 3.301 3.018 3.435 . 0 0 "[ . 1 . 2]" 1 1304 1 60 LEU MD1 1 131 LEU HB2 . . 4.260 3.783 2.701 4.254 . 0 0 "[ . 1 . 2]" 1 1305 1 60 LEU MD1 1 131 LEU QB . . 3.730 3.077 2.384 3.486 . 0 0 "[ . 1 . 2]" 1 1306 1 60 LEU MD1 1 131 LEU HB3 . . 4.260 3.271 2.618 3.721 . 0 0 "[ . 1 . 2]" 1 1307 1 60 LEU MD1 1 131 LEU MD1 . . 4.080 2.953 2.427 3.497 . 0 0 "[ . 1 . 2]" 1 1308 1 60 LEU MD1 1 131 LEU MD2 . . 4.440 4.121 3.557 4.440 . 0 0 "[ . 1 . 2]" 1 1309 1 60 LEU MD1 1 132 SER H . . 5.500 4.790 3.524 5.461 . 0 0 "[ . 1 . 2]" 1 1310 1 60 LEU MD1 1 132 SER QB . . 4.950 4.285 3.180 4.875 . 0 0 "[ . 1 . 2]" 1 1311 1 60 LEU MD2 1 62 PHE QE . . 3.630 2.198 1.957 3.077 . 0 0 "[ . 1 . 2]" 1 1312 1 60 LEU MD2 1 62 PHE HZ . . 4.160 3.132 2.371 4.070 . 0 0 "[ . 1 . 2]" 1 1313 1 60 LEU MD2 1 128 LEU HA . . 4.310 3.710 3.193 4.260 . 0 0 "[ . 1 . 2]" 1 1314 1 60 LEU MD2 1 128 LEU MD2 . . 3.310 2.549 2.139 3.181 . 0 0 "[ . 1 . 2]" 1 1315 1 60 LEU MD2 1 131 LEU HB2 . . 4.160 3.174 2.717 3.516 . 0 0 "[ . 1 . 2]" 1 1316 1 60 LEU MD2 1 131 LEU HB3 . . 4.160 3.576 2.961 4.162 0.002 12 0 "[ . 1 . 2]" 1 1317 1 60 LEU MD2 1 132 SER H . . 4.900 3.615 3.253 4.073 . 0 0 "[ . 1 . 2]" 1 1318 1 60 LEU MD2 1 132 SER HA . . 4.620 4.076 3.129 4.608 . 0 0 "[ . 1 . 2]" 1 1319 1 60 LEU MD2 1 132 SER HB2 . . 4.200 3.058 2.311 4.188 . 0 0 "[ . 1 . 2]" 1 1320 1 60 LEU MD2 1 132 SER QB . . 3.580 2.593 1.962 3.072 . 0 0 "[ . 1 . 2]" 1 1321 1 60 LEU MD2 1 132 SER HB3 . . 4.200 3.441 2.013 4.229 0.029 19 0 "[ . 1 . 2]" 1 1322 1 60 LEU HG 1 61 ASN H . . 4.930 3.036 2.521 3.639 . 0 0 "[ . 1 . 2]" 1 1323 1 60 LEU HG 1 62 PHE QD . . 4.380 3.421 3.044 4.073 . 0 0 "[ . 1 . 2]" 1 1324 1 60 LEU HG 1 62 PHE QE . . 4.250 2.698 2.273 3.069 . 0 0 "[ . 1 . 2]" 1 1325 1 61 ASN H 1 61 ASN QB . . 3.610 2.554 2.368 2.869 . 0 0 "[ . 1 . 2]" 1 1326 1 61 ASN HA 1 61 ASN HD21 . . 4.390 3.618 2.666 4.022 . 0 0 "[ . 1 . 2]" 1 1327 1 61 ASN HA 1 61 ASN QD . . 3.710 3.407 2.623 3.706 . 0 0 "[ . 1 . 2]" 1 1328 1 61 ASN HA 1 61 ASN HD22 . . 4.390 4.221 3.910 4.378 . 0 0 "[ . 1 . 2]" 1 1329 1 61 ASN HA 1 62 PHE H . . 3.290 2.378 2.185 2.562 . 0 0 "[ . 1 . 2]" 1 1330 1 61 ASN HA 1 62 PHE QD . . 4.060 2.980 2.648 3.267 . 0 0 "[ . 1 . 2]" 1 1331 1 61 ASN QB 1 62 PHE H . . 3.700 2.507 2.077 3.011 . 0 0 "[ . 1 . 2]" 1 1332 1 61 ASN QB 1 62 PHE HA . . 4.690 4.094 3.968 4.296 . 0 0 "[ . 1 . 2]" 1 1333 1 61 ASN HB2 1 62 PHE H . . 4.320 3.693 3.204 4.123 . 0 0 "[ . 1 . 2]" 1 1334 1 61 ASN HB3 1 62 PHE H . . 4.320 2.560 2.093 3.128 . 0 0 "[ . 1 . 2]" 1 1335 1 62 PHE H 1 62 PHE HB2 . . 4.030 2.514 2.328 2.667 . 0 0 "[ . 1 . 2]" 1 1336 1 62 PHE H 1 62 PHE HB3 . . 3.800 3.671 3.573 3.771 . 0 0 "[ . 1 . 2]" 1 1337 1 62 PHE H 1 62 PHE QD . . 3.640 2.850 2.373 3.170 . 0 0 "[ . 1 . 2]" 1 1338 1 62 PHE HA 1 62 PHE QD . . 4.170 2.943 2.660 3.126 . 0 0 "[ . 1 . 2]" 1 1339 1 62 PHE HA 1 62 PHE QE . . 5.500 4.526 4.384 4.664 . 0 0 "[ . 1 . 2]" 1 1340 1 62 PHE HA 1 63 GLY H . . 3.270 2.196 2.147 2.288 . 0 0 "[ . 1 . 2]" 1 1341 1 62 PHE HA 1 63 GLY HA3 . . 5.050 4.335 4.303 4.369 . 0 0 "[ . 1 . 2]" 1 1342 1 62 PHE HB2 1 63 GLY H . . 4.750 4.239 4.001 4.442 . 0 0 "[ . 1 . 2]" 1 1343 1 62 PHE QE 1 91 LEU MD2 . . 4.970 4.661 3.909 4.956 . 0 0 "[ . 1 . 2]" 1 1344 1 62 PHE QE 1 128 LEU MD1 . . 3.670 3.487 3.172 3.672 0.002 16 0 "[ . 1 . 2]" 1 1345 1 62 PHE QE 1 128 LEU MD2 . . 4.520 3.710 3.139 4.179 . 0 0 "[ . 1 . 2]" 1 1346 1 62 PHE HZ 1 128 LEU MD1 . . 3.840 2.698 2.240 3.202 . 0 0 "[ . 1 . 2]" 1 1347 1 62 PHE HZ 1 128 LEU MD2 . . 4.490 3.050 2.375 3.679 . 0 0 "[ . 1 . 2]" 1 1348 1 63 GLY HA2 1 64 LYS H . . 3.530 2.363 2.143 2.541 . 0 0 "[ . 1 . 2]" 1 1349 1 63 GLY HA3 1 64 LYS HA . . 5.440 4.383 4.319 4.547 . 0 0 "[ . 1 . 2]" 1 1350 1 64 LYS H 1 64 LYS QB . . 3.660 2.640 2.400 2.841 . 0 0 "[ . 1 . 2]" 1 1351 1 64 LYS HA 1 65 VAL H . . 3.260 2.227 2.141 2.460 . 0 0 "[ . 1 . 2]" 1 1352 1 64 LYS HA 1 65 VAL MG1 . . 4.770 3.615 3.358 3.882 . 0 0 "[ . 1 . 2]" 1 1353 1 64 LYS QB 1 64 LYS QE . . 3.760 2.313 1.920 3.351 . 0 0 "[ . 1 . 2]" 1 1354 1 64 LYS QB 1 65 VAL H . . 4.340 3.292 2.318 3.902 . 0 0 "[ . 1 . 2]" 1 1355 1 64 LYS QG 1 65 VAL H . . 4.220 3.166 2.531 3.666 . 0 0 "[ . 1 . 2]" 1 1356 1 64 LYS HG2 1 65 VAL H . . 4.830 3.398 2.672 3.884 . 0 0 "[ . 1 . 2]" 1 1357 1 64 LYS HG3 1 65 VAL H . . 4.830 3.889 3.099 4.749 . 0 0 "[ . 1 . 2]" 1 1358 1 65 VAL H 1 65 VAL MG1 . . 3.530 2.146 1.942 2.446 . 0 0 "[ . 1 . 2]" 1 1359 1 65 VAL H 1 65 VAL MG2 . . 4.640 3.913 3.817 4.021 . 0 0 "[ . 1 . 2]" 1 1360 1 65 VAL HA 1 66 ASP H . . 2.200 2.156 2.139 2.221 0.021 13 0 "[ . 1 . 2]" 1 1361 1 65 VAL HB 1 73 VAL MG1 . . 4.710 4.556 4.193 4.707 . 0 0 "[ . 1 . 2]" 1 1362 1 65 VAL MG1 1 67 VAL MG1 . . 3.280 2.652 2.339 3.038 . 0 0 "[ . 1 . 2]" 1 1363 1 65 VAL MG1 1 67 VAL MG2 . . 5.210 4.198 3.793 4.670 . 0 0 "[ . 1 . 2]" 1 1364 1 65 VAL MG1 1 73 VAL MG1 . . 3.260 2.689 2.172 3.002 . 0 0 "[ . 1 . 2]" 1 1365 1 65 VAL MG1 1 73 VAL MG2 . . 4.360 3.863 3.194 4.323 . 0 0 "[ . 1 . 2]" 1 1366 1 65 VAL MG2 1 66 ASP H . . 3.830 2.646 2.036 3.058 . 0 0 "[ . 1 . 2]" 1 1367 1 65 VAL MG2 1 66 ASP HA . . 4.390 4.131 3.852 4.373 . 0 0 "[ . 1 . 2]" 1 1368 1 65 VAL MG2 1 67 VAL HA . . 4.700 3.832 3.582 4.258 . 0 0 "[ . 1 . 2]" 1 1369 1 65 VAL MG2 1 67 VAL MG1 . . 3.620 2.953 2.629 3.344 . 0 0 "[ . 1 . 2]" 1 1370 1 65 VAL MG2 1 70 TYR HB2 . . 4.360 3.658 3.237 4.011 . 0 0 "[ . 1 . 2]" 1 1371 1 65 VAL MG2 1 70 TYR HB3 . . 4.640 4.300 3.715 4.548 . 0 0 "[ . 1 . 2]" 1 1372 1 65 VAL MG2 1 70 TYR QD . . 4.240 3.913 3.229 4.229 . 0 0 "[ . 1 . 2]" 1 1373 1 65 VAL MG2 1 70 TYR QE . . 5.280 4.443 3.746 4.853 . 0 0 "[ . 1 . 2]" 1 1374 1 65 VAL MG2 1 73 VAL HB . . 4.270 3.615 3.141 3.856 . 0 0 "[ . 1 . 2]" 1 1375 1 65 VAL MG2 1 73 VAL MG1 . . 3.290 2.550 2.338 3.019 . 0 0 "[ . 1 . 2]" 1 1376 1 65 VAL MG2 1 73 VAL MG2 . . 3.520 2.573 2.075 2.890 . 0 0 "[ . 1 . 2]" 1 1377 1 65 VAL MG2 1 74 SER H . . 5.500 5.285 4.929 5.498 . 0 0 "[ . 1 . 2]" 1 1378 1 65 VAL MG2 1 77 TYR QE . . 5.500 5.252 4.724 5.474 . 0 0 "[ . 1 . 2]" 1 1379 1 66 ASP H 1 66 ASP HB2 . . 3.830 3.201 2.309 3.624 . 0 0 "[ . 1 . 2]" 1 1380 1 66 ASP H 1 66 ASP HB3 . . 3.830 2.723 2.455 3.086 . 0 0 "[ . 1 . 2]" 1 1381 1 66 ASP H 1 70 TYR QD . . 5.010 4.926 4.745 5.021 0.011 20 0 "[ . 1 . 2]" 1 1382 1 66 ASP HA 1 67 VAL H . . 3.070 2.155 2.138 2.208 . 0 0 "[ . 1 . 2]" 1 1383 1 66 ASP HA 1 67 VAL HA . . 5.100 4.409 4.386 4.465 . 0 0 "[ . 1 . 2]" 1 1384 1 66 ASP HA 1 67 VAL MG1 . . 4.420 4.043 3.750 4.287 . 0 0 "[ . 1 . 2]" 1 1385 1 66 ASP HA 1 67 VAL MG2 . . 4.180 3.641 3.531 3.746 . 0 0 "[ . 1 . 2]" 1 1386 1 66 ASP HA 1 68 GLY H . . 4.070 3.647 3.378 4.054 . 0 0 "[ . 1 . 2]" 1 1387 1 66 ASP QB 1 69 ARG H . . 4.180 3.540 2.903 4.161 . 0 0 "[ . 1 . 2]" 1 1388 1 66 ASP QB 1 69 ARG QB . . 3.980 3.365 2.504 3.860 . 0 0 "[ . 1 . 2]" 1 1389 1 66 ASP QB 1 70 TYR QD . . 4.410 3.683 2.963 4.277 . 0 0 "[ . 1 . 2]" 1 1390 1 66 ASP QB 1 70 TYR QE . . 5.340 4.043 2.871 4.698 . 0 0 "[ . 1 . 2]" 1 1391 1 67 VAL H 1 67 VAL MG1 . . 3.710 2.732 2.422 3.042 . 0 0 "[ . 1 . 2]" 1 1392 1 67 VAL H 1 67 VAL MG2 . . 3.180 1.935 1.854 2.049 . 0 0 "[ . 1 . 2]" 1 1393 1 67 VAL H 1 68 GLY H . . 3.510 2.244 1.932 2.481 . 0 0 "[ . 1 . 2]" 1 1394 1 67 VAL H 1 69 ARG H . . 4.530 4.047 3.640 4.387 . 0 0 "[ . 1 . 2]" 1 1395 1 67 VAL H 1 88 LEU MD2 . . 5.500 4.026 3.761 4.280 . 0 0 "[ . 1 . 2]" 1 1396 1 67 VAL HA 1 67 VAL MG1 . . 3.180 2.222 2.080 2.356 . 0 0 "[ . 1 . 2]" 1 1397 1 67 VAL HA 1 69 ARG H . . 4.410 3.602 3.360 3.882 . 0 0 "[ . 1 . 2]" 1 1398 1 67 VAL HA 1 70 TYR H . . 3.390 2.888 2.670 3.135 . 0 0 "[ . 1 . 2]" 1 1399 1 67 VAL HA 1 70 TYR HB2 . . 3.950 2.416 2.118 2.711 . 0 0 "[ . 1 . 2]" 1 1400 1 67 VAL HA 1 70 TYR HB3 . . 4.810 3.917 3.662 4.186 . 0 0 "[ . 1 . 2]" 1 1401 1 67 VAL HA 1 70 TYR QD . . 4.940 4.113 3.846 4.689 . 0 0 "[ . 1 . 2]" 1 1402 1 67 VAL HA 1 73 VAL HB . . 4.440 3.218 2.938 3.598 . 0 0 "[ . 1 . 2]" 1 1403 1 67 VAL HB 1 68 GLY H . . 4.900 3.760 3.517 4.030 . 0 0 "[ . 1 . 2]" 1 1404 1 67 VAL HB 1 71 THR HA . . 5.400 5.091 4.396 5.401 0.001 7 0 "[ . 1 . 2]" 1 1405 1 67 VAL HB 1 74 SER H . . 4.420 3.299 3.029 3.805 . 0 0 "[ . 1 . 2]" 1 1406 1 67 VAL HB 1 74 SER HA . . 4.170 3.166 2.246 3.713 . 0 0 "[ . 1 . 2]" 1 1407 1 67 VAL HB 1 74 SER HB2 . . 3.880 3.444 2.740 3.769 . 0 0 "[ . 1 . 2]" 1 1408 1 67 VAL HB 1 74 SER HB3 . . 3.880 2.036 1.997 2.136 . 0 0 "[ . 1 . 2]" 1 1409 1 67 VAL HB 1 81 THR MG . . 3.710 2.723 2.217 3.418 . 0 0 "[ . 1 . 2]" 1 1410 1 67 VAL MG1 1 68 GLY H . . 4.800 4.061 3.911 4.171 . 0 0 "[ . 1 . 2]" 1 1411 1 67 VAL MG1 1 70 TYR H . . 5.500 4.685 4.528 4.946 . 0 0 "[ . 1 . 2]" 1 1412 1 67 VAL MG1 1 73 VAL H . . 5.500 4.720 4.394 5.066 . 0 0 "[ . 1 . 2]" 1 1413 1 67 VAL MG1 1 73 VAL HB . . 3.560 2.605 2.202 3.097 . 0 0 "[ . 1 . 2]" 1 1414 1 67 VAL MG1 1 74 SER H . . 3.900 2.979 2.574 3.357 . 0 0 "[ . 1 . 2]" 1 1415 1 67 VAL MG1 1 74 SER HA . . 3.690 2.724 2.475 3.034 . 0 0 "[ . 1 . 2]" 1 1416 1 67 VAL MG1 1 74 SER HB2 . . 4.320 4.185 3.772 4.334 0.014 2 0 "[ . 1 . 2]" 1 1417 1 67 VAL MG1 1 74 SER HB3 . . 4.320 3.154 2.757 3.517 . 0 0 "[ . 1 . 2]" 1 1418 1 67 VAL MG1 1 75 THR H . . 5.500 5.260 4.935 5.447 . 0 0 "[ . 1 . 2]" 1 1419 1 67 VAL MG1 1 79 VAL H . . 5.500 5.300 5.022 5.504 0.004 6 0 "[ . 1 . 2]" 1 1420 1 67 VAL MG1 1 79 VAL HB . . 4.040 3.458 3.216 3.794 . 0 0 "[ . 1 . 2]" 1 1421 1 67 VAL MG1 1 79 VAL MG1 . . 3.740 3.274 2.772 3.686 . 0 0 "[ . 1 . 2]" 1 1422 1 67 VAL MG1 1 88 LEU MD2 . . 3.820 3.689 3.422 3.834 0.014 18 0 "[ . 1 . 2]" 1 1423 1 67 VAL MG2 1 68 GLY H . . 3.960 2.029 1.875 2.418 . 0 0 "[ . 1 . 2]" 1 1424 1 67 VAL MG2 1 68 GLY QA . . 4.430 3.107 2.913 3.259 . 0 0 "[ . 1 . 2]" 1 1425 1 67 VAL MG2 1 69 ARG H . . 4.680 4.285 4.101 4.464 . 0 0 "[ . 1 . 2]" 1 1426 1 67 VAL MG2 1 70 TYR H . . 5.500 4.905 4.654 5.142 . 0 0 "[ . 1 . 2]" 1 1427 1 67 VAL MG2 1 74 SER H . . 5.500 4.764 4.529 5.139 . 0 0 "[ . 1 . 2]" 1 1428 1 67 VAL MG2 1 74 SER HA . . 4.780 4.084 3.501 4.441 . 0 0 "[ . 1 . 2]" 1 1429 1 67 VAL MG2 1 74 SER HB2 . . 4.470 4.230 3.432 4.476 0.006 20 0 "[ . 1 . 2]" 1 1430 1 67 VAL MG2 1 74 SER HB3 . . 4.470 3.437 3.102 3.799 . 0 0 "[ . 1 . 2]" 1 1431 1 67 VAL MG2 1 79 VAL HB . . 4.420 3.973 3.714 4.382 . 0 0 "[ . 1 . 2]" 1 1432 1 67 VAL MG2 1 79 VAL MG2 . . 5.500 4.207 3.747 4.722 . 0 0 "[ . 1 . 2]" 1 1433 1 67 VAL MG2 1 81 THR HA . . 4.660 4.075 3.406 4.582 . 0 0 "[ . 1 . 2]" 1 1434 1 67 VAL MG2 1 81 THR MG . . 3.030 2.574 1.894 3.034 0.004 11 0 "[ . 1 . 2]" 1 1435 1 67 VAL MG2 1 88 LEU MD2 . . 2.990 1.906 1.795 2.047 . 0 0 "[ . 1 . 2]" 1 1436 1 68 GLY H 1 69 ARG H . . 3.190 2.826 2.639 2.968 . 0 0 "[ . 1 . 2]" 1 1437 1 68 GLY H 1 81 THR MG . . 4.980 3.773 3.188 4.200 . 0 0 "[ . 1 . 2]" 1 1438 1 68 GLY QA 1 81 THR MG . . 3.680 2.522 2.075 2.987 . 0 0 "[ . 1 . 2]" 1 1439 1 68 GLY HA2 1 81 THR MG . . 4.380 2.553 2.086 3.042 . 0 0 "[ . 1 . 2]" 1 1440 1 68 GLY HA3 1 81 THR MG . . 4.380 3.961 3.555 4.384 0.004 2 0 "[ . 1 . 2]" 1 1441 1 69 ARG H 1 69 ARG HB2 . . 3.450 2.809 2.272 3.154 . 0 0 "[ . 1 . 2]" 1 1442 1 69 ARG H 1 69 ARG HB3 . . 3.450 2.702 2.380 3.501 0.051 10 0 "[ . 1 . 2]" 1 1443 1 69 ARG H 1 69 ARG HG2 . . 5.110 4.523 4.045 4.744 . 0 0 "[ . 1 . 2]" 1 1444 1 69 ARG H 1 69 ARG QG . . 4.240 4.011 3.268 4.170 . 0 0 "[ . 1 . 2]" 1 1445 1 69 ARG H 1 69 ARG HG3 . . 5.110 4.513 3.451 4.847 . 0 0 "[ . 1 . 2]" 1 1446 1 69 ARG H 1 70 TYR H . . 3.250 2.048 1.823 2.282 . 0 0 "[ . 1 . 2]" 1 1447 1 69 ARG H 1 70 TYR HB2 . . 4.610 4.147 3.936 4.497 . 0 0 "[ . 1 . 2]" 1 1448 1 69 ARG HA 1 69 ARG HD2 . . 4.770 4.256 3.415 4.764 . 0 0 "[ . 1 . 2]" 1 1449 1 69 ARG HA 1 69 ARG QD . . 3.940 3.607 2.249 3.994 0.054 13 0 "[ . 1 . 2]" 1 1450 1 69 ARG HA 1 69 ARG HD3 . . 4.770 4.055 2.264 4.695 . 0 0 "[ . 1 . 2]" 1 1451 1 69 ARG HA 1 69 ARG HG2 . . 4.030 2.978 2.177 3.907 . 0 0 "[ . 1 . 2]" 1 1452 1 69 ARG HA 1 69 ARG QG . . 3.490 2.395 2.134 3.092 . 0 0 "[ . 1 . 2]" 1 1453 1 69 ARG HA 1 69 ARG HG3 . . 4.030 2.839 2.204 3.563 . 0 0 "[ . 1 . 2]" 1 1454 1 69 ARG HA 1 70 TYR QD . . 5.350 4.431 4.115 4.642 . 0 0 "[ . 1 . 2]" 1 1455 1 69 ARG QB 1 69 ARG QD . . 3.250 2.197 2.021 2.625 . 0 0 "[ . 1 . 2]" 1 1456 1 69 ARG QB 1 70 TYR H . . 3.330 2.707 2.478 3.023 . 0 0 "[ . 1 . 2]" 1 1457 1 69 ARG QB 1 70 TYR QD . . 4.140 2.208 2.016 2.586 . 0 0 "[ . 1 . 2]" 1 1458 1 69 ARG HB2 1 70 TYR H . . 4.150 3.817 2.937 4.159 0.009 14 0 "[ . 1 . 2]" 1 1459 1 69 ARG HB3 1 70 TYR H . . 4.150 2.794 2.525 3.389 . 0 0 "[ . 1 . 2]" 1 1460 1 69 ARG QD 1 70 TYR QD . . 4.940 3.818 2.450 4.668 . 0 0 "[ . 1 . 2]" 1 1461 1 69 ARG QD 1 70 TYR QE . . 4.300 3.580 2.442 4.315 0.015 20 0 "[ . 1 . 2]" 1 1462 1 69 ARG HD2 1 70 TYR QE . . 5.160 4.241 2.460 5.052 . 0 0 "[ . 1 . 2]" 1 1463 1 69 ARG HD3 1 70 TYR QE . . 5.160 4.253 3.132 5.163 0.003 14 0 "[ . 1 . 2]" 1 1464 1 69 ARG QG 1 70 TYR H . . 5.340 4.018 3.440 4.403 . 0 0 "[ . 1 . 2]" 1 1465 1 69 ARG QG 1 70 TYR QD . . 4.690 3.526 2.039 4.370 . 0 0 "[ . 1 . 2]" 1 1466 1 69 ARG QG 1 70 TYR QE . . 4.730 3.854 2.399 4.712 . 0 0 "[ . 1 . 2]" 1 1467 1 70 TYR H 1 70 TYR HB2 . . 3.500 2.357 2.288 2.462 . 0 0 "[ . 1 . 2]" 1 1468 1 70 TYR H 1 70 TYR HB3 . . 3.860 3.596 3.557 3.645 . 0 0 "[ . 1 . 2]" 1 1469 1 70 TYR H 1 70 TYR QD . . 3.640 2.122 1.901 2.561 . 0 0 "[ . 1 . 2]" 1 1470 1 70 TYR H 1 71 THR H . . 4.440 3.953 3.380 4.304 . 0 0 "[ . 1 . 2]" 1 1471 1 70 TYR HA 1 70 TYR QD . . 3.470 3.014 2.613 3.175 . 0 0 "[ . 1 . 2]" 1 1472 1 70 TYR HA 1 71 THR H . . 3.080 2.314 2.152 2.608 . 0 0 "[ . 1 . 2]" 1 1473 1 70 TYR HA 1 71 THR HA . . 4.850 4.543 4.420 4.733 . 0 0 "[ . 1 . 2]" 1 1474 1 70 TYR HA 1 73 VAL MG2 . . 4.920 4.439 4.120 4.793 . 0 0 "[ . 1 . 2]" 1 1475 1 70 TYR HB2 1 73 VAL HB . . 4.190 3.047 2.676 3.296 . 0 0 "[ . 1 . 2]" 1 1476 1 70 TYR HB2 1 73 VAL MG1 . . 4.620 4.211 3.755 4.570 . 0 0 "[ . 1 . 2]" 1 1477 1 70 TYR HB2 1 73 VAL MG2 . . 3.970 2.941 2.485 3.412 . 0 0 "[ . 1 . 2]" 1 1478 1 70 TYR HB3 1 73 VAL H . . 4.190 2.652 2.461 2.996 . 0 0 "[ . 1 . 2]" 1 1479 1 70 TYR HB3 1 73 VAL HB . . 4.020 3.039 2.134 3.544 . 0 0 "[ . 1 . 2]" 1 1480 1 70 TYR HB3 1 73 VAL MG2 . . 3.630 2.249 1.982 2.541 . 0 0 "[ . 1 . 2]" 1 1481 1 70 TYR QD 1 73 VAL MG2 . . 4.710 2.660 2.029 3.080 . 0 0 "[ . 1 . 2]" 1 1482 1 70 TYR QE 1 73 VAL MG2 . . 4.780 4.379 3.774 4.739 . 0 0 "[ . 1 . 2]" 1 1483 1 71 THR H 1 71 THR HB . . 3.700 3.232 2.504 3.624 . 0 0 "[ . 1 . 2]" 1 1484 1 71 THR H 1 71 THR MG . . 3.440 2.242 1.893 3.560 0.120 4 0 "[ . 1 . 2]" 1 1485 1 71 THR H 1 72 ASP H . . 4.510 2.703 2.480 2.933 . 0 0 "[ . 1 . 2]" 1 1486 1 71 THR HA 1 71 THR MG . . 3.300 2.633 2.194 3.205 . 0 0 "[ . 1 . 2]" 1 1487 1 71 THR HA 1 74 SER H . . 4.000 3.797 3.532 3.978 . 0 0 "[ . 1 . 2]" 1 1488 1 71 THR HA 1 74 SER HG . . 5.100 2.448 2.032 3.058 . 0 0 "[ . 1 . 2]" 1 1489 1 71 THR HA 1 81 THR MG . . 4.370 3.635 2.243 4.359 . 0 0 "[ . 1 . 2]" 1 1490 1 71 THR HB 1 72 ASP H . . 4.950 3.857 2.977 4.297 . 0 0 "[ . 1 . 2]" 1 1491 1 72 ASP H 1 73 VAL H . . 4.160 2.794 2.489 3.077 . 0 0 "[ . 1 . 2]" 1 1492 1 72 ASP HA 1 75 THR H . . 4.540 4.237 3.795 4.526 . 0 0 "[ . 1 . 2]" 1 1493 1 72 ASP HA 1 75 THR HB . . 3.690 3.460 2.739 3.687 . 0 0 "[ . 1 . 2]" 1 1494 1 72 ASP QB 1 73 VAL H . . 3.260 2.436 2.150 2.842 . 0 0 "[ . 1 . 2]" 1 1495 1 72 ASP QB 1 73 VAL HA . . 4.560 3.888 3.762 4.258 . 0 0 "[ . 1 . 2]" 1 1496 1 73 VAL H 1 73 VAL HB . . 3.140 2.544 2.434 2.631 . 0 0 "[ . 1 . 2]" 1 1497 1 73 VAL H 1 73 VAL MG1 . . 4.180 3.765 3.746 3.777 . 0 0 "[ . 1 . 2]" 1 1498 1 73 VAL H 1 73 VAL MG2 . . 3.180 2.169 1.938 2.351 . 0 0 "[ . 1 . 2]" 1 1499 1 73 VAL H 1 74 SER H . . 3.230 2.863 2.620 3.075 . 0 0 "[ . 1 . 2]" 1 1500 1 73 VAL H 1 76 ARG H . . 5.080 4.616 4.343 4.791 . 0 0 "[ . 1 . 2]" 1 1501 1 73 VAL HA 1 73 VAL MG1 . . 3.360 2.433 2.334 2.498 . 0 0 "[ . 1 . 2]" 1 1502 1 73 VAL HA 1 73 VAL MG2 . . 3.470 2.369 2.261 2.465 . 0 0 "[ . 1 . 2]" 1 1503 1 73 VAL HA 1 76 ARG H . . 4.130 3.360 2.943 3.628 . 0 0 "[ . 1 . 2]" 1 1504 1 73 VAL HA 1 76 ARG HB2 . . 4.110 3.063 2.807 3.627 . 0 0 "[ . 1 . 2]" 1 1505 1 73 VAL HA 1 76 ARG HB3 . . 4.110 2.522 2.014 2.879 . 0 0 "[ . 1 . 2]" 1 1506 1 73 VAL HA 1 76 ARG QG . . 4.940 4.330 3.842 4.784 . 0 0 "[ . 1 . 2]" 1 1507 1 73 VAL HA 1 77 TYR QD . . 3.660 3.050 2.844 3.312 . 0 0 "[ . 1 . 2]" 1 1508 1 73 VAL HA 1 77 TYR QE . . 4.380 3.457 3.220 3.793 . 0 0 "[ . 1 . 2]" 1 1509 1 73 VAL HB 1 74 SER H . . 3.650 2.159 2.030 2.380 . 0 0 "[ . 1 . 2]" 1 1510 1 73 VAL MG1 1 74 SER H . . 4.130 3.071 2.777 3.303 . 0 0 "[ . 1 . 2]" 1 1511 1 73 VAL MG1 1 74 SER HA . . 4.260 3.332 2.955 3.557 . 0 0 "[ . 1 . 2]" 1 1512 1 73 VAL MG1 1 77 TYR H . . 4.210 3.630 3.312 4.007 . 0 0 "[ . 1 . 2]" 1 1513 1 73 VAL MG1 1 77 TYR HB2 . . 4.620 3.228 2.955 3.397 . 0 0 "[ . 1 . 2]" 1 1514 1 73 VAL MG1 1 77 TYR QB . . 3.970 3.158 2.900 3.315 . 0 0 "[ . 1 . 2]" 1 1515 1 73 VAL MG1 1 77 TYR HB3 . . 4.620 4.482 4.201 4.622 0.002 18 0 "[ . 1 . 2]" 1 1516 1 73 VAL MG1 1 77 TYR QD . . 3.290 2.283 2.019 2.669 . 0 0 "[ . 1 . 2]" 1 1517 1 73 VAL MG2 1 74 SER H . . 3.970 3.663 3.554 3.792 . 0 0 "[ . 1 . 2]" 1 1518 1 74 SER H 1 74 SER HB2 . . 3.610 3.600 3.552 3.625 0.015 2 0 "[ . 1 . 2]" 1 1519 1 74 SER H 1 74 SER QB . . 3.090 2.497 2.333 2.739 . 0 0 "[ . 1 . 2]" 1 1520 1 74 SER H 1 74 SER HB3 . . 3.610 2.550 2.363 2.849 . 0 0 "[ . 1 . 2]" 1 1521 1 74 SER H 1 74 SER HG . . 4.710 2.806 1.913 3.919 . 0 0 "[ . 1 . 2]" 1 1522 1 74 SER H 1 75 THR H . . 3.490 3.112 2.773 3.311 . 0 0 "[ . 1 . 2]" 1 1523 1 74 SER HA 1 79 VAL H . . 3.940 3.368 3.031 3.911 . 0 0 "[ . 1 . 2]" 1 1524 1 74 SER HA 1 79 VAL HB . . 3.770 2.295 1.998 2.627 . 0 0 "[ . 1 . 2]" 1 1525 1 74 SER HA 1 79 VAL MG1 . . 4.410 3.562 3.140 3.903 . 0 0 "[ . 1 . 2]" 1 1526 1 74 SER HA 1 79 VAL MG2 . . 4.400 3.434 2.928 4.010 . 0 0 "[ . 1 . 2]" 1 1527 1 74 SER QB 1 75 THR H . . 3.730 3.093 2.631 3.577 . 0 0 "[ . 1 . 2]" 1 1528 1 74 SER QB 1 79 VAL HB . . 4.250 3.100 2.546 3.848 . 0 0 "[ . 1 . 2]" 1 1529 1 74 SER QB 1 79 VAL MG1 . . 4.470 3.343 2.577 3.873 . 0 0 "[ . 1 . 2]" 1 1530 1 74 SER QB 1 81 THR MG . . 3.200 1.972 1.744 2.485 . 0 0 "[ . 1 . 2]" 1 1531 1 74 SER HB2 1 75 THR H . . 4.270 3.312 2.690 3.974 . 0 0 "[ . 1 . 2]" 1 1532 1 74 SER HB2 1 79 VAL HB . . 4.990 3.314 2.769 4.093 . 0 0 "[ . 1 . 2]" 1 1533 1 74 SER HB3 1 75 THR H . . 4.270 3.768 3.519 4.177 . 0 0 "[ . 1 . 2]" 1 1534 1 74 SER HB3 1 79 VAL HB . . 4.990 3.808 2.872 4.679 . 0 0 "[ . 1 . 2]" 1 1535 1 74 SER HG 1 75 THR H . . 2.500 2.138 1.916 2.458 . 0 0 "[ . 1 . 2]" 1 1536 1 75 THR H 1 75 THR HB . . 3.140 2.623 2.502 2.732 . 0 0 "[ . 1 . 2]" 1 1537 1 75 THR H 1 75 THR MG . . 3.900 3.772 3.749 3.811 . 0 0 "[ . 1 . 2]" 1 1538 1 75 THR H 1 76 ARG H . . 3.500 2.661 2.215 2.937 . 0 0 "[ . 1 . 2]" 1 1539 1 75 THR HA 1 75 THR MG . . 3.430 2.355 2.242 2.471 . 0 0 "[ . 1 . 2]" 1 1540 1 75 THR HA 1 78 LYS H . . 4.120 3.647 3.231 3.872 . 0 0 "[ . 1 . 2]" 1 1541 1 75 THR HA 1 79 VAL H . . 4.610 3.610 3.010 4.114 . 0 0 "[ . 1 . 2]" 1 1542 1 75 THR HB 1 76 ARG H . . 3.330 2.697 2.413 2.935 . 0 0 "[ . 1 . 2]" 1 1543 1 75 THR MG 1 76 ARG H . . 3.880 3.623 3.365 3.841 . 0 0 "[ . 1 . 2]" 1 1544 1 75 THR MG 1 78 LYS H . . 4.760 4.294 3.939 4.618 . 0 0 "[ . 1 . 2]" 1 1545 1 76 ARG H 1 76 ARG HB2 . . 3.540 2.431 2.257 2.587 . 0 0 "[ . 1 . 2]" 1 1546 1 76 ARG H 1 76 ARG QB . . 3.090 2.236 2.173 2.294 . 0 0 "[ . 1 . 2]" 1 1547 1 76 ARG H 1 76 ARG HB3 . . 3.540 2.640 2.497 2.831 . 0 0 "[ . 1 . 2]" 1 1548 1 76 ARG H 1 76 ARG HG2 . . 4.560 4.501 4.453 4.565 0.005 8 0 "[ . 1 . 2]" 1 1549 1 76 ARG H 1 76 ARG HG3 . . 4.560 4.383 4.215 4.492 . 0 0 "[ . 1 . 2]" 1 1550 1 76 ARG H 1 77 TYR H . . 3.640 2.646 2.349 2.991 . 0 0 "[ . 1 . 2]" 1 1551 1 76 ARG H 1 78 LYS H . . 4.520 4.063 3.679 4.389 . 0 0 "[ . 1 . 2]" 1 1552 1 76 ARG HA 1 76 ARG HD2 . . 4.880 4.436 3.994 4.638 . 0 0 "[ . 1 . 2]" 1 1553 1 76 ARG HA 1 76 ARG QD . . 4.280 4.066 3.794 4.186 . 0 0 "[ . 1 . 2]" 1 1554 1 76 ARG HA 1 76 ARG HD3 . . 4.880 4.737 4.540 4.893 0.013 6 0 "[ . 1 . 2]" 1 1555 1 76 ARG HA 1 76 ARG HG2 . . 3.450 3.017 2.599 3.388 . 0 0 "[ . 1 . 2]" 1 1556 1 76 ARG HA 1 76 ARG QG . . 3.020 2.384 2.293 2.447 . 0 0 "[ . 1 . 2]" 1 1557 1 76 ARG HA 1 76 ARG HG3 . . 3.450 2.539 2.369 2.810 . 0 0 "[ . 1 . 2]" 1 1558 1 76 ARG QB 1 76 ARG QD . . 3.010 2.168 2.046 2.372 . 0 0 "[ . 1 . 2]" 1 1559 1 76 ARG QB 1 77 TYR H . . 3.730 2.649 2.323 3.238 . 0 0 "[ . 1 . 2]" 1 1560 1 76 ARG QB 1 77 TYR QD . . 3.740 2.167 1.985 2.467 . 0 0 "[ . 1 . 2]" 1 1561 1 76 ARG QB 1 77 TYR QE . . 3.860 3.087 2.551 3.268 . 0 0 "[ . 1 . 2]" 1 1562 1 76 ARG HB2 1 77 TYR H . . 4.350 3.846 3.566 4.256 . 0 0 "[ . 1 . 2]" 1 1563 1 76 ARG HB2 1 77 TYR QD . . 4.260 3.871 3.695 4.122 . 0 0 "[ . 1 . 2]" 1 1564 1 76 ARG HB2 1 77 TYR QE . . 4.720 4.516 3.991 4.706 . 0 0 "[ . 1 . 2]" 1 1565 1 76 ARG HB3 1 77 TYR H . . 4.350 2.703 2.347 3.357 . 0 0 "[ . 1 . 2]" 1 1566 1 76 ARG HB3 1 77 TYR QD . . 4.260 2.179 1.993 2.486 . 0 0 "[ . 1 . 2]" 1 1567 1 76 ARG HB3 1 77 TYR QE . . 4.720 3.144 2.581 3.335 . 0 0 "[ . 1 . 2]" 1 1568 1 76 ARG HD2 1 77 TYR QE . . 4.640 3.077 2.108 4.557 . 0 0 "[ . 1 . 2]" 1 1569 1 76 ARG HD3 1 77 TYR QE . . 4.640 3.326 2.266 4.271 . 0 0 "[ . 1 . 2]" 1 1570 1 76 ARG QG 1 77 TYR HA . . 4.380 4.030 3.565 4.321 . 0 0 "[ . 1 . 2]" 1 1571 1 77 TYR H 1 77 TYR HB2 . . 4.060 2.434 2.352 2.688 . 0 0 "[ . 1 . 2]" 1 1572 1 77 TYR H 1 77 TYR QB . . 3.320 2.400 2.323 2.637 . 0 0 "[ . 1 . 2]" 1 1573 1 77 TYR H 1 77 TYR HB3 . . 4.060 3.648 3.595 3.807 . 0 0 "[ . 1 . 2]" 1 1574 1 77 TYR H 1 77 TYR QD . . 3.620 2.320 1.988 2.607 . 0 0 "[ . 1 . 2]" 1 1575 1 77 TYR H 1 78 LYS H . . 3.290 2.655 2.201 2.884 . 0 0 "[ . 1 . 2]" 1 1576 1 77 TYR H 1 79 VAL H . . 4.190 3.538 3.068 3.961 . 0 0 "[ . 1 . 2]" 1 1577 1 77 TYR H 1 79 VAL MG2 . . 4.700 3.878 3.455 4.196 . 0 0 "[ . 1 . 2]" 1 1578 1 77 TYR HA 1 77 TYR QD . . 3.470 3.118 3.045 3.158 . 0 0 "[ . 1 . 2]" 1 1579 1 77 TYR HA 1 78 LYS HB2 . . 4.790 4.169 3.951 4.527 . 0 0 "[ . 1 . 2]" 1 1580 1 77 TYR HA 1 78 LYS QD . . 5.200 4.130 2.832 5.213 0.013 18 0 "[ . 1 . 2]" 1 1581 1 77 TYR HA 1 79 VAL MG2 . . 4.390 3.956 3.760 4.235 . 0 0 "[ . 1 . 2]" 1 1582 1 77 TYR QB 1 78 LYS H . . 4.040 3.702 3.420 3.818 . 0 0 "[ . 1 . 2]" 1 1583 1 77 TYR QB 1 79 VAL MG2 . . 3.610 1.964 1.825 2.104 . 0 0 "[ . 1 . 2]" 1 1584 1 77 TYR QB 1 92 ILE MD . . 3.770 3.110 2.781 3.371 . 0 0 "[ . 1 . 2]" 1 1585 1 77 TYR HB2 1 78 LYS H . . 4.640 3.992 3.607 4.161 . 0 0 "[ . 1 . 2]" 1 1586 1 77 TYR HB2 1 79 VAL MG2 . . 4.170 2.175 1.960 2.568 . 0 0 "[ . 1 . 2]" 1 1587 1 77 TYR HB2 1 92 ILE MD . . 4.630 4.316 3.998 4.633 0.003 9 0 "[ . 1 . 2]" 1 1588 1 77 TYR HB3 1 78 LYS H . . 4.640 4.385 4.231 4.440 . 0 0 "[ . 1 . 2]" 1 1589 1 77 TYR HB3 1 79 VAL MG2 . . 4.170 2.284 2.049 2.558 . 0 0 "[ . 1 . 2]" 1 1590 1 77 TYR HB3 1 92 ILE MD . . 4.630 3.191 2.838 3.463 . 0 0 "[ . 1 . 2]" 1 1591 1 77 TYR QD 1 92 ILE MD . . 4.000 2.683 2.131 3.136 . 0 0 "[ . 1 . 2]" 1 1592 1 77 TYR QD 1 94 PHE HZ . . 3.820 2.968 2.482 3.818 . 0 0 "[ . 1 . 2]" 1 1593 1 77 TYR QE 1 92 ILE MD . . 5.030 3.913 3.177 4.474 . 0 0 "[ . 1 . 2]" 1 1594 1 77 TYR QE 1 94 PHE HZ . . 3.750 2.044 1.997 2.276 . 0 0 "[ . 1 . 2]" 1 1595 1 78 LYS H 1 78 LYS HA . . 2.920 2.296 2.274 2.314 . 0 0 "[ . 1 . 2]" 1 1596 1 78 LYS H 1 78 LYS HB2 . . 4.100 3.341 3.122 3.654 . 0 0 "[ . 1 . 2]" 1 1597 1 78 LYS H 1 78 LYS QD . . 4.360 3.105 2.073 4.370 0.010 7 0 "[ . 1 . 2]" 1 1598 1 78 LYS H 1 78 LYS QG . . 3.740 2.857 2.288 3.442 . 0 0 "[ . 1 . 2]" 1 1599 1 78 LYS H 1 79 VAL H . . 3.480 2.940 2.601 3.132 . 0 0 "[ . 1 . 2]" 1 1600 1 78 LYS H 1 79 VAL MG2 . . 4.900 4.183 3.877 4.492 . 0 0 "[ . 1 . 2]" 1 1601 1 78 LYS HA 1 78 LYS QD . . 4.140 3.279 2.139 4.157 0.017 7 0 "[ . 1 . 2]" 1 1602 1 78 LYS HA 1 78 LYS HG2 . . 3.860 3.172 2.506 3.570 . 0 0 "[ . 1 . 2]" 1 1603 1 78 LYS HA 1 78 LYS QG . . 3.310 2.429 2.147 2.996 . 0 0 "[ . 1 . 2]" 1 1604 1 78 LYS HA 1 78 LYS HG3 . . 3.860 2.739 2.168 3.904 0.044 18 0 "[ . 1 . 2]" 1 1605 1 78 LYS HA 1 79 VAL H . . 3.320 2.772 2.626 2.956 . 0 0 "[ . 1 . 2]" 1 1606 1 78 LYS HB3 1 78 LYS HD2 . . 3.850 3.428 2.645 3.792 . 0 0 "[ . 1 . 2]" 1 1607 1 78 LYS HB3 1 78 LYS QD . . 3.360 2.918 2.157 3.281 . 0 0 "[ . 1 . 2]" 1 1608 1 78 LYS HB3 1 78 LYS HD3 . . 3.850 3.332 2.179 3.688 . 0 0 "[ . 1 . 2]" 1 1609 1 78 LYS HB3 1 78 LYS QE . . 4.880 3.676 2.003 4.431 . 0 0 "[ . 1 . 2]" 1 1610 1 78 LYS QE 1 78 LYS QG . . 3.280 2.230 2.122 2.520 . 0 0 "[ . 1 . 2]" 1 1611 1 79 VAL H 1 79 VAL HB . . 3.390 2.542 2.368 2.737 . 0 0 "[ . 1 . 2]" 1 1612 1 79 VAL H 1 79 VAL MG1 . . 4.150 3.803 3.709 3.895 . 0 0 "[ . 1 . 2]" 1 1613 1 79 VAL H 1 79 VAL MG2 . . 3.650 2.728 2.371 2.965 . 0 0 "[ . 1 . 2]" 1 1614 1 79 VAL H 1 80 SER H . . 4.510 4.206 3.796 4.498 . 0 0 "[ . 1 . 2]" 1 1615 1 79 VAL HA 1 79 VAL MG1 . . 3.070 2.369 2.272 2.478 . 0 0 "[ . 1 . 2]" 1 1616 1 79 VAL HA 1 79 VAL MG2 . . 3.180 2.270 2.146 2.390 . 0 0 "[ . 1 . 2]" 1 1617 1 79 VAL HA 1 80 SER H . . 2.880 2.192 2.140 2.318 . 0 0 "[ . 1 . 2]" 1 1618 1 79 VAL HA 1 80 SER HA . . 4.690 4.437 4.361 4.564 . 0 0 "[ . 1 . 2]" 1 1619 1 79 VAL HA 1 87 GLN HB2 . . 5.150 4.272 3.833 4.678 . 0 0 "[ . 1 . 2]" 1 1620 1 79 VAL HA 1 87 GLN HB3 . . 4.740 3.563 3.166 4.142 . 0 0 "[ . 1 . 2]" 1 1621 1 79 VAL HA 1 87 GLN HE21 . . 4.450 3.732 2.424 4.412 . 0 0 "[ . 1 . 2]" 1 1622 1 79 VAL HA 1 87 GLN QE . . 3.800 3.179 2.370 3.620 . 0 0 "[ . 1 . 2]" 1 1623 1 79 VAL HA 1 87 GLN HE22 . . 4.450 3.676 2.946 4.443 . 0 0 "[ . 1 . 2]" 1 1624 1 79 VAL HB 1 80 SER H . . 4.950 4.337 3.712 4.506 . 0 0 "[ . 1 . 2]" 1 1625 1 79 VAL MG1 1 80 SER H . . 3.790 2.932 1.912 3.542 . 0 0 "[ . 1 . 2]" 1 1626 1 79 VAL MG1 1 80 SER HA . . 5.040 4.220 3.696 4.633 . 0 0 "[ . 1 . 2]" 1 1627 1 79 VAL MG1 1 81 THR MG . . 4.270 3.172 2.793 4.208 . 0 0 "[ . 1 . 2]" 1 1628 1 79 VAL MG1 1 87 GLN HA . . 4.930 4.349 4.133 4.633 . 0 0 "[ . 1 . 2]" 1 1629 1 79 VAL MG1 1 87 GLN HB2 . . 3.930 2.997 2.544 3.305 . 0 0 "[ . 1 . 2]" 1 1630 1 79 VAL MG1 1 87 GLN HB3 . . 3.700 2.475 2.239 2.784 . 0 0 "[ . 1 . 2]" 1 1631 1 79 VAL MG1 1 87 GLN QE . . 4.470 3.848 3.308 4.465 . 0 0 "[ . 1 . 2]" 1 1632 1 79 VAL MG1 1 87 GLN HG2 . . 5.040 4.838 4.560 5.046 0.006 6 0 "[ . 1 . 2]" 1 1633 1 79 VAL MG1 1 87 GLN HG3 . . 5.040 4.388 4.014 4.891 . 0 0 "[ . 1 . 2]" 1 1634 1 79 VAL MG1 1 88 LEU MD2 . . 3.120 2.635 2.191 3.029 . 0 0 "[ . 1 . 2]" 1 1635 1 79 VAL MG1 1 90 THR HB . . 3.630 3.209 2.610 3.581 . 0 0 "[ . 1 . 2]" 1 1636 1 79 VAL MG1 1 90 THR HG1 . . 4.190 3.898 3.454 4.186 . 0 0 "[ . 1 . 2]" 1 1637 1 79 VAL MG1 1 90 THR MG . . 4.140 3.343 2.897 3.694 . 0 0 "[ . 1 . 2]" 1 1638 1 79 VAL MG2 1 80 SER H . . 4.330 4.085 3.835 4.260 . 0 0 "[ . 1 . 2]" 1 1639 1 79 VAL MG2 1 87 GLN HE21 . . 5.200 4.347 3.688 4.940 . 0 0 "[ . 1 . 2]" 1 1640 1 79 VAL MG2 1 87 GLN QE . . 4.510 3.795 3.264 4.274 . 0 0 "[ . 1 . 2]" 1 1641 1 79 VAL MG2 1 87 GLN HE22 . . 5.200 4.201 3.639 4.928 . 0 0 "[ . 1 . 2]" 1 1642 1 79 VAL MG2 1 90 THR HB . . 4.300 3.609 3.303 4.006 . 0 0 "[ . 1 . 2]" 1 1643 1 79 VAL MG2 1 90 THR MG . . 3.340 2.797 2.456 3.217 . 0 0 "[ . 1 . 2]" 1 1644 1 79 VAL MG2 1 102 ARG QH1 . . 3.990 3.253 2.205 3.987 . 0 0 "[ . 1 . 2]" 1 1645 1 80 SER H 1 80 SER HB2 . . 3.790 2.511 2.191 3.262 . 0 0 "[ . 1 . 2]" 1 1646 1 80 SER H 1 80 SER QB . . 3.090 2.369 2.169 2.577 . 0 0 "[ . 1 . 2]" 1 1647 1 80 SER H 1 80 SER HB3 . . 3.790 3.399 2.276 3.627 . 0 0 "[ . 1 . 2]" 1 1648 1 80 SER H 1 81 THR H . . 4.660 4.542 4.287 4.648 . 0 0 "[ . 1 . 2]" 1 1649 1 80 SER H 1 87 GLN HB2 . . 4.140 3.366 2.757 3.997 . 0 0 "[ . 1 . 2]" 1 1650 1 80 SER H 1 87 GLN HB3 . . 4.500 3.545 2.619 4.258 . 0 0 "[ . 1 . 2]" 1 1651 1 80 SER H 1 87 GLN QE . . 4.410 3.402 2.298 4.227 . 0 0 "[ . 1 . 2]" 1 1652 1 80 SER HA 1 81 THR H . . 2.900 2.195 2.139 2.360 . 0 0 "[ . 1 . 2]" 1 1653 1 80 SER HA 1 81 THR MG . . 4.410 3.837 3.509 4.169 . 0 0 "[ . 1 . 2]" 1 1654 1 80 SER HA 1 82 SER H . . 4.270 4.041 3.601 4.270 . 15 0 "[ . 1 . 2]" 1 1655 1 80 SER QB 1 81 THR H . . 3.710 3.183 2.815 3.633 . 0 0 "[ . 1 . 2]" 1 1656 1 80 SER QB 1 82 SER H . . 3.600 2.897 2.491 3.598 . 0 0 "[ . 1 . 2]" 1 1657 1 80 SER QB 1 87 GLN HB2 . . 3.940 2.900 2.032 3.450 . 0 0 "[ . 1 . 2]" 1 1658 1 80 SER QB 1 87 GLN QG . . 4.300 2.653 2.024 3.422 . 0 0 "[ . 1 . 2]" 1 1659 1 80 SER HB2 1 81 THR H . . 4.460 4.150 3.511 4.466 0.006 11 0 "[ . 1 . 2]" 1 1660 1 80 SER HB2 1 82 SER H . . 4.390 3.945 3.680 4.364 . 0 0 "[ . 1 . 2]" 1 1661 1 80 SER HB2 1 85 THR HB . . 4.730 3.748 3.185 4.417 . 0 0 "[ . 1 . 2]" 1 1662 1 80 SER HB2 1 85 THR MG . . 3.850 2.602 1.993 3.677 . 0 0 "[ . 1 . 2]" 1 1663 1 80 SER HB3 1 81 THR H . . 4.460 3.362 2.877 4.045 . 0 0 "[ . 1 . 2]" 1 1664 1 80 SER HB3 1 82 SER H . . 4.390 3.000 2.524 3.993 . 0 0 "[ . 1 . 2]" 1 1665 1 80 SER HB3 1 85 THR HB . . 4.730 3.331 2.729 3.853 . 0 0 "[ . 1 . 2]" 1 1666 1 80 SER HB3 1 85 THR MG . . 3.850 2.536 2.005 3.578 . 0 0 "[ . 1 . 2]" 1 1667 1 81 THR H 1 81 THR MG . . 3.600 2.851 2.174 3.242 . 0 0 "[ . 1 . 2]" 1 1668 1 81 THR H 1 82 SER H . . 3.330 2.872 2.304 3.278 . 0 0 "[ . 1 . 2]" 1 1669 1 81 THR HA 1 81 THR MG . . 3.460 2.326 2.073 3.187 . 0 0 "[ . 1 . 2]" 1 1670 1 81 THR HA 1 85 THR MG . . 4.470 3.717 3.225 4.153 . 0 0 "[ . 1 . 2]" 1 1671 1 81 THR HA 1 88 LEU MD1 . . 3.510 2.235 1.815 2.948 . 0 0 "[ . 1 . 2]" 1 1672 1 81 THR HA 1 88 LEU MD2 . . 4.400 4.104 2.959 4.401 0.001 19 0 "[ . 1 . 2]" 1 1673 1 81 THR HA 1 88 LEU HG . . 4.530 3.708 2.732 4.354 . 0 0 "[ . 1 . 2]" 1 1674 1 81 THR MG 1 88 LEU MD1 . . 3.530 2.795 2.160 3.571 0.041 11 0 "[ . 1 . 2]" 1 1675 1 81 THR MG 1 88 LEU MD2 . . 4.260 3.617 3.095 4.207 . 0 0 "[ . 1 . 2]" 1 1676 1 82 SER H 1 82 SER QB . . 3.240 2.428 2.213 3.027 . 0 0 "[ . 1 . 2]" 1 1677 1 82 SER H 1 85 THR HB . . 4.620 3.939 3.410 4.629 0.009 20 0 "[ . 1 . 2]" 1 1678 1 82 SER H 1 85 THR MG . . 4.200 2.174 1.756 2.642 . 0 0 "[ . 1 . 2]" 1 1679 1 82 SER QB 1 84 LEU H . . 4.350 2.420 2.197 2.951 . 0 0 "[ . 1 . 2]" 1 1680 1 82 SER QB 1 85 THR HB . . 5.060 2.971 1.987 4.969 . 0 0 "[ . 1 . 2]" 1 1681 1 82 SER QB 1 85 THR MG . . 4.180 2.494 1.925 3.905 . 0 0 "[ . 1 . 2]" 1 1682 1 83 PRO HA 1 85 THR H . . 4.910 4.508 3.723 4.919 0.009 18 0 "[ . 1 . 2]" 1 1683 1 83 PRO QB 1 84 LEU QD . . 4.310 3.355 2.045 4.218 . 0 0 "[ . 1 . 2]" 1 1684 1 83 PRO QG 1 84 LEU H . . 4.720 3.062 2.272 3.323 . 0 0 "[ . 1 . 2]" 1 1685 1 83 PRO QG 1 84 LEU QD . . 4.320 2.664 1.864 3.695 . 0 0 "[ . 1 . 2]" 1 1686 1 83 PRO QG 1 84 LEU HG . . 4.490 3.591 2.411 4.498 0.008 3 0 "[ . 1 . 2]" 1 1687 1 83 PRO HG2 1 84 LEU H . . 5.460 3.122 2.289 3.402 . 0 0 "[ . 1 . 2]" 1 1688 1 83 PRO HG3 1 84 LEU H . . 5.460 4.447 3.822 4.661 . 0 0 "[ . 1 . 2]" 1 1689 1 84 LEU H 1 84 LEU MD1 . . 4.690 3.466 2.203 4.362 . 0 0 "[ . 1 . 2]" 1 1690 1 84 LEU H 1 84 LEU MD2 . . 4.690 3.774 2.095 4.435 . 0 0 "[ . 1 . 2]" 1 1691 1 84 LEU H 1 84 LEU HG . . 4.150 3.558 2.675 4.164 0.014 2 0 "[ . 1 . 2]" 1 1692 1 84 LEU H 1 85 THR H . . 3.460 2.451 1.990 3.250 . 0 0 "[ . 1 . 2]" 1 1693 1 84 LEU HA 1 84 LEU MD1 . . 4.030 3.255 2.120 3.971 . 0 0 "[ . 1 . 2]" 1 1694 1 84 LEU HA 1 84 LEU QD . . 2.910 2.366 1.949 2.844 . 0 0 "[ . 1 . 2]" 1 1695 1 84 LEU HA 1 84 LEU MD2 . . 4.030 2.732 2.008 3.731 . 0 0 "[ . 1 . 2]" 1 1696 1 84 LEU HA 1 84 LEU HG . . 3.860 2.879 2.273 3.746 . 0 0 "[ . 1 . 2]" 1 1697 1 84 LEU QB 1 84 LEU QD . . 2.840 1.898 1.749 2.009 . 0 0 "[ . 1 . 2]" 1 1698 1 84 LEU QB 1 85 THR H . . 4.090 2.946 2.412 3.887 . 0 0 "[ . 1 . 2]" 1 1699 1 84 LEU QD 1 85 THR H . . 4.780 4.005 3.710 4.555 . 0 0 "[ . 1 . 2]" 1 1700 1 84 LEU MD1 1 85 THR H . . 5.500 4.502 3.999 5.519 0.019 13 0 "[ . 1 . 2]" 1 1701 1 84 LEU MD2 1 85 THR H . . 5.500 4.589 3.891 4.861 . 0 0 "[ . 1 . 2]" 1 1702 1 85 THR H 1 85 THR HB . . 3.830 2.697 2.376 3.448 . 0 0 "[ . 1 . 2]" 1 1703 1 85 THR H 1 85 THR MG . . 3.400 2.391 1.932 2.764 . 0 0 "[ . 1 . 2]" 1 1704 1 85 THR H 1 86 LYS H . . 4.650 4.556 4.304 4.647 . 0 0 "[ . 1 . 2]" 1 1705 1 85 THR HA 1 85 THR MG . . 3.440 3.190 3.171 3.201 . 0 0 "[ . 1 . 2]" 1 1706 1 85 THR HA 1 86 LYS H . . 2.500 2.405 2.260 2.503 0.003 4 0 "[ . 1 . 2]" 1 1707 1 85 THR HA 1 86 LYS QB . . 5.340 4.403 4.224 4.681 . 0 0 "[ . 1 . 2]" 1 1708 1 85 THR HA 1 86 LYS QD . . 5.500 4.242 2.521 5.475 . 0 0 "[ . 1 . 2]" 1 1709 1 85 THR HA 1 86 LYS QG . . 4.550 3.836 3.137 4.444 . 0 0 "[ . 1 . 2]" 1 1710 1 85 THR HA 1 87 GLN H . . 4.670 4.313 3.804 4.676 0.006 7 0 "[ . 1 . 2]" 1 1711 1 85 THR HB 1 86 LYS H . . 4.830 3.826 3.631 4.112 . 0 0 "[ . 1 . 2]" 1 1712 1 85 THR HB 1 87 GLN H . . 5.080 4.400 3.947 4.680 . 0 0 "[ . 1 . 2]" 1 1713 1 85 THR HB 1 87 GLN HG2 . . 5.500 5.378 5.025 5.543 0.043 15 0 "[ . 1 . 2]" 1 1714 1 85 THR HB 1 87 GLN QG . . 4.640 4.127 3.715 4.631 . 0 0 "[ . 1 . 2]" 1 1715 1 85 THR HB 1 87 GLN HG3 . . 5.500 4.366 3.803 5.261 . 0 0 "[ . 1 . 2]" 1 1716 1 85 THR MG 1 87 GLN H . . 4.200 2.182 1.861 3.163 . 0 0 "[ . 1 . 2]" 1 1717 1 85 THR MG 1 87 GLN HB2 . . 4.080 2.639 2.134 3.367 . 0 0 "[ . 1 . 2]" 1 1718 1 85 THR MG 1 87 GLN QG . . 4.370 2.939 2.242 3.787 . 0 0 "[ . 1 . 2]" 1 1719 1 85 THR MG 1 88 LEU HB2 . . 4.030 3.841 3.433 4.046 0.016 13 0 "[ . 1 . 2]" 1 1720 1 85 THR MG 1 88 LEU MD1 . . 3.730 3.483 2.918 3.739 0.009 9 0 "[ . 1 . 2]" 1 1721 1 86 LYS H 1 86 LYS HG2 . . 4.770 3.503 1.900 4.442 . 0 0 "[ . 1 . 2]" 1 1722 1 86 LYS H 1 86 LYS HG3 . . 4.770 3.650 2.705 4.237 . 0 0 "[ . 1 . 2]" 1 1723 1 86 LYS H 1 87 GLN H . . 3.890 2.797 2.257 3.244 . 0 0 "[ . 1 . 2]" 1 1724 1 86 LYS H 1 87 GLN HG2 . . 4.910 3.561 2.983 3.995 . 0 0 "[ . 1 . 2]" 1 1725 1 86 LYS H 1 87 GLN HG3 . . 4.910 3.828 3.148 4.706 . 0 0 "[ . 1 . 2]" 1 1726 1 86 LYS HA 1 86 LYS QD . . 4.280 3.018 1.984 4.251 . 0 0 "[ . 1 . 2]" 1 1727 1 86 LYS HA 1 86 LYS HG2 . . 3.940 3.116 2.665 3.658 . 0 0 "[ . 1 . 2]" 1 1728 1 86 LYS HA 1 86 LYS QG . . 3.450 2.595 2.291 3.324 . 0 0 "[ . 1 . 2]" 1 1729 1 86 LYS HA 1 86 LYS HG3 . . 3.940 3.172 2.320 3.819 . 0 0 "[ . 1 . 2]" 1 1730 1 86 LYS HA 1 88 LEU H . . 4.100 3.208 3.099 3.399 . 0 0 "[ . 1 . 2]" 1 1731 1 86 LYS QB 1 86 LYS QE . . 4.500 3.214 1.975 3.773 . 0 0 "[ . 1 . 2]" 1 1732 1 86 LYS QB 1 104 PRO QG . . 4.460 3.354 2.921 4.243 . 0 0 "[ . 1 . 2]" 1 1733 1 86 LYS QB 1 112 ALA MB . . 3.240 2.116 1.830 2.617 . 0 0 "[ . 1 . 2]" 1 1734 1 86 LYS HB2 1 112 ALA MB . . 3.830 2.155 1.868 2.675 . 0 0 "[ . 1 . 2]" 1 1735 1 86 LYS HB3 1 112 ALA MB . . 3.830 3.163 2.613 3.835 0.005 18 0 "[ . 1 . 2]" 1 1736 1 86 LYS QE 1 86 LYS QG . . 3.330 2.227 2.042 2.692 . 0 0 "[ . 1 . 2]" 1 1737 1 87 GLN H 1 87 GLN HB2 . . 3.490 2.574 2.364 2.816 . 0 0 "[ . 1 . 2]" 1 1738 1 87 GLN H 1 87 GLN HB3 . . 3.970 3.692 3.609 3.771 . 0 0 "[ . 1 . 2]" 1 1739 1 87 GLN H 1 87 GLN HG2 . . 4.050 3.067 2.748 3.279 . 0 0 "[ . 1 . 2]" 1 1740 1 87 GLN H 1 87 GLN QG . . 3.520 2.674 2.248 2.976 . 0 0 "[ . 1 . 2]" 1 1741 1 87 GLN H 1 87 GLN HG3 . . 4.050 3.152 2.385 3.962 . 0 0 "[ . 1 . 2]" 1 1742 1 87 GLN H 1 88 LEU H . . 3.370 2.716 2.484 3.062 . 0 0 "[ . 1 . 2]" 1 1743 1 87 GLN H 1 88 LEU HG . . 4.720 4.153 3.658 4.420 . 0 0 "[ . 1 . 2]" 1 1744 1 87 GLN HA 1 87 GLN HG2 . . 3.780 2.579 2.423 2.815 . 0 0 "[ . 1 . 2]" 1 1745 1 87 GLN HA 1 87 GLN QG . . 3.300 2.527 2.381 2.742 . 0 0 "[ . 1 . 2]" 1 1746 1 87 GLN HA 1 87 GLN HG3 . . 3.780 3.622 3.504 3.783 0.003 2 0 "[ . 1 . 2]" 1 1747 1 87 GLN HA 1 88 LEU H . . 3.000 2.941 2.827 2.997 . 0 0 "[ . 1 . 2]" 1 1748 1 87 GLN HA 1 88 LEU MD2 . . 5.470 4.953 4.808 5.271 . 0 0 "[ . 1 . 2]" 1 1749 1 87 GLN HA 1 90 THR HG1 . . 4.210 2.983 2.559 3.211 . 0 0 "[ . 1 . 2]" 1 1750 1 87 GLN HA 1 104 PRO HG2 . . 4.140 3.418 3.079 3.893 . 0 0 "[ . 1 . 2]" 1 1751 1 87 GLN HA 1 104 PRO QG . . 3.550 3.180 2.772 3.541 . 0 0 "[ . 1 . 2]" 1 1752 1 87 GLN HA 1 104 PRO HG3 . . 4.140 3.801 3.147 4.138 . 0 0 "[ . 1 . 2]" 1 1753 1 87 GLN HA 1 112 ALA MB . . 4.100 3.436 2.845 3.786 . 0 0 "[ . 1 . 2]" 1 1754 1 87 GLN HB2 1 88 LEU H . . 4.400 4.070 3.992 4.201 . 0 0 "[ . 1 . 2]" 1 1755 1 87 GLN HB2 1 90 THR HG1 . . 5.070 4.801 4.359 5.003 . 0 0 "[ . 1 . 2]" 1 1756 1 87 GLN HB3 1 90 THR HG1 . . 4.110 3.555 3.017 3.852 . 0 0 "[ . 1 . 2]" 1 1757 1 87 GLN HB3 1 112 ALA MB . . 4.890 4.563 3.894 4.890 0.000 4 0 "[ . 1 . 2]" 1 1758 1 87 GLN QE 1 106 ILE MD . . 3.810 2.090 1.853 2.393 . 0 0 "[ . 1 . 2]" 1 1759 1 87 GLN QE 1 106 ILE MG . . 4.560 4.075 3.417 4.493 . 0 0 "[ . 1 . 2]" 1 1760 1 87 GLN HE21 1 106 ILE MD . . 4.340 2.570 2.000 3.170 . 0 0 "[ . 1 . 2]" 1 1761 1 87 GLN HE21 1 106 ILE MG . . 5.210 4.908 4.252 5.217 0.007 2 0 "[ . 1 . 2]" 1 1762 1 87 GLN HE22 1 106 ILE MD . . 4.340 2.347 1.867 2.887 . 0 0 "[ . 1 . 2]" 1 1763 1 87 GLN HE22 1 106 ILE MG . . 5.210 4.366 3.600 4.906 . 0 0 "[ . 1 . 2]" 1 1764 1 87 GLN QG 1 104 PRO QG . . 4.880 3.886 3.360 4.597 . 0 0 "[ . 1 . 2]" 1 1765 1 87 GLN QG 1 106 ILE MD . . 4.000 3.249 2.589 3.846 . 0 0 "[ . 1 . 2]" 1 1766 1 87 GLN HG2 1 106 ILE MD . . 4.650 3.448 2.646 4.321 . 0 0 "[ . 1 . 2]" 1 1767 1 87 GLN HG2 1 112 ALA MB . . 4.070 2.481 2.061 2.832 . 0 0 "[ . 1 . 2]" 1 1768 1 87 GLN HG3 1 106 ILE MD . . 4.650 4.127 3.231 4.628 . 0 0 "[ . 1 . 2]" 1 1769 1 87 GLN HG3 1 112 ALA MB . . 4.070 3.698 3.313 4.076 0.006 18 0 "[ . 1 . 2]" 1 1770 1 88 LEU H 1 88 LEU HB2 . . 3.560 2.833 2.785 2.894 . 0 0 "[ . 1 . 2]" 1 1771 1 88 LEU H 1 88 LEU HB3 . . 3.990 3.850 3.806 3.914 . 0 0 "[ . 1 . 2]" 1 1772 1 88 LEU H 1 88 LEU MD1 . . 4.660 4.490 4.348 4.580 . 0 0 "[ . 1 . 2]" 1 1773 1 88 LEU H 1 88 LEU MD2 . . 4.370 4.155 4.070 4.303 . 0 0 "[ . 1 . 2]" 1 1774 1 88 LEU H 1 88 LEU HG . . 3.720 3.674 3.444 3.733 0.013 5 0 "[ . 1 . 2]" 1 1775 1 88 LEU HB2 1 88 LEU MD1 . . 3.440 2.340 2.226 2.436 . 0 0 "[ . 1 . 2]" 1 1776 1 88 LEU MD2 1 90 THR H . . 4.460 3.555 3.345 3.729 . 0 0 "[ . 1 . 2]" 1 1777 1 88 LEU MD2 1 90 THR HB . . 4.570 3.341 3.008 3.654 . 0 0 "[ . 1 . 2]" 1 1778 1 88 LEU MD2 1 90 THR HG1 . . 4.910 4.087 3.168 4.864 . 0 0 "[ . 1 . 2]" 1 1779 1 89 PRO QB 1 90 THR H . . 3.610 2.175 2.044 2.353 . 0 0 "[ . 1 . 2]" 1 1780 1 89 PRO HB2 1 90 THR H . . 4.120 2.209 2.068 2.404 . 0 0 "[ . 1 . 2]" 1 1781 1 89 PRO HB3 1 90 THR H . . 4.120 3.265 3.206 3.351 . 0 0 "[ . 1 . 2]" 1 1782 1 90 THR H 1 90 THR HB . . 3.730 2.849 2.772 2.917 . 0 0 "[ . 1 . 2]" 1 1783 1 90 THR H 1 90 THR HG1 . . 4.830 4.050 3.417 4.548 . 0 0 "[ . 1 . 2]" 1 1784 1 90 THR H 1 90 THR MG . . 4.550 3.854 3.799 3.933 . 0 0 "[ . 1 . 2]" 1 1785 1 90 THR H 1 91 LEU MD2 . . 4.690 4.563 4.295 4.693 0.003 13 0 "[ . 1 . 2]" 1 1786 1 90 THR HA 1 90 THR HG1 . . 3.930 2.429 2.098 2.697 . 0 0 "[ . 1 . 2]" 1 1787 1 90 THR HA 1 90 THR MG . . 3.670 2.481 2.369 2.557 . 0 0 "[ . 1 . 2]" 1 1788 1 90 THR HA 1 91 LEU H . . 3.200 2.170 2.142 2.314 . 0 0 "[ . 1 . 2]" 1 1789 1 90 THR HA 1 104 PRO HD2 . . 3.920 3.159 2.744 3.618 . 0 0 "[ . 1 . 2]" 1 1790 1 90 THR HA 1 104 PRO QD . . 3.400 2.962 2.677 3.314 . 0 0 "[ . 1 . 2]" 1 1791 1 90 THR HA 1 104 PRO HD3 . . 3.920 3.633 3.246 3.895 . 0 0 "[ . 1 . 2]" 1 1792 1 90 THR HA 1 117 PHE QE . . 4.650 3.767 3.325 4.403 . 0 0 "[ . 1 . 2]" 1 1793 1 90 THR HA 1 117 PHE HZ . . 4.270 3.010 2.265 3.677 . 0 0 "[ . 1 . 2]" 1 1794 1 90 THR HB 1 91 LEU H . . 4.930 4.261 3.920 4.396 . 0 0 "[ . 1 . 2]" 1 1795 1 90 THR HG1 1 91 LEU H . . 4.740 4.183 3.775 4.634 . 0 0 "[ . 1 . 2]" 1 1796 1 90 THR HG1 1 104 PRO QD . . 4.400 2.674 2.109 3.693 . 0 0 "[ . 1 . 2]" 1 1797 1 90 THR MG 1 91 LEU H . . 3.600 2.513 1.943 2.866 . 0 0 "[ . 1 . 2]" 1 1798 1 90 THR MG 1 91 LEU HA . . 4.480 3.584 3.152 3.858 . 0 0 "[ . 1 . 2]" 1 1799 1 90 THR MG 1 92 ILE H . . 4.340 4.080 3.328 4.343 0.003 4 0 "[ . 1 . 2]" 1 1800 1 90 THR MG 1 92 ILE HB . . 4.450 4.246 4.023 4.436 . 0 0 "[ . 1 . 2]" 1 1801 1 90 THR MG 1 92 ILE MD . . 3.460 2.461 2.091 2.778 . 0 0 "[ . 1 . 2]" 1 1802 1 90 THR MG 1 92 ILE HG12 . . 3.610 3.222 2.878 3.598 . 0 0 "[ . 1 . 2]" 1 1803 1 90 THR MG 1 92 ILE QG . . 3.100 2.239 2.103 2.428 . 0 0 "[ . 1 . 2]" 1 1804 1 90 THR MG 1 92 ILE HG13 . . 3.610 2.286 2.133 2.468 . 0 0 "[ . 1 . 2]" 1 1805 1 90 THR MG 1 92 ILE MG . . 4.570 4.449 4.321 4.569 . 0 0 "[ . 1 . 2]" 1 1806 1 90 THR MG 1 102 ARG HA . . 4.750 4.430 3.988 4.706 . 0 0 "[ . 1 . 2]" 1 1807 1 90 THR MG 1 102 ARG HB2 . . 4.860 3.363 3.167 3.581 . 0 0 "[ . 1 . 2]" 1 1808 1 90 THR MG 1 102 ARG QB . . 4.000 3.285 3.084 3.493 . 0 0 "[ . 1 . 2]" 1 1809 1 90 THR MG 1 102 ARG HB3 . . 4.860 4.617 4.244 4.863 0.003 16 0 "[ . 1 . 2]" 1 1810 1 90 THR MG 1 102 ARG QD . . 4.100 3.781 3.366 4.122 0.022 9 0 "[ . 1 . 2]" 1 1811 1 90 THR MG 1 102 ARG QH1 . . 4.420 3.738 1.666 4.419 . 0 0 "[ . 1 . 2]" 1 1812 1 90 THR MG 1 103 ARG H . . 4.190 3.457 3.115 4.004 . 0 0 "[ . 1 . 2]" 1 1813 1 90 THR MG 1 104 PRO HD2 . . 4.730 3.436 3.074 3.603 . 0 0 "[ . 1 . 2]" 1 1814 1 90 THR MG 1 104 PRO QD . . 4.060 3.341 2.986 3.496 . 0 0 "[ . 1 . 2]" 1 1815 1 90 THR MG 1 104 PRO HD3 . . 4.730 4.568 4.057 4.730 0.000 12 0 "[ . 1 . 2]" 1 1816 1 91 LEU H 1 91 LEU HB2 . . 4.170 2.383 2.294 2.616 . 0 0 "[ . 1 . 2]" 1 1817 1 91 LEU H 1 91 LEU QB . . 3.540 2.351 2.267 2.563 . 0 0 "[ . 1 . 2]" 1 1818 1 91 LEU H 1 91 LEU HB3 . . 4.170 3.597 3.541 3.676 . 0 0 "[ . 1 . 2]" 1 1819 1 91 LEU H 1 91 LEU MD1 . . 5.100 4.121 3.910 4.564 . 0 0 "[ . 1 . 2]" 1 1820 1 91 LEU H 1 91 LEU MD2 . . 4.860 4.027 3.828 4.189 . 0 0 "[ . 1 . 2]" 1 1821 1 91 LEU H 1 91 LEU HG . . 4.370 3.331 3.007 3.806 . 0 0 "[ . 1 . 2]" 1 1822 1 91 LEU H 1 103 ARG H . . 4.050 3.294 2.990 3.948 . 0 0 "[ . 1 . 2]" 1 1823 1 91 LEU H 1 103 ARG QB . . 5.190 3.642 2.774 3.937 . 0 0 "[ . 1 . 2]" 1 1824 1 91 LEU H 1 104 PRO HD2 . . 4.750 4.229 3.743 4.603 . 0 0 "[ . 1 . 2]" 1 1825 1 91 LEU H 1 104 PRO HD3 . . 4.750 4.493 4.077 4.751 0.001 20 0 "[ . 1 . 2]" 1 1826 1 91 LEU H 1 117 PHE QE . . 4.450 3.646 3.069 4.327 . 0 0 "[ . 1 . 2]" 1 1827 1 91 LEU H 1 117 PHE HZ . . 4.770 3.621 3.096 4.462 . 0 0 "[ . 1 . 2]" 1 1828 1 91 LEU HA 1 91 LEU MD1 . . 4.170 3.811 3.742 3.860 . 0 0 "[ . 1 . 2]" 1 1829 1 91 LEU HA 1 91 LEU MD2 . . 3.330 2.071 1.938 2.205 . 0 0 "[ . 1 . 2]" 1 1830 1 91 LEU HA 1 92 ILE H . . 3.140 2.169 2.139 2.205 . 0 0 "[ . 1 . 2]" 1 1831 1 91 LEU QB 1 91 LEU MD2 . . 3.220 2.260 2.186 2.365 . 0 0 "[ . 1 . 2]" 1 1832 1 91 LEU QB 1 92 ILE H . . 4.330 3.150 2.943 3.530 . 0 0 "[ . 1 . 2]" 1 1833 1 91 LEU QB 1 103 ARG H . . 4.750 3.530 2.814 4.293 . 0 0 "[ . 1 . 2]" 1 1834 1 91 LEU QB 1 126 PHE HZ . . 3.650 2.188 1.859 2.859 . 0 0 "[ . 1 . 2]" 1 1835 1 91 LEU HB2 1 91 LEU MD1 . . 3.630 2.334 2.163 2.491 . 0 0 "[ . 1 . 2]" 1 1836 1 91 LEU HB2 1 126 PHE HZ . . 4.180 2.633 2.052 3.361 . 0 0 "[ . 1 . 2]" 1 1837 1 91 LEU HB3 1 91 LEU MD1 . . 3.630 2.319 2.142 2.477 . 0 0 "[ . 1 . 2]" 1 1838 1 91 LEU HB3 1 126 PHE HZ . . 4.180 2.367 1.999 3.095 . 0 0 "[ . 1 . 2]" 1 1839 1 91 LEU MD1 1 92 ILE H . . 5.100 4.860 4.521 5.100 . 15 0 "[ . 1 . 2]" 1 1840 1 91 LEU MD1 1 115 TRP HZ3 . . 4.460 3.431 2.611 3.951 . 0 0 "[ . 1 . 2]" 1 1841 1 91 LEU MD1 1 117 PHE QD . . 3.900 3.347 2.554 3.880 . 0 0 "[ . 1 . 2]" 1 1842 1 91 LEU MD1 1 117 PHE QE . . 3.940 2.997 2.291 3.487 . 0 0 "[ . 1 . 2]" 1 1843 1 91 LEU MD1 1 122 VAL HA . . 4.920 4.249 3.880 4.869 . 0 0 "[ . 1 . 2]" 1 1844 1 91 LEU MD1 1 122 VAL MG2 . . 3.160 2.476 2.203 2.864 . 0 0 "[ . 1 . 2]" 1 1845 1 91 LEU MD1 1 126 PHE QE . . 3.860 2.631 1.948 3.162 . 0 0 "[ . 1 . 2]" 1 1846 1 91 LEU MD1 1 126 PHE HZ . . 5.410 3.438 2.923 4.123 . 0 0 "[ . 1 . 2]" 1 1847 1 91 LEU MD2 1 92 ILE H . . 4.100 3.035 2.699 3.266 . 0 0 "[ . 1 . 2]" 1 1848 1 91 LEU MD2 1 122 VAL MG2 . . 4.840 4.572 4.286 4.835 . 0 0 "[ . 1 . 2]" 1 1849 1 91 LEU MD2 1 126 PHE QE . . 5.280 4.234 3.647 4.653 . 0 0 "[ . 1 . 2]" 1 1850 1 91 LEU HG 1 117 PHE QE . . 3.880 2.876 2.052 3.610 . 0 0 "[ . 1 . 2]" 1 1851 1 92 ILE H 1 92 ILE HB . . 3.880 2.751 2.597 2.829 . 0 0 "[ . 1 . 2]" 1 1852 1 92 ILE H 1 92 ILE HG12 . . 4.600 4.159 3.911 4.481 . 0 0 "[ . 1 . 2]" 1 1853 1 92 ILE H 1 92 ILE QG . . 3.730 2.942 2.693 3.207 . 0 0 "[ . 1 . 2]" 1 1854 1 92 ILE H 1 92 ILE HG13 . . 4.600 3.009 2.738 3.285 . 0 0 "[ . 1 . 2]" 1 1855 1 92 ILE H 1 92 ILE MG . . 4.610 3.881 3.826 3.912 . 0 0 "[ . 1 . 2]" 1 1856 1 92 ILE HA 1 92 ILE MG . . 3.520 2.395 2.287 2.443 . 0 0 "[ . 1 . 2]" 1 1857 1 92 ILE HA 1 93 LEU H . . 3.290 2.171 2.145 2.249 . 0 0 "[ . 1 . 2]" 1 1858 1 92 ILE HA 1 102 ARG HA . . 3.570 2.337 2.161 2.592 . 0 0 "[ . 1 . 2]" 1 1859 1 92 ILE HA 1 102 ARG QB . . 4.530 3.197 2.715 3.779 . 0 0 "[ . 1 . 2]" 1 1860 1 92 ILE HA 1 103 ARG H . . 4.550 3.612 3.198 3.827 . 0 0 "[ . 1 . 2]" 1 1861 1 92 ILE HA 1 126 PHE QE . . 4.900 3.210 2.604 3.804 . 0 0 "[ . 1 . 2]" 1 1862 1 92 ILE HB 1 92 ILE MD . . 3.480 2.348 2.236 2.463 . 0 0 "[ . 1 . 2]" 1 1863 1 92 ILE HB 1 94 PHE QD . . 4.450 4.252 3.866 4.433 . 0 0 "[ . 1 . 2]" 1 1864 1 92 ILE HB 1 94 PHE QE . . 3.870 2.977 2.519 3.426 . 0 0 "[ . 1 . 2]" 1 1865 1 92 ILE HB 1 94 PHE HZ . . 5.360 3.849 3.017 4.773 . 0 0 "[ . 1 . 2]" 1 1866 1 92 ILE MD 1 92 ILE MG . . 3.600 2.107 1.944 2.275 . 0 0 "[ . 1 . 2]" 1 1867 1 92 ILE MD 1 93 LEU H . . 5.200 5.056 4.853 5.192 . 0 0 "[ . 1 . 2]" 1 1868 1 92 ILE MD 1 94 PHE QE . . 4.150 3.557 3.020 3.850 . 0 0 "[ . 1 . 2]" 1 1869 1 92 ILE MD 1 94 PHE HZ . . 4.310 3.236 2.619 3.829 . 0 0 "[ . 1 . 2]" 1 1870 1 92 ILE MD 1 102 ARG HA . . 4.850 4.485 3.696 4.851 0.001 18 0 "[ . 1 . 2]" 1 1871 1 92 ILE MD 1 102 ARG HB2 . . 4.490 3.295 2.720 3.775 . 0 0 "[ . 1 . 2]" 1 1872 1 92 ILE MD 1 102 ARG QB . . 3.910 2.994 2.489 3.298 . 0 0 "[ . 1 . 2]" 1 1873 1 92 ILE MD 1 102 ARG HB3 . . 4.490 3.454 2.860 3.818 . 0 0 "[ . 1 . 2]" 1 1874 1 92 ILE MD 1 102 ARG HE . . 4.440 4.034 3.573 4.445 0.005 9 0 "[ . 1 . 2]" 1 1875 1 92 ILE QG 1 102 ARG HA . . 3.970 2.862 2.092 3.296 . 0 0 "[ . 1 . 2]" 1 1876 1 92 ILE QG 1 102 ARG QB . . 3.650 1.966 1.768 2.482 . 0 0 "[ . 1 . 2]" 1 1877 1 92 ILE QG 1 103 ARG H . . 4.260 3.513 2.601 3.964 . 0 0 "[ . 1 . 2]" 1 1878 1 92 ILE HG12 1 102 ARG HA . . 4.530 2.959 2.108 3.480 . 0 0 "[ . 1 . 2]" 1 1879 1 92 ILE HG13 1 102 ARG HA . . 4.530 3.904 3.442 4.525 . 0 0 "[ . 1 . 2]" 1 1880 1 92 ILE MG 1 93 LEU H . . 3.490 2.331 1.959 2.683 . 0 0 "[ . 1 . 2]" 1 1881 1 92 ILE MG 1 94 PHE H . . 4.950 4.124 3.720 4.402 . 0 0 "[ . 1 . 2]" 1 1882 1 92 ILE MG 1 94 PHE HA . . 4.780 3.983 3.738 4.117 . 0 0 "[ . 1 . 2]" 1 1883 1 92 ILE MG 1 94 PHE QD . . 4.350 3.403 3.076 3.648 . 0 0 "[ . 1 . 2]" 1 1884 1 92 ILE MG 1 94 PHE QE . . 3.890 2.802 2.456 3.144 . 0 0 "[ . 1 . 2]" 1 1885 1 92 ILE MG 1 94 PHE HZ . . 4.080 2.874 2.313 3.369 . 0 0 "[ . 1 . 2]" 1 1886 1 92 ILE MG 1 99 GLU HA . . 3.900 3.272 3.016 3.470 . 0 0 "[ . 1 . 2]" 1 1887 1 92 ILE MG 1 99 GLU HB2 . . 4.710 3.467 2.771 4.195 . 0 0 "[ . 1 . 2]" 1 1888 1 92 ILE MG 1 99 GLU QB . . 3.930 3.336 2.711 3.908 . 0 0 "[ . 1 . 2]" 1 1889 1 92 ILE MG 1 99 GLU HB3 . . 4.710 4.395 3.844 4.710 0.000 19 0 "[ . 1 . 2]" 1 1890 1 92 ILE MG 1 99 GLU HG2 . . 3.830 3.084 1.845 3.807 . 0 0 "[ . 1 . 2]" 1 1891 1 92 ILE MG 1 99 GLU QG . . 3.130 2.111 1.805 2.610 . 0 0 "[ . 1 . 2]" 1 1892 1 92 ILE MG 1 99 GLU HG3 . . 3.830 2.227 1.934 3.087 . 0 0 "[ . 1 . 2]" 1 1893 1 92 ILE MG 1 100 ALA H . . 4.370 4.089 3.687 4.356 . 0 0 "[ . 1 . 2]" 1 1894 1 92 ILE MG 1 101 MET H . . 4.140 3.607 3.298 3.895 . 0 0 "[ . 1 . 2]" 1 1895 1 92 ILE MG 1 101 MET QG . . 5.340 4.412 3.929 4.775 . 0 0 "[ . 1 . 2]" 1 1896 1 92 ILE MG 1 102 ARG HA . . 4.350 3.444 2.378 3.894 . 0 0 "[ . 1 . 2]" 1 1897 1 92 ILE MG 1 102 ARG QB . . 3.690 2.647 2.345 3.061 . 0 0 "[ . 1 . 2]" 1 1898 1 93 LEU H 1 93 LEU HB2 . . 3.620 2.729 2.468 2.916 . 0 0 "[ . 1 . 2]" 1 1899 1 93 LEU H 1 93 LEU HB3 . . 3.630 2.588 2.508 2.787 . 0 0 "[ . 1 . 2]" 1 1900 1 93 LEU H 1 93 LEU MD1 . . 4.650 4.220 3.901 4.328 . 0 0 "[ . 1 . 2]" 1 1901 1 93 LEU H 1 93 LEU MD2 . . 4.910 4.302 4.239 4.369 . 0 0 "[ . 1 . 2]" 1 1902 1 93 LEU H 1 93 LEU HG . . 4.550 4.504 4.466 4.581 0.031 20 0 "[ . 1 . 2]" 1 1903 1 93 LEU H 1 101 MET H . . 3.940 3.199 3.045 3.339 . 0 0 "[ . 1 . 2]" 1 1904 1 93 LEU H 1 101 MET HG2 . . 4.570 3.888 3.276 4.570 . 7 0 "[ . 1 . 2]" 1 1905 1 93 LEU H 1 101 MET QG . . 3.980 3.044 2.779 3.383 . 0 0 "[ . 1 . 2]" 1 1906 1 93 LEU H 1 101 MET HG3 . . 4.570 3.239 2.805 3.609 . 0 0 "[ . 1 . 2]" 1 1907 1 93 LEU H 1 102 ARG HA . . 4.210 3.492 3.258 3.890 . 0 0 "[ . 1 . 2]" 1 1908 1 93 LEU H 1 126 PHE QE . . 4.420 2.835 2.495 3.167 . 0 0 "[ . 1 . 2]" 1 1909 1 93 LEU HA 1 93 LEU MD1 . . 3.360 2.379 2.079 2.629 . 0 0 "[ . 1 . 2]" 1 1910 1 93 LEU HA 1 93 LEU MD2 . . 4.380 3.901 3.838 3.921 . 0 0 "[ . 1 . 2]" 1 1911 1 93 LEU HA 1 93 LEU HG . . 3.930 2.804 2.678 2.893 . 0 0 "[ . 1 . 2]" 1 1912 1 93 LEU HA 1 94 PHE H . . 3.290 2.146 2.139 2.167 . 0 0 "[ . 1 . 2]" 1 1913 1 93 LEU HA 1 94 PHE HB2 . . 4.940 4.486 4.337 4.659 . 0 0 "[ . 1 . 2]" 1 1914 1 93 LEU HA 1 94 PHE QD . . 4.360 3.993 3.609 4.272 . 0 0 "[ . 1 . 2]" 1 1915 1 93 LEU HA 1 126 PHE QD . . 4.740 4.413 3.914 4.740 . 0 0 "[ . 1 . 2]" 1 1916 1 93 LEU HB2 1 93 LEU MD1 . . 3.190 2.163 2.007 2.316 . 0 0 "[ . 1 . 2]" 1 1917 1 93 LEU HB2 1 101 MET H . . 4.730 4.490 4.188 4.730 0.000 19 0 "[ . 1 . 2]" 1 1918 1 93 LEU HB2 1 101 MET ME . . 4.480 4.275 3.707 4.479 . 0 0 "[ . 1 . 2]" 1 1919 1 93 LEU HB2 1 101 MET HG2 . . 4.400 3.446 2.766 3.857 . 0 0 "[ . 1 . 2]" 1 1920 1 93 LEU HB2 1 101 MET QG . . 3.650 2.979 2.538 3.352 . 0 0 "[ . 1 . 2]" 1 1921 1 93 LEU HB2 1 101 MET HG3 . . 4.400 3.323 2.767 3.768 . 0 0 "[ . 1 . 2]" 1 1922 1 93 LEU HB2 1 126 PHE QD . . 3.380 2.198 2.012 2.394 . 0 0 "[ . 1 . 2]" 1 1923 1 93 LEU HB2 1 126 PHE QE . . 3.870 2.482 2.005 2.906 . 0 0 "[ . 1 . 2]" 1 1924 1 93 LEU HB3 1 93 LEU MD1 . . 3.650 3.145 3.110 3.180 . 0 0 "[ . 1 . 2]" 1 1925 1 93 LEU HB3 1 93 LEU MD2 . . 3.310 2.133 1.980 2.248 . 0 0 "[ . 1 . 2]" 1 1926 1 93 LEU HB3 1 100 ALA MB . . 3.760 2.843 2.254 3.313 . 0 0 "[ . 1 . 2]" 1 1927 1 93 LEU HB3 1 101 MET H . . 3.830 3.016 2.590 3.209 . 0 0 "[ . 1 . 2]" 1 1928 1 93 LEU HB3 1 101 MET HG2 . . 4.230 2.589 2.005 3.411 . 0 0 "[ . 1 . 2]" 1 1929 1 93 LEU HB3 1 101 MET QG . . 3.680 2.297 1.986 2.698 . 0 0 "[ . 1 . 2]" 1 1930 1 93 LEU HB3 1 101 MET HG3 . . 4.230 2.980 2.018 3.421 . 0 0 "[ . 1 . 2]" 1 1931 1 93 LEU HB3 1 126 PHE QD . . 3.780 3.487 3.020 3.782 0.002 15 0 "[ . 1 . 2]" 1 1932 1 93 LEU HB3 1 126 PHE QE . . 4.480 3.548 2.654 4.275 . 0 0 "[ . 1 . 2]" 1 1933 1 93 LEU MD1 1 94 PHE H . . 3.820 3.327 3.081 3.640 . 0 0 "[ . 1 . 2]" 1 1934 1 93 LEU MD1 1 95 GLN HG2 . . 5.090 4.239 3.640 5.003 . 0 0 "[ . 1 . 2]" 1 1935 1 93 LEU MD1 1 95 GLN QG . . 4.350 3.651 3.258 4.413 0.063 20 0 "[ . 1 . 2]" 1 1936 1 93 LEU MD1 1 95 GLN HG3 . . 5.090 4.097 3.417 4.906 . 0 0 "[ . 1 . 2]" 1 1937 1 93 LEU MD1 1 101 MET QG . . 5.340 4.198 3.947 4.449 . 0 0 "[ . 1 . 2]" 1 1938 1 93 LEU MD1 1 126 PHE HA . . 4.880 4.389 3.612 4.837 . 0 0 "[ . 1 . 2]" 1 1939 1 93 LEU MD1 1 126 PHE HB2 . . 4.700 4.515 3.911 4.701 0.001 18 0 "[ . 1 . 2]" 1 1940 1 93 LEU MD1 1 126 PHE QB . . 3.920 3.027 2.315 3.277 . 0 0 "[ . 1 . 2]" 1 1941 1 93 LEU MD1 1 126 PHE HB3 . . 4.700 3.077 2.332 3.345 . 0 0 "[ . 1 . 2]" 1 1942 1 93 LEU MD1 1 126 PHE QD . . 3.350 2.541 1.907 3.096 . 0 0 "[ . 1 . 2]" 1 1943 1 93 LEU MD1 1 126 PHE QE . . 4.450 3.800 3.328 4.283 . 0 0 "[ . 1 . 2]" 1 1944 1 93 LEU MD2 1 95 GLN QB . . 4.800 3.836 3.170 4.343 . 0 0 "[ . 1 . 2]" 1 1945 1 93 LEU MD2 1 95 GLN QE . . 3.780 2.434 1.828 3.138 . 0 0 "[ . 1 . 2]" 1 1946 1 93 LEU MD2 1 95 GLN HG2 . . 4.100 3.318 2.320 4.026 . 0 0 "[ . 1 . 2]" 1 1947 1 93 LEU MD2 1 95 GLN QG . . 3.440 2.465 1.980 3.070 . 0 0 "[ . 1 . 2]" 1 1948 1 93 LEU MD2 1 95 GLN HG3 . . 4.100 2.597 2.008 3.889 . 0 0 "[ . 1 . 2]" 1 1949 1 93 LEU MD2 1 100 ALA HA . . 5.470 5.174 4.579 5.469 . 0 0 "[ . 1 . 2]" 1 1950 1 93 LEU MD2 1 100 ALA MB . . 3.110 2.529 1.917 2.750 . 0 0 "[ . 1 . 2]" 1 1951 1 93 LEU MD2 1 101 MET H . . 4.320 4.084 3.698 4.319 . 0 0 "[ . 1 . 2]" 1 1952 1 93 LEU MD2 1 101 MET QB . . 5.340 4.227 3.697 4.680 . 0 0 "[ . 1 . 2]" 1 1953 1 93 LEU MD2 1 101 MET HG2 . . 3.930 2.830 2.573 3.192 . 0 0 "[ . 1 . 2]" 1 1954 1 93 LEU MD2 1 101 MET QG . . 3.360 2.712 2.521 2.899 . 0 0 "[ . 1 . 2]" 1 1955 1 93 LEU MD2 1 101 MET HG3 . . 3.930 3.673 3.076 3.922 . 0 0 "[ . 1 . 2]" 1 1956 1 93 LEU MD2 1 126 PHE HA . . 4.900 3.696 2.779 4.126 . 0 0 "[ . 1 . 2]" 1 1957 1 93 LEU MD2 1 126 PHE QB . . 5.310 3.605 2.976 4.012 . 0 0 "[ . 1 . 2]" 1 1958 1 93 LEU MD2 1 126 PHE QD . . 4.350 2.867 2.165 3.368 . 0 0 "[ . 1 . 2]" 1 1959 1 93 LEU HG 1 94 PHE H . . 3.970 2.977 2.607 3.332 . 0 0 "[ . 1 . 2]" 1 1960 1 93 LEU HG 1 95 GLN QE . . 4.510 3.815 1.863 4.489 . 0 0 "[ . 1 . 2]" 1 1961 1 93 LEU HG 1 95 GLN QG . . 4.120 2.699 2.156 3.562 . 0 0 "[ . 1 . 2]" 1 1962 1 93 LEU HG 1 126 PHE QD . . 5.160 4.571 4.122 4.907 . 0 0 "[ . 1 . 2]" 1 1963 1 94 PHE H 1 94 PHE HB2 . . 3.880 2.456 2.325 2.586 . 0 0 "[ . 1 . 2]" 1 1964 1 94 PHE H 1 94 PHE QD . . 3.780 2.903 2.550 3.281 . 0 0 "[ . 1 . 2]" 1 1965 1 94 PHE HA 1 94 PHE QD . . 3.850 2.752 2.589 2.943 . 0 0 "[ . 1 . 2]" 1 1966 1 94 PHE HA 1 95 GLN H . . 3.050 2.146 2.139 2.173 . 0 0 "[ . 1 . 2]" 1 1967 1 94 PHE HA 1 98 LYS H . . 4.470 4.038 3.565 4.465 . 0 0 "[ . 1 . 2]" 1 1968 1 94 PHE HA 1 99 GLU HA . . 3.710 3.012 2.484 3.287 . 0 0 "[ . 1 . 2]" 1 1969 1 94 PHE HA 1 100 ALA H . . 3.850 2.970 2.560 3.424 . 0 0 "[ . 1 . 2]" 1 1970 1 94 PHE HA 1 100 ALA MB . . 4.190 3.748 3.309 4.173 . 0 0 "[ . 1 . 2]" 1 1971 1 94 PHE HB2 1 95 GLN H . . 4.700 4.377 4.277 4.490 . 0 0 "[ . 1 . 2]" 1 1972 1 94 PHE HB3 1 95 GLN H . . 4.130 3.546 3.235 3.803 . 0 0 "[ . 1 . 2]" 1 1973 1 94 PHE HB3 1 98 LYS H . . 4.590 3.784 3.228 4.254 . 0 0 "[ . 1 . 2]" 1 1974 1 94 PHE QD 1 95 GLN H . . 4.370 4.097 3.648 4.370 . 12 0 "[ . 1 . 2]" 1 1975 1 94 PHE QD 1 98 LYS H . . 4.540 3.656 2.874 4.504 . 0 0 "[ . 1 . 2]" 1 1976 1 94 PHE QD 1 98 LYS HA . . 4.080 3.859 3.430 4.075 . 0 0 "[ . 1 . 2]" 1 1977 1 94 PHE QD 1 99 GLU HA . . 4.070 3.194 2.622 3.681 . 0 0 "[ . 1 . 2]" 1 1978 1 94 PHE QD 1 99 GLU QB . . 4.910 3.929 3.364 4.381 . 0 0 "[ . 1 . 2]" 1 1979 1 94 PHE QE 1 99 GLU H . . 5.500 4.392 3.422 5.479 . 0 0 "[ . 1 . 2]" 1 1980 1 95 GLN H 1 95 GLN QB . . 3.530 2.470 2.325 2.662 . 0 0 "[ . 1 . 2]" 1 1981 1 95 GLN H 1 95 GLN QG . . 4.360 3.268 2.956 3.777 . 0 0 "[ . 1 . 2]" 1 1982 1 95 GLN H 1 98 LYS H . . 3.630 3.271 2.800 3.555 . 0 0 "[ . 1 . 2]" 1 1983 1 95 GLN H 1 99 GLU HA . . 4.370 4.098 3.564 4.351 . 0 0 "[ . 1 . 2]" 1 1984 1 95 GLN H 1 100 ALA H . . 4.690 3.179 2.662 3.558 . 0 0 "[ . 1 . 2]" 1 1985 1 95 GLN H 1 100 ALA MB . . 3.940 3.073 2.339 3.638 . 0 0 "[ . 1 . 2]" 1 1986 1 95 GLN HA 1 95 GLN HG2 . . 4.140 2.456 2.183 3.720 . 0 0 "[ . 1 . 2]" 1 1987 1 95 GLN HA 1 95 GLN QG . . 3.490 2.321 2.147 2.566 . 0 0 "[ . 1 . 2]" 1 1988 1 95 GLN HA 1 95 GLN HG3 . . 4.140 3.194 2.580 3.716 . 0 0 "[ . 1 . 2]" 1 1989 1 95 GLN HA 1 96 GLY H . . 2.500 2.281 2.155 2.478 . 0 0 "[ . 1 . 2]" 1 1990 1 95 GLN HA 1 96 GLY HA2 . . 4.670 4.392 4.354 4.469 . 0 0 "[ . 1 . 2]" 1 1991 1 95 GLN HA 1 97 GLY H . . 4.540 4.161 3.671 4.538 . 0 0 "[ . 1 . 2]" 1 1992 1 95 GLN QB 1 95 GLN QE . . 3.990 3.360 2.588 3.620 . 0 0 "[ . 1 . 2]" 1 1993 1 95 GLN QB 1 96 GLY H . . 4.200 3.757 3.563 3.903 . 0 0 "[ . 1 . 2]" 1 1994 1 95 GLN QB 1 96 GLY HA3 . . 5.340 4.178 4.071 4.281 . 0 0 "[ . 1 . 2]" 1 1995 1 95 GLN QB 1 100 ALA MB . . 3.540 2.475 2.088 2.822 . 0 0 "[ . 1 . 2]" 1 1996 1 95 GLN HB2 1 100 ALA MB . . 4.070 2.504 2.101 2.878 . 0 0 "[ . 1 . 2]" 1 1997 1 95 GLN HB3 1 100 ALA MB . . 4.070 3.905 3.600 4.094 0.024 20 0 "[ . 1 . 2]" 1 1998 1 95 GLN QE 1 95 GLN QG . . 3.080 2.151 2.070 2.254 . 0 0 "[ . 1 . 2]" 1 1999 1 95 GLN QE 1 131 LEU MD1 . . 4.350 3.390 2.557 4.159 . 0 0 "[ . 1 . 2]" 1 2000 1 95 GLN HE21 1 131 LEU MD2 . . 3.910 2.482 1.808 3.557 . 0 0 "[ . 1 . 2]" 1 2001 1 95 GLN HE22 1 131 LEU MD2 . . 3.910 2.563 1.853 3.901 . 0 0 "[ . 1 . 2]" 1 2002 1 95 GLN QG 1 96 GLY H . . 4.840 4.350 3.961 4.617 . 0 0 "[ . 1 . 2]" 1 2003 1 95 GLN QG 1 100 ALA MB . . 4.230 2.921 2.042 3.761 . 0 0 "[ . 1 . 2]" 1 2004 1 96 GLY H 1 97 GLY H . . 2.700 2.323 2.094 2.561 . 0 0 "[ . 1 . 2]" 1 2005 1 96 GLY HA3 1 98 LYS H . . 4.320 3.926 3.569 4.321 0.001 9 0 "[ . 1 . 2]" 1 2006 1 97 GLY H 1 98 LYS H . . 3.390 2.634 2.282 2.829 . 0 0 "[ . 1 . 2]" 1 2007 1 97 GLY QA 1 98 LYS QG . . 5.340 3.992 3.388 5.064 . 0 0 "[ . 1 . 2]" 1 2008 1 98 LYS H 1 98 LYS HB2 . . 4.090 3.114 2.342 4.005 . 0 0 "[ . 1 . 2]" 1 2009 1 98 LYS H 1 98 LYS QB . . 3.330 2.790 2.313 3.246 . 0 0 "[ . 1 . 2]" 1 2010 1 98 LYS H 1 98 LYS HB3 . . 4.090 3.580 3.030 3.854 . 0 0 "[ . 1 . 2]" 1 2011 1 98 LYS H 1 98 LYS QD . . 4.530 3.689 2.004 4.523 . 0 0 "[ . 1 . 2]" 1 2012 1 98 LYS H 1 98 LYS QE . . 4.730 4.316 3.201 4.731 0.001 2 0 "[ . 1 . 2]" 1 2013 1 98 LYS H 1 98 LYS QG . . 3.560 2.856 2.316 3.558 . 0 0 "[ . 1 . 2]" 1 2014 1 98 LYS H 1 99 GLU H . . 4.780 4.407 4.157 4.579 . 0 0 "[ . 1 . 2]" 1 2015 1 98 LYS HA 1 98 LYS QD . . 4.640 3.747 2.067 4.417 . 0 0 "[ . 1 . 2]" 1 2016 1 98 LYS HA 1 98 LYS QG . . 3.780 2.861 2.215 3.396 . 0 0 "[ . 1 . 2]" 1 2017 1 98 LYS HA 1 99 GLU H . . 3.240 2.322 2.151 2.637 . 0 0 "[ . 1 . 2]" 1 2018 1 98 LYS QB 1 99 GLU H . . 3.410 2.669 2.101 3.207 . 0 0 "[ . 1 . 2]" 1 2019 1 98 LYS HB2 1 99 GLU H . . 4.270 3.381 2.114 4.269 . 0 0 "[ . 1 . 2]" 1 2020 1 98 LYS HB3 1 99 GLU H . . 4.270 3.227 2.140 4.129 . 0 0 "[ . 1 . 2]" 1 2021 1 98 LYS QG 1 99 GLU H . . 4.460 3.881 2.835 4.435 . 0 0 "[ . 1 . 2]" 1 2022 1 99 GLU H 1 99 GLU HB2 . . 3.890 2.711 2.287 3.046 . 0 0 "[ . 1 . 2]" 1 2023 1 99 GLU H 1 99 GLU QB . . 3.170 2.274 2.188 2.417 . 0 0 "[ . 1 . 2]" 1 2024 1 99 GLU H 1 99 GLU HB3 . . 3.890 2.488 2.316 2.819 . 0 0 "[ . 1 . 2]" 1 2025 1 99 GLU HA 1 99 GLU QG . . 3.680 2.477 2.361 2.623 . 0 0 "[ . 1 . 2]" 1 2026 1 99 GLU HA 1 100 ALA H . . 3.180 2.213 2.140 2.311 . 0 0 "[ . 1 . 2]" 1 2027 1 99 GLU HA 1 100 ALA MB . . 4.080 4.020 3.942 4.096 0.016 18 0 "[ . 1 . 2]" 1 2028 1 99 GLU HA 1 101 MET H . . 4.010 3.831 3.633 4.013 0.003 2 0 "[ . 1 . 2]" 1 2029 1 99 GLU QG 1 100 ALA H . . 3.890 3.439 3.001 3.727 . 0 0 "[ . 1 . 2]" 1 2030 1 99 GLU HG2 1 100 ALA H . . 4.740 3.803 3.037 4.465 . 0 0 "[ . 1 . 2]" 1 2031 1 99 GLU HG2 1 101 MET H . . 4.520 3.430 2.388 4.239 . 0 0 "[ . 1 . 2]" 1 2032 1 99 GLU HG3 1 100 ALA H . . 4.740 4.205 3.681 4.734 . 0 0 "[ . 1 . 2]" 1 2033 1 99 GLU HG3 1 101 MET H . . 4.520 3.975 3.330 4.519 . 0 0 "[ . 1 . 2]" 1 2034 1 100 ALA H 1 100 ALA MB . . 3.210 2.162 2.041 2.278 . 0 0 "[ . 1 . 2]" 1 2035 1 100 ALA H 1 101 MET H . . 3.210 2.640 2.219 3.009 . 0 0 "[ . 1 . 2]" 1 2036 1 100 ALA MB 1 101 MET H . . 3.410 2.519 2.242 2.783 . 0 0 "[ . 1 . 2]" 1 2037 1 100 ALA MB 1 101 MET QB . . 3.610 3.382 3.150 3.614 0.004 14 0 "[ . 1 . 2]" 1 2038 1 100 ALA MB 1 101 MET QG . . 4.030 2.898 2.525 3.536 . 0 0 "[ . 1 . 2]" 1 2039 1 101 MET H 1 101 MET HG2 . . 4.710 2.983 2.305 4.232 . 0 0 "[ . 1 . 2]" 1 2040 1 101 MET H 1 101 MET QG . . 3.960 2.607 2.267 2.961 . 0 0 "[ . 1 . 2]" 1 2041 1 101 MET H 1 101 MET HG3 . . 4.710 3.262 2.444 3.763 . 0 0 "[ . 1 . 2]" 1 2042 1 101 MET H 1 102 ARG H . . 4.840 4.361 4.293 4.400 . 0 0 "[ . 1 . 2]" 1 2043 1 101 MET QB 1 101 MET ME . . 3.050 2.527 1.951 3.002 . 0 0 "[ . 1 . 2]" 1 2044 1 101 MET QB 1 102 ARG H . . 3.270 2.452 2.058 2.711 . 0 0 "[ . 1 . 2]" 1 2045 1 101 MET HB2 1 102 ARG H . . 4.060 2.483 2.072 2.762 . 0 0 "[ . 1 . 2]" 1 2046 1 101 MET HB3 1 102 ARG H . . 4.060 3.826 3.541 3.994 . 0 0 "[ . 1 . 2]" 1 2047 1 101 MET ME 1 101 MET QG . . 3.540 2.196 1.991 2.458 . 0 0 "[ . 1 . 2]" 1 2048 1 101 MET ME 1 102 ARG H . . 4.140 3.829 3.309 4.150 0.010 19 0 "[ . 1 . 2]" 1 2049 1 101 MET ME 1 103 ARG QB . . 4.980 3.824 2.393 4.848 . 0 0 "[ . 1 . 2]" 1 2050 1 101 MET ME 1 103 ARG QD . . 4.970 3.051 1.918 4.663 . 0 0 "[ . 1 . 2]" 1 2051 1 101 MET ME 1 103 ARG HE . . 4.110 3.108 1.848 4.107 . 0 0 "[ . 1 . 2]" 1 2052 1 101 MET ME 1 103 ARG HG2 . . 4.400 3.139 1.956 4.021 . 0 0 "[ . 1 . 2]" 1 2053 1 101 MET ME 1 103 ARG QG . . 3.690 2.841 1.867 3.690 . 0 0 "[ . 1 . 2]" 1 2054 1 101 MET ME 1 103 ARG HG3 . . 4.400 3.344 2.015 4.404 0.004 18 0 "[ . 1 . 2]" 1 2055 1 101 MET ME 1 125 GLU HA . . 4.350 3.926 3.464 4.364 0.014 19 0 "[ . 1 . 2]" 1 2056 1 101 MET ME 1 125 GLU QB . . 3.670 2.522 2.041 3.547 . 0 0 "[ . 1 . 2]" 1 2057 1 101 MET ME 1 126 PHE H . . 4.850 3.593 2.795 4.454 . 0 0 "[ . 1 . 2]" 1 2058 1 101 MET ME 1 126 PHE HA . . 3.530 2.572 1.967 3.425 . 0 0 "[ . 1 . 2]" 1 2059 1 101 MET ME 1 126 PHE QD . . 3.890 2.936 2.524 3.315 . 0 0 "[ . 1 . 2]" 1 2060 1 101 MET ME 1 126 PHE QE . . 3.670 3.016 2.479 3.513 . 0 0 "[ . 1 . 2]" 1 2061 1 101 MET QG 1 102 ARG H . . 4.270 3.524 3.168 3.835 . 0 0 "[ . 1 . 2]" 1 2062 1 101 MET QG 1 126 PHE QD . . 4.730 3.252 2.598 3.838 . 0 0 "[ . 1 . 2]" 1 2063 1 101 MET QG 1 126 PHE QE . . 3.950 2.781 1.965 3.717 . 0 0 "[ . 1 . 2]" 1 2064 1 101 MET HG2 1 102 ARG H . . 4.850 4.583 4.244 4.841 . 0 0 "[ . 1 . 2]" 1 2065 1 101 MET HG2 1 126 PHE QE . . 4.510 3.899 2.888 4.508 . 0 0 "[ . 1 . 2]" 1 2066 1 101 MET HG3 1 102 ARG H . . 4.850 3.674 3.250 4.072 . 0 0 "[ . 1 . 2]" 1 2067 1 101 MET HG3 1 126 PHE QE . . 4.510 2.862 1.999 3.959 . 0 0 "[ . 1 . 2]" 1 2068 1 102 ARG H 1 102 ARG HG2 . . 4.090 3.119 2.512 4.086 . 0 0 "[ . 1 . 2]" 1 2069 1 102 ARG H 1 102 ARG QG . . 3.510 2.587 2.379 2.774 . 0 0 "[ . 1 . 2]" 1 2070 1 102 ARG H 1 102 ARG HG3 . . 4.090 2.881 2.399 3.205 . 0 0 "[ . 1 . 2]" 1 2071 1 102 ARG H 1 126 PHE QE . . 5.500 5.227 4.737 5.501 0.001 18 0 "[ . 1 . 2]" 1 2072 1 102 ARG HA 1 103 ARG H . . 3.410 2.235 2.145 2.386 . 0 0 "[ . 1 . 2]" 1 2073 1 102 ARG HA 1 126 PHE QE . . 4.590 3.730 3.174 4.516 . 0 0 "[ . 1 . 2]" 1 2074 1 102 ARG QB 1 102 ARG HE . . 3.990 2.557 2.121 3.523 . 0 0 "[ . 1 . 2]" 1 2075 1 102 ARG QB 1 103 ARG H . . 3.610 2.885 2.474 3.237 . 0 0 "[ . 1 . 2]" 1 2076 1 102 ARG HB2 1 102 ARG HE . . 4.800 3.038 2.135 3.691 . 0 0 "[ . 1 . 2]" 1 2077 1 102 ARG HB2 1 103 ARG H . . 4.270 2.954 2.504 3.369 . 0 0 "[ . 1 . 2]" 1 2078 1 102 ARG HB3 1 102 ARG HE . . 4.800 3.218 2.478 4.458 . 0 0 "[ . 1 . 2]" 1 2079 1 102 ARG HB3 1 103 ARG H . . 4.270 4.085 3.854 4.279 0.009 14 0 "[ . 1 . 2]" 1 2080 1 102 ARG QD 1 105 GLN HA . . 4.330 3.189 1.926 4.343 0.013 18 0 "[ . 1 . 2]" 1 2081 1 102 ARG QD 1 106 ILE H . . 4.590 3.185 2.127 4.125 . 0 0 "[ . 1 . 2]" 1 2082 1 102 ARG QD 1 106 ILE MD . . 4.210 3.657 3.146 4.201 . 0 0 "[ . 1 . 2]" 1 2083 1 102 ARG QD 1 106 ILE HG12 . . 4.570 2.625 1.987 3.204 . 0 0 "[ . 1 . 2]" 1 2084 1 102 ARG QD 1 106 ILE HG13 . . 4.400 3.635 2.841 4.383 . 0 0 "[ . 1 . 2]" 1 2085 1 102 ARG HD2 1 102 ARG QH1 . . 3.890 2.399 1.956 3.313 . 0 0 "[ . 1 . 2]" 1 2086 1 102 ARG HD2 1 106 ILE MD . . 5.070 4.176 3.497 4.853 . 0 0 "[ . 1 . 2]" 1 2087 1 102 ARG HD3 1 102 ARG QH1 . . 3.890 2.215 1.773 3.418 . 0 0 "[ . 1 . 2]" 1 2088 1 102 ARG HD3 1 106 ILE MD . . 5.070 4.211 3.367 4.962 . 0 0 "[ . 1 . 2]" 1 2089 1 102 ARG QG 1 105 GLN HA . . 3.580 2.768 2.067 3.376 . 0 0 "[ . 1 . 2]" 1 2090 1 102 ARG HG2 1 105 GLN HA . . 4.440 4.153 3.405 4.459 0.019 9 0 "[ . 1 . 2]" 1 2091 1 102 ARG HG3 1 105 GLN HA . . 4.440 2.816 2.085 3.495 . 0 0 "[ . 1 . 2]" 1 2092 1 102 ARG QH1 1 106 ILE MD . . 4.280 3.453 2.438 4.180 . 0 0 "[ . 1 . 2]" 1 2093 1 103 ARG H 1 103 ARG QG . . 4.680 3.430 2.801 4.322 . 0 0 "[ . 1 . 2]" 1 2094 1 103 ARG H 1 126 PHE QE . . 4.390 4.172 3.727 4.411 0.021 19 0 "[ . 1 . 2]" 1 2095 1 103 ARG H 1 126 PHE HZ . . 4.010 3.124 2.629 3.678 . 0 0 "[ . 1 . 2]" 1 2096 1 103 ARG HA 1 103 ARG HD2 . . 4.350 3.157 2.009 3.886 . 0 0 "[ . 1 . 2]" 1 2097 1 103 ARG HA 1 103 ARG QD . . 3.570 2.512 1.992 3.634 0.064 6 0 "[ . 1 . 2]" 1 2098 1 103 ARG HA 1 103 ARG HD3 . . 4.350 3.122 2.046 4.371 0.021 6 0 "[ . 1 . 2]" 1 2099 1 103 ARG HA 1 104 PRO HA . . 3.560 2.131 1.976 2.248 . 0 0 "[ . 1 . 2]" 1 2100 1 103 ARG HA 1 104 PRO HB2 . . 4.560 4.282 4.245 4.325 . 0 0 "[ . 1 . 2]" 1 2101 1 103 ARG HA 1 104 PRO HB3 . . 4.520 4.290 4.172 4.381 . 0 0 "[ . 1 . 2]" 1 2102 1 103 ARG HA 1 105 GLN H . . 3.950 2.945 2.457 3.420 . 0 0 "[ . 1 . 2]" 1 2103 1 103 ARG QB 1 104 PRO HA . . 4.320 2.667 2.179 3.622 . 0 0 "[ . 1 . 2]" 1 2104 1 103 ARG QB 1 126 PHE QE . . 4.390 2.882 2.322 3.599 . 0 0 "[ . 1 . 2]" 1 2105 1 103 ARG QB 1 126 PHE HZ . . 4.220 2.664 1.949 3.575 . 0 0 "[ . 1 . 2]" 1 2106 1 103 ARG QD 1 104 PRO HA . . 4.420 3.136 2.172 4.466 0.046 12 0 "[ . 1 . 2]" 1 2107 1 103 ARG QG 1 126 PHE HZ . . 4.600 3.454 2.384 4.316 . 0 0 "[ . 1 . 2]" 1 2108 1 103 ARG HG2 1 126 PHE QE . . 4.430 3.640 2.676 4.437 0.007 6 0 "[ . 1 . 2]" 1 2109 1 103 ARG HG3 1 126 PHE QE . . 4.430 3.611 1.996 4.432 0.002 20 0 "[ . 1 . 2]" 1 2110 1 104 PRO HA 1 105 GLN H . . 3.340 2.308 2.172 2.505 . 0 0 "[ . 1 . 2]" 1 2111 1 104 PRO HA 1 115 TRP QB . . 4.390 3.096 2.523 3.515 . 0 0 "[ . 1 . 2]" 1 2112 1 104 PRO HB2 1 105 GLN H . . 3.700 2.902 2.361 3.389 . 0 0 "[ . 1 . 2]" 1 2113 1 104 PRO HB2 1 106 ILE MD . . 5.300 4.103 3.429 4.873 . 0 0 "[ . 1 . 2]" 1 2114 1 104 PRO HB2 1 112 ALA MB . . 3.740 2.807 2.043 3.335 . 0 0 "[ . 1 . 2]" 1 2115 1 104 PRO HB2 1 113 VAL H . . 4.090 2.952 2.540 3.343 . 0 0 "[ . 1 . 2]" 1 2116 1 104 PRO HB2 1 114 SER HA . . 5.500 5.150 4.549 5.495 . 0 0 "[ . 1 . 2]" 1 2117 1 104 PRO HB2 1 115 TRP H . . 4.840 4.418 3.882 4.835 . 0 0 "[ . 1 . 2]" 1 2118 1 104 PRO HB3 1 105 GLN H . . 4.030 3.618 3.332 3.905 . 0 0 "[ . 1 . 2]" 1 2119 1 104 PRO HB3 1 112 ALA MB . . 4.130 3.738 3.145 4.122 . 0 0 "[ . 1 . 2]" 1 2120 1 104 PRO HB3 1 113 VAL H . . 4.790 4.442 4.095 4.792 0.002 13 0 "[ . 1 . 2]" 1 2121 1 104 PRO HB3 1 114 SER HA . . 4.910 4.604 3.879 4.918 0.008 6 0 "[ . 1 . 2]" 1 2122 1 104 PRO HB3 1 115 TRP QB . . 4.620 2.494 1.932 3.234 . 0 0 "[ . 1 . 2]" 1 2123 1 104 PRO HB3 1 117 PHE QE . . 4.770 3.874 2.979 4.706 . 0 0 "[ . 1 . 2]" 1 2124 1 104 PRO QD 1 112 ALA MB . . 4.230 3.764 3.463 4.005 . 0 0 "[ . 1 . 2]" 1 2125 1 104 PRO QD 1 117 PHE QE . . 3.820 2.616 2.071 3.261 . 0 0 "[ . 1 . 2]" 1 2126 1 104 PRO QD 1 117 PHE HZ . . 3.650 2.243 1.974 2.638 . 0 0 "[ . 1 . 2]" 1 2127 1 104 PRO HD2 1 112 ALA MB . . 4.910 4.051 3.692 4.322 . 0 0 "[ . 1 . 2]" 1 2128 1 104 PRO HD2 1 117 PHE QE . . 4.560 4.158 3.702 4.588 0.028 19 0 "[ . 1 . 2]" 1 2129 1 104 PRO HD3 1 112 ALA MB . . 4.910 4.475 4.190 4.774 . 0 0 "[ . 1 . 2]" 1 2130 1 104 PRO HD3 1 117 PHE QE . . 4.560 2.647 2.081 3.340 . 0 0 "[ . 1 . 2]" 1 2131 1 104 PRO QG 1 112 ALA MB . . 3.070 2.078 1.892 2.381 . 0 0 "[ . 1 . 2]" 1 2132 1 104 PRO QG 1 114 SER HA . . 5.350 4.877 4.421 5.356 0.006 19 0 "[ . 1 . 2]" 1 2133 1 104 PRO HG2 1 112 ALA MB . . 3.650 2.193 1.953 2.572 . 0 0 "[ . 1 . 2]" 1 2134 1 104 PRO HG3 1 112 ALA MB . . 3.650 2.624 2.273 3.070 . 0 0 "[ . 1 . 2]" 1 2135 1 105 GLN H 1 105 GLN HB2 . . 3.940 2.684 2.211 3.625 . 0 0 "[ . 1 . 2]" 1 2136 1 105 GLN H 1 105 GLN QB . . 3.390 2.319 2.189 2.724 . 0 0 "[ . 1 . 2]" 1 2137 1 105 GLN H 1 105 GLN HB3 . . 3.940 2.778 2.332 3.516 . 0 0 "[ . 1 . 2]" 1 2138 1 105 GLN H 1 105 GLN QG . . 4.470 3.568 2.215 4.117 . 0 0 "[ . 1 . 2]" 1 2139 1 105 GLN H 1 106 ILE H . . 4.840 4.575 4.436 4.625 . 0 0 "[ . 1 . 2]" 1 2140 1 105 GLN H 1 113 VAL HB . . 5.220 3.452 2.971 4.196 . 0 0 "[ . 1 . 2]" 1 2141 1 105 GLN H 1 113 VAL QG . . 4.350 3.853 3.594 4.342 . 0 0 "[ . 1 . 2]" 1 2142 1 105 GLN HA 1 105 GLN QG . . 3.570 2.599 2.196 3.439 . 0 0 "[ . 1 . 2]" 1 2143 1 105 GLN HA 1 106 ILE H . . 2.970 2.231 2.162 2.376 . 0 0 "[ . 1 . 2]" 1 2144 1 105 GLN HA 1 106 ILE HB . . 4.980 4.802 4.681 4.909 . 0 0 "[ . 1 . 2]" 1 2145 1 105 GLN HA 1 106 ILE MD . . 4.250 3.961 3.416 4.249 . 0 0 "[ . 1 . 2]" 1 2146 1 105 GLN HA 1 106 ILE HG12 . . 4.700 3.492 3.335 3.651 . 0 0 "[ . 1 . 2]" 1 2147 1 105 GLN HA 1 106 ILE HG13 . . 5.360 5.235 5.093 5.346 . 0 0 "[ . 1 . 2]" 1 2148 1 105 GLN QB 1 113 VAL QG . . 3.660 3.340 2.832 3.656 . 0 0 "[ . 1 . 2]" 1 2149 1 105 GLN QG 1 106 ILE H . . 4.280 2.943 2.032 4.191 . 0 0 "[ . 1 . 2]" 1 2150 1 106 ILE H 1 106 ILE HB . . 3.380 2.629 2.524 2.724 . 0 0 "[ . 1 . 2]" 1 2151 1 106 ILE H 1 106 ILE MD . . 4.260 3.272 2.728 3.519 . 0 0 "[ . 1 . 2]" 1 2152 1 106 ILE H 1 106 ILE HG12 . . 3.750 2.235 2.040 2.437 . 0 0 "[ . 1 . 2]" 1 2153 1 106 ILE H 1 106 ILE HG13 . . 3.840 3.703 3.506 3.844 0.004 19 0 "[ . 1 . 2]" 1 2154 1 106 ILE H 1 106 ILE MG . . 4.240 3.813 3.794 3.844 . 0 0 "[ . 1 . 2]" 1 2155 1 106 ILE H 1 107 ASP H . . 4.520 4.499 4.388 4.590 0.070 13 0 "[ . 1 . 2]" 1 2156 1 106 ILE HA 1 106 ILE MD . . 3.500 2.164 2.053 2.308 . 0 0 "[ . 1 . 2]" 1 2157 1 106 ILE HA 1 106 ILE MG . . 3.360 2.255 2.121 2.389 . 0 0 "[ . 1 . 2]" 1 2158 1 106 ILE HA 1 107 ASP H . . 3.080 2.175 2.139 2.374 . 0 0 "[ . 1 . 2]" 1 2159 1 106 ILE HA 1 111 ARG H . . 4.530 4.038 3.694 4.450 . 0 0 "[ . 1 . 2]" 1 2160 1 106 ILE HA 1 113 VAL QG . . 4.110 3.576 3.139 3.797 . 0 0 "[ . 1 . 2]" 1 2161 1 106 ILE HB 1 106 ILE MD . . 3.490 3.222 3.207 3.230 . 0 0 "[ . 1 . 2]" 1 2162 1 106 ILE HB 1 107 ASP H . . 4.290 4.017 3.538 4.253 . 0 0 "[ . 1 . 2]" 1 2163 1 106 ILE HB 1 110 GLY HA2 . . 5.110 4.511 4.195 4.941 . 0 0 "[ . 1 . 2]" 1 2164 1 106 ILE MD 1 107 ASP H . . 4.350 3.752 3.508 3.969 . 0 0 "[ . 1 . 2]" 1 2165 1 106 ILE MD 1 110 GLY HA2 . . 4.670 4.149 2.500 4.658 . 0 0 "[ . 1 . 2]" 1 2166 1 106 ILE MD 1 111 ARG HA . . 4.810 3.867 3.190 4.414 . 0 0 "[ . 1 . 2]" 1 2167 1 106 ILE MD 1 112 ALA MB . . 3.610 2.581 2.084 3.155 . 0 0 "[ . 1 . 2]" 1 2168 1 106 ILE MD 1 113 VAL H . . 4.640 3.741 3.203 4.456 . 0 0 "[ . 1 . 2]" 1 2169 1 106 ILE HG12 1 106 ILE MG . . 3.430 3.192 3.181 3.201 . 0 0 "[ . 1 . 2]" 1 2170 1 106 ILE HG13 1 106 ILE MG . . 3.590 2.335 2.212 2.468 . 0 0 "[ . 1 . 2]" 1 2171 1 106 ILE MG 1 107 ASP H . . 3.620 2.422 1.859 2.776 . 0 0 "[ . 1 . 2]" 1 2172 1 106 ILE MG 1 110 GLY H . . 3.950 2.951 1.750 3.509 . 0 0 "[ . 1 . 2]" 1 2173 1 106 ILE MG 1 110 GLY HA2 . . 3.260 2.084 1.865 2.397 . 0 0 "[ . 1 . 2]" 1 2174 1 106 ILE MG 1 110 GLY HA3 . . 3.660 3.412 3.151 3.659 . 0 0 "[ . 1 . 2]" 1 2175 1 106 ILE MG 1 111 ARG H . . 4.210 2.465 1.937 2.873 . 0 0 "[ . 1 . 2]" 1 2176 1 106 ILE MG 1 111 ARG HA . . 4.440 3.666 3.197 4.136 . 0 0 "[ . 1 . 2]" 1 2177 1 106 ILE MG 1 111 ARG QB . . 4.920 4.198 3.625 4.730 . 0 0 "[ . 1 . 2]" 1 2178 1 106 ILE MG 1 112 ALA H . . 4.960 4.337 3.680 4.743 . 0 0 "[ . 1 . 2]" 1 2179 1 106 ILE MG 1 112 ALA MB . . 4.610 4.355 3.802 4.615 0.005 13 0 "[ . 1 . 2]" 1 2180 1 106 ILE MG 1 113 VAL H . . 5.120 4.926 4.623 5.114 . 0 0 "[ . 1 . 2]" 1 2181 1 107 ASP H 1 107 ASP QB . . 3.550 2.360 2.218 2.856 . 0 0 "[ . 1 . 2]" 1 2182 1 107 ASP H 1 110 GLY H . . 4.850 3.967 3.432 4.774 . 0 0 "[ . 1 . 2]" 1 2183 1 107 ASP H 1 111 ARG H . . 3.820 2.935 2.287 3.714 . 0 0 "[ . 1 . 2]" 1 2184 1 107 ASP H 1 113 VAL QG . . 4.010 3.333 2.608 3.883 . 0 0 "[ . 1 . 2]" 1 2185 1 107 ASP QB 1 109 LYS H . . 4.730 3.203 2.448 3.927 . 0 0 "[ . 1 . 2]" 1 2186 1 107 ASP QB 1 113 VAL QG . . 3.690 2.828 2.232 3.536 . 0 0 "[ . 1 . 2]" 1 2187 1 107 ASP HB2 1 108 LYS H . . 4.600 3.729 1.996 4.605 0.005 15 0 "[ . 1 . 2]" 1 2188 1 107 ASP HB3 1 108 LYS H . . 4.600 3.409 1.897 4.646 0.046 6 0 "[ . 1 . 2]" 1 2189 1 108 LYS H 1 108 LYS QG . . 4.630 3.454 2.177 4.294 . 0 0 "[ . 1 . 2]" 1 2190 1 108 LYS HA 1 108 LYS QD . . 4.180 3.502 2.109 4.183 0.003 11 0 "[ . 1 . 2]" 1 2191 1 108 LYS HA 1 108 LYS QG . . 3.460 2.533 2.134 3.443 . 0 0 "[ . 1 . 2]" 1 2192 1 108 LYS HA 1 110 GLY H . . 4.660 4.259 3.483 4.650 . 0 0 "[ . 1 . 2]" 1 2193 1 108 LYS QB 1 109 LYS H . . 4.670 2.777 1.852 3.843 . 0 0 "[ . 1 . 2]" 1 2194 1 108 LYS QE 1 108 LYS QG . . 3.340 2.276 2.080 2.668 . 0 0 "[ . 1 . 2]" 1 2195 1 108 LYS QG 1 109 LYS H . . 4.460 3.824 2.357 4.467 0.007 6 0 "[ . 1 . 2]" 1 2196 1 109 LYS H 1 109 LYS QB . . 3.320 2.340 2.166 2.729 . 0 0 "[ . 1 . 2]" 1 2197 1 109 LYS H 1 109 LYS HG2 . . 4.200 3.532 2.288 4.196 . 0 0 "[ . 1 . 2]" 1 2198 1 109 LYS H 1 109 LYS HG3 . . 4.200 3.344 2.208 4.338 0.138 19 0 "[ . 1 . 2]" 1 2199 1 109 LYS H 1 111 ARG H . . 4.760 4.091 3.318 4.726 . 0 0 "[ . 1 . 2]" 1 2200 1 109 LYS HA 1 109 LYS QE . . 5.020 4.127 2.028 4.824 . 0 0 "[ . 1 . 2]" 1 2201 1 109 LYS HA 1 109 LYS HG2 . . 3.690 2.796 2.202 3.784 0.094 19 0 "[ . 1 . 2]" 1 2202 1 109 LYS HA 1 109 LYS QG . . 3.220 2.405 2.154 3.280 0.060 15 0 "[ . 1 . 2]" 1 2203 1 109 LYS HA 1 109 LYS HG3 . . 3.690 3.065 2.200 3.719 0.029 5 0 "[ . 1 . 2]" 1 2204 1 109 LYS HA 1 110 GLY HA3 . . 5.070 4.496 4.300 4.548 . 0 0 "[ . 1 . 2]" 1 2205 1 109 LYS QB 1 109 LYS QD . . 3.130 2.212 2.051 2.466 . 0 0 "[ . 1 . 2]" 1 2206 1 109 LYS QB 1 110 GLY H . . 4.200 2.934 2.436 3.894 . 0 0 "[ . 1 . 2]" 1 2207 1 109 LYS QB 1 111 ARG H . . 4.180 3.538 2.780 4.182 0.002 15 0 "[ . 1 . 2]" 1 2208 1 110 GLY H 1 111 ARG H . . 3.290 2.273 1.842 3.123 . 0 0 "[ . 1 . 2]" 1 2209 1 110 GLY HA3 1 111 ARG HA . . 5.450 4.539 4.434 4.594 . 0 0 "[ . 1 . 2]" 1 2210 1 111 ARG H 1 111 ARG HB2 . . 4.010 2.985 2.289 3.875 . 0 0 "[ . 1 . 2]" 1 2211 1 111 ARG H 1 111 ARG QB . . 3.200 2.649 2.263 3.043 . 0 0 "[ . 1 . 2]" 1 2212 1 111 ARG H 1 111 ARG HB3 . . 4.010 3.468 2.917 3.879 . 0 0 "[ . 1 . 2]" 1 2213 1 111 ARG H 1 111 ARG QD . . 4.710 4.127 1.884 4.703 . 0 0 "[ . 1 . 2]" 1 2214 1 111 ARG H 1 111 ARG QG . . 3.490 2.919 2.172 3.428 . 0 0 "[ . 1 . 2]" 1 2215 1 111 ARG HA 1 111 ARG QD . . 4.450 3.451 2.006 4.454 0.004 9 0 "[ . 1 . 2]" 1 2216 1 111 ARG HA 1 111 ARG QG . . 3.480 2.810 2.312 3.429 . 0 0 "[ . 1 . 2]" 1 2217 1 111 ARG HA 1 112 ALA H . . 2.950 2.251 2.146 2.460 . 0 0 "[ . 1 . 2]" 1 2218 1 111 ARG HA 1 112 ALA MB . . 4.930 3.984 3.928 4.051 . 0 0 "[ . 1 . 2]" 1 2219 1 111 ARG QB 1 111 ARG QD . . 3.310 2.238 2.067 2.519 . 0 0 "[ . 1 . 2]" 1 2220 1 111 ARG QB 1 112 ALA H . . 3.520 2.849 2.279 3.223 . 0 0 "[ . 1 . 2]" 1 2221 1 111 ARG HB2 1 112 ALA H . . 4.250 3.629 2.550 4.289 0.039 13 0 "[ . 1 . 2]" 1 2222 1 111 ARG HB3 1 112 ALA H . . 4.250 3.337 2.309 4.166 . 0 0 "[ . 1 . 2]" 1 2223 1 111 ARG QG 1 112 ALA H . . 4.370 3.984 3.474 4.373 0.003 2 0 "[ . 1 . 2]" 1 2224 1 112 ALA H 1 112 ALA MB . . 3.140 2.224 2.072 2.307 . 0 0 "[ . 1 . 2]" 1 2225 1 112 ALA HA 1 113 VAL HB . . 4.790 4.634 4.586 4.710 . 0 0 "[ . 1 . 2]" 1 2226 1 112 ALA MB 1 113 VAL H . . 3.620 3.238 2.952 3.402 . 0 0 "[ . 1 . 2]" 1 2227 1 112 ALA MB 1 113 VAL HA . . 5.280 4.478 4.332 4.539 . 0 0 "[ . 1 . 2]" 1 2228 1 112 ALA MB 1 113 VAL QG . . 4.650 4.317 4.196 4.421 . 0 0 "[ . 1 . 2]" 1 2229 1 113 VAL H 1 113 VAL HB . . 3.410 2.537 2.481 2.596 . 0 0 "[ . 1 . 2]" 1 2230 1 113 VAL H 1 113 VAL MG1 . . 4.040 3.766 3.761 3.785 . 0 0 "[ . 1 . 2]" 1 2231 1 113 VAL H 1 113 VAL QG . . 3.170 2.174 1.972 2.392 . 0 0 "[ . 1 . 2]" 1 2232 1 113 VAL H 1 113 VAL MG2 . . 4.040 2.189 1.979 2.419 . 0 0 "[ . 1 . 2]" 1 2233 1 113 VAL HA 1 113 VAL MG1 . . 3.280 2.407 2.302 2.456 . 0 0 "[ . 1 . 2]" 1 2234 1 113 VAL HA 1 113 VAL MG2 . . 3.280 2.357 2.253 2.453 . 0 0 "[ . 1 . 2]" 1 2235 1 113 VAL HA 1 114 SER H . . 3.000 2.170 2.141 2.220 . 0 0 "[ . 1 . 2]" 1 2236 1 113 VAL QG 1 114 SER H . . 3.540 2.385 1.914 2.878 . 0 0 "[ . 1 . 2]" 1 2237 1 113 VAL QG 1 114 SER QB . . 4.430 3.629 3.299 4.044 . 0 0 "[ . 1 . 2]" 1 2238 1 113 VAL MG1 1 114 SER H . . 4.230 2.408 1.918 2.940 . 0 0 "[ . 1 . 2]" 1 2239 1 113 VAL MG2 1 114 SER H . . 4.230 4.003 3.897 4.094 . 0 0 "[ . 1 . 2]" 1 2240 1 114 SER H 1 114 SER HB2 . . 3.630 2.878 2.249 3.593 . 0 0 "[ . 1 . 2]" 1 2241 1 114 SER H 1 114 SER QB . . 3.100 2.406 2.173 2.574 . 0 0 "[ . 1 . 2]" 1 2242 1 114 SER H 1 114 SER HB3 . . 3.630 2.906 2.318 3.607 . 0 0 "[ . 1 . 2]" 1 2243 1 114 SER HA 1 115 TRP H . . 2.810 2.192 2.149 2.288 . 0 0 "[ . 1 . 2]" 1 2244 1 114 SER HA 1 115 TRP QB . . 5.240 4.222 4.158 4.308 . 0 0 "[ . 1 . 2]" 1 2245 1 114 SER QB 1 115 TRP H . . 4.470 3.750 3.501 4.008 . 0 0 "[ . 1 . 2]" 1 2246 1 114 SER HB2 1 115 TRP H . . 5.150 4.265 3.743 4.629 . 0 0 "[ . 1 . 2]" 1 2247 1 114 SER HB3 1 115 TRP H . . 5.150 4.260 3.685 4.548 . 0 0 "[ . 1 . 2]" 1 2248 1 115 TRP H 1 115 TRP HB2 . . 3.840 3.051 2.822 3.225 . 0 0 "[ . 1 . 2]" 1 2249 1 115 TRP H 1 115 TRP QB . . 3.370 2.435 2.310 2.516 . 0 0 "[ . 1 . 2]" 1 2250 1 115 TRP H 1 115 TRP HB3 . . 3.840 2.567 2.381 2.721 . 0 0 "[ . 1 . 2]" 1 2251 1 115 TRP H 1 116 THR H . . 4.840 4.466 4.306 4.547 . 0 0 "[ . 1 . 2]" 1 2252 1 115 TRP HE3 1 117 PHE QD . . 4.710 3.555 2.668 4.315 . 0 0 "[ . 1 . 2]" 1 2253 1 115 TRP HH2 1 121 ASN QB . . 4.510 3.790 2.992 4.514 0.004 14 0 "[ . 1 . 2]" 1 2254 1 115 TRP HH2 1 122 VAL H . . 4.350 3.865 3.216 4.281 . 0 0 "[ . 1 . 2]" 1 2255 1 115 TRP HH2 1 122 VAL HA . . 3.300 2.560 1.994 2.871 . 0 0 "[ . 1 . 2]" 1 2256 1 115 TRP HH2 1 122 VAL MG1 . . 4.290 3.560 3.146 3.982 . 0 0 "[ . 1 . 2]" 1 2257 1 115 TRP HH2 1 122 VAL MG2 . . 3.300 1.979 1.861 2.169 . 0 0 "[ . 1 . 2]" 1 2258 1 115 TRP HH2 1 126 PHE QD . . 4.590 3.971 3.339 4.459 . 0 0 "[ . 1 . 2]" 1 2259 1 115 TRP HZ2 1 121 ASN HB2 . . 4.240 3.365 2.478 4.251 0.011 13 0 "[ . 1 . 2]" 1 2260 1 115 TRP HZ2 1 121 ASN QB . . 3.560 2.274 1.984 2.778 . 0 0 "[ . 1 . 2]" 1 2261 1 115 TRP HZ2 1 121 ASN HB3 . . 4.240 2.330 1.996 2.824 . 0 0 "[ . 1 . 2]" 1 2262 1 115 TRP HZ2 1 122 VAL HA . . 4.180 2.920 2.182 3.673 . 0 0 "[ . 1 . 2]" 1 2263 1 115 TRP HZ2 1 122 VAL MG1 . . 5.230 4.798 4.170 5.261 0.031 19 0 "[ . 1 . 2]" 1 2264 1 115 TRP HZ2 1 122 VAL MG2 . . 4.510 3.299 2.535 3.916 . 0 0 "[ . 1 . 2]" 1 2265 1 115 TRP HZ2 1 125 GLU H . . 4.630 4.217 3.582 4.560 . 0 0 "[ . 1 . 2]" 1 2266 1 115 TRP HZ2 1 125 GLU HB2 . . 4.340 3.340 2.851 4.340 0.000 10 0 "[ . 1 . 2]" 1 2267 1 115 TRP HZ2 1 125 GLU QB . . 3.480 3.186 2.769 3.423 . 0 0 "[ . 1 . 2]" 1 2268 1 115 TRP HZ2 1 125 GLU HB3 . . 4.340 4.208 3.407 4.361 0.021 13 0 "[ . 1 . 2]" 1 2269 1 115 TRP HZ2 1 125 GLU HG2 . . 4.480 3.271 2.016 3.597 . 0 0 "[ . 1 . 2]" 1 2270 1 115 TRP HZ2 1 125 GLU QG . . 3.800 2.013 1.979 2.100 . 0 0 "[ . 1 . 2]" 1 2271 1 115 TRP HZ2 1 125 GLU HG3 . . 4.480 2.108 1.991 3.560 . 0 0 "[ . 1 . 2]" 1 2272 1 115 TRP HZ2 1 126 PHE QD . . 5.500 4.701 4.074 5.509 0.009 6 0 "[ . 1 . 2]" 1 2273 1 115 TRP HZ3 1 117 PHE HA . . 4.110 3.408 1.993 4.055 . 0 0 "[ . 1 . 2]" 1 2274 1 115 TRP HZ3 1 117 PHE QD . . 4.280 3.271 2.897 3.774 . 0 0 "[ . 1 . 2]" 1 2275 1 115 TRP HZ3 1 118 SER H . . 5.500 4.992 3.502 5.511 0.011 2 0 "[ . 1 . 2]" 1 2276 1 115 TRP HZ3 1 122 VAL HA . . 5.200 4.920 4.332 5.200 . 0 0 "[ . 1 . 2]" 1 2277 1 115 TRP HZ3 1 122 VAL MG2 . . 3.720 3.353 2.744 3.683 . 0 0 "[ . 1 . 2]" 1 2278 1 116 THR H 1 116 THR HB . . 3.300 2.530 2.426 2.641 . 0 0 "[ . 1 . 2]" 1 2279 1 116 THR H 1 116 THR MG . . 4.190 3.777 3.752 3.817 . 0 0 "[ . 1 . 2]" 1 2280 1 116 THR H 1 117 PHE H . . 4.910 4.522 4.342 4.619 . 0 0 "[ . 1 . 2]" 1 2281 1 116 THR H 1 121 ASN HD21 . . 4.660 3.655 3.198 4.062 . 0 0 "[ . 1 . 2]" 1 2282 1 116 THR H 1 121 ASN HD22 . . 4.660 4.320 3.513 4.664 0.004 19 0 "[ . 1 . 2]" 1 2283 1 116 THR HA 1 116 THR MG . . 3.190 2.362 2.232 2.455 . 0 0 "[ . 1 . 2]" 1 2284 1 116 THR HA 1 117 PHE H . . 3.030 2.178 2.141 2.312 . 0 0 "[ . 1 . 2]" 1 2285 1 116 THR HA 1 117 PHE HA . . 4.520 4.387 4.370 4.418 . 0 0 "[ . 1 . 2]" 1 2286 1 116 THR HA 1 117 PHE QD . . 4.260 3.902 3.334 4.257 . 0 0 "[ . 1 . 2]" 1 2287 1 116 THR HB 1 117 PHE H . . 4.870 4.123 3.741 4.381 . 0 0 "[ . 1 . 2]" 1 2288 1 116 THR HB 1 118 SER H . . 5.250 4.513 3.611 5.001 . 0 0 "[ . 1 . 2]" 1 2289 1 116 THR HB 1 121 ASN HD21 . . 3.650 2.170 1.898 2.864 . 0 0 "[ . 1 . 2]" 1 2290 1 116 THR HB 1 121 ASN HD22 . . 3.650 2.511 1.984 3.081 . 0 0 "[ . 1 . 2]" 1 2291 1 116 THR MG 1 117 PHE H . . 3.740 2.429 1.982 3.089 . 0 0 "[ . 1 . 2]" 1 2292 1 116 THR MG 1 117 PHE QB . . 4.770 4.001 3.787 4.327 . 0 0 "[ . 1 . 2]" 1 2293 1 116 THR MG 1 118 SER H . . 3.770 3.352 2.843 3.694 . 0 0 "[ . 1 . 2]" 1 2294 1 116 THR MG 1 118 SER HB2 . . 4.150 3.933 3.779 4.127 . 0 0 "[ . 1 . 2]" 1 2295 1 116 THR MG 1 118 SER HB3 . . 3.700 2.567 2.312 3.022 . 0 0 "[ . 1 . 2]" 1 2296 1 116 THR MG 1 121 ASN HD21 . . 4.080 3.136 2.088 4.044 . 0 0 "[ . 1 . 2]" 1 2297 1 116 THR MG 1 121 ASN HD22 . . 4.080 3.243 2.110 4.083 0.003 13 0 "[ . 1 . 2]" 1 2298 1 117 PHE H 1 117 PHE QB . . 3.400 2.256 2.157 2.430 . 0 0 "[ . 1 . 2]" 1 2299 1 117 PHE H 1 117 PHE QD . . 3.640 2.980 2.615 3.433 . 0 0 "[ . 1 . 2]" 1 2300 1 117 PHE H 1 118 SER H . . 4.430 3.972 3.554 4.163 . 0 0 "[ . 1 . 2]" 1 2301 1 117 PHE H 1 118 SER HB3 . . 5.240 4.710 4.354 5.075 . 0 0 "[ . 1 . 2]" 1 2302 1 117 PHE HA 1 117 PHE QD . . 3.820 2.934 2.739 3.056 . 0 0 "[ . 1 . 2]" 1 2303 1 117 PHE HA 1 117 PHE QE . . 4.620 4.476 4.404 4.535 . 0 0 "[ . 1 . 2]" 1 2304 1 117 PHE HA 1 118 SER H . . 3.070 2.268 2.196 2.507 . 0 0 "[ . 1 . 2]" 1 2305 1 117 PHE HA 1 122 VAL MG2 . . 4.020 3.361 3.090 3.617 . 0 0 "[ . 1 . 2]" 1 2306 1 117 PHE QB 1 122 VAL MG2 . . 4.510 4.210 3.734 4.446 . 0 0 "[ . 1 . 2]" 1 2307 1 117 PHE QD 1 118 SER H . . 4.680 4.548 4.185 4.680 . 5 0 "[ . 1 . 2]" 1 2308 1 117 PHE QD 1 122 VAL MG2 . . 4.030 3.585 3.227 4.032 0.002 15 0 "[ . 1 . 2]" 1 2309 1 118 SER H 1 118 SER HB3 . . 3.880 3.102 2.734 3.556 . 0 0 "[ . 1 . 2]" 1 2310 1 118 SER H 1 118 SER HG . . 3.500 2.793 2.262 3.500 . 0 0 "[ . 1 . 2]" 1 2311 1 118 SER H 1 119 GLU H . . 4.770 4.421 4.263 4.489 . 0 0 "[ . 1 . 2]" 1 2312 1 118 SER H 1 121 ASN QB . . 3.380 2.602 2.072 2.899 . 0 0 "[ . 1 . 2]" 1 2313 1 118 SER H 1 121 ASN QD . . 4.340 3.840 3.178 4.333 . 0 0 "[ . 1 . 2]" 1 2314 1 118 SER H 1 122 VAL H . . 4.600 3.604 2.978 3.967 . 0 0 "[ . 1 . 2]" 1 2315 1 118 SER H 1 122 VAL MG2 . . 4.010 2.899 2.454 3.293 . 0 0 "[ . 1 . 2]" 1 2316 1 118 SER HB2 1 119 GLU H . . 3.690 2.490 1.999 3.147 . 0 0 "[ . 1 . 2]" 1 2317 1 118 SER HB2 1 120 GLU H . . 4.150 3.301 2.666 3.871 . 0 0 "[ . 1 . 2]" 1 2318 1 118 SER HB3 1 119 GLU H . . 4.110 3.802 3.520 4.107 . 0 0 "[ . 1 . 2]" 1 2319 1 118 SER HB3 1 120 GLU H . . 5.500 4.766 4.066 5.272 . 0 0 "[ . 1 . 2]" 1 2320 1 118 SER HG 1 121 ASN H . . 2.200 1.983 1.882 2.189 . 0 0 "[ . 1 . 2]" 1 2321 1 119 GLU H 1 119 GLU HB2 . . 3.600 2.405 2.176 2.737 . 0 0 "[ . 1 . 2]" 1 2322 1 119 GLU H 1 119 GLU QB . . 3.110 2.231 2.126 2.327 . 0 0 "[ . 1 . 2]" 1 2323 1 119 GLU H 1 119 GLU HB3 . . 3.600 2.771 2.375 3.505 . 0 0 "[ . 1 . 2]" 1 2324 1 119 GLU H 1 119 GLU QG . . 4.220 3.835 2.850 4.013 . 0 0 "[ . 1 . 2]" 1 2325 1 119 GLU H 1 120 GLU H . . 3.790 2.762 2.243 3.259 . 0 0 "[ . 1 . 2]" 1 2326 1 119 GLU HA 1 119 GLU QG . . 3.420 2.362 2.258 2.560 . 0 0 "[ . 1 . 2]" 1 2327 1 119 GLU HA 1 122 VAL H . . 4.380 3.915 3.357 4.341 . 0 0 "[ . 1 . 2]" 1 2328 1 119 GLU HA 1 122 VAL HB . . 4.280 2.935 2.472 3.704 . 0 0 "[ . 1 . 2]" 1 2329 1 119 GLU HA 1 122 VAL MG2 . . 4.330 3.200 2.505 3.757 . 0 0 "[ . 1 . 2]" 1 2330 1 119 GLU HA 1 123 ILE MD . . 4.660 3.953 3.219 4.351 . 0 0 "[ . 1 . 2]" 1 2331 1 119 GLU QB 1 120 GLU H . . 3.600 2.427 2.006 3.144 . 0 0 "[ . 1 . 2]" 1 2332 1 119 GLU QB 1 123 ILE MD . . 4.790 3.557 2.164 4.336 . 0 0 "[ . 1 . 2]" 1 2333 1 119 GLU HB2 1 120 GLU H . . 4.270 3.588 2.443 4.258 . 0 0 "[ . 1 . 2]" 1 2334 1 119 GLU HB3 1 120 GLU H . . 4.270 2.518 2.020 3.284 . 0 0 "[ . 1 . 2]" 1 2335 1 119 GLU QG 1 123 ILE MD . . 3.160 2.254 1.835 2.794 . 0 0 "[ . 1 . 2]" 1 2336 1 120 GLU H 1 120 GLU HB2 . . 3.740 3.159 2.139 3.654 . 0 0 "[ . 1 . 2]" 1 2337 1 120 GLU H 1 120 GLU QB . . 3.120 2.451 2.104 2.740 . 0 0 "[ . 1 . 2]" 1 2338 1 120 GLU H 1 120 GLU HB3 . . 3.740 2.845 2.206 3.606 . 0 0 "[ . 1 . 2]" 1 2339 1 120 GLU H 1 120 GLU QG . . 3.520 2.463 1.890 3.650 0.130 15 0 "[ . 1 . 2]" 1 2340 1 120 GLU H 1 121 ASN H . . 3.630 2.877 2.435 3.202 . 0 0 "[ . 1 . 2]" 1 2341 1 120 GLU H 1 123 ILE MD . . 5.010 4.167 3.460 4.701 . 0 0 "[ . 1 . 2]" 1 2342 1 120 GLU HA 1 120 GLU QG . . 3.460 2.957 2.234 3.340 . 0 0 "[ . 1 . 2]" 1 2343 1 120 GLU HA 1 123 ILE H . . 4.260 3.740 3.265 4.237 . 0 0 "[ . 1 . 2]" 1 2344 1 120 GLU HA 1 123 ILE HB . . 3.860 3.073 2.576 3.280 . 0 0 "[ . 1 . 2]" 1 2345 1 120 GLU HA 1 123 ILE MD . . 3.480 2.699 1.988 3.234 . 0 0 "[ . 1 . 2]" 1 2346 1 120 GLU HA 1 123 ILE MG . . 4.550 4.372 3.967 4.559 0.009 6 0 "[ . 1 . 2]" 1 2347 1 120 GLU HA 1 124 ARG H . . 4.580 4.221 3.966 4.578 . 0 0 "[ . 1 . 2]" 1 2348 1 120 GLU QB 1 121 ASN H . . 3.580 2.657 1.946 3.388 . 0 0 "[ . 1 . 2]" 1 2349 1 120 GLU HB2 1 121 ASN H . . 4.090 3.089 1.959 3.894 . 0 0 "[ . 1 . 2]" 1 2350 1 120 GLU HB3 1 121 ASN H . . 4.090 3.286 2.116 3.988 . 0 0 "[ . 1 . 2]" 1 2351 1 120 GLU QG 1 121 ASN H . . 3.970 2.662 1.768 3.972 0.002 4 0 "[ . 1 . 2]" 1 2352 1 121 ASN H 1 121 ASN HB2 . . 3.980 2.439 2.213 2.663 . 0 0 "[ . 1 . 2]" 1 2353 1 121 ASN H 1 121 ASN QB . . 3.190 2.394 2.173 2.595 . 0 0 "[ . 1 . 2]" 1 2354 1 121 ASN H 1 121 ASN HB3 . . 3.980 3.514 2.812 3.622 . 0 0 "[ . 1 . 2]" 1 2355 1 121 ASN H 1 122 VAL H . . 3.470 2.911 2.503 3.202 . 0 0 "[ . 1 . 2]" 1 2356 1 121 ASN H 1 124 ARG H . . 5.500 4.786 4.541 5.068 . 0 0 "[ . 1 . 2]" 1 2357 1 121 ASN H 1 124 ARG HB3 . . 5.500 5.098 4.611 5.495 . 0 0 "[ . 1 . 2]" 1 2358 1 121 ASN HA 1 124 ARG H . . 4.070 3.576 3.205 3.944 . 0 0 "[ . 1 . 2]" 1 2359 1 121 ASN HA 1 124 ARG HB2 . . 4.440 3.623 3.188 4.061 . 0 0 "[ . 1 . 2]" 1 2360 1 121 ASN HA 1 124 ARG HB3 . . 4.460 2.726 2.156 3.063 . 0 0 "[ . 1 . 2]" 1 2361 1 121 ASN HA 1 125 GLU H . . 4.480 3.683 3.136 4.002 . 0 0 "[ . 1 . 2]" 1 2362 1 121 ASN QB 1 122 VAL H . . 3.760 2.461 2.086 2.878 . 0 0 "[ . 1 . 2]" 1 2363 1 121 ASN QB 1 122 VAL MG2 . . 4.090 3.203 3.031 3.357 . 0 0 "[ . 1 . 2]" 1 2364 1 121 ASN HB2 1 122 VAL H . . 4.340 2.650 2.113 3.694 . 0 0 "[ . 1 . 2]" 1 2365 1 121 ASN HB2 1 122 VAL MG2 . . 4.720 3.505 3.153 4.719 . 0 0 "[ . 1 . 2]" 1 2366 1 121 ASN HB3 1 122 VAL H . . 4.340 3.283 2.247 3.925 . 0 0 "[ . 1 . 2]" 1 2367 1 121 ASN HB3 1 122 VAL MG2 . . 4.720 3.952 3.250 4.453 . 0 0 "[ . 1 . 2]" 1 2368 1 122 VAL H 1 122 VAL HB . . 3.240 2.502 2.346 2.705 . 0 0 "[ . 1 . 2]" 1 2369 1 122 VAL H 1 122 VAL MG1 . . 4.010 3.755 3.715 3.782 . 0 0 "[ . 1 . 2]" 1 2370 1 122 VAL H 1 122 VAL MG2 . . 3.200 2.227 1.887 2.515 . 0 0 "[ . 1 . 2]" 1 2371 1 122 VAL H 1 123 ILE H . . 3.600 2.885 2.622 3.148 . 0 0 "[ . 1 . 2]" 1 2372 1 122 VAL H 1 123 ILE MD . . 5.500 5.161 4.959 5.483 . 0 0 "[ . 1 . 2]" 1 2373 1 122 VAL H 1 123 ILE QG . . 4.740 4.453 4.157 4.725 . 0 0 "[ . 1 . 2]" 1 2374 1 122 VAL HA 1 122 VAL MG1 . . 3.370 2.437 2.293 2.548 . 0 0 "[ . 1 . 2]" 1 2375 1 122 VAL HA 1 122 VAL MG2 . . 3.410 2.337 2.256 2.423 . 0 0 "[ . 1 . 2]" 1 2376 1 122 VAL HA 1 126 PHE H . . 4.320 3.531 3.119 3.879 . 0 0 "[ . 1 . 2]" 1 2377 1 122 VAL HA 1 126 PHE QD . . 3.340 2.586 2.123 3.254 . 0 0 "[ . 1 . 2]" 1 2378 1 122 VAL HA 1 126 PHE QE . . 4.460 3.603 3.068 4.474 0.014 19 0 "[ . 1 . 2]" 1 2379 1 122 VAL HB 1 123 ILE H . . 3.590 2.378 1.987 2.733 . 0 0 "[ . 1 . 2]" 1 2380 1 122 VAL HB 1 124 ARG H . . 5.500 4.807 4.404 5.221 . 0 0 "[ . 1 . 2]" 1 2381 1 122 VAL MG1 1 123 ILE H . . 3.990 3.080 2.828 3.327 . 0 0 "[ . 1 . 2]" 1 2382 1 122 VAL MG1 1 123 ILE HA . . 4.450 3.258 2.966 3.458 . 0 0 "[ . 1 . 2]" 1 2383 1 122 VAL MG1 1 126 PHE H . . 4.240 3.748 3.310 4.197 . 0 0 "[ . 1 . 2]" 1 2384 1 122 VAL MG1 1 126 PHE QB . . 3.990 2.866 2.260 3.236 . 0 0 "[ . 1 . 2]" 1 2385 1 122 VAL MG1 1 126 PHE QD . . 3.620 2.253 1.916 2.802 . 0 0 "[ . 1 . 2]" 1 2386 1 122 VAL MG1 1 126 PHE QE . . 4.030 3.231 2.621 3.842 . 0 0 "[ . 1 . 2]" 1 2387 1 122 VAL MG1 1 128 LEU MD1 . . 3.130 2.146 1.879 2.537 . 0 0 "[ . 1 . 2]" 1 2388 1 122 VAL MG2 1 123 ILE H . . 4.300 3.818 3.596 4.020 . 0 0 "[ . 1 . 2]" 1 2389 1 122 VAL MG2 1 126 PHE QD . . 4.050 3.719 3.225 4.005 . 0 0 "[ . 1 . 2]" 1 2390 1 122 VAL MG2 1 126 PHE QE . . 4.540 3.515 3.030 3.970 . 0 0 "[ . 1 . 2]" 1 2391 1 122 VAL MG2 1 128 LEU MD1 . . 4.590 4.415 4.131 4.585 . 0 0 "[ . 1 . 2]" 1 2392 1 123 ILE H 1 123 ILE HB . . 3.290 2.563 2.480 2.665 . 0 0 "[ . 1 . 2]" 1 2393 1 123 ILE H 1 123 ILE MD . . 3.470 3.348 3.137 3.471 0.001 7 0 "[ . 1 . 2]" 1 2394 1 123 ILE H 1 123 ILE QG . . 3.260 2.045 1.893 2.262 . 0 0 "[ . 1 . 2]" 1 2395 1 123 ILE H 1 123 ILE MG . . 3.880 3.766 3.757 3.780 . 0 0 "[ . 1 . 2]" 1 2396 1 123 ILE H 1 124 ARG H . . 3.520 2.721 2.423 3.066 . 0 0 "[ . 1 . 2]" 1 2397 1 123 ILE H 1 128 LEU MD1 . . 4.470 3.651 2.959 4.051 . 0 0 "[ . 1 . 2]" 1 2398 1 123 ILE HA 1 123 ILE MD . . 3.990 3.872 3.842 3.895 . 0 0 "[ . 1 . 2]" 1 2399 1 123 ILE HA 1 123 ILE HG12 . . 3.880 2.666 2.572 2.782 . 0 0 "[ . 1 . 2]" 1 2400 1 123 ILE HA 1 123 ILE QG . . 3.370 2.442 2.393 2.486 . 0 0 "[ . 1 . 2]" 1 2401 1 123 ILE HA 1 123 ILE HG13 . . 3.880 2.841 2.742 2.946 . 0 0 "[ . 1 . 2]" 1 2402 1 123 ILE HA 1 123 ILE MG . . 3.280 2.390 2.280 2.454 . 0 0 "[ . 1 . 2]" 1 2403 1 123 ILE HA 1 128 LEU H . . 3.800 2.698 2.473 2.957 . 0 0 "[ . 1 . 2]" 1 2404 1 123 ILE HA 1 128 LEU QB . . 3.300 2.708 2.128 3.165 . 0 0 "[ . 1 . 2]" 1 2405 1 123 ILE HA 1 128 LEU MD1 . . 3.320 2.312 1.980 2.816 . 0 0 "[ . 1 . 2]" 1 2406 1 123 ILE HA 1 128 LEU HG . . 3.580 2.464 2.100 2.812 . 0 0 "[ . 1 . 2]" 1 2407 1 123 ILE HB 1 123 ILE MD . . 3.270 2.303 2.187 2.407 . 0 0 "[ . 1 . 2]" 1 2408 1 123 ILE HB 1 124 ARG H . . 3.480 2.734 2.180 3.025 . 0 0 "[ . 1 . 2]" 1 2409 1 123 ILE MD 1 123 ILE MG . . 2.900 2.196 2.036 2.335 . 0 0 "[ . 1 . 2]" 1 2410 1 123 ILE MD 1 124 ARG H . . 4.690 4.515 4.052 4.698 0.008 5 0 "[ . 1 . 2]" 1 2411 1 123 ILE MD 1 128 LEU MD1 . . 3.940 3.682 3.330 3.916 . 0 0 "[ . 1 . 2]" 1 2412 1 123 ILE MD 1 129 ASN QD . . 5.340 3.895 2.943 4.930 . 0 0 "[ . 1 . 2]" 1 2413 1 123 ILE QG 1 128 LEU QB . . 4.670 2.927 2.551 3.363 . 0 0 "[ . 1 . 2]" 1 2414 1 123 ILE QG 1 128 LEU MD1 . . 3.320 2.252 1.951 2.533 . 0 0 "[ . 1 . 2]" 1 2415 1 123 ILE HG12 1 128 LEU MD1 . . 3.980 2.351 1.981 2.661 . 0 0 "[ . 1 . 2]" 1 2416 1 123 ILE HG13 1 128 LEU MD1 . . 3.980 2.944 2.578 3.332 . 0 0 "[ . 1 . 2]" 1 2417 1 123 ILE MG 1 124 ARG H . . 3.860 3.547 3.105 3.802 . 0 0 "[ . 1 . 2]" 1 2418 1 123 ILE MG 1 124 ARG HA . . 3.950 3.560 3.336 3.786 . 0 0 "[ . 1 . 2]" 1 2419 1 123 ILE MG 1 127 ASN H . . 4.710 4.411 3.963 4.716 0.006 19 0 "[ . 1 . 2]" 1 2420 1 123 ILE MG 1 128 LEU H . . 3.890 2.969 2.562 3.292 . 0 0 "[ . 1 . 2]" 1 2421 1 123 ILE MG 1 128 LEU QB . . 3.100 2.395 2.007 2.942 . 0 0 "[ . 1 . 2]" 1 2422 1 123 ILE MG 1 128 LEU MD1 . . 3.820 3.249 2.771 3.546 . 0 0 "[ . 1 . 2]" 1 2423 1 123 ILE MG 1 128 LEU HG . . 4.500 3.770 3.335 4.090 . 0 0 "[ . 1 . 2]" 1 2424 1 123 ILE MG 1 129 ASN H . . 4.010 2.196 1.831 2.560 . 0 0 "[ . 1 . 2]" 1 2425 1 123 ILE MG 1 129 ASN QB . . 4.300 2.837 2.096 3.686 . 0 0 "[ . 1 . 2]" 1 2426 1 123 ILE MG 1 129 ASN HD21 . . 4.310 2.976 1.993 4.122 . 0 0 "[ . 1 . 2]" 1 2427 1 123 ILE MG 1 129 ASN QD . . 3.610 2.523 1.873 3.271 . 0 0 "[ . 1 . 2]" 1 2428 1 123 ILE MG 1 129 ASN HD22 . . 4.310 2.932 1.915 4.190 . 0 0 "[ . 1 . 2]" 1 2429 1 123 ILE MG 1 130 GLU H . . 4.890 4.452 4.055 4.882 . 0 0 "[ . 1 . 2]" 1 2430 1 124 ARG H 1 124 ARG HB2 . . 3.240 2.571 2.352 2.916 . 0 0 "[ . 1 . 2]" 1 2431 1 124 ARG H 1 124 ARG HB3 . . 3.250 2.534 2.274 2.710 . 0 0 "[ . 1 . 2]" 1 2432 1 124 ARG H 1 124 ARG HG2 . . 4.850 4.556 4.412 4.651 . 0 0 "[ . 1 . 2]" 1 2433 1 124 ARG H 1 124 ARG QG . . 4.180 3.989 3.881 4.061 . 0 0 "[ . 1 . 2]" 1 2434 1 124 ARG H 1 124 ARG HG3 . . 4.850 4.413 4.192 4.533 . 0 0 "[ . 1 . 2]" 1 2435 1 124 ARG H 1 125 GLU H . . 3.630 2.710 2.423 2.840 . 0 0 "[ . 1 . 2]" 1 2436 1 124 ARG H 1 125 GLU HG2 . . 5.500 4.461 3.844 4.715 . 0 0 "[ . 1 . 2]" 1 2437 1 124 ARG H 1 125 GLU HG3 . . 5.500 5.403 3.861 5.515 0.015 14 0 "[ . 1 . 2]" 1 2438 1 124 ARG HA 1 124 ARG QD . . 4.340 2.967 1.997 4.195 . 0 0 "[ . 1 . 2]" 1 2439 1 124 ARG HA 1 124 ARG HG2 . . 3.890 3.489 2.767 3.878 . 0 0 "[ . 1 . 2]" 1 2440 1 124 ARG HA 1 124 ARG QG . . 3.240 2.663 2.339 3.147 . 0 0 "[ . 1 . 2]" 1 2441 1 124 ARG HA 1 124 ARG HG3 . . 3.890 2.776 2.390 3.328 . 0 0 "[ . 1 . 2]" 1 2442 1 124 ARG HB2 1 124 ARG QD . . 3.800 2.408 2.109 2.935 . 0 0 "[ . 1 . 2]" 1 2443 1 124 ARG HB3 1 125 GLU H . . 3.360 2.286 2.016 2.781 . 0 0 "[ . 1 . 2]" 1 2444 1 124 ARG HB3 1 125 GLU HG2 . . 4.790 3.136 2.765 3.788 . 0 0 "[ . 1 . 2]" 1 2445 1 124 ARG HB3 1 125 GLU QG . . 4.000 3.084 2.735 3.609 . 0 0 "[ . 1 . 2]" 1 2446 1 124 ARG HB3 1 125 GLU HG3 . . 4.790 4.626 4.327 4.800 0.010 14 0 "[ . 1 . 2]" 1 2447 1 124 ARG QG 1 125 GLU H . . 4.220 3.361 2.682 3.878 . 0 0 "[ . 1 . 2]" 1 2448 1 124 ARG QG 1 125 GLU HA . . 4.110 3.574 2.965 3.955 . 0 0 "[ . 1 . 2]" 1 2449 1 124 ARG QG 1 125 GLU QG . . 4.440 3.768 3.140 4.246 . 0 0 "[ . 1 . 2]" 1 2450 1 124 ARG HG2 1 125 GLU H . . 4.920 3.918 3.148 4.652 . 0 0 "[ . 1 . 2]" 1 2451 1 124 ARG HG3 1 125 GLU H . . 4.920 3.905 2.733 4.926 0.006 13 0 "[ . 1 . 2]" 1 2452 1 125 GLU H 1 125 GLU HB2 . . 4.150 2.609 2.403 3.556 . 0 0 "[ . 1 . 2]" 1 2453 1 125 GLU H 1 125 GLU QB . . 3.310 2.517 2.369 2.719 . 0 0 "[ . 1 . 2]" 1 2454 1 125 GLU H 1 125 GLU HB3 . . 4.150 3.556 2.822 3.627 . 0 0 "[ . 1 . 2]" 1 2455 1 125 GLU H 1 125 GLU HG2 . . 3.870 2.127 1.907 2.525 . 0 0 "[ . 1 . 2]" 1 2456 1 125 GLU H 1 125 GLU QG . . 3.310 2.095 1.893 2.474 . 0 0 "[ . 1 . 2]" 1 2457 1 125 GLU H 1 125 GLU HG3 . . 3.870 3.233 2.403 3.551 . 0 0 "[ . 1 . 2]" 1 2458 1 125 GLU H 1 126 PHE H . . 3.520 2.872 2.548 3.091 . 0 0 "[ . 1 . 2]" 1 2459 1 125 GLU H 1 127 ASN H . . 4.290 3.733 3.391 3.907 . 0 0 "[ . 1 . 2]" 1 2460 1 125 GLU HA 1 125 GLU HG2 . . 3.960 2.811 2.648 3.730 . 0 0 "[ . 1 . 2]" 1 2461 1 125 GLU HA 1 125 GLU QG . . 3.170 2.728 2.596 3.287 0.117 10 0 "[ . 1 . 2]" 1 2462 1 125 GLU HA 1 125 GLU HG3 . . 3.960 3.788 3.652 3.836 . 0 0 "[ . 1 . 2]" 1 2463 1 125 GLU HA 1 127 ASN H . . 4.540 3.897 3.709 4.303 . 0 0 "[ . 1 . 2]" 1 2464 1 125 GLU QB 1 126 PHE QD . . 4.530 2.906 2.371 3.923 . 0 0 "[ . 1 . 2]" 1 2465 1 125 GLU HB2 1 126 PHE H . . 4.310 2.358 2.227 3.486 . 0 0 "[ . 1 . 2]" 1 2466 1 125 GLU HB2 1 126 PHE QD . . 5.170 2.977 2.406 4.155 . 0 0 "[ . 1 . 2]" 1 2467 1 125 GLU HB3 1 126 PHE H . . 4.310 3.422 3.266 4.120 . 0 0 "[ . 1 . 2]" 1 2468 1 125 GLU HB3 1 126 PHE QD . . 5.170 4.137 3.407 5.131 . 0 0 "[ . 1 . 2]" 1 2469 1 126 PHE H 1 126 PHE HB2 . . 3.750 2.353 2.225 2.445 . 0 0 "[ . 1 . 2]" 1 2470 1 126 PHE H 1 126 PHE QB . . 3.180 2.323 2.202 2.409 . 0 0 "[ . 1 . 2]" 1 2471 1 126 PHE H 1 126 PHE HB3 . . 3.750 3.586 3.520 3.633 . 0 0 "[ . 1 . 2]" 1 2472 1 126 PHE H 1 126 PHE QD . . 3.300 2.498 1.990 3.271 . 0 0 "[ . 1 . 2]" 1 2473 1 126 PHE H 1 127 ASN H . . 3.260 2.540 2.307 2.712 . 0 0 "[ . 1 . 2]" 1 2474 1 126 PHE H 1 128 LEU MD1 . . 5.500 4.771 4.183 5.268 . 0 0 "[ . 1 . 2]" 1 2475 1 126 PHE H 1 128 LEU MD2 . . 4.980 4.795 4.540 4.974 . 0 0 "[ . 1 . 2]" 1 2476 1 126 PHE HA 1 126 PHE QD . . 3.970 2.851 2.072 3.108 . 0 0 "[ . 1 . 2]" 1 2477 1 126 PHE HA 1 128 LEU MD2 . . 4.790 4.453 4.168 4.781 . 0 0 "[ . 1 . 2]" 1 2478 1 126 PHE QB 1 128 LEU HG . . 3.940 2.250 1.948 2.600 . 0 0 "[ . 1 . 2]" 1 2479 1 126 PHE HB2 1 128 LEU MD1 . . 4.500 3.274 2.893 3.676 . 0 0 "[ . 1 . 2]" 1 2480 1 126 PHE HB2 1 128 LEU MD2 . . 3.590 2.802 2.502 3.010 . 0 0 "[ . 1 . 2]" 1 2481 1 126 PHE HB2 1 128 LEU HG . . 4.530 2.347 2.018 2.784 . 0 0 "[ . 1 . 2]" 1 2482 1 126 PHE HB3 1 128 LEU MD1 . . 4.500 3.973 3.666 4.266 . 0 0 "[ . 1 . 2]" 1 2483 1 126 PHE HB3 1 128 LEU MD2 . . 3.590 2.273 1.986 2.729 . 0 0 "[ . 1 . 2]" 1 2484 1 126 PHE HB3 1 128 LEU HG . . 4.530 2.939 2.564 3.272 . 0 0 "[ . 1 . 2]" 1 2485 1 126 PHE QD 1 128 LEU MD1 . . 4.910 4.097 3.454 4.528 . 0 0 "[ . 1 . 2]" 1 2486 1 126 PHE QD 1 128 LEU MD2 . . 4.270 3.569 3.122 4.027 . 0 0 "[ . 1 . 2]" 1 2487 1 127 ASN H 1 127 ASN HA . . 2.870 2.295 2.274 2.316 . 0 0 "[ . 1 . 2]" 1 2488 1 127 ASN H 1 127 ASN HB2 . . 3.960 3.253 3.071 3.664 . 0 0 "[ . 1 . 2]" 1 2489 1 127 ASN H 1 128 LEU H . . 3.610 2.938 2.658 3.068 . 0 0 "[ . 1 . 2]" 1 2490 1 127 ASN H 1 128 LEU MD1 . . 5.500 5.266 4.801 5.500 0.000 10 0 "[ . 1 . 2]" 1 2491 1 127 ASN H 1 128 LEU MD2 . . 5.500 4.947 4.526 5.358 . 0 0 "[ . 1 . 2]" 1 2492 1 127 ASN H 1 128 LEU HG . . 4.870 4.169 3.744 4.477 . 0 0 "[ . 1 . 2]" 1 2493 1 127 ASN HA 1 128 LEU H . . 3.500 2.758 2.642 2.923 . 0 0 "[ . 1 . 2]" 1 2494 1 127 ASN HA 1 129 ASN H . . 4.430 3.586 3.009 3.950 . 0 0 "[ . 1 . 2]" 1 2495 1 127 ASN HB2 1 130 GLU H . . 5.500 4.791 4.170 5.051 . 0 0 "[ . 1 . 2]" 1 2496 1 127 ASN HB2 1 130 GLU QB . . 4.180 3.785 3.385 4.161 . 0 0 "[ . 1 . 2]" 1 2497 1 127 ASN HB2 1 130 GLU QG . . 4.860 4.281 2.272 4.666 . 0 0 "[ . 1 . 2]" 1 2498 1 127 ASN HB2 1 131 LEU H . . 5.500 4.703 4.196 5.100 . 0 0 "[ . 1 . 2]" 1 2499 1 127 ASN HB2 1 131 LEU MD1 . . 4.360 4.122 3.478 4.367 0.007 19 0 "[ . 1 . 2]" 1 2500 1 127 ASN HB2 1 131 LEU MD2 . . 4.820 4.231 3.469 4.659 . 0 0 "[ . 1 . 2]" 1 2501 1 127 ASN HB2 1 131 LEU HG . . 4.510 3.919 3.330 4.369 . 0 0 "[ . 1 . 2]" 1 2502 1 127 ASN HB3 1 130 GLU H . . 4.450 3.350 2.980 3.651 . 0 0 "[ . 1 . 2]" 1 2503 1 127 ASN HB3 1 130 GLU HA . . 5.500 5.174 4.854 5.436 . 0 0 "[ . 1 . 2]" 1 2504 1 127 ASN HB3 1 130 GLU QB . . 3.500 2.390 2.021 3.180 . 0 0 "[ . 1 . 2]" 1 2505 1 127 ASN HB3 1 130 GLU QG . . 4.250 2.864 1.997 3.184 . 0 0 "[ . 1 . 2]" 1 2506 1 127 ASN HB3 1 131 LEU H . . 4.840 3.844 3.050 4.573 . 0 0 "[ . 1 . 2]" 1 2507 1 127 ASN HB3 1 131 LEU MD1 . . 4.710 4.631 4.368 4.710 . 0 0 "[ . 1 . 2]" 1 2508 1 127 ASN HB3 1 131 LEU MD2 . . 4.770 4.506 4.085 4.762 . 0 0 "[ . 1 . 2]" 1 2509 1 127 ASN HB3 1 131 LEU HG . . 4.310 3.876 3.231 4.294 . 0 0 "[ . 1 . 2]" 1 2510 1 127 ASN QD 1 130 GLU QB . . 4.330 3.693 2.763 4.317 . 0 0 "[ . 1 . 2]" 1 2511 1 127 ASN QD 1 130 GLU QG . . 4.560 2.919 2.069 4.086 . 0 0 "[ . 1 . 2]" 1 2512 1 128 LEU H 1 128 LEU QB . . 3.400 2.528 2.404 2.623 . 0 0 "[ . 1 . 2]" 1 2513 1 128 LEU H 1 128 LEU MD1 . . 3.790 3.494 3.329 3.619 . 0 0 "[ . 1 . 2]" 1 2514 1 128 LEU H 1 128 LEU MD2 . . 3.900 3.253 2.973 3.503 . 0 0 "[ . 1 . 2]" 1 2515 1 128 LEU H 1 128 LEU HG . . 3.390 2.077 1.900 2.306 . 0 0 "[ . 1 . 2]" 1 2516 1 128 LEU H 1 129 ASN H . . 3.740 2.827 2.713 3.023 . 0 0 "[ . 1 . 2]" 1 2517 1 128 LEU HA 1 128 LEU MD1 . . 4.140 3.908 3.859 3.963 . 0 0 "[ . 1 . 2]" 1 2518 1 128 LEU HA 1 128 LEU MD2 . . 3.020 2.058 1.974 2.348 . 0 0 "[ . 1 . 2]" 1 2519 1 128 LEU HA 1 128 LEU HG . . 3.990 3.097 2.979 3.220 . 0 0 "[ . 1 . 2]" 1 2520 1 128 LEU HA 1 130 GLU H . . 4.970 4.212 3.885 4.710 . 0 0 "[ . 1 . 2]" 1 2521 1 128 LEU HA 1 131 LEU H . . 4.130 3.351 3.071 3.585 . 0 0 "[ . 1 . 2]" 1 2522 1 128 LEU HA 1 131 LEU HB2 . . 4.470 2.588 2.345 2.957 . 0 0 "[ . 1 . 2]" 1 2523 1 128 LEU HA 1 131 LEU QB . . 3.620 2.561 2.327 2.915 . 0 0 "[ . 1 . 2]" 1 2524 1 128 LEU HA 1 131 LEU HB3 . . 4.470 4.110 3.890 4.426 . 0 0 "[ . 1 . 2]" 1 2525 1 128 LEU HA 1 131 LEU MD1 . . 3.690 2.102 1.853 2.659 . 0 0 "[ . 1 . 2]" 1 2526 1 128 LEU HA 1 131 LEU MD2 . . 4.820 4.266 4.015 4.613 . 0 0 "[ . 1 . 2]" 1 2527 1 128 LEU HA 1 131 LEU HG . . 4.280 2.940 2.714 3.303 . 0 0 "[ . 1 . 2]" 1 2528 1 128 LEU QB 1 129 ASN H . . 3.930 2.473 2.160 2.971 . 0 0 "[ . 1 . 2]" 1 2529 1 128 LEU QB 1 131 LEU MD1 . . 4.560 3.603 3.237 4.075 . 0 0 "[ . 1 . 2]" 1 2530 1 128 LEU HB2 1 129 ASN H . . 4.560 2.519 2.184 3.058 . 0 0 "[ . 1 . 2]" 1 2531 1 128 LEU HB3 1 129 ASN H . . 4.560 3.621 3.329 4.040 . 0 0 "[ . 1 . 2]" 1 2532 1 128 LEU MD2 1 131 LEU H . . 5.010 4.898 4.700 5.019 0.009 19 0 "[ . 1 . 2]" 1 2533 1 128 LEU MD2 1 131 LEU QB . . 4.170 3.401 3.163 3.662 . 0 0 "[ . 1 . 2]" 1 2534 1 128 LEU MD2 1 131 LEU MD1 . . 3.240 2.050 1.912 2.419 . 0 0 "[ . 1 . 2]" 1 2535 1 128 LEU MD2 1 131 LEU HG . . 4.400 4.024 3.786 4.222 . 0 0 "[ . 1 . 2]" 1 2536 1 129 ASN H 1 129 ASN QB . . 3.220 2.331 2.144 2.765 . 0 0 "[ . 1 . 2]" 1 2537 1 129 ASN H 1 129 ASN QD . . 4.730 3.679 2.441 4.281 . 0 0 "[ . 1 . 2]" 1 2538 1 129 ASN H 1 130 GLU H . . 3.380 2.894 2.662 3.042 . 0 0 "[ . 1 . 2]" 1 2539 1 129 ASN H 1 130 GLU QB . . 5.050 4.845 4.628 4.997 . 0 0 "[ . 1 . 2]" 1 2540 1 129 ASN QB 1 130 GLU H . . 3.660 2.703 2.371 3.363 . 0 0 "[ . 1 . 2]" 1 2541 1 129 ASN QB 1 130 GLU QG . . 4.430 3.461 2.965 4.235 . 0 0 "[ . 1 . 2]" 1 2542 1 130 GLU H 1 130 GLU QB . . 3.210 2.331 2.180 2.418 . 0 0 "[ . 1 . 2]" 1 2543 1 130 GLU H 1 130 GLU QG . . 3.680 2.512 2.293 2.878 . 0 0 "[ . 1 . 2]" 1 2544 1 130 GLU HA 1 130 GLU QG . . 3.330 2.751 2.312 3.329 . 0 0 "[ . 1 . 2]" 1 2545 1 130 GLU QB 1 131 LEU H . . 3.640 2.424 2.166 3.524 . 0 0 "[ . 1 . 2]" 1 2546 1 130 GLU QB 1 131 LEU HA . . 4.480 3.824 3.744 4.488 0.008 11 0 "[ . 1 . 2]" 1 2547 1 130 GLU QB 1 131 LEU MD2 . . 4.170 3.804 3.648 4.169 . 0 0 "[ . 1 . 2]" 1 2548 1 130 GLU QG 1 131 LEU H . . 4.790 3.963 2.171 4.256 . 0 0 "[ . 1 . 2]" 1 2549 1 131 LEU H 1 131 LEU HB2 . . 3.770 2.631 2.494 2.717 . 0 0 "[ . 1 . 2]" 1 2550 1 131 LEU H 1 131 LEU QB . . 3.150 2.569 2.449 2.642 . 0 0 "[ . 1 . 2]" 1 2551 1 131 LEU H 1 131 LEU HB3 . . 3.770 3.594 3.579 3.618 . 0 0 "[ . 1 . 2]" 1 2552 1 131 LEU H 1 131 LEU MD1 . . 3.610 3.488 3.365 3.611 0.001 13 0 "[ . 1 . 2]" 1 2553 1 131 LEU H 1 131 LEU MD2 . . 3.950 3.223 3.043 3.465 . 0 0 "[ . 1 . 2]" 1 2554 1 131 LEU H 1 131 LEU HG . . 3.330 2.039 1.902 2.232 . 0 0 "[ . 1 . 2]" 1 2555 1 131 LEU H 1 132 SER H . . 3.410 3.064 2.770 3.234 . 0 0 "[ . 1 . 2]" 1 2556 1 131 LEU HA 1 131 LEU MD1 . . 4.010 3.912 3.860 3.993 . 0 0 "[ . 1 . 2]" 1 2557 1 131 LEU HA 1 131 LEU MD2 . . 2.880 2.166 1.978 2.316 . 0 0 "[ . 1 . 2]" 1 2558 1 131 LEU HA 1 131 LEU HG . . 3.750 3.077 2.993 3.197 . 0 0 "[ . 1 . 2]" 1 2559 1 131 LEU QB 1 131 LEU MD2 . . 3.080 2.225 2.132 2.313 . 0 0 "[ . 1 . 2]" 1 2560 1 131 LEU QB 1 132 SER H . . 3.750 2.143 1.890 2.345 . 0 0 "[ . 1 . 2]" 1 2561 1 131 LEU HB2 1 131 LEU MD1 . . 3.230 2.200 2.074 2.358 . 0 0 "[ . 1 . 2]" 1 2562 1 131 LEU HB2 1 132 SER H . . 4.430 2.173 1.912 2.379 . 0 0 "[ . 1 . 2]" 1 2563 1 131 LEU HB3 1 131 LEU MD1 . . 3.230 2.446 2.321 2.566 . 0 0 "[ . 1 . 2]" 1 2564 1 131 LEU HB3 1 132 SER H . . 4.430 3.288 2.982 3.554 . 0 0 "[ . 1 . 2]" 1 2565 1 131 LEU MD1 1 132 SER H . . 4.850 4.018 3.688 4.307 . 0 0 "[ . 1 . 2]" 1 2566 1 131 LEU MD2 1 132 SER H . . 5.490 4.563 4.430 4.637 . 0 0 "[ . 1 . 2]" 1 2567 1 131 LEU HG 1 132 SER H . . 4.760 4.153 3.797 4.349 . 0 0 "[ . 1 . 2]" 1 2568 1 132 SER H 1 132 SER HB2 . . 4.000 2.894 2.176 3.687 . 0 0 "[ . 1 . 2]" 1 2569 1 132 SER H 1 132 SER QB . . 3.390 2.345 2.155 2.918 . 0 0 "[ . 1 . 2]" 1 2570 1 132 SER H 1 132 SER HB3 . . 4.000 2.655 2.274 3.592 . 0 0 "[ . 1 . 2]" 1 2571 1 133 GLY H 1 134 PRO QD . . 4.360 4.167 3.438 4.380 0.020 11 0 "[ . 1 . 2]" 1 2572 1 133 GLY QA 1 134 PRO QG . . 4.630 3.679 3.644 3.700 . 0 0 "[ . 1 . 2]" 1 2573 1 133 GLY HA2 1 134 PRO QD . . 3.060 2.193 1.897 2.709 . 0 0 "[ . 1 . 2]" 1 2574 1 133 GLY HA3 1 134 PRO QD . . 3.060 2.459 1.923 2.979 . 0 0 "[ . 1 . 2]" 1 stop_ save_
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