NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
529064 | 2rrk | 11422 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2rrk 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 3205 _Distance_constraint_stats_list.Viol_count 3347 _Distance_constraint_stats_list.Viol_total 3970.242 _Distance_constraint_stats_list.Viol_max 0.402 _Distance_constraint_stats_list.Viol_rms 0.0191 _Distance_constraint_stats_list.Viol_average_all_restraints 0.0031 _Distance_constraint_stats_list.Viol_average_violations_only 0.0593 _Distance_constraint_stats_list.Cutoff_violation_report 0.500 _Distance_constraint_stats_list.Details ; Description of the tags in this list: * 1 * Administrative tag * 2 * Administrative tag * 3 * Administrative tag * 4 * ID of the restraint list. * 5 * Number of restraints in list. * 6 * Number of violated restraints (each model violation is used). * 7 * Sum of violations in Angstrom. * 8 * Maximum violation of a restraint without averaging in any way. * 9 * Rms of violations over all restraints. * 10 * Average violation over all restraints. * 11 * Average violation over violated restraints. This violation is averaged over only those models in which the restraint is violated. These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998). * 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table. * 13 * This tag Description of the tags in the per residue table below: * 1 * Chain identifier (can be absent if none defined) * 2 * Residue number * 3 * Residue name * 4 * Maximum violation in ensemble of models (without any averaging) * 5 * Model number with the maximum violation * 6 * Number of models with a violation above cutoff * 7 * List of models (1 character per model) with a violation above cutoff. An '*' marks a violation above the cutoff. A '+' indicates the largest violation above the cutoff and a '-' marks the smallest violation over cutoff. For models 5, 15, 25,... a ' ' is replaced by a '.'. For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1. * 8 * Administrative tag * 9 * Administrative tag Description of the tags in the per restraint table below: * 1 * Restraint ID within restraint list. First node, FIRST member, first atom's: * 2 * Chain identifier (can be absent if none defined) * 3 * Residue number * 4 * Residue name * 5 * Name of (pseudo-)atom First node, SECOND member, first atom's: * 6 * Chain identifier (can be absent if none defined) * 7 * Residue number * 8 * Residue name * 9 * Name of (pseudo-)atom FIRST node's: * 10 * Target distance value (Angstrom) * 11 * Lower bound distance (Angstrom) * 12 * Upper bound distance (Angstrom) * 13 * Average distance in ensemble of models * 14 * Minimum distance in ensemble of models * 15 * Maximum distance in ensemble of models * 16 * Maximum violation (without any averaging) * 17 * Model number with the maximum violation * 18 * Number of models with a violation above cutoff * 19 * List of models with a violation above cutoff. See description above. * 20 * Administrative tag * 21 * Administrative tag ; loop_ _Distance_constraint_stats_per_res.Atom_entity_assembly_ID _Distance_constraint_stats_per_res.Atom_comp_index_ID _Distance_constraint_stats_per_res.Atom_comp_ID _Distance_constraint_stats_per_res.Total_violation _Distance_constraint_stats_per_res.Max_violation _Distance_constraint_stats_per_res.Max_violation_model_number _Distance_constraint_stats_per_res.Over_cutoff_viol_count _Distance_constraint_stats_per_res.Over_cutoff_viol_per_model 1 3 LEU 0.000 0.000 . 0 "[ . 1 . 2]" 1 6 MET 0.813 0.104 6 0 "[ . 1 . 2]" 1 7 LYS 0.291 0.057 20 0 "[ . 1 . 2]" 1 8 MET 1.315 0.064 14 0 "[ . 1 . 2]" 1 9 ILE 12.699 0.395 6 0 "[ . 1 . 2]" 1 10 GLU 6.049 0.178 14 0 "[ . 1 . 2]" 1 11 VAL 1.011 0.101 14 0 "[ . 1 . 2]" 1 12 VAL 1.936 0.079 5 0 "[ . 1 . 2]" 1 13 ALA 2.273 0.113 10 0 "[ . 1 . 2]" 1 14 ALA 2.114 0.101 2 0 "[ . 1 . 2]" 1 15 ILE 15.532 0.358 11 0 "[ . 1 . 2]" 1 16 ILE 4.484 0.158 13 0 "[ . 1 . 2]" 1 17 GLU 0.493 0.065 3 0 "[ . 1 . 2]" 1 18 ARG 1.772 0.139 19 0 "[ . 1 . 2]" 1 19 ASP 3.339 0.186 5 0 "[ . 1 . 2]" 1 20 GLY 0.766 0.186 5 0 "[ . 1 . 2]" 1 21 LYS 6.757 0.185 18 0 "[ . 1 . 2]" 1 22 ILE 9.986 0.358 11 0 "[ . 1 . 2]" 1 23 LEU 3.790 0.300 10 0 "[ . 1 . 2]" 1 24 LEU 4.735 0.181 2 0 "[ . 1 . 2]" 1 25 ALA 2.833 0.270 19 0 "[ . 1 . 2]" 1 26 GLN 1.133 0.128 6 0 "[ . 1 . 2]" 1 27 ARG 0.742 0.270 19 0 "[ . 1 . 2]" 1 28 PRO 7.613 0.315 14 0 "[ . 1 . 2]" 1 29 ALA 6.750 0.315 14 0 "[ . 1 . 2]" 1 30 GLN 1.094 0.179 5 0 "[ . 1 . 2]" 1 31 SER 2.435 0.164 2 0 "[ . 1 . 2]" 1 32 ASP 1.414 0.202 19 0 "[ . 1 . 2]" 1 33 GLN 3.504 0.202 19 0 "[ . 1 . 2]" 1 34 ALA 1.013 0.189 15 0 "[ . 1 . 2]" 1 35 GLY 3.133 0.289 8 0 "[ . 1 . 2]" 1 36 LEU 5.956 0.289 8 0 "[ . 1 . 2]" 1 37 TRP 2.275 0.165 6 0 "[ . 1 . 2]" 1 38 GLU 2.123 0.216 17 0 "[ . 1 . 2]" 1 39 PHE 3.265 0.150 8 0 "[ . 1 . 2]" 1 40 ALA 0.803 0.090 17 0 "[ . 1 . 2]" 1 41 GLY 0.420 0.041 16 0 "[ . 1 . 2]" 1 42 GLY 0.000 0.000 . 0 "[ . 1 . 2]" 1 43 LYS 2.135 0.121 15 0 "[ . 1 . 2]" 1 44 VAL 1.558 0.102 6 0 "[ . 1 . 2]" 1 45 GLU 0.907 0.140 14 0 "[ . 1 . 2]" 1 46 PRO 0.143 0.047 13 0 "[ . 1 . 2]" 1 47 ASP 2.358 0.236 4 0 "[ . 1 . 2]" 1 48 GLU 4.556 0.236 4 0 "[ . 1 . 2]" 1 49 SER 2.157 0.217 3 0 "[ . 1 . 2]" 1 50 GLN 1.069 0.093 1 0 "[ . 1 . 2]" 1 51 ARG 2.780 0.122 11 0 "[ . 1 . 2]" 1 52 GLN 1.809 0.217 3 0 "[ . 1 . 2]" 1 53 ALA 1.182 0.086 6 0 "[ . 1 . 2]" 1 54 LEU 1.673 0.127 20 0 "[ . 1 . 2]" 1 55 VAL 6.430 0.136 8 0 "[ . 1 . 2]" 1 56 ARG 1.649 0.214 6 0 "[ . 1 . 2]" 1 57 GLU 2.890 0.116 13 0 "[ . 1 . 2]" 1 58 LEU 8.999 0.285 13 0 "[ . 1 . 2]" 1 59 ARG 3.265 0.216 7 0 "[ . 1 . 2]" 1 60 GLU 4.262 0.216 7 0 "[ . 1 . 2]" 1 61 GLU 9.021 0.402 8 0 "[ . 1 . 2]" 1 62 LEU 6.584 0.285 13 0 "[ . 1 . 2]" 1 63 GLY 1.666 0.157 6 0 "[ . 1 . 2]" 1 64 ILE 7.499 0.159 12 0 "[ . 1 . 2]" 1 65 GLU 2.853 0.161 17 0 "[ . 1 . 2]" 1 66 ALA 0.541 0.072 13 0 "[ . 1 . 2]" 1 67 THR 0.410 0.122 17 0 "[ . 1 . 2]" 1 68 VAL 2.635 0.136 8 0 "[ . 1 . 2]" 1 69 GLY 1.642 0.152 8 0 "[ . 1 . 2]" 1 70 GLU 2.293 0.286 6 0 "[ . 1 . 2]" 1 71 TYR 1.377 0.236 10 0 "[ . 1 . 2]" 1 72 VAL 4.518 0.170 8 0 "[ . 1 . 2]" 1 73 ALA 4.886 0.344 8 0 "[ . 1 . 2]" 1 74 SER 0.395 0.104 18 0 "[ . 1 . 2]" 1 75 HIS 2.309 0.140 20 0 "[ . 1 . 2]" 1 76 GLN 1.866 0.171 14 0 "[ . 1 . 2]" 1 77 ARG 4.426 0.146 20 0 "[ . 1 . 2]" 1 78 GLU 2.762 0.084 16 0 "[ . 1 . 2]" 1 79 VAL 10.771 0.301 16 0 "[ . 1 . 2]" 1 80 SER 0.000 0.000 . 0 "[ . 1 . 2]" 1 81 GLY 0.898 0.084 16 0 "[ . 1 . 2]" 1 82 ARG 2.656 0.209 6 0 "[ . 1 . 2]" 1 83 ILE 2.523 0.209 6 0 "[ . 1 . 2]" 1 84 ILE 19.858 0.395 6 0 "[ . 1 . 2]" 1 85 HIS 0.904 0.081 15 0 "[ . 1 . 2]" 1 86 LEU 3.135 0.117 14 0 "[ . 1 . 2]" 1 87 HIS 0.395 0.104 18 0 "[ . 1 . 2]" 1 88 ALA 3.593 0.164 4 0 "[ . 1 . 2]" 1 89 TRP 0.305 0.127 20 0 "[ . 1 . 2]" 1 90 HIS 0.717 0.096 13 0 "[ . 1 . 2]" 1 91 VAL 1.013 0.145 1 0 "[ . 1 . 2]" 1 92 PRO 2.026 0.286 6 0 "[ . 1 . 2]" 1 93 ASP 2.547 0.208 19 0 "[ . 1 . 2]" 1 94 PHE 2.896 0.208 19 0 "[ . 1 . 2]" 1 95 HIS 1.534 0.123 19 0 "[ . 1 . 2]" 1 96 GLY 0.000 0.000 . 0 "[ . 1 . 2]" 1 97 THR 3.497 0.188 19 0 "[ . 1 . 2]" 1 98 LEU 4.357 0.210 13 0 "[ . 1 . 2]" 1 99 GLN 2.701 0.188 19 0 "[ . 1 . 2]" 1 100 ALA 2.619 0.250 17 0 "[ . 1 . 2]" 1 101 HIS 1.406 0.197 20 0 "[ . 1 . 2]" 1 102 GLU 5.501 0.402 8 0 "[ . 1 . 2]" 1 103 HIS 0.886 0.091 11 0 "[ . 1 . 2]" 1 104 GLN 0.280 0.166 10 0 "[ . 1 . 2]" 1 105 ALA 0.349 0.080 10 0 "[ . 1 . 2]" 1 106 LEU 2.503 0.300 10 0 "[ . 1 . 2]" 1 107 VAL 1.416 0.224 17 0 "[ . 1 . 2]" 1 108 TRP 0.540 0.096 19 0 "[ . 1 . 2]" 1 109 CYS 2.070 0.118 4 0 "[ . 1 . 2]" 1 110 SER 3.724 0.185 18 0 "[ . 1 . 2]" 1 111 PRO 1.347 0.132 20 0 "[ . 1 . 2]" 1 112 GLU 0.872 0.109 9 0 "[ . 1 . 2]" 1 113 GLU 0.105 0.059 13 0 "[ . 1 . 2]" 1 114 ALA 2.164 0.104 10 0 "[ . 1 . 2]" 1 115 LEU 6.284 0.155 9 0 "[ . 1 . 2]" 1 116 GLN 1.409 0.153 4 0 "[ . 1 . 2]" 1 117 TYR 1.417 0.112 4 0 "[ . 1 . 2]" 1 118 PRO 1.264 0.129 17 0 "[ . 1 . 2]" 1 119 LEU 2.365 0.112 4 0 "[ . 1 . 2]" 1 120 ALA 0.785 0.216 17 0 "[ . 1 . 2]" 1 121 PRO 0.203 0.051 20 0 "[ . 1 . 2]" 1 122 ALA 2.579 0.125 18 0 "[ . 1 . 2]" 1 123 ASP 2.255 0.155 9 0 "[ . 1 . 2]" 1 124 ILE 0.791 0.067 2 0 "[ . 1 . 2]" 1 125 PRO 1.736 0.140 20 0 "[ . 1 . 2]" 1 126 LEU 1.716 0.175 6 0 "[ . 1 . 2]" 1 127 LEU 3.945 0.153 5 0 "[ . 1 . 2]" 1 128 GLU 3.004 0.154 10 0 "[ . 1 . 2]" 1 129 ALA 9.345 0.333 3 0 "[ . 1 . 2]" 1 130 PHE 0.635 0.066 19 0 "[ . 1 . 2]" 1 131 MET 2.748 0.117 18 0 "[ . 1 . 2]" 1 132 ALA 5.220 0.333 3 0 "[ . 1 . 2]" 1 133 LEU 3.805 0.191 18 0 "[ . 1 . 2]" 1 134 ARG 2.856 0.150 12 0 "[ . 1 . 2]" 1 135 ALA 0.948 0.105 14 0 "[ . 1 . 2]" 1 136 ALA 0.005 0.005 9 0 "[ . 1 . 2]" 1 137 ARG 0.678 0.150 12 0 "[ . 1 . 2]" 1 138 PRO 2.965 0.210 1 0 "[ . 1 . 2]" 1 139 ALA 2.540 0.210 1 0 "[ . 1 . 2]" 1 140 ASP 0.097 0.077 3 0 "[ . 1 . 2]" stop_ loop_ _Distance_constraint_stats.Restraint_ID _Distance_constraint_stats.Atom_1_entity_assembly_ID _Distance_constraint_stats.Atom_1_comp_index_ID _Distance_constraint_stats.Atom_1_comp_ID _Distance_constraint_stats.Atom_1_ID _Distance_constraint_stats.Atom_2_entity_assembly_ID _Distance_constraint_stats.Atom_2_comp_index_ID _Distance_constraint_stats.Atom_2_comp_ID _Distance_constraint_stats.Atom_2_ID _Distance_constraint_stats.Node_1_distance_val _Distance_constraint_stats.Node_1_distance_lower_bound_val _Distance_constraint_stats.Node_1_distance_upper_bound_val _Distance_constraint_stats.Distance_average _Distance_constraint_stats.Distance_minimum _Distance_constraint_stats.Distance_maximum _Distance_constraint_stats.Max_violation _Distance_constraint_stats.Max_violation_model_number _Distance_constraint_stats.Over_cutoff_violation_count _Distance_constraint_stats.Over_cutoff_viol_per_model _Distance_constraint_stats.Distance_constraint_stats_ID 1 1 9 ILE MD 1 84 ILE MD 2.800 . 2.800 2.890 2.857 2.945 0.145 7 0 "[ . 1 . 2]" 1 2 1 9 ILE MG 1 84 ILE MD 2.800 . 2.800 3.134 3.051 3.195 0.395 6 0 "[ . 1 . 2]" 1 3 1 9 ILE MG 1 84 ILE MG 2.800 . 2.800 1.943 1.884 1.999 . 0 0 "[ . 1 . 2]" 1 4 1 11 VAL QG 1 84 ILE MG 2.800 . 2.800 1.984 1.803 2.146 . 0 0 "[ . 1 . 2]" 1 5 1 12 VAL QG 1 44 VAL QG 2.800 . 2.800 1.788 1.732 1.841 0.068 7 0 "[ . 1 . 2]" 1 6 1 12 VAL QG 1 53 ALA MB 2.800 . 2.800 2.024 1.875 2.274 . 0 0 "[ . 1 . 2]" 1 7 1 12 VAL QG 1 54 LEU QD 2.800 . 2.800 2.043 1.927 2.208 . 0 0 "[ . 1 . 2]" 1 8 1 13 ALA MB 1 86 LEU QD 2.800 . 2.800 2.831 2.661 2.913 0.113 10 0 "[ . 1 . 2]" 1 9 1 13 ALA MB 1 88 ALA MB 2.800 . 2.800 2.853 2.811 2.899 0.099 8 0 "[ . 1 . 2]" 1 10 1 14 ALA MB 1 54 LEU QD 2.800 . 2.800 1.773 1.735 2.091 0.065 7 0 "[ . 1 . 2]" 1 11 1 14 ALA MB 1 58 LEU QD 2.800 . 2.800 1.778 1.727 1.829 0.073 19 0 "[ . 1 . 2]" 1 12 1 15 ILE MD 1 22 ILE MD 2.800 . 2.800 2.859 2.812 2.885 0.085 8 0 "[ . 1 . 2]" 1 13 1 15 ILE MD 1 22 ILE MG 2.800 . 2.800 3.078 3.019 3.158 0.358 11 0 "[ . 1 . 2]" 1 14 1 15 ILE MD 1 72 VAL QG 2.800 . 2.800 2.319 1.968 2.812 0.012 14 0 "[ . 1 . 2]" 1 15 1 15 ILE MD 1 88 ALA MB 2.800 . 2.800 2.511 2.294 2.796 . 0 0 "[ . 1 . 2]" 1 16 1 15 ILE MD 1 127 LEU QD 2.800 . 2.800 2.779 2.677 2.838 0.038 11 0 "[ . 1 . 2]" 1 17 1 15 ILE MG 1 22 ILE MD 2.800 . 2.800 2.393 2.227 2.495 . 0 0 "[ . 1 . 2]" 1 18 1 15 ILE MG 1 22 ILE MG 2.800 . 2.800 1.747 1.720 1.775 0.080 17 0 "[ . 1 . 2]" 1 19 1 15 ILE MG 1 127 LEU QD 3.500 . 3.500 3.497 3.339 3.559 0.059 12 0 "[ . 1 . 2]" 1 20 1 16 ILE MD 1 23 LEU QD 2.800 . 2.800 2.414 1.779 2.939 0.139 19 0 "[ . 1 . 2]" 1 21 1 16 ILE MD 1 58 LEU QD 2.800 . 2.800 2.034 1.855 2.403 . 0 0 "[ . 1 . 2]" 1 22 1 16 ILE MD 1 62 LEU QD 2.800 . 2.800 2.184 1.865 2.688 . 0 0 "[ . 1 . 2]" 1 23 1 16 ILE MD 1 64 ILE MD 2.800 . 2.800 2.079 1.797 2.439 0.003 9 0 "[ . 1 . 2]" 1 24 1 16 ILE MG 1 23 LEU QD 2.800 . 2.800 2.606 2.207 2.827 0.027 13 0 "[ . 1 . 2]" 1 25 1 16 ILE MG 1 64 ILE MD 2.800 . 2.800 2.898 2.846 2.958 0.158 13 0 "[ . 1 . 2]" 1 26 1 22 ILE MD 1 114 ALA MB 2.800 . 2.800 2.773 2.540 2.898 0.098 13 0 "[ . 1 . 2]" 1 27 1 22 ILE MD 1 127 LEU QD 2.800 . 2.800 1.882 1.790 2.069 0.010 16 0 "[ . 1 . 2]" 1 28 1 23 LEU QD 1 106 LEU QD 2.800 . 2.800 2.024 1.772 2.494 0.028 10 0 "[ . 1 . 2]" 1 29 1 24 LEU QD 1 107 VAL QG 2.800 . 2.800 2.514 1.985 2.853 0.053 13 0 "[ . 1 . 2]" 1 30 1 24 LEU QD 1 114 ALA MB 2.800 . 2.800 2.032 1.788 2.307 0.012 4 0 "[ . 1 . 2]" 1 31 1 24 LEU QD 1 119 LEU QD 2.800 . 2.800 1.862 1.762 2.054 0.038 10 0 "[ . 1 . 2]" 1 32 1 25 ALA MB 1 100 ALA MB 3.500 . 3.500 3.598 3.503 3.750 0.250 17 0 "[ . 1 . 2]" 1 33 1 25 ALA MB 1 106 LEU QD 2.800 . 2.800 2.078 1.854 2.449 . 0 0 "[ . 1 . 2]" 1 34 1 40 ALA MB 1 58 LEU QD 2.800 . 2.800 2.330 2.056 2.797 . 0 0 "[ . 1 . 2]" 1 35 1 40 ALA MB 1 62 LEU QD 2.800 . 2.800 1.845 1.773 2.088 0.027 20 0 "[ . 1 . 2]" 1 36 1 44 VAL QG 1 53 ALA MB 2.800 . 2.800 2.081 1.836 2.568 . 0 0 "[ . 1 . 2]" 1 37 1 54 LEU QD 1 58 LEU QD 2.800 . 2.800 2.617 2.406 2.850 0.050 5 0 "[ . 1 . 2]" 1 38 1 55 VAL QG 1 66 ALA MB 2.800 . 2.800 2.734 2.396 2.861 0.061 17 0 "[ . 1 . 2]" 1 39 1 58 LEU QD 1 66 ALA MB 2.800 . 2.800 1.890 1.791 2.272 0.009 4 0 "[ . 1 . 2]" 1 40 1 62 LEU QD 1 64 ILE MD 2.800 . 2.800 2.350 2.162 2.528 . 0 0 "[ . 1 . 2]" 1 41 1 64 ILE MD 1 98 LEU QD 2.800 . 2.800 2.775 2.077 2.959 0.159 12 0 "[ . 1 . 2]" 1 42 1 64 ILE MG 1 98 LEU QD 2.800 . 2.800 2.706 1.776 2.884 0.084 14 0 "[ . 1 . 2]" 1 43 1 72 VAL QG 1 88 ALA MB 2.800 . 2.800 2.873 2.626 2.964 0.164 4 0 "[ . 1 . 2]" 1 44 1 72 VAL QG 1 129 ALA MB 2.800 . 2.800 2.918 2.854 2.970 0.170 8 0 "[ . 1 . 2]" 1 45 1 72 VAL QG 1 133 LEU QD 2.800 . 2.800 2.098 1.765 2.826 0.035 8 0 "[ . 1 . 2]" 1 46 1 73 ALA MB 1 129 ALA MB 2.800 . 2.800 2.056 1.760 2.246 0.040 14 0 "[ . 1 . 2]" 1 47 1 79 VAL QG 1 84 ILE MD 2.800 . 2.800 2.070 1.988 2.190 . 0 0 "[ . 1 . 2]" 1 48 1 79 VAL QG 1 84 ILE MG 2.800 . 2.800 2.966 2.902 3.042 0.242 2 0 "[ . 1 . 2]" 1 49 1 86 LEU QD 1 122 ALA MB 2.800 . 2.800 1.836 1.775 2.133 0.025 14 0 "[ . 1 . 2]" 1 50 1 86 LEU QD 1 126 LEU QD 2.800 . 2.800 2.424 2.183 2.750 . 0 0 "[ . 1 . 2]" 1 51 1 88 ALA MB 1 126 LEU QD 2.800 . 2.800 1.790 1.766 1.852 0.034 1 0 "[ . 1 . 2]" 1 52 1 100 ALA MB 1 106 LEU QD 2.800 . 2.800 1.808 1.748 2.124 0.052 17 0 "[ . 1 . 2]" 1 53 1 114 ALA MB 1 119 LEU QD 2.800 . 2.800 2.408 2.259 2.543 . 0 0 "[ . 1 . 2]" 1 54 1 114 ALA MB 1 127 LEU QD 2.800 . 2.800 2.431 2.200 2.583 . 0 0 "[ . 1 . 2]" 1 55 1 115 LEU QD 1 127 LEU QD 2.800 . 2.800 1.851 1.748 2.097 0.052 15 0 "[ . 1 . 2]" 1 56 1 119 LEU QD 1 127 LEU QD 3.500 . 3.500 3.227 3.030 3.394 . 0 0 "[ . 1 . 2]" 1 57 1 129 ALA MB 1 132 ALA MB 2.800 . 2.800 3.057 3.004 3.133 0.333 3 0 "[ . 1 . 2]" 1 58 1 129 ALA MB 1 133 LEU QD 2.800 . 2.800 2.861 2.782 2.991 0.191 18 0 "[ . 1 . 2]" 1 59 1 6 MET HA 1 7 LYS H 3.200 . 3.200 2.253 2.095 2.667 . 0 0 "[ . 1 . 2]" 1 60 1 7 LYS H 1 82 ARG HA . . 3.990 3.117 2.552 3.863 . 0 0 "[ . 1 . 2]" 1 61 1 7 LYS HA 1 8 MET H . . 2.880 2.283 2.154 2.453 . 0 0 "[ . 1 . 2]" 1 62 1 8 MET HA 1 9 ILE H . . 2.960 2.101 2.053 2.158 . 0 0 "[ . 1 . 2]" 1 63 1 9 ILE H 1 83 ILE H 4.200 . 4.200 3.827 3.648 3.994 . 0 0 "[ . 1 . 2]" 1 64 1 9 ILE H 1 84 ILE HA 3.200 . 3.200 2.515 2.357 2.705 . 0 0 "[ . 1 . 2]" 1 65 1 9 ILE H 1 85 HIS H 4.200 . 4.200 3.700 3.524 3.881 . 0 0 "[ . 1 . 2]" 1 66 1 9 ILE HA 1 10 GLU H . . 2.800 2.178 2.159 2.211 . 0 0 "[ . 1 . 2]" 1 67 1 10 GLU HA 1 11 VAL H . . 3.000 2.144 2.110 2.193 . 0 0 "[ . 1 . 2]" 1 68 1 11 VAL H 1 86 LEU HA . . 3.900 2.938 2.775 3.158 . 0 0 "[ . 1 . 2]" 1 69 1 11 VAL H 1 87 HIS H 4.200 . 4.200 3.987 3.746 4.131 . 0 0 "[ . 1 . 2]" 1 70 1 11 VAL HA 1 12 VAL H 3.200 . 3.200 2.150 2.092 2.224 . 0 0 "[ . 1 . 2]" 1 71 1 12 VAL H 1 42 GLY H . . 4.030 3.207 3.054 3.365 . 0 0 "[ . 1 . 2]" 1 72 1 12 VAL H 1 43 LYS HA . . 4.010 3.286 2.666 3.549 . 0 0 "[ . 1 . 2]" 1 73 1 12 VAL HA 1 13 ALA H . . 3.030 2.161 2.125 2.206 . 0 0 "[ . 1 . 2]" 1 74 1 13 ALA H 1 87 HIS H . . 4.010 3.276 3.160 3.448 . 0 0 "[ . 1 . 2]" 1 75 1 13 ALA HA 1 14 ALA H . . 3.000 2.160 2.115 2.190 . 0 0 "[ . 1 . 2]" 1 76 1 14 ALA HA 1 15 ILE H . . 3.070 2.126 2.106 2.149 . 0 0 "[ . 1 . 2]" 1 77 1 15 ILE H 1 90 HIS HA . . 3.980 3.155 2.761 3.525 . 0 0 "[ . 1 . 2]" 1 78 1 15 ILE HA 1 16 ILE H 3.200 . 3.200 2.184 2.153 2.207 . 0 0 "[ . 1 . 2]" 1 79 1 16 ILE HA 1 17 GLU H 3.200 . 3.200 2.182 2.128 2.228 . 0 0 "[ . 1 . 2]" 1 80 1 17 GLU HA 1 18 ARG H 3.200 . 3.200 2.097 2.057 2.142 . 0 0 "[ . 1 . 2]" 1 81 1 18 ARG HA 1 19 ASP H 3.200 . 3.200 2.157 2.076 2.280 . 0 0 "[ . 1 . 2]" 1 82 1 19 ASP HA 1 20 GLY H 3.200 . 3.200 3.159 2.949 3.386 0.186 5 0 "[ . 1 . 2]" 1 83 1 20 GLY QA 1 21 LYS H 3.200 . 3.200 2.910 2.871 2.932 . 0 0 "[ . 1 . 2]" 1 84 1 21 LYS HA 1 22 ILE H 3.200 . 3.200 2.259 2.197 2.402 . 0 0 "[ . 1 . 2]" 1 85 1 22 ILE H 1 110 SER HA 4.200 . 4.200 3.259 3.049 3.484 . 0 0 "[ . 1 . 2]" 1 86 1 22 ILE HA 1 23 LEU H 3.200 . 3.200 2.242 2.174 2.281 . 0 0 "[ . 1 . 2]" 1 87 1 23 LEU HA 1 24 LEU H . . 3.180 2.100 2.073 2.152 . 0 0 "[ . 1 . 2]" 1 88 1 24 LEU H 1 107 VAL H . . 3.920 2.848 2.668 2.987 . 0 0 "[ . 1 . 2]" 1 89 1 24 LEU H 1 108 TRP HA 4.200 . 4.200 3.496 3.120 3.769 . 0 0 "[ . 1 . 2]" 1 90 1 24 LEU HA 1 25 ALA H . . 3.180 2.198 2.133 2.327 . 0 0 "[ . 1 . 2]" 1 91 1 25 ALA H 1 38 GLU H . . 3.690 2.743 2.256 3.002 . 0 0 "[ . 1 . 2]" 1 92 1 25 ALA HA 1 26 GLN H 3.200 . 3.200 2.122 2.076 2.167 . 0 0 "[ . 1 . 2]" 1 93 1 26 GLN H 1 105 ALA H . . 4.040 2.930 2.530 3.290 . 0 0 "[ . 1 . 2]" 1 94 1 26 GLN H 1 106 LEU HA . . 4.170 3.536 3.144 3.767 . 0 0 "[ . 1 . 2]" 1 95 1 26 GLN HA 1 27 ARG H 3.200 . 3.200 2.118 2.055 2.188 . 0 0 "[ . 1 . 2]" 1 96 1 27 ARG H 1 37 TRP HA . . 4.140 2.912 2.400 3.535 . 0 0 "[ . 1 . 2]" 1 97 1 35 GLY QA 1 36 LEU H 3.200 . 3.200 2.820 2.768 2.871 . 0 0 "[ . 1 . 2]" 1 98 1 36 LEU HA 1 37 TRP H 3.200 . 3.200 2.254 2.114 2.327 . 0 0 "[ . 1 . 2]" 1 99 1 37 TRP HA 1 38 GLU H 3.200 . 3.200 2.283 2.240 2.385 . 0 0 "[ . 1 . 2]" 1 100 1 38 GLU HA 1 39 PHE H 3.200 . 3.200 2.421 2.277 2.604 . 0 0 "[ . 1 . 2]" 1 101 1 39 PHE HA 1 40 ALA H 3.200 . 3.200 2.228 2.123 2.397 . 0 0 "[ . 1 . 2]" 1 102 1 40 ALA HA 1 41 GLY H . . 2.890 2.368 2.251 2.560 . 0 0 "[ . 1 . 2]" 1 103 1 13 ALA HA 1 42 GLY H 4.200 . 4.200 3.717 3.562 3.915 . 0 0 "[ . 1 . 2]" 1 104 1 41 GLY QA 1 42 GLY H 3.200 . 3.200 2.131 2.111 2.170 . 0 0 "[ . 1 . 2]" 1 105 1 42 GLY QA 1 43 LYS H 3.200 . 3.200 2.222 2.120 2.280 . 0 0 "[ . 1 . 2]" 1 106 1 11 VAL HA 1 44 VAL H 3.200 . 3.200 3.093 2.837 3.253 0.053 15 0 "[ . 1 . 2]" 1 107 1 43 LYS HA 1 44 VAL H . . 3.070 2.286 2.262 2.339 . 0 0 "[ . 1 . 2]" 1 108 1 44 VAL HA 1 45 GLU H . . 3.150 2.167 2.144 2.202 . 0 0 "[ . 1 . 2]" 1 109 1 47 ASP HA 1 48 GLU H 3.200 . 3.200 3.297 3.127 3.436 0.236 4 0 "[ . 1 . 2]" 1 110 1 49 SER HA 1 50 GLN H 3.200 . 3.200 2.413 2.333 2.499 . 0 0 "[ . 1 . 2]" 1 111 1 50 GLN HA 1 51 ARG H 4.200 . 4.200 3.565 3.533 3.594 . 0 0 "[ . 1 . 2]" 1 112 1 51 ARG HA 1 52 GLN H 4.200 . 4.200 3.483 3.432 3.515 . 0 0 "[ . 1 . 2]" 1 113 1 50 GLN HA 1 53 ALA H . . 4.190 3.547 3.260 3.817 . 0 0 "[ . 1 . 2]" 1 114 1 52 GLN HA 1 53 ALA H 4.200 . 4.200 3.523 3.495 3.547 . 0 0 "[ . 1 . 2]" 1 115 1 51 ARG HA 1 54 LEU H . . 4.120 3.559 3.270 3.708 . 0 0 "[ . 1 . 2]" 1 116 1 53 ALA HA 1 54 LEU H 4.200 . 4.200 3.571 3.559 3.589 . 0 0 "[ . 1 . 2]" 1 117 1 51 ARG HA 1 55 VAL H 4.200 . 4.200 4.192 4.021 4.276 0.076 7 0 "[ . 1 . 2]" 1 118 1 52 GLN HA 1 55 VAL H . . 4.060 3.442 3.236 3.578 . 0 0 "[ . 1 . 2]" 1 119 1 52 GLN HA 1 56 ARG H 4.200 . 4.200 4.031 3.790 4.224 0.024 4 0 "[ . 1 . 2]" 1 120 1 53 ALA HA 1 56 ARG H 4.200 . 4.200 3.637 3.470 3.762 . 0 0 "[ . 1 . 2]" 1 121 1 54 LEU HA 1 57 GLU H 4.200 . 4.200 3.691 3.587 3.911 . 0 0 "[ . 1 . 2]" 1 122 1 54 LEU HA 1 58 LEU H 4.200 . 4.200 3.746 3.640 3.984 . 0 0 "[ . 1 . 2]" 1 123 1 55 VAL HA 1 58 LEU H 4.200 . 4.200 3.945 3.777 4.203 0.003 19 0 "[ . 1 . 2]" 1 124 1 55 VAL HA 1 59 ARG H 4.200 . 4.200 4.197 4.069 4.285 0.085 11 0 "[ . 1 . 2]" 1 125 1 56 ARG HA 1 59 ARG H . . 4.130 3.395 3.165 3.633 . 0 0 "[ . 1 . 2]" 1 126 1 58 LEU HA 1 59 ARG H 4.200 . 4.200 3.525 3.501 3.557 . 0 0 "[ . 1 . 2]" 1 127 1 57 GLU HA 1 60 GLU H . . 4.090 3.345 3.154 3.478 . 0 0 "[ . 1 . 2]" 1 128 1 59 ARG HA 1 60 GLU H 4.200 . 4.200 3.509 3.468 3.532 . 0 0 "[ . 1 . 2]" 1 129 1 58 LEU HA 1 61 GLU H . . 3.950 3.194 3.050 3.359 . 0 0 "[ . 1 . 2]" 1 130 1 58 LEU HA 1 62 LEU H . . 4.010 2.593 2.435 2.766 . 0 0 "[ . 1 . 2]" 1 131 1 61 GLU HA 1 62 LEU H 4.200 . 4.200 3.561 3.527 3.587 . 0 0 "[ . 1 . 2]" 1 132 1 60 GLU HA 1 63 GLY H 4.200 . 4.200 4.279 4.210 4.357 0.157 6 0 "[ . 1 . 2]" 1 133 1 62 LEU HA 1 63 GLY H 4.200 . 4.200 3.257 3.151 3.496 . 0 0 "[ . 1 . 2]" 1 134 1 64 ILE HA 1 65 GLU H . . 3.070 2.166 2.113 2.201 . 0 0 "[ . 1 . 2]" 1 135 1 66 ALA HA 1 67 THR H . . 3.050 2.265 2.205 2.371 . 0 0 "[ . 1 . 2]" 1 136 1 69 GLY QA 1 70 GLU H 3.200 . 3.200 2.405 2.272 2.579 . 0 0 "[ . 1 . 2]" 1 137 1 70 GLU HA 1 71 TYR H . . 2.960 2.143 2.070 2.274 . 0 0 "[ . 1 . 2]" 1 138 1 71 TYR HA 1 72 VAL H 3.200 . 3.200 2.206 2.154 2.290 . 0 0 "[ . 1 . 2]" 1 139 1 72 VAL HA 1 73 ALA H 4.200 . 4.200 3.577 3.562 3.616 . 0 0 "[ . 1 . 2]" 1 140 1 73 ALA H 1 88 ALA H . . 4.040 3.330 3.177 3.470 . 0 0 "[ . 1 . 2]" 1 141 1 73 ALA HA 1 74 SER H . . 2.960 2.508 2.356 2.623 . 0 0 "[ . 1 . 2]" 1 142 1 74 SER HA 1 75 HIS H 3.200 . 3.200 2.281 2.200 2.332 . 0 0 "[ . 1 . 2]" 1 143 1 75 HIS HA 1 76 GLN H . . 3.140 2.203 2.136 2.260 . 0 0 "[ . 1 . 2]" 1 144 1 76 GLN HA 1 77 ARG H . . 2.920 2.155 2.134 2.173 . 0 0 "[ . 1 . 2]" 1 145 1 77 ARG H 1 84 ILE H 3.200 . 3.200 3.189 3.006 3.275 0.075 17 0 "[ . 1 . 2]" 1 146 1 77 ARG H 1 85 HIS HA . . 4.150 3.960 3.744 4.174 0.024 7 0 "[ . 1 . 2]" 1 147 1 77 ARG HA 1 78 GLU H . . 2.850 2.569 2.461 2.618 . 0 0 "[ . 1 . 2]" 1 148 1 78 GLU HA 1 79 VAL H . . 2.890 2.213 2.141 2.253 . 0 0 "[ . 1 . 2]" 1 149 1 79 VAL HA 1 80 SER H 4.200 . 4.200 2.173 2.157 2.194 . 0 0 "[ . 1 . 2]" 1 150 1 80 SER HA 1 81 GLY H 3.200 . 3.200 2.464 2.347 2.571 . 0 0 "[ . 1 . 2]" 1 151 1 81 GLY QA 1 82 ARG H 3.200 . 3.200 2.896 2.861 2.938 . 0 0 "[ . 1 . 2]" 1 152 1 8 MET HA 1 83 ILE H 3.200 . 3.200 2.820 2.578 3.055 . 0 0 "[ . 1 . 2]" 1 153 1 82 ARG HA 1 83 ILE H . . 2.950 2.230 2.192 2.317 . 0 0 "[ . 1 . 2]" 1 154 1 78 GLU HA 1 84 ILE H 3.200 . 3.200 2.423 2.298 2.793 . 0 0 "[ . 1 . 2]" 1 155 1 83 ILE HA 1 84 ILE H . . 2.990 2.121 2.096 2.165 . 0 0 "[ . 1 . 2]" 1 156 1 10 GLU HA 1 85 HIS H . . 3.910 2.681 2.474 2.847 . 0 0 "[ . 1 . 2]" 1 157 1 84 ILE HA 1 85 HIS H . . 2.950 2.133 2.107 2.161 . 0 0 "[ . 1 . 2]" 1 158 1 85 HIS HA 1 86 LEU H . . 3.090 2.209 2.186 2.249 . 0 0 "[ . 1 . 2]" 1 159 1 12 VAL HA 1 87 HIS H 3.200 . 3.200 2.408 2.304 2.525 . 0 0 "[ . 1 . 2]" 1 160 1 86 LEU HA 1 87 HIS H . . 3.080 2.122 2.088 2.150 . 0 0 "[ . 1 . 2]" 1 161 1 74 SER HA 1 88 ALA H . . 4.090 2.830 2.627 3.001 . 0 0 "[ . 1 . 2]" 1 162 1 87 HIS HA 1 88 ALA H 3.200 . 3.200 2.179 2.111 2.210 . 0 0 "[ . 1 . 2]" 1 163 1 14 ALA HA 1 89 TRP H . . 4.090 3.178 3.026 3.457 . 0 0 "[ . 1 . 2]" 1 164 1 88 ALA HA 1 89 TRP H . . 3.060 2.130 2.097 2.212 . 0 0 "[ . 1 . 2]" 1 165 1 89 TRP HA 1 90 HIS H 3.200 . 3.200 2.218 2.113 2.295 . 0 0 "[ . 1 . 2]" 1 166 1 16 ILE HA 1 91 VAL H . . 3.940 3.255 2.873 3.633 . 0 0 "[ . 1 . 2]" 1 167 1 17 GLU H 1 91 VAL H 4.200 . 4.200 3.618 3.163 4.233 0.033 3 0 "[ . 1 . 2]" 1 168 1 90 HIS HA 1 91 VAL H . . 3.190 2.160 2.123 2.231 . 0 0 "[ . 1 . 2]" 1 169 1 92 PRO QD 1 93 ASP H 3.200 . 3.200 2.506 2.166 2.954 . 0 0 "[ . 1 . 2]" 1 170 1 93 ASP HA 1 94 PHE H . . 2.820 2.218 2.135 2.507 . 0 0 "[ . 1 . 2]" 1 171 1 94 PHE HA 1 95 HIS H 3.200 . 3.200 2.239 2.167 2.468 . 0 0 "[ . 1 . 2]" 1 172 1 95 HIS HA 1 96 GLY H 4.200 . 4.200 2.165 2.140 2.221 . 0 0 "[ . 1 . 2]" 1 173 1 96 GLY QA 1 97 THR H 3.200 . 3.200 2.253 2.212 2.279 . 0 0 "[ . 1 . 2]" 1 174 1 97 THR HA 1 98 LEU H . . 2.820 2.162 2.096 2.283 . 0 0 "[ . 1 . 2]" 1 175 1 98 LEU HA 1 99 GLN H . . 2.810 2.073 2.044 2.161 . 0 0 "[ . 1 . 2]" 1 176 1 99 GLN HA 1 100 ALA H . . 3.040 2.431 2.273 2.522 . 0 0 "[ . 1 . 2]" 1 177 1 104 GLN HA 1 105 ALA H 4.200 . 4.200 3.572 3.536 3.596 . 0 0 "[ . 1 . 2]" 1 178 1 105 ALA HA 1 106 LEU H . . 2.890 2.376 2.255 2.481 . 0 0 "[ . 1 . 2]" 1 179 1 25 ALA HA 1 107 VAL H 4.200 . 4.200 3.726 3.503 3.936 . 0 0 "[ . 1 . 2]" 1 180 1 106 LEU HA 1 107 VAL H . . 3.160 2.193 2.124 2.227 . 0 0 "[ . 1 . 2]" 1 181 1 107 VAL HA 1 108 TRP H . . 2.840 2.201 2.105 2.240 . 0 0 "[ . 1 . 2]" 1 182 1 23 LEU HA 1 109 CYS H 4.200 . 4.200 4.095 3.900 4.238 0.038 2 0 "[ . 1 . 2]" 1 183 1 108 TRP HA 1 109 CYS H . . 3.040 2.124 2.070 2.163 . 0 0 "[ . 1 . 2]" 1 184 1 109 CYS HA 1 110 SER H . . 2.990 2.349 2.262 2.414 . 0 0 "[ . 1 . 2]" 1 185 1 112 GLU HA 1 113 GLU H 4.200 . 4.200 3.494 3.460 3.546 . 0 0 "[ . 1 . 2]" 1 186 1 111 PRO HA 1 114 ALA H . . 4.100 3.616 3.446 3.692 . 0 0 "[ . 1 . 2]" 1 187 1 112 GLU HA 1 115 LEU H . . 4.150 3.703 3.385 3.971 . 0 0 "[ . 1 . 2]" 1 188 1 114 ALA HA 1 115 LEU H 4.200 . 4.200 3.530 3.497 3.558 . 0 0 "[ . 1 . 2]" 1 189 1 118 PRO HA 1 119 LEU H . . 3.020 2.411 2.307 2.481 . 0 0 "[ . 1 . 2]" 1 190 1 119 LEU HA 1 120 ALA H . . 3.010 2.298 2.267 2.319 . 0 0 "[ . 1 . 2]" 1 191 1 121 PRO HA 1 122 ALA H 4.200 . 4.200 3.463 3.362 3.555 . 0 0 "[ . 1 . 2]" 1 192 1 121 PRO HA 1 124 ILE H . . 4.190 3.846 3.523 4.175 . 0 0 "[ . 1 . 2]" 1 193 1 123 ASP HA 1 124 ILE H 4.200 . 4.200 3.442 3.418 3.470 . 0 0 "[ . 1 . 2]" 1 194 1 123 ASP HA 1 126 LEU H 4.200 . 4.200 3.578 3.307 3.823 . 0 0 "[ . 1 . 2]" 1 195 1 125 PRO HA 1 128 GLU H . . 4.120 3.489 3.298 3.664 . 0 0 "[ . 1 . 2]" 1 196 1 125 PRO HA 1 129 ALA H 5.000 . 5.000 4.262 4.068 4.560 . 0 0 "[ . 1 . 2]" 1 197 1 126 LEU HA 1 129 ALA H 4.200 . 4.200 3.692 3.621 3.778 . 0 0 "[ . 1 . 2]" 1 198 1 126 LEU HA 1 130 PHE H 5.000 . 5.000 4.626 4.484 4.793 . 0 0 "[ . 1 . 2]" 1 199 1 127 LEU HA 1 130 PHE H . . 3.560 3.004 2.906 3.076 . 0 0 "[ . 1 . 2]" 1 200 1 127 LEU HA 1 131 MET H 4.200 . 4.200 3.828 3.767 3.924 . 0 0 "[ . 1 . 2]" 1 201 1 128 GLU HA 1 131 MET H 4.200 . 4.200 3.886 3.640 4.059 . 0 0 "[ . 1 . 2]" 1 202 1 128 GLU HA 1 132 ALA H 4.200 . 4.200 4.125 3.979 4.224 0.024 17 0 "[ . 1 . 2]" 1 203 1 129 ALA HA 1 132 ALA H 4.200 . 4.200 3.049 2.981 3.103 . 0 0 "[ . 1 . 2]" 1 204 1 129 ALA HA 1 133 LEU H 4.200 . 4.200 3.794 3.589 4.014 . 0 0 "[ . 1 . 2]" 1 205 1 130 PHE HA 1 133 LEU H . . 3.990 3.317 3.127 3.570 . 0 0 "[ . 1 . 2]" 1 206 1 131 MET HA 1 134 ARG H . . 3.960 3.233 3.065 3.483 . 0 0 "[ . 1 . 2]" 1 207 1 131 MET HA 1 135 ALA H 4.200 . 4.200 4.242 4.203 4.305 0.105 14 0 "[ . 1 . 2]" 1 208 1 132 ALA HA 1 135 ALA H . . 3.780 3.433 3.253 3.612 . 0 0 "[ . 1 . 2]" 1 209 1 133 LEU HA 1 136 ALA H 4.200 . 4.200 3.723 3.456 4.205 0.005 9 0 "[ . 1 . 2]" 1 210 1 133 LEU HA 1 137 ARG H 4.200 . 4.200 3.420 3.107 4.186 . 0 0 "[ . 1 . 2]" 1 211 1 134 ARG HA 1 137 ARG H 4.200 . 4.200 3.810 3.454 4.190 . 0 0 "[ . 1 . 2]" 1 212 1 15 ILE MD 1 39 PHE QD 3.500 . 3.500 3.454 2.696 3.650 0.150 8 0 "[ . 1 . 2]" 1 213 1 15 ILE MD 1 39 PHE QE 3.500 . 3.500 2.683 2.030 3.002 . 0 0 "[ . 1 . 2]" 1 214 1 15 ILE MD 1 130 PHE QD 2.800 . 2.800 2.575 2.408 2.769 . 0 0 "[ . 1 . 2]" 1 215 1 15 ILE MD 1 130 PHE QE 3.500 . 3.500 3.494 3.250 3.545 0.045 19 0 "[ . 1 . 2]" 1 216 1 15 ILE MG 1 39 PHE QD 3.500 . 3.500 3.476 3.223 3.580 0.080 5 0 "[ . 1 . 2]" 1 217 1 15 ILE MG 1 39 PHE QE 3.500 . 3.500 2.743 2.446 2.996 . 0 0 "[ . 1 . 2]" 1 218 1 15 ILE MG 1 130 PHE QD 3.500 . 3.500 3.233 3.071 3.437 . 0 0 "[ . 1 . 2]" 1 219 1 15 ILE MG 1 130 PHE QE 3.500 . 3.500 2.819 2.674 2.973 . 0 0 "[ . 1 . 2]" 1 220 1 39 PHE HA 1 39 PHE QD 2.800 . 2.800 2.659 2.108 2.939 0.139 13 0 "[ . 1 . 2]" 1 221 1 39 PHE QB 1 39 PHE QD 2.800 . 2.800 2.134 2.097 2.296 . 0 0 "[ . 1 . 2]" 1 222 1 64 ILE MD 1 94 PHE QD 2.800 . 2.800 2.837 2.760 2.896 0.096 14 0 "[ . 1 . 2]" 1 223 1 71 TYR HA 1 71 TYR QD 2.800 . 2.800 2.568 1.979 2.888 0.088 10 0 "[ . 1 . 2]" 1 224 1 71 TYR QB 1 71 TYR QD 2.800 . 2.800 2.152 2.128 2.314 . 0 0 "[ . 1 . 2]" 1 225 1 94 PHE QB 1 94 PHE QD 2.800 . 2.800 2.126 2.123 2.131 . 0 0 "[ . 1 . 2]" 1 226 1 130 PHE HA 1 130 PHE QD 2.800 . 2.800 2.770 2.617 2.866 0.066 19 0 "[ . 1 . 2]" 1 227 1 130 PHE QB 1 130 PHE QD 2.800 . 2.800 2.125 2.120 2.130 . 0 0 "[ . 1 . 2]" 1 228 1 52 GLN HA 1 55 VAL MG2 5.180 . 5.180 3.112 2.697 3.357 . 0 0 "[ . 1 . 2]" 1 229 1 25 ALA MB 1 39 PHE H 5.750 . 5.750 5.581 5.234 5.795 0.045 2 0 "[ . 1 . 2]" 1 230 1 25 ALA MB 1 106 LEU HA 4.730 . 4.730 3.653 3.449 3.815 . 0 0 "[ . 1 . 2]" 1 231 1 24 LEU HA 1 25 ALA MB 4.850 . 4.850 3.902 3.823 3.971 . 0 0 "[ . 1 . 2]" 1 232 1 107 VAL HA 1 107 VAL MG2 3.740 . 3.740 2.365 2.272 3.218 . 0 0 "[ . 1 . 2]" 1 233 1 24 LEU HB2 1 107 VAL MG2 4.400 . 4.400 4.188 1.859 4.428 0.028 5 0 "[ . 1 . 2]" 1 234 1 25 ALA MB 1 103 HIS HB3 4.830 . 4.830 2.110 1.778 2.492 0.022 10 0 "[ . 1 . 2]" 1 235 1 25 ALA MB 1 103 HIS HB2 4.830 . 4.830 2.439 2.149 2.889 . 0 0 "[ . 1 . 2]" 1 236 1 48 GLU HA 1 53 ALA MB 5.650 . 5.650 5.504 5.337 5.697 0.047 11 0 "[ . 1 . 2]" 1 237 1 49 SER HA 1 53 ALA MB 5.750 . 5.750 5.005 4.780 5.257 . 0 0 "[ . 1 . 2]" 1 238 1 44 VAL HA 1 53 ALA MB 3.280 . 3.280 2.554 2.190 2.756 . 0 0 "[ . 1 . 2]" 1 239 1 50 GLN HA 1 53 ALA MB 3.800 . 3.800 2.869 2.572 3.366 . 0 0 "[ . 1 . 2]" 1 240 1 48 GLU HB2 1 53 ALA MB 3.800 . 3.800 3.760 3.536 3.886 0.086 6 0 "[ . 1 . 2]" 1 241 1 12 VAL MG2 1 53 ALA MB 3.730 . 3.730 2.052 1.891 2.312 . 0 0 "[ . 1 . 2]" 1 242 1 72 VAL MG2 1 130 PHE HA 4.490 . 4.490 3.806 3.606 4.129 . 0 0 "[ . 1 . 2]" 1 243 1 72 VAL HA 1 72 VAL MG2 3.510 . 3.510 2.379 2.317 2.430 . 0 0 "[ . 1 . 2]" 1 244 1 72 VAL MG2 1 130 PHE HB2 4.930 . 4.930 3.689 3.406 4.015 . 0 0 "[ . 1 . 2]" 1 245 1 72 VAL MG2 1 130 PHE HB3 5.250 . 5.250 4.962 4.743 5.169 . 0 0 "[ . 1 . 2]" 1 246 1 15 ILE MD 1 72 VAL MG2 3.680 . 3.680 2.537 2.120 3.347 . 0 0 "[ . 1 . 2]" 1 247 1 122 ALA MB 1 125 PRO HD2 4.990 . 4.990 4.356 4.201 4.509 . 0 0 "[ . 1 . 2]" 1 248 1 86 LEU HB3 1 122 ALA MB 4.050 . 4.050 4.078 3.883 4.167 0.117 14 0 "[ . 1 . 2]" 1 249 1 86 LEU MD1 1 122 ALA MB 3.760 . 3.760 2.531 2.317 2.821 . 0 0 "[ . 1 . 2]" 1 250 1 86 LEU MD2 1 122 ALA MB 3.760 . 3.760 1.889 1.810 2.239 . 0 0 "[ . 1 . 2]" 1 251 1 28 PRO HD2 1 29 ALA MB 5.750 . 5.750 5.387 4.518 5.898 0.148 19 0 "[ . 1 . 2]" 1 252 1 122 ALA MB 1 125 PRO HD3 5.750 . 5.750 5.448 5.263 5.648 . 0 0 "[ . 1 . 2]" 1 253 1 28 PRO HB2 1 29 ALA MB 4.790 . 4.790 4.049 3.137 4.632 . 0 0 "[ . 1 . 2]" 1 254 1 114 ALA MB 1 117 TYR QD 5.480 . 5.480 4.157 3.889 4.652 . 0 0 "[ . 1 . 2]" 1 255 1 29 ALA MB 1 30 GLN HG2 5.320 . 5.320 3.690 2.707 4.233 . 0 0 "[ . 1 . 2]" 1 256 1 29 ALA MB 1 30 GLN HG3 5.320 . 5.320 2.919 2.498 4.448 . 0 0 "[ . 1 . 2]" 1 257 1 28 PRO HG2 1 29 ALA MB 4.890 . 4.890 4.817 4.629 4.967 0.077 4 0 "[ . 1 . 2]" 1 258 1 22 ILE HB 1 114 ALA MB 4.150 . 4.150 3.199 2.918 3.532 . 0 0 "[ . 1 . 2]" 1 259 1 24 LEU MD2 1 114 ALA MB 3.840 . 3.840 2.341 1.861 3.121 . 0 0 "[ . 1 . 2]" 1 260 1 24 LEU MD1 1 114 ALA MB 3.840 . 3.840 2.335 2.074 2.529 . 0 0 "[ . 1 . 2]" 1 261 1 11 VAL HA 1 12 VAL MG2 5.040 . 5.040 3.435 3.371 3.515 . 0 0 "[ . 1 . 2]" 1 262 1 12 VAL MG2 1 44 VAL HA 4.820 . 4.820 3.848 3.560 4.109 . 0 0 "[ . 1 . 2]" 1 263 1 12 VAL MG2 1 44 VAL HB 5.450 . 5.450 4.510 4.347 4.677 . 0 0 "[ . 1 . 2]" 1 264 1 109 CYS QB 1 114 ALA MB . . 5.370 3.887 3.293 4.318 . 0 0 "[ . 1 . 2]" 1 265 1 111 PRO HB3 1 114 ALA MB 5.450 . 5.450 4.637 4.409 4.892 . 0 0 "[ . 1 . 2]" 1 266 1 114 ALA MB 1 127 LEU HG 4.070 . 4.070 2.357 2.137 2.540 . 0 0 "[ . 1 . 2]" 1 267 1 40 ALA MB 1 61 GLU HB2 4.900 . 4.900 3.951 3.523 4.659 . 0 0 "[ . 1 . 2]" 1 268 1 40 ALA MB 1 58 LEU HG 4.830 . 4.830 4.596 2.975 4.878 0.048 10 0 "[ . 1 . 2]" 1 269 1 40 ALA MB 1 61 GLU HB3 5.230 . 5.230 4.148 3.513 5.234 0.004 2 0 "[ . 1 . 2]" 1 270 1 40 ALA MB 1 62 LEU HB2 5.590 . 5.590 4.676 4.494 4.999 . 0 0 "[ . 1 . 2]" 1 271 1 40 ALA MB 1 62 LEU MD1 3.620 . 3.620 1.926 1.829 2.191 . 0 0 "[ . 1 . 2]" 1 272 1 16 ILE MG 1 23 LEU H 4.320 . 4.320 4.086 3.808 4.310 . 0 0 "[ . 1 . 2]" 1 273 1 16 ILE HA 1 16 ILE MG 3.700 . 3.700 2.288 2.211 2.356 . 0 0 "[ . 1 . 2]" 1 274 1 16 ILE MG 1 23 LEU HB2 3.810 . 3.810 3.119 2.708 3.296 . 0 0 "[ . 1 . 2]" 1 275 1 16 ILE MD 1 16 ILE MG 3.320 . 3.320 1.901 1.833 1.929 . 0 0 "[ . 1 . 2]" 1 276 1 16 ILE MG 1 23 LEU HB3 4.330 . 4.330 3.514 3.342 3.863 . 0 0 "[ . 1 . 2]" 1 277 1 16 ILE MG 1 23 LEU MD2 5.050 . 5.050 2.756 2.233 4.629 . 0 0 "[ . 1 . 2]" 1 278 1 64 ILE HA 1 64 ILE MG 3.410 . 3.410 2.332 2.297 2.376 . 0 0 "[ . 1 . 2]" 1 279 1 64 ILE MG 1 97 THR HA 4.330 . 4.330 3.226 3.047 3.441 . 0 0 "[ . 1 . 2]" 1 280 1 64 ILE MG 1 98 LEU HA 3.540 . 3.540 2.092 1.828 2.452 . 0 0 "[ . 1 . 2]" 1 281 1 63 GLY HA3 1 64 ILE MG 5.160 . 5.160 3.867 3.730 3.994 . 0 0 "[ . 1 . 2]" 1 282 1 64 ILE MG 1 97 THR HB 5.680 . 5.680 4.509 4.396 4.679 . 0 0 "[ . 1 . 2]" 1 283 1 64 ILE MG 1 94 PHE HB3 5.620 . 5.620 4.552 4.155 4.786 . 0 0 "[ . 1 . 2]" 1 284 1 64 ILE MG 1 94 PHE HB2 4.550 . 4.550 3.350 3.024 3.592 . 0 0 "[ . 1 . 2]" 1 285 1 62 LEU HB2 1 64 ILE MG 4.270 . 4.270 3.485 3.238 3.821 . 0 0 "[ . 1 . 2]" 1 286 1 64 ILE MD 1 64 ILE MG 3.400 . 3.400 1.919 1.850 2.009 . 0 0 "[ . 1 . 2]" 1 287 1 100 ALA MB 1 106 LEU HA 5.230 . 5.230 4.539 3.915 5.239 0.009 5 0 "[ . 1 . 2]" 1 288 1 62 LEU HA 1 100 ALA MB 5.710 . 5.710 4.905 4.432 5.141 . 0 0 "[ . 1 . 2]" 1 289 1 100 ALA MB 1 105 ALA HA 4.730 . 4.730 3.481 2.745 4.114 . 0 0 "[ . 1 . 2]" 1 290 1 100 ALA MB 1 104 GLN HA 4.930 . 4.930 3.429 2.875 3.946 . 0 0 "[ . 1 . 2]" 1 291 1 100 ALA MB 1 103 HIS HB3 4.250 . 4.250 3.448 2.852 4.295 0.045 10 0 "[ . 1 . 2]" 1 292 1 100 ALA MB 1 103 HIS HB2 4.250 . 4.250 2.530 1.882 3.172 . 0 0 "[ . 1 . 2]" 1 293 1 100 ALA MB 1 106 LEU MD2 3.580 . 3.580 2.520 1.815 3.622 0.042 5 0 "[ . 1 . 2]" 1 294 1 22 ILE HA 1 22 ILE MG 3.660 . 3.660 2.270 2.220 2.332 . 0 0 "[ . 1 . 2]" 1 295 1 17 GLU HA 1 22 ILE MG 3.940 . 3.940 3.600 3.435 3.742 . 0 0 "[ . 1 . 2]" 1 296 1 22 ILE MG 1 90 HIS HA 5.750 . 5.750 5.585 5.326 5.784 0.034 17 0 "[ . 1 . 2]" 1 297 1 21 LYS HA 1 22 ILE MG 5.730 . 5.730 5.388 5.312 5.442 . 0 0 "[ . 1 . 2]" 1 298 1 22 ILE MG 1 111 PRO HA 5.260 . 5.260 4.706 4.361 4.928 . 0 0 "[ . 1 . 2]" 1 299 1 22 ILE HG13 1 22 ILE MG 3.740 . 3.740 3.199 3.195 3.204 . 0 0 "[ . 1 . 2]" 1 300 1 8 MET HA 1 83 ILE MG 4.340 . 4.340 3.588 3.429 3.822 . 0 0 "[ . 1 . 2]" 1 301 1 83 ILE MG 1 84 ILE HA 4.600 . 4.600 3.749 3.685 3.869 . 0 0 "[ . 1 . 2]" 1 302 1 83 ILE HA 1 83 ILE MG 3.450 . 3.450 2.561 2.494 2.640 . 0 0 "[ . 1 . 2]" 1 303 1 83 ILE MG 1 85 HIS HB2 5.220 . 5.220 3.379 3.031 3.815 . 0 0 "[ . 1 . 2]" 1 304 1 83 ILE MG 1 85 HIS HB3 5.750 . 5.750 4.783 4.463 5.242 . 0 0 "[ . 1 . 2]" 1 305 1 8 MET HG2 1 83 ILE MG 3.880 . 3.880 2.632 2.383 2.861 . 0 0 "[ . 1 . 2]" 1 306 1 8 MET HB3 1 83 ILE MG 4.140 . 4.140 3.902 3.700 4.153 0.013 6 0 "[ . 1 . 2]" 1 307 1 83 ILE HG13 1 83 ILE MG 3.550 . 3.550 2.453 2.358 2.503 . 0 0 "[ . 1 . 2]" 1 308 1 79 VAL HA 1 84 ILE MG 5.750 . 5.750 5.965 5.924 6.051 0.301 16 0 "[ . 1 . 2]" 1 309 1 9 ILE HA 1 84 ILE MG 4.900 . 4.900 4.065 3.984 4.162 . 0 0 "[ . 1 . 2]" 1 310 1 83 ILE HA 1 84 ILE MG 5.420 . 5.420 5.122 5.051 5.214 . 0 0 "[ . 1 . 2]" 1 311 1 84 ILE HG12 1 84 ILE MG 3.300 . 3.300 2.530 2.486 2.570 . 0 0 "[ . 1 . 2]" 1 312 1 84 ILE HG13 1 84 ILE MG 3.500 . 3.500 3.124 3.116 3.132 . 0 0 "[ . 1 . 2]" 1 313 1 9 ILE MG 1 10 GLU HA 4.600 . 4.600 3.948 3.816 4.086 . 0 0 "[ . 1 . 2]" 1 314 1 9 ILE MG 1 84 ILE HA 4.760 . 4.760 3.466 3.335 3.550 . 0 0 "[ . 1 . 2]" 1 315 1 9 ILE HA 1 9 ILE MG 3.310 . 3.310 2.506 2.473 2.523 . 0 0 "[ . 1 . 2]" 1 316 1 9 ILE MG 1 82 ARG HD2 5.460 . 5.460 5.265 4.739 5.504 0.044 19 0 "[ . 1 . 2]" 1 317 1 9 ILE MG 1 43 LYS HD2 4.130 . 4.130 2.577 2.051 3.023 . 0 0 "[ . 1 . 2]" 1 318 1 9 ILE MG 1 43 LYS HD3 4.130 . 4.130 3.790 2.571 4.202 0.072 19 0 "[ . 1 . 2]" 1 319 1 9 ILE HG12 1 9 ILE MG 3.380 . 3.380 2.436 2.376 2.481 . 0 0 "[ . 1 . 2]" 1 320 1 119 LEU HA 1 120 ALA MB 4.790 . 4.790 4.077 4.052 4.124 . 0 0 "[ . 1 . 2]" 1 321 1 120 ALA MB 1 123 ASP HB2 4.430 . 4.430 2.992 2.121 3.347 . 0 0 "[ . 1 . 2]" 1 322 1 38 GLU HB3 1 120 ALA MB 4.050 . 4.050 3.159 2.411 3.921 . 0 0 "[ . 1 . 2]" 1 323 1 38 GLU HB2 1 120 ALA MB 4.050 . 4.050 3.781 3.186 4.222 0.172 17 0 "[ . 1 . 2]" 1 324 1 15 ILE MG 1 22 ILE HA 5.010 . 5.010 3.735 3.563 3.859 . 0 0 "[ . 1 . 2]" 1 325 1 15 ILE MG 1 90 HIS HA 4.490 . 4.490 3.339 3.008 3.685 . 0 0 "[ . 1 . 2]" 1 326 1 15 ILE HA 1 15 ILE MG 3.710 . 3.710 2.490 2.432 2.531 . 0 0 "[ . 1 . 2]" 1 327 1 15 ILE MG 1 17 GLU HB3 4.800 . 4.800 3.733 3.169 4.401 . 0 0 "[ . 1 . 2]" 1 328 1 15 ILE MG 1 17 GLU HB2 4.800 . 4.800 2.606 2.126 3.071 . 0 0 "[ . 1 . 2]" 1 329 1 15 ILE MG 1 22 ILE HG12 4.790 . 4.790 2.887 2.705 3.091 . 0 0 "[ . 1 . 2]" 1 330 1 15 ILE MG 1 23 LEU HB3 5.750 . 5.750 5.420 5.162 5.750 . 0 0 "[ . 1 . 2]" 1 331 1 22 ILE MD 1 111 PRO HA 3.640 . 3.640 2.091 1.881 2.316 . 0 0 "[ . 1 . 2]" 1 332 1 22 ILE MD 1 111 PRO HB2 4.290 . 4.290 3.860 3.593 4.183 . 0 0 "[ . 1 . 2]" 1 333 1 22 ILE MD 1 111 PRO HB3 4.350 . 4.350 2.477 2.125 2.837 . 0 0 "[ . 1 . 2]" 1 334 1 22 ILE HB 1 22 ILE MD 3.660 . 3.660 2.407 2.374 2.435 . 0 0 "[ . 1 . 2]" 1 335 1 16 ILE MD 1 62 LEU HB2 5.020 . 5.020 4.301 3.846 4.938 . 0 0 "[ . 1 . 2]" 1 336 1 16 ILE HB 1 16 ILE MD 3.700 . 3.700 2.869 2.416 3.229 . 0 0 "[ . 1 . 2]" 1 337 1 14 ALA MB 1 16 ILE MD 4.210 . 4.210 2.699 2.217 3.164 . 0 0 "[ . 1 . 2]" 1 338 1 16 ILE MD 1 23 LEU HB3 4.670 . 4.670 3.468 2.462 4.133 . 0 0 "[ . 1 . 2]" 1 339 1 15 ILE MG 1 16 ILE MD 5.750 . 5.750 5.397 4.974 5.823 0.073 8 0 "[ . 1 . 2]" 1 340 1 15 ILE MD 1 73 ALA H 4.600 . 4.600 4.823 4.759 4.944 0.344 8 0 "[ . 1 . 2]" 1 341 1 15 ILE MD 1 90 HIS HA 4.730 . 4.730 4.254 3.875 4.666 . 0 0 "[ . 1 . 2]" 1 342 1 15 ILE MD 1 127 LEU HA 4.330 . 4.330 3.273 3.158 3.410 . 0 0 "[ . 1 . 2]" 1 343 1 15 ILE HA 1 15 ILE MD 4.300 . 4.300 3.635 3.594 3.672 . 0 0 "[ . 1 . 2]" 1 344 1 15 ILE MD 1 130 PHE HB2 4.100 . 4.100 2.671 2.452 2.976 . 0 0 "[ . 1 . 2]" 1 345 1 15 ILE MD 1 130 PHE HB3 4.690 . 4.690 3.455 3.238 3.764 . 0 0 "[ . 1 . 2]" 1 346 1 15 ILE MD 1 126 LEU HB2 4.660 . 4.660 4.086 3.743 4.450 . 0 0 "[ . 1 . 2]" 1 347 1 15 ILE MD 1 72 VAL HB 4.280 . 4.280 3.482 3.284 3.742 . 0 0 "[ . 1 . 2]" 1 348 1 15 ILE MD 1 72 VAL MG1 3.680 . 3.680 2.738 2.209 3.224 . 0 0 "[ . 1 . 2]" 1 349 1 15 ILE MD 1 15 ILE MG 3.440 . 3.440 1.862 1.826 1.899 . 0 0 "[ . 1 . 2]" 1 350 1 8 MET HA 1 9 ILE MD 5.250 . 5.250 5.079 4.925 5.197 . 0 0 "[ . 1 . 2]" 1 351 1 9 ILE HA 1 9 ILE MD 4.340 . 4.340 3.788 3.748 3.822 . 0 0 "[ . 1 . 2]" 1 352 1 77 ARG HD3 1 84 ILE MD 4.260 . 4.260 3.945 2.721 4.309 0.049 9 0 "[ . 1 . 2]" 1 353 1 9 ILE MD 1 82 ARG HB3 3.660 . 3.660 2.761 2.405 3.330 . 0 0 "[ . 1 . 2]" 1 354 1 9 ILE MD 1 82 ARG HB2 4.030 . 4.030 2.714 2.452 3.046 . 0 0 "[ . 1 . 2]" 1 355 1 77 ARG HG3 1 84 ILE MD 3.890 . 3.890 2.682 2.462 2.840 . 0 0 "[ . 1 . 2]" 1 356 1 9 ILE MD 1 84 ILE HA 4.950 . 4.950 4.092 3.886 4.237 . 0 0 "[ . 1 . 2]" 1 357 1 9 ILE HB 1 9 ILE MD 3.550 . 3.550 2.480 2.436 2.515 . 0 0 "[ . 1 . 2]" 1 358 1 79 VAL HB 1 84 ILE MD 3.720 . 3.720 1.724 1.687 1.792 0.113 5 0 "[ . 1 . 2]" 1 359 1 64 ILE MD 1 94 PHE HA 4.590 . 4.590 4.134 3.903 4.329 . 0 0 "[ . 1 . 2]" 1 360 1 64 ILE MD 1 66 ALA HA 4.380 . 4.380 3.935 3.565 4.194 . 0 0 "[ . 1 . 2]" 1 361 1 64 ILE MD 1 98 LEU HA 5.000 . 5.000 3.492 3.159 3.775 . 0 0 "[ . 1 . 2]" 1 362 1 64 ILE MD 1 94 PHE HB3 4.150 . 4.150 2.568 2.213 2.832 . 0 0 "[ . 1 . 2]" 1 363 1 64 ILE MD 1 94 PHE HB2 4.070 . 4.070 2.086 1.806 2.528 . 0 0 "[ . 1 . 2]" 1 364 1 58 LEU HB2 1 64 ILE MD 5.180 . 5.180 3.956 3.716 4.272 . 0 0 "[ . 1 . 2]" 1 365 1 62 LEU HB2 1 64 ILE MD 4.150 . 4.150 3.023 2.865 3.241 . 0 0 "[ . 1 . 2]" 1 366 1 64 ILE HB 1 64 ILE MD 3.700 . 3.700 2.409 2.361 2.447 . 0 0 "[ . 1 . 2]" 1 367 1 64 ILE MD 1 66 ALA MB 3.790 . 3.790 2.962 2.742 3.226 . 0 0 "[ . 1 . 2]" 1 368 1 8 MET HA 1 83 ILE MD 4.790 . 4.790 4.324 4.069 4.452 . 0 0 "[ . 1 . 2]" 1 369 1 82 ARG HA 1 83 ILE MD 5.080 . 5.080 2.870 2.700 3.146 . 0 0 "[ . 1 . 2]" 1 370 1 83 ILE HA 1 83 ILE MD 3.660 . 3.660 2.737 2.439 2.941 . 0 0 "[ . 1 . 2]" 1 371 1 8 MET HG3 1 83 ILE MD 4.710 . 4.710 4.456 4.184 4.706 . 0 0 "[ . 1 . 2]" 1 372 1 8 MET HG2 1 83 ILE MD 5.300 . 5.300 4.162 3.698 4.593 . 0 0 "[ . 1 . 2]" 1 373 1 83 ILE HB 1 83 ILE MD 3.370 . 3.370 2.406 2.382 2.473 . 0 0 "[ . 1 . 2]" 1 374 1 21 LYS HD2 1 108 TRP HA 5.750 . 5.750 5.267 4.744 5.836 0.086 18 0 "[ . 1 . 2]" 1 375 1 21 LYS HD3 1 108 TRP HA 5.750 . 5.750 5.198 4.313 5.781 0.031 9 0 "[ . 1 . 2]" 1 376 1 21 LYS HD3 1 110 SER HA 4.980 . 4.980 3.600 2.710 4.805 . 0 0 "[ . 1 . 2]" 1 377 1 21 LYS HA 1 21 LYS HD3 4.530 . 4.530 3.255 2.533 4.195 . 0 0 "[ . 1 . 2]" 1 378 1 19 ASP HB2 1 21 LYS HD2 5.380 . 5.380 5.252 4.077 5.557 0.177 20 0 "[ . 1 . 2]" 1 379 1 14 ALA MB 1 16 ILE HG12 4.930 . 4.930 3.268 2.873 3.702 . 0 0 "[ . 1 . 2]" 1 380 1 14 ALA MB 1 16 ILE HG13 4.930 . 4.930 3.688 2.771 4.616 . 0 0 "[ . 1 . 2]" 1 381 1 11 VAL HB 1 86 LEU HG 3.800 . 3.800 1.923 1.757 2.249 0.043 2 0 "[ . 1 . 2]" 1 382 1 51 ARG HG2 1 68 VAL HB 4.740 . 4.740 2.927 2.493 3.559 . 0 0 "[ . 1 . 2]" 1 383 1 83 ILE HA 1 84 ILE HG13 5.250 . 5.250 4.047 3.903 4.179 . 0 0 "[ . 1 . 2]" 1 384 1 78 GLU HB3 1 83 ILE HG13 4.150 . 4.150 3.144 2.887 3.359 . 0 0 "[ . 1 . 2]" 1 385 1 78 GLU HB2 1 83 ILE HG13 4.170 . 4.170 3.733 3.324 3.889 . 0 0 "[ . 1 . 2]" 1 386 1 78 GLU HA 1 84 ILE HG12 4.640 . 4.640 3.019 2.755 3.528 . 0 0 "[ . 1 . 2]" 1 387 1 9 ILE HA 1 9 ILE HG12 3.720 . 3.720 2.480 2.426 2.538 . 0 0 "[ . 1 . 2]" 1 388 1 59 ARG HG3 1 60 GLU HA 4.890 . 4.890 4.862 4.646 4.972 0.082 18 0 "[ . 1 . 2]" 1 389 1 9 ILE HG13 1 84 ILE HA 4.670 . 4.670 4.011 3.905 4.157 . 0 0 "[ . 1 . 2]" 1 390 1 75 HIS HB2 1 125 PRO HG3 4.990 . 4.990 3.946 3.622 4.298 . 0 0 "[ . 1 . 2]" 1 391 1 9 ILE HG13 1 82 ARG HB3 4.180 . 4.180 2.421 2.144 2.639 . 0 0 "[ . 1 . 2]" 1 392 1 127 LEU MD1 1 130 PHE H 5.750 . 5.750 4.029 3.903 4.169 . 0 0 "[ . 1 . 2]" 1 393 1 15 ILE MD 1 127 LEU MD1 5.750 . 5.750 4.866 4.714 4.966 . 0 0 "[ . 1 . 2]" 1 394 1 111 PRO HA 1 127 LEU MD1 4.360 . 4.360 2.921 2.519 3.201 . 0 0 "[ . 1 . 2]" 1 395 1 127 LEU MD1 1 131 MET HB3 4.790 . 4.790 2.634 2.361 2.815 . 0 0 "[ . 1 . 2]" 1 396 1 114 ALA MB 1 127 LEU MD1 3.830 . 3.830 2.731 2.413 3.050 . 0 0 "[ . 1 . 2]" 1 397 1 23 LEU MD1 1 25 ALA HA 5.750 . 5.750 4.794 4.434 5.809 0.059 19 0 "[ . 1 . 2]" 1 398 1 23 LEU HA 1 23 LEU MD1 4.410 . 4.410 2.161 1.993 3.851 . 0 0 "[ . 1 . 2]" 1 399 1 111 PRO HA 1 127 LEU HG 5.180 . 5.180 4.105 3.802 4.444 . 0 0 "[ . 1 . 2]" 1 400 1 117 TYR HB2 1 119 LEU HG 5.020 . 5.020 3.078 2.840 3.446 . 0 0 "[ . 1 . 2]" 1 401 1 37 TRP HB2 1 119 LEU HG 5.490 . 5.490 4.110 3.665 4.601 . 0 0 "[ . 1 . 2]" 1 402 1 119 LEU HG 1 123 ASP HB3 5.510 . 5.510 5.174 4.892 5.435 . 0 0 "[ . 1 . 2]" 1 403 1 117 TYR HB3 1 119 LEU HG 4.090 . 4.090 3.697 3.487 4.081 . 0 0 "[ . 1 . 2]" 1 404 1 133 LEU HA 1 133 LEU HG 3.940 . 3.940 2.561 2.423 3.658 . 0 0 "[ . 1 . 2]" 1 405 1 114 ALA HA 1 119 LEU HG 4.660 . 4.660 4.717 4.628 4.764 0.104 10 0 "[ . 1 . 2]" 1 406 1 77 ARG HA 1 77 ARG HG2 4.270 . 4.270 3.800 3.749 3.863 . 0 0 "[ . 1 . 2]" 1 407 1 7 LYS HA 1 82 ARG HG2 5.750 . 5.750 5.373 4.553 5.785 0.035 5 0 "[ . 1 . 2]" 1 408 1 58 LEU HB2 1 62 LEU HG 5.510 . 5.510 4.880 4.739 5.106 . 0 0 "[ . 1 . 2]" 1 409 1 24 LEU HG 1 37 TRP HB2 4.790 . 4.790 4.556 4.126 4.955 0.165 6 0 "[ . 1 . 2]" 1 410 1 24 LEU HG 1 37 TRP HB3 5.170 . 5.170 4.060 3.714 4.687 . 0 0 "[ . 1 . 2]" 1 411 1 22 ILE MG 1 24 LEU HG 5.750 . 5.750 3.855 3.290 4.315 . 0 0 "[ . 1 . 2]" 1 412 1 22 ILE MD 1 24 LEU HG 5.750 . 5.750 5.226 4.851 5.556 . 0 0 "[ . 1 . 2]" 1 413 1 75 HIS HB3 1 86 LEU MD1 5.590 . 5.590 3.800 3.309 4.273 . 0 0 "[ . 1 . 2]" 1 414 1 77 ARG HA 1 77 ARG HG3 4.290 . 4.290 3.738 3.663 3.819 . 0 0 "[ . 1 . 2]" 1 415 1 97 THR MG 1 98 LEU HG 4.940 . 4.940 3.921 3.241 4.979 0.039 20 0 "[ . 1 . 2]" 1 416 1 62 LEU HA 1 62 LEU MD1 4.160 . 4.160 3.844 3.786 3.883 . 0 0 "[ . 1 . 2]" 1 417 1 58 LEU HA 1 62 LEU MD1 4.590 . 4.590 3.186 3.067 3.385 . 0 0 "[ . 1 . 2]" 1 418 1 61 GLU HB2 1 62 LEU MD1 5.040 . 5.040 4.343 4.134 5.018 . 0 0 "[ . 1 . 2]" 1 419 1 62 LEU HB2 1 62 LEU MD1 3.650 . 3.650 2.353 2.323 2.399 . 0 0 "[ . 1 . 2]" 1 420 1 134 ARG HA 1 134 ARG HG2 4.280 . 4.280 2.527 2.426 2.681 . 0 0 "[ . 1 . 2]" 1 421 1 134 ARG HA 1 134 ARG HG3 4.280 . 4.280 3.022 2.802 3.250 . 0 0 "[ . 1 . 2]" 1 422 1 98 LEU HA 1 98 LEU MD1 4.240 . 4.240 3.792 3.243 4.118 . 0 0 "[ . 1 . 2]" 1 423 1 97 THR MG 1 98 LEU MD1 4.830 . 4.830 3.978 3.183 4.983 0.153 12 0 "[ . 1 . 2]" 1 424 1 16 ILE H 1 23 LEU HG 5.750 . 5.750 5.476 5.173 5.844 0.094 19 0 "[ . 1 . 2]" 1 425 1 106 LEU HA 1 106 LEU MD1 4.230 . 4.230 2.245 1.950 3.863 . 0 0 "[ . 1 . 2]" 1 426 1 14 ALA HA 1 54 LEU MD1 4.500 . 4.500 2.951 2.551 4.052 . 0 0 "[ . 1 . 2]" 1 427 1 13 ALA HA 1 54 LEU MD1 5.150 . 5.150 4.516 4.086 5.209 0.059 20 0 "[ . 1 . 2]" 1 428 1 100 ALA HA 1 106 LEU MD1 4.540 . 4.540 3.162 2.685 3.840 . 0 0 "[ . 1 . 2]" 1 429 1 98 LEU HA 1 98 LEU MD2 4.240 . 4.240 3.556 2.210 3.895 . 0 0 "[ . 1 . 2]" 1 430 1 54 LEU HA 1 54 LEU MD1 4.270 . 4.270 3.812 3.774 3.863 . 0 0 "[ . 1 . 2]" 1 431 1 12 VAL HB 1 54 LEU MD1 3.990 . 3.990 2.356 2.203 2.680 . 0 0 "[ . 1 . 2]" 1 432 1 100 ALA MB 1 106 LEU MD1 3.580 . 3.580 2.104 1.753 3.184 0.047 5 0 "[ . 1 . 2]" 1 433 1 119 LEU HA 1 119 LEU MD1 4.140 . 4.140 3.837 3.824 3.859 . 0 0 "[ . 1 . 2]" 1 434 1 115 LEU HA 1 119 LEU MD1 3.760 . 3.760 2.284 2.081 2.480 . 0 0 "[ . 1 . 2]" 1 435 1 119 LEU MD1 1 124 ILE HA 4.080 . 4.080 3.014 2.768 3.214 . 0 0 "[ . 1 . 2]" 1 436 1 119 LEU MD1 1 123 ASP HB2 4.630 . 4.630 3.446 3.148 4.577 . 0 0 "[ . 1 . 2]" 1 437 1 117 TYR HB3 1 119 LEU MD1 5.470 . 5.470 4.853 4.675 5.212 . 0 0 "[ . 1 . 2]" 1 438 1 119 LEU HB2 1 119 LEU MD1 3.410 . 3.410 2.341 2.321 2.367 . 0 0 "[ . 1 . 2]" 1 439 1 119 LEU HB3 1 119 LEU MD1 3.480 . 3.480 2.348 2.322 2.364 . 0 0 "[ . 1 . 2]" 1 440 1 51 ARG HA 1 54 LEU HG 5.360 . 5.360 3.978 3.530 4.363 . 0 0 "[ . 1 . 2]" 1 441 1 20 GLY HA3 1 21 LYS HG2 4.940 . 4.940 3.782 3.507 4.146 . 0 0 "[ . 1 . 2]" 1 442 1 36 LEU HA 1 36 LEU MD1 4.100 . 4.100 2.947 2.092 3.958 . 0 0 "[ . 1 . 2]" 1 443 1 23 LEU HA 1 23 LEU HG 4.070 . 4.070 3.054 2.621 3.152 . 0 0 "[ . 1 . 2]" 1 444 1 35 GLY HA3 1 36 LEU MD1 6.170 . 6.170 4.026 3.025 5.464 . 0 0 "[ . 1 . 2]" 1 445 1 36 LEU MD1 1 118 PRO HB3 5.290 . 5.290 3.946 2.759 5.289 . 0 0 "[ . 1 . 2]" 1 446 1 36 LEU HB2 1 36 LEU MD1 3.550 . 3.550 2.513 2.160 3.204 . 0 0 "[ . 1 . 2]" 1 447 1 75 HIS HA 1 126 LEU MD1 5.750 . 5.750 5.417 3.620 5.780 0.030 3 0 "[ . 1 . 2]" 1 448 1 123 ASP HA 1 126 LEU MD1 5.030 . 5.030 2.402 1.975 3.948 . 0 0 "[ . 1 . 2]" 1 449 1 126 LEU HA 1 126 LEU MD1 4.210 . 4.210 3.680 2.033 3.884 . 0 0 "[ . 1 . 2]" 1 450 1 75 HIS HB2 1 126 LEU MD1 4.600 . 4.600 3.858 1.964 4.216 . 0 0 "[ . 1 . 2]" 1 451 1 75 HIS HB3 1 126 LEU MD1 4.510 . 4.510 3.325 2.402 3.810 . 0 0 "[ . 1 . 2]" 1 452 1 88 ALA MB 1 126 LEU MD1 3.670 . 3.670 2.119 1.878 3.389 . 0 0 "[ . 1 . 2]" 1 453 1 22 ILE HG13 1 111 PRO HA 4.850 . 4.850 3.404 3.119 3.870 . 0 0 "[ . 1 . 2]" 1 454 1 115 LEU HA 1 115 LEU MD1 3.840 . 3.840 2.879 2.580 3.760 . 0 0 "[ . 1 . 2]" 1 455 1 115 LEU MD1 1 128 GLU HG2 4.270 . 4.270 2.905 2.015 3.366 . 0 0 "[ . 1 . 2]" 1 456 1 21 LYS HG3 1 109 CYS HA 5.750 . 5.750 5.020 4.525 5.411 . 0 0 "[ . 1 . 2]" 1 457 1 21 LYS HG3 1 110 SER HA 5.750 . 5.750 5.172 4.494 5.589 . 0 0 "[ . 1 . 2]" 1 458 1 21 LYS HE3 1 21 LYS HG3 4.060 . 4.060 3.142 2.691 3.785 . 0 0 "[ . 1 . 2]" 1 459 1 23 LEU HG 1 106 LEU HG 4.090 . 4.090 3.468 2.640 4.390 0.300 10 0 "[ . 1 . 2]" 1 460 1 22 ILE HG12 1 111 PRO HA 4.970 . 4.970 4.504 4.252 4.973 0.003 9 0 "[ . 1 . 2]" 1 461 1 22 ILE HG12 1 111 PRO HD3 4.990 . 4.990 3.882 3.438 4.105 . 0 0 "[ . 1 . 2]" 1 462 1 86 LEU HA 1 86 LEU MD2 3.940 . 3.940 3.609 3.507 3.674 . 0 0 "[ . 1 . 2]" 1 463 1 86 LEU MD2 1 122 ALA HA 5.150 . 5.150 4.087 3.920 4.593 . 0 0 "[ . 1 . 2]" 1 464 1 75 HIS HB3 1 86 LEU MD2 5.590 . 5.590 3.933 3.613 4.392 . 0 0 "[ . 1 . 2]" 1 465 1 24 LEU HA 1 24 LEU MD1 4.320 . 4.320 3.159 2.839 3.815 . 0 0 "[ . 1 . 2]" 1 466 1 24 LEU MD1 1 114 ALA HA 4.850 . 4.850 3.245 2.415 3.977 . 0 0 "[ . 1 . 2]" 1 467 1 24 LEU HB2 1 24 LEU MD1 3.670 . 3.670 2.336 2.281 2.431 . 0 0 "[ . 1 . 2]" 1 468 1 24 LEU MD1 1 119 LEU MD1 4.440 . 4.440 3.960 2.907 4.452 0.012 9 0 "[ . 1 . 2]" 1 469 1 3 LEU HA 1 3 LEU MD1 4.470 . 4.470 2.741 1.886 4.103 . 0 0 "[ . 1 . 2]" 1 470 1 133 LEU HA 1 133 LEU MD1 4.060 . 4.060 2.203 1.923 3.837 . 0 0 "[ . 1 . 2]" 1 471 1 133 LEU MD1 1 138 PRO HD2 5.980 . 5.980 4.580 3.042 6.015 0.035 14 0 "[ . 1 . 2]" 1 472 1 41 GLY HA2 1 58 LEU MD1 5.580 . 5.580 4.151 2.328 4.735 . 0 0 "[ . 1 . 2]" 1 473 1 58 LEU HA 1 58 LEU MD1 4.370 . 4.370 3.702 2.502 3.871 . 0 0 "[ . 1 . 2]" 1 474 1 54 LEU HA 1 58 LEU MD1 5.740 . 5.740 4.069 2.696 4.334 . 0 0 "[ . 1 . 2]" 1 475 1 58 LEU HB3 1 58 LEU MD1 3.500 . 3.500 2.403 2.280 3.215 . 0 0 "[ . 1 . 2]" 1 476 1 58 LEU MD1 1 64 ILE MD 4.030 . 4.030 2.831 2.348 4.167 0.137 13 0 "[ . 1 . 2]" 1 477 1 7 LYS HA 1 7 LYS HG3 4.150 . 4.150 3.061 2.380 3.758 . 0 0 "[ . 1 . 2]" 1 478 1 11 VAL MG1 1 43 LYS HG3 5.750 . 5.750 4.804 4.528 4.977 . 0 0 "[ . 1 . 2]" 1 479 1 11 VAL MG2 1 43 LYS HG3 5.750 . 5.750 3.026 2.494 3.344 . 0 0 "[ . 1 . 2]" 1 480 1 115 LEU HA 1 119 LEU MD2 5.340 . 5.340 4.657 4.365 4.821 . 0 0 "[ . 1 . 2]" 1 481 1 117 TYR HB2 1 119 LEU MD2 4.610 . 4.610 3.493 3.007 4.283 . 0 0 "[ . 1 . 2]" 1 482 1 11 VAL MG1 1 43 LYS HG2 5.750 . 5.750 5.689 5.349 5.811 0.061 17 0 "[ . 1 . 2]" 1 483 1 11 VAL MG2 1 43 LYS HG2 5.750 . 5.750 4.325 3.715 4.663 . 0 0 "[ . 1 . 2]" 1 484 1 38 GLU HA 1 119 LEU MD2 4.490 . 4.490 2.636 2.236 2.961 . 0 0 "[ . 1 . 2]" 1 485 1 119 LEU HA 1 119 LEU MD2 3.240 . 3.240 1.959 1.912 2.017 . 0 0 "[ . 1 . 2]" 1 486 1 24 LEU HA 1 119 LEU MD2 5.300 . 5.300 4.527 4.082 4.794 . 0 0 "[ . 1 . 2]" 1 487 1 114 ALA HA 1 119 LEU MD2 4.880 . 4.880 4.291 4.015 4.589 . 0 0 "[ . 1 . 2]" 1 488 1 37 TRP HB2 1 119 LEU MD2 3.860 . 3.860 2.348 2.055 2.828 . 0 0 "[ . 1 . 2]" 1 489 1 119 LEU MD2 1 123 ASP HB3 4.210 . 4.210 3.016 2.618 3.424 . 0 0 "[ . 1 . 2]" 1 490 1 117 TYR HB3 1 119 LEU MD2 4.660 . 4.660 3.691 3.210 4.554 . 0 0 "[ . 1 . 2]" 1 491 1 114 ALA MB 1 119 LEU MD2 3.710 . 3.710 3.318 3.089 3.479 . 0 0 "[ . 1 . 2]" 1 492 1 119 LEU HB3 1 119 LEU MD2 3.390 . 3.390 2.399 2.377 2.432 . 0 0 "[ . 1 . 2]" 1 493 1 58 LEU HB2 1 64 ILE HG13 5.360 . 5.360 3.077 2.835 3.319 . 0 0 "[ . 1 . 2]" 1 494 1 58 LEU HG 1 64 ILE HG13 5.750 . 5.750 4.994 4.027 5.277 . 0 0 "[ . 1 . 2]" 1 495 1 64 ILE HG13 1 66 ALA MB 4.800 . 4.800 2.920 2.723 3.126 . 0 0 "[ . 1 . 2]" 1 496 1 58 LEU HB2 1 64 ILE HG12 5.750 . 5.750 3.932 3.715 4.183 . 0 0 "[ . 1 . 2]" 1 497 1 58 LEU HG 1 64 ILE HG12 5.750 . 5.750 5.599 3.929 5.850 0.100 7 0 "[ . 1 . 2]" 1 498 1 62 LEU HB2 1 64 ILE HG12 4.670 . 4.670 1.913 1.762 2.089 0.038 9 0 "[ . 1 . 2]" 1 499 1 62 LEU HB3 1 64 ILE HG12 4.650 . 4.650 2.711 2.561 2.924 . 0 0 "[ . 1 . 2]" 1 500 1 64 ILE HG12 1 66 ALA MB 5.300 . 5.300 4.374 4.095 4.597 . 0 0 "[ . 1 . 2]" 1 501 1 13 ALA HA 1 54 LEU MD2 5.150 . 5.150 2.973 2.713 3.307 . 0 0 "[ . 1 . 2]" 1 502 1 58 LEU HA 1 62 LEU MD2 4.590 . 4.590 4.172 4.067 4.312 . 0 0 "[ . 1 . 2]" 1 503 1 54 LEU HA 1 54 LEU MD2 4.270 . 4.270 1.953 1.860 2.195 . 0 0 "[ . 1 . 2]" 1 504 1 12 VAL HB 1 54 LEU MD2 3.990 . 3.990 2.158 1.821 2.440 . 0 0 "[ . 1 . 2]" 1 505 1 13 ALA HA 1 14 ALA MB 4.800 . 4.800 3.942 3.875 3.979 . 0 0 "[ . 1 . 2]" 1 506 1 14 ALA MB 1 41 GLY HA2 4.970 . 4.970 3.326 2.865 3.673 . 0 0 "[ . 1 . 2]" 1 507 1 14 ALA MB 1 15 ILE HA 4.820 . 4.820 4.224 4.166 4.270 . 0 0 "[ . 1 . 2]" 1 508 1 14 ALA MB 1 58 LEU MD1 3.280 . 3.280 1.941 1.892 2.104 . 0 0 "[ . 1 . 2]" 1 509 1 14 ALA MB 1 64 ILE MD 5.560 . 5.560 4.588 4.234 4.857 . 0 0 "[ . 1 . 2]" 1 510 1 133 LEU HA 1 133 LEU MD2 4.060 . 4.060 3.597 2.012 3.768 . 0 0 "[ . 1 . 2]" 1 511 1 133 LEU MD2 1 138 PRO HD2 5.980 . 5.980 4.311 3.011 5.719 . 0 0 "[ . 1 . 2]" 1 512 1 3 LEU HA 1 3 LEU MD2 4.470 . 4.470 3.289 1.909 3.908 . 0 0 "[ . 1 . 2]" 1 513 1 62 LEU HA 1 62 LEU MD2 4.160 . 4.160 2.090 1.982 2.186 . 0 0 "[ . 1 . 2]" 1 514 1 100 ALA HA 1 106 LEU MD2 4.540 . 4.540 3.449 2.976 4.068 . 0 0 "[ . 1 . 2]" 1 515 1 62 LEU HB2 1 62 LEU MD2 3.650 . 3.650 3.202 3.199 3.207 . 0 0 "[ . 1 . 2]" 1 516 1 115 LEU H 1 115 LEU MD2 4.720 . 4.720 3.533 3.342 3.706 . 0 0 "[ . 1 . 2]" 1 517 1 68 VAL MG1 1 91 VAL HA 5.640 . 5.640 4.406 3.730 5.153 . 0 0 "[ . 1 . 2]" 1 518 1 115 LEU HA 1 115 LEU MD2 3.840 . 3.840 1.792 1.777 1.801 0.023 20 0 "[ . 1 . 2]" 1 519 1 44 VAL HA 1 44 VAL MG1 3.570 . 3.570 2.375 2.324 2.426 . 0 0 "[ . 1 . 2]" 1 520 1 51 ARG HA 1 68 VAL MG1 3.960 . 3.960 2.536 2.280 2.829 . 0 0 "[ . 1 . 2]" 1 521 1 44 VAL MG1 1 50 GLN HG3 4.390 . 4.390 3.490 2.915 4.023 . 0 0 "[ . 1 . 2]" 1 522 1 10 GLU HB2 1 44 VAL MG1 3.640 . 3.640 3.658 3.521 3.701 0.061 6 0 "[ . 1 . 2]" 1 523 1 44 VAL MG1 1 53 ALA MB 4.720 . 4.720 2.487 2.105 3.095 . 0 0 "[ . 1 . 2]" 1 524 1 54 LEU HB2 1 68 VAL MG1 4.240 . 4.240 3.764 3.465 4.158 . 0 0 "[ . 1 . 2]" 1 525 1 44 VAL MG1 1 50 GLN HA 4.020 . 4.020 2.770 2.319 3.223 . 0 0 "[ . 1 . 2]" 1 526 1 68 VAL MG1 1 69 GLY HA2 5.750 . 5.750 3.512 3.164 3.901 . 0 0 "[ . 1 . 2]" 1 527 1 52 GLN HA 1 55 VAL MG1 5.180 . 5.180 3.937 3.639 4.165 . 0 0 "[ . 1 . 2]" 1 528 1 55 VAL HA 1 55 VAL MG1 3.560 . 3.560 2.494 2.450 2.545 . 0 0 "[ . 1 . 2]" 1 529 1 106 LEU HA 1 106 LEU MD2 4.230 . 4.230 3.472 2.065 3.807 . 0 0 "[ . 1 . 2]" 1 530 1 40 ALA MB 1 62 LEU MD2 3.620 . 3.620 2.389 2.201 2.667 . 0 0 "[ . 1 . 2]" 1 531 1 24 LEU HA 1 24 LEU MD2 4.320 . 4.320 3.277 1.848 3.771 . 0 0 "[ . 1 . 2]" 1 532 1 24 LEU HB2 1 24 LEU MD2 3.670 . 3.670 2.652 2.429 3.205 . 0 0 "[ . 1 . 2]" 1 533 1 24 LEU MD2 1 119 LEU MD1 4.440 . 4.440 3.015 2.654 3.322 . 0 0 "[ . 1 . 2]" 1 534 1 13 ALA MB 1 86 LEU HB3 4.680 . 4.680 3.440 3.158 3.665 . 0 0 "[ . 1 . 2]" 1 535 1 13 ALA MB 1 88 ALA HA 3.550 . 3.550 2.294 2.010 2.472 . 0 0 "[ . 1 . 2]" 1 536 1 13 ALA MB 1 39 PHE HB3 3.980 . 3.980 2.914 2.420 3.437 . 0 0 "[ . 1 . 2]" 1 537 1 13 ALA MB 1 41 GLY HA3 4.590 . 4.590 4.057 3.855 4.473 . 0 0 "[ . 1 . 2]" 1 538 1 13 ALA MB 1 39 PHE HB2 3.980 . 3.980 2.536 2.087 2.966 . 0 0 "[ . 1 . 2]" 1 539 1 111 PRO HA 1 127 LEU MD2 4.360 . 4.360 2.419 2.166 2.751 . 0 0 "[ . 1 . 2]" 1 540 1 127 LEU MD2 1 128 GLU HA 4.990 . 4.990 4.964 4.781 5.143 0.153 5 0 "[ . 1 . 2]" 1 541 1 127 LEU MD2 1 131 MET HB3 4.790 . 4.790 3.732 3.443 3.986 . 0 0 "[ . 1 . 2]" 1 542 1 114 ALA MB 1 127 LEU MD2 3.830 . 3.830 2.740 2.538 2.981 . 0 0 "[ . 1 . 2]" 1 543 1 15 ILE MD 1 127 LEU MD2 5.750 . 5.750 2.796 2.691 2.857 . 0 0 "[ . 1 . 2]" 1 544 1 51 ARG HA 1 68 VAL MG2 3.960 . 3.960 2.381 1.973 2.744 . 0 0 "[ . 1 . 2]" 1 545 1 68 VAL MG2 1 91 VAL HA 5.640 . 5.640 4.374 3.852 5.124 . 0 0 "[ . 1 . 2]" 1 546 1 36 LEU HA 1 36 LEU MD2 4.100 . 4.100 3.229 2.176 3.848 . 0 0 "[ . 1 . 2]" 1 547 1 35 GLY HA3 1 36 LEU MD2 6.170 . 6.170 4.799 3.394 5.678 . 0 0 "[ . 1 . 2]" 1 548 1 36 LEU MD2 1 118 PRO HB3 5.290 . 5.290 3.996 2.722 5.218 . 0 0 "[ . 1 . 2]" 1 549 1 36 LEU HB2 1 36 LEU MD2 3.550 . 3.550 2.584 2.209 3.203 . 0 0 "[ . 1 . 2]" 1 550 1 54 LEU HB2 1 68 VAL MG2 4.240 . 4.240 2.329 2.098 2.531 . 0 0 "[ . 1 . 2]" 1 551 1 11 VAL MG1 1 86 LEU HA 4.370 . 4.370 3.597 3.300 3.861 . 0 0 "[ . 1 . 2]" 1 552 1 11 VAL HA 1 11 VAL MG1 3.500 . 3.500 2.423 2.387 2.480 . 0 0 "[ . 1 . 2]" 1 553 1 11 VAL MG1 1 43 LYS HA 3.720 . 3.720 3.071 2.780 3.389 . 0 0 "[ . 1 . 2]" 1 554 1 58 LEU HA 1 58 LEU MD2 4.370 . 4.370 2.271 2.052 3.797 . 0 0 "[ . 1 . 2]" 1 555 1 58 LEU HB3 1 58 LEU MD2 3.500 . 3.500 2.441 2.326 2.495 . 0 0 "[ . 1 . 2]" 1 556 1 58 LEU MD2 1 64 ILE MD 4.030 . 4.030 3.551 1.835 3.963 . 0 0 "[ . 1 . 2]" 1 557 1 73 ALA MB 1 126 LEU H 5.650 . 5.650 5.137 4.688 5.654 0.004 7 0 "[ . 1 . 2]" 1 558 1 73 ALA MB 1 74 SER HA 4.770 . 4.770 3.867 3.790 3.960 . 0 0 "[ . 1 . 2]" 1 559 1 73 ALA MB 1 126 LEU HA 3.710 . 3.710 2.689 2.212 3.190 . 0 0 "[ . 1 . 2]" 1 560 1 73 ALA MB 1 126 LEU HB2 5.470 . 5.470 4.990 4.327 5.488 0.018 7 0 "[ . 1 . 2]" 1 561 1 73 ALA MB 1 126 LEU HG 5.340 . 5.340 4.670 2.795 5.346 0.006 3 0 "[ . 1 . 2]" 1 562 1 104 GLN HA 1 105 ALA MB 5.060 . 5.060 4.664 4.454 4.853 . 0 0 "[ . 1 . 2]" 1 563 1 26 GLN HB3 1 105 ALA MB 4.080 . 4.080 2.612 1.967 3.581 . 0 0 "[ . 1 . 2]" 1 564 1 26 GLN HB2 1 105 ALA MB 4.080 . 4.080 2.964 2.173 3.879 . 0 0 "[ . 1 . 2]" 1 565 1 12 VAL MG1 1 44 VAL HA 4.820 . 4.820 4.741 4.358 4.878 0.058 7 0 "[ . 1 . 2]" 1 566 1 12 VAL MG1 1 53 ALA MB 3.730 . 3.730 3.115 2.838 3.380 . 0 0 "[ . 1 . 2]" 1 567 1 41 GLY HA2 1 58 LEU MD2 5.580 . 5.580 2.697 2.285 4.604 . 0 0 "[ . 1 . 2]" 1 568 1 11 VAL HA 1 11 VAL MG2 3.500 . 3.500 2.385 2.327 2.439 . 0 0 "[ . 1 . 2]" 1 569 1 23 LEU MD2 1 25 ALA HA 5.750 . 5.750 5.416 3.613 5.639 . 0 0 "[ . 1 . 2]" 1 570 1 23 LEU HA 1 23 LEU MD2 4.410 . 4.410 3.809 2.424 3.921 . 0 0 "[ . 1 . 2]" 1 571 1 72 VAL HA 1 72 VAL MG1 3.510 . 3.510 2.416 2.358 2.460 . 0 0 "[ . 1 . 2]" 1 572 1 72 VAL MG1 1 130 PHE HB2 4.930 . 4.930 2.120 1.876 2.344 . 0 0 "[ . 1 . 2]" 1 573 1 72 VAL MG1 1 73 ALA H 4.020 . 4.020 2.758 2.634 2.913 . 0 0 "[ . 1 . 2]" 1 574 1 72 VAL MG1 1 130 PHE HB3 5.250 . 5.250 3.594 3.299 3.799 . 0 0 "[ . 1 . 2]" 1 575 1 44 VAL HA 1 44 VAL MG2 3.570 . 3.570 2.434 2.377 2.474 . 0 0 "[ . 1 . 2]" 1 576 1 44 VAL MG2 1 50 GLN HA 4.020 . 4.020 2.600 2.239 3.033 . 0 0 "[ . 1 . 2]" 1 577 1 44 VAL MG2 1 50 GLN HG3 4.390 . 4.390 4.059 3.617 4.405 0.015 13 0 "[ . 1 . 2]" 1 578 1 44 VAL MG2 1 53 ALA MB 4.720 . 4.720 2.242 1.946 2.742 . 0 0 "[ . 1 . 2]" 1 579 1 107 VAL H 1 107 VAL MG1 4.710 . 4.710 2.343 2.179 2.940 . 0 0 "[ . 1 . 2]" 1 580 1 107 VAL MG1 1 108 TRP HA 5.750 . 5.750 3.922 3.621 5.461 . 0 0 "[ . 1 . 2]" 1 581 1 107 VAL HA 1 107 VAL MG1 3.740 . 3.740 3.172 2.342 3.224 . 0 0 "[ . 1 . 2]" 1 582 1 24 LEU HB2 1 107 VAL MG1 4.400 . 4.400 2.046 1.851 4.147 . 0 0 "[ . 1 . 2]" 1 583 1 66 ALA MB 1 94 PHE HA 4.100 . 4.100 3.598 3.227 3.849 . 0 0 "[ . 1 . 2]" 1 584 1 65 GLU HA 1 66 ALA MB 4.570 . 4.570 4.056 3.969 4.114 . 0 0 "[ . 1 . 2]" 1 585 1 55 VAL HA 1 66 ALA MB 3.920 . 3.920 2.670 2.108 2.926 . 0 0 "[ . 1 . 2]" 1 586 1 66 ALA MB 1 94 PHE HB3 4.100 . 4.100 3.100 2.769 3.440 . 0 0 "[ . 1 . 2]" 1 587 1 66 ALA MB 1 94 PHE HB2 4.210 . 4.210 3.539 3.152 3.994 . 0 0 "[ . 1 . 2]" 1 588 1 64 ILE HB 1 66 ALA MB 4.920 . 4.920 4.167 3.920 4.361 . 0 0 "[ . 1 . 2]" 1 589 1 97 THR MG 1 98 LEU MD2 4.830 . 4.830 3.879 2.386 4.825 . 0 0 "[ . 1 . 2]" 1 590 1 74 SER HA 1 126 LEU MD2 5.060 . 5.060 2.575 2.177 3.567 . 0 0 "[ . 1 . 2]" 1 591 1 126 LEU HA 1 126 LEU MD2 4.210 . 4.210 2.186 1.958 3.812 . 0 0 "[ . 1 . 2]" 1 592 1 75 HIS HB2 1 126 LEU MD2 4.600 . 4.600 2.583 2.220 4.080 . 0 0 "[ . 1 . 2]" 1 593 1 75 HIS HB3 1 126 LEU MD2 4.510 . 4.510 2.756 2.294 3.930 . 0 0 "[ . 1 . 2]" 1 594 1 88 ALA MB 1 126 LEU MD2 3.670 . 3.670 2.028 1.783 2.225 0.017 6 0 "[ . 1 . 2]" 1 595 1 87 HIS HA 1 88 ALA MB 4.980 . 4.980 4.073 4.005 4.118 . 0 0 "[ . 1 . 2]" 1 596 1 67 THR MG 1 69 GLY HA3 4.540 . 4.540 4.116 3.480 4.411 . 0 0 "[ . 1 . 2]" 1 597 1 88 ALA MB 1 126 LEU HB2 4.160 . 4.160 3.558 3.188 3.792 . 0 0 "[ . 1 . 2]" 1 598 1 72 VAL HB 1 88 ALA MB 3.410 . 3.410 2.502 2.269 2.791 . 0 0 "[ . 1 . 2]" 1 599 1 15 ILE HG13 1 88 ALA MB 4.210 . 4.210 2.603 2.334 2.931 . 0 0 "[ . 1 . 2]" 1 600 1 15 ILE HG12 1 88 ALA MB 4.550 . 4.550 3.768 3.345 4.146 . 0 0 "[ . 1 . 2]" 1 601 1 67 THR HA 1 67 THR MG 3.080 . 3.080 2.410 2.318 3.202 0.122 17 0 "[ . 1 . 2]" 1 602 1 88 ALA MB 1 127 LEU HA 5.270 . 5.270 5.082 4.690 5.343 0.073 17 0 "[ . 1 . 2]" 1 603 1 67 THR MG 1 93 ASP HB2 5.170 . 5.170 4.481 3.323 5.200 0.030 9 0 "[ . 1 . 2]" 1 604 1 88 ALA MB 1 126 LEU HG 4.050 . 4.050 3.804 1.855 4.100 0.050 20 0 "[ . 1 . 2]" 1 605 1 67 THR MG 1 92 PRO HG2 4.090 . 4.090 3.428 2.269 3.925 . 0 0 "[ . 1 . 2]" 1 606 1 10 GLU HB3 1 85 HIS HB2 5.750 . 5.750 5.582 4.666 5.831 0.081 15 0 "[ . 1 . 2]" 1 607 1 8 MET HB3 1 85 HIS HB2 5.190 . 5.190 3.880 3.050 4.641 . 0 0 "[ . 1 . 2]" 1 608 1 52 GLN HA 1 55 VAL HB 4.140 . 4.140 2.592 2.245 2.826 . 0 0 "[ . 1 . 2]" 1 609 1 10 GLU HB3 1 85 HIS HB3 5.360 . 5.360 4.028 3.366 4.413 . 0 0 "[ . 1 . 2]" 1 610 1 8 MET HG3 1 83 ILE HG12 5.200 . 5.200 5.227 5.206 5.264 0.064 14 0 "[ . 1 . 2]" 1 611 1 97 THR H 1 99 GLN HB3 5.750 . 5.750 5.870 5.788 5.938 0.188 19 0 "[ . 1 . 2]" 1 612 1 97 THR HB 1 99 GLN HB3 5.750 . 5.750 4.590 4.203 4.899 . 0 0 "[ . 1 . 2]" 1 613 1 97 THR MG 1 99 GLN HB3 4.830 . 4.830 3.949 3.431 4.786 . 0 0 "[ . 1 . 2]" 1 614 1 75 HIS HB3 1 125 PRO HB2 5.140 . 5.140 4.293 3.778 4.515 . 0 0 "[ . 1 . 2]" 1 615 1 75 HIS HB2 1 125 PRO HB2 4.950 . 4.950 2.913 2.772 3.016 . 0 0 "[ . 1 . 2]" 1 616 1 63 GLY HA3 1 99 GLN HB2 5.750 . 5.750 5.421 4.871 5.784 0.034 5 0 "[ . 1 . 2]" 1 617 1 99 GLN HB2 1 100 ALA MB 5.110 . 5.110 4.537 4.396 4.843 . 0 0 "[ . 1 . 2]" 1 618 1 76 GLN HB2 1 85 HIS HA 5.700 . 5.700 4.909 3.937 5.210 . 0 0 "[ . 1 . 2]" 1 619 1 76 GLN HB3 1 85 HIS HA 5.750 . 5.750 4.457 3.973 4.895 . 0 0 "[ . 1 . 2]" 1 620 1 76 GLN HB3 1 77 ARG HA 4.950 . 4.950 4.046 3.882 4.262 . 0 0 "[ . 1 . 2]" 1 621 1 76 GLN HB3 1 83 ILE MG 4.050 . 4.050 2.883 2.230 4.110 0.060 14 0 "[ . 1 . 2]" 1 622 1 68 VAL HB 1 69 GLY HA3 5.690 . 5.690 5.434 5.121 5.724 0.034 6 0 "[ . 1 . 2]" 1 623 1 21 LYS HB2 1 108 TRP HB3 4.730 . 4.730 2.858 1.961 4.298 . 0 0 "[ . 1 . 2]" 1 624 1 109 CYS QB 1 113 GLU HB3 3.860 . 3.860 2.590 2.153 3.051 . 0 0 "[ . 1 . 2]" 1 625 1 109 CYS QB 1 113 GLU HB2 3.980 . 3.980 2.182 1.779 2.431 0.021 15 0 "[ . 1 . 2]" 1 626 1 24 LEU HB3 1 37 TRP HB3 4.310 . 4.310 1.920 1.705 2.099 0.095 10 0 "[ . 1 . 2]" 1 627 1 109 CYS QB 1 117 TYR QE . . 5.240 3.111 2.571 4.165 . 0 0 "[ . 1 . 2]" 1 628 1 78 GLU HB2 1 83 ILE MD 4.320 . 4.320 3.213 2.701 3.428 . 0 0 "[ . 1 . 2]" 1 629 1 137 ARG HB3 1 138 PRO HD2 5.530 . 5.530 4.492 3.829 5.133 . 0 0 "[ . 1 . 2]" 1 630 1 137 ARG HB3 1 138 PRO HD3 5.530 . 5.530 4.835 4.337 5.209 . 0 0 "[ . 1 . 2]" 1 631 1 78 GLU HB2 1 83 ILE HG12 5.360 . 5.360 5.325 5.036 5.412 0.052 1 0 "[ . 1 . 2]" 1 632 1 109 CYS HA 1 113 GLU HB3 5.440 . 5.440 4.718 4.306 5.151 . 0 0 "[ . 1 . 2]" 1 633 1 78 GLU HB3 1 83 ILE MD 4.600 . 4.600 3.572 2.934 4.126 . 0 0 "[ . 1 . 2]" 1 634 1 59 ARG HB2 1 65 GLU HA 4.080 . 4.080 3.276 2.690 3.701 . 0 0 "[ . 1 . 2]" 1 635 1 137 ARG HB2 1 138 PRO HD2 5.530 . 5.530 4.265 2.737 5.172 . 0 0 "[ . 1 . 2]" 1 636 1 137 ARG HB2 1 138 PRO HD3 5.530 . 5.530 4.727 4.202 4.924 . 0 0 "[ . 1 . 2]" 1 637 1 50 GLN HB2 1 51 ARG HB2 5.750 . 5.750 5.004 4.782 5.363 . 0 0 "[ . 1 . 2]" 1 638 1 51 ARG HB2 1 55 VAL HB 5.750 . 5.750 5.804 5.719 5.872 0.122 11 0 "[ . 1 . 2]" 1 639 1 61 GLU HB2 1 62 LEU HG 4.790 . 4.790 2.874 2.638 3.750 . 0 0 "[ . 1 . 2]" 1 640 1 61 GLU HB2 1 62 LEU MD2 5.040 . 5.040 3.472 3.112 3.704 . 0 0 "[ . 1 . 2]" 1 641 1 109 CYS HA 1 113 GLU HB2 5.150 . 5.150 4.008 3.522 4.287 . 0 0 "[ . 1 . 2]" 1 642 1 128 GLU HB2 1 129 ALA MB 5.000 . 5.000 3.900 3.707 4.141 . 0 0 "[ . 1 . 2]" 1 643 1 61 GLU HA 1 101 HIS HB3 3.880 . 3.880 1.893 1.693 2.344 0.107 17 0 "[ . 1 . 2]" 1 644 1 61 GLU HB3 1 101 HIS HB3 5.220 . 5.220 3.510 3.175 4.114 . 0 0 "[ . 1 . 2]" 1 645 1 61 GLU HB3 1 101 HIS HB2 4.650 . 4.650 4.652 4.260 4.724 0.074 2 0 "[ . 1 . 2]" 1 646 1 101 HIS HB2 1 102 GLU HA 5.750 . 5.750 5.622 5.538 5.680 . 0 0 "[ . 1 . 2]" 1 647 1 65 GLU HB3 1 95 HIS HB3 4.900 . 4.900 4.004 3.249 4.991 0.091 20 0 "[ . 1 . 2]" 1 648 1 125 PRO HA 1 128 GLU HB3 4.930 . 4.930 3.892 3.584 4.290 . 0 0 "[ . 1 . 2]" 1 649 1 7 LYS HA 1 7 LYS HD2 5.490 . 5.490 3.752 2.213 4.845 . 0 0 "[ . 1 . 2]" 1 650 1 7 LYS HA 1 7 LYS HD3 5.490 . 5.490 3.723 1.964 4.748 . 0 0 "[ . 1 . 2]" 1 651 1 110 SER HA 1 111 PRO HG3 5.060 . 5.060 4.639 4.332 4.790 . 0 0 "[ . 1 . 2]" 1 652 1 22 ILE MD 1 111 PRO HG3 4.370 . 4.370 3.537 2.244 4.267 . 0 0 "[ . 1 . 2]" 1 653 1 111 PRO HG2 1 131 MET HB3 5.090 . 5.090 4.451 3.998 4.944 . 0 0 "[ . 1 . 2]" 1 654 1 22 ILE MD 1 111 PRO HG2 5.250 . 5.250 4.492 3.797 5.028 . 0 0 "[ . 1 . 2]" 1 655 1 113 GLU HA 1 116 GLN HB3 4.880 . 4.880 4.630 4.362 4.887 0.007 1 0 "[ . 1 . 2]" 1 656 1 36 LEU HA 1 118 PRO HB2 4.040 . 4.040 2.353 2.064 2.802 . 0 0 "[ . 1 . 2]" 1 657 1 36 LEU H 1 118 PRO HB2 5.550 . 5.550 4.585 4.373 4.898 . 0 0 "[ . 1 . 2]" 1 658 1 117 TYR HA 1 118 PRO HB3 5.220 . 5.220 4.934 4.871 4.988 . 0 0 "[ . 1 . 2]" 1 659 1 22 ILE HG12 1 111 PRO HG3 5.750 . 5.750 5.062 3.786 5.686 . 0 0 "[ . 1 . 2]" 1 660 1 50 GLN HB2 1 51 ARG HB3 5.750 . 5.750 5.718 5.424 5.843 0.093 1 0 "[ . 1 . 2]" 1 661 1 45 GLU HA 1 46 PRO HG2 5.030 . 5.030 4.446 4.231 4.701 . 0 0 "[ . 1 . 2]" 1 662 1 36 LEU HA 1 118 PRO HG2 4.380 . 4.380 1.956 1.795 2.349 0.005 5 0 "[ . 1 . 2]" 1 663 1 36 LEU H 1 118 PRO HG2 5.000 . 5.000 4.481 3.992 4.741 . 0 0 "[ . 1 . 2]" 1 664 1 36 LEU HA 1 118 PRO HG3 4.380 . 4.380 3.115 2.876 3.569 . 0 0 "[ . 1 . 2]" 1 665 1 36 LEU H 1 118 PRO HG3 5.000 . 5.000 5.003 4.734 5.129 0.129 17 0 "[ . 1 . 2]" 1 666 1 27 ARG HA 1 28 PRO HG3 4.850 . 4.850 4.346 4.002 4.556 . 0 0 "[ . 1 . 2]" 1 667 1 28 PRO HG3 1 31 SER HB2 4.970 . 4.970 3.313 1.995 4.968 . 0 0 "[ . 1 . 2]" 1 668 1 28 PRO HG3 1 31 SER HB3 4.970 . 4.970 4.100 2.594 5.023 0.053 9 0 "[ . 1 . 2]" 1 669 1 45 GLU HA 1 46 PRO HG3 4.790 . 4.790 4.486 3.920 4.585 . 0 0 "[ . 1 . 2]" 1 670 1 77 ARG HD2 1 121 PRO HG2 5.060 . 5.060 4.004 2.350 5.001 . 0 0 "[ . 1 . 2]" 1 671 1 121 PRO HG2 1 122 ALA MB 4.410 . 4.410 3.723 3.624 3.865 . 0 0 "[ . 1 . 2]" 1 672 1 115 LEU HA 1 115 LEU HG 4.300 . 4.300 3.490 2.895 3.610 . 0 0 "[ . 1 . 2]" 1 673 1 112 GLU HA 1 115 LEU HG 5.380 . 5.380 5.115 3.931 5.489 0.109 9 0 "[ . 1 . 2]" 1 674 1 115 LEU HG 1 128 GLU HA 5.580 . 5.580 3.735 3.185 4.866 . 0 0 "[ . 1 . 2]" 1 675 1 114 ALA MB 1 115 LEU HG 5.750 . 5.750 5.108 3.434 5.454 . 0 0 "[ . 1 . 2]" 1 676 1 115 LEU HG 1 119 LEU MD1 5.120 . 5.120 4.356 3.515 4.634 . 0 0 "[ . 1 . 2]" 1 677 1 58 LEU HG 1 62 LEU HG 5.150 . 5.150 4.954 2.892 5.237 0.087 3 0 "[ . 1 . 2]" 1 678 1 125 PRO HG2 1 126 LEU HG 5.480 . 5.480 3.201 2.751 5.472 . 0 0 "[ . 1 . 2]" 1 679 1 69 GLY HA3 1 92 PRO HG3 4.500 . 4.500 3.438 3.226 3.706 . 0 0 "[ . 1 . 2]" 1 680 1 75 HIS HB2 1 126 LEU HG 4.560 . 4.560 3.258 2.848 4.533 . 0 0 "[ . 1 . 2]" 1 681 1 55 VAL HA 1 55 VAL MG2 3.560 . 3.560 2.293 2.248 2.324 . 0 0 "[ . 1 . 2]" 1 682 1 40 ALA MB 1 41 GLY HA2 4.410 . 4.410 3.824 3.726 3.935 . 0 0 "[ . 1 . 2]" 1 683 1 40 ALA MB 1 41 GLY HA3 5.160 . 5.160 4.288 4.141 4.419 . 0 0 "[ . 1 . 2]" 1 684 1 69 GLY HA3 1 92 PRO HD2 5.530 . 5.530 4.473 3.721 5.419 . 0 0 "[ . 1 . 2]" 1 685 1 69 GLY HA3 1 92 PRO HD3 5.750 . 5.750 4.154 3.322 5.153 . 0 0 "[ . 1 . 2]" 1 686 1 68 VAL HA 1 69 GLY HA3 5.120 . 5.120 4.335 4.295 4.371 . 0 0 "[ . 1 . 2]" 1 687 1 69 GLY HA3 1 70 GLU HG2 5.360 . 5.360 4.089 3.491 4.662 . 0 0 "[ . 1 . 2]" 1 688 1 69 GLY HA3 1 92 PRO HG2 4.980 . 4.980 4.453 4.170 4.785 . 0 0 "[ . 1 . 2]" 1 689 1 68 VAL HA 1 69 GLY HA2 5.250 . 5.250 4.424 4.375 4.465 . 0 0 "[ . 1 . 2]" 1 690 1 69 GLY HA2 1 92 PRO HG3 4.900 . 4.900 4.972 4.915 5.052 0.152 8 0 "[ . 1 . 2]" 1 691 1 67 THR MG 1 69 GLY HA2 5.250 . 5.250 4.778 4.110 5.328 0.078 17 0 "[ . 1 . 2]" 1 692 1 68 VAL MG2 1 69 GLY HA2 5.750 . 5.750 5.508 5.433 5.564 . 0 0 "[ . 1 . 2]" 1 693 1 62 LEU HB2 1 64 ILE HG13 4.630 . 4.630 3.314 3.183 3.446 . 0 0 "[ . 1 . 2]" 1 694 1 62 LEU HB3 1 64 ILE HG13 4.610 . 4.610 4.362 4.152 4.588 . 0 0 "[ . 1 . 2]" 1 695 1 62 LEU HB3 1 64 ILE MD 5.180 . 5.180 3.030 2.877 3.174 . 0 0 "[ . 1 . 2]" 1 696 1 123 ASP HA 1 126 LEU HB3 4.970 . 4.970 4.215 3.892 4.522 . 0 0 "[ . 1 . 2]" 1 697 1 58 LEU HB3 1 66 ALA MB 4.700 . 4.700 3.543 3.202 3.817 . 0 0 "[ . 1 . 2]" 1 698 1 58 LEU HB3 1 64 ILE MD 4.840 . 4.840 2.901 2.636 3.187 . 0 0 "[ . 1 . 2]" 1 699 1 8 MET HA 1 9 ILE HG12 4.840 . 4.840 4.865 4.834 4.888 0.048 20 0 "[ . 1 . 2]" 1 700 1 47 ASP HA 1 48 GLU HA 5.060 . 5.060 4.478 4.338 4.566 . 0 0 "[ . 1 . 2]" 1 701 1 19 ASP HA 1 20 GLY HA2 5.290 . 5.290 4.877 4.719 5.099 . 0 0 "[ . 1 . 2]" 1 702 1 116 GLN HA 1 116 GLN HG2 3.600 . 3.600 2.739 2.493 3.269 . 0 0 "[ . 1 . 2]" 1 703 1 116 GLN HA 1 116 GLN HG3 3.600 . 3.600 3.246 2.811 3.753 0.153 4 0 "[ . 1 . 2]" 1 704 1 14 ALA HA 1 88 ALA HA 5.430 . 5.430 4.533 4.311 4.849 . 0 0 "[ . 1 . 2]" 1 705 1 87 HIS HA 1 88 ALA HA 5.720 . 5.720 4.414 4.386 4.437 . 0 0 "[ . 1 . 2]" 1 706 1 15 ILE MD 1 88 ALA HA 5.270 . 5.270 4.409 4.155 4.747 . 0 0 "[ . 1 . 2]" 1 707 1 112 GLU HA 1 115 LEU HB3 4.870 . 4.870 4.387 3.840 4.969 0.099 16 0 "[ . 1 . 2]" 1 708 1 11 VAL HA 1 86 LEU HG 5.750 . 5.750 4.749 4.585 5.017 . 0 0 "[ . 1 . 2]" 1 709 1 11 VAL HA 1 12 VAL MG1 5.040 . 5.040 4.047 3.905 4.180 . 0 0 "[ . 1 . 2]" 1 710 1 128 GLU HA 1 128 GLU HG2 3.680 . 3.680 2.619 2.437 2.840 . 0 0 "[ . 1 . 2]" 1 711 1 127 LEU MD1 1 128 GLU HA 4.990 . 4.990 3.165 2.980 3.304 . 0 0 "[ . 1 . 2]" 1 712 1 125 PRO HA 1 128 GLU HA 5.750 . 5.750 5.156 4.931 5.407 . 0 0 "[ . 1 . 2]" 1 713 1 128 GLU HA 1 131 MET HB3 4.830 . 4.830 4.488 4.087 4.793 . 0 0 "[ . 1 . 2]" 1 714 1 128 GLU HA 1 132 ALA MB 4.990 . 4.990 4.498 4.407 4.606 . 0 0 "[ . 1 . 2]" 1 715 1 56 ARG HA 1 59 ARG HA 5.750 . 5.750 5.169 4.868 5.477 . 0 0 "[ . 1 . 2]" 1 716 1 56 ARG HA 1 56 ARG HD3 5.000 . 5.000 4.394 3.946 4.817 . 0 0 "[ . 1 . 2]" 1 717 1 56 ARG HA 1 56 ARG HD2 5.000 . 5.000 4.437 4.079 5.214 0.214 6 0 "[ . 1 . 2]" 1 718 1 56 ARG HA 1 60 GLU HG3 4.920 . 4.920 4.064 3.642 4.807 . 0 0 "[ . 1 . 2]" 1 719 1 56 ARG HA 1 56 ARG HG3 4.010 . 4.010 3.646 3.616 3.693 . 0 0 "[ . 1 . 2]" 1 720 1 44 VAL HA 1 50 GLN HA 5.750 . 5.750 4.893 4.325 5.568 . 0 0 "[ . 1 . 2]" 1 721 1 50 GLN HA 1 50 GLN HG3 4.040 . 4.040 3.090 2.822 3.489 . 0 0 "[ . 1 . 2]" 1 722 1 50 GLN HA 1 50 GLN HG2 4.030 . 4.030 2.528 2.433 2.676 . 0 0 "[ . 1 . 2]" 1 723 1 59 ARG HA 1 60 GLU HG2 5.750 . 5.750 5.555 4.738 5.808 0.058 20 0 "[ . 1 . 2]" 1 724 1 9 ILE HA 1 9 ILE HG13 3.850 . 3.850 3.149 3.078 3.182 . 0 0 "[ . 1 . 2]" 1 725 1 59 ARG HA 1 63 GLY HA3 5.180 . 5.180 4.609 4.296 5.093 . 0 0 "[ . 1 . 2]" 1 726 1 59 ARG HA 1 59 ARG HG3 3.580 . 3.580 2.587 2.460 2.827 . 0 0 "[ . 1 . 2]" 1 727 1 8 MET HA 1 83 ILE HA 5.270 . 5.270 4.653 4.538 4.813 . 0 0 "[ . 1 . 2]" 1 728 1 78 GLU HB2 1 83 ILE HA 4.260 . 4.260 3.320 3.117 3.670 . 0 0 "[ . 1 . 2]" 1 729 1 83 ILE HA 1 83 ILE HG13 4.000 . 4.000 2.368 2.348 2.396 . 0 0 "[ . 1 . 2]" 1 730 1 9 ILE HA 1 84 ILE HA 5.190 . 5.190 4.317 4.255 4.370 . 0 0 "[ . 1 . 2]" 1 731 1 83 ILE HA 1 84 ILE HA 5.530 . 5.530 4.383 4.362 4.407 . 0 0 "[ . 1 . 2]" 1 732 1 9 ILE HB 1 84 ILE HA 3.550 . 3.550 2.172 2.038 2.258 . 0 0 "[ . 1 . 2]" 1 733 1 84 ILE HA 1 84 ILE HG12 3.940 . 3.940 3.052 2.941 3.126 . 0 0 "[ . 1 . 2]" 1 734 1 84 ILE HA 1 84 ILE HG13 4.000 . 4.000 3.817 3.763 3.863 . 0 0 "[ . 1 . 2]" 1 735 1 84 ILE HA 1 84 ILE MG 3.320 . 3.320 2.137 2.122 2.165 . 0 0 "[ . 1 . 2]" 1 736 1 59 ARG HA 1 64 ILE HA 4.950 . 4.950 4.160 3.912 4.379 . 0 0 "[ . 1 . 2]" 1 737 1 63 GLY HA2 1 64 ILE HA 5.430 . 5.430 4.421 4.363 4.481 . 0 0 "[ . 1 . 2]" 1 738 1 64 ILE HA 1 98 LEU HA 5.750 . 5.750 5.104 4.653 5.591 . 0 0 "[ . 1 . 2]" 1 739 1 64 ILE HA 1 94 PHE HB2 5.750 . 5.750 4.669 4.216 4.944 . 0 0 "[ . 1 . 2]" 1 740 1 62 LEU HB2 1 64 ILE HA 5.750 . 5.750 5.279 5.124 5.447 . 0 0 "[ . 1 . 2]" 1 741 1 64 ILE HA 1 64 ILE MD 4.500 . 4.500 4.183 4.163 4.200 . 0 0 "[ . 1 . 2]" 1 742 1 100 ALA MB 1 103 HIS HA 4.950 . 4.950 4.194 3.785 4.621 . 0 0 "[ . 1 . 2]" 1 743 1 25 ALA MB 1 103 HIS HA 5.210 . 5.210 4.221 3.800 4.507 . 0 0 "[ . 1 . 2]" 1 744 1 59 ARG HA 1 60 GLU HA 5.740 . 5.740 4.630 4.594 4.657 . 0 0 "[ . 1 . 2]" 1 745 1 60 GLU HA 1 63 GLY HA2 5.750 . 5.750 4.468 4.117 4.644 . 0 0 "[ . 1 . 2]" 1 746 1 60 GLU HA 1 60 GLU HG3 4.010 . 4.010 3.367 3.176 3.774 . 0 0 "[ . 1 . 2]" 1 747 1 60 GLU HA 1 60 GLU HG2 3.670 . 3.670 2.512 2.411 2.821 . 0 0 "[ . 1 . 2]" 1 748 1 59 ARG HG2 1 60 GLU HA 4.720 . 4.720 3.622 3.490 3.751 . 0 0 "[ . 1 . 2]" 1 749 1 91 VAL HA 1 92 PRO HB3 5.300 . 5.300 4.912 4.732 5.053 . 0 0 "[ . 1 . 2]" 1 750 1 91 VAL HA 1 92 PRO HG3 4.710 . 4.710 4.355 4.263 4.406 . 0 0 "[ . 1 . 2]" 1 751 1 14 ALA MB 1 91 VAL HA 5.750 . 5.750 5.295 5.038 5.686 . 0 0 "[ . 1 . 2]" 1 752 1 57 GLU HA 1 60 GLU HG3 3.920 . 3.920 3.232 2.958 3.599 . 0 0 "[ . 1 . 2]" 1 753 1 57 GLU HA 1 60 GLU HG2 4.820 . 4.820 4.768 4.002 4.934 0.114 6 0 "[ . 1 . 2]" 1 754 1 57 GLU HA 1 57 GLU HG2 4.180 . 4.180 2.840 2.705 3.009 . 0 0 "[ . 1 . 2]" 1 755 1 56 ARG HG3 1 57 GLU HA 4.510 . 4.510 4.175 3.349 4.597 0.087 6 0 "[ . 1 . 2]" 1 756 1 12 VAL HA 1 86 LEU HA 5.750 . 5.750 3.922 3.807 4.090 . 0 0 "[ . 1 . 2]" 1 757 1 12 VAL HA 1 87 HIS HB3 4.740 . 4.740 4.019 2.941 4.341 . 0 0 "[ . 1 . 2]" 1 758 1 80 SER HA 1 81 GLY HA2 5.170 . 5.170 4.460 4.363 4.541 . 0 0 "[ . 1 . 2]" 1 759 1 109 CYS QB 1 113 GLU HA 5.510 . 5.510 4.623 4.246 4.973 . 0 0 "[ . 1 . 2]" 1 760 1 113 GLU HA 1 113 GLU HG2 3.560 . 3.560 3.017 2.627 3.221 . 0 0 "[ . 1 . 2]" 1 761 1 113 GLU HA 1 116 GLN HB2 4.050 . 4.050 3.162 2.769 3.508 . 0 0 "[ . 1 . 2]" 1 762 1 31 SER HA 1 33 GLN HG2 5.520 . 5.520 4.752 3.701 5.585 0.065 12 0 "[ . 1 . 2]" 1 763 1 28 PRO HB2 1 31 SER HA 5.470 . 5.470 4.783 3.996 5.511 0.041 4 0 "[ . 1 . 2]" 1 764 1 28 PRO HG2 1 31 SER HA 5.750 . 5.750 5.157 4.288 5.859 0.109 10 0 "[ . 1 . 2]" 1 765 1 110 SER HA 1 111 PRO HG2 5.130 . 5.130 4.515 4.421 4.640 . 0 0 "[ . 1 . 2]" 1 766 1 110 SER HA 1 111 PRO HB3 5.440 . 5.440 5.327 5.162 5.572 0.132 20 0 "[ . 1 . 2]" 1 767 1 21 LYS HB2 1 110 SER HA 5.190 . 5.190 4.948 4.723 5.083 . 0 0 "[ . 1 . 2]" 1 768 1 22 ILE HG12 1 110 SER HA 5.470 . 5.470 5.212 4.771 5.489 0.019 16 0 "[ . 1 . 2]" 1 769 1 21 LYS HG2 1 110 SER HA 4.820 . 4.820 3.745 2.802 4.314 . 0 0 "[ . 1 . 2]" 1 770 1 117 TYR HA 1 117 TYR QE 5.640 . 5.640 4.565 4.348 4.663 . 0 0 "[ . 1 . 2]" 1 771 1 117 TYR HA 1 118 PRO HD3 3.440 . 3.440 2.404 2.332 2.489 . 0 0 "[ . 1 . 2]" 1 772 1 117 TYR HA 1 118 PRO HD2 3.570 . 3.570 2.598 2.388 2.868 . 0 0 "[ . 1 . 2]" 1 773 1 127 LEU HA 1 130 PHE HB2 4.270 . 4.270 2.799 2.616 2.963 . 0 0 "[ . 1 . 2]" 1 774 1 116 GLN HB3 1 117 TYR HA 4.650 . 4.650 4.664 4.533 4.747 0.097 16 0 "[ . 1 . 2]" 1 775 1 127 LEU HA 1 129 ALA MB 5.130 . 5.130 5.032 4.920 5.111 . 0 0 "[ . 1 . 2]" 1 776 1 127 LEU HA 1 127 LEU MD2 4.240 . 4.240 1.877 1.804 1.955 . 0 0 "[ . 1 . 2]" 1 777 1 127 LEU HA 1 127 LEU MD1 4.240 . 4.240 3.036 2.876 3.153 . 0 0 "[ . 1 . 2]" 1 778 1 22 ILE MD 1 127 LEU HA 5.000 . 5.000 4.273 4.173 4.498 . 0 0 "[ . 1 . 2]" 1 779 1 54 LEU HA 1 57 GLU HG3 5.120 . 5.120 4.001 3.475 4.381 . 0 0 "[ . 1 . 2]" 1 780 1 54 LEU HA 1 57 GLU HG2 5.120 . 5.120 4.266 4.050 4.745 . 0 0 "[ . 1 . 2]" 1 781 1 54 LEU HA 1 54 LEU HG 4.240 . 4.240 2.897 2.719 3.007 . 0 0 "[ . 1 . 2]" 1 782 1 101 HIS HA 1 102 GLU HA 5.150 . 5.150 4.619 4.534 4.670 . 0 0 "[ . 1 . 2]" 1 783 1 61 GLU HA 1 101 HIS HB2 3.550 . 3.550 2.670 2.144 2.998 . 0 0 "[ . 1 . 2]" 1 784 1 100 ALA MB 1 101 HIS HA 5.230 . 5.230 4.313 4.047 4.439 . 0 0 "[ . 1 . 2]" 1 785 1 58 LEU HA 1 61 GLU HB2 4.540 . 4.540 2.946 2.624 4.711 0.171 2 0 "[ . 1 . 2]" 1 786 1 58 LEU HA 1 58 LEU HG 4.220 . 4.220 3.247 2.486 3.380 . 0 0 "[ . 1 . 2]" 1 787 1 58 LEU HA 1 62 LEU HB3 5.390 . 5.390 4.677 4.407 4.899 . 0 0 "[ . 1 . 2]" 1 788 1 14 ALA MB 1 58 LEU HA 5.190 . 5.190 5.185 4.972 5.291 0.101 2 0 "[ . 1 . 2]" 1 789 1 40 ALA MB 1 58 LEU HA 4.540 . 4.540 3.998 3.757 4.185 . 0 0 "[ . 1 . 2]" 1 790 1 58 LEU HA 1 64 ILE MD 5.440 . 5.440 4.760 4.389 5.006 . 0 0 "[ . 1 . 2]" 1 791 1 11 VAL HA 1 43 LYS HA 3.370 . 3.370 2.075 1.940 2.185 . 0 0 "[ . 1 . 2]" 1 792 1 11 VAL MG2 1 43 LYS HA 3.720 . 3.720 2.555 2.296 3.089 . 0 0 "[ . 1 . 2]" 1 793 1 132 ALA MB 1 133 LEU HA 4.660 . 4.660 3.777 3.663 3.845 . 0 0 "[ . 1 . 2]" 1 794 1 42 GLY HA2 1 43 LYS HA 5.260 . 5.260 4.327 4.287 4.442 . 0 0 "[ . 1 . 2]" 1 795 1 43 LYS HA 1 43 LYS HG3 4.290 . 4.290 2.653 2.522 2.770 . 0 0 "[ . 1 . 2]" 1 796 1 74 SER HA 1 87 HIS HA 3.460 . 3.460 2.623 2.294 2.824 . 0 0 "[ . 1 . 2]" 1 797 1 74 SER HA 1 87 HIS HB3 5.750 . 5.750 5.051 4.638 5.450 . 0 0 "[ . 1 . 2]" 1 798 1 74 SER HA 1 87 HIS HB2 5.750 . 5.750 5.518 4.570 5.778 0.028 4 0 "[ . 1 . 2]" 1 799 1 74 SER HA 1 88 ALA MB 4.940 . 4.940 3.874 3.554 4.193 . 0 0 "[ . 1 . 2]" 1 800 1 74 SER HA 1 126 LEU MD1 5.060 . 5.060 4.031 2.767 4.460 . 0 0 "[ . 1 . 2]" 1 801 1 101 HIS HB3 1 102 GLU HA 5.070 . 5.070 4.430 4.084 4.601 . 0 0 "[ . 1 . 2]" 1 802 1 102 GLU HA 1 102 GLU HG2 4.220 . 4.220 2.768 2.225 4.241 0.021 14 0 "[ . 1 . 2]" 1 803 1 102 GLU HA 1 102 GLU HG3 4.220 . 4.220 3.494 2.835 3.786 . 0 0 "[ . 1 . 2]" 1 804 1 126 LEU HA 1 126 LEU HG 4.370 . 4.370 3.060 2.638 3.173 . 0 0 "[ . 1 . 2]" 1 805 1 126 LEU HA 1 129 ALA MB 3.400 . 3.400 3.419 3.338 3.461 0.061 15 0 "[ . 1 . 2]" 1 806 1 66 ALA HA 1 94 PHE HA 3.490 . 3.490 2.041 1.786 2.246 0.014 19 0 "[ . 1 . 2]" 1 807 1 93 ASP HB3 1 94 PHE HA 5.230 . 5.230 4.541 4.300 4.736 . 0 0 "[ . 1 . 2]" 1 808 1 64 ILE HB 1 94 PHE HA 4.870 . 4.870 4.237 3.949 4.491 . 0 0 "[ . 1 . 2]" 1 809 1 93 ASP HA 1 94 PHE HA 4.890 . 4.890 4.446 4.417 4.555 . 0 0 "[ . 1 . 2]" 1 810 1 7 LYS HA 1 8 MET HA 4.860 . 4.860 4.337 4.297 4.377 . 0 0 "[ . 1 . 2]" 1 811 1 7 LYS HA 1 82 ARG HA 5.750 . 5.750 5.246 4.698 5.746 . 0 0 "[ . 1 . 2]" 1 812 1 7 LYS HA 1 7 LYS HG2 4.150 . 4.150 2.921 2.376 3.816 . 0 0 "[ . 1 . 2]" 1 813 1 7 LYS HA 1 83 ILE MD 5.750 . 5.750 5.317 4.956 5.593 . 0 0 "[ . 1 . 2]" 1 814 1 70 GLU HA 1 70 GLU HG3 4.330 . 4.330 3.811 3.629 4.262 . 0 0 "[ . 1 . 2]" 1 815 1 115 LEU HA 1 116 GLN HA 5.060 . 5.060 4.659 4.578 4.715 . 0 0 "[ . 1 . 2]" 1 816 1 115 LEU HA 1 119 LEU HB2 4.940 . 4.940 4.082 3.830 4.219 . 0 0 "[ . 1 . 2]" 1 817 1 26 GLN HA 1 37 TRP HA 3.490 . 3.490 2.136 1.864 2.508 . 0 0 "[ . 1 . 2]" 1 818 1 26 GLN HG3 1 37 TRP HA 5.750 . 5.750 4.239 3.505 5.496 . 0 0 "[ . 1 . 2]" 1 819 1 24 LEU HB2 1 37 TRP HA 5.750 . 5.750 5.719 5.508 5.820 0.070 17 0 "[ . 1 . 2]" 1 820 1 75 HIS HA 1 125 PRO HG3 5.750 . 5.750 5.548 5.205 5.794 0.044 3 0 "[ . 1 . 2]" 1 821 1 25 ALA MB 1 37 TRP HA 5.440 . 5.440 4.778 4.424 5.089 . 0 0 "[ . 1 . 2]" 1 822 1 26 GLN HG2 1 37 TRP HA 5.750 . 5.750 4.749 3.672 5.500 . 0 0 "[ . 1 . 2]" 1 823 1 75 HIS HA 1 125 PRO HB2 4.610 . 4.610 4.680 4.616 4.750 0.140 20 0 "[ . 1 . 2]" 1 824 1 75 HIS HA 1 126 LEU MD2 5.750 . 5.750 4.012 3.742 5.660 . 0 0 "[ . 1 . 2]" 1 825 1 48 GLU HB2 1 49 SER HA 5.590 . 5.590 4.768 4.624 4.898 . 0 0 "[ . 1 . 2]" 1 826 1 49 SER HA 1 52 GLN HB3 5.750 . 5.750 4.180 3.979 4.436 . 0 0 "[ . 1 . 2]" 1 827 1 21 LYS HG2 1 109 CYS HA 5.360 . 5.360 4.790 4.252 5.219 . 0 0 "[ . 1 . 2]" 1 828 1 109 CYS HA 1 113 GLU HG3 5.750 . 5.750 4.334 3.866 5.309 . 0 0 "[ . 1 . 2]" 1 829 1 21 LYS HB2 1 109 CYS HA 5.150 . 5.150 4.802 4.604 5.034 . 0 0 "[ . 1 . 2]" 1 830 1 21 LYS HD3 1 109 CYS HA 3.850 . 3.850 2.546 2.030 3.055 . 0 0 "[ . 1 . 2]" 1 831 1 88 ALA MB 1 89 TRP HA 4.930 . 4.930 4.156 3.902 4.221 . 0 0 "[ . 1 . 2]" 1 832 1 71 TYR HA 1 89 TRP HA 3.560 . 3.560 2.648 1.941 3.176 . 0 0 "[ . 1 . 2]" 1 833 1 72 VAL HB 1 89 TRP HA 4.480 . 4.480 3.820 3.379 4.418 . 0 0 "[ . 1 . 2]" 1 834 1 45 GLU HA 1 46 PRO HA 4.740 . 4.740 4.386 4.253 4.511 . 0 0 "[ . 1 . 2]" 1 835 1 18 ARG HA 1 18 ARG HG2 3.930 . 3.930 3.677 3.578 3.811 . 0 0 "[ . 1 . 2]" 1 836 1 97 THR MG 1 98 LEU HA 5.170 . 5.170 4.215 4.033 4.369 . 0 0 "[ . 1 . 2]" 1 837 1 29 ALA MB 1 30 GLN HA 4.290 . 4.290 3.902 3.807 4.007 . 0 0 "[ . 1 . 2]" 1 838 1 10 GLU HA 1 11 VAL HA 5.100 . 5.100 4.377 4.355 4.403 . 0 0 "[ . 1 . 2]" 1 839 1 10 GLU HA 1 85 HIS HB2 3.990 . 3.990 3.853 3.305 4.041 0.051 18 0 "[ . 1 . 2]" 1 840 1 10 GLU HA 1 85 HIS HB3 4.110 . 4.110 2.564 2.356 2.842 . 0 0 "[ . 1 . 2]" 1 841 1 9 ILE HB 1 10 GLU HA 5.410 . 5.410 4.887 4.791 4.962 . 0 0 "[ . 1 . 2]" 1 842 1 10 GLU HA 1 44 VAL HB 5.750 . 5.750 4.748 4.469 4.965 . 0 0 "[ . 1 . 2]" 1 843 1 10 GLU HA 1 11 VAL HB 5.750 . 5.750 4.560 4.448 4.645 . 0 0 "[ . 1 . 2]" 1 844 1 10 GLU HA 1 84 ILE HB 5.750 . 5.750 5.800 5.684 5.892 0.142 9 0 "[ . 1 . 2]" 1 845 1 78 GLU HA 1 83 ILE HA 3.260 . 3.260 2.230 2.091 2.341 . 0 0 "[ . 1 . 2]" 1 846 1 77 ARG HG3 1 78 GLU HA 5.020 . 5.020 3.835 3.606 4.141 . 0 0 "[ . 1 . 2]" 1 847 1 78 GLU HA 1 83 ILE HG13 4.470 . 4.470 3.782 3.511 3.973 . 0 0 "[ . 1 . 2]" 1 848 1 78 GLU HA 1 83 ILE MD 4.190 . 4.190 3.950 3.499 4.225 0.035 17 0 "[ . 1 . 2]" 1 849 1 26 GLN HA 1 37 TRP HB3 4.890 . 4.890 3.870 3.566 4.125 . 0 0 "[ . 1 . 2]" 1 850 1 26 GLN HA 1 26 GLN HG3 4.100 . 4.100 2.786 2.406 3.675 . 0 0 "[ . 1 . 2]" 1 851 1 24 LEU HB3 1 26 GLN HA 5.750 . 5.750 5.266 4.999 5.537 . 0 0 "[ . 1 . 2]" 1 852 1 26 GLN HA 1 105 ALA MB 5.750 . 5.750 4.905 4.278 5.600 . 0 0 "[ . 1 . 2]" 1 853 1 26 GLN HA 1 26 GLN HG2 4.100 . 4.100 2.993 2.345 3.298 . 0 0 "[ . 1 . 2]" 1 854 1 52 GLN HG2 1 53 ALA HA 5.230 . 5.230 4.228 3.347 5.278 0.048 7 0 "[ . 1 . 2]" 1 855 1 52 GLN HG3 1 53 ALA HA 5.230 . 5.230 4.479 3.506 5.245 0.015 6 0 "[ . 1 . 2]" 1 856 1 53 ALA HA 1 56 ARG HB3 4.420 . 4.420 4.428 4.338 4.488 0.068 10 0 "[ . 1 . 2]" 1 857 1 125 PRO HA 1 126 LEU HA 5.160 . 5.160 4.740 4.719 4.768 . 0 0 "[ . 1 . 2]" 1 858 1 125 PRO HA 1 128 GLU HG3 3.620 . 3.620 2.745 2.495 3.173 . 0 0 "[ . 1 . 2]" 1 859 1 28 PRO HG2 1 31 SER HB2 4.960 . 4.960 3.301 2.154 5.014 0.054 2 0 "[ . 1 . 2]" 1 860 1 28 PRO HG2 1 31 SER HB3 4.960 . 4.960 4.309 2.355 5.113 0.153 20 0 "[ . 1 . 2]" 1 861 1 68 VAL HA 1 91 VAL HA 4.140 . 4.140 3.254 2.528 4.261 0.121 20 0 "[ . 1 . 2]" 1 862 1 68 VAL HA 1 92 PRO HD2 4.520 . 4.520 3.306 2.722 3.739 . 0 0 "[ . 1 . 2]" 1 863 1 68 VAL HA 1 68 VAL MG2 3.560 . 3.560 2.438 2.412 2.504 . 0 0 "[ . 1 . 2]" 1 864 1 72 VAL HA 1 88 ALA MB 5.680 . 5.680 4.961 4.768 5.308 . 0 0 "[ . 1 . 2]" 1 865 1 21 LYS HA 1 110 SER HB2 5.300 . 5.300 4.971 4.159 5.248 . 0 0 "[ . 1 . 2]" 1 866 1 110 SER HB2 1 113 GLU HG3 5.320 . 5.320 3.014 1.823 5.019 . 0 0 "[ . 1 . 2]" 1 867 1 28 PRO HA 1 29 ALA MB 4.920 . 4.920 4.002 3.765 4.246 . 0 0 "[ . 1 . 2]" 1 868 1 21 LYS HA 1 110 SER HB3 5.300 . 5.300 4.310 3.563 5.087 . 0 0 "[ . 1 . 2]" 1 869 1 110 SER HB3 1 113 GLU HG3 5.320 . 5.320 4.365 2.590 5.087 . 0 0 "[ . 1 . 2]" 1 870 1 91 VAL HA 1 92 PRO HA 4.930 . 4.930 4.503 4.473 4.535 . 0 0 "[ . 1 . 2]" 1 871 1 92 PRO HA 1 93 ASP HA 4.950 . 4.950 4.553 4.507 4.616 . 0 0 "[ . 1 . 2]" 1 872 1 67 THR HA 1 68 VAL HB 5.120 . 5.120 4.730 4.624 4.814 . 0 0 "[ . 1 . 2]" 1 873 1 117 TYR HA 1 118 PRO HA 4.980 . 4.980 4.421 4.369 4.455 . 0 0 "[ . 1 . 2]" 1 874 1 118 PRO HA 1 119 LEU HG 5.750 . 5.750 4.788 4.636 5.072 . 0 0 "[ . 1 . 2]" 1 875 1 78 GLU HA 1 79 VAL HA 5.240 . 5.240 4.391 4.361 4.424 . 0 0 "[ . 1 . 2]" 1 876 1 79 VAL HA 1 80 SER HA 4.720 . 4.720 4.386 4.372 4.408 . 0 0 "[ . 1 . 2]" 1 877 1 78 GLU HB2 1 79 VAL HA 5.580 . 5.580 4.632 4.549 4.926 . 0 0 "[ . 1 . 2]" 1 878 1 79 VAL HA 1 82 ARG HB2 5.750 . 5.750 5.058 4.853 5.233 . 0 0 "[ . 1 . 2]" 1 879 1 43 LYS HA 1 44 VAL HA 5.440 . 5.440 4.363 4.313 4.411 . 0 0 "[ . 1 . 2]" 1 880 1 44 VAL HA 1 45 GLU HA 5.750 . 5.750 4.409 4.380 4.453 . 0 0 "[ . 1 . 2]" 1 881 1 14 ALA MB 1 16 ILE HA 5.500 . 5.500 4.538 4.363 4.784 . 0 0 "[ . 1 . 2]" 1 882 1 16 ILE HA 1 16 ILE MD 4.010 . 4.010 3.126 2.488 3.868 . 0 0 "[ . 1 . 2]" 1 883 1 97 THR HA 1 98 LEU HB3 5.380 . 5.380 4.897 4.566 5.520 0.140 13 0 "[ . 1 . 2]" 1 884 1 97 THR HA 1 97 THR MG 3.340 . 3.340 2.358 2.286 2.411 . 0 0 "[ . 1 . 2]" 1 885 1 130 PHE HA 1 133 LEU HB2 4.020 . 4.020 2.617 2.299 2.981 . 0 0 "[ . 1 . 2]" 1 886 1 15 ILE MD 1 130 PHE HA 5.640 . 5.640 4.404 4.179 4.734 . 0 0 "[ . 1 . 2]" 1 887 1 106 LEU HA 1 107 VAL HA 4.990 . 4.990 4.409 4.359 4.425 . 0 0 "[ . 1 . 2]" 1 888 1 107 VAL HA 1 108 TRP HA 5.330 . 5.330 4.387 4.347 4.418 . 0 0 "[ . 1 . 2]" 1 889 1 105 ALA MB 1 107 VAL HA 5.750 . 5.750 5.409 5.287 5.585 . 0 0 "[ . 1 . 2]" 1 890 1 15 ILE HA 1 16 ILE HG12 5.750 . 5.750 4.180 3.509 5.041 . 0 0 "[ . 1 . 2]" 1 891 1 15 ILE HA 1 16 ILE HG13 5.750 . 5.750 4.565 3.682 5.263 . 0 0 "[ . 1 . 2]" 1 892 1 15 ILE HA 1 22 ILE MG 4.950 . 4.950 2.968 2.780 3.184 . 0 0 "[ . 1 . 2]" 1 893 1 15 ILE HA 1 15 ILE HG12 4.350 . 4.350 2.312 2.282 2.351 . 0 0 "[ . 1 . 2]" 1 894 1 51 ARG HA 1 52 GLN HA 5.150 . 5.150 4.766 4.722 4.815 . 0 0 "[ . 1 . 2]" 1 895 1 12 VAL HB 1 51 ARG HA 5.750 . 5.750 5.318 4.661 5.761 0.011 19 0 "[ . 1 . 2]" 1 896 1 51 ARG HA 1 68 VAL HB 5.130 . 5.130 3.368 2.992 3.805 . 0 0 "[ . 1 . 2]" 1 897 1 51 ARG HA 1 54 LEU HB2 4.120 . 4.120 2.887 2.700 3.066 . 0 0 "[ . 1 . 2]" 1 898 1 51 ARG HA 1 51 ARG HG3 4.150 . 4.150 3.286 3.155 3.368 . 0 0 "[ . 1 . 2]" 1 899 1 51 ARG HA 1 51 ARG HG2 4.150 . 4.150 2.614 2.462 2.700 . 0 0 "[ . 1 . 2]" 1 900 1 131 MET HA 1 132 ALA HA 5.020 . 5.020 4.847 4.804 4.889 . 0 0 "[ . 1 . 2]" 1 901 1 131 MET HA 1 135 ALA MB 4.910 . 4.910 4.431 4.257 4.554 . 0 0 "[ . 1 . 2]" 1 902 1 131 MET HA 1 134 ARG HD2 4.790 . 4.790 4.687 3.759 4.870 0.080 4 0 "[ . 1 . 2]" 1 903 1 111 PRO HB3 1 131 MET HA 3.990 . 3.990 3.505 3.089 3.835 . 0 0 "[ . 1 . 2]" 1 904 1 120 ALA MB 1 121 PRO HA 4.950 . 4.950 4.526 4.492 4.572 . 0 0 "[ . 1 . 2]" 1 905 1 120 ALA HA 1 121 PRO HA 4.850 . 4.850 4.373 4.331 4.413 . 0 0 "[ . 1 . 2]" 1 906 1 22 ILE HB 1 111 PRO HA 5.750 . 5.750 4.295 3.780 4.659 . 0 0 "[ . 1 . 2]" 1 907 1 111 PRO HA 1 114 ALA MB 3.870 . 3.870 2.841 2.598 3.104 . 0 0 "[ . 1 . 2]" 1 908 1 124 ILE HA 1 127 LEU HB3 4.380 . 4.380 3.246 3.038 3.389 . 0 0 "[ . 1 . 2]" 1 909 1 119 LEU HB2 1 124 ILE HA 4.960 . 4.960 3.751 3.455 4.011 . 0 0 "[ . 1 . 2]" 1 910 1 115 LEU MD1 1 124 ILE HA 4.090 . 4.090 3.695 3.315 4.082 . 0 0 "[ . 1 . 2]" 1 911 1 119 LEU MD2 1 124 ILE HA 5.750 . 5.750 5.169 4.921 5.390 . 0 0 "[ . 1 . 2]" 1 912 1 115 LEU MD2 1 124 ILE HA 4.090 . 4.090 2.106 1.936 2.280 . 0 0 "[ . 1 . 2]" 1 913 1 125 PRO HA 1 128 GLU HB2 3.990 . 3.990 2.442 2.209 2.937 . 0 0 "[ . 1 . 2]" 1 914 1 68 VAL HA 1 68 VAL MG1 3.560 . 3.560 2.352 2.287 2.382 . 0 0 "[ . 1 . 2]" 1 915 1 129 ALA MB 1 130 PHE HA 4.650 . 4.650 3.895 3.824 3.957 . 0 0 "[ . 1 . 2]" 1 916 1 128 GLU HA 1 131 MET HG2 3.610 . 3.610 2.367 2.120 2.576 . 0 0 "[ . 1 . 2]" 1 917 1 56 ARG HA 1 59 ARG HB3 3.620 . 3.620 2.459 2.028 2.837 . 0 0 "[ . 1 . 2]" 1 918 1 131 MET HA 1 131 MET HG3 4.100 . 4.100 3.737 3.641 3.777 . 0 0 "[ . 1 . 2]" 1 919 1 103 HIS HA 1 104 GLN HB2 4.690 . 4.690 4.335 4.139 4.487 . 0 0 "[ . 1 . 2]" 1 920 1 57 GLU HA 1 60 GLU HB2 3.590 . 3.590 2.945 2.742 3.094 . 0 0 "[ . 1 . 2]" 1 921 1 91 VAL HA 1 92 PRO HG2 4.590 . 4.590 4.245 3.977 4.406 . 0 0 "[ . 1 . 2]" 1 922 1 57 GLU HA 1 58 LEU HA 5.130 . 5.130 4.721 4.697 4.787 . 0 0 "[ . 1 . 2]" 1 923 1 12 VAL HA 1 87 HIS HB2 4.740 . 4.740 2.798 2.385 4.209 . 0 0 "[ . 1 . 2]" 1 924 1 127 LEU HA 1 127 LEU HG 4.120 . 4.120 3.684 3.665 3.709 . 0 0 "[ . 1 . 2]" 1 925 1 127 LEU HA 1 130 PHE HB3 4.270 . 4.270 2.367 2.179 2.566 . 0 0 "[ . 1 . 2]" 1 926 1 12 VAL HB 1 54 LEU HA 4.890 . 4.890 4.381 4.049 4.744 . 0 0 "[ . 1 . 2]" 1 927 1 54 LEU HA 1 58 LEU MD2 5.740 . 5.740 3.904 3.784 4.501 . 0 0 "[ . 1 . 2]" 1 928 1 43 LYS HA 1 43 LYS HG2 4.290 . 4.290 3.133 2.691 3.527 . 0 0 "[ . 1 . 2]" 1 929 1 33 GLN HA 1 33 GLN HG2 3.720 . 3.720 3.113 2.524 3.735 0.015 1 0 "[ . 1 . 2]" 1 930 1 18 ARG HA 1 18 ARG HG3 3.520 . 3.520 2.777 2.445 3.175 . 0 0 "[ . 1 . 2]" 1 931 1 27 ARG HA 1 28 PRO HG2 4.590 . 4.590 4.403 3.964 4.568 . 0 0 "[ . 1 . 2]" 1 932 1 27 ARG HA 1 28 PRO HD2 3.670 . 3.670 2.321 1.794 2.746 0.006 14 0 "[ . 1 . 2]" 1 933 1 27 ARG HA 1 34 ALA HA 5.750 . 5.750 4.398 3.246 5.759 0.009 1 0 "[ . 1 . 2]" 1 934 1 62 LEU HB2 1 98 LEU HA 4.760 . 4.760 4.093 3.668 4.570 . 0 0 "[ . 1 . 2]" 1 935 1 10 GLU HA 1 10 GLU HG2 4.040 . 4.040 2.664 2.302 3.850 . 0 0 "[ . 1 . 2]" 1 936 1 78 GLU HA 1 83 ILE MG 4.270 . 4.270 4.051 3.859 4.176 . 0 0 "[ . 1 . 2]" 1 937 1 10 GLU HA 1 85 HIS HA 5.570 . 5.570 4.756 4.529 4.889 . 0 0 "[ . 1 . 2]" 1 938 1 10 GLU HA 1 86 LEU HA 5.750 . 5.750 4.757 4.510 5.037 . 0 0 "[ . 1 . 2]" 1 939 1 15 ILE HG13 1 90 HIS HA 4.930 . 4.930 4.297 3.925 4.607 . 0 0 "[ . 1 . 2]" 1 940 1 125 PRO HB2 1 126 LEU HG 5.440 . 5.440 4.181 3.761 5.468 0.028 13 0 "[ . 1 . 2]" 1 941 1 125 PRO HB2 1 128 GLU HB2 5.750 . 5.750 4.706 4.389 5.077 . 0 0 "[ . 1 . 2]" 1 942 1 51 ARG HB2 1 68 VAL HB 4.680 . 4.680 3.732 3.521 3.953 . 0 0 "[ . 1 . 2]" 1 943 1 51 ARG HG3 1 68 VAL HB 4.740 . 4.740 4.243 3.967 4.715 . 0 0 "[ . 1 . 2]" 1 944 1 51 ARG HB3 1 68 VAL HB 4.680 . 4.680 2.048 1.867 2.343 . 0 0 "[ . 1 . 2]" 1 945 1 45 GLU HA 1 46 PRO HB3 5.170 . 5.170 5.001 4.771 5.205 0.035 13 0 "[ . 1 . 2]" 1 946 1 77 ARG HD2 1 121 PRO HB2 5.750 . 5.750 4.525 3.356 5.396 . 0 0 "[ . 1 . 2]" 1 947 1 59 ARG HG2 1 60 GLU HB2 5.750 . 5.750 5.474 5.189 5.675 . 0 0 "[ . 1 . 2]" 1 948 1 59 ARG HG2 1 60 GLU HB3 5.750 . 5.750 5.488 5.260 5.642 . 0 0 "[ . 1 . 2]" 1 949 1 9 ILE HG13 1 9 ILE MG 3.480 . 3.480 3.200 3.191 3.205 . 0 0 "[ . 1 . 2]" 1 950 1 83 ILE HG12 1 83 ILE MG 3.490 . 3.490 2.271 2.243 2.331 . 0 0 "[ . 1 . 2]" 1 951 1 14 ALA MB 1 58 LEU MD2 3.280 . 3.280 2.073 1.918 2.146 . 0 0 "[ . 1 . 2]" 1 952 1 11 VAL MG2 1 86 LEU HA 4.370 . 4.370 4.203 3.977 4.389 0.019 18 0 "[ . 1 . 2]" 1 953 1 72 VAL MG1 1 130 PHE HA 4.490 . 4.490 2.142 1.903 2.495 . 0 0 "[ . 1 . 2]" 1 954 1 10 GLU HB2 1 44 VAL MG2 3.640 . 3.640 3.387 2.878 3.623 . 0 0 "[ . 1 . 2]" 1 955 1 72 VAL MG2 1 88 ALA MB 4.110 . 4.110 3.421 3.204 3.828 . 0 0 "[ . 1 . 2]" 1 956 1 104 GLN HB3 1 105 ALA MB 4.200 . 4.200 3.450 3.336 3.589 . 0 0 "[ . 1 . 2]" 1 957 1 72 VAL MG1 1 88 ALA MB 4.110 . 4.110 3.103 2.767 3.359 . 0 0 "[ . 1 . 2]" 1 958 1 25 ALA MB 1 40 ALA MB 4.940 . 4.940 3.036 2.711 3.578 . 0 0 "[ . 1 . 2]" 1 959 1 114 ALA MB 1 115 LEU HA 4.420 . 4.420 3.784 3.746 3.835 . 0 0 "[ . 1 . 2]" 1 960 1 133 LEU HA 1 136 ALA MB 4.690 . 4.690 3.419 3.014 4.007 . 0 0 "[ . 1 . 2]" 1 961 1 62 LEU HB3 1 64 ILE MG 3.820 . 3.820 3.212 2.982 3.445 . 0 0 "[ . 1 . 2]" 1 962 1 16 ILE MG 1 23 LEU MD1 5.050 . 5.050 3.961 2.297 4.307 . 0 0 "[ . 1 . 2]" 1 963 1 84 ILE HB 1 84 ILE MD 3.490 . 3.490 2.602 2.565 2.649 . 0 0 "[ . 1 . 2]" 1 964 1 8 MET HA 1 8 MET HG2 3.920 . 3.920 2.428 2.307 2.514 . 0 0 "[ . 1 . 2]" 1 965 1 8 MET HG2 1 85 HIS HB2 5.750 . 5.750 4.531 3.914 5.447 . 0 0 "[ . 1 . 2]" 1 966 1 111 PRO HB3 1 131 MET HB3 5.110 . 5.110 3.134 2.447 3.565 . 0 0 "[ . 1 . 2]" 1 967 1 51 ARG HB3 1 55 VAL HB 5.750 . 5.750 5.439 5.256 5.688 . 0 0 "[ . 1 . 2]" 1 968 1 111 PRO HB2 1 127 LEU MD2 4.490 . 4.490 3.881 3.386 4.317 . 0 0 "[ . 1 . 2]" 1 969 1 111 PRO HB2 1 127 LEU MD1 4.490 . 4.490 3.373 2.922 3.747 . 0 0 "[ . 1 . 2]" 1 970 1 8 MET HG3 1 83 ILE MG 4.120 . 4.120 4.017 3.805 4.151 0.031 8 0 "[ . 1 . 2]" 1 971 1 16 ILE MD 1 23 LEU HB2 4.650 . 4.650 4.116 3.366 4.629 . 0 0 "[ . 1 . 2]" 1 972 1 96 GLY HA3 1 97 THR HA 5.260 . 5.260 4.385 4.347 4.426 . 0 0 "[ . 1 . 2]" 1 973 1 96 GLY HA2 1 97 THR HA 5.260 . 5.260 4.468 4.423 4.507 . 0 0 "[ . 1 . 2]" 1 974 1 64 ILE MG 1 96 GLY HA3 4.570 . 4.570 2.756 2.517 3.306 . 0 0 "[ . 1 . 2]" 1 975 1 64 ILE MG 1 96 GLY HA2 4.570 . 4.570 4.036 3.849 4.515 . 0 0 "[ . 1 . 2]" 1 976 1 92 PRO HD2 1 93 ASP HB2 5.750 . 5.750 5.251 4.453 5.756 0.006 5 0 "[ . 1 . 2]" 1 977 1 66 ALA HA 1 93 ASP HB3 5.630 . 5.630 5.482 5.082 5.702 0.072 13 0 "[ . 1 . 2]" 1 978 1 92 PRO HD2 1 93 ASP HB3 5.750 . 5.750 4.611 3.785 5.444 . 0 0 "[ . 1 . 2]" 1 979 1 119 LEU HB3 1 124 ILE HA 5.360 . 5.360 3.980 3.700 4.232 . 0 0 "[ . 1 . 2]" 1 980 1 119 LEU HB2 1 123 ASP HB2 5.750 . 5.750 3.819 3.501 5.289 . 0 0 "[ . 1 . 2]" 1 981 1 119 LEU HB3 1 123 ASP HB2 4.700 . 4.700 2.262 1.912 3.680 . 0 0 "[ . 1 . 2]" 1 982 1 119 LEU HB2 1 123 ASP HB3 5.340 . 5.340 4.377 3.605 4.795 . 0 0 "[ . 1 . 2]" 1 983 1 117 TYR HB3 1 119 LEU HB2 5.750 . 5.750 5.772 5.621 5.862 0.112 4 0 "[ . 1 . 2]" 1 984 1 119 LEU HB3 1 124 ILE HB 5.750 . 5.750 5.537 5.283 5.790 0.040 10 0 "[ . 1 . 2]" 1 985 1 92 PRO HB2 1 93 ASP HB2 4.970 . 4.970 3.684 3.406 3.974 . 0 0 "[ . 1 . 2]" 1 986 1 92 PRO HB2 1 93 ASP HB3 5.190 . 5.190 4.429 3.826 4.973 . 0 0 "[ . 1 . 2]" 1 987 1 92 PRO HG2 1 93 ASP HB2 5.090 . 5.090 3.804 3.301 4.148 . 0 0 "[ . 1 . 2]" 1 988 1 92 PRO HG2 1 93 ASP HB3 5.250 . 5.250 3.561 3.170 4.022 . 0 0 "[ . 1 . 2]" 1 989 1 67 THR MG 1 93 ASP HB3 4.540 . 4.540 3.362 2.091 4.223 . 0 0 "[ . 1 . 2]" 1 990 1 24 LEU HB2 1 37 TRP HB3 4.580 . 4.580 3.472 3.206 3.595 . 0 0 "[ . 1 . 2]" 1 991 1 13 ALA HA 1 14 ALA HA 4.740 . 4.740 4.355 4.327 4.376 . 0 0 "[ . 1 . 2]" 1 992 1 122 ALA HA 1 125 PRO HD3 4.690 . 4.690 4.175 3.901 4.530 . 0 0 "[ . 1 . 2]" 1 993 1 124 ILE HB 1 125 PRO HD3 3.610 . 3.610 1.957 1.842 2.036 . 0 0 "[ . 1 . 2]" 1 994 1 118 PRO HD2 1 119 LEU HG 5.430 . 5.430 5.135 4.981 5.263 . 0 0 "[ . 1 . 2]" 1 995 1 14 ALA HA 1 54 LEU MD2 4.500 . 4.500 3.138 2.613 3.371 . 0 0 "[ . 1 . 2]" 1 996 1 117 TYR QD 1 118 PRO HD3 5.750 . 5.750 3.502 2.543 4.359 . 0 0 "[ . 1 . 2]" 1 997 1 117 TYR QD 1 118 PRO HD2 5.260 . 5.260 2.345 1.841 2.940 . 0 0 "[ . 1 . 2]" 1 998 1 110 SER HA 1 111 PRO HD3 3.870 . 3.870 2.601 2.145 2.751 . 0 0 "[ . 1 . 2]" 1 999 1 110 SER HA 1 111 PRO HD2 3.880 . 3.880 2.391 2.258 2.731 . 0 0 "[ . 1 . 2]" 1 1000 1 21 LYS HA 1 111 PRO HD2 4.990 . 4.990 3.966 3.703 4.382 . 0 0 "[ . 1 . 2]" 1 1001 1 36 LEU HA 1 118 PRO HD2 5.210 . 5.210 4.185 3.964 4.593 . 0 0 "[ . 1 . 2]" 1 1002 1 117 TYR HB2 1 118 PRO HD3 4.900 . 4.900 4.684 4.445 4.878 . 0 0 "[ . 1 . 2]" 1 1003 1 117 TYR HB2 1 118 PRO HD2 4.470 . 4.470 3.639 3.414 3.789 . 0 0 "[ . 1 . 2]" 1 1004 1 117 TYR HB3 1 118 PRO HD3 4.250 . 4.250 3.412 3.044 3.687 . 0 0 "[ . 1 . 2]" 1 1005 1 25 ALA HA 1 106 LEU HB3 5.750 . 5.750 4.775 4.059 5.322 . 0 0 "[ . 1 . 2]" 1 1006 1 24 LEU HB3 1 25 ALA HA 5.720 . 5.720 4.480 4.358 4.572 . 0 0 "[ . 1 . 2]" 1 1007 1 25 ALA HA 1 106 LEU HG 5.750 . 5.750 4.162 2.186 5.261 . 0 0 "[ . 1 . 2]" 1 1008 1 22 ILE HG12 1 111 PRO HD2 5.750 . 5.750 5.602 5.167 5.808 0.058 12 0 "[ . 1 . 2]" 1 1009 1 24 LEU HB2 1 25 ALA HA 5.750 . 5.750 4.887 4.685 5.050 . 0 0 "[ . 1 . 2]" 1 1010 1 25 ALA HA 1 106 LEU HB2 5.750 . 5.750 5.001 4.665 5.422 . 0 0 "[ . 1 . 2]" 1 1011 1 22 ILE MD 1 111 PRO HD2 5.280 . 5.280 4.418 4.091 4.851 . 0 0 "[ . 1 . 2]" 1 1012 1 22 ILE MD 1 111 PRO HD3 4.830 . 4.830 3.112 2.673 3.534 . 0 0 "[ . 1 . 2]" 1 1013 1 117 TYR HB3 1 118 PRO HD2 3.270 . 3.270 2.008 1.701 2.235 0.099 4 0 "[ . 1 . 2]" 1 1014 1 12 VAL HA 1 13 ALA HA 5.320 . 5.320 4.369 4.346 4.386 . 0 0 "[ . 1 . 2]" 1 1015 1 13 ALA HA 1 88 ALA HA 5.750 . 5.750 4.654 4.566 4.776 . 0 0 "[ . 1 . 2]" 1 1016 1 13 ALA HA 1 39 PHE HB3 5.750 . 5.750 4.356 4.058 4.779 . 0 0 "[ . 1 . 2]" 1 1017 1 13 ALA HA 1 41 GLY HA3 3.910 . 3.910 2.502 2.316 2.936 . 0 0 "[ . 1 . 2]" 1 1018 1 13 ALA HA 1 39 PHE HB2 5.750 . 5.750 4.405 3.891 4.833 . 0 0 "[ . 1 . 2]" 1 1019 1 70 GLU HG2 1 92 PRO HD3 5.020 . 5.020 3.034 2.201 4.209 . 0 0 "[ . 1 . 2]" 1 1020 1 91 VAL HA 1 92 PRO HD2 3.830 . 3.830 2.071 1.802 2.337 . 0 0 "[ . 1 . 2]" 1 1021 1 45 GLU HA 1 46 PRO HD2 3.540 . 3.540 2.334 2.038 3.191 . 0 0 "[ . 1 . 2]" 1 1022 1 45 GLU HA 1 46 PRO HD3 3.540 . 3.540 2.416 1.981 2.603 . 0 0 "[ . 1 . 2]" 1 1023 1 137 ARG HA 1 138 PRO HD3 3.310 . 3.310 2.383 1.931 2.653 . 0 0 "[ . 1 . 2]" 1 1024 1 27 ARG HA 1 28 PRO HD3 3.880 . 3.880 2.208 1.831 2.628 . 0 0 "[ . 1 . 2]" 1 1025 1 28 PRO HD2 1 34 ALA HA 5.310 . 5.310 4.058 2.845 5.315 0.005 1 0 "[ . 1 . 2]" 1 1026 1 62 LEU HA 1 100 ALA HA 4.460 . 4.460 3.628 3.088 3.924 . 0 0 "[ . 1 . 2]" 1 1027 1 104 GLN HG2 1 105 ALA HA 5.750 . 5.750 4.573 3.667 5.772 0.022 10 0 "[ . 1 . 2]" 1 1028 1 104 GLN HG3 1 105 ALA HA 5.750 . 5.750 4.781 3.700 5.631 . 0 0 "[ . 1 . 2]" 1 1029 1 73 ALA HA 1 74 SER HA 5.000 . 5.000 4.509 4.435 4.600 . 0 0 "[ . 1 . 2]" 1 1030 1 104 GLN HA 1 105 ALA HA 4.990 . 4.990 4.536 4.480 4.581 . 0 0 "[ . 1 . 2]" 1 1031 1 40 ALA HA 1 41 GLY HA2 5.120 . 5.120 4.599 4.515 4.734 . 0 0 "[ . 1 . 2]" 1 1032 1 99 GLN HG3 1 100 ALA HA 5.370 . 5.370 4.049 3.797 4.617 . 0 0 "[ . 1 . 2]" 1 1033 1 99 GLN HB2 1 100 ALA HA 5.230 . 5.230 4.787 4.631 5.038 . 0 0 "[ . 1 . 2]" 1 1034 1 25 ALA MB 1 40 ALA HA 4.750 . 4.750 3.895 3.620 4.359 . 0 0 "[ . 1 . 2]" 1 1035 1 64 ILE HB 1 66 ALA HA 5.670 . 5.670 4.376 4.145 4.583 . 0 0 "[ . 1 . 2]" 1 1036 1 39 PHE HA 1 40 ALA HA 5.330 . 5.330 4.320 4.266 4.372 . 0 0 "[ . 1 . 2]" 1 1037 1 66 ALA HA 1 94 PHE HB3 3.830 . 3.830 2.833 2.484 3.118 . 0 0 "[ . 1 . 2]" 1 1038 1 66 ALA HA 1 94 PHE HB2 4.160 . 4.160 3.117 2.727 3.439 . 0 0 "[ . 1 . 2]" 1 1039 1 38 GLU HA 1 123 ASP HB3 5.130 . 5.130 3.960 3.666 4.400 . 0 0 "[ . 1 . 2]" 1 1040 1 25 ALA MB 1 38 GLU HA 5.750 . 5.750 5.555 5.284 5.835 0.085 17 0 "[ . 1 . 2]" 1 1041 1 24 LEU HA 1 39 PHE HA 4.950 . 4.950 3.410 3.038 3.857 . 0 0 "[ . 1 . 2]" 1 1042 1 33 GLN HA 1 34 ALA HA 5.090 . 5.090 4.568 4.297 5.279 0.189 15 0 "[ . 1 . 2]" 1 1043 1 24 LEU HA 1 37 TRP HB2 5.750 . 5.750 5.271 4.824 5.755 0.005 13 0 "[ . 1 . 2]" 1 1044 1 24 LEU HA 1 37 TRP HB3 5.750 . 5.750 3.971 3.760 4.281 . 0 0 "[ . 1 . 2]" 1 1045 1 24 LEU HA 1 24 LEU HG 4.320 . 4.320 2.641 2.420 3.169 . 0 0 "[ . 1 . 2]" 1 1046 1 83 ILE MG 1 85 HIS HA 4.860 . 4.860 4.023 3.687 4.488 . 0 0 "[ . 1 . 2]" 1 1047 1 23 LEU HA 1 24 LEU HA 5.190 . 5.190 4.390 4.372 4.404 . 0 0 "[ . 1 . 2]" 1 1048 1 28 PRO HB2 1 29 ALA HA 5.060 . 5.060 4.530 4.179 5.143 0.083 14 0 "[ . 1 . 2]" 1 1049 1 16 ILE HB 1 23 LEU HA 5.310 . 5.310 4.348 4.050 4.660 . 0 0 "[ . 1 . 2]" 1 1050 1 22 ILE HB 1 23 LEU HA 5.650 . 5.650 4.916 4.821 5.040 . 0 0 "[ . 1 . 2]" 1 1051 1 23 LEU HA 1 24 LEU HB2 5.700 . 5.700 4.538 4.440 4.698 . 0 0 "[ . 1 . 2]" 1 1052 1 23 LEU HA 1 24 LEU HG 5.750 . 5.750 5.149 4.321 5.493 . 0 0 "[ . 1 . 2]" 1 1053 1 25 ALA HA 1 106 LEU HA 3.870 . 3.870 2.480 2.321 2.568 . 0 0 "[ . 1 . 2]" 1 1054 1 29 ALA HA 1 30 GLN HA 4.950 . 4.950 4.547 4.486 4.610 . 0 0 "[ . 1 . 2]" 1 1055 1 28 PRO HD2 1 29 ALA HA 5.480 . 5.480 4.879 3.961 5.504 0.024 18 0 "[ . 1 . 2]" 1 1056 1 29 ALA HA 1 30 GLN HG2 5.750 . 5.750 5.387 4.878 5.820 0.070 6 0 "[ . 1 . 2]" 1 1057 1 29 ALA HA 1 30 GLN HG3 5.750 . 5.750 4.927 4.333 5.929 0.179 5 0 "[ . 1 . 2]" 1 1058 1 119 LEU HA 1 119 LEU HG 4.230 . 4.230 3.084 2.928 3.196 . 0 0 "[ . 1 . 2]" 1 1059 1 106 LEU HA 1 106 LEU HG 4.350 . 4.350 3.041 2.359 3.771 . 0 0 "[ . 1 . 2]" 1 1060 1 76 GLN HA 1 85 HIS HA 3.360 . 3.360 2.674 2.398 2.880 . 0 0 "[ . 1 . 2]" 1 1061 1 61 GLU HA 1 62 LEU HA 4.920 . 4.920 4.537 4.507 4.568 . 0 0 "[ . 1 . 2]" 1 1062 1 137 ARG HA 1 138 PRO HD2 3.310 . 3.310 2.172 1.809 2.568 . 0 0 "[ . 1 . 2]" 1 1063 1 76 GLN HA 1 85 HIS HB2 5.450 . 5.450 4.740 4.244 5.261 . 0 0 "[ . 1 . 2]" 1 1064 1 75 HIS HB3 1 76 GLN HA 5.460 . 5.460 4.736 4.579 4.868 . 0 0 "[ . 1 . 2]" 1 1065 1 76 GLN HA 1 76 GLN HG3 3.690 . 3.690 2.816 2.336 3.037 . 0 0 "[ . 1 . 2]" 1 1066 1 136 ALA MB 1 137 ARG HA 4.750 . 4.750 4.284 4.070 4.472 . 0 0 "[ . 1 . 2]" 1 1067 1 76 GLN HA 1 83 ILE MG 4.730 . 4.730 3.921 3.632 4.302 . 0 0 "[ . 1 . 2]" 1 1068 1 122 ALA HA 1 125 PRO HD2 4.270 . 4.270 3.154 2.861 3.460 . 0 0 "[ . 1 . 2]" 1 1069 1 77 ARG HD2 1 122 ALA HA 4.890 . 4.890 4.616 3.047 4.969 0.079 18 0 "[ . 1 . 2]" 1 1070 1 82 ARG HA 1 82 ARG HD3 4.700 . 4.700 4.345 4.139 4.615 . 0 0 "[ . 1 . 2]" 1 1071 1 82 ARG HA 1 82 ARG HB3 3.130 . 3.130 2.450 2.373 2.561 . 0 0 "[ . 1 . 2]" 1 1072 1 82 ARG HA 1 82 ARG HG2 3.430 . 3.430 2.568 2.384 2.699 . 0 0 "[ . 1 . 2]" 1 1073 1 86 LEU MD1 1 122 ALA HA 5.150 . 5.150 4.535 4.093 5.157 0.007 18 0 "[ . 1 . 2]" 1 1074 1 76 GLN HA 1 77 ARG HA 5.250 . 5.250 4.428 4.405 4.453 . 0 0 "[ . 1 . 2]" 1 1075 1 21 LYS HA 1 110 SER HA 3.680 . 3.680 2.175 1.955 2.336 . 0 0 "[ . 1 . 2]" 1 1076 1 6 MET HA 1 82 ARG HA 5.470 . 5.470 3.950 2.577 5.494 0.024 17 0 "[ . 1 . 2]" 1 1077 1 82 ARG HA 1 83 ILE HA 5.660 . 5.660 4.330 4.289 4.377 . 0 0 "[ . 1 . 2]" 1 1078 1 21 LYS HA 1 111 PRO HD3 3.980 . 3.980 3.436 3.000 3.886 . 0 0 "[ . 1 . 2]" 1 1079 1 36 LEU HA 1 37 TRP HB2 5.750 . 5.750 4.662 4.552 4.781 . 0 0 "[ . 1 . 2]" 1 1080 1 36 LEU HA 1 118 PRO HB3 5.650 . 5.650 3.808 3.637 4.283 . 0 0 "[ . 1 . 2]" 1 1081 1 21 LYS HA 1 21 LYS HG3 4.450 . 4.450 3.756 3.470 3.939 . 0 0 "[ . 1 . 2]" 1 1082 1 21 LYS HA 1 22 ILE HG12 4.720 . 4.720 4.518 4.284 4.733 0.013 14 0 "[ . 1 . 2]" 1 1083 1 39 PHE HA 1 40 ALA MB 4.400 . 4.400 4.005 3.961 4.046 . 0 0 "[ . 1 . 2]" 1 1084 1 21 LYS HA 1 21 LYS HG2 3.970 . 3.970 2.688 2.449 2.956 . 0 0 "[ . 1 . 2]" 1 1085 1 88 ALA MB 1 123 ASP HA 5.230 . 5.230 5.168 4.800 5.268 0.038 11 0 "[ . 1 . 2]" 1 1086 1 21 LYS HA 1 22 ILE HG13 4.530 . 4.530 3.317 3.151 3.481 . 0 0 "[ . 1 . 2]" 1 1087 1 123 ASP HA 1 126 LEU MD2 5.030 . 5.030 4.417 2.881 4.865 . 0 0 "[ . 1 . 2]" 1 1088 1 25 ALA MB 1 39 PHE HA 5.750 . 5.750 4.420 3.969 4.848 . 0 0 "[ . 1 . 2]" 1 1089 1 77 ARG HA 1 78 GLU HA 4.970 . 4.970 4.389 4.324 4.430 . 0 0 "[ . 1 . 2]" 1 1090 1 46 PRO HG2 1 47 ASP HA 5.750 . 5.750 4.841 4.592 5.797 0.047 13 0 "[ . 1 . 2]" 1 1091 1 77 ARG HA 1 78 GLU HG2 5.750 . 5.750 4.618 4.389 4.918 . 0 0 "[ . 1 . 2]" 1 1092 1 11 VAL HB 1 86 LEU HA 3.640 . 3.640 2.714 2.409 2.990 . 0 0 "[ . 1 . 2]" 1 1093 1 86 LEU HA 1 86 LEU HG 4.070 . 4.070 2.322 2.278 2.367 . 0 0 "[ . 1 . 2]" 1 1094 1 86 LEU HA 1 86 LEU MD1 3.940 . 3.940 2.979 2.839 3.174 . 0 0 "[ . 1 . 2]" 1 1095 1 77 ARG HA 1 83 ILE MG 5.180 . 5.180 4.671 4.507 4.839 . 0 0 "[ . 1 . 2]" 1 1096 1 8 MET HA 1 84 ILE HA 5.120 . 5.120 4.289 4.160 4.492 . 0 0 "[ . 1 . 2]" 1 1097 1 8 MET HA 1 9 ILE HA 4.740 . 4.740 4.368 4.351 4.392 . 0 0 "[ . 1 . 2]" 1 1098 1 99 GLN HA 1 100 ALA HA 4.700 . 4.700 4.382 4.301 4.426 . 0 0 "[ . 1 . 2]" 1 1099 1 48 GLU HA 1 49 SER HB3 5.600 . 5.600 5.137 4.616 5.704 0.104 9 0 "[ . 1 . 2]" 1 1100 1 23 LEU HA 1 108 TRP HA 3.820 . 3.820 2.802 2.420 3.089 . 0 0 "[ . 1 . 2]" 1 1101 1 74 SER HB2 1 87 HIS HA 4.350 . 4.350 3.895 2.906 4.454 0.104 18 0 "[ . 1 . 2]" 1 1102 1 32 ASP HA 1 33 GLN HA 4.900 . 4.900 4.666 4.346 5.024 0.124 10 0 "[ . 1 . 2]" 1 1103 1 113 GLU HA 1 114 ALA HA 5.430 . 5.430 4.845 4.817 4.880 . 0 0 "[ . 1 . 2]" 1 1104 1 114 ALA HA 1 115 LEU HA 5.750 . 5.750 4.694 4.668 4.715 . 0 0 "[ . 1 . 2]" 1 1105 1 48 GLU HA 1 49 SER HB2 5.600 . 5.600 4.629 4.179 5.655 0.055 3 0 "[ . 1 . 2]" 1 1106 1 52 GLN HA 1 53 ALA HA 5.040 . 5.040 4.815 4.791 4.840 . 0 0 "[ . 1 . 2]" 1 1107 1 122 ALA HA 1 123 ASP HA 5.090 . 5.090 4.728 4.698 4.742 . 0 0 "[ . 1 . 2]" 1 1108 1 74 SER HB3 1 87 HIS HA 4.350 . 4.350 3.143 2.542 4.387 0.037 7 0 "[ . 1 . 2]" 1 1109 1 114 ALA HA 1 117 TYR HB2 4.510 . 4.510 3.060 2.896 3.401 . 0 0 "[ . 1 . 2]" 1 1110 1 109 CYS QB 1 114 ALA HA 4.880 . 4.880 3.835 3.361 4.223 . 0 0 "[ . 1 . 2]" 1 1111 1 8 MET HA 1 8 MET HG3 3.870 . 3.870 2.932 2.815 3.084 . 0 0 "[ . 1 . 2]" 1 1112 1 113 GLU HB3 1 114 ALA HA 4.820 . 4.820 4.415 3.995 4.595 . 0 0 "[ . 1 . 2]" 1 1113 1 32 ASP HA 1 33 GLN HG2 5.520 . 5.520 5.244 3.215 5.680 0.160 15 0 "[ . 1 . 2]" 1 1114 1 46 PRO HB2 1 47 ASP HA 5.750 . 5.750 4.257 3.893 4.475 . 0 0 "[ . 1 . 2]" 1 1115 1 99 GLN HA 1 99 GLN HG2 4.460 . 4.460 3.768 3.663 3.848 . 0 0 "[ . 1 . 2]" 1 1116 1 131 MET HG3 1 132 ALA HA 4.730 . 4.730 3.485 3.146 3.612 . 0 0 "[ . 1 . 2]" 1 1117 1 48 GLU HB2 1 53 ALA HA 4.300 . 4.300 4.088 3.449 4.354 0.054 7 0 "[ . 1 . 2]" 1 1118 1 128 GLU HB2 1 129 ALA HA 5.070 . 5.070 4.485 4.196 4.797 . 0 0 "[ . 1 . 2]" 1 1119 1 21 LYS HB2 1 108 TRP HA 4.610 . 4.610 4.210 3.686 4.604 . 0 0 "[ . 1 . 2]" 1 1120 1 8 MET HA 1 83 ILE HB 3.630 . 3.630 2.988 2.860 3.082 . 0 0 "[ . 1 . 2]" 1 1121 1 22 ILE HB 1 108 TRP HA 5.750 . 5.750 5.125 4.941 5.342 . 0 0 "[ . 1 . 2]" 1 1122 1 123 ASP HA 1 127 LEU HB2 5.750 . 5.750 4.971 4.771 5.260 . 0 0 "[ . 1 . 2]" 1 1123 1 53 ALA HA 1 56 ARG HG2 4.070 . 4.070 2.591 2.139 2.862 . 0 0 "[ . 1 . 2]" 1 1124 1 98 LEU HB2 1 99 GLN HA 4.850 . 4.850 4.400 4.177 4.678 . 0 0 "[ . 1 . 2]" 1 1125 1 99 GLN HA 1 100 ALA MB 4.410 . 4.410 3.957 3.875 4.043 . 0 0 "[ . 1 . 2]" 1 1126 1 15 ILE HB 1 90 HIS HA 3.820 . 3.820 2.305 2.046 2.669 . 0 0 "[ . 1 . 2]" 1 1127 1 8 MET HA 1 9 ILE HG13 4.530 . 4.530 3.694 3.559 3.803 . 0 0 "[ . 1 . 2]" 1 1128 1 107 VAL MG2 1 108 TRP HA 5.750 . 5.750 3.842 3.705 3.998 . 0 0 "[ . 1 . 2]" 1 1129 1 24 LEU MD2 1 114 ALA HA 4.850 . 4.850 3.009 2.219 4.692 . 0 0 "[ . 1 . 2]" 1 1130 1 6 MET HA 1 6 MET HG3 4.200 . 4.200 3.354 2.405 4.251 0.051 11 0 "[ . 1 . 2]" 1 1131 1 6 MET HA 1 6 MET HG2 4.200 . 4.200 3.139 2.522 3.819 . 0 0 "[ . 1 . 2]" 1 1132 1 65 GLU HB3 1 95 HIS HB2 4.900 . 4.900 4.266 3.318 4.917 0.017 11 0 "[ . 1 . 2]" 1 1133 1 65 GLU HB2 1 95 HIS HB3 4.900 . 4.900 2.417 1.758 3.705 0.042 10 0 "[ . 1 . 2]" 1 1134 1 65 GLU HB2 1 95 HIS HB2 4.900 . 4.900 2.849 1.766 3.633 0.034 20 0 "[ . 1 . 2]" 1 1135 1 6 MET HG3 1 83 ILE MD 5.050 . 5.050 3.591 2.176 5.050 0.000 18 0 "[ . 1 . 2]" 1 1136 1 6 MET HG2 1 83 ILE MD 5.050 . 5.050 3.460 2.256 4.684 . 0 0 "[ . 1 . 2]" 1 1137 1 111 PRO HB2 1 131 MET HB3 4.550 . 4.550 2.424 1.978 2.875 . 0 0 "[ . 1 . 2]" 1 1138 1 121 PRO HB2 1 122 ALA MB 4.900 . 4.900 4.171 3.767 4.445 . 0 0 "[ . 1 . 2]" 1 1139 1 8 MET HG2 1 83 ILE HG12 4.820 . 4.820 4.348 4.132 4.581 . 0 0 "[ . 1 . 2]" 1 1140 1 91 VAL HA 1 92 PRO HB2 5.750 . 5.750 5.477 5.389 5.523 . 0 0 "[ . 1 . 2]" 1 1141 1 27 ARG HA 1 28 PRO HB3 5.420 . 5.420 4.861 4.574 5.353 . 0 0 "[ . 1 . 2]" 1 1142 1 82 ARG HB3 1 82 ARG HD3 4.200 . 4.200 2.580 2.350 3.545 . 0 0 "[ . 1 . 2]" 1 1143 1 130 PHE HB3 1 131 MET HG2 5.110 . 5.110 4.399 4.215 4.747 . 0 0 "[ . 1 . 2]" 1 1144 1 128 GLU HA 1 131 MET HG3 4.390 . 4.390 3.583 3.392 3.859 . 0 0 "[ . 1 . 2]" 1 1145 1 131 MET HA 1 131 MET HG2 4.230 . 4.230 3.794 3.760 3.881 . 0 0 "[ . 1 . 2]" 1 1146 1 70 GLU HG2 1 92 PRO HB2 5.750 . 5.750 5.462 4.621 6.036 0.286 6 0 "[ . 1 . 2]" 1 1147 1 44 VAL HB 1 53 ALA MB 5.750 . 5.750 4.363 4.122 4.753 . 0 0 "[ . 1 . 2]" 1 1148 1 131 MET HG2 1 132 ALA MB 5.220 . 5.220 3.966 3.843 4.055 . 0 0 "[ . 1 . 2]" 1 1149 1 127 LEU MD2 1 131 MET HG2 5.560 . 5.560 4.437 4.141 4.839 . 0 0 "[ . 1 . 2]" 1 1150 1 127 LEU MD1 1 131 MET HG2 5.560 . 5.560 2.867 2.655 3.202 . 0 0 "[ . 1 . 2]" 1 1151 1 111 PRO HA 1 131 MET HB3 4.920 . 4.920 4.316 3.841 4.561 . 0 0 "[ . 1 . 2]" 1 1152 1 111 PRO HA 1 131 MET HB2 5.750 . 5.750 5.589 5.058 5.812 0.062 17 0 "[ . 1 . 2]" 1 1153 1 131 MET HB2 1 132 ALA HA 5.750 . 5.750 4.839 4.781 4.911 . 0 0 "[ . 1 . 2]" 1 1154 1 112 GLU HA 1 131 MET HB3 5.220 . 5.220 4.212 3.812 4.669 . 0 0 "[ . 1 . 2]" 1 1155 1 112 GLU HA 1 131 MET HB2 4.990 . 4.990 4.445 3.966 5.014 0.024 5 0 "[ . 1 . 2]" 1 1156 1 128 GLU HA 1 131 MET HB2 5.620 . 5.620 5.234 4.953 5.489 . 0 0 "[ . 1 . 2]" 1 1157 1 127 LEU HG 1 131 MET HB3 5.370 . 5.370 5.411 5.244 5.487 0.117 18 0 "[ . 1 . 2]" 1 1158 1 114 ALA MB 1 131 MET HB3 5.750 . 5.750 5.533 5.112 5.775 0.025 5 0 "[ . 1 . 2]" 1 1159 1 131 MET HB3 1 135 ALA MB 5.750 . 5.750 5.506 5.277 5.760 0.010 17 0 "[ . 1 . 2]" 1 1160 1 131 MET HB2 1 135 ALA MB 5.220 . 5.220 4.133 3.884 4.446 . 0 0 "[ . 1 . 2]" 1 1161 1 12 VAL MG1 1 44 VAL HB 5.450 . 5.450 4.173 3.962 4.260 . 0 0 "[ . 1 . 2]" 1 1162 1 11 VAL HA 1 43 LYS HB2 4.520 . 4.520 4.174 3.563 4.421 . 0 0 "[ . 1 . 2]" 1 1163 1 63 GLY HA3 1 99 GLN HG2 4.570 . 4.570 2.613 1.950 2.955 . 0 0 "[ . 1 . 2]" 1 1164 1 104 GLN HG3 1 105 ALA MB 5.000 . 5.000 3.932 2.564 4.894 . 0 0 "[ . 1 . 2]" 1 1165 1 64 ILE MG 1 99 GLN HG2 5.050 . 5.050 4.401 4.111 4.706 . 0 0 "[ . 1 . 2]" 1 1166 1 104 GLN HG2 1 105 ALA MB 5.000 . 5.000 3.370 2.661 4.396 . 0 0 "[ . 1 . 2]" 1 1167 1 113 GLU HA 1 116 GLN HG3 4.990 . 4.990 3.224 2.801 3.972 . 0 0 "[ . 1 . 2]" 1 1168 1 113 GLU HA 1 116 GLN HG2 4.990 . 4.990 4.174 2.424 4.978 . 0 0 "[ . 1 . 2]" 1 1169 1 76 GLN HG3 1 85 HIS HB3 5.640 . 5.640 5.440 4.333 5.708 0.068 18 0 "[ . 1 . 2]" 1 1170 1 75 HIS HB3 1 125 PRO HB3 5.750 . 5.750 5.592 5.062 5.780 0.030 1 0 "[ . 1 . 2]" 1 1171 1 75 HIS HB3 1 126 LEU HB2 5.750 . 5.750 5.584 5.203 5.770 0.020 11 0 "[ . 1 . 2]" 1 1172 1 75 HIS HB3 1 126 LEU HG 5.150 . 5.150 3.359 2.893 5.191 0.041 6 0 "[ . 1 . 2]" 1 1173 1 75 HIS HB2 1 125 PRO HG2 5.180 . 5.180 2.991 2.661 3.234 . 0 0 "[ . 1 . 2]" 1 1174 1 75 HIS HB3 1 86 LEU HB2 4.770 . 4.770 2.941 2.706 3.260 . 0 0 "[ . 1 . 2]" 1 1175 1 75 HIS HB3 1 125 PRO HG2 5.100 . 5.100 3.409 3.150 3.584 . 0 0 "[ . 1 . 2]" 1 1176 1 75 HIS HB3 1 125 PRO HG3 5.550 . 5.550 4.376 3.914 4.583 . 0 0 "[ . 1 . 2]" 1 1177 1 76 GLN HG2 1 85 HIS HA 4.550 . 4.550 2.606 1.830 4.009 . 0 0 "[ . 1 . 2]" 1 1178 1 76 GLN HG2 1 83 ILE MG 4.400 . 4.400 2.950 2.071 3.604 . 0 0 "[ . 1 . 2]" 1 1179 1 50 GLN HG2 1 53 ALA MB 5.660 . 5.660 4.749 4.417 5.184 . 0 0 "[ . 1 . 2]" 1 1180 1 49 SER HA 1 50 GLN HG3 4.660 . 4.660 3.947 3.723 4.170 . 0 0 "[ . 1 . 2]" 1 1181 1 33 GLN HA 1 33 GLN HG3 4.130 . 4.130 3.545 3.111 3.828 . 0 0 "[ . 1 . 2]" 1 1182 1 79 VAL HB 1 84 ILE HG12 4.180 . 4.180 3.518 3.246 3.633 . 0 0 "[ . 1 . 2]" 1 1183 1 79 VAL HB 1 84 ILE HG13 5.400 . 5.400 3.917 3.661 4.111 . 0 0 "[ . 1 . 2]" 1 1184 1 57 GLU HA 1 57 GLU HG3 4.180 . 4.180 3.707 3.663 3.746 . 0 0 "[ . 1 . 2]" 1 1185 1 121 PRO HA 1 124 ILE HB 5.050 . 5.050 3.659 3.273 4.304 . 0 0 "[ . 1 . 2]" 1 1186 1 124 ILE HB 1 125 PRO HD2 4.350 . 4.350 2.361 2.184 2.511 . 0 0 "[ . 1 . 2]" 1 1187 1 12 VAL HB 1 53 ALA MB 5.270 . 5.270 4.232 4.043 4.594 . 0 0 "[ . 1 . 2]" 1 1188 1 12 VAL HB 1 54 LEU HG 4.320 . 4.320 1.977 1.791 2.159 0.009 17 0 "[ . 1 . 2]" 1 1189 1 17 GLU HG2 1 22 ILE HA 5.530 . 5.530 4.329 3.135 5.085 . 0 0 "[ . 1 . 2]" 1 1190 1 14 ALA HA 1 15 ILE HB 5.270 . 5.270 4.533 4.472 4.602 . 0 0 "[ . 1 . 2]" 1 1191 1 11 VAL HB 1 43 LYS HA 4.920 . 4.920 4.682 4.483 4.915 . 0 0 "[ . 1 . 2]" 1 1192 1 78 GLU HG3 1 79 VAL HA 4.950 . 4.950 3.586 3.352 3.884 . 0 0 "[ . 1 . 2]" 1 1193 1 78 GLU HG3 1 81 GLY HA2 4.950 . 4.950 4.995 4.957 5.034 0.084 16 0 "[ . 1 . 2]" 1 1194 1 21 LYS HB2 1 21 LYS HE3 5.070 . 5.070 4.732 4.070 4.870 . 0 0 "[ . 1 . 2]" 1 1195 1 21 LYS HB3 1 21 LYS HE2 4.910 . 4.910 4.311 3.114 4.605 . 0 0 "[ . 1 . 2]" 1 1196 1 21 LYS HB3 1 21 LYS HE3 5.300 . 5.300 4.212 2.806 4.463 . 0 0 "[ . 1 . 2]" 1 1197 1 21 LYS HB2 1 108 TRP HB2 4.730 . 4.730 3.564 2.406 4.409 . 0 0 "[ . 1 . 2]" 1 1198 1 59 ARG HG2 1 60 GLU HG3 4.630 . 4.630 4.138 3.779 4.728 0.098 11 0 "[ . 1 . 2]" 1 1199 1 59 ARG HG2 1 60 GLU HG2 5.070 . 5.070 3.515 3.035 3.946 . 0 0 "[ . 1 . 2]" 1 1200 1 21 LYS HB3 1 21 LYS HD3 4.090 . 4.090 2.264 1.973 2.582 . 0 0 "[ . 1 . 2]" 1 1201 1 77 ARG HG3 1 78 GLU HG2 5.590 . 5.590 5.554 5.183 5.648 0.058 17 0 "[ . 1 . 2]" 1 1202 1 78 GLU HG2 1 83 ILE HG13 5.750 . 5.750 5.537 5.269 5.772 0.022 16 0 "[ . 1 . 2]" 1 1203 1 78 GLU HG3 1 83 ILE MD 5.370 . 5.370 5.290 4.861 5.417 0.047 19 0 "[ . 1 . 2]" 1 1204 1 106 LEU HA 1 107 VAL HB 5.410 . 5.410 4.542 4.347 5.634 0.224 17 0 "[ . 1 . 2]" 1 1205 1 78 GLU HA 1 78 GLU HG2 4.020 . 4.020 3.821 3.743 3.887 . 0 0 "[ . 1 . 2]" 1 1206 1 78 GLU HA 1 78 GLU HG3 4.250 . 4.250 3.648 3.582 3.718 . 0 0 "[ . 1 . 2]" 1 1207 1 48 GLU HA 1 48 GLU HG3 4.130 . 4.130 3.799 3.754 3.856 . 0 0 "[ . 1 . 2]" 1 1208 1 48 GLU HA 1 48 GLU HG2 4.130 . 4.130 3.723 3.667 3.787 . 0 0 "[ . 1 . 2]" 1 1209 1 24 LEU HB2 1 107 VAL HB 5.020 . 5.020 4.514 4.373 5.025 0.005 13 0 "[ . 1 . 2]" 1 1210 1 19 ASP HB2 1 21 LYS HB2 5.180 . 5.180 3.933 3.333 4.453 . 0 0 "[ . 1 . 2]" 1 1211 1 10 GLU HA 1 10 GLU HG3 4.040 . 4.040 3.530 2.453 3.809 . 0 0 "[ . 1 . 2]" 1 1212 1 125 PRO HA 1 128 GLU HG2 4.380 . 4.380 3.787 3.097 4.390 0.010 3 0 "[ . 1 . 2]" 1 1213 1 128 GLU HA 1 128 GLU HG3 4.020 . 4.020 3.522 3.207 3.767 . 0 0 "[ . 1 . 2]" 1 1214 1 115 LEU MD2 1 128 GLU HG2 4.270 . 4.270 2.928 2.271 3.499 . 0 0 "[ . 1 . 2]" 1 1215 1 109 CYS QB 1 113 GLU HG3 4.530 . 4.530 3.400 2.800 4.118 . 0 0 "[ . 1 . 2]" 1 1216 1 114 ALA HA 1 117 TYR HB3 5.070 . 5.070 4.643 4.445 4.992 . 0 0 "[ . 1 . 2]" 1 1217 1 15 ILE HA 1 16 ILE HB 5.070 . 5.070 4.837 4.698 5.013 . 0 0 "[ . 1 . 2]" 1 1218 1 16 ILE HB 1 23 LEU HB2 4.190 . 4.190 2.214 1.698 2.690 0.102 19 0 "[ . 1 . 2]" 1 1219 1 16 ILE HB 1 23 LEU HB3 4.550 . 4.550 2.014 1.761 2.340 0.039 15 0 "[ . 1 . 2]" 1 1220 1 15 ILE MG 1 16 ILE HB 5.620 . 5.620 5.001 4.815 5.100 . 0 0 "[ . 1 . 2]" 1 1221 1 78 GLU HA 1 83 ILE HB 5.400 . 5.400 5.229 5.069 5.347 . 0 0 "[ . 1 . 2]" 1 1222 1 8 MET HG3 1 83 ILE HB 4.730 . 4.730 3.421 3.340 3.572 . 0 0 "[ . 1 . 2]" 1 1223 1 8 MET HG2 1 83 ILE HB 4.920 . 4.920 2.364 1.981 2.791 . 0 0 "[ . 1 . 2]" 1 1224 1 8 MET HB3 1 83 ILE HB 4.630 . 4.630 4.429 4.055 4.666 0.036 7 0 "[ . 1 . 2]" 1 1225 1 77 ARG HG2 1 84 ILE HB 4.290 . 4.290 2.751 2.205 3.103 . 0 0 "[ . 1 . 2]" 1 1226 1 119 LEU HB3 1 123 ASP HB3 4.730 . 4.730 2.823 2.049 3.218 . 0 0 "[ . 1 . 2]" 1 1227 1 22 ILE MD 1 130 PHE HB3 4.840 . 4.840 3.746 3.527 4.086 . 0 0 "[ . 1 . 2]" 1 1228 1 119 LEU MD2 1 123 ASP HB2 5.140 . 5.140 3.391 3.006 4.206 . 0 0 "[ . 1 . 2]" 1 1229 1 18 ARG HA 1 19 ASP HB2 5.290 . 5.290 4.749 4.634 4.956 . 0 0 "[ . 1 . 2]" 1 1230 1 19 ASP HB3 1 21 LYS HG3 4.980 . 4.980 3.825 2.042 4.412 . 0 0 "[ . 1 . 2]" 1 1231 1 19 ASP HB3 1 21 LYS HG2 5.590 . 5.590 4.493 2.844 5.170 . 0 0 "[ . 1 . 2]" 1 1232 1 19 ASP HB2 1 21 LYS HG2 4.400 . 4.400 4.142 3.340 4.547 0.147 5 0 "[ . 1 . 2]" 1 1233 1 123 ASP HA 1 126 LEU HB2 4.810 . 4.810 2.700 2.381 2.994 . 0 0 "[ . 1 . 2]" 1 1234 1 125 PRO HG2 1 126 LEU HB2 5.000 . 5.000 4.567 4.067 4.789 . 0 0 "[ . 1 . 2]" 1 1235 1 127 LEU HB3 1 130 PHE H 5.740 . 5.740 5.102 5.011 5.192 . 0 0 "[ . 1 . 2]" 1 1236 1 124 ILE HA 1 127 LEU HB2 5.080 . 5.080 3.888 3.556 4.118 . 0 0 "[ . 1 . 2]" 1 1237 1 64 ILE HB 1 94 PHE HB2 4.530 . 4.530 2.312 1.882 2.549 . 0 0 "[ . 1 . 2]" 1 1238 1 119 LEU MD1 1 127 LEU HB3 5.100 . 5.100 3.285 2.978 3.714 . 0 0 "[ . 1 . 2]" 1 1239 1 119 LEU MD1 1 127 LEU HB2 5.020 . 5.020 2.976 2.693 3.186 . 0 0 "[ . 1 . 2]" 1 1240 1 119 LEU MD2 1 127 LEU HB2 5.750 . 5.750 4.839 4.482 5.165 . 0 0 "[ . 1 . 2]" 1 1241 1 93 ASP H 1 94 PHE HB3 5.210 . 5.210 4.719 4.479 5.106 . 0 0 "[ . 1 . 2]" 1 1242 1 59 ARG HA 1 64 ILE HB 5.750 . 5.750 5.439 5.277 5.640 . 0 0 "[ . 1 . 2]" 1 1243 1 114 ALA MB 1 127 LEU HB3 5.130 . 5.130 4.459 4.208 4.676 . 0 0 "[ . 1 . 2]" 1 1244 1 64 ILE HG13 1 94 PHE HB3 5.750 . 5.750 4.368 4.080 4.666 . 0 0 "[ . 1 . 2]" 1 1245 1 16 ILE MD 1 94 PHE HB2 5.490 . 5.490 4.519 4.169 5.234 . 0 0 "[ . 1 . 2]" 1 1246 1 64 ILE HG12 1 94 PHE HB2 5.750 . 5.750 4.509 4.223 4.856 . 0 0 "[ . 1 . 2]" 1 1247 1 64 ILE HB 1 94 PHE HB3 5.150 . 5.150 3.930 3.526 4.173 . 0 0 "[ . 1 . 2]" 1 1248 1 64 ILE HG13 1 94 PHE HB2 4.880 . 4.880 3.518 3.342 4.021 . 0 0 "[ . 1 . 2]" 1 1249 1 17 GLU HA 1 22 ILE HB 5.400 . 5.400 5.171 5.017 5.387 . 0 0 "[ . 1 . 2]" 1 1250 1 15 ILE MG 1 22 ILE HB 4.460 . 4.460 4.043 3.975 4.087 . 0 0 "[ . 1 . 2]" 1 1251 1 51 ARG HA 1 54 LEU HB3 4.670 . 4.670 4.507 4.342 4.698 0.028 17 0 "[ . 1 . 2]" 1 1252 1 12 VAL HB 1 54 LEU HB3 5.750 . 5.750 4.681 4.473 4.892 . 0 0 "[ . 1 . 2]" 1 1253 1 36 LEU HB3 1 118 PRO HB2 5.750 . 5.750 3.315 2.777 3.697 . 0 0 "[ . 1 . 2]" 1 1254 1 54 LEU HB3 1 55 VAL HB 5.750 . 5.750 5.562 5.459 5.641 . 0 0 "[ . 1 . 2]" 1 1255 1 54 LEU HB3 1 58 LEU HB2 5.750 . 5.750 5.140 4.713 5.344 . 0 0 "[ . 1 . 2]" 1 1256 1 54 LEU HB3 1 58 LEU HG 5.750 . 5.750 3.548 3.185 5.779 0.029 19 0 "[ . 1 . 2]" 1 1257 1 21 LYS HD3 1 21 LYS HE2 3.030 . 3.030 2.398 2.319 2.489 . 0 0 "[ . 1 . 2]" 1 1258 1 21 LYS HE2 1 109 CYS HA 4.820 . 4.820 3.863 2.766 4.564 . 0 0 "[ . 1 . 2]" 1 1259 1 21 LYS HE3 1 110 SER HA 4.580 . 4.580 4.426 2.464 4.722 0.142 12 0 "[ . 1 . 2]" 1 1260 1 112 GLU HA 1 115 LEU HB2 4.690 . 4.690 3.570 3.186 3.875 . 0 0 "[ . 1 . 2]" 1 1261 1 115 LEU HB2 1 127 LEU HB3 5.450 . 5.450 4.279 3.912 5.162 . 0 0 "[ . 1 . 2]" 1 1262 1 36 LEU HB2 1 118 PRO HB2 4.580 . 4.580 4.394 4.064 4.653 0.073 9 0 "[ . 1 . 2]" 1 1263 1 28 PRO HB2 1 36 LEU HB2 5.580 . 5.580 4.652 3.559 5.712 0.132 4 0 "[ . 1 . 2]" 1 1264 1 28 PRO HG3 1 36 LEU HB2 4.920 . 4.920 3.806 2.543 4.977 0.057 1 0 "[ . 1 . 2]" 1 1265 1 114 ALA MB 1 115 LEU HB2 4.490 . 4.490 3.867 3.703 4.431 . 0 0 "[ . 1 . 2]" 1 1266 1 21 LYS HE3 1 21 LYS HG2 3.870 . 3.870 2.419 2.235 2.780 . 0 0 "[ . 1 . 2]" 1 1267 1 131 MET HA 1 134 ARG HD3 4.790 . 4.790 3.248 2.820 3.622 . 0 0 "[ . 1 . 2]" 1 1268 1 111 PRO HB3 1 134 ARG HD2 5.420 . 5.420 4.659 3.324 5.380 . 0 0 "[ . 1 . 2]" 1 1269 1 111 PRO HB3 1 134 ARG HD3 5.420 . 5.420 3.571 2.907 4.227 . 0 0 "[ . 1 . 2]" 1 1270 1 111 PRO HG3 1 134 ARG HD2 5.120 . 5.120 3.703 2.635 4.935 . 0 0 "[ . 1 . 2]" 1 1271 1 111 PRO HG3 1 134 ARG HD3 5.120 . 5.120 2.614 1.844 3.625 . 0 0 "[ . 1 . 2]" 1 1272 1 64 ILE MG 1 98 LEU HB3 4.290 . 4.290 2.612 2.115 4.028 . 0 0 "[ . 1 . 2]" 1 1273 1 64 ILE MG 1 98 LEU HB2 4.570 . 4.570 3.808 3.408 4.618 0.048 11 0 "[ . 1 . 2]" 1 1274 1 18 ARG HD3 1 93 ASP HA 5.750 . 5.750 4.823 3.571 5.800 0.050 10 0 "[ . 1 . 2]" 1 1275 1 18 ARG HD2 1 93 ASP HA 5.750 . 5.750 5.287 4.243 5.889 0.139 19 0 "[ . 1 . 2]" 1 1276 1 18 ARG HA 1 18 ARG HD3 4.270 . 4.270 3.269 2.676 3.725 . 0 0 "[ . 1 . 2]" 1 1277 1 18 ARG HA 1 18 ARG HD2 4.270 . 4.270 2.245 1.782 3.556 0.018 15 0 "[ . 1 . 2]" 1 1278 1 18 ARG HB2 1 18 ARG HD3 3.910 . 3.910 2.732 2.344 3.677 . 0 0 "[ . 1 . 2]" 1 1279 1 18 ARG HB2 1 18 ARG HD2 3.910 . 3.910 2.848 2.426 3.307 . 0 0 "[ . 1 . 2]" 1 1280 1 51 ARG H 1 51 ARG HD2 5.750 . 5.750 4.280 4.054 4.877 . 0 0 "[ . 1 . 2]" 1 1281 1 51 ARG H 1 51 ARG HD3 5.750 . 5.750 4.787 4.598 4.880 . 0 0 "[ . 1 . 2]" 1 1282 1 59 ARG HA 1 59 ARG HD2 4.720 . 4.720 4.264 4.091 4.456 . 0 0 "[ . 1 . 2]" 1 1283 1 59 ARG HB3 1 59 ARG HD3 3.590 . 3.590 2.612 2.406 3.171 . 0 0 "[ . 1 . 2]" 1 1284 1 59 ARG HB2 1 59 ARG HD2 3.470 . 3.470 2.459 2.207 3.057 . 0 0 "[ . 1 . 2]" 1 1285 1 51 ARG HD2 1 68 VAL HB 5.190 . 5.190 3.656 1.919 4.160 . 0 0 "[ . 1 . 2]" 1 1286 1 51 ARG HD3 1 68 VAL HB 5.190 . 5.190 2.701 2.158 3.762 . 0 0 "[ . 1 . 2]" 1 1287 1 59 ARG HD2 1 59 ARG HG3 3.050 . 3.050 2.473 2.218 2.868 . 0 0 "[ . 1 . 2]" 1 1288 1 82 ARG HA 1 82 ARG HD2 5.020 . 5.020 4.644 4.211 4.718 . 0 0 "[ . 1 . 2]" 1 1289 1 59 ARG HD2 1 65 GLU HA 4.500 . 4.500 4.273 3.807 4.661 0.161 17 0 "[ . 1 . 2]" 1 1290 1 77 ARG HD3 1 122 ALA HA 4.440 . 4.440 3.801 3.264 4.496 0.056 14 0 "[ . 1 . 2]" 1 1291 1 82 ARG HB3 1 82 ARG HD2 3.360 . 3.360 2.916 2.289 3.123 . 0 0 "[ . 1 . 2]" 1 1292 1 82 ARG HB2 1 82 ARG HD2 3.380 . 3.380 2.498 2.333 2.947 . 0 0 "[ . 1 . 2]" 1 1293 1 9 ILE HG13 1 82 ARG HD2 4.380 . 4.380 3.963 2.939 4.391 0.011 7 0 "[ . 1 . 2]" 1 1294 1 77 ARG HD3 1 84 ILE HG13 4.880 . 4.880 4.459 3.582 4.879 . 0 0 "[ . 1 . 2]" 1 1295 1 9 ILE HG13 1 82 ARG HD3 4.640 . 4.640 3.510 2.927 4.664 0.024 6 0 "[ . 1 . 2]" 1 1296 1 9 ILE MD 1 82 ARG HD2 3.510 . 3.510 2.298 1.795 2.628 0.005 5 0 "[ . 1 . 2]" 1 1297 1 9 ILE MD 1 82 ARG HD3 3.720 . 3.720 2.606 2.056 3.732 0.012 6 0 "[ . 1 . 2]" 1 1298 1 75 HIS HB2 1 86 LEU HB2 5.750 . 5.750 4.461 4.281 4.662 . 0 0 "[ . 1 . 2]" 1 1299 1 75 HIS HB3 1 86 LEU HB3 4.690 . 4.690 4.126 3.841 4.467 . 0 0 "[ . 1 . 2]" 1 1300 1 63 GLY HA2 1 99 GLN HG2 5.250 . 5.250 4.060 3.590 4.392 . 0 0 "[ . 1 . 2]" 1 1301 1 63 GLY HA3 1 99 GLN HB3 5.340 . 5.340 4.535 4.211 5.030 . 0 0 "[ . 1 . 2]" 1 1302 1 63 GLY HA2 1 64 ILE MG 5.280 . 5.280 4.504 4.440 4.574 . 0 0 "[ . 1 . 2]" 1 1303 1 77 ARG HA 1 77 ARG HD2 4.840 . 4.840 4.743 4.626 4.880 0.040 11 0 "[ . 1 . 2]" 1 1304 1 133 LEU HB3 1 134 ARG HA 4.460 . 4.460 3.938 3.854 4.118 . 0 0 "[ . 1 . 2]" 1 1305 1 56 ARG HA 1 59 ARG HD3 4.120 . 4.120 3.482 2.778 4.089 . 0 0 "[ . 1 . 2]" 1 1306 1 75 HIS HB2 1 86 LEU HB3 5.360 . 5.360 5.381 5.247 5.430 0.070 16 0 "[ . 1 . 2]" 1 1307 1 28 PRO HD3 1 34 ALA HA 4.710 . 4.710 3.228 1.892 4.219 . 0 0 "[ . 1 . 2]" 1 1308 1 38 GLU HA 1 119 LEU MD1 5.270 . 5.270 4.659 4.329 4.968 . 0 0 "[ . 1 . 2]" 1 1309 1 76 GLN HA 1 76 GLN HG2 3.990 . 3.990 2.436 2.318 2.809 . 0 0 "[ . 1 . 2]" 1 1310 1 21 LYS HB3 1 108 TRP HA 4.670 . 4.670 3.621 3.224 3.889 . 0 0 "[ . 1 . 2]" 1 1311 1 8 MET HA 1 84 ILE MG 5.750 . 5.750 5.360 5.239 5.515 . 0 0 "[ . 1 . 2]" 1 1312 1 76 GLN HG3 1 85 HIS HA 3.990 . 3.990 3.329 2.623 3.786 . 0 0 "[ . 1 . 2]" 1 1313 1 14 ALA HA 1 15 ILE HG13 4.560 . 4.560 4.212 4.111 4.333 . 0 0 "[ . 1 . 2]" 1 1314 1 72 VAL HB 1 88 ALA HA 5.340 . 5.340 4.659 4.392 4.805 . 0 0 "[ . 1 . 2]" 1 1315 1 77 ARG HD3 1 122 ALA MB 3.720 . 3.720 2.091 1.675 2.960 0.125 18 0 "[ . 1 . 2]" 1 1316 1 19 ASP HB2 1 21 LYS HG3 4.760 . 4.760 3.205 2.806 3.438 . 0 0 "[ . 1 . 2]" 1 1317 1 120 ALA MB 1 123 ASP HB3 4.650 . 4.650 4.129 2.889 4.516 . 0 0 "[ . 1 . 2]" 1 1318 1 18 ARG HG3 1 19 ASP HB3 5.750 . 5.750 5.127 4.496 5.698 . 0 0 "[ . 1 . 2]" 1 1319 1 45 GLU H 1 47 ASP H 5.270 . 5.270 4.658 4.081 5.309 0.039 6 0 "[ . 1 . 2]" 1 1320 1 45 GLU H 1 53 ALA HA 5.750 . 5.750 5.284 4.654 5.705 . 0 0 "[ . 1 . 2]" 1 1321 1 45 GLU H 1 46 PRO HD2 5.750 . 5.750 4.843 4.736 5.290 . 0 0 "[ . 1 . 2]" 1 1322 1 45 GLU H 1 46 PRO HD3 5.750 . 5.750 5.082 4.718 5.204 . 0 0 "[ . 1 . 2]" 1 1323 1 45 GLU H 1 48 GLU HG3 3.680 . 3.680 3.075 2.608 3.401 . 0 0 "[ . 1 . 2]" 1 1324 1 45 GLU H 1 48 GLU HG2 3.680 . 3.680 2.444 2.235 2.626 . 0 0 "[ . 1 . 2]" 1 1325 1 45 GLU H 1 48 GLU HB3 4.700 . 4.700 4.667 4.482 4.840 0.140 14 0 "[ . 1 . 2]" 1 1326 1 45 GLU H 1 53 ALA MB 3.950 . 3.950 3.540 3.074 3.957 0.007 17 0 "[ . 1 . 2]" 1 1327 1 44 VAL HB 1 45 GLU H 4.890 . 4.890 4.236 3.990 4.355 . 0 0 "[ . 1 . 2]" 1 1328 1 27 ARG H 1 35 GLY H 5.750 . 5.750 5.083 3.490 5.671 . 0 0 "[ . 1 . 2]" 1 1329 1 27 ARG H 1 28 PRO HD3 4.970 . 4.970 3.582 2.895 4.337 . 0 0 "[ . 1 . 2]" 1 1330 1 26 GLN HB3 1 27 ARG H 5.220 . 5.220 4.309 3.849 4.474 . 0 0 "[ . 1 . 2]" 1 1331 1 25 ALA MB 1 27 ARG H 4.880 . 4.880 4.664 4.215 5.150 0.270 19 0 "[ . 1 . 2]" 1 1332 1 26 GLN HB2 1 27 ARG H 5.220 . 5.220 4.365 4.020 4.568 . 0 0 "[ . 1 . 2]" 1 1333 1 26 GLN H 1 27 ARG H 5.120 . 5.120 4.344 4.187 4.546 . 0 0 "[ . 1 . 2]" 1 1334 1 84 ILE HB 1 85 HIS H 3.700 . 3.700 3.458 3.314 3.671 . 0 0 "[ . 1 . 2]" 1 1335 1 19 ASP H 1 20 GLY H 4.010 . 4.010 2.659 2.541 2.763 . 0 0 "[ . 1 . 2]" 1 1336 1 18 ARG H 1 20 GLY H 4.620 . 4.620 3.664 3.318 3.894 . 0 0 "[ . 1 . 2]" 1 1337 1 17 GLU HA 1 20 GLY H 5.570 . 5.570 4.831 4.570 5.117 . 0 0 "[ . 1 . 2]" 1 1338 1 20 GLY H 1 21 LYS HA 5.310 . 5.310 4.899 4.660 5.043 . 0 0 "[ . 1 . 2]" 1 1339 1 18 ARG HA 1 20 GLY H 4.130 . 4.130 3.398 3.007 3.743 . 0 0 "[ . 1 . 2]" 1 1340 1 20 GLY H 1 20 GLY HA2 3.080 . 3.080 2.363 2.321 2.421 . 0 0 "[ . 1 . 2]" 1 1341 1 19 ASP HB3 1 20 GLY H 4.800 . 4.800 4.277 3.194 4.485 . 0 0 "[ . 1 . 2]" 1 1342 1 19 ASP HB2 1 20 GLY H 4.360 . 4.360 3.912 3.631 4.241 . 0 0 "[ . 1 . 2]" 1 1343 1 18 ARG HB3 1 20 GLY H 5.550 . 5.550 4.996 4.655 5.326 . 0 0 "[ . 1 . 2]" 1 1344 1 20 GLY H 1 21 LYS HG3 5.750 . 5.750 5.017 4.275 5.516 . 0 0 "[ . 1 . 2]" 1 1345 1 20 GLY H 1 21 LYS HG2 4.960 . 4.960 4.627 4.086 5.073 0.113 12 0 "[ . 1 . 2]" 1 1346 1 85 HIS H 1 86 LEU HA 5.340 . 5.340 4.629 4.546 4.816 . 0 0 "[ . 1 . 2]" 1 1347 1 85 HIS H 1 85 HIS HB2 3.700 . 3.700 2.843 2.464 3.128 . 0 0 "[ . 1 . 2]" 1 1348 1 85 HIS H 1 85 HIS HB3 3.650 . 3.650 2.703 2.408 3.050 . 0 0 "[ . 1 . 2]" 1 1349 1 9 ILE HB 1 85 HIS H 4.660 . 4.660 3.755 3.663 3.837 . 0 0 "[ . 1 . 2]" 1 1350 1 65 GLU HB3 1 66 ALA H 5.040 . 5.040 3.872 3.741 3.955 . 0 0 "[ . 1 . 2]" 1 1351 1 84 ILE HG12 1 85 HIS H 5.550 . 5.550 4.966 4.918 5.003 . 0 0 "[ . 1 . 2]" 1 1352 1 84 ILE MG 1 85 HIS H 3.570 . 3.570 2.612 2.458 2.747 . 0 0 "[ . 1 . 2]" 1 1353 1 66 ALA H 1 67 THR H 5.010 . 5.010 4.576 4.547 4.598 . 0 0 "[ . 1 . 2]" 1 1354 1 65 GLU HB2 1 66 ALA H 5.040 . 5.040 4.410 4.344 4.495 . 0 0 "[ . 1 . 2]" 1 1355 1 66 ALA H 1 66 ALA MB 3.330 . 3.330 2.280 2.253 2.325 . 0 0 "[ . 1 . 2]" 1 1356 1 64 ILE MD 1 66 ALA H 5.340 . 5.340 4.583 4.285 4.802 . 0 0 "[ . 1 . 2]" 1 1357 1 15 ILE H 1 16 ILE H 4.940 . 4.940 4.167 4.093 4.239 . 0 0 "[ . 1 . 2]" 1 1358 1 16 ILE H 1 23 LEU H 4.930 . 4.930 3.142 2.908 3.346 . 0 0 "[ . 1 . 2]" 1 1359 1 16 ILE H 1 16 ILE HB 3.790 . 3.790 2.668 2.541 2.847 . 0 0 "[ . 1 . 2]" 1 1360 1 16 ILE H 1 16 ILE HG12 4.760 . 4.760 2.554 1.779 3.498 0.021 20 0 "[ . 1 . 2]" 1 1361 1 16 ILE H 1 16 ILE HG13 4.760 . 4.760 2.830 2.130 3.349 . 0 0 "[ . 1 . 2]" 1 1362 1 14 ALA MB 1 16 ILE H 4.700 . 4.700 4.171 4.042 4.347 . 0 0 "[ . 1 . 2]" 1 1363 1 15 ILE HB 1 16 ILE H 4.980 . 4.980 4.471 4.426 4.514 . 0 0 "[ . 1 . 2]" 1 1364 1 16 ILE H 1 16 ILE MG 4.400 . 4.400 3.780 3.749 3.807 . 0 0 "[ . 1 . 2]" 1 1365 1 16 ILE H 1 22 ILE MD 5.750 . 5.750 5.519 5.257 5.776 0.026 19 0 "[ . 1 . 2]" 1 1366 1 16 ILE H 1 16 ILE MD 4.370 . 4.370 3.454 3.082 3.770 . 0 0 "[ . 1 . 2]" 1 1367 1 15 ILE MG 1 16 ILE H 4.200 . 4.200 3.278 3.203 3.350 . 0 0 "[ . 1 . 2]" 1 1368 1 15 ILE HG12 1 16 ILE H 5.120 . 5.120 4.456 4.399 4.523 . 0 0 "[ . 1 . 2]" 1 1369 1 19 ASP H 1 19 ASP HB3 4.310 . 4.310 4.075 3.727 4.145 . 0 0 "[ . 1 . 2]" 1 1370 1 19 ASP H 1 21 LYS H 5.290 . 5.290 4.133 4.050 4.286 . 0 0 "[ . 1 . 2]" 1 1371 1 19 ASP H 1 20 GLY HA2 5.360 . 5.360 4.907 4.778 5.038 . 0 0 "[ . 1 . 2]" 1 1372 1 19 ASP H 1 19 ASP HB2 4.380 . 4.380 3.590 3.368 3.688 . 0 0 "[ . 1 . 2]" 1 1373 1 18 ARG HB3 1 19 ASP H 4.570 . 4.570 3.922 3.487 4.284 . 0 0 "[ . 1 . 2]" 1 1374 1 18 ARG HG3 1 19 ASP H 4.450 . 4.450 2.882 2.210 3.557 . 0 0 "[ . 1 . 2]" 1 1375 1 18 ARG HG2 1 19 ASP H 4.670 . 4.670 4.458 3.916 4.802 0.132 11 0 "[ . 1 . 2]" 1 1376 1 18 ARG HB2 1 19 ASP H 4.910 . 4.910 4.334 4.166 4.448 . 0 0 "[ . 1 . 2]" 1 1377 1 118 PRO HD2 1 119 LEU H 5.240 . 5.240 4.796 4.639 5.045 . 0 0 "[ . 1 . 2]" 1 1378 1 119 LEU H 1 120 ALA H 4.970 . 4.970 4.592 4.549 4.618 . 0 0 "[ . 1 . 2]" 1 1379 1 119 LEU H 1 119 LEU HG 3.490 . 3.490 2.709 2.610 2.875 . 0 0 "[ . 1 . 2]" 1 1380 1 119 LEU H 1 119 LEU HB2 3.230 . 3.230 2.367 2.239 2.445 . 0 0 "[ . 1 . 2]" 1 1381 1 119 LEU H 1 119 LEU HB3 3.770 . 3.770 3.591 3.527 3.627 . 0 0 "[ . 1 . 2]" 1 1382 1 119 LEU H 1 119 LEU MD1 4.430 . 4.430 3.817 3.752 3.896 . 0 0 "[ . 1 . 2]" 1 1383 1 119 LEU H 1 119 LEU MD2 4.300 . 4.300 3.589 3.433 3.777 . 0 0 "[ . 1 . 2]" 1 1384 1 17 GLU H 1 18 ARG H 5.010 . 5.010 4.239 4.109 4.414 . 0 0 "[ . 1 . 2]" 1 1385 1 17 GLU H 1 17 GLU HB3 3.950 . 3.950 2.612 2.490 2.693 . 0 0 "[ . 1 . 2]" 1 1386 1 17 GLU H 1 17 GLU HB2 3.950 . 3.950 2.996 2.815 3.178 . 0 0 "[ . 1 . 2]" 1 1387 1 17 GLU H 1 18 ARG HB2 4.940 . 4.940 4.765 4.476 4.996 0.056 11 0 "[ . 1 . 2]" 1 1388 1 16 ILE MG 1 17 GLU H 3.790 . 3.790 3.222 3.058 3.329 . 0 0 "[ . 1 . 2]" 1 1389 1 17 GLU H 1 22 ILE MG 4.910 . 4.910 4.473 4.302 4.642 . 0 0 "[ . 1 . 2]" 1 1390 1 17 GLU H 1 23 LEU H 5.310 . 5.310 4.945 4.781 5.119 . 0 0 "[ . 1 . 2]" 1 1391 1 91 VAL H 1 92 PRO HD2 5.730 . 5.730 4.805 4.509 5.043 . 0 0 "[ . 1 . 2]" 1 1392 1 91 VAL H 1 92 PRO HD3 5.750 . 5.750 4.306 4.102 4.432 . 0 0 "[ . 1 . 2]" 1 1393 1 90 HIS HB2 1 91 VAL H 4.740 . 4.740 4.255 4.131 4.417 . 0 0 "[ . 1 . 2]" 1 1394 1 14 ALA MB 1 91 VAL H 5.560 . 5.560 4.555 4.086 5.133 . 0 0 "[ . 1 . 2]" 1 1395 1 15 ILE HB 1 91 VAL H 4.550 . 4.550 3.691 3.096 4.280 . 0 0 "[ . 1 . 2]" 1 1396 1 16 ILE MD 1 91 VAL H 5.680 . 5.680 4.902 4.009 5.737 0.057 8 0 "[ . 1 . 2]" 1 1397 1 15 ILE MG 1 91 VAL H 4.850 . 4.850 3.953 3.580 4.557 . 0 0 "[ . 1 . 2]" 1 1398 1 40 ALA H 1 41 GLY H 4.910 . 4.910 4.619 4.535 4.648 . 0 0 "[ . 1 . 2]" 1 1399 1 39 PHE H 1 40 ALA H 4.930 . 4.930 4.541 4.397 4.628 . 0 0 "[ . 1 . 2]" 1 1400 1 39 PHE HB3 1 40 ALA H 4.540 . 4.540 3.039 2.523 3.508 . 0 0 "[ . 1 . 2]" 1 1401 1 39 PHE HB2 1 40 ALA H 4.540 . 4.540 4.074 3.689 4.388 . 0 0 "[ . 1 . 2]" 1 1402 1 40 ALA H 1 40 ALA MB 3.160 . 3.160 2.249 2.220 2.307 . 0 0 "[ . 1 . 2]" 1 1403 1 40 ALA H 1 62 LEU MD2 5.680 . 5.680 4.850 4.401 5.229 . 0 0 "[ . 1 . 2]" 1 1404 1 16 ILE MD 1 40 ALA H 5.440 . 5.440 4.780 4.235 5.302 . 0 0 "[ . 1 . 2]" 1 1405 1 40 ALA H 1 62 LEU MD1 5.680 . 5.680 4.141 3.640 4.449 . 0 0 "[ . 1 . 2]" 1 1406 1 25 ALA MB 1 40 ALA H 5.750 . 5.750 4.055 3.583 4.706 . 0 0 "[ . 1 . 2]" 1 1407 1 14 ALA MB 1 40 ALA H 4.630 . 4.630 4.197 3.735 4.633 0.003 10 0 "[ . 1 . 2]" 1 1408 1 22 ILE HB 1 24 LEU H 5.750 . 5.750 5.275 5.071 5.450 . 0 0 "[ . 1 . 2]" 1 1409 1 24 LEU H 1 107 VAL HB 5.750 . 5.750 5.197 4.899 5.406 . 0 0 "[ . 1 . 2]" 1 1410 1 24 LEU H 1 107 VAL HA 5.340 . 5.340 4.729 4.655 4.856 . 0 0 "[ . 1 . 2]" 1 1411 1 24 LEU H 1 37 TRP HB3 5.750 . 5.750 5.544 5.247 5.760 0.010 17 0 "[ . 1 . 2]" 1 1412 1 24 LEU H 1 24 LEU HB3 4.080 . 4.080 3.718 3.666 3.785 . 0 0 "[ . 1 . 2]" 1 1413 1 24 LEU H 1 24 LEU HB2 4.150 . 4.150 2.543 2.451 2.676 . 0 0 "[ . 1 . 2]" 1 1414 1 23 LEU HG 1 24 LEU H 3.920 . 3.920 3.377 3.173 3.969 0.049 19 0 "[ . 1 . 2]" 1 1415 1 24 LEU H 1 107 VAL MG1 5.420 . 5.420 3.103 2.682 5.015 . 0 0 "[ . 1 . 2]" 1 1416 1 24 LEU H 1 24 LEU MD2 4.720 . 4.720 4.164 3.630 4.366 . 0 0 "[ . 1 . 2]" 1 1417 1 24 LEU H 1 107 VAL MG2 5.420 . 5.420 4.637 2.905 4.891 . 0 0 "[ . 1 . 2]" 1 1418 1 24 LEU H 1 24 LEU MD1 4.720 . 4.720 2.895 2.185 4.250 . 0 0 "[ . 1 . 2]" 1 1419 1 23 LEU HB3 1 24 LEU H 4.630 . 4.630 4.246 4.091 4.343 . 0 0 "[ . 1 . 2]" 1 1420 1 84 ILE H 1 85 HIS H 4.910 . 4.910 4.495 4.462 4.525 . 0 0 "[ . 1 . 2]" 1 1421 1 76 GLN HA 1 84 ILE H 5.600 . 5.600 4.868 4.594 4.950 . 0 0 "[ . 1 . 2]" 1 1422 1 8 MET HA 1 84 ILE H 5.750 . 5.750 5.164 5.033 5.365 . 0 0 "[ . 1 . 2]" 1 1423 1 84 ILE H 1 84 ILE HB 3.950 . 3.950 3.183 3.074 3.251 . 0 0 "[ . 1 . 2]" 1 1424 1 83 ILE HB 1 84 ILE H 4.930 . 4.930 4.430 4.398 4.482 . 0 0 "[ . 1 . 2]" 1 1425 1 77 ARG HG2 1 84 ILE H 4.470 . 4.470 4.144 3.886 4.500 0.030 14 0 "[ . 1 . 2]" 1 1426 1 84 ILE H 1 84 ILE HG12 3.710 . 3.710 2.101 1.952 2.248 . 0 0 "[ . 1 . 2]" 1 1427 1 84 ILE H 1 84 ILE HG13 3.920 . 3.920 2.229 2.151 2.297 . 0 0 "[ . 1 . 2]" 1 1428 1 83 ILE HG13 1 84 ILE H 4.800 . 4.800 4.200 4.053 4.375 . 0 0 "[ . 1 . 2]" 1 1429 1 84 ILE H 1 84 ILE MG 3.940 . 3.940 3.631 3.583 3.687 . 0 0 "[ . 1 . 2]" 1 1430 1 84 ILE H 1 84 ILE MD 4.300 . 4.300 3.609 3.553 3.661 . 0 0 "[ . 1 . 2]" 1 1431 1 83 ILE MG 1 84 ILE H 3.480 . 3.480 3.001 2.927 3.086 . 0 0 "[ . 1 . 2]" 1 1432 1 98 LEU H 1 99 GLN H 4.900 . 4.900 4.460 4.405 4.504 . 0 0 "[ . 1 . 2]" 1 1433 1 97 THR HB 1 98 LEU H 4.470 . 4.470 4.076 3.771 4.261 . 0 0 "[ . 1 . 2]" 1 1434 1 98 LEU H 1 98 LEU HB3 3.270 . 3.270 3.099 2.770 3.480 0.210 13 0 "[ . 1 . 2]" 1 1435 1 98 LEU H 1 98 LEU HB2 3.920 . 3.920 3.491 2.607 3.634 . 0 0 "[ . 1 . 2]" 1 1436 1 97 THR MG 1 98 LEU H 3.560 . 3.560 2.598 2.250 2.976 . 0 0 "[ . 1 . 2]" 1 1437 1 98 LEU H 1 98 LEU MD1 4.090 . 4.090 2.990 1.673 3.839 0.127 1 0 "[ . 1 . 2]" 1 1438 1 98 LEU H 1 98 LEU MD2 4.090 . 4.090 2.483 1.671 3.283 0.129 2 0 "[ . 1 . 2]" 1 1439 1 64 ILE MG 1 98 LEU H 4.100 . 4.100 3.075 2.860 3.367 . 0 0 "[ . 1 . 2]" 1 1440 1 79 VAL H 1 80 SER H 4.780 . 4.780 3.845 3.792 3.909 . 0 0 "[ . 1 . 2]" 1 1441 1 79 VAL H 1 84 ILE H 4.010 . 4.010 3.720 3.504 3.835 . 0 0 "[ . 1 . 2]" 1 1442 1 79 VAL H 1 82 ARG HA 4.880 . 4.880 4.507 4.431 4.578 . 0 0 "[ . 1 . 2]" 1 1443 1 78 GLU HG2 1 79 VAL H 4.680 . 4.680 4.680 4.534 4.730 0.050 4 0 "[ . 1 . 2]" 1 1444 1 79 VAL H 1 79 VAL HB 3.750 . 3.750 3.291 3.217 3.346 . 0 0 "[ . 1 . 2]" 1 1445 1 78 GLU HB2 1 79 VAL H 3.830 . 3.830 2.803 2.698 3.084 . 0 0 "[ . 1 . 2]" 1 1446 1 79 VAL H 1 82 ARG HG2 5.750 . 5.750 5.763 5.563 5.864 0.114 17 0 "[ . 1 . 2]" 1 1447 1 79 VAL H 1 82 ARG HG3 5.750 . 5.750 4.919 4.538 5.252 . 0 0 "[ . 1 . 2]" 1 1448 1 79 VAL H 1 84 ILE HG12 4.450 . 4.450 2.993 2.864 3.140 . 0 0 "[ . 1 . 2]" 1 1449 1 79 VAL H 1 84 ILE HG13 4.900 . 4.900 3.734 3.416 4.003 . 0 0 "[ . 1 . 2]" 1 1450 1 79 VAL H 1 83 ILE HG13 5.410 . 5.410 5.363 5.144 5.447 0.037 3 0 "[ . 1 . 2]" 1 1451 1 79 VAL H 1 84 ILE MD 4.420 . 4.420 3.379 3.205 3.639 . 0 0 "[ . 1 . 2]" 1 1452 1 79 VAL H 1 83 ILE MG 5.700 . 5.700 5.511 5.313 5.625 . 0 0 "[ . 1 . 2]" 1 1453 1 72 VAL H 1 89 TRP HA 3.790 . 3.790 2.535 1.897 2.960 . 0 0 "[ . 1 . 2]" 1 1454 1 72 VAL H 1 73 ALA HA 5.270 . 5.270 4.787 4.723 4.957 . 0 0 "[ . 1 . 2]" 1 1455 1 72 VAL H 1 72 VAL HB 3.420 . 3.420 2.510 2.460 2.553 . 0 0 "[ . 1 . 2]" 1 1456 1 72 VAL H 1 88 ALA MB 4.760 . 4.760 3.868 3.383 4.329 . 0 0 "[ . 1 . 2]" 1 1457 1 79 VAL H 1 83 ILE HA 3.720 . 3.720 3.580 3.416 3.699 . 0 0 "[ . 1 . 2]" 1 1458 1 75 HIS H 1 86 LEU H 3.980 . 3.980 3.157 2.969 3.387 . 0 0 "[ . 1 . 2]" 1 1459 1 74 SER HA 1 86 LEU H 5.750 . 5.750 4.976 4.683 5.235 . 0 0 "[ . 1 . 2]" 1 1460 1 76 GLN HA 1 86 LEU H 3.870 . 3.870 3.227 2.943 3.511 . 0 0 "[ . 1 . 2]" 1 1461 1 85 HIS HB2 1 86 LEU H 5.110 . 5.110 4.569 4.377 4.686 . 0 0 "[ . 1 . 2]" 1 1462 1 86 LEU H 1 86 LEU HB3 3.810 . 3.810 3.578 3.542 3.604 . 0 0 "[ . 1 . 2]" 1 1463 1 77 ARG HG2 1 86 LEU H 5.490 . 5.490 4.908 4.652 5.187 . 0 0 "[ . 1 . 2]" 1 1464 1 86 LEU H 1 86 LEU HB2 3.550 . 3.550 2.321 2.267 2.360 . 0 0 "[ . 1 . 2]" 1 1465 1 86 LEU H 1 126 LEU MD2 5.650 . 5.650 4.747 4.440 4.955 . 0 0 "[ . 1 . 2]" 1 1466 1 77 ARG H 1 86 LEU H 5.050 . 5.050 4.587 4.364 4.763 . 0 0 "[ . 1 . 2]" 1 1467 1 75 HIS HB3 1 86 LEU H 4.860 . 4.860 4.163 3.828 4.512 . 0 0 "[ . 1 . 2]" 1 1468 1 85 HIS HB3 1 86 LEU H 5.230 . 5.230 4.360 4.177 4.512 . 0 0 "[ . 1 . 2]" 1 1469 1 86 LEU H 1 126 LEU MD1 5.650 . 5.650 4.914 4.593 5.207 . 0 0 "[ . 1 . 2]" 1 1470 1 99 GLN H 1 100 ALA H 4.820 . 4.820 4.412 4.326 4.456 . 0 0 "[ . 1 . 2]" 1 1471 1 63 GLY H 1 99 GLN H 5.140 . 5.140 4.404 4.210 4.883 . 0 0 "[ . 1 . 2]" 1 1472 1 62 LEU HA 1 99 GLN H 3.960 . 3.960 2.506 2.104 3.058 . 0 0 "[ . 1 . 2]" 1 1473 1 99 GLN H 1 100 ALA HA 5.380 . 5.380 4.699 4.505 4.791 . 0 0 "[ . 1 . 2]" 1 1474 1 63 GLY HA3 1 99 GLN H 4.940 . 4.940 4.068 3.398 4.527 . 0 0 "[ . 1 . 2]" 1 1475 1 99 GLN H 1 99 GLN HG2 4.060 . 4.060 2.328 2.076 2.641 . 0 0 "[ . 1 . 2]" 1 1476 1 99 GLN H 1 99 GLN HB3 3.500 . 3.500 3.093 2.963 3.252 . 0 0 "[ . 1 . 2]" 1 1477 1 98 LEU HB3 1 99 GLN H 4.500 . 4.500 3.850 3.269 4.133 . 0 0 "[ . 1 . 2]" 1 1478 1 98 LEU HB2 1 99 GLN H 3.890 . 3.890 3.404 3.168 4.047 0.157 13 0 "[ . 1 . 2]" 1 1479 1 97 THR MG 1 99 GLN H 5.130 . 5.130 4.788 4.640 5.082 . 0 0 "[ . 1 . 2]" 1 1480 1 64 ILE MG 1 99 GLN H 3.760 . 3.760 3.511 3.167 3.705 . 0 0 "[ . 1 . 2]" 1 1481 1 10 GLU H 1 85 HIS H 5.700 . 5.700 4.564 4.414 4.663 . 0 0 "[ . 1 . 2]" 1 1482 1 9 ILE H 1 10 GLU H 4.780 . 4.780 4.273 4.167 4.365 . 0 0 "[ . 1 . 2]" 1 1483 1 10 GLU H 1 44 VAL H 5.140 . 5.140 3.939 3.779 4.222 . 0 0 "[ . 1 . 2]" 1 1484 1 10 GLU H 1 11 VAL HA 5.600 . 5.600 5.077 4.973 5.163 . 0 0 "[ . 1 . 2]" 1 1485 1 10 GLU H 1 43 LYS HA 5.750 . 5.750 5.155 4.799 5.594 . 0 0 "[ . 1 . 2]" 1 1486 1 10 GLU H 1 10 GLU HG3 4.450 . 4.450 3.459 2.458 4.176 . 0 0 "[ . 1 . 2]" 1 1487 1 10 GLU H 1 10 GLU HG2 4.450 . 4.450 3.220 2.680 4.156 . 0 0 "[ . 1 . 2]" 1 1488 1 10 GLU H 1 10 GLU HB2 3.260 . 3.260 2.473 2.267 2.979 . 0 0 "[ . 1 . 2]" 1 1489 1 9 ILE HB 1 10 GLU H 4.150 . 4.150 4.288 4.218 4.328 0.178 14 0 "[ . 1 . 2]" 1 1490 1 10 GLU H 1 43 LYS HB2 5.750 . 5.750 5.766 5.469 5.871 0.121 15 0 "[ . 1 . 2]" 1 1491 1 9 ILE HG13 1 10 GLU H 5.500 . 5.500 5.209 5.138 5.242 . 0 0 "[ . 1 . 2]" 1 1492 1 9 ILE MG 1 10 GLU H 3.380 . 3.380 2.934 2.707 3.146 . 0 0 "[ . 1 . 2]" 1 1493 1 18 ARG H 1 19 ASP H 5.150 . 5.150 4.221 4.077 4.319 . 0 0 "[ . 1 . 2]" 1 1494 1 18 ARG H 1 21 LYS HA 5.340 . 5.340 4.765 4.619 4.962 . 0 0 "[ . 1 . 2]" 1 1495 1 18 ARG H 1 21 LYS HB2 4.970 . 4.970 3.753 3.532 3.990 . 0 0 "[ . 1 . 2]" 1 1496 1 18 ARG H 1 21 LYS HB3 5.750 . 5.750 5.047 4.847 5.258 . 0 0 "[ . 1 . 2]" 1 1497 1 18 ARG H 1 18 ARG HB3 4.160 . 4.160 2.972 2.638 3.287 . 0 0 "[ . 1 . 2]" 1 1498 1 16 ILE MG 1 18 ARG H 4.970 . 4.970 4.381 3.974 4.741 . 0 0 "[ . 1 . 2]" 1 1499 1 18 ARG H 1 22 ILE H 5.510 . 5.510 4.959 4.871 5.126 . 0 0 "[ . 1 . 2]" 1 1500 1 18 ARG H 1 23 LEU H 5.590 . 5.590 4.914 4.528 5.164 . 0 0 "[ . 1 . 2]" 1 1501 1 18 ARG H 1 22 ILE HA 4.080 . 4.080 3.625 3.503 3.780 . 0 0 "[ . 1 . 2]" 1 1502 1 18 ARG H 1 18 ARG HG2 5.620 . 5.620 5.003 4.862 5.155 . 0 0 "[ . 1 . 2]" 1 1503 1 18 ARG H 1 18 ARG HB2 4.050 . 4.050 2.993 2.753 3.237 . 0 0 "[ . 1 . 2]" 1 1504 1 18 ARG H 1 22 ILE MG 5.190 . 5.190 5.197 5.042 5.288 0.098 18 0 "[ . 1 . 2]" 1 1505 1 26 GLN H 1 37 TRP HA 5.220 . 5.220 4.281 4.052 4.546 . 0 0 "[ . 1 . 2]" 1 1506 1 26 GLN H 1 103 HIS HB3 5.000 . 5.000 3.723 3.485 4.091 . 0 0 "[ . 1 . 2]" 1 1507 1 26 GLN H 1 103 HIS HB2 5.000 . 5.000 4.999 4.721 5.091 0.091 8 0 "[ . 1 . 2]" 1 1508 1 26 GLN H 1 105 ALA MB 4.290 . 4.290 3.417 2.710 3.864 . 0 0 "[ . 1 . 2]" 1 1509 1 25 ALA MB 1 26 GLN H 3.670 . 3.670 3.197 3.111 3.301 . 0 0 "[ . 1 . 2]" 1 1510 1 26 GLN H 1 26 GLN HB2 3.790 . 3.790 2.552 2.350 2.672 . 0 0 "[ . 1 . 2]" 1 1511 1 26 GLN H 1 26 GLN HB3 3.790 . 3.790 2.538 2.403 2.779 . 0 0 "[ . 1 . 2]" 1 1512 1 68 VAL H 1 69 GLY H 4.950 . 4.950 4.523 4.382 4.584 . 0 0 "[ . 1 . 2]" 1 1513 1 67 THR HA 1 68 VAL H 2.770 . 2.770 2.179 2.153 2.243 . 0 0 "[ . 1 . 2]" 1 1514 1 99 GLN HG3 1 100 ALA H 4.090 . 4.090 3.520 3.248 4.114 0.024 4 0 "[ . 1 . 2]" 1 1515 1 100 ALA H 1 100 ALA MB 3.000 . 3.000 2.403 2.325 2.458 . 0 0 "[ . 1 . 2]" 1 1516 1 68 VAL H 1 68 VAL MG1 4.020 . 4.020 3.799 3.772 3.835 . 0 0 "[ . 1 . 2]" 1 1517 1 68 VAL H 1 68 VAL MG2 4.020 . 4.020 2.209 2.057 2.541 . 0 0 "[ . 1 . 2]" 1 1518 1 120 ALA H 1 123 ASP HB3 5.040 . 5.040 3.915 2.693 4.333 . 0 0 "[ . 1 . 2]" 1 1519 1 119 LEU HB2 1 120 ALA H 4.670 . 4.670 3.906 3.848 4.047 . 0 0 "[ . 1 . 2]" 1 1520 1 120 ALA H 1 120 ALA MB 3.050 . 3.050 2.232 2.218 2.245 . 0 0 "[ . 1 . 2]" 1 1521 1 119 LEU MD1 1 120 ALA H 5.040 . 5.040 4.534 4.482 4.608 . 0 0 "[ . 1 . 2]" 1 1522 1 119 LEU MD2 1 120 ALA H 3.860 . 3.860 3.270 3.040 3.459 . 0 0 "[ . 1 . 2]" 1 1523 1 38 GLU HA 1 120 ALA H 5.010 . 5.010 3.405 3.118 3.803 . 0 0 "[ . 1 . 2]" 1 1524 1 75 HIS H 1 76 GLN H 4.820 . 4.820 4.321 4.249 4.385 . 0 0 "[ . 1 . 2]" 1 1525 1 76 GLN H 1 85 HIS HA 5.750 . 5.750 5.050 4.807 5.275 . 0 0 "[ . 1 . 2]" 1 1526 1 75 HIS HB2 1 76 GLN H 4.460 . 4.460 4.117 4.038 4.227 . 0 0 "[ . 1 . 2]" 1 1527 1 75 HIS HB3 1 76 GLN H 4.410 . 4.410 3.972 3.713 4.169 . 0 0 "[ . 1 . 2]" 1 1528 1 76 GLN H 1 76 GLN HG2 5.110 . 5.110 4.219 3.999 4.600 . 0 0 "[ . 1 . 2]" 1 1529 1 76 GLN H 1 76 GLN HG3 4.220 . 4.220 3.279 3.128 4.391 0.171 14 0 "[ . 1 . 2]" 1 1530 1 76 GLN H 1 76 GLN HB2 3.420 . 3.420 2.425 2.344 2.553 . 0 0 "[ . 1 . 2]" 1 1531 1 51 ARG HA 1 68 VAL H 5.750 . 5.750 5.477 5.205 5.759 0.009 11 0 "[ . 1 . 2]" 1 1532 1 51 ARG HD2 1 68 VAL H 5.750 . 5.750 5.466 4.081 5.810 0.060 9 0 "[ . 1 . 2]" 1 1533 1 51 ARG HD3 1 68 VAL H 5.750 . 5.750 4.613 3.941 5.827 0.077 10 0 "[ . 1 . 2]" 1 1534 1 12 VAL HB 1 13 ALA H 3.620 . 3.620 3.123 2.988 3.211 . 0 0 "[ . 1 . 2]" 1 1535 1 13 ALA H 1 13 ALA MB 3.440 . 3.440 2.428 2.391 2.483 . 0 0 "[ . 1 . 2]" 1 1536 1 12 VAL MG2 1 13 ALA H 4.170 . 4.170 4.105 4.037 4.166 . 0 0 "[ . 1 . 2]" 1 1537 1 139 ALA H 1 140 ASP H 4.340 . 4.340 2.902 1.858 4.417 0.077 3 0 "[ . 1 . 2]" 1 1538 1 11 VAL H 1 44 VAL H 5.350 . 5.350 4.718 4.516 4.873 . 0 0 "[ . 1 . 2]" 1 1539 1 11 VAL H 1 85 HIS HB2 5.310 . 5.310 5.006 4.648 5.277 . 0 0 "[ . 1 . 2]" 1 1540 1 11 VAL H 1 44 VAL HB 5.750 . 5.750 5.190 4.851 5.461 . 0 0 "[ . 1 . 2]" 1 1541 1 70 GLU H 1 92 PRO HG3 5.750 . 5.750 4.664 3.084 5.694 . 0 0 "[ . 1 . 2]" 1 1542 1 11 VAL H 1 11 VAL HB 3.450 . 3.450 2.696 2.580 2.788 . 0 0 "[ . 1 . 2]" 1 1543 1 11 VAL H 1 86 LEU HB2 5.750 . 5.750 5.610 5.461 5.783 0.033 16 0 "[ . 1 . 2]" 1 1544 1 11 VAL H 1 86 LEU HG 5.750 . 5.750 4.031 3.612 4.425 . 0 0 "[ . 1 . 2]" 1 1545 1 10 GLU H 1 11 VAL H 4.790 . 4.790 4.412 4.358 4.462 . 0 0 "[ . 1 . 2]" 1 1546 1 70 GLU H 1 92 PRO HD3 5.440 . 5.440 4.259 3.053 5.294 . 0 0 "[ . 1 . 2]" 1 1547 1 68 VAL HA 1 70 GLU H 5.050 . 5.050 4.824 4.575 5.072 0.022 7 0 "[ . 1 . 2]" 1 1548 1 88 ALA H 1 89 TRP H 4.890 . 4.890 4.338 4.240 4.562 . 0 0 "[ . 1 . 2]" 1 1549 1 87 HIS HB3 1 88 ALA H 4.820 . 4.820 3.688 3.485 4.190 . 0 0 "[ . 1 . 2]" 1 1550 1 87 HIS HB2 1 88 ALA H 4.820 . 4.820 4.343 4.230 4.504 . 0 0 "[ . 1 . 2]" 1 1551 1 72 VAL HB 1 88 ALA H 5.210 . 5.210 4.519 4.356 4.803 . 0 0 "[ . 1 . 2]" 1 1552 1 13 ALA MB 1 88 ALA H 5.120 . 5.120 4.205 4.022 4.390 . 0 0 "[ . 1 . 2]" 1 1553 1 73 ALA MB 1 88 ALA H 5.480 . 5.480 4.248 3.680 4.397 . 0 0 "[ . 1 . 2]" 1 1554 1 88 ALA H 1 88 ALA MB 3.430 . 3.430 2.319 2.295 2.346 . 0 0 "[ . 1 . 2]" 1 1555 1 88 ALA H 1 126 LEU MD1 4.770 . 4.770 3.816 3.470 4.062 . 0 0 "[ . 1 . 2]" 1 1556 1 88 ALA H 1 126 LEU MD2 4.770 . 4.770 2.907 2.518 3.286 . 0 0 "[ . 1 . 2]" 1 1557 1 138 PRO HA 1 139 ALA H 3.140 . 3.140 2.257 2.101 3.296 0.156 1 0 "[ . 1 . 2]" 1 1558 1 138 PRO HB2 1 139 ALA H 4.120 . 4.120 3.439 2.377 4.186 0.066 4 0 "[ . 1 . 2]" 1 1559 1 138 PRO HB3 1 139 ALA H 4.120 . 4.120 3.786 3.302 4.330 0.210 1 0 "[ . 1 . 2]" 1 1560 1 139 ALA H 1 139 ALA MB 3.220 . 3.220 2.423 2.207 2.961 . 0 0 "[ . 1 . 2]" 1 1561 1 8 MET HG3 1 9 ILE H 5.030 . 5.030 4.827 4.763 4.938 . 0 0 "[ . 1 . 2]" 1 1562 1 8 MET HG2 1 9 ILE H 5.290 . 5.290 3.900 3.725 4.042 . 0 0 "[ . 1 . 2]" 1 1563 1 8 MET HB3 1 9 ILE H 3.670 . 3.670 3.087 2.889 3.281 . 0 0 "[ . 1 . 2]" 1 1564 1 9 ILE H 1 9 ILE HB 3.810 . 3.810 2.505 2.471 2.545 . 0 0 "[ . 1 . 2]" 1 1565 1 9 ILE H 1 82 ARG HB3 5.120 . 5.120 4.244 3.897 4.473 . 0 0 "[ . 1 . 2]" 1 1566 1 9 ILE H 1 83 ILE HB 5.530 . 5.530 4.261 4.071 4.384 . 0 0 "[ . 1 . 2]" 1 1567 1 9 ILE H 1 9 ILE HG12 4.020 . 4.020 3.728 3.657 3.825 . 0 0 "[ . 1 . 2]" 1 1568 1 9 ILE H 1 9 ILE HG13 3.880 . 3.880 2.703 2.576 2.798 . 0 0 "[ . 1 . 2]" 1 1569 1 9 ILE H 1 9 ILE MG 4.230 . 4.230 3.799 3.780 3.820 . 0 0 "[ . 1 . 2]" 1 1570 1 9 ILE H 1 84 ILE MG 3.820 . 3.820 3.670 3.534 3.831 0.011 12 0 "[ . 1 . 2]" 1 1571 1 9 ILE H 1 83 ILE MG 4.680 . 4.680 3.859 3.700 4.101 . 0 0 "[ . 1 . 2]" 1 1572 1 70 GLU H 1 70 GLU HG2 3.940 . 3.940 2.783 1.694 4.101 0.161 4 0 "[ . 1 . 2]" 1 1573 1 77 ARG HG2 1 78 GLU H 4.680 . 4.680 4.431 4.222 4.619 . 0 0 "[ . 1 . 2]" 1 1574 1 78 GLU H 1 79 VAL H 4.900 . 4.900 4.470 4.439 4.512 . 0 0 "[ . 1 . 2]" 1 1575 1 78 GLU H 1 84 ILE H 4.930 . 4.930 4.494 4.417 4.640 . 0 0 "[ . 1 . 2]" 1 1576 1 77 ARG HD2 1 78 GLU H 5.260 . 5.260 4.566 3.988 5.285 0.025 15 0 "[ . 1 . 2]" 1 1577 1 78 GLU H 1 78 GLU HG2 4.070 . 4.070 2.492 2.349 2.645 . 0 0 "[ . 1 . 2]" 1 1578 1 78 GLU H 1 78 GLU HB3 3.190 . 3.190 2.892 2.731 3.029 . 0 0 "[ . 1 . 2]" 1 1579 1 77 ARG HG3 1 78 GLU H 4.030 . 4.030 3.281 3.010 3.561 . 0 0 "[ . 1 . 2]" 1 1580 1 78 GLU H 1 84 ILE MD 4.970 . 4.970 4.706 4.490 5.032 0.062 16 0 "[ . 1 . 2]" 1 1581 1 78 GLU H 1 83 ILE MG 5.750 . 5.750 5.340 5.130 5.491 . 0 0 "[ . 1 . 2]" 1 1582 1 70 GLU H 1 71 TYR H 4.760 . 4.760 3.994 3.222 4.520 . 0 0 "[ . 1 . 2]" 1 1583 1 71 TYR H 1 72 VAL H 4.860 . 4.860 4.529 4.371 4.587 . 0 0 "[ . 1 . 2]" 1 1584 1 71 TYR H 1 71 TYR HB3 3.410 . 3.410 2.860 2.147 3.646 0.236 10 0 "[ . 1 . 2]" 1 1585 1 71 TYR H 1 71 TYR HB2 3.410 . 3.410 2.519 2.238 2.930 . 0 0 "[ . 1 . 2]" 1 1586 1 89 TRP HB3 1 90 HIS H 4.580 . 4.580 3.256 2.695 4.371 . 0 0 "[ . 1 . 2]" 1 1587 1 89 TRP H 1 90 HIS H 5.600 . 5.600 4.457 4.350 4.505 . 0 0 "[ . 1 . 2]" 1 1588 1 90 HIS H 1 90 HIS HB3 3.500 . 3.500 2.421 2.317 2.507 . 0 0 "[ . 1 . 2]" 1 1589 1 71 TYR HA 1 90 HIS H 4.200 . 4.200 3.484 2.738 4.082 . 0 0 "[ . 1 . 2]" 1 1590 1 90 HIS H 1 90 HIS HB2 3.500 . 3.500 2.851 2.663 3.011 . 0 0 "[ . 1 . 2]" 1 1591 1 89 TRP HB2 1 90 HIS H 4.580 . 4.580 4.012 2.843 4.383 . 0 0 "[ . 1 . 2]" 1 1592 1 72 VAL HB 1 90 HIS H 4.970 . 4.970 4.580 4.306 4.870 . 0 0 "[ . 1 . 2]" 1 1593 1 108 TRP H 1 108 TRP HB3 4.110 . 4.110 3.505 3.052 3.702 . 0 0 "[ . 1 . 2]" 1 1594 1 108 TRP H 1 108 TRP HB2 4.110 . 4.110 2.816 2.322 3.761 . 0 0 "[ . 1 . 2]" 1 1595 1 107 VAL HB 1 108 TRP H 4.360 . 4.360 4.065 2.920 4.245 . 0 0 "[ . 1 . 2]" 1 1596 1 107 VAL MG1 1 108 TRP H 4.660 . 4.660 3.728 3.556 4.069 . 0 0 "[ . 1 . 2]" 1 1597 1 107 VAL MG2 1 108 TRP H 4.660 . 4.660 2.446 2.214 3.795 . 0 0 "[ . 1 . 2]" 1 1598 1 15 ILE H 1 90 HIS H 5.130 . 5.130 4.795 4.568 4.995 . 0 0 "[ . 1 . 2]" 1 1599 1 15 ILE H 1 88 ALA HA 5.460 . 5.460 4.692 4.514 4.865 . 0 0 "[ . 1 . 2]" 1 1600 1 14 ALA MB 1 15 ILE H 3.690 . 3.690 3.259 3.126 3.377 . 0 0 "[ . 1 . 2]" 1 1601 1 15 ILE H 1 15 ILE HB 3.600 . 3.600 2.435 2.390 2.502 . 0 0 "[ . 1 . 2]" 1 1602 1 15 ILE H 1 15 ILE HG13 3.900 . 3.900 2.762 2.665 2.860 . 0 0 "[ . 1 . 2]" 1 1603 1 15 ILE H 1 15 ILE MD 4.400 . 4.400 4.111 4.028 4.193 . 0 0 "[ . 1 . 2]" 1 1604 1 15 ILE H 1 15 ILE MG 4.330 . 4.330 3.749 3.726 3.781 . 0 0 "[ . 1 . 2]" 1 1605 1 15 ILE H 1 15 ILE HG12 4.390 . 4.390 3.564 3.455 3.627 . 0 0 "[ . 1 . 2]" 1 1606 1 87 HIS H 1 88 ALA H 4.760 . 4.760 4.269 4.227 4.334 . 0 0 "[ . 1 . 2]" 1 1607 1 11 VAL HA 1 87 HIS H 5.750 . 5.750 5.101 4.986 5.361 . 0 0 "[ . 1 . 2]" 1 1608 1 87 HIS H 1 87 HIS HB3 4.070 . 4.070 3.578 2.795 3.757 . 0 0 "[ . 1 . 2]" 1 1609 1 87 HIS H 1 87 HIS HB2 4.070 . 4.070 2.612 2.347 2.853 . 0 0 "[ . 1 . 2]" 1 1610 1 12 VAL HB 1 87 HIS H 5.240 . 5.240 4.887 4.779 5.048 . 0 0 "[ . 1 . 2]" 1 1611 1 86 LEU HB3 1 87 HIS H 3.860 . 3.860 3.283 3.119 3.485 . 0 0 "[ . 1 . 2]" 1 1612 1 86 LEU HB2 1 87 HIS H 5.400 . 5.400 4.298 4.216 4.407 . 0 0 "[ . 1 . 2]" 1 1613 1 86 LEU HG 1 87 HIS H 5.620 . 5.620 3.995 3.886 4.130 . 0 0 "[ . 1 . 2]" 1 1614 1 24 LEU H 1 25 ALA H 4.900 . 4.900 4.458 4.390 4.503 . 0 0 "[ . 1 . 2]" 1 1615 1 25 ALA H 1 26 GLN H 5.180 . 5.180 4.277 4.191 4.381 . 0 0 "[ . 1 . 2]" 1 1616 1 25 ALA H 1 106 LEU HA 5.460 . 5.460 4.856 4.673 5.023 . 0 0 "[ . 1 . 2]" 1 1617 1 25 ALA H 1 37 TRP HA 4.480 . 4.480 4.246 3.687 4.502 0.022 5 0 "[ . 1 . 2]" 1 1618 1 25 ALA H 1 37 TRP HB3 4.870 . 4.870 3.449 2.871 3.743 . 0 0 "[ . 1 . 2]" 1 1619 1 24 LEU HB3 1 25 ALA H 4.270 . 4.270 3.006 2.589 3.256 . 0 0 "[ . 1 . 2]" 1 1620 1 24 LEU HB2 1 25 ALA H 4.840 . 4.840 4.096 3.792 4.260 . 0 0 "[ . 1 . 2]" 1 1621 1 24 LEU HG 1 25 ALA H 5.290 . 5.290 4.357 4.017 5.069 . 0 0 "[ . 1 . 2]" 1 1622 1 25 ALA H 1 25 ALA MB 3.350 . 3.350 2.465 2.400 2.532 . 0 0 "[ . 1 . 2]" 1 1623 1 114 ALA H 1 115 LEU HB2 5.030 . 5.030 4.678 4.612 4.912 . 0 0 "[ . 1 . 2]" 1 1624 1 112 GLU H 1 114 ALA H 4.520 . 4.520 4.052 3.637 4.221 . 0 0 "[ . 1 . 2]" 1 1625 1 114 ALA H 1 116 GLN H 4.670 . 4.670 4.054 3.954 4.144 . 0 0 "[ . 1 . 2]" 1 1626 1 109 CYS QB 1 114 ALA H 4.700 . 4.700 3.817 3.297 4.087 . 0 0 "[ . 1 . 2]" 1 1627 1 113 GLU HB3 1 114 ALA H 4.050 . 4.050 3.725 3.444 3.846 . 0 0 "[ . 1 . 2]" 1 1628 1 113 GLU HB2 1 114 ALA H 3.850 . 3.850 2.668 2.541 2.823 . 0 0 "[ . 1 . 2]" 1 1629 1 6 MET HB2 1 7 LYS H 5.280 . 5.280 3.800 2.931 4.484 . 0 0 "[ . 1 . 2]" 1 1630 1 6 MET HB3 1 7 LYS H 5.280 . 5.280 3.584 1.865 4.483 . 0 0 "[ . 1 . 2]" 1 1631 1 112 GLU HB2 1 114 ALA H 5.750 . 5.750 5.614 5.460 5.711 . 0 0 "[ . 1 . 2]" 1 1632 1 114 ALA H 1 114 ALA MB 2.980 . 2.980 2.225 2.220 2.232 . 0 0 "[ . 1 . 2]" 1 1633 1 22 ILE MD 1 114 ALA H 5.170 . 5.170 4.495 4.234 4.649 . 0 0 "[ . 1 . 2]" 1 1634 1 78 GLU HG3 1 80 SER H 5.400 . 5.400 3.117 2.803 3.401 . 0 0 "[ . 1 . 2]" 1 1635 1 79 VAL HB 1 80 SER H 5.750 . 5.750 4.423 4.395 4.456 . 0 0 "[ . 1 . 2]" 1 1636 1 51 ARG H 1 53 ALA H 4.700 . 4.700 4.183 3.966 4.437 . 0 0 "[ . 1 . 2]" 1 1637 1 49 SER HA 1 53 ALA H 5.470 . 5.470 4.950 4.837 5.126 . 0 0 "[ . 1 . 2]" 1 1638 1 51 ARG HA 1 53 ALA H 5.040 . 5.040 4.439 4.212 4.612 . 0 0 "[ . 1 . 2]" 1 1639 1 52 GLN HB3 1 53 ALA H 3.520 . 3.520 2.601 2.501 2.816 . 0 0 "[ . 1 . 2]" 1 1640 1 53 ALA H 1 53 ALA MB 3.090 . 3.090 2.229 2.218 2.243 . 0 0 "[ . 1 . 2]" 1 1641 1 12 VAL MG1 1 53 ALA H 4.970 . 4.970 4.710 4.521 4.879 . 0 0 "[ . 1 . 2]" 1 1642 1 12 VAL MG2 1 53 ALA H 4.970 . 4.970 4.162 3.976 4.379 . 0 0 "[ . 1 . 2]" 1 1643 1 44 VAL H 1 45 GLU H 4.960 . 4.960 4.343 4.150 4.476 . 0 0 "[ . 1 . 2]" 1 1644 1 12 VAL H 1 44 VAL H 4.500 . 4.500 4.223 4.050 4.421 . 0 0 "[ . 1 . 2]" 1 1645 1 43 LYS H 1 44 VAL H 4.900 . 4.900 4.572 4.448 4.608 . 0 0 "[ . 1 . 2]" 1 1646 1 10 GLU HB2 1 44 VAL H 4.340 . 4.340 3.342 2.903 3.722 . 0 0 "[ . 1 . 2]" 1 1647 1 44 VAL H 1 44 VAL HB 3.780 . 3.780 2.576 2.474 2.646 . 0 0 "[ . 1 . 2]" 1 1648 1 43 LYS HB2 1 44 VAL H 4.230 . 4.230 3.910 3.763 4.074 . 0 0 "[ . 1 . 2]" 1 1649 1 43 LYS HB3 1 44 VAL H 4.660 . 4.660 3.838 3.509 4.044 . 0 0 "[ . 1 . 2]" 1 1650 1 43 LYS HG3 1 44 VAL H 4.310 . 4.310 2.589 2.066 3.170 . 0 0 "[ . 1 . 2]" 1 1651 1 43 LYS HG2 1 44 VAL H 4.310 . 4.310 2.390 1.965 3.065 . 0 0 "[ . 1 . 2]" 1 1652 1 115 LEU H 1 117 TYR H 4.460 . 4.460 4.011 3.903 4.156 . 0 0 "[ . 1 . 2]" 1 1653 1 117 TYR H 1 117 TYR QD 3.520 . 3.520 2.697 2.420 3.200 . 0 0 "[ . 1 . 2]" 1 1654 1 115 LEU HA 1 117 TYR H 4.060 . 4.060 3.462 3.375 3.555 . 0 0 "[ . 1 . 2]" 1 1655 1 114 ALA HA 1 117 TYR H 4.220 . 4.220 3.662 3.472 3.906 . 0 0 "[ . 1 . 2]" 1 1656 1 117 TYR H 1 118 PRO HD3 5.620 . 5.620 5.111 5.053 5.174 . 0 0 "[ . 1 . 2]" 1 1657 1 117 TYR H 1 118 PRO HD2 5.150 . 5.150 4.833 4.787 4.885 . 0 0 "[ . 1 . 2]" 1 1658 1 117 TYR H 1 117 TYR HB2 3.220 . 3.220 2.299 2.247 2.354 . 0 0 "[ . 1 . 2]" 1 1659 1 116 GLN HB3 1 117 TYR H 4.300 . 4.300 4.181 4.069 4.256 . 0 0 "[ . 1 . 2]" 1 1660 1 116 GLN HB2 1 117 TYR H 4.190 . 4.190 3.377 3.217 3.581 . 0 0 "[ . 1 . 2]" 1 1661 1 117 TYR H 1 119 LEU HG 4.550 . 4.550 3.768 3.527 3.959 . 0 0 "[ . 1 . 2]" 1 1662 1 114 ALA MB 1 117 TYR H 5.090 . 5.090 4.480 4.371 4.613 . 0 0 "[ . 1 . 2]" 1 1663 1 117 TYR H 1 119 LEU MD1 4.760 . 4.760 4.097 3.940 4.236 . 0 0 "[ . 1 . 2]" 1 1664 1 117 TYR H 1 119 LEU MD2 5.610 . 5.610 4.800 4.427 5.216 . 0 0 "[ . 1 . 2]" 1 1665 1 29 ALA H 1 30 GLN H 3.840 . 3.840 2.942 1.974 3.949 0.109 15 0 "[ . 1 . 2]" 1 1666 1 28 PRO HD2 1 29 ALA H 4.970 . 4.970 3.802 2.055 4.879 . 0 0 "[ . 1 . 2]" 1 1667 1 28 PRO HB3 1 29 ALA H 3.810 . 3.810 3.510 3.220 4.125 0.315 14 0 "[ . 1 . 2]" 1 1668 1 28 PRO HB2 1 29 ALA H 3.400 . 3.400 2.205 1.682 3.414 0.118 19 0 "[ . 1 . 2]" 1 1669 1 28 PRO HG2 1 29 ALA H 4.080 . 4.080 2.899 2.138 3.265 . 0 0 "[ . 1 . 2]" 1 1670 1 29 ALA H 1 29 ALA MB 3.200 . 3.200 2.699 2.290 3.018 . 0 0 "[ . 1 . 2]" 1 1671 1 131 MET HB3 1 132 ALA H 4.560 . 4.560 3.991 3.872 4.051 . 0 0 "[ . 1 . 2]" 1 1672 1 128 GLU H 1 129 ALA H 3.390 . 3.390 2.843 2.766 2.901 . 0 0 "[ . 1 . 2]" 1 1673 1 129 ALA H 1 130 PHE HB2 5.250 . 5.250 4.756 4.670 4.855 . 0 0 "[ . 1 . 2]" 1 1674 1 130 PHE HB3 1 132 ALA H 5.140 . 5.140 4.790 4.707 4.903 . 0 0 "[ . 1 . 2]" 1 1675 1 131 MET HB2 1 132 ALA H 4.310 . 4.310 3.933 3.853 4.011 . 0 0 "[ . 1 . 2]" 1 1676 1 131 MET HG3 1 132 ALA H 3.230 . 3.230 2.484 2.241 2.660 . 0 0 "[ . 1 . 2]" 1 1677 1 132 ALA H 1 133 LEU HB2 5.090 . 5.090 4.591 4.494 4.695 . 0 0 "[ . 1 . 2]" 1 1678 1 129 ALA H 1 130 PHE H 3.400 . 3.400 2.470 2.409 2.538 . 0 0 "[ . 1 . 2]" 1 1679 1 126 LEU H 1 129 ALA H 5.490 . 5.490 4.848 4.741 5.012 . 0 0 "[ . 1 . 2]" 1 1680 1 128 GLU HB2 1 129 ALA H 3.730 . 3.730 2.636 2.555 2.788 . 0 0 "[ . 1 . 2]" 1 1681 1 8 MET H 1 8 MET HG2 5.230 . 5.230 4.061 3.950 4.185 . 0 0 "[ . 1 . 2]" 1 1682 1 8 MET H 1 9 ILE H 4.810 . 4.810 4.433 4.370 4.475 . 0 0 "[ . 1 . 2]" 1 1683 1 8 MET H 1 8 MET HG3 4.000 . 4.000 3.054 2.938 3.257 . 0 0 "[ . 1 . 2]" 1 1684 1 8 MET H 1 8 MET HB2 3.160 . 3.160 2.414 2.351 2.514 . 0 0 "[ . 1 . 2]" 1 1685 1 7 LYS HG2 1 8 MET H 5.390 . 5.390 4.432 3.854 5.080 . 0 0 "[ . 1 . 2]" 1 1686 1 7 LYS HG3 1 8 MET H 5.390 . 5.390 4.561 2.792 5.178 . 0 0 "[ . 1 . 2]" 1 1687 1 22 ILE H 1 23 LEU H 4.880 . 4.880 4.506 4.451 4.535 . 0 0 "[ . 1 . 2]" 1 1688 1 23 LEU H 1 24 LEU H 4.980 . 4.980 4.384 4.297 4.435 . 0 0 "[ . 1 . 2]" 1 1689 1 23 LEU H 1 108 TRP HA 5.480 . 5.480 4.727 4.504 4.950 . 0 0 "[ . 1 . 2]" 1 1690 1 16 ILE HB 1 23 LEU H 3.670 . 3.670 2.817 2.361 3.212 . 0 0 "[ . 1 . 2]" 1 1691 1 22 ILE HB 1 23 LEU H 3.980 . 3.980 3.781 3.670 3.934 . 0 0 "[ . 1 . 2]" 1 1692 1 23 LEU H 1 23 LEU HB2 3.770 . 3.770 2.612 2.324 2.705 . 0 0 "[ . 1 . 2]" 1 1693 1 22 ILE HG13 1 23 LEU H 5.630 . 5.630 5.045 4.998 5.103 . 0 0 "[ . 1 . 2]" 1 1694 1 22 ILE MG 1 23 LEU H 3.960 . 3.960 2.269 2.182 2.399 . 0 0 "[ . 1 . 2]" 1 1695 1 16 ILE MD 1 23 LEU H 5.720 . 5.720 4.956 4.335 5.349 . 0 0 "[ . 1 . 2]" 1 1696 1 23 LEU H 1 23 LEU MD1 5.100 . 5.100 4.153 4.034 4.237 . 0 0 "[ . 1 . 2]" 1 1697 1 23 LEU H 1 23 LEU HB3 3.810 . 3.810 2.492 2.390 2.706 . 0 0 "[ . 1 . 2]" 1 1698 1 15 ILE MG 1 23 LEU H 4.780 . 4.780 4.088 3.854 4.341 . 0 0 "[ . 1 . 2]" 1 1699 1 23 LEU H 1 23 LEU MD2 5.100 . 5.100 4.268 4.215 4.320 . 0 0 "[ . 1 . 2]" 1 1700 1 57 GLU H 1 59 ARG H 4.850 . 4.850 4.089 3.988 4.224 . 0 0 "[ . 1 . 2]" 1 1701 1 59 ARG H 1 61 GLU H 5.220 . 5.220 4.208 4.080 4.290 . 0 0 "[ . 1 . 2]" 1 1702 1 58 LEU H 1 59 ARG H 3.580 . 3.580 2.602 2.513 2.753 . 0 0 "[ . 1 . 2]" 1 1703 1 59 ARG H 1 60 GLU H 3.430 . 3.430 2.694 2.620 2.782 . 0 0 "[ . 1 . 2]" 1 1704 1 56 ARG H 1 59 ARG H 5.600 . 5.600 4.676 4.525 4.835 . 0 0 "[ . 1 . 2]" 1 1705 1 59 ARG H 1 62 LEU H 5.750 . 5.750 4.538 4.459 4.615 . 0 0 "[ . 1 . 2]" 1 1706 1 59 ARG H 1 64 ILE H 5.130 . 5.130 4.294 4.171 4.639 . 0 0 "[ . 1 . 2]" 1 1707 1 59 ARG H 1 59 ARG HD2 5.690 . 5.690 4.928 4.295 5.537 . 0 0 "[ . 1 . 2]" 1 1708 1 59 ARG H 1 59 ARG HD3 5.750 . 5.750 4.933 4.497 5.451 . 0 0 "[ . 1 . 2]" 1 1709 1 59 ARG H 1 60 GLU HG3 5.110 . 5.110 4.459 4.135 5.326 0.216 7 0 "[ . 1 . 2]" 1 1710 1 59 ARG H 1 60 GLU HG2 5.410 . 5.410 5.340 4.063 5.503 0.093 16 0 "[ . 1 . 2]" 1 1711 1 59 ARG H 1 59 ARG HB3 3.130 . 3.130 2.451 2.301 2.561 . 0 0 "[ . 1 . 2]" 1 1712 1 59 ARG H 1 59 ARG HG2 4.610 . 4.610 4.412 4.326 4.470 . 0 0 "[ . 1 . 2]" 1 1713 1 58 LEU HB3 1 59 ARG H 4.090 . 4.090 3.834 3.465 3.965 . 0 0 "[ . 1 . 2]" 1 1714 1 58 LEU MD1 1 59 ARG H 5.730 . 5.730 4.586 4.072 4.742 . 0 0 "[ . 1 . 2]" 1 1715 1 58 LEU MD2 1 59 ARG H 5.730 . 5.730 4.532 4.425 4.755 . 0 0 "[ . 1 . 2]" 1 1716 1 135 ALA H 1 136 ALA HA 5.460 . 5.460 4.986 4.908 5.065 . 0 0 "[ . 1 . 2]" 1 1717 1 37 TRP H 1 37 TRP HE1 4.950 . 4.950 4.967 4.851 5.095 0.145 4 0 "[ . 1 . 2]" 1 1718 1 37 TRP H 1 38 GLU H 4.890 . 4.890 4.477 4.439 4.545 . 0 0 "[ . 1 . 2]" 1 1719 1 26 GLN HA 1 37 TRP H 5.230 . 5.230 4.573 4.377 4.810 . 0 0 "[ . 1 . 2]" 1 1720 1 37 TRP H 1 37 TRP HB2 3.640 . 3.640 2.657 2.573 2.800 . 0 0 "[ . 1 . 2]" 1 1721 1 36 LEU HB2 1 37 TRP H 4.880 . 4.880 3.872 3.643 4.194 . 0 0 "[ . 1 . 2]" 1 1722 1 36 LEU HB3 1 37 TRP H 4.260 . 4.260 2.811 2.580 3.493 . 0 0 "[ . 1 . 2]" 1 1723 1 36 LEU MD1 1 37 TRP H 5.380 . 5.380 4.433 3.546 5.187 . 0 0 "[ . 1 . 2]" 1 1724 1 36 LEU MD2 1 37 TRP H 5.380 . 5.380 4.376 3.728 4.943 . 0 0 "[ . 1 . 2]" 1 1725 1 37 TRP H 1 119 LEU MD2 4.610 . 4.610 3.405 3.090 3.704 . 0 0 "[ . 1 . 2]" 1 1726 1 13 ALA H 1 14 ALA H 4.750 . 4.750 4.356 4.304 4.386 . 0 0 "[ . 1 . 2]" 1 1727 1 14 ALA H 1 41 GLY HA3 4.620 . 4.620 3.028 2.666 3.244 . 0 0 "[ . 1 . 2]" 1 1728 1 14 ALA H 1 54 LEU HB3 5.750 . 5.750 5.582 5.288 5.815 0.065 20 0 "[ . 1 . 2]" 1 1729 1 14 ALA H 1 14 ALA MB 3.240 . 3.240 2.332 2.310 2.358 . 0 0 "[ . 1 . 2]" 1 1730 1 83 ILE H 1 83 ILE MD 3.970 . 3.970 2.392 2.281 2.599 . 0 0 "[ . 1 . 2]" 1 1731 1 79 VAL H 1 83 ILE H 4.950 . 4.950 4.707 4.615 4.754 . 0 0 "[ . 1 . 2]" 1 1732 1 82 ARG H 1 83 ILE H 4.810 . 4.810 4.521 4.360 4.568 . 0 0 "[ . 1 . 2]" 1 1733 1 82 ARG HD3 1 83 ILE H 5.560 . 5.560 5.423 5.097 5.769 0.209 6 0 "[ . 1 . 2]" 1 1734 1 8 MET HG3 1 83 ILE H 4.910 . 4.910 4.530 4.224 4.742 . 0 0 "[ . 1 . 2]" 1 1735 1 82 ARG HB3 1 83 ILE H 3.350 . 3.350 3.027 2.728 3.180 . 0 0 "[ . 1 . 2]" 1 1736 1 83 ILE H 1 83 ILE HB 3.460 . 3.460 2.413 2.351 2.494 . 0 0 "[ . 1 . 2]" 1 1737 1 82 ARG HG2 1 83 ILE H 4.820 . 4.820 4.360 3.833 4.601 . 0 0 "[ . 1 . 2]" 1 1738 1 83 ILE H 1 83 ILE HG13 4.340 . 4.340 3.971 3.855 4.169 . 0 0 "[ . 1 . 2]" 1 1739 1 135 ALA H 1 137 ARG H 4.240 . 4.240 3.505 3.271 3.761 . 0 0 "[ . 1 . 2]" 1 1740 1 133 LEU H 1 135 ALA H 4.050 . 4.050 3.900 3.766 4.048 . 0 0 "[ . 1 . 2]" 1 1741 1 134 ARG HA 1 135 ALA H 3.800 . 3.800 3.441 3.376 3.491 . 0 0 "[ . 1 . 2]" 1 1742 1 106 LEU H 1 107 VAL H 4.780 . 4.780 4.324 4.222 4.433 . 0 0 "[ . 1 . 2]" 1 1743 1 107 VAL H 1 108 TRP H 4.650 . 4.650 4.370 4.193 4.426 . 0 0 "[ . 1 . 2]" 1 1744 1 24 LEU HA 1 107 VAL H 5.310 . 5.310 4.667 4.601 4.761 . 0 0 "[ . 1 . 2]" 1 1745 1 23 LEU HA 1 107 VAL H 4.920 . 4.920 4.268 4.026 4.431 . 0 0 "[ . 1 . 2]" 1 1746 1 107 VAL H 1 107 VAL HB 3.800 . 3.800 3.179 3.082 3.809 0.009 17 0 "[ . 1 . 2]" 1 1747 1 24 LEU HB3 1 107 VAL H 5.450 . 5.450 4.420 4.156 4.710 . 0 0 "[ . 1 . 2]" 1 1748 1 106 LEU HG 1 107 VAL H 5.750 . 5.750 4.232 3.272 5.217 . 0 0 "[ . 1 . 2]" 1 1749 1 24 LEU HB2 1 107 VAL H 3.980 . 3.980 3.383 3.054 3.771 . 0 0 "[ . 1 . 2]" 1 1750 1 107 VAL H 1 107 VAL MG2 4.710 . 4.710 3.868 2.183 3.978 . 0 0 "[ . 1 . 2]" 1 1751 1 26 GLN H 1 107 VAL H 5.310 . 5.310 4.763 4.426 5.068 . 0 0 "[ . 1 . 2]" 1 1752 1 124 ILE H 1 126 LEU H 5.110 . 5.110 3.955 3.821 4.080 . 0 0 "[ . 1 . 2]" 1 1753 1 124 ILE H 1 125 PRO HD3 3.690 . 3.690 3.380 3.264 3.523 . 0 0 "[ . 1 . 2]" 1 1754 1 123 ASP HB2 1 124 ILE H 4.470 . 4.470 3.070 2.901 3.941 . 0 0 "[ . 1 . 2]" 1 1755 1 123 ASP HB3 1 124 ILE H 4.500 . 4.500 3.815 2.874 3.977 . 0 0 "[ . 1 . 2]" 1 1756 1 124 ILE H 1 126 LEU HB2 5.660 . 5.660 4.967 4.831 5.134 . 0 0 "[ . 1 . 2]" 1 1757 1 124 ILE H 1 127 LEU HB3 5.750 . 5.750 5.638 5.474 5.771 0.021 16 0 "[ . 1 . 2]" 1 1758 1 124 ILE H 1 124 ILE HB 3.450 . 3.450 2.515 2.477 2.557 . 0 0 "[ . 1 . 2]" 1 1759 1 119 LEU HB3 1 124 ILE H 5.060 . 5.060 3.886 3.613 4.105 . 0 0 "[ . 1 . 2]" 1 1760 1 120 ALA MB 1 124 ILE H 5.680 . 5.680 4.526 4.294 4.713 . 0 0 "[ . 1 . 2]" 1 1761 1 122 ALA MB 1 124 ILE H 5.750 . 5.750 4.501 4.430 4.595 . 0 0 "[ . 1 . 2]" 1 1762 1 124 ILE H 1 125 PRO HG3 4.950 . 4.950 4.710 4.635 4.780 . 0 0 "[ . 1 . 2]" 1 1763 1 119 LEU MD1 1 124 ILE H 5.310 . 5.310 4.333 4.129 4.480 . 0 0 "[ . 1 . 2]" 1 1764 1 121 PRO HB2 1 124 ILE H 5.750 . 5.750 5.722 5.506 5.801 0.051 20 0 "[ . 1 . 2]" 1 1765 1 136 ALA H 1 137 ARG H 3.180 . 3.180 2.201 2.079 2.302 . 0 0 "[ . 1 . 2]" 1 1766 1 135 ALA HA 1 137 ARG H 4.910 . 4.910 4.531 4.071 4.945 0.035 4 0 "[ . 1 . 2]" 1 1767 1 136 ALA MB 1 137 ARG H 3.730 . 3.730 2.750 2.434 3.138 . 0 0 "[ . 1 . 2]" 1 1768 1 14 ALA MB 1 89 TRP H 5.220 . 5.220 4.636 4.470 4.867 . 0 0 "[ . 1 . 2]" 1 1769 1 13 ALA H 1 89 TRP H 4.360 . 4.360 3.712 3.331 4.341 . 0 0 "[ . 1 . 2]" 1 1770 1 71 TYR HA 1 89 TRP H 5.750 . 5.750 5.373 4.767 5.871 0.121 10 0 "[ . 1 . 2]" 1 1771 1 89 TRP H 1 89 TRP HB3 4.210 . 4.210 3.397 2.354 3.736 . 0 0 "[ . 1 . 2]" 1 1772 1 89 TRP H 1 89 TRP HB2 4.210 . 4.210 2.664 2.301 3.914 . 0 0 "[ . 1 . 2]" 1 1773 1 72 VAL HB 1 89 TRP H 5.430 . 5.430 4.802 4.343 5.099 . 0 0 "[ . 1 . 2]" 1 1774 1 88 ALA MB 1 89 TRP H 3.560 . 3.560 3.270 2.795 3.404 . 0 0 "[ . 1 . 2]" 1 1775 1 54 LEU MD1 1 89 TRP H 4.950 . 4.950 3.402 2.918 4.431 . 0 0 "[ . 1 . 2]" 1 1776 1 54 LEU MD2 1 89 TRP H 4.950 . 4.950 4.399 3.840 4.787 . 0 0 "[ . 1 . 2]" 1 1777 1 13 ALA MB 1 89 TRP H 4.460 . 4.460 3.690 3.311 3.984 . 0 0 "[ . 1 . 2]" 1 1778 1 77 ARG H 1 85 HIS H 5.560 . 5.560 5.105 4.979 5.224 . 0 0 "[ . 1 . 2]" 1 1779 1 77 ARG H 1 78 GLU H 4.850 . 4.850 4.355 4.329 4.402 . 0 0 "[ . 1 . 2]" 1 1780 1 77 ARG H 1 84 ILE HA 5.490 . 5.490 4.786 4.662 4.847 . 0 0 "[ . 1 . 2]" 1 1781 1 77 ARG H 1 77 ARG HD2 5.700 . 5.700 5.188 4.742 5.365 . 0 0 "[ . 1 . 2]" 1 1782 1 77 ARG H 1 77 ARG HD3 5.750 . 5.750 4.837 4.477 5.250 . 0 0 "[ . 1 . 2]" 1 1783 1 76 GLN HG2 1 77 ARG H 3.660 . 3.660 3.694 2.794 3.806 0.146 20 0 "[ . 1 . 2]" 1 1784 1 77 ARG H 1 77 ARG HG2 3.430 . 3.430 2.687 2.484 2.892 . 0 0 "[ . 1 . 2]" 1 1785 1 77 ARG H 1 77 ARG HG3 4.260 . 4.260 3.448 3.162 3.741 . 0 0 "[ . 1 . 2]" 1 1786 1 77 ARG H 1 84 ILE HG13 5.070 . 5.070 3.497 3.306 3.600 . 0 0 "[ . 1 . 2]" 1 1787 1 77 ARG H 1 84 ILE MD 4.810 . 4.810 4.809 4.648 4.877 0.067 3 0 "[ . 1 . 2]" 1 1788 1 77 ARG H 1 83 ILE MG 3.990 . 3.990 3.387 3.184 3.584 . 0 0 "[ . 1 . 2]" 1 1789 1 75 HIS H 1 88 ALA H 4.920 . 4.920 4.680 4.467 4.872 . 0 0 "[ . 1 . 2]" 1 1790 1 75 HIS H 1 87 HIS HA 4.270 . 4.270 3.978 3.640 4.164 . 0 0 "[ . 1 . 2]" 1 1791 1 75 HIS H 1 85 HIS HA 5.650 . 5.650 4.680 4.349 5.028 . 0 0 "[ . 1 . 2]" 1 1792 1 75 HIS H 1 75 HIS HB2 3.920 . 3.920 3.224 3.088 3.344 . 0 0 "[ . 1 . 2]" 1 1793 1 75 HIS H 1 75 HIS HB3 3.800 . 3.800 2.833 2.711 2.974 . 0 0 "[ . 1 . 2]" 1 1794 1 75 HIS H 1 86 LEU HB3 4.270 . 4.270 3.829 3.624 3.995 . 0 0 "[ . 1 . 2]" 1 1795 1 75 HIS H 1 86 LEU HB2 4.270 . 4.270 2.998 2.745 3.231 . 0 0 "[ . 1 . 2]" 1 1796 1 75 HIS H 1 88 ALA MB 5.480 . 5.480 5.122 4.832 5.396 . 0 0 "[ . 1 . 2]" 1 1797 1 75 HIS H 1 126 LEU MD1 4.800 . 4.800 3.844 2.618 4.164 . 0 0 "[ . 1 . 2]" 1 1798 1 75 HIS H 1 86 LEU MD1 5.750 . 5.750 4.462 4.220 4.716 . 0 0 "[ . 1 . 2]" 1 1799 1 75 HIS H 1 86 LEU MD2 5.750 . 5.750 4.918 4.647 5.148 . 0 0 "[ . 1 . 2]" 1 1800 1 75 HIS H 1 126 LEU MD2 4.800 . 4.800 2.639 2.336 3.790 . 0 0 "[ . 1 . 2]" 1 1801 1 64 ILE HG12 1 65 GLU H 5.410 . 5.410 4.973 4.933 5.039 . 0 0 "[ . 1 . 2]" 1 1802 1 65 GLU H 1 66 ALA H 4.530 . 4.530 4.153 4.083 4.258 . 0 0 "[ . 1 . 2]" 1 1803 1 65 GLU H 1 94 PHE HA 5.180 . 5.180 4.833 4.696 5.025 . 0 0 "[ . 1 . 2]" 1 1804 1 65 GLU H 1 94 PHE HB2 5.230 . 5.230 4.278 4.075 4.598 . 0 0 "[ . 1 . 2]" 1 1805 1 65 GLU H 1 65 GLU HB3 4.080 . 4.080 3.635 3.587 3.678 . 0 0 "[ . 1 . 2]" 1 1806 1 64 ILE HB 1 65 GLU H 3.520 . 3.520 2.839 2.732 2.993 . 0 0 "[ . 1 . 2]" 1 1807 1 65 GLU H 1 65 GLU HB2 4.080 . 4.080 2.498 2.335 2.661 . 0 0 "[ . 1 . 2]" 1 1808 1 64 ILE HG13 1 65 GLU H 4.600 . 4.600 4.118 4.046 4.201 . 0 0 "[ . 1 . 2]" 1 1809 1 64 ILE MG 1 65 GLU H 4.250 . 4.250 3.730 3.621 3.870 . 0 0 "[ . 1 . 2]" 1 1810 1 64 ILE MD 1 65 GLU H 4.640 . 4.640 4.684 4.621 4.768 0.128 17 0 "[ . 1 . 2]" 1 1811 1 127 LEU H 1 129 ALA H 4.730 . 4.730 4.174 4.098 4.249 . 0 0 "[ . 1 . 2]" 1 1812 1 127 LEU H 1 128 GLU H 3.610 . 3.610 2.509 2.446 2.566 . 0 0 "[ . 1 . 2]" 1 1813 1 123 ASP HA 1 127 LEU H 4.970 . 4.970 4.185 3.935 4.502 . 0 0 "[ . 1 . 2]" 1 1814 1 125 PRO HA 1 127 LEU H 5.180 . 5.180 4.521 4.385 4.706 . 0 0 "[ . 1 . 2]" 1 1815 1 127 LEU H 1 128 GLU HG2 5.250 . 5.250 4.892 4.370 5.336 0.086 7 0 "[ . 1 . 2]" 1 1816 1 126 LEU HB2 1 127 LEU H 3.560 . 3.560 2.592 2.441 2.874 . 0 0 "[ . 1 . 2]" 1 1817 1 127 LEU H 1 127 LEU HB3 3.760 . 3.760 2.621 2.553 2.725 . 0 0 "[ . 1 . 2]" 1 1818 1 126 LEU HG 1 127 LEU H 5.510 . 5.510 4.392 4.224 5.167 . 0 0 "[ . 1 . 2]" 1 1819 1 127 LEU H 1 128 GLU HB2 5.750 . 5.750 4.555 4.310 4.801 . 0 0 "[ . 1 . 2]" 1 1820 1 127 LEU H 1 127 LEU HB2 3.640 . 3.640 2.434 2.361 2.507 . 0 0 "[ . 1 . 2]" 1 1821 1 125 PRO HG2 1 127 LEU H 5.600 . 5.600 5.129 5.018 5.266 . 0 0 "[ . 1 . 2]" 1 1822 1 127 LEU H 1 129 ALA MB 5.750 . 5.750 5.252 5.189 5.333 . 0 0 "[ . 1 . 2]" 1 1823 1 126 LEU HB3 1 127 LEU H 3.920 . 3.920 3.561 3.130 3.743 . 0 0 "[ . 1 . 2]" 1 1824 1 27 ARG H 1 36 LEU H 5.290 . 5.290 4.946 3.889 5.316 0.026 5 0 "[ . 1 . 2]" 1 1825 1 36 LEU H 1 37 TRP H 4.840 . 4.840 4.579 4.429 4.616 . 0 0 "[ . 1 . 2]" 1 1826 1 35 GLY HA3 1 36 LEU H 3.810 . 3.810 2.989 2.900 3.100 . 0 0 "[ . 1 . 2]" 1 1827 1 35 GLY HA2 1 36 LEU H 3.810 . 3.810 3.465 3.309 3.549 . 0 0 "[ . 1 . 2]" 1 1828 1 36 LEU H 1 36 LEU HB2 4.000 . 4.000 2.430 2.206 2.685 . 0 0 "[ . 1 . 2]" 1 1829 1 36 LEU H 1 36 LEU MD1 4.370 . 4.370 2.613 1.786 3.486 0.014 5 0 "[ . 1 . 2]" 1 1830 1 36 LEU H 1 36 LEU MD2 4.370 . 4.370 3.190 1.759 3.988 0.041 10 0 "[ . 1 . 2]" 1 1831 1 136 ALA H 1 137 ARG HA 5.070 . 5.070 4.398 4.189 4.514 . 0 0 "[ . 1 . 2]" 1 1832 1 136 ALA H 1 136 ALA MB 2.820 . 2.820 2.314 2.272 2.376 . 0 0 "[ . 1 . 2]" 1 1833 1 101 HIS H 1 102 GLU HA 5.260 . 5.260 5.115 4.629 5.325 0.065 11 0 "[ . 1 . 2]" 1 1834 1 61 GLU HB3 1 101 HIS H 5.520 . 5.520 3.556 3.255 4.422 . 0 0 "[ . 1 . 2]" 1 1835 1 100 ALA H 1 101 HIS H 4.810 . 4.810 4.276 4.105 4.533 . 0 0 "[ . 1 . 2]" 1 1836 1 62 LEU HA 1 101 HIS H 5.430 . 5.430 4.066 3.671 4.675 . 0 0 "[ . 1 . 2]" 1 1837 1 100 ALA HA 1 101 HIS H 3.250 . 3.250 2.161 2.124 2.228 . 0 0 "[ . 1 . 2]" 1 1838 1 101 HIS H 1 101 HIS HB3 3.400 . 3.400 2.466 2.298 2.749 . 0 0 "[ . 1 . 2]" 1 1839 1 99 GLN HG3 1 101 HIS H 5.110 . 5.110 3.988 3.293 4.790 . 0 0 "[ . 1 . 2]" 1 1840 1 100 ALA MB 1 101 HIS H 3.670 . 3.670 3.314 2.933 3.519 . 0 0 "[ . 1 . 2]" 1 1841 1 21 LYS H 1 22 ILE H 4.740 . 4.740 4.466 4.416 4.504 . 0 0 "[ . 1 . 2]" 1 1842 1 18 ARG H 1 21 LYS H 3.690 . 3.690 2.976 2.762 3.263 . 0 0 "[ . 1 . 2]" 1 1843 1 20 GLY H 1 21 LYS H 3.550 . 3.550 2.257 1.945 2.431 . 0 0 "[ . 1 . 2]" 1 1844 1 21 LYS H 1 110 SER HA 5.240 . 5.240 4.852 4.583 5.165 . 0 0 "[ . 1 . 2]" 1 1845 1 18 ARG HA 1 21 LYS H 4.900 . 4.900 4.337 4.098 4.436 . 0 0 "[ . 1 . 2]" 1 1846 1 19 ASP HA 1 21 LYS H 5.140 . 5.140 4.469 4.293 4.621 . 0 0 "[ . 1 . 2]" 1 1847 1 20 GLY HA3 1 21 LYS H 3.810 . 3.810 3.323 3.255 3.372 . 0 0 "[ . 1 . 2]" 1 1848 1 19 ASP HB3 1 21 LYS H 5.520 . 5.520 4.317 2.470 4.867 . 0 0 "[ . 1 . 2]" 1 1849 1 19 ASP HB2 1 21 LYS H 4.580 . 4.580 3.518 3.109 4.118 . 0 0 "[ . 1 . 2]" 1 1850 1 21 LYS H 1 21 LYS HB2 3.460 . 3.460 2.719 2.627 2.873 . 0 0 "[ . 1 . 2]" 1 1851 1 21 LYS H 1 21 LYS HG3 3.490 . 3.490 3.256 2.629 3.631 0.141 9 0 "[ . 1 . 2]" 1 1852 1 21 LYS H 1 21 LYS HG2 3.920 . 3.920 2.882 2.418 3.404 . 0 0 "[ . 1 . 2]" 1 1853 1 18 ARG HB2 1 21 LYS H 5.750 . 5.750 5.427 5.186 5.612 . 0 0 "[ . 1 . 2]" 1 1854 1 21 LYS H 1 22 ILE HA 5.290 . 5.290 4.940 4.863 4.999 . 0 0 "[ . 1 . 2]" 1 1855 1 33 GLN HA 1 34 ALA H 3.370 . 3.370 2.477 2.135 3.454 0.084 15 0 "[ . 1 . 2]" 1 1856 1 33 GLN HG2 1 34 ALA H 5.260 . 5.260 4.821 4.135 5.328 0.068 4 0 "[ . 1 . 2]" 1 1857 1 34 ALA H 1 34 ALA MB 3.370 . 3.370 2.497 2.231 2.919 . 0 0 "[ . 1 . 2]" 1 1858 1 33 GLN H 1 34 ALA H 4.770 . 4.770 4.029 2.358 4.634 . 0 0 "[ . 1 . 2]" 1 1859 1 49 SER HB3 1 50 GLN H 4.200 . 4.200 3.173 2.358 3.869 . 0 0 "[ . 1 . 2]" 1 1860 1 50 GLN H 1 50 GLN HB2 3.810 . 3.810 2.502 2.374 2.633 . 0 0 "[ . 1 . 2]" 1 1861 1 49 SER HB2 1 50 GLN H 4.200 . 4.200 3.669 2.300 3.980 . 0 0 "[ . 1 . 2]" 1 1862 1 56 ARG H 1 57 GLU H 3.610 . 3.610 2.607 2.555 2.682 . 0 0 "[ . 1 . 2]" 1 1863 1 56 ARG H 1 58 LEU H 4.900 . 4.900 4.240 4.095 4.453 . 0 0 "[ . 1 . 2]" 1 1864 1 55 VAL HB 1 56 ARG H 4.170 . 4.170 2.647 2.520 2.775 . 0 0 "[ . 1 . 2]" 1 1865 1 56 ARG H 1 56 ARG HB3 3.390 . 3.390 2.692 2.565 2.831 . 0 0 "[ . 1 . 2]" 1 1866 1 56 ARG H 1 56 ARG HG3 3.800 . 3.800 2.268 1.931 2.905 . 0 0 "[ . 1 . 2]" 1 1867 1 130 PHE H 1 131 MET HB3 5.260 . 5.260 4.959 4.829 5.053 . 0 0 "[ . 1 . 2]" 1 1868 1 127 LEU MD2 1 130 PHE H 5.750 . 5.750 3.757 3.590 3.971 . 0 0 "[ . 1 . 2]" 1 1869 1 130 PHE H 1 131 MET H 3.490 . 3.490 2.507 2.428 2.577 . 0 0 "[ . 1 . 2]" 1 1870 1 130 PHE H 1 131 MET HA 5.560 . 5.560 5.121 5.046 5.181 . 0 0 "[ . 1 . 2]" 1 1871 1 130 PHE H 1 130 PHE HB2 3.420 . 3.420 2.599 2.481 2.685 . 0 0 "[ . 1 . 2]" 1 1872 1 130 PHE H 1 130 PHE HB3 3.410 . 3.410 2.506 2.428 2.600 . 0 0 "[ . 1 . 2]" 1 1873 1 130 PHE H 1 133 LEU HB2 5.460 . 5.460 4.867 4.610 5.173 . 0 0 "[ . 1 . 2]" 1 1874 1 129 ALA MB 1 130 PHE H 3.350 . 3.350 2.999 2.886 3.120 . 0 0 "[ . 1 . 2]" 1 1875 1 69 GLY H 1 92 PRO HD2 4.330 . 4.330 3.425 2.788 4.098 . 0 0 "[ . 1 . 2]" 1 1876 1 69 GLY H 1 92 PRO HD3 4.520 . 4.520 3.100 2.736 3.619 . 0 0 "[ . 1 . 2]" 1 1877 1 68 VAL HA 1 69 GLY H 3.170 . 3.170 2.202 2.162 2.235 . 0 0 "[ . 1 . 2]" 1 1878 1 68 VAL HB 1 69 GLY H 4.600 . 4.600 4.125 3.959 4.264 . 0 0 "[ . 1 . 2]" 1 1879 1 68 VAL MG1 1 69 GLY H 4.420 . 4.420 2.644 2.383 2.857 . 0 0 "[ . 1 . 2]" 1 1880 1 68 VAL MG2 1 69 GLY H 4.420 . 4.420 4.111 4.027 4.188 . 0 0 "[ . 1 . 2]" 1 1881 1 110 SER H 1 114 ALA MB 5.690 . 5.690 4.963 4.691 5.294 . 0 0 "[ . 1 . 2]" 1 1882 1 110 SER H 1 114 ALA H 5.250 . 5.250 4.523 4.163 4.776 . 0 0 "[ . 1 . 2]" 1 1883 1 21 LYS HA 1 110 SER H 4.600 . 4.600 4.116 3.778 4.405 . 0 0 "[ . 1 . 2]" 1 1884 1 110 SER H 1 110 SER HB3 3.740 . 3.740 3.451 2.605 3.592 . 0 0 "[ . 1 . 2]" 1 1885 1 110 SER H 1 110 SER HB2 3.740 . 3.740 2.675 2.405 3.561 . 0 0 "[ . 1 . 2]" 1 1886 1 109 CYS QB 1 110 SER H 3.390 . 3.390 2.546 2.447 2.723 . 0 0 "[ . 1 . 2]" 1 1887 1 110 SER H 1 113 GLU HG3 3.670 . 3.670 2.721 2.287 3.257 . 0 0 "[ . 1 . 2]" 1 1888 1 110 SER H 1 113 GLU HB2 3.810 . 3.810 2.537 2.247 2.828 . 0 0 "[ . 1 . 2]" 1 1889 1 21 LYS HD3 1 110 SER H 4.400 . 4.400 3.019 2.532 4.252 . 0 0 "[ . 1 . 2]" 1 1890 1 21 LYS HG2 1 110 SER H 5.130 . 5.130 4.719 3.959 5.227 0.097 17 0 "[ . 1 . 2]" 1 1891 1 131 MET H 1 133 LEU H 4.640 . 4.640 4.056 3.932 4.207 . 0 0 "[ . 1 . 2]" 1 1892 1 130 PHE H 1 133 LEU H 5.010 . 5.010 4.415 4.242 4.571 . 0 0 "[ . 1 . 2]" 1 1893 1 132 ALA H 1 133 LEU H 3.290 . 3.290 2.753 2.676 2.813 . 0 0 "[ . 1 . 2]" 1 1894 1 131 MET HA 1 133 LEU H 4.860 . 4.860 4.155 4.053 4.401 . 0 0 "[ . 1 . 2]" 1 1895 1 131 MET HG2 1 133 LEU H 5.180 . 5.180 5.155 5.039 5.234 0.054 18 0 "[ . 1 . 2]" 1 1896 1 131 MET HG3 1 133 LEU H 5.160 . 5.160 5.015 4.752 5.169 0.009 3 0 "[ . 1 . 2]" 1 1897 1 133 LEU H 1 133 LEU HB2 2.840 . 2.840 2.077 2.037 2.237 . 0 0 "[ . 1 . 2]" 1 1898 1 132 ALA MB 1 133 LEU H 3.180 . 3.180 2.532 2.382 2.592 . 0 0 "[ . 1 . 2]" 1 1899 1 110 SER H 1 113 GLU H 4.720 . 4.720 4.033 3.633 4.262 . 0 0 "[ . 1 . 2]" 1 1900 1 113 GLU H 1 114 ALA H 3.230 . 3.230 2.538 2.440 2.612 . 0 0 "[ . 1 . 2]" 1 1901 1 113 GLU H 1 115 LEU H 4.630 . 4.630 4.287 4.139 4.412 . 0 0 "[ . 1 . 2]" 1 1902 1 110 SER HB3 1 113 GLU H 4.890 . 4.890 3.966 2.920 4.817 . 0 0 "[ . 1 . 2]" 1 1903 1 113 GLU H 1 113 GLU HG2 3.020 . 3.020 2.267 1.949 3.079 0.059 13 0 "[ . 1 . 2]" 1 1904 1 113 GLU H 1 113 GLU HB2 3.350 . 3.350 2.497 2.272 2.650 . 0 0 "[ . 1 . 2]" 1 1905 1 112 GLU HB2 1 113 GLU H 4.210 . 4.210 3.802 3.610 3.961 . 0 0 "[ . 1 . 2]" 1 1906 1 113 GLU H 1 114 ALA MB 4.620 . 4.620 4.206 4.111 4.275 . 0 0 "[ . 1 . 2]" 1 1907 1 109 CYS QB 1 113 GLU H 5.340 . 5.340 4.489 4.122 4.724 . 0 0 "[ . 1 . 2]" 1 1908 1 82 ARG H 1 82 ARG HD2 5.250 . 5.250 4.359 4.130 5.219 . 0 0 "[ . 1 . 2]" 1 1909 1 78 GLU HG3 1 82 ARG H 4.810 . 4.810 4.693 4.276 4.853 0.043 1 0 "[ . 1 . 2]" 1 1910 1 12 VAL H 1 43 LYS H 5.340 . 5.340 4.841 4.392 5.063 . 0 0 "[ . 1 . 2]" 1 1911 1 11 VAL HA 1 43 LYS H 4.940 . 4.940 4.605 4.441 4.796 . 0 0 "[ . 1 . 2]" 1 1912 1 42 GLY HA3 1 43 LYS H 3.130 . 3.130 2.485 2.167 2.661 . 0 0 "[ . 1 . 2]" 1 1913 1 42 GLY HA2 1 43 LYS H 3.160 . 3.160 2.600 2.376 3.006 . 0 0 "[ . 1 . 2]" 1 1914 1 43 LYS H 1 43 LYS HB3 2.930 . 2.930 2.493 2.249 2.806 . 0 0 "[ . 1 . 2]" 1 1915 1 43 LYS H 1 43 LYS HG3 4.780 . 4.780 4.566 4.355 4.773 . 0 0 "[ . 1 . 2]" 1 1916 1 43 LYS H 1 43 LYS HG2 4.780 . 4.780 4.391 4.208 4.536 . 0 0 "[ . 1 . 2]" 1 1917 1 32 ASP H 1 33 GLN HA 5.630 . 5.630 5.048 4.566 5.665 0.035 16 0 "[ . 1 . 2]" 1 1918 1 45 GLU H 1 48 GLU H 4.600 . 4.600 4.235 3.899 4.457 . 0 0 "[ . 1 . 2]" 1 1919 1 47 ASP H 1 48 GLU H 3.100 . 3.100 2.254 2.008 2.673 . 0 0 "[ . 1 . 2]" 1 1920 1 44 VAL HA 1 48 GLU H 5.750 . 5.750 5.706 5.306 5.852 0.102 6 0 "[ . 1 . 2]" 1 1921 1 46 PRO HD2 1 48 GLU H 5.750 . 5.750 5.056 4.819 5.388 . 0 0 "[ . 1 . 2]" 1 1922 1 46 PRO HD3 1 48 GLU H 5.750 . 5.750 5.598 5.431 5.772 0.022 17 0 "[ . 1 . 2]" 1 1923 1 47 ASP HB3 1 48 GLU H 4.280 . 4.280 3.811 3.044 4.358 0.078 1 0 "[ . 1 . 2]" 1 1924 1 48 GLU H 1 48 GLU HG3 4.040 . 4.040 3.368 3.129 3.572 . 0 0 "[ . 1 . 2]" 1 1925 1 48 GLU H 1 48 GLU HG2 4.040 . 4.040 2.252 2.042 2.444 . 0 0 "[ . 1 . 2]" 1 1926 1 48 GLU H 1 48 GLU HB3 3.270 . 3.270 3.114 2.888 3.285 0.015 8 0 "[ . 1 . 2]" 1 1927 1 48 GLU H 1 53 ALA MB 5.560 . 5.560 5.349 5.069 5.597 0.037 8 0 "[ . 1 . 2]" 1 1928 1 22 ILE HB 1 109 CYS H 5.300 . 5.300 3.922 3.818 4.133 . 0 0 "[ . 1 . 2]" 1 1929 1 24 LEU H 1 109 CYS H 4.910 . 4.910 4.323 4.129 4.479 . 0 0 "[ . 1 . 2]" 1 1930 1 108 TRP H 1 109 CYS H 4.680 . 4.680 4.295 4.242 4.420 . 0 0 "[ . 1 . 2]" 1 1931 1 22 ILE HA 1 109 CYS H 5.660 . 5.660 4.732 4.605 4.939 . 0 0 "[ . 1 . 2]" 1 1932 1 21 LYS HA 1 109 CYS H 5.470 . 5.470 4.263 3.866 4.660 . 0 0 "[ . 1 . 2]" 1 1933 1 107 VAL HA 1 109 CYS H 5.750 . 5.750 5.762 5.662 5.825 0.075 13 0 "[ . 1 . 2]" 1 1934 1 108 TRP HB3 1 109 CYS H 4.890 . 4.890 3.738 3.497 4.225 . 0 0 "[ . 1 . 2]" 1 1935 1 108 TRP HB2 1 109 CYS H 4.890 . 4.890 4.095 3.289 4.495 . 0 0 "[ . 1 . 2]" 1 1936 1 21 LYS HB3 1 109 CYS H 3.980 . 3.980 2.989 2.885 3.212 . 0 0 "[ . 1 . 2]" 1 1937 1 21 LYS HD3 1 109 CYS H 5.030 . 5.030 4.223 3.754 4.634 . 0 0 "[ . 1 . 2]" 1 1938 1 109 CYS H 1 114 ALA MB 5.470 . 5.470 4.585 4.451 4.809 . 0 0 "[ . 1 . 2]" 1 1939 1 24 LEU HB2 1 109 CYS H 5.750 . 5.750 4.943 4.547 5.536 . 0 0 "[ . 1 . 2]" 1 1940 1 24 LEU HG 1 109 CYS H 5.750 . 5.750 5.446 4.116 5.868 0.118 4 0 "[ . 1 . 2]" 1 1941 1 22 ILE HG13 1 109 CYS H 5.160 . 5.160 4.932 4.780 5.154 . 0 0 "[ . 1 . 2]" 1 1942 1 80 SER H 1 82 ARG H 5.240 . 5.240 4.148 3.934 4.305 . 0 0 "[ . 1 . 2]" 1 1943 1 79 VAL H 1 82 ARG H 3.400 . 3.400 3.015 2.662 3.195 . 0 0 "[ . 1 . 2]" 1 1944 1 78 GLU HA 1 82 ARG H 4.890 . 4.890 4.610 4.101 4.862 . 0 0 "[ . 1 . 2]" 1 1945 1 82 ARG H 1 83 ILE HA 5.480 . 5.480 5.011 4.635 5.109 . 0 0 "[ . 1 . 2]" 1 1946 1 79 VAL HA 1 82 ARG H 5.020 . 5.020 4.641 4.430 4.799 . 0 0 "[ . 1 . 2]" 1 1947 1 81 GLY HA3 1 82 ARG H 3.780 . 3.780 3.145 3.041 3.422 . 0 0 "[ . 1 . 2]" 1 1948 1 80 SER HA 1 82 ARG H 5.170 . 5.170 4.226 4.134 4.364 . 0 0 "[ . 1 . 2]" 1 1949 1 82 ARG H 1 82 ARG HB2 3.180 . 3.180 2.571 2.404 2.758 . 0 0 "[ . 1 . 2]" 1 1950 1 82 ARG H 1 82 ARG HG3 3.530 . 3.530 2.588 2.278 3.213 . 0 0 "[ . 1 . 2]" 1 1951 1 79 VAL MG1 1 82 ARG H 5.710 . 5.710 3.270 3.012 3.516 . 0 0 "[ . 1 . 2]" 1 1952 1 79 VAL MG2 1 82 ARG H 5.710 . 5.710 4.421 4.156 4.710 . 0 0 "[ . 1 . 2]" 1 1953 1 105 ALA H 1 106 LEU H 4.690 . 4.690 4.489 4.415 4.577 . 0 0 "[ . 1 . 2]" 1 1954 1 25 ALA HA 1 106 LEU H 5.590 . 5.590 4.857 4.675 4.982 . 0 0 "[ . 1 . 2]" 1 1955 1 106 LEU H 1 106 LEU HB3 3.880 . 3.880 3.549 3.164 3.830 . 0 0 "[ . 1 . 2]" 1 1956 1 105 ALA MB 1 106 LEU H 3.290 . 3.290 2.476 2.242 2.692 . 0 0 "[ . 1 . 2]" 1 1957 1 106 LEU H 1 106 LEU HB2 3.880 . 3.880 2.608 2.477 2.753 . 0 0 "[ . 1 . 2]" 1 1958 1 25 ALA MB 1 106 LEU H 5.750 . 5.750 5.496 5.223 5.650 . 0 0 "[ . 1 . 2]" 1 1959 1 33 GLN H 1 33 GLN HG2 4.830 . 4.830 2.674 1.748 3.913 0.052 19 0 "[ . 1 . 2]" 1 1960 1 33 GLN H 1 33 GLN HG3 4.810 . 4.810 2.694 1.926 4.453 . 0 0 "[ . 1 . 2]" 1 1961 1 67 THR H 1 68 VAL H 4.380 . 4.380 4.168 4.033 4.415 0.035 17 0 "[ . 1 . 2]" 1 1962 1 67 THR H 1 94 PHE HA 3.900 . 3.900 3.068 2.716 3.361 . 0 0 "[ . 1 . 2]" 1 1963 1 67 THR H 1 93 ASP HA 5.520 . 5.520 5.044 4.811 5.326 . 0 0 "[ . 1 . 2]" 1 1964 1 67 THR H 1 94 PHE HB3 5.080 . 5.080 3.872 3.571 4.299 . 0 0 "[ . 1 . 2]" 1 1965 1 67 THR H 1 93 ASP HB3 4.840 . 4.840 3.987 3.364 4.464 . 0 0 "[ . 1 . 2]" 1 1966 1 66 ALA MB 1 67 THR H 3.520 . 3.520 2.583 2.447 2.706 . 0 0 "[ . 1 . 2]" 1 1967 1 67 THR H 1 67 THR MG 4.130 . 4.130 3.769 2.244 3.884 . 0 0 "[ . 1 . 2]" 1 1968 1 60 GLU H 1 61 GLU H 3.640 . 3.640 2.409 2.330 2.566 . 0 0 "[ . 1 . 2]" 1 1969 1 58 LEU H 1 60 GLU H 4.870 . 4.870 4.025 3.983 4.131 . 0 0 "[ . 1 . 2]" 1 1970 1 60 GLU H 1 62 LEU H 4.750 . 4.750 3.966 3.839 4.066 . 0 0 "[ . 1 . 2]" 1 1971 1 60 GLU H 1 61 GLU HA 5.600 . 5.600 5.068 4.996 5.191 . 0 0 "[ . 1 . 2]" 1 1972 1 59 ARG HD3 1 60 GLU H 5.510 . 5.510 5.118 4.848 5.346 . 0 0 "[ . 1 . 2]" 1 1973 1 60 GLU H 1 60 GLU HG3 3.630 . 3.630 2.497 2.175 3.409 . 0 0 "[ . 1 . 2]" 1 1974 1 60 GLU H 1 60 GLU HG2 3.710 . 3.710 3.176 2.241 3.356 . 0 0 "[ . 1 . 2]" 1 1975 1 60 GLU H 1 60 GLU HB2 3.120 . 3.120 2.540 2.420 2.593 . 0 0 "[ . 1 . 2]" 1 1976 1 59 ARG HG2 1 60 GLU H 4.260 . 4.260 3.774 3.614 3.918 . 0 0 "[ . 1 . 2]" 1 1977 1 26 GLN HB3 1 105 ALA H 4.770 . 4.770 2.155 1.782 2.649 0.018 1 0 "[ . 1 . 2]" 1 1978 1 26 GLN HB2 1 105 ALA H 4.770 . 4.770 3.605 3.019 3.985 . 0 0 "[ . 1 . 2]" 1 1979 1 127 LEU HB3 1 128 GLU H 3.580 . 3.580 2.687 2.639 2.727 . 0 0 "[ . 1 . 2]" 1 1980 1 127 LEU HB2 1 128 GLU H 4.300 . 4.300 3.814 3.696 3.867 . 0 0 "[ . 1 . 2]" 1 1981 1 127 LEU MD2 1 128 GLU H 4.730 . 4.730 4.463 4.351 4.542 . 0 0 "[ . 1 . 2]" 1 1982 1 120 ALA H 1 122 ALA H 5.480 . 5.480 4.937 4.656 5.304 . 0 0 "[ . 1 . 2]" 1 1983 1 122 ALA H 1 123 ASP H 3.300 . 3.300 2.169 2.059 2.312 . 0 0 "[ . 1 . 2]" 1 1984 1 122 ALA H 1 124 ILE H 4.490 . 4.490 3.831 3.604 4.054 . 0 0 "[ . 1 . 2]" 1 1985 1 126 LEU H 1 128 GLU H 4.610 . 4.610 3.836 3.725 3.970 . 0 0 "[ . 1 . 2]" 1 1986 1 122 ALA H 1 123 ASP HA 5.400 . 5.400 4.823 4.719 4.925 . 0 0 "[ . 1 . 2]" 1 1987 1 120 ALA HA 1 122 ALA H 4.530 . 4.530 4.148 3.918 4.532 0.002 16 0 "[ . 1 . 2]" 1 1988 1 122 ALA H 1 123 ASP HB2 5.170 . 5.170 4.296 4.107 4.472 . 0 0 "[ . 1 . 2]" 1 1989 1 128 GLU H 1 128 GLU HG2 3.370 . 3.370 2.727 2.244 3.164 . 0 0 "[ . 1 . 2]" 1 1990 1 121 PRO HG2 1 122 ALA H 3.520 . 3.520 2.956 2.649 3.194 . 0 0 "[ . 1 . 2]" 1 1991 1 128 GLU H 1 128 GLU HG3 3.980 . 3.980 3.023 2.051 3.735 . 0 0 "[ . 1 . 2]" 1 1992 1 128 GLU H 1 128 GLU HB2 3.600 . 3.600 2.443 2.197 2.660 . 0 0 "[ . 1 . 2]" 1 1993 1 115 LEU HG 1 128 GLU H 4.750 . 4.750 4.282 4.004 4.839 0.089 6 0 "[ . 1 . 2]" 1 1994 1 127 LEU HG 1 128 GLU H 5.080 . 5.080 5.068 5.008 5.109 0.029 19 0 "[ . 1 . 2]" 1 1995 1 120 ALA MB 1 122 ALA H 3.030 . 3.030 2.710 2.497 3.028 . 0 0 "[ . 1 . 2]" 1 1996 1 122 ALA H 1 122 ALA MB 3.280 . 3.280 2.316 2.284 2.349 . 0 0 "[ . 1 . 2]" 1 1997 1 115 LEU MD1 1 128 GLU H 4.590 . 4.590 4.467 3.208 4.744 0.154 10 0 "[ . 1 . 2]" 1 1998 1 127 LEU MD1 1 128 GLU H 4.730 . 4.730 3.508 3.370 3.644 . 0 0 "[ . 1 . 2]" 1 1999 1 77 ARG HD2 1 122 ALA H 5.750 . 5.750 4.836 3.634 5.642 . 0 0 "[ . 1 . 2]" 1 2000 1 77 ARG HD3 1 122 ALA H 5.750 . 5.750 4.363 3.044 5.488 . 0 0 "[ . 1 . 2]" 1 2001 1 57 GLU H 1 60 GLU H 5.520 . 5.520 4.738 4.580 4.921 . 0 0 "[ . 1 . 2]" 1 2002 1 55 VAL H 1 57 GLU H 4.920 . 4.920 4.244 4.197 4.327 . 0 0 "[ . 1 . 2]" 1 2003 1 56 ARG HG3 1 57 GLU H 4.020 . 4.020 2.097 1.771 2.368 0.029 4 0 "[ . 1 . 2]" 1 2004 1 55 VAL MG1 1 57 GLU H 5.750 . 5.750 5.045 4.945 5.100 . 0 0 "[ . 1 . 2]" 1 2005 1 57 GLU H 1 58 LEU MD1 5.750 . 5.750 5.513 3.993 5.749 . 0 0 "[ . 1 . 2]" 1 2006 1 57 GLU H 1 58 LEU MD2 5.750 . 5.750 5.025 4.828 5.830 0.080 13 0 "[ . 1 . 2]" 1 2007 1 39 PHE H 1 39 PHE HB3 4.220 . 4.220 3.624 3.581 3.654 . 0 0 "[ . 1 . 2]" 1 2008 1 39 PHE H 1 39 PHE HB2 4.220 . 4.220 2.430 2.315 2.492 . 0 0 "[ . 1 . 2]" 1 2009 1 38 GLU HB3 1 39 PHE H 4.100 . 4.100 3.606 2.373 3.951 . 0 0 "[ . 1 . 2]" 1 2010 1 38 GLU HB2 1 39 PHE H 4.100 . 4.100 2.574 2.125 3.656 . 0 0 "[ . 1 . 2]" 1 2011 1 39 PHE H 1 120 ALA MB 5.340 . 5.340 4.724 4.354 5.090 . 0 0 "[ . 1 . 2]" 1 2012 1 13 ALA MB 1 39 PHE H 5.290 . 5.290 4.469 4.068 4.837 . 0 0 "[ . 1 . 2]" 1 2013 1 132 ALA H 1 134 ARG H 4.830 . 4.830 4.223 4.145 4.325 . 0 0 "[ . 1 . 2]" 1 2014 1 134 ARG H 1 137 ARG H 5.270 . 5.270 4.481 4.199 4.694 . 0 0 "[ . 1 . 2]" 1 2015 1 133 LEU HB3 1 134 ARG H 3.210 . 3.210 3.105 2.891 3.316 0.106 18 0 "[ . 1 . 2]" 1 2016 1 133 LEU MD1 1 134 ARG H 5.580 . 5.580 4.544 4.426 4.663 . 0 0 "[ . 1 . 2]" 1 2017 1 133 LEU MD2 1 134 ARG H 5.580 . 5.580 4.762 4.332 4.962 . 0 0 "[ . 1 . 2]" 1 2018 1 50 GLN H 1 52 GLN H 5.390 . 5.390 3.892 3.672 4.118 . 0 0 "[ . 1 . 2]" 1 2019 1 52 GLN H 1 53 ALA H 3.400 . 3.400 2.509 2.432 2.570 . 0 0 "[ . 1 . 2]" 1 2020 1 52 GLN H 1 54 LEU H 4.520 . 4.520 4.121 4.002 4.286 . 0 0 "[ . 1 . 2]" 1 2021 1 51 ARG H 1 52 GLN H 3.610 . 3.610 2.541 2.411 2.688 . 0 0 "[ . 1 . 2]" 1 2022 1 52 GLN H 1 53 ALA HA 5.750 . 5.750 5.139 5.062 5.195 . 0 0 "[ . 1 . 2]" 1 2023 1 50 GLN HA 1 52 GLN H 5.300 . 5.300 4.218 4.032 4.409 . 0 0 "[ . 1 . 2]" 1 2024 1 52 GLN H 1 52 GLN HB3 3.530 . 3.530 2.384 2.254 2.526 . 0 0 "[ . 1 . 2]" 1 2025 1 51 ARG HB3 1 52 GLN H 4.590 . 4.590 3.872 3.728 4.012 . 0 0 "[ . 1 . 2]" 1 2026 1 51 ARG HB2 1 52 GLN H 4.590 . 4.590 2.768 2.539 2.991 . 0 0 "[ . 1 . 2]" 1 2027 1 12 VAL H 1 13 ALA H 5.420 . 5.420 4.455 4.408 4.506 . 0 0 "[ . 1 . 2]" 1 2028 1 12 VAL H 1 13 ALA HA 5.490 . 5.490 5.021 4.943 5.090 . 0 0 "[ . 1 . 2]" 1 2029 1 12 VAL H 1 12 VAL HB 4.310 . 4.310 3.648 3.599 3.684 . 0 0 "[ . 1 . 2]" 1 2030 1 12 VAL H 1 44 VAL HB 5.750 . 5.750 5.317 5.151 5.579 . 0 0 "[ . 1 . 2]" 1 2031 1 11 VAL HB 1 12 VAL H 4.190 . 4.190 4.165 4.028 4.251 0.061 17 0 "[ . 1 . 2]" 1 2032 1 12 VAL H 1 53 ALA MB 5.750 . 5.750 4.431 4.229 4.818 . 0 0 "[ . 1 . 2]" 1 2033 1 12 VAL H 1 54 LEU HG 5.750 . 5.750 4.955 4.745 5.209 . 0 0 "[ . 1 . 2]" 1 2034 1 12 VAL H 1 86 LEU HG 5.750 . 5.750 5.320 5.096 5.524 . 0 0 "[ . 1 . 2]" 1 2035 1 12 VAL H 1 12 VAL MG1 3.900 . 3.900 2.994 2.871 3.177 . 0 0 "[ . 1 . 2]" 1 2036 1 12 VAL H 1 12 VAL MG2 3.900 . 3.900 1.879 1.800 1.974 . 0 0 "[ . 1 . 2]" 1 2037 1 27 ARG H 1 38 GLU H 5.040 . 5.040 3.884 3.347 4.880 . 0 0 "[ . 1 . 2]" 1 2038 1 38 GLU H 1 39 PHE H 4.970 . 4.970 4.399 4.329 4.445 . 0 0 "[ . 1 . 2]" 1 2039 1 25 ALA HA 1 38 GLU H 5.530 . 5.530 4.653 4.420 4.998 . 0 0 "[ . 1 . 2]" 1 2040 1 38 GLU H 1 39 PHE HA 5.750 . 5.750 4.791 4.567 4.913 . 0 0 "[ . 1 . 2]" 1 2041 1 24 LEU HA 1 38 GLU H 4.460 . 4.460 4.287 3.796 4.525 0.065 7 0 "[ . 1 . 2]" 1 2042 1 26 GLN HA 1 38 GLU H 4.740 . 4.740 3.704 3.126 4.366 . 0 0 "[ . 1 . 2]" 1 2043 1 37 TRP HB3 1 38 GLU H 4.040 . 4.040 2.808 2.636 2.968 . 0 0 "[ . 1 . 2]" 1 2044 1 24 LEU HB3 1 38 GLU H 5.090 . 5.090 3.827 3.340 4.105 . 0 0 "[ . 1 . 2]" 1 2045 1 24 LEU HB2 1 38 GLU H 5.650 . 5.650 5.497 5.038 5.712 0.062 17 0 "[ . 1 . 2]" 1 2046 1 24 LEU HG 1 38 GLU H 5.750 . 5.750 5.333 4.672 5.931 0.181 2 0 "[ . 1 . 2]" 1 2047 1 25 ALA MB 1 38 GLU H 5.030 . 5.030 3.651 3.422 3.999 . 0 0 "[ . 1 . 2]" 1 2048 1 40 ALA MB 1 58 LEU H 5.750 . 5.750 5.552 5.181 5.775 0.025 20 0 "[ . 1 . 2]" 1 2049 1 58 LEU H 1 66 ALA MB 5.750 . 5.750 4.810 4.565 5.170 . 0 0 "[ . 1 . 2]" 1 2050 1 57 GLU H 1 58 LEU H 3.710 . 3.710 2.832 2.780 2.936 . 0 0 "[ . 1 . 2]" 1 2051 1 14 ALA MB 1 58 LEU H 5.680 . 5.680 5.081 4.831 5.260 . 0 0 "[ . 1 . 2]" 1 2052 1 129 ALA MB 1 131 MET H 5.750 . 5.750 4.829 4.742 4.908 . 0 0 "[ . 1 . 2]" 1 2053 1 58 LEU H 1 58 LEU HB3 4.050 . 4.050 3.631 3.538 3.653 . 0 0 "[ . 1 . 2]" 1 2054 1 131 MET H 1 132 ALA H 3.380 . 3.380 2.615 2.548 2.660 . 0 0 "[ . 1 . 2]" 1 2055 1 130 PHE HB2 1 131 MET H 3.900 . 3.900 3.749 3.669 3.791 . 0 0 "[ . 1 . 2]" 1 2056 1 130 PHE HB3 1 131 MET H 4.090 . 4.090 2.410 2.353 2.457 . 0 0 "[ . 1 . 2]" 1 2057 1 131 MET H 1 131 MET HB3 3.510 . 3.510 2.547 2.444 2.598 . 0 0 "[ . 1 . 2]" 1 2058 1 131 MET H 1 131 MET HB2 3.920 . 3.920 3.618 3.604 3.631 . 0 0 "[ . 1 . 2]" 1 2059 1 111 PRO HB2 1 131 MET H 5.190 . 5.190 4.489 3.925 5.112 . 0 0 "[ . 1 . 2]" 1 2060 1 131 MET H 1 131 MET HG2 3.510 . 3.510 2.245 2.134 2.479 . 0 0 "[ . 1 . 2]" 1 2061 1 131 MET H 1 131 MET HG3 3.890 . 3.890 3.398 3.312 3.481 . 0 0 "[ . 1 . 2]" 1 2062 1 127 LEU HG 1 131 MET H 5.750 . 5.750 5.709 5.633 5.779 0.029 3 0 "[ . 1 . 2]" 1 2063 1 131 MET H 1 133 LEU HB2 5.750 . 5.750 5.047 4.900 5.295 . 0 0 "[ . 1 . 2]" 1 2064 1 94 PHE H 1 95 HIS H 4.770 . 4.770 4.297 4.222 4.410 . 0 0 "[ . 1 . 2]" 1 2065 1 65 GLU HG2 1 95 HIS H 5.750 . 5.750 5.570 4.366 5.873 0.123 19 0 "[ . 1 . 2]" 1 2066 1 65 GLU HG3 1 95 HIS H 5.750 . 5.750 4.944 4.595 5.365 . 0 0 "[ . 1 . 2]" 1 2067 1 65 GLU HB3 1 95 HIS H 5.020 . 5.020 4.286 4.059 4.938 . 0 0 "[ . 1 . 2]" 1 2068 1 66 ALA MB 1 95 HIS H 5.200 . 5.200 4.544 4.222 4.749 . 0 0 "[ . 1 . 2]" 1 2069 1 64 ILE HG13 1 95 HIS H 5.590 . 5.590 5.041 4.518 5.287 . 0 0 "[ . 1 . 2]" 1 2070 1 53 ALA H 1 55 VAL H 4.780 . 4.780 4.159 4.042 4.227 . 0 0 "[ . 1 . 2]" 1 2071 1 54 LEU H 1 55 VAL H 3.540 . 3.540 2.686 2.616 2.736 . 0 0 "[ . 1 . 2]" 1 2072 1 55 VAL H 1 56 ARG H 3.450 . 3.450 2.766 2.715 2.831 . 0 0 "[ . 1 . 2]" 1 2073 1 53 ALA HA 1 55 VAL H 5.270 . 5.270 4.509 4.319 4.620 . 0 0 "[ . 1 . 2]" 1 2074 1 55 VAL H 1 55 VAL HB 3.130 . 3.130 2.438 2.363 2.508 . 0 0 "[ . 1 . 2]" 1 2075 1 55 VAL H 1 56 ARG HB3 5.440 . 5.440 5.328 5.175 5.445 0.005 3 0 "[ . 1 . 2]" 1 2076 1 54 LEU HB3 1 55 VAL H 3.600 . 3.600 3.336 3.234 3.430 . 0 0 "[ . 1 . 2]" 1 2077 1 54 LEU HB2 1 55 VAL H 3.650 . 3.650 2.587 2.477 2.697 . 0 0 "[ . 1 . 2]" 1 2078 1 55 VAL H 1 66 ALA MB 5.750 . 5.750 4.599 4.127 4.872 . 0 0 "[ . 1 . 2]" 1 2079 1 55 VAL H 1 55 VAL MG1 4.090 . 4.090 3.750 3.725 3.766 . 0 0 "[ . 1 . 2]" 1 2080 1 55 VAL H 1 55 VAL MG2 4.090 . 4.090 2.241 2.109 2.380 . 0 0 "[ . 1 . 2]" 1 2081 1 55 VAL H 1 58 LEU MD1 5.750 . 5.750 4.791 4.496 4.940 . 0 0 "[ . 1 . 2]" 1 2082 1 55 VAL H 1 58 LEU MD2 5.750 . 5.750 5.755 5.144 5.856 0.106 4 0 "[ . 1 . 2]" 1 2083 1 54 LEU H 1 57 GLU H 5.190 . 5.190 4.743 4.644 4.939 . 0 0 "[ . 1 . 2]" 1 2084 1 53 ALA H 1 54 LEU H 3.500 . 3.500 2.771 2.695 2.832 . 0 0 "[ . 1 . 2]" 1 2085 1 52 GLN HB3 1 54 LEU H 5.750 . 5.750 5.146 5.009 5.329 . 0 0 "[ . 1 . 2]" 1 2086 1 54 LEU H 1 55 VAL HB 5.750 . 5.750 4.805 4.693 4.905 . 0 0 "[ . 1 . 2]" 1 2087 1 53 ALA MB 1 54 LEU H 3.260 . 3.260 2.452 2.357 2.511 . 0 0 "[ . 1 . 2]" 1 2088 1 54 LEU H 1 54 LEU HB2 3.200 . 3.200 2.314 2.243 2.351 . 0 0 "[ . 1 . 2]" 1 2089 1 12 VAL MG1 1 54 LEU H 4.670 . 4.670 3.944 3.717 4.153 . 0 0 "[ . 1 . 2]" 1 2090 1 12 VAL MG2 1 54 LEU H 4.670 . 4.670 2.787 2.684 3.078 . 0 0 "[ . 1 . 2]" 1 2091 1 54 LEU H 1 54 LEU MD1 5.070 . 5.070 3.674 3.318 3.825 . 0 0 "[ . 1 . 2]" 1 2092 1 54 LEU H 1 54 LEU MD2 5.070 . 5.070 3.607 3.463 3.836 . 0 0 "[ . 1 . 2]" 1 2093 1 64 ILE HA 1 95 HIS H 5.210 . 5.210 4.576 3.856 4.828 . 0 0 "[ . 1 . 2]" 1 2094 1 66 ALA HA 1 95 HIS H 4.090 . 4.090 3.272 3.033 3.518 . 0 0 "[ . 1 . 2]" 1 2095 1 95 HIS H 1 95 HIS HB3 4.040 . 4.040 2.939 2.313 3.740 . 0 0 "[ . 1 . 2]" 1 2096 1 95 HIS H 1 95 HIS HB2 4.040 . 4.040 2.761 2.447 3.121 . 0 0 "[ . 1 . 2]" 1 2097 1 94 PHE HB2 1 95 HIS H 3.660 . 3.660 2.950 2.230 3.197 . 0 0 "[ . 1 . 2]" 1 2098 1 64 ILE HB 1 95 HIS H 4.130 . 4.130 3.444 2.718 3.667 . 0 0 "[ . 1 . 2]" 1 2099 1 65 GLU HB2 1 95 HIS H 5.020 . 5.020 3.089 2.763 3.606 . 0 0 "[ . 1 . 2]" 1 2100 1 64 ILE MG 1 95 HIS H 5.010 . 5.010 4.602 3.953 4.811 . 0 0 "[ . 1 . 2]" 1 2101 1 64 ILE MD 1 95 HIS H 4.690 . 4.690 4.543 4.039 4.734 0.044 16 0 "[ . 1 . 2]" 1 2102 1 26 GLN H 1 104 GLN H 4.390 . 4.390 4.076 3.868 4.440 0.050 10 0 "[ . 1 . 2]" 1 2103 1 103 HIS H 1 104 GLN H 4.980 . 4.980 4.544 4.184 4.647 . 0 0 "[ . 1 . 2]" 1 2104 1 104 GLN H 1 105 ALA H 3.650 . 3.650 2.642 2.351 2.861 . 0 0 "[ . 1 . 2]" 1 2105 1 103 HIS HA 1 104 GLN H 3.300 . 3.300 2.453 2.222 2.688 . 0 0 "[ . 1 . 2]" 1 2106 1 103 HIS HB3 1 104 GLN H 4.330 . 4.330 2.556 2.056 3.651 . 0 0 "[ . 1 . 2]" 1 2107 1 103 HIS HB2 1 104 GLN H 4.330 . 4.330 3.654 3.244 4.270 . 0 0 "[ . 1 . 2]" 1 2108 1 104 GLN H 1 104 GLN HB3 3.920 . 3.920 2.560 2.432 2.669 . 0 0 "[ . 1 . 2]" 1 2109 1 104 GLN H 1 105 ALA MB 4.970 . 4.970 4.648 4.355 4.836 . 0 0 "[ . 1 . 2]" 1 2110 1 100 ALA MB 1 104 GLN H 5.140 . 5.140 3.846 3.294 4.468 . 0 0 "[ . 1 . 2]" 1 2111 1 25 ALA MB 1 104 GLN H 5.250 . 5.250 4.181 3.787 4.604 . 0 0 "[ . 1 . 2]" 1 2112 1 27 ARG HA 1 104 GLN H 5.750 . 5.750 4.396 4.047 4.957 . 0 0 "[ . 1 . 2]" 1 2113 1 48 GLU H 1 49 SER H 4.960 . 4.960 4.464 4.411 4.546 . 0 0 "[ . 1 . 2]" 1 2114 1 49 SER H 1 53 ALA MB 5.260 . 5.260 4.586 4.267 4.887 . 0 0 "[ . 1 . 2]" 1 2115 1 49 SER H 1 50 GLN H 4.980 . 4.980 4.569 4.524 4.603 . 0 0 "[ . 1 . 2]" 1 2116 1 49 SER H 1 52 GLN H 4.360 . 4.360 3.933 3.757 4.152 . 0 0 "[ . 1 . 2]" 1 2117 1 48 GLU HA 1 49 SER H 2.880 . 2.880 2.398 2.275 2.530 . 0 0 "[ . 1 . 2]" 1 2118 1 49 SER H 1 49 SER HB3 4.100 . 4.100 2.989 2.396 3.646 . 0 0 "[ . 1 . 2]" 1 2119 1 49 SER H 1 49 SER HB2 4.100 . 4.100 2.696 2.469 3.565 . 0 0 "[ . 1 . 2]" 1 2120 1 48 GLU HB2 1 49 SER H 3.700 . 3.700 2.446 2.144 2.815 . 0 0 "[ . 1 . 2]" 1 2121 1 49 SER H 1 52 GLN HB3 3.820 . 3.820 2.154 2.020 2.341 . 0 0 "[ . 1 . 2]" 1 2122 1 96 GLY H 1 97 THR H 4.890 . 4.890 4.501 4.457 4.552 . 0 0 "[ . 1 . 2]" 1 2123 1 96 GLY HA3 1 97 THR H 3.250 . 3.250 2.381 2.305 2.435 . 0 0 "[ . 1 . 2]" 1 2124 1 97 THR H 1 97 THR HB 3.090 . 3.090 2.714 2.649 2.845 . 0 0 "[ . 1 . 2]" 1 2125 1 96 GLY HA2 1 97 THR H 3.250 . 3.250 2.790 2.709 2.874 . 0 0 "[ . 1 . 2]" 1 2126 1 64 ILE HB 1 97 THR H 5.200 . 5.200 5.181 4.961 5.259 0.059 3 0 "[ . 1 . 2]" 1 2127 1 97 THR H 1 97 THR MG 4.350 . 4.350 3.886 3.858 3.938 . 0 0 "[ . 1 . 2]" 1 2128 1 64 ILE MG 1 97 THR H 4.150 . 4.150 2.865 2.609 3.051 . 0 0 "[ . 1 . 2]" 1 2129 1 101 HIS H 1 103 HIS H 4.230 . 4.230 3.292 2.858 3.757 . 0 0 "[ . 1 . 2]" 1 2130 1 100 ALA HA 1 103 HIS H 4.270 . 4.270 3.984 3.584 4.279 0.009 20 0 "[ . 1 . 2]" 1 2131 1 103 HIS H 1 103 HIS HB3 4.020 . 4.020 3.667 3.565 3.819 . 0 0 "[ . 1 . 2]" 1 2132 1 103 HIS H 1 103 HIS HB2 4.020 . 4.020 2.529 2.358 2.756 . 0 0 "[ . 1 . 2]" 1 2133 1 102 GLU HG2 1 103 HIS H 5.750 . 5.750 4.715 3.796 5.244 . 0 0 "[ . 1 . 2]" 1 2134 1 102 GLU HG3 1 103 HIS H 5.750 . 5.750 4.974 2.071 5.841 0.091 11 0 "[ . 1 . 2]" 1 2135 1 102 GLU HB3 1 103 HIS H 4.380 . 4.380 3.643 2.612 4.257 . 0 0 "[ . 1 . 2]" 1 2136 1 100 ALA MB 1 103 HIS H 3.980 . 3.980 3.339 2.869 3.874 . 0 0 "[ . 1 . 2]" 1 2137 1 73 ALA H 1 89 TRP H 5.720 . 5.720 5.319 5.019 5.491 . 0 0 "[ . 1 . 2]" 1 2138 1 73 ALA H 1 74 SER H 4.720 . 4.720 4.391 4.370 4.420 . 0 0 "[ . 1 . 2]" 1 2139 1 72 VAL H 1 73 ALA H 3.400 . 3.400 2.714 2.650 2.772 . 0 0 "[ . 1 . 2]" 1 2140 1 73 ALA H 1 88 ALA HA 5.130 . 5.130 4.706 4.354 4.937 . 0 0 "[ . 1 . 2]" 1 2141 1 73 ALA H 1 87 HIS HA 5.750 . 5.750 5.133 4.895 5.335 . 0 0 "[ . 1 . 2]" 1 2142 1 73 ALA H 1 89 TRP HA 4.820 . 4.820 4.509 4.099 4.829 0.009 4 0 "[ . 1 . 2]" 1 2143 1 71 TYR HA 1 73 ALA H 5.180 . 5.180 4.746 4.609 4.926 . 0 0 "[ . 1 . 2]" 1 2144 1 72 VAL HB 1 73 ALA H 3.140 . 3.140 1.985 1.923 2.135 . 0 0 "[ . 1 . 2]" 1 2145 1 73 ALA H 1 73 ALA MB 3.520 . 3.520 2.747 2.594 2.828 . 0 0 "[ . 1 . 2]" 1 2146 1 73 ALA H 1 88 ALA MB 3.420 . 3.420 2.265 1.934 2.788 . 0 0 "[ . 1 . 2]" 1 2147 1 72 VAL MG2 1 73 ALA H 4.020 . 4.020 3.608 3.504 3.729 . 0 0 "[ . 1 . 2]" 1 2148 1 126 LEU H 1 127 LEU H 3.480 . 3.480 2.494 2.452 2.543 . 0 0 "[ . 1 . 2]" 1 2149 1 123 ASP H 1 126 LEU H 5.750 . 5.750 5.067 4.822 5.227 . 0 0 "[ . 1 . 2]" 1 2150 1 126 LEU H 1 127 LEU HA 5.700 . 5.700 5.135 5.103 5.173 . 0 0 "[ . 1 . 2]" 1 2151 1 125 PRO HD2 1 126 LEU H 3.970 . 3.970 3.079 2.905 3.235 . 0 0 "[ . 1 . 2]" 1 2152 1 125 PRO HD3 1 126 LEU H 4.660 . 4.660 4.086 3.988 4.186 . 0 0 "[ . 1 . 2]" 1 2153 1 126 LEU H 1 126 LEU HB2 3.510 . 3.510 2.415 2.127 2.501 . 0 0 "[ . 1 . 2]" 1 2154 1 126 LEU H 1 126 LEU HG 4.130 . 4.130 2.597 2.283 4.227 0.097 13 0 "[ . 1 . 2]" 1 2155 1 126 LEU H 1 127 LEU HB2 5.570 . 5.570 4.762 4.632 4.847 . 0 0 "[ . 1 . 2]" 1 2156 1 125 PRO HG2 1 126 LEU H 3.880 . 3.880 2.689 2.576 2.813 . 0 0 "[ . 1 . 2]" 1 2157 1 125 PRO HG3 1 126 LEU H 4.370 . 4.370 4.175 4.095 4.272 . 0 0 "[ . 1 . 2]" 1 2158 1 126 LEU H 1 126 LEU MD1 4.080 . 4.080 3.561 2.428 3.757 . 0 0 "[ . 1 . 2]" 1 2159 1 126 LEU H 1 126 LEU MD2 4.080 . 4.080 3.433 3.280 3.693 . 0 0 "[ . 1 . 2]" 1 2160 1 67 THR H 1 93 ASP H 4.290 . 4.290 3.582 3.345 3.713 . 0 0 "[ . 1 . 2]" 1 2161 1 92 PRO HD2 1 93 ASP H 3.730 . 3.730 2.545 2.185 3.032 . 0 0 "[ . 1 . 2]" 1 2162 1 93 ASP H 1 93 ASP HB2 3.790 . 3.790 3.359 3.211 3.479 . 0 0 "[ . 1 . 2]" 1 2163 1 93 ASP H 1 93 ASP HB3 3.790 . 3.790 2.961 2.711 3.228 . 0 0 "[ . 1 . 2]" 1 2164 1 92 PRO HB3 1 93 ASP H 4.640 . 4.640 4.286 4.122 4.457 . 0 0 "[ . 1 . 2]" 1 2165 1 92 PRO HB2 1 93 ASP H 3.910 . 3.910 3.628 3.309 3.939 0.029 1 0 "[ . 1 . 2]" 1 2166 1 92 PRO HG2 1 93 ASP H 3.950 . 3.950 2.761 2.391 3.282 . 0 0 "[ . 1 . 2]" 1 2167 1 66 ALA MB 1 93 ASP H 5.010 . 5.010 4.796 4.501 5.033 0.023 5 0 "[ . 1 . 2]" 1 2168 1 30 GLN H 1 31 SER H 4.510 . 4.510 2.323 1.891 2.636 . 0 0 "[ . 1 . 2]" 1 2169 1 30 GLN HG2 1 31 SER H 5.750 . 5.750 4.948 3.534 5.269 . 0 0 "[ . 1 . 2]" 1 2170 1 30 GLN HG3 1 31 SER H 5.750 . 5.750 4.410 2.548 4.787 . 0 0 "[ . 1 . 2]" 1 2171 1 50 GLN H 1 51 ARG H 4.120 . 4.120 2.782 2.591 2.941 . 0 0 "[ . 1 . 2]" 1 2172 1 29 ALA HA 1 31 SER H 5.050 . 5.050 4.310 3.837 4.718 . 0 0 "[ . 1 . 2]" 1 2173 1 61 GLU HG3 1 62 LEU H 5.050 . 5.050 4.741 2.045 5.144 0.094 4 0 "[ . 1 . 2]" 1 2174 1 40 ALA MB 1 62 LEU H 5.750 . 5.750 4.976 4.674 5.200 . 0 0 "[ . 1 . 2]" 1 2175 1 51 ARG H 1 51 ARG HG3 4.450 . 4.450 2.182 2.023 2.370 . 0 0 "[ . 1 . 2]" 1 2176 1 51 ARG H 1 51 ARG HG2 4.450 . 4.450 3.212 3.083 3.365 . 0 0 "[ . 1 . 2]" 1 2177 1 46 PRO HA 1 47 ASP H 3.690 . 3.690 3.337 3.159 3.524 . 0 0 "[ . 1 . 2]" 1 2178 1 47 ASP H 1 47 ASP HB3 4.140 . 4.140 3.062 2.410 3.708 . 0 0 "[ . 1 . 2]" 1 2179 1 46 PRO HG2 1 47 ASP H 5.160 . 5.160 3.325 2.598 4.424 . 0 0 "[ . 1 . 2]" 1 2180 1 47 ASP H 1 48 GLU HB3 5.670 . 5.670 4.591 4.299 5.020 . 0 0 "[ . 1 . 2]" 1 2181 1 62 LEU H 1 101 HIS H 5.750 . 5.750 5.222 5.025 5.662 . 0 0 "[ . 1 . 2]" 1 2182 1 59 ARG HA 1 62 LEU H 5.240 . 5.240 4.283 3.955 4.466 . 0 0 "[ . 1 . 2]" 1 2183 1 62 LEU H 1 63 GLY HA2 5.720 . 5.720 4.468 4.344 4.544 . 0 0 "[ . 1 . 2]" 1 2184 1 61 GLU HG2 1 62 LEU H 5.050 . 5.050 4.530 3.237 4.907 . 0 0 "[ . 1 . 2]" 1 2185 1 58 LEU HB2 1 62 LEU H 4.640 . 4.640 4.796 4.744 4.925 0.285 13 0 "[ . 1 . 2]" 1 2186 1 61 GLU HB3 1 62 LEU H 4.810 . 4.810 3.466 3.057 4.065 . 0 0 "[ . 1 . 2]" 1 2187 1 50 GLN HB2 1 51 ARG H 4.040 . 4.040 2.504 2.256 2.803 . 0 0 "[ . 1 . 2]" 1 2188 1 62 LEU H 1 62 LEU HB2 3.900 . 3.900 2.585 2.538 2.660 . 0 0 "[ . 1 . 2]" 1 2189 1 62 LEU H 1 62 LEU HG 3.790 . 3.790 2.566 2.420 2.810 . 0 0 "[ . 1 . 2]" 1 2190 1 62 LEU H 1 62 LEU MD2 4.350 . 4.350 3.355 3.213 3.487 . 0 0 "[ . 1 . 2]" 1 2191 1 62 LEU H 1 62 LEU MD1 4.350 . 4.350 3.880 3.777 4.038 . 0 0 "[ . 1 . 2]" 1 2192 1 30 GLN H 1 30 GLN HG2 5.220 . 5.220 3.465 1.954 4.057 . 0 0 "[ . 1 . 2]" 1 2193 1 30 GLN H 1 30 GLN HG3 5.220 . 5.220 2.623 2.259 3.033 . 0 0 "[ . 1 . 2]" 1 2194 1 28 PRO HG2 1 30 GLN H 5.060 . 5.060 4.824 4.186 5.117 0.057 2 0 "[ . 1 . 2]" 1 2195 1 29 ALA MB 1 30 GLN H 3.330 . 3.330 2.030 1.778 2.475 0.022 1 0 "[ . 1 . 2]" 1 2196 1 61 GLU H 1 62 LEU H 3.660 . 3.660 2.444 2.335 2.543 . 0 0 "[ . 1 . 2]" 1 2197 1 61 GLU H 1 63 GLY H 4.400 . 4.400 3.691 3.547 3.875 . 0 0 "[ . 1 . 2]" 1 2198 1 61 GLU H 1 61 GLU HG3 4.120 . 4.120 3.681 2.716 3.998 . 0 0 "[ . 1 . 2]" 1 2199 1 61 GLU H 1 61 GLU HB2 3.610 . 3.610 2.448 2.219 3.670 0.060 2 0 "[ . 1 . 2]" 1 2200 1 60 GLU HB2 1 61 GLU H 3.480 . 3.480 2.701 2.571 2.798 . 0 0 "[ . 1 . 2]" 1 2201 1 61 GLU H 1 61 GLU HB3 3.980 . 3.980 3.577 2.911 3.667 . 0 0 "[ . 1 . 2]" 1 2202 1 59 ARG HG2 1 61 GLU H 5.750 . 5.750 5.772 5.646 5.853 0.103 18 0 "[ . 1 . 2]" 1 2203 1 61 GLU H 1 62 LEU HG 4.780 . 4.780 4.281 4.097 4.423 . 0 0 "[ . 1 . 2]" 1 2204 1 61 GLU H 1 62 LEU HA 5.340 . 5.340 5.085 5.013 5.153 . 0 0 "[ . 1 . 2]" 1 2205 1 57 GLU HA 1 61 GLU H 4.640 . 4.640 3.902 3.743 4.053 . 0 0 "[ . 1 . 2]" 1 2206 1 61 GLU H 1 61 GLU HG2 4.120 . 4.120 2.952 2.372 3.758 . 0 0 "[ . 1 . 2]" 1 2207 1 60 GLU HG3 1 61 GLU H 4.960 . 4.960 4.271 4.090 4.782 . 0 0 "[ . 1 . 2]" 1 2208 1 113 GLU HA 1 116 GLN H 3.970 . 3.970 3.596 3.389 3.850 . 0 0 "[ . 1 . 2]" 1 2209 1 114 ALA HA 1 116 GLN H 4.580 . 4.580 3.899 3.817 4.029 . 0 0 "[ . 1 . 2]" 1 2210 1 116 GLN H 1 117 TYR HB2 4.680 . 4.680 4.285 4.157 4.430 . 0 0 "[ . 1 . 2]" 1 2211 1 116 GLN H 1 116 GLN HB3 3.940 . 3.940 3.603 3.571 3.651 . 0 0 "[ . 1 . 2]" 1 2212 1 116 GLN H 1 116 GLN HB2 3.280 . 3.280 2.443 2.345 2.529 . 0 0 "[ . 1 . 2]" 1 2213 1 115 LEU HB2 1 116 GLN H 3.930 . 3.930 3.755 3.383 3.904 . 0 0 "[ . 1 . 2]" 1 2214 1 67 THR H 1 94 PHE H 5.530 . 5.530 4.818 4.524 5.144 . 0 0 "[ . 1 . 2]" 1 2215 1 93 ASP H 1 94 PHE H 4.780 . 4.780 4.268 4.157 4.369 . 0 0 "[ . 1 . 2]" 1 2216 1 66 ALA HA 1 94 PHE H 4.880 . 4.880 4.728 4.526 4.895 0.015 8 0 "[ . 1 . 2]" 1 2217 1 94 PHE H 1 94 PHE HB3 4.160 . 4.160 3.402 3.279 3.676 . 0 0 "[ . 1 . 2]" 1 2218 1 94 PHE H 1 94 PHE HB2 4.250 . 4.250 3.905 3.828 3.938 . 0 0 "[ . 1 . 2]" 1 2219 1 93 ASP HB3 1 94 PHE H 3.880 . 3.880 3.866 3.184 4.088 0.208 19 0 "[ . 1 . 2]" 1 2220 1 110 SER HA 1 112 GLU H 5.160 . 5.160 4.627 4.088 4.912 . 0 0 "[ . 1 . 2]" 1 2221 1 112 GLU H 1 113 GLU H 3.410 . 3.410 2.552 2.168 2.653 . 0 0 "[ . 1 . 2]" 1 2222 1 111 PRO HD2 1 112 GLU H 3.470 . 3.470 3.373 3.096 3.508 0.038 19 0 "[ . 1 . 2]" 1 2223 1 111 PRO HG2 1 112 GLU H 3.690 . 3.690 2.745 2.398 3.752 0.062 6 0 "[ . 1 . 2]" 1 2224 1 111 PRO HB2 1 112 GLU H 3.600 . 3.600 2.690 2.255 3.486 . 0 0 "[ . 1 . 2]" 1 2225 1 112 GLU H 1 112 GLU HB3 3.130 . 3.130 2.721 2.563 2.968 . 0 0 "[ . 1 . 2]" 1 2226 1 112 GLU H 1 112 GLU HB2 3.980 . 3.980 3.613 3.569 3.742 . 0 0 "[ . 1 . 2]" 1 2227 1 112 GLU H 1 114 ALA MB 5.130 . 5.130 4.793 4.507 4.997 . 0 0 "[ . 1 . 2]" 1 2228 1 17 GLU HA 1 22 ILE H 5.540 . 5.540 4.531 4.406 4.790 . 0 0 "[ . 1 . 2]" 1 2229 1 22 ILE H 1 108 TRP HA 4.920 . 4.920 4.113 3.992 4.291 . 0 0 "[ . 1 . 2]" 1 2230 1 22 ILE H 1 109 CYS HA 5.130 . 5.130 4.328 4.171 4.475 . 0 0 "[ . 1 . 2]" 1 2231 1 22 ILE H 1 111 PRO HD3 4.890 . 4.890 4.086 3.729 4.383 . 0 0 "[ . 1 . 2]" 1 2232 1 22 ILE H 1 109 CYS QB 5.750 . 5.750 4.723 4.166 4.898 . 0 0 "[ . 1 . 2]" 1 2233 1 21 LYS HB2 1 22 ILE H 3.970 . 3.970 3.727 3.451 3.912 . 0 0 "[ . 1 . 2]" 1 2234 1 21 LYS HB3 1 22 ILE H 3.900 . 3.900 2.826 2.600 3.036 . 0 0 "[ . 1 . 2]" 1 2235 1 22 ILE H 1 22 ILE HG12 3.680 . 3.680 3.543 3.370 3.649 . 0 0 "[ . 1 . 2]" 1 2236 1 21 LYS HG2 1 22 ILE H 5.110 . 5.110 4.655 4.312 4.937 . 0 0 "[ . 1 . 2]" 1 2237 1 22 ILE H 1 22 ILE HG13 3.720 . 3.720 2.346 2.206 2.475 . 0 0 "[ . 1 . 2]" 1 2238 1 22 ILE H 1 22 ILE MG 4.140 . 4.140 3.845 3.820 3.867 . 0 0 "[ . 1 . 2]" 1 2239 1 112 GLU H 1 115 LEU H 5.740 . 5.740 5.185 5.015 5.428 . 0 0 "[ . 1 . 2]" 1 2240 1 114 ALA H 1 115 LEU H 3.480 . 3.480 2.754 2.712 2.795 . 0 0 "[ . 1 . 2]" 1 2241 1 115 LEU H 1 116 GLN H 3.350 . 3.350 2.538 2.491 2.594 . 0 0 "[ . 1 . 2]" 1 2242 1 115 LEU H 1 116 GLN HA 5.610 . 5.610 5.128 5.071 5.181 . 0 0 "[ . 1 . 2]" 1 2243 1 115 LEU H 1 127 LEU HB3 5.750 . 5.750 5.264 5.078 5.451 . 0 0 "[ . 1 . 2]" 1 2244 1 115 LEU H 1 116 GLN HB2 4.820 . 4.820 4.766 4.642 4.853 0.033 10 0 "[ . 1 . 2]" 1 2245 1 115 LEU H 1 115 LEU HB2 3.060 . 3.060 2.153 2.077 2.315 . 0 0 "[ . 1 . 2]" 1 2246 1 115 LEU H 1 115 LEU HB3 3.580 . 3.580 3.095 2.966 3.579 . 0 0 "[ . 1 . 2]" 1 2247 1 114 ALA MB 1 115 LEU H 3.430 . 3.430 2.603 2.487 2.702 . 0 0 "[ . 1 . 2]" 1 2248 1 115 LEU H 1 127 LEU MD2 5.190 . 5.190 4.638 4.443 4.919 . 0 0 "[ . 1 . 2]" 1 2249 1 115 LEU H 1 115 LEU MD1 4.720 . 4.720 4.329 3.896 4.417 . 0 0 "[ . 1 . 2]" 1 2250 1 115 LEU H 1 127 LEU MD1 5.190 . 5.190 3.042 2.762 3.502 . 0 0 "[ . 1 . 2]" 1 2251 1 115 LEU H 1 119 LEU MD1 4.930 . 4.930 3.914 3.780 4.089 . 0 0 "[ . 1 . 2]" 1 2252 1 74 SER H 1 88 ALA H 5.320 . 5.320 4.688 4.388 4.809 . 0 0 "[ . 1 . 2]" 1 2253 1 74 SER H 1 75 HIS H 4.900 . 4.900 4.372 4.138 4.442 . 0 0 "[ . 1 . 2]" 1 2254 1 74 SER H 1 87 HIS HA 5.590 . 5.590 5.063 4.845 5.269 . 0 0 "[ . 1 . 2]" 1 2255 1 74 SER H 1 74 SER HB2 4.320 . 4.320 3.261 2.664 3.956 . 0 0 "[ . 1 . 2]" 1 2256 1 74 SER H 1 74 SER HB3 4.320 . 4.320 3.570 2.880 3.901 . 0 0 "[ . 1 . 2]" 1 2257 1 73 ALA MB 1 74 SER H 3.040 . 3.040 2.173 1.988 2.414 . 0 0 "[ . 1 . 2]" 1 2258 1 74 SER H 1 88 ALA MB 5.250 . 5.250 4.772 4.021 5.100 . 0 0 "[ . 1 . 2]" 1 2259 1 95 HIS HB3 1 96 GLY H 4.770 . 4.770 3.953 3.043 4.399 . 0 0 "[ . 1 . 2]" 1 2260 1 95 HIS HB2 1 96 GLY H 4.770 . 4.770 4.298 3.998 4.434 . 0 0 "[ . 1 . 2]" 1 2261 1 120 ALA H 1 123 ASP H 5.170 . 5.170 4.068 3.827 4.278 . 0 0 "[ . 1 . 2]" 1 2262 1 123 ASP H 1 124 ILE H 3.310 . 3.310 2.336 2.250 2.368 . 0 0 "[ . 1 . 2]" 1 2263 1 121 PRO HA 1 123 ASP H 4.670 . 4.670 4.193 3.986 4.317 . 0 0 "[ . 1 . 2]" 1 2264 1 123 ASP H 1 125 PRO HD2 4.020 . 4.020 3.506 3.350 3.611 . 0 0 "[ . 1 . 2]" 1 2265 1 123 ASP H 1 125 PRO HD3 5.090 . 5.090 5.075 4.915 5.121 0.031 17 0 "[ . 1 . 2]" 1 2266 1 123 ASP H 1 123 ASP HB2 3.340 . 3.340 2.421 2.363 2.513 . 0 0 "[ . 1 . 2]" 1 2267 1 123 ASP H 1 123 ASP HB3 3.710 . 3.710 3.495 2.587 3.608 . 0 0 "[ . 1 . 2]" 1 2268 1 123 ASP H 1 126 LEU HB2 5.560 . 5.560 5.320 5.080 5.552 . 0 0 "[ . 1 . 2]" 1 2269 1 123 ASP H 1 124 ILE HB 4.600 . 4.600 4.619 4.524 4.667 0.067 2 0 "[ . 1 . 2]" 1 2270 1 121 PRO HB2 1 123 ASP H 5.750 . 5.750 5.276 4.904 5.537 . 0 0 "[ . 1 . 2]" 1 2271 1 120 ALA MB 1 123 ASP H 3.460 . 3.460 2.821 2.615 3.012 . 0 0 "[ . 1 . 2]" 1 2272 1 122 ALA MB 1 123 ASP H 3.850 . 3.850 2.904 2.715 3.104 . 0 0 "[ . 1 . 2]" 1 2273 1 119 LEU MD1 1 123 ASP H 5.740 . 5.740 5.173 4.996 5.348 . 0 0 "[ . 1 . 2]" 1 2274 1 119 LEU MD2 1 123 ASP H 5.750 . 5.750 5.420 5.165 5.654 . 0 0 "[ . 1 . 2]" 1 2275 1 62 LEU H 1 64 ILE H 4.330 . 4.330 3.625 3.435 3.792 . 0 0 "[ . 1 . 2]" 1 2276 1 62 LEU HA 1 64 ILE H 5.150 . 5.150 4.590 4.465 4.818 . 0 0 "[ . 1 . 2]" 1 2277 1 59 ARG HA 1 64 ILE H 3.400 . 3.400 2.411 2.123 2.865 . 0 0 "[ . 1 . 2]" 1 2278 1 64 ILE H 1 98 LEU HA 5.680 . 5.680 4.624 4.342 5.267 . 0 0 "[ . 1 . 2]" 1 2279 1 58 LEU HB2 1 64 ILE H 5.070 . 5.070 4.320 4.157 4.688 . 0 0 "[ . 1 . 2]" 1 2280 1 59 ARG HB2 1 64 ILE H 5.250 . 5.250 4.574 4.249 5.066 . 0 0 "[ . 1 . 2]" 1 2281 1 62 LEU HB2 1 64 ILE H 4.360 . 4.360 2.921 2.828 3.109 . 0 0 "[ . 1 . 2]" 1 2282 1 64 ILE H 1 64 ILE HB 4.380 . 4.380 3.844 3.813 3.893 . 0 0 "[ . 1 . 2]" 1 2283 1 62 LEU HB3 1 64 ILE H 4.460 . 4.460 4.017 3.827 4.270 . 0 0 "[ . 1 . 2]" 1 2284 1 64 ILE H 1 64 ILE HG13 3.630 . 3.630 3.040 2.925 3.121 . 0 0 "[ . 1 . 2]" 1 2285 1 64 ILE H 1 64 ILE HG12 3.460 . 3.460 2.336 2.255 2.472 . 0 0 "[ . 1 . 2]" 1 2286 1 64 ILE H 1 64 ILE MG 3.590 . 3.590 2.963 2.832 3.030 . 0 0 "[ . 1 . 2]" 1 2287 1 64 ILE H 1 64 ILE MD 4.330 . 4.330 3.959 3.904 4.058 . 0 0 "[ . 1 . 2]" 1 2288 1 34 ALA HA 1 35 GLY H 3.320 . 3.320 2.456 2.180 2.822 . 0 0 "[ . 1 . 2]" 1 2289 1 34 ALA MB 1 35 GLY H 3.770 . 3.770 2.371 1.799 3.475 0.001 7 0 "[ . 1 . 2]" 1 2290 1 13 ALA H 1 42 GLY H 5.570 . 5.570 5.133 5.012 5.351 . 0 0 "[ . 1 . 2]" 1 2291 1 14 ALA H 1 42 GLY H 5.340 . 5.340 4.974 4.579 5.198 . 0 0 "[ . 1 . 2]" 1 2292 1 42 GLY H 1 43 LYS H 4.660 . 4.660 4.347 4.183 4.405 . 0 0 "[ . 1 . 2]" 1 2293 1 12 VAL HA 1 42 GLY H 5.520 . 5.520 4.920 4.839 5.057 . 0 0 "[ . 1 . 2]" 1 2294 1 41 GLY HA3 1 42 GLY H 3.380 . 3.380 2.172 2.144 2.227 . 0 0 "[ . 1 . 2]" 1 2295 1 12 VAL HB 1 42 GLY H 5.370 . 5.370 4.676 4.288 4.939 . 0 0 "[ . 1 . 2]" 1 2296 1 42 GLY H 1 43 LYS HA 5.250 . 5.250 4.776 4.609 4.878 . 0 0 "[ . 1 . 2]" 1 2297 1 60 GLU H 1 63 GLY H 5.310 . 5.310 4.403 3.948 4.610 . 0 0 "[ . 1 . 2]" 1 2298 1 61 GLU HA 1 63 GLY H 5.010 . 5.010 4.274 4.082 4.720 . 0 0 "[ . 1 . 2]" 1 2299 1 62 LEU HG 1 63 GLY H 5.050 . 5.050 4.665 4.249 4.811 . 0 0 "[ . 1 . 2]" 1 2300 1 63 GLY H 1 64 ILE MG 5.110 . 5.110 4.521 4.102 4.695 . 0 0 "[ . 1 . 2]" 1 2301 1 62 LEU H 1 63 GLY H 3.330 . 3.330 2.382 2.166 2.508 . 0 0 "[ . 1 . 2]" 1 2302 1 61 GLU HB3 1 63 GLY H 5.610 . 5.610 5.229 4.932 5.645 0.035 14 0 "[ . 1 . 2]" 1 2303 1 62 LEU HB2 1 63 GLY H 4.430 . 4.430 3.597 2.955 3.820 . 0 0 "[ . 1 . 2]" 1 2304 1 62 LEU HB3 1 63 GLY H 4.760 . 4.760 4.339 4.028 4.478 . 0 0 "[ . 1 . 2]" 1 2305 1 63 GLY H 1 64 ILE HG12 4.890 . 4.890 4.399 3.638 4.634 . 0 0 "[ . 1 . 2]" 1 2306 1 80 SER H 1 81 GLY H 4.850 . 4.850 3.225 3.086 3.393 . 0 0 "[ . 1 . 2]" 1 2307 1 79 VAL H 1 81 GLY H 4.890 . 4.890 4.312 4.119 4.523 . 0 0 "[ . 1 . 2]" 1 2308 1 81 GLY H 1 82 ARG H 3.440 . 3.440 2.905 2.688 3.002 . 0 0 "[ . 1 . 2]" 1 2309 1 81 GLY H 1 81 GLY HA2 3.100 . 3.100 2.308 2.278 2.369 . 0 0 "[ . 1 . 2]" 1 2310 1 78 GLU HG2 1 81 GLY H 5.640 . 5.640 4.730 4.481 5.182 . 0 0 "[ . 1 . 2]" 1 2311 1 78 GLU HG3 1 81 GLY H 3.910 . 3.910 3.279 2.984 3.562 . 0 0 "[ . 1 . 2]" 1 2312 1 78 GLU HB2 1 81 GLY H 4.830 . 4.830 3.362 3.176 3.628 . 0 0 "[ . 1 . 2]" 1 2313 1 81 GLY H 1 82 ARG HG3 5.630 . 5.630 5.099 4.629 5.496 . 0 0 "[ . 1 . 2]" 1 2314 1 79 VAL MG1 1 81 GLY H 5.750 . 5.750 5.151 4.907 5.284 . 0 0 "[ . 1 . 2]" 1 2315 1 79 VAL MG2 1 81 GLY H 5.750 . 5.750 5.401 5.213 5.513 . 0 0 "[ . 1 . 2]" 1 2316 1 41 GLY H 1 58 LEU HG 5.750 . 5.750 5.546 4.719 5.758 0.008 16 0 "[ . 1 . 2]" 1 2317 1 41 GLY H 1 61 GLU HB3 5.750 . 5.750 5.275 4.739 5.761 0.011 12 0 "[ . 1 . 2]" 1 2318 1 14 ALA MB 1 41 GLY H 5.080 . 5.080 4.518 3.931 4.868 . 0 0 "[ . 1 . 2]" 1 2319 1 40 ALA MB 1 41 GLY H 3.250 . 3.250 2.489 2.173 2.737 . 0 0 "[ . 1 . 2]" 1 2320 1 61 GLU HB2 1 62 LEU H 4.310 . 4.310 2.712 2.514 3.718 . 0 0 "[ . 1 . 2]" 1 2321 1 64 ILE MD 1 67 THR H 5.750 . 5.750 5.444 5.016 5.689 . 0 0 "[ . 1 . 2]" 1 2322 1 83 ILE H 1 83 ILE MG 4.100 . 4.100 3.721 3.663 3.777 . 0 0 "[ . 1 . 2]" 1 2323 1 79 VAL HA 1 81 GLY H 5.040 . 5.040 4.778 4.638 4.922 . 0 0 "[ . 1 . 2]" 1 2324 1 90 HIS HB3 1 91 VAL H 4.740 . 4.740 4.295 4.133 4.433 . 0 0 "[ . 1 . 2]" 1 2325 1 83 ILE H 1 84 ILE H 4.600 . 4.600 4.328 4.274 4.361 . 0 0 "[ . 1 . 2]" 1 2326 1 50 GLN H 1 50 GLN HG3 3.940 . 3.940 2.221 1.970 2.447 . 0 0 "[ . 1 . 2]" 1 2327 1 72 VAL H 1 90 HIS H 4.420 . 4.420 3.624 3.388 3.898 . 0 0 "[ . 1 . 2]" 1 2328 1 56 ARG HB2 1 57 GLU H 4.150 . 4.150 3.756 3.627 3.896 . 0 0 "[ . 1 . 2]" 1 2329 1 57 GLU HA 1 59 ARG H 5.010 . 5.010 4.362 4.242 4.480 . 0 0 "[ . 1 . 2]" 1 2330 1 132 ALA HA 1 134 ARG H 4.870 . 4.870 4.382 4.203 4.582 . 0 0 "[ . 1 . 2]" 1 2331 1 135 ALA H 1 135 ALA MB 2.710 . 2.710 2.305 2.278 2.331 . 0 0 "[ . 1 . 2]" 1 2332 1 139 ALA HA 1 140 ASP H 3.770 . 3.770 3.043 2.119 3.583 . 0 0 "[ . 1 . 2]" 1 2333 1 139 ALA MB 1 140 ASP H 4.110 . 4.110 2.971 1.880 3.674 . 0 0 "[ . 1 . 2]" 1 2334 1 21 LYS HE2 1 110 SER H 4.260 . 4.260 3.773 2.487 4.296 0.036 11 0 "[ . 1 . 2]" 1 2335 1 49 SER HA 1 52 GLN H 5.160 . 5.160 4.501 4.227 4.727 . 0 0 "[ . 1 . 2]" 1 2336 1 128 GLU HA 1 130 PHE H 5.540 . 5.540 4.203 4.077 4.315 . 0 0 "[ . 1 . 2]" 1 2337 1 129 ALA H 1 129 ALA MB 2.860 . 2.860 2.303 2.289 2.319 . 0 0 "[ . 1 . 2]" 1 2338 1 132 ALA H 1 132 ALA MB 3.080 . 3.080 2.209 2.190 2.221 . 0 0 "[ . 1 . 2]" 1 2339 1 132 ALA HA 1 133 LEU H 3.800 . 3.800 3.536 3.521 3.548 . 0 0 "[ . 1 . 2]" 1 2340 1 133 LEU HA 1 135 ALA H 4.480 . 4.480 4.113 3.945 4.354 . 0 0 "[ . 1 . 2]" 1 2341 1 65 GLU HA 1 66 ALA H 3.160 . 3.160 2.190 2.145 2.237 . 0 0 "[ . 1 . 2]" 1 2342 1 72 VAL H 1 73 ALA MB 5.110 . 5.110 4.852 4.734 4.901 . 0 0 "[ . 1 . 2]" 1 2343 1 68 VAL H 1 68 VAL HB 3.190 . 3.190 2.577 2.518 2.650 . 0 0 "[ . 1 . 2]" 1 2344 1 99 GLN HB2 1 100 ALA H 4.290 . 4.290 2.580 2.348 3.076 . 0 0 "[ . 1 . 2]" 1 2345 1 78 GLU HA 1 83 ILE H 4.860 . 4.860 4.639 4.562 4.744 . 0 0 "[ . 1 . 2]" 1 2346 1 130 PHE H 1 131 MET HG2 5.040 . 5.040 3.892 3.697 4.213 . 0 0 "[ . 1 . 2]" 1 2347 1 47 ASP HB2 1 48 GLU H 4.280 . 4.280 3.920 3.051 4.306 0.026 20 0 "[ . 1 . 2]" 1 2348 1 46 PRO HA 1 48 GLU H 4.490 . 4.490 3.787 3.540 4.061 . 0 0 "[ . 1 . 2]" 1 2349 1 21 LYS HB2 1 109 CYS H 4.480 . 4.480 4.303 4.017 4.551 0.071 19 0 "[ . 1 . 2]" 1 2350 1 59 ARG HB3 1 60 GLU H 3.530 . 3.530 2.801 2.713 2.923 . 0 0 "[ . 1 . 2]" 1 2351 1 58 LEU H 1 58 LEU HB2 3.300 . 3.300 2.632 2.280 2.724 . 0 0 "[ . 1 . 2]" 1 2352 1 58 LEU H 1 58 LEU HG 3.540 . 3.540 2.354 2.119 3.783 0.243 13 0 "[ . 1 . 2]" 1 2353 1 91 VAL HA 1 93 ASP H 4.110 . 4.110 3.526 3.418 3.684 . 0 0 "[ . 1 . 2]" 1 2354 1 115 LEU HB3 1 116 GLN H 4.240 . 4.240 3.485 3.308 3.957 . 0 0 "[ . 1 . 2]" 1 2355 1 29 ALA MB 1 31 SER H 4.010 . 4.010 3.770 3.118 4.093 0.083 10 0 "[ . 1 . 2]" 1 2356 1 16 ILE MG 1 91 VAL H 5.500 . 5.500 4.769 4.512 5.154 . 0 0 "[ . 1 . 2]" 1 2357 1 23 LEU HB2 1 24 LEU H 4.750 . 4.750 4.325 4.243 4.494 . 0 0 "[ . 1 . 2]" 1 2358 1 9 ILE MD 1 10 GLU H 5.600 . 5.600 5.210 5.075 5.376 . 0 0 "[ . 1 . 2]" 1 2359 1 10 GLU H 1 84 ILE MG 5.750 . 5.750 4.420 4.265 4.569 . 0 0 "[ . 1 . 2]" 1 2360 1 18 ARG H 1 18 ARG HG3 4.990 . 4.990 4.631 4.398 4.798 . 0 0 "[ . 1 . 2]" 1 2361 1 120 ALA H 1 123 ASP HB2 4.420 . 4.420 2.779 2.500 3.189 . 0 0 "[ . 1 . 2]" 1 2362 1 12 VAL MG1 1 13 ALA H 4.170 . 4.170 3.606 3.505 3.691 . 0 0 "[ . 1 . 2]" 1 2363 1 13 ALA H 1 54 LEU HG 4.930 . 4.930 4.824 4.559 4.982 0.052 14 0 "[ . 1 . 2]" 1 2364 1 10 GLU HB3 1 11 VAL H 3.820 . 3.820 3.370 3.290 3.714 . 0 0 "[ . 1 . 2]" 1 2365 1 28 PRO HG3 1 29 ALA H 4.000 . 4.000 4.023 3.649 4.183 0.183 1 0 "[ . 1 . 2]" 1 2366 1 73 ALA MB 1 129 ALA H 4.410 . 4.410 4.062 3.539 4.367 . 0 0 "[ . 1 . 2]" 1 2367 1 16 ILE HG12 1 23 LEU H 5.750 . 5.750 4.822 3.792 5.811 0.061 2 0 "[ . 1 . 2]" 1 2368 1 16 ILE HG13 1 23 LEU H 5.750 . 5.750 4.558 4.217 4.889 . 0 0 "[ . 1 . 2]" 1 2369 1 124 ILE H 1 125 PRO HG2 4.530 . 4.530 4.163 3.997 4.320 . 0 0 "[ . 1 . 2]" 1 2370 1 73 ALA MB 1 75 HIS H 5.750 . 5.750 5.127 4.956 5.262 . 0 0 "[ . 1 . 2]" 1 2371 1 75 HIS H 1 122 ALA MB 5.750 . 5.750 5.451 4.568 5.791 0.041 11 0 "[ . 1 . 2]" 1 2372 1 36 LEU H 1 36 LEU HG 4.680 . 4.680 3.191 1.798 4.107 0.002 13 0 "[ . 1 . 2]" 1 2373 1 34 ALA HA 1 36 LEU H 3.990 . 3.990 3.370 3.054 4.046 0.056 10 0 "[ . 1 . 2]" 1 2374 1 21 LYS H 1 21 LYS HB3 4.180 . 4.180 3.768 3.708 3.841 . 0 0 "[ . 1 . 2]" 1 2375 1 127 LEU H 1 127 LEU HG 4.920 . 4.920 4.606 4.575 4.640 . 0 0 "[ . 1 . 2]" 1 2376 1 56 ARG H 1 56 ARG HB2 3.930 . 3.930 3.645 3.615 3.667 . 0 0 "[ . 1 . 2]" 1 2377 1 110 SER H 1 111 PRO HD2 5.110 . 5.110 4.715 4.651 4.947 . 0 0 "[ . 1 . 2]" 1 2378 1 21 LYS HB2 1 110 SER H 5.660 . 5.660 5.757 5.571 5.845 0.185 18 0 "[ . 1 . 2]" 1 2379 1 110 SER HB2 1 113 GLU H 4.890 . 4.890 2.944 2.421 4.617 . 0 0 "[ . 1 . 2]" 1 2380 1 111 PRO HD2 1 113 GLU H 5.490 . 5.490 4.673 4.508 4.852 . 0 0 "[ . 1 . 2]" 1 2381 1 133 LEU H 1 133 LEU MD1 5.000 . 5.000 3.008 2.734 3.983 . 0 0 "[ . 1 . 2]" 1 2382 1 133 LEU H 1 133 LEU MD2 5.000 . 5.000 3.970 2.567 4.170 . 0 0 "[ . 1 . 2]" 1 2383 1 115 LEU MD2 1 128 GLU H 4.590 . 4.590 3.165 2.973 3.451 . 0 0 "[ . 1 . 2]" 1 2384 1 86 LEU MD1 1 122 ALA H 5.740 . 5.740 5.491 4.822 5.760 0.020 7 0 "[ . 1 . 2]" 1 2385 1 86 LEU MD2 1 122 ALA H 5.740 . 5.740 4.562 4.056 4.725 . 0 0 "[ . 1 . 2]" 1 2386 1 55 VAL MG2 1 57 GLU H 5.750 . 5.750 5.603 5.537 5.672 . 0 0 "[ . 1 . 2]" 1 2387 1 12 VAL HB 1 54 LEU H 5.350 . 5.350 4.344 4.239 4.471 . 0 0 "[ . 1 . 2]" 1 2388 1 104 GLN H 1 104 GLN HB2 3.760 . 3.760 2.702 2.423 3.003 . 0 0 "[ . 1 . 2]" 1 2389 1 102 GLU HB2 1 103 HIS H 4.380 . 4.380 3.130 2.411 4.083 . 0 0 "[ . 1 . 2]" 1 2390 1 31 SER H 1 33 GLN HG3 5.750 . 5.750 5.649 5.145 5.898 0.148 4 0 "[ . 1 . 2]" 1 2391 1 47 ASP H 1 47 ASP HB2 4.140 . 4.140 2.784 2.418 3.697 . 0 0 "[ . 1 . 2]" 1 2392 1 62 LEU H 1 64 ILE HG13 5.300 . 5.300 5.243 5.072 5.380 0.080 14 0 "[ . 1 . 2]" 1 2393 1 62 LEU H 1 62 LEU HB3 3.970 . 3.970 3.690 3.654 3.745 . 0 0 "[ . 1 . 2]" 1 2394 1 61 GLU H 1 62 LEU HB2 5.250 . 5.250 4.872 4.710 5.015 . 0 0 "[ . 1 . 2]" 1 2395 1 41 GLY H 1 42 GLY H 4.670 . 4.670 4.194 4.050 4.325 . 0 0 "[ . 1 . 2]" 1 2396 1 14 ALA H 1 41 GLY H 5.040 . 5.040 4.596 4.366 4.767 . 0 0 "[ . 1 . 2]" 1 2397 1 63 GLY H 1 64 ILE H 3.640 . 3.640 2.871 2.229 3.119 . 0 0 "[ . 1 . 2]" 1 2398 1 64 ILE H 1 65 GLU H 4.740 . 4.740 4.406 4.327 4.443 . 0 0 "[ . 1 . 2]" 1 2399 1 93 ASP H 1 94 PHE HA 5.320 . 5.320 4.837 4.729 4.965 . 0 0 "[ . 1 . 2]" 1 2400 1 11 VAL H 1 12 VAL H 4.790 . 4.790 4.257 4.085 4.417 . 0 0 "[ . 1 . 2]" 1 2401 1 26 GLN H 1 106 LEU H 5.750 . 5.750 4.840 4.573 5.098 . 0 0 "[ . 1 . 2]" 1 2402 1 133 LEU H 1 134 ARG H 3.090 . 3.090 2.611 2.560 2.663 . 0 0 "[ . 1 . 2]" 1 2403 1 69 GLY H 1 70 GLU H 3.990 . 3.990 2.809 2.612 3.096 . 0 0 "[ . 1 . 2]" 1 2404 1 65 GLU H 1 95 HIS H 3.590 . 3.590 3.006 2.718 3.171 . 0 0 "[ . 1 . 2]" 1 2405 1 116 GLN H 1 117 TYR H 2.910 . 2.910 2.377 2.289 2.481 . 0 0 "[ . 1 . 2]" 1 2406 1 90 HIS H 1 91 VAL H 4.920 . 4.920 4.427 4.320 4.518 . 0 0 "[ . 1 . 2]" 1 2407 1 124 ILE HA 1 127 LEU H 4.370 . 4.370 3.591 3.486 3.679 . 0 0 "[ . 1 . 2]" 1 2408 1 124 ILE HA 1 128 GLU H 5.140 . 5.140 4.041 3.801 4.229 . 0 0 "[ . 1 . 2]" 1 2409 1 122 ALA H 1 125 PRO HD2 5.560 . 5.560 4.391 4.086 4.655 . 0 0 "[ . 1 . 2]" 1 2410 1 124 ILE H 1 125 PRO HD2 3.290 . 3.290 2.073 2.007 2.148 . 0 0 "[ . 1 . 2]" 1 2411 1 41 GLY HA2 1 42 GLY H 3.510 . 3.510 3.093 2.994 3.166 . 0 0 "[ . 1 . 2]" 1 2412 1 15 ILE HB 1 90 HIS H 4.870 . 4.870 4.457 4.230 4.718 . 0 0 "[ . 1 . 2]" 1 2413 1 12 VAL H 1 41 GLY HA3 5.750 . 5.750 4.875 4.744 5.051 . 0 0 "[ . 1 . 2]" 1 2414 1 77 ARG H 1 83 ILE HA 4.850 . 4.850 4.450 4.253 4.603 . 0 0 "[ . 1 . 2]" 1 2415 1 76 GLN H 1 77 ARG H 5.360 . 5.360 4.457 4.412 4.495 . 0 0 "[ . 1 . 2]" 1 2416 1 117 TYR H 1 117 TYR QE 5.750 . 5.750 4.921 4.726 5.240 . 0 0 "[ . 1 . 2]" 1 2417 1 17 GLU HA 1 22 ILE HG12 4.160 . 4.160 3.516 3.156 3.780 . 0 0 "[ . 1 . 2]" 1 2418 1 116 GLN HB2 1 117 TYR QD 4.210 . 4.210 3.343 2.892 3.922 . 0 0 "[ . 1 . 2]" 1 2419 1 117 TYR HA 1 117 TYR QD 4.150 . 4.150 3.013 2.540 3.132 . 0 0 "[ . 1 . 2]" 1 2420 1 117 TYR HB2 1 117 TYR QE 5.070 . 5.070 4.434 4.378 4.482 . 0 0 "[ . 1 . 2]" 1 2421 1 17 GLU HA 1 22 ILE MD 5.130 . 5.130 4.957 4.685 5.146 0.016 15 0 "[ . 1 . 2]" 1 2422 1 16 ILE MG 1 17 GLU HA 4.620 . 4.620 4.137 3.976 4.346 . 0 0 "[ . 1 . 2]" 1 2423 1 17 GLU HA 1 23 LEU HB2 5.690 . 5.690 5.106 4.692 5.487 . 0 0 "[ . 1 . 2]" 1 2424 1 16 ILE HA 1 17 GLU HA 4.950 . 4.950 4.385 4.359 4.407 . 0 0 "[ . 1 . 2]" 1 2425 1 17 GLU HA 1 21 LYS HA 5.340 . 5.340 4.981 4.762 5.177 . 0 0 "[ . 1 . 2]" 1 2426 1 17 GLU HA 1 23 LEU H 4.090 . 4.090 3.740 3.487 4.054 . 0 0 "[ . 1 . 2]" 1 2427 1 114 ALA H 1 117 TYR QD 5.500 . 5.500 4.372 4.169 4.731 . 0 0 "[ . 1 . 2]" 1 2428 1 116 GLN H 1 117 TYR QD 4.270 . 4.270 3.441 3.108 3.992 . 0 0 "[ . 1 . 2]" 1 2429 1 17 GLU HA 1 22 ILE HA 2.720 . 2.720 2.288 2.119 2.459 . 0 0 "[ . 1 . 2]" 1 2430 1 114 ALA HA 1 117 TYR QD 4.130 . 4.130 2.587 2.211 3.278 . 0 0 "[ . 1 . 2]" 1 2431 1 109 CYS QB 1 117 TYR QD 5.750 . 5.750 4.172 3.607 4.676 . 0 0 "[ . 1 . 2]" 1 2432 1 17 GLU HG3 1 22 ILE HA 5.530 . 5.530 4.002 3.193 4.960 . 0 0 "[ . 1 . 2]" 1 2433 1 116 GLN HB3 1 117 TYR QD 5.220 . 5.220 4.663 4.113 5.022 . 0 0 "[ . 1 . 2]" 1 2434 1 22 ILE HA 1 22 ILE HG12 4.130 . 4.130 2.650 2.561 2.742 . 0 0 "[ . 1 . 2]" 1 2435 1 16 ILE MG 1 22 ILE HA 5.110 . 5.110 4.876 4.497 5.128 0.018 19 0 "[ . 1 . 2]" 1 2436 1 134 ARG H 1 134 ARG HD2 5.060 . 5.060 4.780 4.292 4.974 . 0 0 "[ . 1 . 2]" 1 2437 1 134 ARG H 1 134 ARG HD3 5.060 . 5.060 4.086 3.741 4.404 . 0 0 "[ . 1 . 2]" 1 2438 1 25 ALA HA 1 105 ALA H 4.980 . 4.980 4.464 3.903 4.810 . 0 0 "[ . 1 . 2]" 1 2439 1 104 GLN HB2 1 105 ALA H 4.800 . 4.800 3.648 3.473 4.009 . 0 0 "[ . 1 . 2]" 1 2440 1 104 GLN HB3 1 105 ALA H 4.630 . 4.630 2.208 1.948 2.842 . 0 0 "[ . 1 . 2]" 1 2441 1 115 LEU H 1 119 LEU HG 5.560 . 5.560 5.503 5.344 5.589 0.029 17 0 "[ . 1 . 2]" 1 2442 1 100 ALA MB 1 105 ALA H 4.430 . 4.430 4.017 3.394 4.463 0.033 20 0 "[ . 1 . 2]" 1 2443 1 122 ALA MB 1 126 LEU H 5.750 . 5.750 5.281 4.674 5.616 . 0 0 "[ . 1 . 2]" 1 2444 1 22 ILE HA 1 22 ILE MD 4.650 . 4.650 3.878 3.835 3.914 . 0 0 "[ . 1 . 2]" 1 2445 1 17 GLU HA 1 21 LYS HB2 5.580 . 5.580 4.972 4.794 5.178 . 0 0 "[ . 1 . 2]" 1 2446 1 3 LEU HA 1 3 LEU QD 3.430 . 3.430 2.282 1.862 3.368 . 0 0 "[ . 1 . 2]" 1 2447 1 6 MET HA 1 6 MET QG 3.650 . 3.650 2.813 2.373 3.500 . 0 0 "[ . 1 . 2]" 1 2448 1 6 MET HA 1 7 LYS QB 4.890 . 4.890 4.345 4.030 4.530 . 0 0 "[ . 1 . 2]" 1 2449 1 6 MET QB 1 7 LYS H 4.650 . 4.650 3.124 1.850 3.868 . 0 0 "[ . 1 . 2]" 1 2450 1 6 MET QB 1 82 ARG HA 3.980 . 3.980 3.637 2.838 4.084 0.104 6 0 "[ . 1 . 2]" 1 2451 1 6 MET QB 1 83 ILE H 4.630 . 4.630 3.759 3.218 4.451 . 0 0 "[ . 1 . 2]" 1 2452 1 6 MET QB 1 83 ILE MD 3.570 . 3.570 2.072 1.744 2.900 0.056 12 0 "[ . 1 . 2]" 1 2453 1 6 MET QG 1 82 ARG HA 5.150 . 5.150 4.719 3.979 5.219 0.069 2 0 "[ . 1 . 2]" 1 2454 1 6 MET QG 1 83 ILE H 5.590 . 5.590 5.047 4.240 5.622 0.032 18 0 "[ . 1 . 2]" 1 2455 1 6 MET QG 1 83 ILE MD 4.460 . 4.460 2.976 2.093 3.820 . 0 0 "[ . 1 . 2]" 1 2456 1 7 LYS H 1 7 LYS QB 3.820 . 3.820 2.387 2.133 2.584 . 0 0 "[ . 1 . 2]" 1 2457 1 7 LYS H 1 7 LYS QG 4.490 . 4.490 3.059 2.287 4.021 . 0 0 "[ . 1 . 2]" 1 2458 1 7 LYS HA 1 7 LYS QG 3.650 . 3.650 2.495 2.328 3.008 . 0 0 "[ . 1 . 2]" 1 2459 1 7 LYS HA 1 7 LYS QD 4.780 . 4.780 3.200 1.947 4.232 . 0 0 "[ . 1 . 2]" 1 2460 1 7 LYS QB 1 8 MET H 3.650 . 3.650 2.830 2.412 3.655 0.005 9 0 "[ . 1 . 2]" 1 2461 1 7 LYS QB 1 82 ARG HA 4.920 . 4.920 3.942 2.879 4.663 . 0 0 "[ . 1 . 2]" 1 2462 1 7 LYS QB 1 82 ARG HD2 5.050 . 5.050 4.637 2.806 5.107 0.057 20 0 "[ . 1 . 2]" 1 2463 1 7 LYS QG 1 8 MET H 4.550 . 4.550 3.886 2.756 4.511 . 0 0 "[ . 1 . 2]" 1 2464 1 9 ILE HA 1 10 GLU QG 4.630 . 4.630 4.068 3.521 4.714 0.084 2 0 "[ . 1 . 2]" 1 2465 1 9 ILE MG 1 10 GLU QG 5.590 . 5.590 4.838 4.609 5.139 . 0 0 "[ . 1 . 2]" 1 2466 1 9 ILE MG 1 43 LYS QD 3.460 . 3.460 2.530 2.007 2.954 . 0 0 "[ . 1 . 2]" 1 2467 1 9 ILE MG 1 43 LYS QE 3.820 . 3.820 2.838 1.863 3.931 0.111 11 0 "[ . 1 . 2]" 1 2468 1 9 ILE HG13 1 79 VAL QG 4.530 . 4.530 3.441 3.075 3.720 . 0 0 "[ . 1 . 2]" 1 2469 1 9 ILE MD 1 43 LYS QE 5.100 . 5.100 4.209 3.531 5.110 0.010 5 0 "[ . 1 . 2]" 1 2470 1 10 GLU H 1 10 GLU QG 3.590 . 3.590 2.858 2.421 3.420 . 0 0 "[ . 1 . 2]" 1 2471 1 10 GLU H 1 43 LYS QG 4.730 . 4.730 3.323 2.796 3.692 . 0 0 "[ . 1 . 2]" 1 2472 1 10 GLU HA 1 10 GLU QG 3.510 . 3.510 2.507 2.267 2.847 . 0 0 "[ . 1 . 2]" 1 2473 1 10 GLU HA 1 11 VAL QG 4.150 . 4.150 3.597 3.511 3.698 . 0 0 "[ . 1 . 2]" 1 2474 1 10 GLU HA 1 44 VAL QG 4.740 . 4.740 4.338 4.085 4.581 . 0 0 "[ . 1 . 2]" 1 2475 1 10 GLU HB3 1 44 VAL QG 4.010 . 4.010 2.832 2.434 3.447 . 0 0 "[ . 1 . 2]" 1 2476 1 10 GLU QG 1 11 VAL H 4.940 . 4.940 4.349 4.075 4.737 . 0 0 "[ . 1 . 2]" 1 2477 1 10 GLU QG 1 44 VAL HB 5.590 . 5.590 3.826 3.350 4.129 . 0 0 "[ . 1 . 2]" 1 2478 1 10 GLU QG 1 44 VAL QG 5.100 . 5.100 3.876 3.425 4.208 . 0 0 "[ . 1 . 2]" 1 2479 1 10 GLU QG 1 85 HIS H 5.490 . 5.490 4.200 3.588 4.633 . 0 0 "[ . 1 . 2]" 1 2480 1 10 GLU QG 1 85 HIS HB2 4.360 . 4.360 3.945 2.951 4.434 0.074 5 0 "[ . 1 . 2]" 1 2481 1 10 GLU QG 1 85 HIS HB3 4.420 . 4.420 3.098 2.172 4.004 . 0 0 "[ . 1 . 2]" 1 2482 1 11 VAL H 1 11 VAL QG 3.330 . 3.330 2.797 2.699 2.887 . 0 0 "[ . 1 . 2]" 1 2483 1 11 VAL HA 1 11 VAL QG 3.090 . 3.090 2.141 2.133 2.152 . 0 0 "[ . 1 . 2]" 1 2484 1 11 VAL HA 1 12 VAL QG 4.450 . 4.450 3.257 3.224 3.317 . 0 0 "[ . 1 . 2]" 1 2485 1 11 VAL HA 1 43 LYS QG 4.740 . 4.740 3.699 3.342 3.947 . 0 0 "[ . 1 . 2]" 1 2486 1 11 VAL HA 1 44 VAL QG 3.950 . 3.950 2.941 2.600 3.264 . 0 0 "[ . 1 . 2]" 1 2487 1 11 VAL HB 1 86 LEU QD 3.340 . 3.340 2.696 2.524 2.866 . 0 0 "[ . 1 . 2]" 1 2488 1 11 VAL QG 1 12 VAL H 3.270 . 3.270 2.615 2.400 2.801 . 0 0 "[ . 1 . 2]" 1 2489 1 11 VAL QG 1 12 VAL HA 4.830 . 4.830 3.673 3.549 3.812 . 0 0 "[ . 1 . 2]" 1 2490 1 11 VAL QG 1 42 GLY H 4.150 . 4.150 3.037 2.718 3.373 . 0 0 "[ . 1 . 2]" 1 2491 1 11 VAL QG 1 42 GLY HA2 3.970 . 3.970 3.293 3.095 3.689 . 0 0 "[ . 1 . 2]" 1 2492 1 11 VAL QG 1 42 GLY HA3 4.770 . 4.770 4.198 4.024 4.466 . 0 0 "[ . 1 . 2]" 1 2493 1 11 VAL QG 1 43 LYS H 4.130 . 4.130 3.695 3.443 4.231 0.101 14 0 "[ . 1 . 2]" 1 2494 1 11 VAL QG 1 43 LYS HA 3.270 . 3.270 2.428 2.193 2.758 . 0 0 "[ . 1 . 2]" 1 2495 1 11 VAL QG 1 43 LYS HB2 3.910 . 3.910 2.823 2.451 3.036 . 0 0 "[ . 1 . 2]" 1 2496 1 11 VAL QG 1 43 LYS QG 4.060 . 4.060 2.932 2.444 3.202 . 0 0 "[ . 1 . 2]" 1 2497 1 11 VAL QG 1 86 LEU HG 4.430 . 4.430 2.529 2.262 2.755 . 0 0 "[ . 1 . 2]" 1 2498 1 11 VAL QG 1 87 HIS H 4.810 . 4.810 4.034 3.788 4.330 . 0 0 "[ . 1 . 2]" 1 2499 1 12 VAL H 1 12 VAL QG 3.120 . 3.120 1.860 1.783 1.952 0.017 17 0 "[ . 1 . 2]" 1 2500 1 12 VAL H 1 43 LYS QG 5.590 . 5.590 5.216 4.853 5.427 . 0 0 "[ . 1 . 2]" 1 2501 1 12 VAL H 1 87 HIS QB 5.590 . 5.590 5.088 4.890 5.482 . 0 0 "[ . 1 . 2]" 1 2502 1 12 VAL HA 1 12 VAL QG 3.230 . 3.230 2.195 2.161 2.218 . 0 0 "[ . 1 . 2]" 1 2503 1 12 VAL HA 1 44 VAL QG 4.880 . 4.880 3.997 3.822 4.104 . 0 0 "[ . 1 . 2]" 1 2504 1 12 VAL HA 1 54 LEU QD 4.660 . 4.660 3.469 3.306 3.601 . 0 0 "[ . 1 . 2]" 1 2505 1 12 VAL HA 1 86 LEU QD 5.110 . 5.110 5.015 4.726 5.146 0.036 8 0 "[ . 1 . 2]" 1 2506 1 12 VAL HA 1 87 HIS QB 3.960 . 3.960 2.615 2.371 3.100 . 0 0 "[ . 1 . 2]" 1 2507 1 12 VAL HB 1 54 LEU QD 3.410 . 3.410 1.979 1.765 2.133 0.035 19 0 "[ . 1 . 2]" 1 2508 1 12 VAL QG 1 13 ALA HA 4.640 . 4.640 4.166 4.113 4.253 . 0 0 "[ . 1 . 2]" 1 2509 1 12 VAL QG 1 14 ALA H 5.560 . 5.560 4.988 4.872 5.093 . 0 0 "[ . 1 . 2]" 1 2510 1 12 VAL QG 1 41 GLY H 5.690 . 5.690 5.695 5.543 5.731 0.041 16 0 "[ . 1 . 2]" 1 2511 1 12 VAL QG 1 41 GLY HA2 4.730 . 4.730 3.801 3.595 3.953 . 0 0 "[ . 1 . 2]" 1 2512 1 12 VAL QG 1 41 GLY HA3 4.550 . 4.550 3.647 3.441 3.746 . 0 0 "[ . 1 . 2]" 1 2513 1 12 VAL QG 1 42 GLY H 3.450 . 3.450 2.740 2.538 2.878 . 0 0 "[ . 1 . 2]" 1 2514 1 12 VAL QG 1 42 GLY HA2 5.300 . 5.300 4.484 4.211 4.639 . 0 0 "[ . 1 . 2]" 1 2515 1 12 VAL QG 1 43 LYS H 4.950 . 4.950 4.496 3.576 4.802 . 0 0 "[ . 1 . 2]" 1 2516 1 12 VAL QG 1 44 VAL H 4.910 . 4.910 3.853 3.471 4.034 . 0 0 "[ . 1 . 2]" 1 2517 1 12 VAL QG 1 44 VAL HA 4.250 . 4.250 3.689 3.409 3.897 . 0 0 "[ . 1 . 2]" 1 2518 1 12 VAL QG 1 44 VAL HB 4.300 . 4.300 3.846 3.674 3.946 . 0 0 "[ . 1 . 2]" 1 2519 1 12 VAL QG 1 50 GLN HA 3.610 . 3.610 2.533 2.299 2.706 . 0 0 "[ . 1 . 2]" 1 2520 1 12 VAL QG 1 50 GLN HB3 3.490 . 3.490 2.256 1.852 2.868 . 0 0 "[ . 1 . 2]" 1 2521 1 12 VAL QG 1 50 GLN HG2 4.340 . 4.340 3.043 2.725 3.535 . 0 0 "[ . 1 . 2]" 1 2522 1 12 VAL QG 1 50 GLN HG3 4.140 . 4.140 4.131 3.919 4.219 0.079 5 0 "[ . 1 . 2]" 1 2523 1 12 VAL QG 1 51 ARG H 5.530 . 5.530 4.397 4.125 4.624 . 0 0 "[ . 1 . 2]" 1 2524 1 12 VAL QG 1 53 ALA HA 4.850 . 4.850 4.240 4.049 4.457 . 0 0 "[ . 1 . 2]" 1 2525 1 12 VAL QG 1 54 LEU H 3.710 . 3.710 2.731 2.649 2.985 . 0 0 "[ . 1 . 2]" 1 2526 1 12 VAL QG 1 54 LEU HA 3.680 . 3.680 2.989 2.737 3.291 . 0 0 "[ . 1 . 2]" 1 2527 1 12 VAL QG 1 54 LEU HB2 4.320 . 4.320 3.696 3.488 3.869 . 0 0 "[ . 1 . 2]" 1 2528 1 12 VAL QG 1 54 LEU HB3 4.860 . 4.860 4.138 3.990 4.318 . 0 0 "[ . 1 . 2]" 1 2529 1 12 VAL QG 1 54 LEU HG 3.490 . 3.490 2.061 1.840 2.224 . 0 0 "[ . 1 . 2]" 1 2530 1 12 VAL QG 1 57 GLU H 5.690 . 5.690 5.151 4.907 5.512 . 0 0 "[ . 1 . 2]" 1 2531 1 12 VAL QG 1 57 GLU QB 5.010 . 5.010 3.988 3.698 4.402 . 0 0 "[ . 1 . 2]" 1 2532 1 12 VAL QG 1 57 GLU QG 4.790 . 4.790 3.547 3.162 3.980 . 0 0 "[ . 1 . 2]" 1 2533 1 12 VAL QG 1 87 HIS H 4.150 . 4.150 3.481 3.341 3.697 . 0 0 "[ . 1 . 2]" 1 2534 1 12 VAL QG 1 87 HIS QB 3.560 . 3.560 2.069 1.824 2.486 . 0 0 "[ . 1 . 2]" 1 2535 1 13 ALA H 1 54 LEU QD 3.880 . 3.880 2.963 2.812 3.206 . 0 0 "[ . 1 . 2]" 1 2536 1 13 ALA H 1 87 HIS QB 4.570 . 4.570 3.480 3.152 3.918 . 0 0 "[ . 1 . 2]" 1 2537 1 13 ALA H 1 89 TRP QB 5.590 . 5.590 4.708 4.212 5.177 . 0 0 "[ . 1 . 2]" 1 2538 1 13 ALA HA 1 39 PHE QB 5.000 . 5.000 3.894 3.535 4.263 . 0 0 "[ . 1 . 2]" 1 2539 1 13 ALA HA 1 54 LEU QD 3.790 . 3.790 2.933 2.681 3.272 . 0 0 "[ . 1 . 2]" 1 2540 1 13 ALA HA 1 126 LEU QD 5.690 . 5.690 4.962 4.720 5.139 . 0 0 "[ . 1 . 2]" 1 2541 1 13 ALA MB 1 126 LEU QD 3.510 . 3.510 2.509 2.351 2.650 . 0 0 "[ . 1 . 2]" 1 2542 1 14 ALA H 1 39 PHE QB 4.040 . 4.040 3.418 3.125 3.623 . 0 0 "[ . 1 . 2]" 1 2543 1 14 ALA H 1 54 LEU QD 3.840 . 3.840 2.875 2.627 3.219 . 0 0 "[ . 1 . 2]" 1 2544 1 14 ALA H 1 58 LEU QD 4.260 . 4.260 3.561 3.363 3.782 . 0 0 "[ . 1 . 2]" 1 2545 1 14 ALA HA 1 54 LEU QD 3.630 . 3.630 2.601 2.464 2.930 . 0 0 "[ . 1 . 2]" 1 2546 1 14 ALA HA 1 58 LEU QD 4.910 . 4.910 3.873 3.754 3.966 . 0 0 "[ . 1 . 2]" 1 2547 1 14 ALA HA 1 89 TRP QB 5.590 . 5.590 3.403 3.076 4.473 . 0 0 "[ . 1 . 2]" 1 2548 1 14 ALA MB 1 16 ILE QG 4.300 . 4.300 3.016 2.539 3.549 . 0 0 "[ . 1 . 2]" 1 2549 1 14 ALA MB 1 89 TRP QB 5.590 . 5.590 4.177 3.821 5.137 . 0 0 "[ . 1 . 2]" 1 2550 1 15 ILE H 1 54 LEU QD 4.950 . 4.950 4.109 3.935 4.523 . 0 0 "[ . 1 . 2]" 1 2551 1 15 ILE HA 1 16 ILE QG 5.090 . 5.090 3.564 3.457 3.736 . 0 0 "[ . 1 . 2]" 1 2552 1 15 ILE HB 1 72 VAL QG 3.880 . 3.880 3.264 2.942 3.696 . 0 0 "[ . 1 . 2]" 1 2553 1 15 ILE HB 1 90 HIS QB 4.940 . 4.940 3.498 2.898 3.913 . 0 0 "[ . 1 . 2]" 1 2554 1 15 ILE MG 1 17 GLU QB 4.240 . 4.240 2.558 2.096 3.016 . 0 0 "[ . 1 . 2]" 1 2555 1 15 ILE MD 1 126 LEU QD 5.070 . 5.070 3.870 3.630 4.160 . 0 0 "[ . 1 . 2]" 1 2556 1 16 ILE H 1 16 ILE QG 4.130 . 4.130 2.004 1.772 2.261 0.028 20 0 "[ . 1 . 2]" 1 2557 1 16 ILE HB 1 23 LEU QD 3.990 . 3.990 2.759 2.427 3.110 . 0 0 "[ . 1 . 2]" 1 2558 1 16 ILE QG 1 17 GLU H 4.960 . 4.960 4.611 4.311 4.865 . 0 0 "[ . 1 . 2]" 1 2559 1 16 ILE QG 1 62 LEU QD 5.200 . 5.200 3.022 2.455 3.700 . 0 0 "[ . 1 . 2]" 1 2560 1 17 GLU H 1 17 GLU QB 3.420 . 3.420 2.455 2.373 2.527 . 0 0 "[ . 1 . 2]" 1 2561 1 17 GLU HA 1 17 GLU QG 3.850 . 3.850 2.462 2.385 2.590 . 0 0 "[ . 1 . 2]" 1 2562 1 17 GLU QB 1 18 ARG H 4.390 . 4.390 3.804 3.671 3.918 . 0 0 "[ . 1 . 2]" 1 2563 1 17 GLU QB 1 20 GLY H 5.590 . 5.590 4.837 4.288 5.261 . 0 0 "[ . 1 . 2]" 1 2564 1 17 GLU QB 1 21 LYS H 5.590 . 5.590 5.077 4.744 5.342 . 0 0 "[ . 1 . 2]" 1 2565 1 17 GLU QB 1 22 ILE HA 5.100 . 5.100 3.456 2.919 3.929 . 0 0 "[ . 1 . 2]" 1 2566 1 17 GLU QB 1 22 ILE MG 3.790 . 3.790 3.391 2.806 3.836 0.046 15 0 "[ . 1 . 2]" 1 2567 1 17 GLU QG 1 18 ARG H 3.560 . 3.560 2.964 2.599 3.254 . 0 0 "[ . 1 . 2]" 1 2568 1 17 GLU QG 1 18 ARG HA 4.520 . 4.520 3.907 3.407 4.494 . 0 0 "[ . 1 . 2]" 1 2569 1 17 GLU QG 1 19 ASP H 5.590 . 5.590 4.593 3.859 5.455 . 0 0 "[ . 1 . 2]" 1 2570 1 17 GLU QG 1 20 GLY H 3.900 . 3.900 2.930 2.264 3.712 . 0 0 "[ . 1 . 2]" 1 2571 1 17 GLU QG 1 20 GLY HA2 4.280 . 4.280 3.065 2.634 3.632 . 0 0 "[ . 1 . 2]" 1 2572 1 17 GLU QG 1 20 GLY HA3 5.400 . 5.400 4.380 3.948 4.931 . 0 0 "[ . 1 . 2]" 1 2573 1 17 GLU QG 1 21 LYS H 3.940 . 3.940 3.150 2.741 3.420 . 0 0 "[ . 1 . 2]" 1 2574 1 17 GLU QG 1 22 ILE HA 4.850 . 4.850 3.532 3.049 3.805 . 0 0 "[ . 1 . 2]" 1 2575 1 17 GLU QG 1 22 ILE MG 4.360 . 4.360 4.227 3.732 4.425 0.065 3 0 "[ . 1 . 2]" 1 2576 1 18 ARG HB3 1 18 ARG QD 3.630 . 3.630 3.319 3.272 3.472 . 0 0 "[ . 1 . 2]" 1 2577 1 21 LYS H 1 108 TRP QB 5.590 . 5.590 4.923 4.462 5.309 . 0 0 "[ . 1 . 2]" 1 2578 1 21 LYS HA 1 108 TRP QB 5.590 . 5.590 4.622 4.327 4.917 . 0 0 "[ . 1 . 2]" 1 2579 1 21 LYS HB2 1 108 TRP QB 4.180 . 4.180 2.399 1.953 2.742 . 0 0 "[ . 1 . 2]" 1 2580 1 21 LYS HB3 1 108 TRP QB 4.490 . 4.490 2.528 2.173 2.896 . 0 0 "[ . 1 . 2]" 1 2581 1 21 LYS HG2 1 110 SER QB 5.530 . 5.530 4.500 3.261 5.321 . 0 0 "[ . 1 . 2]" 1 2582 1 21 LYS HD2 1 108 TRP QB 5.590 . 5.590 3.359 2.559 4.047 . 0 0 "[ . 1 . 2]" 1 2583 1 21 LYS HD3 1 108 TRP QB 5.590 . 5.590 3.866 2.423 4.749 . 0 0 "[ . 1 . 2]" 1 2584 1 21 LYS HD3 1 110 SER QB 5.410 . 5.410 4.196 2.772 5.500 0.090 7 0 "[ . 1 . 2]" 1 2585 1 21 LYS HE2 1 110 SER QB 5.590 . 5.590 4.322 3.356 5.296 . 0 0 "[ . 1 . 2]" 1 2586 1 21 LYS HE3 1 110 SER QB 5.590 . 5.590 4.122 2.790 4.909 . 0 0 "[ . 1 . 2]" 1 2587 1 22 ILE H 1 108 TRP QB 5.540 . 5.540 4.397 4.092 4.629 . 0 0 "[ . 1 . 2]" 1 2588 1 22 ILE HA 1 108 TRP QB 5.590 . 5.590 5.250 4.591 5.611 0.021 1 0 "[ . 1 . 2]" 1 2589 1 22 ILE HB 1 24 LEU QD 4.330 . 4.330 2.777 2.256 3.786 . 0 0 "[ . 1 . 2]" 1 2590 1 22 ILE MG 1 23 LEU QD 5.580 . 5.580 4.578 4.344 4.654 . 0 0 "[ . 1 . 2]" 1 2591 1 22 ILE HG12 1 24 LEU QD 5.690 . 5.690 5.088 4.648 5.777 0.087 6 0 "[ . 1 . 2]" 1 2592 1 22 ILE MD 1 24 LEU QD 4.000 . 4.000 3.685 3.285 4.061 0.061 18 0 "[ . 1 . 2]" 1 2593 1 23 LEU H 1 23 LEU QD 4.380 . 4.380 3.748 3.672 3.772 . 0 0 "[ . 1 . 2]" 1 2594 1 23 LEU H 1 24 LEU QD 4.910 . 4.910 3.939 3.585 4.902 . 0 0 "[ . 1 . 2]" 1 2595 1 23 LEU HA 1 23 LEU QD 3.370 . 3.370 2.080 1.986 2.399 . 0 0 "[ . 1 . 2]" 1 2596 1 23 LEU HA 1 24 LEU QD 4.920 . 4.920 3.494 2.949 4.628 . 0 0 "[ . 1 . 2]" 1 2597 1 23 LEU HB3 1 62 LEU QD 5.690 . 5.690 4.110 3.764 4.379 . 0 0 "[ . 1 . 2]" 1 2598 1 23 LEU HG 1 106 LEU QB 4.640 . 4.640 3.991 2.994 4.725 0.085 16 0 "[ . 1 . 2]" 1 2599 1 23 LEU QD 1 24 LEU H 3.620 . 3.620 2.639 2.230 3.199 . 0 0 "[ . 1 . 2]" 1 2600 1 23 LEU QD 1 24 LEU HA 5.020 . 5.020 4.303 3.313 4.666 . 0 0 "[ . 1 . 2]" 1 2601 1 23 LEU QD 1 25 ALA HA 4.780 . 4.780 4.431 3.580 4.791 0.011 10 0 "[ . 1 . 2]" 1 2602 1 23 LEU QD 1 39 PHE HA 5.510 . 5.510 5.431 4.633 5.586 0.076 10 0 "[ . 1 . 2]" 1 2603 1 23 LEU QD 1 40 ALA H 5.490 . 5.490 4.586 4.297 4.904 . 0 0 "[ . 1 . 2]" 1 2604 1 23 LEU QD 1 40 ALA MB 4.640 . 4.640 3.401 3.049 3.966 . 0 0 "[ . 1 . 2]" 1 2605 1 23 LEU QD 1 62 LEU HA 5.690 . 5.690 4.819 4.501 5.251 . 0 0 "[ . 1 . 2]" 1 2606 1 23 LEU QD 1 62 LEU QD 3.370 . 3.370 2.084 1.900 2.383 . 0 0 "[ . 1 . 2]" 1 2607 1 23 LEU QD 1 106 LEU H 5.390 . 5.390 4.963 4.741 5.255 . 0 0 "[ . 1 . 2]" 1 2608 1 23 LEU QD 1 106 LEU HA 3.970 . 3.970 3.459 2.948 3.720 . 0 0 "[ . 1 . 2]" 1 2609 1 23 LEU QD 1 106 LEU QB 3.240 . 3.240 2.174 1.746 2.888 0.054 3 0 "[ . 1 . 2]" 1 2610 1 23 LEU QD 1 107 VAL H 3.780 . 3.780 3.073 2.798 3.488 . 0 0 "[ . 1 . 2]" 1 2611 1 23 LEU QD 1 107 VAL HA 5.080 . 5.080 4.089 3.746 4.669 . 0 0 "[ . 1 . 2]" 1 2612 1 23 LEU QD 1 108 TRP H 5.020 . 5.020 4.270 3.573 5.116 0.096 19 0 "[ . 1 . 2]" 1 2613 1 23 LEU QD 1 108 TRP HA 4.360 . 4.360 3.590 3.223 4.366 0.006 19 0 "[ . 1 . 2]" 1 2614 1 23 LEU QD 1 109 CYS H 5.530 . 5.530 5.086 4.867 5.518 . 0 0 "[ . 1 . 2]" 1 2615 1 24 LEU H 1 24 LEU QD 3.730 . 3.730 2.713 2.178 3.591 . 0 0 "[ . 1 . 2]" 1 2616 1 24 LEU H 1 106 LEU QD 5.410 . 5.410 4.505 3.723 4.898 . 0 0 "[ . 1 . 2]" 1 2617 1 24 LEU H 1 107 VAL QG 4.030 . 4.030 2.966 2.665 3.142 . 0 0 "[ . 1 . 2]" 1 2618 1 24 LEU H 1 108 TRP QB 5.590 . 5.590 5.186 4.473 5.634 0.044 10 0 "[ . 1 . 2]" 1 2619 1 24 LEU HA 1 24 LEU QD 3.230 . 3.230 2.604 1.844 2.983 . 0 0 "[ . 1 . 2]" 1 2620 1 24 LEU HA 1 106 LEU QD 5.640 . 5.640 4.792 3.936 5.203 . 0 0 "[ . 1 . 2]" 1 2621 1 24 LEU HA 1 107 VAL QG 5.320 . 5.320 4.208 4.107 4.358 . 0 0 "[ . 1 . 2]" 1 2622 1 24 LEU HB2 1 24 LEU QD 3.250 . 3.250 2.175 2.116 2.361 . 0 0 "[ . 1 . 2]" 1 2623 1 24 LEU HB2 1 107 VAL QG 3.450 . 3.450 1.929 1.849 2.096 . 0 0 "[ . 1 . 2]" 1 2624 1 24 LEU HB3 1 106 LEU QD 5.690 . 5.690 5.542 4.915 5.780 0.090 5 0 "[ . 1 . 2]" 1 2625 1 24 LEU HB3 1 107 VAL QG 3.630 . 3.630 3.002 2.839 3.153 . 0 0 "[ . 1 . 2]" 1 2626 1 24 LEU HG 1 107 VAL QG 5.690 . 5.690 4.080 3.339 4.576 . 0 0 "[ . 1 . 2]" 1 2627 1 24 LEU QD 1 25 ALA H 4.970 . 4.970 3.906 3.096 4.244 . 0 0 "[ . 1 . 2]" 1 2628 1 24 LEU QD 1 37 TRP HA 5.180 . 5.180 4.491 4.034 4.872 . 0 0 "[ . 1 . 2]" 1 2629 1 24 LEU QD 1 37 TRP HB2 3.810 . 3.810 2.361 2.064 2.718 . 0 0 "[ . 1 . 2]" 1 2630 1 24 LEU QD 1 37 TRP HB3 4.920 . 4.920 2.623 2.406 2.976 . 0 0 "[ . 1 . 2]" 1 2631 1 24 LEU QD 1 38 GLU H 4.820 . 4.820 4.213 3.221 4.765 . 0 0 "[ . 1 . 2]" 1 2632 1 24 LEU QD 1 38 GLU HA 5.690 . 5.690 4.254 2.853 4.901 . 0 0 "[ . 1 . 2]" 1 2633 1 24 LEU QD 1 39 PHE HA 5.610 . 5.610 4.251 2.881 5.049 . 0 0 "[ . 1 . 2]" 1 2634 1 24 LEU QD 1 108 TRP HA 5.690 . 5.690 3.890 3.255 5.302 . 0 0 "[ . 1 . 2]" 1 2635 1 24 LEU QD 1 109 CYS H 5.220 . 5.220 3.205 2.738 4.534 . 0 0 "[ . 1 . 2]" 1 2636 1 24 LEU QD 1 109 CYS QB 4.530 . 4.530 3.499 2.756 3.891 . 0 0 "[ . 1 . 2]" 1 2637 1 24 LEU QD 1 111 PRO HA 5.690 . 5.690 4.983 4.449 5.710 0.020 12 0 "[ . 1 . 2]" 1 2638 1 24 LEU QD 1 114 ALA H 5.020 . 5.020 4.219 3.941 4.604 . 0 0 "[ . 1 . 2]" 1 2639 1 24 LEU QD 1 114 ALA HA 3.620 . 3.620 2.484 2.166 2.842 . 0 0 "[ . 1 . 2]" 1 2640 1 24 LEU QD 1 115 LEU QD 5.620 . 5.620 4.707 4.532 4.944 . 0 0 "[ . 1 . 2]" 1 2641 1 24 LEU QD 1 117 TYR H 5.560 . 5.560 4.359 3.953 4.914 . 0 0 "[ . 1 . 2]" 1 2642 1 24 LEU QD 1 117 TYR HB2 4.210 . 4.210 2.860 2.463 3.525 . 0 0 "[ . 1 . 2]" 1 2643 1 24 LEU QD 1 117 TYR HB3 4.480 . 4.480 3.258 2.856 4.023 . 0 0 "[ . 1 . 2]" 1 2644 1 24 LEU QD 1 117 TYR QD 4.850 . 4.850 3.356 2.893 4.127 . 0 0 "[ . 1 . 2]" 1 2645 1 24 LEU QD 1 119 LEU HA 5.690 . 5.690 4.434 4.057 4.728 . 0 0 "[ . 1 . 2]" 1 2646 1 24 LEU QD 1 119 LEU HG 4.700 . 4.700 3.359 3.039 3.660 . 0 0 "[ . 1 . 2]" 1 2647 1 24 LEU QD 1 119 LEU MD1 3.830 . 3.830 2.876 2.626 3.141 . 0 0 "[ . 1 . 2]" 1 2648 1 24 LEU QD 1 119 LEU MD2 3.460 . 3.460 1.886 1.785 2.082 0.015 10 0 "[ . 1 . 2]" 1 2649 1 25 ALA H 1 38 GLU QB 5.590 . 5.590 4.941 4.409 5.286 . 0 0 "[ . 1 . 2]" 1 2650 1 25 ALA H 1 106 LEU QD 4.830 . 4.830 4.133 3.463 4.513 . 0 0 "[ . 1 . 2]" 1 2651 1 25 ALA HA 1 106 LEU QD 3.510 . 3.510 2.254 1.973 3.174 . 0 0 "[ . 1 . 2]" 1 2652 1 25 ALA MB 1 106 LEU QB 5.590 . 5.590 4.389 3.993 4.529 . 0 0 "[ . 1 . 2]" 1 2653 1 26 GLN H 1 103 HIS QB 4.170 . 4.170 3.623 3.417 3.919 . 0 0 "[ . 1 . 2]" 1 2654 1 26 GLN QB 1 27 ARG H 4.510 . 4.510 3.861 3.500 3.966 . 0 0 "[ . 1 . 2]" 1 2655 1 26 GLN QB 1 37 TRP HA 4.680 . 4.680 3.929 3.350 4.176 . 0 0 "[ . 1 . 2]" 1 2656 1 26 GLN QB 1 104 GLN H 4.590 . 4.590 3.517 2.999 4.008 . 0 0 "[ . 1 . 2]" 1 2657 1 26 GLN QB 1 104 GLN HB3 4.280 . 4.280 2.721 2.246 3.442 . 0 0 "[ . 1 . 2]" 1 2658 1 26 GLN QB 1 105 ALA H 4.100 . 4.100 2.136 1.770 2.611 0.030 1 0 "[ . 1 . 2]" 1 2659 1 26 GLN QB 1 105 ALA MB 3.450 . 3.450 2.428 1.895 3.177 . 0 0 "[ . 1 . 2]" 1 2660 1 26 GLN QG 1 27 ARG H 4.130 . 4.130 3.223 2.338 3.886 . 0 0 "[ . 1 . 2]" 1 2661 1 26 GLN QG 1 28 PRO HD3 5.590 . 5.590 4.260 3.233 5.159 . 0 0 "[ . 1 . 2]" 1 2662 1 26 GLN QG 1 35 GLY H 4.740 . 4.740 2.761 2.261 3.672 . 0 0 "[ . 1 . 2]" 1 2663 1 26 GLN QG 1 35 GLY QA 4.880 . 4.880 2.999 2.617 3.488 . 0 0 "[ . 1 . 2]" 1 2664 1 26 GLN QG 1 36 LEU H 3.740 . 3.740 3.704 3.451 3.868 0.128 6 0 "[ . 1 . 2]" 1 2665 1 26 GLN QG 1 37 TRP HA 4.900 . 4.900 3.800 3.418 4.310 . 0 0 "[ . 1 . 2]" 1 2666 1 26 GLN QG 1 105 ALA MB 5.440 . 5.440 3.993 3.309 4.758 . 0 0 "[ . 1 . 2]" 1 2667 1 27 ARG HA 1 103 HIS QB 5.440 . 5.440 5.089 4.773 5.494 0.054 19 0 "[ . 1 . 2]" 1 2668 1 28 PRO HA 1 31 SER QB 5.110 . 5.110 4.551 3.033 5.233 0.123 4 0 "[ . 1 . 2]" 1 2669 1 28 PRO HB2 1 31 SER QB 4.370 . 4.370 2.369 1.693 3.565 0.107 20 0 "[ . 1 . 2]" 1 2670 1 28 PRO HB3 1 31 SER QB 4.910 . 4.910 3.159 2.529 4.698 . 0 0 "[ . 1 . 2]" 1 2671 1 28 PRO HG2 1 31 SER QB 4.370 . 4.370 3.012 2.139 3.880 . 0 0 "[ . 1 . 2]" 1 2672 1 28 PRO HG3 1 31 SER QB 4.310 . 4.310 2.987 1.979 4.087 . 0 0 "[ . 1 . 2]" 1 2673 1 29 ALA H 1 31 SER QB 5.260 . 5.260 3.933 3.141 4.838 . 0 0 "[ . 1 . 2]" 1 2674 1 29 ALA MB 1 30 GLN QB 4.850 . 4.850 3.665 3.504 3.925 . 0 0 "[ . 1 . 2]" 1 2675 1 29 ALA MB 1 30 GLN QG 4.660 . 4.660 2.700 2.458 3.184 . 0 0 "[ . 1 . 2]" 1 2676 1 30 GLN H 1 30 GLN QB 3.790 . 3.790 2.546 2.414 2.942 . 0 0 "[ . 1 . 2]" 1 2677 1 30 GLN H 1 30 GLN QG 4.550 . 4.550 2.503 1.884 2.953 . 0 0 "[ . 1 . 2]" 1 2678 1 30 GLN HA 1 30 GLN QG 3.540 . 3.540 2.555 2.366 3.307 . 0 0 "[ . 1 . 2]" 1 2679 1 31 SER H 1 31 SER QB 3.750 . 3.750 2.510 2.272 2.691 . 0 0 "[ . 1 . 2]" 1 2680 1 31 SER QB 1 32 ASP H 3.580 . 3.580 2.989 2.196 3.744 0.164 2 0 "[ . 1 . 2]" 1 2681 1 31 SER QB 1 32 ASP HA 5.160 . 5.160 4.458 4.206 4.793 . 0 0 "[ . 1 . 2]" 1 2682 1 31 SER QB 1 32 ASP QB 5.430 . 5.430 4.632 3.825 5.165 . 0 0 "[ . 1 . 2]" 1 2683 1 31 SER QB 1 33 GLN QB 4.520 . 4.520 3.638 2.727 4.577 0.057 14 0 "[ . 1 . 2]" 1 2684 1 31 SER QB 1 33 GLN HG2 5.200 . 5.200 3.467 1.843 5.152 . 0 0 "[ . 1 . 2]" 1 2685 1 31 SER QB 1 33 GLN HG3 5.190 . 5.190 2.794 2.260 5.208 0.018 10 0 "[ . 1 . 2]" 1 2686 1 32 ASP H 1 32 ASP QB 3.580 . 3.580 2.631 2.214 3.359 . 0 0 "[ . 1 . 2]" 1 2687 1 32 ASP QB 1 33 GLN HG2 4.500 . 4.500 4.253 3.582 4.702 0.202 19 0 "[ . 1 . 2]" 1 2688 1 33 GLN QB 1 34 ALA H 4.480 . 4.480 2.922 2.070 3.635 . 0 0 "[ . 1 . 2]" 1 2689 1 33 GLN QB 1 34 ALA HA 5.020 . 5.020 4.405 3.859 4.720 . 0 0 "[ . 1 . 2]" 1 2690 1 33 GLN QB 1 34 ALA MB 4.980 . 4.980 4.407 3.240 4.895 . 0 0 "[ . 1 . 2]" 1 2691 1 33 GLN QB 1 36 LEU H 5.590 . 5.590 4.899 4.105 5.642 0.052 6 0 "[ . 1 . 2]" 1 2692 1 33 GLN QB 1 36 LEU QD 3.800 . 3.800 2.963 1.977 3.865 0.065 1 0 "[ . 1 . 2]" 1 2693 1 33 GLN HG3 1 36 LEU QD 5.130 . 5.130 3.464 2.167 5.311 0.181 10 0 "[ . 1 . 2]" 1 2694 1 35 GLY QA 1 36 LEU QD 3.790 . 3.790 3.335 2.938 3.813 0.023 17 0 "[ . 1 . 2]" 1 2695 1 35 GLY HA2 1 36 LEU MD1 6.170 . 6.170 4.994 4.133 6.289 0.119 17 0 "[ . 1 . 2]" 1 2696 1 35 GLY HA2 1 36 LEU MD2 6.170 . 6.170 5.699 4.378 6.459 0.289 8 0 "[ . 1 . 2]" 1 2697 1 36 LEU H 1 36 LEU QD 3.730 . 3.730 2.256 1.743 2.937 0.057 10 0 "[ . 1 . 2]" 1 2698 1 36 LEU H 1 118 PRO QG 4.400 . 4.400 4.179 3.793 4.371 . 0 0 "[ . 1 . 2]" 1 2699 1 36 LEU HA 1 36 LEU QD 2.990 . 2.990 2.369 2.068 3.057 0.067 5 0 "[ . 1 . 2]" 1 2700 1 36 LEU HA 1 118 PRO QG 3.860 . 3.860 1.935 1.783 2.310 0.017 5 0 "[ . 1 . 2]" 1 2701 1 36 LEU HB2 1 36 LEU QD 3.130 . 3.130 2.155 2.091 2.255 . 0 0 "[ . 1 . 2]" 1 2702 1 36 LEU QD 1 37 TRP H 4.340 . 4.340 3.825 3.463 4.330 . 0 0 "[ . 1 . 2]" 1 2703 1 36 LEU QD 1 118 PRO HA 5.130 . 5.130 3.983 3.441 4.593 . 0 0 "[ . 1 . 2]" 1 2704 1 36 LEU QD 1 118 PRO HB2 3.560 . 3.560 2.137 1.749 2.789 0.051 9 0 "[ . 1 . 2]" 1 2705 1 36 LEU QD 1 118 PRO HB3 3.810 . 3.810 3.010 2.711 3.562 . 0 0 "[ . 1 . 2]" 1 2706 1 36 LEU QD 1 118 PRO QG 4.210 . 4.210 2.926 2.597 3.536 . 0 0 "[ . 1 . 2]" 1 2707 1 37 TRP H 1 118 PRO QG 5.110 . 5.110 2.694 2.223 3.212 . 0 0 "[ . 1 . 2]" 1 2708 1 37 TRP HA 1 38 GLU QB 5.590 . 5.590 4.359 4.055 4.570 . 0 0 "[ . 1 . 2]" 1 2709 1 37 TRP HB3 1 107 VAL QG 4.010 . 4.010 3.875 3.459 4.155 0.145 17 0 "[ . 1 . 2]" 1 2710 1 38 GLU H 1 38 GLU QB 3.680 . 3.680 3.127 2.772 3.311 . 0 0 "[ . 1 . 2]" 1 2711 1 38 GLU QB 1 39 PHE H 3.470 . 3.470 2.418 2.109 2.796 . 0 0 "[ . 1 . 2]" 1 2712 1 38 GLU QB 1 119 LEU MD2 4.350 . 4.350 4.055 3.594 4.362 0.012 7 0 "[ . 1 . 2]" 1 2713 1 38 GLU QB 1 120 ALA H 3.890 . 3.890 3.565 2.771 4.106 0.216 17 0 "[ . 1 . 2]" 1 2714 1 38 GLU QB 1 123 ASP HB2 5.280 . 5.280 4.553 3.005 5.211 . 0 0 "[ . 1 . 2]" 1 2715 1 39 PHE H 1 39 PHE QB 3.650 . 3.650 2.394 2.288 2.451 . 0 0 "[ . 1 . 2]" 1 2716 1 39 PHE QB 1 40 ALA H 3.920 . 3.920 2.956 2.482 3.370 . 0 0 "[ . 1 . 2]" 1 2717 1 40 ALA H 1 58 LEU QD 4.720 . 4.720 4.432 4.168 4.745 0.025 13 0 "[ . 1 . 2]" 1 2718 1 40 ALA H 1 62 LEU QD 4.800 . 4.800 3.917 3.475 4.179 . 0 0 "[ . 1 . 2]" 1 2719 1 40 ALA HA 1 58 LEU QD 5.050 . 5.050 4.182 3.922 4.605 . 0 0 "[ . 1 . 2]" 1 2720 1 40 ALA HA 1 62 LEU QD 5.460 . 5.460 3.924 3.715 4.263 . 0 0 "[ . 1 . 2]" 1 2721 1 40 ALA MB 1 61 GLU QG 4.520 . 4.520 4.379 3.360 4.610 0.090 17 0 "[ . 1 . 2]" 1 2722 1 41 GLY H 1 54 LEU QD 5.690 . 5.690 4.537 4.220 5.079 . 0 0 "[ . 1 . 2]" 1 2723 1 41 GLY H 1 57 GLU QB 4.870 . 4.870 4.019 3.658 4.214 . 0 0 "[ . 1 . 2]" 1 2724 1 41 GLY H 1 58 LEU QD 4.400 . 4.400 3.190 2.860 3.344 . 0 0 "[ . 1 . 2]" 1 2725 1 41 GLY H 1 61 GLU QG 5.190 . 5.190 4.280 3.837 4.683 . 0 0 "[ . 1 . 2]" 1 2726 1 41 GLY H 1 62 LEU QD 5.690 . 5.690 4.247 3.980 4.508 . 0 0 "[ . 1 . 2]" 1 2727 1 41 GLY HA2 1 54 LEU QD 4.150 . 4.150 2.431 2.165 2.943 . 0 0 "[ . 1 . 2]" 1 2728 1 41 GLY HA2 1 57 GLU QB 5.020 . 5.020 3.154 2.738 3.467 . 0 0 "[ . 1 . 2]" 1 2729 1 41 GLY HA2 1 57 GLU QG 5.280 . 5.280 4.194 3.405 4.570 . 0 0 "[ . 1 . 2]" 1 2730 1 41 GLY HA2 1 58 LEU QD 4.280 . 4.280 2.464 2.276 2.864 . 0 0 "[ . 1 . 2]" 1 2731 1 41 GLY HA3 1 54 LEU QD 3.930 . 3.930 2.784 2.411 3.269 . 0 0 "[ . 1 . 2]" 1 2732 1 41 GLY HA3 1 57 GLU QB 5.390 . 5.390 4.367 4.025 4.716 . 0 0 "[ . 1 . 2]" 1 2733 1 41 GLY HA3 1 58 LEU QD 4.640 . 4.640 3.659 3.482 3.825 . 0 0 "[ . 1 . 2]" 1 2734 1 42 GLY H 1 54 LEU QD 4.420 . 4.420 3.274 2.891 3.841 . 0 0 "[ . 1 . 2]" 1 2735 1 42 GLY H 1 57 GLU QB 5.470 . 5.470 4.288 3.947 4.691 . 0 0 "[ . 1 . 2]" 1 2736 1 42 GLY H 1 57 GLU QG 5.140 . 5.140 3.935 3.547 4.397 . 0 0 "[ . 1 . 2]" 1 2737 1 42 GLY HA3 1 57 GLU QB 4.700 . 4.700 3.269 2.714 4.302 . 0 0 "[ . 1 . 2]" 1 2738 1 42 GLY HA3 1 57 GLU QG 4.810 . 4.810 2.186 1.802 2.852 . 0 0 "[ . 1 . 2]" 1 2739 1 43 LYS H 1 43 LYS QG 4.230 . 4.230 3.981 3.878 4.077 . 0 0 "[ . 1 . 2]" 1 2740 1 43 LYS H 1 43 LYS QD 5.160 . 5.160 4.502 4.336 4.886 . 0 0 "[ . 1 . 2]" 1 2741 1 43 LYS H 1 57 GLU QG 5.120 . 5.120 3.808 2.884 4.689 . 0 0 "[ . 1 . 2]" 1 2742 1 43 LYS HA 1 43 LYS QD 4.630 . 4.630 4.028 3.892 4.109 . 0 0 "[ . 1 . 2]" 1 2743 1 43 LYS HA 1 44 VAL QG 4.390 . 4.390 3.335 3.272 3.393 . 0 0 "[ . 1 . 2]" 1 2744 1 43 LYS HB3 1 43 LYS QE 4.770 . 4.770 3.745 2.043 4.185 . 0 0 "[ . 1 . 2]" 1 2745 1 43 LYS QG 1 44 VAL H 3.740 . 3.740 2.134 1.927 2.275 . 0 0 "[ . 1 . 2]" 1 2746 1 43 LYS QG 1 44 VAL HB 5.340 . 5.340 4.035 3.888 4.232 . 0 0 "[ . 1 . 2]" 1 2747 1 43 LYS QG 1 44 VAL QG 4.460 . 4.460 3.798 3.699 3.886 . 0 0 "[ . 1 . 2]" 1 2748 1 43 LYS QG 1 45 GLU HA 4.850 . 4.850 4.087 3.780 4.866 0.016 5 0 "[ . 1 . 2]" 1 2749 1 43 LYS QE 1 45 GLU HA 4.490 . 4.490 4.036 2.745 4.565 0.075 13 0 "[ . 1 . 2]" 1 2750 1 43 LYS QE 1 46 PRO QD 5.010 . 5.010 4.382 3.466 5.047 0.037 11 0 "[ . 1 . 2]" 1 2751 1 44 VAL H 1 44 VAL QG 3.210 . 3.210 2.401 2.318 2.540 . 0 0 "[ . 1 . 2]" 1 2752 1 44 VAL HA 1 44 VAL QG 3.110 . 3.110 2.141 2.130 2.147 . 0 0 "[ . 1 . 2]" 1 2753 1 44 VAL QG 1 45 GLU H 3.560 . 3.560 2.829 2.436 3.128 . 0 0 "[ . 1 . 2]" 1 2754 1 44 VAL QG 1 45 GLU HA 4.640 . 4.640 3.857 3.630 4.147 . 0 0 "[ . 1 . 2]" 1 2755 1 44 VAL QG 1 46 PRO HA 5.350 . 5.350 3.781 3.239 4.034 . 0 0 "[ . 1 . 2]" 1 2756 1 44 VAL QG 1 48 GLU H 4.290 . 4.290 3.774 3.500 3.958 . 0 0 "[ . 1 . 2]" 1 2757 1 44 VAL QG 1 48 GLU HA 5.620 . 5.620 4.978 4.545 5.165 . 0 0 "[ . 1 . 2]" 1 2758 1 44 VAL QG 1 48 GLU HB2 5.480 . 5.480 4.311 3.863 4.703 . 0 0 "[ . 1 . 2]" 1 2759 1 44 VAL QG 1 48 GLU QG 3.740 . 3.740 2.348 1.889 2.934 . 0 0 "[ . 1 . 2]" 1 2760 1 44 VAL QG 1 49 SER H 5.050 . 5.050 4.510 4.090 4.937 . 0 0 "[ . 1 . 2]" 1 2761 1 44 VAL QG 1 49 SER HA 4.530 . 4.530 3.697 3.347 3.999 . 0 0 "[ . 1 . 2]" 1 2762 1 44 VAL QG 1 50 GLN H 4.610 . 4.610 3.653 3.364 4.033 . 0 0 "[ . 1 . 2]" 1 2763 1 44 VAL QG 1 50 GLN HB3 5.690 . 5.690 3.480 2.873 4.311 . 0 0 "[ . 1 . 2]" 1 2764 1 44 VAL QG 1 50 GLN HG2 3.650 . 3.650 2.446 1.972 3.148 . 0 0 "[ . 1 . 2]" 1 2765 1 44 VAL QG 1 50 GLN HG3 3.820 . 3.820 3.292 2.825 3.726 . 0 0 "[ . 1 . 2]" 1 2766 1 44 VAL QG 1 53 ALA H 5.370 . 5.370 3.755 3.462 4.048 . 0 0 "[ . 1 . 2]" 1 2767 1 44 VAL QG 1 87 HIS QB 5.010 . 5.010 4.395 4.053 4.773 . 0 0 "[ . 1 . 2]" 1 2768 1 45 GLU H 1 46 PRO QD 5.040 . 5.040 4.406 4.340 4.447 . 0 0 "[ . 1 . 2]" 1 2769 1 45 GLU H 1 48 GLU QG 3.230 . 3.230 2.346 2.192 2.543 . 0 0 "[ . 1 . 2]" 1 2770 1 45 GLU HA 1 46 PRO QD 3.040 . 3.040 2.079 1.958 2.194 . 0 0 "[ . 1 . 2]" 1 2771 1 45 GLU HA 1 48 GLU QG 4.380 . 4.380 4.117 3.900 4.380 . 0 0 "[ . 1 . 2]" 1 2772 1 46 PRO QD 1 47 ASP H 4.830 . 4.830 3.134 2.694 3.395 . 0 0 "[ . 1 . 2]" 1 2773 1 47 ASP H 1 47 ASP QB 3.480 . 3.480 2.440 2.277 2.747 . 0 0 "[ . 1 . 2]" 1 2774 1 47 ASP H 1 48 GLU QG 4.680 . 4.680 3.479 3.129 4.059 . 0 0 "[ . 1 . 2]" 1 2775 1 48 GLU H 1 48 GLU QG 3.320 . 3.320 2.219 2.026 2.405 . 0 0 "[ . 1 . 2]" 1 2776 1 48 GLU HA 1 52 GLN QG 4.550 . 4.550 4.054 3.309 4.559 0.009 16 0 "[ . 1 . 2]" 1 2777 1 48 GLU HB2 1 52 GLN QG 3.250 . 3.250 2.618 2.145 3.069 . 0 0 "[ . 1 . 2]" 1 2778 1 48 GLU QG 1 49 SER H 4.090 . 4.090 3.449 3.208 3.813 . 0 0 "[ . 1 . 2]" 1 2779 1 48 GLU QG 1 49 SER HA 5.590 . 5.590 4.235 4.020 4.470 . 0 0 "[ . 1 . 2]" 1 2780 1 48 GLU QG 1 53 ALA H 4.320 . 4.320 3.663 3.226 3.948 . 0 0 "[ . 1 . 2]" 1 2781 1 48 GLU QG 1 53 ALA MB 4.170 . 4.170 2.338 2.027 2.528 . 0 0 "[ . 1 . 2]" 1 2782 1 49 SER H 1 52 GLN QG 3.740 . 3.740 3.215 2.903 3.467 . 0 0 "[ . 1 . 2]" 1 2783 1 49 SER HA 1 52 GLN QG 5.590 . 5.590 5.646 5.375 5.807 0.217 3 0 "[ . 1 . 2]" 1 2784 1 49 SER QB 1 50 GLN H 3.670 . 3.670 2.929 2.270 3.455 . 0 0 "[ . 1 . 2]" 1 2785 1 49 SER QB 1 50 GLN HA 5.590 . 5.590 4.742 4.468 5.016 . 0 0 "[ . 1 . 2]" 1 2786 1 49 SER QB 1 50 GLN HB2 5.190 . 5.190 4.688 3.970 5.226 0.036 1 0 "[ . 1 . 2]" 1 2787 1 49 SER QB 1 51 ARG H 4.180 . 4.180 3.362 2.842 3.789 . 0 0 "[ . 1 . 2]" 1 2788 1 49 SER QB 1 51 ARG QG 5.430 . 5.430 4.382 3.712 4.929 . 0 0 "[ . 1 . 2]" 1 2789 1 49 SER QB 1 52 GLN H 4.840 . 4.840 2.547 2.157 3.417 . 0 0 "[ . 1 . 2]" 1 2790 1 49 SER QB 1 52 GLN HB3 3.690 . 3.690 2.479 1.890 3.665 . 0 0 "[ . 1 . 2]" 1 2791 1 50 GLN H 1 51 ARG QG 5.050 . 5.050 4.324 3.987 4.550 . 0 0 "[ . 1 . 2]" 1 2792 1 51 ARG H 1 51 ARG QB 3.760 . 3.760 2.572 2.490 2.649 . 0 0 "[ . 1 . 2]" 1 2793 1 51 ARG H 1 51 ARG QG 3.780 . 3.780 2.147 1.999 2.319 . 0 0 "[ . 1 . 2]" 1 2794 1 51 ARG HA 1 51 ARG QG 3.640 . 3.640 2.517 2.393 2.592 . 0 0 "[ . 1 . 2]" 1 2795 1 51 ARG HA 1 54 LEU QD 4.220 . 4.220 2.870 2.258 3.325 . 0 0 "[ . 1 . 2]" 1 2796 1 51 ARG HA 1 55 VAL QG 5.520 . 5.520 3.836 3.671 4.047 . 0 0 "[ . 1 . 2]" 1 2797 1 51 ARG HA 1 68 VAL QG 3.280 . 3.280 2.162 1.871 2.477 . 0 0 "[ . 1 . 2]" 1 2798 1 51 ARG QB 1 51 ARG QD 3.440 . 3.440 2.126 2.068 2.311 . 0 0 "[ . 1 . 2]" 1 2799 1 51 ARG QB 1 52 GLN H 3.770 . 3.770 2.710 2.500 2.913 . 0 0 "[ . 1 . 2]" 1 2800 1 51 ARG QB 1 52 GLN HA 5.590 . 5.590 3.783 3.685 3.929 . 0 0 "[ . 1 . 2]" 1 2801 1 51 ARG QB 1 52 GLN HB2 5.590 . 5.590 4.066 3.859 4.336 . 0 0 "[ . 1 . 2]" 1 2802 1 51 ARG QB 1 68 VAL HA 4.910 . 4.910 4.875 4.743 5.029 0.119 1 0 "[ . 1 . 2]" 1 2803 1 51 ARG QB 1 68 VAL HB 4.110 . 4.110 2.039 1.861 2.327 . 0 0 "[ . 1 . 2]" 1 2804 1 51 ARG QB 1 68 VAL QG 3.630 . 3.630 2.455 2.158 2.745 . 0 0 "[ . 1 . 2]" 1 2805 1 51 ARG QG 1 52 GLN H 4.410 . 4.410 3.950 3.786 4.124 . 0 0 "[ . 1 . 2]" 1 2806 1 51 ARG QG 1 68 VAL HB 4.190 . 4.190 2.876 2.468 3.460 . 0 0 "[ . 1 . 2]" 1 2807 1 51 ARG QD 1 68 VAL HA 5.360 . 5.360 4.768 4.085 5.111 . 0 0 "[ . 1 . 2]" 1 2808 1 51 ARG QD 1 68 VAL HB 4.570 . 4.570 2.449 1.910 2.793 . 0 0 "[ . 1 . 2]" 1 2809 1 51 ARG QD 1 68 VAL QG 4.710 . 4.710 2.749 2.235 3.083 . 0 0 "[ . 1 . 2]" 1 2810 1 51 ARG QD 1 69 GLY HA2 4.560 . 4.560 3.991 2.990 4.549 . 0 0 "[ . 1 . 2]" 1 2811 1 52 GLN HA 1 52 GLN QG 3.290 . 3.290 2.676 2.410 3.076 . 0 0 "[ . 1 . 2]" 1 2812 1 52 GLN HA 1 55 VAL QG 3.690 . 3.690 2.999 2.629 3.196 . 0 0 "[ . 1 . 2]" 1 2813 1 52 GLN QG 1 53 ALA H 4.000 . 4.000 3.506 3.192 3.696 . 0 0 "[ . 1 . 2]" 1 2814 1 52 GLN QG 1 53 ALA HA 4.580 . 4.580 3.605 3.279 3.858 . 0 0 "[ . 1 . 2]" 1 2815 1 52 GLN QG 1 53 ALA MB 5.220 . 5.220 4.252 3.921 4.481 . 0 0 "[ . 1 . 2]" 1 2816 1 52 GLN QG 1 55 VAL H 5.590 . 5.590 4.975 4.697 5.196 . 0 0 "[ . 1 . 2]" 1 2817 1 52 GLN QG 1 55 VAL QG 4.410 . 4.410 4.180 3.634 4.535 0.125 8 0 "[ . 1 . 2]" 1 2818 1 52 GLN QG 1 56 ARG H 4.920 . 4.920 4.129 3.678 4.439 . 0 0 "[ . 1 . 2]" 1 2819 1 52 GLN QG 1 56 ARG HB3 4.810 . 4.810 3.745 3.220 4.179 . 0 0 "[ . 1 . 2]" 1 2820 1 52 GLN QG 1 56 ARG HG2 5.080 . 5.080 3.255 2.935 3.662 . 0 0 "[ . 1 . 2]" 1 2821 1 53 ALA MB 1 57 GLU QG 5.060 . 5.060 3.204 3.009 3.404 . 0 0 "[ . 1 . 2]" 1 2822 1 54 LEU H 1 54 LEU QD 4.200 . 4.200 3.227 3.124 3.306 . 0 0 "[ . 1 . 2]" 1 2823 1 54 LEU H 1 68 VAL QG 5.050 . 5.050 3.935 3.795 4.080 . 0 0 "[ . 1 . 2]" 1 2824 1 54 LEU HA 1 54 LEU QD 3.200 . 3.200 1.947 1.856 2.183 . 0 0 "[ . 1 . 2]" 1 2825 1 54 LEU HA 1 57 GLU QB 4.100 . 4.100 2.674 2.397 3.061 . 0 0 "[ . 1 . 2]" 1 2826 1 54 LEU HA 1 57 GLU QG 4.280 . 4.280 3.664 3.286 4.043 . 0 0 "[ . 1 . 2]" 1 2827 1 54 LEU HA 1 58 LEU QD 4.880 . 4.880 3.475 2.675 3.615 . 0 0 "[ . 1 . 2]" 1 2828 1 54 LEU HB2 1 54 LEU QD 3.060 . 3.060 2.275 2.174 2.322 . 0 0 "[ . 1 . 2]" 1 2829 1 54 LEU HB2 1 68 VAL QG 3.710 . 3.710 2.307 2.084 2.500 . 0 0 "[ . 1 . 2]" 1 2830 1 54 LEU HB3 1 68 VAL QG 3.770 . 3.770 2.851 2.602 3.131 . 0 0 "[ . 1 . 2]" 1 2831 1 54 LEU HG 1 89 TRP QB 5.590 . 5.590 4.646 4.246 5.717 0.127 20 0 "[ . 1 . 2]" 1 2832 1 54 LEU QD 1 57 GLU H 5.690 . 5.690 4.917 4.718 5.321 . 0 0 "[ . 1 . 2]" 1 2833 1 54 LEU QD 1 57 GLU QB 5.010 . 5.010 3.467 3.151 4.053 . 0 0 "[ . 1 . 2]" 1 2834 1 54 LEU QD 1 88 ALA HA 5.690 . 5.690 4.224 3.965 4.593 . 0 0 "[ . 1 . 2]" 1 2835 1 54 LEU QD 1 89 TRP H 4.180 . 4.180 3.253 2.877 3.920 . 0 0 "[ . 1 . 2]" 1 2836 1 54 LEU QD 1 89 TRP QB 3.470 . 3.470 2.218 1.902 3.018 . 0 0 "[ . 1 . 2]" 1 2837 1 55 VAL H 1 55 VAL QG 3.450 . 3.450 2.224 2.098 2.354 . 0 0 "[ . 1 . 2]" 1 2838 1 55 VAL H 1 58 LEU QD 5.040 . 5.040 4.565 4.235 4.681 . 0 0 "[ . 1 . 2]" 1 2839 1 55 VAL H 1 68 VAL QG 3.800 . 3.800 3.330 3.212 3.420 . 0 0 "[ . 1 . 2]" 1 2840 1 55 VAL HA 1 55 VAL QG 3.040 . 3.040 2.119 2.106 2.131 . 0 0 "[ . 1 . 2]" 1 2841 1 55 VAL HA 1 58 LEU QD 4.450 . 4.450 3.374 3.218 3.499 . 0 0 "[ . 1 . 2]" 1 2842 1 55 VAL HA 1 68 VAL QG 4.520 . 4.520 3.810 3.579 4.116 . 0 0 "[ . 1 . 2]" 1 2843 1 55 VAL HB 1 68 VAL QG 4.800 . 4.800 4.265 4.061 4.439 . 0 0 "[ . 1 . 2]" 1 2844 1 55 VAL QG 1 56 ARG H 3.520 . 3.520 3.083 2.987 3.137 . 0 0 "[ . 1 . 2]" 1 2845 1 55 VAL QG 1 56 ARG HA 4.390 . 4.390 3.144 3.006 3.215 . 0 0 "[ . 1 . 2]" 1 2846 1 55 VAL QG 1 57 GLU H 4.620 . 4.620 4.698 4.649 4.736 0.116 13 0 "[ . 1 . 2]" 1 2847 1 55 VAL QG 1 66 ALA H 4.440 . 4.440 2.727 2.396 2.917 . 0 0 "[ . 1 . 2]" 1 2848 1 55 VAL QG 1 66 ALA HA 4.910 . 4.910 4.210 3.949 4.370 . 0 0 "[ . 1 . 2]" 1 2849 1 55 VAL QG 1 67 THR H 4.430 . 4.430 4.344 4.065 4.453 0.023 9 0 "[ . 1 . 2]" 1 2850 1 55 VAL QG 1 67 THR HA 3.710 . 3.710 3.302 2.778 3.635 . 0 0 "[ . 1 . 2]" 1 2851 1 55 VAL QG 1 68 VAL H 3.970 . 3.970 3.108 2.885 3.429 . 0 0 "[ . 1 . 2]" 1 2852 1 55 VAL QG 1 68 VAL HA 4.630 . 4.630 4.681 4.608 4.766 0.136 8 0 "[ . 1 . 2]" 1 2853 1 55 VAL QG 1 68 VAL HB 4.210 . 4.210 3.612 3.403 3.918 . 0 0 "[ . 1 . 2]" 1 2854 1 55 VAL QG 1 68 VAL QG 3.090 . 3.090 2.114 1.984 2.245 . 0 0 "[ . 1 . 2]" 1 2855 1 56 ARG H 1 56 ARG QD 4.760 . 4.760 3.898 3.507 4.228 . 0 0 "[ . 1 . 2]" 1 2856 1 56 ARG H 1 68 VAL QG 5.500 . 5.500 5.469 5.339 5.585 0.085 17 0 "[ . 1 . 2]" 1 2857 1 56 ARG HA 1 56 ARG QD 4.190 . 4.190 3.892 3.706 4.186 . 0 0 "[ . 1 . 2]" 1 2858 1 56 ARG HB3 1 56 ARG QD 3.900 . 3.900 3.133 2.664 3.511 . 0 0 "[ . 1 . 2]" 1 2859 1 56 ARG HG3 1 57 GLU QG 5.140 . 5.140 2.958 2.177 3.349 . 0 0 "[ . 1 . 2]" 1 2860 1 56 ARG QD 1 57 GLU H 4.750 . 4.750 2.708 1.967 3.821 . 0 0 "[ . 1 . 2]" 1 2861 1 56 ARG QD 1 57 GLU HA 4.010 . 4.010 2.974 2.439 4.091 0.081 11 0 "[ . 1 . 2]" 1 2862 1 57 GLU H 1 57 GLU QB 3.340 . 3.340 2.367 2.305 2.442 . 0 0 "[ . 1 . 2]" 1 2863 1 57 GLU H 1 57 GLU QG 3.240 . 3.240 2.410 2.213 2.587 . 0 0 "[ . 1 . 2]" 1 2864 1 57 GLU HA 1 57 GLU QG 3.340 . 3.340 2.753 2.640 2.890 . 0 0 "[ . 1 . 2]" 1 2865 1 57 GLU HA 1 61 GLU QG 4.970 . 4.970 4.044 3.551 4.629 . 0 0 "[ . 1 . 2]" 1 2866 1 57 GLU QB 1 58 LEU H 3.870 . 3.870 2.565 2.355 2.689 . 0 0 "[ . 1 . 2]" 1 2867 1 57 GLU QB 1 61 GLU QG 5.430 . 5.430 3.606 2.906 3.962 . 0 0 "[ . 1 . 2]" 1 2868 1 58 LEU H 1 58 LEU QD 3.670 . 3.670 2.725 2.010 2.892 . 0 0 "[ . 1 . 2]" 1 2869 1 58 LEU HA 1 58 LEU QD 3.220 . 3.220 2.132 2.044 2.495 . 0 0 "[ . 1 . 2]" 1 2870 1 58 LEU HA 1 61 GLU QG 5.030 . 5.030 4.204 2.074 4.593 . 0 0 "[ . 1 . 2]" 1 2871 1 58 LEU HA 1 62 LEU QD 4.060 . 4.060 3.090 2.986 3.257 . 0 0 "[ . 1 . 2]" 1 2872 1 58 LEU HB2 1 62 LEU QD 4.830 . 4.830 3.865 3.700 4.128 . 0 0 "[ . 1 . 2]" 1 2873 1 58 LEU HB3 1 58 LEU QD 3.070 . 3.070 2.133 2.108 2.287 . 0 0 "[ . 1 . 2]" 1 2874 1 58 LEU HG 1 62 LEU QD 5.140 . 5.140 3.859 1.775 4.345 0.025 13 0 "[ . 1 . 2]" 1 2875 1 58 LEU QD 1 59 ARG H 4.950 . 4.950 4.053 3.827 4.132 . 0 0 "[ . 1 . 2]" 1 2876 1 58 LEU QD 1 61 GLU H 5.250 . 5.250 4.525 4.359 4.715 . 0 0 "[ . 1 . 2]" 1 2877 1 58 LEU QD 1 61 GLU HB2 5.120 . 5.120 3.699 3.469 4.971 . 0 0 "[ . 1 . 2]" 1 2878 1 58 LEU QD 1 62 LEU HG 4.120 . 4.120 2.794 2.422 3.650 . 0 0 "[ . 1 . 2]" 1 2879 1 58 LEU QD 1 66 ALA H 4.350 . 4.350 3.703 3.360 3.983 . 0 0 "[ . 1 . 2]" 1 2880 1 58 LEU QD 1 66 ALA HA 5.140 . 5.140 4.155 3.998 4.501 . 0 0 "[ . 1 . 2]" 1 2881 1 58 LEU QD 1 67 THR H 5.690 . 5.690 4.967 4.801 5.270 . 0 0 "[ . 1 . 2]" 1 2882 1 58 LEU QD 1 91 VAL HA 5.490 . 5.490 5.445 5.235 5.635 0.145 1 0 "[ . 1 . 2]" 1 2883 1 59 ARG HD2 1 65 GLU QG 5.120 . 5.120 3.084 2.028 4.266 . 0 0 "[ . 1 . 2]" 1 2884 1 60 GLU HB2 1 61 GLU QG 4.410 . 4.410 3.369 2.713 4.002 . 0 0 "[ . 1 . 2]" 1 2885 1 61 GLU H 1 62 LEU QD 4.970 . 4.970 4.565 4.400 4.660 . 0 0 "[ . 1 . 2]" 1 2886 1 61 GLU HA 1 102 GLU QB 5.240 . 5.240 4.405 4.047 4.824 . 0 0 "[ . 1 . 2]" 1 2887 1 61 GLU HB2 1 62 LEU QD 4.360 . 4.360 3.335 3.083 3.527 . 0 0 "[ . 1 . 2]" 1 2888 1 61 GLU HB3 1 62 LEU QD 4.250 . 4.250 2.912 2.321 4.329 0.079 2 0 "[ . 1 . 2]" 1 2889 1 61 GLU HB3 1 102 GLU QB 3.870 . 3.870 4.062 2.797 4.272 0.402 8 0 "[ . 1 . 2]" 1 2890 1 61 GLU QG 1 62 LEU HG 4.470 . 4.470 4.388 1.785 4.592 0.122 7 0 "[ . 1 . 2]" 1 2891 1 61 GLU QG 1 62 LEU QD 4.280 . 4.280 4.170 2.713 4.363 0.083 10 0 "[ . 1 . 2]" 1 2892 1 62 LEU HA 1 62 LEU QD 3.130 . 3.130 2.081 1.976 2.175 . 0 0 "[ . 1 . 2]" 1 2893 1 62 LEU HA 1 106 LEU QD 4.780 . 4.780 3.890 3.446 4.443 . 0 0 "[ . 1 . 2]" 1 2894 1 62 LEU QD 1 63 GLY H 4.930 . 4.930 4.296 4.164 4.340 . 0 0 "[ . 1 . 2]" 1 2895 1 62 LEU QD 1 64 ILE H 5.680 . 5.680 4.388 4.287 4.540 . 0 0 "[ . 1 . 2]" 1 2896 1 62 LEU QD 1 94 PHE HB3 5.690 . 5.690 5.672 5.285 5.761 0.071 4 0 "[ . 1 . 2]" 1 2897 1 62 LEU QD 1 98 LEU HA 4.840 . 4.840 3.889 3.679 4.333 . 0 0 "[ . 1 . 2]" 1 2898 1 62 LEU QD 1 98 LEU HB2 5.410 . 5.410 3.349 2.901 4.849 . 0 0 "[ . 1 . 2]" 1 2899 1 62 LEU QD 1 99 GLN H 4.180 . 4.180 3.507 3.266 3.963 . 0 0 "[ . 1 . 2]" 1 2900 1 62 LEU QD 1 99 GLN HA 5.690 . 5.690 4.651 4.371 5.002 . 0 0 "[ . 1 . 2]" 1 2901 1 62 LEU QD 1 100 ALA HA 4.240 . 4.240 2.956 2.760 3.237 . 0 0 "[ . 1 . 2]" 1 2902 1 62 LEU QD 1 101 HIS H 4.790 . 4.790 3.621 3.387 3.789 . 0 0 "[ . 1 . 2]" 1 2903 1 62 LEU QD 1 103 HIS H 5.690 . 5.690 4.825 4.252 5.391 . 0 0 "[ . 1 . 2]" 1 2904 1 64 ILE HA 1 65 GLU QG 4.900 . 4.900 3.634 3.393 3.918 . 0 0 "[ . 1 . 2]" 1 2905 1 64 ILE HA 1 96 GLY QA 4.800 . 4.800 2.737 2.428 3.104 . 0 0 "[ . 1 . 2]" 1 2906 1 64 ILE HB 1 95 HIS QB 5.590 . 5.590 4.836 4.432 5.018 . 0 0 "[ . 1 . 2]" 1 2907 1 64 ILE HB 1 96 GLY QA 5.590 . 5.590 3.927 3.647 4.327 . 0 0 "[ . 1 . 2]" 1 2908 1 64 ILE HG13 1 65 GLU QG 5.590 . 5.590 5.561 5.420 5.690 0.100 8 0 "[ . 1 . 2]" 1 2909 1 65 GLU H 1 65 GLU QB 3.490 . 3.490 2.456 2.307 2.600 . 0 0 "[ . 1 . 2]" 1 2910 1 65 GLU H 1 65 GLU QG 3.900 . 3.900 2.420 2.097 2.892 . 0 0 "[ . 1 . 2]" 1 2911 1 65 GLU H 1 95 HIS QB 4.280 . 4.280 3.096 2.523 3.310 . 0 0 "[ . 1 . 2]" 1 2912 1 65 GLU HA 1 65 GLU QG 3.600 . 3.600 2.551 2.294 3.074 . 0 0 "[ . 1 . 2]" 1 2913 1 65 GLU QB 1 66 ALA H 4.330 . 4.330 3.635 3.535 3.699 . 0 0 "[ . 1 . 2]" 1 2914 1 65 GLU QB 1 66 ALA HA 5.590 . 5.590 4.490 4.410 4.589 . 0 0 "[ . 1 . 2]" 1 2915 1 65 GLU QB 1 95 HIS H 4.180 . 4.180 3.020 2.720 3.522 . 0 0 "[ . 1 . 2]" 1 2916 1 65 GLU QB 1 95 HIS QB 3.470 . 3.470 1.859 1.744 2.207 0.056 10 0 "[ . 1 . 2]" 1 2917 1 65 GLU QG 1 66 ALA H 5.010 . 5.010 4.446 4.099 4.862 . 0 0 "[ . 1 . 2]" 1 2918 1 65 GLU QG 1 95 HIS QB 4.500 . 4.500 3.458 2.812 4.168 . 0 0 "[ . 1 . 2]" 1 2919 1 66 ALA MB 1 68 VAL QG 4.570 . 4.570 3.086 2.845 3.562 . 0 0 "[ . 1 . 2]" 1 2920 1 67 THR H 1 68 VAL QG 5.030 . 5.030 4.293 4.050 4.442 . 0 0 "[ . 1 . 2]" 1 2921 1 67 THR HA 1 68 VAL QG 4.150 . 4.150 3.569 3.318 3.681 . 0 0 "[ . 1 . 2]" 1 2922 1 68 VAL H 1 68 VAL QG 2.920 . 2.920 2.195 2.049 2.507 . 0 0 "[ . 1 . 2]" 1 2923 1 68 VAL HA 1 68 VAL QG 3.130 . 3.130 2.131 2.119 2.142 . 0 0 "[ . 1 . 2]" 1 2924 1 68 VAL QG 1 69 GLY H 3.440 . 3.440 2.613 2.367 2.811 . 0 0 "[ . 1 . 2]" 1 2925 1 68 VAL QG 1 69 GLY HA2 4.340 . 4.340 3.472 3.144 3.826 . 0 0 "[ . 1 . 2]" 1 2926 1 68 VAL QG 1 69 GLY HA3 4.860 . 4.860 4.200 4.024 4.327 . 0 0 "[ . 1 . 2]" 1 2927 1 68 VAL QG 1 70 GLU HA 5.690 . 5.690 5.324 5.044 5.463 . 0 0 "[ . 1 . 2]" 1 2928 1 68 VAL QG 1 70 GLU HG2 5.690 . 5.690 5.200 4.431 5.779 0.089 4 0 "[ . 1 . 2]" 1 2929 1 68 VAL QG 1 89 TRP QB 3.870 . 3.870 2.297 1.831 3.188 . 0 0 "[ . 1 . 2]" 1 2930 1 68 VAL QG 1 91 VAL HA 4.850 . 4.850 3.904 3.445 4.572 . 0 0 "[ . 1 . 2]" 1 2931 1 70 GLU H 1 70 GLU QB 3.800 . 3.800 3.156 2.673 3.507 . 0 0 "[ . 1 . 2]" 1 2932 1 70 GLU HA 1 72 VAL QG 5.690 . 5.690 5.518 4.655 5.755 0.065 20 0 "[ . 1 . 2]" 1 2933 1 70 GLU QB 1 72 VAL QG 4.990 . 4.990 4.288 2.852 4.620 . 0 0 "[ . 1 . 2]" 1 2934 1 70 GLU QB 1 90 HIS QB 4.920 . 4.920 3.515 1.737 3.755 0.063 4 0 "[ . 1 . 2]" 1 2935 1 70 GLU HG3 1 72 VAL QG 4.320 . 4.320 3.786 3.319 4.444 0.124 4 0 "[ . 1 . 2]" 1 2936 1 70 GLU HG3 1 90 HIS QB 4.450 . 4.450 2.014 1.704 3.078 0.096 13 0 "[ . 1 . 2]" 1 2937 1 71 TYR H 1 71 TYR QB 3.000 . 3.000 2.279 2.093 2.596 . 0 0 "[ . 1 . 2]" 1 2938 1 71 TYR H 1 72 VAL QG 5.460 . 5.460 4.847 4.508 4.989 . 0 0 "[ . 1 . 2]" 1 2939 1 71 TYR HA 1 72 VAL QG 4.540 . 4.540 3.569 3.269 3.801 . 0 0 "[ . 1 . 2]" 1 2940 1 71 TYR HA 1 89 TRP QB 5.090 . 5.090 3.816 2.313 4.525 . 0 0 "[ . 1 . 2]" 1 2941 1 71 TYR QB 1 72 VAL H 4.690 . 4.690 3.520 2.772 3.880 . 0 0 "[ . 1 . 2]" 1 2942 1 71 TYR QB 1 89 TRP HA 5.590 . 5.590 4.550 3.657 5.258 . 0 0 "[ . 1 . 2]" 1 2943 1 72 VAL H 1 72 VAL QG 3.450 . 3.450 2.391 2.234 2.547 . 0 0 "[ . 1 . 2]" 1 2944 1 72 VAL H 1 89 TRP QB 5.340 . 5.340 4.489 3.448 5.001 . 0 0 "[ . 1 . 2]" 1 2945 1 72 VAL HA 1 72 VAL QG 3.100 . 3.100 2.135 2.121 2.146 . 0 0 "[ . 1 . 2]" 1 2946 1 72 VAL QG 1 73 ALA H 3.290 . 3.290 2.674 2.575 2.778 . 0 0 "[ . 1 . 2]" 1 2947 1 72 VAL QG 1 73 ALA HA 4.390 . 4.390 3.853 3.439 3.927 . 0 0 "[ . 1 . 2]" 1 2948 1 72 VAL QG 1 73 ALA MB 3.190 . 3.190 2.392 2.025 2.542 . 0 0 "[ . 1 . 2]" 1 2949 1 72 VAL QG 1 88 ALA H 5.690 . 5.690 4.795 4.693 4.951 . 0 0 "[ . 1 . 2]" 1 2950 1 72 VAL QG 1 89 TRP H 4.860 . 4.860 4.325 3.797 4.761 . 0 0 "[ . 1 . 2]" 1 2951 1 72 VAL QG 1 89 TRP HA 3.840 . 3.840 2.848 2.263 3.337 . 0 0 "[ . 1 . 2]" 1 2952 1 72 VAL QG 1 90 HIS H 3.490 . 3.490 2.458 2.201 2.759 . 0 0 "[ . 1 . 2]" 1 2953 1 72 VAL QG 1 90 HIS HA 4.150 . 4.150 3.328 3.126 3.602 . 0 0 "[ . 1 . 2]" 1 2954 1 72 VAL QG 1 90 HIS QB 3.450 . 3.450 2.111 1.910 2.370 . 0 0 "[ . 1 . 2]" 1 2955 1 72 VAL QG 1 127 LEU HA 4.700 . 4.700 4.234 3.710 4.470 . 0 0 "[ . 1 . 2]" 1 2956 1 72 VAL QG 1 129 ALA H 5.180 . 5.180 4.552 4.272 4.717 . 0 0 "[ . 1 . 2]" 1 2957 1 72 VAL QG 1 129 ALA HA 5.300 . 5.300 4.792 4.675 4.940 . 0 0 "[ . 1 . 2]" 1 2958 1 72 VAL QG 1 130 PHE H 3.740 . 3.740 3.361 3.110 3.496 . 0 0 "[ . 1 . 2]" 1 2959 1 72 VAL QG 1 130 PHE HA 3.460 . 3.460 2.131 1.896 2.475 . 0 0 "[ . 1 . 2]" 1 2960 1 72 VAL QG 1 130 PHE HB2 3.940 . 3.940 2.107 1.868 2.326 . 0 0 "[ . 1 . 2]" 1 2961 1 72 VAL QG 1 130 PHE HB3 3.840 . 3.840 3.514 3.245 3.707 . 0 0 "[ . 1 . 2]" 1 2962 1 73 ALA H 1 126 LEU QD 4.120 . 4.120 3.881 3.563 4.295 0.175 6 0 "[ . 1 . 2]" 1 2963 1 73 ALA HA 1 126 LEU QD 5.400 . 5.400 4.479 4.232 4.750 . 0 0 "[ . 1 . 2]" 1 2964 1 73 ALA MB 1 126 LEU QD 3.240 . 3.240 2.659 2.279 3.025 . 0 0 "[ . 1 . 2]" 1 2965 1 74 SER H 1 126 LEU QD 4.540 . 4.540 3.520 2.855 3.880 . 0 0 "[ . 1 . 2]" 1 2966 1 74 SER HA 1 87 HIS QB 5.040 . 5.040 4.639 4.318 4.925 . 0 0 "[ . 1 . 2]" 1 2967 1 74 SER HA 1 126 LEU QD 3.780 . 3.780 2.477 2.167 2.748 . 0 0 "[ . 1 . 2]" 1 2968 1 74 SER QB 1 75 HIS H 3.670 . 3.670 2.832 2.582 3.432 . 0 0 "[ . 1 . 2]" 1 2969 1 74 SER QB 1 126 LEU QD 5.330 . 5.330 3.893 3.687 4.107 . 0 0 "[ . 1 . 2]" 1 2970 1 75 HIS H 1 126 LEU QD 3.710 . 3.710 2.502 2.318 2.701 . 0 0 "[ . 1 . 2]" 1 2971 1 75 HIS HA 1 126 LEU QD 4.410 . 4.410 3.762 3.570 3.865 . 0 0 "[ . 1 . 2]" 1 2972 1 75 HIS HB2 1 126 LEU QD 3.680 . 3.680 2.366 1.959 2.575 . 0 0 "[ . 1 . 2]" 1 2973 1 75 HIS HB3 1 86 LEU QD 4.610 . 4.610 3.431 3.118 3.785 . 0 0 "[ . 1 . 2]" 1 2974 1 75 HIS HB3 1 126 LEU QD 3.680 . 3.680 2.544 2.245 2.837 . 0 0 "[ . 1 . 2]" 1 2975 1 76 GLN H 1 126 LEU QD 5.690 . 5.690 5.191 4.947 5.313 . 0 0 "[ . 1 . 2]" 1 2976 1 77 ARG H 1 77 ARG QB 3.590 . 3.590 3.171 3.072 3.244 . 0 0 "[ . 1 . 2]" 1 2977 1 77 ARG QB 1 77 ARG HD2 2.890 . 2.890 2.342 2.247 2.457 . 0 0 "[ . 1 . 2]" 1 2978 1 77 ARG HG2 1 79 VAL QG 5.690 . 5.690 5.475 5.076 5.711 0.021 14 0 "[ . 1 . 2]" 1 2979 1 77 ARG HD3 1 86 LEU QD 5.460 . 5.460 3.091 2.448 3.539 . 0 0 "[ . 1 . 2]" 1 2980 1 78 GLU H 1 79 VAL QG 5.380 . 5.380 5.213 5.136 5.262 . 0 0 "[ . 1 . 2]" 1 2981 1 78 GLU HA 1 79 VAL QG 4.530 . 4.530 3.525 3.444 3.605 . 0 0 "[ . 1 . 2]" 1 2982 1 78 GLU HB2 1 79 VAL QG 5.200 . 5.200 4.386 4.310 4.564 . 0 0 "[ . 1 . 2]" 1 2983 1 78 GLU HB3 1 79 VAL QG 5.690 . 5.690 5.329 5.260 5.406 . 0 0 "[ . 1 . 2]" 1 2984 1 79 VAL H 1 79 VAL QG 3.480 . 3.480 2.160 1.994 2.222 . 0 0 "[ . 1 . 2]" 1 2985 1 79 VAL HA 1 79 VAL QG 3.060 . 3.060 2.381 2.351 2.416 . 0 0 "[ . 1 . 2]" 1 2986 1 79 VAL QG 1 80 SER H 4.460 . 4.460 3.250 3.204 3.311 . 0 0 "[ . 1 . 2]" 1 2987 1 79 VAL QG 1 80 SER HA 4.990 . 4.990 4.378 4.316 4.449 . 0 0 "[ . 1 . 2]" 1 2988 1 79 VAL QG 1 82 ARG H 5.030 . 5.030 3.188 2.945 3.424 . 0 0 "[ . 1 . 2]" 1 2989 1 79 VAL QG 1 82 ARG HB2 3.610 . 3.610 1.842 1.756 2.030 0.044 2 0 "[ . 1 . 2]" 1 2990 1 79 VAL QG 1 82 ARG HG3 5.690 . 5.690 3.456 3.081 3.764 . 0 0 "[ . 1 . 2]" 1 2991 1 79 VAL QG 1 82 ARG HD2 4.510 . 4.510 2.853 2.384 3.600 . 0 0 "[ . 1 . 2]" 1 2992 1 79 VAL QG 1 83 ILE H 5.570 . 5.570 4.549 4.305 4.658 . 0 0 "[ . 1 . 2]" 1 2993 1 79 VAL QG 1 83 ILE HA 4.670 . 4.670 4.251 3.943 4.409 . 0 0 "[ . 1 . 2]" 1 2994 1 79 VAL QG 1 84 ILE H 4.010 . 4.010 3.689 3.387 3.840 . 0 0 "[ . 1 . 2]" 1 2995 1 79 VAL QG 1 84 ILE HG12 3.420 . 3.420 2.045 1.857 2.210 . 0 0 "[ . 1 . 2]" 1 2996 1 79 VAL QG 1 84 ILE HG13 3.780 . 3.780 3.303 3.136 3.499 . 0 0 "[ . 1 . 2]" 1 2997 1 85 HIS HA 1 86 LEU QD 4.990 . 4.990 3.470 3.315 3.593 . 0 0 "[ . 1 . 2]" 1 2998 1 85 HIS HB3 1 86 LEU QD 5.690 . 5.690 4.942 4.823 5.058 . 0 0 "[ . 1 . 2]" 1 2999 1 86 LEU H 1 86 LEU QD 3.710 . 3.710 2.399 2.221 2.549 . 0 0 "[ . 1 . 2]" 1 3000 1 86 LEU H 1 126 LEU QD 4.980 . 4.980 4.295 4.048 4.482 . 0 0 "[ . 1 . 2]" 1 3001 1 86 LEU HA 1 86 LEU QD 3.410 . 3.410 2.842 2.748 2.951 . 0 0 "[ . 1 . 2]" 1 3002 1 86 LEU HB2 1 86 LEU QD 3.180 . 3.180 2.110 2.095 2.121 . 0 0 "[ . 1 . 2]" 1 3003 1 86 LEU HB2 1 126 LEU QD 4.220 . 4.220 2.785 2.553 2.996 . 0 0 "[ . 1 . 2]" 1 3004 1 86 LEU HB3 1 86 LEU QD 3.200 . 3.200 2.161 2.118 2.185 . 0 0 "[ . 1 . 2]" 1 3005 1 86 LEU HB3 1 126 LEU QD 4.040 . 4.040 2.206 1.828 2.406 . 0 0 "[ . 1 . 2]" 1 3006 1 86 LEU HG 1 126 LEU QD 4.530 . 4.530 4.122 3.833 4.340 . 0 0 "[ . 1 . 2]" 1 3007 1 86 LEU QD 1 87 HIS H 4.970 . 4.970 4.109 4.013 4.214 . 0 0 "[ . 1 . 2]" 1 3008 1 86 LEU QD 1 87 HIS HA 5.690 . 5.690 5.362 5.280 5.423 . 0 0 "[ . 1 . 2]" 1 3009 1 86 LEU QD 1 88 ALA H 5.690 . 5.690 5.646 5.526 5.728 0.038 11 0 "[ . 1 . 2]" 1 3010 1 86 LEU QD 1 88 ALA HA 5.690 . 5.690 5.531 5.437 5.671 . 0 0 "[ . 1 . 2]" 1 3011 1 86 LEU QD 1 122 ALA H 5.040 . 5.040 4.350 3.856 4.516 . 0 0 "[ . 1 . 2]" 1 3012 1 86 LEU QD 1 122 ALA HA 4.540 . 4.540 3.803 3.574 4.293 . 0 0 "[ . 1 . 2]" 1 3013 1 86 LEU QD 1 123 ASP H 5.200 . 5.200 4.339 4.016 4.552 . 0 0 "[ . 1 . 2]" 1 3014 1 86 LEU QD 1 123 ASP HA 4.760 . 4.760 3.984 3.662 4.216 . 0 0 "[ . 1 . 2]" 1 3015 1 86 LEU QD 1 126 LEU H 5.690 . 5.690 5.567 5.329 5.718 0.028 10 0 "[ . 1 . 2]" 1 3016 1 87 HIS H 1 87 HIS QB 3.540 . 3.540 2.528 2.318 2.617 . 0 0 "[ . 1 . 2]" 1 3017 1 87 HIS HA 1 126 LEU QD 4.760 . 4.760 3.690 3.373 3.967 . 0 0 "[ . 1 . 2]" 1 3018 1 87 HIS QB 1 88 ALA H 4.140 . 4.140 3.492 3.355 3.850 . 0 0 "[ . 1 . 2]" 1 3019 1 88 ALA H 1 126 LEU QD 4.150 . 4.150 2.820 2.462 3.148 . 0 0 "[ . 1 . 2]" 1 3020 1 88 ALA HA 1 126 LEU QD 4.750 . 4.750 3.298 3.137 3.468 . 0 0 "[ . 1 . 2]" 1 3021 1 89 TRP H 1 89 TRP QB 3.670 . 3.670 2.435 2.267 3.008 . 0 0 "[ . 1 . 2]" 1 3022 1 89 TRP H 1 126 LEU QD 5.570 . 5.570 4.907 4.779 5.012 . 0 0 "[ . 1 . 2]" 1 3023 1 89 TRP QB 1 90 HIS H 3.920 . 3.920 3.027 2.650 3.652 . 0 0 "[ . 1 . 2]" 1 3024 1 90 HIS QB 1 91 VAL H 4.200 . 4.200 3.808 3.696 3.938 . 0 0 "[ . 1 . 2]" 1 3025 1 95 HIS H 1 95 HIS QB 3.330 . 3.330 2.412 2.203 2.538 . 0 0 "[ . 1 . 2]" 1 3026 1 96 GLY QA 1 97 THR HA 4.600 . 4.600 3.942 3.929 3.951 . 0 0 "[ . 1 . 2]" 1 3027 1 97 THR HA 1 98 LEU QD 5.690 . 5.690 3.475 2.624 4.154 . 0 0 "[ . 1 . 2]" 1 3028 1 97 THR MG 1 98 LEU QD 3.940 . 3.940 3.297 2.322 4.031 0.091 13 0 "[ . 1 . 2]" 1 3029 1 98 LEU HA 1 98 LEU QD 3.740 . 3.740 3.205 2.199 3.429 . 0 0 "[ . 1 . 2]" 1 3030 1 98 LEU HB2 1 106 LEU QD 4.010 . 4.010 3.032 1.980 4.048 0.038 2 0 "[ . 1 . 2]" 1 3031 1 98 LEU QD 1 99 GLN H 4.870 . 4.870 4.161 3.739 4.420 . 0 0 "[ . 1 . 2]" 1 3032 1 99 GLN H 1 106 LEU QD 4.640 . 4.640 3.772 3.049 4.285 . 0 0 "[ . 1 . 2]" 1 3033 1 99 GLN HA 1 106 LEU QD 4.060 . 4.060 2.957 2.492 3.268 . 0 0 "[ . 1 . 2]" 1 3034 1 99 GLN HB2 1 106 LEU QD 5.690 . 5.690 4.555 3.878 5.049 . 0 0 "[ . 1 . 2]" 1 3035 1 99 GLN HB3 1 106 LEU QD 5.690 . 5.690 4.845 4.407 5.144 . 0 0 "[ . 1 . 2]" 1 3036 1 100 ALA HA 1 106 LEU QD 3.940 . 3.940 2.863 2.650 3.068 . 0 0 "[ . 1 . 2]" 1 3037 1 100 ALA MB 1 103 HIS QB 3.620 . 3.620 2.460 1.861 3.094 . 0 0 "[ . 1 . 2]" 1 3038 1 101 HIS H 1 102 GLU QB 4.890 . 4.890 4.563 4.018 4.948 0.058 10 0 "[ . 1 . 2]" 1 3039 1 101 HIS HB3 1 102 GLU QG 4.420 . 4.420 3.665 2.601 4.617 0.197 20 0 "[ . 1 . 2]" 1 3040 1 102 GLU HA 1 102 GLU QG 3.720 . 3.720 2.642 2.176 3.459 . 0 0 "[ . 1 . 2]" 1 3041 1 102 GLU QB 1 103 HIS H 3.820 . 3.820 2.924 2.371 3.709 . 0 0 "[ . 1 . 2]" 1 3042 1 102 GLU QB 1 103 HIS HA 4.590 . 4.590 4.043 3.641 4.602 0.012 14 0 "[ . 1 . 2]" 1 3043 1 103 HIS H 1 103 HIS QB 3.560 . 3.560 2.486 2.328 2.689 . 0 0 "[ . 1 . 2]" 1 3044 1 103 HIS H 1 106 LEU QD 5.690 . 5.690 4.860 4.430 5.163 . 0 0 "[ . 1 . 2]" 1 3045 1 103 HIS HA 1 106 LEU QD 5.690 . 5.690 5.287 4.522 5.594 . 0 0 "[ . 1 . 2]" 1 3046 1 103 HIS QB 1 104 GLN H 3.630 . 3.630 2.504 2.036 3.456 . 0 0 "[ . 1 . 2]" 1 3047 1 103 HIS QB 1 105 ALA H 4.230 . 4.230 3.793 3.332 4.191 . 0 0 "[ . 1 . 2]" 1 3048 1 103 HIS QB 1 106 LEU QD 3.980 . 3.980 2.997 2.349 3.406 . 0 0 "[ . 1 . 2]" 1 3049 1 104 GLN HA 1 104 GLN QG 3.840 . 3.840 2.583 2.329 3.008 . 0 0 "[ . 1 . 2]" 1 3050 1 104 GLN HA 1 106 LEU QD 5.690 . 5.690 5.221 4.619 5.856 0.166 10 0 "[ . 1 . 2]" 1 3051 1 104 GLN QG 1 105 ALA H 5.310 . 5.310 3.267 2.702 3.882 . 0 0 "[ . 1 . 2]" 1 3052 1 104 GLN QG 1 105 ALA MB 4.250 . 4.250 2.926 2.525 3.379 . 0 0 "[ . 1 . 2]" 1 3053 1 105 ALA H 1 106 LEU QD 4.420 . 4.420 4.077 3.714 4.500 0.080 10 0 "[ . 1 . 2]" 1 3054 1 105 ALA HA 1 106 LEU QD 4.580 . 4.580 3.363 2.436 4.389 . 0 0 "[ . 1 . 2]" 1 3055 1 105 ALA MB 1 106 LEU QD 4.820 . 4.820 3.938 3.384 4.492 . 0 0 "[ . 1 . 2]" 1 3056 1 105 ALA MB 1 107 VAL QG 5.690 . 5.690 4.363 3.422 4.781 . 0 0 "[ . 1 . 2]" 1 3057 1 106 LEU H 1 106 LEU QB 3.310 . 3.310 2.541 2.427 2.694 . 0 0 "[ . 1 . 2]" 1 3058 1 106 LEU H 1 106 LEU QD 3.840 . 3.840 2.985 2.155 3.700 . 0 0 "[ . 1 . 2]" 1 3059 1 106 LEU H 1 107 VAL QG 5.690 . 5.690 4.870 3.820 5.183 . 0 0 "[ . 1 . 2]" 1 3060 1 106 LEU HA 1 106 LEU QD 3.260 . 3.260 2.127 1.929 2.990 . 0 0 "[ . 1 . 2]" 1 3061 1 106 LEU HA 1 107 VAL QG 4.510 . 4.510 3.749 3.264 3.945 . 0 0 "[ . 1 . 2]" 1 3062 1 106 LEU QB 1 107 VAL H 4.200 . 4.200 3.213 2.916 3.617 . 0 0 "[ . 1 . 2]" 1 3063 1 106 LEU QD 1 107 VAL H 4.420 . 4.420 3.631 3.335 4.015 . 0 0 "[ . 1 . 2]" 1 3064 1 107 VAL H 1 107 VAL QG 3.450 . 3.450 2.288 2.127 2.361 . 0 0 "[ . 1 . 2]" 1 3065 1 107 VAL HA 1 107 VAL QG 3.150 . 3.150 2.271 2.228 2.344 . 0 0 "[ . 1 . 2]" 1 3066 1 107 VAL QG 1 108 TRP H 3.340 . 3.340 2.401 2.194 3.393 0.053 17 0 "[ . 1 . 2]" 1 3067 1 107 VAL QG 1 108 TRP HA 4.360 . 4.360 3.434 3.272 3.741 . 0 0 "[ . 1 . 2]" 1 3068 1 107 VAL QG 1 108 TRP QB 5.040 . 5.040 3.925 3.665 4.732 . 0 0 "[ . 1 . 2]" 1 3069 1 107 VAL QG 1 109 CYS H 4.480 . 4.480 3.549 3.348 3.982 . 0 0 "[ . 1 . 2]" 1 3070 1 107 VAL QG 1 109 CYS HA 5.050 . 5.050 4.111 3.816 5.148 0.098 17 0 "[ . 1 . 2]" 1 3071 1 107 VAL QG 1 109 CYS QB . . 4.690 2.914 2.700 3.564 . 0 0 "[ . 1 . 2]" 1 3072 1 108 TRP H 1 108 TRP QB 3.300 . 3.300 2.590 2.290 3.055 . 0 0 "[ . 1 . 2]" 1 3073 1 108 TRP QB 1 109 CYS H 4.120 . 4.120 3.381 3.149 3.507 . 0 0 "[ . 1 . 2]" 1 3074 1 109 CYS HA 1 110 SER QB 5.310 . 5.310 4.599 4.093 4.759 . 0 0 "[ . 1 . 2]" 1 3075 1 110 SER H 1 110 SER QB 3.200 . 3.200 2.537 2.219 2.772 . 0 0 "[ . 1 . 2]" 1 3076 1 110 SER QB 1 111 PRO HG2 5.060 . 5.060 3.553 3.228 4.530 . 0 0 "[ . 1 . 2]" 1 3077 1 110 SER QB 1 111 PRO HG3 5.590 . 5.590 4.432 4.188 5.425 . 0 0 "[ . 1 . 2]" 1 3078 1 110 SER QB 1 111 PRO HD2 3.390 . 3.390 2.004 1.762 3.137 0.038 7 0 "[ . 1 . 2]" 1 3079 1 110 SER QB 1 111 PRO HD3 4.150 . 4.150 3.443 3.047 4.244 0.094 11 0 "[ . 1 . 2]" 1 3080 1 110 SER QB 1 112 GLU H 4.150 . 4.150 3.138 2.627 3.592 . 0 0 "[ . 1 . 2]" 1 3081 1 110 SER QB 1 112 GLU QG 4.870 . 4.870 2.837 2.233 3.692 . 0 0 "[ . 1 . 2]" 1 3082 1 110 SER QB 1 113 GLU H 4.320 . 4.320 2.799 2.394 3.665 . 0 0 "[ . 1 . 2]" 1 3083 1 110 SER QB 1 113 GLU HB2 4.460 . 4.460 3.196 2.752 4.384 . 0 0 "[ . 1 . 2]" 1 3084 1 110 SER QB 1 113 GLU HG2 4.930 . 4.930 2.387 1.782 3.792 0.018 18 0 "[ . 1 . 2]" 1 3085 1 110 SER QB 1 113 GLU HG3 4.550 . 4.550 2.875 1.818 4.271 . 0 0 "[ . 1 . 2]" 1 3086 1 111 PRO HA 1 127 LEU QD 3.340 . 3.340 2.294 2.109 2.553 . 0 0 "[ . 1 . 2]" 1 3087 1 111 PRO HB2 1 127 LEU QD 3.980 . 3.980 3.167 2.853 3.520 . 0 0 "[ . 1 . 2]" 1 3088 1 111 PRO HB3 1 127 LEU QD 3.640 . 3.640 2.818 2.497 3.226 . 0 0 "[ . 1 . 2]" 1 3089 1 111 PRO HB3 1 134 ARG QD 4.790 . 4.790 3.450 2.733 4.081 . 0 0 "[ . 1 . 2]" 1 3090 1 111 PRO HG2 1 127 LEU QD 5.210 . 5.210 4.670 4.425 5.017 . 0 0 "[ . 1 . 2]" 1 3091 1 111 PRO HG2 1 134 ARG QD 5.350 . 5.350 3.704 2.268 4.978 . 0 0 "[ . 1 . 2]" 1 3092 1 111 PRO HG3 1 127 LEU QD 5.280 . 5.280 4.449 3.706 4.907 . 0 0 "[ . 1 . 2]" 1 3093 1 111 PRO HG3 1 134 ARG QB 4.650 . 4.650 4.089 3.535 4.674 0.024 13 0 "[ . 1 . 2]" 1 3094 1 111 PRO HD2 1 112 GLU QG 5.350 . 5.350 4.376 3.838 5.322 . 0 0 "[ . 1 . 2]" 1 3095 1 111 PRO HD3 1 134 ARG QD 4.850 . 4.850 4.169 3.573 4.920 0.070 18 0 "[ . 1 . 2]" 1 3096 1 112 GLU H 1 112 GLU QG 3.280 . 3.280 2.282 1.789 3.033 0.011 3 0 "[ . 1 . 2]" 1 3097 1 112 GLU H 1 127 LEU QD 5.140 . 5.140 4.172 3.931 4.438 . 0 0 "[ . 1 . 2]" 1 3098 1 112 GLU HA 1 112 GLU QG 3.730 . 3.730 3.406 3.330 3.522 . 0 0 "[ . 1 . 2]" 1 3099 1 112 GLU HA 1 127 LEU QD 4.500 . 4.500 3.468 3.024 3.913 . 0 0 "[ . 1 . 2]" 1 3100 1 112 GLU QG 1 113 GLU H 3.880 . 3.880 2.287 1.994 2.547 . 0 0 "[ . 1 . 2]" 1 3101 1 112 GLU QG 1 113 GLU HA 5.590 . 5.590 3.595 3.395 3.845 . 0 0 "[ . 1 . 2]" 1 3102 1 113 GLU HA 1 116 GLN QG 4.200 . 4.200 3.047 2.293 3.484 . 0 0 "[ . 1 . 2]" 1 3103 1 114 ALA H 1 127 LEU QD 4.780 . 4.780 3.850 3.677 4.066 . 0 0 "[ . 1 . 2]" 1 3104 1 114 ALA HA 1 115 LEU QD 5.690 . 5.690 5.154 4.995 5.244 . 0 0 "[ . 1 . 2]" 1 3105 1 114 ALA HA 1 127 LEU QD 5.690 . 5.690 4.714 4.448 4.897 . 0 0 "[ . 1 . 2]" 1 3106 1 114 ALA MB 1 115 LEU QD 3.620 . 3.620 3.600 3.396 3.684 0.064 14 0 "[ . 1 . 2]" 1 3107 1 115 LEU H 1 115 LEU QD 3.720 . 3.720 3.376 3.244 3.442 . 0 0 "[ . 1 . 2]" 1 3108 1 115 LEU H 1 127 LEU QD 3.930 . 3.930 3.001 2.738 3.425 . 0 0 "[ . 1 . 2]" 1 3109 1 115 LEU HA 1 115 LEU QD 2.980 . 2.980 1.771 1.753 1.796 0.047 20 0 "[ . 1 . 2]" 1 3110 1 115 LEU HB2 1 115 LEU QD 3.130 . 3.130 2.416 2.310 2.463 . 0 0 "[ . 1 . 2]" 1 3111 1 115 LEU HB2 1 116 GLN QG 5.430 . 5.430 4.476 3.736 4.695 . 0 0 "[ . 1 . 2]" 1 3112 1 115 LEU HB2 1 127 LEU QD 3.940 . 3.940 2.239 1.837 3.437 . 0 0 "[ . 1 . 2]" 1 3113 1 115 LEU HB3 1 115 LEU QD 3.110 . 3.110 2.198 2.112 2.234 . 0 0 "[ . 1 . 2]" 1 3114 1 115 LEU HB3 1 116 GLN QG 4.790 . 4.790 3.788 3.524 4.381 . 0 0 "[ . 1 . 2]" 1 3115 1 115 LEU HG 1 127 LEU QD 4.330 . 4.330 2.385 1.704 2.811 0.096 16 0 "[ . 1 . 2]" 1 3116 1 115 LEU QD 1 116 GLN H 5.150 . 5.150 4.088 3.992 4.370 . 0 0 "[ . 1 . 2]" 1 3117 1 115 LEU QD 1 117 TYR H 5.190 . 5.190 4.329 4.167 4.693 . 0 0 "[ . 1 . 2]" 1 3118 1 115 LEU QD 1 119 LEU HB2 3.700 . 3.700 3.322 3.120 3.522 . 0 0 "[ . 1 . 2]" 1 3119 1 115 LEU QD 1 119 LEU HB3 4.160 . 4.160 4.083 3.815 4.194 0.034 19 0 "[ . 1 . 2]" 1 3120 1 115 LEU QD 1 119 LEU MD1 3.040 . 3.040 1.918 1.751 2.072 0.049 6 0 "[ . 1 . 2]" 1 3121 1 115 LEU QD 1 123 ASP HB3 4.790 . 4.790 4.861 4.798 4.945 0.155 9 0 "[ . 1 . 2]" 1 3122 1 115 LEU QD 1 124 ILE HA 3.360 . 3.360 2.093 1.927 2.260 . 0 0 "[ . 1 . 2]" 1 3123 1 115 LEU QD 1 125 PRO HA 5.520 . 5.520 4.603 4.379 4.794 . 0 0 "[ . 1 . 2]" 1 3124 1 115 LEU QD 1 127 LEU H 4.420 . 4.420 3.592 3.467 3.713 . 0 0 "[ . 1 . 2]" 1 3125 1 115 LEU QD 1 127 LEU HB2 4.000 . 4.000 2.938 2.796 3.018 . 0 0 "[ . 1 . 2]" 1 3126 1 115 LEU QD 1 127 LEU HB3 4.030 . 4.030 1.792 1.742 1.918 0.058 7 0 "[ . 1 . 2]" 1 3127 1 115 LEU QD 1 127 LEU HG 3.620 . 3.620 2.604 2.286 2.985 . 0 0 "[ . 1 . 2]" 1 3128 1 115 LEU QD 1 128 GLU H 3.920 . 3.920 3.060 2.904 3.221 . 0 0 "[ . 1 . 2]" 1 3129 1 115 LEU QD 1 128 GLU HA 4.910 . 4.910 3.561 2.518 3.954 . 0 0 "[ . 1 . 2]" 1 3130 1 115 LEU QD 1 128 GLU HB2 5.030 . 5.030 4.306 3.973 4.722 . 0 0 "[ . 1 . 2]" 1 3131 1 115 LEU QD 1 128 GLU HB3 4.960 . 4.960 4.551 3.765 4.976 0.016 17 0 "[ . 1 . 2]" 1 3132 1 115 LEU QD 1 128 GLU HG2 3.650 . 3.650 2.533 1.998 3.024 . 0 0 "[ . 1 . 2]" 1 3133 1 115 LEU QD 1 128 GLU HG3 4.110 . 4.110 3.252 2.593 3.913 . 0 0 "[ . 1 . 2]" 1 3134 1 116 GLN H 1 116 GLN QG 3.440 . 3.440 2.401 2.191 2.725 . 0 0 "[ . 1 . 2]" 1 3135 1 116 GLN H 1 127 LEU QD 5.660 . 5.660 4.925 4.646 5.388 . 0 0 "[ . 1 . 2]" 1 3136 1 117 TYR HA 1 118 PRO QG 4.900 . 4.900 4.136 4.048 4.273 . 0 0 "[ . 1 . 2]" 1 3137 1 119 LEU MD1 1 127 LEU QD 4.290 . 4.290 3.290 3.084 3.477 . 0 0 "[ . 1 . 2]" 1 3138 1 122 ALA MB 1 126 LEU QD 4.350 . 4.350 3.307 3.070 3.525 . 0 0 "[ . 1 . 2]" 1 3139 1 123 ASP HA 1 126 LEU QD 3.490 . 3.490 2.288 1.971 2.855 . 0 0 "[ . 1 . 2]" 1 3140 1 123 ASP HB2 1 126 LEU QD 5.340 . 5.340 4.783 4.354 5.216 . 0 0 "[ . 1 . 2]" 1 3141 1 123 ASP HB3 1 126 LEU QD 5.400 . 5.400 4.248 3.777 5.069 . 0 0 "[ . 1 . 2]" 1 3142 1 124 ILE HA 1 127 LEU QD 4.900 . 4.900 4.467 4.312 4.624 . 0 0 "[ . 1 . 2]" 1 3143 1 125 PRO HB2 1 126 LEU QD 4.950 . 4.950 3.603 2.791 3.884 . 0 0 "[ . 1 . 2]" 1 3144 1 125 PRO HD2 1 126 LEU QD 5.690 . 5.690 4.511 3.993 4.867 . 0 0 "[ . 1 . 2]" 1 3145 1 126 LEU H 1 126 LEU QD 3.580 . 3.580 3.069 2.397 3.217 . 0 0 "[ . 1 . 2]" 1 3146 1 126 LEU HA 1 126 LEU QD 3.190 . 3.190 2.006 1.953 2.097 . 0 0 "[ . 1 . 2]" 1 3147 1 126 LEU QD 1 127 LEU H 4.970 . 4.970 4.043 3.891 4.108 . 0 0 "[ . 1 . 2]" 1 3148 1 127 LEU H 1 127 LEU QD 4.850 . 4.850 3.643 3.597 3.669 . 0 0 "[ . 1 . 2]" 1 3149 1 127 LEU HA 1 127 LEU QD 3.450 . 3.450 1.860 1.786 1.936 0.014 5 0 "[ . 1 . 2]" 1 3150 1 127 LEU QD 1 128 GLU H 4.090 . 4.090 3.386 3.269 3.504 . 0 0 "[ . 1 . 2]" 1 3151 1 127 LEU QD 1 128 GLU HA 4.330 . 4.330 3.131 2.952 3.267 . 0 0 "[ . 1 . 2]" 1 3152 1 127 LEU QD 1 128 GLU HG2 4.540 . 4.540 4.018 3.797 4.319 . 0 0 "[ . 1 . 2]" 1 3153 1 127 LEU QD 1 129 ALA H 5.690 . 5.690 4.464 4.387 4.556 . 0 0 "[ . 1 . 2]" 1 3154 1 127 LEU QD 1 130 PHE H 4.350 . 4.350 3.451 3.335 3.542 . 0 0 "[ . 1 . 2]" 1 3155 1 127 LEU QD 1 130 PHE HB2 4.150 . 4.150 3.083 2.905 3.225 . 0 0 "[ . 1 . 2]" 1 3156 1 127 LEU QD 1 130 PHE HB3 4.360 . 4.360 1.964 1.841 2.112 . 0 0 "[ . 1 . 2]" 1 3157 1 127 LEU QD 1 131 MET H 4.290 . 4.290 2.768 2.658 2.838 . 0 0 "[ . 1 . 2]" 1 3158 1 127 LEU QD 1 131 MET HA 4.690 . 4.690 4.071 3.914 4.139 . 0 0 "[ . 1 . 2]" 1 3159 1 127 LEU QD 1 131 MET HB2 4.690 . 4.690 3.869 3.712 3.966 . 0 0 "[ . 1 . 2]" 1 3160 1 127 LEU QD 1 131 MET HB3 3.860 . 3.860 2.578 2.344 2.706 . 0 0 "[ . 1 . 2]" 1 3161 1 127 LEU QD 1 131 MET HG2 4.770 . 4.770 2.833 2.628 3.159 . 0 0 "[ . 1 . 2]" 1 3162 1 127 LEU QD 1 131 MET HG3 5.690 . 5.690 4.107 3.934 4.414 . 0 0 "[ . 1 . 2]" 1 3163 1 127 LEU QD 1 132 ALA H 5.690 . 5.690 4.554 4.469 4.665 . 0 0 "[ . 1 . 2]" 1 3164 1 130 PHE H 1 133 LEU QD 5.690 . 5.690 4.550 4.304 4.853 . 0 0 "[ . 1 . 2]" 1 3165 1 130 PHE HA 1 134 ARG QG 4.830 . 4.830 4.393 3.897 4.842 0.012 1 0 "[ . 1 . 2]" 1 3166 1 131 MET HA 1 134 ARG QG 4.560 . 4.560 3.613 3.088 4.077 . 0 0 "[ . 1 . 2]" 1 3167 1 131 MET HA 1 134 ARG QD 4.150 . 4.150 3.186 2.744 3.518 . 0 0 "[ . 1 . 2]" 1 3168 1 131 MET HB2 1 134 ARG QD 5.590 . 5.590 5.022 4.445 5.369 . 0 0 "[ . 1 . 2]" 1 3169 1 133 LEU H 1 133 LEU QD 4.340 . 4.340 2.863 2.538 3.203 . 0 0 "[ . 1 . 2]" 1 3170 1 133 LEU H 1 134 ARG QG 4.600 . 4.600 4.335 3.934 4.608 0.008 1 0 "[ . 1 . 2]" 1 3171 1 133 LEU HA 1 133 LEU QD 3.110 . 3.110 2.097 1.840 2.256 . 0 0 "[ . 1 . 2]" 1 3172 1 133 LEU HA 1 138 PRO QD 4.450 . 4.450 2.726 2.020 4.157 . 0 0 "[ . 1 . 2]" 1 3173 1 133 LEU HB3 1 134 ARG QG 3.410 . 3.410 3.332 2.917 3.518 0.108 18 0 "[ . 1 . 2]" 1 3174 1 133 LEU HG 1 138 PRO QD 5.470 . 5.470 2.798 2.271 4.914 . 0 0 "[ . 1 . 2]" 1 3175 1 133 LEU QD 1 134 ARG H 4.870 . 4.870 4.135 3.940 4.243 . 0 0 "[ . 1 . 2]" 1 3176 1 133 LEU QD 1 134 ARG HA 5.010 . 5.010 5.037 4.727 5.124 0.114 15 0 "[ . 1 . 2]" 1 3177 1 133 LEU QD 1 134 ARG QD 5.530 . 5.530 5.383 4.910 5.669 0.139 7 0 "[ . 1 . 2]" 1 3178 1 133 LEU QD 1 137 ARG HA 5.000 . 5.000 4.760 4.510 5.093 0.093 14 0 "[ . 1 . 2]" 1 3179 1 133 LEU QD 1 138 PRO HA 5.280 . 5.280 5.104 3.714 5.375 0.095 15 0 "[ . 1 . 2]" 1 3180 1 133 LEU QD 1 138 PRO QG 4.300 . 4.300 2.675 1.949 4.067 . 0 0 "[ . 1 . 2]" 1 3181 1 133 LEU QD 1 138 PRO QD 3.650 . 3.650 3.102 2.578 3.666 0.016 14 0 "[ . 1 . 2]" 1 3182 1 133 LEU MD1 1 138 PRO HD3 5.980 . 5.980 3.688 2.697 5.425 . 0 0 "[ . 1 . 2]" 1 3183 1 133 LEU MD2 1 138 PRO HD3 5.980 . 5.980 4.144 3.097 5.084 . 0 0 "[ . 1 . 2]" 1 3184 1 134 ARG H 1 134 ARG QG 3.320 . 3.320 2.441 2.013 2.646 . 0 0 "[ . 1 . 2]" 1 3185 1 134 ARG H 1 134 ARG QD 4.280 . 4.280 3.862 3.574 4.117 . 0 0 "[ . 1 . 2]" 1 3186 1 134 ARG HA 1 134 ARG QG 3.720 . 3.720 2.400 2.348 2.561 . 0 0 "[ . 1 . 2]" 1 3187 1 134 ARG HA 1 137 ARG QB 4.480 . 4.480 4.133 3.437 4.630 0.150 12 0 "[ . 1 . 2]" 1 3188 1 134 ARG QB 1 134 ARG QD 3.350 . 3.350 2.343 2.196 2.438 . 0 0 "[ . 1 . 2]" 1 3189 1 134 ARG QB 1 135 ALA HA 5.040 . 5.040 4.011 3.900 4.151 . 0 0 "[ . 1 . 2]" 1 3190 1 134 ARG QB 1 136 ALA H 5.590 . 5.590 4.957 4.863 5.043 . 0 0 "[ . 1 . 2]" 1 3191 1 134 ARG QG 1 135 ALA H 4.630 . 4.630 4.278 3.983 4.415 . 0 0 "[ . 1 . 2]" 1 3192 1 134 ARG QD 1 135 ALA H 5.410 . 5.410 5.298 4.975 5.424 0.014 13 0 "[ . 1 . 2]" 1 3193 1 136 ALA HA 1 137 ARG QB 5.560 . 5.560 4.458 4.018 5.001 . 0 0 "[ . 1 . 2]" 1 3194 1 136 ALA MB 1 137 ARG QB 5.330 . 5.330 4.486 4.167 4.925 . 0 0 "[ . 1 . 2]" 1 3195 1 136 ALA MB 1 138 PRO QD 5.030 . 5.030 3.716 2.471 4.882 . 0 0 "[ . 1 . 2]" 1 3196 1 137 ARG H 1 137 ARG QB 3.400 . 3.400 3.002 2.848 3.341 . 0 0 "[ . 1 . 2]" 1 3197 1 137 ARG H 1 138 PRO QG 5.600 . 5.600 4.823 4.311 5.546 . 0 0 "[ . 1 . 2]" 1 3198 1 137 ARG H 1 138 PRO QD 4.470 . 4.470 2.943 2.501 3.591 . 0 0 "[ . 1 . 2]" 1 3199 1 137 ARG QB 1 138 PRO QD 3.950 . 3.950 3.535 2.656 3.834 . 0 0 "[ . 1 . 2]" 1 3200 1 138 PRO QB 1 139 ALA H 3.590 . 3.590 3.143 2.334 3.591 0.001 13 0 "[ . 1 . 2]" 1 3201 1 138 PRO QB 1 140 ASP H 4.940 . 4.940 3.875 2.226 4.957 0.017 3 0 "[ . 1 . 2]" 1 3202 1 138 PRO QG 1 139 ALA H 4.560 . 4.560 4.494 3.956 4.704 0.144 13 0 "[ . 1 . 2]" 1 3203 1 138 PRO QG 1 139 ALA MB 5.600 . 5.600 5.302 3.594 5.795 0.195 12 0 "[ . 1 . 2]" 1 3204 1 138 PRO QD 1 139 ALA H 5.210 . 5.210 4.786 2.649 4.991 . 0 0 "[ . 1 . 2]" 1 3205 1 140 ASP H 1 140 ASP QB 3.660 . 3.660 2.626 2.241 3.101 . 0 0 "[ . 1 . 2]" 1 stop_ save_ save_distance_constraint_statistics_2 _Distance_constraint_stats_list.Sf_category distance_constraint_statistics _Distance_constraint_stats_list.Constraint_list_ID 2 _Distance_constraint_stats_list.Constraint_count 70 _Distance_constraint_stats_list.Viol_count 312 _Distance_constraint_stats_list.Viol_total 367.575 _Distance_constraint_stats_list.Viol_max 0.349 _Distance_constraint_stats_list.Viol_rms 0.0353 _Distance_constraint_stats_list.Viol_average_all_restraints 0.0131 _Distance_constraint_stats_list.Viol_average_violations_only 0.0589 _Distance_constraint_stats_list.Cutoff_violation_report 0.500 _Distance_constraint_stats_list.Details . loop_ _Distance_constraint_stats_per_res.Atom_entity_assembly_ID _Distance_constraint_stats_per_res.Atom_comp_index_ID _Distance_constraint_stats_per_res.Atom_comp_ID _Distance_constraint_stats_per_res.Total_violation _Distance_constraint_stats_per_res.Max_violation _Distance_constraint_stats_per_res.Max_violation_model_number _Distance_constraint_stats_per_res.Over_cutoff_viol_count _Distance_constraint_stats_per_res.Over_cutoff_viol_per_model 1 7 LYS 0.399 0.136 1 0 "[ . 1 . 2]" 1 9 ILE 2.103 0.101 16 0 "[ . 1 . 2]" 1 10 GLU 0.162 0.047 7 0 "[ . 1 . 2]" 1 11 VAL 0.000 0.000 . 0 "[ . 1 . 2]" 1 12 VAL 0.071 0.061 18 0 "[ . 1 . 2]" 1 13 ALA 0.670 0.078 8 0 "[ . 1 . 2]" 1 14 ALA 1.299 0.104 20 0 "[ . 1 . 2]" 1 15 ILE 1.132 0.331 17 0 "[ . 1 . 2]" 1 22 ILE 0.228 0.098 2 0 "[ . 1 . 2]" 1 24 LEU 0.000 0.000 . 0 "[ . 1 . 2]" 1 26 GLN 0.090 0.078 5 0 "[ . 1 . 2]" 1 40 ALA 1.299 0.104 20 0 "[ . 1 . 2]" 1 42 GLY 0.071 0.061 18 0 "[ . 1 . 2]" 1 44 VAL 0.162 0.047 7 0 "[ . 1 . 2]" 1 51 ARG 0.000 0.000 . 0 "[ . 1 . 2]" 1 52 GLN 0.054 0.048 17 0 "[ . 1 . 2]" 1 53 ALA 0.527 0.126 10 0 "[ . 1 . 2]" 1 54 LEU 0.047 0.023 10 0 "[ . 1 . 2]" 1 55 VAL 0.310 0.132 11 0 "[ . 1 . 2]" 1 56 ARG 0.054 0.048 17 0 "[ . 1 . 2]" 1 57 GLU 3.278 0.173 13 0 "[ . 1 . 2]" 1 58 LEU 0.047 0.023 10 0 "[ . 1 . 2]" 1 59 ARG 0.310 0.132 11 0 "[ . 1 . 2]" 1 61 GLU 2.751 0.173 13 0 "[ . 1 . 2]" 1 73 ALA 0.179 0.064 6 0 "[ . 1 . 2]" 1 75 HIS 0.000 0.000 . 0 "[ . 1 . 2]" 1 77 ARG 2.439 0.164 18 0 "[ . 1 . 2]" 1 83 ILE 0.938 0.136 1 0 "[ . 1 . 2]" 1 84 ILE 2.439 0.164 18 0 "[ . 1 . 2]" 1 85 HIS 1.564 0.101 16 0 "[ . 1 . 2]" 1 86 LEU 0.000 0.000 . 0 "[ . 1 . 2]" 1 87 HIS 0.670 0.078 8 0 "[ . 1 . 2]" 1 88 ALA 0.179 0.064 6 0 "[ . 1 . 2]" 1 89 TRP 0.142 0.047 9 0 "[ . 1 . 2]" 1 91 VAL 0.990 0.331 17 0 "[ . 1 . 2]" 1 105 ALA 0.090 0.078 5 0 "[ . 1 . 2]" 1 107 VAL 0.000 0.000 . 0 "[ . 1 . 2]" 1 109 CYS 0.228 0.098 2 0 "[ . 1 . 2]" 1 126 LEU 2.040 0.234 19 0 "[ . 1 . 2]" 1 127 LEU 0.101 0.059 16 0 "[ . 1 . 2]" 1 128 GLU 0.000 0.000 . 0 "[ . 1 . 2]" 1 129 ALA 0.515 0.098 20 0 "[ . 1 . 2]" 1 130 PHE 3.098 0.238 12 0 "[ . 1 . 2]" 1 131 MET 0.295 0.119 17 0 "[ . 1 . 2]" 1 132 ALA 0.726 0.165 14 0 "[ . 1 . 2]" 1 133 LEU 1.798 0.349 9 0 "[ . 1 . 2]" 1 134 ARG 1.058 0.238 12 0 "[ . 1 . 2]" 1 135 ALA 0.193 0.119 17 0 "[ . 1 . 2]" 1 136 ALA 0.726 0.165 14 0 "[ . 1 . 2]" 1 137 ARG 1.283 0.349 9 0 "[ . 1 . 2]" stop_ loop_ _Distance_constraint_stats.Restraint_ID _Distance_constraint_stats.Atom_1_entity_assembly_ID _Distance_constraint_stats.Atom_1_comp_index_ID _Distance_constraint_stats.Atom_1_comp_ID _Distance_constraint_stats.Atom_1_ID _Distance_constraint_stats.Atom_2_entity_assembly_ID _Distance_constraint_stats.Atom_2_comp_index_ID _Distance_constraint_stats.Atom_2_comp_ID _Distance_constraint_stats.Atom_2_ID _Distance_constraint_stats.Node_1_distance_val _Distance_constraint_stats.Node_1_distance_lower_bound_val _Distance_constraint_stats.Node_1_distance_upper_bound_val _Distance_constraint_stats.Distance_average _Distance_constraint_stats.Distance_minimum _Distance_constraint_stats.Distance_maximum _Distance_constraint_stats.Max_violation _Distance_constraint_stats.Max_violation_model_number _Distance_constraint_stats.Over_cutoff_violation_count _Distance_constraint_stats.Over_cutoff_viol_per_model _Distance_constraint_stats.Distance_constraint_stats_ID 1 1 51 ARG O 1 55 VAL H 2.300 . 2.300 2.045 1.958 2.126 . 0 0 "[ . 1 . 2]" 2 2 1 51 ARG O 1 55 VAL N 3.300 2.800 3.300 2.976 2.897 3.040 . 0 0 "[ . 1 . 2]" 2 3 1 52 GLN O 1 56 ARG H 2.300 . 2.300 1.974 1.810 2.175 . 0 0 "[ . 1 . 2]" 2 4 1 52 GLN O 1 56 ARG N 3.300 2.800 3.300 2.923 2.752 3.124 0.048 17 0 "[ . 1 . 2]" 2 5 1 53 ALA O 1 57 GLU H 2.300 . 2.300 1.863 1.708 2.060 0.092 10 0 "[ . 1 . 2]" 2 6 1 53 ALA O 1 57 GLU N 3.300 2.800 3.300 2.822 2.674 3.024 0.126 10 0 "[ . 1 . 2]" 2 7 1 54 LEU O 1 58 LEU H 2.300 . 2.300 1.907 1.815 2.124 . 0 0 "[ . 1 . 2]" 2 8 1 54 LEU O 1 58 LEU N 3.300 2.800 3.300 2.870 2.777 3.077 0.023 10 0 "[ . 1 . 2]" 2 9 1 55 VAL O 1 59 ARG H 2.300 . 2.300 2.226 2.058 2.432 0.132 11 0 "[ . 1 . 2]" 2 10 1 55 VAL O 1 59 ARG N 3.300 2.800 3.300 3.113 2.969 3.328 0.028 11 0 "[ . 1 . 2]" 2 11 1 57 GLU O 1 61 GLU H 2.300 . 2.300 1.758 1.658 1.835 0.142 13 0 "[ . 1 . 2]" 2 12 1 57 GLU O 1 61 GLU N 3.300 2.800 3.300 2.708 2.627 2.781 0.173 13 0 "[ . 1 . 2]" 2 13 1 126 LEU O 1 130 PHE H 2.300 . 2.300 2.400 2.263 2.534 0.234 19 0 "[ . 1 . 2]" 2 14 1 126 LEU O 1 130 PHE N 3.300 2.800 3.300 3.105 2.985 3.231 . 0 0 "[ . 1 . 2]" 2 15 1 127 LEU O 1 131 MET H 2.300 . 2.300 1.866 1.762 1.965 0.038 16 0 "[ . 1 . 2]" 2 16 1 127 LEU O 1 131 MET N 3.300 2.800 3.300 2.845 2.741 2.943 0.059 16 0 "[ . 1 . 2]" 2 17 1 128 GLU O 1 132 ALA H 2.300 . 2.300 2.077 1.940 2.221 . 0 0 "[ . 1 . 2]" 2 18 1 128 GLU O 1 132 ALA N 3.300 2.800 3.300 2.965 2.841 3.088 . 0 0 "[ . 1 . 2]" 2 19 1 129 ALA O 1 133 LEU H 2.300 . 2.300 1.959 1.836 2.056 . 0 0 "[ . 1 . 2]" 2 20 1 129 ALA O 1 133 LEU N 3.300 2.800 3.300 2.783 2.702 2.873 0.098 20 0 "[ . 1 . 2]" 2 21 1 130 PHE O 1 134 ARG H 2.300 . 2.300 2.278 2.089 2.538 0.238 12 0 "[ . 1 . 2]" 2 22 1 130 PHE O 1 134 ARG N 3.300 2.800 3.300 3.151 3.008 3.349 0.049 12 0 "[ . 1 . 2]" 2 23 1 131 MET O 1 135 ALA H 2.300 . 2.300 2.196 2.036 2.419 0.119 17 0 "[ . 1 . 2]" 2 24 1 131 MET O 1 135 ALA N 3.300 2.800 3.300 2.906 2.814 3.093 . 0 0 "[ . 1 . 2]" 2 25 1 132 ALA O 1 136 ALA H 2.300 . 2.300 1.867 1.681 2.034 0.119 14 0 "[ . 1 . 2]" 2 26 1 132 ALA O 1 136 ALA N 3.300 2.800 3.300 2.798 2.635 2.945 0.165 14 0 "[ . 1 . 2]" 2 27 1 133 LEU O 1 137 ARG H 2.300 . 2.300 2.175 1.949 2.649 0.349 9 0 "[ . 1 . 2]" 2 28 1 133 LEU O 1 137 ARG N 3.300 2.800 3.300 2.857 2.703 3.173 0.097 13 0 "[ . 1 . 2]" 2 29 1 12 VAL H 1 42 GLY O 2.200 . 2.200 1.909 1.798 2.036 . 0 0 "[ . 1 . 2]" 2 30 1 12 VAL N 1 42 GLY O 3.200 2.700 3.200 2.815 2.737 2.916 . 0 0 "[ . 1 . 2]" 2 31 1 14 ALA H 1 40 ALA O 2.200 . 2.200 1.689 1.618 1.768 0.082 20 0 "[ . 1 . 2]" 2 32 1 14 ALA N 1 40 ALA O 3.200 2.700 3.200 2.661 2.596 2.743 0.104 20 0 "[ . 1 . 2]" 2 33 1 10 GLU O 1 44 VAL H 2.200 . 2.200 1.786 1.701 1.885 . 0 0 "[ . 1 . 2]" 2 34 1 10 GLU O 1 44 VAL N 3.200 2.700 3.200 2.735 2.653 2.839 0.047 7 0 "[ . 1 . 2]" 2 35 1 12 VAL O 1 42 GLY H 2.200 . 2.200 2.027 1.906 2.261 0.061 18 0 "[ . 1 . 2]" 2 36 1 12 VAL O 1 42 GLY N 3.200 2.700 3.200 2.977 2.885 3.202 0.002 18 0 "[ . 1 . 2]" 2 37 1 15 ILE H 1 89 TRP O 2.200 . 2.200 1.782 1.688 1.896 0.012 9 0 "[ . 1 . 2]" 2 38 1 15 ILE N 1 89 TRP O 3.200 2.700 3.200 2.751 2.653 2.832 0.047 9 0 "[ . 1 . 2]" 2 39 1 13 ALA H 1 87 HIS O 2.200 . 2.200 1.720 1.646 1.891 0.054 6 0 "[ . 1 . 2]" 2 40 1 13 ALA N 1 87 HIS O 3.200 2.700 3.200 2.700 2.622 2.870 0.078 8 0 "[ . 1 . 2]" 2 41 1 11 VAL H 1 85 HIS O 2.200 . 2.200 1.932 1.770 2.104 . 0 0 "[ . 1 . 2]" 2 42 1 11 VAL N 1 85 HIS O 3.200 2.700 3.200 2.906 2.750 3.061 . 0 0 "[ . 1 . 2]" 2 43 1 9 ILE H 1 83 ILE O 2.200 . 2.200 1.724 1.649 1.817 0.051 14 0 "[ . 1 . 2]" 2 44 1 9 ILE N 1 83 ILE O 3.200 2.700 3.200 2.683 2.632 2.734 0.068 14 0 "[ . 1 . 2]" 2 45 1 15 ILE O 1 91 VAL H 2.200 . 2.200 2.028 1.737 2.531 0.331 17 0 "[ . 1 . 2]" 2 46 1 15 ILE O 1 91 VAL N 3.200 2.700 3.200 2.967 2.689 3.457 0.257 17 0 "[ . 1 . 2]" 2 47 1 11 VAL O 1 87 HIS H 2.200 . 2.200 1.899 1.776 2.152 . 0 0 "[ . 1 . 2]" 2 48 1 11 VAL O 1 87 HIS N 3.200 2.700 3.200 2.811 2.713 3.064 . 0 0 "[ . 1 . 2]" 2 49 1 9 ILE O 1 85 HIS H 2.200 . 2.200 1.689 1.637 1.769 0.063 7 0 "[ . 1 . 2]" 2 50 1 9 ILE O 1 85 HIS N 3.200 2.700 3.200 2.644 2.599 2.710 0.101 16 0 "[ . 1 . 2]" 2 51 1 7 LYS O 1 83 ILE H 2.200 . 2.200 2.033 1.716 2.336 0.136 1 0 "[ . 1 . 2]" 2 52 1 7 LYS O 1 83 ILE N 3.200 2.700 3.200 2.933 2.650 3.214 0.050 12 0 "[ . 1 . 2]" 2 53 1 77 ARG O 1 84 ILE H 2.200 . 2.200 1.717 1.645 1.773 0.055 16 0 "[ . 1 . 2]" 2 54 1 77 ARG O 1 84 ILE N 3.200 2.700 3.200 2.586 2.536 2.644 0.164 18 0 "[ . 1 . 2]" 2 55 1 75 HIS O 1 86 LEU H 2.200 . 2.200 1.893 1.791 1.978 . 0 0 "[ . 1 . 2]" 2 56 1 75 HIS O 1 86 LEU N 3.200 2.700 3.200 2.836 2.748 2.951 . 0 0 "[ . 1 . 2]" 2 57 1 73 ALA O 1 88 ALA H 2.200 . 2.200 1.795 1.680 1.904 0.020 6 0 "[ . 1 . 2]" 2 58 1 73 ALA O 1 88 ALA N 3.200 2.700 3.200 2.724 2.636 2.778 0.064 6 0 "[ . 1 . 2]" 2 59 1 77 ARG H 1 84 ILE O 2.200 . 2.200 2.042 1.896 2.173 . 0 0 "[ . 1 . 2]" 2 60 1 77 ARG N 1 84 ILE O 3.200 2.700 3.200 2.996 2.859 3.111 . 0 0 "[ . 1 . 2]" 2 61 1 75 HIS H 1 86 LEU O 2.200 . 2.200 2.003 1.818 2.193 . 0 0 "[ . 1 . 2]" 2 62 1 75 HIS N 1 86 LEU O 3.200 2.700 3.200 2.918 2.769 3.075 . 0 0 "[ . 1 . 2]" 2 63 1 24 LEU H 1 107 VAL O 2.200 . 2.200 1.837 1.736 1.989 . 0 0 "[ . 1 . 2]" 2 64 1 24 LEU N 1 107 VAL O 3.200 2.700 3.200 2.811 2.701 2.973 . 0 0 "[ . 1 . 2]" 2 65 1 26 GLN H 1 105 ALA O 2.200 . 2.200 1.897 1.727 2.080 . 0 0 "[ . 1 . 2]" 2 66 1 26 GLN N 1 105 ALA O 3.200 2.700 3.200 2.817 2.622 2.996 0.078 5 0 "[ . 1 . 2]" 2 67 1 22 ILE O 1 109 CYS H 2.200 . 2.200 2.100 1.913 2.298 0.098 2 0 "[ . 1 . 2]" 2 68 1 22 ILE O 1 109 CYS N 3.200 2.700 3.200 3.047 2.876 3.263 0.063 2 0 "[ . 1 . 2]" 2 69 1 24 LEU O 1 107 VAL H 2.200 . 2.200 1.893 1.782 1.980 . 0 0 "[ . 1 . 2]" 2 70 1 24 LEU O 1 107 VAL N 3.200 2.700 3.200 2.843 2.741 2.926 . 0 0 "[ . 1 . 2]" 2 stop_ save_
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