NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
603524 | 2nbq | 25985 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2nbq 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 2656 _Distance_constraint_stats_list.Viol_count 6852 _Distance_constraint_stats_list.Viol_total 16444.084 _Distance_constraint_stats_list.Viol_max 0.464 _Distance_constraint_stats_list.Viol_rms 0.0314 _Distance_constraint_stats_list.Viol_average_all_restraints 0.0069 _Distance_constraint_stats_list.Viol_average_violations_only 0.0800 _Distance_constraint_stats_list.Cutoff_violation_report 0.500 _Distance_constraint_stats_list.Details ; Description of the tags in this list: * 1 * Administrative tag * 2 * Administrative tag * 3 * Administrative tag * 4 * ID of the restraint list. * 5 * Number of restraints in list. * 6 * Number of violated restraints (each model violation is used). * 7 * Sum of violations in Angstrom. * 8 * Maximum violation of a restraint without averaging in any way. * 9 * Rms of violations over all restraints. * 10 * Average violation over all restraints. * 11 * Average violation over violated restraints. This violation is averaged over only those models in which the restraint is violated. These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998). * 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table. * 13 * This tag Description of the tags in the per residue table below: * 1 * Chain identifier (can be absent if none defined) * 2 * Residue number * 3 * Residue name * 4 * Maximum violation in ensemble of models (without any averaging) * 5 * Model number with the maximum violation * 6 * Number of models with a violation above cutoff * 7 * List of models (1 character per model) with a violation above cutoff. An '*' marks a violation above the cutoff. A '+' indicates the largest violation above the cutoff and a '-' marks the smallest violation over cutoff. For models 5, 15, 25,... a ' ' is replaced by a '.'. For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1. * 8 * Administrative tag * 9 * Administrative tag Description of the tags in the per restraint table below: * 1 * Restraint ID within restraint list. First node, FIRST member, first atom's: * 2 * Chain identifier (can be absent if none defined) * 3 * Residue number * 4 * Residue name * 5 * Name of (pseudo-)atom First node, SECOND member, first atom's: * 6 * Chain identifier (can be absent if none defined) * 7 * Residue number * 8 * Residue name * 9 * Name of (pseudo-)atom FIRST node's: * 10 * Target distance value (Angstrom) * 11 * Lower bound distance (Angstrom) * 12 * Upper bound distance (Angstrom) * 13 * Average distance in ensemble of models * 14 * Minimum distance in ensemble of models * 15 * Maximum distance in ensemble of models * 16 * Maximum violation (without any averaging) * 17 * Model number with the maximum violation * 18 * Number of models with a violation above cutoff * 19 * List of models with a violation above cutoff. See description above. * 20 * Administrative tag * 21 * Administrative tag ; loop_ _Distance_constraint_stats_per_res.Atom_entity_assembly_ID _Distance_constraint_stats_per_res.Atom_comp_index_ID _Distance_constraint_stats_per_res.Atom_comp_ID _Distance_constraint_stats_per_res.Total_violation _Distance_constraint_stats_per_res.Max_violation _Distance_constraint_stats_per_res.Max_violation_model_number _Distance_constraint_stats_per_res.Over_cutoff_viol_count _Distance_constraint_stats_per_res.Over_cutoff_viol_per_model 1 1 MET 0.000 0.000 12 0 "[ . 1 . 2 . 3]" 1 2 GLU 1.348 0.074 12 0 "[ . 1 . 2 . 3]" 1 3 ILE 3.810 0.298 17 0 "[ . 1 . 2 . 3]" 1 4 LEU 0.861 0.109 1 0 "[ . 1 . 2 . 3]" 1 5 ARG 10.211 0.444 19 0 "[ . 1 . 2 . 3]" 1 6 TYR 12.139 0.444 19 0 "[ . 1 . 2 . 3]" 1 7 LEU 10.500 0.374 5 0 "[ . 1 . 2 . 3]" 1 8 MET 4.769 0.245 29 0 "[ . 1 . 2 . 3]" 1 9 ASP 3.114 0.245 29 0 "[ . 1 . 2 . 3]" 1 10 PRO 2.986 0.166 5 0 "[ . 1 . 2 . 3]" 1 11 ASP 1.756 0.166 5 0 "[ . 1 . 2 . 3]" 1 12 THR 0.196 0.027 16 0 "[ . 1 . 2 . 3]" 1 13 PHE 0.043 0.017 2 0 "[ . 1 . 2 . 3]" 1 14 THR 0.488 0.086 28 0 "[ . 1 . 2 . 3]" 1 15 PHE 0.215 0.027 16 0 "[ . 1 . 2 . 3]" 1 16 ASN 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 17 PHE 0.019 0.009 19 0 "[ . 1 . 2 . 3]" 1 18 ASN 0.601 0.067 21 0 "[ . 1 . 2 . 3]" 1 19 ASN 0.601 0.067 21 0 "[ . 1 . 2 . 3]" 1 22 LEU 0.008 0.008 30 0 "[ . 1 . 2 . 3]" 1 28 GLN 1.047 0.110 28 0 "[ . 1 . 2 . 3]" 1 29 THR 0.372 0.063 25 0 "[ . 1 . 2 . 3]" 1 30 TYR 4.235 0.191 26 0 "[ . 1 . 2 . 3]" 1 31 LEU 25.820 0.288 21 0 "[ . 1 . 2 . 3]" 1 32 CYS 12.470 0.317 27 0 "[ . 1 . 2 . 3]" 1 33 TYR 2.168 0.223 3 0 "[ . 1 . 2 . 3]" 1 34 GLU 8.773 0.193 7 0 "[ . 1 . 2 . 3]" 1 35 VAL 4.348 0.161 18 0 "[ . 1 . 2 . 3]" 1 36 GLU 11.795 0.313 25 0 "[ . 1 . 2 . 3]" 1 37 ARG 14.904 0.436 25 0 "[ . 1 . 2 . 3]" 1 38 LEU 35.864 0.416 22 0 "[ . 1 . 2 . 3]" 1 39 ASP 26.499 0.393 24 0 "[ . 1 . 2 . 3]" 1 40 ASN 2.816 0.301 10 0 "[ . 1 . 2 . 3]" 1 41 GLY 0.415 0.046 28 0 "[ . 1 . 2 . 3]" 1 42 THR 13.895 0.249 16 0 "[ . 1 . 2 . 3]" 1 43 TRP 55.088 0.416 22 0 "[ . 1 . 2 . 3]" 1 44 VAL 25.247 0.317 28 0 "[ . 1 . 2 . 3]" 1 45 LEU 17.669 0.436 25 0 "[ . 1 . 2 . 3]" 1 46 MET 5.385 0.364 25 0 "[ . 1 . 2 . 3]" 1 47 ASP 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 48 GLN 2.668 0.138 13 0 "[ . 1 . 2 . 3]" 1 49 HIS 8.515 0.344 24 0 "[ . 1 . 2 . 3]" 1 50 MET 7.654 0.344 24 0 "[ . 1 . 2 . 3]" 1 51 GLY 0.078 0.066 7 0 "[ . 1 . 2 . 3]" 1 52 PHE 11.594 0.266 27 0 "[ . 1 . 2 . 3]" 1 53 LEU 13.965 0.254 17 0 "[ . 1 . 2 . 3]" 1 55 ASN 0.927 0.148 18 0 "[ . 1 . 2 . 3]" 1 56 GLU 2.052 0.238 16 0 "[ . 1 . 2 . 3]" 1 57 ALA 0.105 0.042 17 0 "[ . 1 . 2 . 3]" 1 58 LYS 0.165 0.066 29 0 "[ . 1 . 2 . 3]" 1 59 ASN 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 60 LEU 0.337 0.154 14 0 "[ . 1 . 2 . 3]" 1 61 LEU 0.209 0.154 14 0 "[ . 1 . 2 . 3]" 1 62 CYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 63 GLY 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 64 PHE 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 65 TYR 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 67 ARG 1.411 0.238 16 0 "[ . 1 . 2 . 3]" 1 68 HIS 0.707 0.111 29 0 "[ . 1 . 2 . 3]" 1 69 ALA 6.666 0.287 23 0 "[ . 1 . 2 . 3]" 1 70 GLU 1.863 0.263 26 0 "[ . 1 . 2 . 3]" 1 71 LEU 3.421 0.230 4 0 "[ . 1 . 2 . 3]" 1 72 ARG 0.555 0.193 25 0 "[ . 1 . 2 . 3]" 1 73 PHE 21.769 0.378 28 0 "[ . 1 . 2 . 3]" 1 74 LEU 9.096 0.225 17 0 "[ . 1 . 2 . 3]" 1 75 ASP 9.926 0.346 30 0 "[ . 1 . 2 . 3]" 1 76 LEU 18.630 0.325 7 0 "[ . 1 . 2 . 3]" 1 77 VAL 39.305 0.346 30 0 "[ . 1 . 2 . 3]" 1 78 PRO 5.519 0.279 13 0 "[ . 1 . 2 . 3]" 1 79 SER 4.975 0.268 30 0 "[ . 1 . 2 . 3]" 1 80 LEU 32.438 0.285 23 0 "[ . 1 . 2 . 3]" 1 81 GLN 11.951 0.212 27 0 "[ . 1 . 2 . 3]" 1 82 LEU 6.548 0.191 12 0 "[ . 1 . 2 . 3]" 1 83 ASP 0.756 0.124 18 0 "[ . 1 . 2 . 3]" 1 84 PRO 9.483 0.248 12 0 "[ . 1 . 2 . 3]" 1 85 ALA 10.281 0.248 12 0 "[ . 1 . 2 . 3]" 1 86 GLN 4.265 0.286 9 0 "[ . 1 . 2 . 3]" 1 87 ILE 6.245 0.145 18 0 "[ . 1 . 2 . 3]" 1 88 TYR 19.330 0.351 9 0 "[ . 1 . 2 . 3]" 1 89 ARG 0.107 0.038 20 0 "[ . 1 . 2 . 3]" 1 90 VAL 14.282 0.209 22 0 "[ . 1 . 2 . 3]" 1 91 THR 3.478 0.153 15 0 "[ . 1 . 2 . 3]" 1 92 TRP 23.641 0.378 28 0 "[ . 1 . 2 . 3]" 1 93 PHE 5.263 0.317 27 0 "[ . 1 . 2 . 3]" 1 94 ILE 15.036 0.380 30 0 "[ . 1 . 2 . 3]" 1 95 SER 0.410 0.047 10 0 "[ . 1 . 2 . 3]" 1 96 TRP 9.008 0.291 20 0 "[ . 1 . 2 . 3]" 1 97 SER 2.160 0.151 25 0 "[ . 1 . 2 . 3]" 1 98 PRO 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 99 CYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 100 PHE 5.835 0.280 16 0 "[ . 1 . 2 . 3]" 1 101 SER 10.237 0.288 24 0 "[ . 1 . 2 . 3]" 1 102 TRP 1.211 0.112 13 0 "[ . 1 . 2 . 3]" 1 103 GLY 0.244 0.073 6 0 "[ . 1 . 2 . 3]" 1 104 CYS 5.094 0.288 24 0 "[ . 1 . 2 . 3]" 1 105 ALA 2.994 0.154 11 0 "[ . 1 . 2 . 3]" 1 106 GLY 0.150 0.041 3 0 "[ . 1 . 2 . 3]" 1 107 GLU 0.272 0.116 11 0 "[ . 1 . 2 . 3]" 1 108 VAL 4.747 0.186 5 0 "[ . 1 . 2 . 3]" 1 109 ARG 1.912 0.107 15 0 "[ . 1 . 2 . 3]" 1 110 ALA 1.193 0.223 26 0 "[ . 1 . 2 . 3]" 1 111 PHE 16.713 0.432 30 0 "[ . 1 . 2 . 3]" 1 112 LEU 3.883 0.183 26 0 "[ . 1 . 2 . 3]" 1 113 GLN 6.146 0.223 26 0 "[ . 1 . 2 . 3]" 1 114 GLU 10.592 0.432 30 0 "[ . 1 . 2 . 3]" 1 115 ASN 5.947 0.365 30 0 "[ . 1 . 2 . 3]" 1 116 THR 0.036 0.005 2 0 "[ . 1 . 2 . 3]" 1 117 HIS 5.666 0.268 16 0 "[ . 1 . 2 . 3]" 1 118 VAL 31.739 0.351 9 0 "[ . 1 . 2 . 3]" 1 119 ARG 5.733 0.252 9 0 "[ . 1 . 2 . 3]" 1 120 LEU 27.044 0.266 12 0 "[ . 1 . 2 . 3]" 1 121 ARG 4.588 0.181 18 0 "[ . 1 . 2 . 3]" 1 122 ILE 6.897 0.344 26 0 "[ . 1 . 2 . 3]" 1 123 PHE 17.467 0.380 30 0 "[ . 1 . 2 . 3]" 1 124 ALA 14.615 0.307 1 0 "[ . 1 . 2 . 3]" 1 125 ALA 0.165 0.126 30 0 "[ . 1 . 2 . 3]" 1 126 ARG 0.401 0.083 23 0 "[ . 1 . 2 . 3]" 1 127 ILE 3.453 0.123 4 0 "[ . 1 . 2 . 3]" 1 128 TYR 5.073 0.271 8 0 "[ . 1 . 2 . 3]" 1 129 ASP 2.946 0.291 20 0 "[ . 1 . 2 . 3]" 1 130 TYR 0.521 0.154 21 0 "[ . 1 . 2 . 3]" 1 131 ASP 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 133 LEU 0.539 0.085 8 0 "[ . 1 . 2 . 3]" 1 134 TYR 0.066 0.046 22 0 "[ . 1 . 2 . 3]" 1 135 LYS 3.414 0.247 16 0 "[ . 1 . 2 . 3]" 1 136 GLU 0.076 0.033 20 0 "[ . 1 . 2 . 3]" 1 137 ALA 0.942 0.094 16 0 "[ . 1 . 2 . 3]" 1 138 LEU 1.910 0.119 4 0 "[ . 1 . 2 . 3]" 1 139 GLN 0.176 0.030 1 0 "[ . 1 . 2 . 3]" 1 140 MET 1.136 0.093 9 0 "[ . 1 . 2 . 3]" 1 141 LEU 6.403 0.174 23 0 "[ . 1 . 2 . 3]" 1 142 ARG 3.374 0.186 4 0 "[ . 1 . 2 . 3]" 1 143 ASP 1.980 0.186 4 0 "[ . 1 . 2 . 3]" 1 144 ALA 3.283 0.174 23 0 "[ . 1 . 2 . 3]" 1 145 GLY 1.857 0.114 3 0 "[ . 1 . 2 . 3]" 1 146 ALA 1.964 0.129 29 0 "[ . 1 . 2 . 3]" 1 147 GLN 5.327 0.176 26 0 "[ . 1 . 2 . 3]" 1 148 VAL 16.025 0.270 4 0 "[ . 1 . 2 . 3]" 1 149 SER 1.195 0.117 18 0 "[ . 1 . 2 . 3]" 1 150 ILE 1.440 0.180 15 0 "[ . 1 . 2 . 3]" 1 151 MET 0.003 0.002 26 0 "[ . 1 . 2 . 3]" 1 152 THR 0.515 0.110 9 0 "[ . 1 . 2 . 3]" 1 153 TYR 0.930 0.074 9 0 "[ . 1 . 2 . 3]" 1 154 ASP 0.182 0.074 9 0 "[ . 1 . 2 . 3]" 1 155 GLU 3.870 0.162 8 0 "[ . 1 . 2 . 3]" 1 156 PHE 0.100 0.030 9 0 "[ . 1 . 2 . 3]" 1 157 GLU 0.960 0.178 30 0 "[ . 1 . 2 . 3]" 1 158 TYR 0.249 0.143 30 0 "[ . 1 . 2 . 3]" 1 159 CYS 2.153 0.133 9 0 "[ . 1 . 2 . 3]" 1 160 TRP 9.059 0.177 19 0 "[ . 1 . 2 . 3]" 1 161 ASP 2.144 0.133 9 0 "[ . 1 . 2 . 3]" 1 162 THR 0.223 0.123 19 0 "[ . 1 . 2 . 3]" 1 163 PHE 3.349 0.246 5 0 "[ . 1 . 2 . 3]" 1 164 VAL 2.627 0.217 23 0 "[ . 1 . 2 . 3]" 1 165 TYR 1.434 0.093 5 0 "[ . 1 . 2 . 3]" 1 166 ARG 2.726 0.217 23 0 "[ . 1 . 2 . 3]" 1 167 GLN 1.321 0.136 7 0 "[ . 1 . 2 . 3]" 1 168 GLY 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 169 CYS 3.585 0.161 21 0 "[ . 1 . 2 . 3]" 1 170 PRO 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 171 PHE 8.940 0.335 14 0 "[ . 1 . 2 . 3]" 1 172 GLN 5.860 0.335 14 0 "[ . 1 . 2 . 3]" 1 173 PRO 1.609 0.121 21 0 "[ . 1 . 2 . 3]" 1 174 TRP 12.864 0.464 28 0 "[ . 1 . 2 . 3]" 1 175 ASP 14.018 0.464 28 0 "[ . 1 . 2 . 3]" 1 176 GLY 3.165 0.154 29 0 "[ . 1 . 2 . 3]" 1 177 LEU 8.713 0.237 18 0 "[ . 1 . 2 . 3]" 1 178 GLU 2.703 0.164 27 0 "[ . 1 . 2 . 3]" 1 179 GLU 2.727 0.453 12 0 "[ . 1 . 2 . 3]" 1 180 HIS 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 181 SER 1.006 0.263 19 0 "[ . 1 . 2 . 3]" 1 182 GLN 3.826 0.453 12 0 "[ . 1 . 2 . 3]" 1 183 ALA 0.528 0.146 17 0 "[ . 1 . 2 . 3]" 1 184 LEU 0.113 0.059 15 0 "[ . 1 . 2 . 3]" 1 185 SER 0.010 0.010 8 0 "[ . 1 . 2 . 3]" 1 186 GLY 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 187 ARG 0.574 0.117 11 0 "[ . 1 . 2 . 3]" 1 188 LEU 0.724 0.099 14 0 "[ . 1 . 2 . 3]" 1 189 ARG 1.073 0.153 25 0 "[ . 1 . 2 . 3]" 1 190 ALA 0.468 0.153 25 0 "[ . 1 . 2 . 3]" 1 191 ILE 2.448 0.117 11 0 "[ . 1 . 2 . 3]" 1 192 LEU 4.592 0.328 5 0 "[ . 1 . 2 . 3]" 1 193 GLN 4.561 0.328 5 0 "[ . 1 . 2 . 3]" 1 194 ASN 1.962 0.301 30 0 "[ . 1 . 2 . 3]" 1 195 GLN 0.507 0.038 2 0 "[ . 1 . 2 . 3]" 1 196 GLY 0.006 0.006 25 0 "[ . 1 . 2 . 3]" 1 197 ASN 0.034 0.033 10 0 "[ . 1 . 2 . 3]" stop_ loop_ _Distance_constraint_stats.Restraint_ID _Distance_constraint_stats.Atom_1_entity_assembly_ID _Distance_constraint_stats.Atom_1_comp_index_ID _Distance_constraint_stats.Atom_1_comp_ID _Distance_constraint_stats.Atom_1_ID _Distance_constraint_stats.Atom_2_entity_assembly_ID _Distance_constraint_stats.Atom_2_comp_index_ID _Distance_constraint_stats.Atom_2_comp_ID _Distance_constraint_stats.Atom_2_ID _Distance_constraint_stats.Node_1_distance_val _Distance_constraint_stats.Node_1_distance_lower_bound_val _Distance_constraint_stats.Node_1_distance_upper_bound_val _Distance_constraint_stats.Distance_average _Distance_constraint_stats.Distance_minimum _Distance_constraint_stats.Distance_maximum _Distance_constraint_stats.Max_violation _Distance_constraint_stats.Max_violation_model_number _Distance_constraint_stats.Over_cutoff_violation_count _Distance_constraint_stats.Over_cutoff_viol_per_model _Distance_constraint_stats.Distance_constraint_stats_ID 1 1 1 MET HB2 1 1 MET HG2 2.500 . 3.500 2.857 2.378 3.036 . 0 0 "[ . 1 . 2 . 3]" 1 2 1 1 MET HG2 1 3 ILE MD 4.500 . 5.700 4.882 3.118 5.700 0.000 12 0 "[ . 1 . 2 . 3]" 1 3 1 1 MET HA 1 1 MET HB2 2.600 . 3.300 2.662 2.386 3.022 . 0 0 "[ . 1 . 2 . 3]" 1 4 1 1 MET HA 1 1 MET HG2 3.200 . 3.800 3.040 2.356 3.674 . 0 0 "[ . 1 . 2 . 3]" 1 5 1 2 GLU HA 1 2 GLU HB2 2.900 . 3.500 2.870 2.468 3.028 . 0 0 "[ . 1 . 2 . 3]" 1 6 1 2 GLU HA 1 2 GLU HG3 3.300 . 4.000 2.836 2.329 4.028 0.028 17 0 "[ . 1 . 2 . 3]" 1 7 1 2 GLU HB2 1 2 GLU HG3 2.800 . 3.400 2.510 2.254 3.034 . 0 0 "[ . 1 . 2 . 3]" 1 8 1 2 GLU HB2 1 2 GLU HG2 2.700 . 3.200 2.911 2.480 3.036 . 0 0 "[ . 1 . 2 . 3]" 1 9 1 2 GLU HB3 1 2 GLU HG2 2.800 . 3.400 2.548 2.266 3.033 . 0 0 "[ . 1 . 2 . 3]" 1 10 1 2 GLU HA 1 2 GLU HB3 2.900 . 3.500 2.697 2.409 3.006 . 0 0 "[ . 1 . 2 . 3]" 1 11 1 2 GLU HB3 1 2 GLU HG3 2.700 . 3.200 2.909 2.477 3.033 . 0 0 "[ . 1 . 2 . 3]" 1 12 1 2 GLU HA 1 2 GLU HG2 3.300 . 4.000 2.628 2.334 3.522 . 0 0 "[ . 1 . 2 . 3]" 1 13 1 2 GLU HA 1 3 ILE H 2.100 . 2.500 2.350 2.138 2.546 0.046 2 0 "[ . 1 . 2 . 3]" 1 14 1 3 ILE MD 1 4 LEU H 3.000 . 4.600 4.293 4.003 4.709 0.109 1 0 "[ . 1 . 2 . 3]" 1 15 1 2 GLU HB2 1 3 ILE MD 3.600 . 4.600 4.552 3.466 4.674 0.074 12 0 "[ . 1 . 2 . 3]" 1 16 1 3 ILE H 1 3 ILE HB 2.400 . 3.200 2.904 2.338 3.387 0.187 28 0 "[ . 1 . 2 . 3]" 1 17 1 3 ILE MD 1 3 ILE HG12 2.400 . 3.400 2.121 2.111 2.151 . 0 0 "[ . 1 . 2 . 3]" 1 18 1 3 ILE H 1 3 ILE MD 3.200 . 4.300 2.329 1.773 4.128 0.027 2 0 "[ . 1 . 2 . 3]" 1 19 1 3 ILE H 1 3 ILE HG13 3.300 . 4.000 3.419 2.575 3.759 . 0 0 "[ . 1 . 2 . 3]" 1 20 1 3 ILE HB 1 3 ILE MD 2.300 . 3.300 2.919 2.143 3.207 . 0 0 "[ . 1 . 2 . 3]" 1 21 1 3 ILE HB 1 3 ILE HG12 2.800 . 3.400 2.501 2.420 3.029 . 0 0 "[ . 1 . 2 . 3]" 1 22 1 3 ILE MG 1 4 LEU H 3.000 . 4.100 2.183 1.745 2.944 0.055 1 0 "[ . 1 . 2 . 3]" 1 23 1 3 ILE HB 1 3 ILE MG 2.300 . 3.300 2.145 2.128 2.149 . 0 0 "[ . 1 . 2 . 3]" 1 24 1 3 ILE HA 1 3 ILE MD 2.600 . 4.100 2.533 2.228 3.795 . 0 0 "[ . 1 . 2 . 3]" 1 25 1 3 ILE HA 1 3 ILE HB 2.900 . 3.500 2.959 2.912 3.028 . 0 0 "[ . 1 . 2 . 3]" 1 26 1 3 ILE HA 1 3 ILE HG12 3.000 . 3.600 3.510 2.513 3.634 0.034 20 0 "[ . 1 . 2 . 3]" 1 27 1 3 ILE MD 1 3 ILE HG13 2.400 . 3.400 2.119 2.108 2.148 . 0 0 "[ . 1 . 2 . 3]" 1 28 1 3 ILE HG13 1 3 ILE MG 2.400 . 3.400 2.428 2.315 3.181 . 0 0 "[ . 1 . 2 . 3]" 1 29 1 3 ILE HA 1 3 ILE HG13 3.300 . 4.000 3.513 2.372 4.008 0.008 4 0 "[ . 1 . 2 . 3]" 1 30 1 3 ILE HA 1 3 ILE MG 2.600 . 3.600 2.215 2.133 2.420 . 0 0 "[ . 1 . 2 . 3]" 1 31 1 3 ILE H 1 3 ILE HA 2.900 . 3.500 2.890 2.276 2.953 . 0 0 "[ . 1 . 2 . 3]" 1 32 1 3 ILE H 1 3 ILE HG12 3.000 . 3.900 2.452 1.786 3.959 0.059 20 0 "[ . 1 . 2 . 3]" 1 33 1 2 GLU HB3 1 3 ILE H 3.000 . 3.600 2.998 2.143 3.642 0.042 3 0 "[ . 1 . 2 . 3]" 1 34 1 2 GLU HG2 1 3 ILE H 3.500 . 4.200 3.513 1.808 4.213 0.013 3 0 "[ . 1 . 2 . 3]" 1 35 1 3 ILE H 1 3 ILE MG 2.700 . 3.700 3.742 3.686 3.998 0.298 17 0 "[ . 1 . 2 . 3]" 1 36 1 4 LEU HB2 1 4 LEU MD1 2.400 . 3.900 2.500 2.135 3.214 . 0 0 "[ . 1 . 2 . 3]" 1 37 1 4 LEU HA 1 4 LEU MD1 2.500 . 4.000 2.728 2.139 3.996 . 0 0 "[ . 1 . 2 . 3]" 1 38 1 4 LEU MD1 1 4 LEU HG 2.300 . 3.800 2.125 2.106 2.150 . 0 0 "[ . 1 . 2 . 3]" 1 39 1 4 LEU HA 1 4 LEU MD2 3.100 . 4.700 3.110 2.097 3.792 . 0 0 "[ . 1 . 2 . 3]" 1 40 1 4 LEU HB3 1 4 LEU MD1 2.400 . 3.900 2.783 2.230 3.197 . 0 0 "[ . 1 . 2 . 3]" 1 41 1 3 ILE HA 1 4 LEU H 2.200 . 2.600 2.329 2.149 2.647 0.047 19 0 "[ . 1 . 2 . 3]" 1 42 1 4 LEU H 1 4 LEU HA 2.900 . 3.500 2.798 2.296 2.962 . 0 0 "[ . 1 . 2 . 3]" 1 43 1 3 ILE HB 1 4 LEU H 3.200 . 3.800 3.439 2.471 3.837 0.037 2 0 "[ . 1 . 2 . 3]" 1 44 1 4 LEU H 1 4 LEU MD1 2.600 . 4.100 3.363 1.801 4.208 0.108 17 0 "[ . 1 . 2 . 3]" 1 45 1 5 ARG HD3 1 5 ARG HG3 2.500 . 3.300 2.864 2.391 3.032 . 0 0 "[ . 1 . 2 . 3]" 1 46 1 5 ARG HA 1 5 ARG HB3 3.000 . 3.600 2.531 2.310 3.021 . 0 0 "[ . 1 . 2 . 3]" 1 47 1 5 ARG HB2 1 5 ARG HG3 2.800 . 3.400 2.407 2.245 2.916 . 0 0 "[ . 1 . 2 . 3]" 1 48 1 5 ARG HA 1 5 ARG HG2 3.000 . 3.900 2.638 2.236 3.639 . 0 0 "[ . 1 . 2 . 3]" 1 49 1 5 ARG HB2 1 5 ARG HG2 2.900 . 3.500 2.862 2.510 3.037 . 0 0 "[ . 1 . 2 . 3]" 1 50 1 5 ARG HA 1 5 ARG HG3 3.100 . 4.000 3.382 2.479 4.219 0.219 22 0 "[ . 1 . 2 . 3]" 1 51 1 5 ARG HB3 1 5 ARG HG3 2.900 . 3.800 2.860 2.524 3.034 . 0 0 "[ . 1 . 2 . 3]" 1 52 1 5 ARG HB3 1 5 ARG HG2 2.900 . 3.800 2.699 2.257 3.038 . 0 0 "[ . 1 . 2 . 3]" 1 53 1 5 ARG HB3 1 5 ARG HD3 3.400 . 4.300 2.624 2.284 3.968 . 0 0 "[ . 1 . 2 . 3]" 1 54 1 5 ARG HA 1 5 ARG HD3 3.400 . 4.300 3.832 2.331 4.514 0.214 15 0 "[ . 1 . 2 . 3]" 1 55 1 5 ARG H 1 5 ARG HB2 2.700 . 3.500 2.944 2.075 3.624 0.124 10 0 "[ . 1 . 2 . 3]" 1 56 1 5 ARG H 1 5 ARG HB3 3.400 . 4.300 3.644 2.569 4.039 . 0 0 "[ . 1 . 2 . 3]" 1 57 1 5 ARG HD3 1 5 ARG HG2 2.500 . 3.300 2.617 2.247 3.034 . 0 0 "[ . 1 . 2 . 3]" 1 58 1 5 ARG HB2 1 5 ARG HD3 3.400 . 4.300 3.311 2.437 4.187 . 0 0 "[ . 1 . 2 . 3]" 1 59 1 5 ARG H 1 6 TYR H 3.400 . 4.100 4.227 3.950 4.544 0.444 19 0 "[ . 1 . 2 . 3]" 1 60 1 4 LEU HA 1 5 ARG H 2.300 . 2.800 2.429 2.148 2.852 0.052 16 0 "[ . 1 . 2 . 3]" 1 61 1 4 LEU MD1 1 5 ARG H 2.900 . 4.500 3.598 1.802 4.460 . 0 0 "[ . 1 . 2 . 3]" 1 62 1 5 ARG H 1 5 ARG HG2 2.600 . 4.100 3.387 1.848 4.347 0.247 15 0 "[ . 1 . 2 . 3]" 1 63 1 5 ARG HA 1 52 PHE QE 3.300 . 6.000 5.950 5.121 6.266 0.266 27 0 "[ . 1 . 2 . 3]" 1 64 1 6 TYR H 1 7 LEU H 3.200 . 3.800 2.512 1.784 4.069 0.269 8 0 "[ . 1 . 2 . 3]" 1 65 1 6 TYR H 1 52 PHE HZ 4.500 . 5.000 4.949 4.040 5.259 0.259 10 0 "[ . 1 . 2 . 3]" 1 66 1 6 TYR QB 1 52 PHE HZ 4.500 . 5.000 2.865 2.169 5.156 0.156 15 0 "[ . 1 . 2 . 3]" 1 67 1 6 TYR QD 1 7 LEU H 3.500 . 4.700 4.128 1.795 4.734 0.034 2 0 "[ . 1 . 2 . 3]" 1 68 1 5 ARG HA 1 6 TYR H 2.600 . 3.100 2.614 2.108 3.161 0.061 9 0 "[ . 1 . 2 . 3]" 1 69 1 6 TYR HB2 1 7 LEU H 3.400 . 4.100 3.114 1.857 4.135 0.035 5 0 "[ . 1 . 2 . 3]" 1 70 1 6 TYR HB3 1 7 LEU H 3.300 . 4.000 3.004 1.891 4.105 0.105 5 0 "[ . 1 . 2 . 3]" 1 71 1 6 TYR H 1 6 TYR HB2 3.100 . 4.000 2.860 2.088 3.824 . 0 0 "[ . 1 . 2 . 3]" 1 72 1 6 TYR HA 1 6 TYR HB2 2.900 . 3.500 2.831 2.441 3.022 . 0 0 "[ . 1 . 2 . 3]" 1 73 1 6 TYR HB3 1 6 TYR QD 2.700 . 3.700 2.491 2.311 2.717 . 0 0 "[ . 1 . 2 . 3]" 1 74 1 5 ARG HG2 1 6 TYR H 3.600 . 4.300 4.015 1.959 4.447 0.147 10 0 "[ . 1 . 2 . 3]" 1 75 1 5 ARG HB2 1 6 TYR H 3.200 . 3.800 3.094 1.776 4.000 0.200 15 0 "[ . 1 . 2 . 3]" 1 76 1 6 TYR H 1 6 TYR HA 2.900 . 3.500 2.870 2.277 2.961 . 0 0 "[ . 1 . 2 . 3]" 1 77 1 6 TYR H 1 6 TYR QD 3.500 . 4.700 3.831 2.717 4.491 . 0 0 "[ . 1 . 2 . 3]" 1 78 1 6 TYR HB2 1 6 TYR QD 2.900 . 4.000 2.414 2.310 2.693 . 0 0 "[ . 1 . 2 . 3]" 1 79 1 6 TYR H 1 6 TYR HB3 3.200 . 4.100 3.471 2.936 4.029 . 0 0 "[ . 1 . 2 . 3]" 1 80 1 7 LEU MD2 1 163 PHE H 4.000 . 5.800 5.875 5.807 6.046 0.246 5 0 "[ . 1 . 2 . 3]" 1 81 1 7 LEU H 1 7 LEU HB3 3.900 . 4.700 3.855 3.492 4.075 . 0 0 "[ . 1 . 2 . 3]" 1 82 1 7 LEU MD2 1 164 VAL MG2 4.400 . 6.300 5.504 4.593 6.134 . 0 0 "[ . 1 . 2 . 3]" 1 83 1 7 LEU H 1 7 LEU HB2 3.300 . 4.000 3.237 2.179 3.726 . 0 0 "[ . 1 . 2 . 3]" 1 84 1 7 LEU HB2 1 7 LEU MD2 2.600 . 3.600 2.877 2.367 3.202 . 0 0 "[ . 1 . 2 . 3]" 1 85 1 7 LEU HA 1 7 LEU MD2 3.100 . 4.200 2.170 2.084 2.267 . 0 0 "[ . 1 . 2 . 3]" 1 86 1 7 LEU MD2 1 163 PHE HA 3.100 . 5.700 3.704 3.354 4.072 . 0 0 "[ . 1 . 2 . 3]" 1 87 1 7 LEU H 1 7 LEU MD2 3.300 . 4.500 2.138 1.794 3.580 0.006 1 0 "[ . 1 . 2 . 3]" 1 88 1 7 LEU MD2 1 52 PHE HZ 3.000 . 5.600 5.110 4.157 5.791 0.191 27 0 "[ . 1 . 2 . 3]" 1 89 1 7 LEU MD2 1 52 PHE QE 3.700 . 5.400 3.504 2.780 4.511 . 0 0 "[ . 1 . 2 . 3]" 1 90 1 7 LEU HB2 1 7 LEU MD1 2.300 . 3.800 2.710 2.301 3.202 . 0 0 "[ . 1 . 2 . 3]" 1 91 1 7 LEU MD2 1 8 MET H 3.400 . 4.100 3.966 3.770 4.124 0.024 25 0 "[ . 1 . 2 . 3]" 1 92 1 7 LEU H 1 7 LEU MD1 3.000 . 4.100 3.951 3.514 4.232 0.132 19 0 "[ . 1 . 2 . 3]" 1 93 1 7 LEU H 1 7 LEU HG 3.600 . 4.300 3.253 1.780 4.417 0.117 4 0 "[ . 1 . 2 . 3]" 1 94 1 7 LEU MD1 1 7 LEU MD2 2.400 . 3.900 1.973 1.858 2.078 . 0 0 "[ . 1 . 2 . 3]" 1 95 1 7 LEU HA 1 7 LEU HG 3.600 . 4.200 3.456 3.168 3.613 . 0 0 "[ . 1 . 2 . 3]" 1 96 1 7 LEU HA 1 7 LEU MD1 3.000 . 4.100 3.157 2.144 3.890 . 0 0 "[ . 1 . 2 . 3]" 1 97 1 6 TYR HB2 1 7 LEU MD2 3.300 . 4.500 4.302 2.236 4.874 0.374 5 0 "[ . 1 . 2 . 3]" 1 98 1 5 ARG HA 1 7 LEU MD2 4.100 . 5.900 4.579 3.368 6.083 0.183 19 0 "[ . 1 . 2 . 3]" 1 99 1 5 ARG HD3 1 7 LEU MD2 3.400 . 4.600 3.925 2.211 4.696 0.096 30 0 "[ . 1 . 2 . 3]" 1 100 1 6 TYR HB3 1 7 LEU MD2 3.400 . 4.600 4.328 2.760 4.847 0.247 10 0 "[ . 1 . 2 . 3]" 1 101 1 8 MET HA 1 9 ASP H 2.900 . 3.500 2.325 2.104 2.578 . 0 0 "[ . 1 . 2 . 3]" 1 102 1 8 MET HA 1 164 VAL QG 4.200 . 5.500 5.027 4.293 5.555 0.055 28 0 "[ . 1 . 2 . 3]" 1 103 1 8 MET ME 1 53 LEU H 4.300 . 5.700 4.798 4.204 5.332 . 0 0 "[ . 1 . 2 . 3]" 1 104 1 8 MET ME 1 13 PHE QE 5.400 . 7.000 3.650 2.309 5.196 . 0 0 "[ . 1 . 2 . 3]" 1 105 1 8 MET ME 1 13 PHE QD 4.000 . 6.000 2.497 2.163 3.769 . 0 0 "[ . 1 . 2 . 3]" 1 106 1 8 MET ME 1 30 TYR QE 3.700 . 5.400 3.180 2.158 4.399 . 0 0 "[ . 1 . 2 . 3]" 1 107 1 8 MET ME 1 52 PHE HA 4.500 . 5.900 4.731 4.268 5.533 . 0 0 "[ . 1 . 2 . 3]" 1 108 1 8 MET ME 1 52 PHE HB3 3.200 . 4.400 3.020 2.362 3.911 . 0 0 "[ . 1 . 2 . 3]" 1 109 1 8 MET ME 1 52 PHE HB2 3.800 . 5.100 2.731 2.323 3.474 . 0 0 "[ . 1 . 2 . 3]" 1 110 1 8 MET ME 1 164 VAL MG1 4.100 . 6.400 5.612 5.108 6.278 . 0 0 "[ . 1 . 2 . 3]" 1 111 1 8 MET ME 1 32 CYS H 4.500 . 5.900 5.355 4.415 5.798 . 0 0 "[ . 1 . 2 . 3]" 1 112 1 8 MET HB3 1 52 PHE QE 3.400 . 4.600 3.731 2.511 4.668 0.068 23 0 "[ . 1 . 2 . 3]" 1 113 1 8 MET QB 1 164 VAL QG 4.000 . 5.500 3.448 2.258 4.621 . 0 0 "[ . 1 . 2 . 3]" 1 114 1 8 MET HB3 1 8 MET ME 2.900 . 4.000 2.389 2.073 3.378 . 0 0 "[ . 1 . 2 . 3]" 1 115 1 8 MET H 1 8 MET ME 3.500 . 4.700 3.960 3.732 4.574 . 0 0 "[ . 1 . 2 . 3]" 1 116 1 8 MET HA 1 8 MET ME 3.200 . 4.300 4.129 3.656 4.386 0.086 25 0 "[ . 1 . 2 . 3]" 1 117 1 8 MET ME 1 163 PHE HB2 3.300 . 5.000 4.981 4.749 5.046 0.046 18 0 "[ . 1 . 2 . 3]" 1 118 1 8 MET ME 1 8 MET HG2 3.100 . 4.200 2.939 2.168 3.354 . 0 0 "[ . 1 . 2 . 3]" 1 119 1 8 MET ME 1 52 PHE QE 3.200 . 4.800 3.611 2.849 4.206 . 0 0 "[ . 1 . 2 . 3]" 1 120 1 8 MET ME 1 8 MET HG3 3.700 . 4.900 2.740 2.243 3.352 . 0 0 "[ . 1 . 2 . 3]" 1 121 1 8 MET ME 1 164 VAL MG2 3.300 . 5.000 4.121 3.698 4.635 . 0 0 "[ . 1 . 2 . 3]" 1 122 1 8 MET H 1 164 VAL MG1 4.600 . 6.000 5.385 4.690 5.762 . 0 0 "[ . 1 . 2 . 3]" 1 123 1 8 MET H 1 164 VAL HA 4.600 . 5.000 4.809 3.846 5.040 0.040 16 0 "[ . 1 . 2 . 3]" 1 124 1 8 MET ME 1 52 PHE QD 3.000 . 4.600 2.635 2.105 3.011 . 0 0 "[ . 1 . 2 . 3]" 1 125 1 8 MET ME 1 30 TYR QD 2.800 . 4.400 2.684 2.221 3.459 . 0 0 "[ . 1 . 2 . 3]" 1 126 1 8 MET ME 1 30 TYR HA 3.900 . 5.700 5.066 4.209 5.644 . 0 0 "[ . 1 . 2 . 3]" 1 127 1 8 MET ME 1 30 TYR QB 3.000 . 4.200 3.577 2.923 4.256 0.056 26 0 "[ . 1 . 2 . 3]" 1 128 1 8 MET ME 1 52 PHE HZ 5.200 . 6.500 4.715 4.248 5.576 . 0 0 "[ . 1 . 2 . 3]" 1 129 1 8 MET ME 1 31 LEU H 4.000 . 5.300 4.948 3.895 5.383 0.083 30 0 "[ . 1 . 2 . 3]" 1 130 1 8 MET ME 1 17 PHE QE 3.100 . 4.700 3.749 2.579 4.709 0.009 19 0 "[ . 1 . 2 . 3]" 1 131 1 8 MET HB2 1 8 MET ME 2.900 . 4.500 2.452 2.076 3.401 . 0 0 "[ . 1 . 2 . 3]" 1 132 1 8 MET ME 1 53 LEU HA 3.000 . 6.100 5.976 5.155 6.181 0.081 15 0 "[ . 1 . 2 . 3]" 1 133 1 9 ASP H 1 52 PHE QE 4.800 . 6.100 4.957 4.267 5.780 . 0 0 "[ . 1 . 2 . 3]" 1 134 1 8 MET HA 1 9 ASP HB2 3.400 . 5.100 4.840 4.067 5.282 0.182 9 0 "[ . 1 . 2 . 3]" 1 135 1 8 MET HA 1 9 ASP HB3 3.400 . 5.100 4.647 4.119 5.345 0.245 29 0 "[ . 1 . 2 . 3]" 1 136 1 8 MET HB3 1 9 ASP H 3.600 . 4.300 3.588 2.594 4.080 . 0 0 "[ . 1 . 2 . 3]" 1 137 1 8 MET ME 1 9 ASP H 3.200 . 4.800 4.752 4.365 4.862 0.062 29 0 "[ . 1 . 2 . 3]" 1 138 1 8 MET HB2 1 9 ASP H 3.800 . 4.600 3.367 2.048 4.325 . 0 0 "[ . 1 . 2 . 3]" 1 139 1 9 ASP H 1 9 ASP HB3 3.300 . 4.500 2.490 2.050 3.483 . 0 0 "[ . 1 . 2 . 3]" 1 140 1 9 ASP H 1 9 ASP HB2 3.300 . 4.500 2.885 2.022 3.495 . 0 0 "[ . 1 . 2 . 3]" 1 141 1 9 ASP QB 1 12 THR H 5.000 . 5.500 3.118 2.303 3.864 . 0 0 "[ . 1 . 2 . 3]" 1 142 1 9 ASP QB 1 12 THR HB 5.000 . 5.500 2.937 2.263 3.891 . 0 0 "[ . 1 . 2 . 3]" 1 143 1 9 ASP QB 1 12 THR MG 5.000 . 6.000 3.951 2.079 4.714 . 0 0 "[ . 1 . 2 . 3]" 1 144 1 10 PRO HB2 1 11 ASP H 3.200 . 3.800 2.449 2.124 2.865 . 0 0 "[ . 1 . 2 . 3]" 1 145 1 9 ASP HA 1 10 PRO HD3 3.200 . 3.800 2.338 2.300 2.424 . 0 0 "[ . 1 . 2 . 3]" 1 146 1 9 ASP HA 1 10 PRO HD2 3.200 . 3.800 2.397 2.325 2.540 . 0 0 "[ . 1 . 2 . 3]" 1 147 1 10 PRO HD3 1 164 VAL QG 4.000 . 5.500 2.925 2.286 3.509 . 0 0 "[ . 1 . 2 . 3]" 1 148 1 10 PRO HD2 1 164 VAL QG 4.000 . 5.500 4.060 3.566 4.553 . 0 0 "[ . 1 . 2 . 3]" 1 149 1 10 PRO HB3 1 164 VAL MG1 3.700 . 4.900 2.460 2.040 3.056 . 0 0 "[ . 1 . 2 . 3]" 1 150 1 11 ASP H 1 11 ASP HB3 3.200 . 3.800 2.898 2.083 3.600 . 0 0 "[ . 1 . 2 . 3]" 1 151 1 10 PRO QD 1 11 ASP H 4.000 . 5.000 2.978 2.617 3.270 . 0 0 "[ . 1 . 2 . 3]" 1 152 1 10 PRO HB3 1 11 ASP H 3.100 . 3.700 3.744 3.611 3.866 0.166 5 0 "[ . 1 . 2 . 3]" 1 153 1 11 ASP HB3 1 12 THR H 3.900 . 4.700 2.960 2.164 4.041 . 0 0 "[ . 1 . 2 . 3]" 1 154 1 11 ASP H 1 11 ASP HB2 3.200 . 3.800 2.555 2.079 3.581 . 0 0 "[ . 1 . 2 . 3]" 1 155 1 9 ASP HA 1 11 ASP H 5.000 . 6.000 4.525 4.227 4.758 . 0 0 "[ . 1 . 2 . 3]" 1 156 1 10 PRO HA 1 11 ASP H 3.500 . 4.200 3.570 3.555 3.581 . 0 0 "[ . 1 . 2 . 3]" 1 157 1 12 THR MG 1 15 PHE H 3.100 . 4.700 4.636 4.327 4.727 0.027 16 0 "[ . 1 . 2 . 3]" 1 158 1 12 THR MG 1 30 TYR QD 3.400 . 5.100 4.565 4.005 5.093 . 0 0 "[ . 1 . 2 . 3]" 1 159 1 12 THR MG 1 30 TYR QE 3.200 . 4.800 3.647 2.755 4.666 . 0 0 "[ . 1 . 2 . 3]" 1 160 1 12 THR MG 1 14 THR H 5.500 . 6.900 4.963 4.272 5.391 . 0 0 "[ . 1 . 2 . 3]" 1 161 1 8 MET ME 1 12 THR MG 3.200 . 4.800 3.851 2.552 4.805 0.005 20 0 "[ . 1 . 2 . 3]" 1 162 1 12 THR HA 1 12 THR MG 2.500 . 3.500 2.363 2.253 3.188 . 0 0 "[ . 1 . 2 . 3]" 1 163 1 12 THR H 1 12 THR MG 3.000 . 4.100 3.688 2.203 3.780 . 0 0 "[ . 1 . 2 . 3]" 1 164 1 12 THR H 1 13 PHE H 3.500 . 4.200 2.683 2.467 3.014 . 0 0 "[ . 1 . 2 . 3]" 1 165 1 9 ASP H 1 12 THR MG 5.000 . 6.500 4.115 3.210 4.901 . 0 0 "[ . 1 . 2 . 3]" 1 166 1 12 THR H 1 12 THR HB 4.000 . 4.800 2.474 2.263 2.684 . 0 0 "[ . 1 . 2 . 3]" 1 167 1 11 ASP H 1 12 THR H 3.300 . 4.000 2.889 2.774 3.096 . 0 0 "[ . 1 . 2 . 3]" 1 168 1 10 PRO HA 1 13 PHE H 3.400 . 4.100 3.585 3.245 4.081 . 0 0 "[ . 1 . 2 . 3]" 1 169 1 10 PRO HA 1 13 PHE QD 4.000 . 5.500 4.311 3.514 4.816 . 0 0 "[ . 1 . 2 . 3]" 1 170 1 13 PHE H 1 13 PHE HB2 3.700 . 4.400 2.496 2.274 2.845 . 0 0 "[ . 1 . 2 . 3]" 1 171 1 13 PHE HB2 1 13 PHE QD 3.100 . 4.200 2.389 2.332 2.578 . 0 0 "[ . 1 . 2 . 3]" 1 172 1 13 PHE QE 1 164 VAL MG2 4.400 . 6.300 3.532 3.099 4.275 . 0 0 "[ . 1 . 2 . 3]" 1 173 1 13 PHE HA 1 14 THR H 4.300 . 5.200 3.552 3.443 3.579 . 0 0 "[ . 1 . 2 . 3]" 1 174 1 13 PHE HB3 1 164 VAL MG2 3.600 . 4.800 2.837 2.273 3.522 . 0 0 "[ . 1 . 2 . 3]" 1 175 1 12 THR MG 1 13 PHE H 3.300 . 4.500 3.165 1.790 3.738 0.010 5 0 "[ . 1 . 2 . 3]" 1 176 1 13 PHE QE 1 171 PHE QE 5.000 . 6.000 3.687 2.357 5.534 . 0 0 "[ . 1 . 2 . 3]" 1 177 1 13 PHE HA 1 13 PHE QD 3.600 . 4.800 2.949 2.383 3.064 . 0 0 "[ . 1 . 2 . 3]" 1 178 1 13 PHE H 1 13 PHE HB3 3.100 . 3.700 2.594 2.258 2.843 . 0 0 "[ . 1 . 2 . 3]" 1 179 1 12 THR HA 1 13 PHE H 4.000 . 5.000 3.561 3.506 3.578 . 0 0 "[ . 1 . 2 . 3]" 1 180 1 12 THR HB 1 13 PHE H 4.400 . 5.100 2.430 2.076 3.764 . 0 0 "[ . 1 . 2 . 3]" 1 181 1 13 PHE H 1 14 THR H 3.900 . 4.700 2.882 2.635 3.091 . 0 0 "[ . 1 . 2 . 3]" 1 182 1 13 PHE QE 1 171 PHE QD 4.800 . 6.600 5.004 3.671 6.160 . 0 0 "[ . 1 . 2 . 3]" 1 183 1 14 THR H 1 15 PHE H 4.000 . 4.800 2.671 2.450 2.846 . 0 0 "[ . 1 . 2 . 3]" 1 184 1 14 THR H 1 164 VAL MG2 4.600 . 6.000 4.785 3.919 5.555 . 0 0 "[ . 1 . 2 . 3]" 1 185 1 14 THR H 1 14 THR MG 3.500 . 4.700 3.567 2.575 3.773 . 0 0 "[ . 1 . 2 . 3]" 1 186 1 11 ASP HA 1 14 THR H 3.900 . 4.700 3.993 3.615 4.404 . 0 0 "[ . 1 . 2 . 3]" 1 187 1 14 THR MG 1 174 TRP HE3 3.100 . 4.200 3.978 3.259 4.286 0.086 28 0 "[ . 1 . 2 . 3]" 1 188 1 14 THR HB 1 15 PHE H 2.600 . 3.100 2.685 2.132 3.118 0.018 17 0 "[ . 1 . 2 . 3]" 1 189 1 14 THR HA 1 14 THR MG 2.900 . 4.000 2.208 2.121 2.303 . 0 0 "[ . 1 . 2 . 3]" 1 190 1 14 THR HA 1 174 TRP HZ3 5.000 . 6.000 4.248 3.141 4.768 . 0 0 "[ . 1 . 2 . 3]" 1 191 1 14 THR H 1 14 THR HB 3.400 . 4.100 2.913 2.514 3.558 . 0 0 "[ . 1 . 2 . 3]" 1 192 1 13 PHE HB3 1 14 THR H 3.800 . 4.600 2.437 2.077 3.081 . 0 0 "[ . 1 . 2 . 3]" 1 193 1 13 PHE HB2 1 14 THR H 4.300 . 5.200 3.774 3.477 4.199 . 0 0 "[ . 1 . 2 . 3]" 1 194 1 13 PHE QD 1 14 THR H 5.300 . 6.400 3.084 2.340 3.856 . 0 0 "[ . 1 . 2 . 3]" 1 195 1 11 ASP HA 1 14 THR HB 3.500 . 4.200 3.581 2.773 4.191 . 0 0 "[ . 1 . 2 . 3]" 1 196 1 11 ASP HA 1 14 THR MG 4.000 . 5.500 4.579 3.251 5.139 . 0 0 "[ . 1 . 2 . 3]" 1 197 1 14 THR HB 1 14 THR MG 2.400 . 3.400 2.134 2.105 2.148 . 0 0 "[ . 1 . 2 . 3]" 1 198 1 14 THR MG 1 174 TRP HZ3 3.500 . 4.700 2.543 2.053 4.010 . 0 0 "[ . 1 . 2 . 3]" 1 199 1 14 THR MG 1 15 PHE H 2.800 . 4.400 3.873 3.245 4.224 . 0 0 "[ . 1 . 2 . 3]" 1 200 1 14 THR HA 1 15 PHE H 3.300 . 4.000 3.542 3.468 3.576 . 0 0 "[ . 1 . 2 . 3]" 1 201 1 12 THR HA 1 15 PHE H 5.000 . 6.000 3.492 3.240 3.778 . 0 0 "[ . 1 . 2 . 3]" 1 202 1 16 ASN H 1 17 PHE H 4.600 . 5.500 2.676 2.389 3.051 . 0 0 "[ . 1 . 2 . 3]" 1 203 1 18 ASN H 1 18 ASN HB3 3.600 . 4.300 2.691 2.083 3.512 . 0 0 "[ . 1 . 2 . 3]" 1 204 1 18 ASN HA 1 19 ASN H 2.900 . 3.500 3.459 3.293 3.567 0.067 21 0 "[ . 1 . 2 . 3]" 1 205 1 19 ASN H 1 19 ASN HB2 3.700 . 4.400 3.136 2.109 3.995 . 0 0 "[ . 1 . 2 . 3]" 1 206 1 18 ASN HB3 1 19 ASN H 3.200 . 3.800 3.036 2.216 3.724 . 0 0 "[ . 1 . 2 . 3]" 1 207 1 22 LEU H 1 22 LEU MD1 3.000 . 4.600 3.410 1.984 4.608 0.008 30 0 "[ . 1 . 2 . 3]" 1 208 1 22 LEU H 1 22 LEU HB2 3.100 . 3.700 2.738 2.076 3.610 . 0 0 "[ . 1 . 2 . 3]" 1 209 1 28 GLN HE21 1 28 GLN HG2 2.800 . 3.900 2.725 2.240 3.616 . 0 0 "[ . 1 . 2 . 3]" 1 210 1 28 GLN HA 1 28 GLN HG3 3.600 . 4.300 3.158 2.427 4.147 . 0 0 "[ . 1 . 2 . 3]" 1 211 1 28 GLN HA 1 28 GLN HG2 3.400 . 4.100 2.622 2.321 3.564 . 0 0 "[ . 1 . 2 . 3]" 1 212 1 28 GLN HB3 1 28 GLN HE21 3.500 . 4.700 3.149 1.791 4.119 0.009 15 0 "[ . 1 . 2 . 3]" 1 213 1 28 GLN HB2 1 28 GLN HE21 3.400 . 4.600 3.826 1.808 4.602 0.002 21 0 "[ . 1 . 2 . 3]" 1 214 1 28 GLN HB3 1 28 GLN HE22 3.100 . 4.200 3.904 3.351 4.284 0.084 17 0 "[ . 1 . 2 . 3]" 1 215 1 28 GLN HE22 1 28 GLN HG2 2.900 . 4.000 3.718 3.506 4.110 0.110 28 0 "[ . 1 . 2 . 3]" 1 216 1 28 GLN HE22 1 28 GLN HG3 3.100 . 4.200 3.915 3.528 4.060 . 0 0 "[ . 1 . 2 . 3]" 1 217 1 28 GLN HE21 1 28 GLN HG3 2.800 . 3.400 3.190 2.299 3.497 0.097 16 0 "[ . 1 . 2 . 3]" 1 218 1 29 THR MG 1 70 GLU H 5.200 . 6.900 5.050 3.738 6.559 . 0 0 "[ . 1 . 2 . 3]" 1 219 1 28 GLN HA 1 29 THR H 4.000 . 5.000 2.255 2.145 2.494 . 0 0 "[ . 1 . 2 . 3]" 1 220 1 30 TYR H 1 31 LEU MD2 4.300 . 6.200 6.186 5.891 6.391 0.191 26 0 "[ . 1 . 2 . 3]" 1 221 1 30 TYR QD 1 31 LEU H 3.700 . 4.900 3.467 2.775 3.950 . 0 0 "[ . 1 . 2 . 3]" 1 222 1 30 TYR QE 1 52 PHE QD 2.900 . 6.500 3.347 2.503 4.304 . 0 0 "[ . 1 . 2 . 3]" 1 223 1 29 THR MG 1 30 TYR H 3.200 . 4.200 1.987 1.767 2.404 0.033 9 0 "[ . 1 . 2 . 3]" 1 224 1 30 TYR H 1 95 SER H 5.000 . 6.000 3.550 2.968 4.003 . 0 0 "[ . 1 . 2 . 3]" 1 225 1 30 TYR HB2 1 30 TYR QD 2.900 . 4.000 2.402 2.319 2.527 . 0 0 "[ . 1 . 2 . 3]" 1 226 1 30 TYR H 1 30 TYR QD 3.700 . 4.900 3.867 3.433 4.184 . 0 0 "[ . 1 . 2 . 3]" 1 227 1 29 THR H 1 30 TYR QE 4.400 . 5.800 5.152 4.117 5.817 0.017 10 0 "[ . 1 . 2 . 3]" 1 228 1 30 TYR QE 1 31 LEU H 4.600 . 6.500 5.290 4.706 5.651 . 0 0 "[ . 1 . 2 . 3]" 1 229 1 31 LEU MD2 1 32 CYS H 3.900 . 5.200 4.666 4.085 4.929 . 0 0 "[ . 1 . 2 . 3]" 1 230 1 31 LEU MD2 1 70 GLU H 4.200 . 5.500 2.844 2.347 3.596 . 0 0 "[ . 1 . 2 . 3]" 1 231 1 31 LEU H 1 31 LEU MD2 4.300 . 6.200 4.168 3.801 4.573 . 0 0 "[ . 1 . 2 . 3]" 1 232 1 31 LEU HA 1 31 LEU MD2 3.700 . 5.400 3.985 3.742 4.132 . 0 0 "[ . 1 . 2 . 3]" 1 233 1 31 LEU H 1 31 LEU MD1 4.500 . 6.400 4.156 3.930 4.734 . 0 0 "[ . 1 . 2 . 3]" 1 234 1 31 LEU HB2 1 31 LEU MD2 3.200 . 6.300 2.401 2.229 3.000 . 0 0 "[ . 1 . 2 . 3]" 1 235 1 31 LEU MD1 1 92 TRP HD1 3.200 . 4.300 3.658 3.407 4.372 0.072 26 0 "[ . 1 . 2 . 3]" 1 236 1 31 LEU MD2 1 92 TRP HD1 4.000 . 5.300 5.013 4.595 5.315 0.015 4 0 "[ . 1 . 2 . 3]" 1 237 1 31 LEU MD1 1 73 PHE QD 3.500 . 5.200 4.069 3.652 4.490 . 0 0 "[ . 1 . 2 . 3]" 1 238 1 31 LEU HG 1 73 PHE QD 3.100 . 5.200 4.923 4.183 5.313 0.113 30 0 "[ . 1 . 2 . 3]" 1 239 1 30 TYR H 1 31 LEU MD1 5.700 . 6.600 6.346 5.774 6.713 0.113 18 0 "[ . 1 . 2 . 3]" 1 240 1 31 LEU MD2 1 73 PHE HB2 3.900 . 5.200 2.606 2.237 2.968 . 0 0 "[ . 1 . 2 . 3]" 1 241 1 31 LEU MD1 1 73 PHE HB3 3.700 . 4.900 4.995 4.516 5.127 0.227 16 0 "[ . 1 . 2 . 3]" 1 242 1 31 LEU MD2 1 94 ILE MD 3.000 . 4.600 3.884 3.500 4.702 0.102 26 0 "[ . 1 . 2 . 3]" 1 243 1 31 LEU MD2 1 33 TYR HB3 4.600 . 6.000 3.719 2.291 4.120 . 0 0 "[ . 1 . 2 . 3]" 1 244 1 31 LEU MD1 1 33 TYR HB3 3.400 . 4.600 2.572 2.148 3.822 . 0 0 "[ . 1 . 2 . 3]" 1 245 1 31 LEU MD2 1 73 PHE HA 3.900 . 5.200 4.560 4.019 4.926 . 0 0 "[ . 1 . 2 . 3]" 1 246 1 31 LEU MD1 1 73 PHE HA 4.100 . 5.900 5.855 5.544 6.111 0.211 21 0 "[ . 1 . 2 . 3]" 1 247 1 30 TYR HA 1 31 LEU H 3.500 . 4.200 2.140 2.109 2.223 . 0 0 "[ . 1 . 2 . 3]" 1 248 1 31 LEU HB3 1 31 LEU MD1 2.600 . 4.600 3.177 2.823 3.201 . 0 0 "[ . 1 . 2 . 3]" 1 249 1 31 LEU MD1 1 73 PHE HB2 3.900 . 5.200 4.053 3.867 4.217 . 0 0 "[ . 1 . 2 . 3]" 1 250 1 31 LEU MD2 1 92 TRP HB2 4.400 . 5.800 5.487 4.987 5.947 0.147 24 0 "[ . 1 . 2 . 3]" 1 251 1 31 LEU MD2 1 32 CYS HB3 5.100 . 7.100 6.865 5.799 7.104 0.004 21 0 "[ . 1 . 2 . 3]" 1 252 1 31 LEU MD2 1 33 TYR H 5.200 . 6.200 5.107 3.373 5.786 . 0 0 "[ . 1 . 2 . 3]" 1 253 1 31 LEU MD2 1 53 LEU H 4.900 . 5.900 4.400 2.427 5.041 . 0 0 "[ . 1 . 2 . 3]" 1 254 1 31 LEU MD2 1 94 ILE HA 4.500 . 5.900 5.560 5.135 5.802 . 0 0 "[ . 1 . 2 . 3]" 1 255 1 31 LEU MD1 1 94 ILE HA 4.600 . 6.000 4.169 3.639 4.715 . 0 0 "[ . 1 . 2 . 3]" 1 256 1 31 LEU MD2 1 92 TRP HA 4.700 . 6.100 4.902 4.506 5.203 . 0 0 "[ . 1 . 2 . 3]" 1 257 1 31 LEU MD2 1 92 TRP HE1 4.500 . 5.900 4.239 3.826 4.546 . 0 0 "[ . 1 . 2 . 3]" 1 258 1 31 LEU H 1 31 LEU HB2 3.800 . 5.100 3.613 3.180 3.859 . 0 0 "[ . 1 . 2 . 3]" 1 259 1 31 LEU MD2 1 73 PHE QD 4.300 . 6.200 3.708 2.845 3.950 . 0 0 "[ . 1 . 2 . 3]" 1 260 1 31 LEU MD2 1 90 VAL MG2 6.200 . 7.500 5.385 4.868 5.608 . 0 0 "[ . 1 . 2 . 3]" 1 261 1 31 LEU MD2 1 53 LEU MD1 2.900 . 4.500 2.692 2.062 4.502 0.002 21 0 "[ . 1 . 2 . 3]" 1 262 1 31 LEU MD2 1 70 GLU HB3 3.700 . 4.900 3.644 2.703 4.166 . 0 0 "[ . 1 . 2 . 3]" 1 263 1 31 LEU MD2 1 52 PHE HA 5.000 . 6.000 5.543 3.663 6.016 0.016 19 0 "[ . 1 . 2 . 3]" 1 264 1 31 LEU MD2 1 70 GLU HB2 3.400 . 4.600 4.240 3.727 4.863 0.263 26 0 "[ . 1 . 2 . 3]" 1 265 1 29 THR MG 1 31 LEU MD1 3.600 . 6.000 5.690 4.868 6.056 0.056 2 0 "[ . 1 . 2 . 3]" 1 266 1 31 LEU MD1 1 33 TYR H 4.300 . 5.600 3.172 2.512 5.148 . 0 0 "[ . 1 . 2 . 3]" 1 267 1 31 LEU MD1 1 94 ILE H 4.700 . 6.100 4.773 4.411 5.382 . 0 0 "[ . 1 . 2 . 3]" 1 268 1 31 LEU MD1 1 69 ALA H 4.500 . 6.400 6.481 5.387 6.687 0.287 23 0 "[ . 1 . 2 . 3]" 1 269 1 31 LEU MD2 1 69 ALA H 6.400 . 7.700 4.281 3.923 5.330 . 0 0 "[ . 1 . 2 . 3]" 1 270 1 30 TYR HA 1 31 LEU MD2 5.800 . 7.000 5.605 5.147 6.049 . 0 0 "[ . 1 . 2 . 3]" 1 271 1 31 LEU MD1 1 73 PHE QE 3.500 . 5.200 5.004 4.684 5.376 0.176 26 0 "[ . 1 . 2 . 3]" 1 272 1 30 TYR H 1 31 LEU HG 4.300 . 7.600 6.947 6.407 7.443 . 0 0 "[ . 1 . 2 . 3]" 1 273 1 31 LEU HG 1 92 TRP HD1 4.700 . 6.400 6.349 5.091 6.523 0.123 22 0 "[ . 1 . 2 . 3]" 1 274 1 31 LEU MD2 1 73 PHE HB3 3.500 . 4.700 3.527 3.176 3.967 . 0 0 "[ . 1 . 2 . 3]" 1 275 1 31 LEU MD2 1 33 TYR HB2 3.500 . 4.700 4.697 3.670 4.916 0.216 3 0 "[ . 1 . 2 . 3]" 1 276 1 31 LEU HG 1 73 PHE QE 4.300 . 7.000 6.621 5.837 7.064 0.064 8 0 "[ . 1 . 2 . 3]" 1 277 1 31 LEU MD1 1 31 LEU MD2 2.800 . 4.900 1.956 1.780 2.025 0.020 9 0 "[ . 1 . 2 . 3]" 1 278 1 31 LEU HA 1 31 LEU MD1 3.700 . 5.400 2.665 2.175 3.312 . 0 0 "[ . 1 . 2 . 3]" 1 279 1 31 LEU MD1 1 33 TYR HB2 3.400 . 4.600 3.583 3.255 4.684 0.084 26 0 "[ . 1 . 2 . 3]" 1 280 1 31 LEU MD2 1 69 ALA MB 2.900 . 4.500 2.093 1.918 2.583 . 0 0 "[ . 1 . 2 . 3]" 1 281 1 31 LEU MD1 1 32 CYS H 3.700 . 4.900 2.418 2.188 4.202 . 0 0 "[ . 1 . 2 . 3]" 1 282 1 31 LEU HB3 1 31 LEU MD2 2.900 . 4.500 2.303 2.122 2.487 . 0 0 "[ . 1 . 2 . 3]" 1 283 1 31 LEU MD1 1 33 TYR QD 3.700 . 4.900 3.807 3.172 4.940 0.040 26 0 "[ . 1 . 2 . 3]" 1 284 1 31 LEU HB2 1 31 LEU MD1 2.900 . 5.000 2.292 2.155 2.418 . 0 0 "[ . 1 . 2 . 3]" 1 285 1 30 TYR HB2 1 31 LEU H 3.900 . 4.700 4.446 4.274 4.518 . 0 0 "[ . 1 . 2 . 3]" 1 286 1 31 LEU MD2 1 122 ILE MD 5.900 . 6.900 6.451 5.671 6.986 0.086 26 0 "[ . 1 . 2 . 3]" 1 287 1 31 LEU H 1 31 LEU HB3 3.600 . 4.800 2.579 2.351 2.784 . 0 0 "[ . 1 . 2 . 3]" 1 288 1 31 LEU MD1 1 92 TRP HH2 3.600 . 5.300 4.818 3.766 5.346 0.046 22 0 "[ . 1 . 2 . 3]" 1 289 1 31 LEU H 1 52 PHE QD 5.200 . 6.200 5.558 4.907 6.079 . 0 0 "[ . 1 . 2 . 3]" 1 290 1 31 LEU MD2 1 70 GLU HA 3.200 . 4.300 2.281 2.046 2.753 . 0 0 "[ . 1 . 2 . 3]" 1 291 1 31 LEU H 1 52 PHE HA 4.900 . 5.900 5.556 4.962 5.890 . 0 0 "[ . 1 . 2 . 3]" 1 292 1 31 LEU H 1 32 CYS H 4.700 . 5.600 4.268 4.065 4.400 . 0 0 "[ . 1 . 2 . 3]" 1 293 1 32 CYS H 1 94 ILE HA 4.200 . 5.000 3.432 3.172 3.596 . 0 0 "[ . 1 . 2 . 3]" 1 294 1 31 LEU HB2 1 32 CYS H 3.700 . 4.400 3.694 3.195 4.340 . 0 0 "[ . 1 . 2 . 3]" 1 295 1 31 LEU HB3 1 32 CYS H 3.500 . 4.200 4.390 4.296 4.488 0.288 21 0 "[ . 1 . 2 . 3]" 1 296 1 32 CYS HB2 1 94 ILE HA 4.300 . 6.200 5.168 4.339 6.186 . 0 0 "[ . 1 . 2 . 3]" 1 297 1 32 CYS HB2 1 52 PHE HA 4.200 . 5.000 5.055 4.235 5.231 0.231 26 0 "[ . 1 . 2 . 3]" 1 298 1 32 CYS H 1 93 PHE QD 3.900 . 5.700 5.104 4.529 5.381 . 0 0 "[ . 1 . 2 . 3]" 1 299 1 32 CYS H 1 32 CYS HB2 3.600 . 4.800 2.588 2.220 3.412 . 0 0 "[ . 1 . 2 . 3]" 1 300 1 31 LEU HA 1 32 CYS H 3.200 . 3.800 2.134 2.077 2.184 . 0 0 "[ . 1 . 2 . 3]" 1 301 1 32 CYS H 1 32 CYS HB3 3.600 . 4.800 3.488 2.297 3.727 . 0 0 "[ . 1 . 2 . 3]" 1 302 1 32 CYS HB2 1 93 PHE H 3.800 . 4.600 3.391 2.954 4.670 0.070 3 0 "[ . 1 . 2 . 3]" 1 303 1 33 TYR H 1 53 LEU H 4.700 . 5.600 3.786 3.472 4.248 . 0 0 "[ . 1 . 2 . 3]" 1 304 1 33 TYR HA 1 33 TYR QD 3.400 . 4.500 3.567 3.466 3.620 . 0 0 "[ . 1 . 2 . 3]" 1 305 1 33 TYR H 1 52 PHE HA 3.900 . 4.700 2.254 1.942 2.458 . 0 0 "[ . 1 . 2 . 3]" 1 306 1 33 TYR H 1 33 TYR QD 3.500 . 4.700 2.598 2.431 3.007 . 0 0 "[ . 1 . 2 . 3]" 1 307 1 33 TYR QE 1 49 HIS HB2 4.100 . 5.400 5.046 3.889 5.393 . 0 0 "[ . 1 . 2 . 3]" 1 308 1 33 TYR H 1 33 TYR QE 3.600 . 4.800 4.433 4.268 4.786 . 0 0 "[ . 1 . 2 . 3]" 1 309 1 33 TYR HA 1 93 PHE H 3.800 . 4.600 3.703 3.234 3.972 . 0 0 "[ . 1 . 2 . 3]" 1 310 1 33 TYR QD 1 90 VAL MG2 3.200 . 4.800 2.982 2.347 3.411 . 0 0 "[ . 1 . 2 . 3]" 1 311 1 33 TYR QD 1 53 LEU MD2 3.200 . 4.800 3.501 2.018 4.093 . 0 0 "[ . 1 . 2 . 3]" 1 312 1 31 LEU MD1 1 33 TYR HA 3.300 . 5.000 3.315 2.993 4.858 . 0 0 "[ . 1 . 2 . 3]" 1 313 1 32 CYS HA 1 33 TYR H 3.300 . 4.000 2.168 2.138 2.244 . 0 0 "[ . 1 . 2 . 3]" 1 314 1 32 CYS HB3 1 33 TYR H 3.300 . 4.000 3.677 3.173 4.223 0.223 3 0 "[ . 1 . 2 . 3]" 1 315 1 34 GLU H 1 91 THR H 3.700 . 4.400 2.737 2.511 3.138 . 0 0 "[ . 1 . 2 . 3]" 1 316 1 34 GLU HA 1 34 GLU HG3 4.800 3.800 5.800 3.755 3.693 4.203 0.107 13 0 "[ . 1 . 2 . 3]" 1 317 1 34 GLU QG 1 50 MET HA 4.400 . 5.300 5.330 5.201 5.432 0.132 7 0 "[ . 1 . 2 . 3]" 1 318 1 34 GLU HA 1 51 GLY H 4.100 . 4.900 3.070 2.888 3.277 . 0 0 "[ . 1 . 2 . 3]" 1 319 1 34 GLU HA 1 50 MET H 3.700 . 5.200 5.165 5.058 5.278 0.078 25 0 "[ . 1 . 2 . 3]" 1 320 1 34 GLU HA 1 45 LEU MD1 3.700 . 4.900 4.009 3.680 5.000 0.100 25 0 "[ . 1 . 2 . 3]" 1 321 1 34 GLU HA 1 35 VAL MG2 3.800 . 5.100 3.779 3.353 4.029 . 0 0 "[ . 1 . 2 . 3]" 1 322 1 34 GLU H 1 34 GLU HG3 3.500 . 4.700 2.650 2.369 3.687 . 0 0 "[ . 1 . 2 . 3]" 1 323 1 33 TYR HB2 1 34 GLU H 3.900 . 4.700 3.006 2.678 3.175 . 0 0 "[ . 1 . 2 . 3]" 1 324 1 34 GLU HA 1 35 VAL MG1 4.400 . 5.800 5.427 5.393 5.458 . 0 0 "[ . 1 . 2 . 3]" 1 325 1 34 GLU HA 1 50 MET HB2 4.700 . 5.600 3.168 2.340 4.093 . 0 0 "[ . 1 . 2 . 3]" 1 326 1 34 GLU HA 1 35 VAL HB 3.800 . 5.100 4.348 4.227 4.578 . 0 0 "[ . 1 . 2 . 3]" 1 327 1 33 TYR HB3 1 34 GLU HA 3.900 . 5.700 5.648 5.532 5.701 0.001 11 0 "[ . 1 . 2 . 3]" 1 328 1 34 GLU H 1 93 PHE H 4.600 . 5.500 5.414 5.229 5.573 0.073 30 0 "[ . 1 . 2 . 3]" 1 329 1 34 GLU H 1 34 GLU HG2 3.400 . 5.100 2.360 2.047 2.483 . 0 0 "[ . 1 . 2 . 3]" 1 330 1 33 TYR HA 1 34 GLU H 3.200 . 3.800 2.212 2.165 2.326 . 0 0 "[ . 1 . 2 . 3]" 1 331 1 34 GLU H 1 90 VAL MG1 3.800 . 5.100 5.102 4.957 5.249 0.149 7 0 "[ . 1 . 2 . 3]" 1 332 1 34 GLU H 1 34 GLU HB2 3.300 . 4.500 3.767 3.664 3.900 . 0 0 "[ . 1 . 2 . 3]" 1 333 1 34 GLU HA 1 50 MET HA 3.500 . 4.200 2.376 2.322 2.449 . 0 0 "[ . 1 . 2 . 3]" 1 334 1 33 TYR QD 1 34 GLU HA 4.000 . 5.300 3.173 2.884 3.353 . 0 0 "[ . 1 . 2 . 3]" 1 335 1 34 GLU H 1 91 THR MG 3.800 . 5.100 5.098 4.751 5.212 0.112 26 0 "[ . 1 . 2 . 3]" 1 336 1 34 GLU HB2 1 35 VAL HA 3.900 . 5.200 4.327 4.140 4.635 . 0 0 "[ . 1 . 2 . 3]" 1 337 1 34 GLU H 1 90 VAL MG2 3.800 . 5.100 2.351 2.177 2.534 . 0 0 "[ . 1 . 2 . 3]" 1 338 1 33 TYR HB3 1 34 GLU H 3.600 . 4.300 4.190 3.997 4.279 . 0 0 "[ . 1 . 2 . 3]" 1 339 1 35 VAL H 1 35 VAL MG2 3.200 . 4.300 3.157 2.884 3.342 . 0 0 "[ . 1 . 2 . 3]" 1 340 1 35 VAL HB 1 49 HIS HA 4.000 . 5.000 4.526 4.181 5.161 0.161 18 0 "[ . 1 . 2 . 3]" 1 341 1 35 VAL HB 1 88 TYR QD 3.200 . 5.000 4.935 4.726 5.104 0.104 9 0 "[ . 1 . 2 . 3]" 1 342 1 35 VAL HA 1 35 VAL MG1 3.100 . 4.200 2.477 2.340 2.596 . 0 0 "[ . 1 . 2 . 3]" 1 343 1 35 VAL MG1 1 89 ARG H 3.800 . 5.100 3.400 3.095 3.688 . 0 0 "[ . 1 . 2 . 3]" 1 344 1 35 VAL MG1 1 88 TYR QE 3.600 . 5.300 3.040 2.285 3.745 . 0 0 "[ . 1 . 2 . 3]" 1 345 1 35 VAL H 1 35 VAL MG1 3.600 . 4.800 3.720 3.613 3.877 . 0 0 "[ . 1 . 2 . 3]" 1 346 1 35 VAL MG1 1 88 TYR QD 3.100 . 4.700 2.186 2.049 2.495 . 0 0 "[ . 1 . 2 . 3]" 1 347 1 35 VAL MG1 1 80 LEU MD1 5.700 . 6.800 3.940 3.379 5.192 . 0 0 "[ . 1 . 2 . 3]" 1 348 1 35 VAL MG2 1 82 LEU MD2 3.100 . 4.700 2.893 2.430 3.513 . 0 0 "[ . 1 . 2 . 3]" 1 349 1 34 GLU HB2 1 35 VAL MG1 3.900 . 5.700 5.474 5.346 5.719 0.019 7 0 "[ . 1 . 2 . 3]" 1 350 1 34 GLU HG3 1 35 VAL MG1 5.000 . 6.800 6.138 5.915 6.594 . 0 0 "[ . 1 . 2 . 3]" 1 351 1 35 VAL MG1 1 80 LEU MD2 3.600 . 5.300 4.100 3.270 4.659 . 0 0 "[ . 1 . 2 . 3]" 1 352 1 35 VAL HA 1 35 VAL MG2 3.200 . 4.300 2.225 2.182 2.393 . 0 0 "[ . 1 . 2 . 3]" 1 353 1 35 VAL MG2 1 80 LEU MD2 3.200 . 4.800 2.567 1.962 3.109 . 0 0 "[ . 1 . 2 . 3]" 1 354 1 35 VAL MG1 1 82 LEU MD2 3.200 . 4.800 2.893 2.095 3.344 . 0 0 "[ . 1 . 2 . 3]" 1 355 1 35 VAL MG1 1 36 GLU HA 4.000 . 5.300 3.452 3.250 3.598 . 0 0 "[ . 1 . 2 . 3]" 1 356 1 35 VAL MG1 1 90 VAL HA 3.500 . 4.700 4.278 3.976 4.455 . 0 0 "[ . 1 . 2 . 3]" 1 357 1 35 VAL QG 1 90 VAL HB 3.500 . 4.700 2.511 2.235 2.730 . 0 0 "[ . 1 . 2 . 3]" 1 358 1 35 VAL MG2 1 80 LEU MD1 3.200 . 4.800 2.311 1.855 3.540 . 0 0 "[ . 1 . 2 . 3]" 1 359 1 35 VAL MG1 1 35 VAL MG2 2.700 . 4.200 2.045 2.022 2.075 . 0 0 "[ . 1 . 2 . 3]" 1 360 1 35 VAL MG2 1 90 VAL MG1 3.000 . 4.600 3.574 3.223 3.821 . 0 0 "[ . 1 . 2 . 3]" 1 361 1 34 GLU HG3 1 35 VAL H 3.500 . 4.200 4.167 4.003 4.288 0.088 1 0 "[ . 1 . 2 . 3]" 1 362 1 35 VAL H 1 35 VAL HB 3.600 . 4.300 2.548 2.378 2.720 . 0 0 "[ . 1 . 2 . 3]" 1 363 1 35 VAL HA 1 90 VAL HA 2.700 . 3.200 2.459 2.330 2.617 . 0 0 "[ . 1 . 2 . 3]" 1 364 1 35 VAL HA 1 90 VAL HB 3.300 . 3.800 2.954 2.762 3.143 . 0 0 "[ . 1 . 2 . 3]" 1 365 1 35 VAL HA 1 90 VAL MG1 3.600 . 4.800 4.238 4.089 4.373 . 0 0 "[ . 1 . 2 . 3]" 1 366 1 33 TYR QD 1 35 VAL HA 4.300 . 5.600 4.724 4.252 5.076 . 0 0 "[ . 1 . 2 . 3]" 1 367 1 34 GLU HA 1 35 VAL H 3.300 . 4.000 2.417 2.253 2.519 . 0 0 "[ . 1 . 2 . 3]" 1 368 1 35 VAL HA 1 36 GLU H 3.200 . 3.800 2.167 2.080 2.245 . 0 0 "[ . 1 . 2 . 3]" 1 369 1 35 VAL MG2 1 36 GLU H 3.600 . 4.800 3.692 3.405 3.841 . 0 0 "[ . 1 . 2 . 3]" 1 370 1 36 GLU H 1 90 VAL MG1 4.200 . 5.500 4.844 4.662 5.042 . 0 0 "[ . 1 . 2 . 3]" 1 371 1 36 GLU H 1 36 GLU HB2 3.700 . 4.900 2.639 2.480 2.782 . 0 0 "[ . 1 . 2 . 3]" 1 372 1 36 GLU H 1 36 GLU HG3 4.000 . 5.300 3.572 2.802 4.040 . 0 0 "[ . 1 . 2 . 3]" 1 373 1 36 GLU H 1 90 VAL HA 4.900 . 5.900 3.252 2.977 3.546 . 0 0 "[ . 1 . 2 . 3]" 1 374 1 36 GLU H 1 89 ARG H 3.500 . 4.200 2.673 2.491 2.920 . 0 0 "[ . 1 . 2 . 3]" 1 375 1 36 GLU HA 1 46 MET H 3.700 . 4.400 3.335 2.968 4.013 . 0 0 "[ . 1 . 2 . 3]" 1 376 1 36 GLU HA 1 43 TRP HE3 3.700 . 4.400 3.980 3.825 4.227 . 0 0 "[ . 1 . 2 . 3]" 1 377 1 35 VAL MG1 1 36 GLU H 3.400 . 4.600 2.355 1.980 2.695 . 0 0 "[ . 1 . 2 . 3]" 1 378 1 36 GLU HA 1 45 LEU HA 4.200 . 5.000 2.805 2.339 2.987 . 0 0 "[ . 1 . 2 . 3]" 1 379 1 36 GLU HA 1 36 GLU HG3 3.900 . 5.200 2.364 2.319 2.615 . 0 0 "[ . 1 . 2 . 3]" 1 380 1 36 GLU HA 1 37 ARG H 3.500 . 4.200 2.186 2.156 2.231 . 0 0 "[ . 1 . 2 . 3]" 1 381 1 37 ARG H 1 46 MET H 4.300 . 5.200 4.607 4.433 4.872 . 0 0 "[ . 1 . 2 . 3]" 1 382 1 36 GLU H 1 37 ARG H 4.500 . 5.400 4.424 4.331 4.494 . 0 0 "[ . 1 . 2 . 3]" 1 383 1 37 ARG HA 1 37 ARG QG 3.800 . 4.600 2.570 2.293 3.128 . 0 0 "[ . 1 . 2 . 3]" 1 384 1 37 ARG H 1 46 MET HG3 4.400 . 5.300 3.501 3.030 4.249 . 0 0 "[ . 1 . 2 . 3]" 1 385 1 37 ARG H 1 46 MET HG2 4.100 . 4.900 4.339 3.294 4.961 0.061 13 0 "[ . 1 . 2 . 3]" 1 386 1 36 GLU HB2 1 37 ARG H 3.300 . 4.000 4.001 3.680 4.084 0.084 26 0 "[ . 1 . 2 . 3]" 1 387 1 37 ARG H 1 44 VAL MG2 4.000 . 5.300 2.136 1.887 2.773 . 0 0 "[ . 1 . 2 . 3]" 1 388 1 37 ARG H 1 45 LEU MD2 3.900 . 5.200 5.162 4.803 5.265 0.065 30 0 "[ . 1 . 2 . 3]" 1 389 1 37 ARG H 1 45 LEU HA 4.400 . 5.300 4.085 3.334 4.298 . 0 0 "[ . 1 . 2 . 3]" 1 390 1 37 ARG H 1 44 VAL HA 4.400 . 5.300 4.677 4.312 4.879 . 0 0 "[ . 1 . 2 . 3]" 1 391 1 36 GLU HG3 1 37 ARG H 3.700 . 4.400 4.255 4.142 4.496 0.096 25 0 "[ . 1 . 2 . 3]" 1 392 1 37 ARG H 1 38 LEU HA 4.900 . 5.900 4.734 4.650 4.782 . 0 0 "[ . 1 . 2 . 3]" 1 393 1 37 ARG H 1 38 LEU HB2 4.100 . 6.100 5.971 5.855 6.038 . 0 0 "[ . 1 . 2 . 3]" 1 394 1 37 ARG H 1 37 ARG HB2 3.500 . 4.200 3.281 2.926 3.512 . 0 0 "[ . 1 . 2 . 3]" 1 395 1 37 ARG H 1 37 ARG HG2 3.700 . 4.900 4.115 2.941 4.801 . 0 0 "[ . 1 . 2 . 3]" 1 396 1 37 ARG H 1 46 MET ME 3.500 . 4.700 4.533 4.223 4.761 0.061 10 0 "[ . 1 . 2 . 3]" 1 397 1 38 LEU MD1 1 43 TRP HH2 3.400 . 4.600 4.296 4.160 4.344 . 0 0 "[ . 1 . 2 . 3]" 1 398 1 38 LEU HA 1 43 TRP H 4.000 . 5.000 4.442 4.296 4.622 . 0 0 "[ . 1 . 2 . 3]" 1 399 1 38 LEU MD1 1 43 TRP HZ2 3.500 . 4.700 3.729 3.611 3.801 . 0 0 "[ . 1 . 2 . 3]" 1 400 1 38 LEU HB2 1 38 LEU MD1 3.300 . 5.000 2.233 2.221 2.279 . 0 0 "[ . 1 . 2 . 3]" 1 401 1 38 LEU H 1 38 LEU MD2 3.500 . 5.800 4.248 4.219 4.269 . 0 0 "[ . 1 . 2 . 3]" 1 402 1 38 LEU H 1 38 LEU HB2 3.300 . 4.500 2.417 2.340 2.472 . 0 0 "[ . 1 . 2 . 3]" 1 403 1 38 LEU MD1 1 38 LEU MD2 2.500 . 5.000 1.918 1.831 2.018 . 0 0 "[ . 1 . 2 . 3]" 1 404 1 38 LEU MD1 1 43 TRP HE3 3.700 . 4.900 3.313 3.256 3.373 . 0 0 "[ . 1 . 2 . 3]" 1 405 1 38 LEU HG 1 39 ASP H 3.700 . 4.400 3.454 3.254 3.663 . 0 0 "[ . 1 . 2 . 3]" 1 406 1 38 LEU MD2 1 43 TRP HE1 5.300 . 6.400 4.791 4.619 4.888 . 0 0 "[ . 1 . 2 . 3]" 1 407 1 38 LEU MD2 1 87 ILE H 4.000 . 5.800 5.022 4.843 5.231 . 0 0 "[ . 1 . 2 . 3]" 1 408 1 38 LEU MD2 1 43 TRP HZ3 3.400 . 5.100 4.891 4.715 4.990 . 0 0 "[ . 1 . 2 . 3]" 1 409 1 38 LEU MD2 1 43 TRP HE3 4.500 . 5.900 5.301 5.212 5.328 . 0 0 "[ . 1 . 2 . 3]" 1 410 1 38 LEU MD1 1 42 THR HA 3.200 . 4.300 2.588 2.380 2.904 . 0 0 "[ . 1 . 2 . 3]" 1 411 1 38 LEU MD1 1 43 TRP HB3 4.000 . 5.300 4.195 4.030 4.292 . 0 0 "[ . 1 . 2 . 3]" 1 412 1 38 LEU H 1 88 TYR HA 3.900 . 4.700 3.417 3.344 3.584 . 0 0 "[ . 1 . 2 . 3]" 1 413 1 38 LEU H 1 43 TRP HH2 3.500 . 4.200 3.543 3.453 3.856 . 0 0 "[ . 1 . 2 . 3]" 1 414 1 37 ARG HB2 1 38 LEU H 3.500 . 4.200 4.218 3.948 4.398 0.198 12 0 "[ . 1 . 2 . 3]" 1 415 1 38 LEU MD1 1 41 GLY HA2 3.400 . 4.600 3.500 3.340 3.627 . 0 0 "[ . 1 . 2 . 3]" 1 416 1 38 LEU H 1 38 LEU HG 3.700 . 4.900 4.448 4.438 4.457 . 0 0 "[ . 1 . 2 . 3]" 1 417 1 38 LEU HB2 1 38 LEU MD2 2.500 . 4.500 2.406 2.349 2.453 . 0 0 "[ . 1 . 2 . 3]" 1 418 1 38 LEU HG 1 41 GLY H 3.200 . 4.100 3.323 2.846 3.605 . 0 0 "[ . 1 . 2 . 3]" 1 419 1 38 LEU MD2 1 87 ILE MD 2.800 . 3.900 2.592 2.456 2.845 . 0 0 "[ . 1 . 2 . 3]" 1 420 1 38 LEU MD1 1 39 ASP HB3 4.200 . 5.500 5.813 5.752 5.893 0.393 24 0 "[ . 1 . 2 . 3]" 1 421 1 38 LEU MD2 1 87 ILE HB 4.000 . 5.300 4.334 4.291 4.457 . 0 0 "[ . 1 . 2 . 3]" 1 422 1 38 LEU HG 1 41 GLY HA2 3.300 . 4.000 3.211 2.821 3.512 . 0 0 "[ . 1 . 2 . 3]" 1 423 1 38 LEU HG 1 42 THR H 3.900 . 5.000 3.276 2.897 3.610 . 0 0 "[ . 1 . 2 . 3]" 1 424 1 38 LEU HG 1 43 TRP HE3 3.900 . 5.000 5.345 5.262 5.416 0.416 22 0 "[ . 1 . 2 . 3]" 1 425 1 38 LEU MD2 1 86 GLN HB3 4.100 . 7.900 6.422 5.812 7.445 . 0 0 "[ . 1 . 2 . 3]" 1 426 1 38 LEU HG 1 87 ILE MG 3.900 . 5.700 3.901 3.856 3.954 . 0 0 "[ . 1 . 2 . 3]" 1 427 1 38 LEU HA 1 38 LEU MD1 3.400 . 5.600 2.166 2.130 2.187 . 0 0 "[ . 1 . 2 . 3]" 1 428 1 38 LEU H 1 38 LEU MD1 3.800 . 6.100 3.852 3.748 3.921 . 0 0 "[ . 1 . 2 . 3]" 1 429 1 38 LEU MD1 1 87 ILE HG12 3.800 . 5.600 5.649 5.611 5.681 0.081 30 0 "[ . 1 . 2 . 3]" 1 430 1 38 LEU MD1 1 43 TRP H 3.900 . 5.200 3.037 2.898 3.139 . 0 0 "[ . 1 . 2 . 3]" 1 431 1 38 LEU HB2 1 38 LEU HG 2.500 . 3.700 3.009 2.999 3.018 . 0 0 "[ . 1 . 2 . 3]" 1 432 1 37 ARG HA 1 38 LEU H 3.000 . 3.600 2.158 2.132 2.181 . 0 0 "[ . 1 . 2 . 3]" 1 433 1 38 LEU MD2 1 39 ASP H 3.500 . 5.000 4.876 4.732 5.021 0.021 30 0 "[ . 1 . 2 . 3]" 1 434 1 38 LEU H 1 39 ASP H 4.600 . 5.500 4.268 4.200 4.325 . 0 0 "[ . 1 . 2 . 3]" 1 435 1 39 ASP H 1 43 TRP H 4.900 . 5.900 4.914 4.814 4.974 . 0 0 "[ . 1 . 2 . 3]" 1 436 1 39 ASP H 1 41 GLY H 8.000 . 8.000 4.454 4.113 4.818 . 0 0 "[ . 1 . 2 . 3]" 1 437 1 39 ASP H 1 44 VAL HB 4.000 . 4.800 5.039 4.991 5.064 0.264 30 0 "[ . 1 . 2 . 3]" 1 438 1 39 ASP HB3 1 44 VAL HB 3.400 . 4.100 4.303 4.226 4.353 0.253 26 0 "[ . 1 . 2 . 3]" 1 439 1 39 ASP HB2 1 44 VAL HB 3.800 . 4.600 4.629 4.579 4.649 0.049 4 0 "[ . 1 . 2 . 3]" 1 440 1 39 ASP H 1 39 ASP HB2 3.400 . 4.100 2.721 2.666 2.780 . 0 0 "[ . 1 . 2 . 3]" 1 441 1 39 ASP H 1 44 VAL MG1 3.300 . 4.500 2.086 2.037 2.116 . 0 0 "[ . 1 . 2 . 3]" 1 442 1 38 LEU MD1 1 39 ASP H 3.200 . 4.800 3.518 3.307 3.653 . 0 0 "[ . 1 . 2 . 3]" 1 443 1 39 ASP H 1 39 ASP HB3 3.400 . 4.100 2.861 2.702 2.998 . 0 0 "[ . 1 . 2 . 3]" 1 444 1 39 ASP H 1 42 THR MG 3.400 . 4.600 4.699 4.658 4.735 0.135 25 0 "[ . 1 . 2 . 3]" 1 445 1 39 ASP H 1 43 TRP HA 3.100 . 3.700 3.271 3.160 3.362 . 0 0 "[ . 1 . 2 . 3]" 1 446 1 38 LEU HA 1 39 ASP H 3.600 . 4.300 2.164 2.109 2.230 . 0 0 "[ . 1 . 2 . 3]" 1 447 1 40 ASN H 1 40 ASN HB2 3.300 . 4.000 3.287 3.045 3.912 . 0 0 "[ . 1 . 2 . 3]" 1 448 1 39 ASP HA 1 40 ASN H 3.800 . 4.600 2.194 2.147 2.265 . 0 0 "[ . 1 . 2 . 3]" 1 449 1 38 LEU MD1 1 40 ASN H 4.600 . 6.000 5.792 5.525 6.039 0.039 3 0 "[ . 1 . 2 . 3]" 1 450 1 40 ASN HA 1 40 ASN HB3 2.900 . 3.500 2.924 2.587 3.027 . 0 0 "[ . 1 . 2 . 3]" 1 451 1 40 ASN HA 1 40 ASN HB2 2.700 . 3.200 2.523 2.243 2.678 . 0 0 "[ . 1 . 2 . 3]" 1 452 1 39 ASP H 1 40 ASN H 4.800 3.800 5.800 4.414 4.312 4.487 . 0 0 "[ . 1 . 2 . 3]" 1 453 1 40 ASN H 1 41 GLY H 4.700 . 5.600 2.663 2.537 2.785 . 0 0 "[ . 1 . 2 . 3]" 1 454 1 40 ASN HB2 1 40 ASN HD22 2.800 . 3.700 3.648 3.491 4.001 0.301 10 0 "[ . 1 . 2 . 3]" 1 455 1 40 ASN HB3 1 41 GLY H 3.800 . 4.600 4.180 3.989 4.479 . 0 0 "[ . 1 . 2 . 3]" 1 456 1 39 ASP HB3 1 40 ASN HB3 3.500 . 4.700 4.060 3.400 4.445 . 0 0 "[ . 1 . 2 . 3]" 1 457 1 40 ASN HB2 1 41 GLY H 4.100 . 4.900 4.555 4.405 4.667 . 0 0 "[ . 1 . 2 . 3]" 1 458 1 40 ASN HB3 1 40 ASN HD22 2.800 . 3.700 3.719 3.494 3.910 0.210 3 0 "[ . 1 . 2 . 3]" 1 459 1 40 ASN HA 1 41 GLY H 3.000 . 3.600 2.944 2.796 3.051 . 0 0 "[ . 1 . 2 . 3]" 1 460 1 40 ASN HB2 1 40 ASN HD21 2.600 . 3.400 2.599 2.233 3.425 0.025 10 0 "[ . 1 . 2 . 3]" 1 461 1 40 ASN H 1 40 ASN HD22 6.000 . 7.200 6.162 5.201 6.384 . 0 0 "[ . 1 . 2 . 3]" 1 462 1 40 ASN HB3 1 40 ASN HD21 2.800 . 3.700 2.770 2.249 3.224 . 0 0 "[ . 1 . 2 . 3]" 1 463 1 41 GLY HA3 1 42 THR H 3.600 . 4.300 3.401 3.335 3.440 . 0 0 "[ . 1 . 2 . 3]" 1 464 1 38 LEU MD2 1 41 GLY HA2 3.900 . 5.200 3.138 2.618 3.372 . 0 0 "[ . 1 . 2 . 3]" 1 465 1 38 LEU MD1 1 41 GLY HA3 3.400 . 4.600 4.537 4.292 4.635 0.035 18 0 "[ . 1 . 2 . 3]" 1 466 1 38 LEU MD2 1 41 GLY HA3 3.600 . 4.800 4.593 4.064 4.846 0.046 28 0 "[ . 1 . 2 . 3]" 1 467 1 38 LEU MD2 1 41 GLY H 3.200 . 4.300 4.035 3.548 4.299 . 0 0 "[ . 1 . 2 . 3]" 1 468 1 38 LEU MD1 1 41 GLY H 3.600 . 4.800 4.217 4.005 4.354 . 0 0 "[ . 1 . 2 . 3]" 1 469 1 38 LEU MD1 1 42 THR H 2.900 . 4.000 3.046 2.922 3.124 . 0 0 "[ . 1 . 2 . 3]" 1 470 1 40 ASN QB 1 42 THR H 3.900 . 5.000 3.544 3.166 4.262 . 0 0 "[ . 1 . 2 . 3]" 1 471 1 42 THR HA 1 42 THR MG 2.600 . 4.100 2.321 2.285 2.363 . 0 0 "[ . 1 . 2 . 3]" 1 472 1 38 LEU MD2 1 42 THR H 3.500 . 4.700 4.472 4.198 4.724 0.024 13 0 "[ . 1 . 2 . 3]" 1 473 1 41 GLY H 1 42 THR H 3.100 . 3.700 2.555 2.369 2.718 . 0 0 "[ . 1 . 2 . 3]" 1 474 1 42 THR HA 1 42 THR HB 2.900 . 3.500 3.021 3.017 3.026 . 0 0 "[ . 1 . 2 . 3]" 1 475 1 42 THR HB 1 42 THR MG 2.400 . 3.900 2.136 2.133 2.140 . 0 0 "[ . 1 . 2 . 3]" 1 476 1 42 THR MG 1 43 TRP HB3 3.600 . 4.800 4.390 4.285 4.512 . 0 0 "[ . 1 . 2 . 3]" 1 477 1 42 THR H 1 42 THR HA 3.000 . 3.600 2.939 2.935 2.950 . 0 0 "[ . 1 . 2 . 3]" 1 478 1 38 LEU MD1 1 42 THR MG 3.500 . 5.200 3.875 3.711 4.053 . 0 0 "[ . 1 . 2 . 3]" 1 479 1 41 GLY HA2 1 42 THR H 3.200 . 3.800 3.148 3.095 3.232 . 0 0 "[ . 1 . 2 . 3]" 1 480 1 42 THR H 1 43 TRP H 3.500 . 4.200 4.383 4.363 4.416 0.216 14 0 "[ . 1 . 2 . 3]" 1 481 1 39 ASP H 1 42 THR H 3.100 . 3.700 3.385 3.194 3.562 . 0 0 "[ . 1 . 2 . 3]" 1 482 1 42 THR H 1 42 THR HB 2.700 . 3.200 2.741 2.665 2.790 . 0 0 "[ . 1 . 2 . 3]" 1 483 1 42 THR H 1 42 THR MG 2.800 . 4.400 3.865 3.827 3.897 . 0 0 "[ . 1 . 2 . 3]" 1 484 1 42 THR HB 1 43 TRP H 3.000 . 3.600 3.779 3.703 3.849 0.249 16 0 "[ . 1 . 2 . 3]" 1 485 1 43 TRP H 1 43 TRP HE1 4.500 . 5.400 5.359 5.259 5.425 0.025 2 0 "[ . 1 . 2 . 3]" 1 486 1 38 LEU MD1 1 43 TRP HE1 4.200 . 5.500 3.419 3.183 3.597 . 0 0 "[ . 1 . 2 . 3]" 1 487 1 43 TRP HZ3 1 44 VAL H 4.200 . 5.000 4.713 4.602 4.805 . 0 0 "[ . 1 . 2 . 3]" 1 488 1 38 LEU MD1 1 43 TRP HA 2.800 . 3.900 2.552 2.301 2.694 . 0 0 "[ . 1 . 2 . 3]" 1 489 1 42 THR HA 1 43 TRP H 2.400 . 2.900 2.287 2.237 2.358 . 0 0 "[ . 1 . 2 . 3]" 1 490 1 38 LEU MD2 1 43 TRP HH2 3.100 . 4.200 4.241 4.120 4.316 0.116 24 0 "[ . 1 . 2 . 3]" 1 491 1 37 ARG H 1 43 TRP HE3 4.300 . 5.200 3.132 2.872 3.296 . 0 0 "[ . 1 . 2 . 3]" 1 492 1 43 TRP H 1 43 TRP HE3 4.000 . 5.000 4.952 4.905 4.997 . 0 0 "[ . 1 . 2 . 3]" 1 493 1 39 ASP H 1 43 TRP HE3 4.200 . 5.000 4.412 4.246 4.535 . 0 0 "[ . 1 . 2 . 3]" 1 494 1 38 LEU HA 1 43 TRP HA 2.700 . 3.200 2.288 2.263 2.327 . 0 0 "[ . 1 . 2 . 3]" 1 495 1 43 TRP H 1 43 TRP HB2 3.300 . 4.000 2.297 2.270 2.325 . 0 0 "[ . 1 . 2 . 3]" 1 496 1 38 LEU HB2 1 43 TRP HH2 2.900 . 3.500 3.093 3.018 3.143 . 0 0 "[ . 1 . 2 . 3]" 1 497 1 36 GLU HG3 1 43 TRP HE3 3.500 . 4.700 4.859 4.576 5.013 0.313 25 0 "[ . 1 . 2 . 3]" 1 498 1 43 TRP H 1 43 TRP HD1 3.300 . 4.000 3.452 3.364 3.512 . 0 0 "[ . 1 . 2 . 3]" 1 499 1 43 TRP HA 1 43 TRP HE3 3.500 . 4.200 2.278 2.242 2.307 . 0 0 "[ . 1 . 2 . 3]" 1 500 1 36 GLU HB2 1 43 TRP HE3 3.300 . 4.000 3.089 2.465 3.492 . 0 0 "[ . 1 . 2 . 3]" 1 501 1 43 TRP HB3 1 43 TRP HD1 2.700 . 3.700 3.585 3.570 3.607 . 0 0 "[ . 1 . 2 . 3]" 1 502 1 38 LEU MD2 1 43 TRP HA 3.000 . 4.800 5.059 4.955 5.119 0.319 30 0 "[ . 1 . 2 . 3]" 1 503 1 43 TRP HA 1 44 VAL QG 4.000 . 5.900 3.184 3.170 3.210 . 0 0 "[ . 1 . 2 . 3]" 1 504 1 43 TRP H 1 43 TRP HB3 3.100 . 3.700 3.569 3.553 3.585 . 0 0 "[ . 1 . 2 . 3]" 1 505 1 38 LEU H 1 43 TRP HE3 3.700 . 4.400 3.097 2.884 3.237 . 0 0 "[ . 1 . 2 . 3]" 1 506 1 42 THR MG 1 43 TRP H 2.800 . 3.900 1.969 1.786 2.103 0.014 24 0 "[ . 1 . 2 . 3]" 1 507 1 38 LEU MD1 1 43 TRP HD1 4.000 . 5.300 3.655 3.465 3.842 . 0 0 "[ . 1 . 2 . 3]" 1 508 1 36 GLU H 1 43 TRP HE3 4.400 . 5.600 5.054 4.799 5.284 . 0 0 "[ . 1 . 2 . 3]" 1 509 1 37 ARG HA 1 43 TRP HE3 4.000 . 4.800 3.498 3.258 3.699 . 0 0 "[ . 1 . 2 . 3]" 1 510 1 37 ARG HA 1 43 TRP HZ3 4.000 . 4.800 2.302 2.291 2.326 . 0 0 "[ . 1 . 2 . 3]" 1 511 1 43 TRP HE3 1 44 VAL H 3.600 . 4.300 2.603 2.484 2.720 . 0 0 "[ . 1 . 2 . 3]" 1 512 1 43 TRP HB2 1 43 TRP HD1 3.400 . 4.100 2.529 2.517 2.544 . 0 0 "[ . 1 . 2 . 3]" 1 513 1 43 TRP HB3 1 43 TRP HE3 3.000 . 4.200 3.026 2.984 3.051 . 0 0 "[ . 1 . 2 . 3]" 1 514 1 43 TRP HB2 1 43 TRP HE3 3.000 . 4.200 4.250 4.238 4.257 0.057 19 0 "[ . 1 . 2 . 3]" 1 515 1 37 ARG HA 1 43 TRP HH2 3.700 . 4.400 4.548 4.481 4.644 0.244 28 0 "[ . 1 . 2 . 3]" 1 516 1 43 TRP H 1 44 VAL H 4.300 . 5.200 4.551 4.507 4.583 . 0 0 "[ . 1 . 2 . 3]" 1 517 1 37 ARG H 1 44 VAL H 3.800 . 4.600 2.713 2.491 2.977 . 0 0 "[ . 1 . 2 . 3]" 1 518 1 39 ASP H 1 44 VAL H 3.900 . 4.700 3.435 3.317 3.526 . 0 0 "[ . 1 . 2 . 3]" 1 519 1 43 TRP HA 1 44 VAL H 3.700 . 4.400 2.171 2.127 2.207 . 0 0 "[ . 1 . 2 . 3]" 1 520 1 37 ARG H 1 44 VAL HB 3.900 2.100 4.700 4.852 4.717 5.017 0.317 28 0 "[ . 1 . 2 . 3]" 1 521 1 37 ARG H 1 44 VAL MG1 4.100 . 5.400 4.020 3.919 4.165 . 0 0 "[ . 1 . 2 . 3]" 1 522 1 44 VAL H 1 44 VAL HB 3.400 . 4.100 3.810 3.768 3.843 . 0 0 "[ . 1 . 2 . 3]" 1 523 1 44 VAL HA 1 44 VAL MG2 2.700 . 4.000 3.168 3.143 3.185 . 0 0 "[ . 1 . 2 . 3]" 1 524 1 39 ASP HA 1 44 VAL MG2 4.000 . 5.000 4.921 4.769 4.993 . 0 0 "[ . 1 . 2 . 3]" 1 525 1 42 THR HB 1 44 VAL MG1 3.100 . 4.200 3.566 3.337 3.787 . 0 0 "[ . 1 . 2 . 3]" 1 526 1 39 ASP HB2 1 44 VAL MG1 2.800 . 3.900 2.300 2.269 2.383 . 0 0 "[ . 1 . 2 . 3]" 1 527 1 44 VAL HB 1 44 VAL MG1 2.400 . 3.400 2.089 2.083 2.100 . 0 0 "[ . 1 . 2 . 3]" 1 528 1 38 LEU MD1 1 44 VAL MG1 3.800 . 5.100 4.333 4.214 4.407 . 0 0 "[ . 1 . 2 . 3]" 1 529 1 44 VAL MG1 1 45 LEU H 3.100 . 4.200 4.245 4.157 4.276 0.076 28 0 "[ . 1 . 2 . 3]" 1 530 1 36 GLU HB2 1 44 VAL H 4.500 . 5.400 4.724 4.189 5.347 . 0 0 "[ . 1 . 2 . 3]" 1 531 1 44 VAL MG2 1 45 LEU HA 3.800 . 5.100 3.992 3.672 4.127 . 0 0 "[ . 1 . 2 . 3]" 1 532 1 44 VAL HB 1 44 VAL MG2 2.300 . 3.300 2.131 2.122 2.139 . 0 0 "[ . 1 . 2 . 3]" 1 533 1 44 VAL HA 1 44 VAL HB 2.800 . 3.400 2.314 2.275 2.332 . 0 0 "[ . 1 . 2 . 3]" 1 534 1 39 ASP HB3 1 44 VAL MG1 2.900 . 4.000 2.023 2.013 2.037 . 0 0 "[ . 1 . 2 . 3]" 1 535 1 44 VAL HA 1 44 VAL MG1 2.600 . 3.600 2.528 2.475 2.600 . 0 0 "[ . 1 . 2 . 3]" 1 536 1 39 ASP HB3 1 44 VAL MG2 3.700 . 4.900 3.316 2.989 3.474 . 0 0 "[ . 1 . 2 . 3]" 1 537 1 39 ASP H 1 44 VAL MG2 3.600 . 4.800 3.617 3.557 3.652 . 0 0 "[ . 1 . 2 . 3]" 1 538 1 39 ASP HB2 1 44 VAL MG2 3.600 . 4.800 2.712 2.539 2.815 . 0 0 "[ . 1 . 2 . 3]" 1 539 1 44 VAL H 1 44 VAL MG2 3.100 . 4.200 2.411 2.326 2.581 . 0 0 "[ . 1 . 2 . 3]" 1 540 1 38 LEU MD1 1 44 VAL H 3.600 . 4.800 4.301 4.081 4.422 . 0 0 "[ . 1 . 2 . 3]" 1 541 1 43 TRP HB2 1 44 VAL H 3.000 . 4.100 4.253 4.231 4.297 0.197 28 0 "[ . 1 . 2 . 3]" 1 542 1 43 TRP HB3 1 44 VAL H 3.100 . 3.700 3.170 3.108 3.275 . 0 0 "[ . 1 . 2 . 3]" 1 543 1 38 LEU HA 1 44 VAL H 3.200 . 3.800 3.329 3.136 3.481 . 0 0 "[ . 1 . 2 . 3]" 1 544 1 38 LEU HA 1 44 VAL MG2 4.400 . 5.400 4.338 4.129 4.453 . 0 0 "[ . 1 . 2 . 3]" 1 545 1 44 VAL H 1 44 VAL MG1 3.200 . 4.300 2.495 2.433 2.535 . 0 0 "[ . 1 . 2 . 3]" 1 546 1 42 THR MG 1 44 VAL H 4.000 . 5.500 4.590 4.489 4.691 . 0 0 "[ . 1 . 2 . 3]" 1 547 1 44 VAL H 1 45 LEU H 3.900 . 4.700 4.354 4.231 4.497 . 0 0 "[ . 1 . 2 . 3]" 1 548 1 36 GLU QB 1 45 LEU MD2 3.800 . 5.100 3.854 3.614 4.872 . 0 0 "[ . 1 . 2 . 3]" 1 549 1 36 GLU QB 1 45 LEU MD1 3.800 . 5.100 4.757 4.175 4.969 . 0 0 "[ . 1 . 2 . 3]" 1 550 1 45 LEU MD2 1 46 MET H 3.000 . 4.100 3.190 1.797 3.503 0.003 28 0 "[ . 1 . 2 . 3]" 1 551 1 44 VAL HA 1 45 LEU H 2.700 . 3.200 2.163 2.080 2.266 . 0 0 "[ . 1 . 2 . 3]" 1 552 1 44 VAL HB 1 45 LEU H 3.300 . 4.000 3.351 3.033 3.547 . 0 0 "[ . 1 . 2 . 3]" 1 553 1 45 LEU HA 1 45 LEU MD2 2.500 . 3.700 2.220 2.150 2.639 . 0 0 "[ . 1 . 2 . 3]" 1 554 1 45 LEU H 1 45 LEU HG 4.000 . 5.000 4.522 3.576 4.732 . 0 0 "[ . 1 . 2 . 3]" 1 555 1 36 GLU QG 1 45 LEU HA 4.200 . 5.200 2.637 2.303 3.681 . 0 0 "[ . 1 . 2 . 3]" 1 556 1 37 ARG H 1 45 LEU MD1 4.100 . 5.400 5.373 5.213 5.836 0.436 25 0 "[ . 1 . 2 . 3]" 1 557 1 37 ARG H 1 45 LEU H 4.500 . 5.400 5.040 4.494 5.206 . 0 0 "[ . 1 . 2 . 3]" 1 558 1 43 TRP HE3 1 45 LEU MD1 4.800 . 6.800 6.929 6.355 7.028 0.228 4 0 "[ . 1 . 2 . 3]" 1 559 1 34 GLU HA 1 45 LEU MD2 3.600 . 4.800 4.510 3.342 4.841 0.041 18 0 "[ . 1 . 2 . 3]" 1 560 1 36 GLU HA 1 45 LEU MD1 3.500 . 4.700 3.843 3.692 4.430 . 0 0 "[ . 1 . 2 . 3]" 1 561 1 36 GLU HA 1 45 LEU MD2 3.500 . 4.700 3.661 3.143 3.862 . 0 0 "[ . 1 . 2 . 3]" 1 562 1 45 LEU HA 1 45 LEU MD1 2.600 . 3.700 2.379 2.175 3.618 . 0 0 "[ . 1 . 2 . 3]" 1 563 1 45 LEU HB3 1 45 LEU MD2 2.400 . 3.500 3.060 2.181 3.198 . 0 0 "[ . 1 . 2 . 3]" 1 564 1 45 LEU HB3 1 45 LEU MD1 2.500 . 3.600 2.422 2.372 2.551 . 0 0 "[ . 1 . 2 . 3]" 1 565 1 45 LEU MD2 1 45 LEU HG 2.300 . 3.300 2.105 2.099 2.119 . 0 0 "[ . 1 . 2 . 3]" 1 566 1 34 GLU HB2 1 45 LEU MD1 2.700 . 3.700 2.609 2.248 2.969 . 0 0 "[ . 1 . 2 . 3]" 1 567 1 34 GLU HB2 1 45 LEU MD2 2.500 . 3.500 2.426 2.066 2.564 . 0 0 "[ . 1 . 2 . 3]" 1 568 1 36 GLU HG3 1 45 LEU MD2 2.500 . 3.500 2.254 2.052 3.792 0.292 29 0 "[ . 1 . 2 . 3]" 1 569 1 36 GLU HG3 1 45 LEU MD1 2.700 . 3.700 3.141 2.412 3.490 . 0 0 "[ . 1 . 2 . 3]" 1 570 1 44 VAL HA 1 45 LEU MD1 3.600 . 6.300 5.695 5.068 5.796 . 0 0 "[ . 1 . 2 . 3]" 1 571 1 44 VAL HA 1 45 LEU MD2 3.500 . 5.700 4.896 4.575 5.926 0.226 29 0 "[ . 1 . 2 . 3]" 1 572 1 35 VAL H 1 45 LEU MD2 3.600 . 4.800 3.462 1.790 4.318 0.010 13 0 "[ . 1 . 2 . 3]" 1 573 1 35 VAL H 1 45 LEU MD1 3.600 . 4.800 3.039 2.667 4.196 . 0 0 "[ . 1 . 2 . 3]" 1 574 1 45 LEU MD1 1 46 MET H 3.000 . 4.100 2.158 1.757 4.464 0.364 25 0 "[ . 1 . 2 . 3]" 1 575 1 45 LEU MD1 1 45 LEU HG 2.300 . 3.300 2.125 2.089 2.132 . 0 0 "[ . 1 . 2 . 3]" 1 576 1 45 LEU H 1 45 LEU MD2 3.000 . 4.100 3.588 3.353 4.346 0.246 13 0 "[ . 1 . 2 . 3]" 1 577 1 45 LEU HA 1 45 LEU HG 3.700 . 4.400 3.400 2.102 3.606 . 0 0 "[ . 1 . 2 . 3]" 1 578 1 34 GLU HB3 1 45 LEU MD2 2.500 . 3.500 3.565 3.095 3.693 0.193 7 0 "[ . 1 . 2 . 3]" 1 579 1 45 LEU H 1 45 LEU MD1 3.100 . 4.200 4.158 3.887 4.200 . 24 0 "[ . 1 . 2 . 3]" 1 580 1 34 GLU HB3 1 45 LEU MD1 2.600 . 3.600 3.291 2.989 3.651 0.051 28 0 "[ . 1 . 2 . 3]" 1 581 1 44 VAL MG2 1 45 LEU H 2.800 . 3.900 3.617 3.380 3.808 . 0 0 "[ . 1 . 2 . 3]" 1 582 1 45 LEU H 1 45 LEU HB3 3.000 . 3.600 2.986 2.905 3.364 . 0 0 "[ . 1 . 2 . 3]" 1 583 1 43 TRP HB3 1 45 LEU QD 5.000 . 5.500 4.529 4.323 4.798 . 0 0 "[ . 1 . 2 . 3]" 1 584 1 43 TRP HB2 1 45 LEU QD 5.000 . 5.500 5.549 5.359 5.694 0.194 13 0 "[ . 1 . 2 . 3]" 1 585 1 37 ARG HA 1 46 MET ME 4.200 2.200 5.500 4.696 4.217 5.180 . 0 0 "[ . 1 . 2 . 3]" 1 586 1 46 MET H 1 46 MET ME 3.700 . 4.900 4.454 3.716 4.918 0.018 22 0 "[ . 1 . 2 . 3]" 1 587 1 45 LEU HG 1 46 MET H 3.700 . 4.400 4.304 3.350 4.448 0.048 23 0 "[ . 1 . 2 . 3]" 1 588 1 46 MET H 1 46 MET HG3 4.200 . 5.000 3.026 2.322 3.754 . 0 0 "[ . 1 . 2 . 3]" 1 589 1 35 VAL MG1 1 46 MET ME 3.300 . 5.000 2.429 2.018 3.388 . 0 0 "[ . 1 . 2 . 3]" 1 590 1 46 MET H 1 46 MET HB2 3.900 . 4.700 2.563 2.391 2.839 . 0 0 "[ . 1 . 2 . 3]" 1 591 1 36 GLU H 1 46 MET H 4.400 . 5.300 5.202 4.923 5.517 0.217 13 0 "[ . 1 . 2 . 3]" 1 592 1 46 MET ME 1 88 TYR QD 3.400 . 5.100 3.530 2.777 4.242 . 0 0 "[ . 1 . 2 . 3]" 1 593 1 46 MET ME 1 46 MET HG3 3.400 . 4.600 2.721 2.159 3.347 . 0 0 "[ . 1 . 2 . 3]" 1 594 1 46 MET HA 1 46 MET ME 3.300 . 4.500 4.265 4.041 4.598 0.098 29 0 "[ . 1 . 2 . 3]" 1 595 1 46 MET ME 1 46 MET HG2 3.300 . 4.500 2.890 2.257 3.347 . 0 0 "[ . 1 . 2 . 3]" 1 596 1 46 MET ME 1 49 HIS HD2 3.100 . 4.200 2.950 2.329 4.242 0.042 27 0 "[ . 1 . 2 . 3]" 1 597 1 46 MET ME 1 82 LEU MD2 3.000 . 4.600 4.298 3.642 4.694 0.094 7 0 "[ . 1 . 2 . 3]" 1 598 1 46 MET ME 1 49 HIS HE1 3.700 . 4.900 3.938 2.237 4.681 . 0 0 "[ . 1 . 2 . 3]" 1 599 1 46 MET H 1 46 MET HG2 3.800 . 4.600 3.612 2.792 4.312 . 0 0 "[ . 1 . 2 . 3]" 1 600 1 46 MET H 1 46 MET HB3 3.800 . 4.600 3.711 3.617 3.812 . 0 0 "[ . 1 . 2 . 3]" 1 601 1 46 MET QB 1 46 MET ME 3.800 . 5.100 2.179 1.954 2.781 . 0 0 "[ . 1 . 2 . 3]" 1 602 1 45 LEU HA 1 46 MET H 3.200 . 3.800 2.165 2.140 2.187 . 0 0 "[ . 1 . 2 . 3]" 1 603 1 46 MET ME 1 49 HIS HB3 3.200 . 4.300 3.757 2.865 4.591 0.291 18 0 "[ . 1 . 2 . 3]" 1 604 1 35 VAL HA 1 46 MET H 4.800 . 5.600 5.353 5.046 5.537 . 0 0 "[ . 1 . 2 . 3]" 1 605 1 35 VAL MG2 1 46 MET ME 4.000 . 5.800 4.330 3.398 5.246 . 0 0 "[ . 1 . 2 . 3]" 1 606 1 36 GLU HA 1 46 MET ME 3.600 . 4.800 4.784 4.044 4.937 0.137 18 0 "[ . 1 . 2 . 3]" 1 607 1 47 ASP H 1 49 HIS H 4.700 . 5.600 4.202 3.957 4.570 . 0 0 "[ . 1 . 2 . 3]" 1 608 1 46 MET HA 1 47 ASP H 3.400 . 4.100 2.169 2.142 2.193 . 0 0 "[ . 1 . 2 . 3]" 1 609 1 48 GLN HE21 1 48 GLN HG2 2.800 . 4.700 3.174 2.243 3.619 . 0 0 "[ . 1 . 2 . 3]" 1 610 1 48 GLN HB3 1 48 GLN HE21 3.100 . 5.000 3.070 1.827 4.461 . 0 0 "[ . 1 . 2 . 3]" 1 611 1 48 GLN H 1 48 GLN HG3 3.500 . 4.200 2.566 1.798 3.308 0.002 24 0 "[ . 1 . 2 . 3]" 1 612 1 47 ASP H 1 48 GLN H 4.700 . 5.600 2.601 2.437 2.772 . 0 0 "[ . 1 . 2 . 3]" 1 613 1 48 GLN H 1 48 GLN HE21 3.900 . 5.000 3.690 1.769 4.818 0.031 28 0 "[ . 1 . 2 . 3]" 1 614 1 48 GLN HE21 1 48 GLN HG3 2.500 . 4.000 3.051 2.244 3.619 . 0 0 "[ . 1 . 2 . 3]" 1 615 1 46 MET HA 1 48 GLN H 3.900 . 5.000 3.574 3.162 3.866 . 0 0 "[ . 1 . 2 . 3]" 1 616 1 48 GLN HA 1 48 GLN HG2 3.300 . 4.300 2.987 2.460 3.657 . 0 0 "[ . 1 . 2 . 3]" 1 617 1 48 GLN HG3 1 49 HIS H 3.800 . 4.600 4.290 2.177 4.713 0.113 2 0 "[ . 1 . 2 . 3]" 1 618 1 48 GLN HB3 1 48 GLN HG3 2.800 . 3.400 2.911 2.513 3.034 . 0 0 "[ . 1 . 2 . 3]" 1 619 1 48 GLN HA 1 48 GLN HG3 3.500 . 4.200 2.944 2.321 4.223 0.023 30 0 "[ . 1 . 2 . 3]" 1 620 1 46 MET QG 1 48 GLN H 4.000 . 6.000 4.902 4.513 5.460 . 0 0 "[ . 1 . 2 . 3]" 1 621 1 48 GLN H 1 48 GLN HA 2.900 . 3.500 2.841 2.767 2.874 . 0 0 "[ . 1 . 2 . 3]" 1 622 1 48 GLN H 1 48 GLN HB3 2.900 . 3.800 3.438 2.660 3.593 . 0 0 "[ . 1 . 2 . 3]" 1 623 1 48 GLN HE22 1 48 GLN HG2 3.100 . 4.000 3.905 3.507 4.110 0.110 19 0 "[ . 1 . 2 . 3]" 1 624 1 48 GLN H 1 48 GLN HG2 3.400 . 4.100 3.210 1.775 4.069 0.025 26 0 "[ . 1 . 2 . 3]" 1 625 1 48 GLN HA 1 48 GLN HE22 3.400 . 5.700 5.576 3.589 5.838 0.138 13 0 "[ . 1 . 2 . 3]" 1 626 1 47 ASP HB2 1 48 GLN H 4.100 . 4.900 3.408 2.596 4.307 . 0 0 "[ . 1 . 2 . 3]" 1 627 1 48 GLN HB3 1 48 GLN HE22 3.800 . 4.900 4.129 3.412 4.935 0.035 23 0 "[ . 1 . 2 . 3]" 1 628 1 48 GLN QG 1 49 HIS H 4.200 . 5.000 3.875 2.085 4.468 . 0 0 "[ . 1 . 2 . 3]" 1 629 1 49 HIS H 1 80 LEU MD1 5.000 . 6.500 6.595 6.321 6.705 0.205 8 0 "[ . 1 . 2 . 3]" 1 630 1 49 HIS H 1 49 HIS HB3 3.800 . 4.600 3.783 3.510 3.952 . 0 0 "[ . 1 . 2 . 3]" 1 631 1 48 GLN HA 1 49 HIS H 3.200 . 3.800 3.345 3.089 3.552 . 0 0 "[ . 1 . 2 . 3]" 1 632 1 49 HIS H 1 49 HIS HB2 3.500 . 4.200 2.812 2.435 3.855 . 0 0 "[ . 1 . 2 . 3]" 1 633 1 49 HIS HA 1 80 LEU MD1 5.000 . 6.500 4.772 3.944 5.669 . 0 0 "[ . 1 . 2 . 3]" 1 634 1 49 HIS HB2 1 50 MET H 3.300 . 4.000 4.013 3.808 4.344 0.344 24 0 "[ . 1 . 2 . 3]" 1 635 1 49 HIS HD2 1 50 MET H 4.000 . 5.000 4.890 3.740 5.120 0.120 3 0 "[ . 1 . 2 . 3]" 1 636 1 46 MET QG 1 49 HIS H 4.000 . 6.000 5.085 4.474 5.534 . 0 0 "[ . 1 . 2 . 3]" 1 637 1 48 GLN HB3 1 49 HIS H 3.700 . 4.400 4.177 3.471 4.451 0.051 6 0 "[ . 1 . 2 . 3]" 1 638 1 48 GLN H 1 49 HIS H 3.100 . 3.700 2.704 2.543 2.876 . 0 0 "[ . 1 . 2 . 3]" 1 639 1 49 HIS H 1 49 HIS HD2 4.000 . 5.000 2.967 1.856 3.439 . 0 0 "[ . 1 . 2 . 3]" 1 640 1 49 HIS HA 1 50 MET H 2.800 . 3.400 2.976 2.550 3.127 . 0 0 "[ . 1 . 2 . 3]" 1 641 1 50 MET H 1 50 MET HB2 2.700 . 3.500 3.178 2.633 3.753 0.253 24 0 "[ . 1 . 2 . 3]" 1 642 1 50 MET H 1 50 MET ME 2.900 . 5.000 4.606 4.154 5.098 0.098 17 0 "[ . 1 . 2 . 3]" 1 643 1 50 MET HB3 1 50 MET ME 3.000 . 4.100 2.520 2.144 3.283 . 0 0 "[ . 1 . 2 . 3]" 1 644 1 48 GLN HA 1 50 MET H 4.000 . 5.000 4.010 3.792 4.618 . 0 0 "[ . 1 . 2 . 3]" 1 645 1 45 LEU MD1 1 50 MET ME 2.500 . 4.500 3.036 2.391 4.553 0.053 25 0 "[ . 1 . 2 . 3]" 1 646 1 7 LEU MD1 1 50 MET ME 3.600 . 5.300 4.514 2.974 5.359 0.059 5 0 "[ . 1 . 2 . 3]" 1 647 1 50 MET ME 1 51 GLY H 3.400 . 4.600 4.100 2.788 4.666 0.066 7 0 "[ . 1 . 2 . 3]" 1 648 1 45 LEU MD2 1 50 MET ME 2.500 . 4.500 4.322 3.175 4.673 0.173 17 0 "[ . 1 . 2 . 3]" 1 649 1 50 MET QB 1 163 PHE QE 4.000 . 5.500 4.932 3.895 5.401 . 0 0 "[ . 1 . 2 . 3]" 1 650 1 50 MET QG 1 163 PHE QE 4.000 . 5.500 3.465 3.022 5.301 . 0 0 "[ . 1 . 2 . 3]" 1 651 1 50 MET ME 1 162 THR MG 2.400 . 3.900 2.104 1.852 2.772 . 0 0 "[ . 1 . 2 . 3]" 1 652 1 50 MET ME 1 163 PHE QE 4.000 . 6.000 4.110 2.552 4.972 . 0 0 "[ . 1 . 2 . 3]" 1 653 1 50 MET ME 1 163 PHE QD 4.000 . 6.000 3.979 2.791 4.859 . 0 0 "[ . 1 . 2 . 3]" 1 654 1 50 MET ME 1 50 MET HG3 2.700 . 3.700 2.877 2.144 3.338 . 0 0 "[ . 1 . 2 . 3]" 1 655 1 50 MET H 1 50 MET HG3 3.000 . 4.800 4.384 2.414 4.919 0.119 21 0 "[ . 1 . 2 . 3]" 1 656 1 50 MET H 1 50 MET HB3 3.200 . 4.100 2.589 2.462 2.950 . 0 0 "[ . 1 . 2 . 3]" 1 657 1 35 VAL H 1 50 MET HA 3.700 . 4.600 3.264 2.900 3.638 . 0 0 "[ . 1 . 2 . 3]" 1 658 1 49 HIS H 1 50 MET H 3.200 . 3.800 2.280 1.782 2.854 0.018 13 0 "[ . 1 . 2 . 3]" 1 659 1 50 MET HA 1 50 MET ME 4.000 . 5.500 4.408 3.936 4.943 . 0 0 "[ . 1 . 2 . 3]" 1 660 1 50 MET HA 1 50 MET HB2 3.000 . 3.600 2.420 2.252 2.687 . 0 0 "[ . 1 . 2 . 3]" 1 661 1 50 MET HA 1 51 GLY H 3.100 . 3.700 2.358 2.251 2.507 . 0 0 "[ . 1 . 2 . 3]" 1 662 1 51 GLY HA3 1 52 PHE H 2.800 . 3.400 2.651 2.362 2.734 . 0 0 "[ . 1 . 2 . 3]" 1 663 1 33 TYR H 1 51 GLY H 4.100 . 4.900 4.202 3.930 4.355 . 0 0 "[ . 1 . 2 . 3]" 1 664 1 51 GLY H 1 163 PHE QE 4.000 . 5.500 3.100 2.719 3.624 . 0 0 "[ . 1 . 2 . 3]" 1 665 1 52 PHE H 1 52 PHE HB3 3.500 . 4.200 3.248 3.074 3.500 . 0 0 "[ . 1 . 2 . 3]" 1 666 1 52 PHE H 1 52 PHE HB2 3.300 . 4.000 3.688 3.574 3.928 . 0 0 "[ . 1 . 2 . 3]" 1 667 1 52 PHE HB2 1 52 PHE QD 2.900 . 4.000 2.338 2.320 2.427 . 0 0 "[ . 1 . 2 . 3]" 1 668 1 52 PHE HB3 1 52 PHE QD 2.700 . 3.700 2.517 2.391 2.560 . 0 0 "[ . 1 . 2 . 3]" 1 669 1 52 PHE HA 1 52 PHE QE 3.900 . 6.700 5.547 5.485 5.597 . 0 0 "[ . 1 . 2 . 3]" 1 670 1 30 TYR QE 1 52 PHE QE 3.800 . 5.400 4.144 3.680 4.731 . 0 0 "[ . 1 . 2 . 3]" 1 671 1 8 MET H 1 52 PHE QD 4.000 . 5.300 3.634 3.161 4.600 . 0 0 "[ . 1 . 2 . 3]" 1 672 1 52 PHE QE 1 53 LEU H 4.700 . 6.100 6.042 5.654 6.171 0.071 21 0 "[ . 1 . 2 . 3]" 1 673 1 51 GLY HA2 1 52 PHE QD 3.200 . 5.100 2.802 2.518 3.283 . 0 0 "[ . 1 . 2 . 3]" 1 674 1 30 TYR QD 1 52 PHE QD 2.300 . 3.800 3.816 3.658 3.894 0.094 15 0 "[ . 1 . 2 . 3]" 1 675 1 30 TYR QD 1 52 PHE QE 3.600 . 5.500 5.490 5.109 5.574 0.074 18 0 "[ . 1 . 2 . 3]" 1 676 1 7 LEU MD2 1 52 PHE QD 3.100 . 6.000 4.554 3.648 5.434 . 0 0 "[ . 1 . 2 . 3]" 1 677 1 8 MET HA 1 52 PHE HZ 3.200 . 3.800 2.852 2.342 3.854 0.054 27 0 "[ . 1 . 2 . 3]" 1 678 1 8 MET HA 1 52 PHE QE 3.000 . 4.100 3.309 2.709 4.126 0.026 27 0 "[ . 1 . 2 . 3]" 1 679 1 8 MET HA 1 52 PHE QD 3.200 . 5.800 4.818 4.200 5.647 . 0 0 "[ . 1 . 2 . 3]" 1 680 1 33 TYR H 1 52 PHE QD 4.400 . 5.800 5.025 4.499 5.408 . 0 0 "[ . 1 . 2 . 3]" 1 681 1 52 PHE H 1 53 LEU H 4.400 . 5.300 4.472 4.300 4.513 . 0 0 "[ . 1 . 2 . 3]" 1 682 1 52 PHE H 1 52 PHE QE 3.800 . 6.100 3.595 3.469 4.012 . 0 0 "[ . 1 . 2 . 3]" 1 683 1 7 LEU H 1 52 PHE QE 4.000 . 5.700 2.718 1.786 4.893 0.014 14 0 "[ . 1 . 2 . 3]" 1 684 1 7 LEU H 1 52 PHE HZ 4.000 . 5.500 3.928 2.657 5.047 . 0 0 "[ . 1 . 2 . 3]" 1 685 1 52 PHE QD 1 53 LEU HA 3.100 . 4.200 4.153 3.669 4.322 0.122 23 0 "[ . 1 . 2 . 3]" 1 686 1 52 PHE QE 1 53 LEU HA 4.300 . 6.000 5.653 5.010 5.990 . 0 0 "[ . 1 . 2 . 3]" 1 687 1 7 LEU HA 1 52 PHE QE 5.000 . 6.000 2.620 2.323 4.275 . 0 0 "[ . 1 . 2 . 3]" 1 688 1 7 LEU HA 1 52 PHE HZ 5.000 . 5.500 4.126 3.143 5.330 . 0 0 "[ . 1 . 2 . 3]" 1 689 1 52 PHE HA 1 52 PHE QD 3.500 . 4.700 3.590 3.485 3.668 . 0 0 "[ . 1 . 2 . 3]" 1 690 1 51 GLY HA2 1 52 PHE H 2.700 . 3.200 2.513 2.427 2.838 . 0 0 "[ . 1 . 2 . 3]" 1 691 1 52 PHE H 1 52 PHE QD 3.600 . 4.800 2.230 1.943 2.720 . 0 0 "[ . 1 . 2 . 3]" 1 692 1 8 MET H 1 52 PHE QE 3.500 . 4.700 2.475 1.785 3.696 0.015 15 0 "[ . 1 . 2 . 3]" 1 693 1 7 LEU MD1 1 52 PHE HZ 3.500 . 6.500 6.228 4.868 6.639 0.139 9 0 "[ . 1 . 2 . 3]" 1 694 1 52 PHE HB2 1 163 PHE QE 3.500 . 4.700 4.664 4.169 4.752 0.052 16 0 "[ . 1 . 2 . 3]" 1 695 1 7 LEU QB 1 52 PHE QE 4.000 . 5.500 4.306 4.095 5.505 0.005 27 0 "[ . 1 . 2 . 3]" 1 696 1 31 LEU MD2 1 53 LEU HB3 4.600 . 7.100 4.115 3.123 5.462 . 0 0 "[ . 1 . 2 . 3]" 1 697 1 52 PHE QD 1 53 LEU H 3.800 . 5.100 3.967 3.549 4.178 . 0 0 "[ . 1 . 2 . 3]" 1 698 1 53 LEU H 1 53 LEU HB2 3.500 . 4.500 2.851 2.369 3.949 . 0 0 "[ . 1 . 2 . 3]" 1 699 1 52 PHE HB3 1 53 LEU H 4.000 . 4.800 3.696 3.342 4.113 . 0 0 "[ . 1 . 2 . 3]" 1 700 1 52 PHE HB2 1 53 LEU H 3.800 . 4.600 2.594 2.133 3.056 . 0 0 "[ . 1 . 2 . 3]" 1 701 1 53 LEU H 1 53 LEU HB3 4.100 . 4.900 3.680 3.331 3.795 . 0 0 "[ . 1 . 2 . 3]" 1 702 1 53 LEU HA 1 53 LEU HB2 2.900 . 3.500 2.919 2.482 3.029 . 0 0 "[ . 1 . 2 . 3]" 1 703 1 53 LEU HA 1 53 LEU HB3 3.000 . 3.600 2.502 2.383 2.682 . 0 0 "[ . 1 . 2 . 3]" 1 704 1 53 LEU H 1 53 LEU MD1 3.800 . 5.100 3.715 3.111 4.232 . 0 0 "[ . 1 . 2 . 3]" 1 705 1 33 TYR QE 1 53 LEU MD1 3.700 . 5.400 3.619 2.962 5.380 . 0 0 "[ . 1 . 2 . 3]" 1 706 1 53 LEU MD1 1 76 LEU MD1 3.300 . 5.000 2.619 2.104 4.525 . 0 0 "[ . 1 . 2 . 3]" 1 707 1 53 LEU H 1 53 LEU MD2 4.200 . 5.500 3.770 1.762 4.357 0.038 14 0 "[ . 1 . 2 . 3]" 1 708 1 31 LEU HA 1 53 LEU QD 5.000 . 6.000 5.785 4.600 6.161 0.161 30 0 "[ . 1 . 2 . 3]" 1 709 1 53 LEU QB 1 53 LEU MD1 3.000 . 4.300 2.076 2.057 2.183 . 0 0 "[ . 1 . 2 . 3]" 1 710 1 53 LEU QB 1 53 LEU MD2 3.000 . 4.300 2.146 2.108 2.287 . 0 0 "[ . 1 . 2 . 3]" 1 711 1 32 CYS HA 1 53 LEU H 3.900 . 4.700 3.198 2.939 3.730 . 0 0 "[ . 1 . 2 . 3]" 1 712 1 33 TYR QE 1 53 LEU MD2 3.500 . 5.200 3.238 2.185 3.583 . 0 0 "[ . 1 . 2 . 3]" 1 713 1 30 TYR QD 1 53 LEU H 4.700 . 6.100 4.882 4.191 5.733 . 0 0 "[ . 1 . 2 . 3]" 1 714 1 53 LEU HA 1 53 LEU MD1 2.900 . 4.500 3.820 2.164 4.110 . 0 0 "[ . 1 . 2 . 3]" 1 715 1 53 LEU MD1 1 69 ALA HA 3.100 . 4.200 3.900 2.282 4.361 0.161 4 0 "[ . 1 . 2 . 3]" 1 716 1 53 LEU MD1 1 73 PHE HB2 3.700 . 4.900 2.315 2.026 4.934 0.034 21 0 "[ . 1 . 2 . 3]" 1 717 1 53 LEU MD1 1 76 LEU MD2 2.900 . 4.500 2.595 2.107 4.490 . 0 0 "[ . 1 . 2 . 3]" 1 718 1 53 LEU MD1 1 73 PHE QD 3.600 . 5.300 2.460 2.050 5.263 . 0 0 "[ . 1 . 2 . 3]" 1 719 1 31 LEU QB 1 53 LEU QD 4.100 . 5.600 4.250 3.060 4.837 . 0 0 "[ . 1 . 2 . 3]" 1 720 1 31 LEU MD1 1 53 LEU H 4.900 . 6.200 3.908 3.466 5.106 . 0 0 "[ . 1 . 2 . 3]" 1 721 1 31 LEU H 1 53 LEU H 4.000 . 4.800 3.709 2.955 4.142 . 0 0 "[ . 1 . 2 . 3]" 1 722 1 52 PHE HA 1 53 LEU H 3.400 . 4.100 2.337 2.206 2.534 . 0 0 "[ . 1 . 2 . 3]" 1 723 1 55 ASN HA 1 56 GLU H 3.300 . 4.000 3.385 2.755 3.573 . 0 0 "[ . 1 . 2 . 3]" 1 724 1 56 GLU H 1 56 GLU HA 3.000 . 3.600 2.884 2.795 2.960 . 0 0 "[ . 1 . 2 . 3]" 1 725 1 55 ASN HB2 1 56 GLU H 3.600 . 4.300 2.845 1.815 4.448 0.148 18 0 "[ . 1 . 2 . 3]" 1 726 1 56 GLU H 1 56 GLU HB2 3.100 . 3.700 3.040 2.066 3.753 0.053 27 0 "[ . 1 . 2 . 3]" 1 727 1 56 GLU H 1 67 ARG HB2 3.000 . 3.600 3.468 2.816 3.838 0.238 16 0 "[ . 1 . 2 . 3]" 1 728 1 56 GLU H 1 67 ARG HD3 3.400 . 4.100 3.954 3.586 4.276 0.176 29 0 "[ . 1 . 2 . 3]" 1 729 1 56 GLU H 1 67 ARG HB3 3.600 . 4.300 4.188 3.021 4.362 0.062 3 0 "[ . 1 . 2 . 3]" 1 730 1 55 ASN H 1 56 GLU H 3.500 . 4.200 2.989 2.421 3.415 . 0 0 "[ . 1 . 2 . 3]" 1 731 1 57 ALA HA 1 57 ALA MB 2.400 . 3.400 2.126 2.101 2.143 . 0 0 "[ . 1 . 2 . 3]" 1 732 1 57 ALA H 1 57 ALA MB 3.200 . 4.300 2.677 2.088 2.973 . 0 0 "[ . 1 . 2 . 3]" 1 733 1 56 GLU HA 1 57 ALA H 3.700 . 4.400 2.214 2.148 2.275 . 0 0 "[ . 1 . 2 . 3]" 1 734 1 56 GLU HB2 1 57 ALA H 3.700 . 4.400 3.690 2.789 4.435 0.035 28 0 "[ . 1 . 2 . 3]" 1 735 1 57 ALA MB 1 58 LYS H 3.300 . 4.500 3.082 1.813 3.726 . 0 0 "[ . 1 . 2 . 3]" 1 736 1 58 LYS HB3 1 58 LYS HE3 3.400 . 4.400 3.360 2.348 4.466 0.066 29 0 "[ . 1 . 2 . 3]" 1 737 1 57 ALA HA 1 58 LYS H 2.500 . 3.000 2.514 2.153 3.042 0.042 17 0 "[ . 1 . 2 . 3]" 1 738 1 58 LYS HA 1 58 LYS HB2 2.800 . 3.400 2.911 2.563 3.029 . 0 0 "[ . 1 . 2 . 3]" 1 739 1 58 LYS HD3 1 58 LYS HG2 2.600 . 3.100 2.685 2.276 3.037 . 0 0 "[ . 1 . 2 . 3]" 1 740 1 58 LYS HD3 1 58 LYS HE3 2.500 . 3.300 2.680 2.393 3.033 . 0 0 "[ . 1 . 2 . 3]" 1 741 1 58 LYS HA 1 58 LYS HG2 4.000 . 4.800 2.635 2.334 3.538 . 0 0 "[ . 1 . 2 . 3]" 1 742 1 58 LYS HE3 1 58 LYS HG3 3.400 . 4.100 3.147 2.327 3.781 . 0 0 "[ . 1 . 2 . 3]" 1 743 1 58 LYS HE3 1 58 LYS HG2 3.300 . 4.000 2.869 2.345 3.926 . 0 0 "[ . 1 . 2 . 3]" 1 744 1 58 LYS HA 1 58 LYS HE3 3.800 . 4.900 4.365 2.343 4.895 . 0 0 "[ . 1 . 2 . 3]" 1 745 1 58 LYS HB2 1 58 LYS HG2 2.900 . 3.500 2.907 2.464 3.037 . 0 0 "[ . 1 . 2 . 3]" 1 746 1 58 LYS HB2 1 58 LYS HG3 2.800 . 3.400 2.516 2.254 3.036 . 0 0 "[ . 1 . 2 . 3]" 1 747 1 58 LYS HB2 1 58 LYS HE3 3.400 . 4.400 3.446 2.344 4.425 0.025 1 0 "[ . 1 . 2 . 3]" 1 748 1 58 LYS HA 1 59 ASN H 3.600 . 3.700 2.700 2.149 3.574 . 0 0 "[ . 1 . 2 . 3]" 1 749 1 58 LYS HA 1 58 LYS HD3 3.700 . 4.700 4.067 2.325 4.694 . 0 0 "[ . 1 . 2 . 3]" 1 750 1 58 LYS HD3 1 58 LYS HG3 2.600 . 3.100 2.715 2.440 3.032 . 0 0 "[ . 1 . 2 . 3]" 1 751 1 58 LYS H 1 58 LYS HB2 3.000 . 3.600 2.845 2.094 3.570 . 0 0 "[ . 1 . 2 . 3]" 1 752 1 58 LYS H 1 59 ASN H 6.800 . 8.000 3.554 2.307 4.641 . 0 0 "[ . 1 . 2 . 3]" 1 753 1 60 LEU MD2 1 61 LEU H 3.900 . 5.200 4.051 2.953 4.976 . 0 0 "[ . 1 . 2 . 3]" 1 754 1 60 LEU MD1 1 61 LEU HA 4.200 . 5.300 4.414 2.354 5.454 0.154 14 0 "[ . 1 . 2 . 3]" 1 755 1 60 LEU MD2 1 60 LEU HG 2.200 . 3.600 2.139 2.104 2.153 . 0 0 "[ . 1 . 2 . 3]" 1 756 1 60 LEU HA 1 60 LEU HG 3.800 . 4.600 3.037 2.340 4.241 . 0 0 "[ . 1 . 2 . 3]" 1 757 1 60 LEU HA 1 60 LEU HB2 2.800 . 3.400 2.594 2.268 3.018 . 0 0 "[ . 1 . 2 . 3]" 1 758 1 60 LEU HB3 1 60 LEU MD1 3.300 . 4.300 2.937 2.248 3.201 . 0 0 "[ . 1 . 2 . 3]" 1 759 1 60 LEU HB3 1 60 LEU MD2 3.300 . 4.300 2.313 2.136 3.207 . 0 0 "[ . 1 . 2 . 3]" 1 760 1 60 LEU HB2 1 60 LEU MD1 3.300 . 4.300 2.294 2.142 3.216 . 0 0 "[ . 1 . 2 . 3]" 1 761 1 60 LEU HB2 1 60 LEU MD2 3.300 . 4.300 2.671 2.226 3.191 . 0 0 "[ . 1 . 2 . 3]" 1 762 1 60 LEU H 1 60 LEU MD1 3.700 . 4.900 3.624 1.799 4.371 0.001 13 0 "[ . 1 . 2 . 3]" 1 763 1 60 LEU HA 1 60 LEU MD2 3.100 . 4.200 3.518 2.176 3.993 . 0 0 "[ . 1 . 2 . 3]" 1 764 1 60 LEU HA 1 60 LEU MD1 2.700 . 3.700 3.049 2.113 3.827 0.127 14 0 "[ . 1 . 2 . 3]" 1 765 1 61 LEU H 1 61 LEU HA 2.900 . 3.500 2.804 2.738 2.902 . 0 0 "[ . 1 . 2 . 3]" 1 766 1 61 LEU HA 1 62 CYS H 3.500 . 4.200 3.454 3.352 3.565 . 0 0 "[ . 1 . 2 . 3]" 1 767 1 60 LEU HA 1 61 LEU H 3.300 . 3.700 3.498 3.411 3.576 . 0 0 "[ . 1 . 2 . 3]" 1 768 1 61 LEU HA 1 61 LEU MD2 3.000 . 4.100 2.870 2.174 3.897 . 0 0 "[ . 1 . 2 . 3]" 1 769 1 61 LEU HB2 1 61 LEU MD2 3.100 . 4.200 2.793 2.270 3.180 . 0 0 "[ . 1 . 2 . 3]" 1 770 1 61 LEU H 1 61 LEU MD1 3.700 . 4.900 3.226 1.810 4.153 . 0 0 "[ . 1 . 2 . 3]" 1 771 1 61 LEU HA 1 61 LEU HB3 3.000 . 3.600 2.679 2.399 3.016 . 0 0 "[ . 1 . 2 . 3]" 1 772 1 61 LEU HB2 1 61 LEU MD1 3.300 . 4.500 2.358 2.127 3.188 . 0 0 "[ . 1 . 2 . 3]" 1 773 1 61 LEU HA 1 61 LEU MD1 2.600 . 4.100 3.123 2.170 3.963 . 0 0 "[ . 1 . 2 . 3]" 1 774 1 61 LEU HB3 1 61 LEU MD1 2.500 . 3.500 2.745 2.247 3.196 . 0 0 "[ . 1 . 2 . 3]" 1 775 1 61 LEU HA 1 61 LEU HG 3.200 . 3.800 2.672 2.345 3.548 . 0 0 "[ . 1 . 2 . 3]" 1 776 1 61 LEU HB3 1 61 LEU MD2 2.900 . 4.000 2.359 2.124 3.186 . 0 0 "[ . 1 . 2 . 3]" 1 777 1 61 LEU MD2 1 62 CYS H 4.600 . 6.000 4.577 3.575 5.168 . 0 0 "[ . 1 . 2 . 3]" 1 778 1 61 LEU HB3 1 62 CYS H 3.800 . 4.600 3.578 2.492 4.298 . 0 0 "[ . 1 . 2 . 3]" 1 779 1 61 LEU HB2 1 62 CYS H 3.700 . 4.400 3.320 2.423 4.185 . 0 0 "[ . 1 . 2 . 3]" 1 780 1 62 CYS H 1 62 CYS HB3 3.500 . 4.200 3.215 2.359 3.646 . 0 0 "[ . 1 . 2 . 3]" 1 781 1 64 PHE H 1 64 PHE HB3 3.500 . 4.200 3.125 2.280 3.496 . 0 0 "[ . 1 . 2 . 3]" 1 782 1 63 GLY HA3 1 64 PHE H 3.500 . 4.200 3.338 2.975 3.502 . 0 0 "[ . 1 . 2 . 3]" 1 783 1 63 GLY HA2 1 64 PHE H 3.900 . 4.700 3.179 2.955 3.491 . 0 0 "[ . 1 . 2 . 3]" 1 784 1 64 PHE HA 1 65 TYR H 3.200 . 3.800 2.219 2.146 2.376 . 0 0 "[ . 1 . 2 . 3]" 1 785 1 65 TYR H 1 65 TYR HB3 3.300 . 4.000 3.287 2.159 3.873 . 0 0 "[ . 1 . 2 . 3]" 1 786 1 68 HIS H 1 68 HIS HB2 3.600 . 4.300 2.713 2.393 3.334 . 0 0 "[ . 1 . 2 . 3]" 1 787 1 68 HIS H 1 68 HIS HD2 3.600 . 4.600 2.762 1.853 4.521 . 0 0 "[ . 1 . 2 . 3]" 1 788 1 55 ASN HA 1 68 HIS HD2 5.500 . 7.000 6.493 5.565 7.082 0.082 16 0 "[ . 1 . 2 . 3]" 1 789 1 67 ARG HA 1 68 HIS H 2.900 . 3.500 2.200 2.142 2.277 . 0 0 "[ . 1 . 2 . 3]" 1 790 1 69 ALA H 1 70 GLU H 4.200 . 5.000 2.749 2.375 3.108 . 0 0 "[ . 1 . 2 . 3]" 1 791 1 69 ALA H 1 69 ALA MB 3.100 . 4.200 2.167 2.048 2.248 . 0 0 "[ . 1 . 2 . 3]" 1 792 1 31 LEU HA 1 69 ALA MB 5.000 . 6.000 4.377 4.089 4.698 . 0 0 "[ . 1 . 2 . 3]" 1 793 1 55 ASN HA 1 69 ALA H 4.000 . 5.000 3.134 2.286 5.082 0.082 29 0 "[ . 1 . 2 . 3]" 1 794 1 69 ALA HA 1 72 ARG H 4.000 . 5.000 3.213 2.910 3.508 . 0 0 "[ . 1 . 2 . 3]" 1 795 1 69 ALA HA 1 72 ARG QB 4.000 . 5.000 2.416 2.164 2.866 . 0 0 "[ . 1 . 2 . 3]" 1 796 1 31 LEU HG 1 69 ALA MB 4.000 . 5.300 2.830 2.277 4.350 . 0 0 "[ . 1 . 2 . 3]" 1 797 1 31 LEU QB 1 69 ALA MB 4.100 . 5.600 2.220 1.890 2.747 . 0 0 "[ . 1 . 2 . 3]" 1 798 1 69 ALA MB 1 70 GLU H 3.400 . 4.600 2.561 2.154 2.974 . 0 0 "[ . 1 . 2 . 3]" 1 799 1 70 GLU H 1 70 GLU HG3 4.100 . 4.900 2.879 2.144 3.600 . 0 0 "[ . 1 . 2 . 3]" 1 800 1 70 GLU H 1 70 GLU HB2 3.700 . 4.400 2.966 2.400 3.592 . 0 0 "[ . 1 . 2 . 3]" 1 801 1 70 GLU QB 1 73 PHE QD 5.000 . 6.500 5.549 5.083 5.751 . 0 0 "[ . 1 . 2 . 3]" 1 802 1 68 HIS HB2 1 70 GLU H 4.300 . 5.200 4.145 2.860 5.311 0.111 29 0 "[ . 1 . 2 . 3]" 1 803 1 69 ALA HA 1 70 GLU H 4.200 . 5.000 3.514 3.400 3.583 . 0 0 "[ . 1 . 2 . 3]" 1 804 1 70 GLU HA 1 70 GLU HB2 2.700 . 3.200 2.891 2.529 3.036 . 0 0 "[ . 1 . 2 . 3]" 1 805 1 70 GLU HA 1 73 PHE H 3.600 . 4.600 3.529 3.184 3.730 . 0 0 "[ . 1 . 2 . 3]" 1 806 1 70 GLU HA 1 73 PHE QB 3.600 . 4.600 2.869 2.496 3.002 . 0 0 "[ . 1 . 2 . 3]" 1 807 1 70 GLU HB2 1 71 LEU H 3.300 . 4.000 2.784 2.320 3.713 . 0 0 "[ . 1 . 2 . 3]" 1 808 1 70 GLU HB3 1 71 LEU H 3.600 . 4.300 3.810 3.407 4.178 . 0 0 "[ . 1 . 2 . 3]" 1 809 1 70 GLU HA 1 70 GLU HG3 3.700 . 4.400 3.104 2.286 4.236 . 0 0 "[ . 1 . 2 . 3]" 1 810 1 70 GLU HA 1 71 LEU H 3.300 . 4.300 3.547 3.488 3.585 . 0 0 "[ . 1 . 2 . 3]" 1 811 1 70 GLU H 1 71 LEU H 3.900 . 4.700 2.821 2.563 2.991 . 0 0 "[ . 1 . 2 . 3]" 1 812 1 70 GLU QG 1 71 LEU H 4.000 . 5.000 3.355 1.731 4.353 0.069 11 0 "[ . 1 . 2 . 3]" 1 813 1 71 LEU MD1 1 74 LEU MD1 5.800 3.800 7.000 5.090 4.223 6.067 . 0 0 "[ . 1 . 2 . 3]" 1 814 1 71 LEU HA 1 75 ASP H 5.000 . 6.000 4.676 4.481 4.939 . 0 0 "[ . 1 . 2 . 3]" 1 815 1 71 LEU HA 1 74 LEU H 4.000 . 5.000 3.557 3.106 3.865 . 0 0 "[ . 1 . 2 . 3]" 1 816 1 71 LEU HA 1 74 LEU QB 4.000 . 5.000 3.016 2.504 3.451 . 0 0 "[ . 1 . 2 . 3]" 1 817 1 71 LEU HA 1 72 ARG H 4.000 . 5.000 3.551 3.533 3.572 . 0 0 "[ . 1 . 2 . 3]" 1 818 1 71 LEU HA 1 71 LEU HB3 2.900 . 3.700 2.811 2.638 3.030 . 0 0 "[ . 1 . 2 . 3]" 1 819 1 71 LEU H 1 71 LEU HB2 3.700 . 4.900 2.215 2.068 2.583 . 0 0 "[ . 1 . 2 . 3]" 1 820 1 71 LEU HB3 1 71 LEU MD1 2.600 . 4.100 3.086 2.370 3.194 . 0 0 "[ . 1 . 2 . 3]" 1 821 1 71 LEU MD1 1 74 LEU H 4.600 . 6.000 5.289 4.890 6.154 0.154 28 0 "[ . 1 . 2 . 3]" 1 822 1 71 LEU H 1 71 LEU MD1 3.400 . 4.500 2.776 1.849 4.253 . 0 0 "[ . 1 . 2 . 3]" 1 823 1 69 ALA H 1 71 LEU H 3.600 . 4.300 4.331 3.964 4.530 0.230 4 0 "[ . 1 . 2 . 3]" 1 824 1 71 LEU H 1 72 ARG H 2.100 . 2.800 2.645 2.439 2.834 0.034 17 0 "[ . 1 . 2 . 3]" 1 825 1 71 LEU H 1 73 PHE H 2.100 . 4.000 3.929 3.697 4.106 0.106 7 0 "[ . 1 . 2 . 3]" 1 826 1 71 LEU MD1 1 107 GLU HB3 2.700 . 4.200 3.553 2.824 4.316 0.116 11 0 "[ . 1 . 2 . 3]" 1 827 1 71 LEU HA 1 71 LEU MD1 3.000 . 4.600 2.480 2.193 3.673 . 0 0 "[ . 1 . 2 . 3]" 1 828 1 68 HIS HB2 1 71 LEU MD1 3.000 . 4.100 2.903 2.306 4.091 . 0 0 "[ . 1 . 2 . 3]" 1 829 1 68 HIS H 1 71 LEU MD1 3.500 . 4.700 4.569 4.149 4.761 0.061 11 0 "[ . 1 . 2 . 3]" 1 830 1 71 LEU MD1 1 107 GLU HB2 2.700 . 4.200 3.219 2.255 4.195 . 0 0 "[ . 1 . 2 . 3]" 1 831 1 71 LEU QD 1 103 GLY HA3 4.000 . 5.500 4.862 3.788 5.517 0.017 19 0 "[ . 1 . 2 . 3]" 1 832 1 71 LEU QD 1 103 GLY HA2 4.000 . 5.500 4.279 3.052 5.281 . 0 0 "[ . 1 . 2 . 3]" 1 833 1 71 LEU QD 1 103 GLY H 5.000 . 6.500 5.968 5.053 6.573 0.073 6 0 "[ . 1 . 2 . 3]" 1 834 1 71 LEU HB2 1 71 LEU MD1 3.100 . 4.700 2.254 2.122 2.342 . 0 0 "[ . 1 . 2 . 3]" 1 835 1 71 LEU MD1 1 72 ARG H 4.100 . 5.400 4.310 3.964 4.793 . 0 0 "[ . 1 . 2 . 3]" 1 836 1 71 LEU H 1 71 LEU HG 3.600 . 4.800 4.148 3.421 4.420 . 0 0 "[ . 1 . 2 . 3]" 1 837 1 71 LEU H 1 71 LEU HB3 3.300 . 4.500 3.224 2.493 3.530 . 0 0 "[ . 1 . 2 . 3]" 1 838 1 72 ARG H 1 72 ARG HB2 3.500 . 4.200 2.289 2.060 2.649 . 0 0 "[ . 1 . 2 . 3]" 1 839 1 53 LEU QD 1 72 ARG H 5.000 . 6.500 4.145 3.522 4.786 . 0 0 "[ . 1 . 2 . 3]" 1 840 1 53 LEU QD 1 72 ARG HA 5.000 . 6.500 4.016 3.713 4.327 . 0 0 "[ . 1 . 2 . 3]" 1 841 1 72 ARG HA 1 73 PHE H 4.000 . 5.000 3.525 3.489 3.568 . 0 0 "[ . 1 . 2 . 3]" 1 842 1 72 ARG HA 1 76 LEU H 4.000 . 5.000 4.499 4.265 4.772 . 0 0 "[ . 1 . 2 . 3]" 1 843 1 72 ARG HA 1 76 LEU MD1 4.000 . 6.500 6.112 5.803 6.693 0.193 25 0 "[ . 1 . 2 . 3]" 1 844 1 53 LEU QD 1 72 ARG QB 4.000 . 5.500 2.126 1.972 2.531 . 0 0 "[ . 1 . 2 . 3]" 1 845 1 72 ARG HA 1 72 ARG HB2 3.000 . 3.600 2.851 2.470 3.030 . 0 0 "[ . 1 . 2 . 3]" 1 846 1 72 ARG HA 1 75 ASP QB 4.000 . 5.000 2.615 2.323 2.967 . 0 0 "[ . 1 . 2 . 3]" 1 847 1 72 ARG HA 1 75 ASP H 4.000 . 5.000 3.581 3.399 3.727 . 0 0 "[ . 1 . 2 . 3]" 1 848 1 73 PHE QD 1 92 TRP HE1 3.200 . 4.300 3.370 3.195 3.579 . 0 0 "[ . 1 . 2 . 3]" 1 849 1 73 PHE H 1 73 PHE HB2 3.300 . 4.500 2.608 2.532 2.704 . 0 0 "[ . 1 . 2 . 3]" 1 850 1 73 PHE H 1 73 PHE HB3 3.900 . 5.200 2.550 2.496 2.635 . 0 0 "[ . 1 . 2 . 3]" 1 851 1 73 PHE QD 1 77 VAL MG2 2.800 . 4.400 2.572 2.319 2.731 . 0 0 "[ . 1 . 2 . 3]" 1 852 1 73 PHE QD 1 90 VAL MG1 3.500 . 5.200 4.960 4.778 5.117 . 0 0 "[ . 1 . 2 . 3]" 1 853 1 73 PHE QD 1 76 LEU MD2 3.400 . 5.100 2.729 2.360 3.504 . 0 0 "[ . 1 . 2 . 3]" 1 854 1 73 PHE QD 1 74 LEU MD1 3.200 . 4.800 2.149 2.062 2.341 . 0 0 "[ . 1 . 2 . 3]" 1 855 1 53 LEU MD2 1 73 PHE QD 3.200 . 4.800 3.983 2.405 4.497 . 0 0 "[ . 1 . 2 . 3]" 1 856 1 73 PHE QD 1 74 LEU HG 3.900 . 5.200 4.321 3.834 4.818 . 0 0 "[ . 1 . 2 . 3]" 1 857 1 33 TYR HB3 1 73 PHE QD 3.300 . 5.000 2.850 2.632 3.459 . 0 0 "[ . 1 . 2 . 3]" 1 858 1 73 PHE HB2 1 73 PHE QD 3.200 . 4.800 2.421 2.351 2.530 . 0 0 "[ . 1 . 2 . 3]" 1 859 1 70 GLU HA 1 73 PHE QD 3.600 . 4.800 4.792 4.498 4.919 0.119 3 0 "[ . 1 . 2 . 3]" 1 860 1 73 PHE HA 1 73 PHE QD 3.200 . 4.800 2.845 2.503 3.037 . 0 0 "[ . 1 . 2 . 3]" 1 861 1 73 PHE QD 1 92 TRP HH2 3.100 . 4.200 4.115 4.034 4.209 0.009 4 0 "[ . 1 . 2 . 3]" 1 862 1 73 PHE QE 1 74 LEU MD1 3.500 . 5.200 3.181 2.690 3.380 . 0 0 "[ . 1 . 2 . 3]" 1 863 1 73 PHE HZ 1 74 LEU MD1 4.000 . 5.300 5.259 4.850 5.482 0.182 11 0 "[ . 1 . 2 . 3]" 1 864 1 33 TYR HB2 1 73 PHE QE 3.600 . 4.800 2.413 2.308 3.165 . 0 0 "[ . 1 . 2 . 3]" 1 865 1 33 TYR HB3 1 73 PHE QE 3.600 . 4.800 3.490 3.239 3.736 . 0 0 "[ . 1 . 2 . 3]" 1 866 1 73 PHE QE 1 76 LEU H 4.200 . 6.000 5.880 5.454 6.145 0.145 24 0 "[ . 1 . 2 . 3]" 1 867 1 73 PHE HZ 1 120 LEU MD1 4.600 . 6.000 3.419 3.069 3.670 . 0 0 "[ . 1 . 2 . 3]" 1 868 1 73 PHE HZ 1 92 TRP HE1 3.700 . 4.400 3.501 3.214 3.752 . 0 0 "[ . 1 . 2 . 3]" 1 869 1 53 LEU MD1 1 73 PHE H 3.500 . 4.700 2.857 2.378 4.429 . 0 0 "[ . 1 . 2 . 3]" 1 870 1 53 LEU MD1 1 73 PHE HA 3.500 . 5.400 2.333 2.063 4.077 . 0 0 "[ . 1 . 2 . 3]" 1 871 1 53 LEU MD2 1 73 PHE HA 3.500 . 5.400 3.356 3.122 4.038 . 0 0 "[ . 1 . 2 . 3]" 1 872 1 73 PHE QE 1 92 TRP HZ2 3.200 . 4.300 3.754 3.585 3.815 . 0 0 "[ . 1 . 2 . 3]" 1 873 1 31 LEU MD2 1 73 PHE H 5.000 . 6.000 3.784 3.399 4.130 . 0 0 "[ . 1 . 2 . 3]" 1 874 1 73 PHE QE 1 120 LEU MD2 3.800 . 5.600 5.153 4.978 5.334 . 0 0 "[ . 1 . 2 . 3]" 1 875 1 33 TYR HB2 1 73 PHE QD 3.700 . 4.900 3.096 2.754 3.890 . 0 0 "[ . 1 . 2 . 3]" 1 876 1 73 PHE QD 1 74 LEU H 3.300 . 4.500 2.753 2.486 3.147 . 0 0 "[ . 1 . 2 . 3]" 1 877 1 73 PHE HB3 1 73 PHE QD 3.200 . 4.800 2.412 2.329 2.486 . 0 0 "[ . 1 . 2 . 3]" 1 878 1 73 PHE QE 1 90 VAL MG2 2.700 . 4.200 2.620 2.313 2.895 . 0 0 "[ . 1 . 2 . 3]" 1 879 1 73 PHE H 1 75 ASP H 3.600 . 4.300 3.805 3.724 3.983 . 0 0 "[ . 1 . 2 . 3]" 1 880 1 73 PHE QD 1 76 LEU H 3.400 . 5.100 4.742 4.368 5.051 . 0 0 "[ . 1 . 2 . 3]" 1 881 1 73 PHE H 1 73 PHE QD 3.200 . 4.800 4.197 4.176 4.212 . 0 0 "[ . 1 . 2 . 3]" 1 882 1 73 PHE QE 1 120 LEU HB2 4.600 . 6.300 5.189 4.807 5.607 . 0 0 "[ . 1 . 2 . 3]" 1 883 1 35 VAL MG2 1 73 PHE QE 3.700 . 5.400 3.870 3.683 4.090 . 0 0 "[ . 1 . 2 . 3]" 1 884 1 73 PHE HZ 1 90 VAL MG2 2.900 . 4.000 2.454 2.278 2.915 . 0 0 "[ . 1 . 2 . 3]" 1 885 1 73 PHE HA 1 73 PHE QE 4.600 . 6.300 4.582 4.427 4.675 . 0 0 "[ . 1 . 2 . 3]" 1 886 1 73 PHE QE 1 92 TRP HE1 3.300 . 4.500 3.077 2.630 3.310 . 0 0 "[ . 1 . 2 . 3]" 1 887 1 33 TYR QD 1 73 PHE QD 3.400 . 4.600 3.310 2.961 3.750 . 0 0 "[ . 1 . 2 . 3]" 1 888 1 73 PHE QD 1 92 TRP HZ2 2.900 . 4.000 2.529 2.332 2.730 . 0 0 "[ . 1 . 2 . 3]" 1 889 1 74 LEU HA 1 74 LEU MD1 2.800 . 4.400 2.174 2.046 2.442 . 0 0 "[ . 1 . 2 . 3]" 1 890 1 74 LEU MD1 1 111 PHE HB3 3.500 . 4.700 2.558 2.238 3.306 . 0 0 "[ . 1 . 2 . 3]" 1 891 1 74 LEU MD1 1 111 PHE H 4.200 . 5.500 4.046 3.699 4.835 . 0 0 "[ . 1 . 2 . 3]" 1 892 1 74 LEU MD1 1 75 ASP H 4.700 . 6.100 4.419 4.160 4.633 . 0 0 "[ . 1 . 2 . 3]" 1 893 1 74 LEU MD1 1 92 TRP HE1 4.700 . 6.100 5.310 5.012 6.031 . 0 0 "[ . 1 . 2 . 3]" 1 894 1 74 LEU MD1 1 111 PHE HA 4.100 . 5.400 4.357 3.943 5.329 . 0 0 "[ . 1 . 2 . 3]" 1 895 1 74 LEU MD1 1 74 LEU MD2 2.800 . 4.400 1.913 1.854 2.033 . 0 0 "[ . 1 . 2 . 3]" 1 896 1 74 LEU MD1 1 108 VAL MG2 3.400 . 5.100 2.803 2.143 3.409 . 0 0 "[ . 1 . 2 . 3]" 1 897 1 74 LEU MD1 1 77 VAL MG1 3.800 . 5.600 4.243 3.794 4.946 . 0 0 "[ . 1 . 2 . 3]" 1 898 1 74 LEU MD1 1 120 LEU MD2 4.800 3.800 5.800 5.195 4.978 5.760 . 0 0 "[ . 1 . 2 . 3]" 1 899 1 74 LEU H 1 75 ASP H 3.400 . 4.100 2.780 2.632 2.882 . 0 0 "[ . 1 . 2 . 3]" 1 900 1 74 LEU HA 1 74 LEU MD2 3.100 . 4.700 3.484 2.825 3.692 . 0 0 "[ . 1 . 2 . 3]" 1 901 1 74 LEU H 1 74 LEU HB3 3.500 . 4.700 3.465 3.306 3.658 . 0 0 "[ . 1 . 2 . 3]" 1 902 1 74 LEU H 1 74 LEU HG 3.200 . 4.200 4.060 3.738 4.249 0.049 23 0 "[ . 1 . 2 . 3]" 1 903 1 74 LEU MD1 1 108 VAL HA 3.400 . 4.600 2.323 2.255 2.537 . 0 0 "[ . 1 . 2 . 3]" 1 904 1 74 LEU MD2 1 108 VAL HA 2.600 . 3.600 2.685 2.261 3.375 . 0 0 "[ . 1 . 2 . 3]" 1 905 1 73 PHE HB2 1 74 LEU MD1 4.500 . 5.900 4.726 4.293 5.374 . 0 0 "[ . 1 . 2 . 3]" 1 906 1 73 PHE HB3 1 74 LEU MD1 4.100 . 5.400 3.231 2.748 3.947 . 0 0 "[ . 1 . 2 . 3]" 1 907 1 73 PHE HB2 1 74 LEU H 3.200 . 3.800 3.678 3.549 3.846 0.046 20 0 "[ . 1 . 2 . 3]" 1 908 1 73 PHE HB3 1 74 LEU H 3.900 . 4.700 2.211 2.046 2.459 . 0 0 "[ . 1 . 2 . 3]" 1 909 1 74 LEU MD1 1 112 LEU H 4.400 . 5.800 4.504 4.081 5.183 . 0 0 "[ . 1 . 2 . 3]" 1 910 1 74 LEU H 1 74 LEU MD2 3.400 . 5.100 3.409 1.653 4.059 0.147 5 0 "[ . 1 . 2 . 3]" 1 911 1 74 LEU MD2 1 111 PHE HB3 3.400 . 4.600 3.227 2.450 4.523 . 0 0 "[ . 1 . 2 . 3]" 1 912 1 74 LEU MD2 1 107 GLU HB2 3.200 . 4.300 3.513 2.315 4.319 0.019 7 0 "[ . 1 . 2 . 3]" 1 913 1 74 LEU MD2 1 120 LEU MD2 3.000 . 6.600 6.417 5.536 6.682 0.082 6 0 "[ . 1 . 2 . 3]" 1 914 1 74 LEU MD2 1 92 TRP HZ2 4.400 . 5.800 5.004 2.886 5.823 0.023 12 0 "[ . 1 . 2 . 3]" 1 915 1 73 PHE QD 1 74 LEU MD2 4.200 . 6.000 4.053 2.290 4.683 . 0 0 "[ . 1 . 2 . 3]" 1 916 1 73 PHE QE 1 74 LEU MD2 4.000 . 5.800 5.364 4.276 5.820 0.020 30 0 "[ . 1 . 2 . 3]" 1 917 1 74 LEU HA 1 74 LEU HG 3.200 . 4.300 2.658 2.301 3.693 . 0 0 "[ . 1 . 2 . 3]" 1 918 1 74 LEU H 1 74 LEU HB2 3.500 . 4.700 2.215 2.056 2.596 . 0 0 "[ . 1 . 2 . 3]" 1 919 1 74 LEU MD1 1 111 PHE HZ 4.700 . 5.900 4.756 4.382 5.164 . 0 0 "[ . 1 . 2 . 3]" 1 920 1 74 LEU HB3 1 74 LEU MD1 3.200 . 4.800 2.997 2.356 3.201 . 0 0 "[ . 1 . 2 . 3]" 1 921 1 74 LEU HB2 1 74 LEU MD1 3.200 . 4.800 2.496 2.241 3.221 . 0 0 "[ . 1 . 2 . 3]" 1 922 1 74 LEU HA 1 77 VAL MG2 2.900 . 4.000 2.158 2.004 2.476 . 0 0 "[ . 1 . 2 . 3]" 1 923 1 74 LEU H 1 74 LEU MD1 3.600 . 5.100 2.476 1.843 3.257 . 0 0 "[ . 1 . 2 . 3]" 1 924 1 74 LEU HB3 1 74 LEU MD2 3.000 . 4.600 2.540 2.257 3.201 . 0 0 "[ . 1 . 2 . 3]" 1 925 1 74 LEU MD1 1 109 ARG H 5.100 . 6.400 5.260 4.868 5.434 . 0 0 "[ . 1 . 2 . 3]" 1 926 1 74 LEU HA 1 74 LEU HB2 2.700 . 3.600 2.924 2.847 3.030 . 0 0 "[ . 1 . 2 . 3]" 1 927 1 74 LEU MD2 1 75 ASP H 3.900 . 5.200 4.689 3.687 5.106 . 0 0 "[ . 1 . 2 . 3]" 1 928 1 74 LEU HA 1 75 ASP H 3.900 . 4.700 3.443 3.384 3.510 . 0 0 "[ . 1 . 2 . 3]" 1 929 1 75 ASP H 1 75 ASP HB3 3.300 . 4.500 3.459 2.830 3.659 . 0 0 "[ . 1 . 2 . 3]" 1 930 1 74 LEU QB 1 75 ASP H 4.000 . 5.000 2.977 2.801 3.114 . 0 0 "[ . 1 . 2 . 3]" 1 931 1 74 LEU HG 1 75 ASP H 3.400 . 5.100 5.130 4.937 5.325 0.225 17 0 "[ . 1 . 2 . 3]" 1 932 1 75 ASP H 1 75 ASP HB2 2.900 . 4.000 2.348 2.124 2.667 . 0 0 "[ . 1 . 2 . 3]" 1 933 1 75 ASP HA 1 77 VAL H 3.400 . 4.100 4.113 3.960 4.319 0.219 20 0 "[ . 1 . 2 . 3]" 1 934 1 75 ASP HA 1 76 LEU H 3.400 . 4.100 3.479 3.391 3.573 . 0 0 "[ . 1 . 2 . 3]" 1 935 1 76 LEU H 1 76 LEU MD2 3.800 . 5.500 2.998 2.449 3.993 . 0 0 "[ . 1 . 2 . 3]" 1 936 1 76 LEU HA 1 76 LEU MD2 3.800 . 5.400 3.630 3.481 4.017 . 0 0 "[ . 1 . 2 . 3]" 1 937 1 76 LEU H 1 76 LEU MD1 3.800 . 6.000 4.172 3.740 4.371 . 0 0 "[ . 1 . 2 . 3]" 1 938 1 73 PHE HZ 1 76 LEU MD1 4.700 . 6.100 5.877 4.713 6.276 0.176 22 0 "[ . 1 . 2 . 3]" 1 939 1 73 PHE QE 1 76 LEU MD1 3.400 . 5.100 4.323 3.050 4.853 . 0 0 "[ . 1 . 2 . 3]" 1 940 1 75 ASP HB2 1 76 LEU H 3.200 . 3.800 3.166 2.772 3.779 . 0 0 "[ . 1 . 2 . 3]" 1 941 1 75 ASP HB3 1 76 LEU H 3.500 . 4.200 3.642 2.652 4.098 . 0 0 "[ . 1 . 2 . 3]" 1 942 1 76 LEU H 1 76 LEU HA 2.900 . 3.500 2.923 2.904 2.942 . 0 0 "[ . 1 . 2 . 3]" 1 943 1 76 LEU H 1 76 LEU HG 2.900 . 5.000 4.006 2.101 4.416 . 0 0 "[ . 1 . 2 . 3]" 1 944 1 76 LEU H 1 78 PRO QD 4.000 . 5.000 3.534 3.364 3.844 . 0 0 "[ . 1 . 2 . 3]" 1 945 1 76 LEU HA 1 77 VAL H 3.100 . 3.700 3.413 3.299 3.516 . 0 0 "[ . 1 . 2 . 3]" 1 946 1 76 LEU HA 1 79 SER HB2 2.300 . 3.700 3.162 2.345 3.800 0.100 24 0 "[ . 1 . 2 . 3]" 1 947 1 53 LEU MD1 1 76 LEU HG 2.500 . 5.200 4.572 3.996 5.240 0.040 21 0 "[ . 1 . 2 . 3]" 1 948 1 73 PHE HA 1 76 LEU MD2 3.300 . 4.500 2.513 2.060 3.469 . 0 0 "[ . 1 . 2 . 3]" 1 949 1 76 LEU HG 1 77 VAL H 3.800 . 4.600 3.953 2.675 4.403 . 0 0 "[ . 1 . 2 . 3]" 1 950 1 53 LEU HB3 1 76 LEU MD1 3.600 . 4.800 4.831 3.220 4.970 0.170 9 0 "[ . 1 . 2 . 3]" 1 951 1 53 LEU HB2 1 76 LEU MD2 4.000 . 5.500 5.380 3.950 5.754 0.254 17 0 "[ . 1 . 2 . 3]" 1 952 1 73 PHE HB3 1 76 LEU MD1 4.200 . 6.500 5.867 5.460 6.185 . 0 0 "[ . 1 . 2 . 3]" 1 953 1 76 LEU MD1 1 77 VAL HA 5.400 . 6.500 4.702 3.032 5.445 . 0 0 "[ . 1 . 2 . 3]" 1 954 1 76 LEU MD1 1 76 LEU MD2 2.500 . 4.500 1.983 1.806 2.061 . 0 0 "[ . 1 . 2 . 3]" 1 955 1 76 LEU HB3 1 76 LEU MD2 3.000 . 4.600 2.199 2.103 2.317 . 0 0 "[ . 1 . 2 . 3]" 1 956 1 73 PHE HB3 1 76 LEU MD2 4.100 . 6.400 4.583 4.207 5.333 . 0 0 "[ . 1 . 2 . 3]" 1 957 1 76 LEU MD2 1 79 SER HB2 3.800 . 5.100 4.544 3.620 5.307 0.207 6 0 "[ . 1 . 2 . 3]" 1 958 1 73 PHE HB2 1 76 LEU MD2 6.400 . 7.700 3.981 3.628 4.589 . 0 0 "[ . 1 . 2 . 3]" 1 959 1 73 PHE QE 1 76 LEU MD2 3.300 . 5.000 3.200 2.691 4.874 . 0 0 "[ . 1 . 2 . 3]" 1 960 1 76 LEU MD1 1 77 VAL MG1 3.300 . 6.000 5.754 4.137 6.235 0.235 13 0 "[ . 1 . 2 . 3]" 1 961 1 76 LEU HB2 1 79 SER H 4.700 . 5.600 5.047 4.166 5.617 0.017 4 0 "[ . 1 . 2 . 3]" 1 962 1 76 LEU H 1 76 LEU HB3 3.300 . 4.500 2.297 2.114 2.761 . 0 0 "[ . 1 . 2 . 3]" 1 963 1 76 LEU MD2 1 77 VAL HA 3.500 . 5.200 2.918 2.276 5.174 . 0 0 "[ . 1 . 2 . 3]" 1 964 1 76 LEU MD2 1 77 VAL H 3.500 . 4.700 2.910 2.334 4.366 . 0 0 "[ . 1 . 2 . 3]" 1 965 1 76 LEU HB2 1 76 LEU MD2 2.800 . 4.400 3.079 2.755 3.199 . 0 0 "[ . 1 . 2 . 3]" 1 966 1 76 LEU MD2 1 77 VAL MG1 3.200 . 5.800 4.201 3.228 6.125 0.325 7 0 "[ . 1 . 2 . 3]" 1 967 1 76 LEU MD1 1 77 VAL H 3.700 . 4.900 4.638 3.657 5.048 0.148 4 0 "[ . 1 . 2 . 3]" 1 968 1 53 LEU MD2 1 76 LEU MD2 3.700 . 5.400 3.440 2.238 3.894 . 0 0 "[ . 1 . 2 . 3]" 1 969 1 33 TYR QE 1 76 LEU MD2 3.600 . 5.300 3.288 2.444 3.717 . 0 0 "[ . 1 . 2 . 3]" 1 970 1 76 LEU HA 1 76 LEU MD1 3.200 . 5.100 3.720 3.147 3.994 . 0 0 "[ . 1 . 2 . 3]" 1 971 1 76 LEU HA 1 76 LEU HG 3.700 . 4.900 3.049 2.411 3.558 . 0 0 "[ . 1 . 2 . 3]" 1 972 1 73 PHE HA 1 76 LEU MD1 3.300 . 4.500 3.465 3.265 3.756 . 0 0 "[ . 1 . 2 . 3]" 1 973 1 76 LEU HA 1 76 LEU HB2 2.600 . 3.500 2.306 2.208 2.463 . 0 0 "[ . 1 . 2 . 3]" 1 974 1 75 ASP H 1 76 LEU H 3.300 . 4.000 2.325 2.192 2.633 . 0 0 "[ . 1 . 2 . 3]" 1 975 1 73 PHE HA 1 76 LEU H 3.400 . 4.600 3.037 2.831 3.381 . 0 0 "[ . 1 . 2 . 3]" 1 976 1 73 PHE QD 1 76 LEU MD1 3.400 . 5.100 3.711 2.925 4.202 . 0 0 "[ . 1 . 2 . 3]" 1 977 1 76 LEU HB2 1 76 LEU MD1 3.000 . 4.500 2.208 2.117 2.318 . 0 0 "[ . 1 . 2 . 3]" 1 978 1 33 TYR QE 1 76 LEU MD1 4.000 . 5.800 2.532 2.176 2.986 . 0 0 "[ . 1 . 2 . 3]" 1 979 1 73 PHE HB2 1 76 LEU MD1 4.700 . 6.100 4.895 4.596 5.195 . 0 0 "[ . 1 . 2 . 3]" 1 980 1 76 LEU MD1 1 79 SER HB2 4.700 . 6.100 4.176 2.955 4.722 . 0 0 "[ . 1 . 2 . 3]" 1 981 1 76 LEU H 1 76 LEU HB2 2.900 . 4.000 3.269 2.650 3.706 . 0 0 "[ . 1 . 2 . 3]" 1 982 1 77 VAL HA 1 80 LEU MD2 3.700 . 4.700 3.279 2.187 3.614 . 0 0 "[ . 1 . 2 . 3]" 1 983 1 77 VAL MG1 1 77 VAL MG2 2.500 . 4.000 2.038 2.002 2.056 . 0 0 "[ . 1 . 2 . 3]" 1 984 1 77 VAL MG1 1 80 LEU MD1 3.700 . 5.400 2.739 1.978 3.556 . 0 0 "[ . 1 . 2 . 3]" 1 985 1 74 LEU HA 1 77 VAL H 3.200 . 3.800 3.565 3.406 3.787 . 0 0 "[ . 1 . 2 . 3]" 1 986 1 77 VAL H 1 77 VAL MG2 2.900 . 4.500 2.088 1.642 2.537 0.158 20 0 "[ . 1 . 2 . 3]" 1 987 1 77 VAL MG1 1 80 LEU HG 3.400 . 4.600 3.815 3.488 4.834 0.234 27 0 "[ . 1 . 2 . 3]" 1 988 1 73 PHE HZ 1 77 VAL MG1 3.300 . 4.500 3.635 2.331 4.538 0.038 10 0 "[ . 1 . 2 . 3]" 1 989 1 77 VAL HA 1 77 VAL HB 2.900 . 3.500 2.955 2.876 3.005 . 0 0 "[ . 1 . 2 . 3]" 1 990 1 77 VAL H 1 77 VAL HB 2.900 . 4.000 2.698 2.272 3.294 . 0 0 "[ . 1 . 2 . 3]" 1 991 1 77 VAL HA 1 80 LEU MD1 3.900 . 5.000 2.165 2.070 2.323 . 0 0 "[ . 1 . 2 . 3]" 1 992 1 77 VAL MG1 1 111 PHE QD 3.100 . 4.700 3.998 3.740 4.284 . 0 0 "[ . 1 . 2 . 3]" 1 993 1 77 VAL MG2 1 78 PRO HG2 3.800 . 5.700 5.275 4.350 5.938 0.238 6 0 "[ . 1 . 2 . 3]" 1 994 1 77 VAL MG1 1 80 LEU MD2 3.000 . 4.600 4.030 2.267 4.802 0.202 18 0 "[ . 1 . 2 . 3]" 1 995 1 73 PHE HZ 1 77 VAL MG2 3.300 . 4.500 3.139 2.624 3.867 . 0 0 "[ . 1 . 2 . 3]" 1 996 1 77 VAL MG2 1 80 LEU MD1 3.100 . 4.700 3.225 2.465 3.746 . 0 0 "[ . 1 . 2 . 3]" 1 997 1 76 LEU H 1 77 VAL MG2 3.800 . 5.100 3.553 3.082 3.996 . 0 0 "[ . 1 . 2 . 3]" 1 998 1 73 PHE QE 1 77 VAL MG1 4.000 . 5.800 3.181 2.154 3.921 . 0 0 "[ . 1 . 2 . 3]" 1 999 1 75 ASP H 1 77 VAL MG1 4.100 . 5.900 6.136 6.033 6.246 0.346 30 0 "[ . 1 . 2 . 3]" 1 1000 1 77 VAL HA 1 80 LEU HB3 3.000 . 4.600 4.706 4.601 4.794 0.194 29 0 "[ . 1 . 2 . 3]" 1 1001 1 77 VAL HA 1 77 VAL MG2 2.800 . 4.400 2.404 2.172 2.820 . 0 0 "[ . 1 . 2 . 3]" 1 1002 1 77 VAL MG1 1 111 PHE QE 2.700 . 3.900 2.602 2.263 2.917 . 0 0 "[ . 1 . 2 . 3]" 1 1003 1 77 VAL HA 1 77 VAL MG1 2.900 . 4.500 2.318 2.098 2.558 . 0 0 "[ . 1 . 2 . 3]" 1 1004 1 77 VAL MG1 1 118 VAL MG1 3.700 . 5.400 3.640 3.261 4.079 . 0 0 "[ . 1 . 2 . 3]" 1 1005 1 74 LEU MD1 1 77 VAL MG2 3.100 . 4.200 2.771 2.489 3.178 . 0 0 "[ . 1 . 2 . 3]" 1 1006 1 74 LEU HA 1 77 VAL MG1 2.900 . 4.100 4.102 3.853 4.188 0.088 24 0 "[ . 1 . 2 . 3]" 1 1007 1 77 VAL HB 1 80 LEU H 3.500 . 5.200 5.246 4.954 5.469 0.269 25 0 "[ . 1 . 2 . 3]" 1 1008 1 73 PHE QE 1 77 VAL MG2 2.700 . 4.200 2.193 2.037 2.446 . 0 0 "[ . 1 . 2 . 3]" 1 1009 1 77 VAL MG2 1 80 LEU MD2 3.200 . 4.800 4.260 2.381 5.054 0.254 20 0 "[ . 1 . 2 . 3]" 1 1010 1 77 VAL H 1 77 VAL MG1 3.200 . 4.800 3.629 3.341 3.750 . 0 0 "[ . 1 . 2 . 3]" 1 1011 1 76 LEU H 1 77 VAL H 3.200 . 3.800 2.309 2.162 2.522 . 0 0 "[ . 1 . 2 . 3]" 1 1012 1 74 LEU HB2 1 77 VAL MG2 3.000 . 4.600 4.507 4.304 4.762 0.162 30 0 "[ . 1 . 2 . 3]" 1 1013 1 76 LEU HB2 1 77 VAL H 3.700 . 4.400 4.367 4.033 4.557 0.157 26 0 "[ . 1 . 2 . 3]" 1 1014 1 77 VAL H 1 78 PRO QD 4.000 . 5.000 2.310 2.197 2.394 . 0 0 "[ . 1 . 2 . 3]" 1 1015 1 77 VAL MG2 1 111 PHE HZ 3.000 . 4.100 3.463 2.731 4.076 . 0 0 "[ . 1 . 2 . 3]" 1 1016 1 77 VAL MG2 1 80 LEU HG 3.200 . 4.900 4.401 3.819 5.126 0.226 16 0 "[ . 1 . 2 . 3]" 1 1017 1 76 LEU QB 1 77 VAL MG2 2.700 . 5.200 4.239 3.446 5.002 . 0 0 "[ . 1 . 2 . 3]" 1 1018 1 77 VAL HA 1 80 LEU HB2 3.100 . 4.600 3.609 3.041 3.800 . 0 0 "[ . 1 . 2 . 3]" 1 1019 1 77 VAL HA 1 78 PRO QD 3.600 . 4.300 3.546 3.508 3.585 . 0 0 "[ . 1 . 2 . 3]" 1 1020 1 75 ASP HA 1 78 PRO QD 4.000 . 5.000 3.322 3.160 3.706 . 0 0 "[ . 1 . 2 . 3]" 1 1021 1 79 SER H 1 79 SER HB2 3.000 . 3.600 2.408 2.113 2.905 . 0 0 "[ . 1 . 2 . 3]" 1 1022 1 79 SER H 1 80 LEU MD2 4.400 . 5.800 4.400 3.956 5.113 . 0 0 "[ . 1 . 2 . 3]" 1 1023 1 78 PRO HG2 1 79 SER H 3.600 . 4.300 3.587 2.727 4.259 . 0 0 "[ . 1 . 2 . 3]" 1 1024 1 78 PRO HD3 1 79 SER H 3.700 . 4.400 4.018 3.702 4.239 . 0 0 "[ . 1 . 2 . 3]" 1 1025 1 79 SER HA 1 79 SER HB2 2.400 . 3.200 2.779 2.565 3.029 . 0 0 "[ . 1 . 2 . 3]" 1 1026 1 76 LEU HA 1 79 SER H 3.000 . 3.200 3.338 3.162 3.468 0.268 30 0 "[ . 1 . 2 . 3]" 1 1027 1 79 SER H 1 79 SER HA 3.000 . 3.600 2.853 2.818 2.879 . 0 0 "[ . 1 . 2 . 3]" 1 1028 1 78 PRO HB2 1 79 SER H 3.300 . 4.000 3.074 2.790 3.364 . 0 0 "[ . 1 . 2 . 3]" 1 1029 1 79 SER QB 1 80 LEU QD 4.000 . 5.500 2.733 2.310 3.222 . 0 0 "[ . 1 . 2 . 3]" 1 1030 1 80 LEU HB3 1 80 LEU MD1 3.200 . 4.300 2.529 2.234 3.206 . 0 0 "[ . 1 . 2 . 3]" 1 1031 1 77 VAL HB 1 80 LEU MD1 4.300 . 5.700 4.406 3.938 4.875 . 0 0 "[ . 1 . 2 . 3]" 1 1032 1 80 LEU HB2 1 80 LEU MD1 3.200 . 4.300 2.370 2.271 2.580 . 0 0 "[ . 1 . 2 . 3]" 1 1033 1 80 LEU HB3 1 80 LEU MD2 2.900 . 4.000 2.355 2.251 2.600 . 0 0 "[ . 1 . 2 . 3]" 1 1034 1 78 PRO HD3 1 80 LEU MD1 5.100 . 6.400 5.515 5.161 6.093 . 0 0 "[ . 1 . 2 . 3]" 1 1035 1 49 HIS HA 1 80 LEU MD2 5.000 . 6.500 3.427 2.321 5.895 . 0 0 "[ . 1 . 2 . 3]" 1 1036 1 80 LEU HB3 1 82 LEU MD2 3.900 . 5.200 2.517 2.265 2.922 . 0 0 "[ . 1 . 2 . 3]" 1 1037 1 80 LEU H 1 80 LEU HA 2.700 . 3.200 2.873 2.836 2.929 . 0 0 "[ . 1 . 2 . 3]" 1 1038 1 80 LEU H 1 80 LEU HB3 3.300 . 4.000 3.605 3.549 3.674 . 0 0 "[ . 1 . 2 . 3]" 1 1039 1 80 LEU HB2 1 80 LEU MD2 3.200 . 4.300 2.986 2.166 3.192 . 0 0 "[ . 1 . 2 . 3]" 1 1040 1 80 LEU HA 1 80 LEU HG 2.800 . 3.700 3.124 2.598 3.388 . 0 0 "[ . 1 . 2 . 3]" 1 1041 1 80 LEU MD1 1 82 LEU MD1 3.300 . 5.000 3.086 2.513 4.823 . 0 0 "[ . 1 . 2 . 3]" 1 1042 1 80 LEU MD1 1 82 LEU H 4.900 . 5.900 4.940 4.435 5.400 . 0 0 "[ . 1 . 2 . 3]" 1 1043 1 80 LEU HB2 1 82 LEU MD2 3.100 . 4.200 2.547 2.081 3.802 . 0 0 "[ . 1 . 2 . 3]" 1 1044 1 80 LEU HG 1 82 LEU MD2 3.200 . 4.300 4.145 3.826 4.432 0.132 23 0 "[ . 1 . 2 . 3]" 1 1045 1 77 VAL HB 1 80 LEU MD2 3.900 . 5.700 5.594 4.284 5.985 0.285 23 0 "[ . 1 . 2 . 3]" 1 1046 1 78 PRO HD3 1 80 LEU MD2 4.700 . 6.400 6.313 5.558 6.679 0.279 13 0 "[ . 1 . 2 . 3]" 1 1047 1 33 TYR QE 1 80 LEU MD2 4.100 . 5.900 2.701 2.144 3.653 . 0 0 "[ . 1 . 2 . 3]" 1 1048 1 80 LEU H 1 82 LEU H 4.200 . 5.000 4.411 4.224 4.749 . 0 0 "[ . 1 . 2 . 3]" 1 1049 1 80 LEU HA 1 80 LEU MD1 3.300 . 4.500 3.524 2.213 3.944 . 0 0 "[ . 1 . 2 . 3]" 1 1050 1 76 LEU MD1 1 80 LEU MD2 3.000 . 4.600 3.220 1.896 4.435 . 0 0 "[ . 1 . 2 . 3]" 1 1051 1 80 LEU HA 1 80 LEU MD2 2.500 . 4.000 2.515 2.076 3.843 . 0 0 "[ . 1 . 2 . 3]" 1 1052 1 80 LEU H 1 80 LEU MD2 3.100 . 4.200 2.996 2.467 3.553 . 0 0 "[ . 1 . 2 . 3]" 1 1053 1 80 LEU MD2 1 82 LEU MD2 3.000 . 4.200 3.757 2.657 4.302 0.102 15 0 "[ . 1 . 2 . 3]" 1 1054 1 80 LEU MD1 1 80 LEU MD2 2.100 . 3.500 2.029 1.990 2.057 . 0 0 "[ . 1 . 2 . 3]" 1 1055 1 80 LEU H 1 80 LEU MD1 3.100 . 4.200 3.198 1.766 3.681 0.034 16 0 "[ . 1 . 2 . 3]" 1 1056 1 80 LEU MD2 1 82 LEU HG 3.500 . 6.200 4.736 3.317 5.113 . 0 0 "[ . 1 . 2 . 3]" 1 1057 1 80 LEU H 1 80 LEU HG 3.400 . 4.500 2.315 1.803 4.076 . 0 0 "[ . 1 . 2 . 3]" 1 1058 1 79 SER HB2 1 80 LEU H 3.800 . 4.600 3.571 2.915 4.137 . 0 0 "[ . 1 . 2 . 3]" 1 1059 1 79 SER H 1 80 LEU H 3.200 . 3.800 2.546 2.449 2.622 . 0 0 "[ . 1 . 2 . 3]" 1 1060 1 79 SER HA 1 80 LEU H 3.800 . 4.600 3.462 3.362 3.516 . 0 0 "[ . 1 . 2 . 3]" 1 1061 1 81 GLN HA 1 81 GLN HG3 2.700 . 3.500 2.763 2.418 3.573 0.073 10 0 "[ . 1 . 2 . 3]" 1 1062 1 81 GLN HE21 1 81 GLN HG2 2.900 . 4.500 3.289 2.320 3.620 . 0 0 "[ . 1 . 2 . 3]" 1 1063 1 80 LEU MD2 1 81 GLN H 3.400 . 4.700 4.522 4.185 4.858 0.158 24 0 "[ . 1 . 2 . 3]" 1 1064 1 81 GLN H 1 81 GLN HA 2.700 . 3.200 2.308 2.290 2.326 . 0 0 "[ . 1 . 2 . 3]" 1 1065 1 80 LEU HA 1 81 GLN H 2.700 . 3.200 3.320 3.219 3.412 0.212 27 0 "[ . 1 . 2 . 3]" 1 1066 1 81 GLN H 1 81 GLN HB3 3.200 . 3.800 3.888 3.657 3.979 0.179 9 0 "[ . 1 . 2 . 3]" 1 1067 1 80 LEU HB2 1 81 GLN H 3.600 . 4.300 3.374 3.077 3.659 . 0 0 "[ . 1 . 2 . 3]" 1 1068 1 80 LEU MD1 1 81 GLN H 3.900 . 5.300 4.796 3.851 5.280 . 0 0 "[ . 1 . 2 . 3]" 1 1069 1 81 GLN HA 1 82 LEU H 2.900 . 3.500 2.667 2.620 2.799 . 0 0 "[ . 1 . 2 . 3]" 1 1070 1 81 GLN H 1 81 GLN HB2 2.900 . 3.500 3.185 2.771 3.474 . 0 0 "[ . 1 . 2 . 3]" 1 1071 1 81 GLN H 1 81 GLN HG3 2.900 . 4.000 3.123 2.301 4.058 0.058 26 0 "[ . 1 . 2 . 3]" 1 1072 1 81 GLN HB2 1 81 GLN HG3 2.900 . 3.500 2.452 2.250 2.626 . 0 0 "[ . 1 . 2 . 3]" 1 1073 1 81 GLN H 1 81 GLN HG2 2.900 . 4.500 3.762 2.422 4.552 0.052 22 0 "[ . 1 . 2 . 3]" 1 1074 1 81 GLN HA 1 81 GLN HB2 2.800 . 3.400 2.891 2.641 3.024 . 0 0 "[ . 1 . 2 . 3]" 1 1075 1 81 GLN HA 1 81 GLN HB3 2.800 . 3.400 2.665 2.419 2.982 . 0 0 "[ . 1 . 2 . 3]" 1 1076 1 81 GLN HB3 1 81 GLN HG3 3.000 . 3.600 3.011 2.871 3.028 . 0 0 "[ . 1 . 2 . 3]" 1 1077 1 81 GLN HA 1 81 GLN HG2 2.800 . 3.400 2.471 2.328 2.682 . 0 0 "[ . 1 . 2 . 3]" 1 1078 1 81 GLN HE22 1 81 GLN HG2 2.700 . 4.200 3.963 3.537 4.120 . 0 0 "[ . 1 . 2 . 3]" 1 1079 1 81 GLN HB2 1 81 GLN HE22 3.500 . 5.200 3.996 3.346 4.781 . 0 0 "[ . 1 . 2 . 3]" 1 1080 1 80 LEU H 1 81 GLN H 3.200 . 3.800 2.514 2.231 2.751 . 0 0 "[ . 1 . 2 . 3]" 1 1081 1 80 LEU HB3 1 81 GLN H 4.200 . 5.000 4.242 3.725 4.421 . 0 0 "[ . 1 . 2 . 3]" 1 1082 1 79 SER HA 1 81 GLN H 3.800 . 4.200 3.506 3.148 3.818 . 0 0 "[ . 1 . 2 . 3]" 1 1083 1 81 GLN H 1 82 LEU H 3.100 . 3.700 3.023 2.756 3.153 . 0 0 "[ . 1 . 2 . 3]" 1 1084 1 81 GLN HB2 1 81 GLN HE21 2.700 . 5.200 3.051 1.810 4.563 . 0 0 "[ . 1 . 2 . 3]" 1 1085 1 81 GLN HE21 1 81 GLN HG3 2.500 . 4.000 2.699 2.244 3.618 . 0 0 "[ . 1 . 2 . 3]" 1 1086 1 82 LEU MD1 1 82 LEU MD2 2.700 . 4.200 2.037 1.965 2.081 . 0 0 "[ . 1 . 2 . 3]" 1 1087 1 80 LEU MD1 1 82 LEU MD2 3.300 . 5.000 2.994 2.275 4.947 . 0 0 "[ . 1 . 2 . 3]" 1 1088 1 82 LEU H 1 82 LEU MD2 3.200 . 4.800 3.068 2.634 3.769 . 0 0 "[ . 1 . 2 . 3]" 1 1089 1 82 LEU H 1 82 LEU MD1 3.300 . 5.000 3.307 2.091 3.616 . 0 0 "[ . 1 . 2 . 3]" 1 1090 1 82 LEU H 1 82 LEU HB2 3.400 . 4.100 2.644 2.518 2.753 . 0 0 "[ . 1 . 2 . 3]" 1 1091 1 82 LEU MD1 1 118 VAL MG1 3.100 . 4.700 2.180 2.032 2.602 . 0 0 "[ . 1 . 2 . 3]" 1 1092 1 82 LEU HG 1 118 VAL MG1 4.000 . 5.300 4.680 4.349 5.062 . 0 0 "[ . 1 . 2 . 3]" 1 1093 1 81 GLN HB3 1 82 LEU H 3.500 . 4.200 4.328 4.228 4.391 0.191 12 0 "[ . 1 . 2 . 3]" 1 1094 1 81 GLN HB2 1 82 LEU H 4.300 . 5.200 4.448 4.318 4.629 . 0 0 "[ . 1 . 2 . 3]" 1 1095 1 81 GLN HG2 1 82 LEU H 4.300 . 5.200 4.851 4.456 5.230 0.030 16 0 "[ . 1 . 2 . 3]" 1 1096 1 82 LEU HB2 1 82 LEU MD2 2.700 . 3.700 3.162 2.904 3.199 . 0 0 "[ . 1 . 2 . 3]" 1 1097 1 82 LEU MD1 1 88 TYR HB2 4.400 . 5.800 3.913 3.422 4.596 . 0 0 "[ . 1 . 2 . 3]" 1 1098 1 82 LEU MD2 1 88 TYR QD 3.500 . 5.200 2.968 2.318 3.533 . 0 0 "[ . 1 . 2 . 3]" 1 1099 1 35 VAL MG1 1 82 LEU MD1 3.700 . 5.400 4.560 4.019 4.902 . 0 0 "[ . 1 . 2 . 3]" 1 1100 1 35 VAL MG2 1 82 LEU MD1 3.200 . 4.800 3.999 3.540 4.336 . 0 0 "[ . 1 . 2 . 3]" 1 1101 1 82 LEU HB3 1 82 LEU MD1 3.100 . 4.200 2.425 2.260 2.979 . 0 0 "[ . 1 . 2 . 3]" 1 1102 1 46 MET ME 1 82 LEU MD1 4.400 . 7.300 6.330 5.676 6.823 . 0 0 "[ . 1 . 2 . 3]" 1 1103 1 77 VAL MG2 1 82 LEU MD1 3.200 . 4.800 3.858 3.125 4.597 . 0 0 "[ . 1 . 2 . 3]" 1 1104 1 77 VAL MG1 1 82 LEU MD2 3.300 . 5.000 3.707 3.353 4.218 . 0 0 "[ . 1 . 2 . 3]" 1 1105 1 82 LEU HB3 1 82 LEU MD2 3.000 . 4.100 2.253 2.137 2.329 . 0 0 "[ . 1 . 2 . 3]" 1 1106 1 80 LEU HA 1 82 LEU MD2 3.800 . 5.100 4.247 3.817 5.108 0.008 30 0 "[ . 1 . 2 . 3]" 1 1107 1 82 LEU MD2 1 88 TYR HB3 3.200 . 4.300 3.267 2.515 3.597 . 0 0 "[ . 1 . 2 . 3]" 1 1108 1 80 LEU HB3 1 82 LEU MD1 3.100 . 4.200 3.960 3.191 4.286 0.086 20 0 "[ . 1 . 2 . 3]" 1 1109 1 82 LEU HA 1 82 LEU MD2 2.400 . 3.400 2.233 2.103 3.139 . 0 0 "[ . 1 . 2 . 3]" 1 1110 1 82 LEU MD1 1 88 TYR QD 3.600 . 5.300 4.459 4.076 4.918 . 0 0 "[ . 1 . 2 . 3]" 1 1111 1 82 LEU HA 1 82 LEU MD1 2.800 . 3.900 3.819 3.792 3.865 . 0 0 "[ . 1 . 2 . 3]" 1 1112 1 77 VAL MG1 1 82 LEU MD1 3.000 . 4.100 2.165 1.917 2.702 . 0 0 "[ . 1 . 2 . 3]" 1 1113 1 82 LEU HB2 1 82 LEU MD1 2.700 . 3.700 2.341 2.130 2.446 . 0 0 "[ . 1 . 2 . 3]" 1 1114 1 82 LEU H 1 82 LEU HB3 3.000 . 3.600 3.594 3.580 3.621 0.021 9 0 "[ . 1 . 2 . 3]" 1 1115 1 82 LEU MD2 1 83 ASP H 3.600 . 4.800 3.542 3.170 4.704 . 0 0 "[ . 1 . 2 . 3]" 1 1116 1 82 LEU H 1 82 LEU HG 3.000 . 3.700 1.917 1.796 2.188 0.004 19 0 "[ . 1 . 2 . 3]" 1 1117 1 83 ASP QB 1 86 GLN QE 4.000 . 5.000 3.045 1.759 4.937 0.041 2 0 "[ . 1 . 2 . 3]" 1 1118 1 82 LEU HA 1 83 ASP H 2.900 . 3.500 2.438 2.161 2.745 . 0 0 "[ . 1 . 2 . 3]" 1 1119 1 82 LEU MD1 1 83 ASP H 3.900 . 6.200 4.462 3.915 5.294 . 0 0 "[ . 1 . 2 . 3]" 1 1120 1 83 ASP H 1 86 GLN HB2 3.500 . 8.000 5.536 4.153 7.528 . 0 0 "[ . 1 . 2 . 3]" 1 1121 1 83 ASP H 1 86 GLN HG3 4.300 . 8.200 6.809 4.923 8.093 . 0 0 "[ . 1 . 2 . 3]" 1 1122 1 83 ASP H 1 83 ASP HB3 2.500 . 4.300 3.806 3.569 3.989 . 0 0 "[ . 1 . 2 . 3]" 1 1123 1 83 ASP HB2 1 86 GLN H 3.900 . 4.700 3.497 2.445 4.710 0.010 17 0 "[ . 1 . 2 . 3]" 1 1124 1 83 ASP HB2 1 86 GLN HG3 2.600 . 6.100 5.290 3.892 6.126 0.026 19 0 "[ . 1 . 2 . 3]" 1 1125 1 83 ASP HA 1 83 ASP HB3 2.400 . 3.700 2.434 2.238 2.791 . 0 0 "[ . 1 . 2 . 3]" 1 1126 1 83 ASP H 1 83 ASP HB2 3.200 . 4.800 2.894 2.386 3.625 . 0 0 "[ . 1 . 2 . 3]" 1 1127 1 82 LEU HB2 1 83 ASP H 3.700 . 4.400 3.442 2.874 4.216 . 0 0 "[ . 1 . 2 . 3]" 1 1128 1 83 ASP H 1 88 TYR QD 4.200 . 6.000 3.756 3.160 4.476 . 0 0 "[ . 1 . 2 . 3]" 1 1129 1 83 ASP HA 1 84 PRO HD3 3.200 . 3.800 2.394 2.291 2.581 . 0 0 "[ . 1 . 2 . 3]" 1 1130 1 84 PRO HB3 1 84 PRO HD3 3.300 . 4.000 3.423 3.019 4.023 0.023 7 0 "[ . 1 . 2 . 3]" 1 1131 1 84 PRO HB3 1 85 ALA H 3.700 . 4.300 4.386 4.370 4.405 0.105 9 0 "[ . 1 . 2 . 3]" 1 1132 1 85 ALA HA 1 85 ALA MB 2.300 . 3.300 2.125 2.100 2.143 . 0 0 "[ . 1 . 2 . 3]" 1 1133 1 85 ALA MB 1 86 GLN HE21 3.100 . 4.200 2.774 1.796 4.215 0.015 3 0 "[ . 1 . 2 . 3]" 1 1134 1 85 ALA H 1 86 GLN HE22 4.600 . 5.500 4.820 3.339 5.539 0.039 30 0 "[ . 1 . 2 . 3]" 1 1135 1 85 ALA HA 1 86 GLN H 2.900 . 3.500 3.509 3.390 3.563 0.063 6 0 "[ . 1 . 2 . 3]" 1 1136 1 84 PRO HD3 1 85 ALA MB 3.900 . 5.700 5.229 4.997 5.480 . 0 0 "[ . 1 . 2 . 3]" 1 1137 1 83 ASP HA 1 85 ALA H 3.400 . 4.100 3.583 3.197 3.905 . 0 0 "[ . 1 . 2 . 3]" 1 1138 1 85 ALA H 1 85 ALA HA 2.900 . 3.500 2.850 2.763 2.926 . 0 0 "[ . 1 . 2 . 3]" 1 1139 1 85 ALA H 1 85 ALA MB 2.400 . 3.400 2.166 2.031 2.292 . 0 0 "[ . 1 . 2 . 3]" 1 1140 1 85 ALA H 1 86 GLN H 2.900 . 3.500 2.742 2.426 3.500 . 0 0 "[ . 1 . 2 . 3]" 1 1141 1 84 PRO HD3 1 85 ALA H 3.400 . 4.100 3.938 3.819 4.110 0.010 7 0 "[ . 1 . 2 . 3]" 1 1142 1 85 ALA MB 1 86 GLN HE22 3.700 . 4.900 2.712 1.796 4.314 0.004 7 0 "[ . 1 . 2 . 3]" 1 1143 1 85 ALA MB 1 86 GLN H 3.200 . 4.300 2.418 1.804 3.104 . 0 0 "[ . 1 . 2 . 3]" 1 1144 1 85 ALA MB 1 87 ILE H 3.800 . 6.200 5.769 5.514 6.034 . 0 0 "[ . 1 . 2 . 3]" 1 1145 1 84 PRO HA 1 85 ALA H 2.600 . 3.100 3.322 3.303 3.348 0.248 12 0 "[ . 1 . 2 . 3]" 1 1146 1 86 GLN HE21 1 86 GLN HG3 3.500 . 4.200 3.011 2.245 3.620 . 0 0 "[ . 1 . 2 . 3]" 1 1147 1 86 GLN H 1 86 GLN HB2 3.200 . 3.800 2.869 2.177 3.847 0.047 10 0 "[ . 1 . 2 . 3]" 1 1148 1 86 GLN H 1 86 GLN HA 2.900 . 3.500 2.910 2.828 2.962 . 0 0 "[ . 1 . 2 . 3]" 1 1149 1 86 GLN HA 1 86 GLN HB2 2.700 . 3.200 2.886 2.422 3.028 . 0 0 "[ . 1 . 2 . 3]" 1 1150 1 86 GLN HE22 1 86 GLN HG3 3.700 . 4.400 3.841 3.509 4.121 . 0 0 "[ . 1 . 2 . 3]" 1 1151 1 86 GLN HE21 1 86 GLN HG2 3.500 . 4.200 2.750 2.247 3.557 . 0 0 "[ . 1 . 2 . 3]" 1 1152 1 86 GLN H 1 86 GLN HG3 3.500 . 4.200 3.461 2.239 4.116 . 0 0 "[ . 1 . 2 . 3]" 1 1153 1 83 ASP HB2 1 86 GLN HG2 3.200 . 4.800 4.544 2.927 4.924 0.124 18 0 "[ . 1 . 2 . 3]" 1 1154 1 86 GLN HG3 1 87 ILE H 3.900 . 4.700 3.838 2.384 4.504 . 0 0 "[ . 1 . 2 . 3]" 1 1155 1 86 GLN HG2 1 87 ILE H 3.700 . 4.300 4.131 3.258 4.346 0.046 25 0 "[ . 1 . 2 . 3]" 1 1156 1 86 GLN HE22 1 86 GLN HG2 3.500 . 4.200 3.721 3.511 4.088 . 0 0 "[ . 1 . 2 . 3]" 1 1157 1 86 GLN H 1 86 GLN HG2 3.600 . 4.300 3.208 1.898 4.321 0.021 26 0 "[ . 1 . 2 . 3]" 1 1158 1 86 GLN HA 1 86 GLN HG2 3.000 . 3.600 3.524 3.008 3.749 0.149 28 0 "[ . 1 . 2 . 3]" 1 1159 1 86 GLN HA 1 86 GLN HG3 3.200 . 3.800 3.044 2.336 4.086 0.286 9 0 "[ . 1 . 2 . 3]" 1 1160 1 86 GLN HB2 1 87 ILE H 3.100 . 3.700 2.654 1.797 3.719 0.019 29 0 "[ . 1 . 2 . 3]" 1 1161 1 38 LEU MD1 1 87 ILE MD 3.800 . 5.100 3.897 3.698 4.356 . 0 0 "[ . 1 . 2 . 3]" 1 1162 1 87 ILE MG 1 89 ARG H 4.400 . 6.400 5.550 5.365 5.694 . 0 0 "[ . 1 . 2 . 3]" 1 1163 1 86 GLN HA 1 87 ILE H 2.900 . 3.500 2.714 2.333 2.878 . 0 0 "[ . 1 . 2 . 3]" 1 1164 1 37 ARG HA 1 87 ILE MD 4.200 . 6.000 6.056 6.032 6.088 0.088 17 0 "[ . 1 . 2 . 3]" 1 1165 1 43 TRP HH2 1 87 ILE MD 3.600 . 4.800 2.684 2.592 2.845 . 0 0 "[ . 1 . 2 . 3]" 1 1166 1 43 TRP HZ2 1 87 ILE MD 3.700 . 4.900 2.774 2.414 3.480 . 0 0 "[ . 1 . 2 . 3]" 1 1167 1 87 ILE H 1 87 ILE MD 2.900 . 4.500 4.476 4.352 4.549 0.049 28 0 "[ . 1 . 2 . 3]" 1 1168 1 38 LEU H 1 87 ILE MG 4.400 . 5.800 2.840 2.644 2.903 . 0 0 "[ . 1 . 2 . 3]" 1 1169 1 38 LEU H 1 87 ILE MD 4.400 . 5.800 4.640 4.575 4.829 . 0 0 "[ . 1 . 2 . 3]" 1 1170 1 43 TRP HE1 1 87 ILE MD 4.700 . 6.000 4.889 4.502 5.694 . 0 0 "[ . 1 . 2 . 3]" 1 1171 1 38 LEU HB2 1 87 ILE MG 2.600 . 3.600 2.249 2.224 2.287 . 0 0 "[ . 1 . 2 . 3]" 1 1172 1 87 ILE H 1 87 ILE HG12 3.400 . 5.100 4.458 4.427 4.481 . 0 0 "[ . 1 . 2 . 3]" 1 1173 1 86 GLN HB3 1 87 ILE H 2.900 . 4.500 2.395 1.797 3.676 0.003 12 0 "[ . 1 . 2 . 3]" 1 1174 1 38 LEU MD1 1 87 ILE MG 3.600 . 4.800 3.656 3.582 3.743 . 0 0 "[ . 1 . 2 . 3]" 1 1175 1 87 ILE HB 1 87 ILE HG13 2.900 . 3.500 2.370 2.347 2.455 . 0 0 "[ . 1 . 2 . 3]" 1 1176 1 87 ILE H 1 87 ILE MG 3.400 . 4.600 1.988 1.865 2.069 . 0 0 "[ . 1 . 2 . 3]" 1 1177 1 87 ILE HA 1 87 ILE MD 3.200 . 4.300 3.830 3.795 3.845 . 0 0 "[ . 1 . 2 . 3]" 1 1178 1 43 TRP HZ2 1 87 ILE MG 3.500 . 4.700 3.806 3.534 4.284 . 0 0 "[ . 1 . 2 . 3]" 1 1179 1 43 TRP HZ3 1 87 ILE MG 3.000 . 4.100 3.328 3.088 3.384 . 0 0 "[ . 1 . 2 . 3]" 1 1180 1 43 TRP HZ3 1 87 ILE HA 4.300 . 5.500 5.577 5.522 5.645 0.145 18 0 "[ . 1 . 2 . 3]" 1 1181 1 43 TRP HZ3 1 87 ILE MD 3.900 . 5.200 4.504 4.456 4.587 . 0 0 "[ . 1 . 2 . 3]" 1 1182 1 87 ILE MD 1 87 ILE MG 2.700 . 4.200 1.844 1.804 1.970 . 0 0 "[ . 1 . 2 . 3]" 1 1183 1 38 LEU MD2 1 87 ILE HG12 3.700 . 4.900 4.583 4.484 4.692 . 0 0 "[ . 1 . 2 . 3]" 1 1184 1 87 ILE HA 1 87 ILE MG 3.100 . 4.200 3.180 3.174 3.186 . 0 0 "[ . 1 . 2 . 3]" 1 1185 1 87 ILE HG12 1 88 TYR H 3.700 . 4.400 2.850 2.646 3.072 . 0 0 "[ . 1 . 2 . 3]" 1 1186 1 38 LEU HB2 1 87 ILE MD 2.300 . 3.800 3.275 3.167 3.556 . 0 0 "[ . 1 . 2 . 3]" 1 1187 1 87 ILE HG12 1 87 ILE MG 3.200 . 4.300 2.475 2.346 2.527 . 0 0 "[ . 1 . 2 . 3]" 1 1188 1 43 TRP HH2 1 87 ILE MG 2.600 . 3.600 2.501 2.334 2.725 . 0 0 "[ . 1 . 2 . 3]" 1 1189 1 38 LEU MD2 1 87 ILE MG 2.900 . 4.500 2.167 2.136 2.270 . 0 0 "[ . 1 . 2 . 3]" 1 1190 1 87 ILE MG 1 88 TYR H 3.300 . 4.500 3.930 3.794 4.007 . 0 0 "[ . 1 . 2 . 3]" 1 1191 1 87 ILE H 1 87 ILE HG13 3.400 . 5.100 4.737 4.649 4.805 . 0 0 "[ . 1 . 2 . 3]" 1 1192 1 88 TYR H 1 88 TYR QD 3.500 . 4.700 2.704 2.391 3.078 . 0 0 "[ . 1 . 2 . 3]" 1 1193 1 88 TYR QD 1 118 VAL MG1 3.500 . 5.200 4.721 4.007 5.161 . 0 0 "[ . 1 . 2 . 3]" 1 1194 1 88 TYR H 1 118 VAL HA 3.800 . 4.600 2.831 2.632 2.994 . 0 0 "[ . 1 . 2 . 3]" 1 1195 1 36 GLU HB2 1 88 TYR HA 3.800 . 4.600 4.699 4.649 4.762 0.162 28 0 "[ . 1 . 2 . 3]" 1 1196 1 37 ARG HA 1 88 TYR QD 3.200 . 4.300 3.440 2.952 3.879 . 0 0 "[ . 1 . 2 . 3]" 1 1197 1 37 ARG QB 1 88 TYR QD 3.200 . 4.300 3.425 2.881 3.996 . 0 0 "[ . 1 . 2 . 3]" 1 1198 1 43 TRP HH2 1 88 TYR H 4.200 . 5.000 3.889 3.617 4.424 . 0 0 "[ . 1 . 2 . 3]" 1 1199 1 88 TYR HA 1 89 ARG H 3.300 . 4.000 2.426 2.320 2.545 . 0 0 "[ . 1 . 2 . 3]" 1 1200 1 35 VAL MG1 1 88 TYR HA 3.700 . 4.900 4.272 4.045 4.421 . 0 0 "[ . 1 . 2 . 3]" 1 1201 1 38 LEU MD2 1 88 TYR HA 4.600 . 6.100 6.220 6.134 6.323 0.223 28 0 "[ . 1 . 2 . 3]" 1 1202 1 88 TYR HA 1 118 VAL MG2 4.300 . 5.700 5.168 4.979 5.504 . 0 0 "[ . 1 . 2 . 3]" 1 1203 1 82 LEU HA 1 88 TYR QD 3.500 . 4.700 4.393 3.819 4.749 0.049 22 0 "[ . 1 . 2 . 3]" 1 1204 1 88 TYR HB3 1 88 TYR QD 3.100 . 4.200 2.368 2.303 2.488 . 0 0 "[ . 1 . 2 . 3]" 1 1205 1 88 TYR QD 1 89 ARG H 3.700 . 4.900 3.516 3.101 3.746 . 0 0 "[ . 1 . 2 . 3]" 1 1206 1 83 ASP QB 1 88 TYR QE 4.000 . 5.500 3.150 2.299 4.650 . 0 0 "[ . 1 . 2 . 3]" 1 1207 1 88 TYR H 1 88 TYR HB3 3.700 . 4.400 3.651 3.539 3.769 . 0 0 "[ . 1 . 2 . 3]" 1 1208 1 43 TRP HZ3 1 88 TYR HA 3.400 . 4.100 2.351 2.314 2.597 . 0 0 "[ . 1 . 2 . 3]" 1 1209 1 88 TYR HB2 1 88 TYR QD 3.100 . 4.200 2.513 2.346 2.713 . 0 0 "[ . 1 . 2 . 3]" 1 1210 1 87 ILE MD 1 88 TYR H 3.300 . 4.500 4.431 4.179 4.577 0.077 28 0 "[ . 1 . 2 . 3]" 1 1211 1 82 LEU MD2 1 88 TYR QE 3.400 . 5.100 3.598 3.127 4.144 . 0 0 "[ . 1 . 2 . 3]" 1 1212 1 87 ILE MG 1 88 TYR HA 3.200 . 4.300 3.918 3.784 4.052 . 0 0 "[ . 1 . 2 . 3]" 1 1213 1 46 MET ME 1 88 TYR QE 2.900 . 4.500 2.168 2.033 2.762 . 0 0 "[ . 1 . 2 . 3]" 1 1214 1 35 VAL MG2 1 88 TYR HB2 3.200 . 5.300 5.363 5.286 5.454 0.154 26 0 "[ . 1 . 2 . 3]" 1 1215 1 35 VAL MG1 1 88 TYR HB2 3.500 . 4.700 4.448 3.874 4.746 0.046 14 0 "[ . 1 . 2 . 3]" 1 1216 1 82 LEU QB 1 88 TYR QD 4.000 . 5.500 3.830 2.607 4.424 . 0 0 "[ . 1 . 2 . 3]" 1 1217 1 82 LEU QB 1 88 TYR QE 4.000 . 5.500 4.389 3.351 5.084 . 0 0 "[ . 1 . 2 . 3]" 1 1218 1 36 GLU H 1 88 TYR QB 4.400 . 5.000 3.934 3.574 4.409 . 0 0 "[ . 1 . 2 . 3]" 1 1219 1 43 TRP HE3 1 88 TYR HA 4.600 . 5.500 4.623 4.590 4.754 . 0 0 "[ . 1 . 2 . 3]" 1 1220 1 88 TYR HA 1 88 TYR QD 3.400 . 4.600 2.905 2.708 3.091 . 0 0 "[ . 1 . 2 . 3]" 1 1221 1 87 ILE HA 1 88 TYR H 3.200 . 3.800 2.125 2.108 2.173 . 0 0 "[ . 1 . 2 . 3]" 1 1222 1 36 GLU HA 1 88 TYR HA 3.700 . 5.600 5.605 5.521 5.720 0.120 28 0 "[ . 1 . 2 . 3]" 1 1223 1 88 TYR H 1 89 ARG H 3.900 . 4.700 4.489 4.450 4.519 . 0 0 "[ . 1 . 2 . 3]" 1 1224 1 88 TYR HA 1 88 TYR QE 3.900 . 5.200 4.510 4.391 4.640 . 0 0 "[ . 1 . 2 . 3]" 1 1225 1 43 TRP HH2 1 88 TYR HA 3.300 . 4.000 3.106 2.824 3.594 . 0 0 "[ . 1 . 2 . 3]" 1 1226 1 37 ARG HA 1 88 TYR HA 3.300 . 4.000 2.747 2.535 2.934 . 0 0 "[ . 1 . 2 . 3]" 1 1227 1 43 TRP HE3 1 89 ARG H 5.000 . 5.500 4.793 4.551 4.997 . 0 0 "[ . 1 . 2 . 3]" 1 1228 1 89 ARG H 1 90 VAL H 4.200 . 5.000 3.897 3.699 4.056 . 0 0 "[ . 1 . 2 . 3]" 1 1229 1 43 TRP HH2 1 89 ARG H 3.500 . 4.200 3.973 3.709 4.222 0.022 29 0 "[ . 1 . 2 . 3]" 1 1230 1 43 TRP HH2 1 89 ARG HA 4.000 . 4.800 4.542 4.328 4.764 . 0 0 "[ . 1 . 2 . 3]" 1 1231 1 88 TYR HB2 1 89 ARG H 3.500 . 4.200 3.668 3.455 3.901 . 0 0 "[ . 1 . 2 . 3]" 1 1232 1 88 TYR HB3 1 89 ARG H 3.500 . 4.200 2.349 2.101 2.578 . 0 0 "[ . 1 . 2 . 3]" 1 1233 1 37 ARG HA 1 89 ARG H 4.000 . 4.800 4.201 3.946 4.335 . 0 0 "[ . 1 . 2 . 3]" 1 1234 1 89 ARG H 1 89 ARG HB2 3.500 . 4.200 3.481 3.304 3.721 . 0 0 "[ . 1 . 2 . 3]" 1 1235 1 89 ARG HA 1 90 VAL H 3.200 . 3.800 2.171 2.154 2.209 . 0 0 "[ . 1 . 2 . 3]" 1 1236 1 89 ARG H 1 89 ARG HB3 3.900 . 4.700 2.960 2.867 3.057 . 0 0 "[ . 1 . 2 . 3]" 1 1237 1 36 GLU QG 1 89 ARG H 4.200 . 5.200 5.104 4.919 5.217 0.017 11 0 "[ . 1 . 2 . 3]" 1 1238 1 36 GLU QG 1 89 ARG QB 4.200 . 5.200 4.294 3.989 4.519 . 0 0 "[ . 1 . 2 . 3]" 1 1239 1 43 TRP HZ3 1 89 ARG H 3.600 . 4.300 3.419 3.177 3.610 . 0 0 "[ . 1 . 2 . 3]" 1 1240 1 89 ARG H 1 90 VAL MG1 3.400 . 4.600 4.428 4.266 4.620 0.020 7 0 "[ . 1 . 2 . 3]" 1 1241 1 87 ILE MD 1 89 ARG HB2 4.600 . 5.800 4.390 4.198 4.623 . 0 0 "[ . 1 . 2 . 3]" 1 1242 1 43 TRP HZ3 1 89 ARG HA 4.300 . 5.500 5.398 5.236 5.538 0.038 20 0 "[ . 1 . 2 . 3]" 1 1243 1 87 ILE MD 1 89 ARG HB3 4.100 . 5.700 5.343 4.995 5.666 . 0 0 "[ . 1 . 2 . 3]" 1 1244 1 90 VAL H 1 120 LEU MD1 4.100 . 5.400 4.556 4.396 4.695 . 0 0 "[ . 1 . 2 . 3]" 1 1245 1 90 VAL H 1 90 VAL MG2 3.400 . 4.600 3.573 3.523 3.603 . 0 0 "[ . 1 . 2 . 3]" 1 1246 1 90 VAL MG2 1 120 LEU MD2 2.700 . 4.200 3.411 3.256 3.512 . 0 0 "[ . 1 . 2 . 3]" 1 1247 1 90 VAL MG2 1 91 THR H 3.200 . 4.300 2.260 2.104 2.767 . 0 0 "[ . 1 . 2 . 3]" 1 1248 1 35 VAL MG1 1 90 VAL H 4.400 . 5.800 5.244 4.780 5.517 . 0 0 "[ . 1 . 2 . 3]" 1 1249 1 89 ARG HB2 1 90 VAL H 4.600 . 5.500 4.358 4.068 4.507 . 0 0 "[ . 1 . 2 . 3]" 1 1250 1 89 ARG HB3 1 90 VAL H 4.200 . 5.000 4.385 4.218 4.502 . 0 0 "[ . 1 . 2 . 3]" 1 1251 1 88 TYR HB2 1 90 VAL H 4.500 . 6.300 5.675 5.387 5.987 . 0 0 "[ . 1 . 2 . 3]" 1 1252 1 73 PHE QE 1 90 VAL MG1 3.500 . 5.200 3.299 3.048 3.571 . 0 0 "[ . 1 . 2 . 3]" 1 1253 1 73 PHE HZ 1 90 VAL MG1 3.100 . 4.200 2.530 2.290 2.776 . 0 0 "[ . 1 . 2 . 3]" 1 1254 1 90 VAL MG1 1 92 TRP HZ2 3.900 . 5.700 5.342 5.004 5.546 . 0 0 "[ . 1 . 2 . 3]" 1 1255 1 90 VAL H 1 118 VAL MG2 3.800 . 5.100 2.822 2.605 3.085 . 0 0 "[ . 1 . 2 . 3]" 1 1256 1 90 VAL H 1 120 LEU HA 4.200 . 5.000 2.989 2.793 3.191 . 0 0 "[ . 1 . 2 . 3]" 1 1257 1 82 LEU MD1 1 90 VAL MG1 3.400 . 5.100 4.106 3.644 4.492 . 0 0 "[ . 1 . 2 . 3]" 1 1258 1 82 LEU MD2 1 90 VAL MG1 3.700 . 5.400 4.433 3.668 4.784 . 0 0 "[ . 1 . 2 . 3]" 1 1259 1 90 VAL HB 1 120 LEU MD2 3.700 . 5.900 5.938 5.744 6.084 0.184 21 0 "[ . 1 . 2 . 3]" 1 1260 1 90 VAL MG2 1 92 TRP HA 3.700 . 4.900 3.937 3.837 4.057 . 0 0 "[ . 1 . 2 . 3]" 1 1261 1 90 VAL H 1 120 LEU MD2 3.800 . 5.600 5.395 5.229 5.578 . 0 0 "[ . 1 . 2 . 3]" 1 1262 1 90 VAL MG1 1 90 VAL MG2 2.700 . 4.200 2.074 2.058 2.082 . 0 0 "[ . 1 . 2 . 3]" 1 1263 1 90 VAL MG2 1 92 TRP HE1 3.100 . 4.200 2.380 2.130 2.463 . 0 0 "[ . 1 . 2 . 3]" 1 1264 1 35 VAL MG1 1 90 VAL MG1 3.000 . 4.600 4.575 4.104 4.733 0.133 26 0 "[ . 1 . 2 . 3]" 1 1265 1 90 VAL H 1 90 VAL HB 3.400 . 4.100 3.230 3.127 3.331 . 0 0 "[ . 1 . 2 . 3]" 1 1266 1 90 VAL HB 1 118 VAL MG1 2.900 . 6.600 6.139 5.829 6.374 . 0 0 "[ . 1 . 2 . 3]" 1 1267 1 90 VAL MG1 1 120 LEU HA 3.700 . 4.900 2.297 2.272 2.374 . 0 0 "[ . 1 . 2 . 3]" 1 1268 1 90 VAL MG2 1 92 TRP HD1 3.300 . 4.500 2.180 2.086 2.276 . 0 0 "[ . 1 . 2 . 3]" 1 1269 1 82 LEU MD1 1 90 VAL MG2 3.700 . 5.800 5.604 5.079 5.830 0.030 15 0 "[ . 1 . 2 . 3]" 1 1270 1 35 VAL MG2 1 90 VAL MG2 2.900 . 4.500 3.376 3.087 3.563 . 0 0 "[ . 1 . 2 . 3]" 1 1271 1 35 VAL MG1 1 90 VAL MG2 3.700 . 5.400 5.086 4.743 5.241 . 0 0 "[ . 1 . 2 . 3]" 1 1272 1 90 VAL HA 1 90 VAL MG1 3.500 . 4.700 3.119 3.092 3.133 . 0 0 "[ . 1 . 2 . 3]" 1 1273 1 82 LEU HG 1 90 VAL MG1 4.000 . 6.600 6.466 6.181 6.659 0.059 2 0 "[ . 1 . 2 . 3]" 1 1274 1 82 LEU MD2 1 90 VAL MG2 3.600 . 5.900 5.678 5.125 5.942 0.042 17 0 "[ . 1 . 2 . 3]" 1 1275 1 90 VAL H 1 90 VAL MG1 3.200 . 4.300 1.787 1.755 1.846 0.045 28 0 "[ . 1 . 2 . 3]" 1 1276 1 90 VAL HB 1 120 LEU HA 3.700 . 5.000 5.088 5.044 5.164 0.164 26 0 "[ . 1 . 2 . 3]" 1 1277 1 33 TYR HB3 1 90 VAL MG2 3.700 . 4.900 4.061 3.927 4.208 . 0 0 "[ . 1 . 2 . 3]" 1 1278 1 90 VAL MG2 1 120 LEU HB3 2.700 . 5.200 4.942 4.865 4.989 . 0 0 "[ . 1 . 2 . 3]" 1 1279 1 90 VAL MG1 1 91 THR H 3.800 . 5.100 4.172 4.106 4.311 . 0 0 "[ . 1 . 2 . 3]" 1 1280 1 90 VAL H 1 91 THR H 4.500 . 5.400 4.536 4.406 4.583 . 0 0 "[ . 1 . 2 . 3]" 1 1281 1 91 THR MG 1 92 TRP H 3.300 . 4.500 2.308 2.056 2.752 . 0 0 "[ . 1 . 2 . 3]" 1 1282 1 91 THR HA 1 91 THR MG 2.800 . 3.900 2.225 2.129 2.329 . 0 0 "[ . 1 . 2 . 3]" 1 1283 1 91 THR MG 1 93 PHE H 3.900 . 5.200 4.708 4.124 5.240 0.040 11 0 "[ . 1 . 2 . 3]" 1 1284 1 91 THR HA 1 120 LEU MD2 3.300 . 6.000 4.183 3.749 4.627 . 0 0 "[ . 1 . 2 . 3]" 1 1285 1 91 THR MG 1 122 ILE HA 4.000 . 5.300 4.350 4.021 4.967 . 0 0 "[ . 1 . 2 . 3]" 1 1286 1 91 THR MG 1 92 TRP HA 3.900 . 5.200 4.171 3.739 4.661 . 0 0 "[ . 1 . 2 . 3]" 1 1287 1 33 TYR HA 1 91 THR H 4.200 . 5.000 4.396 4.192 4.806 . 0 0 "[ . 1 . 2 . 3]" 1 1288 1 36 GLU H 1 91 THR H 5.000 . 6.000 4.960 4.589 5.380 . 0 0 "[ . 1 . 2 . 3]" 1 1289 1 34 GLU HA 1 91 THR H 5.200 . 6.200 4.774 4.574 5.089 . 0 0 "[ . 1 . 2 . 3]" 1 1290 1 91 THR MG 1 93 PHE HZ 3.200 . 4.300 3.512 2.293 4.353 0.053 17 0 "[ . 1 . 2 . 3]" 1 1291 1 91 THR H 1 91 THR MG 3.100 . 4.200 3.853 3.732 3.896 . 0 0 "[ . 1 . 2 . 3]" 1 1292 1 91 THR H 1 91 THR HB 3.600 . 4.300 2.835 2.456 3.115 . 0 0 "[ . 1 . 2 . 3]" 1 1293 1 90 VAL HA 1 91 THR H 3.200 . 3.800 2.211 2.134 2.251 . 0 0 "[ . 1 . 2 . 3]" 1 1294 1 35 VAL HA 1 91 THR H 3.700 . 4.400 3.969 3.694 4.169 . 0 0 "[ . 1 . 2 . 3]" 1 1295 1 91 THR MG 1 123 PHE H 3.500 . 4.700 4.758 4.499 4.853 0.153 15 0 "[ . 1 . 2 . 3]" 1 1296 1 91 THR HA 1 92 TRP H 2.900 . 3.500 2.173 2.151 2.194 . 0 0 "[ . 1 . 2 . 3]" 1 1297 1 31 LEU MD2 1 92 TRP HZ2 4.300 . 5.700 3.559 3.183 4.082 . 0 0 "[ . 1 . 2 . 3]" 1 1298 1 92 TRP HE1 1 120 LEU MD1 3.600 . 4.800 2.606 2.351 2.754 . 0 0 "[ . 1 . 2 . 3]" 1 1299 1 92 TRP HE1 1 120 LEU HG 3.100 . 3.700 3.874 3.786 3.966 0.266 12 0 "[ . 1 . 2 . 3]" 1 1300 1 92 TRP HD1 1 120 LEU MD1 3.800 . 5.100 3.683 3.437 3.859 . 0 0 "[ . 1 . 2 . 3]" 1 1301 1 33 TYR QD 1 92 TRP HZ2 3.000 . 6.600 6.230 5.907 6.535 . 0 0 "[ . 1 . 2 . 3]" 1 1302 1 92 TRP HD1 1 93 PHE H 3.800 . 4.600 4.477 4.380 4.607 0.007 17 0 "[ . 1 . 2 . 3]" 1 1303 1 92 TRP H 1 92 TRP HB3 3.800 . 4.600 3.522 3.451 3.577 . 0 0 "[ . 1 . 2 . 3]" 1 1304 1 92 TRP H 1 92 TRP HB2 3.800 . 4.600 2.304 2.258 2.342 . 0 0 "[ . 1 . 2 . 3]" 1 1305 1 90 VAL MG2 1 92 TRP HZ2 3.400 . 4.600 4.631 4.334 4.742 0.142 14 0 "[ . 1 . 2 . 3]" 1 1306 1 31 LEU MD1 1 92 TRP HZ2 3.800 . 5.100 4.269 3.876 4.680 . 0 0 "[ . 1 . 2 . 3]" 1 1307 1 74 LEU MD1 1 92 TRP HZ2 3.400 . 4.600 3.408 2.957 4.124 . 0 0 "[ . 1 . 2 . 3]" 1 1308 1 74 LEU MD1 1 92 TRP HH2 3.800 . 5.100 3.627 2.913 4.683 . 0 0 "[ . 1 . 2 . 3]" 1 1309 1 92 TRP QB 1 93 PHE H 4.000 . 5.000 3.368 3.330 3.412 . 0 0 "[ . 1 . 2 . 3]" 1 1310 1 33 TYR HA 1 92 TRP HA 3.500 . 4.200 2.803 2.544 2.906 . 0 0 "[ . 1 . 2 . 3]" 1 1311 1 34 GLU H 1 92 TRP HA 4.100 . 4.900 4.245 4.045 4.396 . 0 0 "[ . 1 . 2 . 3]" 1 1312 1 33 TYR HB3 1 92 TRP HA 3.800 . 4.600 4.394 3.971 4.561 . 0 0 "[ . 1 . 2 . 3]" 1 1313 1 33 TYR HB3 1 92 TRP HD1 3.200 . 4.300 4.058 3.657 4.368 0.068 25 0 "[ . 1 . 2 . 3]" 1 1314 1 92 TRP HD1 1 122 ILE MG 5.400 . 6.800 5.592 5.238 5.993 . 0 0 "[ . 1 . 2 . 3]" 1 1315 1 92 TRP H 1 122 ILE HA 2.800 . 3.400 3.110 2.779 3.454 0.054 2 0 "[ . 1 . 2 . 3]" 1 1316 1 31 LEU MD1 1 92 TRP HE1 3.700 . 4.900 3.758 3.419 4.297 . 0 0 "[ . 1 . 2 . 3]" 1 1317 1 92 TRP HA 1 120 LEU MD2 3.800 . 5.600 4.534 4.337 4.720 . 0 0 "[ . 1 . 2 . 3]" 1 1318 1 31 LEU MD1 1 92 TRP HA 3.900 . 5.200 2.974 2.729 3.935 . 0 0 "[ . 1 . 2 . 3]" 1 1319 1 33 TYR HB3 1 92 TRP HE1 3.700 . 4.400 3.738 3.443 4.295 . 0 0 "[ . 1 . 2 . 3]" 1 1320 1 31 LEU MD2 1 92 TRP HH2 3.900 . 5.200 3.551 3.194 4.609 . 0 0 "[ . 1 . 2 . 3]" 1 1321 1 92 TRP H 1 120 LEU MD2 4.300 . 5.700 3.656 3.296 3.996 . 0 0 "[ . 1 . 2 . 3]" 1 1322 1 73 PHE HB3 1 92 TRP HZ2 3.600 . 4.300 2.353 2.292 2.587 . 0 0 "[ . 1 . 2 . 3]" 1 1323 1 73 PHE HB2 1 92 TRP HZ2 3.900 . 4.700 3.064 2.877 3.248 . 0 0 "[ . 1 . 2 . 3]" 1 1324 1 53 LEU MD2 1 92 TRP HZ2 4.500 . 6.700 6.528 5.171 6.897 0.197 4 0 "[ . 1 . 2 . 3]" 1 1325 1 73 PHE HA 1 92 TRP HH2 4.100 . 5.900 6.165 6.026 6.278 0.378 28 0 "[ . 1 . 2 . 3]" 1 1326 1 92 TRP HH2 1 108 VAL HB 3.700 . 4.400 4.313 3.732 4.586 0.186 5 0 "[ . 1 . 2 . 3]" 1 1327 1 92 TRP HA 1 93 PHE H 3.300 . 4.000 2.163 2.127 2.211 . 0 0 "[ . 1 . 2 . 3]" 1 1328 1 77 VAL MG2 1 92 TRP HE1 4.800 3.800 5.800 5.061 4.687 5.698 . 0 0 "[ . 1 . 2 . 3]" 1 1329 1 92 TRP HA 1 93 PHE QD 4.000 . 5.300 4.267 3.831 4.654 . 0 0 "[ . 1 . 2 . 3]" 1 1330 1 92 TRP HA 1 92 TRP HD1 3.000 . 4.600 2.355 2.299 2.438 . 0 0 "[ . 1 . 2 . 3]" 1 1331 1 90 VAL MG1 1 92 TRP HE1 4.400 . 5.800 3.764 3.609 3.906 . 0 0 "[ . 1 . 2 . 3]" 1 1332 1 92 TRP H 1 120 LEU MD1 4.000 . 5.300 5.327 5.210 5.396 0.096 24 0 "[ . 1 . 2 . 3]" 1 1333 1 91 THR H 1 92 TRP H 3.900 . 4.700 4.457 4.413 4.549 . 0 0 "[ . 1 . 2 . 3]" 1 1334 1 73 PHE HA 1 92 TRP HZ2 3.500 . 4.800 4.826 4.766 4.924 0.124 8 0 "[ . 1 . 2 . 3]" 1 1335 1 93 PHE H 1 93 PHE QD 3.300 . 5.000 3.370 2.858 3.658 . 0 0 "[ . 1 . 2 . 3]" 1 1336 1 32 CYS H 1 93 PHE H 2.800 . 3.400 2.758 2.414 3.277 . 0 0 "[ . 1 . 2 . 3]" 1 1337 1 93 PHE HA 1 93 PHE QD 3.500 . 5.200 2.574 2.328 2.983 . 0 0 "[ . 1 . 2 . 3]" 1 1338 1 93 PHE H 1 93 PHE HB3 4.200 . 5.000 3.594 3.464 3.800 . 0 0 "[ . 1 . 2 . 3]" 1 1339 1 93 PHE HB3 1 93 PHE QD 2.800 . 4.400 2.468 2.311 2.602 . 0 0 "[ . 1 . 2 . 3]" 1 1340 1 93 PHE HA 1 94 ILE MG 3.900 . 5.200 3.613 3.506 4.996 . 0 0 "[ . 1 . 2 . 3]" 1 1341 1 93 PHE HA 1 123 PHE H 4.000 . 4.800 3.652 3.277 3.881 . 0 0 "[ . 1 . 2 . 3]" 1 1342 1 93 PHE QD 1 123 PHE QD 3.500 . 5.200 4.121 2.927 5.032 . 0 0 "[ . 1 . 2 . 3]" 1 1343 1 31 LEU MD1 1 93 PHE H 3.800 . 5.200 2.893 2.559 4.174 . 0 0 "[ . 1 . 2 . 3]" 1 1344 1 31 LEU MD2 1 93 PHE H 4.000 . 5.400 5.293 4.783 5.554 0.154 9 0 "[ . 1 . 2 . 3]" 1 1345 1 93 PHE QD 1 94 ILE H 3.700 . 5.400 4.093 3.635 4.488 . 0 0 "[ . 1 . 2 . 3]" 1 1346 1 91 THR MG 1 93 PHE QD 3.100 . 4.700 3.191 2.226 3.997 . 0 0 "[ . 1 . 2 . 3]" 1 1347 1 91 THR MG 1 93 PHE QE 4.000 . 6.000 2.410 2.143 3.070 . 0 0 "[ . 1 . 2 . 3]" 1 1348 1 93 PHE QD 1 123 PHE HB3 3.700 . 4.900 3.615 2.339 4.943 0.043 24 0 "[ . 1 . 2 . 3]" 1 1349 1 32 CYS HB3 1 93 PHE H 3.600 . 4.300 4.029 3.272 4.617 0.317 27 0 "[ . 1 . 2 . 3]" 1 1350 1 93 PHE HA 1 94 ILE H 3.500 . 4.200 2.161 2.135 2.188 . 0 0 "[ . 1 . 2 . 3]" 1 1351 1 93 PHE QE 1 123 PHE QD 3.600 . 5.300 3.463 2.607 4.542 . 0 0 "[ . 1 . 2 . 3]" 1 1352 1 94 ILE H 1 94 ILE MG 3.300 . 5.000 1.842 1.744 3.647 0.056 19 0 "[ . 1 . 2 . 3]" 1 1353 1 94 ILE H 1 125 ALA H 4.300 . 5.200 4.510 4.080 4.689 . 0 0 "[ . 1 . 2 . 3]" 1 1354 1 93 PHE H 1 94 ILE H 4.700 . 5.600 4.069 4.013 4.231 . 0 0 "[ . 1 . 2 . 3]" 1 1355 1 94 ILE H 1 123 PHE H 4.800 3.800 5.800 3.715 3.634 3.787 0.166 30 0 "[ . 1 . 2 . 3]" 1 1356 1 94 ILE H 1 94 ILE MD 4.200 . 5.500 4.549 3.575 4.635 . 0 0 "[ . 1 . 2 . 3]" 1 1357 1 94 ILE HG12 1 124 ALA HA 3.200 . 3.800 3.920 3.829 4.029 0.229 10 0 "[ . 1 . 2 . 3]" 1 1358 1 94 ILE H 1 94 ILE HG13 4.000 . 5.300 4.401 1.838 4.538 . 0 0 "[ . 1 . 2 . 3]" 1 1359 1 94 ILE HG13 1 124 ALA HA 4.200 . 5.000 4.990 2.297 5.172 0.172 27 0 "[ . 1 . 2 . 3]" 1 1360 1 94 ILE HA 1 125 ALA MB 5.000 . 6.500 5.298 5.093 5.542 . 0 0 "[ . 1 . 2 . 3]" 1 1361 1 31 LEU MD2 1 94 ILE MG 4.900 . 6.400 4.975 3.667 5.855 . 0 0 "[ . 1 . 2 . 3]" 1 1362 1 31 LEU MD1 1 94 ILE MG 3.900 . 5.200 4.293 3.743 4.726 . 0 0 "[ . 1 . 2 . 3]" 1 1363 1 94 ILE MG 1 124 ALA HA 3.200 . 4.300 2.174 2.051 4.304 0.004 30 0 "[ . 1 . 2 . 3]" 1 1364 1 94 ILE HB 1 94 ILE HG13 2.800 . 3.700 2.641 2.477 2.698 . 0 0 "[ . 1 . 2 . 3]" 1 1365 1 17 PHE QE 1 94 ILE H 4.300 . 7.200 4.769 3.653 6.494 . 0 0 "[ . 1 . 2 . 3]" 1 1366 1 94 ILE H 1 122 ILE HA 4.800 3.800 5.800 5.462 4.865 5.648 . 0 0 "[ . 1 . 2 . 3]" 1 1367 1 94 ILE HB 1 94 ILE MG 2.400 . 3.700 2.125 2.092 2.140 . 0 0 "[ . 1 . 2 . 3]" 1 1368 1 31 LEU HA 1 94 ILE MG 3.100 . 4.700 4.464 2.684 4.719 0.019 16 0 "[ . 1 . 2 . 3]" 1 1369 1 31 LEU HA 1 94 ILE MD 5.000 . 6.000 3.756 3.444 4.971 . 0 0 "[ . 1 . 2 . 3]" 1 1370 1 31 LEU HA 1 94 ILE HA 3.100 . 4.000 2.490 2.289 2.840 . 0 0 "[ . 1 . 2 . 3]" 1 1371 1 94 ILE MD 1 96 TRP QB 3.300 . 4.700 3.351 2.713 4.825 0.125 30 0 "[ . 1 . 2 . 3]" 1 1372 1 94 ILE HB 1 124 ALA HA 3.800 . 4.600 4.676 2.818 4.907 0.307 1 0 "[ . 1 . 2 . 3]" 1 1373 1 32 CYS H 1 94 ILE HG13 3.800 . 5.600 5.485 5.202 5.698 0.098 30 0 "[ . 1 . 2 . 3]" 1 1374 1 17 PHE QE 1 94 ILE HA 4.400 . 6.800 4.494 3.370 5.474 . 0 0 "[ . 1 . 2 . 3]" 1 1375 1 94 ILE MG 1 96 TRP HA 3.500 . 5.200 4.502 3.937 5.181 . 0 0 "[ . 1 . 2 . 3]" 1 1376 1 94 ILE MG 1 96 TRP H 3.800 . 5.100 2.587 2.171 3.137 . 0 0 "[ . 1 . 2 . 3]" 1 1377 1 31 LEU HG 1 94 ILE MG 3.800 . 6.900 6.459 4.636 6.901 0.001 7 0 "[ . 1 . 2 . 3]" 1 1378 1 94 ILE MD 1 94 ILE MG 3.200 . 4.300 2.275 1.907 2.429 . 0 0 "[ . 1 . 2 . 3]" 1 1379 1 94 ILE MG 1 122 ILE MG 3.200 . 4.800 2.737 2.028 4.200 . 0 0 "[ . 1 . 2 . 3]" 1 1380 1 31 LEU HB3 1 94 ILE MD 3.400 . 4.600 3.642 2.681 4.623 0.023 21 0 "[ . 1 . 2 . 3]" 1 1381 1 31 LEU HB2 1 94 ILE MD 3.600 . 5.300 3.052 2.375 4.026 . 0 0 "[ . 1 . 2 . 3]" 1 1382 1 94 ILE HA 1 94 ILE MD 3.700 . 5.400 3.531 3.390 4.000 . 0 0 "[ . 1 . 2 . 3]" 1 1383 1 94 ILE HA 1 96 TRP H 4.000 . 4.800 4.060 3.710 4.302 . 0 0 "[ . 1 . 2 . 3]" 1 1384 1 94 ILE HA 1 94 ILE HG13 3.800 . 4.600 2.469 2.364 3.610 . 0 0 "[ . 1 . 2 . 3]" 1 1385 1 94 ILE HB 1 95 SER H 3.700 . 4.400 3.872 3.334 4.006 . 0 0 "[ . 1 . 2 . 3]" 1 1386 1 94 ILE QG 1 95 SER H 4.000 . 5.000 2.039 1.753 4.513 0.047 10 0 "[ . 1 . 2 . 3]" 1 1387 1 94 ILE MG 1 95 SER H 3.200 . 4.300 3.847 2.617 4.102 . 0 0 "[ . 1 . 2 . 3]" 1 1388 1 17 PHE QE 1 95 SER H 4.000 . 5.500 4.335 3.276 5.163 . 0 0 "[ . 1 . 2 . 3]" 1 1389 1 94 ILE HA 1 95 SER H 3.700 . 4.400 2.228 2.138 2.345 . 0 0 "[ . 1 . 2 . 3]" 1 1390 1 96 TRP HZ3 1 128 TYR QD 4.500 . 5.900 4.120 3.259 4.618 . 0 0 "[ . 1 . 2 . 3]" 1 1391 1 96 TRP HZ3 1 127 ILE QG 5.000 . 6.000 4.166 2.782 5.341 . 0 0 "[ . 1 . 2 . 3]" 1 1392 1 29 THR MG 1 96 TRP H 4.100 . 5.400 4.853 3.989 5.463 0.063 25 0 "[ . 1 . 2 . 3]" 1 1393 1 96 TRP H 1 96 TRP HB3 3.500 . 4.200 3.606 3.206 3.926 . 0 0 "[ . 1 . 2 . 3]" 1 1394 1 96 TRP H 1 96 TRP HB2 3.800 . 4.600 3.449 2.941 4.022 . 0 0 "[ . 1 . 2 . 3]" 1 1395 1 96 TRP HB2 1 96 TRP HE3 3.400 . 4.100 3.658 2.652 4.241 0.141 2 0 "[ . 1 . 2 . 3]" 1 1396 1 96 TRP HZ3 1 128 TYR HA 3.000 . 4.400 3.135 2.335 4.289 . 0 0 "[ . 1 . 2 . 3]" 1 1397 1 96 TRP HZ3 1 128 TYR QB 4.000 . 5.000 3.337 2.129 5.009 0.009 1 0 "[ . 1 . 2 . 3]" 1 1398 1 96 TRP HE3 1 127 ILE HB 4.100 . 5.900 5.562 4.274 5.977 0.077 25 0 "[ . 1 . 2 . 3]" 1 1399 1 96 TRP HE3 1 128 TYR HA 3.000 . 4.600 3.892 3.132 4.522 . 0 0 "[ . 1 . 2 . 3]" 1 1400 1 96 TRP HE3 1 129 ASP H 3.800 . 5.600 5.593 4.933 5.891 0.291 20 0 "[ . 1 . 2 . 3]" 1 1401 1 96 TRP HA 1 96 TRP HZ3 4.900 . 7.100 4.797 4.425 5.661 . 0 0 "[ . 1 . 2 . 3]" 1 1402 1 94 ILE MG 1 97 SER H 3.900 . 5.200 4.541 3.767 5.165 . 0 0 "[ . 1 . 2 . 3]" 1 1403 1 97 SER H 1 124 ALA MB 3.800 . 5.100 3.588 2.186 4.477 . 0 0 "[ . 1 . 2 . 3]" 1 1404 1 96 TRP HA 1 97 SER H 3.900 . 4.700 2.529 2.138 3.091 . 0 0 "[ . 1 . 2 . 3]" 1 1405 1 97 SER H 1 97 SER HB3 3.400 . 4.600 2.788 2.101 3.549 . 0 0 "[ . 1 . 2 . 3]" 1 1406 1 97 SER H 1 124 ALA HA 5.300 . 6.200 5.648 4.396 6.351 0.151 25 0 "[ . 1 . 2 . 3]" 1 1407 1 97 SER H 1 97 SER HB2 3.800 . 5.100 3.193 2.116 3.763 . 0 0 "[ . 1 . 2 . 3]" 1 1408 1 97 SER H 1 128 TYR H 3.800 . 5.100 3.895 3.243 4.714 . 0 0 "[ . 1 . 2 . 3]" 1 1409 1 98 PRO HA 1 99 CYS H 3.400 . 4.100 2.426 2.314 2.507 . 0 0 "[ . 1 . 2 . 3]" 1 1410 1 99 CYS H 1 99 CYS HB3 3.400 . 4.100 2.970 2.253 3.693 . 0 0 "[ . 1 . 2 . 3]" 1 1411 1 98 PRO HB3 1 99 CYS H 3.200 . 3.800 3.246 2.741 3.579 . 0 0 "[ . 1 . 2 . 3]" 1 1412 1 99 CYS H 1 99 CYS HA 2.600 . 3.100 2.884 2.798 2.944 . 0 0 "[ . 1 . 2 . 3]" 1 1413 1 100 PHE QE 1 101 SER H 4.500 . 5.900 3.296 3.117 3.482 . 0 0 "[ . 1 . 2 . 3]" 1 1414 1 100 PHE QD 1 133 LEU MD1 3.600 . 4.800 4.073 2.067 4.845 0.045 27 0 "[ . 1 . 2 . 3]" 1 1415 1 100 PHE QE 1 137 ALA MB 3.300 . 5.000 3.882 2.985 4.646 . 0 0 "[ . 1 . 2 . 3]" 1 1416 1 100 PHE HB3 1 100 PHE QE 3.400 . 5.100 4.439 4.417 4.486 . 0 0 "[ . 1 . 2 . 3]" 1 1417 1 100 PHE H 1 100 PHE QE 4.200 . 6.500 6.303 6.108 6.482 . 0 0 "[ . 1 . 2 . 3]" 1 1418 1 100 PHE H 1 100 PHE HB3 3.600 . 4.800 2.876 2.351 3.314 . 0 0 "[ . 1 . 2 . 3]" 1 1419 1 100 PHE QD 1 105 ALA MB 3.000 . 5.200 4.730 3.796 5.313 0.113 21 0 "[ . 1 . 2 . 3]" 1 1420 1 100 PHE QD 1 137 ALA HA 3.200 . 5.500 4.927 3.407 5.567 0.067 16 0 "[ . 1 . 2 . 3]" 1 1421 1 100 PHE H 1 100 PHE HB2 3.700 . 4.900 3.041 2.299 3.681 . 0 0 "[ . 1 . 2 . 3]" 1 1422 1 100 PHE QD 1 133 LEU HG 3.500 . 4.700 3.605 2.369 4.761 0.061 9 0 "[ . 1 . 2 . 3]" 1 1423 1 100 PHE H 1 101 SER H 4.000 . 4.800 4.449 4.202 4.627 . 0 0 "[ . 1 . 2 . 3]" 1 1424 1 100 PHE HB2 1 100 PHE QD 2.700 . 4.200 2.498 2.337 2.776 . 0 0 "[ . 1 . 2 . 3]" 1 1425 1 100 PHE QE 1 137 ALA HA 3.300 . 5.200 4.750 3.522 5.294 0.094 16 0 "[ . 1 . 2 . 3]" 1 1426 1 100 PHE H 1 100 PHE QD 3.900 . 5.600 4.314 4.083 4.542 . 0 0 "[ . 1 . 2 . 3]" 1 1427 1 100 PHE QD 1 101 SER H 4.000 . 5.300 2.352 1.751 2.755 0.049 13 0 "[ . 1 . 2 . 3]" 1 1428 1 100 PHE QE 1 101 SER HA 3.200 . 4.800 4.925 4.847 5.080 0.280 16 0 "[ . 1 . 2 . 3]" 1 1429 1 100 PHE QD 1 101 SER HA 3.200 . 4.800 4.151 3.866 4.544 . 0 0 "[ . 1 . 2 . 3]" 1 1430 1 100 PHE HB3 1 100 PHE QD 3.000 . 4.600 2.380 2.308 2.536 . 0 0 "[ . 1 . 2 . 3]" 1 1431 1 101 SER H 1 102 TRP H 4.600 . 5.500 3.222 2.889 3.583 . 0 0 "[ . 1 . 2 . 3]" 1 1432 1 100 PHE HB3 1 101 SER H 4.400 . 5.300 3.525 3.190 4.187 . 0 0 "[ . 1 . 2 . 3]" 1 1433 1 101 SER H 1 104 CYS HA 4.300 . 7.200 7.370 7.265 7.488 0.288 24 0 "[ . 1 . 2 . 3]" 1 1434 1 102 TRP H 1 102 TRP HD1 3.900 . 5.700 2.539 1.931 3.372 . 0 0 "[ . 1 . 2 . 3]" 1 1435 1 101 SER HA 1 102 TRP H 4.000 . 4.800 3.551 3.527 3.576 . 0 0 "[ . 1 . 2 . 3]" 1 1436 1 102 TRP H 1 102 TRP HB2 3.800 . 5.100 2.737 2.295 3.377 . 0 0 "[ . 1 . 2 . 3]" 1 1437 1 102 TRP HA 1 102 TRP HD1 3.300 . 4.500 3.355 2.340 4.221 . 0 0 "[ . 1 . 2 . 3]" 1 1438 1 101 SER HA 1 102 TRP HD1 3.600 . 5.300 5.136 4.690 5.412 0.112 13 0 "[ . 1 . 2 . 3]" 1 1439 1 101 SER H 1 102 TRP HD1 4.200 . 5.000 4.757 4.264 5.104 0.104 10 0 "[ . 1 . 2 . 3]" 1 1440 1 102 TRP HB2 1 102 TRP HD1 3.300 . 4.500 3.379 2.751 3.884 . 0 0 "[ . 1 . 2 . 3]" 1 1441 1 102 TRP H 1 103 GLY H 3.100 . 3.700 2.863 2.737 2.965 . 0 0 "[ . 1 . 2 . 3]" 1 1442 1 103 GLY H 1 103 GLY HA2 2.700 . 3.700 2.921 2.896 2.947 . 0 0 "[ . 1 . 2 . 3]" 1 1443 1 103 GLY H 1 105 ALA H 3.500 . 5.200 4.570 4.236 4.834 . 0 0 "[ . 1 . 2 . 3]" 1 1444 1 103 GLY H 1 107 GLU H 3.100 . 5.700 5.265 4.619 5.737 0.037 23 0 "[ . 1 . 2 . 3]" 1 1445 1 102 TRP HB2 1 103 GLY H 3.900 . 4.700 3.609 3.043 4.340 . 0 0 "[ . 1 . 2 . 3]" 1 1446 1 102 TRP HA 1 103 GLY H 3.900 . 4.700 3.439 3.337 3.483 . 0 0 "[ . 1 . 2 . 3]" 1 1447 1 103 GLY H 1 104 CYS H 2.700 . 3.200 2.954 2.435 3.173 . 0 0 "[ . 1 . 2 . 3]" 1 1448 1 104 CYS H 1 105 ALA H 3.200 . 3.800 2.615 2.370 2.777 . 0 0 "[ . 1 . 2 . 3]" 1 1449 1 104 CYS H 1 104 CYS HB3 3.400 . 4.600 3.587 3.459 3.695 . 0 0 "[ . 1 . 2 . 3]" 1 1450 1 103 GLY HA3 1 104 CYS H 3.400 . 4.100 2.368 2.259 2.709 . 0 0 "[ . 1 . 2 . 3]" 1 1451 1 104 CYS H 1 104 CYS HB2 3.400 . 4.600 2.359 2.226 2.708 . 0 0 "[ . 1 . 2 . 3]" 1 1452 1 100 PHE QD 1 105 ALA H 4.900 . 6.200 5.745 5.280 6.029 . 0 0 "[ . 1 . 2 . 3]" 1 1453 1 105 ALA MB 1 106 GLY H 3.200 . 4.300 2.725 2.258 3.026 . 0 0 "[ . 1 . 2 . 3]" 1 1454 1 105 ALA MB 1 108 VAL MG2 4.000 . 6.000 4.966 4.658 5.216 . 0 0 "[ . 1 . 2 . 3]" 1 1455 1 99 CYS H 1 105 ALA MB 5.000 . 6.500 5.135 3.982 6.357 . 0 0 "[ . 1 . 2 . 3]" 1 1456 1 104 CYS HB3 1 105 ALA H 3.400 . 4.100 2.889 2.454 3.577 . 0 0 "[ . 1 . 2 . 3]" 1 1457 1 105 ALA H 1 108 VAL H 4.000 . 4.700 4.749 4.620 4.854 0.154 11 0 "[ . 1 . 2 . 3]" 1 1458 1 105 ALA HA 1 141 LEU MD2 3.400 . 5.100 4.825 4.040 5.174 0.074 2 0 "[ . 1 . 2 . 3]" 1 1459 1 105 ALA H 1 106 GLY H 3.500 . 4.200 2.949 2.839 3.160 . 0 0 "[ . 1 . 2 . 3]" 1 1460 1 105 ALA H 1 105 ALA HA 3.000 . 3.600 2.723 2.694 2.785 . 0 0 "[ . 1 . 2 . 3]" 1 1461 1 104 CYS HB2 1 105 ALA H 3.700 . 4.400 2.303 2.116 2.480 . 0 0 "[ . 1 . 2 . 3]" 1 1462 1 105 ALA H 1 105 ALA MB 3.000 . 4.100 2.100 2.043 2.140 . 0 0 "[ . 1 . 2 . 3]" 1 1463 1 105 ALA H 1 137 ALA MB 3.400 . 4.600 4.055 3.282 4.633 0.033 23 0 "[ . 1 . 2 . 3]" 1 1464 1 106 GLY H 1 106 GLY HA3 2.900 . 3.500 2.316 2.304 2.331 . 0 0 "[ . 1 . 2 . 3]" 1 1465 1 106 GLY H 1 107 GLU H 3.400 . 4.100 2.749 2.412 3.143 . 0 0 "[ . 1 . 2 . 3]" 1 1466 1 107 GLU H 1 107 GLU HA 2.700 . 3.200 2.857 2.810 2.904 . 0 0 "[ . 1 . 2 . 3]" 1 1467 1 107 GLU H 1 107 GLU HB2 3.100 . 4.200 2.359 2.086 3.604 . 0 0 "[ . 1 . 2 . 3]" 1 1468 1 106 GLY HA3 1 107 GLU H 3.800 . 4.600 2.746 2.563 2.910 . 0 0 "[ . 1 . 2 . 3]" 1 1469 1 106 GLY HA2 1 107 GLU H 3.800 . 4.600 3.552 3.498 3.583 . 0 0 "[ . 1 . 2 . 3]" 1 1470 1 107 GLU H 1 107 GLU HB3 3.500 . 4.200 3.313 2.731 3.615 . 0 0 "[ . 1 . 2 . 3]" 1 1471 1 107 GLU H 1 108 VAL H 3.400 . 4.100 2.595 2.276 2.787 . 0 0 "[ . 1 . 2 . 3]" 1 1472 1 108 VAL H 1 108 VAL HB 3.200 . 3.800 2.124 2.071 2.271 . 0 0 "[ . 1 . 2 . 3]" 1 1473 1 108 VAL MG2 1 111 PHE QD 4.300 . 6.200 3.178 2.550 3.883 . 0 0 "[ . 1 . 2 . 3]" 1 1474 1 108 VAL HA 1 108 VAL MG2 2.500 . 3.500 2.144 2.121 2.190 . 0 0 "[ . 1 . 2 . 3]" 1 1475 1 105 ALA HA 1 108 VAL MG2 3.100 . 4.200 4.020 3.599 4.263 0.063 8 0 "[ . 1 . 2 . 3]" 1 1476 1 108 VAL H 1 108 VAL MG1 3.400 . 4.600 3.075 2.640 3.601 . 0 0 "[ . 1 . 2 . 3]" 1 1477 1 108 VAL MG1 1 109 ARG H 3.200 . 4.300 2.356 1.895 3.226 . 0 0 "[ . 1 . 2 . 3]" 1 1478 1 92 TRP HZ2 1 108 VAL MG2 3.500 . 4.700 3.488 3.124 3.812 . 0 0 "[ . 1 . 2 . 3]" 1 1479 1 108 VAL MG1 1 111 PHE QD 3.900 . 5.700 4.462 3.588 5.158 . 0 0 "[ . 1 . 2 . 3]" 1 1480 1 108 VAL MG1 1 111 PHE HB3 4.000 . 5.300 4.446 3.489 4.975 . 0 0 "[ . 1 . 2 . 3]" 1 1481 1 105 ALA H 1 108 VAL MG1 3.900 . 5.200 4.662 4.114 5.302 0.102 20 0 "[ . 1 . 2 . 3]" 1 1482 1 108 VAL MG1 1 120 LEU MD2 2.600 . 4.100 3.818 3.041 4.175 0.075 23 0 "[ . 1 . 2 . 3]" 1 1483 1 108 VAL HA 1 108 VAL MG1 3.000 . 4.100 3.042 2.710 3.156 . 0 0 "[ . 1 . 2 . 3]" 1 1484 1 108 VAL MG2 1 109 ARG H 3.600 . 4.800 4.188 3.992 4.312 . 0 0 "[ . 1 . 2 . 3]" 1 1485 1 71 LEU MD1 1 108 VAL MG2 4.000 . 6.600 5.466 4.484 6.621 0.021 19 0 "[ . 1 . 2 . 3]" 1 1486 1 108 VAL MG1 1 108 VAL MG2 2.600 . 4.100 2.074 2.057 2.081 . 0 0 "[ . 1 . 2 . 3]" 1 1487 1 108 VAL H 1 108 VAL MG2 3.000 . 4.100 3.379 2.756 3.672 . 0 0 "[ . 1 . 2 . 3]" 1 1488 1 105 ALA HA 1 108 VAL MG1 3.500 . 4.700 2.444 2.088 3.085 . 0 0 "[ . 1 . 2 . 3]" 1 1489 1 108 VAL MG1 1 111 PHE H 4.300 . 5.700 4.785 4.530 5.035 . 0 0 "[ . 1 . 2 . 3]" 1 1490 1 108 VAL H 1 109 ARG H 3.300 . 4.000 2.678 2.491 2.866 . 0 0 "[ . 1 . 2 . 3]" 1 1491 1 107 GLU HA 1 108 VAL H 3.500 . 4.200 3.552 3.480 3.580 . 0 0 "[ . 1 . 2 . 3]" 1 1492 1 108 VAL HA 1 109 ARG H 3.800 . 4.600 3.494 3.451 3.545 . 0 0 "[ . 1 . 2 . 3]" 1 1493 1 106 GLY HA2 1 109 ARG H 3.800 . 4.600 3.771 3.477 3.979 . 0 0 "[ . 1 . 2 . 3]" 1 1494 1 109 ARG H 1 109 ARG QB 3.200 . 3.700 2.269 2.156 2.675 . 0 0 "[ . 1 . 2 . 3]" 1 1495 1 108 VAL HB 1 109 ARG H 2.900 . 3.500 3.504 3.244 3.607 0.107 15 0 "[ . 1 . 2 . 3]" 1 1496 1 107 GLU HA 1 110 ALA H 4.000 . 5.000 3.551 3.173 3.832 . 0 0 "[ . 1 . 2 . 3]" 1 1497 1 109 ARG HB2 1 110 ALA H 3.300 . 4.000 3.687 3.365 3.904 . 0 0 "[ . 1 . 2 . 3]" 1 1498 1 110 ALA HA 1 111 PHE H 3.400 . 4.100 3.508 3.465 3.555 . 0 0 "[ . 1 . 2 . 3]" 1 1499 1 110 ALA HA 1 113 GLN HE21 3.600 . 4.300 2.120 1.780 3.541 0.020 3 0 "[ . 1 . 2 . 3]" 1 1500 1 110 ALA H 1 110 ALA MB 2.500 . 3.500 2.153 2.034 2.249 . 0 0 "[ . 1 . 2 . 3]" 1 1501 1 110 ALA H 1 110 ALA HA 3.000 . 3.600 2.754 2.725 2.815 . 0 0 "[ . 1 . 2 . 3]" 1 1502 1 110 ALA HA 1 113 GLN H 3.100 . 3.700 3.724 3.565 3.923 0.223 26 0 "[ . 1 . 2 . 3]" 1 1503 1 110 ALA HA 1 110 ALA MB 2.400 . 3.400 2.122 2.100 2.143 . 0 0 "[ . 1 . 2 . 3]" 1 1504 1 109 ARG H 1 110 ALA H 3.500 . 4.200 2.747 2.483 2.904 . 0 0 "[ . 1 . 2 . 3]" 1 1505 1 111 PHE QE 1 118 VAL MG1 3.300 . 5.000 3.079 2.798 3.909 . 0 0 "[ . 1 . 2 . 3]" 1 1506 1 111 PHE HZ 1 118 VAL MG1 3.100 . 4.700 2.638 2.315 3.400 . 0 0 "[ . 1 . 2 . 3]" 1 1507 1 74 LEU MD1 1 111 PHE QD 3.300 . 5.000 2.585 2.182 3.060 . 0 0 "[ . 1 . 2 . 3]" 1 1508 1 77 VAL MG1 1 111 PHE HZ 2.800 . 4.400 2.648 2.269 3.270 . 0 0 "[ . 1 . 2 . 3]" 1 1509 1 78 PRO QD 1 111 PHE QE 4.000 . 5.500 5.500 4.919 5.673 0.173 4 0 "[ . 1 . 2 . 3]" 1 1510 1 110 ALA MB 1 111 PHE H 2.900 . 4.000 2.703 2.458 2.943 . 0 0 "[ . 1 . 2 . 3]" 1 1511 1 111 PHE H 1 111 PHE HB3 3.100 . 3.700 2.287 2.167 2.526 . 0 0 "[ . 1 . 2 . 3]" 1 1512 1 111 PHE QD 1 112 LEU H 3.500 . 4.700 3.210 2.973 3.616 . 0 0 "[ . 1 . 2 . 3]" 1 1513 1 111 PHE HZ 1 118 VAL MG2 3.000 . 4.100 2.499 2.213 2.944 . 0 0 "[ . 1 . 2 . 3]" 1 1514 1 111 PHE QD 1 112 LEU MD1 2.700 . 5.200 3.855 2.098 4.662 . 0 0 "[ . 1 . 2 . 3]" 1 1515 1 90 VAL MG2 1 111 PHE QE 2.900 . 4.500 4.599 4.522 4.689 0.189 23 0 "[ . 1 . 2 . 3]" 1 1516 1 111 PHE HA 1 111 PHE QE 2.800 . 5.000 4.579 4.407 4.762 . 0 0 "[ . 1 . 2 . 3]" 1 1517 1 77 VAL MG2 1 111 PHE QE 2.900 . 4.500 3.356 2.926 3.695 . 0 0 "[ . 1 . 2 . 3]" 1 1518 1 111 PHE QE 1 112 LEU MD2 2.700 . 4.700 3.787 2.578 4.883 0.183 26 0 "[ . 1 . 2 . 3]" 1 1519 1 108 VAL MG2 1 111 PHE QE 4.500 . 6.200 4.572 3.851 5.294 . 0 0 "[ . 1 . 2 . 3]" 1 1520 1 111 PHE QE 1 120 LEU MD2 3.400 . 5.100 4.660 4.373 5.131 0.031 24 0 "[ . 1 . 2 . 3]" 1 1521 1 111 PHE HB3 1 111 PHE QD 2.800 . 3.900 2.311 2.302 2.322 . 0 0 "[ . 1 . 2 . 3]" 1 1522 1 111 PHE QD 1 112 LEU HA 3.400 . 4.600 3.871 3.553 4.044 . 0 0 "[ . 1 . 2 . 3]" 1 1523 1 111 PHE QD 1 120 LEU HB2 2.700 . 4.700 4.300 3.570 4.732 0.032 26 0 "[ . 1 . 2 . 3]" 1 1524 1 111 PHE HA 1 111 PHE HB3 2.700 . 3.200 3.001 2.967 3.023 . 0 0 "[ . 1 . 2 . 3]" 1 1525 1 74 LEU MD1 1 111 PHE QE 3.600 . 5.300 3.644 3.350 3.976 . 0 0 "[ . 1 . 2 . 3]" 1 1526 1 111 PHE H 1 111 PHE HB2 3.700 . 4.400 2.810 2.536 2.986 . 0 0 "[ . 1 . 2 . 3]" 1 1527 1 111 PHE H 1 111 PHE HA 2.400 . 2.900 2.837 2.793 2.872 . 0 0 "[ . 1 . 2 . 3]" 1 1528 1 110 ALA H 1 111 PHE H 3.400 . 4.100 2.808 2.610 2.920 . 0 0 "[ . 1 . 2 . 3]" 1 1529 1 109 ARG H 1 111 PHE H 3.400 . 4.100 3.884 3.678 4.121 0.021 25 0 "[ . 1 . 2 . 3]" 1 1530 1 111 PHE H 1 111 PHE QD 3.400 . 4.600 4.128 4.033 4.186 . 0 0 "[ . 1 . 2 . 3]" 1 1531 1 111 PHE HA 1 111 PHE QD 2.700 . 3.700 2.324 2.265 2.504 . 0 0 "[ . 1 . 2 . 3]" 1 1532 1 111 PHE QE 1 112 LEU H 3.800 . 5.100 4.883 4.509 5.199 0.099 25 0 "[ . 1 . 2 . 3]" 1 1533 1 74 LEU MD2 1 111 PHE QD 3.100 . 4.700 3.821 3.472 4.252 . 0 0 "[ . 1 . 2 . 3]" 1 1534 1 74 LEU MD2 1 111 PHE QE 3.100 . 5.200 5.267 5.052 5.398 0.198 8 0 "[ . 1 . 2 . 3]" 1 1535 1 112 LEU H 1 112 LEU HB2 3.100 . 3.700 2.250 2.088 2.424 . 0 0 "[ . 1 . 2 . 3]" 1 1536 1 112 LEU HA 1 112 LEU HB2 2.600 . 3.100 2.970 2.910 3.014 . 0 0 "[ . 1 . 2 . 3]" 1 1537 1 112 LEU MD1 1 120 LEU MD1 4.200 . 6.000 3.551 2.075 4.229 . 0 0 "[ . 1 . 2 . 3]" 1 1538 1 111 PHE H 1 112 LEU H 3.600 . 4.300 2.793 2.497 2.967 . 0 0 "[ . 1 . 2 . 3]" 1 1539 1 112 LEU H 1 112 LEU MD2 2.900 . 4.000 3.086 1.815 4.040 0.040 1 0 "[ . 1 . 2 . 3]" 1 1540 1 112 LEU HA 1 112 LEU MD2 2.800 . 3.900 2.503 2.173 3.713 . 0 0 "[ . 1 . 2 . 3]" 1 1541 1 112 LEU HB2 1 112 LEU MD2 2.200 . 3.400 2.670 2.256 3.156 . 0 0 "[ . 1 . 2 . 3]" 1 1542 1 112 LEU MD2 1 144 ALA MB 2.200 . 3.600 3.491 2.243 3.696 0.096 20 0 "[ . 1 . 2 . 3]" 1 1543 1 112 LEU HA 1 112 LEU MD1 2.600 . 3.600 2.850 2.160 3.720 0.120 27 0 "[ . 1 . 2 . 3]" 1 1544 1 112 LEU MD1 1 113 GLN H 4.200 . 5.500 4.550 4.116 4.767 . 0 0 "[ . 1 . 2 . 3]" 1 1545 1 112 LEU HB2 1 112 LEU MD1 2.900 . 4.000 2.629 2.147 3.192 . 0 0 "[ . 1 . 2 . 3]" 1 1546 1 112 LEU H 1 112 LEU MD1 3.300 . 4.500 3.257 1.794 4.064 0.006 11 0 "[ . 1 . 2 . 3]" 1 1547 1 112 LEU H 1 112 LEU HA 3.000 . 3.600 2.743 2.717 2.789 . 0 0 "[ . 1 . 2 . 3]" 1 1548 1 112 LEU H 1 113 GLN H 3.500 . 4.200 2.786 2.702 2.964 . 0 0 "[ . 1 . 2 . 3]" 1 1549 1 111 PHE HB2 1 112 LEU H 3.900 . 4.700 3.801 3.568 4.093 . 0 0 "[ . 1 . 2 . 3]" 1 1550 1 112 LEU MD2 1 120 LEU H 3.300 . 4.500 3.020 1.973 3.972 . 0 0 "[ . 1 . 2 . 3]" 1 1551 1 112 LEU MD1 1 120 LEU H 3.600 . 4.800 3.418 2.184 4.529 . 0 0 "[ . 1 . 2 . 3]" 1 1552 1 111 PHE HB3 1 112 LEU H 3.600 . 4.300 2.385 2.053 2.825 . 0 0 "[ . 1 . 2 . 3]" 1 1553 1 112 LEU MD2 1 113 GLN H 3.800 . 5.100 4.600 4.095 5.016 . 0 0 "[ . 1 . 2 . 3]" 1 1554 1 112 LEU HA 1 113 GLN H 3.300 . 4.000 3.463 3.429 3.555 . 0 0 "[ . 1 . 2 . 3]" 1 1555 1 113 GLN H 1 113 GLN HG3 3.300 . 5.500 3.915 2.118 4.711 . 0 0 "[ . 1 . 2 . 3]" 1 1556 1 113 GLN HA 1 113 GLN HB3 2.700 . 3.700 2.811 2.406 3.012 . 0 0 "[ . 1 . 2 . 3]" 1 1557 1 113 GLN H 1 114 GLU HA 3.700 . 5.000 4.987 4.906 5.054 0.054 22 0 "[ . 1 . 2 . 3]" 1 1558 1 111 PHE QE 1 113 GLN H 5.700 . 7.100 6.269 6.057 6.658 . 0 0 "[ . 1 . 2 . 3]" 1 1559 1 113 GLN HE21 1 114 GLU HB3 3.700 . 6.400 6.004 3.810 6.610 0.210 26 0 "[ . 1 . 2 . 3]" 1 1560 1 113 GLN HA 1 113 GLN HE22 4.600 . 6.000 5.638 5.029 6.084 0.084 11 0 "[ . 1 . 2 . 3]" 1 1561 1 113 GLN HB2 1 113 GLN HG3 2.700 . 3.700 2.456 2.317 2.884 . 0 0 "[ . 1 . 2 . 3]" 1 1562 1 113 GLN HA 1 113 GLN HG2 3.000 . 5.100 2.889 2.559 3.665 . 0 0 "[ . 1 . 2 . 3]" 1 1563 1 113 GLN HE21 1 113 GLN HG2 3.000 . 4.400 3.366 2.471 3.608 . 0 0 "[ . 1 . 2 . 3]" 1 1564 1 113 GLN HA 1 113 GLN HG3 2.600 . 4.100 3.300 2.327 3.701 . 0 0 "[ . 1 . 2 . 3]" 1 1565 1 113 GLN H 1 113 GLN HA 3.000 . 3.600 2.915 2.896 2.931 . 0 0 "[ . 1 . 2 . 3]" 1 1566 1 113 GLN H 1 113 GLN HG2 3.300 . 5.000 4.038 3.533 4.440 . 0 0 "[ . 1 . 2 . 3]" 1 1567 1 113 GLN HB3 1 113 GLN HG3 2.900 . 3.700 2.823 2.626 3.040 . 0 0 "[ . 1 . 2 . 3]" 1 1568 1 113 GLN HB3 1 113 GLN HG2 3.000 . 3.700 2.692 2.238 3.007 . 0 0 "[ . 1 . 2 . 3]" 1 1569 1 113 GLN H 1 113 GLN HB2 3.000 . 4.100 2.929 2.455 3.350 . 0 0 "[ . 1 . 2 . 3]" 1 1570 1 113 GLN HE21 1 113 GLN HG3 2.500 . 4.000 3.044 2.841 3.602 . 0 0 "[ . 1 . 2 . 3]" 1 1571 1 113 GLN H 1 113 GLN HB3 3.200 . 4.300 2.652 2.103 3.660 . 0 0 "[ . 1 . 2 . 3]" 1 1572 1 110 ALA MB 1 113 GLN HE22 3.400 . 4.600 3.473 3.129 4.243 . 0 0 "[ . 1 . 2 . 3]" 1 1573 1 113 GLN HA 1 113 GLN HE21 3.900 . 5.100 4.590 3.636 5.121 0.021 11 0 "[ . 1 . 2 . 3]" 1 1574 1 110 ALA MB 1 113 GLN HE21 3.200 . 4.300 3.156 2.465 4.068 . 0 0 "[ . 1 . 2 . 3]" 1 1575 1 112 LEU HB2 1 113 GLN H 3.200 . 3.800 3.155 2.964 3.303 . 0 0 "[ . 1 . 2 . 3]" 1 1576 1 113 GLN HB2 1 113 GLN HE21 3.900 . 5.500 2.907 1.741 3.571 0.059 26 0 "[ . 1 . 2 . 3]" 1 1577 1 111 PHE H 1 113 GLN HE21 4.000 . 4.800 4.827 4.146 4.929 0.129 23 0 "[ . 1 . 2 . 3]" 1 1578 1 113 GLN HA 1 114 GLU H 3.300 . 4.000 3.525 3.494 3.552 . 0 0 "[ . 1 . 2 . 3]" 1 1579 1 113 GLN H 1 114 GLU HG3 3.300 . 5.000 4.517 4.127 4.669 . 0 0 "[ . 1 . 2 . 3]" 1 1580 1 111 PHE QD 1 114 GLU HB2 3.200 . 4.300 2.702 2.441 4.732 0.432 30 0 "[ . 1 . 2 . 3]" 1 1581 1 111 PHE QD 1 114 GLU HB3 2.900 . 4.000 4.036 3.856 4.155 0.155 30 0 "[ . 1 . 2 . 3]" 1 1582 1 113 GLN H 1 114 GLU H 3.100 . 3.700 2.315 2.217 2.404 . 0 0 "[ . 1 . 2 . 3]" 1 1583 1 114 GLU H 1 114 GLU HG3 3.000 . 4.900 2.842 2.396 3.001 . 0 0 "[ . 1 . 2 . 3]" 1 1584 1 110 ALA MB 1 114 GLU HG2 3.600 . 4.800 3.918 3.598 4.693 . 0 0 "[ . 1 . 2 . 3]" 1 1585 1 114 GLU HA 1 114 GLU HB3 3.000 . 3.800 2.490 2.447 2.644 . 0 0 "[ . 1 . 2 . 3]" 1 1586 1 114 GLU HB3 1 115 ASN H 3.100 . 3.700 3.673 3.602 3.731 0.031 24 0 "[ . 1 . 2 . 3]" 1 1587 1 114 GLU H 1 114 GLU HB3 3.000 . 4.900 3.543 2.323 3.604 . 0 0 "[ . 1 . 2 . 3]" 1 1588 1 114 GLU HG3 1 115 ASN H 3.700 . 4.400 4.434 2.054 4.573 0.173 13 0 "[ . 1 . 2 . 3]" 1 1589 1 114 GLU HA 1 114 GLU HG3 3.000 . 5.000 3.615 3.156 3.699 . 0 0 "[ . 1 . 2 . 3]" 1 1590 1 114 GLU HA 1 114 GLU HG2 2.900 . 4.600 2.449 2.300 4.224 . 0 0 "[ . 1 . 2 . 3]" 1 1591 1 114 GLU H 1 114 GLU HG2 3.000 . 4.900 2.510 2.129 3.635 . 0 0 "[ . 1 . 2 . 3]" 1 1592 1 111 PHE QD 1 114 GLU HG2 3.700 . 5.000 4.992 2.233 5.174 0.174 9 0 "[ . 1 . 2 . 3]" 1 1593 1 114 GLU H 1 114 GLU HA 2.700 . 3.500 2.828 2.786 2.878 . 0 0 "[ . 1 . 2 . 3]" 1 1594 1 110 ALA MB 1 114 GLU HG3 3.900 . 5.200 3.444 2.948 5.266 0.066 30 0 "[ . 1 . 2 . 3]" 1 1595 1 111 PHE QD 1 114 GLU HG3 3.900 . 5.200 3.824 2.629 4.039 . 0 0 "[ . 1 . 2 . 3]" 1 1596 1 114 GLU HB3 1 114 GLU HG3 2.900 . 3.700 2.821 2.607 3.013 . 0 0 "[ . 1 . 2 . 3]" 1 1597 1 114 GLU HG2 1 115 ASN H 3.900 . 4.700 4.430 3.773 4.856 0.156 9 0 "[ . 1 . 2 . 3]" 1 1598 1 114 GLU HB2 1 114 GLU HG3 2.700 . 4.000 2.272 2.237 2.974 . 0 0 "[ . 1 . 2 . 3]" 1 1599 1 114 GLU HB3 1 114 GLU HG2 2.800 . 4.100 2.843 2.297 2.915 . 0 0 "[ . 1 . 2 . 3]" 1 1600 1 114 GLU H 1 114 GLU HB2 2.900 . 4.800 2.512 2.414 3.557 . 0 0 "[ . 1 . 2 . 3]" 1 1601 1 114 GLU H 1 115 ASN H 2.900 . 3.500 2.608 2.425 2.742 . 0 0 "[ . 1 . 2 . 3]" 1 1602 1 113 GLN HG2 1 114 GLU H 3.400 . 5.100 4.107 2.423 5.222 0.122 7 0 "[ . 1 . 2 . 3]" 1 1603 1 114 GLU HB2 1 115 ASN H 3.100 . 3.700 2.685 2.622 4.065 0.365 30 0 "[ . 1 . 2 . 3]" 1 1604 1 115 ASN H 1 116 THR H 3.300 . 4.000 3.835 3.623 3.920 . 0 0 "[ . 1 . 2 . 3]" 1 1605 1 115 ASN QB 1 116 THR H 4.000 . 5.000 3.718 3.653 3.824 . 0 0 "[ . 1 . 2 . 3]" 1 1606 1 115 ASN H 1 115 ASN HB2 3.100 . 4.500 2.801 2.654 3.792 . 0 0 "[ . 1 . 2 . 3]" 1 1607 1 114 GLU HA 1 115 ASN H 3.200 . 3.800 3.515 3.468 3.527 . 0 0 "[ . 1 . 2 . 3]" 1 1608 1 115 ASN H 1 115 ASN HA 2.900 . 3.700 2.961 2.954 2.965 . 0 0 "[ . 1 . 2 . 3]" 1 1609 1 116 THR HA 1 116 THR MG 2.400 . 3.400 2.718 2.270 3.191 . 0 0 "[ . 1 . 2 . 3]" 1 1610 1 116 THR HA 1 117 HIS H 3.600 . 4.300 3.439 3.345 3.492 . 0 0 "[ . 1 . 2 . 3]" 1 1611 1 116 THR HB 1 117 HIS H 4.200 . 5.000 4.087 3.917 4.262 . 0 0 "[ . 1 . 2 . 3]" 1 1612 1 116 THR MG 1 117 HIS H 4.000 . 5.300 3.168 2.008 4.066 . 0 0 "[ . 1 . 2 . 3]" 1 1613 1 116 THR H 1 116 THR MG 2.800 . 3.900 2.144 1.828 2.448 . 0 0 "[ . 1 . 2 . 3]" 1 1614 1 116 THR H 1 117 HIS H 3.300 . 4.000 2.382 2.309 2.535 . 0 0 "[ . 1 . 2 . 3]" 1 1615 1 116 THR MG 1 117 HIS HE1 3.700 . 4.900 4.057 3.038 4.905 0.005 2 0 "[ . 1 . 2 . 3]" 1 1616 1 116 THR H 1 116 THR HB 3.500 . 4.200 3.206 2.419 3.628 . 0 0 "[ . 1 . 2 . 3]" 1 1617 1 116 THR H 1 116 THR HA 2.400 . 2.900 2.890 2.849 2.905 0.005 30 0 "[ . 1 . 2 . 3]" 1 1618 1 115 ASN HA 1 116 THR H 2.600 . 3.100 2.242 2.205 2.337 . 0 0 "[ . 1 . 2 . 3]" 1 1619 1 115 ASN HA 1 116 THR MG 3.400 . 4.600 3.836 3.507 4.121 . 0 0 "[ . 1 . 2 . 3]" 1 1620 1 115 ASN HA 1 117 HIS HD2 3.000 . 3.600 3.639 2.934 3.737 0.137 9 0 "[ . 1 . 2 . 3]" 1 1621 1 117 HIS HD2 1 118 VAL H 3.300 . 4.000 3.300 1.822 4.031 0.031 30 0 "[ . 1 . 2 . 3]" 1 1622 1 117 HIS HE1 1 118 VAL H 4.000 . 6.000 5.851 5.637 6.070 0.070 30 0 "[ . 1 . 2 . 3]" 1 1623 1 117 HIS H 1 118 VAL H 3.200 . 3.800 2.606 2.410 2.750 . 0 0 "[ . 1 . 2 . 3]" 1 1624 1 117 HIS H 1 117 HIS HB3 3.300 . 4.300 3.244 3.088 3.309 . 0 0 "[ . 1 . 2 . 3]" 1 1625 1 82 LEU MD1 1 117 HIS HD2 4.400 . 5.800 3.859 3.470 4.440 . 0 0 "[ . 1 . 2 . 3]" 1 1626 1 117 HIS HD2 1 118 VAL HB 3.500 . 4.200 4.321 4.157 4.468 0.268 16 0 "[ . 1 . 2 . 3]" 1 1627 1 82 LEU QB 1 117 HIS HD2 4.000 . 5.500 3.711 3.255 5.284 . 0 0 "[ . 1 . 2 . 3]" 1 1628 1 117 HIS HE1 1 118 VAL MG1 4.500 . 5.900 5.426 5.069 5.558 . 0 0 "[ . 1 . 2 . 3]" 1 1629 1 118 VAL MG1 1 118 VAL MG2 2.600 . 4.100 2.068 2.059 2.078 . 0 0 "[ . 1 . 2 . 3]" 1 1630 1 88 TYR HB2 1 118 VAL MG1 4.000 . 5.300 3.791 3.654 3.864 . 0 0 "[ . 1 . 2 . 3]" 1 1631 1 88 TYR HB3 1 118 VAL MG1 2.900 . 4.800 4.743 4.455 4.908 0.108 29 0 "[ . 1 . 2 . 3]" 1 1632 1 117 HIS HD2 1 118 VAL MG1 3.700 . 4.900 2.263 2.064 2.341 . 0 0 "[ . 1 . 2 . 3]" 1 1633 1 118 VAL MG1 1 119 ARG H 3.700 . 4.900 4.276 4.217 4.362 . 0 0 "[ . 1 . 2 . 3]" 1 1634 1 117 HIS H 1 118 VAL MG1 4.200 . 5.500 3.469 3.123 3.617 . 0 0 "[ . 1 . 2 . 3]" 1 1635 1 118 VAL MG1 1 119 ARG HA 5.300 . 6.400 4.710 4.584 4.968 . 0 0 "[ . 1 . 2 . 3]" 1 1636 1 117 HIS HA 1 118 VAL MG1 4.300 . 5.700 4.562 4.095 4.699 . 0 0 "[ . 1 . 2 . 3]" 1 1637 1 115 ASN HB2 1 118 VAL MG1 3.700 . 4.900 2.174 2.004 2.428 . 0 0 "[ . 1 . 2 . 3]" 1 1638 1 111 PHE QD 1 118 VAL MG2 3.300 . 5.000 4.826 4.364 5.080 0.080 26 0 "[ . 1 . 2 . 3]" 1 1639 1 88 TYR H 1 118 VAL MG1 4.800 3.800 5.800 4.667 4.274 4.870 . 0 0 "[ . 1 . 2 . 3]" 1 1640 1 35 VAL MG1 1 118 VAL MG1 4.600 . 6.500 5.929 5.505 6.167 . 0 0 "[ . 1 . 2 . 3]" 1 1641 1 112 LEU HA 1 118 VAL MG1 4.100 . 5.400 4.664 4.377 5.061 . 0 0 "[ . 1 . 2 . 3]" 1 1642 1 88 TYR HA 1 118 VAL MG1 4.900 . 5.900 6.176 6.020 6.251 0.351 9 0 "[ . 1 . 2 . 3]" 1 1643 1 118 VAL H 1 118 VAL MG1 3.000 . 4.100 1.788 1.731 1.954 0.069 14 0 "[ . 1 . 2 . 3]" 1 1644 1 118 VAL HA 1 118 VAL MG1 3.200 . 4.300 3.105 2.997 3.134 . 0 0 "[ . 1 . 2 . 3]" 1 1645 1 111 PHE QE 1 118 VAL HB 3.500 . 5.300 5.383 5.188 5.526 0.226 30 0 "[ . 1 . 2 . 3]" 1 1646 1 118 VAL H 1 118 VAL MG2 3.100 . 4.200 3.555 3.410 3.606 . 0 0 "[ . 1 . 2 . 3]" 1 1647 1 82 LEU MD2 1 118 VAL MG2 2.700 . 4.200 3.458 2.572 3.742 . 0 0 "[ . 1 . 2 . 3]" 1 1648 1 82 LEU MD2 1 118 VAL H 4.700 . 6.100 5.983 5.238 6.166 0.066 18 0 "[ . 1 . 2 . 3]" 1 1649 1 82 LEU HB3 1 118 VAL MG1 5.300 . 6.400 3.599 2.926 4.252 . 0 0 "[ . 1 . 2 . 3]" 1 1650 1 118 VAL MG1 1 120 LEU HA 4.000 . 6.800 6.555 6.334 6.808 0.008 16 0 "[ . 1 . 2 . 3]" 1 1651 1 87 ILE HA 1 118 VAL MG1 5.300 . 6.400 5.808 5.313 6.114 . 0 0 "[ . 1 . 2 . 3]" 1 1652 1 111 PHE QE 1 118 VAL MG2 2.700 . 4.200 3.177 2.724 3.447 . 0 0 "[ . 1 . 2 . 3]" 1 1653 1 73 PHE HZ 1 118 VAL MG2 3.700 . 4.900 4.264 3.981 4.575 . 0 0 "[ . 1 . 2 . 3]" 1 1654 1 118 VAL MG2 1 120 LEU HA 3.200 . 4.300 4.248 4.145 4.325 0.025 27 0 "[ . 1 . 2 . 3]" 1 1655 1 90 VAL HB 1 118 VAL MG2 2.400 . 4.100 3.848 3.632 4.061 . 0 0 "[ . 1 . 2 . 3]" 1 1656 1 77 VAL MG1 1 118 VAL MG2 2.300 . 3.800 3.810 3.364 4.142 0.342 30 0 "[ . 1 . 2 . 3]" 1 1657 1 115 ASN HB2 1 118 VAL MG2 2.500 . 4.000 3.833 3.460 4.040 0.040 5 0 "[ . 1 . 2 . 3]" 1 1658 1 88 TYR HB3 1 118 VAL MG2 2.600 . 4.100 3.541 3.184 4.112 0.012 30 0 "[ . 1 . 2 . 3]" 1 1659 1 88 TYR HB2 1 118 VAL MG2 4.200 . 5.500 3.513 3.321 3.666 . 0 0 "[ . 1 . 2 . 3]" 1 1660 1 118 VAL MG2 1 119 ARG HA 3.100 . 4.200 3.649 3.589 3.729 . 0 0 "[ . 1 . 2 . 3]" 1 1661 1 117 HIS HB2 1 118 VAL H 3.600 . 4.300 3.301 3.003 3.858 . 0 0 "[ . 1 . 2 . 3]" 1 1662 1 117 HIS HB3 1 118 VAL H 3.900 . 4.700 4.289 4.135 4.556 . 0 0 "[ . 1 . 2 . 3]" 1 1663 1 89 ARG HA 1 118 VAL MG2 4.000 . 5.300 2.995 2.511 3.390 . 0 0 "[ . 1 . 2 . 3]" 1 1664 1 111 PHE QD 1 118 VAL MG1 4.300 . 6.200 4.709 4.518 5.155 . 0 0 "[ . 1 . 2 . 3]" 1 1665 1 90 VAL MG1 1 118 VAL MG2 2.300 . 3.800 2.038 1.953 2.141 . 0 0 "[ . 1 . 2 . 3]" 1 1666 1 118 VAL HB 1 118 VAL MG2 2.400 . 3.400 2.141 2.133 2.151 . 0 0 "[ . 1 . 2 . 3]" 1 1667 1 118 VAL HA 1 118 VAL MG2 3.200 . 4.300 2.657 2.578 2.849 . 0 0 "[ . 1 . 2 . 3]" 1 1668 1 90 VAL MG1 1 118 VAL MG1 3.500 . 5.200 4.101 3.860 4.343 . 0 0 "[ . 1 . 2 . 3]" 1 1669 1 82 LEU MD2 1 118 VAL MG1 4.100 . 5.900 3.716 2.701 3.985 . 0 0 "[ . 1 . 2 . 3]" 1 1670 1 80 LEU MD2 1 118 VAL MG2 3.400 . 6.100 5.853 4.197 6.328 0.228 14 0 "[ . 1 . 2 . 3]" 1 1671 1 118 VAL H 1 119 ARG H 3.600 . 4.300 4.350 4.248 4.422 0.122 2 0 "[ . 1 . 2 . 3]" 1 1672 1 117 HIS HA 1 118 VAL H 3.400 . 4.100 3.467 3.276 3.533 . 0 0 "[ . 1 . 2 . 3]" 1 1673 1 118 VAL H 1 118 VAL HB 3.000 . 3.600 3.349 3.203 3.664 0.064 30 0 "[ . 1 . 2 . 3]" 1 1674 1 118 VAL MG2 1 119 ARG H 3.200 . 4.300 2.709 2.509 2.924 . 0 0 "[ . 1 . 2 . 3]" 1 1675 1 118 VAL MG2 1 120 LEU H 3.300 . 4.500 4.535 4.379 4.624 0.124 14 0 "[ . 1 . 2 . 3]" 1 1676 1 118 VAL MG2 1 120 LEU MD1 3.200 . 4.800 3.862 3.738 4.034 . 0 0 "[ . 1 . 2 . 3]" 1 1677 1 115 ASN HA 1 118 VAL MG1 4.000 . 5.300 3.708 3.539 3.798 . 0 0 "[ . 1 . 2 . 3]" 1 1678 1 88 TYR H 1 118 VAL MG2 3.200 . 4.800 4.733 4.514 4.868 0.068 30 0 "[ . 1 . 2 . 3]" 1 1679 1 88 TYR HB3 1 119 ARG H 3.500 . 5.200 4.689 4.226 5.180 . 0 0 "[ . 1 . 2 . 3]" 1 1680 1 119 ARG HB3 1 120 LEU H 3.700 . 4.400 3.090 2.611 3.801 . 0 0 "[ . 1 . 2 . 3]" 1 1681 1 119 ARG HB2 1 120 LEU H 3.600 . 4.300 4.014 3.538 4.253 . 0 0 "[ . 1 . 2 . 3]" 1 1682 1 119 ARG H 1 119 ARG HB3 3.000 . 3.900 3.134 2.403 3.673 . 0 0 "[ . 1 . 2 . 3]" 1 1683 1 89 ARG HA 1 119 ARG H 4.000 . 4.800 2.295 2.055 2.569 . 0 0 "[ . 1 . 2 . 3]" 1 1684 1 118 VAL HB 1 119 ARG H 3.200 . 3.800 3.937 3.794 4.052 0.252 9 0 "[ . 1 . 2 . 3]" 1 1685 1 118 VAL HA 1 119 ARG H 3.100 . 3.700 2.115 2.093 2.160 . 0 0 "[ . 1 . 2 . 3]" 1 1686 1 90 VAL H 1 119 ARG H 3.900 . 4.700 3.795 3.636 3.945 . 0 0 "[ . 1 . 2 . 3]" 1 1687 1 119 ARG H 1 120 LEU H 4.000 . 4.800 4.574 4.560 4.592 . 0 0 "[ . 1 . 2 . 3]" 1 1688 1 119 ARG H 1 119 ARG HB2 2.900 . 3.800 2.435 2.201 2.904 . 0 0 "[ . 1 . 2 . 3]" 1 1689 1 90 VAL MG2 1 120 LEU MD1 3.000 . 4.600 2.656 2.519 2.800 . 0 0 "[ . 1 . 2 . 3]" 1 1690 1 90 VAL MG1 1 120 LEU MD1 3.400 . 5.100 2.183 2.136 2.212 . 0 0 "[ . 1 . 2 . 3]" 1 1691 1 111 PHE QE 1 120 LEU MD1 4.000 . 5.800 2.250 2.070 2.623 . 0 0 "[ . 1 . 2 . 3]" 1 1692 1 92 TRP HE1 1 120 LEU MD2 3.600 . 4.800 3.731 3.569 3.927 . 0 0 "[ . 1 . 2 . 3]" 1 1693 1 120 LEU MD1 1 121 ARG HA 4.300 . 5.700 5.804 5.619 5.881 0.181 18 0 "[ . 1 . 2 . 3]" 1 1694 1 92 TRP HZ2 1 120 LEU MD1 3.900 . 5.200 2.995 2.823 3.188 . 0 0 "[ . 1 . 2 . 3]" 1 1695 1 73 PHE QE 1 120 LEU MD1 4.000 . 5.800 2.930 2.546 3.262 . 0 0 "[ . 1 . 2 . 3]" 1 1696 1 92 TRP HD1 1 120 LEU HG 3.000 . 3.600 3.591 3.399 3.732 0.132 8 0 "[ . 1 . 2 . 3]" 1 1697 1 120 LEU H 1 120 LEU MD1 3.400 . 5.100 4.619 4.552 4.717 . 0 0 "[ . 1 . 2 . 3]" 1 1698 1 120 LEU HB3 1 120 LEU MD2 3.100 . 4.700 2.185 2.165 2.199 . 0 0 "[ . 1 . 2 . 3]" 1 1699 1 120 LEU HA 1 120 LEU MD2 3.800 . 5.600 3.144 2.970 3.285 . 0 0 "[ . 1 . 2 . 3]" 1 1700 1 120 LEU MD2 1 146 ALA HA 4.500 . 5.900 4.626 4.309 5.078 . 0 0 "[ . 1 . 2 . 3]" 1 1701 1 120 LEU HB3 1 120 LEU MD1 3.400 . 5.100 2.604 2.523 2.692 . 0 0 "[ . 1 . 2 . 3]" 1 1702 1 92 TRP HB2 1 120 LEU MD1 4.500 . 5.900 4.477 4.331 4.629 . 0 0 "[ . 1 . 2 . 3]" 1 1703 1 120 LEU MD1 1 146 ALA MB 3.600 . 5.300 4.299 4.093 4.621 . 0 0 "[ . 1 . 2 . 3]" 1 1704 1 91 THR HA 1 120 LEU MD1 2.900 . 5.500 5.427 5.239 5.634 0.134 26 0 "[ . 1 . 2 . 3]" 1 1705 1 108 VAL MG2 1 120 LEU QB 4.200 . 5.500 4.092 3.459 4.737 . 0 0 "[ . 1 . 2 . 3]" 1 1706 1 108 VAL MG2 1 120 LEU MD2 3.600 . 5.300 3.071 2.595 3.568 . 0 0 "[ . 1 . 2 . 3]" 1 1707 1 120 LEU MD2 1 122 ILE HB 3.200 . 6.000 4.609 4.221 4.994 . 0 0 "[ . 1 . 2 . 3]" 1 1708 1 112 LEU HG 1 120 LEU MD2 3.500 . 4.700 4.684 4.388 4.813 0.113 26 0 "[ . 1 . 2 . 3]" 1 1709 1 111 PHE QD 1 120 LEU MD2 4.200 . 6.000 4.767 4.274 5.092 . 0 0 "[ . 1 . 2 . 3]" 1 1710 1 120 LEU MD2 1 147 GLN H 4.500 . 5.900 4.254 4.049 4.679 . 0 0 "[ . 1 . 2 . 3]" 1 1711 1 92 TRP HB2 1 120 LEU MD2 3.700 . 4.900 2.664 2.447 2.862 . 0 0 "[ . 1 . 2 . 3]" 1 1712 1 120 LEU MD2 1 121 ARG HA 4.500 . 5.900 3.318 3.116 3.467 . 0 0 "[ . 1 . 2 . 3]" 1 1713 1 120 LEU H 1 147 GLN H 5.000 . 6.000 4.761 4.590 4.987 . 0 0 "[ . 1 . 2 . 3]" 1 1714 1 120 LEU H 1 146 ALA HA 4.200 . 5.000 3.343 3.179 3.631 . 0 0 "[ . 1 . 2 . 3]" 1 1715 1 119 ARG HA 1 120 LEU H 3.000 . 3.600 2.355 2.283 2.377 . 0 0 "[ . 1 . 2 . 3]" 1 1716 1 73 PHE HZ 1 120 LEU MD2 3.900 . 5.700 5.764 5.518 5.896 0.196 11 0 "[ . 1 . 2 . 3]" 1 1717 1 120 LEU H 1 121 ARG H 4.600 . 5.500 4.263 4.163 4.379 . 0 0 "[ . 1 . 2 . 3]" 1 1718 1 120 LEU HB2 1 120 LEU MD2 2.900 . 4.500 3.131 3.087 3.181 . 0 0 "[ . 1 . 2 . 3]" 1 1719 1 120 LEU HB2 1 120 LEU MD1 3.200 . 4.800 2.178 2.151 2.207 . 0 0 "[ . 1 . 2 . 3]" 1 1720 1 120 LEU MD1 1 120 LEU MD2 2.700 . 4.600 2.027 1.916 2.062 . 0 0 "[ . 1 . 2 . 3]" 1 1721 1 120 LEU HA 1 120 LEU MD1 2.900 . 4.500 3.492 3.382 3.594 . 0 0 "[ . 1 . 2 . 3]" 1 1722 1 120 LEU H 1 120 LEU MD2 3.700 . 5.400 4.295 4.251 4.358 . 0 0 "[ . 1 . 2 . 3]" 1 1723 1 120 LEU H 1 120 LEU HB2 3.000 . 4.100 2.988 2.896 3.108 . 0 0 "[ . 1 . 2 . 3]" 1 1724 1 120 LEU HB2 1 121 ARG H 3.600 . 4.300 4.337 4.226 4.396 0.096 19 0 "[ . 1 . 2 . 3]" 1 1725 1 90 VAL HB 1 120 LEU MD1 3.200 . 4.300 4.398 4.306 4.509 0.209 22 0 "[ . 1 . 2 . 3]" 1 1726 1 120 LEU MD1 1 122 ILE MD 2.600 . 4.100 3.927 3.641 4.256 0.156 11 0 "[ . 1 . 2 . 3]" 1 1727 1 120 LEU HG 1 122 ILE HA 3.900 . 6.700 5.694 5.501 5.918 . 0 0 "[ . 1 . 2 . 3]" 1 1728 1 120 LEU MD1 1 122 ILE HA 4.700 . 6.100 5.814 5.694 5.999 . 0 0 "[ . 1 . 2 . 3]" 1 1729 1 120 LEU HG 1 121 ARG H 3.400 . 4.100 2.892 2.582 3.086 . 0 0 "[ . 1 . 2 . 3]" 1 1730 1 90 VAL MG1 1 121 ARG H 3.900 . 5.200 3.813 3.731 3.957 . 0 0 "[ . 1 . 2 . 3]" 1 1731 1 120 LEU HA 1 121 ARG H 3.300 . 4.000 2.129 2.094 2.196 . 0 0 "[ . 1 . 2 . 3]" 1 1732 1 90 VAL H 1 121 ARG H 4.100 . 4.900 4.417 4.120 4.716 . 0 0 "[ . 1 . 2 . 3]" 1 1733 1 121 ARG H 1 121 ARG HB2 4.000 . 4.800 2.643 2.387 3.383 . 0 0 "[ . 1 . 2 . 3]" 1 1734 1 92 TRP H 1 121 ARG H 4.200 . 5.000 3.659 3.335 3.833 . 0 0 "[ . 1 . 2 . 3]" 1 1735 1 92 TRP HD1 1 121 ARG H 4.800 . 5.600 4.928 4.709 5.196 . 0 0 "[ . 1 . 2 . 3]" 1 1736 1 120 LEU MD1 1 121 ARG H 3.300 . 4.500 4.419 4.198 4.541 0.041 8 0 "[ . 1 . 2 . 3]" 1 1737 1 91 THR HA 1 121 ARG H 3.400 . 4.100 2.774 2.625 2.967 . 0 0 "[ . 1 . 2 . 3]" 1 1738 1 120 LEU MD2 1 121 ARG H 3.700 . 4.900 2.705 2.367 3.151 . 0 0 "[ . 1 . 2 . 3]" 1 1739 1 120 LEU HB3 1 121 ARG H 3.600 . 4.300 4.004 3.831 4.146 . 0 0 "[ . 1 . 2 . 3]" 1 1740 1 122 ILE MD 1 147 GLN H 3.400 . 4.600 2.891 2.459 3.933 . 0 0 "[ . 1 . 2 . 3]" 1 1741 1 121 ARG HA 1 122 ILE MD 2.700 . 3.700 2.623 2.401 2.937 . 0 0 "[ . 1 . 2 . 3]" 1 1742 1 122 ILE MD 1 123 PHE H 3.500 . 4.700 4.520 4.170 4.819 0.119 26 0 "[ . 1 . 2 . 3]" 1 1743 1 122 ILE H 1 148 VAL HA 3.600 . 4.300 2.702 2.339 3.059 . 0 0 "[ . 1 . 2 . 3]" 1 1744 1 122 ILE HB 1 122 ILE MD 2.900 . 4.500 2.656 2.167 3.198 . 0 0 "[ . 1 . 2 . 3]" 1 1745 1 92 TRP HB2 1 122 ILE MG 3.500 . 4.700 2.895 2.648 3.249 . 0 0 "[ . 1 . 2 . 3]" 1 1746 1 120 LEU MD1 1 122 ILE H 4.400 . 6.300 6.336 6.113 6.420 0.120 9 0 "[ . 1 . 2 . 3]" 1 1747 1 122 ILE MG 1 124 ALA H 3.900 . 5.200 4.059 3.390 4.773 . 0 0 "[ . 1 . 2 . 3]" 1 1748 1 122 ILE MG 1 124 ALA MB 4.600 . 6.500 3.752 3.256 4.297 . 0 0 "[ . 1 . 2 . 3]" 1 1749 1 122 ILE MG 1 123 PHE HA 4.500 . 5.900 3.814 3.183 4.634 . 0 0 "[ . 1 . 2 . 3]" 1 1750 1 93 PHE HA 1 122 ILE MG 4.200 . 5.500 4.831 4.336 5.337 . 0 0 "[ . 1 . 2 . 3]" 1 1751 1 122 ILE MG 1 149 SER H 4.200 . 5.500 4.415 3.798 5.531 0.031 2 0 "[ . 1 . 2 . 3]" 1 1752 1 92 TRP H 1 122 ILE MG 4.200 . 5.500 4.494 4.279 4.700 . 0 0 "[ . 1 . 2 . 3]" 1 1753 1 92 TRP HB3 1 122 ILE MD 4.200 . 5.500 4.487 3.769 5.310 . 0 0 "[ . 1 . 2 . 3]" 1 1754 1 122 ILE MD 1 138 LEU HG 5.000 . 6.500 5.864 4.638 6.508 0.008 2 0 "[ . 1 . 2 . 3]" 1 1755 1 122 ILE H 1 122 ILE HB 3.500 . 4.700 2.854 2.549 3.132 . 0 0 "[ . 1 . 2 . 3]" 1 1756 1 122 ILE H 1 122 ILE MG 3.700 . 5.400 3.776 3.694 3.884 . 0 0 "[ . 1 . 2 . 3]" 1 1757 1 122 ILE HA 1 122 ILE MG 3.500 . 5.200 2.194 2.128 2.272 . 0 0 "[ . 1 . 2 . 3]" 1 1758 1 122 ILE H 1 122 ILE MD 3.200 . 4.800 2.122 1.751 2.494 0.049 11 0 "[ . 1 . 2 . 3]" 1 1759 1 121 ARG HA 1 122 ILE H 3.000 . 3.600 2.185 2.165 2.208 . 0 0 "[ . 1 . 2 . 3]" 1 1760 1 92 TRP HB3 1 122 ILE MG 3.900 . 5.200 2.783 2.302 3.303 . 0 0 "[ . 1 . 2 . 3]" 1 1761 1 122 ILE MD 1 122 ILE MG 2.900 . 5.000 2.535 1.852 3.230 . 0 0 "[ . 1 . 2 . 3]" 1 1762 1 122 ILE HB 1 123 PHE HA 3.600 . 4.300 4.252 3.959 4.644 0.344 26 0 "[ . 1 . 2 . 3]" 1 1763 1 122 ILE MD 1 141 LEU MD1 3.100 . 4.700 2.807 2.083 3.388 . 0 0 "[ . 1 . 2 . 3]" 1 1764 1 120 LEU HA 1 122 ILE MD 3.700 . 4.900 4.688 4.417 4.966 0.066 16 0 "[ . 1 . 2 . 3]" 1 1765 1 92 TRP H 1 123 PHE H 3.900 . 4.700 4.241 3.735 4.429 . 0 0 "[ . 1 . 2 . 3]" 1 1766 1 122 ILE MG 1 123 PHE H 3.500 . 4.700 2.223 1.849 3.141 . 0 0 "[ . 1 . 2 . 3]" 1 1767 1 123 PHE H 1 123 PHE HB2 3.700 . 4.900 2.792 2.356 2.953 . 0 0 "[ . 1 . 2 . 3]" 1 1768 1 92 TRP H 1 123 PHE QD 4.100 . 5.400 3.734 3.277 4.668 . 0 0 "[ . 1 . 2 . 3]" 1 1769 1 123 PHE QD 1 149 SER HB2 3.400 . 4.600 4.048 2.724 4.553 . 0 0 "[ . 1 . 2 . 3]" 1 1770 1 123 PHE HB2 1 123 PHE QD 2.900 . 4.500 2.416 2.316 2.539 . 0 0 "[ . 1 . 2 . 3]" 1 1771 1 123 PHE H 1 123 PHE HB3 3.700 . 4.900 3.800 3.528 3.951 . 0 0 "[ . 1 . 2 . 3]" 1 1772 1 93 PHE H 1 123 PHE H 4.500 . 5.400 5.185 4.875 5.288 . 0 0 "[ . 1 . 2 . 3]" 1 1773 1 91 THR MG 1 123 PHE QD 2.600 . 4.100 2.733 2.302 3.270 . 0 0 "[ . 1 . 2 . 3]" 1 1774 1 91 THR MG 1 123 PHE QE 2.800 . 5.400 3.102 2.125 4.260 . 0 0 "[ . 1 . 2 . 3]" 1 1775 1 122 ILE HA 1 123 PHE H 3.200 . 3.800 2.186 2.056 2.245 . 0 0 "[ . 1 . 2 . 3]" 1 1776 1 123 PHE QE 1 149 SER HB3 3.100 . 4.200 2.523 2.332 3.932 . 0 0 "[ . 1 . 2 . 3]" 1 1777 1 123 PHE QE 1 149 SER HB2 3.400 . 4.600 3.234 2.343 3.933 . 0 0 "[ . 1 . 2 . 3]" 1 1778 1 123 PHE HA 1 123 PHE QD 3.200 . 4.800 2.819 2.371 3.008 . 0 0 "[ . 1 . 2 . 3]" 1 1779 1 123 PHE QD 1 149 SER H 4.100 . 5.400 3.752 2.519 4.206 . 0 0 "[ . 1 . 2 . 3]" 1 1780 1 123 PHE QD 1 149 SER HB3 3.300 . 4.500 3.290 2.317 4.520 0.020 11 0 "[ . 1 . 2 . 3]" 1 1781 1 123 PHE H 1 123 PHE QD 3.600 . 5.300 3.465 2.737 4.027 . 0 0 "[ . 1 . 2 . 3]" 1 1782 1 123 PHE HA 1 123 PHE QE 4.300 . 6.100 4.452 4.337 4.605 . 0 0 "[ . 1 . 2 . 3]" 1 1783 1 93 PHE HA 1 123 PHE QD 3.800 . 5.100 4.616 3.854 5.051 . 0 0 "[ . 1 . 2 . 3]" 1 1784 1 94 ILE MG 1 123 PHE H 3.400 . 4.900 3.320 3.104 5.280 0.380 30 0 "[ . 1 . 2 . 3]" 1 1785 1 94 ILE H 1 124 ALA HA 4.100 . 4.900 3.074 2.857 3.262 . 0 0 "[ . 1 . 2 . 3]" 1 1786 1 94 ILE H 1 124 ALA MB 4.200 . 5.500 4.430 4.298 4.569 . 0 0 "[ . 1 . 2 . 3]" 1 1787 1 93 PHE HA 1 124 ALA MB 4.400 . 5.800 5.822 5.614 5.924 0.124 11 0 "[ . 1 . 2 . 3]" 1 1788 1 124 ALA H 1 151 MET H 4.200 . 5.000 3.878 3.539 4.198 . 0 0 "[ . 1 . 2 . 3]" 1 1789 1 124 ALA H 1 150 ILE HA 3.300 . 4.000 3.315 3.092 3.585 . 0 0 "[ . 1 . 2 . 3]" 1 1790 1 123 PHE QD 1 124 ALA H 3.900 . 5.200 4.174 3.776 4.431 . 0 0 "[ . 1 . 2 . 3]" 1 1791 1 124 ALA H 1 148 VAL MG2 4.200 . 5.500 3.456 3.255 5.512 0.012 18 0 "[ . 1 . 2 . 3]" 1 1792 1 124 ALA MB 1 150 ILE HA 4.000 . 5.300 3.958 3.731 4.190 . 0 0 "[ . 1 . 2 . 3]" 1 1793 1 123 PHE HA 1 124 ALA MB 3.900 . 5.200 3.993 3.954 4.051 . 0 0 "[ . 1 . 2 . 3]" 1 1794 1 94 ILE MG 1 124 ALA MB 3.200 . 4.800 2.415 2.192 4.214 . 0 0 "[ . 1 . 2 . 3]" 1 1795 1 124 ALA MB 1 188 LEU MD1 3.300 . 5.000 4.806 3.752 5.099 0.099 14 0 "[ . 1 . 2 . 3]" 1 1796 1 97 SER HA 1 124 ALA MB 2.700 . 5.700 2.586 2.244 2.909 . 0 0 "[ . 1 . 2 . 3]" 1 1797 1 97 SER HB3 1 124 ALA MB 3.300 . 4.500 4.048 2.936 4.539 0.039 21 0 "[ . 1 . 2 . 3]" 1 1798 1 97 SER HB2 1 124 ALA MB 3.200 . 4.300 3.821 3.346 4.416 0.116 20 0 "[ . 1 . 2 . 3]" 1 1799 1 124 ALA H 1 124 ALA MB 3.100 . 4.200 2.219 2.137 2.305 . 0 0 "[ . 1 . 2 . 3]" 1 1800 1 123 PHE HA 1 124 ALA H 3.200 . 3.800 2.159 2.144 2.176 . 0 0 "[ . 1 . 2 . 3]" 1 1801 1 124 ALA HA 1 126 ARG H 3.700 . 4.400 4.122 3.817 4.478 0.078 15 0 "[ . 1 . 2 . 3]" 1 1802 1 125 ALA H 1 126 ARG H 3.300 . 4.000 2.323 2.099 2.768 . 0 0 "[ . 1 . 2 . 3]" 1 1803 1 17 PHE QE 1 125 ALA H 4.000 . 5.500 4.680 3.889 5.509 0.009 16 0 "[ . 1 . 2 . 3]" 1 1804 1 124 ALA MB 1 125 ALA H 3.300 . 4.500 2.720 2.418 3.051 . 0 0 "[ . 1 . 2 . 3]" 1 1805 1 94 ILE MG 1 125 ALA H 3.400 . 4.800 3.547 3.362 4.926 0.126 30 0 "[ . 1 . 2 . 3]" 1 1806 1 95 SER HA 1 125 ALA MB 2.700 . 3.700 2.084 2.068 2.212 . 0 0 "[ . 1 . 2 . 3]" 1 1807 1 124 ALA HA 1 125 ALA H 3.300 . 4.000 2.295 2.195 2.389 . 0 0 "[ . 1 . 2 . 3]" 1 1808 1 125 ALA H 1 125 ALA MB 3.400 . 4.600 2.293 2.216 2.374 . 0 0 "[ . 1 . 2 . 3]" 1 1809 1 125 ALA MB 1 126 ARG H 3.100 . 4.200 2.651 2.167 2.989 . 0 0 "[ . 1 . 2 . 3]" 1 1810 1 97 SER H 1 126 ARG H 4.200 . 5.000 4.595 3.906 5.083 0.083 23 0 "[ . 1 . 2 . 3]" 1 1811 1 124 ALA MB 1 126 ARG H 3.300 . 4.500 2.825 2.365 3.456 . 0 0 "[ . 1 . 2 . 3]" 1 1812 1 96 TRP HA 1 126 ARG H 3.900 . 4.700 2.928 2.478 3.618 . 0 0 "[ . 1 . 2 . 3]" 1 1813 1 125 ALA HA 1 126 ARG H 4.000 . 4.800 3.508 3.416 3.571 . 0 0 "[ . 1 . 2 . 3]" 1 1814 1 95 SER HA 1 126 ARG H 3.800 . 4.600 4.038 3.334 4.624 0.024 30 0 "[ . 1 . 2 . 3]" 1 1815 1 127 ILE MG 1 191 ILE HG13 2.700 . 5.200 5.058 4.363 5.303 0.103 27 0 "[ . 1 . 2 . 3]" 1 1816 1 127 ILE MG 1 128 TYR HA 3.000 . 5.600 5.198 3.843 5.723 0.123 4 0 "[ . 1 . 2 . 3]" 1 1817 1 127 ILE HG13 1 127 ILE MG 2.700 . 3.700 2.653 2.256 3.051 . 0 0 "[ . 1 . 2 . 3]" 1 1818 1 127 ILE MD 1 128 TYR H 3.300 . 4.500 4.114 3.747 4.513 0.013 17 0 "[ . 1 . 2 . 3]" 1 1819 1 127 ILE MD 1 128 TYR HA 3.200 . 5.800 4.845 3.822 5.884 0.084 22 0 "[ . 1 . 2 . 3]" 1 1820 1 127 ILE MD 1 127 ILE MG 2.200 . 3.600 2.585 1.872 3.232 . 0 0 "[ . 1 . 2 . 3]" 1 1821 1 124 ALA MB 1 127 ILE MG 3.400 . 5.100 3.678 2.447 4.999 . 0 0 "[ . 1 . 2 . 3]" 1 1822 1 127 ILE MG 1 191 ILE MD 3.300 . 5.000 3.947 2.582 5.093 0.093 4 0 "[ . 1 . 2 . 3]" 1 1823 1 127 ILE HA 1 127 ILE MD 2.800 . 3.900 3.302 2.094 4.015 0.115 11 0 "[ . 1 . 2 . 3]" 1 1824 1 127 ILE MD 1 188 LEU HA 3.500 . 6.200 5.432 3.786 6.222 0.022 3 0 "[ . 1 . 2 . 3]" 1 1825 1 127 ILE HB 1 127 ILE MD 2.200 . 4.100 2.479 2.123 3.230 . 0 0 "[ . 1 . 2 . 3]" 1 1826 1 127 ILE MG 1 128 TYR H 3.200 . 4.300 3.509 2.365 4.260 . 0 0 "[ . 1 . 2 . 3]" 1 1827 1 127 ILE HA 1 127 ILE MG 3.200 . 4.300 2.291 2.120 2.699 . 0 0 "[ . 1 . 2 . 3]" 1 1828 1 127 ILE MG 1 138 LEU MD2 2.600 . 5.100 4.258 3.018 5.137 0.037 14 0 "[ . 1 . 2 . 3]" 1 1829 1 128 TYR QD 1 130 TYR H 4.900 . 6.200 2.712 1.774 3.757 0.026 29 0 "[ . 1 . 2 . 3]" 1 1830 1 96 TRP HE3 1 128 TYR QD 3.700 . 4.900 3.364 2.284 4.923 0.023 25 0 "[ . 1 . 2 . 3]" 1 1831 1 128 TYR QD 1 129 ASP H 3.500 . 4.700 3.644 2.661 4.579 . 0 0 "[ . 1 . 2 . 3]" 1 1832 1 128 TYR HA 1 128 TYR QD 3.100 . 4.200 2.650 2.336 3.703 . 0 0 "[ . 1 . 2 . 3]" 1 1833 1 97 SER H 1 128 TYR QD 4.400 . 6.300 4.009 1.844 6.419 0.119 20 0 "[ . 1 . 2 . 3]" 1 1834 1 128 TYR QD 1 130 TYR HB2 3.400 . 4.600 3.006 2.348 4.364 . 0 0 "[ . 1 . 2 . 3]" 1 1835 1 128 TYR HA 1 128 TYR QE 2.900 . 5.600 4.317 4.165 5.601 0.001 23 0 "[ . 1 . 2 . 3]" 1 1836 1 128 TYR HB2 1 128 TYR QE 4.100 . 5.400 4.431 4.398 4.489 . 0 0 "[ . 1 . 2 . 3]" 1 1837 1 96 TRP HH2 1 128 TYR QD 4.500 . 5.900 5.125 3.333 5.914 0.014 23 0 "[ . 1 . 2 . 3]" 1 1838 1 127 ILE HA 1 128 TYR H 3.200 . 3.700 2.182 2.150 2.263 . 0 0 "[ . 1 . 2 . 3]" 1 1839 1 127 ILE HB 1 128 TYR H 4.000 . 5.000 3.553 2.912 4.518 . 0 0 "[ . 1 . 2 . 3]" 1 1840 1 128 TYR HB3 1 128 TYR QE 3.400 . 4.600 4.475 4.408 4.529 . 0 0 "[ . 1 . 2 . 3]" 1 1841 1 128 TYR QE 1 130 TYR H 3.800 . 5.100 4.516 3.248 5.254 0.154 21 0 "[ . 1 . 2 . 3]" 1 1842 1 128 TYR H 1 128 TYR HB3 3.600 . 4.300 3.178 2.455 3.447 . 0 0 "[ . 1 . 2 . 3]" 1 1843 1 96 TRP HZ3 1 128 TYR QE 4.600 . 6.100 5.590 4.323 6.371 0.271 8 0 "[ . 1 . 2 . 3]" 1 1844 1 128 TYR H 1 128 TYR QD 4.100 . 5.400 3.493 1.785 4.122 0.015 21 0 "[ . 1 . 2 . 3]" 1 1845 1 128 TYR H 1 128 TYR HB2 3.900 . 4.700 2.249 2.067 3.621 . 0 0 "[ . 1 . 2 . 3]" 1 1846 1 129 ASP H 1 130 TYR H 3.900 . 4.700 2.623 2.324 2.973 . 0 0 "[ . 1 . 2 . 3]" 1 1847 1 129 ASP H 1 129 ASP HB3 3.400 . 4.100 3.244 2.119 3.628 . 0 0 "[ . 1 . 2 . 3]" 1 1848 1 128 TYR HA 1 129 ASP H 3.100 . 3.700 2.242 2.134 2.633 . 0 0 "[ . 1 . 2 . 3]" 1 1849 1 130 TYR HA 1 131 ASP H 3.500 . 4.200 3.295 3.088 3.483 . 0 0 "[ . 1 . 2 . 3]" 1 1850 1 130 TYR HB2 1 131 ASP H 4.100 . 4.900 3.877 2.956 4.408 . 0 0 "[ . 1 . 2 . 3]" 1 1851 1 131 ASP H 1 131 ASP HB3 3.400 . 4.100 3.439 2.636 3.913 . 0 0 "[ . 1 . 2 . 3]" 1 1852 1 101 SER H 1 133 LEU MD2 4.600 . 6.000 5.140 3.610 6.043 0.043 16 0 "[ . 1 . 2 . 3]" 1 1853 1 133 LEU MD1 1 133 LEU MD2 2.500 . 4.000 1.997 1.844 2.081 . 0 0 "[ . 1 . 2 . 3]" 1 1854 1 100 PHE QE 1 133 LEU MD2 2.700 . 4.200 2.904 2.041 4.285 0.085 8 0 "[ . 1 . 2 . 3]" 1 1855 1 100 PHE QE 1 133 LEU MD1 3.200 . 4.800 4.070 2.289 4.806 0.006 14 0 "[ . 1 . 2 . 3]" 1 1856 1 133 LEU HB3 1 133 LEU MD1 3.200 . 4.800 2.977 2.250 3.200 . 0 0 "[ . 1 . 2 . 3]" 1 1857 1 133 LEU HA 1 133 LEU MD1 2.800 . 4.400 2.552 2.117 3.780 . 0 0 "[ . 1 . 2 . 3]" 1 1858 1 133 LEU HA 1 133 LEU MD2 3.400 . 5.100 3.313 2.154 3.809 . 0 0 "[ . 1 . 2 . 3]" 1 1859 1 133 LEU H 1 133 LEU MD1 3.500 . 5.200 3.151 1.984 4.178 . 0 0 "[ . 1 . 2 . 3]" 1 1860 1 133 LEU MD2 1 134 TYR H 3.700 . 4.900 4.616 3.924 4.946 0.046 22 0 "[ . 1 . 2 . 3]" 1 1861 1 133 LEU MD1 1 137 ALA MB 4.600 . 6.300 5.438 3.071 6.198 . 0 0 "[ . 1 . 2 . 3]" 1 1862 1 133 LEU HB3 1 133 LEU HG 3.000 . 4.100 2.623 2.423 3.033 . 0 0 "[ . 1 . 2 . 3]" 1 1863 1 133 LEU MD2 1 136 GLU H 4.500 . 6.200 5.602 3.574 6.233 0.033 20 0 "[ . 1 . 2 . 3]" 1 1864 1 133 LEU H 1 133 LEU MD2 3.700 . 5.400 4.040 2.250 4.357 . 0 0 "[ . 1 . 2 . 3]" 1 1865 1 133 LEU H 1 133 LEU HB3 3.800 . 5.100 3.224 2.535 3.604 . 0 0 "[ . 1 . 2 . 3]" 1 1866 1 133 LEU H 1 133 LEU HG 3.600 . 4.800 4.080 2.250 4.512 . 0 0 "[ . 1 . 2 . 3]" 1 1867 1 100 PHE QD 1 133 LEU MD2 2.800 . 4.400 2.620 2.144 4.325 . 0 0 "[ . 1 . 2 . 3]" 1 1868 1 133 LEU H 1 134 TYR H 3.300 . 4.000 2.549 2.190 2.941 . 0 0 "[ . 1 . 2 . 3]" 1 1869 1 127 ILE HB 1 134 TYR QE 4.000 . 5.500 3.509 2.490 4.821 . 0 0 "[ . 1 . 2 . 3]" 1 1870 1 134 TYR H 1 134 TYR QD 3.200 . 4.300 2.810 2.009 4.134 . 0 0 "[ . 1 . 2 . 3]" 1 1871 1 133 LEU MD1 1 134 TYR H 4.000 . 5.300 4.486 3.738 4.929 . 0 0 "[ . 1 . 2 . 3]" 1 1872 1 134 TYR H 1 134 TYR HB2 3.600 . 4.300 3.396 2.791 3.595 . 0 0 "[ . 1 . 2 . 3]" 1 1873 1 134 TYR HA 1 134 TYR QD 3.100 . 4.200 3.460 2.374 3.699 . 0 0 "[ . 1 . 2 . 3]" 1 1874 1 135 LYS HA 1 138 LEU H 2.900 . 3.500 3.515 3.404 3.619 0.119 4 0 "[ . 1 . 2 . 3]" 1 1875 1 135 LYS HD2 1 135 LYS HE3 2.800 . 3.400 2.574 2.250 3.035 . 0 0 "[ . 1 . 2 . 3]" 1 1876 1 135 LYS HA 1 135 LYS HD2 3.300 . 4.000 3.858 2.523 4.247 0.247 16 0 "[ . 1 . 2 . 3]" 1 1877 1 135 LYS HD3 1 135 LYS HG3 2.900 . 3.500 2.846 2.504 3.034 . 0 0 "[ . 1 . 2 . 3]" 1 1878 1 135 LYS HD2 1 135 LYS HG3 2.900 . 3.500 2.533 2.265 3.037 . 0 0 "[ . 1 . 2 . 3]" 1 1879 1 135 LYS HA 1 135 LYS HD3 3.300 . 4.000 3.235 2.343 4.169 0.169 27 0 "[ . 1 . 2 . 3]" 1 1880 1 135 LYS H 1 136 GLU H 3.500 . 4.200 2.873 2.691 3.026 . 0 0 "[ . 1 . 2 . 3]" 1 1881 1 135 LYS H 1 138 LEU H 6.000 . 7.000 4.588 4.474 4.794 . 0 0 "[ . 1 . 2 . 3]" 1 1882 1 134 TYR HB2 1 135 LYS H 4.800 3.800 5.800 4.224 3.971 4.371 . 0 0 "[ . 1 . 2 . 3]" 1 1883 1 135 LYS H 1 135 LYS HE2 4.800 3.800 5.800 4.986 4.286 5.809 0.009 11 0 "[ . 1 . 2 . 3]" 1 1884 1 134 TYR H 1 135 LYS H 3.300 . 4.000 2.740 2.637 2.914 . 0 0 "[ . 1 . 2 . 3]" 1 1885 1 137 ALA H 1 137 ALA MB 3.100 . 4.200 2.099 2.029 2.243 . 0 0 "[ . 1 . 2 . 3]" 1 1886 1 100 PHE QD 1 137 ALA MB 3.100 . 4.700 3.132 2.071 4.158 . 0 0 "[ . 1 . 2 . 3]" 1 1887 1 101 SER H 1 137 ALA MB 4.300 . 5.700 2.341 1.790 3.027 0.010 19 0 "[ . 1 . 2 . 3]" 1 1888 1 137 ALA H 1 139 GLN H 5.000 . 6.000 4.554 3.793 4.797 . 0 0 "[ . 1 . 2 . 3]" 1 1889 1 106 GLY H 1 137 ALA MB 5.000 . 6.500 4.809 4.040 5.592 . 0 0 "[ . 1 . 2 . 3]" 1 1890 1 105 ALA MB 1 137 ALA H 4.000 . 5.500 5.150 4.528 5.529 0.029 16 0 "[ . 1 . 2 . 3]" 1 1891 1 105 ALA MB 1 137 ALA HA 3.200 . 4.200 3.464 2.876 4.019 . 0 0 "[ . 1 . 2 . 3]" 1 1892 1 138 LEU H 1 138 LEU MD2 3.500 . 4.700 4.145 3.917 4.347 . 0 0 "[ . 1 . 2 . 3]" 1 1893 1 138 LEU QD 1 141 LEU QD 4.000 . 6.000 3.024 2.446 3.881 . 0 0 "[ . 1 . 2 . 3]" 1 1894 1 138 LEU QD 1 188 LEU QD 4.000 . 5.500 2.446 1.874 3.113 . 0 0 "[ . 1 . 2 . 3]" 1 1895 1 138 LEU H 1 138 LEU HB3 3.400 . 4.100 3.032 2.415 3.404 . 0 0 "[ . 1 . 2 . 3]" 1 1896 1 138 LEU HA 1 138 LEU MD1 2.700 . 4.200 2.395 2.156 3.276 . 0 0 "[ . 1 . 2 . 3]" 1 1897 1 135 LYS HA 1 138 LEU MD1 2.600 . 4.100 4.081 3.790 4.162 0.062 29 0 "[ . 1 . 2 . 3]" 1 1898 1 97 SER H 1 138 LEU MD1 3.700 . 7.400 6.321 4.997 7.354 . 0 0 "[ . 1 . 2 . 3]" 1 1899 1 138 LEU HA 1 138 LEU MD2 3.900 . 5.200 3.670 3.532 3.744 . 0 0 "[ . 1 . 2 . 3]" 1 1900 1 137 ALA MB 1 138 LEU H 3.000 . 4.100 2.729 2.491 2.942 . 0 0 "[ . 1 . 2 . 3]" 1 1901 1 138 LEU QB 1 139 GLN H 4.000 . 5.000 2.325 2.042 3.023 . 0 0 "[ . 1 . 2 . 3]" 1 1902 1 138 LEU H 1 139 GLN H 4.000 . 5.000 2.791 2.483 3.025 . 0 0 "[ . 1 . 2 . 3]" 1 1903 1 138 LEU QD 1 139 GLN H 4.000 . 5.500 3.672 2.497 4.205 . 0 0 "[ . 1 . 2 . 3]" 1 1904 1 138 LEU H 1 140 MET H 4.000 . 5.000 4.229 4.010 4.795 . 0 0 "[ . 1 . 2 . 3]" 1 1905 1 137 ALA H 1 138 LEU H 3.600 . 4.300 2.625 2.543 2.777 . 0 0 "[ . 1 . 2 . 3]" 1 1906 1 138 LEU H 1 138 LEU MD1 3.300 . 4.500 3.189 2.221 4.325 . 0 0 "[ . 1 . 2 . 3]" 1 1907 1 138 LEU MD1 1 138 LEU MD2 2.700 . 4.200 2.007 1.867 2.081 . 0 0 "[ . 1 . 2 . 3]" 1 1908 1 139 GLN HE21 1 139 GLN HG3 3.200 . 4.100 2.797 2.245 3.615 . 0 0 "[ . 1 . 2 . 3]" 1 1909 1 139 GLN HE22 1 139 GLN HG3 3.800 . 4.600 3.742 3.507 4.114 . 0 0 "[ . 1 . 2 . 3]" 1 1910 1 139 GLN HE21 1 139 GLN HG2 3.400 . 4.100 3.043 2.248 3.616 . 0 0 "[ . 1 . 2 . 3]" 1 1911 1 139 GLN HE22 1 139 GLN HG2 3.200 . 4.100 3.853 3.510 4.117 0.017 9 0 "[ . 1 . 2 . 3]" 1 1912 1 139 GLN QE 1 191 ILE MG 4.000 . 5.500 3.540 1.919 5.484 . 0 0 "[ . 1 . 2 . 3]" 1 1913 1 139 GLN QE 1 192 LEU QD 5.000 . 6.500 4.084 1.797 6.224 0.003 16 0 "[ . 1 . 2 . 3]" 1 1914 1 139 GLN H 1 139 GLN HB2 3.300 . 4.000 2.318 2.072 2.851 . 0 0 "[ . 1 . 2 . 3]" 1 1915 1 139 GLN H 1 139 GLN QG 3.200 . 4.700 3.050 1.829 4.052 . 0 0 "[ . 1 . 2 . 3]" 1 1916 1 139 GLN QB 1 191 ILE MG 4.000 . 5.500 4.449 3.041 5.528 0.028 16 0 "[ . 1 . 2 . 3]" 1 1917 1 139 GLN QB 1 192 LEU QD 4.000 . 5.500 4.961 3.829 5.530 0.030 1 0 "[ . 1 . 2 . 3]" 1 1918 1 139 GLN HA 1 139 GLN QE 4.000 . 5.000 3.605 1.898 4.860 . 0 0 "[ . 1 . 2 . 3]" 1 1919 1 140 MET ME 1 140 MET HG2 2.700 . 4.200 2.676 2.180 3.342 . 0 0 "[ . 1 . 2 . 3]" 1 1920 1 106 GLY HA3 1 140 MET ME 3.500 . 4.700 4.431 3.916 4.741 0.041 3 0 "[ . 1 . 2 . 3]" 1 1921 1 140 MET HA 1 140 MET ME 3.200 . 4.700 4.454 3.953 4.674 . 0 0 "[ . 1 . 2 . 3]" 1 1922 1 106 GLY HA2 1 140 MET ME 3.300 . 4.500 3.607 2.908 4.054 . 0 0 "[ . 1 . 2 . 3]" 1 1923 1 140 MET ME 1 141 LEU H 3.800 . 5.600 4.990 4.293 5.614 0.014 21 0 "[ . 1 . 2 . 3]" 1 1924 1 109 ARG HB2 1 140 MET ME 4.000 . 5.100 4.836 3.666 5.164 0.064 9 0 "[ . 1 . 2 . 3]" 1 1925 1 100 PHE QD 1 140 MET ME 3.500 . 6.200 5.065 4.673 5.281 . 0 0 "[ . 1 . 2 . 3]" 1 1926 1 139 GLN H 1 140 MET H 4.000 . 5.000 2.918 2.730 3.139 . 0 0 "[ . 1 . 2 . 3]" 1 1927 1 140 MET H 1 140 MET QG 4.000 . 5.000 3.195 1.831 4.043 . 0 0 "[ . 1 . 2 . 3]" 1 1928 1 106 GLY H 1 140 MET ME 5.000 . 6.500 4.726 3.808 5.524 . 0 0 "[ . 1 . 2 . 3]" 1 1929 1 100 PHE QE 1 140 MET ME 2.700 . 4.200 4.084 3.472 4.293 0.093 9 0 "[ . 1 . 2 . 3]" 1 1930 1 137 ALA H 1 140 MET ME 5.000 . 6.000 5.606 4.547 6.021 0.021 13 0 "[ . 1 . 2 . 3]" 1 1931 1 137 ALA HA 1 140 MET ME 5.000 . 6.000 3.432 2.509 4.038 . 0 0 "[ . 1 . 2 . 3]" 1 1932 1 137 ALA MB 1 140 MET ME 4.200 . 5.800 4.169 3.126 4.845 . 0 0 "[ . 1 . 2 . 3]" 1 1933 1 105 ALA MB 1 140 MET ME 4.200 . 5.800 3.681 2.326 4.422 . 0 0 "[ . 1 . 2 . 3]" 1 1934 1 140 MET ME 1 140 MET HG3 2.500 . 4.000 2.889 2.169 3.347 . 0 0 "[ . 1 . 2 . 3]" 1 1935 1 120 LEU MD1 1 141 LEU MD2 3.000 . 5.600 5.211 4.572 5.690 0.090 26 0 "[ . 1 . 2 . 3]" 1 1936 1 120 LEU QD 1 141 LEU HG 4.200 . 6.000 5.272 4.921 5.621 . 0 0 "[ . 1 . 2 . 3]" 1 1937 1 108 VAL HB 1 141 LEU QD 4.000 . 5.500 3.692 3.238 4.122 . 0 0 "[ . 1 . 2 . 3]" 1 1938 1 108 VAL MG2 1 141 LEU MD2 2.700 . 4.200 3.992 3.412 4.246 0.046 27 0 "[ . 1 . 2 . 3]" 1 1939 1 122 ILE HG12 1 141 LEU MD2 2.700 . 3.700 3.392 2.298 3.728 0.028 10 0 "[ . 1 . 2 . 3]" 1 1940 1 138 LEU HG 1 141 LEU MD2 3.200 . 4.800 4.392 3.487 4.874 0.074 29 0 "[ . 1 . 2 . 3]" 1 1941 1 108 VAL HA 1 141 LEU QD 4.000 . 5.500 5.200 4.934 5.512 0.012 26 0 "[ . 1 . 2 . 3]" 1 1942 1 141 LEU H 1 141 LEU MD2 3.100 . 4.200 4.182 3.896 4.244 0.044 6 0 "[ . 1 . 2 . 3]" 1 1943 1 141 LEU HB2 1 141 LEU MD2 3.100 . 4.200 3.151 3.066 3.203 . 0 0 "[ . 1 . 2 . 3]" 1 1944 1 141 LEU HA 1 141 LEU MD1 3.000 . 4.100 3.534 3.276 3.709 . 0 0 "[ . 1 . 2 . 3]" 1 1945 1 141 LEU HA 1 141 LEU HG 4.000 . 5.000 2.301 2.266 2.469 . 0 0 "[ . 1 . 2 . 3]" 1 1946 1 141 LEU HA 1 141 LEU MD2 3.200 . 4.200 3.032 2.489 3.466 . 0 0 "[ . 1 . 2 . 3]" 1 1947 1 141 LEU HA 1 142 ARG H 4.000 . 5.000 3.580 3.568 3.591 . 0 0 "[ . 1 . 2 . 3]" 1 1948 1 141 LEU HA 1 143 ASP H 4.000 . 5.000 4.091 3.841 4.438 . 0 0 "[ . 1 . 2 . 3]" 1 1949 1 141 LEU HA 1 144 ALA H 4.000 . 5.000 3.601 3.229 3.914 . 0 0 "[ . 1 . 2 . 3]" 1 1950 1 141 LEU HA 1 144 ALA MB 4.000 . 5.500 3.228 2.811 3.705 . 0 0 "[ . 1 . 2 . 3]" 1 1951 1 141 LEU HA 1 146 ALA MB 4.000 . 5.500 4.522 4.432 4.647 . 0 0 "[ . 1 . 2 . 3]" 1 1952 1 141 LEU H 1 141 LEU QB 3.500 . 4.000 2.250 2.206 2.281 . 0 0 "[ . 1 . 2 . 3]" 1 1953 1 141 LEU HB3 1 141 LEU MD2 3.400 . 4.600 2.202 2.147 2.264 . 0 0 "[ . 1 . 2 . 3]" 1 1954 1 140 MET QB 1 141 LEU H 4.000 . 5.000 3.094 2.804 3.654 . 0 0 "[ . 1 . 2 . 3]" 1 1955 1 105 ALA MB 1 141 LEU MD1 3.200 . 4.700 2.439 2.167 2.927 . 0 0 "[ . 1 . 2 . 3]" 1 1956 1 141 LEU MD2 1 142 ARG H 3.000 . 4.100 2.746 2.267 3.050 . 0 0 "[ . 1 . 2 . 3]" 1 1957 1 142 ARG H 1 192 LEU QD 4.000 . 5.500 4.960 4.009 5.500 0.000 7 0 "[ . 1 . 2 . 3]" 1 1958 1 142 ARG H 1 142 ARG HD3 3.900 . 5.200 4.224 3.743 5.069 . 0 0 "[ . 1 . 2 . 3]" 1 1959 1 142 ARG HD3 1 142 ARG HG2 2.600 . 3.500 2.756 2.248 3.034 . 0 0 "[ . 1 . 2 . 3]" 1 1960 1 142 ARG HA 1 146 ALA MB 4.000 . 5.500 2.770 2.278 3.442 . 0 0 "[ . 1 . 2 . 3]" 1 1961 1 139 GLN HA 1 142 ARG QB 4.000 . 5.000 4.269 3.323 5.006 0.006 26 0 "[ . 1 . 2 . 3]" 1 1962 1 142 ARG H 1 142 ARG HB3 3.400 . 4.600 2.986 2.217 3.363 . 0 0 "[ . 1 . 2 . 3]" 1 1963 1 142 ARG H 1 142 ARG HB2 3.700 . 4.900 3.315 2.884 3.616 . 0 0 "[ . 1 . 2 . 3]" 1 1964 1 142 ARG H 1 142 ARG HG2 3.700 . 4.900 2.443 1.804 4.473 . 0 0 "[ . 1 . 2 . 3]" 1 1965 1 141 LEU H 1 142 ARG H 2.700 . 3.200 2.854 2.736 3.057 . 0 0 "[ . 1 . 2 . 3]" 1 1966 1 142 ARG HB3 1 142 ARG HD3 3.000 . 4.100 3.439 2.284 4.108 0.008 29 0 "[ . 1 . 2 . 3]" 1 1967 1 142 ARG H 1 143 ASP H 3.400 . 4.100 2.706 2.541 2.840 . 0 0 "[ . 1 . 2 . 3]" 1 1968 1 143 ASP H 1 143 ASP HB3 3.400 . 4.100 2.980 2.079 3.600 . 0 0 "[ . 1 . 2 . 3]" 1 1969 1 142 ARG HD3 1 143 ASP H 3.800 . 4.600 4.360 2.662 4.786 0.186 4 0 "[ . 1 . 2 . 3]" 1 1970 1 142 ARG HA 1 143 ASP H 4.000 . 5.000 3.481 3.413 3.530 . 0 0 "[ . 1 . 2 . 3]" 1 1971 1 143 ASP H 1 143 ASP HB2 3.200 . 3.800 2.350 2.074 3.174 . 0 0 "[ . 1 . 2 . 3]" 1 1972 1 143 ASP H 1 145 GLY H 3.300 . 4.000 4.040 4.002 4.105 0.105 26 0 "[ . 1 . 2 . 3]" 1 1973 1 142 ARG HG2 1 143 ASP H 3.600 . 4.300 4.045 3.756 4.295 . 0 0 "[ . 1 . 2 . 3]" 1 1974 1 142 ARG HB3 1 143 ASP H 3.800 . 4.600 4.057 3.150 4.329 . 0 0 "[ . 1 . 2 . 3]" 1 1975 1 143 ASP H 1 144 ALA H 3.400 . 4.100 2.644 2.390 2.778 . 0 0 "[ . 1 . 2 . 3]" 1 1976 1 142 ARG HB2 1 143 ASP H 3.700 . 4.400 3.492 2.840 4.303 . 0 0 "[ . 1 . 2 . 3]" 1 1977 1 144 ALA HA 1 144 ALA MB 2.400 . 3.400 2.132 2.101 2.145 . 0 0 "[ . 1 . 2 . 3]" 1 1978 1 144 ALA H 1 144 ALA HA 2.900 . 3.500 2.857 2.823 2.910 . 0 0 "[ . 1 . 2 . 3]" 1 1979 1 112 LEU MD2 1 144 ALA H 4.900 . 6.500 5.832 4.491 6.398 . 0 0 "[ . 1 . 2 . 3]" 1 1980 1 141 LEU MD2 1 144 ALA MB 4.000 . 5.500 3.439 2.402 4.324 . 0 0 "[ . 1 . 2 . 3]" 1 1981 1 141 LEU HG 1 144 ALA H 4.000 . 5.000 5.067 4.754 5.174 0.174 23 0 "[ . 1 . 2 . 3]" 1 1982 1 143 ASP HA 1 144 ALA H 3.200 . 3.700 3.484 3.416 3.535 . 0 0 "[ . 1 . 2 . 3]" 1 1983 1 144 ALA H 1 144 ALA MB 2.800 . 3.900 2.208 2.051 2.277 . 0 0 "[ . 1 . 2 . 3]" 1 1984 1 143 ASP HB2 1 144 ALA H 4.500 . 5.400 3.630 2.938 4.299 . 0 0 "[ . 1 . 2 . 3]" 1 1985 1 143 ASP HB3 1 144 ALA H 3.400 . 4.100 3.193 2.774 3.934 . 0 0 "[ . 1 . 2 . 3]" 1 1986 1 145 GLY H 1 145 GLY HA2 3.000 . 3.600 2.467 2.443 2.476 . 0 0 "[ . 1 . 2 . 3]" 1 1987 1 144 ALA H 1 145 GLY H 3.000 . 3.600 2.542 2.307 2.656 . 0 0 "[ . 1 . 2 . 3]" 1 1988 1 145 GLY H 1 145 GLY HA3 3.000 . 3.600 2.965 2.962 2.967 . 0 0 "[ . 1 . 2 . 3]" 1 1989 1 142 ARG HA 1 145 GLY H 3.000 . 3.600 3.521 3.157 3.714 0.114 3 0 "[ . 1 . 2 . 3]" 1 1990 1 144 ALA MB 1 145 GLY H 3.000 . 4.100 3.123 3.003 3.243 . 0 0 "[ . 1 . 2 . 3]" 1 1991 1 145 GLY H 1 146 ALA H 2.900 . 3.500 2.316 1.939 2.490 . 0 0 "[ . 1 . 2 . 3]" 1 1992 1 144 ALA HA 1 145 GLY H 3.100 . 3.700 3.355 3.309 3.410 . 0 0 "[ . 1 . 2 . 3]" 1 1993 1 146 ALA H 1 146 ALA MB 2.700 . 3.700 2.099 2.024 2.503 . 0 0 "[ . 1 . 2 . 3]" 1 1994 1 141 LEU HB2 1 146 ALA MB 3.500 . 5.200 5.256 5.180 5.329 0.129 29 0 "[ . 1 . 2 . 3]" 1 1995 1 122 ILE MD 1 146 ALA MB 4.000 . 5.800 2.186 1.877 2.757 . 0 0 "[ . 1 . 2 . 3]" 1 1996 1 120 LEU MD2 1 146 ALA MB 3.200 . 4.800 2.984 2.788 3.392 . 0 0 "[ . 1 . 2 . 3]" 1 1997 1 145 GLY HA2 1 146 ALA H 3.500 . 4.200 3.400 2.885 3.469 . 0 0 "[ . 1 . 2 . 3]" 1 1998 1 145 GLY HA3 1 146 ALA H 3.300 . 4.000 3.119 3.036 3.520 . 0 0 "[ . 1 . 2 . 3]" 1 1999 1 141 LEU MD2 1 146 ALA H 3.000 . 4.100 3.695 3.193 4.187 0.087 25 0 "[ . 1 . 2 . 3]" 1 2000 1 144 ALA H 1 146 ALA H 4.200 . 5.000 3.661 3.359 3.931 . 0 0 "[ . 1 . 2 . 3]" 1 2001 1 142 ARG HA 1 146 ALA H 3.300 . 4.000 3.160 2.464 3.719 . 0 0 "[ . 1 . 2 . 3]" 1 2002 1 144 ALA MB 1 146 ALA H 4.000 . 5.500 2.843 2.611 3.938 . 0 0 "[ . 1 . 2 . 3]" 1 2003 1 112 LEU MD2 1 146 ALA H 3.400 . 4.600 3.653 2.518 4.612 0.012 5 0 "[ . 1 . 2 . 3]" 1 2004 1 122 ILE H 1 147 GLN H 3.700 . 4.400 3.233 2.788 3.676 . 0 0 "[ . 1 . 2 . 3]" 1 2005 1 147 GLN HE21 1 147 GLN HG2 3.100 . 4.000 3.269 2.256 3.601 . 0 0 "[ . 1 . 2 . 3]" 1 2006 1 147 GLN HE21 1 147 GLN HG3 3.300 . 4.000 3.116 2.245 3.584 . 0 0 "[ . 1 . 2 . 3]" 1 2007 1 147 GLN H 1 147 GLN HE22 3.600 . 6.100 6.036 5.075 6.165 0.065 6 0 "[ . 1 . 2 . 3]" 1 2008 1 147 GLN H 1 147 GLN HA 2.900 . 3.500 2.958 2.951 2.965 . 0 0 "[ . 1 . 2 . 3]" 1 2009 1 147 GLN HE22 1 147 GLN HG3 3.100 . 4.000 3.879 3.510 4.094 0.094 2 0 "[ . 1 . 2 . 3]" 1 2010 1 147 GLN HA 1 147 GLN HG2 3.700 . 4.400 2.729 2.380 3.570 . 0 0 "[ . 1 . 2 . 3]" 1 2011 1 147 GLN HA 1 147 GLN HG3 3.300 . 4.000 2.416 2.283 3.568 . 0 0 "[ . 1 . 2 . 3]" 1 2012 1 147 GLN HE22 1 147 GLN HG2 3.100 . 4.000 3.952 3.515 4.104 0.104 17 0 "[ . 1 . 2 . 3]" 1 2013 1 147 GLN H 1 147 GLN HG3 3.600 . 5.300 4.416 4.153 5.030 . 0 0 "[ . 1 . 2 . 3]" 1 2014 1 146 ALA HA 1 147 GLN H 3.000 . 3.600 2.462 2.402 2.520 . 0 0 "[ . 1 . 2 . 3]" 1 2015 1 121 ARG HA 1 147 GLN H 3.100 . 3.700 2.270 2.067 2.592 . 0 0 "[ . 1 . 2 . 3]" 1 2016 1 121 ARG HA 1 147 GLN HA 4.000 . 5.000 4.705 4.549 4.928 . 0 0 "[ . 1 . 2 . 3]" 1 2017 1 147 GLN H 1 147 GLN HB2 3.300 . 4.000 2.736 2.628 2.958 . 0 0 "[ . 1 . 2 . 3]" 1 2018 1 147 GLN H 1 147 GLN HG2 3.500 . 5.000 4.804 4.599 5.039 0.039 29 0 "[ . 1 . 2 . 3]" 1 2019 1 146 ALA MB 1 147 GLN H 2.800 . 4.400 2.422 2.217 2.558 . 0 0 "[ . 1 . 2 . 3]" 1 2020 1 147 GLN H 1 147 GLN HB3 3.500 . 4.200 3.257 2.978 3.418 . 0 0 "[ . 1 . 2 . 3]" 1 2021 1 148 VAL H 1 148 VAL HB 3.100 . 3.700 3.162 2.806 3.551 . 0 0 "[ . 1 . 2 . 3]" 1 2022 1 123 PHE H 1 148 VAL MG1 3.700 . 6.400 6.430 3.776 6.594 0.194 26 0 "[ . 1 . 2 . 3]" 1 2023 1 148 VAL MG2 1 149 SER H 3.400 . 4.600 2.025 1.770 4.123 0.030 28 0 "[ . 1 . 2 . 3]" 1 2024 1 142 ARG HG2 1 148 VAL H 3.400 . 4.100 4.128 3.983 4.255 0.155 4 0 "[ . 1 . 2 . 3]" 1 2025 1 138 LEU MD2 1 148 VAL MG1 3.500 . 5.000 2.339 2.036 3.085 . 0 0 "[ . 1 . 2 . 3]" 1 2026 1 122 ILE HG12 1 148 VAL MG2 4.700 . 5.700 4.282 3.644 5.163 . 0 0 "[ . 1 . 2 . 3]" 1 2027 1 122 ILE HG12 1 148 VAL MG1 4.900 . 6.500 4.495 3.150 5.518 . 0 0 "[ . 1 . 2 . 3]" 1 2028 1 138 LEU HG 1 148 VAL MG2 3.200 . 4.300 3.226 2.437 3.941 . 0 0 "[ . 1 . 2 . 3]" 1 2029 1 138 LEU HG 1 148 VAL MG1 3.000 . 4.100 2.335 2.090 3.439 . 0 0 "[ . 1 . 2 . 3]" 1 2030 1 123 PHE H 1 148 VAL MG2 3.300 . 5.000 4.426 4.108 5.199 0.199 18 0 "[ . 1 . 2 . 3]" 1 2031 1 147 GLN HB2 1 148 VAL H 4.000 . 4.800 4.527 4.330 4.605 . 0 0 "[ . 1 . 2 . 3]" 1 2032 1 147 GLN QB 1 148 VAL H 4.000 . 5.000 3.647 3.498 3.730 . 0 0 "[ . 1 . 2 . 3]" 1 2033 1 148 VAL MG1 1 148 VAL MG2 2.600 . 4.100 2.016 1.891 2.077 . 0 0 "[ . 1 . 2 . 3]" 1 2034 1 138 LEU MD1 1 148 VAL MG1 3.700 . 5.200 3.062 2.088 3.827 . 0 0 "[ . 1 . 2 . 3]" 1 2035 1 122 ILE MD 1 148 VAL MG2 3.100 . 4.700 4.184 2.167 4.812 0.112 2 0 "[ . 1 . 2 . 3]" 1 2036 1 138 LEU MD1 1 148 VAL MG2 3.000 . 4.600 2.713 1.968 3.469 . 0 0 "[ . 1 . 2 . 3]" 1 2037 1 141 LEU MD2 1 148 VAL MG1 2.800 . 4.400 3.227 2.051 4.187 . 0 0 "[ . 1 . 2 . 3]" 1 2038 1 122 ILE MG 1 148 VAL MG2 2.600 . 4.100 3.196 2.517 4.008 . 0 0 "[ . 1 . 2 . 3]" 1 2039 1 141 LEU MD1 1 148 VAL MG2 3.000 . 4.600 4.324 3.176 4.634 0.034 25 0 "[ . 1 . 2 . 3]" 1 2040 1 124 ALA MB 1 148 VAL MG1 3.900 . 5.500 5.444 3.150 5.599 0.099 9 0 "[ . 1 . 2 . 3]" 1 2041 1 148 VAL HA 1 148 VAL MG2 2.800 . 3.900 2.444 2.320 2.649 . 0 0 "[ . 1 . 2 . 3]" 1 2042 1 141 LEU MD1 1 148 VAL MG1 2.600 . 4.100 3.972 3.528 4.201 0.101 18 0 "[ . 1 . 2 . 3]" 1 2043 1 148 VAL HA 1 148 VAL MG1 3.100 . 4.200 3.125 2.201 3.179 . 0 0 "[ . 1 . 2 . 3]" 1 2044 1 148 VAL MG2 1 188 LEU HB2 5.500 . 7.200 5.925 5.314 7.209 0.009 18 0 "[ . 1 . 2 . 3]" 1 2045 1 148 VAL MG2 1 188 LEU QD 3.200 . 4.700 2.571 2.201 3.845 . 0 0 "[ . 1 . 2 . 3]" 1 2046 1 122 ILE HB 1 148 VAL MG2 3.200 . 4.300 2.696 2.265 3.172 . 0 0 "[ . 1 . 2 . 3]" 1 2047 1 147 GLN HG3 1 148 VAL H 3.400 . 4.100 3.813 2.579 4.233 0.133 6 0 "[ . 1 . 2 . 3]" 1 2048 1 148 VAL MG1 1 149 SER H 3.300 . 4.500 3.854 2.035 4.115 . 0 0 "[ . 1 . 2 . 3]" 1 2049 1 138 LEU MD2 1 148 VAL MG2 2.600 . 4.100 2.637 1.920 3.833 . 0 0 "[ . 1 . 2 . 3]" 1 2050 1 148 VAL H 1 148 VAL MG1 3.300 . 4.500 1.921 1.792 3.848 0.008 12 0 "[ . 1 . 2 . 3]" 1 2051 1 147 GLN HA 1 148 VAL H 2.600 . 3.100 2.156 2.137 2.204 . 0 0 "[ . 1 . 2 . 3]" 1 2052 1 123 PHE HA 1 148 VAL HB 3.800 . 5.300 5.407 4.775 5.570 0.270 4 0 "[ . 1 . 2 . 3]" 1 2053 1 142 ARG HB3 1 148 VAL H 3.100 . 3.700 3.392 2.528 3.832 0.132 3 0 "[ . 1 . 2 . 3]" 1 2054 1 147 GLN HG2 1 148 VAL H 3.600 . 4.300 3.665 3.265 4.396 0.096 29 0 "[ . 1 . 2 . 3]" 1 2055 1 148 VAL H 1 148 VAL MG2 2.900 . 4.000 3.684 2.306 3.832 . 0 0 "[ . 1 . 2 . 3]" 1 2056 1 142 ARG QB 1 148 VAL MG1 4.000 . 5.500 2.943 2.082 5.527 0.027 18 0 "[ . 1 . 2 . 3]" 1 2057 1 147 GLN HB3 1 148 VAL H 3.200 . 3.800 3.847 3.645 3.976 0.176 26 0 "[ . 1 . 2 . 3]" 1 2058 1 148 VAL HA 1 149 SER H 2.900 . 3.500 2.243 2.138 2.320 . 0 0 "[ . 1 . 2 . 3]" 1 2059 1 149 SER H 1 149 SER HB2 3.800 . 4.600 3.137 2.852 4.024 . 0 0 "[ . 1 . 2 . 3]" 1 2060 1 122 ILE H 1 149 SER H 3.800 . 4.600 4.517 4.272 4.682 0.082 15 0 "[ . 1 . 2 . 3]" 1 2061 1 123 PHE HA 1 149 SER H 3.600 . 4.300 2.622 2.293 2.758 . 0 0 "[ . 1 . 2 . 3]" 1 2062 1 124 ALA H 1 149 SER H 4.600 . 5.500 3.681 3.476 3.804 . 0 0 "[ . 1 . 2 . 3]" 1 2063 1 149 SER H 1 149 SER HB3 3.400 . 4.100 3.425 2.895 3.889 . 0 0 "[ . 1 . 2 . 3]" 1 2064 1 149 SER HA 1 149 SER HB2 2.900 . 3.500 2.737 2.237 2.827 . 0 0 "[ . 1 . 2 . 3]" 1 2065 1 148 VAL HB 1 149 SER H 3.600 . 4.300 3.793 3.642 4.036 . 0 0 "[ . 1 . 2 . 3]" 1 2066 1 148 VAL HA 1 149 SER HB3 2.600 . 5.100 5.007 3.994 5.217 0.117 18 0 "[ . 1 . 2 . 3]" 1 2067 1 124 ALA MB 1 149 SER H 3.700 . 4.900 4.811 4.678 4.916 0.016 1 0 "[ . 1 . 2 . 3]" 1 2068 1 124 ALA HA 1 150 ILE MD 4.200 . 5.500 5.258 4.896 5.515 0.015 24 0 "[ . 1 . 2 . 3]" 1 2069 1 149 SER HB2 1 150 ILE H 3.600 . 4.300 3.640 2.363 3.903 . 0 0 "[ . 1 . 2 . 3]" 1 2070 1 149 SER H 1 150 ILE H 3.800 . 4.600 4.377 4.361 4.395 . 0 0 "[ . 1 . 2 . 3]" 1 2071 1 150 ILE HB 1 150 ILE MD 2.700 . 3.700 2.504 2.183 3.219 . 0 0 "[ . 1 . 2 . 3]" 1 2072 1 150 ILE H 1 150 ILE MD 2.900 . 4.000 3.836 2.934 4.180 0.180 15 0 "[ . 1 . 2 . 3]" 1 2073 1 150 ILE H 1 150 ILE MG 3.400 . 4.600 2.696 1.826 3.816 . 0 0 "[ . 1 . 2 . 3]" 1 2074 1 150 ILE HG12 1 150 ILE MG 3.500 . 4.700 2.519 2.184 3.193 . 0 0 "[ . 1 . 2 . 3]" 1 2075 1 150 ILE MD 1 150 ILE MG 2.800 . 4.400 2.771 1.792 3.239 0.008 3 0 "[ . 1 . 2 . 3]" 1 2076 1 150 ILE HA 1 151 MET H 3.300 . 4.000 2.197 2.146 2.293 . 0 0 "[ . 1 . 2 . 3]" 1 2077 1 150 ILE HA 1 150 ILE MG 3.000 . 4.100 2.925 2.254 3.194 . 0 0 "[ . 1 . 2 . 3]" 1 2078 1 124 ALA MB 1 150 ILE MD 2.600 . 4.100 3.355 2.972 3.921 . 0 0 "[ . 1 . 2 . 3]" 1 2079 1 150 ILE HA 1 150 ILE MD 2.900 . 4.000 2.217 2.076 2.341 . 0 0 "[ . 1 . 2 . 3]" 1 2080 1 150 ILE MG 1 151 MET H 3.500 . 4.700 3.201 2.104 3.838 . 0 0 "[ . 1 . 2 . 3]" 1 2081 1 149 SER HA 1 150 ILE H 3.200 . 3.800 2.562 2.521 2.586 . 0 0 "[ . 1 . 2 . 3]" 1 2082 1 149 SER HB3 1 150 ILE H 3.600 . 4.300 2.755 2.522 3.845 . 0 0 "[ . 1 . 2 . 3]" 1 2083 1 150 ILE H 1 150 ILE HB 3.400 . 4.100 2.533 2.223 2.668 . 0 0 "[ . 1 . 2 . 3]" 1 2084 1 150 ILE MD 1 188 LEU HB2 2.300 . 3.800 3.271 2.297 3.844 0.044 26 0 "[ . 1 . 2 . 3]" 1 2085 1 150 ILE MD 1 188 LEU QD 3.200 . 4.700 2.380 1.975 3.314 . 0 0 "[ . 1 . 2 . 3]" 1 2086 1 150 ILE H 1 151 MET H 3.800 . 4.600 4.533 4.403 4.601 0.001 25 0 "[ . 1 . 2 . 3]" 1 2087 1 150 ILE H 1 150 ILE QG 4.000 . 5.000 3.600 2.206 4.110 . 0 0 "[ . 1 . 2 . 3]" 1 2088 1 150 ILE H 1 189 ARG QD 4.000 . 5.500 4.997 4.212 5.574 0.074 3 0 "[ . 1 . 2 . 3]" 1 2089 1 150 ILE MD 1 151 MET H 3.600 . 4.800 3.239 1.856 3.722 . 0 0 "[ . 1 . 2 . 3]" 1 2090 1 125 ALA MB 1 151 MET ME 4.000 . 6.000 2.939 2.121 4.111 . 0 0 "[ . 1 . 2 . 3]" 1 2091 1 93 PHE QB 1 151 MET ME 3.500 . 4.700 3.126 2.523 4.196 . 0 0 "[ . 1 . 2 . 3]" 1 2092 1 151 MET HA 1 151 MET ME 4.000 . 5.500 4.152 3.711 4.539 . 0 0 "[ . 1 . 2 . 3]" 1 2093 1 93 PHE QD 1 151 MET ME 4.000 . 6.000 2.538 2.155 3.892 . 0 0 "[ . 1 . 2 . 3]" 1 2094 1 150 ILE HB 1 151 MET H 4.000 . 5.000 4.212 3.956 4.500 . 0 0 "[ . 1 . 2 . 3]" 1 2095 1 93 PHE HZ 1 151 MET ME 5.000 . 6.800 5.000 3.906 6.716 . 0 0 "[ . 1 . 2 . 3]" 1 2096 1 151 MET H 1 151 MET ME 4.000 . 5.500 4.458 3.760 5.466 . 0 0 "[ . 1 . 2 . 3]" 1 2097 1 151 MET HA 1 152 THR H 3.800 . 4.600 2.200 2.139 2.341 . 0 0 "[ . 1 . 2 . 3]" 1 2098 1 152 THR H 1 152 THR HB 4.000 . 5.000 3.170 3.024 3.525 . 0 0 "[ . 1 . 2 . 3]" 1 2099 1 152 THR MG 1 153 TYR H 3.500 . 4.700 2.202 1.794 3.008 0.006 26 0 "[ . 1 . 2 . 3]" 1 2100 1 152 THR MG 1 154 ASP H 4.000 . 5.500 3.700 3.234 4.397 . 0 0 "[ . 1 . 2 . 3]" 1 2101 1 152 THR MG 1 155 GLU H 4.000 . 5.500 4.208 3.741 4.740 . 0 0 "[ . 1 . 2 . 3]" 1 2102 1 152 THR HA 1 152 THR MG 2.900 . 4.000 2.136 2.119 2.156 . 0 0 "[ . 1 . 2 . 3]" 1 2103 1 152 THR H 1 155 GLU HB3 4.300 . 5.200 3.081 2.545 3.758 . 0 0 "[ . 1 . 2 . 3]" 1 2104 1 152 THR H 1 155 GLU H 4.000 . 5.000 3.709 3.176 3.972 . 0 0 "[ . 1 . 2 . 3]" 1 2105 1 152 THR H 1 155 GLU HA 4.000 . 5.000 4.924 4.652 5.110 0.110 9 0 "[ . 1 . 2 . 3]" 1 2106 1 152 THR H 1 156 PHE QD 5.000 . 6.500 4.392 3.594 5.256 . 0 0 "[ . 1 . 2 . 3]" 1 2107 1 152 THR H 1 152 THR MG 3.600 . 4.800 3.693 3.256 3.887 . 0 0 "[ . 1 . 2 . 3]" 1 2108 1 151 MET HA 1 152 THR MG 3.400 . 5.100 4.952 4.431 5.102 0.002 26 0 "[ . 1 . 2 . 3]" 1 2109 1 153 TYR H 1 153 TYR HB3 3.000 . 3.600 2.509 2.192 2.772 . 0 0 "[ . 1 . 2 . 3]" 1 2110 1 153 TYR H 1 154 ASP H 4.000 . 4.800 2.892 2.676 3.122 . 0 0 "[ . 1 . 2 . 3]" 1 2111 1 153 TYR H 1 177 LEU MD1 4.000 . 5.500 3.613 2.720 4.069 . 0 0 "[ . 1 . 2 . 3]" 1 2112 1 153 TYR QE 1 171 PHE QD 3.600 . 5.300 4.087 2.666 5.099 . 0 0 "[ . 1 . 2 . 3]" 1 2113 1 153 TYR QD 1 171 PHE QD 3.700 . 5.400 4.680 3.221 5.447 0.047 28 0 "[ . 1 . 2 . 3]" 1 2114 1 153 TYR QE 1 177 LEU MD2 3.700 . 5.400 4.756 2.822 5.434 0.034 15 0 "[ . 1 . 2 . 3]" 1 2115 1 153 TYR QE 1 173 PRO HG2 3.100 . 4.200 3.615 2.536 4.254 0.054 29 0 "[ . 1 . 2 . 3]" 1 2116 1 152 THR HB 1 153 TYR H 3.200 . 3.700 2.768 2.204 3.431 . 0 0 "[ . 1 . 2 . 3]" 1 2117 1 153 TYR QD 1 154 ASP HB3 3.400 . 4.500 4.051 2.747 4.525 0.025 15 0 "[ . 1 . 2 . 3]" 1 2118 1 152 THR HA 1 153 TYR H 3.200 . 3.700 2.470 2.222 2.711 . 0 0 "[ . 1 . 2 . 3]" 1 2119 1 153 TYR QE 1 173 PRO HD3 3.700 . 4.900 4.015 2.695 4.928 0.028 29 0 "[ . 1 . 2 . 3]" 1 2120 1 153 TYR H 1 153 TYR QD 3.800 . 5.100 4.129 3.993 4.193 . 0 0 "[ . 1 . 2 . 3]" 1 2121 1 153 TYR QE 1 173 PRO HG3 3.200 . 4.300 2.605 2.327 3.815 . 0 0 "[ . 1 . 2 . 3]" 1 2122 1 153 TYR QD 1 178 GLU HG3 3.100 . 4.200 4.014 2.511 4.268 0.068 29 0 "[ . 1 . 2 . 3]" 1 2123 1 153 TYR QE 1 154 ASP H 4.100 . 5.600 5.034 4.229 5.674 0.074 9 0 "[ . 1 . 2 . 3]" 1 2124 1 153 TYR HB3 1 153 TYR QD 2.900 . 4.000 2.412 2.312 2.509 . 0 0 "[ . 1 . 2 . 3]" 1 2125 1 153 TYR QD 1 154 ASP H 3.100 . 4.200 2.879 2.154 3.431 . 0 0 "[ . 1 . 2 . 3]" 1 2126 1 152 THR HB 1 154 ASP H 3.200 . 3.700 2.983 2.249 3.400 . 0 0 "[ . 1 . 2 . 3]" 1 2127 1 154 ASP H 1 154 ASP HB3 3.300 . 4.000 2.429 2.065 3.407 . 0 0 "[ . 1 . 2 . 3]" 1 2128 1 153 TYR HB3 1 154 ASP H 3.300 . 4.000 2.321 2.097 2.992 . 0 0 "[ . 1 . 2 . 3]" 1 2129 1 154 ASP H 1 155 GLU H 3.100 . 3.700 2.765 2.588 3.035 . 0 0 "[ . 1 . 2 . 3]" 1 2130 1 154 ASP H 1 154 ASP HB2 3.300 . 4.000 3.093 2.085 3.581 . 0 0 "[ . 1 . 2 . 3]" 1 2131 1 155 GLU H 1 155 GLU HG3 2.900 . 3.800 3.164 1.809 3.833 0.033 10 0 "[ . 1 . 2 . 3]" 1 2132 1 155 GLU H 1 155 GLU HG2 2.800 . 3.700 3.074 1.957 3.738 0.038 9 0 "[ . 1 . 2 . 3]" 1 2133 1 155 GLU H 1 155 GLU HB2 2.800 . 3.700 2.383 2.118 3.554 . 0 0 "[ . 1 . 2 . 3]" 1 2134 1 154 ASP HB3 1 155 GLU H 3.200 . 3.800 3.202 2.465 3.832 0.032 29 0 "[ . 1 . 2 . 3]" 1 2135 1 155 GLU H 1 155 GLU HB3 2.600 . 3.400 3.422 2.211 3.562 0.162 8 0 "[ . 1 . 2 . 3]" 1 2136 1 155 GLU H 1 157 GLU H 3.600 . 4.300 4.183 3.931 4.333 0.033 9 0 "[ . 1 . 2 . 3]" 1 2137 1 93 PHE HZ 1 155 GLU QB 5.000 . 6.000 2.636 2.210 4.353 . 0 0 "[ . 1 . 2 . 3]" 1 2138 1 125 ALA MB 1 156 PHE QD 4.000 . 6.000 5.311 4.555 6.018 0.018 15 0 "[ . 1 . 2 . 3]" 1 2139 1 125 ALA MB 1 156 PHE HZ 3.300 . 4.300 3.220 2.152 4.289 . 0 0 "[ . 1 . 2 . 3]" 1 2140 1 156 PHE HZ 1 174 TRP HZ2 5.000 . 6.000 3.660 2.356 5.239 . 0 0 "[ . 1 . 2 . 3]" 1 2141 1 156 PHE H 1 158 TYR H 4.000 . 5.000 4.192 3.907 4.615 . 0 0 "[ . 1 . 2 . 3]" 1 2142 1 156 PHE HB2 1 156 PHE QD 3.000 . 4.100 2.318 2.311 2.351 . 0 0 "[ . 1 . 2 . 3]" 1 2143 1 156 PHE HA 1 156 PHE QD 3.200 . 4.300 2.600 2.422 2.871 . 0 0 "[ . 1 . 2 . 3]" 1 2144 1 156 PHE QD 1 171 PHE QE 4.000 . 6.000 3.235 2.840 4.072 . 0 0 "[ . 1 . 2 . 3]" 1 2145 1 156 PHE QD 1 177 LEU MD2 4.400 . 5.800 3.053 2.314 4.508 . 0 0 "[ . 1 . 2 . 3]" 1 2146 1 156 PHE H 1 156 PHE QD 3.900 . 5.200 3.570 3.148 3.981 . 0 0 "[ . 1 . 2 . 3]" 1 2147 1 152 THR H 1 156 PHE H 4.800 3.800 5.800 3.993 3.770 4.413 0.030 9 0 "[ . 1 . 2 . 3]" 1 2148 1 155 GLU H 1 156 PHE H 3.200 . 3.800 2.649 2.361 2.908 . 0 0 "[ . 1 . 2 . 3]" 1 2149 1 154 ASP H 1 156 PHE H 3.800 . 4.600 4.111 3.700 4.493 . 0 0 "[ . 1 . 2 . 3]" 1 2150 1 152 THR HA 1 156 PHE QD 4.000 . 5.500 4.526 3.806 5.290 . 0 0 "[ . 1 . 2 . 3]" 1 2151 1 156 PHE H 1 156 PHE HB2 3.400 . 4.300 2.088 2.059 2.161 . 0 0 "[ . 1 . 2 . 3]" 1 2152 1 156 PHE H 1 157 GLU H 3.200 . 3.800 2.593 2.409 2.841 . 0 0 "[ . 1 . 2 . 3]" 1 2153 1 156 PHE HB3 1 156 PHE QD 2.900 . 4.000 2.604 2.494 2.717 . 0 0 "[ . 1 . 2 . 3]" 1 2154 1 157 GLU H 1 157 GLU HA 2.900 . 3.500 2.845 2.805 2.892 . 0 0 "[ . 1 . 2 . 3]" 1 2155 1 157 GLU H 1 171 PHE QE 4.000 . 5.500 5.103 3.496 5.503 0.003 19 0 "[ . 1 . 2 . 3]" 1 2156 1 157 GLU H 1 177 LEU MD2 4.400 . 6.300 6.039 5.157 6.357 0.057 19 0 "[ . 1 . 2 . 3]" 1 2157 1 157 GLU H 1 157 GLU HG3 3.100 . 4.000 3.282 2.172 4.178 0.178 30 0 "[ . 1 . 2 . 3]" 1 2158 1 155 GLU HA 1 157 GLU H 3.000 . 4.400 4.321 4.082 4.429 0.029 13 0 "[ . 1 . 2 . 3]" 1 2159 1 156 PHE HB3 1 157 GLU H 2.800 . 3.400 3.004 2.797 3.260 . 0 0 "[ . 1 . 2 . 3]" 1 2160 1 156 PHE HB2 1 157 GLU H 3.100 . 3.700 3.196 2.973 3.441 . 0 0 "[ . 1 . 2 . 3]" 1 2161 1 156 PHE QD 1 157 GLU H 3.600 . 4.800 4.552 4.367 4.683 . 0 0 "[ . 1 . 2 . 3]" 1 2162 1 153 TYR QD 1 157 GLU H 4.500 . 6.000 4.791 3.924 5.305 . 0 0 "[ . 1 . 2 . 3]" 1 2163 1 157 GLU HB2 1 158 TYR H 3.000 . 3.600 3.009 2.315 3.743 0.143 30 0 "[ . 1 . 2 . 3]" 1 2164 1 157 GLU HB3 1 158 TYR H 3.600 . 4.300 3.242 2.292 4.048 . 0 0 "[ . 1 . 2 . 3]" 1 2165 1 157 GLU HA 1 157 GLU HB2 3.000 . 3.600 2.854 2.362 3.029 . 0 0 "[ . 1 . 2 . 3]" 1 2166 1 157 GLU H 1 157 GLU HB3 2.900 . 3.800 3.275 2.253 3.608 . 0 0 "[ . 1 . 2 . 3]" 1 2167 1 157 GLU H 1 157 GLU HB2 2.900 . 3.800 2.442 2.114 3.604 . 0 0 "[ . 1 . 2 . 3]" 1 2168 1 157 GLU HB2 1 171 PHE QD 4.000 . 6.300 4.902 3.358 5.847 . 0 0 "[ . 1 . 2 . 3]" 1 2169 1 157 GLU HB3 1 171 PHE QD 4.000 . 6.300 5.098 2.510 6.320 0.020 19 0 "[ . 1 . 2 . 3]" 1 2170 1 157 GLU HA 1 157 GLU HG3 3.200 . 4.100 3.124 2.352 3.791 . 0 0 "[ . 1 . 2 . 3]" 1 2171 1 157 GLU HA 1 158 TYR H 3.400 . 4.100 3.546 3.467 3.577 . 0 0 "[ . 1 . 2 . 3]" 1 2172 1 157 GLU HA 1 160 TRP H 4.000 . 5.000 3.448 3.233 3.956 . 0 0 "[ . 1 . 2 . 3]" 1 2173 1 157 GLU HA 1 157 GLU HB3 2.900 . 3.500 2.664 2.367 3.015 . 0 0 "[ . 1 . 2 . 3]" 1 2174 1 158 TYR HB2 1 158 TYR QE 3.400 . 4.600 4.464 4.424 4.499 . 0 0 "[ . 1 . 2 . 3]" 1 2175 1 158 TYR HA 1 158 TYR QE 4.600 . 5.800 4.433 4.244 4.986 . 0 0 "[ . 1 . 2 . 3]" 1 2176 1 158 TYR HA 1 158 TYR QD 3.200 . 4.300 2.731 2.329 2.986 . 0 0 "[ . 1 . 2 . 3]" 1 2177 1 158 TYR H 1 158 TYR HA 3.000 . 3.700 2.823 2.755 2.878 . 0 0 "[ . 1 . 2 . 3]" 1 2178 1 158 TYR HB2 1 158 TYR QD 2.900 . 4.000 2.473 2.324 2.607 . 0 0 "[ . 1 . 2 . 3]" 1 2179 1 158 TYR H 1 158 TYR QD 5.000 . 6.500 3.958 3.275 4.184 . 0 0 "[ . 1 . 2 . 3]" 1 2180 1 158 TYR QE 1 162 THR MG 3.200 . 4.800 3.652 2.810 4.473 . 0 0 "[ . 1 . 2 . 3]" 1 2181 1 158 TYR QD 1 162 THR MG 3.800 . 5.600 4.056 3.267 4.611 . 0 0 "[ . 1 . 2 . 3]" 1 2182 1 158 TYR QD 1 159 CYS H 3.500 . 4.700 3.960 2.770 4.628 . 0 0 "[ . 1 . 2 . 3]" 1 2183 1 159 CYS H 1 159 CYS HB3 3.400 . 4.100 2.363 2.088 3.590 . 0 0 "[ . 1 . 2 . 3]" 1 2184 1 159 CYS H 1 159 CYS HB2 3.700 . 4.400 3.089 2.293 3.600 . 0 0 "[ . 1 . 2 . 3]" 1 2185 1 156 PHE HA 1 159 CYS H 4.000 . 5.000 3.618 3.320 4.022 . 0 0 "[ . 1 . 2 . 3]" 1 2186 1 159 CYS HA 1 160 TRP H 4.000 . 5.000 3.506 3.420 3.571 . 0 0 "[ . 1 . 2 . 3]" 1 2187 1 158 TYR HA 1 159 CYS H 5.000 . 5.000 3.527 3.476 3.569 . 0 0 "[ . 1 . 2 . 3]" 1 2188 1 158 TYR QB 1 159 CYS H 3.000 . 3.900 2.684 2.279 2.922 . 0 0 "[ . 1 . 2 . 3]" 1 2189 1 159 CYS H 1 160 TRP H 2.800 . 3.400 2.461 2.328 2.796 . 0 0 "[ . 1 . 2 . 3]" 1 2190 1 157 GLU H 1 159 CYS H 3.600 . 4.300 4.052 3.810 4.350 0.050 19 0 "[ . 1 . 2 . 3]" 1 2191 1 158 TYR H 1 159 CYS H 3.600 . 4.300 2.659 2.467 2.934 . 0 0 "[ . 1 . 2 . 3]" 1 2192 1 160 TRP HE1 1 171 PHE H 4.300 . 5.200 4.520 3.329 5.027 . 0 0 "[ . 1 . 2 . 3]" 1 2193 1 160 TRP HZ3 1 164 VAL MG2 4.300 . 5.700 2.942 2.421 3.539 . 0 0 "[ . 1 . 2 . 3]" 1 2194 1 160 TRP HE1 1 171 PHE HB2 4.200 . 5.500 4.089 3.312 4.625 . 0 0 "[ . 1 . 2 . 3]" 1 2195 1 160 TRP HE1 1 170 PRO HA 4.500 . 5.400 4.318 2.636 5.044 . 0 0 "[ . 1 . 2 . 3]" 1 2196 1 160 TRP H 1 160 TRP HB3 3.400 . 4.100 2.348 2.225 2.532 . 0 0 "[ . 1 . 2 . 3]" 1 2197 1 13 PHE QE 1 160 TRP HZ3 5.000 . 6.500 4.122 2.759 5.300 . 0 0 "[ . 1 . 2 . 3]" 1 2198 1 159 CYS QB 1 160 TRP H 4.000 . 5.000 2.956 2.199 3.540 . 0 0 "[ . 1 . 2 . 3]" 1 2199 1 160 TRP HH2 1 164 VAL MG1 4.000 . 5.500 2.908 2.613 3.328 . 0 0 "[ . 1 . 2 . 3]" 1 2200 1 160 TRP HZ2 1 164 VAL MG1 4.000 . 5.300 3.604 3.135 4.410 . 0 0 "[ . 1 . 2 . 3]" 1 2201 1 160 TRP HH2 1 164 VAL MG2 4.000 . 5.500 4.323 3.963 4.829 . 0 0 "[ . 1 . 2 . 3]" 1 2202 1 160 TRP H 1 160 TRP HB2 3.000 . 3.900 2.709 2.468 2.872 . 0 0 "[ . 1 . 2 . 3]" 1 2203 1 14 THR MG 1 160 TRP HH2 3.400 . 4.600 4.451 3.516 4.620 0.020 28 0 "[ . 1 . 2 . 3]" 1 2204 1 14 THR MG 1 160 TRP HZ3 3.400 . 4.600 3.900 2.568 4.500 . 0 0 "[ . 1 . 2 . 3]" 1 2205 1 10 PRO HB2 1 160 TRP HH2 3.800 . 5.000 3.386 2.439 4.367 . 0 0 "[ . 1 . 2 . 3]" 1 2206 1 10 PRO QB 1 160 TRP HZ3 3.800 . 5.000 3.697 2.921 4.174 . 0 0 "[ . 1 . 2 . 3]" 1 2207 1 10 PRO QB 1 160 TRP HZ2 3.800 . 5.000 3.872 3.061 4.796 . 0 0 "[ . 1 . 2 . 3]" 1 2208 1 10 PRO QG 1 160 TRP HH2 4.100 . 5.700 4.094 3.573 4.578 . 0 0 "[ . 1 . 2 . 3]" 1 2209 1 10 PRO QG 1 160 TRP HZ2 4.100 . 5.700 4.980 4.064 5.706 0.006 5 0 "[ . 1 . 2 . 3]" 1 2210 1 10 PRO QG 1 160 TRP HZ3 4.100 . 5.700 5.308 4.753 5.758 0.058 3 0 "[ . 1 . 2 . 3]" 1 2211 1 160 TRP HA 1 160 TRP HE1 4.700 . 5.600 5.680 5.560 5.773 0.173 4 0 "[ . 1 . 2 . 3]" 1 2212 1 160 TRP HE1 1 169 CYS HB2 5.000 . 6.000 4.670 4.113 5.543 . 0 0 "[ . 1 . 2 . 3]" 1 2213 1 160 TRP HE3 1 164 VAL MG2 4.300 . 5.700 2.832 2.328 3.603 . 0 0 "[ . 1 . 2 . 3]" 1 2214 1 160 TRP HD1 1 166 ARG HD3 3.800 . 4.600 4.339 2.932 4.722 0.122 25 0 "[ . 1 . 2 . 3]" 1 2215 1 160 TRP HZ2 1 166 ARG HD3 3.600 . 4.800 3.140 2.339 4.857 0.057 28 0 "[ . 1 . 2 . 3]" 1 2216 1 160 TRP HE1 1 161 ASP HA 4.800 3.800 5.800 4.686 3.904 5.393 . 0 0 "[ . 1 . 2 . 3]" 1 2217 1 160 TRP HE1 1 169 CYS HA 4.500 . 5.400 5.379 4.917 5.531 0.131 23 0 "[ . 1 . 2 . 3]" 1 2218 1 160 TRP HA 1 160 TRP HE3 3.400 . 4.100 2.676 2.339 3.141 . 0 0 "[ . 1 . 2 . 3]" 1 2219 1 160 TRP HE1 1 171 PHE QD 4.600 . 6.000 4.246 3.660 5.448 . 0 0 "[ . 1 . 2 . 3]" 1 2220 1 13 PHE HB3 1 160 TRP HZ3 3.000 . 4.100 3.031 2.343 4.067 . 0 0 "[ . 1 . 2 . 3]" 1 2221 1 160 TRP H 1 161 ASP H 3.400 . 4.100 2.648 2.408 2.906 . 0 0 "[ . 1 . 2 . 3]" 1 2222 1 10 PRO HB3 1 160 TRP HH2 3.300 . 4.000 2.486 2.340 3.283 . 0 0 "[ . 1 . 2 . 3]" 1 2223 1 10 PRO HA 1 160 TRP HH2 3.900 . 4.500 3.448 2.448 4.504 0.004 20 0 "[ . 1 . 2 . 3]" 1 2224 1 10 PRO HA 1 160 TRP HZ3 3.100 . 4.200 3.260 2.680 4.102 . 0 0 "[ . 1 . 2 . 3]" 1 2225 1 160 TRP HE1 1 166 ARG HD3 4.400 . 5.300 2.880 2.067 4.011 . 0 0 "[ . 1 . 2 . 3]" 1 2226 1 14 THR H 1 160 TRP HH2 5.300 . 6.200 5.106 4.235 6.213 0.013 30 0 "[ . 1 . 2 . 3]" 1 2227 1 14 THR H 1 160 TRP HZ3 5.000 . 6.000 3.836 2.823 4.716 . 0 0 "[ . 1 . 2 . 3]" 1 2228 1 160 TRP HZ3 1 164 VAL MG1 3.400 . 4.600 2.959 2.552 3.404 . 0 0 "[ . 1 . 2 . 3]" 1 2229 1 160 TRP HH2 1 171 PHE QD 4.100 . 5.400 5.214 4.839 5.431 0.031 29 0 "[ . 1 . 2 . 3]" 1 2230 1 160 TRP HE1 1 169 CYS HB3 4.700 . 5.600 3.520 2.736 4.158 . 0 0 "[ . 1 . 2 . 3]" 1 2231 1 160 TRP H 1 160 TRP HD1 3.200 . 5.100 4.700 4.396 5.011 . 0 0 "[ . 1 . 2 . 3]" 1 2232 1 160 TRP HE1 1 171 PHE HA 3.800 . 4.600 3.303 2.810 4.093 . 0 0 "[ . 1 . 2 . 3]" 1 2233 1 160 TRP HB3 1 160 TRP HD1 3.500 . 4.500 2.558 2.523 2.634 . 0 0 "[ . 1 . 2 . 3]" 1 2234 1 160 TRP HB3 1 161 ASP H 3.300 . 4.000 2.642 2.413 2.756 . 0 0 "[ . 1 . 2 . 3]" 1 2235 1 161 ASP H 1 161 ASP HB3 3.500 . 4.200 2.647 2.093 3.614 . 0 0 "[ . 1 . 2 . 3]" 1 2236 1 161 ASP HA 1 162 THR H 5.000 . 6.000 3.462 3.415 3.514 . 0 0 "[ . 1 . 2 . 3]" 1 2237 1 159 CYS H 1 161 ASP H 2.500 . 4.000 4.070 4.013 4.133 0.133 9 0 "[ . 1 . 2 . 3]" 1 2238 1 160 TRP HD1 1 161 ASP H 3.400 . 4.100 3.490 2.821 3.985 . 0 0 "[ . 1 . 2 . 3]" 1 2239 1 161 ASP H 1 162 THR H 3.600 . 4.300 2.407 2.340 2.532 . 0 0 "[ . 1 . 2 . 3]" 1 2240 1 161 ASP HB3 1 162 THR H 4.000 . 5.000 3.591 2.829 4.289 . 0 0 "[ . 1 . 2 . 3]" 1 2241 1 45 LEU MD1 1 162 THR MG 3.400 . 6.400 2.987 2.091 3.623 . 0 0 "[ . 1 . 2 . 3]" 1 2242 1 162 THR H 1 162 THR MG 3.400 . 4.600 3.703 2.933 3.778 . 0 0 "[ . 1 . 2 . 3]" 1 2243 1 162 THR HA 1 163 PHE H 3.500 . 4.200 3.563 3.475 3.583 . 0 0 "[ . 1 . 2 . 3]" 1 2244 1 162 THR MG 1 163 PHE HA 4.600 . 6.000 3.520 3.116 5.229 . 0 0 "[ . 1 . 2 . 3]" 1 2245 1 162 THR H 1 162 THR HB 4.000 . 5.000 2.488 2.347 3.495 . 0 0 "[ . 1 . 2 . 3]" 1 2246 1 50 MET HB3 1 162 THR MG 4.200 . 5.500 4.815 4.184 5.524 0.024 22 0 "[ . 1 . 2 . 3]" 1 2247 1 50 MET HG3 1 162 THR MG 4.300 . 5.700 4.038 2.614 5.683 . 0 0 "[ . 1 . 2 . 3]" 1 2248 1 7 LEU MD2 1 162 THR MG 4.800 3.800 5.800 5.112 4.687 5.832 0.032 8 0 "[ . 1 . 2 . 3]" 1 2249 1 160 TRP H 1 162 THR H 3.200 . 4.000 3.821 3.591 4.123 0.123 19 0 "[ . 1 . 2 . 3]" 1 2250 1 162 THR HA 1 162 THR MG 2.700 . 4.200 2.336 2.113 2.417 . 0 0 "[ . 1 . 2 . 3]" 1 2251 1 159 CYS QB 1 163 PHE QD 4.000 . 5.500 3.220 2.327 4.333 . 0 0 "[ . 1 . 2 . 3]" 1 2252 1 163 PHE H 1 163 PHE HB3 3.000 . 3.600 3.575 3.489 3.658 0.058 21 0 "[ . 1 . 2 . 3]" 1 2253 1 51 GLY QA 1 163 PHE QE 4.000 . 5.500 3.461 2.904 4.348 . 0 0 "[ . 1 . 2 . 3]" 1 2254 1 161 ASP H 1 163 PHE H 5.000 . 6.000 4.366 3.888 4.677 . 0 0 "[ . 1 . 2 . 3]" 1 2255 1 33 TYR H 1 163 PHE QE 4.400 . 5.800 2.979 1.967 3.751 . 0 0 "[ . 1 . 2 . 3]" 1 2256 1 163 PHE H 1 163 PHE QE 3.400 . 5.100 4.618 4.063 5.019 . 0 0 "[ . 1 . 2 . 3]" 1 2257 1 163 PHE H 1 163 PHE QD 3.500 . 4.700 2.523 1.799 3.006 0.001 22 0 "[ . 1 . 2 . 3]" 1 2258 1 33 TYR H 1 163 PHE QD 5.200 . 6.200 4.968 4.197 5.757 . 0 0 "[ . 1 . 2 . 3]" 1 2259 1 163 PHE HA 1 163 PHE QD 3.200 . 4.300 2.805 2.430 3.073 . 0 0 "[ . 1 . 2 . 3]" 1 2260 1 163 PHE HB2 1 163 PHE QD 3.200 . 4.300 2.410 2.320 2.547 . 0 0 "[ . 1 . 2 . 3]" 1 2261 1 163 PHE HA 1 163 PHE QE 4.300 . 5.700 4.437 4.274 4.579 . 0 0 "[ . 1 . 2 . 3]" 1 2262 1 162 THR MG 1 163 PHE QE 3.300 . 5.000 3.403 2.636 4.277 . 0 0 "[ . 1 . 2 . 3]" 1 2263 1 162 THR MG 1 163 PHE H 3.500 . 4.700 3.241 2.736 4.037 . 0 0 "[ . 1 . 2 . 3]" 1 2264 1 162 THR H 1 163 PHE H 3.200 . 3.800 2.538 2.403 2.682 . 0 0 "[ . 1 . 2 . 3]" 1 2265 1 162 THR MG 1 163 PHE QD 3.300 . 5.000 3.255 2.423 4.297 . 0 0 "[ . 1 . 2 . 3]" 1 2266 1 163 PHE H 1 164 VAL H 3.300 . 4.000 2.460 2.073 2.691 . 0 0 "[ . 1 . 2 . 3]" 1 2267 1 50 MET HA 1 163 PHE QE 4.000 . 5.500 5.122 4.890 5.540 0.040 14 0 "[ . 1 . 2 . 3]" 1 2268 1 13 PHE H 1 164 VAL MG2 4.300 . 5.700 4.538 3.806 5.364 . 0 0 "[ . 1 . 2 . 3]" 1 2269 1 164 VAL H 1 164 VAL MG1 3.400 . 4.600 3.838 3.762 3.996 . 0 0 "[ . 1 . 2 . 3]" 1 2270 1 13 PHE QD 1 164 VAL MG2 3.400 . 5.100 2.835 2.397 3.489 . 0 0 "[ . 1 . 2 . 3]" 1 2271 1 13 PHE HA 1 164 VAL MG2 4.100 . 5.900 4.686 4.183 5.596 . 0 0 "[ . 1 . 2 . 3]" 1 2272 1 13 PHE HB3 1 164 VAL MG1 4.300 . 5.700 3.568 2.881 4.005 . 0 0 "[ . 1 . 2 . 3]" 1 2273 1 164 VAL HA 1 164 VAL MG1 2.900 . 4.000 2.254 2.162 2.374 . 0 0 "[ . 1 . 2 . 3]" 1 2274 1 13 PHE QE 1 164 VAL MG1 3.800 . 5.600 5.325 4.741 5.617 0.017 2 0 "[ . 1 . 2 . 3]" 1 2275 1 164 VAL MG2 1 166 ARG HD3 4.000 . 5.300 4.901 3.908 5.517 0.217 23 0 "[ . 1 . 2 . 3]" 1 2276 1 10 PRO HB2 1 164 VAL MG1 3.300 . 4.500 3.758 3.166 4.178 . 0 0 "[ . 1 . 2 . 3]" 1 2277 1 10 PRO HB2 1 164 VAL MG2 4.200 . 5.500 5.373 4.951 5.537 0.037 14 0 "[ . 1 . 2 . 3]" 1 2278 1 163 PHE HA 1 164 VAL MG2 4.800 3.800 6.300 4.304 3.921 4.604 . 0 0 "[ . 1 . 2 . 3]" 1 2279 1 164 VAL MG1 1 165 TYR H 3.500 . 4.700 3.059 2.074 3.682 . 0 0 "[ . 1 . 2 . 3]" 1 2280 1 162 THR H 1 164 VAL H 4.000 . 4.800 3.792 3.432 4.075 . 0 0 "[ . 1 . 2 . 3]" 1 2281 1 164 VAL MG1 1 166 ARG HD2 3.400 . 4.600 3.876 2.297 4.649 0.049 19 0 "[ . 1 . 2 . 3]" 1 2282 1 10 PRO QG 1 164 VAL QG 4.100 . 6.200 2.792 2.011 3.791 . 0 0 "[ . 1 . 2 . 3]" 1 2283 1 13 PHE HB2 1 164 VAL MG1 3.900 . 5.200 3.930 3.038 4.827 . 0 0 "[ . 1 . 2 . 3]" 1 2284 1 13 PHE H 1 164 VAL MG1 5.600 . 6.700 4.832 4.050 5.445 . 0 0 "[ . 1 . 2 . 3]" 1 2285 1 14 THR MG 1 164 VAL MG1 4.900 . 7.000 5.696 4.329 6.163 . 0 0 "[ . 1 . 2 . 3]" 1 2286 1 13 PHE HB2 1 164 VAL MG2 3.100 . 4.200 2.852 2.227 3.732 . 0 0 "[ . 1 . 2 . 3]" 1 2287 1 163 PHE HB2 1 164 VAL MG2 3.900 . 5.000 2.908 2.557 3.377 . 0 0 "[ . 1 . 2 . 3]" 1 2288 1 163 PHE QD 1 164 VAL MG2 4.700 . 6.600 4.401 4.146 4.680 . 0 0 "[ . 1 . 2 . 3]" 1 2289 1 160 TRP H 1 164 VAL MG2 4.700 . 6.100 5.179 4.455 6.128 0.028 4 0 "[ . 1 . 2 . 3]" 1 2290 1 163 PHE H 1 164 VAL MG2 4.000 . 5.300 3.954 3.254 4.522 . 0 0 "[ . 1 . 2 . 3]" 1 2291 1 8 MET H 1 164 VAL MG2 4.400 . 5.800 4.466 3.833 5.182 . 0 0 "[ . 1 . 2 . 3]" 1 2292 1 160 TRP HZ3 1 164 VAL HB 3.300 . 4.000 4.006 3.716 4.095 0.095 26 0 "[ . 1 . 2 . 3]" 1 2293 1 163 PHE QD 1 164 VAL H 4.200 . 5.500 4.323 4.072 4.652 . 0 0 "[ . 1 . 2 . 3]" 1 2294 1 164 VAL HA 1 164 VAL MG2 3.200 . 4.300 2.466 2.273 2.684 . 0 0 "[ . 1 . 2 . 3]" 1 2295 1 164 VAL MG1 1 164 VAL MG2 2.800 . 4.400 2.051 1.915 2.080 . 0 0 "[ . 1 . 2 . 3]" 1 2296 1 163 PHE HB3 1 164 VAL H 3.800 . 4.600 3.527 3.172 4.201 . 0 0 "[ . 1 . 2 . 3]" 1 2297 1 10 PRO HA 1 164 VAL MG1 3.000 . 4.100 2.267 2.068 2.708 . 0 0 "[ . 1 . 2 . 3]" 1 2298 1 164 VAL MG2 1 165 TYR H 3.900 . 5.200 4.261 3.825 4.376 . 0 0 "[ . 1 . 2 . 3]" 1 2299 1 164 VAL H 1 164 VAL MG2 3.000 . 4.100 2.376 1.887 3.181 . 0 0 "[ . 1 . 2 . 3]" 1 2300 1 160 TRP HA 1 164 VAL MG1 3.400 . 4.600 4.575 4.341 4.717 0.117 28 0 "[ . 1 . 2 . 3]" 1 2301 1 13 PHE QD 1 164 VAL MG1 3.500 . 5.200 4.220 3.719 4.527 . 0 0 "[ . 1 . 2 . 3]" 1 2302 1 163 PHE HA 1 164 VAL H 3.400 . 4.100 3.533 3.335 3.585 . 0 0 "[ . 1 . 2 . 3]" 1 2303 1 9 ASP HA 1 164 VAL MG1 4.000 . 5.300 4.205 3.072 5.317 0.017 20 0 "[ . 1 . 2 . 3]" 1 2304 1 160 TRP HE1 1 164 VAL MG1 4.400 . 5.800 4.814 4.194 5.645 . 0 0 "[ . 1 . 2 . 3]" 1 2305 1 164 VAL H 1 164 VAL HB 3.100 . 3.700 2.758 2.459 3.093 . 0 0 "[ . 1 . 2 . 3]" 1 2306 1 160 TRP HE3 1 164 VAL MG1 3.800 . 5.100 3.831 3.393 4.080 . 0 0 "[ . 1 . 2 . 3]" 1 2307 1 160 TRP HE3 1 164 VAL HB 4.000 . 5.000 3.435 3.191 3.671 . 0 0 "[ . 1 . 2 . 3]" 1 2308 1 7 LEU HB3 1 164 VAL MG1 3.300 . 7.000 4.901 3.530 5.783 . 0 0 "[ . 1 . 2 . 3]" 1 2309 1 163 PHE HA 1 164 VAL MG1 5.300 . 6.700 5.899 5.536 6.098 . 0 0 "[ . 1 . 2 . 3]" 1 2310 1 164 VAL HB 1 165 TYR H 4.000 . 5.000 4.244 3.920 4.541 . 0 0 "[ . 1 . 2 . 3]" 1 2311 1 165 TYR H 1 165 TYR QD 4.000 . 5.500 3.112 1.835 4.235 . 0 0 "[ . 1 . 2 . 3]" 1 2312 1 10 PRO QG 1 165 TYR H 4.100 . 5.700 5.541 3.907 5.793 0.093 5 0 "[ . 1 . 2 . 3]" 1 2313 1 164 VAL HA 1 165 TYR H 3.300 . 4.000 2.213 2.132 2.355 . 0 0 "[ . 1 . 2 . 3]" 1 2314 1 7 LEU HA 1 165 TYR H 5.000 . 5.500 5.225 4.519 5.579 0.079 5 0 "[ . 1 . 2 . 3]" 1 2315 1 7 LEU MD1 1 165 TYR H 5.000 . 6.000 3.019 1.723 4.351 0.077 27 0 "[ . 1 . 2 . 3]" 1 2316 1 7 LEU MD2 1 165 TYR H 5.000 . 6.000 4.534 3.135 5.611 . 0 0 "[ . 1 . 2 . 3]" 1 2317 1 7 LEU QD 1 165 TYR QD 5.000 . 6.000 2.878 2.061 4.311 . 0 0 "[ . 1 . 2 . 3]" 1 2318 1 7 LEU QB 1 165 TYR H 4.000 . 5.000 3.606 2.568 4.960 . 0 0 "[ . 1 . 2 . 3]" 1 2319 1 7 LEU QB 1 165 TYR QD 4.000 . 5.500 4.070 2.113 5.531 0.031 16 0 "[ . 1 . 2 . 3]" 1 2320 1 160 TRP HA 1 166 ARG HD3 3.200 . 5.800 5.674 4.468 5.977 0.177 19 0 "[ . 1 . 2 . 3]" 1 2321 1 164 VAL MG1 1 166 ARG HD3 3.900 . 5.200 3.169 2.283 4.968 . 0 0 "[ . 1 . 2 . 3]" 1 2322 1 166 ARG H 1 166 ARG HD3 3.700 . 4.900 3.438 2.284 4.922 0.022 15 0 "[ . 1 . 2 . 3]" 1 2323 1 160 TRP HE1 1 166 ARG HD2 4.200 . 5.000 2.926 1.809 4.571 . 0 0 "[ . 1 . 2 . 3]" 1 2324 1 167 GLN H 1 168 GLY H 3.700 . 4.400 2.696 2.518 2.999 . 0 0 "[ . 1 . 2 . 3]" 1 2325 1 167 GLN HA 1 168 GLY H 4.000 . 5.000 2.891 2.445 3.059 . 0 0 "[ . 1 . 2 . 3]" 1 2326 1 169 CYS H 1 169 CYS HA 3.000 . 3.600 2.824 2.763 2.959 . 0 0 "[ . 1 . 2 . 3]" 1 2327 1 169 CYS H 1 169 CYS HB2 3.000 . 4.400 2.223 2.055 2.682 . 0 0 "[ . 1 . 2 . 3]" 1 2328 1 167 GLN HA 1 169 CYS H 3.700 . 4.400 4.407 4.056 4.536 0.136 7 0 "[ . 1 . 2 . 3]" 1 2329 1 168 GLY H 1 169 CYS H 3.800 . 4.600 2.513 2.089 2.771 . 0 0 "[ . 1 . 2 . 3]" 1 2330 1 168 GLY HA3 1 169 CYS H 3.500 . 4.200 3.417 3.225 3.511 . 0 0 "[ . 1 . 2 . 3]" 1 2331 1 169 CYS H 1 169 CYS HB3 3.200 . 4.300 3.164 2.718 3.454 . 0 0 "[ . 1 . 2 . 3]" 1 2332 1 160 TRP HZ2 1 169 CYS HB3 3.300 . 4.000 3.970 2.843 4.161 0.161 21 0 "[ . 1 . 2 . 3]" 1 2333 1 171 PHE QD 1 177 LEU MD2 4.200 . 6.000 4.362 3.768 4.889 . 0 0 "[ . 1 . 2 . 3]" 1 2334 1 171 PHE QE 1 177 LEU MD2 3.500 . 5.200 2.615 2.371 3.202 . 0 0 "[ . 1 . 2 . 3]" 1 2335 1 164 VAL MG2 1 171 PHE QD 4.300 . 6.200 5.642 4.890 6.223 0.023 18 0 "[ . 1 . 2 . 3]" 1 2336 1 170 PRO HA 1 171 PHE H 2.900 . 3.500 2.407 2.195 2.487 . 0 0 "[ . 1 . 2 . 3]" 1 2337 1 171 PHE HZ 1 177 LEU MD2 3.300 . 4.500 3.173 2.319 4.068 . 0 0 "[ . 1 . 2 . 3]" 1 2338 1 171 PHE H 1 171 PHE HB2 3.400 . 4.600 2.959 2.563 3.710 . 0 0 "[ . 1 . 2 . 3]" 1 2339 1 171 PHE HZ 1 173 PRO HA 3.300 . 4.000 3.092 2.338 3.580 . 0 0 "[ . 1 . 2 . 3]" 1 2340 1 171 PHE QD 1 173 PRO HB3 3.800 . 5.100 3.339 2.747 4.591 . 0 0 "[ . 1 . 2 . 3]" 1 2341 1 14 THR MG 1 171 PHE QD 5.400 . 7.300 4.974 2.267 6.175 . 0 0 "[ . 1 . 2 . 3]" 1 2342 1 14 THR MG 1 171 PHE QE 4.000 . 6.000 3.939 2.739 5.055 . 0 0 "[ . 1 . 2 . 3]" 1 2343 1 171 PHE HB2 1 171 PHE QD 3.000 . 4.600 2.626 2.459 2.701 . 0 0 "[ . 1 . 2 . 3]" 1 2344 1 157 GLU HG3 1 171 PHE QD 4.200 . 6.300 4.066 2.467 6.237 . 0 0 "[ . 1 . 2 . 3]" 1 2345 1 171 PHE QD 1 173 PRO HD3 4.100 . 5.400 3.276 2.770 4.749 . 0 0 "[ . 1 . 2 . 3]" 1 2346 1 161 ASP H 1 171 PHE QD 5.000 . 6.500 5.850 5.410 6.538 0.038 28 0 "[ . 1 . 2 . 3]" 1 2347 1 160 TRP HD1 1 171 PHE QD 3.600 . 5.300 3.869 3.513 4.799 . 0 0 "[ . 1 . 2 . 3]" 1 2348 1 160 TRP HD1 1 171 PHE HA 4.000 . 5.000 3.667 2.931 5.081 0.081 29 0 "[ . 1 . 2 . 3]" 1 2349 1 160 TRP HD1 1 171 PHE HB3 4.000 . 5.000 4.049 2.920 4.729 . 0 0 "[ . 1 . 2 . 3]" 1 2350 1 160 TRP HD1 1 171 PHE HB2 4.000 . 5.000 2.812 2.343 4.704 . 0 0 "[ . 1 . 2 . 3]" 1 2351 1 171 PHE H 1 171 PHE HB3 3.700 . 4.900 2.418 2.221 2.519 . 0 0 "[ . 1 . 2 . 3]" 1 2352 1 170 PRO HB2 1 171 PHE H 3.000 . 3.600 2.894 2.486 3.559 . 0 0 "[ . 1 . 2 . 3]" 1 2353 1 171 PHE HB2 1 172 GLN H 3.100 . 3.700 3.843 3.388 4.035 0.335 14 0 "[ . 1 . 2 . 3]" 1 2354 1 171 PHE HZ 1 174 TRP HZ3 3.500 . 5.200 4.389 3.843 5.328 0.128 28 0 "[ . 1 . 2 . 3]" 1 2355 1 160 TRP HE3 1 171 PHE QD 5.000 . 6.500 3.555 3.010 4.746 . 0 0 "[ . 1 . 2 . 3]" 1 2356 1 171 PHE HZ 1 173 PRO QB 3.600 . 4.300 3.884 2.279 4.417 0.117 12 0 "[ . 1 . 2 . 3]" 1 2357 1 171 PHE QD 1 177 LEU QB 4.100 . 6.900 6.262 5.028 7.028 0.128 20 0 "[ . 1 . 2 . 3]" 1 2358 1 160 TRP HD1 1 171 PHE H 3.700 . 4.400 3.988 2.753 4.414 0.014 11 0 "[ . 1 . 2 . 3]" 1 2359 1 171 PHE H 1 171 PHE QD 3.500 . 5.200 4.065 2.744 4.236 . 0 0 "[ . 1 . 2 . 3]" 1 2360 1 171 PHE HA 1 171 PHE QD 4.000 . 5.900 2.432 2.259 3.476 . 0 0 "[ . 1 . 2 . 3]" 1 2361 1 160 TRP H 1 171 PHE QD 4.100 . 5.400 5.179 4.891 5.477 0.077 29 0 "[ . 1 . 2 . 3]" 1 2362 1 157 GLU HG3 1 171 PHE H 3.700 . 6.400 5.031 2.820 6.433 0.033 3 0 "[ . 1 . 2 . 3]" 1 2363 1 160 TRP HB3 1 171 PHE QD 3.600 . 4.800 3.570 3.177 3.999 . 0 0 "[ . 1 . 2 . 3]" 1 2364 1 171 PHE HA 1 172 GLN H 3.400 . 4.100 2.220 2.097 2.256 . 0 0 "[ . 1 . 2 . 3]" 1 2365 1 171 PHE H 1 172 GLN H 3.800 . 4.600 4.537 4.358 4.619 0.019 17 0 "[ . 1 . 2 . 3]" 1 2366 1 14 THR MG 1 172 GLN H 5.000 . 6.100 5.089 3.663 5.797 . 0 0 "[ . 1 . 2 . 3]" 1 2367 1 171 PHE QD 1 172 GLN H 3.100 . 4.200 2.507 2.058 3.170 . 0 0 "[ . 1 . 2 . 3]" 1 2368 1 171 PHE HB3 1 172 GLN H 3.500 . 4.200 3.999 3.839 4.465 0.265 19 0 "[ . 1 . 2 . 3]" 1 2369 1 172 GLN HE21 1 172 GLN HG2 2.600 . 4.200 2.793 2.245 3.616 . 0 0 "[ . 1 . 2 . 3]" 1 2370 1 172 GLN H 1 172 GLN HG2 3.300 . 5.100 3.828 2.037 4.807 . 0 0 "[ . 1 . 2 . 3]" 1 2371 1 172 GLN H 1 172 GLN HB2 3.400 . 4.900 2.728 2.111 3.603 . 0 0 "[ . 1 . 2 . 3]" 1 2372 1 172 GLN HE22 1 172 GLN HG2 2.700 . 4.000 3.741 3.512 4.110 0.110 22 0 "[ . 1 . 2 . 3]" 1 2373 1 172 GLN H 1 172 GLN HB3 3.600 . 5.100 3.313 2.542 3.740 . 0 0 "[ . 1 . 2 . 3]" 1 2374 1 173 PRO HB3 1 174 TRP H 4.400 . 5.300 4.428 3.433 4.678 . 0 0 "[ . 1 . 2 . 3]" 1 2375 1 173 PRO QB 1 173 PRO QD 3.300 . 5.000 2.901 2.848 2.990 . 0 0 "[ . 1 . 2 . 3]" 1 2376 1 173 PRO QB 1 177 LEU QD 4.000 . 5.500 2.320 1.902 3.228 . 0 0 "[ . 1 . 2 . 3]" 1 2377 1 174 TRP H 1 174 TRP HE3 3.500 . 4.500 3.228 2.703 4.493 . 0 0 "[ . 1 . 2 . 3]" 1 2378 1 173 PRO HB2 1 174 TRP H 4.000 . 4.800 3.900 2.057 4.405 . 0 0 "[ . 1 . 2 . 3]" 1 2379 1 174 TRP HZ2 1 177 LEU MD2 4.400 . 5.800 3.150 2.212 4.377 . 0 0 "[ . 1 . 2 . 3]" 1 2380 1 125 ALA MB 1 174 TRP HZ2 4.000 . 5.800 5.377 3.940 5.811 0.011 6 0 "[ . 1 . 2 . 3]" 1 2381 1 174 TRP HE3 1 177 LEU MD2 4.100 . 5.400 5.289 4.948 5.564 0.164 14 0 "[ . 1 . 2 . 3]" 1 2382 1 174 TRP H 1 174 TRP HD1 4.300 . 5.200 4.485 3.407 5.027 . 0 0 "[ . 1 . 2 . 3]" 1 2383 1 174 TRP HA 1 174 TRP HE3 3.600 . 4.600 3.761 3.303 4.449 . 0 0 "[ . 1 . 2 . 3]" 1 2384 1 174 TRP HA 1 174 TRP HD1 3.700 . 4.700 4.551 4.230 4.704 0.004 5 0 "[ . 1 . 2 . 3]" 1 2385 1 174 TRP HB3 1 174 TRP HE3 3.300 . 4.300 2.629 2.437 2.748 . 0 0 "[ . 1 . 2 . 3]" 1 2386 1 174 TRP HB2 1 174 TRP HE3 3.500 . 4.500 4.139 3.940 4.205 . 0 0 "[ . 1 . 2 . 3]" 1 2387 1 174 TRP HE3 1 175 ASP H 4.000 . 5.500 5.434 5.046 5.964 0.464 28 0 "[ . 1 . 2 . 3]" 1 2388 1 174 TRP HD1 1 177 LEU HA 3.400 . 4.100 4.033 3.538 4.287 0.187 26 0 "[ . 1 . 2 . 3]" 1 2389 1 174 TRP HD1 1 178 GLU H 4.100 . 5.900 4.617 3.865 5.557 . 0 0 "[ . 1 . 2 . 3]" 1 2390 1 174 TRP HB3 1 174 TRP HD1 3.500 . 4.200 3.803 3.737 3.881 . 0 0 "[ . 1 . 2 . 3]" 1 2391 1 174 TRP HD1 1 177 LEU MD2 3.800 . 5.100 3.507 2.319 4.766 . 0 0 "[ . 1 . 2 . 3]" 1 2392 1 174 TRP H 1 174 TRP QB 3.200 . 3.700 3.151 2.614 3.382 . 0 0 "[ . 1 . 2 . 3]" 1 2393 1 171 PHE HZ 1 174 TRP HZ2 4.300 . 5.200 3.320 2.464 5.322 0.122 24 0 "[ . 1 . 2 . 3]" 1 2394 1 173 PRO HA 1 174 TRP H 2.800 . 3.400 3.104 2.794 3.521 0.121 21 0 "[ . 1 . 2 . 3]" 1 2395 1 173 PRO HG2 1 174 TRP H 4.700 . 5.600 3.721 1.793 4.584 0.007 21 0 "[ . 1 . 2 . 3]" 1 2396 1 174 TRP HB2 1 174 TRP HD1 3.300 . 4.000 2.654 2.579 2.845 . 0 0 "[ . 1 . 2 . 3]" 1 2397 1 174 TRP HD1 1 177 LEU MD1 3.200 . 5.800 5.161 4.290 5.776 . 0 0 "[ . 1 . 2 . 3]" 1 2398 1 174 TRP HB2 1 175 ASP H 3.400 . 4.100 2.790 1.825 4.313 0.213 29 0 "[ . 1 . 2 . 3]" 1 2399 1 174 TRP H 1 175 ASP H 4.900 . 5.900 3.470 1.584 4.596 0.216 14 0 "[ . 1 . 2 . 3]" 1 2400 1 174 TRP HD1 1 175 ASP H 4.600 . 5.500 2.687 1.774 4.077 0.026 3 0 "[ . 1 . 2 . 3]" 1 2401 1 174 TRP HD1 1 175 ASP HA 2.900 . 4.500 4.494 4.011 4.926 0.426 27 0 "[ . 1 . 2 . 3]" 1 2402 1 175 ASP H 1 175 ASP HB3 2.700 . 3.500 3.424 2.821 3.892 0.392 14 0 "[ . 1 . 2 . 3]" 1 2403 1 175 ASP HB2 1 176 GLY H 3.800 . 4.600 3.949 2.455 4.472 . 0 0 "[ . 1 . 2 . 3]" 1 2404 1 174 TRP HA 1 175 ASP H 2.900 . 3.500 3.351 2.276 3.567 0.067 22 0 "[ . 1 . 2 . 3]" 1 2405 1 175 ASP H 1 175 ASP HB2 2.700 . 3.500 3.327 2.385 3.846 0.346 24 0 "[ . 1 . 2 . 3]" 1 2406 1 174 TRP HB3 1 175 ASP H 4.000 . 5.000 3.863 3.392 4.613 . 0 0 "[ . 1 . 2 . 3]" 1 2407 1 175 ASP H 1 176 GLY H 3.900 . 4.700 2.284 1.726 3.644 0.074 7 0 "[ . 1 . 2 . 3]" 1 2408 1 176 GLY H 1 177 LEU H 4.100 . 4.900 2.487 2.215 2.971 . 0 0 "[ . 1 . 2 . 3]" 1 2409 1 175 ASP HB3 1 176 GLY H 3.200 . 3.800 3.232 2.266 3.814 0.014 14 0 "[ . 1 . 2 . 3]" 1 2410 1 175 ASP HA 1 176 GLY H 2.800 . 3.400 3.396 3.140 3.554 0.154 29 0 "[ . 1 . 2 . 3]" 1 2411 1 174 TRP H 1 177 LEU H 4.000 . 5.800 5.498 4.076 6.037 0.237 18 0 "[ . 1 . 2 . 3]" 1 2412 1 173 PRO HA 1 177 LEU MD2 3.500 . 4.700 2.759 2.148 4.595 . 0 0 "[ . 1 . 2 . 3]" 1 2413 1 177 LEU H 1 178 GLU H 3.600 . 4.300 2.738 2.337 3.134 . 0 0 "[ . 1 . 2 . 3]" 1 2414 1 177 LEU MD1 1 178 GLU HA 4.000 . 5.500 2.589 2.258 2.982 . 0 0 "[ . 1 . 2 . 3]" 1 2415 1 171 PHE QE 1 177 LEU MD1 3.600 . 5.000 4.104 3.706 4.827 . 0 0 "[ . 1 . 2 . 3]" 1 2416 1 171 PHE HZ 1 177 LEU MD1 4.200 . 5.500 5.229 3.910 5.609 0.109 1 0 "[ . 1 . 2 . 3]" 1 2417 1 174 TRP H 1 177 LEU MD1 4.000 . 6.800 6.501 5.766 6.977 0.177 29 0 "[ . 1 . 2 . 3]" 1 2418 1 152 THR MG 1 177 LEU MD2 5.000 . 7.000 6.310 5.197 6.669 . 0 0 "[ . 1 . 2 . 3]" 1 2419 1 152 THR MG 1 177 LEU MD1 3.300 . 4.700 4.530 3.705 4.711 0.011 12 0 "[ . 1 . 2 . 3]" 1 2420 1 153 TYR HB3 1 177 LEU MD1 3.500 . 4.700 4.418 3.570 4.733 0.033 18 0 "[ . 1 . 2 . 3]" 1 2421 1 176 GLY HA3 1 177 LEU H 4.400 . 5.300 3.079 2.737 3.430 . 0 0 "[ . 1 . 2 . 3]" 1 2422 1 153 TYR HA 1 177 LEU MD1 4.200 . 5.500 2.664 2.204 3.200 . 0 0 "[ . 1 . 2 . 3]" 1 2423 1 152 THR HA 1 177 LEU MD1 3.200 . 4.200 3.876 3.257 4.210 0.010 19 0 "[ . 1 . 2 . 3]" 1 2424 1 177 LEU HA 1 177 LEU MD1 3.700 . 5.900 3.048 2.278 3.631 . 0 0 "[ . 1 . 2 . 3]" 1 2425 1 177 LEU H 1 177 LEU MD2 3.700 . 5.700 3.315 2.744 3.867 . 0 0 "[ . 1 . 2 . 3]" 1 2426 1 177 LEU H 1 177 LEU MD1 3.500 . 5.700 4.042 3.756 4.233 . 0 0 "[ . 1 . 2 . 3]" 1 2427 1 177 LEU MD1 1 178 GLU H 3.300 . 4.500 3.037 2.640 3.399 . 0 0 "[ . 1 . 2 . 3]" 1 2428 1 153 TYR QD 1 177 LEU MD2 3.200 . 4.800 3.788 2.090 4.835 0.035 6 0 "[ . 1 . 2 . 3]" 1 2429 1 153 TYR QD 1 177 LEU MD1 2.900 . 4.500 3.192 2.407 4.126 . 0 0 "[ . 1 . 2 . 3]" 1 2430 1 153 TYR QE 1 177 LEU MD1 4.300 . 6.000 4.924 3.969 5.951 . 0 0 "[ . 1 . 2 . 3]" 1 2431 1 174 TRP H 1 177 LEU MD2 4.000 . 5.300 4.314 3.328 5.420 0.120 27 0 "[ . 1 . 2 . 3]" 1 2432 1 174 TRP HE1 1 177 LEU H 5.000 . 6.000 3.107 2.534 3.771 . 0 0 "[ . 1 . 2 . 3]" 1 2433 1 177 LEU HB3 1 178 GLU H 3.900 . 4.700 3.226 2.027 4.076 . 0 0 "[ . 1 . 2 . 3]" 1 2434 1 178 GLU H 1 178 GLU HB2 3.000 . 3.900 2.597 2.073 3.312 . 0 0 "[ . 1 . 2 . 3]" 1 2435 1 178 GLU H 1 178 GLU HB3 3.000 . 3.900 3.486 2.944 3.595 . 0 0 "[ . 1 . 2 . 3]" 1 2436 1 178 GLU HA 1 178 GLU HG3 2.900 . 3.800 2.986 2.446 3.657 . 0 0 "[ . 1 . 2 . 3]" 1 2437 1 177 LEU MD2 1 178 GLU H 4.400 . 5.800 4.018 3.600 4.488 . 0 0 "[ . 1 . 2 . 3]" 1 2438 1 177 LEU HG 1 178 GLU H 3.600 . 4.300 2.848 1.800 4.383 0.083 1 0 "[ . 1 . 2 . 3]" 1 2439 1 177 LEU MD1 1 178 GLU HB3 3.200 . 4.300 4.351 4.197 4.464 0.164 27 0 "[ . 1 . 2 . 3]" 1 2440 1 178 GLU HB3 1 178 GLU HG3 2.500 . 3.300 2.936 2.613 3.035 . 0 0 "[ . 1 . 2 . 3]" 1 2441 1 178 GLU HA 1 178 GLU HB3 3.000 . 3.900 2.476 2.235 2.990 . 0 0 "[ . 1 . 2 . 3]" 1 2442 1 178 GLU HA 1 178 GLU HB2 2.700 . 3.500 2.965 2.630 3.027 . 0 0 "[ . 1 . 2 . 3]" 1 2443 1 178 GLU H 1 178 GLU HG3 3.200 . 4.100 2.428 1.784 4.114 0.016 22 0 "[ . 1 . 2 . 3]" 1 2444 1 178 GLU HB2 1 178 GLU HG3 2.600 . 3.400 2.553 2.307 3.005 . 0 0 "[ . 1 . 2 . 3]" 1 2445 1 178 GLU HA 1 179 GLU H 3.300 . 4.000 3.578 3.569 3.587 . 0 0 "[ . 1 . 2 . 3]" 1 2446 1 178 GLU HB3 1 179 GLU H 3.400 . 4.100 3.322 2.180 3.880 . 0 0 "[ . 1 . 2 . 3]" 1 2447 1 177 LEU MD1 1 178 GLU HB2 3.400 . 5.100 4.430 3.183 5.131 0.031 1 0 "[ . 1 . 2 . 3]" 1 2448 1 177 LEU MD1 1 178 GLU HG3 3.100 . 4.700 3.224 2.272 4.691 . 0 0 "[ . 1 . 2 . 3]" 1 2449 1 178 GLU HG3 1 179 GLU H 4.100 . 4.900 4.086 2.384 4.848 . 0 0 "[ . 1 . 2 . 3]" 1 2450 1 178 GLU HB2 1 179 GLU H 3.800 . 4.600 2.417 2.141 3.407 . 0 0 "[ . 1 . 2 . 3]" 1 2451 1 179 GLU HA 1 180 HIS H 3.300 . 4.000 3.544 3.428 3.596 . 0 0 "[ . 1 . 2 . 3]" 1 2452 1 179 GLU H 1 179 GLU HB3 3.400 . 4.400 3.045 2.295 3.614 . 0 0 "[ . 1 . 2 . 3]" 1 2453 1 179 GLU H 1 180 HIS H 3.500 . 4.200 2.809 2.448 3.079 . 0 0 "[ . 1 . 2 . 3]" 1 2454 1 178 GLU H 1 179 GLU H 3.600 . 4.300 2.848 2.611 3.045 . 0 0 "[ . 1 . 2 . 3]" 1 2455 1 176 GLY HA3 1 179 GLU H 4.000 . 5.000 4.958 4.673 5.058 0.058 26 0 "[ . 1 . 2 . 3]" 1 2456 1 176 GLY HA2 1 179 GLU H 4.000 . 5.000 3.601 3.356 3.831 . 0 0 "[ . 1 . 2 . 3]" 1 2457 1 176 GLY QA 1 179 GLU QB 4.000 . 5.000 3.173 2.254 4.330 . 0 0 "[ . 1 . 2 . 3]" 1 2458 1 179 GLU HA 1 182 GLN H 3.400 . 4.100 3.644 3.017 3.983 . 0 0 "[ . 1 . 2 . 3]" 1 2459 1 179 GLU H 1 179 GLU HA 3.000 . 3.600 2.786 2.731 2.919 . 0 0 "[ . 1 . 2 . 3]" 1 2460 1 179 GLU H 1 179 GLU HB2 3.000 . 3.900 2.610 2.094 3.600 . 0 0 "[ . 1 . 2 . 3]" 1 2461 1 177 LEU HA 1 180 HIS H 4.000 . 5.000 3.775 3.201 4.694 . 0 0 "[ . 1 . 2 . 3]" 1 2462 1 180 HIS H 1 180 HIS QB 3.200 . 3.700 2.196 2.041 2.507 . 0 0 "[ . 1 . 2 . 3]" 1 2463 1 179 GLU QB 1 180 HIS H 3.000 . 3.700 2.615 2.154 3.461 . 0 0 "[ . 1 . 2 . 3]" 1 2464 1 180 HIS HB3 1 181 SER H 3.600 . 4.300 3.283 2.565 3.781 . 0 0 "[ . 1 . 2 . 3]" 1 2465 1 181 SER H 1 182 GLN H 4.000 . 5.000 2.754 2.396 2.944 . 0 0 "[ . 1 . 2 . 3]" 1 2466 1 178 GLU H 1 181 SER H 4.000 . 5.000 4.570 4.291 4.808 . 0 0 "[ . 1 . 2 . 3]" 1 2467 1 181 SER H 1 183 ALA H 4.000 . 5.000 4.344 3.577 4.692 . 0 0 "[ . 1 . 2 . 3]" 1 2468 1 178 GLU HA 1 181 SER H 3.900 . 4.700 3.467 3.033 4.338 . 0 0 "[ . 1 . 2 . 3]" 1 2469 1 179 GLU HA 1 181 SER H 3.900 . 4.700 4.274 3.730 4.717 0.017 7 0 "[ . 1 . 2 . 3]" 1 2470 1 180 HIS H 1 181 SER H 3.400 . 4.100 2.622 2.319 2.835 . 0 0 "[ . 1 . 2 . 3]" 1 2471 1 181 SER H 1 182 GLN HE22 3.900 . 4.700 4.695 4.429 4.963 0.263 19 0 "[ . 1 . 2 . 3]" 1 2472 1 182 GLN HB3 1 182 GLN HG2 2.900 . 3.800 2.940 2.247 3.035 . 0 0 "[ . 1 . 2 . 3]" 1 2473 1 179 GLU HA 1 182 GLN HG2 3.600 . 4.300 2.988 2.337 4.753 0.453 12 0 "[ . 1 . 2 . 3]" 1 2474 1 182 GLN HE21 1 182 GLN HG2 2.900 . 4.600 2.443 2.240 3.456 . 0 0 "[ . 1 . 2 . 3]" 1 2475 1 179 GLU HA 1 182 GLN HB3 4.200 . 5.500 4.805 2.290 5.516 0.016 19 0 "[ . 1 . 2 . 3]" 1 2476 1 182 GLN HB2 1 182 GLN HG2 2.700 . 3.800 2.399 2.305 2.895 . 0 0 "[ . 1 . 2 . 3]" 1 2477 1 179 GLU HA 1 182 GLN HG3 3.600 . 4.300 3.803 2.942 4.411 0.111 19 0 "[ . 1 . 2 . 3]" 1 2478 1 179 GLU HA 1 182 GLN HB2 3.500 . 4.700 3.773 2.340 5.032 0.332 17 0 "[ . 1 . 2 . 3]" 1 2479 1 182 GLN HB2 1 182 GLN HG3 2.700 . 3.600 2.619 2.360 3.024 . 0 0 "[ . 1 . 2 . 3]" 1 2480 1 182 GLN H 1 182 GLN HB2 3.300 . 4.500 2.803 2.263 3.429 . 0 0 "[ . 1 . 2 . 3]" 1 2481 1 182 GLN HA 1 182 GLN HG3 3.000 . 4.400 3.606 2.304 4.217 . 0 0 "[ . 1 . 2 . 3]" 1 2482 1 182 GLN HA 1 182 GLN HG2 3.100 . 4.500 3.475 2.987 3.632 . 0 0 "[ . 1 . 2 . 3]" 1 2483 1 182 GLN HA 1 185 SER H 4.000 . 5.000 3.880 3.390 4.505 . 0 0 "[ . 1 . 2 . 3]" 1 2484 1 182 GLN HA 1 185 SER QB 4.000 . 5.000 2.784 2.271 3.864 . 0 0 "[ . 1 . 2 . 3]" 1 2485 1 182 GLN HB3 1 182 GLN HG3 2.800 . 3.700 2.398 2.308 2.902 . 0 0 "[ . 1 . 2 . 3]" 1 2486 1 182 GLN H 1 182 GLN HG3 3.100 . 4.500 3.488 2.041 4.552 0.052 27 0 "[ . 1 . 2 . 3]" 1 2487 1 182 GLN H 1 182 GLN HB3 3.000 . 4.400 3.419 2.116 3.603 . 0 0 "[ . 1 . 2 . 3]" 1 2488 1 182 GLN H 1 182 GLN HA 2.900 . 3.800 2.816 2.731 2.884 . 0 0 "[ . 1 . 2 . 3]" 1 2489 1 182 GLN HE21 1 182 GLN HG3 3.000 . 4.400 3.250 2.238 3.584 . 0 0 "[ . 1 . 2 . 3]" 1 2490 1 182 GLN H 1 182 GLN HG2 3.200 . 4.600 2.406 1.769 4.446 0.031 9 0 "[ . 1 . 2 . 3]" 1 2491 1 182 GLN H 1 183 ALA MB 3.700 . 4.900 4.367 4.123 4.581 . 0 0 "[ . 1 . 2 . 3]" 1 2492 1 182 GLN HG2 1 183 ALA H 4.200 . 5.000 3.765 2.286 5.024 0.024 21 0 "[ . 1 . 2 . 3]" 1 2493 1 182 GLN H 1 183 ALA H 3.100 . 3.700 2.791 2.602 3.085 . 0 0 "[ . 1 . 2 . 3]" 1 2494 1 183 ALA H 1 184 LEU H 3.100 . 3.700 2.924 2.758 3.122 . 0 0 "[ . 1 . 2 . 3]" 1 2495 1 183 ALA H 1 183 ALA MB 2.600 . 3.600 2.140 2.024 2.245 . 0 0 "[ . 1 . 2 . 3]" 1 2496 1 182 GLN HB2 1 183 ALA H 3.400 . 4.100 2.504 2.063 4.246 0.146 17 0 "[ . 1 . 2 . 3]" 1 2497 1 183 ALA MB 1 184 LEU H 3.300 . 4.500 2.191 2.050 2.513 . 0 0 "[ . 1 . 2 . 3]" 1 2498 1 182 GLN HB3 1 183 ALA H 3.100 . 3.700 3.582 3.037 3.763 0.063 9 0 "[ . 1 . 2 . 3]" 1 2499 1 183 ALA H 1 183 ALA HA 2.600 . 3.100 2.803 2.728 2.871 . 0 0 "[ . 1 . 2 . 3]" 1 2500 1 183 ALA HA 1 183 ALA MB 2.300 . 3.300 2.123 2.098 2.144 . 0 0 "[ . 1 . 2 . 3]" 1 2501 1 180 HIS HA 1 183 ALA MB 2.900 . 4.000 2.767 2.303 3.708 . 0 0 "[ . 1 . 2 . 3]" 1 2502 1 180 HIS HA 1 183 ALA H 4.000 . 5.000 3.603 3.297 4.092 . 0 0 "[ . 1 . 2 . 3]" 1 2503 1 184 LEU HA 1 184 LEU MD2 2.900 . 4.000 2.683 2.108 3.728 . 0 0 "[ . 1 . 2 . 3]" 1 2504 1 127 ILE HB 1 184 LEU QD 4.000 . 5.500 4.213 2.252 5.495 . 0 0 "[ . 1 . 2 . 3]" 1 2505 1 150 ILE MG 1 184 LEU QD 4.000 . 6.000 3.736 2.234 4.732 . 0 0 "[ . 1 . 2 . 3]" 1 2506 1 184 LEU H 1 184 LEU MD1 3.700 . 4.900 3.104 1.813 4.131 . 0 0 "[ . 1 . 2 . 3]" 1 2507 1 184 LEU H 1 184 LEU MD2 3.600 . 4.800 3.270 1.956 4.056 . 0 0 "[ . 1 . 2 . 3]" 1 2508 1 184 LEU H 1 184 LEU HG 4.000 . 4.800 3.221 1.889 4.407 . 0 0 "[ . 1 . 2 . 3]" 1 2509 1 127 ILE MD 1 184 LEU MD2 3.000 . 4.600 3.388 1.878 4.611 0.011 27 0 "[ . 1 . 2 . 3]" 1 2510 1 150 ILE HG12 1 184 LEU MD2 4.000 . 5.500 4.335 2.304 5.559 0.059 15 0 "[ . 1 . 2 . 3]" 1 2511 1 150 ILE MD 1 184 LEU MD2 3.200 . 4.800 2.982 1.843 3.982 . 0 0 "[ . 1 . 2 . 3]" 1 2512 1 184 LEU MD1 1 184 LEU MD2 2.800 . 4.400 1.975 1.841 2.076 . 0 0 "[ . 1 . 2 . 3]" 1 2513 1 184 LEU HB3 1 184 LEU MD2 3.200 . 4.300 2.495 2.184 3.192 . 0 0 "[ . 1 . 2 . 3]" 1 2514 1 150 ILE MD 1 184 LEU MD1 3.200 . 4.800 3.069 2.037 4.628 . 0 0 "[ . 1 . 2 . 3]" 1 2515 1 184 LEU H 1 185 SER H 3.700 . 4.400 2.840 2.665 3.021 . 0 0 "[ . 1 . 2 . 3]" 1 2516 1 181 SER HA 1 184 LEU QB 4.000 . 5.000 2.966 2.396 3.368 . 0 0 "[ . 1 . 2 . 3]" 1 2517 1 184 LEU MD2 1 185 SER H 3.800 . 5.100 4.560 4.138 4.984 . 0 0 "[ . 1 . 2 . 3]" 1 2518 1 185 SER H 1 185 SER HB3 3.400 . 4.300 2.688 2.119 3.603 . 0 0 "[ . 1 . 2 . 3]" 1 2519 1 185 SER H 1 185 SER HA 3.000 . 3.600 2.751 2.732 2.864 . 0 0 "[ . 1 . 2 . 3]" 1 2520 1 183 ALA H 1 185 SER H 4.300 . 5.200 4.188 3.598 4.570 . 0 0 "[ . 1 . 2 . 3]" 1 2521 1 184 LEU HB2 1 185 SER H 4.200 . 5.000 2.705 2.145 3.344 . 0 0 "[ . 1 . 2 . 3]" 1 2522 1 184 LEU HG 1 185 SER H 4.300 . 5.200 4.683 4.053 5.185 . 0 0 "[ . 1 . 2 . 3]" 1 2523 1 150 ILE MG 1 185 SER H 4.700 . 5.900 3.303 2.833 4.059 . 0 0 "[ . 1 . 2 . 3]" 1 2524 1 150 ILE MG 1 185 SER HA 4.000 . 5.500 2.923 2.266 4.461 . 0 0 "[ . 1 . 2 . 3]" 1 2525 1 185 SER HA 1 186 GLY H 4.000 . 5.000 3.556 3.511 3.577 . 0 0 "[ . 1 . 2 . 3]" 1 2526 1 185 SER HA 1 188 LEU QB 4.000 . 5.000 2.694 2.290 3.156 . 0 0 "[ . 1 . 2 . 3]" 1 2527 1 150 ILE MG 1 185 SER QB 4.000 . 5.500 3.028 2.078 4.509 . 0 0 "[ . 1 . 2 . 3]" 1 2528 1 184 LEU HB3 1 185 SER H 3.800 . 4.600 3.215 2.295 3.886 . 0 0 "[ . 1 . 2 . 3]" 1 2529 1 185 SER HA 1 185 SER HB3 2.400 . 3.200 2.754 2.392 3.028 . 0 0 "[ . 1 . 2 . 3]" 1 2530 1 184 LEU MD1 1 185 SER H 3.600 . 4.800 4.246 3.707 4.810 0.010 8 0 "[ . 1 . 2 . 3]" 1 2531 1 186 GLY H 1 187 ARG H 3.200 . 3.800 2.848 2.673 3.010 . 0 0 "[ . 1 . 2 . 3]" 1 2532 1 185 SER H 1 186 GLY H 3.400 . 4.100 2.920 2.647 3.038 . 0 0 "[ . 1 . 2 . 3]" 1 2533 1 186 GLY H 1 186 GLY HA2 2.900 . 3.500 2.787 2.731 2.847 . 0 0 "[ . 1 . 2 . 3]" 1 2534 1 183 ALA HA 1 186 GLY H 4.000 . 5.000 3.789 3.391 4.012 . 0 0 "[ . 1 . 2 . 3]" 1 2535 1 187 ARG H 1 187 ARG HA 2.900 . 3.500 2.823 2.760 2.871 . 0 0 "[ . 1 . 2 . 3]" 1 2536 1 187 ARG H 1 187 ARG HB2 2.800 . 3.700 2.772 2.138 3.614 . 0 0 "[ . 1 . 2 . 3]" 1 2537 1 187 ARG H 1 188 LEU H 3.300 . 4.000 2.856 2.631 3.079 . 0 0 "[ . 1 . 2 . 3]" 1 2538 1 187 ARG H 1 189 ARG H 4.000 . 5.000 4.528 4.239 4.702 . 0 0 "[ . 1 . 2 . 3]" 1 2539 1 187 ARG HA 1 190 ALA H 4.000 . 5.000 3.450 3.279 3.805 . 0 0 "[ . 1 . 2 . 3]" 1 2540 1 187 ARG HA 1 190 ALA MB 4.000 . 5.500 2.446 2.202 2.785 . 0 0 "[ . 1 . 2 . 3]" 1 2541 1 187 ARG HA 1 188 LEU H 4.000 . 5.000 3.573 3.555 3.580 . 0 0 "[ . 1 . 2 . 3]" 1 2542 1 188 LEU H 1 188 LEU MD1 3.100 . 4.200 4.049 3.813 4.186 . 0 0 "[ . 1 . 2 . 3]" 1 2543 1 149 SER QB 1 188 LEU QD 5.000 . 6.500 4.191 2.822 5.329 . 0 0 "[ . 1 . 2 . 3]" 1 2544 1 188 LEU HA 1 188 LEU QD 4.000 . 5.500 1.975 1.931 2.118 . 0 0 "[ . 1 . 2 . 3]" 1 2545 1 187 ARG QB 1 188 LEU H 3.000 . 3.700 2.275 2.028 3.235 . 0 0 "[ . 1 . 2 . 3]" 1 2546 1 188 LEU MD1 1 192 LEU H 3.200 . 4.300 3.882 3.270 4.313 0.013 1 0 "[ . 1 . 2 . 3]" 1 2547 1 149 SER HA 1 188 LEU QD 5.000 . 6.500 2.665 2.018 3.851 . 0 0 "[ . 1 . 2 . 3]" 1 2548 1 149 SER H 1 188 LEU QD 5.000 . 6.500 4.114 3.400 4.972 . 0 0 "[ . 1 . 2 . 3]" 1 2549 1 188 LEU H 1 189 ARG H 3.500 . 4.200 3.131 3.030 3.204 . 0 0 "[ . 1 . 2 . 3]" 1 2550 1 189 ARG HD2 1 189 ARG HG3 2.900 . 3.800 2.320 2.244 2.664 . 0 0 "[ . 1 . 2 . 3]" 1 2551 1 189 ARG HB2 1 189 ARG HD2 3.100 . 4.000 3.341 2.686 3.626 . 0 0 "[ . 1 . 2 . 3]" 1 2552 1 189 ARG HB2 1 189 ARG HD3 3.100 . 4.000 2.473 2.323 3.898 . 0 0 "[ . 1 . 2 . 3]" 1 2553 1 189 ARG H 1 189 ARG HG2 3.600 . 4.600 3.799 1.891 4.056 . 0 0 "[ . 1 . 2 . 3]" 1 2554 1 189 ARG HB3 1 189 ARG HD2 3.100 . 4.000 3.758 2.337 4.054 0.054 29 0 "[ . 1 . 2 . 3]" 1 2555 1 189 ARG HA 1 189 ARG HD3 3.900 . 5.000 3.231 2.328 4.441 . 0 0 "[ . 1 . 2 . 3]" 1 2556 1 189 ARG HB3 1 189 ARG HD3 3.100 . 4.000 3.325 2.408 3.687 . 0 0 "[ . 1 . 2 . 3]" 1 2557 1 189 ARG H 1 189 ARG HB2 3.000 . 3.900 2.253 2.150 2.640 . 0 0 "[ . 1 . 2 . 3]" 1 2558 1 189 ARG H 1 189 ARG HD2 3.700 . 4.700 3.292 2.357 4.390 . 0 0 "[ . 1 . 2 . 3]" 1 2559 1 189 ARG HD2 1 189 ARG HG2 2.800 . 3.700 2.959 2.672 3.033 . 0 0 "[ . 1 . 2 . 3]" 1 2560 1 189 ARG HD3 1 189 ARG HG2 2.800 . 3.700 2.686 2.302 2.987 . 0 0 "[ . 1 . 2 . 3]" 1 2561 1 189 ARG HA 1 189 ARG HG2 3.400 . 4.400 3.283 2.343 3.566 . 0 0 "[ . 1 . 2 . 3]" 1 2562 1 189 ARG HA 1 189 ARG HD2 3.800 . 4.900 2.906 2.332 4.771 . 0 0 "[ . 1 . 2 . 3]" 1 2563 1 189 ARG HA 1 189 ARG HG3 3.400 . 4.400 2.484 2.320 3.737 . 0 0 "[ . 1 . 2 . 3]" 1 2564 1 189 ARG HD3 1 189 ARG HG3 2.900 . 3.800 2.956 2.668 3.032 . 0 0 "[ . 1 . 2 . 3]" 1 2565 1 188 LEU HB2 1 189 ARG H 3.000 . 3.600 3.162 2.594 3.605 0.005 24 0 "[ . 1 . 2 . 3]" 1 2566 1 188 LEU HA 1 189 ARG H 3.300 . 4.000 3.574 3.565 3.585 . 0 0 "[ . 1 . 2 . 3]" 1 2567 1 188 LEU MD1 1 189 ARG H 3.500 . 4.700 3.831 3.295 4.396 . 0 0 "[ . 1 . 2 . 3]" 1 2568 1 189 ARG H 1 190 ALA H 3.200 . 3.800 2.816 2.700 2.932 . 0 0 "[ . 1 . 2 . 3]" 1 2569 1 189 ARG H 1 189 ARG HG3 3.100 . 4.000 3.609 2.138 4.056 0.056 5 0 "[ . 1 . 2 . 3]" 1 2570 1 189 ARG H 1 189 ARG HB3 2.900 . 3.800 3.520 3.464 3.608 . 0 0 "[ . 1 . 2 . 3]" 1 2571 1 190 ALA H 1 190 ALA HA 3.000 . 3.600 2.826 2.739 2.907 . 0 0 "[ . 1 . 2 . 3]" 1 2572 1 188 LEU H 1 190 ALA H 3.600 . 4.300 4.117 3.943 4.304 0.004 26 0 "[ . 1 . 2 . 3]" 1 2573 1 189 ARG HD3 1 190 ALA H 4.400 . 5.100 4.661 4.300 5.253 0.153 25 0 "[ . 1 . 2 . 3]" 1 2574 1 189 ARG HB3 1 190 ALA H 2.900 . 3.500 3.365 3.161 3.559 0.059 26 0 "[ . 1 . 2 . 3]" 1 2575 1 189 ARG HD2 1 190 ALA H 5.200 . 6.000 5.307 4.706 6.010 0.010 1 0 "[ . 1 . 2 . 3]" 1 2576 1 190 ALA H 1 190 ALA MB 2.500 . 3.500 2.120 2.030 2.251 . 0 0 "[ . 1 . 2 . 3]" 1 2577 1 189 ARG HA 1 190 ALA H 4.000 . 5.000 3.524 3.474 3.555 . 0 0 "[ . 1 . 2 . 3]" 1 2578 1 189 ARG HB2 1 190 ALA H 2.900 . 3.500 2.895 2.373 3.181 . 0 0 "[ . 1 . 2 . 3]" 1 2579 1 190 ALA H 1 191 ILE H 3.200 . 3.800 2.677 2.311 2.932 . 0 0 "[ . 1 . 2 . 3]" 1 2580 1 189 ARG H 1 190 ALA MB 4.000 . 5.500 4.423 4.286 4.561 . 0 0 "[ . 1 . 2 . 3]" 1 2581 1 190 ALA HA 1 190 ALA MB 2.400 . 3.400 2.116 2.100 2.140 . 0 0 "[ . 1 . 2 . 3]" 1 2582 1 190 ALA MB 1 191 ILE H 2.900 . 4.000 2.542 2.143 2.943 . 0 0 "[ . 1 . 2 . 3]" 1 2583 1 139 GLN QG 1 191 ILE MG 4.000 . 5.500 3.789 2.093 5.505 0.005 2 0 "[ . 1 . 2 . 3]" 1 2584 1 191 ILE H 1 191 ILE HB 2.800 . 3.700 2.691 2.245 3.153 . 0 0 "[ . 1 . 2 . 3]" 1 2585 1 191 ILE H 1 191 ILE HG13 3.100 . 4.000 2.660 1.839 3.806 . 0 0 "[ . 1 . 2 . 3]" 1 2586 1 191 ILE H 1 191 ILE HG12 2.900 . 3.800 2.623 1.756 3.851 0.051 13 0 "[ . 1 . 2 . 3]" 1 2587 1 191 ILE MD 1 192 LEU H 4.000 . 5.300 4.472 3.905 4.897 . 0 0 "[ . 1 . 2 . 3]" 1 2588 1 188 LEU HA 1 191 ILE MD 3.600 . 4.800 3.067 2.117 4.280 . 0 0 "[ . 1 . 2 . 3]" 1 2589 1 187 ARG HB2 1 191 ILE MD 3.000 . 4.100 4.026 3.547 4.217 0.117 11 0 "[ . 1 . 2 . 3]" 1 2590 1 190 ALA MB 1 191 ILE MD 4.200 . 6.000 3.520 2.219 4.605 . 0 0 "[ . 1 . 2 . 3]" 1 2591 1 135 LYS HD3 1 191 ILE MD 3.200 . 4.300 2.881 2.071 4.311 0.011 27 0 "[ . 1 . 2 . 3]" 1 2592 1 188 LEU H 1 191 ILE MD 3.900 . 5.000 4.297 3.313 5.051 0.051 5 0 "[ . 1 . 2 . 3]" 1 2593 1 191 ILE MG 1 192 LEU H 3.000 . 4.100 3.737 3.226 4.136 0.036 28 0 "[ . 1 . 2 . 3]" 1 2594 1 191 ILE HA 1 191 ILE MG 2.900 . 4.000 2.281 2.156 2.590 . 0 0 "[ . 1 . 2 . 3]" 1 2595 1 135 LYS HD3 1 191 ILE MG 2.700 . 3.700 2.629 2.077 3.749 0.049 3 0 "[ . 1 . 2 . 3]" 1 2596 1 191 ILE MG 1 194 ASN HB3 3.400 . 4.600 4.406 3.795 4.670 0.070 29 0 "[ . 1 . 2 . 3]" 1 2597 1 191 ILE MD 1 191 ILE MG 2.700 . 4.200 1.980 1.789 3.236 0.011 5 0 "[ . 1 . 2 . 3]" 1 2598 1 191 ILE HB 1 191 ILE MD 3.100 . 4.200 2.678 2.244 3.205 . 0 0 "[ . 1 . 2 . 3]" 1 2599 1 191 ILE HA 1 191 ILE MD 3.200 . 4.300 3.084 2.106 3.853 . 0 0 "[ . 1 . 2 . 3]" 1 2600 1 191 ILE H 1 191 ILE MG 3.000 . 4.100 3.703 3.510 3.768 . 0 0 "[ . 1 . 2 . 3]" 1 2601 1 139 GLN H 1 191 ILE MG 4.000 . 5.500 4.188 3.227 5.280 . 0 0 "[ . 1 . 2 . 3]" 1 2602 1 191 ILE H 1 191 ILE MD 3.300 . 4.500 2.985 1.784 3.794 0.016 29 0 "[ . 1 . 2 . 3]" 1 2603 1 190 ALA HA 1 191 ILE H 3.600 . 4.300 3.540 3.439 3.583 . 0 0 "[ . 1 . 2 . 3]" 1 2604 1 188 LEU HA 1 191 ILE H 4.000 . 5.000 3.373 2.976 3.776 . 0 0 "[ . 1 . 2 . 3]" 1 2605 1 139 GLN QG 1 192 LEU QD 4.000 . 5.500 4.115 2.768 5.471 . 0 0 "[ . 1 . 2 . 3]" 1 2606 1 191 ILE H 1 192 LEU H 3.500 . 4.200 2.635 2.333 2.892 . 0 0 "[ . 1 . 2 . 3]" 1 2607 1 192 LEU H 1 193 GLN H 3.200 . 3.800 2.692 2.410 2.789 . 0 0 "[ . 1 . 2 . 3]" 1 2608 1 191 ILE HA 1 192 LEU H 4.000 . 5.000 3.517 3.456 3.563 . 0 0 "[ . 1 . 2 . 3]" 1 2609 1 189 ARG HA 1 192 LEU H 4.000 . 5.000 3.460 3.111 3.800 . 0 0 "[ . 1 . 2 . 3]" 1 2610 1 139 GLN H 1 192 LEU QD 4.000 . 5.500 4.917 4.075 5.527 0.027 29 0 "[ . 1 . 2 . 3]" 1 2611 1 192 LEU H 1 192 LEU HB2 3.400 . 4.100 2.188 2.075 2.824 . 0 0 "[ . 1 . 2 . 3]" 1 2612 1 192 LEU H 1 192 LEU HB3 3.300 . 4.000 3.377 3.148 3.589 . 0 0 "[ . 1 . 2 . 3]" 1 2613 1 192 LEU H 1 192 LEU HA 2.600 . 3.100 2.848 2.756 2.900 . 0 0 "[ . 1 . 2 . 3]" 1 2614 1 192 LEU H 1 192 LEU MD1 3.000 . 4.100 3.181 2.024 4.141 0.041 13 0 "[ . 1 . 2 . 3]" 1 2615 1 142 ARG QB 1 192 LEU QD 4.000 . 5.500 3.546 2.626 4.171 . 0 0 "[ . 1 . 2 . 3]" 1 2616 1 193 GLN H 1 193 GLN HA 2.600 . 3.400 2.945 2.922 2.962 . 0 0 "[ . 1 . 2 . 3]" 1 2617 1 193 GLN H 1 194 ASN H 4.400 . 5.300 2.271 1.752 3.084 0.048 20 0 "[ . 1 . 2 . 3]" 1 2618 1 191 ILE HA 1 193 GLN H 4.000 . 5.000 3.393 3.130 4.141 . 0 0 "[ . 1 . 2 . 3]" 1 2619 1 193 GLN HA 1 193 GLN HB2 2.700 . 3.500 3.020 2.987 3.030 . 0 0 "[ . 1 . 2 . 3]" 1 2620 1 193 GLN HB2 1 193 GLN HG3 2.800 . 3.700 2.492 2.254 2.929 . 0 0 "[ . 1 . 2 . 3]" 1 2621 1 193 GLN HA 1 194 ASN H 3.300 . 4.000 3.178 2.477 3.575 . 0 0 "[ . 1 . 2 . 3]" 1 2622 1 192 LEU HB2 1 193 GLN H 3.400 . 4.100 3.749 2.850 4.042 . 0 0 "[ . 1 . 2 . 3]" 1 2623 1 193 GLN H 1 193 GLN HG3 2.900 . 3.800 3.320 2.784 3.849 0.049 13 0 "[ . 1 . 2 . 3]" 1 2624 1 192 LEU HA 1 193 GLN H 2.600 . 3.100 3.219 3.176 3.428 0.328 5 0 "[ . 1 . 2 . 3]" 1 2625 1 192 LEU HB3 1 193 GLN H 3.300 . 4.000 3.983 3.862 4.065 0.065 8 0 "[ . 1 . 2 . 3]" 1 2626 1 192 LEU MD1 1 193 GLN H 3.400 . 4.600 4.462 4.167 4.680 0.080 5 0 "[ . 1 . 2 . 3]" 1 2627 1 190 ALA HA 1 193 GLN H 4.000 . 5.000 3.899 3.327 4.390 . 0 0 "[ . 1 . 2 . 3]" 1 2628 1 193 GLN HB2 1 194 ASN H 4.200 . 5.000 3.423 1.802 4.516 . 0 0 "[ . 1 . 2 . 3]" 1 2629 1 193 GLN H 1 193 GLN HB2 2.600 . 3.400 2.682 2.303 2.936 . 0 0 "[ . 1 . 2 . 3]" 1 2630 1 193 GLN HA 1 193 GLN HG3 2.800 . 3.700 2.997 2.322 3.746 0.046 13 0 "[ . 1 . 2 . 3]" 1 2631 1 194 ASN HB2 1 194 ASN HD21 3.400 . 4.400 2.674 2.244 3.308 . 0 0 "[ . 1 . 2 . 3]" 1 2632 1 191 ILE HA 1 194 ASN H 4.000 . 5.000 3.642 2.848 4.677 . 0 0 "[ . 1 . 2 . 3]" 1 2633 1 194 ASN HA 1 194 ASN HD22 3.400 . 4.400 3.893 3.246 4.701 0.301 30 0 "[ . 1 . 2 . 3]" 1 2634 1 194 ASN HB2 1 194 ASN HD22 2.900 . 3.800 3.683 3.511 3.954 0.154 20 0 "[ . 1 . 2 . 3]" 1 2635 1 194 ASN HB3 1 194 ASN HD22 3.300 . 4.300 4.007 3.495 4.121 . 0 0 "[ . 1 . 2 . 3]" 1 2636 1 194 ASN HB3 1 194 ASN HD21 3.400 . 4.400 3.382 2.232 3.621 . 0 0 "[ . 1 . 2 . 3]" 1 2637 1 194 ASN HA 1 194 ASN HD21 4.400 . 5.300 3.115 1.980 4.296 . 0 0 "[ . 1 . 2 . 3]" 1 2638 1 194 ASN H 1 194 ASN HD22 3.800 . 5.100 4.500 2.382 5.182 0.082 8 0 "[ . 1 . 2 . 3]" 1 2639 1 195 GLN HB3 1 195 GLN HG3 2.700 . 3.500 3.003 2.973 3.027 . 0 0 "[ . 1 . 2 . 3]" 1 2640 1 195 GLN HB3 1 196 GLY H 3.800 . 4.600 2.950 1.802 4.229 . 0 0 "[ . 1 . 2 . 3]" 1 2641 1 195 GLN H 1 195 GLN HB2 3.800 . 4.900 3.078 2.302 3.957 . 0 0 "[ . 1 . 2 . 3]" 1 2642 1 195 GLN HA 1 195 GLN HG3 2.900 . 3.800 3.107 2.483 3.828 0.028 25 0 "[ . 1 . 2 . 3]" 1 2643 1 195 GLN HA 1 195 GLN HB2 3.000 . 3.600 2.755 2.340 3.029 . 0 0 "[ . 1 . 2 . 3]" 1 2644 1 195 GLN HB2 1 195 GLN HG3 2.600 . 3.400 2.342 2.296 2.405 . 0 0 "[ . 1 . 2 . 3]" 1 2645 1 195 GLN HB2 1 196 GLY H 3.600 . 4.300 3.552 1.815 4.306 0.006 25 0 "[ . 1 . 2 . 3]" 1 2646 1 195 GLN H 1 195 GLN HG3 3.700 . 4.700 3.686 1.868 4.729 0.029 19 0 "[ . 1 . 2 . 3]" 1 2647 1 195 GLN HB2 1 195 GLN HE22 3.400 . 4.400 4.317 4.076 4.419 0.019 21 0 "[ . 1 . 2 . 3]" 1 2648 1 195 GLN HA 1 196 GLY H 3.300 . 4.000 2.968 2.230 3.575 . 0 0 "[ . 1 . 2 . 3]" 1 2649 1 194 ASN HA 1 195 GLN H 3.200 . 3.800 2.518 2.147 3.574 . 0 0 "[ . 1 . 2 . 3]" 1 2650 1 195 GLN HE21 1 195 GLN HG3 2.800 . 3.700 2.229 2.220 2.257 . 0 0 "[ . 1 . 2 . 3]" 1 2651 1 195 GLN HB3 1 195 GLN HE21 3.500 . 4.500 4.058 3.879 4.157 . 0 0 "[ . 1 . 2 . 3]" 1 2652 1 195 GLN HB3 1 195 GLN HE22 3.300 . 4.300 4.274 4.144 4.338 0.038 2 0 "[ . 1 . 2 . 3]" 1 2653 1 197 ASN HA 1 197 ASN HB3 2.700 . 3.500 2.647 2.291 3.026 . 0 0 "[ . 1 . 2 . 3]" 1 2654 1 197 ASN HA 1 197 ASN HB2 3.000 . 3.900 2.740 2.371 3.028 . 0 0 "[ . 1 . 2 . 3]" 1 2655 1 197 ASN HB3 1 197 ASN HD21 2.700 . 3.700 2.682 2.245 3.455 . 0 0 "[ . 1 . 2 . 3]" 1 2656 1 197 ASN HB3 1 197 ASN HD22 2.900 . 4.000 3.690 3.508 4.033 0.033 10 0 "[ . 1 . 2 . 3]" 1 stop_ save_ save_distance_constraint_statistics_2 _Distance_constraint_stats_list.Sf_category distance_constraint_statistics _Distance_constraint_stats_list.Constraint_list_ID 2 _Distance_constraint_stats_list.Constraint_count 168 _Distance_constraint_stats_list.Viol_count 1804 _Distance_constraint_stats_list.Viol_total 2704.559 _Distance_constraint_stats_list.Viol_max 1.263 _Distance_constraint_stats_list.Viol_rms 0.0468 _Distance_constraint_stats_list.Viol_average_all_restraints 0.0179 _Distance_constraint_stats_list.Viol_average_violations_only 0.0500 _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 9 ASP 0.044 0.013 13 0 "[ . 1 . 2 . 3]" 1 10 PRO 0.267 0.069 5 0 "[ . 1 . 2 . 3]" 1 11 ASP 0.239 0.051 25 0 "[ . 1 . 2 . 3]" 1 12 THR 0.161 0.029 28 0 "[ . 1 . 2 . 3]" 1 13 PHE 0.150 0.036 19 0 "[ . 1 . 2 . 3]" 1 14 THR 0.636 0.069 5 0 "[ . 1 . 2 . 3]" 1 15 PHE 0.239 0.051 25 0 "[ . 1 . 2 . 3]" 1 16 ASN 0.161 0.029 28 0 "[ . 1 . 2 . 3]" 1 17 PHE 0.106 0.036 19 0 "[ . 1 . 2 . 3]" 1 18 ASN 0.369 0.060 6 0 "[ . 1 . 2 . 3]" 1 30 TYR 7.104 0.224 10 0 "[ . 1 . 2 . 3]" 1 31 LEU 1.778 0.133 4 0 "[ . 1 . 2 . 3]" 1 32 CYS 1.363 0.073 22 0 "[ . 1 . 2 . 3]" 1 33 TYR 0.666 0.099 17 0 "[ . 1 . 2 . 3]" 1 34 GLU 5.647 0.192 24 0 "[ . 1 . 2 . 3]" 1 35 VAL 0.725 0.146 13 0 "[ . 1 . 2 . 3]" 1 36 GLU 0.447 0.047 7 0 "[ . 1 . 2 . 3]" 1 37 ARG 3.134 0.177 24 0 "[ . 1 . 2 . 3]" 1 38 LEU 3.363 0.111 25 0 "[ . 1 . 2 . 3]" 1 39 ASP 0.840 0.068 26 0 "[ . 1 . 2 . 3]" 1 42 THR 0.840 0.068 26 0 "[ . 1 . 2 . 3]" 1 44 VAL 3.134 0.177 24 0 "[ . 1 . 2 . 3]" 1 46 MET 1.444 0.146 13 0 "[ . 1 . 2 . 3]" 1 47 ASP 1.333 0.228 7 0 "[ . 1 . 2 . 3]" 1 49 HIS 0.719 0.101 18 0 "[ . 1 . 2 . 3]" 1 50 MET 1.333 0.228 7 0 "[ . 1 . 2 . 3]" 1 51 GLY 0.666 0.099 17 0 "[ . 1 . 2 . 3]" 1 53 LEU 1.778 0.133 4 0 "[ . 1 . 2 . 3]" 1 68 HIS 1.634 0.190 6 0 "[ . 1 . 2 . 3]" 1 69 ALA 0.068 0.023 15 0 "[ . 1 . 2 . 3]" 1 70 GLU 11.994 1.263 19 3 "[ . 1 .- +2 . * 3]" 1 71 LEU 3.345 0.253 22 0 "[ . 1 . 2 . 3]" 1 72 ARG 2.478 0.190 6 0 "[ . 1 . 2 . 3]" 1 73 PHE 0.068 0.023 15 0 "[ . 1 . 2 . 3]" 1 74 LEU 4.061 0.201 22 0 "[ . 1 . 2 . 3]" 1 75 ASP 3.345 0.253 22 0 "[ . 1 . 2 . 3]" 1 76 LEU 1.672 0.149 19 0 "[ . 1 . 2 . 3]" 1 77 VAL 2.376 0.196 12 0 "[ . 1 . 2 . 3]" 1 78 PRO 0.261 0.096 24 0 "[ . 1 . 2 . 3]" 1 79 SER 0.829 0.113 18 0 "[ . 1 . 2 . 3]" 1 80 LEU 2.376 0.196 12 0 "[ . 1 . 2 . 3]" 1 81 GLN 0.261 0.096 24 0 "[ . 1 . 2 . 3]" 1 87 ILE 3.363 0.111 25 0 "[ . 1 . 2 . 3]" 1 88 TYR 0.421 0.055 20 0 "[ . 1 . 2 . 3]" 1 89 ARG 0.447 0.047 7 0 "[ . 1 . 2 . 3]" 1 90 VAL 0.426 0.098 26 0 "[ . 1 . 2 . 3]" 1 91 THR 5.647 0.192 24 0 "[ . 1 . 2 . 3]" 1 92 TRP 2.367 0.115 7 0 "[ . 1 . 2 . 3]" 1 93 PHE 1.363 0.073 22 0 "[ . 1 . 2 . 3]" 1 94 ILE 0.300 0.081 15 0 "[ . 1 . 2 . 3]" 1 95 SER 7.104 0.224 10 0 "[ . 1 . 2 . 3]" 1 104 CYS 0.310 0.080 15 0 "[ . 1 . 2 . 3]" 1 105 ALA 1.428 0.162 30 0 "[ . 1 . 2 . 3]" 1 106 GLY 1.165 0.093 22 0 "[ . 1 . 2 . 3]" 1 107 GLU 0.456 0.091 11 0 "[ . 1 . 2 . 3]" 1 108 VAL 0.626 0.080 15 0 "[ . 1 . 2 . 3]" 1 109 ARG 3.176 0.162 30 0 "[ . 1 . 2 . 3]" 1 110 ALA 1.300 0.093 22 0 "[ . 1 . 2 . 3]" 1 111 PHE 0.475 0.091 11 0 "[ . 1 . 2 . 3]" 1 112 LEU 0.316 0.048 25 0 "[ . 1 . 2 . 3]" 1 113 GLN 1.748 0.129 7 0 "[ . 1 . 2 . 3]" 1 114 GLU 0.135 0.062 30 0 "[ . 1 . 2 . 3]" 1 115 ASN 0.019 0.019 30 0 "[ . 1 . 2 . 3]" 1 117 HIS 0.264 0.031 3 0 "[ . 1 . 2 . 3]" 1 119 ARG 0.377 0.055 20 0 "[ . 1 . 2 . 3]" 1 120 LEU 6.074 0.223 18 0 "[ . 1 . 2 . 3]" 1 121 ARG 0.622 0.098 26 0 "[ . 1 . 2 . 3]" 1 122 ILE 3.956 0.140 11 0 "[ . 1 . 2 . 3]" 1 123 PHE 1.951 0.115 7 0 "[ . 1 . 2 . 3]" 1 124 ALA 3.114 0.156 26 0 "[ . 1 . 2 . 3]" 1 125 ALA 0.300 0.081 15 0 "[ . 1 . 2 . 3]" 1 133 LEU 1.287 0.078 23 0 "[ . 1 . 2 . 3]" 1 134 TYR 0.792 0.098 9 0 "[ . 1 . 2 . 3]" 1 135 LYS 0.308 0.047 22 0 "[ . 1 . 2 . 3]" 1 136 GLU 0.740 0.085 9 0 "[ . 1 . 2 . 3]" 1 137 ALA 2.170 0.154 7 0 "[ . 1 . 2 . 3]" 1 138 LEU 1.049 0.098 9 0 "[ . 1 . 2 . 3]" 1 139 GLN 1.574 0.081 25 0 "[ . 1 . 2 . 3]" 1 140 MET 0.740 0.085 9 0 "[ . 1 . 2 . 3]" 1 141 LEU 0.882 0.154 7 0 "[ . 1 . 2 . 3]" 1 142 ARG 0.257 0.064 12 0 "[ . 1 . 2 . 3]" 1 143 ASP 1.267 0.081 25 0 "[ . 1 . 2 . 3]" 1 147 GLN 8.401 0.223 18 0 "[ . 1 . 2 . 3]" 1 149 SER 4.074 0.156 26 0 "[ . 1 . 2 . 3]" 1 151 MET 0.668 0.091 13 0 "[ . 1 . 2 . 3]" 1 152 THR 0.109 0.042 28 0 "[ . 1 . 2 . 3]" 1 153 TYR 0.362 0.081 9 0 "[ . 1 . 2 . 3]" 1 154 ASP 0.137 0.033 26 0 "[ . 1 . 2 . 3]" 1 155 GLU 0.176 0.034 24 0 "[ . 1 . 2 . 3]" 1 156 PHE 0.229 0.042 28 0 "[ . 1 . 2 . 3]" 1 157 GLU 0.399 0.081 9 0 "[ . 1 . 2 . 3]" 1 158 TYR 0.513 0.036 4 0 "[ . 1 . 2 . 3]" 1 159 CYS 0.780 0.112 19 0 "[ . 1 . 2 . 3]" 1 160 TRP 1.903 0.134 9 0 "[ . 1 . 2 . 3]" 1 161 ASP 0.037 0.010 1 0 "[ . 1 . 2 . 3]" 1 162 THR 0.376 0.036 4 0 "[ . 1 . 2 . 3]" 1 163 PHE 0.604 0.112 19 0 "[ . 1 . 2 . 3]" 1 164 VAL 1.783 0.134 9 0 "[ . 1 . 2 . 3]" 1 176 GLY 0.540 0.092 28 0 "[ . 1 . 2 . 3]" 1 177 LEU 0.593 0.089 13 0 "[ . 1 . 2 . 3]" 1 178 GLU 0.705 0.135 19 0 "[ . 1 . 2 . 3]" 1 179 GLU 1.571 0.271 17 0 "[ . 1 . 2 . 3]" 1 180 HIS 1.238 0.092 28 0 "[ . 1 . 2 . 3]" 1 181 SER 1.559 0.103 27 0 "[ . 1 . 2 . 3]" 1 182 GLN 1.070 0.135 19 0 "[ . 1 . 2 . 3]" 1 183 ALA 3.092 0.271 17 0 "[ . 1 . 2 . 3]" 1 184 LEU 1.516 0.091 19 0 "[ . 1 . 2 . 3]" 1 185 SER 1.027 0.103 27 0 "[ . 1 . 2 . 3]" 1 186 GLY 1.049 0.075 29 0 "[ . 1 . 2 . 3]" 1 187 ARG 1.670 0.107 26 0 "[ . 1 . 2 . 3]" 1 188 LEU 1.172 0.091 19 0 "[ . 1 . 2 . 3]" 1 189 ARG 0.061 0.037 19 0 "[ . 1 . 2 . 3]" 1 190 ALA 0.684 0.075 29 0 "[ . 1 . 2 . 3]" 1 191 ILE 0.149 0.084 5 0 "[ . 1 . 2 . 3]" 1 192 LEU 0.353 0.070 26 0 "[ . 1 . 2 . 3]" stop_ loop_ _Distance_constraint_stats.Restraint_ID _Distance_constraint_stats.Atom_1_entity_assembly_ID _Distance_constraint_stats.Atom_1_comp_index_ID _Distance_constraint_stats.Atom_1_comp_ID _Distance_constraint_stats.Atom_1_ID _Distance_constraint_stats.Atom_2_entity_assembly_ID _Distance_constraint_stats.Atom_2_comp_index_ID _Distance_constraint_stats.Atom_2_comp_ID _Distance_constraint_stats.Atom_2_ID _Distance_constraint_stats.Node_1_distance_val _Distance_constraint_stats.Node_1_distance_lower_bound_val _Distance_constraint_stats.Node_1_distance_upper_bound_val _Distance_constraint_stats.Distance_average _Distance_constraint_stats.Distance_minimum _Distance_constraint_stats.Distance_maximum _Distance_constraint_stats.Max_violation _Distance_constraint_stats.Max_violation_model_number _Distance_constraint_stats.Over_cutoff_violation_count _Distance_constraint_stats.Over_cutoff_viol_per_model _Distance_constraint_stats.Distance_constraint_stats_ID 1 1 9 ASP O 1 13 PHE H 2.000 . 2.300 1.999 1.787 2.311 0.013 13 0 "[ . 1 . 2 . 3]" 2 2 1 10 PRO O 1 14 THR H 2.000 . 2.300 1.854 1.731 2.266 0.069 5 0 "[ . 1 . 2 . 3]" 2 3 1 11 ASP O 1 15 PHE H 2.000 . 2.300 2.142 1.885 2.351 0.051 25 0 "[ . 1 . 2 . 3]" 2 4 1 12 THR O 1 16 ASN H 2.000 . 2.300 1.951 1.779 2.295 0.021 1 0 "[ . 1 . 2 . 3]" 2 5 1 13 PHE O 1 17 PHE H 2.000 . 2.300 2.029 1.764 2.312 0.036 19 0 "[ . 1 . 2 . 3]" 2 6 1 14 THR O 1 18 ASN H 2.000 . 2.300 2.092 1.802 2.311 0.011 13 0 "[ . 1 . 2 . 3]" 2 7 1 31 LEU H 1 53 LEU O 2.000 . 2.300 2.326 2.109 2.433 0.133 4 0 "[ . 1 . 2 . 3]" 2 8 1 32 CYS H 1 93 PHE O 2.000 . 2.300 1.808 1.727 2.155 0.073 22 0 "[ . 1 . 2 . 3]" 2 9 1 33 TYR H 1 51 GLY O 2.000 . 2.300 2.290 2.060 2.399 0.099 17 0 "[ . 1 . 2 . 3]" 2 10 1 34 GLU H 1 91 THR O 2.000 . 2.300 2.381 2.273 2.492 0.192 24 0 "[ . 1 . 2 . 3]" 2 11 1 36 GLU H 1 89 ARG O 2.000 . 2.300 2.244 1.868 2.346 0.046 28 0 "[ . 1 . 2 . 3]" 2 12 1 37 ARG H 1 44 VAL O 2.000 . 2.300 2.030 1.658 2.290 0.142 13 0 "[ . 1 . 2 . 3]" 2 13 1 38 LEU H 1 87 ILE O 2.000 . 2.300 2.375 2.337 2.411 0.111 25 0 "[ . 1 . 2 . 3]" 2 14 1 39 ASP H 1 42 THR O 2.000 . 2.300 1.935 1.837 2.013 . 0 0 "[ . 1 . 2 . 3]" 2 15 1 39 ASP O 1 42 THR H 2.000 . 2.300 2.097 1.748 2.330 0.052 10 0 "[ . 1 . 2 . 3]" 2 16 1 37 ARG O 1 44 VAL H 2.000 . 2.300 2.341 1.771 2.477 0.177 24 0 "[ . 1 . 2 . 3]" 2 17 1 35 VAL O 1 46 MET H 2.000 . 2.300 2.220 1.881 2.446 0.146 13 0 "[ . 1 . 2 . 3]" 2 18 1 33 TYR O 1 51 GLY H 2.000 . 2.300 2.215 2.075 2.312 0.012 6 0 "[ . 1 . 2 . 3]" 2 19 1 31 LEU O 1 53 LEU H 2.000 . 2.300 1.930 1.700 2.169 0.100 21 0 "[ . 1 . 2 . 3]" 2 20 1 46 MET O 1 49 HIS H 2.000 . 2.300 2.294 1.969 2.401 0.101 18 0 "[ . 1 . 2 . 3]" 2 21 1 47 ASP O 1 50 MET H 2.000 . 2.300 2.297 2.068 2.528 0.228 7 0 "[ . 1 . 2 . 3]" 2 22 1 70 GLU H 1 70 GLU OE1 2.000 . 2.300 2.142 1.714 3.563 1.263 19 3 "[ . 1 .- +2 . * 3]" 2 23 1 68 HIS O 1 72 ARG H 2.000 . 2.300 2.283 1.795 2.490 0.190 6 0 "[ . 1 . 2 . 3]" 2 24 1 69 ALA O 1 73 PHE H 2.000 . 2.300 2.045 1.808 2.323 0.023 15 0 "[ . 1 . 2 . 3]" 2 25 1 70 GLU O 1 74 LEU H 2.000 . 2.300 2.373 2.037 2.501 0.201 22 0 "[ . 1 . 2 . 3]" 2 26 1 71 LEU O 1 75 ASP H 2.000 . 2.300 2.407 2.312 2.553 0.253 22 0 "[ . 1 . 2 . 3]" 2 27 1 72 ARG O 1 76 LEU H 2.000 . 2.300 2.208 1.925 2.449 0.149 19 0 "[ . 1 . 2 . 3]" 2 28 1 76 LEU O 1 79 SER H 2.000 . 2.300 1.964 1.846 2.106 . 0 0 "[ . 1 . 2 . 3]" 2 29 1 77 VAL O 1 80 LEU H 2.000 . 2.300 1.795 1.641 2.004 0.159 12 0 "[ . 1 . 2 . 3]" 2 30 1 78 PRO O 1 81 GLN H 2.000 . 2.300 2.210 1.908 2.396 0.096 24 0 "[ . 1 . 2 . 3]" 2 31 1 88 TYR H 1 117 HIS O 2.000 . 2.300 2.265 2.060 2.331 0.031 3 0 "[ . 1 . 2 . 3]" 2 32 1 36 GLU O 1 89 ARG H 2.000 . 2.300 2.220 2.055 2.347 0.047 7 0 "[ . 1 . 2 . 3]" 2 33 1 90 VAL H 1 119 ARG O 2.000 . 2.300 1.845 1.752 2.000 0.048 2 0 "[ . 1 . 2 . 3]" 2 34 1 34 GLU O 1 91 THR H 2.000 . 2.300 2.400 2.159 2.477 0.177 2 0 "[ . 1 . 2 . 3]" 2 35 1 92 TRP H 1 121 ARG O 2.000 . 2.300 1.845 1.741 2.029 0.059 1 0 "[ . 1 . 2 . 3]" 2 36 1 32 CYS O 1 93 PHE H 2.000 . 2.300 1.856 1.752 2.011 0.048 13 0 "[ . 1 . 2 . 3]" 2 37 1 94 ILE H 1 123 PHE O 2.000 . 2.300 2.044 1.804 2.245 . 0 0 "[ . 1 . 2 . 3]" 2 38 1 30 TYR O 1 95 SER H 2.000 . 2.300 2.462 2.407 2.524 0.224 10 0 "[ . 1 . 2 . 3]" 2 39 1 104 CYS O 1 108 VAL H 2.000 . 2.300 1.952 1.720 2.261 0.080 15 0 "[ . 1 . 2 . 3]" 2 40 1 105 ALA O 1 109 ARG H 2.000 . 2.300 2.120 1.732 2.384 0.084 29 0 "[ . 1 . 2 . 3]" 2 41 1 106 GLY O 1 110 ALA H 2.000 . 2.300 2.327 2.156 2.393 0.093 22 0 "[ . 1 . 2 . 3]" 2 42 1 107 GLU O 1 111 PHE H 2.000 . 2.300 2.231 1.836 2.391 0.091 11 0 "[ . 1 . 2 . 3]" 2 43 1 108 VAL O 1 112 LEU H 2.000 . 2.300 2.184 1.931 2.348 0.048 25 0 "[ . 1 . 2 . 3]" 2 44 1 109 ARG O 1 113 GLN H 2.000 . 2.300 2.356 2.280 2.429 0.129 7 0 "[ . 1 . 2 . 3]" 2 45 1 110 ALA O 1 114 GLU H 2.000 . 2.300 2.093 1.871 2.326 0.026 1 0 "[ . 1 . 2 . 3]" 2 46 1 111 PHE O 1 115 ASN H 2.000 . 2.300 1.965 1.781 2.186 0.019 30 0 "[ . 1 . 2 . 3]" 2 47 1 88 TYR O 1 119 ARG H 2.000 . 2.300 2.108 1.784 2.355 0.055 20 0 "[ . 1 . 2 . 3]" 2 48 1 90 VAL O 1 121 ARG H 2.000 . 2.300 2.132 1.934 2.398 0.098 26 0 "[ . 1 . 2 . 3]" 2 49 1 122 ILE H 1 147 GLN O 2.000 . 2.300 1.797 1.684 2.207 0.116 25 0 "[ . 1 . 2 . 3]" 2 50 1 92 TRP O 1 123 PHE H 2.000 . 2.300 2.326 1.849 2.415 0.115 7 0 "[ . 1 . 2 . 3]" 2 51 1 124 ALA H 1 149 SER O 2.000 . 2.300 2.379 2.317 2.456 0.156 26 0 "[ . 1 . 2 . 3]" 2 52 1 94 ILE O 1 125 ALA H 2.000 . 2.300 2.228 1.878 2.381 0.081 15 0 "[ . 1 . 2 . 3]" 2 53 1 133 LEU O 1 137 ALA H 2.000 . 2.300 2.303 1.797 2.378 0.078 23 0 "[ . 1 . 2 . 3]" 2 54 1 134 TYR O 1 138 LEU H 2.000 . 2.300 1.958 1.760 2.337 0.040 20 0 "[ . 1 . 2 . 3]" 2 55 1 135 LYS O 1 139 GLN H 2.000 . 2.300 2.256 2.076 2.347 0.047 22 0 "[ . 1 . 2 . 3]" 2 56 1 136 GLU O 1 140 MET H 2.000 . 2.300 2.307 2.151 2.385 0.085 9 0 "[ . 1 . 2 . 3]" 2 57 1 137 ALA O 1 141 LEU H 2.000 . 2.300 2.258 2.014 2.454 0.154 7 0 "[ . 1 . 2 . 3]" 2 58 1 138 LEU O 1 142 ARG H 2.000 . 2.300 2.155 1.995 2.364 0.064 12 0 "[ . 1 . 2 . 3]" 2 59 1 139 GLN O 1 143 ASP H 2.000 . 2.300 2.342 2.309 2.381 0.081 25 0 "[ . 1 . 2 . 3]" 2 60 1 120 LEU O 1 147 GLN H 2.000 . 2.300 2.460 2.401 2.523 0.223 18 0 "[ . 1 . 2 . 3]" 2 61 1 122 ILE O 1 149 SER H 2.000 . 2.300 2.348 2.121 2.440 0.140 11 0 "[ . 1 . 2 . 3]" 2 62 1 124 ALA O 1 151 MET H 2.000 . 2.300 2.268 2.101 2.391 0.091 13 0 "[ . 1 . 2 . 3]" 2 63 1 152 THR O 1 156 PHE H 2.000 . 2.300 2.030 1.807 2.309 0.009 22 0 "[ . 1 . 2 . 3]" 2 64 1 153 TYR O 1 157 GLU H 2.000 . 2.300 2.234 1.882 2.381 0.081 9 0 "[ . 1 . 2 . 3]" 2 65 1 154 ASP O 1 158 TYR H 2.000 . 2.300 2.167 1.877 2.333 0.033 26 0 "[ . 1 . 2 . 3]" 2 66 1 155 GLU O 1 159 CYS H 2.000 . 2.300 2.222 1.780 2.334 0.034 24 0 "[ . 1 . 2 . 3]" 2 67 1 156 PHE O 1 160 TRP H 2.000 . 2.300 2.024 1.778 2.312 0.022 1 0 "[ . 1 . 2 . 3]" 2 68 1 157 GLU O 1 161 ASP H 2.000 . 2.300 2.036 1.790 2.308 0.010 1 0 "[ . 1 . 2 . 3]" 2 69 1 158 TYR O 1 162 THR H 2.000 . 2.300 2.255 1.905 2.336 0.036 4 0 "[ . 1 . 2 . 3]" 2 70 1 159 CYS O 1 163 PHE H 2.000 . 2.300 1.914 1.732 2.333 0.068 19 0 "[ . 1 . 2 . 3]" 2 71 1 160 TRP O 1 164 VAL H 2.000 . 2.300 2.359 2.274 2.434 0.134 9 0 "[ . 1 . 2 . 3]" 2 72 1 176 GLY O 1 180 HIS H 2.000 . 2.300 2.098 1.761 2.392 0.092 28 0 "[ . 1 . 2 . 3]" 2 73 1 177 LEU O 1 181 SER H 2.000 . 2.300 2.037 1.783 2.372 0.072 15 0 "[ . 1 . 2 . 3]" 2 74 1 178 GLU O 1 182 GLN H 2.000 . 2.300 2.225 1.754 2.435 0.135 19 0 "[ . 1 . 2 . 3]" 2 75 1 179 GLU O 1 183 ALA H 2.000 . 2.300 2.292 1.744 2.571 0.271 17 0 "[ . 1 . 2 . 3]" 2 76 1 180 HIS O 1 184 LEU H 2.000 . 2.300 1.949 1.751 2.379 0.079 27 0 "[ . 1 . 2 . 3]" 2 77 1 181 SER O 1 185 SER H 2.000 . 2.300 1.888 1.747 2.317 0.053 27 0 "[ . 1 . 2 . 3]" 2 78 1 182 GLN O 1 186 GLY H 2.000 . 2.300 2.210 1.872 2.342 0.042 8 0 "[ . 1 . 2 . 3]" 2 79 1 183 ALA O 1 187 ARG H 2.000 . 2.300 2.344 2.281 2.407 0.107 26 0 "[ . 1 . 2 . 3]" 2 80 1 184 LEU O 1 188 LEU H 2.000 . 2.300 1.829 1.722 2.158 0.078 3 0 "[ . 1 . 2 . 3]" 2 81 1 185 SER O 1 189 ARG H 2.000 . 2.300 2.032 1.797 2.337 0.037 19 0 "[ . 1 . 2 . 3]" 2 82 1 186 GLY O 1 190 ALA H 2.000 . 2.300 2.320 2.211 2.375 0.075 29 0 "[ . 1 . 2 . 3]" 2 83 1 187 ARG O 1 191 ILE H 2.000 . 2.300 2.044 1.826 2.313 0.013 3 0 "[ . 1 . 2 . 3]" 2 84 1 188 LEU O 1 192 LEU H 2.000 . 2.300 2.167 1.783 2.370 0.070 26 0 "[ . 1 . 2 . 3]" 2 85 1 9 ASP O 1 13 PHE N 3.000 2.700 3.300 2.930 2.697 3.221 0.003 13 0 "[ . 1 . 2 . 3]" 2 86 1 10 PRO O 1 14 THR N 3.000 2.700 3.300 2.793 2.643 3.201 0.057 25 0 "[ . 1 . 2 . 3]" 2 87 1 11 ASP O 1 15 PHE N 3.000 2.700 3.300 3.011 2.685 3.253 0.015 15 0 "[ . 1 . 2 . 3]" 2 88 1 12 THR O 1 16 ASN N 3.000 2.700 3.300 2.813 2.671 3.227 0.029 28 0 "[ . 1 . 2 . 3]" 2 89 1 13 PHE O 1 17 PHE N 3.000 2.700 3.300 2.965 2.691 3.252 0.009 14 0 "[ . 1 . 2 . 3]" 2 90 1 14 THR O 1 18 ASN N 3.000 2.700 3.300 2.731 2.640 3.175 0.060 6 0 "[ . 1 . 2 . 3]" 2 91 1 31 LEU N 1 53 LEU O 3.000 2.700 3.300 3.229 2.971 3.328 0.028 8 0 "[ . 1 . 2 . 3]" 2 92 1 32 CYS N 1 93 PHE O 3.000 2.700 3.300 2.724 2.645 3.005 0.055 1 0 "[ . 1 . 2 . 3]" 2 93 1 33 TYR N 1 51 GLY O 3.000 2.700 3.300 3.050 2.911 3.151 . 0 0 "[ . 1 . 2 . 3]" 2 94 1 34 GLU N 1 91 THR O 3.000 2.700 3.300 3.188 3.023 3.311 0.011 24 0 "[ . 1 . 2 . 3]" 2 95 1 36 GLU N 1 89 ARG O 3.000 2.700 3.300 2.993 2.673 3.176 0.027 3 0 "[ . 1 . 2 . 3]" 2 96 1 37 ARG N 1 44 VAL O 3.000 2.700 3.300 2.968 2.627 3.157 0.073 13 0 "[ . 1 . 2 . 3]" 2 97 1 38 LEU N 1 87 ILE O 3.000 2.700 3.300 3.337 3.299 3.373 0.073 7 0 "[ . 1 . 2 . 3]" 2 98 1 39 ASP N 1 42 THR O 3.000 2.700 3.300 2.701 2.632 2.797 0.068 26 0 "[ . 1 . 2 . 3]" 2 99 1 39 ASP O 1 42 THR N 3.000 2.700 3.300 2.986 2.684 3.219 0.016 10 0 "[ . 1 . 2 . 3]" 2 100 1 37 ARG O 1 44 VAL N 3.000 2.700 3.300 3.147 2.652 3.305 0.048 29 0 "[ . 1 . 2 . 3]" 2 101 1 35 VAL O 1 46 MET N 3.000 2.700 3.300 3.152 2.789 3.382 0.082 13 0 "[ . 1 . 2 . 3]" 2 102 1 33 TYR O 1 51 GLY N 3.000 2.700 3.300 3.117 2.960 3.261 . 0 0 "[ . 1 . 2 . 3]" 2 103 1 31 LEU O 1 53 LEU N 3.000 2.700 3.300 2.870 2.664 3.135 0.036 4 0 "[ . 1 . 2 . 3]" 2 104 1 46 MET O 1 49 HIS N 3.000 2.700 3.300 3.128 2.730 3.323 0.023 24 0 "[ . 1 . 2 . 3]" 2 105 1 47 ASP O 1 50 MET N 3.000 2.700 3.300 3.235 3.009 3.460 0.160 7 0 "[ . 1 . 2 . 3]" 2 106 1 70 GLU N 1 70 GLU OE1 3.000 2.700 3.300 2.939 2.574 4.261 0.961 19 3 "[ . 1 .- +2 . * 3]" 2 107 1 68 HIS O 1 72 ARG N 3.000 2.700 3.300 3.225 2.745 3.381 0.081 16 0 "[ . 1 . 2 . 3]" 2 108 1 69 ALA O 1 73 PHE N 3.000 2.700 3.300 2.886 2.693 3.137 0.007 28 0 "[ . 1 . 2 . 3]" 2 109 1 70 GLU O 1 74 LEU N 3.000 2.700 3.300 3.329 2.988 3.418 0.118 22 0 "[ . 1 . 2 . 3]" 2 110 1 71 LEU O 1 75 ASP N 3.000 2.700 3.300 3.203 3.055 3.355 0.055 11 0 "[ . 1 . 2 . 3]" 2 111 1 72 ARG O 1 76 LEU N 3.000 2.700 3.300 2.904 2.688 3.066 0.012 29 0 "[ . 1 . 2 . 3]" 2 112 1 76 LEU O 1 79 SER N 3.000 2.700 3.300 2.725 2.587 2.871 0.113 18 0 "[ . 1 . 2 . 3]" 2 113 1 77 VAL O 1 80 LEU N 3.000 2.700 3.300 2.671 2.504 2.841 0.196 12 0 "[ . 1 . 2 . 3]" 2 114 1 78 PRO O 1 81 GLN N 3.000 2.700 3.300 3.090 2.786 3.265 . 0 0 "[ . 1 . 2 . 3]" 2 115 1 88 TYR N 1 117 HIS O 3.000 2.700 3.300 3.179 3.019 3.300 . 0 0 "[ . 1 . 2 . 3]" 2 116 1 36 GLU O 1 89 ARG N 3.000 2.700 3.300 3.025 2.900 3.217 . 0 0 "[ . 1 . 2 . 3]" 2 117 1 90 VAL N 1 119 ARG O 3.000 2.700 3.300 2.751 2.681 2.865 0.019 2 0 "[ . 1 . 2 . 3]" 2 118 1 34 GLU O 1 91 THR N 3.000 2.700 3.300 3.227 2.996 3.307 0.007 1 0 "[ . 1 . 2 . 3]" 2 119 1 92 TRP N 1 121 ARG O 3.000 2.700 3.300 2.764 2.664 2.916 0.036 21 0 "[ . 1 . 2 . 3]" 2 120 1 32 CYS O 1 93 PHE N 3.000 2.700 3.300 2.781 2.657 2.876 0.043 21 0 "[ . 1 . 2 . 3]" 2 121 1 94 ILE N 1 123 PHE O 3.000 2.700 3.300 3.001 2.754 3.203 . 0 0 "[ . 1 . 2 . 3]" 2 122 1 30 TYR O 1 95 SER N 3.000 2.700 3.300 3.374 3.319 3.441 0.141 19 0 "[ . 1 . 2 . 3]" 2 123 1 104 CYS O 1 108 VAL N 3.000 2.700 3.300 2.902 2.631 3.158 0.069 8 0 "[ . 1 . 2 . 3]" 2 124 1 105 ALA O 1 109 ARG N 3.000 2.700 3.300 2.945 2.538 3.225 0.162 30 0 "[ . 1 . 2 . 3]" 2 125 1 106 GLY O 1 110 ALA N 3.000 2.700 3.300 3.292 3.133 3.331 0.031 18 0 "[ . 1 . 2 . 3]" 2 126 1 107 GLU O 1 111 PHE N 3.000 2.700 3.300 3.122 2.725 3.326 0.026 11 0 "[ . 1 . 2 . 3]" 2 127 1 108 VAL O 1 112 LEU N 3.000 2.700 3.300 3.147 2.855 3.320 0.020 10 0 "[ . 1 . 2 . 3]" 2 128 1 109 ARG O 1 113 GLN N 3.000 2.700 3.300 3.167 3.037 3.317 0.017 7 0 "[ . 1 . 2 . 3]" 2 129 1 110 ALA O 1 114 GLU N 3.000 2.700 3.300 2.899 2.638 3.237 0.062 30 0 "[ . 1 . 2 . 3]" 2 130 1 111 PHE O 1 115 ASN N 3.000 2.700 3.300 2.915 2.746 3.100 . 0 0 "[ . 1 . 2 . 3]" 2 131 1 88 TYR O 1 119 ARG N 3.000 2.700 3.300 3.062 2.757 3.308 0.008 9 0 "[ . 1 . 2 . 3]" 2 132 1 90 VAL O 1 121 ARG N 3.000 2.700 3.300 3.070 2.902 3.323 0.023 26 0 "[ . 1 . 2 . 3]" 2 133 1 122 ILE N 1 147 GLN O 3.000 2.700 3.300 2.679 2.604 2.920 0.096 15 0 "[ . 1 . 2 . 3]" 2 134 1 92 TRP O 1 123 PHE N 3.000 2.700 3.300 2.945 2.779 3.073 . 0 0 "[ . 1 . 2 . 3]" 2 135 1 124 ALA N 1 149 SER O 3.000 2.700 3.300 3.255 3.176 3.323 0.023 7 0 "[ . 1 . 2 . 3]" 2 136 1 94 ILE O 1 125 ALA N 3.000 2.700 3.300 2.933 2.765 3.061 . 0 0 "[ . 1 . 2 . 3]" 2 137 1 133 LEU O 1 137 ALA N 3.000 2.700 3.300 3.260 2.777 3.348 0.048 14 0 "[ . 1 . 2 . 3]" 2 138 1 134 TYR O 1 138 LEU N 3.000 2.700 3.300 2.765 2.602 3.136 0.098 9 0 "[ . 1 . 2 . 3]" 2 139 1 135 LYS O 1 139 GLN N 3.000 2.700 3.300 3.190 3.000 3.290 . 0 0 "[ . 1 . 2 . 3]" 2 140 1 136 GLU O 1 140 MET N 3.000 2.700 3.300 3.266 3.089 3.344 0.044 9 0 "[ . 1 . 2 . 3]" 2 141 1 137 ALA O 1 141 LEU N 3.000 2.700 3.300 2.953 2.679 3.277 0.021 23 0 "[ . 1 . 2 . 3]" 2 142 1 138 LEU O 1 142 ARG N 3.000 2.700 3.300 3.062 2.862 3.321 0.021 12 0 "[ . 1 . 2 . 3]" 2 143 1 139 GLN O 1 143 ASP N 3.000 2.700 3.300 3.181 3.051 3.293 . 0 0 "[ . 1 . 2 . 3]" 2 144 1 120 LEU O 1 147 GLN N 3.000 2.700 3.300 3.342 3.303 3.422 0.122 26 0 "[ . 1 . 2 . 3]" 2 145 1 122 ILE O 1 149 SER N 3.000 2.700 3.300 3.113 2.855 3.282 . 0 0 "[ . 1 . 2 . 3]" 2 146 1 124 ALA O 1 151 MET N 3.000 2.700 3.300 3.199 2.967 3.370 0.070 13 0 "[ . 1 . 2 . 3]" 2 147 1 152 THR O 1 156 PHE N 3.000 2.700 3.300 2.862 2.658 3.150 0.042 28 0 "[ . 1 . 2 . 3]" 2 148 1 153 TYR O 1 157 GLU N 3.000 2.700 3.300 3.118 2.790 3.259 . 0 0 "[ . 1 . 2 . 3]" 2 149 1 154 ASP O 1 158 TYR N 3.000 2.700 3.300 3.097 2.840 3.279 . 0 0 "[ . 1 . 2 . 3]" 2 150 1 155 GLU O 1 159 CYS N 3.000 2.700 3.300 3.099 2.694 3.261 0.006 15 0 "[ . 1 . 2 . 3]" 2 151 1 156 PHE O 1 160 TRP N 3.000 2.700 3.300 2.867 2.674 3.228 0.026 21 0 "[ . 1 . 2 . 3]" 2 152 1 157 GLU O 1 161 ASP N 3.000 2.700 3.300 2.959 2.728 3.224 . 0 0 "[ . 1 . 2 . 3]" 2 153 1 158 TYR O 1 162 THR N 3.000 2.700 3.300 2.968 2.742 3.147 . 0 0 "[ . 1 . 2 . 3]" 2 154 1 159 CYS O 1 163 PHE N 3.000 2.700 3.300 2.825 2.588 3.216 0.112 19 0 "[ . 1 . 2 . 3]" 2 155 1 160 TRP O 1 164 VAL N 3.000 2.700 3.300 3.008 2.896 3.116 . 0 0 "[ . 1 . 2 . 3]" 2 156 1 176 GLY O 1 180 HIS N 3.000 2.700 3.300 3.002 2.647 3.319 0.053 15 0 "[ . 1 . 2 . 3]" 2 157 1 177 LEU O 1 181 SER N 3.000 2.700 3.300 2.847 2.611 3.222 0.089 13 0 "[ . 1 . 2 . 3]" 2 158 1 178 GLU O 1 182 GLN N 3.000 2.700 3.300 3.141 2.723 3.323 0.023 19 0 "[ . 1 . 2 . 3]" 2 159 1 179 GLU O 1 183 ALA N 3.000 2.700 3.300 3.248 2.716 3.367 0.067 17 0 "[ . 1 . 2 . 3]" 2 160 1 180 HIS O 1 184 LEU N 3.000 2.700 3.300 2.864 2.639 3.315 0.061 10 0 "[ . 1 . 2 . 3]" 2 161 1 181 SER O 1 185 SER N 3.000 2.700 3.300 2.742 2.597 3.151 0.103 27 0 "[ . 1 . 2 . 3]" 2 162 1 182 GLN O 1 186 GLY N 3.000 2.700 3.300 3.123 2.726 3.303 0.003 17 0 "[ . 1 . 2 . 3]" 2 163 1 183 ALA O 1 187 ARG N 3.000 2.700 3.300 3.289 3.201 3.342 0.042 17 0 "[ . 1 . 2 . 3]" 2 164 1 184 LEU O 1 188 LEU N 3.000 2.700 3.300 2.748 2.609 3.104 0.091 19 0 "[ . 1 . 2 . 3]" 2 165 1 185 SER O 1 189 ARG N 3.000 2.700 3.300 2.967 2.695 3.249 0.005 1 0 "[ . 1 . 2 . 3]" 2 166 1 186 GLY O 1 190 ALA N 3.000 2.700 3.300 3.146 3.009 3.261 . 0 0 "[ . 1 . 2 . 3]" 2 167 1 187 ARG O 1 191 ILE N 3.000 2.700 3.300 2.900 2.616 3.140 0.084 5 0 "[ . 1 . 2 . 3]" 2 168 1 188 LEU O 1 192 LEU N 3.000 2.700 3.300 3.060 2.695 3.305 0.005 15 0 "[ . 1 . 2 . 3]" 2 stop_ save_
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