NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
567075 | 2m8c | 19242 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2m8c 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 1076 _Distance_constraint_stats_list.Viol_count 3875 _Distance_constraint_stats_list.Viol_total 19441.156 _Distance_constraint_stats_list.Viol_max 0.473 _Distance_constraint_stats_list.Viol_rms 0.0660 _Distance_constraint_stats_list.Viol_average_all_restraints 0.0201 _Distance_constraint_stats_list.Viol_average_violations_only 0.1672 _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 5 ILE 13.081 0.322 9 0 "[ . 1 . 2 . 3]" 1 7 GLN 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 8 ASN 5.382 0.141 22 0 "[ . 1 . 2 . 3]" 1 9 ILE 3.906 0.141 22 0 "[ . 1 . 2 . 3]" 1 10 ARG 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 11 ILE 1.278 0.084 15 0 "[ . 1 . 2 . 3]" 1 12 GLY 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 13 THR 0.408 0.068 5 0 "[ . 1 . 2 . 3]" 1 14 ASP 6.098 0.250 20 0 "[ . 1 . 2 . 3]" 1 16 THR 7.985 0.161 25 0 "[ . 1 . 2 . 3]" 1 17 TYR 10.723 0.270 11 0 "[ . 1 . 2 . 3]" 1 18 ALA 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 20 PHE 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 21 GLU 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 22 SER 13.977 0.313 13 0 "[ . 1 . 2 . 3]" 1 23 LYS 1.289 0.115 8 0 "[ . 1 . 2 . 3]" 1 24 ASN 2.440 0.113 20 0 "[ . 1 . 2 . 3]" 1 26 GLN 0.297 0.019 23 0 "[ . 1 . 2 . 3]" 1 27 GLY 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 28 GLU 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 29 LEU 12.125 0.269 28 0 "[ . 1 . 2 . 3]" 1 30 VAL 10.654 0.269 28 0 "[ . 1 . 2 . 3]" 1 31 GLY 7.665 0.313 13 0 "[ . 1 . 2 . 3]" 1 32 PHE 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 33 ASP 5.816 0.217 25 0 "[ . 1 . 2 . 3]" 1 34 ILE 11.364 0.407 29 0 "[ . 1 . 2 . 3]" 1 35 ASP 21.813 0.291 29 0 "[ . 1 . 2 . 3]" 1 36 LEU 53.599 0.473 5 0 "[ . 1 . 2 . 3]" 1 37 ALA 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 38 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 39 GLU 0.399 0.034 28 0 "[ . 1 . 2 . 3]" 1 40 LEU 16.999 0.434 26 0 "[ . 1 . 2 . 3]" 1 41 CYS 3.078 0.131 21 0 "[ . 1 . 2 . 3]" 1 42 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 43 ARG 7.611 0.279 30 0 "[ . 1 . 2 . 3]" 1 44 ILE 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 45 ASN 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 46 THR 16.110 0.322 9 0 "[ . 1 . 2 . 3]" 1 47 GLN 1.476 0.071 26 0 "[ . 1 . 2 . 3]" 1 48 CYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 49 THR 2.827 0.131 11 0 "[ . 1 . 2 . 3]" 1 50 PHE 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 51 VAL 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 52 GLU 2.827 0.131 11 0 "[ . 1 . 2 . 3]" 1 53 ASN 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 55 LEU 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 56 ASP 1.491 0.055 7 0 "[ . 1 . 2 . 3]" 1 57 ALA 5.579 0.198 2 0 "[ . 1 . 2 . 3]" 1 58 LEU 5.972 0.186 7 0 "[ . 1 . 2 . 3]" 1 59 ILE 22.015 0.405 11 0 "[ . 1 . 2 . 3]" 1 61 SER 6.416 0.225 29 0 "[ . 1 . 2 . 3]" 1 62 LEU 15.380 0.271 28 0 "[ . 1 . 2 . 3]" 1 63 LYS 6.416 0.225 29 0 "[ . 1 . 2 . 3]" 1 64 ALA 10.923 0.225 15 0 "[ . 1 . 2 . 3]" 1 65 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 66 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 67 ILE 4.835 0.161 11 0 "[ . 1 . 2 . 3]" 1 68 ASP 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 69 ALA 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 70 ILE 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 71 MET 10.655 0.250 20 0 "[ . 1 . 2 . 3]" 1 72 SER 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 74 LEU 8.282 0.312 4 0 "[ . 1 . 2 . 3]" 1 75 SER 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 76 ILE 24.728 0.473 5 0 "[ . 1 . 2 . 3]" 1 77 THR 7.147 0.254 17 0 "[ . 1 . 2 . 3]" 1 78 GLU 6.960 0.239 5 0 "[ . 1 . 2 . 3]" 1 79 LYS 7.147 0.254 17 0 "[ . 1 . 2 . 3]" 1 80 ARG 6.960 0.239 5 0 "[ . 1 . 2 . 3]" 1 81 GLN 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 82 GLN 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 83 GLU 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 84 ILE 23.578 0.442 23 0 "[ . 1 . 2 . 3]" 1 85 ALA 0.222 0.039 18 0 "[ . 1 . 2 . 3]" 1 86 PHE 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 87 THR 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 88 ASP 9.458 0.288 4 0 "[ . 1 . 2 . 3]" 1 89 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 90 LEU 0.004 0.004 5 0 "[ . 1 . 2 . 3]" 1 91 TYR 6.331 0.284 5 0 "[ . 1 . 2 . 3]" 1 92 ALA 11.110 0.296 17 0 "[ . 1 . 2 . 3]" 1 93 ALA 0.857 0.053 29 0 "[ . 1 . 2 . 3]" 1 94 ASP 2.660 0.113 7 0 "[ . 1 . 2 . 3]" 1 95 SER 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 96 ARG 11.736 0.233 21 0 "[ . 1 . 2 . 3]" 1 97 LEU 4.134 0.159 12 0 "[ . 1 . 2 . 3]" 1 98 VAL 38.589 0.402 5 0 "[ . 1 . 2 . 3]" 1 99 VAL 24.853 0.322 13 0 "[ . 1 . 2 . 3]" 1 100 ALA 0.018 0.010 5 0 "[ . 1 . 2 . 3]" 1 101 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 103 SER 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 104 ASP 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 105 ILE 10.682 0.338 9 0 "[ . 1 . 2 . 3]" 1 106 GLN 0.581 0.057 8 0 "[ . 1 . 2 . 3]" 1 108 THR 2.552 0.057 8 0 "[ . 1 . 2 . 3]" 1 109 VAL 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 110 GLU 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 111 SER 0.475 0.049 28 0 "[ . 1 . 2 . 3]" 1 112 LEU 4.943 0.182 9 0 "[ . 1 . 2 . 3]" 1 113 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 114 GLY 7.569 0.271 28 0 "[ . 1 . 2 . 3]" 1 115 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 116 ARG 2.427 0.094 23 0 "[ . 1 . 2 . 3]" 1 117 VAL 16.761 0.334 30 0 "[ . 1 . 2 . 3]" 1 118 GLY 4.756 0.109 26 0 "[ . 1 . 2 . 3]" 1 119 VAL 3.721 0.120 23 0 "[ . 1 . 2 . 3]" 1 120 LEU 4.316 0.115 1 0 "[ . 1 . 2 . 3]" 1 121 GLN 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 122 GLY 6.521 0.254 30 0 "[ . 1 . 2 . 3]" 1 123 THR 0.008 0.003 11 0 "[ . 1 . 2 . 3]" 1 124 THR 3.957 0.207 13 0 "[ . 1 . 2 . 3]" 1 125 GLN 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 126 GLU 2.988 0.083 13 0 "[ . 1 . 2 . 3]" 1 127 THR 11.323 0.254 30 0 "[ . 1 . 2 . 3]" 1 128 PHE 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 129 GLY 1.276 0.047 13 0 "[ . 1 . 2 . 3]" 1 130 ASN 0.879 0.063 21 0 "[ . 1 . 2 . 3]" 1 131 GLU 1.276 0.047 13 0 "[ . 1 . 2 . 3]" 1 132 HIS 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 133 TRP 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 134 ALA 13.879 0.313 28 0 "[ . 1 . 2 . 3]" 1 136 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 137 GLY 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 138 ILE 18.027 0.313 28 0 "[ . 1 . 2 . 3]" 1 139 GLU 4.943 0.182 9 0 "[ . 1 . 2 . 3]" 1 140 ILE 1.576 0.068 12 0 "[ . 1 . 2 . 3]" 1 141 VAL 4.996 0.196 23 0 "[ . 1 . 2 . 3]" 1 142 SER 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 143 TYR 1.546 0.078 19 0 "[ . 1 . 2 . 3]" 1 144 GLN 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 145 GLY 1.546 0.078 19 0 "[ . 1 . 2 . 3]" 1 146 GLN 1.645 0.064 21 0 "[ . 1 . 2 . 3]" 1 147 ASP 8.125 0.279 21 0 "[ . 1 . 2 . 3]" 1 148 ASN 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 149 ILE 12.442 0.279 21 0 "[ . 1 . 2 . 3]" 1 150 TYR 6.978 0.244 17 0 "[ . 1 . 2 . 3]" 1 151 SER 8.119 0.202 24 0 "[ . 1 . 2 . 3]" 1 152 ASP 15.233 0.294 12 0 "[ . 1 . 2 . 3]" 1 153 LEU 13.564 0.287 15 0 "[ . 1 . 2 . 3]" 1 154 THR 8.319 0.294 12 0 "[ . 1 . 2 . 3]" 1 155 ALA 6.970 0.157 13 0 "[ . 1 . 2 . 3]" 1 156 GLY 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 157 ARG 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 158 ILE 3.922 0.144 19 0 "[ . 1 . 2 . 3]" 1 159 ASP 2.084 0.082 5 0 "[ . 1 . 2 . 3]" 1 160 ALA 29.462 0.334 30 0 "[ . 1 . 2 . 3]" 1 161 ALA 18.461 0.406 23 0 "[ . 1 . 2 . 3]" 1 162 PHE 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 163 GLN 25.594 0.406 23 0 "[ . 1 . 2 . 3]" 1 164 ASP 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 165 GLU 6.376 0.233 21 0 "[ . 1 . 2 . 3]" 1 166 VAL 1.588 0.103 12 0 "[ . 1 . 2 . 3]" 1 167 ALA 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 168 ALA 18.592 0.398 30 0 "[ . 1 . 2 . 3]" 1 169 SER 12.660 0.303 12 0 "[ . 1 . 2 . 3]" 1 170 GLU 2.392 0.099 27 0 "[ . 1 . 2 . 3]" 1 171 GLY 10.653 0.263 12 0 "[ . 1 . 2 . 3]" 1 172 PHE 19.833 0.402 5 0 "[ . 1 . 2 . 3]" 1 173 LEU 24.011 0.398 30 0 "[ . 1 . 2 . 3]" 1 174 LYS 9.229 0.172 23 0 "[ . 1 . 2 . 3]" 1 175 GLN 4.678 0.178 20 0 "[ . 1 . 2 . 3]" 1 177 VAL 8.321 0.278 23 0 "[ . 1 . 2 . 3]" 1 178 GLY 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 179 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 180 ASP 1.170 0.076 28 0 "[ . 1 . 2 . 3]" 1 181 TYR 2.333 0.106 23 0 "[ . 1 . 2 . 3]" 1 182 LYS 4.166 0.174 8 0 "[ . 1 . 2 . 3]" 1 183 PHE 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 184 GLY 17.070 0.338 9 0 "[ . 1 . 2 . 3]" 1 185 GLY 9.104 0.322 13 0 "[ . 1 . 2 . 3]" 1 187 SER 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 188 VAL 8.457 0.214 8 0 "[ . 1 . 2 . 3]" 1 189 LYS 3.080 0.113 30 0 "[ . 1 . 2 . 3]" 1 190 ASP 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 191 GLU 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 192 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 193 LEU 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 194 PHE 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 195 GLY 9.353 0.207 13 0 "[ . 1 . 2 . 3]" 1 196 VAL 12.171 0.442 27 0 "[ . 1 . 2 . 3]" 1 197 GLY 4.539 0.165 28 0 "[ . 1 . 2 . 3]" 1 198 THR 8.450 0.296 17 0 "[ . 1 . 2 . 3]" 1 199 GLY 6.331 0.284 5 0 "[ . 1 . 2 . 3]" 1 200 MET 0.004 0.004 5 0 "[ . 1 . 2 . 3]" 1 201 GLY 4.558 0.230 25 0 "[ . 1 . 2 . 3]" 1 202 LEU 12.421 0.312 4 0 "[ . 1 . 2 . 3]" 1 203 ARG 0.589 0.046 30 0 "[ . 1 . 2 . 3]" 1 204 LYS 16.660 0.442 23 0 "[ . 1 . 2 . 3]" 1 205 GLU 0.759 0.046 30 0 "[ . 1 . 2 . 3]" 1 206 ASP 21.267 0.438 28 0 "[ . 1 . 2 . 3]" 1 207 ASN 4.604 0.159 23 0 "[ . 1 . 2 . 3]" 1 208 GLU 4.582 0.187 27 0 "[ . 1 . 2 . 3]" 1 209 LEU 18.573 0.438 28 0 "[ . 1 . 2 . 3]" 1 210 ARG 8.365 0.231 30 0 "[ . 1 . 2 . 3]" 1 211 GLU 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 212 ALA 1.940 0.079 28 0 "[ . 1 . 2 . 3]" 1 213 LEU 6.425 0.231 30 0 "[ . 1 . 2 . 3]" 1 214 ASN 4.233 0.100 28 0 "[ . 1 . 2 . 3]" 1 215 LYS 2.231 0.094 28 0 "[ . 1 . 2 . 3]" 1 216 ALA 5.683 0.131 21 0 "[ . 1 . 2 . 3]" 1 217 PHE 13.085 0.288 4 0 "[ . 1 . 2 . 3]" 1 218 ALA 10.647 0.208 28 0 "[ . 1 . 2 . 3]" 1 219 GLU 3.023 0.113 29 0 "[ . 1 . 2 . 3]" 1 220 MET 13.401 0.281 25 0 "[ . 1 . 2 . 3]" 1 221 ARG 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 222 ALA 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 223 ASP 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 224 GLY 11.238 0.255 5 0 "[ . 1 . 2 . 3]" 1 225 THR 19.753 0.434 26 0 "[ . 1 . 2 . 3]" 1 226 TYR 7.133 0.269 12 0 "[ . 1 . 2 . 3]" 1 227 GLU 5.259 0.194 18 0 "[ . 1 . 2 . 3]" 1 228 LYS 8.783 0.255 5 0 "[ . 1 . 2 . 3]" 1 229 LEU 8.536 0.330 20 0 "[ . 1 . 2 . 3]" 1 230 ALA 10.406 0.269 12 0 "[ . 1 . 2 . 3]" 1 231 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 232 LYS 0.468 0.021 29 0 "[ . 1 . 2 . 3]" 1 233 TYR 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 234 PHE 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 235 ASP 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 236 PHE 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 237 ASP 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 238 VAL 14.633 0.330 20 0 "[ . 1 . 2 . 3]" 1 239 TYR 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 240 GLY 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 241 GLY 0.000 0.000 . 0 "[ . 1 . 2 . 3]" stop_ loop_ _Distance_constraint_stats.Restraint_ID _Distance_constraint_stats.Atom_1_entity_assembly_ID _Distance_constraint_stats.Atom_1_comp_index_ID _Distance_constraint_stats.Atom_1_comp_ID _Distance_constraint_stats.Atom_1_ID _Distance_constraint_stats.Atom_2_entity_assembly_ID _Distance_constraint_stats.Atom_2_comp_index_ID _Distance_constraint_stats.Atom_2_comp_ID _Distance_constraint_stats.Atom_2_ID _Distance_constraint_stats.Node_1_distance_val _Distance_constraint_stats.Node_1_distance_lower_bound_val _Distance_constraint_stats.Node_1_distance_upper_bound_val _Distance_constraint_stats.Distance_average _Distance_constraint_stats.Distance_minimum _Distance_constraint_stats.Distance_maximum _Distance_constraint_stats.Max_violation _Distance_constraint_stats.Max_violation_model_number _Distance_constraint_stats.Over_cutoff_violation_count _Distance_constraint_stats.Over_cutoff_viol_per_model _Distance_constraint_stats.Distance_constraint_stats_ID 1 1 7 GLN H 1 8 ASN H 5.000 . 5.000 2.618 2.612 2.626 . 0 0 "[ . 1 . 2 . 3]" 1 2 1 8 ASN H 1 9 ILE H 5.000 . 5.000 4.354 4.338 4.371 . 0 0 "[ . 1 . 2 . 3]" 1 3 1 8 ASN H 1 47 GLN H 5.000 . 5.000 5.049 5.033 5.071 0.071 26 0 "[ . 1 . 2 . 3]" 1 4 1 9 ILE H 1 47 GLN H 5.000 . 5.000 3.584 3.544 3.645 . 0 0 "[ . 1 . 2 . 3]" 1 5 1 11 ILE H 1 49 THR H 5.000 . 5.000 3.107 3.038 3.225 . 0 0 "[ . 1 . 2 . 3]" 1 6 1 11 ILE H 1 50 PHE H 5.000 . 5.000 4.737 4.722 4.752 . 0 0 "[ . 1 . 2 . 3]" 1 7 1 11 ILE H 1 12 GLY H 5.000 . 5.000 4.472 4.463 4.482 . 0 0 "[ . 1 . 2 . 3]" 1 8 1 12 GLY H 1 69 ALA H 5.000 . 5.000 4.104 4.012 4.225 . 0 0 "[ . 1 . 2 . 3]" 1 9 1 12 GLY H 1 71 MET H 5.000 . 5.000 3.237 3.146 3.317 . 0 0 "[ . 1 . 2 . 3]" 1 10 1 13 THR H 1 51 VAL H 5.000 . 5.000 2.579 2.519 2.610 . 0 0 "[ . 1 . 2 . 3]" 1 11 1 14 ASP H 1 71 MET H 5.000 . 5.500 5.703 5.677 5.750 0.250 20 0 "[ . 1 . 2 . 3]" 1 12 1 16 THR H 1 17 TYR H 5.000 . 5.000 1.653 1.639 1.680 0.161 25 0 "[ . 1 . 2 . 3]" 1 13 1 17 TYR H 1 20 PHE H 5.000 . 5.000 4.416 4.382 4.506 . 0 0 "[ . 1 . 2 . 3]" 1 14 1 17 TYR H 1 21 GLU H 5.000 . 5.000 3.662 3.637 3.694 . 0 0 "[ . 1 . 2 . 3]" 1 15 1 17 TYR H 1 22 SER H 5.000 . 5.500 5.710 5.658 5.770 0.270 11 0 "[ . 1 . 2 . 3]" 1 16 1 18 ALA H 1 20 PHE H 5.000 . 5.000 4.418 4.396 4.451 . 0 0 "[ . 1 . 2 . 3]" 1 17 1 20 PHE H 1 21 GLU H 5.000 . 5.000 2.438 2.423 2.450 . 0 0 "[ . 1 . 2 . 3]" 1 18 1 18 ALA H 1 21 GLU H 5.000 . 5.000 4.495 4.487 4.506 . 0 0 "[ . 1 . 2 . 3]" 1 19 1 21 GLU H 1 22 SER H 5.000 . 5.000 4.232 4.206 4.279 . 0 0 "[ . 1 . 2 . 3]" 1 20 1 22 SER H 1 23 LYS H 5.000 . 5.000 4.360 4.352 4.374 . 0 0 "[ . 1 . 2 . 3]" 1 21 1 22 SER H 1 30 VAL H 5.000 . 5.000 4.454 4.306 4.603 . 0 0 "[ . 1 . 2 . 3]" 1 22 1 23 LYS H 1 24 ASN H 5.000 . 5.000 4.381 4.362 4.394 . 0 0 "[ . 1 . 2 . 3]" 1 23 1 24 ASN H 1 26 GLN H 5.000 . 5.000 4.999 4.955 5.019 0.019 23 0 "[ . 1 . 2 . 3]" 1 24 1 24 ASN H 1 27 GLY H 5.000 . 5.000 4.402 4.332 4.460 . 0 0 "[ . 1 . 2 . 3]" 1 25 1 24 ASN H 1 28 GLU H 5.000 . 5.000 4.308 4.236 4.359 . 0 0 "[ . 1 . 2 . 3]" 1 26 1 24 ASN H 1 29 LEU H 5.000 . 5.000 4.941 4.746 5.013 0.013 7 0 "[ . 1 . 2 . 3]" 1 27 1 26 GLN H 1 27 GLY H 5.000 . 5.000 2.488 2.477 2.496 . 0 0 "[ . 1 . 2 . 3]" 1 28 1 26 GLN H 1 28 GLU H 5.000 . 5.000 3.494 3.477 3.514 . 0 0 "[ . 1 . 2 . 3]" 1 29 1 27 GLY H 1 28 GLU H 5.000 . 5.000 2.382 2.365 2.408 . 0 0 "[ . 1 . 2 . 3]" 1 30 1 28 GLU H 1 29 LEU H 5.000 . 5.000 4.614 4.606 4.620 . 0 0 "[ . 1 . 2 . 3]" 1 31 1 29 LEU H 1 30 VAL H 5.000 . 5.000 4.435 4.421 4.446 . 0 0 "[ . 1 . 2 . 3]" 1 32 1 23 LYS H 1 30 VAL H 5.000 . 5.000 5.014 4.944 5.049 0.049 4 0 "[ . 1 . 2 . 3]" 1 33 1 24 ASN H 1 30 VAL H 5.000 . 5.000 3.845 3.764 3.976 . 0 0 "[ . 1 . 2 . 3]" 1 34 1 30 VAL H 1 31 GLY H 5.000 . 5.000 4.428 4.425 4.433 . 0 0 "[ . 1 . 2 . 3]" 1 35 1 22 SER H 1 31 GLY H 5.000 . 5.500 5.756 5.704 5.813 0.313 13 0 "[ . 1 . 2 . 3]" 1 36 1 31 GLY H 1 32 PHE H 5.000 . 5.000 4.202 4.197 4.213 . 0 0 "[ . 1 . 2 . 3]" 1 37 1 32 PHE H 1 33 ASP H 3.000 . 4.000 2.727 2.696 2.737 . 0 0 "[ . 1 . 2 . 3]" 1 38 1 33 ASP H 1 34 ILE H 3.000 . 4.000 2.509 2.497 2.518 . 0 0 "[ . 1 . 2 . 3]" 1 39 1 34 ILE H 1 35 ASP H 3.000 . 4.000 2.548 2.538 2.560 . 0 0 "[ . 1 . 2 . 3]" 1 40 1 33 ASP H 1 35 ASP H 3.000 . 4.000 4.194 4.124 4.217 0.217 25 0 "[ . 1 . 2 . 3]" 1 41 1 35 ASP H 1 38 LYS H 5.000 . 5.000 4.880 4.830 4.923 . 0 0 "[ . 1 . 2 . 3]" 1 42 1 36 LEU H 1 37 ALA H 3.000 . 4.000 2.637 2.619 2.660 . 0 0 "[ . 1 . 2 . 3]" 1 43 1 37 ALA H 1 38 LYS H 3.000 . 4.000 2.783 2.732 2.831 . 0 0 "[ . 1 . 2 . 3]" 1 44 1 38 LYS H 1 39 GLU H 3.000 . 4.000 2.907 2.856 2.946 . 0 0 "[ . 1 . 2 . 3]" 1 45 1 36 LEU H 1 39 GLU H 5.000 . 5.000 5.013 5.004 5.034 0.034 28 0 "[ . 1 . 2 . 3]" 1 46 1 39 GLU H 1 40 LEU H 3.000 . 4.000 2.788 2.754 2.816 . 0 0 "[ . 1 . 2 . 3]" 1 47 1 41 CYS H 1 42 LYS H 3.000 . 4.000 2.824 2.809 2.837 . 0 0 "[ . 1 . 2 . 3]" 1 48 1 42 LYS H 1 45 ASN H 5.000 . 5.000 4.507 4.483 4.525 . 0 0 "[ . 1 . 2 . 3]" 1 49 1 42 LYS H 1 43 ARG H 3.000 . 4.000 2.679 2.664 2.697 . 0 0 "[ . 1 . 2 . 3]" 1 50 1 43 ARG H 1 44 ILE H 5.000 . 5.000 2.725 2.717 2.731 . 0 0 "[ . 1 . 2 . 3]" 1 51 1 43 ARG H 1 45 ASN H 5.000 . 5.000 3.796 3.784 3.808 . 0 0 "[ . 1 . 2 . 3]" 1 52 1 43 ARG H 1 46 THR H 5.000 . 5.500 5.754 5.718 5.779 0.279 30 0 "[ . 1 . 2 . 3]" 1 53 1 41 CYS H 1 44 ILE H 5.000 . 5.000 4.635 4.627 4.641 . 0 0 "[ . 1 . 2 . 3]" 1 54 1 45 ASN H 1 46 THR H 5.000 . 5.000 2.781 2.763 2.795 . 0 0 "[ . 1 . 2 . 3]" 1 55 1 44 ILE H 1 46 THR H 5.000 . 5.000 4.357 4.343 4.371 . 0 0 "[ . 1 . 2 . 3]" 1 56 1 48 CYS H 1 49 THR H 5.000 . 5.000 4.402 4.394 4.407 . 0 0 "[ . 1 . 2 . 3]" 1 57 1 49 THR H 1 50 PHE H 5.000 . 5.000 4.303 4.292 4.310 . 0 0 "[ . 1 . 2 . 3]" 1 58 1 50 PHE H 1 51 VAL H 5.000 . 5.000 4.532 4.526 4.536 . 0 0 "[ . 1 . 2 . 3]" 1 59 1 51 VAL H 1 52 GLU H 5.000 . 5.000 4.299 4.293 4.306 . 0 0 "[ . 1 . 2 . 3]" 1 60 1 52 GLU H 1 53 ASN H 5.000 . 5.000 4.601 4.592 4.610 . 0 0 "[ . 1 . 2 . 3]" 1 61 1 13 THR H 1 53 ASN H 5.000 . 5.000 4.758 4.664 4.927 . 0 0 "[ . 1 . 2 . 3]" 1 62 1 55 LEU H 1 56 ASP H 3.000 . 4.000 3.120 3.103 3.131 . 0 0 "[ . 1 . 2 . 3]" 1 63 1 56 ASP H 1 57 ALA H 3.000 . 4.000 2.810 2.799 2.821 . 0 0 "[ . 1 . 2 . 3]" 1 64 1 56 ASP H 1 58 LEU H 3.000 . 4.000 4.050 4.040 4.055 0.055 7 0 "[ . 1 . 2 . 3]" 1 65 1 57 ALA H 1 58 LEU H 3.000 . 4.000 2.187 2.180 2.196 . 0 0 "[ . 1 . 2 . 3]" 1 66 1 57 ALA H 1 59 ILE H 3.000 . 4.000 4.186 4.171 4.198 0.198 2 0 "[ . 1 . 2 . 3]" 1 67 1 58 LEU H 1 59 ILE H 3.000 . 4.000 2.656 2.643 2.666 . 0 0 "[ . 1 . 2 . 3]" 1 68 1 61 SER H 1 62 LEU H 3.000 . 4.000 2.764 2.754 2.769 . 0 0 "[ . 1 . 2 . 3]" 1 69 1 62 LEU H 1 63 LYS H 3.000 . 4.000 2.757 2.738 2.774 . 0 0 "[ . 1 . 2 . 3]" 1 70 1 61 SER H 1 63 LYS H 3.000 . 4.000 4.214 4.196 4.225 0.225 29 0 "[ . 1 . 2 . 3]" 1 71 1 63 LYS H 1 64 ALA H 5.000 . 5.000 2.624 2.614 2.632 . 0 0 "[ . 1 . 2 . 3]" 1 72 1 63 LYS H 1 65 LYS H 5.000 . 5.000 3.967 3.942 3.985 . 0 0 "[ . 1 . 2 . 3]" 1 73 1 61 SER H 1 64 ALA H 5.000 . 5.000 4.623 4.607 4.634 . 0 0 "[ . 1 . 2 . 3]" 1 74 1 64 ALA H 1 67 ILE H 5.000 . 5.000 5.148 5.132 5.161 0.161 11 0 "[ . 1 . 2 . 3]" 1 75 1 65 LYS H 1 66 LYS H 5.000 . 5.000 2.716 2.705 2.723 . 0 0 "[ . 1 . 2 . 3]" 1 76 1 66 LYS H 1 67 ILE H 5.000 . 5.000 2.598 2.589 2.606 . 0 0 "[ . 1 . 2 . 3]" 1 77 1 65 LYS H 1 67 ILE H 5.000 . 5.000 4.157 4.151 4.164 . 0 0 "[ . 1 . 2 . 3]" 1 78 1 67 ILE H 1 68 ASP H 5.000 . 5.000 4.487 4.482 4.494 . 0 0 "[ . 1 . 2 . 3]" 1 79 1 68 ASP H 1 69 ALA H 5.000 . 5.000 2.213 2.192 2.239 . 0 0 "[ . 1 . 2 . 3]" 1 80 1 69 ALA H 1 70 ILE H 5.000 . 5.000 4.343 4.339 4.347 . 0 0 "[ . 1 . 2 . 3]" 1 81 1 71 MET H 1 72 SER H 5.000 . 5.000 4.034 4.013 4.053 . 0 0 "[ . 1 . 2 . 3]" 1 82 1 74 LEU H 1 75 SER H 5.000 . 5.000 4.498 4.484 4.503 . 0 0 "[ . 1 . 2 . 3]" 1 83 1 75 SER H 1 76 ILE H 5.000 . 5.000 4.618 4.612 4.625 . 0 0 "[ . 1 . 2 . 3]" 1 84 1 76 ILE H 1 77 THR H 5.000 . 5.000 4.540 4.538 4.542 . 0 0 "[ . 1 . 2 . 3]" 1 85 1 76 ILE H 1 196 VAL H 5.000 . 5.000 5.406 5.360 5.442 0.442 27 0 "[ . 1 . 2 . 3]" 1 86 1 76 ILE H 1 197 GLY H 5.000 . 5.000 3.915 3.876 3.937 . 0 0 "[ . 1 . 2 . 3]" 1 87 1 77 THR H 1 78 GLU H 5.000 . 5.000 4.355 4.353 4.356 . 0 0 "[ . 1 . 2 . 3]" 1 88 1 77 THR H 1 79 LYS H 5.000 . 5.000 5.238 5.220 5.254 0.254 17 0 "[ . 1 . 2 . 3]" 1 89 1 77 THR H 1 80 ARG H 5.000 . 5.000 3.643 3.624 3.662 . 0 0 "[ . 1 . 2 . 3]" 1 90 1 77 THR H 1 81 GLN H 5.000 . 5.000 3.834 3.823 3.854 . 0 0 "[ . 1 . 2 . 3]" 1 91 1 78 GLU H 1 79 LYS H 3.000 . 4.000 2.911 2.904 2.916 . 0 0 "[ . 1 . 2 . 3]" 1 92 1 78 GLU H 1 80 ARG H 3.000 . 4.000 4.232 4.227 4.239 0.239 5 0 "[ . 1 . 2 . 3]" 1 93 1 79 LYS H 1 80 ARG H 3.000 . 4.000 2.760 2.751 2.764 . 0 0 "[ . 1 . 2 . 3]" 1 94 1 80 ARG H 1 81 GLN H 3.000 . 4.000 2.551 2.542 2.558 . 0 0 "[ . 1 . 2 . 3]" 1 95 1 81 GLN H 1 82 GLN H 3.000 . 4.000 2.698 2.683 2.715 . 0 0 "[ . 1 . 2 . 3]" 1 96 1 81 GLN H 1 83 GLU H 5.000 . 5.000 4.054 4.043 4.064 . 0 0 "[ . 1 . 2 . 3]" 1 97 1 81 GLN H 1 84 ILE H 5.000 . 5.000 4.838 4.811 4.865 . 0 0 "[ . 1 . 2 . 3]" 1 98 1 82 GLN H 1 83 GLU H 5.000 . 5.000 2.649 2.643 2.654 . 0 0 "[ . 1 . 2 . 3]" 1 99 1 82 GLN H 1 84 ILE H 5.000 . 5.000 4.447 4.432 4.464 . 0 0 "[ . 1 . 2 . 3]" 1 100 1 83 GLU H 1 84 ILE H 5.000 . 5.000 2.504 2.489 2.519 . 0 0 "[ . 1 . 2 . 3]" 1 101 1 85 ALA H 1 86 PHE H 5.000 . 5.000 4.527 4.523 4.530 . 0 0 "[ . 1 . 2 . 3]" 1 102 1 86 PHE H 1 87 THR H 5.000 . 5.000 4.443 4.441 4.445 . 0 0 "[ . 1 . 2 . 3]" 1 103 1 88 ASP H 1 214 ASN H 5.000 . 5.000 5.047 4.955 5.096 0.096 2 0 "[ . 1 . 2 . 3]" 1 104 1 88 ASP H 1 217 PHE H 5.000 . 5.500 5.761 5.712 5.788 0.288 4 0 "[ . 1 . 2 . 3]" 1 105 1 87 THR H 1 89 LYS H 5.000 . 5.000 4.322 4.290 4.355 . 0 0 "[ . 1 . 2 . 3]" 1 106 1 88 ASP H 1 89 LYS H 5.000 . 5.000 2.861 2.847 2.877 . 0 0 "[ . 1 . 2 . 3]" 1 107 1 90 LEU H 1 91 TYR H 5.000 . 5.000 2.839 2.830 2.854 . 0 0 "[ . 1 . 2 . 3]" 1 108 1 90 LEU H 1 200 MET H 5.000 . 5.000 4.907 4.858 5.004 0.004 5 0 "[ . 1 . 2 . 3]" 1 109 1 91 TYR H 1 92 ALA H 5.000 . 5.000 4.406 4.402 4.413 . 0 0 "[ . 1 . 2 . 3]" 1 110 1 91 TYR H 1 198 THR H 5.000 . 5.000 2.971 2.928 3.051 . 0 0 "[ . 1 . 2 . 3]" 1 111 1 91 TYR H 1 199 GLY H 5.000 . 5.500 5.711 5.663 5.784 0.284 5 0 "[ . 1 . 2 . 3]" 1 112 1 92 ALA H 1 93 ALA H 5.000 . 5.000 4.481 4.460 4.518 . 0 0 "[ . 1 . 2 . 3]" 1 113 1 92 ALA H 1 94 ASP H 5.000 . 5.500 5.589 5.572 5.613 0.113 7 0 "[ . 1 . 2 . 3]" 1 114 1 93 ALA H 1 94 ASP H 5.000 . 5.000 3.571 3.512 3.617 . 0 0 "[ . 1 . 2 . 3]" 1 115 1 93 ALA H 1 197 GLY H 5.000 . 5.000 4.167 4.104 4.296 . 0 0 "[ . 1 . 2 . 3]" 1 116 1 93 ALA H 1 198 THR H 5.000 . 5.000 3.988 3.923 4.108 . 0 0 "[ . 1 . 2 . 3]" 1 117 1 94 ASP H 1 95 SER H 5.000 . 5.000 3.432 3.410 3.461 . 0 0 "[ . 1 . 2 . 3]" 1 118 1 95 SER H 1 96 ARG H 5.000 . 5.000 4.375 4.369 4.380 . 0 0 "[ . 1 . 2 . 3]" 1 119 1 96 ARG H 1 163 GLN H 5.000 . 5.000 2.461 2.427 2.500 . 0 0 "[ . 1 . 2 . 3]" 1 120 1 96 ARG H 1 165 GLU H 5.000 . 5.000 5.213 5.173 5.233 0.233 21 0 "[ . 1 . 2 . 3]" 1 121 1 96 ARG H 1 188 VAL H 5.000 . 5.000 4.952 4.905 5.009 0.009 8 0 "[ . 1 . 2 . 3]" 1 122 1 97 LEU H 1 98 VAL H 5.000 . 5.000 4.505 4.499 4.509 . 0 0 "[ . 1 . 2 . 3]" 1 123 1 97 LEU H 1 163 GLN H 5.000 . 5.000 5.137 5.113 5.159 0.159 12 0 "[ . 1 . 2 . 3]" 1 124 1 98 VAL H 1 99 VAL H 5.000 . 5.000 4.147 4.136 4.160 . 0 0 "[ . 1 . 2 . 3]" 1 125 1 98 VAL H 1 161 ALA H 5.000 . 5.000 2.333 2.305 2.369 . 0 0 "[ . 1 . 2 . 3]" 1 126 1 98 VAL H 1 163 GLN H 5.000 . 5.000 5.109 5.082 5.129 0.129 21 0 "[ . 1 . 2 . 3]" 1 127 1 99 VAL H 1 100 ALA H 5.000 . 5.000 4.445 4.441 4.446 . 0 0 "[ . 1 . 2 . 3]" 1 128 1 99 VAL H 1 161 ALA H 5.000 . 5.500 5.721 5.709 5.734 0.234 8 0 "[ . 1 . 2 . 3]" 1 129 1 99 VAL H 1 182 LYS H 5.000 . 5.000 5.139 5.102 5.174 0.174 8 0 "[ . 1 . 2 . 3]" 1 130 1 100 ALA H 1 101 LYS H 5.000 . 5.000 4.586 4.582 4.591 . 0 0 "[ . 1 . 2 . 3]" 1 131 1 100 ALA H 1 103 SER H 5.000 . 5.000 3.956 3.916 3.984 . 0 0 "[ . 1 . 2 . 3]" 1 132 1 103 SER H 1 104 ASP H 5.000 . 5.000 4.400 4.397 4.404 . 0 0 "[ . 1 . 2 . 3]" 1 133 1 105 ILE H 1 106 GLN H 5.000 . 5.000 4.326 4.316 4.336 . 0 0 "[ . 1 . 2 . 3]" 1 134 1 106 GLN H 1 108 THR H 5.000 . 5.000 4.982 4.899 5.057 0.057 8 0 "[ . 1 . 2 . 3]" 1 135 1 108 THR H 1 112 LEU H 5.000 . 5.000 4.890 4.850 4.919 . 0 0 "[ . 1 . 2 . 3]" 1 136 1 108 THR H 1 109 VAL H 5.000 . 5.000 4.202 4.184 4.219 . 0 0 "[ . 1 . 2 . 3]" 1 137 1 109 VAL H 1 110 GLU H 3.000 . 4.000 2.530 2.508 2.550 . 0 0 "[ . 1 . 2 . 3]" 1 138 1 109 VAL H 1 112 LEU H 5.000 . 5.000 4.895 4.868 4.926 . 0 0 "[ . 1 . 2 . 3]" 1 139 1 110 GLU H 1 111 SER H 3.000 . 4.000 2.994 2.985 3.004 . 0 0 "[ . 1 . 2 . 3]" 1 140 1 108 THR H 1 111 SER H 5.000 . 5.000 5.014 4.979 5.049 0.049 28 0 "[ . 1 . 2 . 3]" 1 141 1 110 GLU H 1 112 LEU H 3.000 . 4.000 3.800 3.794 3.805 . 0 0 "[ . 1 . 2 . 3]" 1 142 1 111 SER H 1 112 LEU H 3.000 . 4.000 2.706 2.694 2.715 . 0 0 "[ . 1 . 2 . 3]" 1 143 1 112 LEU H 1 113 LYS H 5.000 . 5.000 2.422 2.414 2.431 . 0 0 "[ . 1 . 2 . 3]" 1 144 1 113 LYS H 1 114 GLY H 5.000 . 5.000 4.583 4.578 4.587 . 0 0 "[ . 1 . 2 . 3]" 1 145 1 113 LYS H 1 115 LYS H 5.000 . 5.000 4.316 4.303 4.331 . 0 0 "[ . 1 . 2 . 3]" 1 146 1 114 GLY H 1 138 ILE H 5.000 . 5.000 5.252 5.236 5.271 0.271 28 0 "[ . 1 . 2 . 3]" 1 147 1 114 GLY H 1 139 GLU H 5.000 . 5.000 4.068 3.983 4.121 . 0 0 "[ . 1 . 2 . 3]" 1 148 1 115 LYS H 1 116 ARG H 5.000 . 5.000 4.600 4.598 4.602 . 0 0 "[ . 1 . 2 . 3]" 1 149 1 116 ARG H 1 117 VAL H 5.000 . 5.000 4.515 4.507 4.521 . 0 0 "[ . 1 . 2 . 3]" 1 150 1 116 ARG H 1 159 ASP H 5.000 . 5.000 3.336 3.317 3.354 . 0 0 "[ . 1 . 2 . 3]" 1 151 1 116 ARG H 1 160 ALA H 5.000 . 5.000 5.081 5.070 5.094 0.094 23 0 "[ . 1 . 2 . 3]" 1 152 1 117 VAL H 1 118 GLY H 5.000 . 5.000 4.383 4.380 4.387 . 0 0 "[ . 1 . 2 . 3]" 1 153 1 117 VAL H 1 139 GLU H 5.000 . 5.000 4.492 4.442 4.571 . 0 0 "[ . 1 . 2 . 3]" 1 154 1 117 VAL H 1 141 VAL H 5.000 . 5.000 4.040 3.944 4.137 . 0 0 "[ . 1 . 2 . 3]" 1 155 1 118 GLY H 1 119 VAL H 5.000 . 5.000 4.506 4.499 4.511 . 0 0 "[ . 1 . 2 . 3]" 1 156 1 118 GLY H 1 162 PHE H 5.000 . 5.000 4.552 4.524 4.586 . 0 0 "[ . 1 . 2 . 3]" 1 157 1 119 VAL H 1 143 TYR H 5.000 . 5.000 3.634 3.568 3.680 . 0 0 "[ . 1 . 2 . 3]" 1 158 1 119 VAL H 1 120 LEU H 5.000 . 5.000 4.458 4.452 4.461 . 0 0 "[ . 1 . 2 . 3]" 1 159 1 120 LEU H 1 121 GLN H 5.000 . 5.000 4.399 4.390 4.423 . 0 0 "[ . 1 . 2 . 3]" 1 160 1 121 GLN H 1 143 TYR H 5.000 . 5.000 2.610 2.561 2.711 . 0 0 "[ . 1 . 2 . 3]" 1 161 1 121 GLN H 1 145 GLY H 5.000 . 5.000 4.920 4.904 4.938 . 0 0 "[ . 1 . 2 . 3]" 1 162 1 122 GLY H 1 123 THR H 5.000 . 5.000 2.729 2.723 2.735 . 0 0 "[ . 1 . 2 . 3]" 1 163 1 122 GLY H 1 127 THR H 5.000 . 5.500 5.717 5.687 5.754 0.254 30 0 "[ . 1 . 2 . 3]" 1 164 1 123 THR H 1 125 GLN H 5.000 . 5.000 4.898 4.860 4.985 . 0 0 "[ . 1 . 2 . 3]" 1 165 1 123 THR H 1 126 GLU H 5.000 . 5.000 4.098 4.065 4.139 . 0 0 "[ . 1 . 2 . 3]" 1 166 1 123 THR H 1 124 THR H 5.000 . 5.000 4.402 4.401 4.405 . 0 0 "[ . 1 . 2 . 3]" 1 167 1 124 THR H 1 125 GLN H 3.000 . 4.000 2.466 2.449 2.507 . 0 0 "[ . 1 . 2 . 3]" 1 168 1 125 GLN H 1 126 GLU H 3.000 . 4.000 2.869 2.857 2.892 . 0 0 "[ . 1 . 2 . 3]" 1 169 1 120 LEU H 1 126 GLU H 5.000 . 5.000 5.035 5.023 5.061 0.061 28 0 "[ . 1 . 2 . 3]" 1 170 1 126 GLU H 1 127 THR H 3.000 . 4.000 2.896 2.880 2.919 . 0 0 "[ . 1 . 2 . 3]" 1 171 1 123 THR H 1 127 THR H 5.000 . 5.000 4.073 4.025 4.104 . 0 0 "[ . 1 . 2 . 3]" 1 172 1 127 THR H 1 128 PHE H 3.000 . 4.000 2.820 2.815 2.824 . 0 0 "[ . 1 . 2 . 3]" 1 173 1 130 ASN H 1 131 GLU H 3.000 . 4.000 2.827 2.823 2.831 . 0 0 "[ . 1 . 2 . 3]" 1 174 1 129 GLY H 1 131 GLU H 3.000 . 4.000 4.043 4.039 4.047 0.047 13 0 "[ . 1 . 2 . 3]" 1 175 1 132 HIS H 1 134 ALA H 5.000 . 5.000 3.611 3.597 3.628 . 0 0 "[ . 1 . 2 . 3]" 1 176 1 131 GLU H 1 133 TRP H 3.000 . 4.000 3.558 3.550 3.566 . 0 0 "[ . 1 . 2 . 3]" 1 177 1 132 HIS H 1 133 TRP H 3.000 . 4.000 2.622 2.613 2.632 . 0 0 "[ . 1 . 2 . 3]" 1 178 1 133 TRP H 1 134 ALA H 5.000 . 5.000 2.475 2.463 2.486 . 0 0 "[ . 1 . 2 . 3]" 1 179 1 131 GLU H 1 134 ALA H 5.000 . 5.000 4.050 4.031 4.069 . 0 0 "[ . 1 . 2 . 3]" 1 180 1 134 ALA H 1 138 ILE H 5.000 . 5.000 5.296 5.281 5.313 0.313 28 0 "[ . 1 . 2 . 3]" 1 181 1 136 LYS H 1 137 GLY H 5.000 . 5.000 2.410 2.405 2.415 . 0 0 "[ . 1 . 2 . 3]" 1 182 1 136 LYS H 1 138 ILE H 5.000 . 5.000 3.686 3.678 3.696 . 0 0 "[ . 1 . 2 . 3]" 1 183 1 137 GLY H 1 138 ILE H 5.000 . 5.000 2.419 2.413 2.422 . 0 0 "[ . 1 . 2 . 3]" 1 184 1 115 LYS H 1 139 GLU H 5.000 . 5.000 4.545 4.487 4.582 . 0 0 "[ . 1 . 2 . 3]" 1 185 1 138 ILE H 1 139 GLU H 5.000 . 5.000 4.488 4.484 4.490 . 0 0 "[ . 1 . 2 . 3]" 1 186 1 117 VAL H 1 140 ILE H 5.000 . 5.000 4.817 4.761 4.856 . 0 0 "[ . 1 . 2 . 3]" 1 187 1 139 GLU H 1 140 ILE H 5.000 . 5.000 4.516 4.511 4.521 . 0 0 "[ . 1 . 2 . 3]" 1 188 1 141 VAL H 1 142 SER H 5.000 . 5.000 4.378 4.358 4.387 . 0 0 "[ . 1 . 2 . 3]" 1 189 1 142 SER H 1 143 TYR H 5.000 . 5.000 4.468 4.459 4.482 . 0 0 "[ . 1 . 2 . 3]" 1 190 1 144 GLN H 1 145 GLY H 5.000 . 5.000 2.266 2.253 2.282 . 0 0 "[ . 1 . 2 . 3]" 1 191 1 143 TYR H 1 145 GLY H 5.000 . 5.000 5.052 5.020 5.078 0.078 19 0 "[ . 1 . 2 . 3]" 1 192 1 145 GLY H 1 146 GLN H 5.000 . 5.000 4.316 4.308 4.330 . 0 0 "[ . 1 . 2 . 3]" 1 193 1 146 GLN H 1 147 ASP H 3.000 . 4.000 2.665 2.659 2.669 . 0 0 "[ . 1 . 2 . 3]" 1 194 1 147 ASP H 1 148 ASN H 3.000 . 4.000 2.510 2.502 2.520 . 0 0 "[ . 1 . 2 . 3]" 1 195 1 148 ASN H 1 149 ILE H 3.000 . 4.000 2.609 2.606 2.613 . 0 0 "[ . 1 . 2 . 3]" 1 196 1 145 GLY H 1 149 ILE H 5.000 . 5.000 4.867 4.827 4.891 . 0 0 "[ . 1 . 2 . 3]" 1 197 1 146 GLN H 1 149 ILE H 5.000 . 5.000 5.055 5.044 5.064 0.064 21 0 "[ . 1 . 2 . 3]" 1 198 1 147 ASP H 1 149 ILE H 3.000 . 4.000 4.271 4.261 4.279 0.279 21 0 "[ . 1 . 2 . 3]" 1 199 1 149 ILE H 1 150 TYR H 3.000 . 4.000 2.682 2.676 2.688 . 0 0 "[ . 1 . 2 . 3]" 1 200 1 149 ILE H 1 151 SER H 3.000 . 4.000 3.970 3.955 3.982 . 0 0 "[ . 1 . 2 . 3]" 1 201 1 150 TYR H 1 151 SER H 3.000 . 4.000 2.626 2.613 2.638 . 0 0 "[ . 1 . 2 . 3]" 1 202 1 151 SER H 1 152 ASP H 3.000 . 4.000 2.698 2.693 2.703 . 0 0 "[ . 1 . 2 . 3]" 1 203 1 150 TYR H 1 152 ASP H 3.000 . 4.000 4.233 4.220 4.244 0.244 17 0 "[ . 1 . 2 . 3]" 1 204 1 152 ASP H 1 153 LEU H 3.000 . 4.000 2.672 2.635 2.699 . 0 0 "[ . 1 . 2 . 3]" 1 205 1 152 ASP H 1 154 THR H 3.000 . 4.000 4.275 4.264 4.294 0.294 12 0 "[ . 1 . 2 . 3]" 1 206 1 150 TYR H 1 153 LEU H 5.000 . 5.000 4.813 4.775 4.841 . 0 0 "[ . 1 . 2 . 3]" 1 207 1 151 SER H 1 153 LEU H 3.000 . 4.000 4.169 4.120 4.202 0.202 24 0 "[ . 1 . 2 . 3]" 1 208 1 154 THR H 1 155 ALA H 5.000 . 5.000 2.615 2.605 2.630 . 0 0 "[ . 1 . 2 . 3]" 1 209 1 153 LEU H 1 155 ALA H 5.000 . 5.000 3.836 3.829 3.843 . 0 0 "[ . 1 . 2 . 3]" 1 210 1 155 ALA H 1 156 GLY H 5.000 . 5.000 2.241 2.235 2.250 . 0 0 "[ . 1 . 2 . 3]" 1 211 1 155 ALA H 1 157 ARG H 5.000 . 5.000 3.562 3.551 3.574 . 0 0 "[ . 1 . 2 . 3]" 1 212 1 155 ALA H 1 158 ILE H 5.000 . 5.000 5.131 5.116 5.144 0.144 19 0 "[ . 1 . 2 . 3]" 1 213 1 154 THR H 1 156 GLY H 5.000 . 5.000 3.980 3.971 3.993 . 0 0 "[ . 1 . 2 . 3]" 1 214 1 156 GLY H 1 157 ARG H 5.000 . 5.000 2.348 2.337 2.361 . 0 0 "[ . 1 . 2 . 3]" 1 215 1 156 GLY H 1 158 ILE H 5.000 . 5.000 3.631 3.614 3.650 . 0 0 "[ . 1 . 2 . 3]" 1 216 1 153 LEU H 1 158 ILE H 5.000 . 5.000 4.861 4.806 4.921 . 0 0 "[ . 1 . 2 . 3]" 1 217 1 157 ARG H 1 158 ILE H 5.000 . 5.000 2.519 2.513 2.525 . 0 0 "[ . 1 . 2 . 3]" 1 218 1 118 GLY H 1 159 ASP H 5.000 . 5.000 5.069 5.054 5.082 0.082 5 0 "[ . 1 . 2 . 3]" 1 219 1 158 ILE H 1 159 ASP H 5.000 . 5.000 4.388 4.385 4.391 . 0 0 "[ . 1 . 2 . 3]" 1 220 1 159 ASP H 1 160 ALA H 5.000 . 5.000 2.471 2.466 2.477 . 0 0 "[ . 1 . 2 . 3]" 1 221 1 117 VAL H 1 160 ALA H 5.000 . 5.000 5.318 5.299 5.334 0.334 30 0 "[ . 1 . 2 . 3]" 1 222 1 118 GLY H 1 160 ALA H 5.000 . 5.000 3.932 3.909 3.948 . 0 0 "[ . 1 . 2 . 3]" 1 223 1 158 ILE H 1 160 ALA H 5.000 . 5.500 5.348 5.315 5.383 . 0 0 "[ . 1 . 2 . 3]" 1 224 1 161 ALA H 1 163 GLN H 5.000 . 5.000 5.395 5.382 5.406 0.406 23 0 "[ . 1 . 2 . 3]" 1 225 1 162 PHE H 1 163 GLN H 5.000 . 5.000 4.255 4.246 4.261 . 0 0 "[ . 1 . 2 . 3]" 1 226 1 163 GLN H 1 164 ASP H 5.000 . 5.000 4.461 4.456 4.467 . 0 0 "[ . 1 . 2 . 3]" 1 227 1 96 ARG H 1 164 ASP H 5.000 . 5.500 4.916 4.895 4.930 . 0 0 "[ . 1 . 2 . 3]" 1 228 1 164 ASP H 1 165 GLU H 5.000 . 5.000 4.631 4.629 4.633 . 0 0 "[ . 1 . 2 . 3]" 1 229 1 166 VAL H 1 167 ALA H 3.000 . 4.000 2.810 2.800 2.818 . 0 0 "[ . 1 . 2 . 3]" 1 230 1 164 ASP H 1 167 ALA H 5.000 . 5.000 4.772 4.744 4.795 . 0 0 "[ . 1 . 2 . 3]" 1 231 1 167 ALA H 1 168 ALA H 3.000 . 4.000 2.687 2.675 2.703 . 0 0 "[ . 1 . 2 . 3]" 1 232 1 168 ALA H 1 169 SER H 3.000 . 4.000 2.892 2.881 2.910 . 0 0 "[ . 1 . 2 . 3]" 1 233 1 168 ALA H 1 170 GLU H 3.000 . 4.000 4.080 4.045 4.099 0.099 27 0 "[ . 1 . 2 . 3]" 1 234 1 169 SER H 1 170 GLU H 3.000 . 4.000 2.784 2.772 2.790 . 0 0 "[ . 1 . 2 . 3]" 1 235 1 170 GLU H 1 171 GLY H 3.000 . 4.000 2.842 2.821 2.896 . 0 0 "[ . 1 . 2 . 3]" 1 236 1 170 GLU H 1 172 PHE H 5.000 . 5.000 4.803 4.757 4.832 . 0 0 "[ . 1 . 2 . 3]" 1 237 1 168 ALA H 1 171 GLY H 5.000 . 5.000 4.688 4.652 4.775 . 0 0 "[ . 1 . 2 . 3]" 1 238 1 169 SER H 1 171 GLY H 3.000 . 4.000 4.178 4.145 4.263 0.263 12 0 "[ . 1 . 2 . 3]" 1 239 1 171 GLY H 1 172 PHE H 3.000 . 4.000 2.481 2.413 2.508 . 0 0 "[ . 1 . 2 . 3]" 1 240 1 172 PHE H 1 173 LEU H 3.000 . 4.000 3.281 3.274 3.295 . 0 0 "[ . 1 . 2 . 3]" 1 241 1 172 PHE H 1 174 LYS H 3.000 . 4.000 4.153 4.140 4.171 0.171 11 0 "[ . 1 . 2 . 3]" 1 242 1 172 PHE H 1 175 GLN H 5.000 . 5.000 5.156 5.118 5.178 0.178 20 0 "[ . 1 . 2 . 3]" 1 243 1 171 GLY H 1 173 LEU H 3.000 . 4.000 4.177 4.164 4.193 0.193 11 0 "[ . 1 . 2 . 3]" 1 244 1 173 LEU H 1 174 LYS H 3.000 . 4.000 2.683 2.674 2.689 . 0 0 "[ . 1 . 2 . 3]" 1 245 1 174 LYS H 1 175 GLN H 5.000 . 5.000 2.751 2.740 2.758 . 0 0 "[ . 1 . 2 . 3]" 1 246 1 173 LEU H 1 175 GLN H 5.000 . 5.000 4.012 3.997 4.023 . 0 0 "[ . 1 . 2 . 3]" 1 247 1 175 GLN H 1 177 VAL H 5.000 . 5.000 4.297 4.201 4.464 . 0 0 "[ . 1 . 2 . 3]" 1 248 1 177 VAL H 1 178 GLY H 5.000 . 5.000 2.694 2.677 2.731 . 0 0 "[ . 1 . 2 . 3]" 1 249 1 177 VAL H 1 179 LYS H 5.000 . 5.000 4.087 4.074 4.109 . 0 0 "[ . 1 . 2 . 3]" 1 250 1 178 GLY H 1 179 LYS H 5.000 . 5.000 2.663 2.646 2.675 . 0 0 "[ . 1 . 2 . 3]" 1 251 1 178 GLY H 1 180 ASP H 5.000 . 5.000 4.345 4.325 4.357 . 0 0 "[ . 1 . 2 . 3]" 1 252 1 178 GLY H 1 181 TYR H 5.000 . 5.000 4.912 4.902 4.920 . 0 0 "[ . 1 . 2 . 3]" 1 253 1 179 LYS H 1 180 ASP H 5.000 . 5.000 2.697 2.686 2.705 . 0 0 "[ . 1 . 2 . 3]" 1 254 1 179 LYS H 1 181 TYR H 5.000 . 5.000 4.015 3.996 4.028 . 0 0 "[ . 1 . 2 . 3]" 1 255 1 180 ASP H 1 181 TYR H 5.000 . 5.000 2.581 2.573 2.588 . 0 0 "[ . 1 . 2 . 3]" 1 256 1 181 TYR H 1 182 LYS H 5.000 . 5.000 4.271 4.268 4.276 . 0 0 "[ . 1 . 2 . 3]" 1 257 1 101 LYS H 1 182 LYS H 5.000 . 5.000 3.957 3.925 4.002 . 0 0 "[ . 1 . 2 . 3]" 1 258 1 182 LYS H 1 183 PHE H 5.000 . 5.000 3.492 3.484 3.503 . 0 0 "[ . 1 . 2 . 3]" 1 259 1 183 PHE H 1 184 GLY H 5.000 . 5.000 4.373 4.370 4.375 . 0 0 "[ . 1 . 2 . 3]" 1 260 1 184 GLY H 1 185 GLY H 5.000 . 5.000 2.592 2.581 2.609 . 0 0 "[ . 1 . 2 . 3]" 1 261 1 97 LEU H 1 188 VAL H 5.000 . 5.500 5.475 5.440 5.509 0.009 8 0 "[ . 1 . 2 . 3]" 1 262 1 187 SER H 1 188 VAL H 5.000 . 5.000 3.378 3.364 3.396 . 0 0 "[ . 1 . 2 . 3]" 1 263 1 189 LYS H 1 190 ASP H 5.000 . 5.000 4.208 4.193 4.218 . 0 0 "[ . 1 . 2 . 3]" 1 264 1 190 ASP H 1 191 GLU H 5.000 . 5.000 4.439 4.429 4.460 . 0 0 "[ . 1 . 2 . 3]" 1 265 1 191 GLU H 1 192 LYS H 3.000 . 4.000 2.499 2.491 2.514 . 0 0 "[ . 1 . 2 . 3]" 1 266 1 192 LYS H 1 193 LEU H 3.000 . 4.000 2.610 2.601 2.617 . 0 0 "[ . 1 . 2 . 3]" 1 267 1 192 LYS H 1 195 GLY H 5.000 . 5.000 4.455 4.438 4.467 . 0 0 "[ . 1 . 2 . 3]" 1 268 1 193 LEU H 1 194 PHE H 5.000 . 5.000 2.747 2.738 2.751 . 0 0 "[ . 1 . 2 . 3]" 1 269 1 193 LEU H 1 195 GLY H 5.000 . 5.000 3.602 3.585 3.618 . 0 0 "[ . 1 . 2 . 3]" 1 270 1 192 LYS H 1 194 PHE H 5.000 . 5.000 4.431 4.415 4.447 . 0 0 "[ . 1 . 2 . 3]" 1 271 1 194 PHE H 1 195 GLY H 5.000 . 5.000 2.195 2.176 2.215 . 0 0 "[ . 1 . 2 . 3]" 1 272 1 195 GLY H 1 196 VAL H 5.000 . 5.000 4.623 4.615 4.628 . 0 0 "[ . 1 . 2 . 3]" 1 273 1 195 GLY H 1 197 GLY H 5.000 . 5.000 5.151 5.135 5.165 0.165 28 0 "[ . 1 . 2 . 3]" 1 274 1 196 VAL H 1 197 GLY H 5.000 . 5.000 2.490 2.482 2.499 . 0 0 "[ . 1 . 2 . 3]" 1 275 1 92 ALA H 1 198 THR H 5.000 . 5.000 5.282 5.251 5.296 0.296 17 0 "[ . 1 . 2 . 3]" 1 276 1 198 THR H 1 199 GLY H 5.000 . 5.000 4.458 4.455 4.462 . 0 0 "[ . 1 . 2 . 3]" 1 277 1 70 ILE H 1 201 GLY H 5.000 . 5.000 3.398 3.132 3.677 . 0 0 "[ . 1 . 2 . 3]" 1 278 1 71 MET H 1 201 GLY H 5.000 . 5.000 5.152 5.089 5.230 0.230 25 0 "[ . 1 . 2 . 3]" 1 279 1 86 PHE H 1 202 LEU H 5.000 . 5.000 4.583 4.546 4.635 . 0 0 "[ . 1 . 2 . 3]" 1 280 1 87 THR H 1 202 LEU H 5.000 . 5.000 4.357 4.306 4.423 . 0 0 "[ . 1 . 2 . 3]" 1 281 1 203 ARG H 1 205 GLU H 5.000 . 5.500 5.519 5.493 5.546 0.046 30 0 "[ . 1 . 2 . 3]" 1 282 1 84 ILE H 1 204 LYS H 5.000 . 5.500 5.911 5.888 5.942 0.442 23 0 "[ . 1 . 2 . 3]" 1 283 1 85 ALA H 1 204 LYS H 5.000 . 5.000 3.199 3.174 3.229 . 0 0 "[ . 1 . 2 . 3]" 1 284 1 204 LYS H 1 205 GLU H 3.000 . 4.000 2.907 2.903 2.915 . 0 0 "[ . 1 . 2 . 3]" 1 285 1 204 LYS H 1 206 ASP H 3.000 . 4.000 4.144 4.120 4.176 0.176 3 0 "[ . 1 . 2 . 3]" 1 286 1 205 GLU H 1 206 ASP H 3.000 . 4.000 2.904 2.885 2.924 . 0 0 "[ . 1 . 2 . 3]" 1 287 1 206 ASP H 1 207 ASN H 3.000 . 4.000 3.489 3.474 3.496 . 0 0 "[ . 1 . 2 . 3]" 1 288 1 207 ASN H 1 208 GLU H 3.000 . 4.000 2.698 2.682 2.711 . 0 0 "[ . 1 . 2 . 3]" 1 289 1 208 GLU H 1 209 LEU H 3.000 . 4.000 2.561 2.555 2.567 . 0 0 "[ . 1 . 2 . 3]" 1 290 1 206 ASP H 1 209 LEU H 5.000 . 5.500 5.927 5.915 5.938 0.438 28 0 "[ . 1 . 2 . 3]" 1 291 1 207 ASN H 1 209 LEU H 3.000 . 4.000 4.146 4.139 4.159 0.159 23 0 "[ . 1 . 2 . 3]" 1 292 1 209 LEU H 1 210 ARG H 3.000 . 4.000 2.703 2.687 2.710 . 0 0 "[ . 1 . 2 . 3]" 1 293 1 210 ARG H 1 211 GLU H 3.000 . 4.000 2.672 2.662 2.683 . 0 0 "[ . 1 . 2 . 3]" 1 294 1 210 ARG H 1 212 ALA H 3.000 . 4.000 4.065 4.046 4.079 0.079 28 0 "[ . 1 . 2 . 3]" 1 295 1 210 ARG H 1 213 LEU H 5.000 . 5.000 5.214 5.196 5.231 0.231 30 0 "[ . 1 . 2 . 3]" 1 296 1 211 GLU H 1 212 ALA H 3.000 . 4.000 2.709 2.700 2.716 . 0 0 "[ . 1 . 2 . 3]" 1 297 1 213 LEU H 1 216 ALA H 5.000 . 5.000 4.525 4.511 4.546 . 0 0 "[ . 1 . 2 . 3]" 1 298 1 214 ASN H 1 215 LYS H 3.000 . 4.000 2.673 2.655 2.692 . 0 0 "[ . 1 . 2 . 3]" 1 299 1 214 ASN H 1 216 ALA H 3.000 . 4.000 4.087 4.075 4.100 0.100 28 0 "[ . 1 . 2 . 3]" 1 300 1 215 LYS H 1 216 ALA H 3.000 . 4.000 2.694 2.683 2.714 . 0 0 "[ . 1 . 2 . 3]" 1 301 1 215 LYS H 1 217 PHE H 3.000 . 4.000 4.074 4.059 4.094 0.094 28 0 "[ . 1 . 2 . 3]" 1 302 1 216 ALA H 1 217 PHE H 3.000 . 4.000 2.656 2.645 2.667 . 0 0 "[ . 1 . 2 . 3]" 1 303 1 217 PHE H 1 218 ALA H 3.000 . 4.000 2.691 2.682 2.702 . 0 0 "[ . 1 . 2 . 3]" 1 304 1 217 PHE H 1 219 GLU H 3.000 . 4.000 4.101 4.085 4.113 0.113 29 0 "[ . 1 . 2 . 3]" 1 305 1 219 GLU H 1 220 MET H 3.000 . 4.000 2.663 2.655 2.673 . 0 0 "[ . 1 . 2 . 3]" 1 306 1 218 ALA H 1 220 MET H 3.000 . 4.000 4.191 4.181 4.208 0.208 28 0 "[ . 1 . 2 . 3]" 1 307 1 220 MET H 1 221 ARG H 3.000 . 4.000 2.737 2.713 2.756 . 0 0 "[ . 1 . 2 . 3]" 1 308 1 221 ARG H 1 226 TYR H 5.000 . 5.000 4.705 4.665 4.727 . 0 0 "[ . 1 . 2 . 3]" 1 309 1 222 ALA H 1 223 ASP H 5.000 . 5.000 2.747 2.737 2.762 . 0 0 "[ . 1 . 2 . 3]" 1 310 1 222 ALA H 1 224 GLY H 5.000 . 5.000 3.702 3.692 3.714 . 0 0 "[ . 1 . 2 . 3]" 1 311 1 220 MET H 1 223 ASP H 5.000 . 5.000 4.904 4.843 4.929 . 0 0 "[ . 1 . 2 . 3]" 1 312 1 223 ASP H 1 224 GLY H 5.000 . 5.000 2.437 2.414 2.473 . 0 0 "[ . 1 . 2 . 3]" 1 313 1 223 ASP H 1 225 THR H 5.000 . 5.000 3.511 3.491 3.546 . 0 0 "[ . 1 . 2 . 3]" 1 314 1 221 ARG H 1 224 GLY H 5.000 . 5.000 4.630 4.596 4.659 . 0 0 "[ . 1 . 2 . 3]" 1 315 1 224 GLY H 1 225 THR H 5.000 . 5.000 2.611 2.581 2.643 . 0 0 "[ . 1 . 2 . 3]" 1 316 1 224 GLY H 1 227 GLU H 5.000 . 5.000 5.175 5.155 5.194 0.194 18 0 "[ . 1 . 2 . 3]" 1 317 1 220 MET H 1 225 THR H 5.000 . 5.500 5.756 5.725 5.781 0.281 25 0 "[ . 1 . 2 . 3]" 1 318 1 226 TYR H 1 227 GLU H 3.000 . 4.000 2.840 2.833 2.845 . 0 0 "[ . 1 . 2 . 3]" 1 319 1 227 GLU H 1 228 LYS H 3.000 . 4.000 2.772 2.749 2.781 . 0 0 "[ . 1 . 2 . 3]" 1 320 1 224 GLY H 1 228 LYS H 5.000 . 5.500 5.699 5.677 5.755 0.255 5 0 "[ . 1 . 2 . 3]" 1 321 1 228 LYS H 1 229 LEU H 3.000 . 4.000 2.798 2.779 2.806 . 0 0 "[ . 1 . 2 . 3]" 1 322 1 228 LYS H 1 230 ALA H 3.000 . 4.000 4.093 4.076 4.101 0.101 2 0 "[ . 1 . 2 . 3]" 1 323 1 228 LYS H 1 231 LYS H 5.000 . 5.000 4.809 4.773 4.832 . 0 0 "[ . 1 . 2 . 3]" 1 324 1 229 LEU H 1 230 ALA H 3.000 . 4.000 2.676 2.664 2.684 . 0 0 "[ . 1 . 2 . 3]" 1 325 1 230 ALA H 1 231 LYS H 3.000 . 4.000 2.800 2.766 2.812 . 0 0 "[ . 1 . 2 . 3]" 1 326 1 230 ALA H 1 232 LYS H 3.000 . 4.000 4.016 4.010 4.021 0.021 29 0 "[ . 1 . 2 . 3]" 1 327 1 231 LYS H 1 232 LYS H 3.000 . 4.000 2.701 2.677 2.709 . 0 0 "[ . 1 . 2 . 3]" 1 328 1 230 ALA H 1 233 TYR H 5.000 . 5.000 4.752 4.727 4.812 . 0 0 "[ . 1 . 2 . 3]" 1 329 1 233 TYR H 1 234 PHE H 5.000 . 5.000 2.712 2.695 2.721 . 0 0 "[ . 1 . 2 . 3]" 1 330 1 234 PHE H 1 236 PHE H 5.000 . 5.500 5.237 5.161 5.334 . 0 0 "[ . 1 . 2 . 3]" 1 331 1 235 ASP H 1 236 PHE H 5.000 . 5.000 4.126 4.062 4.183 . 0 0 "[ . 1 . 2 . 3]" 1 332 1 237 ASP H 1 238 VAL H 5.000 . 5.000 4.131 4.112 4.145 . 0 0 "[ . 1 . 2 . 3]" 1 333 1 238 VAL H 1 239 TYR H 5.000 . 5.000 2.652 2.647 2.657 . 0 0 "[ . 1 . 2 . 3]" 1 334 1 239 TYR H 1 240 GLY H 5.000 . 5.000 2.758 2.729 2.784 . 0 0 "[ . 1 . 2 . 3]" 1 335 1 239 TYR H 1 241 GLY H 5.000 . 5.000 4.116 4.098 4.135 . 0 0 "[ . 1 . 2 . 3]" 1 336 1 240 GLY H 1 241 GLY H 5.000 . 5.000 2.645 2.639 2.655 . 0 0 "[ . 1 . 2 . 3]" 1 337 1 5 ILE H 1 5 ILE MD 4.000 . 4.000 3.343 3.339 3.351 . 0 0 "[ . 1 . 2 . 3]" 1 338 1 5 ILE MD 1 46 THR H 6.000 . 6.000 4.717 4.704 4.728 . 0 0 "[ . 1 . 2 . 3]" 1 339 1 5 ILE H 1 5 ILE MG 4.000 . 4.000 3.114 3.095 3.146 . 0 0 "[ . 1 . 2 . 3]" 1 340 1 5 ILE MG 1 46 THR H 6.000 . 6.000 6.283 6.247 6.322 0.322 9 0 "[ . 1 . 2 . 3]" 1 341 1 5 ILE MG 1 208 GLU H 6.000 . 6.000 6.153 6.126 6.187 0.187 27 0 "[ . 1 . 2 . 3]" 1 342 1 9 ILE MD 1 41 CYS H 6.000 . 6.000 5.308 5.230 5.406 . 0 0 "[ . 1 . 2 . 3]" 1 343 1 9 ILE MD 1 49 THR H 6.000 . 6.000 5.427 5.347 5.522 . 0 0 "[ . 1 . 2 . 3]" 1 344 1 8 ASN H 1 9 ILE MG 6.000 . 6.000 6.130 6.120 6.141 0.141 22 0 "[ . 1 . 2 . 3]" 1 345 1 9 ILE H 1 9 ILE MG 4.000 . 4.000 3.816 3.812 3.821 . 0 0 "[ . 1 . 2 . 3]" 1 346 1 9 ILE MG 1 10 ARG H 6.000 . 6.000 2.703 2.610 2.845 . 0 0 "[ . 1 . 2 . 3]" 1 347 1 9 ILE H 1 11 ILE MD 6.000 . 6.000 5.823 5.694 5.939 . 0 0 "[ . 1 . 2 . 3]" 1 348 1 11 ILE H 1 11 ILE MD 4.000 . 4.000 3.776 3.757 3.815 . 0 0 "[ . 1 . 2 . 3]" 1 349 1 11 ILE MD 1 48 CYS H 6.000 . 6.000 5.520 5.388 5.656 . 0 0 "[ . 1 . 2 . 3]" 1 350 1 11 ILE MD 1 69 ALA H 6.000 . 6.000 5.675 5.573 5.715 . 0 0 "[ . 1 . 2 . 3]" 1 351 1 11 ILE H 1 11 ILE MG 4.000 . 4.000 3.806 3.802 3.817 . 0 0 "[ . 1 . 2 . 3]" 1 352 1 11 ILE MG 1 12 GLY H 6.000 . 6.000 2.326 2.259 2.350 . 0 0 "[ . 1 . 2 . 3]" 1 353 1 11 ILE MG 1 13 THR H 6.000 . 6.000 3.551 3.447 3.621 . 0 0 "[ . 1 . 2 . 3]" 1 354 1 11 ILE MG 1 70 ILE H 6.000 . 6.000 4.580 4.517 4.628 . 0 0 "[ . 1 . 2 . 3]" 1 355 1 11 ILE MG 1 71 MET H 6.000 . 6.000 2.915 2.752 3.047 . 0 0 "[ . 1 . 2 . 3]" 1 356 1 13 THR H 1 13 THR MG 4.000 . 4.000 3.869 3.851 3.886 . 0 0 "[ . 1 . 2 . 3]" 1 357 1 13 THR MG 1 16 THR H 6.000 . 6.000 5.414 5.382 5.433 . 0 0 "[ . 1 . 2 . 3]" 1 358 1 13 THR MG 1 51 VAL H 6.000 . 6.000 5.603 5.561 5.623 . 0 0 "[ . 1 . 2 . 3]" 1 359 1 16 THR H 1 16 THR MG 4.000 . 4.000 3.106 3.047 3.131 . 0 0 "[ . 1 . 2 . 3]" 1 360 1 18 ALA MB 1 20 PHE H 6.000 . 6.000 4.363 4.342 4.398 . 0 0 "[ . 1 . 2 . 3]" 1 361 1 18 ALA MB 1 21 GLU H 6.000 . 6.000 4.598 4.578 4.621 . 0 0 "[ . 1 . 2 . 3]" 1 362 1 18 ALA MB 1 23 LYS H 6.000 . 6.000 5.722 5.704 5.740 . 0 0 "[ . 1 . 2 . 3]" 1 363 1 29 LEU MD1 1 50 PHE H 6.000 . 6.000 3.618 3.582 3.641 . 0 0 "[ . 1 . 2 . 3]" 1 364 1 22 SER H 1 29 LEU MD2 6.000 . 6.000 5.231 4.785 5.470 . 0 0 "[ . 1 . 2 . 3]" 1 365 1 24 ASN H 1 30 VAL MG1 6.000 . 6.000 3.384 3.321 3.448 . 0 0 "[ . 1 . 2 . 3]" 1 366 1 30 VAL H 1 30 VAL MG1 4.000 . 4.000 2.079 2.033 2.113 . 0 0 "[ . 1 . 2 . 3]" 1 367 1 30 VAL MG1 1 31 GLY H 6.000 . 6.000 3.776 3.766 3.794 . 0 0 "[ . 1 . 2 . 3]" 1 368 1 23 LYS H 1 30 VAL MG2 6.000 . 6.000 5.965 5.866 6.115 0.115 8 0 "[ . 1 . 2 . 3]" 1 369 1 24 ASN H 1 30 VAL MG2 6.000 . 6.000 6.070 6.026 6.113 0.113 20 0 "[ . 1 . 2 . 3]" 1 370 1 29 LEU H 1 30 VAL MG2 6.000 . 6.000 6.242 6.221 6.269 0.269 28 0 "[ . 1 . 2 . 3]" 1 371 1 30 VAL H 1 30 VAL MG2 4.000 . 4.000 3.826 3.813 3.832 . 0 0 "[ . 1 . 2 . 3]" 1 372 1 30 VAL MG2 1 31 GLY H 6.000 . 6.000 1.988 1.973 2.002 . 0 0 "[ . 1 . 2 . 3]" 1 373 1 30 VAL MG2 1 32 PHE H 6.000 . 6.000 4.602 4.583 4.653 . 0 0 "[ . 1 . 2 . 3]" 1 374 1 22 SER H 1 34 ILE MD 6.000 . 6.000 3.596 3.478 3.657 . 0 0 "[ . 1 . 2 . 3]" 1 375 1 34 ILE H 1 34 ILE MD 4.000 . 4.000 3.479 3.447 3.499 . 0 0 "[ . 1 . 2 . 3]" 1 376 1 34 ILE H 1 34 ILE MG 4.000 . 4.000 3.732 3.730 3.735 . 0 0 "[ . 1 . 2 . 3]" 1 377 1 34 ILE MG 1 35 ASP H 6.000 . 6.000 3.371 3.361 3.379 . 0 0 "[ . 1 . 2 . 3]" 1 378 1 34 ILE MG 1 38 LYS H 6.000 . 6.000 3.810 3.770 3.850 . 0 0 "[ . 1 . 2 . 3]" 1 379 1 35 ASP H 1 36 LEU MD1 6.000 . 6.000 6.257 6.247 6.264 0.264 12 0 "[ . 1 . 2 . 3]" 1 380 1 36 LEU H 1 36 LEU MD1 4.000 . 4.000 4.058 4.049 4.073 0.073 5 0 "[ . 1 . 2 . 3]" 1 381 1 36 LEU MD1 1 37 ALA H 6.000 . 6.000 4.456 4.435 4.477 . 0 0 "[ . 1 . 2 . 3]" 1 382 1 34 ILE H 1 36 LEU MD2 6.000 . 6.000 6.379 6.344 6.407 0.407 29 0 "[ . 1 . 2 . 3]" 1 383 1 35 ASP H 1 36 LEU MD2 6.000 . 6.000 6.277 6.250 6.291 0.291 29 0 "[ . 1 . 2 . 3]" 1 384 1 36 LEU H 1 36 LEU MD2 4.000 . 4.000 4.260 4.250 4.266 0.266 21 0 "[ . 1 . 2 . 3]" 1 385 1 36 LEU MD2 1 37 ALA H 6.000 . 6.000 4.110 4.048 4.158 . 0 0 "[ . 1 . 2 . 3]" 1 386 1 37 ALA MB 1 40 LEU H 6.000 . 6.000 4.522 4.503 4.539 . 0 0 "[ . 1 . 2 . 3]" 1 387 1 38 LYS H 1 40 LEU MD1 6.000 . 6.000 5.148 5.070 5.249 . 0 0 "[ . 1 . 2 . 3]" 1 388 1 40 LEU H 1 40 LEU MD1 4.000 . 4.000 3.467 3.438 3.487 . 0 0 "[ . 1 . 2 . 3]" 1 389 1 40 LEU MD1 1 41 CYS H 6.000 . 6.000 4.481 4.460 4.502 . 0 0 "[ . 1 . 2 . 3]" 1 390 1 40 LEU MD1 1 217 PHE H 6.000 . 6.000 5.467 5.428 5.500 . 0 0 "[ . 1 . 2 . 3]" 1 391 1 40 LEU H 1 40 LEU MD2 4.000 . 4.000 3.592 3.563 3.615 . 0 0 "[ . 1 . 2 . 3]" 1 392 1 40 LEU MD2 1 216 ALA H 6.000 . 6.000 4.270 4.231 4.329 . 0 0 "[ . 1 . 2 . 3]" 1 393 1 40 LEU MD2 1 217 PHE H 6.000 . 6.000 3.644 3.610 3.704 . 0 0 "[ . 1 . 2 . 3]" 1 394 1 40 LEU MD2 1 218 ALA H 6.000 . 6.000 5.738 5.711 5.781 . 0 0 "[ . 1 . 2 . 3]" 1 395 1 44 ILE H 1 44 ILE MD 4.000 . 4.000 3.506 3.497 3.513 . 0 0 "[ . 1 . 2 . 3]" 1 396 1 44 ILE MD 1 46 THR H 6.000 . 6.000 4.962 4.945 4.973 . 0 0 "[ . 1 . 2 . 3]" 1 397 1 44 ILE MD 1 213 LEU H 6.000 . 6.000 3.721 3.690 3.777 . 0 0 "[ . 1 . 2 . 3]" 1 398 1 42 LYS H 1 44 ILE MG 6.000 . 6.500 6.388 6.359 6.416 . 0 0 "[ . 1 . 2 . 3]" 1 399 1 44 ILE H 1 44 ILE MG 4.000 . 4.000 3.747 3.745 3.748 . 0 0 "[ . 1 . 2 . 3]" 1 400 1 7 GLN H 1 46 THR MG 6.000 . 6.000 4.798 4.741 4.855 . 0 0 "[ . 1 . 2 . 3]" 1 401 1 8 ASN H 1 46 THR MG 6.000 . 6.000 4.823 4.797 4.853 . 0 0 "[ . 1 . 2 . 3]" 1 402 1 46 THR H 1 46 THR MG 4.000 . 4.000 3.228 3.212 3.243 . 0 0 "[ . 1 . 2 . 3]" 1 403 1 46 THR MG 1 47 GLN H 6.000 . 6.000 3.443 3.437 3.451 . 0 0 "[ . 1 . 2 . 3]" 1 404 1 49 THR H 1 49 THR MG 4.000 . 4.000 3.859 3.855 3.862 . 0 0 "[ . 1 . 2 . 3]" 1 405 1 49 THR MG 1 50 PHE H 6.000 . 6.000 2.657 2.635 2.687 . 0 0 "[ . 1 . 2 . 3]" 1 406 1 49 THR MG 1 52 GLU H 6.000 . 6.000 6.094 6.079 6.131 0.131 11 0 "[ . 1 . 2 . 3]" 1 407 1 51 VAL MG1 1 53 ASN H 6.000 . 6.000 4.647 4.621 4.669 . 0 0 "[ . 1 . 2 . 3]" 1 408 1 51 VAL H 1 51 VAL MG2 4.000 . 4.000 2.996 2.988 3.007 . 0 0 "[ . 1 . 2 . 3]" 1 409 1 51 VAL MG2 1 52 GLU H 6.000 . 6.000 3.879 3.866 3.890 . 0 0 "[ . 1 . 2 . 3]" 1 410 1 55 LEU MD1 1 75 SER H 6.000 . 6.000 5.271 5.175 5.361 . 0 0 "[ . 1 . 2 . 3]" 1 411 1 55 LEU H 1 55 LEU MD2 4.000 . 4.000 3.310 3.264 3.332 . 0 0 "[ . 1 . 2 . 3]" 1 412 1 55 LEU MD2 1 56 ASP H 6.000 . 6.000 4.571 4.556 4.588 . 0 0 "[ . 1 . 2 . 3]" 1 413 1 55 LEU MD2 1 58 LEU H 6.000 . 6.000 4.593 4.579 4.612 . 0 0 "[ . 1 . 2 . 3]" 1 414 1 55 LEU MD2 1 59 ILE H 6.000 . 6.000 5.102 5.076 5.135 . 0 0 "[ . 1 . 2 . 3]" 1 415 1 56 ASP H 1 57 ALA MB 6.000 . 6.000 4.518 4.507 4.530 . 0 0 "[ . 1 . 2 . 3]" 1 416 1 57 ALA MB 1 58 LEU H 6.000 . 6.000 2.928 2.919 2.936 . 0 0 "[ . 1 . 2 . 3]" 1 417 1 12 GLY H 1 58 LEU MD1 6.000 . 6.000 4.792 4.643 4.851 . 0 0 "[ . 1 . 2 . 3]" 1 418 1 53 ASN H 1 58 LEU MD1 6.000 . 6.000 4.965 4.899 4.994 . 0 0 "[ . 1 . 2 . 3]" 1 419 1 55 LEU H 1 58 LEU MD1 6.000 . 6.000 3.294 3.267 3.337 . 0 0 "[ . 1 . 2 . 3]" 1 420 1 57 ALA H 1 58 LEU MD1 6.000 . 6.000 4.769 4.752 4.787 . 0 0 "[ . 1 . 2 . 3]" 1 421 1 53 ASN H 1 58 LEU MD2 6.000 . 6.000 4.418 4.233 4.511 . 0 0 "[ . 1 . 2 . 3]" 1 422 1 58 LEU H 1 58 LEU MD2 4.000 . 4.000 3.586 3.420 3.663 . 0 0 "[ . 1 . 2 . 3]" 1 423 1 58 LEU MD2 1 59 ILE H 6.000 . 6.000 4.635 4.605 4.656 . 0 0 "[ . 1 . 2 . 3]" 1 424 1 58 LEU H 1 59 ILE MD 6.000 . 6.000 6.142 5.935 6.186 0.186 7 0 "[ . 1 . 2 . 3]" 1 425 1 59 ILE H 1 59 ILE MD 4.000 . 4.000 4.008 3.834 4.043 0.043 2 0 "[ . 1 . 2 . 3]" 1 426 1 59 ILE MD 1 84 ILE H 6.000 . 6.000 6.369 6.329 6.405 0.405 11 0 "[ . 1 . 2 . 3]" 1 427 1 62 LEU H 1 62 LEU MD1 4.000 . 4.000 3.971 3.948 3.985 . 0 0 "[ . 1 . 2 . 3]" 1 428 1 62 LEU MD1 1 64 ALA H 6.000 . 6.000 5.460 5.385 5.544 . 0 0 "[ . 1 . 2 . 3]" 1 429 1 62 LEU MD1 1 69 ALA H 6.000 . 6.000 3.920 3.844 3.998 . 0 0 "[ . 1 . 2 . 3]" 1 430 1 62 LEU H 1 62 LEU MD2 4.000 . 4.000 4.254 4.232 4.271 0.271 28 0 "[ . 1 . 2 . 3]" 1 431 1 62 LEU MD2 1 64 ALA H 6.000 . 6.000 6.217 6.192 6.225 0.225 15 0 "[ . 1 . 2 . 3]" 1 432 1 62 LEU MD2 1 70 ILE H 6.000 . 6.000 4.427 4.278 4.550 . 0 0 "[ . 1 . 2 . 3]" 1 433 1 62 LEU MD2 1 85 ALA H 6.000 . 6.000 4.965 4.885 5.054 . 0 0 "[ . 1 . 2 . 3]" 1 434 1 61 SER H 1 64 ALA MB 6.000 . 6.000 4.559 4.542 4.579 . 0 0 "[ . 1 . 2 . 3]" 1 435 1 62 LEU H 1 64 ALA MB 6.000 . 6.000 4.855 4.839 4.873 . 0 0 "[ . 1 . 2 . 3]" 1 436 1 64 ALA MB 1 65 LYS H 6.000 . 6.000 3.431 3.419 3.437 . 0 0 "[ . 1 . 2 . 3]" 1 437 1 64 ALA MB 1 66 LYS H 6.000 . 6.000 2.681 2.674 2.691 . 0 0 "[ . 1 . 2 . 3]" 1 438 1 64 ALA MB 1 67 ILE H 6.000 . 6.000 4.623 4.615 4.629 . 0 0 "[ . 1 . 2 . 3]" 1 439 1 13 THR H 1 67 ILE MD 6.000 . 6.000 6.010 5.961 6.068 0.068 5 0 "[ . 1 . 2 . 3]" 1 440 1 58 LEU H 1 67 ILE MD 6.000 . 6.000 5.030 4.967 5.096 . 0 0 "[ . 1 . 2 . 3]" 1 441 1 59 ILE H 1 67 ILE MD 6.000 . 6.000 4.831 4.783 4.866 . 0 0 "[ . 1 . 2 . 3]" 1 442 1 61 SER H 1 67 ILE MD 6.000 . 6.000 4.191 4.143 4.235 . 0 0 "[ . 1 . 2 . 3]" 1 443 1 62 LEU H 1 67 ILE MD 6.000 . 6.000 2.706 2.666 2.745 . 0 0 "[ . 1 . 2 . 3]" 1 444 1 63 LYS H 1 67 ILE MD 6.000 . 6.000 4.920 4.893 4.940 . 0 0 "[ . 1 . 2 . 3]" 1 445 1 66 LYS H 1 67 ILE MD 6.000 . 6.000 5.438 5.414 5.453 . 0 0 "[ . 1 . 2 . 3]" 1 446 1 67 ILE H 1 67 ILE MD 4.000 . 4.000 3.812 3.801 3.828 . 0 0 "[ . 1 . 2 . 3]" 1 447 1 67 ILE MD 1 68 ASP H 6.000 . 6.000 4.416 4.375 4.461 . 0 0 "[ . 1 . 2 . 3]" 1 448 1 51 VAL H 1 67 ILE MG 6.000 . 6.000 5.015 4.975 5.053 . 0 0 "[ . 1 . 2 . 3]" 1 449 1 67 ILE H 1 67 ILE MG 4.000 . 4.000 2.768 2.757 2.786 . 0 0 "[ . 1 . 2 . 3]" 1 450 1 67 ILE MG 1 68 ASP H 6.000 . 6.000 3.789 3.782 3.801 . 0 0 "[ . 1 . 2 . 3]" 1 451 1 69 ALA MB 1 70 ILE H 6.000 . 6.000 2.544 2.464 2.579 . 0 0 "[ . 1 . 2 . 3]" 1 452 1 61 SER H 1 70 ILE MD 6.000 . 6.000 4.944 4.907 5.002 . 0 0 "[ . 1 . 2 . 3]" 1 453 1 14 ASP H 1 70 ILE MG 6.000 . 6.000 5.625 5.571 5.664 . 0 0 "[ . 1 . 2 . 3]" 1 454 1 70 ILE H 1 70 ILE MG 4.000 . 4.000 3.795 3.789 3.803 . 0 0 "[ . 1 . 2 . 3]" 1 455 1 70 ILE MG 1 71 MET H 6.000 . 6.000 2.608 2.570 2.636 . 0 0 "[ . 1 . 2 . 3]" 1 456 1 74 LEU MD1 1 75 SER H 6.000 . 6.000 2.538 2.465 2.595 . 0 0 "[ . 1 . 2 . 3]" 1 457 1 74 LEU MD2 1 75 SER H 6.000 . 6.000 4.465 4.444 4.495 . 0 0 "[ . 1 . 2 . 3]" 1 458 1 74 LEU MD2 1 201 GLY H 6.000 . 6.000 4.225 4.154 4.306 . 0 0 "[ . 1 . 2 . 3]" 1 459 1 74 LEU MD2 1 202 LEU H 6.000 . 6.000 6.276 6.239 6.312 0.312 4 0 "[ . 1 . 2 . 3]" 1 460 1 76 ILE MD 1 91 TYR H 6.000 . 6.000 5.798 5.728 5.905 . 0 0 "[ . 1 . 2 . 3]" 1 461 1 76 ILE MD 1 197 GLY H 6.000 . 6.000 3.227 3.209 3.257 . 0 0 "[ . 1 . 2 . 3]" 1 462 1 76 ILE MD 1 198 THR H 6.000 . 6.000 3.959 3.888 4.005 . 0 0 "[ . 1 . 2 . 3]" 1 463 1 76 ILE MD 1 199 GLY H 6.000 . 6.000 4.048 3.922 4.130 . 0 0 "[ . 1 . 2 . 3]" 1 464 1 76 ILE MG 1 77 THR H 6.000 . 6.000 3.850 3.843 3.857 . 0 0 "[ . 1 . 2 . 3]" 1 465 1 76 ILE MG 1 196 VAL H 6.000 . 6.000 5.643 5.630 5.662 . 0 0 "[ . 1 . 2 . 3]" 1 466 1 76 ILE MG 1 197 GLY H 6.000 . 6.000 4.837 4.823 4.852 . 0 0 "[ . 1 . 2 . 3]" 1 467 1 77 THR H 1 77 THR MG 4.000 . 4.000 3.076 3.028 3.115 . 0 0 "[ . 1 . 2 . 3]" 1 468 1 77 THR MG 1 79 LYS H 6.000 . 6.000 4.602 4.585 4.610 . 0 0 "[ . 1 . 2 . 3]" 1 469 1 77 THR MG 1 81 GLN H 6.000 . 6.000 5.646 5.624 5.679 . 0 0 "[ . 1 . 2 . 3]" 1 470 1 77 THR MG 1 195 GLY H 6.000 . 6.000 2.935 2.871 2.989 . 0 0 "[ . 1 . 2 . 3]" 1 471 1 77 THR MG 1 196 VAL H 6.000 . 6.000 4.752 4.606 4.874 . 0 0 "[ . 1 . 2 . 3]" 1 472 1 77 THR MG 1 197 GLY H 6.000 . 6.500 4.897 4.813 4.960 . 0 0 "[ . 1 . 2 . 3]" 1 473 1 83 GLU H 1 84 ILE MD 6.000 . 6.000 5.725 5.709 5.739 . 0 0 "[ . 1 . 2 . 3]" 1 474 1 84 ILE H 1 84 ILE MD 4.000 . 4.000 3.941 3.933 3.950 . 0 0 "[ . 1 . 2 . 3]" 1 475 1 84 ILE MD 1 85 ALA H 6.000 . 6.000 3.440 3.405 3.455 . 0 0 "[ . 1 . 2 . 3]" 1 476 1 84 ILE MD 1 201 GLY H 6.000 . 6.000 4.814 4.757 4.849 . 0 0 "[ . 1 . 2 . 3]" 1 477 1 84 ILE MD 1 202 LEU H 6.000 . 6.000 3.269 3.196 3.352 . 0 0 "[ . 1 . 2 . 3]" 1 478 1 84 ILE H 1 84 ILE MG 4.000 . 4.000 2.901 2.882 2.928 . 0 0 "[ . 1 . 2 . 3]" 1 479 1 84 ILE MG 1 85 ALA H 6.000 . 6.000 3.569 3.559 3.576 . 0 0 "[ . 1 . 2 . 3]" 1 480 1 84 ILE MG 1 204 LYS H 6.000 . 6.000 3.871 3.832 3.926 . 0 0 "[ . 1 . 2 . 3]" 1 481 1 84 ILE MG 1 205 GLU H 6.000 . 6.000 5.997 5.977 6.020 0.020 15 0 "[ . 1 . 2 . 3]" 1 482 1 85 ALA MB 1 86 PHE H 6.000 . 6.000 2.775 2.758 2.792 . 0 0 "[ . 1 . 2 . 3]" 1 483 1 85 ALA MB 1 206 ASP H 6.000 . 6.000 4.051 3.998 4.109 . 0 0 "[ . 1 . 2 . 3]" 1 484 1 85 ALA MB 1 207 ASN H 6.000 . 6.000 5.980 5.925 6.039 0.039 18 0 "[ . 1 . 2 . 3]" 1 485 1 87 THR H 1 87 THR MG 4.000 . 4.000 2.443 2.417 2.461 . 0 0 "[ . 1 . 2 . 3]" 1 486 1 87 THR MG 1 88 ASP H 6.000 . 6.000 2.259 2.239 2.283 . 0 0 "[ . 1 . 2 . 3]" 1 487 1 87 THR MG 1 200 MET H 6.000 . 6.000 3.742 3.686 3.782 . 0 0 "[ . 1 . 2 . 3]" 1 488 1 87 THR MG 1 201 GLY H 6.000 . 6.000 5.658 5.646 5.685 . 0 0 "[ . 1 . 2 . 3]" 1 489 1 87 THR MG 1 202 LEU H 6.000 . 6.000 4.300 4.224 4.387 . 0 0 "[ . 1 . 2 . 3]" 1 490 1 87 THR MG 1 214 ASN H 6.000 . 6.000 4.314 4.292 4.333 . 0 0 "[ . 1 . 2 . 3]" 1 491 1 92 ALA MB 1 93 ALA H 6.000 . 6.000 3.180 3.105 3.220 . 0 0 "[ . 1 . 2 . 3]" 1 492 1 92 ALA MB 1 94 ASP H 6.000 . 6.000 3.364 3.307 3.407 . 0 0 "[ . 1 . 2 . 3]" 1 493 1 92 ALA MB 1 197 GLY H 6.000 . 6.000 5.504 5.488 5.544 . 0 0 "[ . 1 . 2 . 3]" 1 494 1 92 ALA MB 1 198 THR H 6.000 . 6.000 5.251 5.189 5.274 . 0 0 "[ . 1 . 2 . 3]" 1 495 1 92 ALA MB 1 240 GLY H 6.000 . 6.000 4.864 4.786 4.949 . 0 0 "[ . 1 . 2 . 3]" 1 496 1 92 ALA MB 1 241 GLY H 6.000 . 6.000 3.209 3.152 3.270 . 0 0 "[ . 1 . 2 . 3]" 1 497 1 93 ALA MB 1 94 ASP H 6.000 . 6.000 3.713 3.709 3.717 . 0 0 "[ . 1 . 2 . 3]" 1 498 1 93 ALA MB 1 195 GLY H 6.000 . 6.000 6.024 5.885 6.053 0.053 29 0 "[ . 1 . 2 . 3]" 1 499 1 93 ALA MB 1 197 GLY H 6.000 . 6.000 4.426 4.335 4.552 . 0 0 "[ . 1 . 2 . 3]" 1 500 1 98 VAL H 1 98 VAL MG1 4.000 . 4.000 3.905 3.902 3.908 . 0 0 "[ . 1 . 2 . 3]" 1 501 1 98 VAL MG1 1 169 SER H 6.000 . 6.500 6.744 6.701 6.803 0.303 12 0 "[ . 1 . 2 . 3]" 1 502 1 98 VAL MG1 1 172 PHE H 6.000 . 6.000 6.353 6.316 6.402 0.402 5 0 "[ . 1 . 2 . 3]" 1 503 1 98 VAL MG1 1 182 LYS H 6.000 . 6.000 4.677 4.642 4.744 . 0 0 "[ . 1 . 2 . 3]" 1 504 1 98 VAL MG2 1 99 VAL H 6.000 . 6.000 4.348 4.342 4.353 . 0 0 "[ . 1 . 2 . 3]" 1 505 1 98 VAL MG2 1 160 ALA H 6.000 . 6.500 6.796 6.772 6.823 0.323 5 0 "[ . 1 . 2 . 3]" 1 506 1 98 VAL MG2 1 163 GLN H 6.000 . 6.000 3.719 3.689 3.752 . 0 0 "[ . 1 . 2 . 3]" 1 507 1 98 VAL MG2 1 183 PHE H 6.000 . 6.000 4.767 4.723 4.826 . 0 0 "[ . 1 . 2 . 3]" 1 508 1 98 VAL MG2 1 184 GLY H 6.000 . 6.500 6.749 6.702 6.805 0.305 8 0 "[ . 1 . 2 . 3]" 1 509 1 97 LEU H 1 99 VAL MG1 6.000 . 6.000 5.472 5.459 5.488 . 0 0 "[ . 1 . 2 . 3]" 1 510 1 99 VAL MG1 1 100 ALA H 6.000 . 6.000 3.907 3.897 3.922 . 0 0 "[ . 1 . 2 . 3]" 1 511 1 99 VAL MG1 1 105 ILE H 6.000 . 6.000 4.321 4.298 4.344 . 0 0 "[ . 1 . 2 . 3]" 1 512 1 99 VAL MG1 1 185 GLY H 6.000 . 6.000 6.303 6.284 6.322 0.322 13 0 "[ . 1 . 2 . 3]" 1 513 1 98 VAL H 1 99 VAL MG2 6.000 . 6.000 5.104 5.089 5.123 . 0 0 "[ . 1 . 2 . 3]" 1 514 1 99 VAL H 1 99 VAL MG2 4.000 . 4.000 2.212 2.202 2.224 . 0 0 "[ . 1 . 2 . 3]" 1 515 1 99 VAL MG2 1 103 SER H 6.000 . 6.000 4.393 4.312 4.467 . 0 0 "[ . 1 . 2 . 3]" 1 516 1 100 ALA MB 1 101 LYS H 6.000 . 6.000 2.723 2.713 2.730 . 0 0 "[ . 1 . 2 . 3]" 1 517 1 100 ALA MB 1 103 SER H 6.000 . 6.000 2.909 2.852 2.938 . 0 0 "[ . 1 . 2 . 3]" 1 518 1 100 ALA MB 1 181 TYR H 6.000 . 6.000 5.946 5.888 6.010 0.010 5 0 "[ . 1 . 2 . 3]" 1 519 1 100 ALA H 1 105 ILE MD 6.000 . 6.000 4.305 4.231 4.394 . 0 0 "[ . 1 . 2 . 3]" 1 520 1 105 ILE H 1 105 ILE MD 4.000 . 4.000 3.990 3.980 4.002 0.002 6 0 "[ . 1 . 2 . 3]" 1 521 1 105 ILE MD 1 106 GLN H 6.000 . 6.000 5.061 5.052 5.066 . 0 0 "[ . 1 . 2 . 3]" 1 522 1 105 ILE MD 1 116 ARG H 6.000 . 6.000 5.564 5.507 5.618 . 0 0 "[ . 1 . 2 . 3]" 1 523 1 98 VAL H 1 105 ILE MG 6.000 . 6.000 6.036 6.017 6.062 0.062 23 0 "[ . 1 . 2 . 3]" 1 524 1 105 ILE H 1 105 ILE MG 4.000 . 4.000 3.815 3.806 3.821 . 0 0 "[ . 1 . 2 . 3]" 1 525 1 105 ILE MG 1 106 GLN H 6.000 . 6.000 2.542 2.528 2.555 . 0 0 "[ . 1 . 2 . 3]" 1 526 1 105 ILE MG 1 108 THR H 6.000 . 6.000 4.150 4.112 4.214 . 0 0 "[ . 1 . 2 . 3]" 1 527 1 105 ILE MG 1 184 GLY H 6.000 . 6.000 6.320 6.300 6.338 0.338 9 0 "[ . 1 . 2 . 3]" 1 528 1 108 THR H 1 108 THR MG 4.000 . 4.000 4.050 4.045 4.054 0.054 27 0 "[ . 1 . 2 . 3]" 1 529 1 108 THR MG 1 111 SER H 6.000 . 6.000 3.029 2.986 3.075 . 0 0 "[ . 1 . 2 . 3]" 1 530 1 109 VAL H 1 109 VAL MG1 4.000 . 4.000 2.079 2.059 2.098 . 0 0 "[ . 1 . 2 . 3]" 1 531 1 109 VAL MG1 1 110 GLU H 6.000 . 6.000 2.046 2.024 2.072 . 0 0 "[ . 1 . 2 . 3]" 1 532 1 109 VAL MG1 1 113 LYS H 6.000 . 6.000 4.935 4.911 4.955 . 0 0 "[ . 1 . 2 . 3]" 1 533 1 109 VAL H 1 109 VAL MG2 4.000 . 4.000 3.748 3.745 3.751 . 0 0 "[ . 1 . 2 . 3]" 1 534 1 109 VAL MG2 1 110 GLU H 6.000 . 6.000 3.738 3.720 3.756 . 0 0 "[ . 1 . 2 . 3]" 1 535 1 109 VAL MG2 1 112 LEU H 6.000 . 6.000 4.363 4.343 4.388 . 0 0 "[ . 1 . 2 . 3]" 1 536 1 109 VAL MG2 1 113 LYS H 6.000 . 6.000 4.138 4.086 4.177 . 0 0 "[ . 1 . 2 . 3]" 1 537 1 109 VAL MG2 1 137 GLY H 6.000 . 6.000 5.519 5.504 5.534 . 0 0 "[ . 1 . 2 . 3]" 1 538 1 109 VAL MG2 1 138 ILE H 6.000 . 6.000 5.240 5.212 5.267 . 0 0 "[ . 1 . 2 . 3]" 1 539 1 108 THR H 1 112 LEU MD2 6.000 . 6.000 4.658 4.558 4.758 . 0 0 "[ . 1 . 2 . 3]" 1 540 1 111 SER H 1 112 LEU MD2 6.000 . 6.000 5.818 5.787 5.836 . 0 0 "[ . 1 . 2 . 3]" 1 541 1 112 LEU H 1 112 LEU MD2 4.000 . 4.000 3.892 3.874 3.908 . 0 0 "[ . 1 . 2 . 3]" 1 542 1 112 LEU MD2 1 115 LYS H 6.000 . 6.000 4.774 4.761 4.790 . 0 0 "[ . 1 . 2 . 3]" 1 543 1 112 LEU MD2 1 139 GLU H 6.000 . 6.000 6.165 6.128 6.182 0.182 9 0 "[ . 1 . 2 . 3]" 1 544 1 98 VAL H 1 117 VAL MG1 6.000 . 6.000 5.962 5.947 5.985 . 0 0 "[ . 1 . 2 . 3]" 1 545 1 117 VAL H 1 117 VAL MG1 4.000 . 4.000 3.790 3.787 3.794 . 0 0 "[ . 1 . 2 . 3]" 1 546 1 117 VAL MG1 1 141 VAL H 6.000 . 6.000 3.984 3.934 4.009 . 0 0 "[ . 1 . 2 . 3]" 1 547 1 115 LYS H 1 117 VAL MG2 6.000 . 6.000 5.167 5.140 5.199 . 0 0 "[ . 1 . 2 . 3]" 1 548 1 117 VAL H 1 117 VAL MG2 4.000 . 4.000 2.975 2.966 2.983 . 0 0 "[ . 1 . 2 . 3]" 1 549 1 117 VAL MG2 1 160 ALA H 6.000 . 6.000 3.283 3.241 3.323 . 0 0 "[ . 1 . 2 . 3]" 1 550 1 117 VAL MG2 1 162 PHE H 6.000 . 6.000 4.789 4.760 4.824 . 0 0 "[ . 1 . 2 . 3]" 1 551 1 119 VAL MG1 1 129 GLY H 6.000 . 6.000 5.158 5.134 5.233 . 0 0 "[ . 1 . 2 . 3]" 1 552 1 119 VAL MG1 1 130 ASN H 6.000 . 6.000 6.029 6.009 6.063 0.063 21 0 "[ . 1 . 2 . 3]" 1 553 1 119 VAL MG1 1 141 VAL H 6.000 . 6.000 5.678 5.627 5.732 . 0 0 "[ . 1 . 2 . 3]" 1 554 1 119 VAL H 1 119 VAL MG2 4.000 . 4.000 3.038 3.032 3.047 . 0 0 "[ . 1 . 2 . 3]" 1 555 1 119 VAL MG2 1 127 THR H 6.000 . 6.000 6.095 6.057 6.120 0.120 23 0 "[ . 1 . 2 . 3]" 1 556 1 119 VAL MG2 1 129 GLY H 6.000 . 6.000 5.206 5.189 5.257 . 0 0 "[ . 1 . 2 . 3]" 1 557 1 119 VAL MG2 1 163 GLN H 6.000 . 6.500 6.316 6.220 6.357 . 0 0 "[ . 1 . 2 . 3]" 1 558 1 120 LEU H 1 120 LEU MD1 4.000 . 4.000 4.109 4.101 4.115 0.115 1 0 "[ . 1 . 2 . 3]" 1 559 1 120 LEU MD1 1 121 GLN H 6.000 . 6.000 2.613 2.575 2.637 . 0 0 "[ . 1 . 2 . 3]" 1 560 1 120 LEU MD1 1 145 GLY H 6.000 . 6.000 3.145 3.122 3.174 . 0 0 "[ . 1 . 2 . 3]" 1 561 1 120 LEU MD1 1 147 ASP H 6.000 . 6.000 5.170 5.125 5.196 . 0 0 "[ . 1 . 2 . 3]" 1 562 1 120 LEU H 1 123 THR MG 6.000 . 6.000 3.937 3.808 3.972 . 0 0 "[ . 1 . 2 . 3]" 1 563 1 122 GLY H 1 123 THR MG 6.000 . 6.000 4.096 4.082 4.107 . 0 0 "[ . 1 . 2 . 3]" 1 564 1 123 THR H 1 123 THR MG 4.000 . 4.000 3.073 3.062 3.081 . 0 0 "[ . 1 . 2 . 3]" 1 565 1 123 THR MG 1 124 THR H 6.000 . 6.000 3.683 3.679 3.691 . 0 0 "[ . 1 . 2 . 3]" 1 566 1 123 THR H 1 124 THR MG 6.000 . 6.000 5.335 5.305 5.394 . 0 0 "[ . 1 . 2 . 3]" 1 567 1 124 THR H 1 124 THR MG 4.000 . 4.000 2.132 2.114 2.169 . 0 0 "[ . 1 . 2 . 3]" 1 568 1 124 THR MG 1 127 THR H 6.000 . 6.000 5.398 5.380 5.408 . 0 0 "[ . 1 . 2 . 3]" 1 569 1 124 THR MG 1 193 LEU H 6.000 . 6.000 5.516 5.495 5.546 . 0 0 "[ . 1 . 2 . 3]" 1 570 1 124 THR MG 1 194 PHE H 6.000 . 6.000 4.921 4.892 4.982 . 0 0 "[ . 1 . 2 . 3]" 1 571 1 124 THR MG 1 195 GLY H 6.000 . 6.000 6.132 6.103 6.207 0.207 13 0 "[ . 1 . 2 . 3]" 1 572 1 123 THR H 1 127 THR MG 6.000 . 6.000 5.994 5.979 6.003 0.003 11 0 "[ . 1 . 2 . 3]" 1 573 1 126 GLU H 1 127 THR MG 6.000 . 6.000 6.065 6.054 6.083 0.083 13 0 "[ . 1 . 2 . 3]" 1 574 1 127 THR H 1 127 THR MG 4.000 . 4.000 3.732 3.731 3.734 . 0 0 "[ . 1 . 2 . 3]" 1 575 1 127 THR MG 1 128 PHE H 6.000 . 6.000 3.426 3.420 3.432 . 0 0 "[ . 1 . 2 . 3]" 1 576 1 130 ASN H 1 134 ALA MB 6.000 . 6.000 4.834 4.814 4.856 . 0 0 "[ . 1 . 2 . 3]" 1 577 1 134 ALA MB 1 137 GLY H 6.000 . 6.000 4.808 4.801 4.816 . 0 0 "[ . 1 . 2 . 3]" 1 578 1 134 ALA MB 1 138 ILE H 6.000 . 6.000 5.204 5.192 5.219 . 0 0 "[ . 1 . 2 . 3]" 1 579 1 112 LEU H 1 138 ILE MD 6.000 . 6.000 4.111 4.096 4.138 . 0 0 "[ . 1 . 2 . 3]" 1 580 1 113 LYS H 1 138 ILE MD 6.000 . 6.000 3.711 3.694 3.727 . 0 0 "[ . 1 . 2 . 3]" 1 581 1 114 GLY H 1 138 ILE MD 6.000 . 6.000 5.054 5.018 5.091 . 0 0 "[ . 1 . 2 . 3]" 1 582 1 134 ALA H 1 138 ILE MD 6.000 . 6.000 5.533 5.494 5.560 . 0 0 "[ . 1 . 2 . 3]" 1 583 1 138 ILE H 1 138 ILE MD 4.000 . 4.000 3.788 3.782 3.792 . 0 0 "[ . 1 . 2 . 3]" 1 584 1 116 ARG H 1 138 ILE MG 6.000 . 6.000 5.320 5.280 5.355 . 0 0 "[ . 1 . 2 . 3]" 1 585 1 133 TRP H 1 138 ILE MG 6.000 . 6.000 5.828 5.808 5.849 . 0 0 "[ . 1 . 2 . 3]" 1 586 1 137 GLY H 1 138 ILE MG 6.000 . 6.000 5.700 5.696 5.703 . 0 0 "[ . 1 . 2 . 3]" 1 587 1 138 ILE MG 1 139 GLU H 6.000 . 6.000 2.319 2.311 2.335 . 0 0 "[ . 1 . 2 . 3]" 1 588 1 130 ASN H 1 140 ILE MD 6.000 . 6.000 3.145 3.128 3.175 . 0 0 "[ . 1 . 2 . 3]" 1 589 1 138 ILE H 1 140 ILE MD 6.000 . 6.000 6.053 6.036 6.068 0.068 12 0 "[ . 1 . 2 . 3]" 1 590 1 140 ILE H 1 140 ILE MD 4.000 . 4.000 3.799 3.789 3.819 . 0 0 "[ . 1 . 2 . 3]" 1 591 1 134 ALA H 1 140 ILE MG 6.000 . 6.000 5.172 5.144 5.248 . 0 0 "[ . 1 . 2 . 3]" 1 592 1 141 VAL H 1 141 VAL MG1 4.000 . 4.000 3.791 3.787 3.796 . 0 0 "[ . 1 . 2 . 3]" 1 593 1 141 VAL MG1 1 142 SER H 6.000 . 6.000 2.451 2.434 2.482 . 0 0 "[ . 1 . 2 . 3]" 1 594 1 141 VAL MG2 1 142 SER H 6.000 . 6.000 3.845 3.836 3.854 . 0 0 "[ . 1 . 2 . 3]" 1 595 1 118 GLY H 1 149 ILE MD 6.000 . 6.000 6.089 6.065 6.109 0.109 26 0 "[ . 1 . 2 . 3]" 1 596 1 120 LEU H 1 149 ILE MD 6.000 . 6.000 3.212 3.192 3.239 . 0 0 "[ . 1 . 2 . 3]" 1 597 1 145 GLY H 1 149 ILE MD 6.000 . 6.000 4.549 4.529 4.567 . 0 0 "[ . 1 . 2 . 3]" 1 598 1 147 ASP H 1 149 ILE MD 6.000 . 6.000 5.467 5.441 5.490 . 0 0 "[ . 1 . 2 . 3]" 1 599 1 148 ASN H 1 149 ILE MD 6.000 . 6.000 5.022 5.012 5.032 . 0 0 "[ . 1 . 2 . 3]" 1 600 1 118 GLY H 1 149 ILE MG 6.000 . 6.000 4.605 4.565 4.635 . 0 0 "[ . 1 . 2 . 3]" 1 601 1 149 ILE H 1 149 ILE MG 4.000 . 4.000 3.735 3.734 3.736 . 0 0 "[ . 1 . 2 . 3]" 1 602 1 149 ILE MG 1 150 TYR H 6.000 . 6.000 3.189 3.180 3.199 . 0 0 "[ . 1 . 2 . 3]" 1 603 1 149 ILE MG 1 151 SER H 6.000 . 6.000 4.847 4.841 4.852 . 0 0 "[ . 1 . 2 . 3]" 1 604 1 149 ILE MG 1 162 PHE H 6.000 . 6.000 5.141 5.087 5.193 . 0 0 "[ . 1 . 2 . 3]" 1 605 1 100 ALA H 1 153 LEU MD2 6.000 . 6.000 5.238 5.059 5.394 . 0 0 "[ . 1 . 2 . 3]" 1 606 1 153 LEU H 1 153 LEU MD2 4.000 . 4.000 4.281 4.275 4.287 0.287 15 0 "[ . 1 . 2 . 3]" 1 607 1 153 LEU H 1 154 THR MG 6.000 . 6.000 6.002 5.996 6.006 0.006 17 0 "[ . 1 . 2 . 3]" 1 608 1 154 THR H 1 154 THR MG 4.000 . 4.000 3.738 3.737 3.739 . 0 0 "[ . 1 . 2 . 3]" 1 609 1 154 THR MG 1 155 ALA H 6.000 . 6.000 3.903 3.892 3.911 . 0 0 "[ . 1 . 2 . 3]" 1 610 1 151 SER H 1 155 ALA MB 6.000 . 6.000 6.102 6.050 6.157 0.157 13 0 "[ . 1 . 2 . 3]" 1 611 1 153 LEU H 1 155 ALA MB 6.000 . 6.000 4.625 4.599 4.689 . 0 0 "[ . 1 . 2 . 3]" 1 612 1 154 THR H 1 155 ALA MB 6.000 . 6.000 4.304 4.292 4.321 . 0 0 "[ . 1 . 2 . 3]" 1 613 1 155 ALA MB 1 156 GLY H 6.000 . 6.000 2.980 2.957 2.999 . 0 0 "[ . 1 . 2 . 3]" 1 614 1 155 ALA MB 1 157 ARG H 6.000 . 6.000 2.649 2.533 2.695 . 0 0 "[ . 1 . 2 . 3]" 1 615 1 155 ALA MB 1 158 ILE H 6.000 . 6.000 4.691 4.635 4.714 . 0 0 "[ . 1 . 2 . 3]" 1 616 1 118 GLY H 1 158 ILE MD 6.000 . 6.000 3.172 3.098 3.233 . 0 0 "[ . 1 . 2 . 3]" 1 617 1 152 ASP H 1 158 ILE MD 6.000 . 6.000 4.126 4.094 4.155 . 0 0 "[ . 1 . 2 . 3]" 1 618 1 153 LEU H 1 158 ILE MD 6.000 . 6.000 2.455 2.426 2.488 . 0 0 "[ . 1 . 2 . 3]" 1 619 1 154 THR H 1 158 ILE MD 6.000 . 6.000 4.704 4.690 4.717 . 0 0 "[ . 1 . 2 . 3]" 1 620 1 155 ALA H 1 158 ILE MD 6.000 . 6.000 5.447 5.417 5.478 . 0 0 "[ . 1 . 2 . 3]" 1 621 1 156 GLY H 1 158 ILE MD 6.000 . 6.000 5.292 5.256 5.325 . 0 0 "[ . 1 . 2 . 3]" 1 622 1 157 ARG H 1 158 ILE MD 6.000 . 6.000 5.153 5.127 5.179 . 0 0 "[ . 1 . 2 . 3]" 1 623 1 158 ILE H 1 158 ILE MD 4.000 . 4.000 3.847 3.831 3.863 . 0 0 "[ . 1 . 2 . 3]" 1 624 1 158 ILE MD 1 160 ALA H 6.000 . 6.000 3.922 3.858 3.983 . 0 0 "[ . 1 . 2 . 3]" 1 625 1 158 ILE MD 1 161 ALA H 6.000 . 6.000 3.966 3.909 4.029 . 0 0 "[ . 1 . 2 . 3]" 1 626 1 116 ARG H 1 158 ILE MG 6.000 . 6.000 5.875 5.853 5.888 . 0 0 "[ . 1 . 2 . 3]" 1 627 1 118 GLY H 1 158 ILE MG 6.000 . 6.000 3.289 3.257 3.349 . 0 0 "[ . 1 . 2 . 3]" 1 628 1 156 GLY H 1 158 ILE MG 6.000 . 6.000 5.547 5.536 5.562 . 0 0 "[ . 1 . 2 . 3]" 1 629 1 158 ILE H 1 158 ILE MG 4.000 . 4.000 2.909 2.899 2.922 . 0 0 "[ . 1 . 2 . 3]" 1 630 1 98 VAL H 1 160 ALA MB 6.000 . 6.000 2.760 2.732 2.788 . 0 0 "[ . 1 . 2 . 3]" 1 631 1 116 ARG H 1 160 ALA MB 6.000 . 6.000 5.896 5.878 5.921 . 0 0 "[ . 1 . 2 . 3]" 1 632 1 117 VAL H 1 160 ALA MB 6.000 . 6.000 6.075 6.055 6.095 0.095 28 0 "[ . 1 . 2 . 3]" 1 633 1 118 GLY H 1 160 ALA MB 6.000 . 6.000 4.922 4.901 4.942 . 0 0 "[ . 1 . 2 . 3]" 1 634 1 160 ALA MB 1 162 PHE H 6.000 . 6.000 5.021 4.997 5.057 . 0 0 "[ . 1 . 2 . 3]" 1 635 1 160 ALA MB 1 163 GLN H 6.000 . 6.000 6.212 6.202 6.225 0.225 23 0 "[ . 1 . 2 . 3]" 1 636 1 150 TYR H 1 161 ALA MB 6.000 . 6.000 5.856 5.811 5.897 . 0 0 "[ . 1 . 2 . 3]" 1 637 1 161 ALA MB 1 162 PHE H 6.000 . 6.000 2.931 2.902 2.949 . 0 0 "[ . 1 . 2 . 3]" 1 638 1 165 GLU H 1 166 VAL MG1 6.000 . 6.000 5.888 5.876 5.903 . 0 0 "[ . 1 . 2 . 3]" 1 639 1 166 VAL H 1 166 VAL MG1 4.000 . 4.000 3.736 3.735 3.737 . 0 0 "[ . 1 . 2 . 3]" 1 640 1 166 VAL MG1 1 167 ALA H 6.000 . 6.000 3.126 3.114 3.154 . 0 0 "[ . 1 . 2 . 3]" 1 641 1 166 VAL MG1 1 168 ALA H 6.000 . 6.000 4.831 4.820 4.844 . 0 0 "[ . 1 . 2 . 3]" 1 642 1 166 VAL MG1 1 170 GLU H 6.000 . 6.000 3.808 3.789 3.841 . 0 0 "[ . 1 . 2 . 3]" 1 643 1 92 ALA H 1 166 VAL MG2 6.000 . 6.000 3.894 3.839 4.092 . 0 0 "[ . 1 . 2 . 3]" 1 644 1 166 VAL H 1 166 VAL MG2 4.000 . 4.000 2.211 2.185 2.226 . 0 0 "[ . 1 . 2 . 3]" 1 645 1 166 VAL MG2 1 167 ALA H 6.000 . 6.000 3.857 3.851 3.864 . 0 0 "[ . 1 . 2 . 3]" 1 646 1 166 VAL MG2 1 168 ALA H 6.000 . 6.000 5.351 5.345 5.358 . 0 0 "[ . 1 . 2 . 3]" 1 647 1 166 VAL MG2 1 170 GLU H 6.000 . 6.000 5.128 5.084 5.170 . 0 0 "[ . 1 . 2 . 3]" 1 648 1 164 ASP H 1 167 ALA MB 6.000 . 6.000 3.044 3.006 3.078 . 0 0 "[ . 1 . 2 . 3]" 1 649 1 166 VAL H 1 167 ALA MB 6.000 . 6.000 4.430 4.422 4.436 . 0 0 "[ . 1 . 2 . 3]" 1 650 1 167 ALA MB 1 171 GLY H 6.000 . 6.000 4.761 4.735 4.808 . 0 0 "[ . 1 . 2 . 3]" 1 651 1 96 ARG H 1 168 ALA MB 6.000 . 6.000 5.332 5.278 5.423 . 0 0 "[ . 1 . 2 . 3]" 1 652 1 168 ALA MB 1 169 SER H 6.000 . 6.000 2.144 2.130 2.157 . 0 0 "[ . 1 . 2 . 3]" 1 653 1 168 ALA MB 1 170 GLU H 6.000 . 6.000 4.338 4.307 4.358 . 0 0 "[ . 1 . 2 . 3]" 1 654 1 168 ALA MB 1 172 PHE H 6.000 . 6.000 4.105 4.084 4.134 . 0 0 "[ . 1 . 2 . 3]" 1 655 1 168 ALA MB 1 173 LEU H 6.000 . 6.000 4.252 4.226 4.274 . 0 0 "[ . 1 . 2 . 3]" 1 656 1 168 ALA MB 1 174 LYS H 6.000 . 6.000 6.155 6.144 6.172 0.172 23 0 "[ . 1 . 2 . 3]" 1 657 1 168 ALA H 1 173 LEU MD1 6.000 . 6.000 6.385 6.361 6.398 0.398 30 0 "[ . 1 . 2 . 3]" 1 658 1 169 SER H 1 173 LEU MD1 6.000 . 6.000 3.989 3.957 4.008 . 0 0 "[ . 1 . 2 . 3]" 1 659 1 172 PHE H 1 173 LEU MD1 6.000 . 6.000 5.879 5.867 5.900 . 0 0 "[ . 1 . 2 . 3]" 1 660 1 173 LEU H 1 173 LEU MD1 4.000 . 4.000 3.477 3.469 3.483 . 0 0 "[ . 1 . 2 . 3]" 1 661 1 173 LEU MD1 1 174 LYS H 6.000 . 6.000 4.480 4.455 4.491 . 0 0 "[ . 1 . 2 . 3]" 1 662 1 173 LEU H 1 173 LEU MD2 4.000 . 4.000 3.378 3.358 3.389 . 0 0 "[ . 1 . 2 . 3]" 1 663 1 173 LEU MD2 1 174 LYS H 6.000 . 6.000 4.666 4.657 4.675 . 0 0 "[ . 1 . 2 . 3]" 1 664 1 173 LEU MD2 1 175 GLN H 6.000 . 6.000 4.899 4.889 4.914 . 0 0 "[ . 1 . 2 . 3]" 1 665 1 173 LEU MD2 1 180 ASP H 6.000 . 6.000 6.039 5.988 6.076 0.076 28 0 "[ . 1 . 2 . 3]" 1 666 1 173 LEU MD2 1 181 TYR H 6.000 . 6.000 5.363 5.274 5.449 . 0 0 "[ . 1 . 2 . 3]" 1 667 1 173 LEU H 1 177 VAL MG1 6.000 . 6.000 6.200 6.127 6.278 0.278 23 0 "[ . 1 . 2 . 3]" 1 668 1 175 GLN H 1 177 VAL MG1 6.000 . 6.000 5.741 5.708 5.816 . 0 0 "[ . 1 . 2 . 3]" 1 669 1 177 VAL H 1 177 VAL MG1 4.000 . 4.000 3.739 3.735 3.742 . 0 0 "[ . 1 . 2 . 3]" 1 670 1 177 VAL MG1 1 178 GLY H 6.000 . 6.000 3.323 3.280 3.349 . 0 0 "[ . 1 . 2 . 3]" 1 671 1 177 VAL MG1 1 179 LYS H 6.000 . 6.000 4.784 4.767 4.811 . 0 0 "[ . 1 . 2 . 3]" 1 672 1 177 VAL MG1 1 180 ASP H 6.000 . 6.000 4.471 4.438 4.502 . 0 0 "[ . 1 . 2 . 3]" 1 673 1 177 VAL MG1 1 181 TYR H 6.000 . 6.000 4.233 4.192 4.287 . 0 0 "[ . 1 . 2 . 3]" 1 674 1 177 VAL H 1 177 VAL MG2 4.000 . 4.000 2.163 2.127 2.210 . 0 0 "[ . 1 . 2 . 3]" 1 675 1 177 VAL MG2 1 178 GLY H 6.000 . 6.000 3.891 3.870 3.922 . 0 0 "[ . 1 . 2 . 3]" 1 676 1 177 VAL MG2 1 181 TYR H 6.000 . 6.000 6.077 6.052 6.106 0.106 23 0 "[ . 1 . 2 . 3]" 1 677 1 96 ARG H 1 188 VAL MG1 6.000 . 6.000 6.178 6.148 6.214 0.214 8 0 "[ . 1 . 2 . 3]" 1 678 1 188 VAL H 1 188 VAL MG1 4.000 . 4.000 2.375 2.361 2.404 . 0 0 "[ . 1 . 2 . 3]" 1 679 1 188 VAL MG1 1 189 LYS H 6.000 . 6.000 3.473 3.450 3.526 . 0 0 "[ . 1 . 2 . 3]" 1 680 1 188 VAL H 1 188 VAL MG2 4.000 . 4.000 3.959 3.942 3.965 . 0 0 "[ . 1 . 2 . 3]" 1 681 1 188 VAL MG2 1 189 LYS H 6.000 . 6.000 1.697 1.687 1.708 0.113 30 0 "[ . 1 . 2 . 3]" 1 682 1 125 GLN H 1 193 LEU MD1 6.000 . 6.000 4.508 4.459 4.535 . 0 0 "[ . 1 . 2 . 3]" 1 683 1 128 PHE H 1 193 LEU MD1 6.000 . 6.000 4.072 4.044 4.160 . 0 0 "[ . 1 . 2 . 3]" 1 684 1 132 HIS H 1 193 LEU MD1 6.000 . 6.500 6.392 6.365 6.428 . 0 0 "[ . 1 . 2 . 3]" 1 685 1 192 LYS H 1 193 LEU MD1 6.000 . 6.000 4.982 4.949 4.999 . 0 0 "[ . 1 . 2 . 3]" 1 686 1 193 LEU H 1 193 LEU MD1 4.000 . 4.000 3.428 3.406 3.439 . 0 0 "[ . 1 . 2 . 3]" 1 687 1 190 ASP H 1 193 LEU MD2 6.000 . 6.500 5.427 5.343 5.482 . 0 0 "[ . 1 . 2 . 3]" 1 688 1 196 VAL H 1 196 VAL MG1 4.000 . 4.000 1.954 1.926 1.989 . 0 0 "[ . 1 . 2 . 3]" 1 689 1 196 VAL MG1 1 197 GLY H 6.000 . 6.000 2.272 2.245 2.291 . 0 0 "[ . 1 . 2 . 3]" 1 690 1 196 VAL H 1 196 VAL MG2 4.000 . 4.000 3.756 3.754 3.759 . 0 0 "[ . 1 . 2 . 3]" 1 691 1 196 VAL MG2 1 197 GLY H 6.000 . 6.000 3.808 3.791 3.828 . 0 0 "[ . 1 . 2 . 3]" 1 692 1 92 ALA H 1 198 THR MG 6.000 . 6.000 5.934 5.816 5.996 . 0 0 "[ . 1 . 2 . 3]" 1 693 1 93 ALA H 1 198 THR MG 6.000 . 6.000 4.034 3.959 4.090 . 0 0 "[ . 1 . 2 . 3]" 1 694 1 198 THR H 1 198 THR MG 4.000 . 4.000 2.708 2.668 2.739 . 0 0 "[ . 1 . 2 . 3]" 1 695 1 198 THR MG 1 199 GLY H 6.000 . 6.000 3.937 3.918 3.961 . 0 0 "[ . 1 . 2 . 3]" 1 696 1 200 MET H 1 202 LEU MD1 6.000 . 6.000 4.979 4.875 5.051 . 0 0 "[ . 1 . 2 . 3]" 1 697 1 202 LEU H 1 202 LEU MD1 4.000 . 4.000 3.969 3.934 3.999 . 0 0 "[ . 1 . 2 . 3]" 1 698 1 202 LEU MD1 1 203 ARG H 6.000 . 6.000 4.543 4.527 4.566 . 0 0 "[ . 1 . 2 . 3]" 1 699 1 202 LEU MD1 1 210 ARG H 6.000 . 6.000 4.594 4.526 4.676 . 0 0 "[ . 1 . 2 . 3]" 1 700 1 202 LEU MD1 1 214 ASN H 6.000 . 6.000 5.646 5.555 5.793 . 0 0 "[ . 1 . 2 . 3]" 1 701 1 85 ALA H 1 202 LEU MD2 6.000 . 6.000 5.917 5.897 5.941 . 0 0 "[ . 1 . 2 . 3]" 1 702 1 87 THR H 1 202 LEU MD1 6.000 . 6.000 4.037 3.984 4.109 . 0 0 "[ . 1 . 2 . 3]" 1 703 1 87 THR H 1 202 LEU MD2 6.000 . 6.000 5.480 5.393 5.625 . 0 0 "[ . 1 . 2 . 3]" 1 704 1 200 MET H 1 202 LEU MD2 6.000 . 6.000 5.776 5.635 5.933 . 0 0 "[ . 1 . 2 . 3]" 1 705 1 202 LEU H 1 202 LEU MD2 4.000 . 4.000 3.660 3.591 3.737 . 0 0 "[ . 1 . 2 . 3]" 1 706 1 202 LEU MD2 1 203 ARG H 6.000 . 6.000 3.341 3.305 3.385 . 0 0 "[ . 1 . 2 . 3]" 1 707 1 202 LEU MD2 1 206 ASP H 6.000 . 6.000 6.138 6.072 6.185 0.185 21 0 "[ . 1 . 2 . 3]" 1 708 1 209 LEU H 1 209 LEU MD1 4.000 . 4.000 4.000 3.973 4.015 0.015 1 0 "[ . 1 . 2 . 3]" 1 709 1 209 LEU MD1 1 211 GLU H 6.000 . 6.000 5.467 5.411 5.552 . 0 0 "[ . 1 . 2 . 3]" 1 710 1 209 LEU MD1 1 212 ALA H 6.000 . 6.000 4.270 4.189 4.344 . 0 0 "[ . 1 . 2 . 3]" 1 711 1 209 LEU MD1 1 213 LEU H 6.000 . 6.000 3.057 2.993 3.193 . 0 0 "[ . 1 . 2 . 3]" 1 712 1 209 LEU H 1 212 ALA MB 6.000 . 6.000 4.910 4.896 4.924 . 0 0 "[ . 1 . 2 . 3]" 1 713 1 211 GLU H 1 212 ALA MB 6.000 . 6.000 4.406 4.394 4.413 . 0 0 "[ . 1 . 2 . 3]" 1 714 1 212 ALA MB 1 215 LYS H 6.000 . 6.000 4.279 4.270 4.287 . 0 0 "[ . 1 . 2 . 3]" 1 715 1 41 CYS H 1 216 ALA MB 6.000 . 6.000 6.103 6.067 6.131 0.131 21 0 "[ . 1 . 2 . 3]" 1 716 1 216 ALA MB 1 217 PHE H 6.000 . 6.000 2.559 2.537 2.580 . 0 0 "[ . 1 . 2 . 3]" 1 717 1 218 ALA MB 1 219 GLU H 6.000 . 6.000 2.561 2.533 2.592 . 0 0 "[ . 1 . 2 . 3]" 1 718 1 218 ALA MB 1 220 MET H 6.000 . 6.000 4.569 4.558 4.586 . 0 0 "[ . 1 . 2 . 3]" 1 719 1 218 ALA MB 1 222 ALA H 6.000 . 6.000 4.635 4.588 4.663 . 0 0 "[ . 1 . 2 . 3]" 1 720 1 220 MET H 1 222 ALA MB 6.000 . 6.000 4.738 4.719 4.771 . 0 0 "[ . 1 . 2 . 3]" 1 721 1 221 ARG H 1 222 ALA MB 6.000 . 6.000 4.228 4.218 4.245 . 0 0 "[ . 1 . 2 . 3]" 1 722 1 222 ALA MB 1 223 ASP H 6.000 . 6.000 2.416 2.398 2.440 . 0 0 "[ . 1 . 2 . 3]" 1 723 1 222 ALA MB 1 224 GLY H 6.000 . 6.000 4.082 4.069 4.091 . 0 0 "[ . 1 . 2 . 3]" 1 724 1 40 LEU H 1 225 THR MG 6.000 . 6.500 6.903 6.837 6.934 0.434 26 0 "[ . 1 . 2 . 3]" 1 725 1 220 MET H 1 225 THR MG 6.000 . 6.000 5.615 5.591 5.642 . 0 0 "[ . 1 . 2 . 3]" 1 726 1 225 THR H 1 225 THR MG 4.000 . 4.000 3.745 3.743 3.746 . 0 0 "[ . 1 . 2 . 3]" 1 727 1 225 THR MG 1 228 LYS H 6.000 . 6.000 4.937 4.859 4.967 . 0 0 "[ . 1 . 2 . 3]" 1 728 1 39 GLU H 1 229 LEU MD1 6.000 . 6.000 5.788 5.530 5.880 . 0 0 "[ . 1 . 2 . 3]" 1 729 1 228 LYS H 1 229 LEU MD1 6.000 . 6.000 5.258 5.229 5.275 . 0 0 "[ . 1 . 2 . 3]" 1 730 1 229 LEU H 1 229 LEU MD1 4.000 . 4.000 3.417 3.403 3.434 . 0 0 "[ . 1 . 2 . 3]" 1 731 1 229 LEU MD1 1 230 ALA H 6.000 . 6.000 4.454 4.442 4.510 . 0 0 "[ . 1 . 2 . 3]" 1 732 1 229 LEU H 1 229 LEU MD2 4.000 . 4.000 3.579 3.555 3.592 . 0 0 "[ . 1 . 2 . 3]" 1 733 1 226 TYR H 1 230 ALA MB 6.000 . 6.000 6.238 6.165 6.269 0.269 12 0 "[ . 1 . 2 . 3]" 1 734 1 227 GLU H 1 230 ALA MB 6.000 . 6.000 4.538 4.521 4.578 . 0 0 "[ . 1 . 2 . 3]" 1 735 1 228 LYS H 1 230 ALA MB 6.000 . 6.000 4.631 4.603 4.710 . 0 0 "[ . 1 . 2 . 3]" 1 736 1 229 LEU H 1 230 ALA MB 6.000 . 6.000 4.316 4.305 4.333 . 0 0 "[ . 1 . 2 . 3]" 1 737 1 230 ALA MB 1 231 LYS H 6.000 . 6.000 2.361 2.296 2.397 . 0 0 "[ . 1 . 2 . 3]" 1 738 1 230 ALA MB 1 232 LYS H 6.000 . 6.000 4.317 4.297 4.337 . 0 0 "[ . 1 . 2 . 3]" 1 739 1 230 ALA MB 1 233 TYR H 6.000 . 6.000 4.731 4.715 4.765 . 0 0 "[ . 1 . 2 . 3]" 1 740 1 230 ALA MB 1 236 PHE H 6.000 . 6.000 4.521 4.442 4.619 . 0 0 "[ . 1 . 2 . 3]" 1 741 1 230 ALA MB 1 238 VAL H 6.000 . 6.000 4.316 4.272 4.376 . 0 0 "[ . 1 . 2 . 3]" 1 742 1 166 VAL H 1 238 VAL MG1 6.000 . 6.000 6.053 6.016 6.103 0.103 12 0 "[ . 1 . 2 . 3]" 1 743 1 234 PHE H 1 238 VAL MG1 6.000 . 6.500 6.381 6.299 6.439 . 0 0 "[ . 1 . 2 . 3]" 1 744 1 238 VAL H 1 238 VAL MG1 4.000 . 4.000 2.205 2.167 2.238 . 0 0 "[ . 1 . 2 . 3]" 1 745 1 238 VAL MG1 1 239 TYR H 6.000 . 6.000 3.920 3.904 3.939 . 0 0 "[ . 1 . 2 . 3]" 1 746 1 238 VAL MG1 1 240 GLY H 6.000 . 6.000 5.446 5.411 5.462 . 0 0 "[ . 1 . 2 . 3]" 1 747 1 92 ALA H 1 238 VAL MG2 6.000 . 6.000 5.117 4.994 5.189 . 0 0 "[ . 1 . 2 . 3]" 1 748 1 238 VAL H 1 238 VAL MG2 4.000 . 4.000 1.774 1.760 1.789 0.040 21 0 "[ . 1 . 2 . 3]" 1 749 1 238 VAL MG2 1 239 TYR H 6.000 . 6.000 1.967 1.962 1.974 . 0 0 "[ . 1 . 2 . 3]" 1 750 1 5 ILE MD 1 9 ILE MG 8.000 . 8.000 7.123 7.044 7.194 . 0 0 "[ . 1 . 2 . 3]" 1 751 1 5 ILE MD 1 212 ALA MB 8.000 . 8.000 4.701 4.585 4.862 . 0 0 "[ . 1 . 2 . 3]" 1 752 1 5 ILE MG 1 44 ILE MD 8.000 . 8.000 4.514 4.482 4.569 . 0 0 "[ . 1 . 2 . 3]" 1 753 1 9 ILE MG 1 40 LEU MD1 8.000 . 8.000 6.056 5.999 6.118 . 0 0 "[ . 1 . 2 . 3]" 1 754 1 9 ILE MG 1 209 LEU MD1 8.000 . 8.000 4.132 3.963 4.303 . 0 0 "[ . 1 . 2 . 3]" 1 755 1 9 ILE MD 1 11 ILE MD 8.000 . 8.000 4.037 3.973 4.106 . 0 0 "[ . 1 . 2 . 3]" 1 756 1 9 ILE MG 1 11 ILE MD 8.000 . 8.000 2.964 2.892 3.003 . 0 0 "[ . 1 . 2 . 3]" 1 757 1 11 ILE MD 1 29 LEU MD1 8.000 . 8.000 6.156 6.048 6.231 . 0 0 "[ . 1 . 2 . 3]" 1 758 1 11 ILE MD 1 29 LEU MD2 8.000 . 8.000 8.038 7.881 8.084 0.084 15 0 "[ . 1 . 2 . 3]" 1 759 1 11 ILE MD 1 34 ILE MD 8.000 . 8.000 6.410 6.318 6.506 . 0 0 "[ . 1 . 2 . 3]" 1 760 1 11 ILE MD 1 51 VAL MG2 8.000 . 8.000 6.237 6.170 6.293 . 0 0 "[ . 1 . 2 . 3]" 1 761 1 11 ILE MD 1 67 ILE MG 8.000 . 8.000 6.827 6.719 6.911 . 0 0 "[ . 1 . 2 . 3]" 1 762 1 11 ILE MD 1 69 ALA MB 8.000 . 8.000 3.607 3.567 3.632 . 0 0 "[ . 1 . 2 . 3]" 1 763 1 11 ILE MD 1 202 LEU MD2 8.000 . 8.000 5.471 5.284 5.658 . 0 0 "[ . 1 . 2 . 3]" 1 764 1 11 ILE MD 1 209 LEU MD1 8.000 . 8.000 6.275 6.175 6.385 . 0 0 "[ . 1 . 2 . 3]" 1 765 1 11 ILE MG 1 40 LEU MD1 8.000 . 8.000 6.005 5.944 6.073 . 0 0 "[ . 1 . 2 . 3]" 1 766 1 11 ILE MG 1 70 ILE MG 8.000 . 8.000 4.574 4.443 4.659 . 0 0 "[ . 1 . 2 . 3]" 1 767 1 11 ILE MG 1 209 LEU MD1 8.000 . 8.000 7.857 7.691 8.009 0.009 12 0 "[ . 1 . 2 . 3]" 1 768 1 13 THR MG 1 29 LEU MD1 8.000 . 8.000 4.858 4.696 5.025 . 0 0 "[ . 1 . 2 . 3]" 1 769 1 13 THR MG 1 29 LEU MD2 8.000 . 8.000 5.180 5.065 5.273 . 0 0 "[ . 1 . 2 . 3]" 1 770 1 13 THR MG 1 30 VAL MG1 8.000 . 8.500 6.839 6.722 7.017 . 0 0 "[ . 1 . 2 . 3]" 1 771 1 13 THR MG 1 34 ILE MD 8.000 . 8.000 3.515 3.431 3.603 . 0 0 "[ . 1 . 2 . 3]" 1 772 1 13 THR MG 1 67 ILE MG 8.000 . 8.000 7.555 7.513 7.606 . 0 0 "[ . 1 . 2 . 3]" 1 773 1 16 THR MG 1 29 LEU MD2 8.000 . 8.000 8.119 8.088 8.161 0.161 5 0 "[ . 1 . 2 . 3]" 1 774 1 18 ALA MB 1 30 VAL MG1 8.000 . 8.000 6.056 5.919 6.163 . 0 0 "[ . 1 . 2 . 3]" 1 775 1 18 ALA MB 1 30 VAL MG2 8.000 . 8.000 6.664 6.601 6.715 . 0 0 "[ . 1 . 2 . 3]" 1 776 1 29 LEU MD1 1 34 ILE MD 8.000 . 8.000 3.467 3.256 3.605 . 0 0 "[ . 1 . 2 . 3]" 1 777 1 29 LEU MD1 1 34 ILE MG 8.000 . 8.000 4.208 3.972 4.308 . 0 0 "[ . 1 . 2 . 3]" 1 778 1 29 LEU MD2 1 34 ILE MD 8.000 . 8.000 3.510 3.185 3.646 . 0 0 "[ . 1 . 2 . 3]" 1 779 1 29 LEU MD2 1 34 ILE MG 8.000 . 8.000 5.059 4.767 5.193 . 0 0 "[ . 1 . 2 . 3]" 1 780 1 29 LEU MD1 1 30 VAL MG1 8.000 . 8.000 5.958 5.893 6.005 . 0 0 "[ . 1 . 2 . 3]" 1 781 1 29 LEU MD2 1 30 VAL MG1 8.000 . 8.000 4.410 4.292 4.471 . 0 0 "[ . 1 . 2 . 3]" 1 782 1 30 VAL MG1 1 34 ILE MG 8.000 . 8.000 5.248 5.193 5.284 . 0 0 "[ . 1 . 2 . 3]" 1 783 1 36 LEU MD1 1 40 LEU MD1 8.000 . 8.000 3.075 2.978 3.096 . 0 0 "[ . 1 . 2 . 3]" 1 784 1 36 LEU MD1 1 76 ILE MG 8.000 . 8.500 8.919 8.885 8.973 0.473 5 0 "[ . 1 . 2 . 3]" 1 785 1 36 LEU MD2 1 225 THR MG 8.000 . 8.000 6.491 6.397 6.585 . 0 0 "[ . 1 . 2 . 3]" 1 786 1 36 LEU MD2 1 238 VAL MG1 8.000 . 8.000 7.387 7.252 7.508 . 0 0 "[ . 1 . 2 . 3]" 1 787 1 9 ILE MG 1 37 ALA MB 8.000 . 8.000 5.288 5.220 5.362 . 0 0 "[ . 1 . 2 . 3]" 1 788 1 11 ILE MD 1 37 ALA MB 8.000 . 8.000 2.443 2.344 2.505 . 0 0 "[ . 1 . 2 . 3]" 1 789 1 34 ILE MG 1 37 ALA MB 8.000 . 8.000 3.227 3.194 3.259 . 0 0 "[ . 1 . 2 . 3]" 1 790 1 36 LEU MD1 1 37 ALA MB 8.000 . 8.000 5.271 5.234 5.302 . 0 0 "[ . 1 . 2 . 3]" 1 791 1 37 ALA MB 1 69 ALA MB 8.000 . 8.000 5.467 5.404 5.561 . 0 0 "[ . 1 . 2 . 3]" 1 792 1 37 ALA MB 1 40 LEU MD1 8.000 . 8.000 3.663 3.609 3.750 . 0 0 "[ . 1 . 2 . 3]" 1 793 1 9 ILE MD 1 40 LEU MD2 8.000 . 8.000 6.136 6.073 6.184 . 0 0 "[ . 1 . 2 . 3]" 1 794 1 36 LEU MD1 1 40 LEU MD2 8.000 . 8.000 3.474 3.427 3.515 . 0 0 "[ . 1 . 2 . 3]" 1 795 1 40 LEU MD2 1 44 ILE MD 8.000 . 8.000 3.477 3.434 3.529 . 0 0 "[ . 1 . 2 . 3]" 1 796 1 40 LEU MD2 1 44 ILE MG 8.000 . 8.000 5.681 5.644 5.712 . 0 0 "[ . 1 . 2 . 3]" 1 797 1 40 LEU MD2 1 202 LEU MD2 8.000 . 8.000 7.170 6.983 7.474 . 0 0 "[ . 1 . 2 . 3]" 1 798 1 40 LEU MD2 1 209 LEU MD1 8.000 . 8.000 5.321 5.265 5.402 . 0 0 "[ . 1 . 2 . 3]" 1 799 1 40 LEU MD2 1 212 ALA MB 8.000 . 8.000 4.902 4.808 4.994 . 0 0 "[ . 1 . 2 . 3]" 1 800 1 5 ILE MD 1 44 ILE MD 8.000 . 8.000 5.060 5.014 5.106 . 0 0 "[ . 1 . 2 . 3]" 1 801 1 40 LEU MD1 1 44 ILE MG 8.000 . 8.000 6.279 6.224 6.317 . 0 0 "[ . 1 . 2 . 3]" 1 802 1 44 ILE MG 1 216 ALA MB 8.000 . 8.000 5.697 5.593 5.813 . 0 0 "[ . 1 . 2 . 3]" 1 803 1 5 ILE MD 1 46 THR MG 8.000 . 8.000 2.159 2.146 2.170 . 0 0 "[ . 1 . 2 . 3]" 1 804 1 5 ILE MG 1 46 THR MG 8.000 . 8.000 3.230 3.184 3.269 . 0 0 "[ . 1 . 2 . 3]" 1 805 1 9 ILE MD 1 46 THR MG 8.000 . 8.000 2.932 2.855 2.997 . 0 0 "[ . 1 . 2 . 3]" 1 806 1 9 ILE MG 1 46 THR MG 8.000 . 8.000 5.186 5.143 5.228 . 0 0 "[ . 1 . 2 . 3]" 1 807 1 44 ILE MD 1 46 THR MG 8.000 . 8.000 4.302 4.273 4.338 . 0 0 "[ . 1 . 2 . 3]" 1 808 1 44 ILE MG 1 46 THR MG 8.000 . 8.000 2.100 2.084 2.118 . 0 0 "[ . 1 . 2 . 3]" 1 809 1 46 THR MG 1 209 LEU MD1 8.000 . 8.000 4.436 4.329 4.531 . 0 0 "[ . 1 . 2 . 3]" 1 810 1 46 THR MG 1 212 ALA MB 8.000 . 8.000 5.902 5.802 6.002 . 0 0 "[ . 1 . 2 . 3]" 1 811 1 49 THR MG 1 51 VAL MG1 8.000 . 8.000 4.713 4.699 4.735 . 0 0 "[ . 1 . 2 . 3]" 1 812 1 49 THR MG 1 51 VAL MG2 8.000 . 8.000 2.373 2.342 2.414 . 0 0 "[ . 1 . 2 . 3]" 1 813 1 13 THR MG 1 51 VAL MG2 8.000 . 8.000 7.211 7.178 7.229 . 0 0 "[ . 1 . 2 . 3]" 1 814 1 55 LEU MD1 1 58 LEU MD1 8.000 . 8.000 4.025 4.008 4.055 . 0 0 "[ . 1 . 2 . 3]" 1 815 1 55 LEU MD1 1 59 ILE MD 8.000 . 8.000 6.960 6.863 7.001 . 0 0 "[ . 1 . 2 . 3]" 1 816 1 55 LEU MD1 1 70 ILE MG 8.000 . 8.000 5.244 5.215 5.277 . 0 0 "[ . 1 . 2 . 3]" 1 817 1 55 LEU MD1 1 74 LEU MD1 8.000 . 8.000 2.920 2.818 3.035 . 0 0 "[ . 1 . 2 . 3]" 1 818 1 55 LEU MD1 1 74 LEU MD2 8.000 . 8.000 4.419 4.301 4.544 . 0 0 "[ . 1 . 2 . 3]" 1 819 1 55 LEU MD2 1 57 ALA MB 8.000 . 8.000 5.926 5.913 5.935 . 0 0 "[ . 1 . 2 . 3]" 1 820 1 55 LEU MD2 1 58 LEU MD1 8.000 . 8.000 1.904 1.889 1.919 . 0 0 "[ . 1 . 2 . 3]" 1 821 1 55 LEU MD2 1 59 ILE MD 8.000 . 8.000 5.739 5.540 5.786 . 0 0 "[ . 1 . 2 . 3]" 1 822 1 55 LEU MD2 1 59 ILE MG 8.000 . 8.000 6.732 6.711 6.757 . 0 0 "[ . 1 . 2 . 3]" 1 823 1 55 LEU MD2 1 74 LEU MD1 8.000 . 8.000 3.035 2.944 3.102 . 0 0 "[ . 1 . 2 . 3]" 1 824 1 57 ALA MB 1 67 ILE MG 8.000 . 8.000 5.439 5.339 5.534 . 0 0 "[ . 1 . 2 . 3]" 1 825 1 57 ALA MB 1 70 ILE MG 8.000 . 8.000 6.408 6.356 6.436 . 0 0 "[ . 1 . 2 . 3]" 1 826 1 11 ILE MG 1 58 LEU MD1 8.000 . 8.000 5.075 4.962 5.123 . 0 0 "[ . 1 . 2 . 3]" 1 827 1 58 LEU MD1 1 67 ILE MG 8.000 . 8.000 5.244 5.205 5.305 . 0 0 "[ . 1 . 2 . 3]" 1 828 1 58 LEU MD1 1 69 ALA MB 8.000 . 8.000 6.664 6.636 6.692 . 0 0 "[ . 1 . 2 . 3]" 1 829 1 58 LEU MD1 1 70 ILE MD 8.000 . 8.000 3.700 3.636 3.734 . 0 0 "[ . 1 . 2 . 3]" 1 830 1 58 LEU MD1 1 70 ILE MG 8.000 . 8.000 2.057 2.041 2.068 . 0 0 "[ . 1 . 2 . 3]" 1 831 1 55 LEU MD1 1 58 LEU MD2 8.000 . 8.000 6.141 6.077 6.183 . 0 0 "[ . 1 . 2 . 3]" 1 832 1 57 ALA MB 1 58 LEU MD2 8.000 . 8.000 3.996 3.760 4.102 . 0 0 "[ . 1 . 2 . 3]" 1 833 1 58 LEU MD2 1 59 ILE MD 8.000 . 8.000 6.230 5.876 6.369 . 0 0 "[ . 1 . 2 . 3]" 1 834 1 58 LEU MD2 1 74 LEU MD1 8.000 . 8.000 6.948 6.801 7.111 . 0 0 "[ . 1 . 2 . 3]" 1 835 1 59 ILE MD 1 62 LEU MD1 8.000 . 8.000 5.451 5.183 5.545 . 0 0 "[ . 1 . 2 . 3]" 1 836 1 59 ILE MD 1 84 ILE MD 8.000 . 8.000 3.071 2.901 3.168 . 0 0 "[ . 1 . 2 . 3]" 1 837 1 59 ILE MD 1 84 ILE MG 8.000 . 8.000 3.876 3.737 3.985 . 0 0 "[ . 1 . 2 . 3]" 1 838 1 59 ILE MG 1 64 ALA MB 8.000 . 8.000 6.369 6.333 6.390 . 0 0 "[ . 1 . 2 . 3]" 1 839 1 59 ILE MG 1 84 ILE MG 8.000 . 8.000 4.981 4.876 5.054 . 0 0 "[ . 1 . 2 . 3]" 1 840 1 62 LEU MD1 1 69 ALA MB 8.000 . 8.000 4.386 4.270 4.497 . 0 0 "[ . 1 . 2 . 3]" 1 841 1 62 LEU MD1 1 209 LEU MD2 8.000 . 8.000 5.854 5.646 5.955 . 0 0 "[ . 1 . 2 . 3]" 1 842 1 11 ILE MG 1 62 LEU MD2 8.000 . 8.000 7.394 7.247 7.498 . 0 0 "[ . 1 . 2 . 3]" 1 843 1 59 ILE MG 1 62 LEU MD2 8.000 . 8.000 4.379 4.306 4.509 . 0 0 "[ . 1 . 2 . 3]" 1 844 1 62 LEU MD2 1 67 ILE MG 8.000 . 8.000 6.082 6.053 6.115 . 0 0 "[ . 1 . 2 . 3]" 1 845 1 62 LEU MD2 1 69 ALA MB 8.000 . 8.000 5.246 5.077 5.340 . 0 0 "[ . 1 . 2 . 3]" 1 846 1 62 LEU MD2 1 74 LEU MD1 8.000 . 8.000 7.407 7.238 7.631 . 0 0 "[ . 1 . 2 . 3]" 1 847 1 62 LEU MD2 1 74 LEU MD2 8.000 . 8.000 5.512 5.375 5.687 . 0 0 "[ . 1 . 2 . 3]" 1 848 1 62 LEU MD2 1 84 ILE MD 8.000 . 8.000 2.704 2.549 2.901 . 0 0 "[ . 1 . 2 . 3]" 1 849 1 62 LEU MD2 1 84 ILE MG 8.000 . 8.000 2.914 2.736 3.074 . 0 0 "[ . 1 . 2 . 3]" 1 850 1 62 LEU MD2 1 202 LEU MD1 8.000 . 8.000 5.964 5.679 6.120 . 0 0 "[ . 1 . 2 . 3]" 1 851 1 62 LEU MD2 1 202 LEU MD2 8.000 . 8.000 4.099 3.750 4.352 . 0 0 "[ . 1 . 2 . 3]" 1 852 1 64 ALA MB 1 67 ILE MG 8.000 . 8.000 5.208 5.194 5.234 . 0 0 "[ . 1 . 2 . 3]" 1 853 1 58 LEU MD2 1 67 ILE MD 8.000 . 8.000 2.264 2.198 2.371 . 0 0 "[ . 1 . 2 . 3]" 1 854 1 67 ILE MD 1 70 ILE MD 8.000 . 8.000 2.464 2.391 2.538 . 0 0 "[ . 1 . 2 . 3]" 1 855 1 67 ILE MD 1 84 ILE MG 8.000 . 8.000 7.040 6.950 7.149 . 0 0 "[ . 1 . 2 . 3]" 1 856 1 51 VAL MG1 1 67 ILE MG 8.000 . 8.000 3.489 3.390 3.613 . 0 0 "[ . 1 . 2 . 3]" 1 857 1 67 ILE MG 1 70 ILE MG 8.000 . 8.000 5.302 5.292 5.317 . 0 0 "[ . 1 . 2 . 3]" 1 858 1 9 ILE MD 1 69 ALA MB 8.000 . 8.000 4.561 4.429 4.716 . 0 0 "[ . 1 . 2 . 3]" 1 859 1 9 ILE MG 1 69 ALA MB 8.000 . 8.000 2.900 2.750 3.067 . 0 0 "[ . 1 . 2 . 3]" 1 860 1 11 ILE MG 1 69 ALA MB 8.000 . 8.000 3.254 3.214 3.312 . 0 0 "[ . 1 . 2 . 3]" 1 861 1 58 LEU MD2 1 69 ALA MB 8.000 . 8.000 5.965 5.852 6.214 . 0 0 "[ . 1 . 2 . 3]" 1 862 1 69 ALA MB 1 70 ILE MD 8.000 . 8.000 5.296 5.244 5.320 . 0 0 "[ . 1 . 2 . 3]" 1 863 1 69 ALA MB 1 202 LEU MD1 8.000 . 8.000 3.459 3.352 3.523 . 0 0 "[ . 1 . 2 . 3]" 1 864 1 69 ALA MB 1 202 LEU MD2 8.000 . 8.000 1.909 1.840 1.966 . 0 0 "[ . 1 . 2 . 3]" 1 865 1 69 ALA MB 1 209 LEU MD1 8.000 . 8.000 5.039 4.848 5.215 . 0 0 "[ . 1 . 2 . 3]" 1 866 1 69 ALA MB 1 209 LEU MD2 8.000 . 8.000 3.458 3.297 3.601 . 0 0 "[ . 1 . 2 . 3]" 1 867 1 59 ILE MD 1 70 ILE MD 8.000 . 8.000 3.126 2.689 3.275 . 0 0 "[ . 1 . 2 . 3]" 1 868 1 59 ILE MG 1 70 ILE MD 8.000 . 8.000 4.265 4.191 4.345 . 0 0 "[ . 1 . 2 . 3]" 1 869 1 62 LEU MD1 1 70 ILE MD 8.000 . 8.000 3.359 3.290 3.454 . 0 0 "[ . 1 . 2 . 3]" 1 870 1 62 LEU MD2 1 70 ILE MD 8.000 . 8.000 2.246 2.178 2.341 . 0 0 "[ . 1 . 2 . 3]" 1 871 1 67 ILE MG 1 70 ILE MD 8.000 . 8.000 4.982 4.928 5.025 . 0 0 "[ . 1 . 2 . 3]" 1 872 1 70 ILE MD 1 74 LEU MD1 8.000 . 8.000 5.379 5.173 5.561 . 0 0 "[ . 1 . 2 . 3]" 1 873 1 70 ILE MD 1 84 ILE MD 8.000 . 8.000 3.519 3.456 3.610 . 0 0 "[ . 1 . 2 . 3]" 1 874 1 70 ILE MD 1 84 ILE MG 8.000 . 8.000 4.912 4.865 4.973 . 0 0 "[ . 1 . 2 . 3]" 1 875 1 70 ILE MD 1 202 LEU MD2 8.000 . 8.000 4.752 4.418 5.032 . 0 0 "[ . 1 . 2 . 3]" 1 876 1 13 THR MG 1 70 ILE MG 8.000 . 8.000 5.541 5.500 5.575 . 0 0 "[ . 1 . 2 . 3]" 1 877 1 55 LEU MD2 1 70 ILE MG 8.000 . 8.000 3.170 3.138 3.208 . 0 0 "[ . 1 . 2 . 3]" 1 878 1 58 LEU MD2 1 70 ILE MG 8.000 . 8.000 2.710 2.567 2.927 . 0 0 "[ . 1 . 2 . 3]" 1 879 1 62 LEU MD2 1 70 ILE MG 8.000 . 8.000 4.711 4.648 4.739 . 0 0 "[ . 1 . 2 . 3]" 1 880 1 74 LEU MD1 1 77 THR MG 8.000 . 8.000 5.437 5.379 5.548 . 0 0 "[ . 1 . 2 . 3]" 1 881 1 58 LEU MD1 1 74 LEU MD2 8.000 . 8.000 4.148 4.074 4.224 . 0 0 "[ . 1 . 2 . 3]" 1 882 1 62 LEU MD1 1 74 LEU MD2 8.000 . 8.000 7.035 6.830 7.168 . 0 0 "[ . 1 . 2 . 3]" 1 883 1 70 ILE MG 1 74 LEU MD2 8.000 . 8.000 3.078 2.928 3.204 . 0 0 "[ . 1 . 2 . 3]" 1 884 1 74 LEU MD2 1 84 ILE MD 8.000 . 8.000 4.018 3.991 4.038 . 0 0 "[ . 1 . 2 . 3]" 1 885 1 76 ILE MD 1 196 VAL MG1 8.000 . 8.000 1.848 1.842 1.855 . 0 0 "[ . 1 . 2 . 3]" 1 886 1 76 ILE MD 1 196 VAL MG2 8.000 . 8.000 3.832 3.811 3.848 . 0 0 "[ . 1 . 2 . 3]" 1 887 1 76 ILE MG 1 196 VAL MG1 8.000 . 8.000 4.126 4.105 4.146 . 0 0 "[ . 1 . 2 . 3]" 1 888 1 76 ILE MG 1 196 VAL MG2 8.000 . 8.000 6.129 6.115 6.143 . 0 0 "[ . 1 . 2 . 3]" 1 889 1 76 ILE MG 1 77 THR MG 8.000 . 8.000 4.776 4.750 4.799 . 0 0 "[ . 1 . 2 . 3]" 1 890 1 77 THR MG 1 196 VAL MG1 8.000 . 8.000 5.305 5.206 5.386 . 0 0 "[ . 1 . 2 . 3]" 1 891 1 77 THR MG 1 196 VAL MG2 8.000 . 8.000 7.000 6.907 7.078 . 0 0 "[ . 1 . 2 . 3]" 1 892 1 59 ILE MG 1 84 ILE MD 8.000 . 8.000 4.851 4.737 4.950 . 0 0 "[ . 1 . 2 . 3]" 1 893 1 84 ILE MD 1 202 LEU MD2 8.000 . 8.000 4.925 4.874 4.973 . 0 0 "[ . 1 . 2 . 3]" 1 894 1 74 LEU MD1 1 84 ILE MG 8.000 . 8.000 7.718 7.672 7.768 . 0 0 "[ . 1 . 2 . 3]" 1 895 1 62 LEU MD1 1 85 ALA MB 8.000 . 8.000 6.448 6.335 6.562 . 0 0 "[ . 1 . 2 . 3]" 1 896 1 76 ILE MD 1 85 ALA MB 8.000 . 8.000 7.013 6.978 7.045 . 0 0 "[ . 1 . 2 . 3]" 1 897 1 76 ILE MG 1 85 ALA MB 8.000 . 8.000 6.626 6.614 6.634 . 0 0 "[ . 1 . 2 . 3]" 1 898 1 9 ILE MD 1 87 THR MG 8.000 . 8.000 7.005 6.968 7.054 . 0 0 "[ . 1 . 2 . 3]" 1 899 1 44 ILE MD 1 87 THR MG 8.000 . 8.000 5.240 5.206 5.277 . 0 0 "[ . 1 . 2 . 3]" 1 900 1 44 ILE MG 1 87 THR MG 8.000 . 8.000 7.152 7.119 7.181 . 0 0 "[ . 1 . 2 . 3]" 1 901 1 87 THR MG 1 202 LEU MD1 8.000 . 8.000 1.867 1.816 1.943 . 0 0 "[ . 1 . 2 . 3]" 1 902 1 87 THR MG 1 202 LEU MD2 8.000 . 8.000 3.816 3.728 3.958 . 0 0 "[ . 1 . 2 . 3]" 1 903 1 87 THR MG 1 209 LEU MD1 8.000 . 8.000 5.043 4.941 5.176 . 0 0 "[ . 1 . 2 . 3]" 1 904 1 92 ALA MB 1 93 ALA MB 8.000 . 8.000 4.487 4.453 4.506 . 0 0 "[ . 1 . 2 . 3]" 1 905 1 92 ALA MB 1 196 VAL MG1 8.000 . 8.000 4.743 4.689 4.873 . 0 0 "[ . 1 . 2 . 3]" 1 906 1 93 ALA MB 1 166 VAL MG2 8.000 . 8.000 4.964 4.919 5.039 . 0 0 "[ . 1 . 2 . 3]" 1 907 1 93 ALA MB 1 196 VAL MG1 8.000 . 8.000 5.418 5.344 5.543 . 0 0 "[ . 1 . 2 . 3]" 1 908 1 93 ALA MB 1 196 VAL MG2 8.000 . 8.000 5.765 5.679 5.952 . 0 0 "[ . 1 . 2 . 3]" 1 909 1 93 ALA MB 1 238 VAL MG1 8.000 . 8.000 7.610 7.563 7.637 . 0 0 "[ . 1 . 2 . 3]" 1 910 1 98 VAL MG1 1 99 VAL MG1 8.000 . 8.000 4.419 4.413 4.432 . 0 0 "[ . 1 . 2 . 3]" 1 911 1 98 VAL MG1 1 173 LEU MD1 8.000 . 8.000 5.484 5.382 5.661 . 0 0 "[ . 1 . 2 . 3]" 1 912 1 98 VAL MG1 1 177 VAL MG1 8.000 . 8.000 4.525 4.477 4.588 . 0 0 "[ . 1 . 2 . 3]" 1 913 1 98 VAL MG2 1 100 ALA MB 8.000 . 8.000 7.418 7.410 7.429 . 0 0 "[ . 1 . 2 . 3]" 1 914 1 98 VAL MG2 1 117 VAL MG1 8.000 . 8.000 6.096 6.077 6.116 . 0 0 "[ . 1 . 2 . 3]" 1 915 1 98 VAL MG2 1 168 ALA MB 8.000 . 8.000 3.226 3.184 3.265 . 0 0 "[ . 1 . 2 . 3]" 1 916 1 98 VAL MG2 1 173 LEU MD2 8.000 . 8.000 5.858 5.760 5.992 . 0 0 "[ . 1 . 2 . 3]" 1 917 1 98 VAL MG2 1 177 VAL MG1 8.000 . 8.000 6.051 5.987 6.102 . 0 0 "[ . 1 . 2 . 3]" 1 918 1 99 VAL MG1 1 105 ILE MD 8.000 . 8.000 2.013 2.003 2.017 . 0 0 "[ . 1 . 2 . 3]" 1 919 1 99 VAL MG1 1 105 ILE MG 8.000 . 8.000 2.712 2.676 2.753 . 0 0 "[ . 1 . 2 . 3]" 1 920 1 99 VAL MG1 1 117 VAL MG1 8.000 . 8.000 5.989 5.973 6.012 . 0 0 "[ . 1 . 2 . 3]" 1 921 1 99 VAL MG1 1 160 ALA MB 8.000 . 8.000 2.012 1.998 2.029 . 0 0 "[ . 1 . 2 . 3]" 1 922 1 98 VAL MG1 1 99 VAL MG2 8.000 . 8.000 4.615 4.592 4.641 . 0 0 "[ . 1 . 2 . 3]" 1 923 1 98 VAL MG2 1 99 VAL MG2 8.000 . 8.000 5.496 5.481 5.510 . 0 0 "[ . 1 . 2 . 3]" 1 924 1 99 VAL MG2 1 105 ILE MG 8.000 . 8.000 3.627 3.603 3.653 . 0 0 "[ . 1 . 2 . 3]" 1 925 1 99 VAL MG2 1 112 LEU MD2 8.000 . 8.000 5.927 5.882 6.023 . 0 0 "[ . 1 . 2 . 3]" 1 926 1 99 VAL MG2 1 117 VAL MG1 8.000 . 8.000 8.166 8.150 8.187 0.187 8 0 "[ . 1 . 2 . 3]" 1 927 1 99 VAL MG2 1 117 VAL MG2 8.000 . 8.000 7.222 7.195 7.265 . 0 0 "[ . 1 . 2 . 3]" 1 928 1 99 VAL MG2 1 160 ALA MB 8.000 . 8.000 4.206 4.181 4.232 . 0 0 "[ . 1 . 2 . 3]" 1 929 1 99 VAL MG2 1 161 ALA MB 8.000 . 8.000 7.172 7.152 7.190 . 0 0 "[ . 1 . 2 . 3]" 1 930 1 100 ALA MB 1 105 ILE MD 8.000 . 8.000 5.256 5.195 5.331 . 0 0 "[ . 1 . 2 . 3]" 1 931 1 105 ILE MD 1 112 LEU MD2 8.000 . 8.000 3.330 3.254 3.450 . 0 0 "[ . 1 . 2 . 3]" 1 932 1 105 ILE MD 1 117 VAL MG1 8.000 . 8.000 6.431 6.389 6.469 . 0 0 "[ . 1 . 2 . 3]" 1 933 1 105 ILE MD 1 160 ALA MB 8.000 . 8.000 2.639 2.607 2.668 . 0 0 "[ . 1 . 2 . 3]" 1 934 1 98 VAL MG1 1 105 ILE MG 8.000 . 8.000 7.382 7.365 7.400 . 0 0 "[ . 1 . 2 . 3]" 1 935 1 105 ILE MG 1 160 ALA MB 8.000 . 8.000 3.254 3.194 3.311 . 0 0 "[ . 1 . 2 . 3]" 1 936 1 108 THR MG 1 109 VAL MG2 8.000 . 8.000 4.593 4.563 4.617 . 0 0 "[ . 1 . 2 . 3]" 1 937 1 108 THR MG 1 138 ILE MD 8.000 . 8.000 5.868 5.809 5.921 . 0 0 "[ . 1 . 2 . 3]" 1 938 1 109 VAL MG1 1 138 ILE MD 8.000 . 8.000 4.028 3.968 4.102 . 0 0 "[ . 1 . 2 . 3]" 1 939 1 109 VAL MG2 1 138 ILE MD 8.000 . 8.000 1.945 1.917 1.979 . 0 0 "[ . 1 . 2 . 3]" 1 940 1 99 VAL MG1 1 112 LEU MD2 8.000 . 8.000 4.232 4.168 4.344 . 0 0 "[ . 1 . 2 . 3]" 1 941 1 105 ILE MG 1 112 LEU MD2 8.000 . 8.000 2.701 2.652 2.750 . 0 0 "[ . 1 . 2 . 3]" 1 942 1 112 LEU MD2 1 117 VAL MG2 8.000 . 8.000 2.487 2.447 2.546 . 0 0 "[ . 1 . 2 . 3]" 1 943 1 112 LEU MD2 1 138 ILE MD 8.000 . 8.000 3.625 3.561 3.684 . 0 0 "[ . 1 . 2 . 3]" 1 944 1 112 LEU MD2 1 138 ILE MG 8.000 . 8.000 3.458 3.405 3.494 . 0 0 "[ . 1 . 2 . 3]" 1 945 1 112 LEU MD2 1 160 ALA MB 8.000 . 8.000 2.830 2.777 2.947 . 0 0 "[ . 1 . 2 . 3]" 1 946 1 105 ILE MG 1 117 VAL MG1 8.000 . 8.000 6.641 6.584 6.705 . 0 0 "[ . 1 . 2 . 3]" 1 947 1 117 VAL MG1 1 138 ILE MD 8.000 . 8.000 5.172 5.122 5.233 . 0 0 "[ . 1 . 2 . 3]" 1 948 1 117 VAL MG1 1 160 ALA MB 8.000 . 8.000 3.618 3.605 3.642 . 0 0 "[ . 1 . 2 . 3]" 1 949 1 117 VAL MG2 1 140 ILE MD 8.000 . 8.000 6.057 5.946 6.099 . 0 0 "[ . 1 . 2 . 3]" 1 950 1 117 VAL MG2 1 140 ILE MG 8.000 . 8.000 3.662 3.551 3.704 . 0 0 "[ . 1 . 2 . 3]" 1 951 1 117 VAL MG2 1 160 ALA MB 8.000 . 8.000 2.561 2.536 2.600 . 0 0 "[ . 1 . 2 . 3]" 1 952 1 117 VAL MG1 1 119 VAL MG1 8.000 . 8.000 4.677 4.648 4.690 . 0 0 "[ . 1 . 2 . 3]" 1 953 1 119 VAL MG1 1 120 LEU MD1 8.000 . 8.000 4.716 4.708 4.721 . 0 0 "[ . 1 . 2 . 3]" 1 954 1 119 VAL MG1 1 120 LEU MD2 8.000 . 8.000 4.892 4.885 4.899 . 0 0 "[ . 1 . 2 . 3]" 1 955 1 119 VAL MG1 1 138 ILE MG 8.000 . 8.000 7.587 7.541 7.661 . 0 0 "[ . 1 . 2 . 3]" 1 956 1 119 VAL MG1 1 140 ILE MD 8.000 . 8.000 4.798 4.770 4.839 . 0 0 "[ . 1 . 2 . 3]" 1 957 1 119 VAL MG1 1 140 ILE MG 8.000 . 8.000 5.223 5.168 5.306 . 0 0 "[ . 1 . 2 . 3]" 1 958 1 119 VAL MG1 1 141 VAL MG1 8.000 . 8.000 6.051 6.032 6.072 . 0 0 "[ . 1 . 2 . 3]" 1 959 1 119 VAL MG1 1 149 ILE MD 8.000 . 8.000 4.134 4.112 4.162 . 0 0 "[ . 1 . 2 . 3]" 1 960 1 119 VAL MG1 1 149 ILE MG 8.000 . 8.000 5.434 5.404 5.469 . 0 0 "[ . 1 . 2 . 3]" 1 961 1 119 VAL MG2 1 140 ILE MD 8.000 . 8.000 3.978 3.953 4.000 . 0 0 "[ . 1 . 2 . 3]" 1 962 1 119 VAL MG2 1 140 ILE MG 8.000 . 8.000 3.493 3.438 3.560 . 0 0 "[ . 1 . 2 . 3]" 1 963 1 119 VAL MG2 1 161 ALA MB 8.000 . 8.000 4.351 4.273 4.383 . 0 0 "[ . 1 . 2 . 3]" 1 964 1 120 LEU MD1 1 141 VAL MG1 8.000 . 8.000 6.571 6.530 6.625 . 0 0 "[ . 1 . 2 . 3]" 1 965 1 120 LEU MD1 1 149 ILE MD 8.000 . 8.000 2.047 2.039 2.067 . 0 0 "[ . 1 . 2 . 3]" 1 966 1 120 LEU MD2 1 149 ILE MD 8.000 . 8.000 3.300 3.283 3.324 . 0 0 "[ . 1 . 2 . 3]" 1 967 1 119 VAL MG2 1 123 THR MG 8.000 . 8.000 5.721 5.614 5.754 . 0 0 "[ . 1 . 2 . 3]" 1 968 1 120 LEU MD1 1 123 THR MG 8.000 . 8.000 4.127 4.098 4.166 . 0 0 "[ . 1 . 2 . 3]" 1 969 1 120 LEU MD2 1 123 THR MG 8.000 . 8.000 2.643 2.609 2.696 . 0 0 "[ . 1 . 2 . 3]" 1 970 1 123 THR MG 1 124 THR MG 8.000 . 8.000 4.732 4.712 4.775 . 0 0 "[ . 1 . 2 . 3]" 1 971 1 120 LEU MD2 1 124 THR MG 8.000 . 8.000 7.469 7.437 7.516 . 0 0 "[ . 1 . 2 . 3]" 1 972 1 124 THR MG 1 193 LEU MD1 8.000 . 8.000 3.668 3.645 3.677 . 0 0 "[ . 1 . 2 . 3]" 1 973 1 124 THR MG 1 193 LEU MD2 8.000 . 8.000 2.807 2.755 2.833 . 0 0 "[ . 1 . 2 . 3]" 1 974 1 127 THR MG 1 193 LEU MD1 8.000 . 8.000 5.606 5.569 5.712 . 0 0 "[ . 1 . 2 . 3]" 1 975 1 127 THR MG 1 193 LEU MD2 8.000 . 8.000 4.909 4.886 4.929 . 0 0 "[ . 1 . 2 . 3]" 1 976 1 109 VAL MG2 1 134 ALA MB 8.000 . 8.000 6.948 6.925 6.978 . 0 0 "[ . 1 . 2 . 3]" 1 977 1 134 ALA MB 1 138 ILE MD 8.000 . 8.000 6.215 6.171 6.234 . 0 0 "[ . 1 . 2 . 3]" 1 978 1 134 ALA MB 1 138 ILE MG 8.000 . 8.000 6.169 6.131 6.191 . 0 0 "[ . 1 . 2 . 3]" 1 979 1 134 ALA MB 1 140 ILE MG 8.000 . 8.000 4.929 4.894 4.964 . 0 0 "[ . 1 . 2 . 3]" 1 980 1 134 ALA MB 1 141 VAL MG2 8.000 . 8.500 8.667 8.627 8.696 0.196 23 0 "[ . 1 . 2 . 3]" 1 981 1 105 ILE MD 1 138 ILE MG 8.000 . 8.000 6.719 6.642 6.781 . 0 0 "[ . 1 . 2 . 3]" 1 982 1 138 ILE MG 1 140 ILE MD 8.000 . 8.000 4.598 4.535 4.627 . 0 0 "[ . 1 . 2 . 3]" 1 983 1 134 ALA MB 1 140 ILE MD 8.000 . 8.000 3.762 3.730 3.794 . 0 0 "[ . 1 . 2 . 3]" 1 984 1 138 ILE MD 1 140 ILE MD 8.000 . 8.000 5.881 5.823 5.908 . 0 0 "[ . 1 . 2 . 3]" 1 985 1 109 VAL MG2 1 140 ILE MG 8.000 . 8.000 6.212 6.144 6.298 . 0 0 "[ . 1 . 2 . 3]" 1 986 1 112 LEU MD2 1 140 ILE MG 8.000 . 8.000 5.613 5.499 5.663 . 0 0 "[ . 1 . 2 . 3]" 1 987 1 117 VAL MG1 1 140 ILE MG 8.000 . 8.000 3.100 3.055 3.128 . 0 0 "[ . 1 . 2 . 3]" 1 988 1 140 ILE MG 1 141 VAL MG1 8.000 . 8.000 6.287 6.282 6.290 . 0 0 "[ . 1 . 2 . 3]" 1 989 1 140 ILE MG 1 141 VAL MG2 8.000 . 8.000 5.022 5.011 5.029 . 0 0 "[ . 1 . 2 . 3]" 1 990 1 141 VAL MG1 1 158 ILE MG 8.000 . 8.000 4.326 4.278 4.389 . 0 0 "[ . 1 . 2 . 3]" 1 991 1 141 VAL MG2 1 158 ILE MG 8.000 . 8.000 4.165 4.102 4.254 . 0 0 "[ . 1 . 2 . 3]" 1 992 1 98 VAL MG1 1 149 ILE MG 8.000 . 8.000 5.663 5.568 5.717 . 0 0 "[ . 1 . 2 . 3]" 1 993 1 120 LEU MD1 1 149 ILE MG 8.000 . 8.000 4.608 4.598 4.633 . 0 0 "[ . 1 . 2 . 3]" 1 994 1 120 LEU MD2 1 149 ILE MG 8.000 . 8.000 5.497 5.472 5.533 . 0 0 "[ . 1 . 2 . 3]" 1 995 1 149 ILE MG 1 158 ILE MD 8.000 . 8.000 2.547 2.525 2.563 . 0 0 "[ . 1 . 2 . 3]" 1 996 1 149 ILE MG 1 161 ALA MB 8.000 . 8.000 2.457 2.415 2.492 . 0 0 "[ . 1 . 2 . 3]" 1 997 1 98 VAL MG1 1 153 LEU MD2 8.000 . 8.000 2.026 1.986 2.095 . 0 0 "[ . 1 . 2 . 3]" 1 998 1 98 VAL MG2 1 153 LEU MD2 8.000 . 8.000 3.320 3.255 3.414 . 0 0 "[ . 1 . 2 . 3]" 1 999 1 117 VAL MG2 1 153 LEU MD2 8.000 . 8.000 7.323 7.241 7.414 . 0 0 "[ . 1 . 2 . 3]" 1 1000 1 149 ILE MG 1 153 LEU MD2 8.000 . 8.000 4.239 4.176 4.297 . 0 0 "[ . 1 . 2 . 3]" 1 1001 1 153 LEU MD2 1 161 ALA MB 8.000 . 8.000 3.516 3.421 3.634 . 0 0 "[ . 1 . 2 . 3]" 1 1002 1 100 ALA MB 1 154 THR MG 8.000 . 8.000 5.904 5.729 6.012 . 0 0 "[ . 1 . 2 . 3]" 1 1003 1 154 THR MG 1 177 VAL MG1 8.000 . 8.000 3.262 3.114 3.545 . 0 0 "[ . 1 . 2 . 3]" 1 1004 1 154 THR MG 1 177 VAL MG2 8.000 . 8.000 3.699 3.494 4.017 . 0 0 "[ . 1 . 2 . 3]" 1 1005 1 155 ALA MB 1 158 ILE MG 8.000 . 8.000 5.259 5.225 5.271 . 0 0 "[ . 1 . 2 . 3]" 1 1006 1 98 VAL MG2 1 158 ILE MD 8.000 . 8.000 5.061 5.029 5.104 . 0 0 "[ . 1 . 2 . 3]" 1 1007 1 100 ALA MB 1 158 ILE MD 8.000 . 8.000 6.933 6.853 6.998 . 0 0 "[ . 1 . 2 . 3]" 1 1008 1 117 VAL MG2 1 158 ILE MD 8.000 . 8.000 5.329 5.264 5.388 . 0 0 "[ . 1 . 2 . 3]" 1 1009 1 141 VAL MG2 1 158 ILE MD 8.000 . 8.000 6.230 6.158 6.330 . 0 0 "[ . 1 . 2 . 3]" 1 1010 1 153 LEU MD2 1 158 ILE MD 8.000 . 8.000 3.359 3.337 3.389 . 0 0 "[ . 1 . 2 . 3]" 1 1011 1 119 VAL MG1 1 158 ILE MG 8.000 . 8.000 7.257 7.234 7.291 . 0 0 "[ . 1 . 2 . 3]" 1 1012 1 98 VAL MG1 1 160 ALA MB 8.000 . 8.000 5.256 5.236 5.280 . 0 0 "[ . 1 . 2 . 3]" 1 1013 1 100 ALA MB 1 160 ALA MB 8.000 . 8.000 6.558 6.541 6.568 . 0 0 "[ . 1 . 2 . 3]" 1 1014 1 138 ILE MG 1 160 ALA MB 8.000 . 8.000 5.599 5.573 5.647 . 0 0 "[ . 1 . 2 . 3]" 1 1015 1 158 ILE MD 1 160 ALA MB 8.000 . 8.000 4.831 4.776 4.884 . 0 0 "[ . 1 . 2 . 3]" 1 1016 1 117 VAL MG1 1 161 ALA MB 8.000 . 8.000 3.651 3.642 3.661 . 0 0 "[ . 1 . 2 . 3]" 1 1017 1 117 VAL MG2 1 161 ALA MB 8.000 . 8.000 4.959 4.947 4.980 . 0 0 "[ . 1 . 2 . 3]" 1 1018 1 120 LEU MD1 1 161 ALA MB 8.000 . 8.000 6.393 6.346 6.429 . 0 0 "[ . 1 . 2 . 3]" 1 1019 1 120 LEU MD2 1 161 ALA MB 8.000 . 8.000 6.828 6.784 6.858 . 0 0 "[ . 1 . 2 . 3]" 1 1020 1 149 ILE MD 1 161 ALA MB 8.000 . 8.000 3.751 3.686 3.788 . 0 0 "[ . 1 . 2 . 3]" 1 1021 1 92 ALA MB 1 166 VAL MG1 8.000 . 8.000 6.452 6.398 6.601 . 0 0 "[ . 1 . 2 . 3]" 1 1022 1 166 VAL MG1 1 167 ALA MB 8.000 . 8.000 3.809 3.791 3.830 . 0 0 "[ . 1 . 2 . 3]" 1 1023 1 166 VAL MG1 1 238 VAL MG1 8.000 . 8.000 5.001 4.961 5.076 . 0 0 "[ . 1 . 2 . 3]" 1 1024 1 166 VAL MG1 1 238 VAL MG2 8.000 . 8.000 7.139 7.097 7.213 . 0 0 "[ . 1 . 2 . 3]" 1 1025 1 166 VAL MG2 1 238 VAL MG1 8.000 . 8.000 3.419 3.377 3.479 . 0 0 "[ . 1 . 2 . 3]" 1 1026 1 166 VAL MG2 1 238 VAL MG2 8.000 . 8.000 5.376 5.341 5.434 . 0 0 "[ . 1 . 2 . 3]" 1 1027 1 166 VAL MG2 1 167 ALA MB 8.000 . 8.000 4.956 4.948 4.964 . 0 0 "[ . 1 . 2 . 3]" 1 1028 1 98 VAL MG1 1 168 ALA MB 8.000 . 8.000 4.066 4.037 4.101 . 0 0 "[ . 1 . 2 . 3]" 1 1029 1 166 VAL MG1 1 168 ALA MB 8.000 . 8.000 5.621 5.596 5.634 . 0 0 "[ . 1 . 2 . 3]" 1 1030 1 168 ALA MB 1 173 LEU MD1 8.000 . 8.000 4.231 4.195 4.250 . 0 0 "[ . 1 . 2 . 3]" 1 1031 1 98 VAL MG2 1 173 LEU MD1 8.000 . 8.000 6.038 5.921 6.199 . 0 0 "[ . 1 . 2 . 3]" 1 1032 1 98 VAL MG1 1 173 LEU MD2 8.000 . 8.000 4.631 4.533 4.787 . 0 0 "[ . 1 . 2 . 3]" 1 1033 1 173 LEU MD2 1 177 VAL MG1 8.000 . 8.000 5.449 5.404 5.508 . 0 0 "[ . 1 . 2 . 3]" 1 1034 1 98 VAL MG2 1 177 VAL MG2 8.000 . 8.000 7.925 7.857 8.010 0.010 9 0 "[ . 1 . 2 . 3]" 1 1035 1 188 VAL MG2 1 193 LEU MD1 8.000 . 8.000 6.324 6.196 6.376 . 0 0 "[ . 1 . 2 . 3]" 1 1036 1 188 VAL MG1 1 193 LEU MD1 8.000 . 8.000 6.978 6.900 7.026 . 0 0 "[ . 1 . 2 . 3]" 1 1037 1 92 ALA MB 1 196 VAL MG2 8.000 . 8.000 3.360 3.270 3.601 . 0 0 "[ . 1 . 2 . 3]" 1 1038 1 77 THR MG 1 198 THR MG 8.000 . 8.000 5.595 5.553 5.653 . 0 0 "[ . 1 . 2 . 3]" 1 1039 1 93 ALA MB 1 198 THR MG 8.000 . 8.000 2.323 2.264 2.354 . 0 0 "[ . 1 . 2 . 3]" 1 1040 1 9 ILE MD 1 209 LEU MD1 8.000 . 8.000 3.053 2.966 3.111 . 0 0 "[ . 1 . 2 . 3]" 1 1041 1 44 ILE MD 1 209 LEU MD1 8.000 . 8.000 2.050 2.018 2.084 . 0 0 "[ . 1 . 2 . 3]" 1 1042 1 62 LEU MD1 1 209 LEU MD1 8.000 . 8.000 7.981 7.775 8.081 0.081 6 0 "[ . 1 . 2 . 3]" 1 1043 1 202 LEU MD1 1 209 LEU MD1 8.000 . 8.000 4.046 4.008 4.168 . 0 0 "[ . 1 . 2 . 3]" 1 1044 1 209 LEU MD1 1 212 ALA MB 8.000 . 8.000 2.714 2.641 2.768 . 0 0 "[ . 1 . 2 . 3]" 1 1045 1 9 ILE MD 1 209 LEU MD2 8.000 . 8.000 3.593 3.545 3.637 . 0 0 "[ . 1 . 2 . 3]" 1 1046 1 11 ILE MD 1 209 LEU MD2 8.000 . 8.000 5.901 5.781 5.981 . 0 0 "[ . 1 . 2 . 3]" 1 1047 1 44 ILE MG 1 209 LEU MD2 8.000 . 8.000 4.124 4.026 4.227 . 0 0 "[ . 1 . 2 . 3]" 1 1048 1 5 ILE MG 1 212 ALA MB 8.000 . 8.000 3.850 3.741 4.017 . 0 0 "[ . 1 . 2 . 3]" 1 1049 1 9 ILE MD 1 212 ALA MB 8.000 . 8.000 5.703 5.502 5.897 . 0 0 "[ . 1 . 2 . 3]" 1 1050 1 9 ILE MG 1 212 ALA MB 8.000 . 8.000 7.274 7.051 7.488 . 0 0 "[ . 1 . 2 . 3]" 1 1051 1 40 LEU MD1 1 212 ALA MB 8.000 . 8.000 6.257 6.167 6.299 . 0 0 "[ . 1 . 2 . 3]" 1 1052 1 44 ILE MD 1 212 ALA MB 8.000 . 8.000 3.662 3.569 3.737 . 0 0 "[ . 1 . 2 . 3]" 1 1053 1 44 ILE MG 1 212 ALA MB 8.000 . 8.000 3.533 3.411 3.648 . 0 0 "[ . 1 . 2 . 3]" 1 1054 1 202 LEU MD1 1 212 ALA MB 8.000 . 8.000 5.820 5.776 5.871 . 0 0 "[ . 1 . 2 . 3]" 1 1055 1 202 LEU MD2 1 212 ALA MB 8.000 . 8.000 7.363 7.285 7.452 . 0 0 "[ . 1 . 2 . 3]" 1 1056 1 209 LEU MD2 1 212 ALA MB 8.000 . 8.000 4.981 4.932 5.005 . 0 0 "[ . 1 . 2 . 3]" 1 1057 1 9 ILE MD 1 216 ALA MB 8.000 . 8.000 7.015 6.924 7.151 . 0 0 "[ . 1 . 2 . 3]" 1 1058 1 40 LEU MD1 1 216 ALA MB 8.000 . 8.000 4.170 4.106 4.211 . 0 0 "[ . 1 . 2 . 3]" 1 1059 1 40 LEU MD2 1 216 ALA MB 8.000 . 8.000 2.070 2.034 2.108 . 0 0 "[ . 1 . 2 . 3]" 1 1060 1 44 ILE MD 1 216 ALA MB 8.000 . 8.000 4.473 4.396 4.534 . 0 0 "[ . 1 . 2 . 3]" 1 1061 1 202 LEU MD1 1 216 ALA MB 8.000 . 8.000 6.968 6.911 7.060 . 0 0 "[ . 1 . 2 . 3]" 1 1062 1 40 LEU MD1 1 218 ALA MB 8.000 . 8.000 8.164 8.132 8.197 0.197 25 0 "[ . 1 . 2 . 3]" 1 1063 1 216 ALA MB 1 218 ALA MB 8.000 . 8.000 5.294 5.272 5.314 . 0 0 "[ . 1 . 2 . 3]" 1 1064 1 218 ALA MB 1 222 ALA MB 8.000 . 8.000 4.274 4.208 4.324 . 0 0 "[ . 1 . 2 . 3]" 1 1065 1 36 LEU MD1 1 225 THR MG 8.000 . 8.000 4.412 4.342 4.472 . 0 0 "[ . 1 . 2 . 3]" 1 1066 1 40 LEU MD1 1 225 THR MG 8.000 . 8.000 7.054 6.945 7.080 . 0 0 "[ . 1 . 2 . 3]" 1 1067 1 40 LEU MD2 1 225 THR MG 8.000 . 8.000 6.228 6.127 6.300 . 0 0 "[ . 1 . 2 . 3]" 1 1068 1 225 THR MG 1 229 LEU MD1 8.000 . 8.000 2.249 2.177 2.297 . 0 0 "[ . 1 . 2 . 3]" 1 1069 1 225 THR MG 1 229 LEU MD2 8.000 . 8.000 3.715 3.660 3.739 . 0 0 "[ . 1 . 2 . 3]" 1 1070 1 30 VAL MG2 1 229 LEU MD2 8.000 . 8.000 7.576 7.043 7.893 . 0 0 "[ . 1 . 2 . 3]" 1 1071 1 229 LEU MD2 1 238 VAL MG2 8.000 . 8.500 8.785 8.744 8.830 0.330 20 0 "[ . 1 . 2 . 3]" 1 1072 1 229 LEU MD1 1 230 ALA MB 8.000 . 8.000 5.285 5.244 5.316 . 0 0 "[ . 1 . 2 . 3]" 1 1073 1 229 LEU MD2 1 230 ALA MB 8.000 . 8.000 5.671 5.657 5.680 . 0 0 "[ . 1 . 2 . 3]" 1 1074 1 230 ALA MB 1 238 VAL MG1 8.000 . 8.000 2.277 2.232 2.315 . 0 0 "[ . 1 . 2 . 3]" 1 1075 1 230 ALA MB 1 238 VAL MG2 8.000 . 8.000 3.687 3.597 3.748 . 0 0 "[ . 1 . 2 . 3]" 1 1076 1 36 LEU MD1 1 238 VAL MG2 8.000 . 8.000 8.125 8.051 8.164 0.164 25 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 74 _Distance_constraint_stats_list.Viol_count 1134 _Distance_constraint_stats_list.Viol_total 4152.483 _Distance_constraint_stats_list.Viol_max 0.290 _Distance_constraint_stats_list.Viol_rms 0.0811 _Distance_constraint_stats_list.Viol_average_all_restraints 0.0623 _Distance_constraint_stats_list.Viol_average_violations_only 0.1221 _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 24 ASN 1.131 0.071 23 0 "[ . 1 . 2 . 3]" 1 27 GLY 0.167 0.026 8 0 "[ . 1 . 2 . 3]" 1 28 GLU 0.964 0.071 23 0 "[ . 1 . 2 . 3]" 1 34 ILE 2.232 0.082 24 0 "[ . 1 . 2 . 3]" 1 35 ASP 14.317 0.290 28 0 "[ . 1 . 2 . 3]" 1 36 LEU 4.906 0.175 30 0 "[ . 1 . 2 . 3]" 1 37 ALA 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 38 LYS 7.277 0.136 20 0 "[ . 1 . 2 . 3]" 1 39 GLU 25.967 0.290 28 0 "[ . 1 . 2 . 3]" 1 40 LEU 4.906 0.175 30 0 "[ . 1 . 2 . 3]" 1 41 CYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 42 LYS 5.045 0.136 20 0 "[ . 1 . 2 . 3]" 1 43 ARG 11.650 0.239 24 0 "[ . 1 . 2 . 3]" 1 57 ALA 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 58 LEU 0.016 0.008 7 0 "[ . 1 . 2 . 3]" 1 59 ILE 10.475 0.235 23 0 "[ . 1 . 2 . 3]" 1 61 SER 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 62 LEU 0.016 0.008 7 0 "[ . 1 . 2 . 3]" 1 63 LYS 10.475 0.235 23 0 "[ . 1 . 2 . 3]" 1 78 GLU 9.576 0.227 6 0 "[ . 1 . 2 . 3]" 1 82 GLN 9.576 0.227 6 0 "[ . 1 . 2 . 3]" 1 125 GLN 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 126 GLU 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 128 PHE 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 129 GLY 0.004 0.004 12 0 "[ . 1 . 2 . 3]" 1 130 ASN 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 132 HIS 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 133 TRP 0.004 0.004 12 0 "[ . 1 . 2 . 3]" 1 147 ASP 1.725 0.073 17 0 "[ . 1 . 2 . 3]" 1 148 ASN 8.395 0.200 13 0 "[ . 1 . 2 . 3]" 1 149 ILE 5.595 0.131 21 0 "[ . 1 . 2 . 3]" 1 150 TYR 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 151 SER 1.725 0.073 17 0 "[ . 1 . 2 . 3]" 1 152 ASP 8.395 0.200 13 0 "[ . 1 . 2 . 3]" 1 153 LEU 5.595 0.131 21 0 "[ . 1 . 2 . 3]" 1 154 THR 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 165 GLU 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 166 VAL 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 167 ALA 10.045 0.280 8 0 "[ . 1 . 2 . 3]" 1 169 SER 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 170 GLU 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 171 GLY 10.045 0.280 8 0 "[ . 1 . 2 . 3]" 1 207 ASN 8.219 0.208 21 0 "[ . 1 . 2 . 3]" 1 208 GLU 7.670 0.234 25 0 "[ . 1 . 2 . 3]" 1 209 LEU 3.942 0.146 30 0 "[ . 1 . 2 . 3]" 1 210 ARG 1.087 0.056 13 0 "[ . 1 . 2 . 3]" 1 211 GLU 16.661 0.233 28 0 "[ . 1 . 2 . 3]" 1 212 ALA 7.670 0.234 25 0 "[ . 1 . 2 . 3]" 1 213 LEU 3.942 0.146 30 0 "[ . 1 . 2 . 3]" 1 214 ASN 3.836 0.094 28 0 "[ . 1 . 2 . 3]" 1 215 LYS 13.627 0.233 28 0 "[ . 1 . 2 . 3]" 1 216 ALA 0.780 0.036 27 0 "[ . 1 . 2 . 3]" 1 217 PHE 12.529 0.285 30 0 "[ . 1 . 2 . 3]" 1 218 ALA 5.451 0.108 28 0 "[ . 1 . 2 . 3]" 1 219 GLU 5.185 0.145 28 0 "[ . 1 . 2 . 3]" 1 220 MET 0.780 0.036 27 0 "[ . 1 . 2 . 3]" 1 221 ARG 12.529 0.285 30 0 "[ . 1 . 2 . 3]" 1 222 ALA 2.701 0.108 28 0 "[ . 1 . 2 . 3]" 1 226 TYR 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 227 GLU 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 230 ALA 0.000 0.000 . 0 "[ . 1 . 2 . 3]" 1 231 LYS 0.000 0.000 . 0 "[ . 1 . 2 . 3]" stop_ loop_ _Distance_constraint_stats.Restraint_ID _Distance_constraint_stats.Atom_1_entity_assembly_ID _Distance_constraint_stats.Atom_1_comp_index_ID _Distance_constraint_stats.Atom_1_comp_ID _Distance_constraint_stats.Atom_1_ID _Distance_constraint_stats.Atom_2_entity_assembly_ID _Distance_constraint_stats.Atom_2_comp_index_ID _Distance_constraint_stats.Atom_2_comp_ID _Distance_constraint_stats.Atom_2_ID _Distance_constraint_stats.Node_1_distance_val _Distance_constraint_stats.Node_1_distance_lower_bound_val _Distance_constraint_stats.Node_1_distance_upper_bound_val _Distance_constraint_stats.Distance_average _Distance_constraint_stats.Distance_minimum _Distance_constraint_stats.Distance_maximum _Distance_constraint_stats.Max_violation _Distance_constraint_stats.Max_violation_model_number _Distance_constraint_stats.Over_cutoff_violation_count _Distance_constraint_stats.Over_cutoff_viol_per_model _Distance_constraint_stats.Distance_constraint_stats_ID 1 1 24 ASN H 1 28 GLU O 2.000 . 2.000 2.015 1.878 2.071 0.071 23 0 "[ . 1 . 2 . 3]" 2 2 1 24 ASN N 1 28 GLU O 3.000 . 3.000 2.873 2.736 2.932 . 0 0 "[ . 1 . 2 . 3]" 2 3 1 24 ASN O 1 27 GLY H 2.000 . 2.000 1.989 1.968 2.026 0.026 8 0 "[ . 1 . 2 . 3]" 2 4 1 24 ASN O 1 27 GLY N 3.000 . 3.000 2.915 2.895 2.953 . 0 0 "[ . 1 . 2 . 3]" 2 5 1 34 ILE O 1 38 LYS H 2.000 . 2.000 2.058 2.036 2.082 0.082 24 0 "[ . 1 . 2 . 3]" 2 6 1 34 ILE O 1 38 LYS N 3.000 . 3.000 3.012 2.979 3.046 0.046 9 0 "[ . 1 . 2 . 3]" 2 7 1 35 ASP O 1 39 GLU H 2.000 . 2.000 2.247 2.216 2.290 0.290 28 0 "[ . 1 . 2 . 3]" 2 8 1 35 ASP O 1 39 GLU N 3.000 . 3.000 3.230 3.200 3.269 0.269 28 0 "[ . 1 . 2 . 3]" 2 9 1 36 LEU O 1 40 LEU H 2.000 . 2.000 2.134 2.093 2.175 0.175 30 0 "[ . 1 . 2 . 3]" 2 10 1 36 LEU O 1 40 LEU N 3.000 . 3.000 3.030 2.998 3.060 0.060 30 0 "[ . 1 . 2 . 3]" 2 11 1 37 ALA O 1 41 CYS H 2.000 . 2.000 1.761 1.704 1.838 . 0 0 "[ . 1 . 2 . 3]" 2 12 1 37 ALA O 1 41 CYS N 3.000 . 3.000 2.685 2.634 2.751 . 0 0 "[ . 1 . 2 . 3]" 2 13 1 38 LYS O 1 42 LYS H 2.000 . 2.000 2.113 2.086 2.136 0.136 20 0 "[ . 1 . 2 . 3]" 2 14 1 38 LYS O 1 42 LYS N 3.000 . 3.000 3.055 3.030 3.079 0.079 2 0 "[ . 1 . 2 . 3]" 2 15 1 39 GLU O 1 43 ARG H 2.000 . 2.000 2.215 2.182 2.239 0.239 24 0 "[ . 1 . 2 . 3]" 2 16 1 39 GLU O 1 43 ARG N 3.000 . 3.000 3.173 3.138 3.199 0.199 24 0 "[ . 1 . 2 . 3]" 2 17 1 57 ALA O 1 61 SER H 2.000 . 2.000 1.919 1.890 1.955 . 0 0 "[ . 1 . 2 . 3]" 2 18 1 57 ALA O 1 61 SER N 3.000 . 3.000 2.816 2.784 2.853 . 0 0 "[ . 1 . 2 . 3]" 2 19 1 58 LEU O 1 62 LEU H 2.000 . 2.000 1.980 1.937 2.008 0.008 7 0 "[ . 1 . 2 . 3]" 2 20 1 58 LEU O 1 62 LEU N 3.000 . 3.000 2.911 2.870 2.941 . 0 0 "[ . 1 . 2 . 3]" 2 21 1 59 ILE O 1 63 LYS H 2.000 . 2.000 2.203 2.169 2.235 0.235 23 0 "[ . 1 . 2 . 3]" 2 22 1 59 ILE O 1 63 LYS N 3.000 . 3.000 3.146 3.112 3.178 0.178 23 0 "[ . 1 . 2 . 3]" 2 23 1 78 GLU O 1 82 GLN H 2.000 . 2.000 2.212 2.197 2.227 0.227 6 0 "[ . 1 . 2 . 3]" 2 24 1 78 GLU O 1 82 GLN N 3.000 . 3.000 3.107 3.098 3.115 0.115 6 0 "[ . 1 . 2 . 3]" 2 25 1 125 GLN O 1 129 GLY H 2.000 . 2.000 1.545 1.535 1.557 . 0 0 "[ . 1 . 2 . 3]" 2 26 1 125 GLN O 1 129 GLY N 3.000 . 3.000 2.439 2.424 2.452 . 0 0 "[ . 1 . 2 . 3]" 2 27 1 126 GLU O 1 130 ASN H 2.000 . 2.000 1.784 1.768 1.798 . 0 0 "[ . 1 . 2 . 3]" 2 28 1 126 GLU O 1 130 ASN N 3.000 . 3.000 2.726 2.707 2.739 . 0 0 "[ . 1 . 2 . 3]" 2 29 1 128 PHE O 1 132 HIS H 2.000 . 2.000 1.726 1.712 1.740 . 0 0 "[ . 1 . 2 . 3]" 2 30 1 128 PHE O 1 132 HIS N 3.000 . 3.000 2.639 2.626 2.650 . 0 0 "[ . 1 . 2 . 3]" 2 31 1 129 GLY O 1 133 TRP H 2.000 . 2.000 1.991 1.984 2.004 0.004 12 0 "[ . 1 . 2 . 3]" 2 32 1 129 GLY O 1 133 TRP N 3.000 . 3.000 2.788 2.780 2.796 . 0 0 "[ . 1 . 2 . 3]" 2 33 1 147 ASP O 1 151 SER H 2.000 . 2.000 2.057 2.043 2.073 0.073 17 0 "[ . 1 . 2 . 3]" 2 34 1 147 ASP O 1 151 SER N 3.000 . 3.000 2.960 2.944 2.978 . 0 0 "[ . 1 . 2 . 3]" 2 35 1 148 ASN O 1 152 ASP H 2.000 . 2.000 2.183 2.167 2.200 0.200 13 0 "[ . 1 . 2 . 3]" 2 36 1 148 ASN O 1 152 ASP N 3.000 . 3.000 3.097 3.086 3.111 0.111 13 0 "[ . 1 . 2 . 3]" 2 37 1 149 ILE O 1 153 LEU H 2.000 . 2.000 2.116 2.102 2.131 0.131 21 0 "[ . 1 . 2 . 3]" 2 38 1 149 ILE O 1 153 LEU N 3.000 . 3.000 3.071 3.052 3.089 0.089 21 0 "[ . 1 . 2 . 3]" 2 39 1 150 TYR O 1 154 THR H 2.000 . 2.000 1.934 1.920 1.946 . 0 0 "[ . 1 . 2 . 3]" 2 40 1 150 TYR O 1 154 THR N 3.000 . 3.000 2.908 2.896 2.920 . 0 0 "[ . 1 . 2 . 3]" 2 41 1 165 GLU O 1 169 SER H 2.000 . 2.000 1.900 1.874 1.951 . 0 0 "[ . 1 . 2 . 3]" 2 42 1 165 GLU O 1 169 SER N 3.000 . 3.000 2.848 2.821 2.899 . 0 0 "[ . 1 . 2 . 3]" 2 43 1 166 VAL O 1 170 GLU H 2.000 . 2.000 1.785 1.754 1.809 . 0 0 "[ . 1 . 2 . 3]" 2 44 1 166 VAL O 1 170 GLU N 3.000 . 3.000 2.668 2.655 2.696 . 0 0 "[ . 1 . 2 . 3]" 2 45 1 167 ALA O 1 171 GLY H 2.000 . 2.000 2.248 2.225 2.280 0.280 8 0 "[ . 1 . 2 . 3]" 2 46 1 167 ALA O 1 171 GLY N 3.000 . 3.000 3.087 3.062 3.142 0.142 8 0 "[ . 1 . 2 . 3]" 2 47 1 207 ASN O 1 211 GLU H 2.000 . 2.000 2.195 2.184 2.208 0.208 21 0 "[ . 1 . 2 . 3]" 2 48 1 207 ASN O 1 211 GLU N 3.000 . 3.000 3.079 3.067 3.091 0.091 21 0 "[ . 1 . 2 . 3]" 2 49 1 208 GLU O 1 212 ALA H 2.000 . 2.000 2.196 2.174 2.234 0.234 25 0 "[ . 1 . 2 . 3]" 2 50 1 208 GLU O 1 212 ALA N 3.000 . 3.000 3.060 3.044 3.092 0.092 25 0 "[ . 1 . 2 . 3]" 2 51 1 209 LEU O 1 213 LEU H 2.000 . 2.000 2.131 2.110 2.146 0.146 30 0 "[ . 1 . 2 . 3]" 2 52 1 209 LEU O 1 213 LEU N 3.000 . 3.000 2.907 2.885 2.918 . 0 0 "[ . 1 . 2 . 3]" 2 53 1 210 ARG O 1 214 ASN H 2.000 . 2.000 2.036 2.013 2.056 0.056 13 0 "[ . 1 . 2 . 3]" 2 54 1 210 ARG O 1 214 ASN N 3.000 . 3.000 2.952 2.937 2.969 . 0 0 "[ . 1 . 2 . 3]" 2 55 1 211 GLU O 1 215 LYS H 2.000 . 2.000 2.215 2.193 2.233 0.233 28 0 "[ . 1 . 2 . 3]" 2 56 1 211 GLU O 1 215 LYS N 3.000 . 3.000 3.066 3.035 3.099 0.099 28 0 "[ . 1 . 2 . 3]" 2 57 1 212 ALA O 1 216 ALA H 2.000 . 2.000 1.844 1.807 1.884 . 0 0 "[ . 1 . 2 . 3]" 2 58 1 212 ALA O 1 216 ALA N 3.000 . 3.000 2.770 2.735 2.807 . 0 0 "[ . 1 . 2 . 3]" 2 59 1 213 LEU O 1 217 PHE H 2.000 . 2.000 1.955 1.943 1.966 . 0 0 "[ . 1 . 2 . 3]" 2 60 1 213 LEU O 1 217 PHE N 3.000 . 3.000 2.847 2.833 2.859 . 0 0 "[ . 1 . 2 . 3]" 2 61 1 214 ASN O 1 218 ALA H 2.000 . 2.000 2.085 2.068 2.094 0.094 28 0 "[ . 1 . 2 . 3]" 2 62 1 214 ASN O 1 218 ALA N 3.000 . 3.000 3.007 2.993 3.019 0.019 28 0 "[ . 1 . 2 . 3]" 2 63 1 215 LYS O 1 219 GLU H 2.000 . 2.000 2.131 2.121 2.145 0.145 28 0 "[ . 1 . 2 . 3]" 2 64 1 215 LYS O 1 219 GLU N 3.000 . 3.000 3.042 3.029 3.057 0.057 28 0 "[ . 1 . 2 . 3]" 2 65 1 216 ALA O 1 220 MET H 2.000 . 2.000 2.026 2.014 2.036 0.036 27 0 "[ . 1 . 2 . 3]" 2 66 1 216 ALA O 1 220 MET N 3.000 . 3.000 2.965 2.954 2.975 . 0 0 "[ . 1 . 2 . 3]" 2 67 1 217 PHE O 1 221 ARG H 2.000 . 2.000 2.264 2.229 2.285 0.285 30 0 "[ . 1 . 2 . 3]" 2 68 1 217 PHE O 1 221 ARG N 3.000 . 3.000 3.153 3.123 3.171 0.171 30 0 "[ . 1 . 2 . 3]" 2 69 1 218 ALA O 1 222 ALA H 2.000 . 2.000 2.090 2.061 2.108 0.108 28 0 "[ . 1 . 2 . 3]" 2 70 1 218 ALA O 1 222 ALA N 3.000 . 3.000 2.984 2.965 3.001 0.001 12 0 "[ . 1 . 2 . 3]" 2 71 1 226 TYR O 1 230 ALA H 2.000 . 2.000 1.949 1.918 1.971 . 0 0 "[ . 1 . 2 . 3]" 2 72 1 226 TYR O 1 230 ALA N 3.000 . 3.000 2.893 2.860 2.908 . 0 0 "[ . 1 . 2 . 3]" 2 73 1 227 GLU O 1 231 LYS H 2.000 . 2.000 1.903 1.874 1.932 . 0 0 "[ . 1 . 2 . 3]" 2 74 1 227 GLU O 1 231 LYS N 3.000 . 3.000 2.877 2.847 2.901 . 0 0 "[ . 1 . 2 . 3]" 2 stop_ save_
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