NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
575822 | 2me9 | 19521 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2me9 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 579 _Distance_constraint_stats_list.Viol_count 2609 _Distance_constraint_stats_list.Viol_total 6789.642 _Distance_constraint_stats_list.Viol_max 0.827 _Distance_constraint_stats_list.Viol_rms 0.0701 _Distance_constraint_stats_list.Viol_average_all_restraints 0.0293 _Distance_constraint_stats_list.Viol_average_violations_only 0.1301 _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 4 MET 6.626 0.521 7 1 "[ . + 1 . 2]" 1 5 SER 1.716 0.278 20 0 "[ . 1 . 2]" 1 6 GLN 3.679 0.521 7 1 "[ . + 1 . 2]" 1 7 SER 3.095 0.350 3 0 "[ . 1 . 2]" 1 8 ASN 0.000 0.000 . 0 "[ . 1 . 2]" 1 9 ARG 3.095 0.350 3 0 "[ . 1 . 2]" 1 10 GLU 9.551 0.368 9 0 "[ . 1 . 2]" 1 11 LEU 6.182 0.261 3 0 "[ . 1 . 2]" 1 12 VAL 16.860 0.342 10 0 "[ . 1 . 2]" 1 13 VAL 5.005 0.368 9 0 "[ . 1 . 2]" 1 14 ASP 9.849 0.314 14 0 "[ . 1 . 2]" 1 15 PHE 1.600 0.234 4 0 "[ . 1 . 2]" 1 16 LEU 27.519 0.377 20 0 "[ . 1 . 2]" 1 17 SER 7.598 0.312 8 0 "[ . 1 . 2]" 1 18 TYR 11.238 0.371 20 0 "[ . 1 . 2]" 1 19 LYS 1.657 0.137 19 0 "[ . 1 . 2]" 1 20 LEU 22.293 0.371 20 0 "[ . 1 . 2]" 1 21 SER 2.810 0.342 14 0 "[ . 1 . 2]" 1 22 GLN 7.476 0.454 13 0 "[ . 1 . 2]" 1 23 LYS 6.580 0.447 10 0 "[ . 1 . 2]" 1 24 GLY 5.786 0.454 13 0 "[ . 1 . 2]" 1 25 TYR 4.764 0.447 10 0 "[ . 1 . 2]" 1 26 SER 2.909 0.464 19 0 "[ . 1 . 2]" 1 27 TRP 2.749 0.341 18 0 "[ . 1 . 2]" 1 28 SER 0.906 0.464 19 0 "[ . 1 . 2]" 1 29 GLN 2.410 0.377 10 0 "[ . 1 . 2]" 1 30 PHE 0.000 0.000 . 0 "[ . 1 . 2]" 1 31 SER 0.822 0.134 10 0 "[ . 1 . 2]" 1 32 ASP 0.167 0.073 4 0 "[ . 1 . 2]" 1 33 VAL 0.831 0.213 15 0 "[ . 1 . 2]" 1 34 GLU 0.510 0.213 15 0 "[ . 1 . 2]" 1 35 GLU 0.221 0.092 1 0 "[ . 1 . 2]" 1 36 ASN 0.303 0.092 1 0 "[ . 1 . 2]" 1 37 ARG 0.107 0.077 7 0 "[ . 1 . 2]" 1 38 THR 0.050 0.050 4 0 "[ . 1 . 2]" 1 39 GLU 0.050 0.050 4 0 "[ . 1 . 2]" 1 43 GLY 0.034 0.034 16 0 "[ . 1 . 2]" 1 44 THR 0.039 0.034 16 0 "[ . 1 . 2]" 1 45 GLU 0.005 0.005 4 0 "[ . 1 . 2]" 1 46 SER 0.000 0.000 . 0 "[ . 1 . 2]" 1 47 GLU 0.069 0.038 16 0 "[ . 1 . 2]" 1 48 MET 0.408 0.106 13 0 "[ . 1 . 2]" 1 49 GLU 1.255 0.281 11 0 "[ . 1 . 2]" 1 50 THR 0.854 0.281 11 0 "[ . 1 . 2]" 1 52 SER 1.133 0.187 16 0 "[ . 1 . 2]" 1 53 ALA 3.197 0.310 18 0 "[ . 1 . 2]" 1 54 ILE 1.872 0.221 6 0 "[ . 1 . 2]" 1 55 ASN 2.465 0.310 18 0 "[ . 1 . 2]" 1 56 GLY 0.309 0.110 20 0 "[ . 1 . 2]" 1 57 ASN 2.214 0.221 6 0 "[ . 1 . 2]" 1 59 SER 0.433 0.151 8 0 "[ . 1 . 2]" 1 60 TRP 1.006 0.264 8 0 "[ . 1 . 2]" 1 61 HIS 3.157 0.282 12 0 "[ . 1 . 2]" 1 62 LEU 0.000 0.000 . 0 "[ . 1 . 2]" 1 63 ALA 2.090 0.282 12 0 "[ . 1 . 2]" 1 64 ASP 0.205 0.104 4 0 "[ . 1 . 2]" 1 65 SER 0.205 0.104 4 0 "[ . 1 . 2]" 1 67 ALA 0.102 0.052 12 0 "[ . 1 . 2]" 1 68 VAL 0.102 0.052 12 0 "[ . 1 . 2]" 1 69 ASN 0.054 0.054 16 0 "[ . 1 . 2]" 1 70 GLY 0.209 0.082 8 0 "[ . 1 . 2]" 1 71 ALA 0.155 0.082 8 0 "[ . 1 . 2]" 1 73 GLY 0.189 0.060 9 0 "[ . 1 . 2]" 1 74 HIS 0.330 0.079 9 0 "[ . 1 . 2]" 1 75 SER 0.400 0.079 9 0 "[ . 1 . 2]" 1 76 SER 0.259 0.059 4 0 "[ . 1 . 2]" 1 82 GLU 0.465 0.193 3 0 "[ . 1 . 2]" 1 83 VAL 0.515 0.193 3 0 "[ . 1 . 2]" 1 84 ILE 0.339 0.284 1 0 "[ . 1 . 2]" 1 86 MET 0.284 0.284 1 0 "[ . 1 . 2]" 1 87 ALA 0.000 0.000 . 0 "[ . 1 . 2]" 1 88 ALA 0.000 0.000 . 0 "[ . 1 . 2]" 1 89 VAL 3.054 0.250 11 0 "[ . 1 . 2]" 1 90 LYS 0.755 0.245 4 0 "[ . 1 . 2]" 1 91 GLN 2.755 0.250 11 0 "[ . 1 . 2]" 1 92 ALA 5.891 0.449 14 0 "[ . 1 . 2]" 1 93 LEU 7.254 0.253 13 0 "[ . 1 . 2]" 1 94 ARG 4.922 0.449 14 0 "[ . 1 . 2]" 1 95 GLU 4.369 0.253 13 0 "[ . 1 . 2]" 1 96 ALA 9.190 0.340 19 0 "[ . 1 . 2]" 1 97 GLY 3.847 0.192 8 0 "[ . 1 . 2]" 1 98 ASP 8.548 0.340 19 0 "[ . 1 . 2]" 1 99 GLU 9.159 0.418 17 0 "[ . 1 . 2]" 1 100 PHE 2.865 0.261 20 0 "[ . 1 . 2]" 1 101 GLU 11.616 0.418 17 0 "[ . 1 . 2]" 1 102 LEU 0.893 0.198 2 0 "[ . 1 . 2]" 1 103 ARG 4.829 0.297 2 0 "[ . 1 . 2]" 1 104 TYR 0.893 0.198 2 0 "[ . 1 . 2]" 1 105 ARG 0.011 0.011 14 0 "[ . 1 . 2]" 1 106 ARG 0.393 0.192 8 0 "[ . 1 . 2]" 1 107 ALA 0.847 0.192 8 0 "[ . 1 . 2]" 1 108 PHE 0.465 0.151 18 0 "[ . 1 . 2]" 1 109 SER 2.775 0.292 5 0 "[ . 1 . 2]" 1 110 ASP 5.095 0.342 18 0 "[ . 1 . 2]" 1 111 LEU 3.491 0.292 5 0 "[ . 1 . 2]" 1 112 THR 3.979 0.342 18 0 "[ . 1 . 2]" 1 113 SER 1.426 0.190 20 0 "[ . 1 . 2]" 1 114 GLN 3.412 0.256 15 0 "[ . 1 . 2]" 1 115 LEU 10.139 0.368 17 0 "[ . 1 . 2]" 1 116 HIS 2.666 0.256 15 0 "[ . 1 . 2]" 1 117 ILE 9.278 0.368 17 0 "[ . 1 . 2]" 1 118 THR 0.086 0.080 10 0 "[ . 1 . 2]" 1 120 GLY 0.085 0.080 10 0 "[ . 1 . 2]" 1 121 THR 0.000 0.000 . 0 "[ . 1 . 2]" 1 122 ALA 0.000 0.000 . 0 "[ . 1 . 2]" 1 123 TYR 0.000 0.000 . 0 "[ . 1 . 2]" 1 124 GLN 0.000 0.000 . 0 "[ . 1 . 2]" 1 125 SER 1.217 0.194 7 0 "[ . 1 . 2]" 1 126 PHE 0.000 0.000 . 0 "[ . 1 . 2]" 1 127 GLU 1.217 0.194 7 0 "[ . 1 . 2]" 1 128 GLN 1.320 0.191 19 0 "[ . 1 . 2]" 1 129 VAL 2.273 0.220 1 0 "[ . 1 . 2]" 1 130 VAL 3.339 0.225 8 0 "[ . 1 . 2]" 1 131 ASN 0.000 0.000 . 0 "[ . 1 . 2]" 1 132 GLU 4.056 0.279 19 0 "[ . 1 . 2]" 1 133 LEU 2.159 0.225 8 0 "[ . 1 . 2]" 1 134 PHE 4.961 0.279 19 0 "[ . 1 . 2]" 1 135 ARG 3.160 0.212 1 0 "[ . 1 . 2]" 1 136 ASP 1.679 0.201 9 0 "[ . 1 . 2]" 1 137 GLY 4.071 0.212 1 0 "[ . 1 . 2]" 1 138 VAL 6.113 0.326 13 0 "[ . 1 . 2]" 1 139 ASN 3.841 0.326 13 0 "[ . 1 . 2]" 1 140 TRP 11.881 0.386 19 0 "[ . 1 . 2]" 1 141 GLY 9.698 0.393 18 0 "[ . 1 . 2]" 1 142 ARG 3.556 0.386 19 0 "[ . 1 . 2]" 1 143 ILE 12.463 0.393 18 0 "[ . 1 . 2]" 1 144 VAL 0.090 0.045 3 0 "[ . 1 . 2]" 1 145 ALA 5.566 0.384 7 0 "[ . 1 . 2]" 1 146 PHE 3.728 0.254 17 0 "[ . 1 . 2]" 1 147 PHE 5.566 0.384 7 0 "[ . 1 . 2]" 1 148 SER 7.921 0.303 20 0 "[ . 1 . 2]" 1 149 PHE 5.614 0.294 20 0 "[ . 1 . 2]" 1 150 GLY 9.358 0.303 20 0 "[ . 1 . 2]" 1 151 GLY 5.073 0.294 20 0 "[ . 1 . 2]" 1 152 ALA 6.843 0.292 18 0 "[ . 1 . 2]" 1 153 LEU 10.860 0.639 18 1 "[ . 1 . + 2]" 1 154 CYS 2.590 0.639 18 1 "[ . 1 . + 2]" 1 155 VAL 5.329 0.364 9 0 "[ . 1 . 2]" 1 156 GLU 3.739 0.222 3 0 "[ . 1 . 2]" 1 157 SER 3.217 0.242 15 0 "[ . 1 . 2]" 1 158 VAL 3.045 0.374 3 0 "[ . 1 . 2]" 1 159 ASP 5.211 0.305 9 0 "[ . 1 . 2]" 1 160 LYS 3.182 0.544 2 2 "[ + . 1- . 2]" 1 161 GLU 4.695 0.352 17 0 "[ . 1 . 2]" 1 162 MET 6.906 0.544 2 2 "[ + . 1- . 2]" 1 163 GLN 5.509 0.490 17 0 "[ . 1 . 2]" 1 164 VAL 1.653 0.227 8 0 "[ . 1 . 2]" 1 165 LEU 4.594 0.378 4 0 "[ . 1 . 2]" 1 166 VAL 5.290 0.374 3 0 "[ . 1 . 2]" 1 167 SER 8.009 0.463 3 0 "[ . 1 . 2]" 1 168 ARG 5.480 0.275 1 0 "[ . 1 . 2]" 1 169 ILE 16.957 0.463 3 0 "[ . 1 . 2]" 1 170 ALA 2.311 0.223 19 0 "[ . 1 . 2]" 1 171 ALA 5.591 0.348 20 0 "[ . 1 . 2]" 1 172 TRP 2.573 0.205 13 0 "[ . 1 . 2]" 1 173 MET 6.745 0.409 7 0 "[ . 1 . 2]" 1 174 ALA 0.000 0.000 . 0 "[ . 1 . 2]" 1 175 THR 7.990 0.409 7 0 "[ . 1 . 2]" 1 176 TYR 2.131 0.269 6 0 "[ . 1 . 2]" 1 177 LEU 9.520 0.256 18 0 "[ . 1 . 2]" 1 178 ASN 2.604 0.269 6 0 "[ . 1 . 2]" 1 179 ASP 1.480 0.151 16 0 "[ . 1 . 2]" 1 180 HIS 0.000 0.000 . 0 "[ . 1 . 2]" 1 181 LEU 3.978 0.235 8 0 "[ . 1 . 2]" 1 182 GLU 0.235 0.172 1 0 "[ . 1 . 2]" 1 184 TRP 1.136 0.106 18 0 "[ . 1 . 2]" 1 185 ILE 7.767 0.340 13 0 "[ . 1 . 2]" 1 186 GLN 3.313 0.500 19 1 "[ . 1 . +2]" 1 187 GLU 0.000 0.000 . 0 "[ . 1 . 2]" 1 188 ASN 6.489 0.500 19 1 "[ . 1 . +2]" 1 189 GLY 0.453 0.126 13 0 "[ . 1 . 2]" 1 190 GLY 3.556 0.369 19 0 "[ . 1 . 2]" 1 191 TRP 9.811 0.353 9 0 "[ . 1 . 2]" 1 192 ASP 5.253 0.332 20 0 "[ . 1 . 2]" 1 193 THR 4.626 0.353 9 0 "[ . 1 . 2]" 1 194 PHE 3.893 0.332 20 0 "[ . 1 . 2]" 1 195 VAL 2.767 0.201 17 0 "[ . 1 . 2]" 1 196 GLU 4.006 0.271 9 0 "[ . 1 . 2]" 1 197 LEU 4.426 0.276 19 0 "[ . 1 . 2]" 1 198 TYR 4.228 0.271 9 0 "[ . 1 . 2]" 1 199 GLY 2.800 0.276 19 0 "[ . 1 . 2]" 1 200 ASN 3.248 0.296 1 0 "[ . 1 . 2]" 1 201 ASN 1.774 0.296 1 0 "[ . 1 . 2]" 1 202 ALA 1.456 0.229 13 0 "[ . 1 . 2]" 1 203 ALA 3.991 0.827 17 2 "[ . 1 . + -]" 1 204 ALA 1.008 0.156 13 0 "[ . 1 . 2]" 1 205 GLU 3.919 0.827 17 2 "[ . 1 . + -]" 1 206 SER 0.985 0.158 17 0 "[ . 1 . 2]" 1 207 ARG 0.490 0.134 10 0 "[ . 1 . 2]" 1 208 LYS 0.371 0.164 20 0 "[ . 1 . 2]" 1 209 GLY 0.596 0.164 20 0 "[ . 1 . 2]" 1 210 GLN 0.474 0.171 19 0 "[ . 1 . 2]" 1 211 GLU 0.915 0.238 6 0 "[ . 1 . 2]" 1 212 ARG 0.665 0.238 6 0 "[ . 1 . 2]" stop_ loop_ _Distance_constraint_stats.Restraint_ID _Distance_constraint_stats.Atom_1_entity_assembly_ID _Distance_constraint_stats.Atom_1_comp_index_ID _Distance_constraint_stats.Atom_1_comp_ID _Distance_constraint_stats.Atom_1_ID _Distance_constraint_stats.Atom_2_entity_assembly_ID _Distance_constraint_stats.Atom_2_comp_index_ID _Distance_constraint_stats.Atom_2_comp_ID _Distance_constraint_stats.Atom_2_ID _Distance_constraint_stats.Node_1_distance_val _Distance_constraint_stats.Node_1_distance_lower_bound_val _Distance_constraint_stats.Node_1_distance_upper_bound_val _Distance_constraint_stats.Distance_average _Distance_constraint_stats.Distance_minimum _Distance_constraint_stats.Distance_maximum _Distance_constraint_stats.Max_violation _Distance_constraint_stats.Max_violation_model_number _Distance_constraint_stats.Over_cutoff_violation_count _Distance_constraint_stats.Over_cutoff_viol_per_model _Distance_constraint_stats.Distance_constraint_stats_ID 1 1 128 GLN H 1 129 VAL H . . 3.230 2.680 2.502 2.778 . 0 0 "[ . 1 . 2]" 1 2 1 129 VAL H 1 130 VAL H . . 3.200 2.785 2.650 2.906 . 0 0 "[ . 1 . 2]" 1 3 1 186 GLN H 1 187 GLU H . . 3.400 2.713 2.551 2.849 . 0 0 "[ . 1 . 2]" 1 4 1 16 LEU H 1 17 SER H . . 2.700 2.809 2.733 2.918 0.218 9 0 "[ . 1 . 2]" 1 5 1 15 PHE H 1 16 LEU H . . 2.730 2.766 2.565 2.886 0.156 19 0 "[ . 1 . 2]" 1 6 1 14 ASP H 1 16 LEU H . . 3.790 3.982 3.810 4.104 0.314 14 0 "[ . 1 . 2]" 1 7 1 16 LEU H 1 18 TYR H . . 3.680 3.850 3.744 3.980 0.300 14 0 "[ . 1 . 2]" 1 8 1 188 ASN H 1 189 GLY H . . 3.230 2.794 1.865 3.356 0.126 13 0 "[ . 1 . 2]" 1 9 1 189 GLY H 1 190 GLY H . . 2.870 2.368 1.897 2.983 0.113 20 0 "[ . 1 . 2]" 1 10 1 82 GLU H 1 83 VAL H . . 4.130 3.744 2.815 4.323 0.193 3 0 "[ . 1 . 2]" 1 11 1 21 SER H 1 23 LYS H . . 4.160 4.232 3.914 4.502 0.342 14 0 "[ . 1 . 2]" 1 12 1 177 LEU H 1 178 ASN H . . 3.260 2.896 2.791 2.976 . 0 0 "[ . 1 . 2]" 1 13 1 177 LEU H 1 179 ASP H . . 3.930 3.833 3.769 3.911 . 0 0 "[ . 1 . 2]" 1 14 1 176 TYR H 1 177 LEU H . . 2.700 2.536 2.465 2.633 . 0 0 "[ . 1 . 2]" 1 15 1 175 THR H 1 177 LEU H . . 3.820 3.912 3.770 4.046 0.226 1 0 "[ . 1 . 2]" 1 16 1 36 ASN H 1 37 ARG H . . 3.340 2.705 1.971 3.417 0.077 7 0 "[ . 1 . 2]" 1 17 1 34 GLU H 1 35 GLU H . . 3.620 3.003 2.128 3.629 0.009 18 0 "[ . 1 . 2]" 1 18 1 121 THR H 1 122 ALA H . . 3.740 2.651 1.973 3.079 . 0 0 "[ . 1 . 2]" 1 19 1 53 ALA H 1 54 ILE H . . 3.040 2.328 1.948 2.976 . 0 0 "[ . 1 . 2]" 1 20 1 195 VAL H 1 196 GLU H . . 3.060 2.606 2.512 2.712 . 0 0 "[ . 1 . 2]" 1 21 1 140 TRP H 1 141 GLY H . . 2.700 2.842 2.622 2.923 0.223 12 0 "[ . 1 . 2]" 1 22 1 139 ASN H 1 140 TRP H . . 4.650 4.547 4.476 4.638 . 0 0 "[ . 1 . 2]" 1 23 1 140 TRP H 1 143 ILE H . . 4.630 4.803 4.753 4.849 0.219 3 0 "[ . 1 . 2]" 1 24 1 17 SER H 1 20 LEU H . . 4.500 4.723 4.588 4.812 0.312 8 0 "[ . 1 . 2]" 1 25 1 17 SER H 1 18 TYR H . . 2.730 2.742 2.514 2.858 0.128 10 0 "[ . 1 . 2]" 1 26 1 100 PHE H 1 101 GLU H . . 4.320 2.199 2.011 2.444 . 0 0 "[ . 1 . 2]" 1 27 1 93 LEU H 1 96 ALA H . . 4.470 4.648 4.547 4.708 0.238 13 0 "[ . 1 . 2]" 1 28 1 92 ALA H 1 93 LEU H . . 2.810 2.735 2.547 2.869 0.059 13 0 "[ . 1 . 2]" 1 29 1 206 SER H 1 207 ARG H . . 2.700 2.542 1.903 2.834 0.134 10 0 "[ . 1 . 2]" 1 30 1 147 PHE H 1 148 SER H . . 3.090 2.610 2.516 2.725 . 0 0 "[ . 1 . 2]" 1 31 1 145 ALA H 1 147 PHE H . . 3.960 4.238 4.094 4.344 0.384 7 0 "[ . 1 . 2]" 1 32 1 146 PHE H 1 147 PHE H . . 3.060 2.752 2.516 2.832 . 0 0 "[ . 1 . 2]" 1 33 1 163 GLN H 1 164 VAL H . . 2.980 2.791 2.669 2.919 . 0 0 "[ . 1 . 2]" 1 34 1 161 GLU H 1 163 GLN H . . 5.500 5.313 4.261 5.852 0.352 17 0 "[ . 1 . 2]" 1 35 1 30 PHE H 1 31 SER H . . 4.460 2.403 1.998 2.711 . 0 0 "[ . 1 . 2]" 1 36 1 31 SER H 1 33 VAL H . . 4.940 4.490 3.798 4.928 . 0 0 "[ . 1 . 2]" 1 37 1 31 SER H 1 32 ASP H . . 3.540 2.805 2.460 3.373 . 0 0 "[ . 1 . 2]" 1 38 1 108 PHE H 1 109 SER H . . 5.500 4.520 3.951 4.698 . 0 0 "[ . 1 . 2]" 1 39 1 44 THR H 1 45 GLU H . . 3.430 2.667 1.953 3.435 0.005 4 0 "[ . 1 . 2]" 1 40 1 148 SER H 1 151 GLY H . . 4.790 4.700 4.522 4.881 0.091 20 0 "[ . 1 . 2]" 1 41 1 140 TRP H 1 142 ARG H . . 4.120 4.298 4.209 4.506 0.386 19 0 "[ . 1 . 2]" 1 42 1 141 GLY H 1 142 ARG H . . 2.760 2.523 2.413 2.712 . 0 0 "[ . 1 . 2]" 1 43 1 139 ASN H 1 142 ARG H . . 3.680 3.223 2.957 3.504 . 0 0 "[ . 1 . 2]" 1 44 1 88 ALA H 1 89 VAL H . . 5.080 3.921 2.331 4.714 . 0 0 "[ . 1 . 2]" 1 45 1 152 ALA H 1 153 LEU H . . 2.700 2.458 2.375 2.584 . 0 0 "[ . 1 . 2]" 1 46 1 184 TRP H 1 185 ILE H . . 2.840 2.849 2.734 2.936 0.096 13 0 "[ . 1 . 2]" 1 47 1 14 ASP H 1 15 PHE H . . 2.700 2.668 2.468 2.934 0.234 4 0 "[ . 1 . 2]" 1 48 1 61 HIS H 1 63 ALA H . . 3.760 3.819 3.375 4.042 0.282 12 0 "[ . 1 . 2]" 1 49 1 62 LEU H 1 63 ALA H . . 3.650 2.594 2.159 2.770 . 0 0 "[ . 1 . 2]" 1 50 1 7 SER H 1 9 ARG H . . 4.040 4.189 3.975 4.390 0.350 3 0 "[ . 1 . 2]" 1 51 1 6 GLN H 1 7 SER H . . 3.010 2.330 1.833 2.989 . 0 0 "[ . 1 . 2]" 1 52 1 38 THR H 1 39 GLU H . . 2.700 2.408 2.048 2.750 0.050 4 0 "[ . 1 . 2]" 1 53 1 136 ASP H 1 137 GLY H . . 2.700 2.260 1.964 2.770 0.070 19 0 "[ . 1 . 2]" 1 54 1 135 ARG H 1 137 GLY H . . 3.710 3.868 3.781 3.922 0.212 1 0 "[ . 1 . 2]" 1 55 1 75 SER H 1 76 SER H . . 2.700 2.572 1.948 2.759 0.059 4 0 "[ . 1 . 2]" 1 56 1 145 ALA H 1 146 PHE H . . 3.370 2.604 2.443 2.862 . 0 0 "[ . 1 . 2]" 1 57 1 205 GLU H 1 206 SER H . . 2.900 2.671 1.891 3.058 0.158 17 0 "[ . 1 . 2]" 1 58 1 114 GLN H 1 115 LEU H . . 2.920 2.376 2.199 2.755 . 0 0 "[ . 1 . 2]" 1 59 1 114 GLN H 1 116 HIS H . . 3.900 4.033 3.904 4.156 0.256 15 0 "[ . 1 . 2]" 1 60 1 113 SER H 1 114 GLN H . . 2.700 2.474 2.361 2.668 . 0 0 "[ . 1 . 2]" 1 61 1 202 ALA H 1 203 ALA H . . 2.700 2.728 2.523 2.929 0.229 13 0 "[ . 1 . 2]" 1 62 1 203 ALA H 1 204 ALA H . . 2.700 2.434 2.028 2.835 0.135 17 0 "[ . 1 . 2]" 1 63 1 203 ALA H 1 205 GLU H . . 2.700 2.813 2.568 3.527 0.827 17 2 "[ . 1 . + -]" 1 64 1 68 VAL H 1 69 ASN H . . 3.480 2.995 1.953 3.451 . 0 0 "[ . 1 . 2]" 1 65 1 67 ALA H 1 68 VAL H . . 3.150 2.746 2.060 3.202 0.052 12 0 "[ . 1 . 2]" 1 66 1 91 GLN H 1 93 LEU H . . 4.020 3.615 3.058 4.087 0.067 11 0 "[ . 1 . 2]" 1 67 1 89 VAL H 1 91 GLN H . . 4.000 4.120 3.869 4.250 0.250 11 0 "[ . 1 . 2]" 1 68 1 90 LYS H 1 91 GLN H . . 3.430 2.678 2.420 2.820 . 0 0 "[ . 1 . 2]" 1 69 1 132 GLU H 1 133 LEU H . . 3.040 2.588 2.508 2.646 . 0 0 "[ . 1 . 2]" 1 70 1 52 SER H 1 53 ALA H . . 2.700 2.541 1.909 2.887 0.187 16 0 "[ . 1 . 2]" 1 71 1 197 LEU H 1 200 ASN H . . 4.410 4.490 4.224 4.603 0.193 18 0 "[ . 1 . 2]" 1 72 1 199 GLY H 1 200 ASN H . . 3.370 2.210 1.914 2.613 . 0 0 "[ . 1 . 2]" 1 73 1 200 ASN H 1 201 ASN H . . 2.700 2.704 2.198 2.996 0.296 1 0 "[ . 1 . 2]" 1 74 1 23 LYS H 1 25 TYR H . . 3.230 3.256 2.784 3.677 0.447 10 0 "[ . 1 . 2]" 1 75 1 20 LEU H 1 23 LYS H . . 5.000 5.032 4.739 5.233 0.233 18 0 "[ . 1 . 2]" 1 76 1 23 LYS H 1 24 GLY H . . 2.950 2.032 1.864 2.274 . 0 0 "[ . 1 . 2]" 1 77 1 25 TYR H 1 27 TRP H . . 4.660 4.276 3.644 4.820 0.160 5 0 "[ . 1 . 2]" 1 78 1 22 GLN H 1 25 TYR H . . 6.200 4.761 4.307 5.667 . 0 0 "[ . 1 . 2]" 1 79 1 25 TYR H 1 26 SER H . . 3.090 2.880 2.293 3.322 0.232 4 0 "[ . 1 . 2]" 1 80 1 187 GLU H 1 188 ASN H . . 3.090 2.598 2.450 2.836 . 0 0 "[ . 1 . 2]" 1 81 1 188 ASN H 1 190 GLY H . . 3.600 3.715 3.351 3.969 0.369 19 0 "[ . 1 . 2]" 1 82 1 208 LYS H 1 209 GLY H . . 2.760 2.515 1.937 2.924 0.164 20 0 "[ . 1 . 2]" 1 83 1 196 GLU H 1 198 TYR H . . 3.960 4.146 3.866 4.231 0.271 9 0 "[ . 1 . 2]" 1 84 1 197 LEU H 1 198 TYR H . . 2.900 2.593 1.883 2.763 . 0 0 "[ . 1 . 2]" 1 85 1 105 ARG H 1 106 ARG H . . 3.960 3.329 2.769 3.971 0.011 14 0 "[ . 1 . 2]" 1 86 1 87 ALA H 1 88 ALA H . . 4.490 2.341 1.974 2.744 . 0 0 "[ . 1 . 2]" 1 87 1 64 ASP H 1 65 SER H . . 2.700 2.412 1.993 2.804 0.104 4 0 "[ . 1 . 2]" 1 88 1 106 ARG H 1 107 ALA H . . 2.920 2.617 1.860 3.112 0.192 8 0 "[ . 1 . 2]" 1 89 1 20 LEU H 1 21 SER H . . 2.700 2.722 2.612 2.831 0.131 3 0 "[ . 1 . 2]" 1 90 1 18 TYR H 1 20 LEU H . . 3.680 3.945 3.842 4.051 0.371 20 0 "[ . 1 . 2]" 1 91 1 93 LEU H 1 94 ARG H . . 3.150 2.475 2.370 2.563 . 0 0 "[ . 1 . 2]" 1 92 1 94 ARG H 1 95 GLU H . . 3.040 2.733 2.570 2.830 . 0 0 "[ . 1 . 2]" 1 93 1 92 ALA H 1 94 ARG H . . 3.620 3.866 3.762 4.069 0.449 14 0 "[ . 1 . 2]" 1 94 1 166 VAL H 1 167 SER H . . 3.040 2.822 2.696 2.964 . 0 0 "[ . 1 . 2]" 1 95 1 167 SER H 1 168 ARG H . . 3.060 2.574 2.464 2.812 . 0 0 "[ . 1 . 2]" 1 96 1 179 ASP H 1 181 LEU H . . 3.790 3.839 3.773 3.941 0.151 16 0 "[ . 1 . 2]" 1 97 1 181 LEU H 1 182 GLU H . . 3.090 2.476 2.420 2.565 . 0 0 "[ . 1 . 2]" 1 98 1 133 LEU H 1 134 PHE H . . 3.370 2.638 2.468 2.809 . 0 0 "[ . 1 . 2]" 1 99 1 134 PHE H 1 136 ASP H . . 4.600 4.619 4.192 4.801 0.201 9 0 "[ . 1 . 2]" 1 100 1 134 PHE H 1 135 ARG H . . 2.760 2.425 2.190 2.656 . 0 0 "[ . 1 . 2]" 1 101 1 43 GLY H 1 44 THR H . . 3.650 3.307 2.192 3.684 0.034 16 0 "[ . 1 . 2]" 1 102 1 176 TYR H 1 178 ASN H . . 4.410 4.517 4.421 4.679 0.269 6 0 "[ . 1 . 2]" 1 103 1 156 GLU H 1 158 VAL H . . 4.040 4.089 3.927 4.262 0.222 3 0 "[ . 1 . 2]" 1 104 1 156 GLU H 1 157 SER H . . 2.950 2.511 2.324 2.795 . 0 0 "[ . 1 . 2]" 1 105 1 29 GLN H 1 31 SER H . . 3.650 3.682 3.573 3.784 0.134 10 0 "[ . 1 . 2]" 1 106 1 27 TRP H 1 29 GLN H . . 5.140 3.919 2.694 4.553 . 0 0 "[ . 1 . 2]" 1 107 1 45 GLU H 1 46 SER H . . 3.680 3.101 1.975 3.655 . 0 0 "[ . 1 . 2]" 1 108 1 162 MET H 1 163 GLN H . . 3.800 3.771 2.740 4.290 0.490 17 0 "[ . 1 . 2]" 1 109 1 162 MET H 1 164 VAL H . . 5.200 4.457 2.489 5.390 0.190 16 0 "[ . 1 . 2]" 1 110 1 161 GLU H 1 162 MET H . . 2.900 2.181 1.672 2.782 . 0 0 "[ . 1 . 2]" 1 111 1 33 VAL H 1 34 GLU H . . 2.700 2.445 1.913 2.913 0.213 15 0 "[ . 1 . 2]" 1 112 1 54 ILE H 1 57 ASN H . . 4.350 4.216 3.508 4.571 0.221 6 0 "[ . 1 . 2]" 1 113 1 148 SER H 1 150 GLY H . . 3.740 3.944 3.860 4.043 0.303 20 0 "[ . 1 . 2]" 1 114 1 150 GLY H 1 152 ALA H . . 3.790 4.018 3.967 4.082 0.292 18 0 "[ . 1 . 2]" 1 115 1 157 SER H 1 158 VAL H . . 2.980 2.788 2.627 2.932 . 0 0 "[ . 1 . 2]" 1 116 1 73 GLY H 1 74 HIS H . . 3.880 3.329 1.979 3.940 0.060 9 0 "[ . 1 . 2]" 1 117 1 192 ASP H 1 194 PHE H . . 3.850 4.031 3.896 4.182 0.332 20 0 "[ . 1 . 2]" 1 118 1 194 PHE H 1 195 VAL H . . 3.040 2.557 2.431 2.788 . 0 0 "[ . 1 . 2]" 1 119 1 11 LEU H 1 13 VAL H . . 4.000 4.119 4.012 4.261 0.261 3 0 "[ . 1 . 2]" 1 120 1 10 GLU H 1 11 LEU H . . 3.010 2.579 2.479 2.677 . 0 0 "[ . 1 . 2]" 1 121 1 115 LEU H 1 117 ILE H . . 4.940 5.006 4.515 5.207 0.267 15 0 "[ . 1 . 2]" 1 122 1 116 HIS H 1 117 ILE H . . 3.600 3.022 2.757 3.525 . 0 0 "[ . 1 . 2]" 1 123 1 109 SER H 1 111 LEU H . . 4.500 4.516 4.214 4.792 0.292 5 0 "[ . 1 . 2]" 1 124 1 111 LEU H 1 112 THR H . . 3.060 2.771 2.639 2.848 . 0 0 "[ . 1 . 2]" 1 125 1 137 GLY H 1 138 VAL H . . 4.180 4.086 2.243 4.287 0.107 16 0 "[ . 1 . 2]" 1 126 1 170 ALA H 1 172 TRP H . . 4.440 4.402 3.864 4.645 0.205 13 0 "[ . 1 . 2]" 1 127 1 171 ALA H 1 172 TRP H . . 3.120 2.760 2.600 2.909 . 0 0 "[ . 1 . 2]" 1 128 1 172 TRP H 1 173 MET H . . 2.700 2.705 2.551 2.817 0.117 16 0 "[ . 1 . 2]" 1 129 1 32 ASP H 1 33 VAL H . . 2.780 2.564 1.932 2.853 0.073 4 0 "[ . 1 . 2]" 1 130 1 193 THR H 1 195 VAL H . . 4.070 4.186 4.066 4.271 0.201 17 0 "[ . 1 . 2]" 1 131 1 178 ASN H 1 179 ASP H . . 2.700 2.689 2.534 2.816 0.116 1 0 "[ . 1 . 2]" 1 132 1 170 ALA H 1 171 ALA H . . 3.260 2.633 2.528 2.792 . 0 0 "[ . 1 . 2]" 1 133 1 21 SER H 1 22 GLN H . . 3.090 2.703 2.547 2.854 . 0 0 "[ . 1 . 2]" 1 134 1 22 GLN H 1 23 LYS H . . 2.700 2.693 2.509 2.871 0.171 7 0 "[ . 1 . 2]" 1 135 1 20 LEU H 1 22 GLN H . . 3.900 3.951 3.808 4.126 0.226 4 0 "[ . 1 . 2]" 1 136 1 22 GLN H 1 24 GLY H . . 3.740 4.014 3.882 4.194 0.454 13 0 "[ . 1 . 2]" 1 137 1 167 SER H 1 169 ILE H . . 4.000 4.261 4.151 4.463 0.463 3 0 "[ . 1 . 2]" 1 138 1 169 ILE H 1 170 ALA H . . 3.150 2.747 2.600 2.883 . 0 0 "[ . 1 . 2]" 1 139 1 47 GLU H 1 49 GLU H . . 4.880 4.464 3.355 4.918 0.038 16 0 "[ . 1 . 2]" 1 140 1 48 MET H 1 49 GLU H . . 3.400 2.619 1.952 3.262 . 0 0 "[ . 1 . 2]" 1 141 1 13 VAL H 1 14 ASP H . . 2.700 2.592 2.439 2.787 0.087 20 0 "[ . 1 . 2]" 1 142 1 94 ARG H 1 96 ALA H . . 4.210 3.980 3.853 4.081 . 0 0 "[ . 1 . 2]" 1 143 1 96 ALA H 1 98 ASP H . . 3.850 4.132 4.090 4.190 0.340 19 0 "[ . 1 . 2]" 1 144 1 56 GLY H 1 57 ASN H . . 2.700 2.369 1.930 2.810 0.110 20 0 "[ . 1 . 2]" 1 145 1 55 ASN H 1 56 GLY H . . 3.900 2.383 1.974 3.550 . 0 0 "[ . 1 . 2]" 1 146 1 74 HIS H 1 75 SER H . . 3.600 2.687 2.005 3.679 0.079 9 0 "[ . 1 . 2]" 1 147 1 123 TYR H 1 124 GLN H . . 3.120 2.785 2.622 2.965 . 0 0 "[ . 1 . 2]" 1 148 1 123 TYR H 1 125 SER H . . 4.660 4.150 3.880 4.580 . 0 0 "[ . 1 . 2]" 1 149 1 164 VAL H 1 165 LEU H . . 2.920 2.688 2.499 2.821 . 0 0 "[ . 1 . 2]" 1 150 1 165 LEU H 1 167 SER H . . 3.820 3.690 2.800 4.198 0.378 4 0 "[ . 1 . 2]" 1 151 1 165 LEU H 1 166 VAL H . . 2.980 2.215 1.785 2.530 . 0 0 "[ . 1 . 2]" 1 152 1 165 LEU H 1 168 ARG H . . 5.220 4.666 3.806 5.276 0.056 3 0 "[ . 1 . 2]" 1 153 1 117 ILE H 1 118 THR H . . 4.880 3.897 2.910 4.613 . 0 0 "[ . 1 . 2]" 1 154 1 118 THR H 1 120 GLY H . . 5.050 4.747 4.301 5.130 0.080 10 0 "[ . 1 . 2]" 1 155 1 99 GLU H 1 101 GLU H . . 3.570 3.909 3.833 3.988 0.418 17 0 "[ . 1 . 2]" 1 156 1 101 GLU H 1 103 ARG H . . 3.320 3.561 3.502 3.617 0.297 2 0 "[ . 1 . 2]" 1 157 1 59 SER H 1 60 TRP H . . 3.740 2.993 2.287 3.727 . 0 0 "[ . 1 . 2]" 1 158 1 49 GLU H 1 50 THR H . . 2.700 2.617 2.127 2.981 0.281 11 0 "[ . 1 . 2]" 1 159 1 93 LEU H 1 95 GLU H . . 4.160 4.295 4.027 4.413 0.253 13 0 "[ . 1 . 2]" 1 160 1 95 GLU H 1 96 ALA H . . 3.090 2.573 2.515 2.656 . 0 0 "[ . 1 . 2]" 1 161 1 127 GLU H 1 128 GLN H . . 3.230 2.626 2.544 2.852 . 0 0 "[ . 1 . 2]" 1 162 1 126 PHE H 1 127 GLU H . . 3.710 2.724 2.640 2.817 . 0 0 "[ . 1 . 2]" 1 163 1 175 THR H 1 176 TYR H . . 3.650 2.793 2.657 2.898 . 0 0 "[ . 1 . 2]" 1 164 1 27 TRP H 1 28 SER H . . 3.510 2.779 2.055 3.673 0.163 17 0 "[ . 1 . 2]" 1 165 1 28 SER H 1 29 GLN H . . 3.990 2.453 2.241 2.797 . 0 0 "[ . 1 . 2]" 1 166 1 148 SER H 1 149 PHE H . . 3.180 2.656 2.586 2.714 . 0 0 "[ . 1 . 2]" 1 167 1 149 PHE H 1 152 ALA H . . 4.550 4.664 4.604 4.725 0.175 8 0 "[ . 1 . 2]" 1 168 1 149 PHE H 1 150 GLY H . . 3.150 2.608 2.560 2.692 . 0 0 "[ . 1 . 2]" 1 169 1 149 PHE H 1 151 GLY H . . 3.990 4.156 3.967 4.284 0.294 20 0 "[ . 1 . 2]" 1 170 1 69 ASN H 1 70 GLY H . . 3.650 2.811 1.996 3.704 0.054 16 0 "[ . 1 . 2]" 1 171 1 70 GLY H 1 71 ALA H . . 3.820 3.413 2.539 3.902 0.082 8 0 "[ . 1 . 2]" 1 172 1 196 GLU H 1 197 LEU H . . 2.700 2.598 2.412 2.804 0.104 20 0 "[ . 1 . 2]" 1 173 1 197 LEU H 1 199 GLY H . . 3.960 4.029 3.067 4.236 0.276 19 0 "[ . 1 . 2]" 1 174 1 26 SER H 1 27 TRP H . . 3.710 2.257 1.850 3.908 0.198 19 0 "[ . 1 . 2]" 1 175 1 26 SER H 1 29 GLN H . . 4.100 4.066 3.184 4.477 0.377 10 0 "[ . 1 . 2]" 1 176 1 26 SER H 1 28 SER H . . 4.490 3.511 2.459 4.954 0.464 19 0 "[ . 1 . 2]" 1 177 1 126 PHE H 1 128 GLN H . . 5.280 4.098 3.888 4.550 . 0 0 "[ . 1 . 2]" 1 178 1 155 VAL H 1 156 GLU H . . 2.700 2.704 2.460 2.901 0.201 2 0 "[ . 1 . 2]" 1 179 1 128 GLN H 1 130 VAL H . . 4.070 4.077 3.889 4.261 0.191 19 0 "[ . 1 . 2]" 1 180 1 130 VAL H 1 131 ASN H . . 3.340 2.563 2.392 2.732 . 0 0 "[ . 1 . 2]" 1 181 1 89 VAL H 1 90 LYS H . . 3.290 2.610 2.390 3.034 . 0 0 "[ . 1 . 2]" 1 182 1 146 PHE H 1 148 SER H . . 4.020 4.204 4.134 4.274 0.254 17 0 "[ . 1 . 2]" 1 183 1 112 THR H 1 115 LEU H . . 5.140 4.654 4.485 5.132 . 0 0 "[ . 1 . 2]" 1 184 1 132 GLU H 1 134 PHE H . . 3.650 3.821 3.740 3.929 0.279 19 0 "[ . 1 . 2]" 1 185 1 130 VAL H 1 132 GLU H . . 4.130 4.047 3.584 4.239 0.109 8 0 "[ . 1 . 2]" 1 186 1 4 MET H 1 5 SER H . . 2.700 2.521 1.943 2.978 0.278 20 0 "[ . 1 . 2]" 1 187 1 47 GLU H 1 48 MET H . . 3.760 2.623 2.060 3.314 . 0 0 "[ . 1 . 2]" 1 188 1 60 TRP H 1 61 HIS H . . 2.700 2.614 2.005 2.964 0.264 8 0 "[ . 1 . 2]" 1 189 1 180 HIS H 1 181 LEU H . . 3.290 1.920 1.867 2.101 . 0 0 "[ . 1 . 2]" 1 190 1 179 ASP H 1 180 HIS H . . 3.260 3.032 2.877 3.168 . 0 0 "[ . 1 . 2]" 1 191 1 112 THR H 1 114 GLN H . . 3.850 3.873 3.764 3.985 0.135 13 0 "[ . 1 . 2]" 1 192 1 9 ARG H 1 10 GLU H . . 3.370 2.746 2.524 2.892 . 0 0 "[ . 1 . 2]" 1 193 1 8 ASN H 1 10 GLU H . . 4.550 4.124 3.854 4.491 . 0 0 "[ . 1 . 2]" 1 194 1 10 GLU H 1 12 VAL H . . 4.100 4.270 4.011 4.442 0.342 10 0 "[ . 1 . 2]" 1 195 1 139 ASN H 1 141 GLY H . . 4.490 4.601 4.449 4.709 0.219 16 0 "[ . 1 . 2]" 1 196 1 138 VAL H 1 139 ASN H . . 3.480 3.485 3.093 3.806 0.326 13 0 "[ . 1 . 2]" 1 197 1 153 LEU H 1 154 CYS H . . 2.700 2.519 2.332 2.800 0.100 5 0 "[ . 1 . 2]" 1 198 1 35 GLU H 1 36 ASN H . . 3.600 3.027 2.130 3.692 0.092 1 0 "[ . 1 . 2]" 1 199 1 33 VAL H 1 35 GLU H . . 5.500 4.904 3.920 5.589 0.089 7 0 "[ . 1 . 2]" 1 200 1 86 MET H 1 87 ALA H . . 3.960 2.814 2.103 3.398 . 0 0 "[ . 1 . 2]" 1 201 1 124 GLN H 1 125 SER H . . 3.760 2.777 2.628 2.943 . 0 0 "[ . 1 . 2]" 1 202 1 24 GLY H 1 25 TYR H . . 2.840 2.384 1.783 3.034 0.194 17 0 "[ . 1 . 2]" 1 203 1 99 GLU H 1 100 PHE H . . 3.340 2.692 2.643 2.746 . 0 0 "[ . 1 . 2]" 1 204 1 98 ASP H 1 99 GLU H . . 2.700 2.641 2.600 2.698 . 0 0 "[ . 1 . 2]" 1 205 1 97 GLY H 1 99 GLU H . . 3.850 3.969 3.898 4.042 0.192 8 0 "[ . 1 . 2]" 1 206 1 115 LEU H 1 116 HIS H . . 3.120 2.672 2.154 3.107 . 0 0 "[ . 1 . 2]" 1 207 1 7 SER H 1 8 ASN H . . 3.600 2.774 2.444 3.122 . 0 0 "[ . 1 . 2]" 1 208 1 8 ASN H 1 9 ARG H . . 3.200 2.794 2.677 2.954 . 0 0 "[ . 1 . 2]" 1 209 1 131 ASN H 1 132 GLU H . . 3.120 2.787 2.688 2.885 . 0 0 "[ . 1 . 2]" 1 210 1 154 CYS H 1 155 VAL H . . 2.700 2.769 2.598 2.869 0.169 16 0 "[ . 1 . 2]" 1 211 1 19 LYS H 1 20 LEU H . . 2.700 2.556 2.441 2.678 . 0 0 "[ . 1 . 2]" 1 212 1 18 TYR H 1 19 LYS H . . 2.700 2.780 2.738 2.837 0.137 19 0 "[ . 1 . 2]" 1 213 1 144 VAL H 1 145 ALA H . . 3.820 2.654 2.588 2.692 . 0 0 "[ . 1 . 2]" 1 214 1 151 GLY H 1 152 ALA H . . 3.230 2.411 2.300 2.495 . 0 0 "[ . 1 . 2]" 1 215 1 150 GLY H 1 151 GLY H . . 3.200 2.589 2.444 2.774 . 0 0 "[ . 1 . 2]" 1 216 1 151 GLY H 1 153 LEU H . . 3.880 3.946 3.790 4.145 0.265 18 0 "[ . 1 . 2]" 1 217 1 190 GLY H 1 191 TRP H . . 3.900 3.572 1.986 4.136 0.236 13 0 "[ . 1 . 2]" 1 218 1 159 ASP H 1 161 GLU H . . 4.020 4.139 3.905 4.325 0.305 9 0 "[ . 1 . 2]" 1 219 1 174 ALA H 1 175 THR H . . 3.460 2.746 2.576 2.838 . 0 0 "[ . 1 . 2]" 1 220 1 169 ILE H 1 171 ALA H . . 4.210 4.222 4.038 4.431 0.221 7 0 "[ . 1 . 2]" 1 221 1 91 GLN H 1 92 ALA H . . 3.320 2.068 1.956 2.303 . 0 0 "[ . 1 . 2]" 1 222 1 90 LYS H 1 92 ALA H . . 4.260 4.205 3.902 4.505 0.245 4 0 "[ . 1 . 2]" 1 223 1 180 HIS H 1 182 GLU H . . 3.740 3.566 3.468 3.736 . 0 0 "[ . 1 . 2]" 1 224 1 160 LYS H 1 162 MET H . . 3.720 3.792 3.251 4.264 0.544 2 2 "[ + . 1- . 2]" 1 225 1 160 LYS H 1 161 GLU H . . 2.900 2.360 2.148 2.794 . 0 0 "[ . 1 . 2]" 1 226 1 159 ASP H 1 160 LYS H . . 2.950 2.571 2.483 2.666 . 0 0 "[ . 1 . 2]" 1 227 1 54 ILE H 1 55 ASN H . . 3.370 2.346 2.007 3.185 . 0 0 "[ . 1 . 2]" 1 228 1 53 ALA H 1 55 ASN H . . 3.650 3.619 2.843 3.960 0.310 18 0 "[ . 1 . 2]" 1 229 1 55 ASN H 1 57 ASN H . . 3.990 3.555 2.823 4.210 0.220 11 0 "[ . 1 . 2]" 1 230 1 166 VAL H 1 168 ARG H . . 4.040 4.177 4.035 4.291 0.251 2 0 "[ . 1 . 2]" 1 231 1 5 SER H 1 6 GLN H . . 2.700 2.414 1.992 2.913 0.213 5 0 "[ . 1 . 2]" 1 232 1 4 MET H 1 6 GLN H . . 2.810 2.954 2.611 3.331 0.521 7 1 "[ . + 1 . 2]" 1 233 1 158 VAL H 1 159 ASP H . . 2.920 2.765 2.632 2.870 . 0 0 "[ . 1 . 2]" 1 234 1 157 SER H 1 159 ASP H . . 4.100 4.227 4.040 4.342 0.242 15 0 "[ . 1 . 2]" 1 235 1 135 ARG H 1 136 ASP H . . 2.980 2.701 2.195 2.959 . 0 0 "[ . 1 . 2]" 1 236 1 186 GLN H 1 188 ASN H . . 3.790 3.950 3.729 4.290 0.500 19 1 "[ . 1 . +2]" 1 237 1 185 ILE H 1 186 GLN H . . 2.700 2.591 2.459 2.702 0.002 6 0 "[ . 1 . 2]" 1 238 1 168 ARG H 1 170 ALA H . . 3.900 3.924 3.767 4.123 0.223 19 0 "[ . 1 . 2]" 1 239 1 168 ARG H 1 169 ILE H . . 2.870 2.471 2.343 2.623 . 0 0 "[ . 1 . 2]" 1 240 1 198 TYR H 1 199 GLY H . . 2.700 2.632 2.209 2.795 0.095 9 0 "[ . 1 . 2]" 1 241 1 125 SER H 1 127 GLU H . . 3.820 3.874 3.740 4.014 0.194 7 0 "[ . 1 . 2]" 1 242 1 125 SER H 1 126 PHE H . . 4.130 2.565 2.464 2.743 . 0 0 "[ . 1 . 2]" 1 243 1 141 GLY H 1 143 ILE H . . 3.790 4.011 3.870 4.183 0.393 18 0 "[ . 1 . 2]" 1 244 1 142 ARG H 1 143 ILE H . . 3.340 2.427 2.340 2.619 . 0 0 "[ . 1 . 2]" 1 245 1 139 ASN H 1 143 ILE H . . 4.100 3.951 3.446 4.309 0.209 19 0 "[ . 1 . 2]" 1 246 1 143 ILE H 1 144 VAL H . . 3.180 2.653 2.575 2.801 . 0 0 "[ . 1 . 2]" 1 247 1 57 ASN H 1 59 SER H . . 5.500 5.254 3.808 5.651 0.151 8 0 "[ . 1 . 2]" 1 248 1 59 SER H 1 61 HIS H . . 5.500 4.657 2.997 5.561 0.061 17 0 "[ . 1 . 2]" 1 249 1 109 SER H 1 110 ASP H . . 4.300 4.385 4.320 4.522 0.222 19 0 "[ . 1 . 2]" 1 250 1 110 ASP H 1 111 LEU H . . 2.700 2.522 2.331 2.823 0.123 16 0 "[ . 1 . 2]" 1 251 1 98 ASP H 1 100 PHE H . . 4.160 4.303 4.259 4.421 0.261 20 0 "[ . 1 . 2]" 1 252 1 12 VAL H 1 14 ASP H . . 3.850 4.081 4.003 4.152 0.302 13 0 "[ . 1 . 2]" 1 253 1 11 LEU H 1 12 VAL H . . 2.700 2.702 2.512 2.845 0.145 4 0 "[ . 1 . 2]" 1 254 1 12 VAL H 1 13 VAL H . . 2.980 2.566 2.430 2.724 . 0 0 "[ . 1 . 2]" 1 255 1 102 LEU H 1 103 ARG H . . 2.700 2.531 2.451 2.688 . 0 0 "[ . 1 . 2]" 1 256 1 209 GLY H 1 210 GLN H . . 3.460 2.969 2.040 3.555 0.095 5 0 "[ . 1 . 2]" 1 257 1 210 GLN H 1 211 GLU H . . 3.370 2.894 2.321 3.541 0.171 19 0 "[ . 1 . 2]" 1 258 1 173 MET H 1 175 THR H . . 3.620 3.923 3.827 4.029 0.409 7 0 "[ . 1 . 2]" 1 259 1 96 ALA H 1 97 GLY H . . 3.040 2.676 2.612 2.742 . 0 0 "[ . 1 . 2]" 1 260 1 95 GLU H 1 97 GLY H . . 4.070 4.141 4.027 4.208 0.138 3 0 "[ . 1 . 2]" 1 261 1 97 GLY H 1 98 ASP H . . 3.150 2.506 2.422 2.591 . 0 0 "[ . 1 . 2]" 1 262 1 192 ASP H 1 193 THR H . . 3.120 2.532 2.381 2.786 . 0 0 "[ . 1 . 2]" 1 263 1 193 THR H 1 194 PHE H . . 2.810 2.564 2.426 2.774 . 0 0 "[ . 1 . 2]" 1 264 1 191 TRP H 1 193 THR H . . 4.020 4.132 3.957 4.373 0.353 9 0 "[ . 1 . 2]" 1 265 1 104 TYR H 1 105 ARG H . . 3.230 2.398 1.993 2.763 . 0 0 "[ . 1 . 2]" 1 266 1 103 ARG H 1 104 TYR H . . 3.150 2.823 2.495 3.008 . 0 0 "[ . 1 . 2]" 1 267 1 100 PHE H 1 102 LEU H . . 4.660 4.326 4.059 4.629 . 0 0 "[ . 1 . 2]" 1 268 1 101 GLU H 1 102 LEU H . . 2.840 2.737 2.697 2.773 . 0 0 "[ . 1 . 2]" 1 269 1 211 GLU H 1 212 ARG H . . 2.700 2.508 2.033 2.938 0.238 6 0 "[ . 1 . 2]" 1 270 1 83 VAL H 1 84 ILE H . . 4.550 4.023 1.959 4.600 0.050 12 0 "[ . 1 . 2]" 1 271 1 191 TRP H 1 192 ASP H . . 2.700 2.777 2.641 2.905 0.205 4 0 "[ . 1 . 2]" 1 272 1 204 ALA H 1 205 GLU H . . 2.730 2.609 2.116 2.886 0.156 13 0 "[ . 1 . 2]" 1 273 1 113 SER H 1 115 LEU H . . 4.000 4.069 3.961 4.190 0.190 20 0 "[ . 1 . 2]" 1 274 1 112 THR H 1 113 SER H . . 3.480 2.680 2.427 2.903 . 0 0 "[ . 1 . 2]" 1 275 1 107 ALA H 1 108 PHE H . . 3.570 3.251 2.744 3.721 0.151 18 0 "[ . 1 . 2]" 1 276 1 173 MET H 1 174 ALA H . . 4.630 2.896 2.548 3.124 . 0 0 "[ . 1 . 2]" 1 277 1 201 ASN H 1 202 ALA H . . 2.920 2.822 2.007 3.042 0.122 12 0 "[ . 1 . 2]" 1 278 1 4 MET H 1 191 TRP HE1 . . 4.740 4.857 4.745 5.061 0.321 13 0 "[ . 1 . 2]" 1 279 1 140 TRP HE1 1 188 ASN H . . 5.500 5.480 5.363 5.683 0.183 19 0 "[ . 1 . 2]" 1 280 1 154 CYS HG 1 155 VAL H . . 4.410 2.709 1.688 4.377 . 0 0 "[ . 1 . 2]" 1 281 1 138 VAL H 1 184 TRP HE1 . . 5.390 4.528 2.020 5.450 0.060 6 0 "[ . 1 . 2]" 1 282 1 153 LEU H 1 154 CYS HG . . 5.160 4.175 3.554 5.799 0.639 18 1 "[ . 1 . + 2]" 1 283 1 111 LEU MD2 1 129 VAL H . . 6.210 5.670 4.271 6.274 0.064 15 0 "[ . 1 . 2]" 1 284 1 111 LEU MD1 1 129 VAL H . . 6.210 5.703 4.703 6.301 0.091 12 0 "[ . 1 . 2]" 1 285 1 16 LEU H 1 16 LEU MD2 . . 5.460 3.914 3.139 4.326 . 0 0 "[ . 1 . 2]" 1 286 1 16 LEU H 1 16 LEU MD1 . . 5.460 3.397 2.339 3.901 . 0 0 "[ . 1 . 2]" 1 287 1 82 GLU H 1 83 VAL MG1 . . 6.520 5.166 3.436 6.183 . 0 0 "[ . 1 . 2]" 1 288 1 82 GLU H 1 83 VAL MG2 . . 6.520 4.609 2.852 6.246 . 0 0 "[ . 1 . 2]" 1 289 1 165 LEU MD1 1 172 TRP HE1 . . 6.520 6.020 4.378 6.666 0.146 7 0 "[ . 1 . 2]" 1 290 1 165 LEU MD2 1 172 TRP HE1 . . 6.520 6.045 4.459 6.683 0.163 6 0 "[ . 1 . 2]" 1 291 1 33 VAL MG2 1 34 GLU H . . 5.040 3.567 2.100 4.401 . 0 0 "[ . 1 . 2]" 1 292 1 33 VAL MG1 1 34 GLU H . . 5.040 3.777 2.440 4.434 . 0 0 "[ . 1 . 2]" 1 293 1 195 VAL MG1 1 196 GLU H . . 5.260 3.315 2.143 4.057 . 0 0 "[ . 1 . 2]" 1 294 1 195 VAL MG2 1 196 GLU H . . 5.260 3.737 2.105 4.044 . 0 0 "[ . 1 . 2]" 1 295 1 16 LEU MD2 1 17 SER H . . 6.520 4.304 3.804 4.672 . 0 0 "[ . 1 . 2]" 1 296 1 16 LEU MD1 1 17 SER H . . 6.520 4.406 4.118 4.838 . 0 0 "[ . 1 . 2]" 1 297 1 84 ILE MD 1 86 MET H . . 6.490 5.235 3.145 6.774 0.284 1 0 "[ . 1 . 2]" 1 298 1 185 ILE MD 1 191 TRP HE1 . . 4.560 4.323 3.477 4.690 0.130 19 0 "[ . 1 . 2]" 1 299 1 163 GLN H 1 164 VAL MG2 . . 6.010 5.436 3.860 6.237 0.227 8 0 "[ . 1 . 2]" 1 300 1 163 GLN H 1 164 VAL MG1 . . 6.010 4.394 3.911 6.069 0.059 6 0 "[ . 1 . 2]" 1 301 1 184 TRP H 1 185 ILE MD . . 6.180 5.139 4.819 5.748 . 0 0 "[ . 1 . 2]" 1 302 1 15 PHE H 1 16 LEU MD2 . . 6.520 5.950 5.001 6.499 . 0 0 "[ . 1 . 2]" 1 303 1 15 PHE H 1 16 LEU MD1 . . 6.520 5.305 4.224 6.105 . 0 0 "[ . 1 . 2]" 1 304 1 144 VAL MG1 1 145 ALA H . . 5.400 3.081 2.154 4.092 . 0 0 "[ . 1 . 2]" 1 305 1 144 VAL MG2 1 145 ALA H . . 5.400 3.875 2.199 4.106 . 0 0 "[ . 1 . 2]" 1 306 1 164 VAL H 1 164 VAL MG2 . . 4.450 3.294 1.990 3.932 . 0 0 "[ . 1 . 2]" 1 307 1 164 VAL H 1 164 VAL MG1 . . 4.450 2.451 2.038 3.790 . 0 0 "[ . 1 . 2]" 1 308 1 111 LEU MD2 1 114 GLN H . . 6.520 4.981 3.931 6.102 . 0 0 "[ . 1 . 2]" 1 309 1 111 LEU MD1 1 114 GLN H . . 6.520 5.087 3.633 6.370 . 0 0 "[ . 1 . 2]" 1 310 1 197 LEU MD2 1 200 ASN H . . 6.520 5.300 3.885 6.496 . 0 0 "[ . 1 . 2]" 1 311 1 197 LEU MD1 1 200 ASN H . . 6.520 5.100 3.317 6.511 . 0 0 "[ . 1 . 2]" 1 312 1 20 LEU MD2 1 25 TYR H . . 6.520 5.492 3.669 6.686 0.166 1 0 "[ . 1 . 2]" 1 313 1 20 LEU MD1 1 25 TYR H . . 6.520 5.634 3.776 6.753 0.233 11 0 "[ . 1 . 2]" 1 314 1 197 LEU MD2 1 198 TYR H . . 6.270 4.713 3.095 5.456 . 0 0 "[ . 1 . 2]" 1 315 1 197 LEU MD1 1 198 TYR H . . 6.270 4.823 3.924 5.517 . 0 0 "[ . 1 . 2]" 1 316 1 20 LEU H 1 20 LEU MD2 . . 5.230 3.409 2.292 4.094 . 0 0 "[ . 1 . 2]" 1 317 1 20 LEU H 1 20 LEU MD1 . . 5.230 3.069 2.397 4.190 . 0 0 "[ . 1 . 2]" 1 318 1 20 LEU MD2 1 27 TRP H . . 6.520 5.859 4.183 6.861 0.341 18 0 "[ . 1 . 2]" 1 319 1 20 LEU MD1 1 27 TRP H . . 6.520 5.911 3.133 6.727 0.207 5 0 "[ . 1 . 2]" 1 320 1 166 VAL MG2 1 167 SER H . . 5.600 3.915 3.601 4.288 . 0 0 "[ . 1 . 2]" 1 321 1 166 VAL MG1 1 167 SER H . . 5.600 2.882 2.075 3.843 . 0 0 "[ . 1 . 2]" 1 322 1 181 LEU H 1 185 ILE MD . . 6.520 5.010 4.642 5.824 . 0 0 "[ . 1 . 2]" 1 323 1 133 LEU MD2 1 134 PHE H . . 6.520 4.823 3.920 5.119 . 0 0 "[ . 1 . 2]" 1 324 1 133 LEU MD1 1 134 PHE H . . 6.520 4.603 4.211 5.014 . 0 0 "[ . 1 . 2]" 1 325 1 156 GLU H 1 169 ILE MD . . 5.600 5.571 4.996 5.801 0.201 18 0 "[ . 1 . 2]" 1 326 1 33 VAL H 1 33 VAL MG2 . . 4.110 2.791 2.040 3.967 . 0 0 "[ . 1 . 2]" 1 327 1 33 VAL H 1 33 VAL MG1 . . 4.110 3.432 2.102 4.062 . 0 0 "[ . 1 . 2]" 1 328 1 16 LEU MD2 1 150 GLY H . . 6.520 5.952 4.704 6.624 0.104 11 0 "[ . 1 . 2]" 1 329 1 16 LEU MD1 1 150 GLY H . . 6.520 5.415 4.322 6.612 0.092 4 0 "[ . 1 . 2]" 1 330 1 12 VAL MG2 1 14 ASP H . . 5.960 5.082 4.301 5.709 . 0 0 "[ . 1 . 2]" 1 331 1 12 VAL MG1 1 14 ASP H . . 5.960 4.784 4.284 5.542 . 0 0 "[ . 1 . 2]" 1 332 1 194 PHE H 1 195 VAL MG1 . . 5.900 5.397 3.836 5.942 0.042 7 0 "[ . 1 . 2]" 1 333 1 194 PHE H 1 195 VAL MG2 . . 5.900 4.388 3.847 6.081 0.181 20 0 "[ . 1 . 2]" 1 334 1 117 ILE H 1 117 ILE MD . . 5.180 3.777 3.001 4.519 . 0 0 "[ . 1 . 2]" 1 335 1 111 LEU H 1 111 LEU MD2 . . 5.820 4.028 3.171 4.471 . 0 0 "[ . 1 . 2]" 1 336 1 111 LEU H 1 111 LEU MD1 . . 5.820 3.931 3.257 4.369 . 0 0 "[ . 1 . 2]" 1 337 1 128 GLN H 1 129 VAL MG2 . . 6.460 4.323 3.579 5.959 . 0 0 "[ . 1 . 2]" 1 338 1 128 GLN H 1 129 VAL MG1 . . 6.460 4.707 3.597 5.953 . 0 0 "[ . 1 . 2]" 1 339 1 32 ASP H 1 33 VAL MG2 . . 6.520 3.967 2.580 6.215 . 0 0 "[ . 1 . 2]" 1 340 1 32 ASP H 1 33 VAL MG1 . . 6.520 4.910 2.684 6.325 . 0 0 "[ . 1 . 2]" 1 341 1 195 VAL H 1 195 VAL MG1 . . 4.590 3.398 2.102 3.807 . 0 0 "[ . 1 . 2]" 1 342 1 195 VAL H 1 195 VAL MG2 . . 4.590 2.507 2.067 3.801 . 0 0 "[ . 1 . 2]" 1 343 1 16 LEU MD2 1 170 ALA H . . 5.990 4.020 2.953 5.412 . 0 0 "[ . 1 . 2]" 1 344 1 169 ILE MD 1 170 ALA H . . 5.880 4.222 3.333 5.024 . 0 0 "[ . 1 . 2]" 1 345 1 16 LEU MD1 1 170 ALA H . . 5.990 4.514 2.638 5.387 . 0 0 "[ . 1 . 2]" 1 346 1 169 ILE H 1 169 ILE MD . . 4.760 3.924 3.394 4.436 . 0 0 "[ . 1 . 2]" 1 347 1 117 ILE MD 1 169 ILE H . . 5.480 4.936 4.092 5.655 0.175 19 0 "[ . 1 . 2]" 1 348 1 49 GLU H 1 54 ILE MD . . 6.380 5.388 2.631 6.520 0.140 20 0 "[ . 1 . 2]" 1 349 1 13 VAL H 1 13 VAL MG1 . . 4.060 3.145 2.182 3.737 . 0 0 "[ . 1 . 2]" 1 350 1 13 VAL H 1 13 VAL MG2 . . 4.060 2.361 1.939 2.808 . 0 0 "[ . 1 . 2]" 1 351 1 164 VAL MG2 1 165 LEU H . . 5.090 3.826 2.313 4.365 . 0 0 "[ . 1 . 2]" 1 352 1 165 LEU H 1 165 LEU MD1 . . 5.540 4.260 3.399 4.673 . 0 0 "[ . 1 . 2]" 1 353 1 164 VAL MG1 1 165 LEU H . . 5.090 3.047 2.105 4.352 . 0 0 "[ . 1 . 2]" 1 354 1 165 LEU H 1 165 LEU MD2 . . 5.540 4.144 3.611 4.902 . 0 0 "[ . 1 . 2]" 1 355 1 153 LEU MD1 1 155 VAL H . . 5.870 5.308 4.415 6.234 0.364 9 0 "[ . 1 . 2]" 1 356 1 155 VAL H 1 169 ILE MD . . 6.520 4.824 4.276 5.526 . 0 0 "[ . 1 . 2]" 1 357 1 153 LEU MD2 1 155 VAL H . . 5.870 5.309 4.581 6.026 0.156 4 0 "[ . 1 . 2]" 1 358 1 111 LEU MD2 1 130 VAL H . . 6.100 5.909 5.113 6.172 0.072 15 0 "[ . 1 . 2]" 1 359 1 129 VAL MG2 1 130 VAL H . . 6.070 3.045 2.092 4.099 . 0 0 "[ . 1 . 2]" 1 360 1 111 LEU MD1 1 130 VAL H . . 6.100 5.929 5.450 6.254 0.154 4 0 "[ . 1 . 2]" 1 361 1 129 VAL MG1 1 130 VAL H . . 6.070 3.418 2.041 4.083 . 0 0 "[ . 1 . 2]" 1 362 1 111 LEU MD2 1 115 LEU H . . 6.010 4.483 3.369 5.906 . 0 0 "[ . 1 . 2]" 1 363 1 111 LEU MD1 1 115 LEU H . . 6.010 4.660 2.846 5.976 . 0 0 "[ . 1 . 2]" 1 364 1 10 GLU H 1 13 VAL MG1 . . 5.500 5.378 4.554 5.868 0.368 9 0 "[ . 1 . 2]" 1 365 1 10 GLU H 1 185 ILE MD . . 6.300 6.502 6.345 6.640 0.340 13 0 "[ . 1 . 2]" 1 366 1 10 GLU H 1 13 VAL MG2 . . 5.370 4.561 4.090 4.946 . 0 0 "[ . 1 . 2]" 1 367 1 138 VAL MG1 1 139 ASN H . . 5.040 4.007 3.183 4.333 . 0 0 "[ . 1 . 2]" 1 368 1 138 VAL MG2 1 139 ASN H . . 5.040 3.831 3.341 4.349 . 0 0 "[ . 1 . 2]" 1 369 1 185 ILE H 1 185 ILE MD . . 5.850 3.307 3.056 3.679 . 0 0 "[ . 1 . 2]" 1 370 1 153 LEU MD1 1 157 SER H . . 6.520 4.286 3.402 5.418 . 0 0 "[ . 1 . 2]" 1 371 1 157 SER H 1 169 ILE MD . . 5.370 4.887 4.210 5.604 0.234 14 0 "[ . 1 . 2]" 1 372 1 153 LEU MD2 1 157 SER H . . 6.520 4.601 2.757 6.597 0.077 18 0 "[ . 1 . 2]" 1 373 1 140 TRP HE1 1 143 ILE MD . . 6.400 6.390 5.812 6.554 0.154 6 0 "[ . 1 . 2]" 1 374 1 153 LEU MD1 1 154 CYS H . . 5.850 3.870 2.676 5.389 . 0 0 "[ . 1 . 2]" 1 375 1 154 CYS H 1 169 ILE MD . . 4.780 2.996 2.132 3.799 . 0 0 "[ . 1 . 2]" 1 376 1 153 LEU MD2 1 154 CYS H . . 5.850 3.751 2.425 4.378 . 0 0 "[ . 1 . 2]" 1 377 1 19 LYS H 1 20 LEU MD2 . . 6.180 5.085 3.758 5.918 . 0 0 "[ . 1 . 2]" 1 378 1 19 LYS H 1 20 LEU MD1 . . 6.180 4.696 3.918 6.242 0.062 14 0 "[ . 1 . 2]" 1 379 1 16 LEU MD2 1 151 GLY H . . 6.020 4.971 3.426 6.032 0.012 18 0 "[ . 1 . 2]" 1 380 1 16 LEU MD1 1 151 GLY H . . 6.020 4.502 3.035 5.943 . 0 0 "[ . 1 . 2]" 1 381 1 16 LEU MD2 1 171 ALA H . . 6.520 5.603 4.533 6.868 0.348 20 0 "[ . 1 . 2]" 1 382 1 16 LEU MD1 1 171 ALA H . . 6.520 5.932 4.434 6.865 0.345 14 0 "[ . 1 . 2]" 1 383 1 177 LEU MD1 1 182 GLU H . . 6.520 6.220 5.700 6.692 0.172 1 0 "[ . 1 . 2]" 1 384 1 181 LEU MD2 1 182 GLU H . . 6.520 4.728 4.413 5.263 . 0 0 "[ . 1 . 2]" 1 385 1 177 LEU MD2 1 182 GLU H . . 6.520 5.490 5.041 5.914 . 0 0 "[ . 1 . 2]" 1 386 1 182 GLU H 1 185 ILE MD . . 6.350 4.450 4.088 5.124 . 0 0 "[ . 1 . 2]" 1 387 1 181 LEU MD1 1 182 GLU H . . 6.520 4.845 4.316 5.290 . 0 0 "[ . 1 . 2]" 1 388 1 158 VAL MG1 1 160 LYS H . . 6.520 4.691 4.024 5.646 . 0 0 "[ . 1 . 2]" 1 389 1 158 VAL MG2 1 160 LYS H . . 6.520 4.976 4.021 5.768 . 0 0 "[ . 1 . 2]" 1 390 1 158 VAL MG1 1 159 ASP H . . 5.930 3.157 1.906 4.085 . 0 0 "[ . 1 . 2]" 1 391 1 158 VAL MG2 1 159 ASP H . . 5.930 3.620 2.006 4.248 . 0 0 "[ . 1 . 2]" 1 392 1 185 ILE MD 1 186 GLN H . . 6.520 4.487 4.035 4.879 . 0 0 "[ . 1 . 2]" 1 393 1 168 ARG H 1 169 ILE MD . . 6.020 5.507 4.718 6.295 0.275 1 0 "[ . 1 . 2]" 1 394 1 197 LEU MD2 1 199 GLY H . . 6.520 5.561 4.867 6.274 . 0 0 "[ . 1 . 2]" 1 395 1 197 LEU MD1 1 199 GLY H . . 6.520 5.579 4.600 6.512 . 0 0 "[ . 1 . 2]" 1 396 1 143 ILE H 1 143 ILE MD . . 5.340 3.943 2.694 4.252 . 0 0 "[ . 1 . 2]" 1 397 1 48 MET H 1 54 ILE MD . . 6.520 6.024 3.936 6.626 0.106 13 0 "[ . 1 . 2]" 1 398 1 84 ILE H 1 84 ILE MD . . 4.450 3.379 2.021 4.455 0.005 2 0 "[ . 1 . 2]" 1 399 1 16 LEU MD2 1 20 LEU MD2 . . 4.200 3.562 2.257 4.348 0.148 16 0 "[ . 1 . 2]" 1 400 1 158 VAL MG1 1 166 VAL MG2 . . 4.340 3.641 2.021 4.467 0.127 11 0 "[ . 1 . 2]" 1 401 1 158 VAL MG2 1 166 VAL MG2 . . 4.340 2.863 1.876 4.345 0.005 13 0 "[ . 1 . 2]" 1 402 1 153 LEU MD1 1 169 ILE MD . . 3.860 2.846 1.810 4.012 0.152 16 0 "[ . 1 . 2]" 1 403 1 117 ILE MD 1 153 LEU MD1 . . 2.840 2.066 1.782 3.106 0.266 17 0 "[ . 1 . 2]" 1 404 1 177 LEU MD1 1 181 LEU MD1 . . 5.170 3.166 1.939 4.375 . 0 0 "[ . 1 . 2]" 1 405 1 111 LEU MD2 1 133 LEU MD1 . . 3.580 2.791 1.801 3.684 0.104 6 0 "[ . 1 . 2]" 1 406 1 177 LEU MD1 1 181 LEU MD2 . . 5.170 3.580 1.926 4.516 . 0 0 "[ . 1 . 2]" 1 407 1 181 LEU MD2 1 185 ILE MD . . 4.220 3.350 2.044 4.315 0.095 19 0 "[ . 1 . 2]" 1 408 1 143 ILE MD 1 181 LEU MD2 . . 3.660 3.067 2.024 3.895 0.235 8 0 "[ . 1 . 2]" 1 409 1 115 LEU MD2 1 129 VAL MG2 . . 3.150 2.793 2.003 3.358 0.208 17 0 "[ . 1 . 2]" 1 410 1 11 LEU MD2 1 93 LEU MD2 . . 4.230 2.995 2.036 4.333 0.103 4 0 "[ . 1 . 2]" 1 411 1 12 VAL MG2 1 16 LEU MD2 . . 4.500 4.251 3.403 4.707 0.207 20 0 "[ . 1 . 2]" 1 412 1 12 VAL MG1 1 16 LEU MD2 . . 4.500 4.577 4.077 4.728 0.228 14 0 "[ . 1 . 2]" 1 413 1 16 LEU MD2 1 169 ILE MD . . 3.750 3.435 2.738 3.948 0.198 14 0 "[ . 1 . 2]" 1 414 1 153 LEU MD2 1 169 ILE MD . . 3.860 2.747 1.780 4.006 0.146 7 0 "[ . 1 . 2]" 1 415 1 12 VAL MG2 1 177 LEU MD1 . . 3.150 2.843 2.165 3.372 0.222 4 0 "[ . 1 . 2]" 1 416 1 12 VAL MG2 1 177 LEU MD2 . . 3.150 3.061 2.281 3.395 0.245 9 0 "[ . 1 . 2]" 1 417 1 117 ILE MD 1 165 LEU MD1 . . 3.620 2.563 1.796 3.778 0.158 4 0 "[ . 1 . 2]" 1 418 1 158 VAL MG1 1 166 VAL MG1 . . 4.340 4.059 2.680 4.714 0.374 3 0 "[ . 1 . 2]" 1 419 1 115 LEU MD2 1 153 LEU MD2 . . 3.510 2.822 1.851 3.772 0.262 13 0 "[ . 1 . 2]" 1 420 1 117 ILE MD 1 153 LEU MD2 . . 2.840 2.378 1.771 3.121 0.281 14 0 "[ . 1 . 2]" 1 421 1 177 LEU MD2 1 181 LEU MD2 . . 5.170 4.595 2.816 5.366 0.196 19 0 "[ . 1 . 2]" 1 422 1 177 LEU MD2 1 185 ILE MD . . 3.470 2.518 1.893 3.367 . 0 0 "[ . 1 . 2]" 1 423 1 177 LEU MD2 1 181 LEU MD1 . . 5.170 4.134 2.913 5.206 0.036 2 0 "[ . 1 . 2]" 1 424 1 12 VAL MG1 1 177 LEU MD2 . . 3.150 2.676 2.005 3.356 0.206 16 0 "[ . 1 . 2]" 1 425 1 111 LEU MD1 1 133 LEU MD2 . . 3.580 3.055 1.933 3.743 0.163 7 0 "[ . 1 . 2]" 1 426 1 111 LEU MD2 1 133 LEU MD2 . . 3.580 3.151 2.040 3.736 0.156 13 0 "[ . 1 . 2]" 1 427 1 115 LEU MD1 1 153 LEU MD1 . . 3.510 2.862 1.820 3.720 0.210 10 0 "[ . 1 . 2]" 1 428 1 115 LEU MD1 1 129 VAL MG2 . . 3.150 2.560 1.854 3.223 0.073 19 0 "[ . 1 . 2]" 1 429 1 115 LEU MD1 1 153 LEU MD2 . . 3.510 2.903 1.857 3.621 0.111 9 0 "[ . 1 . 2]" 1 430 1 177 LEU MD1 1 185 ILE MD . . 3.470 3.345 2.281 3.607 0.137 10 0 "[ . 1 . 2]" 1 431 1 181 LEU MD1 1 185 ILE MD . . 4.220 2.907 2.013 4.367 0.147 11 0 "[ . 1 . 2]" 1 432 1 11 LEU MD2 1 93 LEU MD1 . . 4.230 3.102 2.026 4.327 0.097 11 0 "[ . 1 . 2]" 1 433 1 11 LEU MD1 1 93 LEU MD1 . . 4.230 3.153 1.920 4.339 0.109 8 0 "[ . 1 . 2]" 1 434 1 16 LEU MD2 1 20 LEU MD1 . . 4.200 3.539 2.634 4.290 0.090 17 0 "[ . 1 . 2]" 1 435 1 16 LEU MD1 1 20 LEU MD1 . . 4.200 4.062 3.140 4.482 0.282 7 0 "[ . 1 . 2]" 1 436 1 158 VAL MG2 1 166 VAL MG1 . . 4.340 3.404 2.075 4.431 0.091 5 0 "[ . 1 . 2]" 1 437 1 138 VAL MG1 1 181 LEU MD2 . . 4.920 2.311 1.784 3.767 . 0 0 "[ . 1 . 2]" 1 438 1 138 VAL MG1 1 181 LEU MD1 . . 4.920 2.588 1.805 4.192 . 0 0 "[ . 1 . 2]" 1 439 1 111 LEU MD1 1 133 LEU MD1 . . 3.580 2.754 1.855 3.697 0.117 3 0 "[ . 1 . 2]" 1 440 1 11 LEU MD1 1 93 LEU MD2 . . 4.230 2.985 1.864 4.179 . 0 0 "[ . 1 . 2]" 1 441 1 115 LEU MD2 1 153 LEU MD1 . . 3.510 2.911 2.013 3.681 0.171 3 0 "[ . 1 . 2]" 1 442 1 115 LEU MD2 1 117 ILE MD . . 2.600 2.401 1.846 2.958 0.358 10 0 "[ . 1 . 2]" 1 443 1 143 ILE MD 1 185 ILE MD . . 3.030 2.324 1.870 3.070 0.040 9 0 "[ . 1 . 2]" 1 444 1 143 ILE MD 1 181 LEU MD1 . . 3.660 2.616 1.834 3.720 0.060 11 0 "[ . 1 . 2]" 1 445 1 138 VAL MG1 1 143 ILE MD . . 3.700 3.174 1.838 3.968 0.268 20 0 "[ . 1 . 2]" 1 446 1 138 VAL MG2 1 143 ILE MD . . 3.310 2.532 1.855 3.569 0.259 10 0 "[ . 1 . 2]" 1 447 1 115 LEU MD1 1 129 VAL MG1 . . 3.150 2.711 1.801 3.370 0.220 1 0 "[ . 1 . 2]" 1 448 1 115 LEU MD2 1 129 VAL MG1 . . 3.150 2.918 2.011 3.359 0.209 1 0 "[ . 1 . 2]" 1 449 1 16 LEU MD1 1 20 LEU MD2 . . 4.200 4.228 3.029 4.473 0.273 10 0 "[ . 1 . 2]" 1 450 1 16 LEU MD1 1 169 ILE MD . . 3.750 3.704 3.345 4.127 0.377 20 0 "[ . 1 . 2]" 1 451 1 12 VAL MG2 1 16 LEU MD1 . . 4.500 3.689 2.613 4.635 0.135 14 0 "[ . 1 . 2]" 1 452 1 117 ILE MD 1 169 ILE MD . . 2.970 3.091 2.852 3.247 0.277 11 0 "[ . 1 . 2]" 1 453 1 115 LEU MD1 1 117 ILE MD . . 2.600 2.519 2.027 2.968 0.368 17 0 "[ . 1 . 2]" 1 454 1 117 ILE MD 1 165 LEU MD2 . . 3.620 3.121 1.891 3.714 0.094 8 0 "[ . 1 . 2]" 1 455 1 12 VAL MG1 1 177 LEU MD1 . . 3.150 2.699 1.953 3.165 0.015 1 0 "[ . 1 . 2]" 1 456 1 12 VAL MG1 1 16 LEU MD1 . . 4.500 3.856 2.502 4.660 0.160 20 0 "[ . 1 . 2]" 1 457 1 138 VAL MG2 1 181 LEU MD2 . . 4.920 2.119 1.832 3.208 . 0 0 "[ . 1 . 2]" 1 458 1 138 VAL MG2 1 181 LEU MD1 . . 4.920 2.206 1.851 3.370 . 0 0 "[ . 1 . 2]" 1 459 1 11 LEU QD 1 89 VAL QG . . 3.190 2.815 1.931 3.259 0.069 10 0 "[ . 1 . 2]" 1 460 1 11 LEU QD 1 93 LEU QD . . 2.350 2.081 1.754 2.370 0.020 11 0 "[ . 1 . 2]" 1 461 1 11 LEU QD 1 177 LEU QD . . 3.960 3.690 2.885 4.216 0.256 18 0 "[ . 1 . 2]" 1 462 1 12 VAL QG 1 13 VAL QG . . 3.210 2.314 2.053 2.850 . 0 0 "[ . 1 . 2]" 1 463 1 12 VAL QG 1 16 LEU QD . . 3.200 2.985 2.447 3.411 0.211 14 0 "[ . 1 . 2]" 1 464 1 12 VAL QG 1 177 LEU QD . . 2.110 2.083 1.888 2.335 0.225 7 0 "[ . 1 . 2]" 1 465 1 16 LEU QD 1 20 LEU QD . . 2.830 2.799 2.203 3.029 0.199 2 0 "[ . 1 . 2]" 1 466 1 16 LEU QD 1 166 VAL QG . . 4.400 2.818 2.126 3.366 . 0 0 "[ . 1 . 2]" 1 467 1 20 LEU QD 1 155 VAL QG . . 3.770 3.269 2.061 3.924 0.154 16 0 "[ . 1 . 2]" 1 468 1 20 LEU QD 1 158 VAL QG . . 3.730 2.656 1.714 3.674 . 0 0 "[ . 1 . 2]" 1 469 1 20 LEU QD 1 166 VAL QG . . 3.740 1.888 1.569 2.519 . 0 0 "[ . 1 . 2]" 1 470 1 89 VAL QG 1 93 LEU QD . . 3.880 3.217 1.849 3.964 0.084 19 0 "[ . 1 . 2]" 1 471 1 89 VAL QG 1 195 VAL QG . . 2.710 2.291 1.770 2.733 0.023 17 0 "[ . 1 . 2]" 1 472 1 93 LEU QD 1 144 VAL QG . . 3.580 3.131 1.974 3.604 0.024 15 0 "[ . 1 . 2]" 1 473 1 111 LEU QD 1 129 VAL QG . . 4.420 2.027 1.744 2.930 . 0 0 "[ . 1 . 2]" 1 474 1 111 LEU QD 1 133 LEU QD . . 2.490 2.065 1.704 2.536 0.046 14 0 "[ . 1 . 2]" 1 475 1 115 LEU QD 1 129 VAL QG . . 2.270 1.957 1.690 2.302 0.032 8 0 "[ . 1 . 2]" 1 476 1 115 LEU QD 1 153 LEU QD . . 2.200 1.982 1.707 2.419 0.219 10 0 "[ . 1 . 2]" 1 477 1 117 ILE MD 1 153 LEU QD . . 2.470 1.822 1.704 2.231 . 0 0 "[ . 1 . 2]" 1 478 1 117 ILE MD 1 165 LEU QD . . 3.160 2.208 1.790 3.183 0.023 3 0 "[ . 1 . 2]" 1 479 1 129 VAL QG 1 133 LEU QD . . 4.230 2.848 1.944 4.230 0.000 5 0 "[ . 1 . 2]" 1 480 1 129 VAL QG 1 153 LEU QD . . 4.300 4.098 3.241 4.454 0.154 15 0 "[ . 1 . 2]" 1 481 1 130 VAL QG 1 133 LEU QD . . 3.530 3.493 3.185 3.755 0.225 8 0 "[ . 1 . 2]" 1 482 1 130 VAL QG 1 181 LEU QD . . 3.740 3.703 3.330 3.804 0.064 19 0 "[ . 1 . 2]" 1 483 1 138 VAL QG 1 143 ILE MD . . 2.440 2.043 1.831 2.352 . 0 0 "[ . 1 . 2]" 1 484 1 138 VAL QG 1 181 LEU QD . . 2.940 1.660 1.554 1.822 . 0 0 "[ . 1 . 2]" 1 485 1 138 VAL QG 1 185 ILE MD . . 3.660 3.723 3.357 3.897 0.237 13 0 "[ . 1 . 2]" 1 486 1 143 ILE MD 1 177 LEU QD . . 4.310 3.248 2.714 4.055 . 0 0 "[ . 1 . 2]" 1 487 1 143 ILE MD 1 181 LEU QD . . 2.650 2.161 1.826 2.850 0.200 13 0 "[ . 1 . 2]" 1 488 1 153 LEU QD 1 169 ILE MD . . 3.310 1.877 1.778 2.109 . 0 0 "[ . 1 . 2]" 1 489 1 155 VAL QG 1 158 VAL QG . . 4.510 3.415 2.757 4.191 . 0 0 "[ . 1 . 2]" 1 490 1 158 VAL QG 1 166 VAL QG . . 2.720 2.346 1.800 2.859 0.139 6 0 "[ . 1 . 2]" 1 491 1 164 VAL QG 1 165 LEU QD . . 3.730 3.181 2.393 3.863 0.133 17 0 "[ . 1 . 2]" 1 492 1 177 LEU QD 1 181 LEU QD . . 3.330 2.522 1.906 3.376 0.046 12 0 "[ . 1 . 2]" 1 493 1 177 LEU QD 1 185 ILE MD . . 2.910 2.385 1.886 3.079 0.169 1 0 "[ . 1 . 2]" 1 494 1 181 LEU QD 1 185 ILE MD . . 3.640 2.346 1.982 3.200 . 0 0 "[ . 1 . 2]" 1 495 1 110 ASP H 1 112 THR H . . 4.250 4.403 4.072 4.592 0.342 18 0 "[ . 1 . 2]" 1 496 1 10 GLU H 1 11 LEU QD . . 5.690 4.782 3.883 5.447 . 0 0 "[ . 1 . 2]" 1 497 1 10 GLU H 1 13 VAL QG . . 4.630 4.325 3.867 4.697 0.067 9 0 "[ . 1 . 2]" 1 498 1 11 LEU H 1 12 VAL QG . . 5.540 4.147 3.353 4.902 . 0 0 "[ . 1 . 2]" 1 499 1 11 LEU QD 1 13 VAL H . . 5.340 5.029 4.357 5.497 0.157 20 0 "[ . 1 . 2]" 1 500 1 11 LEU QD 1 14 ASP H . . 5.180 5.088 4.749 5.390 0.210 12 0 "[ . 1 . 2]" 1 501 1 11 LEU QD 1 191 TRP HE1 . . 4.850 4.544 3.223 4.999 0.149 9 0 "[ . 1 . 2]" 1 502 1 12 VAL H 1 12 VAL QG . . 3.790 2.347 1.791 2.943 . 0 0 "[ . 1 . 2]" 1 503 1 12 VAL H 1 13 VAL QG . . 5.390 3.988 3.485 4.445 . 0 0 "[ . 1 . 2]" 1 504 1 12 VAL QG 1 13 VAL H . . 4.860 2.247 2.025 2.600 . 0 0 "[ . 1 . 2]" 1 505 1 12 VAL QG 1 14 ASP H . . 5.080 4.234 4.136 4.451 . 0 0 "[ . 1 . 2]" 1 506 1 12 VAL QG 1 16 LEU H . . 6.420 4.482 4.208 4.875 . 0 0 "[ . 1 . 2]" 1 507 1 12 VAL QG 1 170 ALA H . . 6.390 6.105 5.305 6.556 0.166 16 0 "[ . 1 . 2]" 1 508 1 12 VAL QG 1 174 ALA H . . 6.420 3.191 2.618 3.836 . 0 0 "[ . 1 . 2]" 1 509 1 13 VAL H 1 13 VAL QG . . 3.560 2.282 1.842 2.720 . 0 0 "[ . 1 . 2]" 1 510 1 13 VAL QG 1 14 ASP H . . 4.470 2.746 2.112 3.266 . 0 0 "[ . 1 . 2]" 1 511 1 16 LEU H 1 166 VAL QG . . 6.420 6.413 5.856 6.595 0.175 12 0 "[ . 1 . 2]" 1 512 1 17 SER H 1 166 VAL QG . . 6.210 5.463 4.866 6.183 . 0 0 "[ . 1 . 2]" 1 513 1 19 LYS H 1 20 LEU QD . . 5.370 4.077 3.702 4.544 . 0 0 "[ . 1 . 2]" 1 514 1 20 LEU H 1 20 LEU QD . . 4.520 2.570 2.282 3.110 . 0 0 "[ . 1 . 2]" 1 515 1 20 LEU QD 1 26 SER H . . 6.420 5.459 3.604 6.510 0.090 4 0 "[ . 1 . 2]" 1 516 1 20 LEU QD 1 27 TRP HE1 . . 4.280 4.168 3.310 4.438 0.158 18 0 "[ . 1 . 2]" 1 517 1 33 VAL QG 1 36 ASN H . . 6.420 5.134 2.537 6.493 0.073 13 0 "[ . 1 . 2]" 1 518 1 62 LEU QD 1 63 ALA H . . 6.120 4.254 2.863 4.627 . 0 0 "[ . 1 . 2]" 1 519 1 92 ALA H 1 195 VAL QG . . 5.610 5.319 3.745 5.686 0.076 11 0 "[ . 1 . 2]" 1 520 1 93 LEU QD 1 94 ARG H . . 6.330 3.727 2.888 4.207 . 0 0 "[ . 1 . 2]" 1 521 1 97 GLY H 1 144 VAL QG . . 5.510 4.167 3.027 5.444 . 0 0 "[ . 1 . 2]" 1 522 1 98 ASP H 1 144 VAL QG . . 6.260 5.122 3.911 6.305 0.045 3 0 "[ . 1 . 2]" 1 523 1 101 GLU H 1 102 LEU QD . . 6.150 5.186 3.296 5.737 . 0 0 "[ . 1 . 2]" 1 524 1 102 LEU QD 1 104 TYR H . . 4.630 4.619 4.203 4.828 0.198 2 0 "[ . 1 . 2]" 1 525 1 111 LEU H 1 111 LEU QD . . 4.860 3.447 3.094 3.649 . 0 0 "[ . 1 . 2]" 1 526 1 111 LEU QD 1 113 SER H . . 6.420 5.242 4.568 5.739 . 0 0 "[ . 1 . 2]" 1 527 1 111 LEU QD 1 114 GLN H . . 5.490 4.360 3.446 5.061 . 0 0 "[ . 1 . 2]" 1 528 1 111 LEU QD 1 115 LEU H . . 5.250 3.815 2.817 4.688 . 0 0 "[ . 1 . 2]" 1 529 1 111 LEU QD 1 129 VAL H . . 5.470 4.990 4.194 5.459 . 0 0 "[ . 1 . 2]" 1 530 1 111 LEU QD 1 132 GLU H . . 5.930 5.405 3.849 5.980 0.050 5 0 "[ . 1 . 2]" 1 531 1 111 LEU QD 1 149 PHE H . . 6.420 5.074 4.205 6.415 . 0 0 "[ . 1 . 2]" 1 532 1 115 LEU QD 1 128 GLN H . . 5.910 5.504 4.764 6.032 0.122 13 0 "[ . 1 . 2]" 1 533 1 118 THR H 1 165 LEU QD . . 6.420 4.376 2.703 6.420 0.000 9 0 "[ . 1 . 2]" 1 534 1 129 VAL H 1 130 VAL QG . . 6.120 4.153 3.901 4.354 . 0 0 "[ . 1 . 2]" 1 535 1 130 VAL QG 1 131 ASN H . . 5.830 3.156 2.132 3.378 . 0 0 "[ . 1 . 2]" 1 536 1 133 LEU QD 1 134 PHE H . . 5.550 4.150 3.754 4.380 . 0 0 "[ . 1 . 2]" 1 537 1 133 LEU QD 1 146 PHE H . . 4.830 4.285 2.917 4.876 0.046 19 0 "[ . 1 . 2]" 1 538 1 133 LEU QD 1 149 PHE H . . 6.420 5.077 4.002 6.088 . 0 0 "[ . 1 . 2]" 1 539 1 137 GLY H 1 138 VAL QG . . 6.420 4.545 3.015 5.076 . 0 0 "[ . 1 . 2]" 1 540 1 138 VAL H 1 138 VAL QG . . 3.920 2.404 1.836 3.179 . 0 0 "[ . 1 . 2]" 1 541 1 138 VAL QG 1 139 ASN H . . 3.630 3.409 3.078 3.530 . 0 0 "[ . 1 . 2]" 1 542 1 138 VAL QG 1 140 TRP H . . 6.420 5.260 5.092 5.598 . 0 0 "[ . 1 . 2]" 1 543 1 138 VAL QG 1 140 TRP HE1 . . 6.600 6.507 6.140 6.727 0.127 9 0 "[ . 1 . 2]" 1 544 1 152 ALA H 1 155 VAL QG . . 6.260 4.438 4.042 5.878 . 0 0 "[ . 1 . 2]" 1 545 1 153 LEU QD 1 154 CYS H . . 5.150 3.089 2.416 3.924 . 0 0 "[ . 1 . 2]" 1 546 1 153 LEU QD 1 155 VAL H . . 5.180 4.633 4.068 5.251 0.071 19 0 "[ . 1 . 2]" 1 547 1 153 LEU QD 1 157 SER H . . 5.620 3.769 2.736 4.764 . 0 0 "[ . 1 . 2]" 1 548 1 153 LEU QD 1 169 ILE H . . 5.000 5.075 4.563 5.236 0.236 19 0 "[ . 1 . 2]" 1 549 1 154 CYS H 1 155 VAL QG . . 5.010 3.923 3.510 4.242 . 0 0 "[ . 1 . 2]" 1 550 1 155 VAL H 1 155 VAL QG . . 4.150 2.082 1.782 2.501 . 0 0 "[ . 1 . 2]" 1 551 1 155 VAL QG 1 156 GLU H . . 4.590 2.802 1.982 3.455 . 0 0 "[ . 1 . 2]" 1 552 1 155 VAL QG 1 157 SER H . . 6.360 4.524 4.043 5.007 . 0 0 "[ . 1 . 2]" 1 553 1 157 SER H 1 158 VAL QG . . 5.390 4.034 3.541 4.571 . 0 0 "[ . 1 . 2]" 1 554 1 158 VAL H 1 158 VAL QG . . 3.960 2.131 1.848 2.501 . 0 0 "[ . 1 . 2]" 1 555 1 158 VAL QG 1 159 ASP H . . 4.890 2.732 1.900 3.527 . 0 0 "[ . 1 . 2]" 1 556 1 163 GLN H 1 164 VAL QG . . 4.960 4.036 3.584 4.379 . 0 0 "[ . 1 . 2]" 1 557 1 164 VAL H 1 164 VAL QG . . 3.620 2.199 1.929 2.431 . 0 0 "[ . 1 . 2]" 1 558 1 164 VAL QG 1 165 LEU H . . 4.030 2.721 2.096 3.432 . 0 0 "[ . 1 . 2]" 1 559 1 164 VAL QG 1 166 VAL H . . 5.210 4.142 2.819 5.035 . 0 0 "[ . 1 . 2]" 1 560 1 164 VAL QG 1 167 SER H . . 6.360 4.851 4.282 5.723 . 0 0 "[ . 1 . 2]" 1 561 1 164 VAL QG 1 168 ARG H . . 6.420 5.287 4.580 6.392 . 0 0 "[ . 1 . 2]" 1 562 1 165 LEU H 1 166 VAL QG . . 5.180 3.653 3.167 4.280 . 0 0 "[ . 1 . 2]" 1 563 1 166 VAL H 1 166 VAL QG . . 3.850 2.261 1.832 2.956 . 0 0 "[ . 1 . 2]" 1 564 1 166 VAL QG 1 167 SER H . . 4.910 2.736 2.067 3.438 . 0 0 "[ . 1 . 2]" 1 565 1 166 VAL QG 1 168 ARG H . . 5.780 4.320 4.033 4.644 . 0 0 "[ . 1 . 2]" 1 566 1 175 THR H 1 177 LEU QD . . 6.200 5.262 4.946 5.564 . 0 0 "[ . 1 . 2]" 1 567 1 177 LEU H 1 177 LEU QD . . 4.640 3.313 3.080 3.725 . 0 0 "[ . 1 . 2]" 1 568 1 177 LEU H 1 181 LEU QD . . 6.420 4.769 3.958 5.484 . 0 0 "[ . 1 . 2]" 1 569 1 177 LEU QD 1 178 ASN H . . 4.870 3.703 2.279 3.992 . 0 0 "[ . 1 . 2]" 1 570 1 177 LEU QD 1 181 LEU H . . 6.420 4.936 4.411 5.238 . 0 0 "[ . 1 . 2]" 1 571 1 177 LEU QD 1 182 GLU H . . 5.290 5.130 4.767 5.316 0.026 18 0 "[ . 1 . 2]" 1 572 1 177 LEU QD 1 191 TRP HE1 . . 5.510 5.596 5.320 5.728 0.218 9 0 "[ . 1 . 2]" 1 573 1 181 LEU QD 1 182 GLU H . . 5.600 4.210 4.022 4.451 . 0 0 "[ . 1 . 2]" 1 574 1 181 LEU QD 1 184 TRP H . . 6.120 4.231 3.773 4.989 . 0 0 "[ . 1 . 2]" 1 575 1 181 LEU QD 1 184 TRP HE1 . . 4.420 4.418 4.202 4.526 0.106 18 0 "[ . 1 . 2]" 1 576 1 181 LEU QD 1 185 ILE H . . 6.420 3.605 2.818 5.026 . 0 0 "[ . 1 . 2]" 1 577 1 194 PHE H 1 195 VAL QG . . 4.980 3.993 3.577 4.221 . 0 0 "[ . 1 . 2]" 1 578 1 195 VAL H 1 195 VAL QG . . 3.690 2.235 1.930 2.431 . 0 0 "[ . 1 . 2]" 1 579 1 195 VAL QG 1 196 GLU H . . 4.490 2.971 2.098 3.386 . 0 0 "[ . 1 . 2]" 1 stop_ save_ save_distance_constraint_statistics_2 _Distance_constraint_stats_list.Sf_category distance_constraint_statistics _Distance_constraint_stats_list.Constraint_list_ID 2 _Distance_constraint_stats_list.Constraint_count 96 _Distance_constraint_stats_list.Viol_count 337 _Distance_constraint_stats_list.Viol_total 888.198 _Distance_constraint_stats_list.Viol_max 0.693 _Distance_constraint_stats_list.Viol_rms 0.0689 _Distance_constraint_stats_list.Viol_average_all_restraints 0.0231 _Distance_constraint_stats_list.Viol_average_violations_only 0.1318 _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 6 GLN 0.000 0.000 . 0 "[ . 1 . 2]" 1 8 ASN 2.634 0.212 10 0 "[ . 1 . 2]" 1 10 GLU 0.000 0.000 . 0 "[ . 1 . 2]" 1 12 VAL 2.634 0.212 10 0 "[ . 1 . 2]" 1 14 ASP 0.000 0.000 . 0 "[ . 1 . 2]" 1 15 PHE 0.348 0.149 12 0 "[ . 1 . 2]" 1 16 LEU 0.000 0.000 . 0 "[ . 1 . 2]" 1 18 TYR 0.000 0.000 . 0 "[ . 1 . 2]" 1 19 LYS 0.348 0.149 12 0 "[ . 1 . 2]" 1 20 LEU 1.606 0.498 5 0 "[ . 1 . 2]" 1 24 GLY 1.606 0.498 5 0 "[ . 1 . 2]" 1 84 ILE 0.926 0.453 5 0 "[ . 1 . 2]" 1 88 ALA 0.926 0.453 5 0 "[ . 1 . 2]" 1 91 GLN 0.000 0.000 . 0 "[ . 1 . 2]" 1 92 ALA 0.000 0.000 . 0 "[ . 1 . 2]" 1 93 LEU 0.000 0.000 . 0 "[ . 1 . 2]" 1 94 ARG 0.000 0.000 . 0 "[ . 1 . 2]" 1 95 GLU 0.000 0.000 . 0 "[ . 1 . 2]" 1 96 ALA 0.000 0.000 . 0 "[ . 1 . 2]" 1 97 GLY 0.000 0.000 . 0 "[ . 1 . 2]" 1 98 ASP 0.000 0.000 . 0 "[ . 1 . 2]" 1 101 GLU 0.000 0.000 . 0 "[ . 1 . 2]" 1 102 LEU 0.000 0.000 . 0 "[ . 1 . 2]" 1 110 ASP 0.019 0.010 13 0 "[ . 1 . 2]" 1 111 LEU 0.000 0.000 . 0 "[ . 1 . 2]" 1 114 GLN 0.019 0.010 13 0 "[ . 1 . 2]" 1 115 LEU 0.000 0.000 . 0 "[ . 1 . 2]" 1 122 ALA 0.104 0.039 13 0 "[ . 1 . 2]" 1 123 TYR 0.000 0.000 . 0 "[ . 1 . 2]" 1 125 SER 0.761 0.119 20 0 "[ . 1 . 2]" 1 126 PHE 0.104 0.039 13 0 "[ . 1 . 2]" 1 127 GLU 0.000 0.000 . 0 "[ . 1 . 2]" 1 128 GLN 0.148 0.050 6 0 "[ . 1 . 2]" 1 129 VAL 0.958 0.119 20 0 "[ . 1 . 2]" 1 130 VAL 0.000 0.000 . 0 "[ . 1 . 2]" 1 131 ASN 0.000 0.000 . 0 "[ . 1 . 2]" 1 132 GLU 0.148 0.050 6 0 "[ . 1 . 2]" 1 133 LEU 0.197 0.080 10 0 "[ . 1 . 2]" 1 134 PHE 0.000 0.000 . 0 "[ . 1 . 2]" 1 139 ASN 0.000 0.000 . 0 "[ . 1 . 2]" 1 140 TRP 2.599 0.171 17 0 "[ . 1 . 2]" 1 141 GLY 3.986 0.361 8 0 "[ . 1 . 2]" 1 143 ILE 0.000 0.000 . 0 "[ . 1 . 2]" 1 144 VAL 2.599 0.171 17 0 "[ . 1 . 2]" 1 145 ALA 4.209 0.361 8 0 "[ . 1 . 2]" 1 146 PHE 0.000 0.000 . 0 "[ . 1 . 2]" 1 147 PHE 0.000 0.000 . 0 "[ . 1 . 2]" 1 148 SER 0.000 0.000 . 0 "[ . 1 . 2]" 1 149 PHE 0.223 0.082 9 0 "[ . 1 . 2]" 1 150 GLY 0.000 0.000 . 0 "[ . 1 . 2]" 1 151 GLY 0.000 0.000 . 0 "[ . 1 . 2]" 1 152 ALA 0.000 0.000 . 0 "[ . 1 . 2]" 1 156 GLU 0.903 0.314 15 0 "[ . 1 . 2]" 1 157 SER 1.979 0.547 10 1 "[ . + . 2]" 1 160 LYS 0.903 0.314 15 0 "[ . 1 . 2]" 1 161 GLU 1.979 0.547 10 1 "[ . + . 2]" 1 166 VAL 0.773 0.162 10 0 "[ . 1 . 2]" 1 167 SER 0.528 0.184 19 0 "[ . 1 . 2]" 1 168 ARG 0.029 0.015 4 0 "[ . 1 . 2]" 1 170 ALA 0.773 0.162 10 0 "[ . 1 . 2]" 1 171 ALA 0.528 0.184 19 0 "[ . 1 . 2]" 1 172 TRP 0.665 0.126 15 0 "[ . 1 . 2]" 1 173 MET 0.000 0.000 . 0 "[ . 1 . 2]" 1 174 ALA 0.000 0.000 . 0 "[ . 1 . 2]" 1 176 TYR 8.011 0.294 14 0 "[ . 1 . 2]" 1 177 LEU 1.589 0.476 18 0 "[ . 1 . 2]" 1 178 ASN 9.889 0.693 20 1 "[ . 1 . +]" 1 180 HIS 12.028 0.294 14 0 "[ . 1 . 2]" 1 181 LEU 1.589 0.476 18 0 "[ . 1 . 2]" 1 182 GLU 9.986 0.693 20 1 "[ . 1 . +]" 1 183 PRO 0.042 0.042 18 0 "[ . 1 . 2]" 1 184 TRP 4.652 0.229 11 0 "[ . 1 . 2]" 1 185 ILE 0.000 0.000 . 0 "[ . 1 . 2]" 1 186 GLN 0.096 0.020 10 0 "[ . 1 . 2]" 1 187 GLU 0.042 0.042 18 0 "[ . 1 . 2]" 1 191 TRP 0.130 0.049 9 0 "[ . 1 . 2]" 1 192 ASP 0.000 0.000 . 0 "[ . 1 . 2]" 1 193 THR 2.238 0.382 6 0 "[ . 1 . 2]" 1 195 VAL 0.130 0.049 9 0 "[ . 1 . 2]" 1 196 GLU 0.000 0.000 . 0 "[ . 1 . 2]" 1 197 LEU 2.238 0.382 6 0 "[ . 1 . 2]" stop_ loop_ _Distance_constraint_stats.Restraint_ID _Distance_constraint_stats.Atom_1_entity_assembly_ID _Distance_constraint_stats.Atom_1_comp_index_ID _Distance_constraint_stats.Atom_1_comp_ID _Distance_constraint_stats.Atom_1_ID _Distance_constraint_stats.Atom_2_entity_assembly_ID _Distance_constraint_stats.Atom_2_comp_index_ID _Distance_constraint_stats.Atom_2_comp_ID _Distance_constraint_stats.Atom_2_ID _Distance_constraint_stats.Node_1_distance_val _Distance_constraint_stats.Node_1_distance_lower_bound_val _Distance_constraint_stats.Node_1_distance_upper_bound_val _Distance_constraint_stats.Distance_average _Distance_constraint_stats.Distance_minimum _Distance_constraint_stats.Distance_maximum _Distance_constraint_stats.Max_violation _Distance_constraint_stats.Max_violation_model_number _Distance_constraint_stats.Over_cutoff_violation_count _Distance_constraint_stats.Over_cutoff_viol_per_model _Distance_constraint_stats.Distance_constraint_stats_ID 1 1 6 GLN O 1 10 GLU H . . 2.300 2.048 1.751 2.236 . 0 0 "[ . 1 . 2]" 2 2 1 6 GLN O 1 10 GLU N . . 3.200 2.907 2.649 3.079 . 0 0 "[ . 1 . 2]" 2 3 1 8 ASN O 1 12 VAL H . . 2.300 2.289 1.936 2.492 0.192 3 0 "[ . 1 . 2]" 2 4 1 8 ASN O 1 12 VAL N . . 3.200 3.232 2.810 3.412 0.212 10 0 "[ . 1 . 2]" 2 5 1 14 ASP O 1 18 TYR H . . 2.300 1.842 1.729 2.258 . 0 0 "[ . 1 . 2]" 2 6 1 14 ASP O 1 18 TYR N . . 3.200 2.801 2.700 3.155 . 0 0 "[ . 1 . 2]" 2 7 1 15 PHE O 1 19 LYS H . . 2.300 2.126 1.798 2.449 0.149 12 0 "[ . 1 . 2]" 2 8 1 15 PHE O 1 19 LYS N . . 3.200 3.080 2.813 3.264 0.064 12 0 "[ . 1 . 2]" 2 9 1 16 LEU O 1 20 LEU H . . 2.300 1.882 1.741 2.228 . 0 0 "[ . 1 . 2]" 2 10 1 16 LEU O 1 20 LEU N . . 3.200 2.846 2.743 3.125 . 0 0 "[ . 1 . 2]" 2 11 1 20 LEU O 1 24 GLY H . . 2.300 2.197 1.761 2.798 0.498 5 0 "[ . 1 . 2]" 2 12 1 20 LEU O 1 24 GLY N . . 3.200 2.836 2.675 3.041 . 0 0 "[ . 1 . 2]" 2 13 1 84 ILE O 1 88 ALA H . . 2.300 2.165 1.809 2.727 0.427 5 0 "[ . 1 . 2]" 2 14 1 84 ILE O 1 88 ALA N . . 3.200 3.029 2.820 3.653 0.453 5 0 "[ . 1 . 2]" 2 15 1 88 ALA O 1 92 ALA H . . 2.300 1.900 1.719 2.056 . 0 0 "[ . 1 . 2]" 2 16 1 88 ALA O 1 92 ALA N . . 3.200 2.846 2.728 3.023 . 0 0 "[ . 1 . 2]" 2 17 1 91 GLN O 1 95 GLU H . . 2.300 1.931 1.771 2.031 . 0 0 "[ . 1 . 2]" 2 18 1 91 GLN O 1 95 GLU N . . 3.200 2.891 2.765 2.990 . 0 0 "[ . 1 . 2]" 2 19 1 92 ALA O 1 96 ALA H . . 2.300 2.094 1.960 2.185 . 0 0 "[ . 1 . 2]" 2 20 1 92 ALA O 1 96 ALA N . . 3.200 3.016 2.918 3.086 . 0 0 "[ . 1 . 2]" 2 21 1 93 LEU O 1 97 GLY H . . 2.300 1.946 1.831 2.119 . 0 0 "[ . 1 . 2]" 2 22 1 93 LEU O 1 97 GLY N . . 3.200 2.858 2.761 3.065 . 0 0 "[ . 1 . 2]" 2 23 1 94 ARG O 1 98 ASP H . . 2.300 1.941 1.798 2.072 . 0 0 "[ . 1 . 2]" 2 24 1 94 ARG O 1 98 ASP N . . 3.200 2.872 2.773 2.982 . 0 0 "[ . 1 . 2]" 2 25 1 97 GLY O 1 101 GLU H . . 2.300 1.927 1.804 2.179 . 0 0 "[ . 1 . 2]" 2 26 1 97 GLY O 1 101 GLU N . . 3.200 2.809 2.766 2.945 . 0 0 "[ . 1 . 2]" 2 27 1 98 ASP O 1 102 LEU H . . 2.300 2.085 1.969 2.188 . 0 0 "[ . 1 . 2]" 2 28 1 98 ASP O 1 102 LEU N . . 3.200 3.049 2.953 3.159 . 0 0 "[ . 1 . 2]" 2 29 1 110 ASP O 1 114 GLN H . . 2.700 2.393 1.925 2.710 0.010 13 0 "[ . 1 . 2]" 2 30 1 110 ASP O 1 114 GLN N . . 4.000 3.251 2.825 3.546 . 0 0 "[ . 1 . 2]" 2 31 1 111 LEU O 1 115 LEU H . . 2.700 1.917 1.779 2.366 . 0 0 "[ . 1 . 2]" 2 32 1 111 LEU O 1 115 LEU N . . 4.000 2.802 2.726 3.187 . 0 0 "[ . 1 . 2]" 2 33 1 122 ALA O 1 126 PHE H . . 2.300 2.084 1.720 2.268 . 0 0 "[ . 1 . 2]" 2 34 1 122 ALA O 1 126 PHE N . . 3.200 3.073 2.729 3.239 0.039 13 0 "[ . 1 . 2]" 2 35 1 123 TYR O 1 127 GLU H . . 2.300 1.942 1.778 2.295 . 0 0 "[ . 1 . 2]" 2 36 1 123 TYR O 1 127 GLU N . . 3.200 2.893 2.716 3.168 . 0 0 "[ . 1 . 2]" 2 37 1 125 SER O 1 129 VAL H . . 2.300 2.198 1.801 2.329 0.029 20 0 "[ . 1 . 2]" 2 38 1 125 SER O 1 129 VAL N . . 3.200 3.189 2.792 3.319 0.119 20 0 "[ . 1 . 2]" 2 39 1 127 GLU O 1 131 ASN H . . 2.300 1.901 1.726 2.184 . 0 0 "[ . 1 . 2]" 2 40 1 127 GLU O 1 131 ASN N . . 3.200 2.853 2.687 3.193 . 0 0 "[ . 1 . 2]" 2 41 1 128 GLN O 1 132 GLU H . . 2.300 2.060 1.802 2.350 0.050 6 0 "[ . 1 . 2]" 2 42 1 128 GLN O 1 132 GLU N . . 3.200 2.999 2.748 3.239 0.039 6 0 "[ . 1 . 2]" 2 43 1 129 VAL O 1 133 LEU H . . 2.300 2.192 2.111 2.323 0.023 10 0 "[ . 1 . 2]" 2 44 1 129 VAL O 1 133 LEU N . . 3.200 3.154 3.035 3.280 0.080 10 0 "[ . 1 . 2]" 2 45 1 130 VAL O 1 134 PHE H . . 2.300 2.010 1.809 2.211 . 0 0 "[ . 1 . 2]" 2 46 1 130 VAL O 1 134 PHE N . . 3.200 2.845 2.719 3.144 . 0 0 "[ . 1 . 2]" 2 47 1 139 ASN O 1 143 ILE H . . 2.500 1.860 1.750 2.266 . 0 0 "[ . 1 . 2]" 2 48 1 139 ASN O 1 143 ILE N . . 3.500 2.834 2.739 3.115 . 0 0 "[ . 1 . 2]" 2 49 1 140 TRP O 1 144 VAL H . . 2.300 2.303 2.088 2.471 0.171 17 0 "[ . 1 . 2]" 2 50 1 140 TRP O 1 144 VAL N . . 3.200 3.256 3.082 3.362 0.162 18 0 "[ . 1 . 2]" 2 51 1 141 GLY O 1 145 ALA H . . 2.300 2.379 2.128 2.661 0.361 8 0 "[ . 1 . 2]" 2 52 1 141 GLY O 1 145 ALA N . . 3.200 3.267 3.084 3.495 0.295 10 0 "[ . 1 . 2]" 2 53 1 145 ALA O 1 149 PHE H . . 2.300 2.194 1.853 2.319 0.019 9 0 "[ . 1 . 2]" 2 54 1 145 ALA O 1 149 PHE N . . 3.200 3.163 2.865 3.282 0.082 9 0 "[ . 1 . 2]" 2 55 1 146 PHE O 1 150 GLY H . . 2.300 2.011 1.836 2.170 . 0 0 "[ . 1 . 2]" 2 56 1 146 PHE O 1 150 GLY N . . 3.200 2.921 2.740 3.049 . 0 0 "[ . 1 . 2]" 2 57 1 147 PHE O 1 151 GLY H . . 2.300 2.007 1.833 2.240 . 0 0 "[ . 1 . 2]" 2 58 1 147 PHE O 1 151 GLY N . . 3.200 2.911 2.697 3.096 . 0 0 "[ . 1 . 2]" 2 59 1 148 SER O 1 152 ALA H . . 2.300 1.938 1.782 2.033 . 0 0 "[ . 1 . 2]" 2 60 1 148 SER O 1 152 ALA N . . 3.200 2.829 2.728 2.892 . 0 0 "[ . 1 . 2]" 2 61 1 156 GLU O 1 160 LYS H . . 2.500 2.413 2.019 2.814 0.314 15 0 "[ . 1 . 2]" 2 62 1 156 GLU O 1 160 LYS N . . 3.500 3.120 2.809 3.559 0.059 17 0 "[ . 1 . 2]" 2 63 1 157 SER O 1 161 GLU H . . 2.300 2.345 2.031 2.847 0.547 10 1 "[ . + . 2]" 2 64 1 157 SER O 1 161 GLU N . . 3.200 2.922 2.752 3.171 . 0 0 "[ . 1 . 2]" 2 65 1 166 VAL O 1 170 ALA H . . 2.300 2.202 1.984 2.391 0.091 10 0 "[ . 1 . 2]" 2 66 1 166 VAL O 1 170 ALA N . . 3.200 3.152 2.911 3.362 0.162 10 0 "[ . 1 . 2]" 2 67 1 167 SER O 1 171 ALA H . . 2.300 2.235 2.046 2.469 0.169 19 0 "[ . 1 . 2]" 2 68 1 167 SER O 1 171 ALA N . . 3.200 3.130 2.973 3.384 0.184 19 0 "[ . 1 . 2]" 2 69 1 168 ARG O 1 172 TRP H . . 2.300 1.953 1.764 2.211 . 0 0 "[ . 1 . 2]" 2 70 1 168 ARG O 1 172 TRP N . . 3.200 2.930 2.736 3.215 0.015 4 0 "[ . 1 . 2]" 2 71 1 172 TRP O 1 176 TYR H . . 2.300 2.053 1.757 2.422 0.122 15 0 "[ . 1 . 2]" 2 72 1 172 TRP O 1 176 TYR N . . 3.200 3.034 2.743 3.326 0.126 15 0 "[ . 1 . 2]" 2 73 1 173 MET O 1 177 LEU H . . 2.300 1.834 1.772 2.119 . 0 0 "[ . 1 . 2]" 2 74 1 173 MET O 1 177 LEU N . . 3.200 2.788 2.722 3.009 . 0 0 "[ . 1 . 2]" 2 75 1 174 ALA O 1 178 ASN H . . 2.300 2.066 1.794 2.224 . 0 0 "[ . 1 . 2]" 2 76 1 174 ALA O 1 178 ASN N . . 3.200 3.057 2.784 3.189 . 0 0 "[ . 1 . 2]" 2 77 1 176 TYR O 1 180 HIS H . . 2.500 2.698 2.597 2.794 0.294 14 0 "[ . 1 . 2]" 2 78 1 176 TYR O 1 180 HIS N . . 3.500 3.671 3.585 3.772 0.272 14 0 "[ . 1 . 2]" 2 79 1 177 LEU O 1 181 LEU H . . 2.300 2.296 1.771 2.776 0.476 18 0 "[ . 1 . 2]" 2 80 1 177 LEU O 1 181 LEU N . . 3.200 2.909 2.736 3.226 0.026 18 0 "[ . 1 . 2]" 2 81 1 178 ASN O 1 182 GLU H . . 3.000 3.114 2.061 3.469 0.469 20 0 "[ . 1 . 2]" 2 82 1 178 ASN O 1 182 GLU N . . 3.600 3.893 2.798 4.293 0.693 20 1 "[ . 1 . +]" 2 83 1 180 HIS O 1 184 TRP H . . 2.700 2.834 2.716 2.929 0.229 11 0 "[ . 1 . 2]" 2 84 1 180 HIS O 1 184 TRP N . . 3.700 3.794 3.610 3.898 0.198 11 0 "[ . 1 . 2]" 2 85 1 181 LEU O 1 185 ILE H . . 2.300 1.955 1.807 2.159 . 0 0 "[ . 1 . 2]" 2 86 1 181 LEU O 1 185 ILE N . . 3.200 2.943 2.786 3.171 . 0 0 "[ . 1 . 2]" 2 87 1 182 GLU O 1 186 GLN H . . 2.300 2.215 2.037 2.307 0.007 5 0 "[ . 1 . 2]" 2 88 1 182 GLU O 1 186 GLN N . . 3.200 3.138 2.944 3.220 0.020 10 0 "[ . 1 . 2]" 2 89 1 183 PRO O 1 187 GLU H . . 2.300 1.922 1.757 2.279 . 0 0 "[ . 1 . 2]" 2 90 1 183 PRO O 1 187 GLU N . . 3.200 2.879 2.724 3.242 0.042 18 0 "[ . 1 . 2]" 2 91 1 191 TRP O 1 195 VAL H . . 2.300 2.161 1.849 2.343 0.043 2 0 "[ . 1 . 2]" 2 92 1 191 TRP O 1 195 VAL N . . 3.200 3.116 2.840 3.249 0.049 9 0 "[ . 1 . 2]" 2 93 1 192 ASP O 1 196 GLU H . . 2.300 1.951 1.708 2.180 . 0 0 "[ . 1 . 2]" 2 94 1 192 ASP O 1 196 GLU N . . 3.200 2.899 2.710 3.159 . 0 0 "[ . 1 . 2]" 2 95 1 193 THR O 1 197 LEU H . . 2.300 2.333 1.978 2.682 0.382 6 0 "[ . 1 . 2]" 2 96 1 193 THR O 1 197 LEU N . . 3.200 3.106 2.925 3.250 0.050 6 0 "[ . 1 . 2]" 2 stop_ save_
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