NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
598958 |
2myi   |
19558 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2myi
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 475
_Distance_constraint_stats_list.Viol_count 1340
_Distance_constraint_stats_list.Viol_total 925.604
_Distance_constraint_stats_list.Viol_max 0.488
_Distance_constraint_stats_list.Viol_rms 0.0494
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0195
_Distance_constraint_stats_list.Viol_average_violations_only 0.0691
_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 2 ARG 0.178 0.067 3 0 "[ . 1]"
1 3 ILE 0.782 0.197 3 0 "[ . 1]"
1 5 SER 0.532 0.090 7 0 "[ . 1]"
1 6 VAL 0.000 0.000 . 0 "[ . 1]"
1 8 VAL 1.887 0.260 8 0 "[ . 1]"
1 9 ASN 0.198 0.058 1 0 "[ . 1]"
1 10 GLY 0.520 0.068 1 0 "[ . 1]"
1 11 ILE 2.683 0.257 9 0 "[ . 1]"
1 12 GLN 4.534 0.321 6 0 "[ . 1]"
1 13 THR 3.809 0.257 9 0 "[ . 1]"
1 14 ALA 3.340 0.321 6 0 "[ . 1]"
1 15 VAL 4.178 0.264 5 0 "[ . 1]"
1 16 GLU 0.569 0.075 9 0 "[ . 1]"
1 17 ARG 2.038 0.264 5 0 "[ . 1]"
1 18 GLY 0.002 0.002 7 0 "[ . 1]"
1 19 LEU 0.088 0.076 10 0 "[ . 1]"
1 20 LEU 1.805 0.132 3 0 "[ . 1]"
1 21 SER 0.053 0.053 5 0 "[ . 1]"
1 22 TRP 0.762 0.117 8 0 "[ . 1]"
1 23 LEU 1.481 0.329 10 0 "[ . 1]"
1 24 GLN 1.783 0.329 10 0 "[ . 1]"
1 25 ALA 1.175 0.260 5 0 "[ . 1]"
1 26 GLN 0.749 0.147 9 0 "[ . 1]"
1 27 ASN 0.000 0.000 . 0 "[ . 1]"
1 28 ALA 0.521 0.147 9 0 "[ . 1]"
1 29 ASP 0.959 0.197 3 0 "[ . 1]"
1 31 ILE 0.161 0.088 8 0 "[ . 1]"
1 36 THR 0.030 0.030 1 0 "[ . 1]"
1 37 ARG 0.431 0.068 1 0 "[ . 1]"
1 38 ALA 0.761 0.228 2 0 "[ . 1]"
1 39 SER 0.333 0.060 2 0 "[ . 1]"
1 40 ALA 0.858 0.152 6 0 "[ . 1]"
1 41 PHE 0.235 0.056 1 0 "[ . 1]"
1 42 GLU 2.486 0.187 3 0 "[ . 1]"
1 43 LEU 5.303 0.290 5 0 "[ . 1]"
1 44 ASP 1.969 0.290 5 0 "[ . 1]"
1 45 ASP 0.708 0.119 6 0 "[ . 1]"
1 47 ALA 0.136 0.029 10 0 "[ . 1]"
1 48 TYR 0.033 0.025 1 0 "[ . 1]"
1 49 GLN 0.136 0.029 10 0 "[ . 1]"
1 50 LEU 4.782 0.260 5 0 "[ . 1]"
1 51 ASP 3.211 0.255 1 0 "[ . 1]"
1 52 GLY 0.155 0.055 4 0 "[ . 1]"
1 53 TYR 0.551 0.113 10 0 "[ . 1]"
1 54 PHE 0.192 0.073 10 0 "[ . 1]"
1 55 LEU 0.000 0.000 . 0 "[ . 1]"
1 57 ALA 0.390 0.123 1 0 "[ . 1]"
1 58 CYS 1.237 0.199 7 0 "[ . 1]"
1 59 GLU 0.523 0.076 2 0 "[ . 1]"
1 60 ALA 0.701 0.080 2 0 "[ . 1]"
1 61 GLU 4.800 0.467 7 0 "[ . 1]"
1 62 VAL 4.413 0.467 7 0 "[ . 1]"
1 64 ALA 0.322 0.195 7 0 "[ . 1]"
1 65 GLN 1.344 0.374 7 0 "[ . 1]"
1 66 GLY 0.385 0.048 4 0 "[ . 1]"
1 67 GLY 1.425 0.223 6 0 "[ . 1]"
1 68 VAL 3.450 0.329 9 0 "[ . 1]"
1 71 TYR 0.000 0.000 . 0 "[ . 1]"
1 72 SER 0.192 0.073 10 0 "[ . 1]"
1 73 ARG 0.000 0.000 . 0 "[ . 1]"
1 74 LEU 1.908 0.256 6 0 "[ . 1]"
1 75 GLN 2.232 0.256 6 0 "[ . 1]"
1 77 LYS 0.418 0.055 9 0 "[ . 1]"
1 78 ALA 0.525 0.091 8 0 "[ . 1]"
1 79 VAL 1.111 0.196 1 0 "[ . 1]"
1 80 ILE 3.637 0.394 7 0 "[ . 1]"
1 81 THR 2.378 0.196 1 0 "[ . 1]"
1 82 GLY 4.358 0.394 7 0 "[ . 1]"
1 83 LEU 0.003 0.003 6 0 "[ . 1]"
1 84 GLY 0.149 0.074 6 0 "[ . 1]"
1 85 PHE 0.063 0.032 6 0 "[ . 1]"
1 87 THR 0.000 0.000 . 0 "[ . 1]"
1 88 ALA 0.000 0.000 . 0 "[ . 1]"
1 89 ASP 0.132 0.074 6 0 "[ . 1]"
1 90 ARG 2.238 0.269 10 0 "[ . 1]"
1 91 TYR 0.285 0.064 5 0 "[ . 1]"
1 92 GLY 3.379 0.256 10 0 "[ . 1]"
1 93 ARG 0.182 0.126 7 0 "[ . 1]"
1 94 TYR 4.421 0.329 9 0 "[ . 1]"
1 95 LEU 1.749 0.199 7 0 "[ . 1]"
1 96 GLN 0.000 0.000 . 0 "[ . 1]"
1 97 ALA 0.173 0.025 7 0 "[ . 1]"
1 98 ASP 0.836 0.055 9 0 "[ . 1]"
1 102 VAL 0.390 0.077 8 0 "[ . 1]"
1 103 SER 0.111 0.030 2 0 "[ . 1]"
1 104 ILE 0.111 0.025 7 0 "[ . 1]"
1 105 ALA 0.528 0.080 10 0 "[ . 1]"
1 106 THR 0.692 0.084 4 0 "[ . 1]"
1 107 LEU 0.044 0.019 4 0 "[ . 1]"
1 108 LEU 0.913 0.119 6 0 "[ . 1]"
1 111 SER 0.193 0.040 3 0 "[ . 1]"
1 112 GLY 0.047 0.020 8 0 "[ . 1]"
1 113 GLN 0.000 0.000 . 0 "[ . 1]"
1 114 ASN 0.285 0.040 3 0 "[ . 1]"
1 115 GLY 0.045 0.018 3 0 "[ . 1]"
1 116 ASP 0.048 0.029 1 0 "[ . 1]"
1 117 GLU 0.000 0.000 . 0 "[ . 1]"
1 118 ASP 0.116 0.029 1 0 "[ . 1]"
1 119 LEU 0.307 0.211 1 0 "[ . 1]"
1 120 ASN 1.166 0.211 1 0 "[ . 1]"
1 121 GLN 0.246 0.059 1 0 "[ . 1]"
1 122 LYS 0.798 0.118 3 0 "[ . 1]"
1 123 PHE 0.239 0.059 1 0 "[ . 1]"
1 124 LYS 0.862 0.113 10 0 "[ . 1]"
1 125 LEU 0.303 0.089 7 0 "[ . 1]"
1 126 MET 1.165 0.113 10 0 "[ . 1]"
1 127 ASP 0.000 0.000 . 0 "[ . 1]"
1 128 ASP 0.000 0.000 . 0 "[ . 1]"
1 129 PHE 0.765 0.101 10 0 "[ . 1]"
1 130 ALA 0.340 0.056 10 0 "[ . 1]"
1 131 ARG 0.701 0.101 10 0 "[ . 1]"
1 132 TYR 2.022 0.171 10 0 "[ . 1]"
1 133 LEU 0.230 0.059 9 0 "[ . 1]"
1 134 ASP 0.230 0.059 9 0 "[ . 1]"
1 135 LYS 1.619 0.171 10 0 "[ . 1]"
1 136 GLN 0.000 0.000 . 0 "[ . 1]"
1 137 ARG 0.000 0.000 . 0 "[ . 1]"
1 138 ARG 0.000 0.000 . 0 "[ . 1]"
1 139 LYS 0.000 0.000 . 0 "[ . 1]"
1 140 ARG 0.000 0.000 . 0 "[ . 1]"
1 141 ARG 0.000 0.000 . 0 "[ . 1]"
1 142 GLU 0.390 0.077 8 0 "[ . 1]"
1 143 TYR 0.095 0.018 10 0 "[ . 1]"
1 144 ILE 1.254 0.171 3 0 "[ . 1]"
1 145 TYR 0.173 0.042 4 0 "[ . 1]"
1 146 CYS 0.297 0.080 10 0 "[ . 1]"
1 147 GLY 0.092 0.055 4 0 "[ . 1]"
1 148 SER 0.008 0.008 6 0 "[ . 1]"
1 149 LEU 0.783 0.209 4 0 "[ . 1]"
1 150 TYR 0.000 0.000 . 0 "[ . 1]"
1 151 VAL 0.998 0.153 9 0 "[ . 1]"
1 152 ALA 0.000 0.000 . 0 "[ . 1]"
1 153 GLN 0.425 0.089 2 0 "[ . 1]"
1 154 GLN 0.000 0.000 . 0 "[ . 1]"
1 155 LYS 0.000 0.000 . 0 "[ . 1]"
1 156 LEU 0.440 0.049 10 0 "[ . 1]"
1 157 ASP 0.337 0.051 7 0 "[ . 1]"
1 158 ILE 0.153 0.025 3 0 "[ . 1]"
1 159 LYS 0.986 0.133 2 0 "[ . 1]"
1 160 ASN 0.008 0.008 7 0 "[ . 1]"
1 161 TRP 0.001 0.001 9 0 "[ . 1]"
1 162 ARG 0.000 0.000 . 0 "[ . 1]"
1 163 ASP 0.063 0.032 1 0 "[ . 1]"
1 164 SER 0.000 0.000 . 0 "[ . 1]"
1 165 GLN 0.347 0.061 3 0 "[ . 1]"
1 166 GLN 1.383 0.252 10 0 "[ . 1]"
1 167 SER 1.138 0.146 9 0 "[ . 1]"
1 171 LEU 3.869 0.411 7 0 "[ . 1]"
1 172 ALA 1.543 0.411 7 0 "[ . 1]"
1 174 GLU 0.262 0.090 7 0 "[ . 1]"
1 175 ARG 0.000 0.000 . 0 "[ . 1]"
1 176 ALA 0.000 0.000 . 0 "[ . 1]"
1 177 TRP 0.477 0.060 8 0 "[ . 1]"
1 178 MET 0.320 0.153 9 0 "[ . 1]"
1 179 ASP 0.894 0.101 5 0 "[ . 1]"
1 180 GLU 0.000 0.000 . 0 "[ . 1]"
1 181 ILE 3.552 0.441 2 0 "[ . 1]"
1 182 VAL 7.045 0.488 3 0 "[ . 1]"
1 183 GLY 2.238 0.307 5 0 "[ . 1]"
1 184 ASN 3.038 0.488 3 0 "[ . 1]"
1 185 MET 0.549 0.111 8 0 "[ . 1]"
1 186 GLY 0.081 0.045 4 0 "[ . 1]"
1 187 TYR 0.827 0.103 9 0 "[ . 1]"
1 188 VAL 0.890 0.109 4 0 "[ . 1]"
1 189 ASP 1.156 0.150 7 0 "[ . 1]"
1 190 ALA 0.403 0.097 2 0 "[ . 1]"
1 191 LEU 1.457 0.211 6 0 "[ . 1]"
1 192 ARG 1.457 0.211 6 0 "[ . 1]"
1 193 GLU 0.794 0.110 10 0 "[ . 1]"
1 194 VAL 2.613 0.110 10 0 "[ . 1]"
1 195 SER 0.483 0.099 7 0 "[ . 1]"
1 196 ARG 0.188 0.051 9 0 "[ . 1]"
1 197 GLU 0.188 0.051 9 0 "[ . 1]"
1 198 GLY 0.309 0.049 10 0 "[ . 1]"
1 199 ASP 0.069 0.020 3 0 "[ . 1]"
1 200 GLN 0.069 0.020 3 0 "[ . 1]"
1 202 SER 0.334 0.056 2 0 "[ . 1]"
1 203 TRP 0.369 0.056 2 0 "[ . 1]"
1 204 TRP 0.005 0.005 3 0 "[ . 1]"
1 206 ASP 0.030 0.009 2 0 "[ . 1]"
1 207 ASN 0.000 0.000 . 0 "[ . 1]"
1 208 GLU 0.000 0.000 . 0 "[ . 1]"
1 209 GLN 0.155 0.051 3 0 "[ . 1]"
1 210 ALA 0.414 0.092 2 0 "[ . 1]"
1 211 GLU 0.078 0.019 3 0 "[ . 1]"
1 212 MET 0.121 0.051 3 0 "[ . 1]"
1 213 LEU 0.010 0.010 10 0 "[ . 1]"
1 214 ASN 0.000 0.000 . 0 "[ . 1]"
1 215 LEU 1.127 0.133 2 0 "[ . 1]"
1 219 PHE 0.000 0.000 . 0 "[ . 1]"
1 220 ASP 0.000 0.000 . 0 "[ . 1]"
1 221 TYR 0.550 0.209 4 0 "[ . 1]"
1 222 GLN 0.017 0.017 5 0 "[ . 1]"
1 223 LEU 1.195 0.150 7 0 "[ . 1]"
1 224 LEU 0.614 0.071 3 0 "[ . 1]"
1 225 THR 1.651 0.171 3 0 "[ . 1]"
1 227 GLY 1.161 0.087 10 0 "[ . 1]"
1 228 LEU 0.145 0.065 9 0 "[ . 1]"
1 229 ARG 1.060 0.137 6 0 "[ . 1]"
1 230 ARG 0.548 0.137 6 0 "[ . 1]"
1 231 PHE 0.168 0.039 6 0 "[ . 1]"
1 232 VAL 0.309 0.073 4 0 "[ . 1]"
1 233 ARG 0.777 0.140 8 0 "[ . 1]"
1 234 SER 0.913 0.106 3 0 "[ . 1]"
1 235 ALA 0.707 0.096 9 0 "[ . 1]"
1 236 ARG 1.129 0.138 9 0 "[ . 1]"
1 237 LEU 0.016 0.016 7 0 "[ . 1]"
1 239 ARG 0.044 0.015 10 0 "[ . 1]"
1 240 GLN 0.044 0.015 10 0 "[ . 1]"
1 242 ARG 0.727 0.236 2 0 "[ . 1]"
1 243 PHE 0.764 0.236 2 0 "[ . 1]"
1 244 SER 0.413 0.087 7 0 "[ . 1]"
1 245 GLN 0.000 0.000 . 0 "[ . 1]"
1 246 HIS 0.000 0.000 . 0 "[ . 1]"
1 249 LEU 0.532 0.090 7 0 "[ . 1]"
1 250 ILE 0.319 0.131 9 0 "[ . 1]"
1 251 VAL 0.680 0.138 9 0 "[ . 1]"
1 252 ASP 0.076 0.026 9 0 "[ . 1]"
1 254 ASP 1.009 0.140 8 0 "[ . 1]"
1 255 TRP 0.268 0.090 5 0 "[ . 1]"
1 257 LEU 0.327 0.078 9 0 "[ . 1]"
1 258 THR 0.339 0.078 9 0 "[ . 1]"
1 259 ILE 0.861 0.091 8 0 "[ . 1]"
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 2 ARG H 1 3 ILE H 5.000 . 5.500 4.023 2.815 4.435 . 0 0 "[ . 1]" 1
2 1 2 ARG H 1 29 ASP H 2.800 . 3.300 2.433 1.770 3.367 0.067 3 0 "[ . 1]" 1
3 1 3 ILE H 1 251 VAL H 3.500 . 4.000 2.819 2.414 3.194 . 0 0 "[ . 1]" 1
4 1 5 SER H 1 6 VAL H 5.000 . 5.500 4.298 4.166 4.400 . 0 0 "[ . 1]" 1
5 1 5 SER H 1 249 LEU H 2.800 . 3.300 3.353 3.322 3.390 0.090 7 0 "[ . 1]" 1
6 1 9 ASN H 1 10 GLY H 2.700 . 3.200 3.188 3.012 3.258 0.058 1 0 "[ . 1]" 1
7 1 10 GLY H 1 11 ILE H 3.300 . 3.800 3.001 2.577 3.647 . 0 0 "[ . 1]" 1
8 1 10 GLY H 1 37 ARG H 5.000 . 5.500 5.514 5.423 5.568 0.068 1 0 "[ . 1]" 1
9 1 11 ILE H 1 12 GLN H 2.700 . 3.200 2.630 2.449 2.866 . 0 0 "[ . 1]" 1
10 1 11 ILE H 1 13 THR H 3.300 . 3.800 3.940 3.906 3.992 0.192 8 0 "[ . 1]" 1
11 1 11 ILE H 1 37 ARG H 5.000 . 5.500 4.804 4.521 5.314 . 0 0 "[ . 1]" 1
12 1 12 GLN H 1 13 THR H 2.700 . 3.200 2.416 2.293 2.521 . 0 0 "[ . 1]" 1
13 1 12 GLN H 1 14 ALA H 2.700 . 3.200 3.477 3.443 3.521 0.321 6 0 "[ . 1]" 1
14 1 13 THR H 1 14 ALA H 2.700 . 3.200 2.254 2.188 2.316 . 0 0 "[ . 1]" 1
15 1 13 THR H 1 15 VAL H 5.000 . 5.500 4.119 4.042 4.179 . 0 0 "[ . 1]" 1
16 1 13 THR H 1 16 GLU H 5.000 . 5.500 4.612 4.500 4.673 . 0 0 "[ . 1]" 1
17 1 14 ALA H 1 15 VAL H 3.300 . 3.800 2.595 2.544 2.638 . 0 0 "[ . 1]" 1
18 1 14 ALA H 1 16 GLU H 3.300 . 3.800 3.857 3.835 3.875 0.075 9 0 "[ . 1]" 1
19 1 14 ALA H 1 17 ARG H 5.000 . 5.500 4.827 4.728 4.955 . 0 0 "[ . 1]" 1
20 1 15 VAL H 1 16 GLU H 3.300 . 3.800 2.531 2.480 2.610 . 0 0 "[ . 1]" 1
21 1 15 VAL H 1 17 ARG H 3.300 . 3.800 3.719 3.623 3.806 0.006 3 0 "[ . 1]" 1
22 1 16 GLU H 1 17 ARG H 3.300 . 3.800 2.413 2.353 2.496 . 0 0 "[ . 1]" 1
23 1 17 ARG H 1 18 GLY H 2.700 . 3.200 2.230 2.171 2.312 . 0 0 "[ . 1]" 1
24 1 17 ARG H 1 19 LEU H 4.000 . 4.500 3.536 3.428 3.686 . 0 0 "[ . 1]" 1
25 1 18 GLY H 1 19 LEU H 2.700 . 3.200 2.071 1.908 2.527 . 0 0 "[ . 1]" 1
26 1 18 GLY H 1 20 LEU H 4.000 . 4.500 3.656 3.473 3.906 . 0 0 "[ . 1]" 1
27 1 19 LEU H 1 22 TRP H 5.000 . 5.500 4.729 4.545 4.889 . 0 0 "[ . 1]" 1
28 1 19 LEU H 1 20 LEU H 4.000 . 4.500 2.779 2.628 3.023 . 0 0 "[ . 1]" 1
29 1 20 LEU H 1 21 SER H 2.700 . 3.200 2.685 2.623 2.745 . 0 0 "[ . 1]" 1
30 1 20 LEU H 1 22 TRP H 3.300 . 3.800 3.876 3.839 3.917 0.117 8 0 "[ . 1]" 1
31 1 20 LEU H 1 23 LEU H 5.000 . 5.500 4.675 4.399 4.916 . 0 0 "[ . 1]" 1
32 1 21 SER H 1 23 LEU H 5.000 . 5.500 4.188 3.757 4.873 . 0 0 "[ . 1]" 1
33 1 21 SER H 1 22 TRP H 2.700 . 3.200 2.538 2.435 2.646 . 0 0 "[ . 1]" 1
34 1 22 TRP H 1 23 LEU H 4.000 . 4.500 2.447 2.230 2.740 . 0 0 "[ . 1]" 1
35 1 22 TRP H 1 24 GLN H 5.000 . 5.500 3.897 3.523 4.518 . 0 0 "[ . 1]" 1
36 1 23 LEU H 1 24 GLN H 4.000 . 4.500 2.550 2.214 2.763 . 0 0 "[ . 1]" 1
37 1 23 LEU H 1 25 ALA H 5.000 . 5.500 3.889 3.559 4.228 . 0 0 "[ . 1]" 1
38 1 24 GLN H 1 25 ALA H 3.300 . 3.800 2.306 1.841 2.578 . 0 0 "[ . 1]" 1
39 1 24 GLN H 1 26 GLN H 3.300 . 3.800 3.804 3.505 3.873 0.073 4 0 "[ . 1]" 1
40 1 25 ALA H 1 26 GLN H 3.300 . 3.800 2.625 2.508 2.672 . 0 0 "[ . 1]" 1
41 1 26 GLN H 1 27 ASN H 3.300 . 3.800 2.525 1.896 3.429 . 0 0 "[ . 1]" 1
42 1 26 GLN H 1 28 ALA H 4.000 . 4.500 4.250 3.432 4.647 0.147 9 0 "[ . 1]" 1
43 1 27 ASN H 1 28 ALA H 3.300 . 3.800 2.894 2.595 3.214 . 0 0 "[ . 1]" 1
44 1 31 ILE H 1 71 TYR H 3.000 . 3.500 2.693 2.324 3.265 . 0 0 "[ . 1]" 1
45 1 36 THR H 1 37 ARG H 4.000 . 4.500 2.461 2.054 3.104 . 0 0 "[ . 1]" 1
46 1 36 THR H 1 38 ALA H 5.000 . 5.500 4.350 3.863 5.530 0.030 1 0 "[ . 1]" 1
47 1 37 ARG H 1 38 ALA H 3.300 . 3.800 2.986 2.758 3.650 . 0 0 "[ . 1]" 1
48 1 37 ARG H 1 66 GLY H 4.500 . 5.000 4.852 3.937 5.037 0.037 1 0 "[ . 1]" 1
49 1 37 ARG H 1 67 GLY H 5.000 . 5.500 5.469 5.174 5.547 0.047 4 0 "[ . 1]" 1
50 1 38 ALA H 1 39 SER H 5.000 . 5.500 4.505 4.292 4.581 . 0 0 "[ . 1]" 1
51 1 39 SER H 1 41 PHE H 4.000 . 4.500 4.518 4.449 4.556 0.056 1 0 "[ . 1]" 1
52 1 39 SER H 1 42 GLU H 4.000 . 4.500 3.587 3.110 3.909 . 0 0 "[ . 1]" 1
53 1 39 SER H 1 43 LEU H 4.000 . 4.500 4.058 3.634 4.560 0.060 2 0 "[ . 1]" 1
54 1 40 ALA H 1 41 PHE H 2.700 . 3.200 2.422 2.197 2.714 . 0 0 "[ . 1]" 1
55 1 40 ALA H 1 42 GLU H 3.300 . 3.800 3.866 3.830 3.952 0.152 6 0 "[ . 1]" 1
56 1 40 ALA H 1 59 GLU H 5.500 . 6.000 5.998 5.777 6.042 0.042 3 0 "[ . 1]" 1
57 1 41 PHE H 1 42 GLU H 2.700 . 3.200 2.211 1.836 2.974 . 0 0 "[ . 1]" 1
58 1 41 PHE H 1 44 ASP H 6.000 . 6.500 5.264 4.540 5.633 . 0 0 "[ . 1]" 1
59 1 42 GLU H 1 43 LEU H 2.700 . 3.200 2.058 1.798 2.685 0.002 1 0 "[ . 1]" 1
60 1 42 GLU H 1 44 ASP H 4.000 . 4.500 3.946 3.408 4.416 . 0 0 "[ . 1]" 1
61 1 42 GLU H 1 45 ASP H 6.000 . 6.500 4.988 4.540 5.251 . 0 0 "[ . 1]" 1
62 1 43 LEU H 1 44 ASP H 3.300 . 3.800 2.759 2.272 2.878 . 0 0 "[ . 1]" 1
63 1 43 LEU H 1 45 ASP H 3.300 . 3.800 3.871 3.834 3.919 0.119 6 0 "[ . 1]" 1
64 1 44 ASP H 1 45 ASP H 2.700 . 3.200 2.745 2.239 2.888 . 0 0 "[ . 1]" 1
65 1 44 ASP H 1 48 TYR H 6.000 . 6.500 6.317 5.947 6.525 0.025 1 0 "[ . 1]" 1
66 1 45 ASP H 1 47 ALA H 5.000 . 5.500 4.855 4.478 5.430 . 0 0 "[ . 1]" 1
67 1 45 ASP H 1 48 TYR H 5.000 . 5.500 4.436 4.181 4.741 . 0 0 "[ . 1]" 1
68 1 47 ALA H 1 48 TYR H 2.700 . 3.200 2.666 2.352 2.764 . 0 0 "[ . 1]" 1
69 1 47 ALA H 1 49 GLN H 3.300 . 3.800 3.808 3.766 3.829 0.029 10 0 "[ . 1]" 1
70 1 48 TYR H 1 49 GLN H 2.700 . 3.200 2.335 2.026 2.519 . 0 0 "[ . 1]" 1
71 1 49 GLN H 1 50 LEU H 5.000 . 5.500 4.643 4.572 4.706 . 0 0 "[ . 1]" 1
72 1 50 LEU H 1 51 ASP H 3.300 . 3.800 3.787 3.680 3.844 0.044 3 0 "[ . 1]" 1
73 1 50 LEU H 1 53 TYR H 3.300 . 3.800 3.808 3.484 3.913 0.113 10 0 "[ . 1]" 1
74 1 51 ASP H 1 52 GLY H 4.000 . 4.500 2.508 2.260 2.807 . 0 0 "[ . 1]" 1
75 1 51 ASP H 1 53 TYR H 5.000 . 5.500 5.038 3.922 5.500 . 5 0 "[ . 1]" 1
76 1 52 GLY H 1 53 TYR H 2.700 . 3.200 3.098 2.745 3.255 0.055 4 0 "[ . 1]" 1
77 1 53 TYR H 1 54 PHE H 5.000 . 5.500 4.420 4.353 4.473 . 0 0 "[ . 1]" 1
78 1 54 PHE H 1 72 SER H 3.300 . 3.800 3.709 3.176 3.873 0.073 10 0 "[ . 1]" 1
79 1 57 ALA H 1 58 CYS H 5.000 . 5.500 4.313 4.235 4.373 . 0 0 "[ . 1]" 1
80 1 58 CYS H 1 59 GLU H 4.000 . 4.500 4.476 4.362 4.514 0.014 1 0 "[ . 1]" 1
81 1 58 CYS H 1 68 VAL H 3.300 . 3.800 3.763 3.399 3.926 0.126 7 0 "[ . 1]" 1
82 1 59 GLU H 1 60 ALA H 5.000 . 5.500 4.420 4.319 4.514 . 0 0 "[ . 1]" 1
83 1 60 ALA H 1 61 GLU H 5.000 . 5.500 3.634 3.004 4.635 . 0 0 "[ . 1]" 1
84 1 60 ALA H 1 65 GLN H 5.500 . 6.000 5.963 5.183 6.080 0.080 2 0 "[ . 1]" 1
85 1 60 ALA H 1 66 GLY H 6.000 . 6.500 4.548 3.377 5.355 . 0 0 "[ . 1]" 1
86 1 60 ALA H 1 67 GLY H 4.000 . 4.500 3.529 1.772 4.567 0.067 2 0 "[ . 1]" 1
87 1 60 ALA H 1 92 GLY H 5.000 . 5.500 5.202 4.765 5.562 0.062 5 0 "[ . 1]" 1
88 1 61 GLU H 1 62 VAL H 2.700 . 3.200 2.964 1.937 3.286 0.086 5 0 "[ . 1]" 1
89 1 61 GLU H 1 90 ARG H . . 5.500 5.587 5.187 5.769 0.269 10 0 "[ . 1]" 1
90 1 61 GLU H 1 92 GLY H 5.000 . 5.500 5.407 4.780 5.559 0.059 3 0 "[ . 1]" 1
91 1 62 VAL H 1 64 ALA H 6.000 . 6.500 4.294 4.019 5.775 . 0 0 "[ . 1]" 1
92 1 62 VAL H 1 65 GLN H 5.500 . 6.000 4.549 4.278 4.838 . 0 0 "[ . 1]" 1
93 1 64 ALA H 1 65 GLN H 2.700 . 3.200 2.306 2.097 2.548 . 0 0 "[ . 1]" 1
94 1 64 ALA H 1 66 GLY H 3.300 . 3.800 3.598 3.452 3.815 0.015 6 0 "[ . 1]" 1
95 1 65 GLN H 1 66 GLY H 2.700 . 3.200 1.881 1.752 2.278 0.048 4 0 "[ . 1]" 1
96 1 66 GLY H 1 67 GLY H 4.000 . 4.500 4.160 2.544 4.544 0.044 6 0 "[ . 1]" 1
97 1 67 GLY H 1 68 VAL H 5.000 . 5.500 3.630 2.506 4.358 . 0 0 "[ . 1]" 1
98 1 67 GLY H 1 92 GLY H 5.000 . 5.500 5.430 4.882 5.573 0.073 10 0 "[ . 1]" 1
99 1 67 GLY H 1 93 ARG H 5.000 . 5.500 4.900 4.018 5.626 0.126 7 0 "[ . 1]" 1
100 1 77 LYS H 1 78 ALA H 2.700 . 3.200 2.053 1.922 2.350 . 0 0 "[ . 1]" 1
101 1 77 LYS H 1 98 ASP H 3.300 . 3.800 3.842 3.827 3.855 0.055 9 0 "[ . 1]" 1
102 1 78 ALA H 1 98 ASP H 3.000 . 3.500 2.886 2.680 3.064 . 0 0 "[ . 1]" 1
103 1 79 VAL H 1 80 ILE H 4.000 . 4.500 4.088 3.924 4.179 . 0 0 "[ . 1]" 1
104 1 80 ILE H 1 81 THR H 5.000 . 5.500 4.253 4.208 4.315 . 0 0 "[ . 1]" 1
105 1 80 ILE H 1 96 GLN H 3.300 . 3.800 3.148 2.877 3.323 . 0 0 "[ . 1]" 1
106 1 80 ILE H 1 97 ALA H 5.000 . 5.500 5.406 5.133 5.515 0.015 6 0 "[ . 1]" 1
107 1 81 THR H 1 82 GLY H 2.700 . 3.200 3.312 3.249 3.359 0.159 5 0 "[ . 1]" 1
108 1 83 LEU H 1 84 GLY H 3.300 . 3.800 2.785 1.892 3.698 . 0 0 "[ . 1]" 1
109 1 83 LEU H 1 85 PHE H 5.000 . 5.500 4.602 3.184 5.503 0.003 6 0 "[ . 1]" 1
110 1 84 GLY H 1 85 PHE H 3.300 . 3.800 2.533 1.794 3.832 0.032 6 0 "[ . 1]" 1
111 1 85 PHE H 1 89 ASP H 5.000 . 5.500 4.969 4.229 5.519 0.019 3 0 "[ . 1]" 1
112 1 87 THR H 1 88 ALA H 4.000 . 4.500 2.586 2.145 2.960 . 0 0 "[ . 1]" 1
113 1 87 THR H 1 89 ASP H 4.000 . 4.500 4.154 3.603 4.370 . 0 0 "[ . 1]" 1
114 1 88 ALA H 1 89 ASP H 3.300 . 3.800 2.680 2.525 2.972 . 0 0 "[ . 1]" 1
115 1 88 ALA H 1 90 ARG H 4.000 . 4.500 3.957 3.774 4.327 . 0 0 "[ . 1]" 1
116 1 89 ASP H 1 90 ARG H 3.300 . 3.800 2.614 2.422 2.816 . 0 0 "[ . 1]" 1
117 1 90 ARG H 1 91 TYR H 3.300 . 3.800 1.817 1.736 1.975 0.064 5 0 "[ . 1]" 1
118 1 90 ARG H 1 92 GLY H 3.300 . 3.800 3.886 3.834 3.941 0.141 1 0 "[ . 1]" 1
119 1 91 TYR H 1 92 GLY H 3.300 . 3.800 2.455 2.230 2.837 . 0 0 "[ . 1]" 1
120 1 92 GLY H 1 93 ARG H 3.300 . 3.800 2.338 2.081 2.705 . 0 0 "[ . 1]" 1
121 1 92 GLY H 1 94 TYR H 3.300 . 3.800 3.968 3.890 4.056 0.256 10 0 "[ . 1]" 1
122 1 93 ARG H 1 94 TYR H 3.300 . 3.800 2.527 2.121 2.976 . 0 0 "[ . 1]" 1
123 1 95 LEU H 1 106 THR H 3.000 . 3.500 3.523 3.442 3.567 0.067 8 0 "[ . 1]" 1
124 1 97 ALA H 1 104 ILE H 3.300 . 3.800 3.719 3.380 3.825 0.025 7 0 "[ . 1]" 1
125 1 103 SER H 1 144 ILE H 4.000 . 4.500 4.470 4.330 4.530 0.030 2 0 "[ . 1]" 1
126 1 105 ALA H 1 144 ILE H . . 3.800 3.741 3.358 3.872 0.072 6 0 "[ . 1]" 1
127 1 105 ALA H 1 146 CYS H 3.300 . 3.800 3.779 3.397 3.880 0.080 10 0 "[ . 1]" 1
128 1 107 LEU H 1 148 SER H 4.000 . 4.500 4.277 3.471 4.508 0.008 6 0 "[ . 1]" 1
129 1 111 SER H 1 112 GLY H 3.300 . 3.800 2.024 1.975 2.079 . 0 0 "[ . 1]" 1
130 1 111 SER H 1 113 GLN H 5.000 . 6.000 3.817 3.725 3.942 . 0 0 "[ . 1]" 1
131 1 111 SER H 1 114 ASN H 4.000 . 4.500 4.517 4.478 4.540 0.040 3 0 "[ . 1]" 1
132 1 112 GLY H 1 114 ASN H 3.300 . 3.800 3.800 3.778 3.820 0.020 8 0 "[ . 1]" 1
133 1 113 GLN H 1 114 ASN H 3.300 . 3.800 2.460 2.427 2.479 . 0 0 "[ . 1]" 1
134 1 114 ASN H 1 115 GLY H 2.700 . 3.200 2.974 2.433 3.218 0.018 3 0 "[ . 1]" 1
135 1 116 ASP H 1 118 ASP H 4.000 . 4.500 4.242 4.041 4.529 0.029 1 0 "[ . 1]" 1
136 1 117 GLU H 1 118 ASP H 3.300 . 3.800 2.776 2.507 2.888 . 0 0 "[ . 1]" 1
137 1 118 ASP H 1 119 LEU H 2.700 . 3.200 2.499 2.312 2.608 . 0 0 "[ . 1]" 1
138 1 118 ASP H 1 120 ASN H 4.000 . 4.500 4.341 3.684 4.529 0.029 7 0 "[ . 1]" 1
139 1 119 LEU H 1 120 ASN H 3.300 . 3.800 2.835 2.572 2.953 . 0 0 "[ . 1]" 1
140 1 119 LEU H 1 121 GLN H 4.000 . 4.500 4.247 3.990 4.507 0.007 1 0 "[ . 1]" 1
141 1 120 ASN H 1 121 GLN H 3.300 . 3.800 2.701 2.296 2.920 . 0 0 "[ . 1]" 1
142 1 120 ASN H 1 122 LYS H 3.300 . 3.800 3.773 3.210 3.918 0.118 3 0 "[ . 1]" 1
143 1 121 GLN H 1 123 PHE H 3.300 . 3.800 3.818 3.737 3.859 0.059 1 0 "[ . 1]" 1
144 1 122 LYS H 1 123 PHE H 2.700 . 3.200 2.556 2.307 2.699 . 0 0 "[ . 1]" 1
145 1 123 PHE H 1 125 LEU H 5.000 . 5.500 4.199 4.052 4.400 . 0 0 "[ . 1]" 1
146 1 123 PHE H 1 124 LYS H 2.700 . 3.200 2.799 2.593 3.066 . 0 0 "[ . 1]" 1
147 1 124 LYS H 1 125 LEU H 5.000 . 5.500 2.764 2.651 2.873 . 0 0 "[ . 1]" 1
148 1 124 LYS H 1 126 MET H 3.300 . 3.800 3.886 3.861 3.913 0.113 10 0 "[ . 1]" 1
149 1 125 LEU H 1 126 MET H 2.700 . 3.200 2.519 2.451 2.565 . 0 0 "[ . 1]" 1
150 1 126 MET H 1 127 ASP H 2.700 . 3.200 2.793 2.736 2.850 . 0 0 "[ . 1]" 1
151 1 126 MET H 1 128 ASP H 4.000 . 4.500 4.298 4.218 4.430 . 0 0 "[ . 1]" 1
152 1 127 ASP H 1 128 ASP H 2.700 . 3.200 2.797 2.748 2.857 . 0 0 "[ . 1]" 1
153 1 127 ASP H 1 129 PHE H 4.000 . 4.500 4.100 4.033 4.165 . 0 0 "[ . 1]" 1
154 1 128 ASP H 1 129 PHE H 3.300 . 3.800 2.611 2.569 2.672 . 0 0 "[ . 1]" 1
155 1 128 ASP H 1 130 ALA H 4.000 . 4.500 4.209 4.006 4.337 . 0 0 "[ . 1]" 1
156 1 129 PHE H 1 130 ALA H 3.300 . 3.800 2.678 2.544 2.762 . 0 0 "[ . 1]" 1
157 1 129 PHE H 1 131 ARG H 3.300 . 3.800 3.870 3.829 3.901 0.101 10 0 "[ . 1]" 1
158 1 130 ALA H 1 131 ARG H 2.700 . 3.200 2.534 2.488 2.605 . 0 0 "[ . 1]" 1
159 1 130 ALA H 1 132 TYR H 3.300 . 3.800 3.834 3.815 3.856 0.056 10 0 "[ . 1]" 1
160 1 131 ARG H 1 132 TYR H 3.300 . 3.800 2.480 2.388 2.585 . 0 0 "[ . 1]" 1
161 1 133 LEU H 1 134 ASP H 3.300 . 3.800 2.596 2.559 2.670 . 0 0 "[ . 1]" 1
162 1 133 LEU H 1 135 LYS H 4.000 . 4.500 3.901 3.814 3.971 . 0 0 "[ . 1]" 1
163 1 134 ASP H 1 135 LYS H 2.700 . 3.200 2.611 2.474 2.683 . 0 0 "[ . 1]" 1
164 1 135 LYS H 1 136 GLN H 3.300 . 3.800 2.565 2.464 2.711 . 0 0 "[ . 1]" 1
165 1 135 LYS H 1 137 ARG H 4.000 . 4.500 3.957 3.820 4.255 . 0 0 "[ . 1]" 1
166 1 136 GLN H 1 137 ARG H 3.300 . 3.800 2.255 2.156 2.412 . 0 0 "[ . 1]" 1
167 1 137 ARG H 1 138 ARG H 3.300 . 3.800 2.505 2.409 2.629 . 0 0 "[ . 1]" 1
168 1 138 ARG H 1 139 LYS H 2.700 . 3.200 2.718 2.624 2.819 . 0 0 "[ . 1]" 1
169 1 145 TYR H 1 223 LEU H 3.300 . 3.800 3.765 3.576 3.842 0.042 4 0 "[ . 1]" 1
170 1 147 GLY H 1 221 TYR H 3.300 . 3.800 3.436 3.081 3.855 0.055 4 0 "[ . 1]" 1
171 1 147 GLY H 1 223 LEU H 4.000 . 4.500 4.105 2.661 4.523 0.023 10 0 "[ . 1]" 1
172 1 149 LEU H 1 150 TYR H 4.000 . 4.500 4.342 4.145 4.478 . 0 0 "[ . 1]" 1
173 1 149 LEU H 1 151 VAL H 3.300 . 3.800 3.805 3.661 3.878 0.078 9 0 "[ . 1]" 1
174 1 150 TYR H 1 151 VAL H 5.000 . 5.500 3.352 3.144 3.494 . 0 0 "[ . 1]" 1
175 1 153 GLN H 1 154 GLN H 2.700 . 3.200 2.668 2.274 3.102 . 0 0 "[ . 1]" 1
176 1 154 GLN H 1 156 LEU H 5.000 . 5.500 3.390 3.032 3.800 . 0 0 "[ . 1]" 1
177 1 154 GLN H 1 157 ASP H 4.000 . 4.500 3.498 2.716 3.984 . 0 0 "[ . 1]" 1
178 1 155 LYS H 1 156 LEU H 2.700 . 3.200 2.503 2.148 2.864 . 0 0 "[ . 1]" 1
179 1 156 LEU H 1 157 ASP H 3.300 . 3.800 2.201 1.877 2.681 . 0 0 "[ . 1]" 1
180 1 156 LEU H 1 158 ILE H 3.300 . 3.800 3.813 3.800 3.825 0.025 3 0 "[ . 1]" 1
181 1 157 ASP H 1 158 ILE H 2.700 . 3.200 2.177 1.780 2.543 0.020 4 0 "[ . 1]" 1
182 1 157 ASP H 1 159 LYS H 4.000 . 4.500 4.475 4.161 4.551 0.051 7 0 "[ . 1]" 1
183 1 159 LYS H 1 160 ASN H 3.300 . 3.800 2.547 2.141 2.922 . 0 0 "[ . 1]" 1
184 1 161 TRP H 1 162 ARG H 3.300 . 3.800 2.930 2.761 3.150 . 0 0 "[ . 1]" 1
185 1 163 ASP H 1 164 SER H 4.000 . 4.500 2.286 2.000 2.807 . 0 0 "[ . 1]" 1
186 1 164 SER H 1 165 GLN H 3.300 . 3.800 2.642 2.227 2.961 . 0 0 "[ . 1]" 1
187 1 165 GLN H 1 166 GLN H 4.000 . 4.500 2.387 2.049 2.636 . 0 0 "[ . 1]" 1
188 1 165 GLN H 1 167 SER H 3.300 . 3.800 3.827 3.783 3.861 0.061 3 0 "[ . 1]" 1
189 1 166 GLN H 1 167 SER H 2.700 . 3.200 2.843 1.932 3.165 . 0 0 "[ . 1]" 1
190 1 174 GLU H 1 175 ARG H 2.700 . 3.200 2.833 2.513 3.030 . 0 0 "[ . 1]" 1
191 1 174 GLU H 1 177 TRP H 4.000 . 4.500 4.517 4.500 4.544 0.044 4 0 "[ . 1]" 1
192 1 176 ALA H 1 177 TRP H 2.700 . 3.200 2.669 2.479 2.945 . 0 0 "[ . 1]" 1
193 1 177 TRP H 1 179 ASP H 3.300 . 3.800 3.831 3.811 3.860 0.060 8 0 "[ . 1]" 1
194 1 178 MET H 1 179 ASP H 2.700 . 3.200 2.585 2.490 2.675 . 0 0 "[ . 1]" 1
195 1 178 MET H 1 180 GLU H 4.000 . 4.500 4.276 4.135 4.429 . 0 0 "[ . 1]" 1
196 1 179 ASP H 1 180 GLU H 2.700 . 3.200 2.646 2.509 2.696 . 0 0 "[ . 1]" 1
197 1 179 ASP H 1 181 ILE H 3.300 . 3.800 3.859 3.829 3.901 0.101 5 0 "[ . 1]" 1
198 1 180 GLU H 1 181 ILE H 2.700 . 3.200 2.754 2.668 2.904 . 0 0 "[ . 1]" 1
199 1 181 ILE H 1 182 VAL H 3.300 . 3.800 2.125 1.793 2.480 0.007 7 0 "[ . 1]" 1
200 1 181 ILE H 1 183 GLY H 3.300 . 3.800 3.581 3.147 3.846 0.046 4 0 "[ . 1]" 1
201 1 182 VAL H 1 183 GLY H 3.300 . 3.800 2.240 1.795 2.660 0.005 9 0 "[ . 1]" 1
202 1 183 GLY H 1 184 ASN H 3.300 . 3.800 2.597 2.116 3.308 . 0 0 "[ . 1]" 1
203 1 183 GLY H 1 185 MET H 3.300 . 3.800 3.816 3.644 3.911 0.111 8 0 "[ . 1]" 1
204 1 184 ASN H 1 185 MET H 2.700 . 3.200 2.334 2.305 2.389 . 0 0 "[ . 1]" 1
205 1 184 ASN H 1 186 GLY H 4.000 . 4.500 3.594 3.503 3.723 . 0 0 "[ . 1]" 1
206 1 185 MET H 1 186 GLY H 2.700 . 3.200 2.388 1.755 2.632 0.045 4 0 "[ . 1]" 1
207 1 185 MET H 1 187 TYR H 3.300 . 3.800 3.790 3.641 3.844 0.044 6 0 "[ . 1]" 1
208 1 186 GLY H 1 187 TYR H 3.300 . 3.800 2.204 1.975 2.731 . 0 0 "[ . 1]" 1
209 1 191 LEU H 1 192 ARG H 3.300 . 3.800 2.726 2.549 2.959 . 0 0 "[ . 1]" 1
210 1 192 ARG H 1 193 GLU H 3.300 . 3.800 2.513 2.217 2.770 . 0 0 "[ . 1]" 1
211 1 193 GLU H 1 195 SER H 3.300 . 3.800 3.503 3.129 3.797 . 0 0 "[ . 1]" 1
212 1 194 VAL H 1 195 SER H 3.300 . 3.800 1.869 1.775 2.308 0.025 10 0 "[ . 1]" 1
213 1 196 ARG H 1 197 GLU H 4.000 . 4.500 4.485 4.353 4.551 0.051 9 0 "[ . 1]" 1
214 1 199 ASP H 1 200 GLN H 3.300 . 3.800 3.443 1.847 3.820 0.020 3 0 "[ . 1]" 1
215 1 202 SER H 1 203 TRP H 3.300 . 3.800 3.833 3.811 3.856 0.056 2 0 "[ . 1]" 1
216 1 206 ASP H 1 207 ASN H 3.300 . 3.800 3.042 1.946 3.798 . 0 0 "[ . 1]" 1
217 1 209 GLN H 1 211 GLU H 4.000 . 4.500 4.438 4.255 4.519 0.019 3 0 "[ . 1]" 1
218 1 211 GLU H 1 212 MET H 2.700 . 3.200 3.039 2.698 3.216 0.016 8 0 "[ . 1]" 1
219 1 211 GLU H 1 213 LEU H 4.000 . 4.500 3.752 3.442 4.510 0.010 10 0 "[ . 1]" 1
220 1 212 MET H 1 213 LEU H 2.700 . 3.200 2.780 2.242 2.998 . 0 0 "[ . 1]" 1
221 1 213 LEU H 1 214 ASN H 3.300 . 3.800 3.475 2.832 3.752 . 0 0 "[ . 1]" 1
222 1 219 PHE H 1 220 ASP H 5.000 . 5.500 3.545 3.007 4.415 . 0 0 "[ . 1]" 1
223 1 225 THR H 1 227 GLY H 3.300 . 3.800 3.857 3.825 3.887 0.087 10 0 "[ . 1]" 1
224 1 227 GLY H 1 228 LEU H 2.700 . 3.200 2.216 2.116 2.402 . 0 0 "[ . 1]" 1
225 1 227 GLY H 1 229 ARG H 2.700 . 3.200 3.249 3.163 3.287 0.087 4 0 "[ . 1]" 1
226 1 228 LEU H 1 229 ARG H 2.700 . 3.200 1.982 1.795 2.493 0.005 3 0 "[ . 1]" 1
227 1 229 ARG H 1 230 ARG H 2.700 . 3.200 3.249 3.166 3.337 0.137 6 0 "[ . 1]" 1
228 1 229 ARG H 1 231 PHE H 5.000 . 5.500 4.339 4.196 4.520 . 0 0 "[ . 1]" 1
229 1 230 ARG H 1 231 PHE H 3.300 . 3.800 2.843 2.585 3.032 . 0 0 "[ . 1]" 1
230 1 231 PHE H 1 232 VAL H 2.700 . 3.200 3.050 2.730 3.239 0.039 6 0 "[ . 1]" 1
231 1 233 ARG H 1 234 SER H 2.700 . 3.200 2.563 1.797 2.813 0.003 10 0 "[ . 1]" 1
232 1 233 ARG H 1 252 ASP H 4.500 . 5.000 4.804 4.351 5.018 0.018 1 0 "[ . 1]" 1
233 1 233 ARG H 1 254 ASP H 4.000 . 4.500 4.574 4.518 4.640 0.140 8 0 "[ . 1]" 1
234 1 234 SER H 1 252 ASP H 2.700 . 3.200 3.062 2.760 3.226 0.026 9 0 "[ . 1]" 1
235 1 235 ALA H 1 236 ARG H 3.300 . 3.800 3.780 3.712 3.843 0.043 8 0 "[ . 1]" 1
236 1 236 ARG H 1 237 LEU H 4.000 . 4.500 4.337 4.215 4.382 . 0 0 "[ . 1]" 1
237 1 236 ARG H 1 250 ILE H 3.300 . 3.800 3.418 2.982 3.749 . 0 0 "[ . 1]" 1
238 1 236 ARG H 1 252 ASP H 5.000 . 5.500 4.413 4.040 4.817 . 0 0 "[ . 1]" 1
239 1 239 ARG H 1 240 GLN H 2.700 . 3.200 1.978 1.785 2.208 0.015 10 0 "[ . 1]" 1
240 1 242 ARG H 1 243 PHE H 3.300 . 3.800 3.854 3.809 4.036 0.236 2 0 "[ . 1]" 1
241 1 243 PHE H 1 244 SER H 2.700 . 3.200 3.210 3.134 3.287 0.087 7 0 "[ . 1]" 1
242 1 244 SER H 1 246 HIS H 5.000 . 5.500 3.827 2.486 5.107 . 0 0 "[ . 1]" 1
243 1 245 GLN H 1 246 HIS H 2.700 . 3.200 2.563 2.197 2.828 . 0 0 "[ . 1]" 1
244 1 254 ASP H 1 255 TRP H 4.000 . 4.500 4.494 4.354 4.590 0.090 5 0 "[ . 1]" 1
245 1 68 VAL H 1 94 TYR H 6.000 . 6.500 5.302 4.310 6.293 . 0 0 "[ . 1]" 1
246 1 74 LEU H 1 75 GLN H 5.000 . 5.500 4.437 4.381 4.523 . 0 0 "[ . 1]" 1
247 1 55 LEU H 1 72 SER H 6.000 . 6.500 5.112 4.432 5.557 . 0 0 "[ . 1]" 1
248 1 73 ARG H 1 74 LEU H 3.300 . 3.800 2.514 2.217 2.668 . 0 0 "[ . 1]" 1
249 1 78 ALA H 1 79 VAL H 5.000 . 5.500 4.074 3.800 4.229 . 0 0 "[ . 1]" 1
250 1 84 GLY H 1 89 ASP H 5.000 . 5.500 5.381 4.893 5.574 0.074 6 0 "[ . 1]" 1
251 1 59 GLU H 1 92 GLY H 6.000 . 6.500 6.420 5.632 6.576 0.076 2 0 "[ . 1]" 1
252 1 80 ILE H 1 98 ASP H 5.000 . 5.500 5.539 5.517 5.551 0.051 3 0 "[ . 1]" 1
253 1 89 ASP H 1 91 TYR H 4.000 . 4.500 3.966 3.805 4.155 . 0 0 "[ . 1]" 1
254 1 91 TYR H 1 93 ARG H 4.000 . 4.500 4.374 4.013 4.544 0.044 10 0 "[ . 1]" 1
255 1 61 GLU H 1 91 TYR H 5.000 . 5.500 4.967 4.521 5.525 0.025 9 0 "[ . 1]" 1
256 1 82 GLY H 1 94 TYR H 4.000 . 4.500 4.629 4.594 4.675 0.175 5 0 "[ . 1]" 1
257 1 94 TYR H 1 95 LEU H 5.000 . 5.500 4.048 3.790 4.406 . 0 0 "[ . 1]" 1
258 1 96 GLN H 1 106 THR H 5.000 . 5.500 4.823 4.504 4.991 . 0 0 "[ . 1]" 1
259 1 95 LEU H 1 96 GLN H 5.000 . 5.500 4.061 3.960 4.152 . 0 0 "[ . 1]" 1
260 1 104 ILE H 1 105 ALA H 5.000 . 5.500 4.248 3.971 4.526 . 0 0 "[ . 1]" 1
261 1 107 LEU H 1 146 CYS H 5.000 . 5.500 3.861 3.274 4.464 . 0 0 "[ . 1]" 1
262 1 107 LEU H 1 108 LEU H 5.000 . 5.500 4.201 4.083 4.332 . 0 0 "[ . 1]" 1
263 1 115 GLY H 1 116 ASP H 5.000 . 5.500 4.424 4.351 4.567 . 0 0 "[ . 1]" 1
264 1 116 ASP H 1 117 GLU H . . 3.800 2.805 2.562 3.213 . 0 0 "[ . 1]" 1
265 1 113 GLN H 1 115 GLY H 6.000 . 6.500 5.056 3.881 5.501 . 0 0 "[ . 1]" 1
266 1 121 GLN H 1 122 LYS H 3.300 . 3.800 2.469 2.321 2.563 . 0 0 "[ . 1]" 1
267 1 119 LEU H 1 122 LYS H 5.000 . 5.500 4.440 4.285 4.614 . 0 0 "[ . 1]" 1
268 1 124 LYS H 1 127 ASP H 5.000 . 5.500 4.698 4.530 4.997 . 0 0 "[ . 1]" 1
269 1 125 LEU H 1 127 ASP H 5.000 . 5.500 4.263 4.098 4.485 . 0 0 "[ . 1]" 1
270 1 122 LYS H 1 124 LYS H 5.000 . 5.500 4.546 4.395 4.707 . 0 0 "[ . 1]" 1
271 1 123 PHE H 1 126 MET H 5.000 . 5.500 4.404 4.348 4.465 . 0 0 "[ . 1]" 1
272 1 131 ARG H 1 133 LEU H 5.000 . 5.500 4.360 4.260 4.449 . 0 0 "[ . 1]" 1
273 1 132 TYR H 1 133 LEU H 3.300 . 3.800 2.535 2.505 2.558 . 0 0 "[ . 1]" 1
274 1 132 TYR H 1 135 LYS H 3.300 . 3.800 3.962 3.949 3.971 0.171 10 0 "[ . 1]" 1
275 1 132 TYR H 1 134 ASP H 4.500 . 5.000 3.644 3.566 3.725 . 0 0 "[ . 1]" 1
276 1 129 PHE H 1 132 TYR H 4.000 . 4.500 4.470 4.386 4.554 0.054 4 0 "[ . 1]" 1
277 1 131 ARG H 1 134 ASP H 5.000 . 5.500 4.637 4.543 4.797 . 0 0 "[ . 1]" 1
278 1 134 ASP H 1 137 ARG H 5.000 . 5.500 4.476 4.359 4.750 . 0 0 "[ . 1]" 1
279 1 133 LEU H 1 136 GLN H 5.000 . 5.500 4.477 4.368 4.596 . 0 0 "[ . 1]" 1
280 1 134 ASP H 1 136 GLN H 5.000 . 5.500 3.831 3.680 4.133 . 0 0 "[ . 1]" 1
281 1 136 GLN H 1 138 ARG H 5.000 . 5.500 3.928 3.799 4.178 . 0 0 "[ . 1]" 1
282 1 137 ARG H 1 139 LYS H 4.000 . 4.500 4.191 4.022 4.378 . 0 0 "[ . 1]" 1
283 1 140 ARG H 1 141 ARG H 4.000 . 4.500 3.392 2.375 4.474 . 0 0 "[ . 1]" 1
284 1 141 ARG H 1 142 GLU H 5.000 . 5.500 4.097 2.854 4.608 . 0 0 "[ . 1]" 1
285 1 143 TYR H 1 225 THR H 3.300 . 3.800 3.810 3.803 3.818 0.018 10 0 "[ . 1]" 1
286 1 148 SER H 1 149 LEU H 4.500 . 5.000 3.930 2.594 4.275 . 0 0 "[ . 1]" 1
287 1 149 LEU H 1 221 TYR H 5.000 . 5.500 4.565 3.813 5.319 . 0 0 "[ . 1]" 1
288 1 153 GLN H 1 157 ASP H 5.000 . 5.500 5.243 4.539 5.521 0.021 7 0 "[ . 1]" 1
289 1 154 GLN H 1 155 LYS H 5.000 . 5.500 3.370 2.736 4.195 . 0 0 "[ . 1]" 1
290 1 155 LYS H 1 157 ASP H 5.000 . 5.500 3.947 3.414 4.434 . 0 0 "[ . 1]" 1
291 1 160 ASN H 1 161 TRP H 4.000 . 4.500 2.711 1.817 3.193 . 0 0 "[ . 1]" 1
292 1 158 ILE H 1 161 TRP H 6.000 . 6.500 5.773 4.694 6.501 0.001 9 0 "[ . 1]" 1
293 1 160 ASN H 1 162 ARG H 5.500 . 6.000 4.829 3.392 5.358 . 0 0 "[ . 1]" 1
294 1 162 ARG H 1 163 ASP H 3.300 . 3.800 2.960 2.404 3.278 . 0 0 "[ . 1]" 1
295 1 162 ARG H 1 164 SER H 4.500 . 5.000 3.825 3.423 4.944 . 0 0 "[ . 1]" 1
296 1 161 TRP H 1 163 ASP H 5.000 . 5.500 4.928 4.644 5.310 . 0 0 "[ . 1]" 1
297 1 163 ASP H 1 165 GLN H 4.000 . 4.500 4.211 3.208 4.532 0.032 1 0 "[ . 1]" 1
298 1 162 ARG H 1 165 GLN H 6.000 . 6.500 5.693 4.820 6.294 . 0 0 "[ . 1]" 1
299 1 174 GLU H 1 176 ALA H 4.000 . 4.500 4.265 4.158 4.449 . 0 0 "[ . 1]" 1
300 1 175 ARG H 1 176 ALA H 3.300 . 3.800 2.913 2.861 2.976 . 0 0 "[ . 1]" 1
301 1 172 ALA H 1 174 GLU H 5.000 . 5.500 3.925 3.746 4.162 . 0 0 "[ . 1]" 1
302 1 175 ARG H 1 177 TRP H 4.000 . 4.500 4.054 3.859 4.322 . 0 0 "[ . 1]" 1
303 1 176 ALA H 1 178 MET H 5.000 . 5.500 4.630 4.421 4.778 . 0 0 "[ . 1]" 1
304 1 177 TRP H 1 178 MET H 3.300 . 3.800 2.713 2.600 2.869 . 0 0 "[ . 1]" 1
305 1 182 VAL H 1 184 ASN H 5.000 . 5.500 3.583 2.745 4.927 . 0 0 "[ . 1]" 1
306 1 182 VAL H 1 185 MET H 5.000 . 5.500 4.924 4.468 5.326 . 0 0 "[ . 1]" 1
307 1 183 GLY H 1 187 TYR H 5.000 . 5.500 5.567 5.535 5.603 0.103 9 0 "[ . 1]" 1
308 1 188 VAL H 1 224 LEU H 3.300 . 3.800 3.620 3.249 3.844 0.044 10 0 "[ . 1]" 1
309 1 190 ALA H 1 224 LEU H 5.000 . 5.500 4.908 4.212 5.499 . 0 0 "[ . 1]" 1
310 1 190 ALA H 1 191 LEU H 4.000 . 4.500 2.849 2.768 2.950 . 0 0 "[ . 1]" 1
311 1 188 VAL H 1 189 ASP H 5.000 . 5.500 4.442 4.019 4.572 . 0 0 "[ . 1]" 1
312 1 189 ASP H 1 190 ALA H 5.000 . 5.500 3.425 2.915 3.928 . 0 0 "[ . 1]" 1
313 1 190 ALA H 1 222 GLN H 5.000 . 5.500 4.556 3.584 5.517 0.017 5 0 "[ . 1]" 1
314 1 191 LEU H 1 193 GLU H 5.000 . 5.500 3.550 3.407 3.643 . 0 0 "[ . 1]" 1
315 1 190 ALA H 1 192 ARG H 5.000 . 5.500 4.869 4.682 5.159 . 0 0 "[ . 1]" 1
316 1 192 ARG H 1 194 VAL H 5.000 . 5.500 4.466 4.134 4.666 . 0 0 "[ . 1]" 1
317 1 208 GLU H 1 209 GLN H 3.300 . 3.800 2.684 2.508 2.923 . 0 0 "[ . 1]" 1
318 1 209 GLN H 1 210 ALA H 3.300 . 3.800 2.687 2.517 2.925 . 0 0 "[ . 1]" 1
319 1 209 GLN H 1 212 MET H 5.500 . 6.000 5.885 5.482 6.051 0.051 3 0 "[ . 1]" 1
320 1 203 TRP HE1 1 204 TRP H 5.000 . 5.500 4.548 3.574 5.505 0.005 3 0 "[ . 1]" 1
321 1 203 TRP HE1 1 206 ASP H 6.000 . 6.500 5.842 3.692 6.509 0.009 2 0 "[ . 1]" 1
322 1 212 MET H 1 214 ASN H 6.000 . 6.500 5.163 3.650 5.581 . 0 0 "[ . 1]" 1
323 1 213 LEU H 1 215 LEU H 4.000 . 4.500 3.753 3.406 4.047 . 0 0 "[ . 1]" 1
324 1 225 THR H 1 228 LEU H 6.000 . 6.500 3.879 3.525 4.085 . 0 0 "[ . 1]" 1
325 1 228 LEU H 1 230 ARG H 5.000 . 5.500 4.658 4.402 5.032 . 0 0 "[ . 1]" 1
326 1 228 LEU H 1 231 PHE H 6.000 . 6.500 5.500 5.325 5.670 . 0 0 "[ . 1]" 1
327 1 230 ARG H 1 232 VAL H 5.000 . 5.500 5.359 5.094 5.518 0.018 1 0 "[ . 1]" 1
328 1 244 SER H 1 245 GLN H 5.000 . 5.500 3.312 2.525 4.174 . 0 0 "[ . 1]" 1
329 1 242 ARG H 1 244 SER H 6.000 . 6.500 6.330 4.781 6.545 0.045 9 0 "[ . 1]" 1
330 1 243 PHE H 1 245 GLN H 6.000 . 6.500 3.621 2.323 5.267 . 0 0 "[ . 1]" 1
331 1 243 PHE H 1 246 HIS H 5.000 . 5.500 3.609 2.706 5.074 . 0 0 "[ . 1]" 1
332 1 257 LEU H 1 258 THR H 5.000 . 5.500 4.533 4.419 4.623 . 0 0 "[ . 1]" 1
333 1 8 VAL MG1 1 10 GLY H 4.000 . 4.500 3.725 2.565 4.530 0.030 4 0 "[ . 1]" 1
334 1 8 VAL MG2 1 10 GLY H 2.700 . 3.200 1.954 1.777 2.495 0.023 9 0 "[ . 1]" 1
335 1 8 VAL MG2 1 11 ILE H 2.700 . 3.200 2.832 2.073 3.222 0.022 4 0 "[ . 1]" 1
336 1 8 VAL MG2 1 12 GLN H 3.300 . 3.800 3.976 3.912 4.060 0.260 8 0 "[ . 1]" 1
337 1 12 GLN H 1 15 VAL MG1 6.000 . 6.500 3.871 3.816 3.957 . 0 0 "[ . 1]" 1
338 1 11 ILE MD 1 12 GLN H 4.000 . 4.500 3.638 3.321 4.108 . 0 0 "[ . 1]" 1
339 1 8 VAL MG2 1 13 THR H 4.000 . 4.500 3.551 3.178 4.310 . 0 0 "[ . 1]" 1
340 1 11 ILE MD 1 13 THR H 4.000 . 4.500 4.627 4.570 4.757 0.257 9 0 "[ . 1]" 1
341 1 13 THR H 1 15 VAL MG1 3.300 . 3.800 3.915 3.876 3.958 0.158 10 0 "[ . 1]" 1
342 1 8 VAL MG2 1 14 ALA H 5.000 . 5.500 2.657 2.144 3.429 . 0 0 "[ . 1]" 1
343 1 14 ALA H 1 15 VAL MG1 3.300 . 3.800 3.267 3.199 3.421 . 0 0 "[ . 1]" 1
344 1 14 ALA H 1 15 VAL MG2 6.000 . 6.500 5.060 4.867 5.694 . 0 0 "[ . 1]" 1
345 1 11 ILE MD 1 15 VAL H 4.000 . 4.500 3.090 2.766 3.446 . 0 0 "[ . 1]" 1
346 1 15 VAL MG1 1 16 GLU H 2.700 . 3.200 2.691 2.018 2.881 . 0 0 "[ . 1]" 1
347 1 15 VAL MG2 1 16 GLU H 3.300 . 3.800 2.477 2.287 3.152 . 0 0 "[ . 1]" 1
348 1 15 VAL MG1 1 17 ARG H 4.000 . 4.500 4.344 3.922 4.482 . 0 0 "[ . 1]" 1
349 1 15 VAL MG2 1 17 ARG H 3.300 . 3.800 4.003 3.973 4.064 0.264 5 0 "[ . 1]" 1
350 1 15 VAL MG2 1 18 GLY H 4.000 . 4.500 4.277 4.077 4.502 0.002 7 0 "[ . 1]" 1
351 1 15 VAL MG1 1 20 LEU H 4.000 . 4.500 4.457 4.195 4.605 0.105 3 0 "[ . 1]" 1
352 1 15 VAL MG2 1 20 LEU H 4.000 . 4.500 4.474 3.576 4.632 0.132 3 0 "[ . 1]" 1
353 1 20 LEU MD1 1 21 SER H 4.000 . 4.500 4.379 4.201 4.553 0.053 5 0 "[ . 1]" 1
354 1 19 LEU MD2 1 23 LEU H 4.000 . 4.500 3.927 3.036 4.576 0.076 10 0 "[ . 1]" 1
355 1 23 LEU MD2 1 24 GLN H 3.300 . 3.800 3.860 3.004 4.129 0.329 10 0 "[ . 1]" 1
356 1 24 GLN H 1 50 LEU MD1 5.000 . 5.500 3.526 2.582 4.579 . 0 0 "[ . 1]" 1
357 1 24 GLN H 1 50 LEU MD2 4.000 . 4.500 2.978 2.632 3.482 . 0 0 "[ . 1]" 1
358 1 25 ALA H 1 50 LEU MD1 6.000 . 6.500 5.200 4.410 6.373 . 0 0 "[ . 1]" 1
359 1 25 ALA H 1 50 LEU MD2 4.000 . 4.500 4.617 4.497 4.760 0.260 5 0 "[ . 1]" 1
360 1 28 ALA H 1 31 ILE MD 4.000 . 4.500 4.160 3.608 4.588 0.088 8 0 "[ . 1]" 1
361 1 3 ILE MD 1 29 ASP H 3.300 . 3.800 3.829 3.311 3.997 0.197 3 0 "[ . 1]" 1
362 1 38 ALA H 1 43 LEU MD1 3.300 . 3.800 3.813 3.272 4.028 0.228 2 0 "[ . 1]" 1
363 1 39 SER H 1 43 LEU MD1 4.000 . 4.500 4.116 3.787 4.538 0.038 1 0 "[ . 1]" 1
364 1 42 GLU H 1 43 LEU MD2 5.000 . 5.500 5.134 3.168 5.605 0.105 1 0 "[ . 1]" 1
365 1 42 GLU H 1 43 LEU MD1 4.000 . 4.500 4.541 3.730 4.687 0.187 3 0 "[ . 1]" 1
366 1 43 LEU MD1 1 44 ASP H 4.000 . 4.500 4.405 3.915 4.646 0.146 2 0 "[ . 1]" 1
367 1 43 LEU MD2 1 44 ASP H 3.300 . 3.800 3.973 3.886 4.090 0.290 5 0 "[ . 1]" 1
368 1 50 LEU MD1 1 51 ASP H 2.700 . 3.200 3.387 3.293 3.455 0.255 1 0 "[ . 1]" 1
369 1 50 LEU MD2 1 51 ASP H 2.700 . 3.200 3.163 1.735 3.419 0.219 8 0 "[ . 1]" 1
370 1 55 LEU MD1 1 57 ALA H 4.000 . 4.500 4.080 3.579 4.482 . 0 0 "[ . 1]" 1
371 1 57 ALA H 1 95 LEU MD1 4.000 . 4.500 4.086 3.029 4.623 0.123 1 0 "[ . 1]" 1
372 1 57 ALA H 1 95 LEU MD2 4.000 . 4.500 4.324 3.902 4.543 0.043 9 0 "[ . 1]" 1
373 1 58 CYS H 1 68 VAL MG1 2.700 . 3.200 2.165 1.798 2.442 0.002 7 0 "[ . 1]" 1
374 1 58 CYS H 1 68 VAL MG2 3.300 . 3.800 3.697 2.758 3.928 0.128 6 0 "[ . 1]" 1
375 1 58 CYS H 1 95 LEU MD1 2.700 . 3.200 3.116 2.764 3.399 0.199 7 0 "[ . 1]" 1
376 1 58 CYS H 1 95 LEU MD2 4.000 . 4.500 3.527 2.793 4.013 . 0 0 "[ . 1]" 1
377 1 61 GLU H 1 62 VAL MG2 3.300 . 3.800 3.961 3.850 4.267 0.467 7 0 "[ . 1]" 1
378 1 61 GLU H 1 62 VAL MG1 4.000 . 4.500 4.426 2.106 4.799 0.299 5 0 "[ . 1]" 1
379 1 62 VAL MG2 1 64 ALA H 4.000 . 4.500 4.424 4.265 4.552 0.052 6 0 "[ . 1]" 1
380 1 62 VAL MG1 1 64 ALA H 5.000 . 5.500 4.694 4.449 5.695 0.195 7 0 "[ . 1]" 1
381 1 62 VAL MG2 1 65 GLN H 5.000 . 5.500 5.063 4.628 5.242 . 0 0 "[ . 1]" 1
382 1 62 VAL MG1 1 65 GLN H 4.000 . 4.500 4.549 4.439 4.874 0.374 7 0 "[ . 1]" 1
383 1 67 GLY H 1 108 LEU MD2 4.000 . 4.500 4.252 3.636 4.580 0.080 2 0 "[ . 1]" 1
384 1 67 GLY H 1 68 VAL MG1 4.000 . 4.500 4.412 3.928 4.723 0.223 6 0 "[ . 1]" 1
385 1 67 GLY H 1 68 VAL MG2 6.000 . 6.500 5.869 5.612 6.445 . 0 0 "[ . 1]" 1
386 1 74 LEU MD1 1 75 GLN H 2.700 . 3.200 3.100 1.694 3.408 0.208 8 0 "[ . 1]" 1
387 1 74 LEU MD2 1 75 GLN H 2.700 . 3.200 2.416 1.760 3.456 0.256 6 0 "[ . 1]" 1
388 1 78 ALA H 1 79 VAL MG2 4.000 . 4.500 3.659 3.145 4.047 . 0 0 "[ . 1]" 1
389 1 79 VAL H 1 80 ILE MD 4.000 . 4.500 3.529 3.007 3.895 . 0 0 "[ . 1]" 1
390 1 79 VAL MG1 1 80 ILE H 2.700 . 3.200 3.179 2.815 3.316 0.116 7 0 "[ . 1]" 1
391 1 79 VAL MG2 1 80 ILE H 4.000 . 4.500 4.178 4.056 4.303 . 0 0 "[ . 1]" 1
392 1 80 ILE H 1 95 LEU MD1 2.700 . 3.200 2.774 2.063 3.295 0.095 9 0 "[ . 1]" 1
393 1 80 ILE H 1 95 LEU MD2 4.000 . 4.500 4.285 3.413 4.600 0.100 3 0 "[ . 1]" 1
394 1 79 VAL MG1 1 81 THR H 3.300 . 3.800 3.873 3.816 3.996 0.196 1 0 "[ . 1]" 1
395 1 80 ILE MD 1 81 THR H 4.000 . 4.500 4.194 3.401 4.610 0.110 8 0 "[ . 1]" 1
396 1 81 THR H 1 95 LEU MD1 3.300 . 3.800 3.440 2.895 3.643 . 0 0 "[ . 1]" 1
397 1 80 ILE MD 1 82 GLY H 4.000 . 4.500 4.695 4.558 4.894 0.394 7 0 "[ . 1]" 1
398 1 82 GLY H 1 95 LEU MD1 4.000 . 4.500 3.827 3.479 4.045 . 0 0 "[ . 1]" 1
399 1 68 VAL MG1 1 94 TYR H 4.000 . 4.500 2.756 1.986 3.710 . 0 0 "[ . 1]" 1
400 1 68 VAL MG2 1 94 TYR H 3.300 . 3.800 3.946 3.805 4.129 0.329 9 0 "[ . 1]" 1
401 1 79 VAL MG2 1 98 ASP H 4.000 . 4.500 4.366 4.093 4.514 0.014 4 0 "[ . 1]" 1
402 1 106 THR H 1 107 LEU MD1 3.300 . 3.800 3.362 2.722 3.819 0.019 4 0 "[ . 1]" 1
403 1 68 VAL MG2 1 106 THR H 4.000 . 4.500 4.409 4.084 4.574 0.074 6 0 "[ . 1]" 1
404 1 95 LEU MD2 1 106 THR H 4.000 . 4.500 4.341 3.607 4.584 0.084 4 0 "[ . 1]" 1
405 1 68 VAL MG2 1 108 LEU H 3.300 . 3.800 3.863 3.812 3.919 0.119 6 0 "[ . 1]" 1
406 1 119 LEU MD1 1 120 ASN H 4.000 . 4.500 4.341 4.108 4.711 0.211 1 0 "[ . 1]" 1
407 1 119 LEU MD2 1 120 ASN H 4.000 . 4.500 4.359 4.001 4.537 0.037 10 0 "[ . 1]" 1
408 1 125 LEU MD2 1 126 MET H 4.000 . 4.500 4.332 3.700 4.589 0.089 7 0 "[ . 1]" 1
409 1 133 LEU MD1 1 134 ASP H 4.000 . 4.500 4.457 4.209 4.549 0.049 3 0 "[ . 1]" 1
410 1 133 LEU MD2 1 134 ASP H 4.000 . 4.500 3.457 2.513 4.559 0.059 9 0 "[ . 1]" 1
411 1 102 VAL MG1 1 142 GLU H 4.000 . 4.500 4.530 4.482 4.577 0.077 8 0 "[ . 1]" 1
412 1 102 VAL MG2 1 142 GLU H 3.300 . 3.800 3.764 3.572 3.832 0.032 4 0 "[ . 1]" 1
413 1 108 LEU MD1 1 148 SER H 6.000 . 6.500 4.377 2.221 6.094 . 0 0 "[ . 1]" 1
414 1 149 LEU MD1 1 151 VAL H 4.000 . 4.500 3.637 2.524 4.508 0.008 7 0 "[ . 1]" 1
415 1 151 VAL MG1 1 152 ALA H 2.700 . 3.200 2.653 2.438 2.888 . 0 0 "[ . 1]" 1
416 1 151 VAL MG2 1 152 ALA H 4.000 . 4.500 4.000 3.910 4.121 . 0 0 "[ . 1]" 1
417 1 151 VAL MG1 1 153 GLN H 3.300 . 3.800 3.791 3.318 3.889 0.089 2 0 "[ . 1]" 1
418 1 159 LYS H 1 215 LEU MD2 4.000 . 4.500 4.501 3.878 4.633 0.133 2 0 "[ . 1]" 1
419 1 160 ASN H 1 215 LEU MD2 4.000 . 4.500 3.623 2.990 4.508 0.008 7 0 "[ . 1]" 1
420 1 166 GLN H 1 171 LEU MD2 3.300 . 3.800 3.938 3.795 4.052 0.252 10 0 "[ . 1]" 1
421 1 167 SER H 1 171 LEU MD2 2.700 . 3.200 2.996 2.155 3.346 0.146 9 0 "[ . 1]" 1
422 1 167 SER H 1 171 LEU MD1 4.000 . 4.500 4.328 3.321 4.609 0.109 6 0 "[ . 1]" 1
423 1 171 LEU MD2 1 172 ALA H 3.300 . 3.800 3.934 3.681 4.211 0.411 7 0 "[ . 1]" 1
424 1 171 LEU MD1 1 174 GLU H 5.000 . 5.500 4.239 3.676 5.590 0.090 7 0 "[ . 1]" 1
425 1 151 VAL MG1 1 178 MET H 3.300 . 3.800 3.771 3.225 3.953 0.153 9 0 "[ . 1]" 1
426 1 151 VAL MG2 1 178 MET H 5.000 . 5.500 4.373 3.631 5.261 . 0 0 "[ . 1]" 1
427 1 181 ILE H 1 182 VAL MG1 4.000 . 4.500 4.342 3.418 4.941 0.441 2 0 "[ . 1]" 1
428 1 181 ILE H 1 182 VAL MG2 3.300 . 3.800 3.816 3.551 3.980 0.180 6 0 "[ . 1]" 1
429 1 182 VAL MG1 1 183 GLY H 4.000 . 4.500 3.007 2.103 4.037 . 0 0 "[ . 1]" 1
430 1 182 VAL MG2 1 183 GLY H 2.700 . 3.200 2.607 1.939 3.507 0.307 5 0 "[ . 1]" 1
431 1 182 VAL MG1 1 184 ASN H 3.300 . 3.800 4.104 3.965 4.288 0.488 3 0 "[ . 1]" 1
432 1 188 VAL H 1 223 LEU MD2 5.000 . 5.500 2.921 1.756 4.122 0.044 7 0 "[ . 1]" 1
433 1 188 VAL H 1 224 LEU MD2 5.000 . 5.500 5.013 4.404 5.424 . 0 0 "[ . 1]" 1
434 1 188 VAL MG1 1 189 ASP H 2.700 . 3.200 2.541 1.866 3.232 0.032 8 0 "[ . 1]" 1
435 1 188 VAL MG2 1 189 ASP H 2.700 . 3.200 2.891 1.907 3.309 0.109 4 0 "[ . 1]" 1
436 1 189 ASP H 1 223 LEU MD2 4.000 . 4.500 4.462 4.054 4.650 0.150 7 0 "[ . 1]" 1
437 1 189 ASP H 1 224 LEU MD2 5.000 . 5.500 5.443 5.202 5.560 0.060 9 0 "[ . 1]" 1
438 1 190 ALA H 1 223 LEU MD2 3.300 . 3.800 3.833 3.808 3.897 0.097 2 0 "[ . 1]" 1
439 1 190 ALA H 1 224 LEU MD2 3.300 . 3.800 3.361 2.499 3.842 0.042 10 0 "[ . 1]" 1
440 1 191 LEU MD1 1 192 ARG H 3.300 . 3.800 3.585 2.426 3.918 0.118 6 0 "[ . 1]" 1
441 1 191 LEU MD2 1 192 ARG H 3.300 . 3.800 3.715 2.986 4.011 0.211 6 0 "[ . 1]" 1
442 1 193 GLU H 1 194 VAL MG1 2.700 . 3.200 3.268 3.217 3.310 0.110 10 0 "[ . 1]" 1
443 1 193 GLU H 1 194 VAL MG2 5.000 . 5.500 5.478 5.325 5.539 0.039 8 0 "[ . 1]" 1
444 1 194 VAL MG1 1 195 SER H 2.700 . 3.200 2.057 1.915 2.221 . 0 0 "[ . 1]" 1
445 1 194 VAL MG2 1 195 SER H 2.700 . 3.200 3.242 3.212 3.299 0.099 7 0 "[ . 1]" 1
446 1 156 LEU MD1 1 198 GLY H 2.700 . 3.200 3.142 2.690 3.249 0.049 10 0 "[ . 1]" 1
447 1 156 LEU MD2 1 198 GLY H 2.700 . 3.200 3.087 2.635 3.244 0.044 3 0 "[ . 1]" 1
448 1 149 LEU MD1 1 221 TYR H 3.300 . 3.800 3.730 3.170 4.009 0.209 4 0 "[ . 1]" 1
449 1 223 LEU H 1 224 LEU MD2 3.300 . 3.800 3.813 3.720 3.871 0.071 3 0 "[ . 1]" 1
450 1 188 VAL MG2 1 224 LEU H 5.000 . 5.500 4.185 2.856 5.510 0.010 6 0 "[ . 1]" 1
451 1 223 LEU MD1 1 224 LEU H 5.000 . 5.500 5.023 4.917 5.160 . 0 0 "[ . 1]" 1
452 1 223 LEU MD2 1 224 LEU H 3.300 . 3.800 3.519 3.398 3.678 . 0 0 "[ . 1]" 1
453 1 144 ILE MD 1 225 THR H 4.000 . 4.500 4.591 4.542 4.671 0.171 3 0 "[ . 1]" 1
454 1 224 LEU MD2 1 225 THR H 5.000 . 5.500 4.599 4.536 4.643 . 0 0 "[ . 1]" 1
455 1 225 THR H 1 228 LEU MD1 2.700 . 3.200 2.708 1.845 3.254 0.054 3 0 "[ . 1]" 1
456 1 225 THR H 1 228 LEU MD2 3.300 . 3.800 3.030 1.785 3.552 0.015 8 0 "[ . 1]" 1
457 1 227 GLY H 1 228 LEU MD1 5.000 . 5.500 4.691 3.784 5.082 . 0 0 "[ . 1]" 1
458 1 227 GLY H 1 228 LEU MD2 4.000 . 4.500 3.263 2.484 4.565 0.065 9 0 "[ . 1]" 1
459 1 231 PHE H 1 232 VAL MG2 2.700 . 3.200 2.901 2.523 3.211 0.011 6 0 "[ . 1]" 1
460 1 232 VAL MG1 1 233 ARG H 5.000 . 5.500 3.609 2.814 4.306 . 0 0 "[ . 1]" 1
461 1 232 VAL MG2 1 233 ARG H 5.000 . 5.500 4.274 4.117 4.413 . 0 0 "[ . 1]" 1
462 1 194 VAL MG2 1 234 SER H 3.300 . 3.800 3.874 3.848 3.906 0.106 3 0 "[ . 1]" 1
463 1 232 VAL MG1 1 234 SER H 4.000 . 4.500 3.582 2.368 4.573 0.073 4 0 "[ . 1]" 1
464 1 194 VAL MG2 1 235 ALA H 4.000 . 4.500 2.902 2.671 3.134 . 0 0 "[ . 1]" 1
465 1 194 VAL MG1 1 235 ALA H 3.300 . 3.800 3.859 3.827 3.896 0.096 9 0 "[ . 1]" 1
466 1 236 ARG H 1 237 LEU MD1 4.000 . 4.500 3.801 3.045 4.516 0.016 7 0 "[ . 1]" 1
467 1 236 ARG H 1 250 ILE MD 3.300 . 3.800 3.611 2.473 3.931 0.131 9 0 "[ . 1]" 1
468 1 236 ARG H 1 251 VAL MG1 4.000 . 4.500 4.568 4.520 4.638 0.138 9 0 "[ . 1]" 1
469 1 257 LEU MD1 1 258 THR H 3.300 . 3.800 3.398 1.886 3.833 0.033 6 0 "[ . 1]" 1
470 1 257 LEU MD2 1 258 THR H 3.300 . 3.800 3.605 2.960 3.878 0.078 9 0 "[ . 1]" 1
471 1 74 LEU MD1 1 258 THR H 6.000 . 6.500 4.854 3.822 6.512 0.012 6 0 "[ . 1]" 1
472 1 75 GLN H 1 259 ILE MD 2.700 . 3.200 3.234 3.209 3.269 0.069 8 0 "[ . 1]" 1
473 1 77 LYS H 1 259 ILE MD 2.700 . 3.200 2.882 2.687 3.112 . 0 0 "[ . 1]" 1
474 1 78 ALA H 1 259 ILE MD 4.000 . 4.500 4.553 4.527 4.591 0.091 8 0 "[ . 1]" 1
475 1 210 ALA H 1 215 LEU MD1 5.000 . 5.500 5.529 5.378 5.592 0.092 2 0 "[ . 1]" 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 117
_Distance_constraint_stats_list.Viol_count 152
_Distance_constraint_stats_list.Viol_total 52.774
_Distance_constraint_stats_list.Viol_max 0.284
_Distance_constraint_stats_list.Viol_rms 0.0219
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0045
_Distance_constraint_stats_list.Viol_average_violations_only 0.0347
_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 3 ILE 0.375 0.054 2 0 "[ . 1]"
1 4 ILE 0.016 0.016 5 0 "[ . 1]"
1 6 VAL 0.093 0.047 1 0 "[ . 1]"
1 8 VAL 0.136 0.047 1 0 "[ . 1]"
1 11 ILE 0.303 0.045 3 0 "[ . 1]"
1 15 VAL 0.099 0.040 10 0 "[ . 1]"
1 19 LEU 0.112 0.029 8 0 "[ . 1]"
1 20 LEU 0.320 0.056 3 0 "[ . 1]"
1 23 LEU 0.032 0.029 7 0 "[ . 1]"
1 31 ILE 0.568 0.239 4 0 "[ . 1]"
1 43 LEU 0.567 0.138 2 0 "[ . 1]"
1 50 LEU 0.782 0.239 4 0 "[ . 1]"
1 55 LEU 0.367 0.138 2 0 "[ . 1]"
1 62 VAL 0.000 0.000 . 0 "[ . 1]"
1 68 VAL 0.023 0.023 7 0 "[ . 1]"
1 70 LEU 0.000 0.000 . 0 "[ . 1]"
1 74 LEU 0.064 0.024 1 0 "[ . 1]"
1 79 VAL 0.000 0.000 . 0 "[ . 1]"
1 80 ILE 1.276 0.273 7 0 "[ . 1]"
1 83 LEU 0.027 0.016 6 0 "[ . 1]"
1 95 LEU 1.276 0.273 7 0 "[ . 1]"
1 102 VAL 0.074 0.020 8 0 "[ . 1]"
1 104 ILE 0.066 0.024 8 0 "[ . 1]"
1 107 LEU 0.060 0.016 6 0 "[ . 1]"
1 108 LEU 0.023 0.023 7 0 "[ . 1]"
1 119 LEU 0.249 0.057 3 0 "[ . 1]"
1 125 LEU 0.033 0.014 5 0 "[ . 1]"
1 133 LEU 0.053 0.027 3 0 "[ . 1]"
1 144 ILE 0.535 0.131 3 0 "[ . 1]"
1 149 LEU 0.193 0.049 9 0 "[ . 1]"
1 151 VAL 0.000 0.000 . 0 "[ . 1]"
1 156 LEU 0.000 0.000 . 0 "[ . 1]"
1 171 LEU 0.249 0.057 3 0 "[ . 1]"
1 181 ILE 0.095 0.027 3 0 "[ . 1]"
1 182 VAL 0.055 0.038 9 0 "[ . 1]"
1 188 VAL 0.000 0.000 . 0 "[ . 1]"
1 191 LEU 0.000 0.000 . 0 "[ . 1]"
1 194 VAL 0.000 0.000 . 0 "[ . 1]"
1 213 LEU 0.013 0.013 6 0 "[ . 1]"
1 215 LEU 0.013 0.013 6 0 "[ . 1]"
1 223 LEU 0.205 0.049 9 0 "[ . 1]"
1 224 LEU 0.949 0.284 1 0 "[ . 1]"
1 228 LEU 0.691 0.284 1 0 "[ . 1]"
1 232 VAL 0.278 0.069 10 0 "[ . 1]"
1 237 LEU 0.000 0.000 . 0 "[ . 1]"
1 249 LEU 0.000 0.000 . 0 "[ . 1]"
1 250 ILE 0.016 0.016 5 0 "[ . 1]"
1 251 VAL 0.160 0.069 10 0 "[ . 1]"
1 257 LEU 0.108 0.024 1 0 "[ . 1]"
1 259 ILE 0.000 0.000 . 0 "[ . 1]"
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 3 ILE MD 1 104 ILE MD 2.700 . 3.200 2.891 2.478 3.224 0.024 8 0 "[ . 1]" 2
2 1 3 ILE MD 1 144 ILE MD 2.700 . 3.200 3.231 3.170 3.254 0.054 2 0 "[ . 1]" 2
3 1 4 ILE MD 1 23 LEU MD2 5.000 . 5.500 3.803 2.019 5.330 . 0 0 "[ . 1]" 2
4 1 4 ILE MD 1 250 ILE MD 5.000 . 5.500 4.169 3.104 5.516 0.016 5 0 "[ . 1]" 2
5 1 6 VAL MG1 1 6 VAL MG2 2.500 . 3.000 1.990 1.881 2.077 . 0 0 "[ . 1]" 2
6 1 6 VAL MG1 1 8 VAL MG1 5.000 . 5.500 3.166 2.551 4.048 . 0 0 "[ . 1]" 2
7 1 6 VAL MG2 1 8 VAL MG1 5.000 . 5.500 3.127 2.218 4.505 . 0 0 "[ . 1]" 2
8 1 6 VAL MG1 1 8 VAL MG2 5.000 . 5.500 5.019 4.178 5.547 0.047 1 0 "[ . 1]" 2
9 1 6 VAL MG2 1 8 VAL MG2 5.000 . 5.500 4.786 3.724 5.525 0.025 1 0 "[ . 1]" 2
10 1 8 VAL MG1 1 8 VAL MG2 2.500 . 3.000 2.033 1.868 2.072 . 0 0 "[ . 1]" 2
11 1 8 VAL MG1 1 11 ILE MD 5.000 . 5.500 4.128 2.986 5.536 0.036 1 0 "[ . 1]" 2
12 1 8 VAL MG2 1 11 ILE MD 5.000 . 5.500 3.822 2.962 4.716 . 0 0 "[ . 1]" 2
13 1 8 VAL MG1 1 19 LEU MD2 5.000 . 5.500 4.467 3.280 5.358 . 0 0 "[ . 1]" 2
14 1 8 VAL MG2 1 19 LEU MD2 6.000 . 6.500 5.152 3.918 6.507 0.007 2 0 "[ . 1]" 2
15 1 11 ILE MD 1 15 VAL MG1 3.300 . 3.800 2.152 1.980 2.523 . 0 0 "[ . 1]" 2
16 1 11 ILE MD 1 19 LEU MD1 4.000 . 4.500 4.386 3.943 4.529 0.029 8 0 "[ . 1]" 2
17 1 11 ILE MD 1 43 LEU MD1 3.300 . 3.800 3.689 3.319 3.845 0.045 3 0 "[ . 1]" 2
18 1 11 ILE MD 1 43 LEU MD2 3.300 . 3.800 3.348 2.681 3.824 0.024 8 0 "[ . 1]" 2
19 1 15 VAL MG1 1 15 VAL MG2 2.500 . 3.000 2.055 1.983 2.078 . 0 0 "[ . 1]" 2
20 1 15 VAL MG1 1 20 LEU MD1 2.700 . 3.200 2.616 2.099 3.240 0.040 10 0 "[ . 1]" 2
21 1 15 VAL MG1 1 20 LEU MD2 3.300 . 3.800 2.893 2.678 3.517 . 0 0 "[ . 1]" 2
22 1 15 VAL MG2 1 20 LEU MD1 3.300 . 3.800 3.151 2.315 3.687 . 0 0 "[ . 1]" 2
23 1 15 VAL MG2 1 20 LEU MD2 3.300 . 3.800 3.018 2.034 3.822 0.022 8 0 "[ . 1]" 2
24 1 19 LEU MD1 1 19 LEU MD2 2.500 . 3.000 2.032 1.887 2.075 . 0 0 "[ . 1]" 2
25 1 19 LEU MD2 1 20 LEU MD2 5.000 . 5.500 4.794 3.363 5.507 0.007 1 0 "[ . 1]" 2
26 1 19 LEU MD1 1 23 LEU MD2 5.000 . 5.500 3.808 1.942 5.529 0.029 7 0 "[ . 1]" 2
27 1 20 LEU MD1 1 20 LEU MD2 2.500 . 3.000 1.881 1.830 2.006 . 0 0 "[ . 1]" 2
28 1 20 LEU MD1 1 50 LEU MD1 5.000 . 5.500 4.139 3.122 5.521 0.021 8 0 "[ . 1]" 2
29 1 20 LEU MD1 1 50 LEU MD2 . . 4.500 3.830 3.202 4.334 . 0 0 "[ . 1]" 2
30 1 20 LEU MD2 1 50 LEU MD1 . . 3.800 3.645 3.085 3.856 0.056 3 0 "[ . 1]" 2
31 1 20 LEU MD2 1 50 LEU MD2 3.300 . 3.800 2.674 2.177 3.018 . 0 0 "[ . 1]" 2
32 1 23 LEU MD1 1 23 LEU MD2 2.500 . 3.000 1.971 1.859 2.082 . 0 0 "[ . 1]" 2
33 1 23 LEU MD1 1 31 ILE MD 4.000 . 4.500 2.380 1.826 3.554 . 0 0 "[ . 1]" 2
34 1 23 LEU MD2 1 31 ILE MD 4.000 . 4.500 2.599 1.851 3.986 . 0 0 "[ . 1]" 2
35 1 23 LEU MD1 1 50 LEU MD1 4.000 . 4.500 2.828 2.133 3.890 . 0 0 "[ . 1]" 2
36 1 31 ILE MD 1 50 LEU MD1 3.300 . 3.800 3.681 2.799 4.039 0.239 4 0 "[ . 1]" 2
37 1 43 LEU MD1 1 43 LEU MD2 2.500 . 3.000 2.012 1.812 2.084 . 0 0 "[ . 1]" 2
38 1 43 LEU MD1 1 55 LEU MD1 3.300 . 3.800 3.275 2.708 3.815 0.015 8 0 "[ . 1]" 2
39 1 43 LEU MD1 1 55 LEU MD2 2.700 . 3.200 2.897 2.047 3.239 0.039 8 0 "[ . 1]" 2
40 1 43 LEU MD2 1 55 LEU MD1 5.000 . 5.500 3.603 2.093 4.914 . 0 0 "[ . 1]" 2
41 1 43 LEU MD2 1 55 LEU MD2 2.700 . 3.200 2.878 2.076 3.338 0.138 2 0 "[ . 1]" 2
42 1 50 LEU MD1 1 50 LEU MD2 2.500 . 3.000 1.963 1.849 2.084 . 0 0 "[ . 1]" 2
43 1 55 LEU MD1 1 55 LEU MD2 2.500 . 3.000 1.994 1.926 2.047 . 0 0 "[ . 1]" 2
44 1 62 VAL MG1 1 62 VAL MG2 2.500 . 3.000 2.022 1.966 2.074 . 0 0 "[ . 1]" 2
45 1 68 VAL MG1 1 68 VAL MG2 2.500 . 3.000 1.996 1.888 2.051 . 0 0 "[ . 1]" 2
46 1 68 VAL MG2 1 95 LEU MD2 6.000 . 6.500 2.773 2.196 3.405 . 0 0 "[ . 1]" 2
47 1 68 VAL MG2 1 108 LEU MD2 3.300 . 3.800 2.773 2.059 3.823 0.023 7 0 "[ . 1]" 2
48 1 68 VAL MG1 1 108 LEU MD2 4.000 . 4.500 3.806 3.408 4.223 . 0 0 "[ . 1]" 2
49 1 70 LEU MD1 1 70 LEU MD2 2.500 . 3.000 2.003 1.854 2.078 . 0 0 "[ . 1]" 2
50 1 70 LEU MD1 1 95 LEU MD2 5.000 . 5.500 2.486 1.895 3.069 . 0 0 "[ . 1]" 2
51 1 70 LEU MD2 1 95 LEU MD2 5.000 . 5.500 2.703 2.029 4.012 . 0 0 "[ . 1]" 2
52 1 74 LEU MD1 1 74 LEU MD2 2.500 . 3.000 1.973 1.921 2.061 . 0 0 "[ . 1]" 2
53 1 74 LEU MD1 1 257 LEU MD2 5.000 . 5.500 5.073 3.420 5.524 0.024 1 0 "[ . 1]" 2
54 1 74 LEU MD1 1 259 ILE MD 5.000 . 5.500 3.287 2.155 4.415 . 0 0 "[ . 1]" 2
55 1 74 LEU MD2 1 259 ILE MD 5.000 . 5.500 3.307 2.006 4.641 . 0 0 "[ . 1]" 2
56 1 79 VAL MG1 1 79 VAL MG2 2.500 . 3.000 2.031 1.994 2.089 . 0 0 "[ . 1]" 2
57 1 79 VAL MG1 1 95 LEU MD2 5.000 . 5.500 2.960 2.405 3.491 . 0 0 "[ . 1]" 2
58 1 79 VAL MG2 1 95 LEU MD2 5.000 . 5.500 3.846 3.378 4.172 . 0 0 "[ . 1]" 2
59 1 80 ILE MD 1 95 LEU MD1 3.300 . 3.800 3.928 3.822 4.073 0.273 7 0 "[ . 1]" 2
60 1 83 LEU MD1 1 83 LEU MD2 2.500 . 3.000 2.004 1.859 2.080 . 0 0 "[ . 1]" 2
61 1 83 LEU MD1 1 107 LEU MD1 5.000 . 5.500 5.177 4.616 5.516 0.016 6 0 "[ . 1]" 2
62 1 83 LEU MD1 1 125 LEU MD1 5.000 . 5.500 4.356 2.129 5.456 . 0 0 "[ . 1]" 2
63 1 95 LEU MD1 1 95 LEU MD2 2.500 . 3.000 2.007 1.890 2.039 . 0 0 "[ . 1]" 2
64 1 102 VAL MG1 1 102 VAL MG2 2.500 . 3.000 2.040 2.003 2.069 . 0 0 "[ . 1]" 2
65 1 102 VAL MG1 1 104 ILE MD 5.000 . 5.500 4.146 2.807 5.504 0.004 2 0 "[ . 1]" 2
66 1 102 VAL MG1 1 144 ILE MD 5.000 . 5.500 3.696 2.434 5.504 0.004 8 0 "[ . 1]" 2
67 1 102 VAL MG1 1 257 LEU MD2 3.300 . 3.800 3.731 3.132 3.820 0.020 8 0 "[ . 1]" 2
68 1 102 VAL MG2 1 144 ILE MD 5.000 . 5.500 4.585 3.028 5.274 . 0 0 "[ . 1]" 2
69 1 102 VAL MG2 1 228 LEU MD1 5.000 . 5.500 4.510 3.017 5.516 0.016 1 0 "[ . 1]" 2
70 1 104 ILE MD 1 144 ILE MD 2.700 . 3.200 2.990 2.526 3.211 0.011 4 0 "[ . 1]" 2
71 1 107 LEU MD1 1 107 LEU MD2 2.500 . 3.000 1.951 1.844 2.069 . 0 0 "[ . 1]" 2
72 1 107 LEU MD1 1 125 LEU MD2 6.000 . 6.500 5.394 3.488 6.514 0.014 5 0 "[ . 1]" 2
73 1 107 LEU MD2 1 149 LEU MD1 6.000 . 6.500 4.677 3.989 5.306 . 0 0 "[ . 1]" 2
74 1 108 LEU MD1 1 108 LEU MD2 2.500 . 3.000 2.020 1.869 2.081 . 0 0 "[ . 1]" 2
75 1 119 LEU MD1 1 119 LEU MD2 2.500 . 3.000 1.938 1.856 2.068 . 0 0 "[ . 1]" 2
76 1 119 LEU MD1 1 171 LEU MD1 3.300 . 3.800 3.410 2.047 3.821 0.021 10 0 "[ . 1]" 2
77 1 119 LEU MD2 1 171 LEU MD1 3.300 . 3.800 2.920 1.922 3.786 . 0 0 "[ . 1]" 2
78 1 83 LEU MD1 1 125 LEU MD2 5.000 . 5.500 3.839 2.269 5.073 . 0 0 "[ . 1]" 2
79 1 133 LEU MD1 1 133 LEU MD2 2.500 . 3.000 1.987 1.902 2.063 . 0 0 "[ . 1]" 2
80 1 133 LEU MD1 1 181 ILE MD 3.300 . 3.800 3.730 3.302 3.827 0.027 3 0 "[ . 1]" 2
81 1 133 LEU MD2 1 181 ILE MD 5.000 . 5.500 4.662 3.033 5.410 . 0 0 "[ . 1]" 2
82 1 144 ILE MD 1 224 LEU MD2 3.300 . 3.800 3.291 2.311 3.931 0.131 3 0 "[ . 1]" 2
83 1 144 ILE MD 1 228 LEU MD1 4.000 . 4.500 2.157 1.894 2.618 . 0 0 "[ . 1]" 2
84 1 149 LEU MD1 1 149 LEU MD2 2.500 . 3.000 2.021 1.870 2.078 . 0 0 "[ . 1]" 2
85 1 149 LEU MD1 1 181 ILE MD 5.000 . 5.500 5.194 4.684 5.525 0.025 3 0 "[ . 1]" 2
86 1 149 LEU MD1 1 223 LEU MD1 3.300 . 3.800 3.660 2.689 3.849 0.049 9 0 "[ . 1]" 2
87 1 151 VAL MG1 1 151 VAL MG2 2.500 . 3.000 2.063 2.030 2.085 . 0 0 "[ . 1]" 2
88 1 156 LEU MD1 1 156 LEU MD2 2.500 . 3.000 1.967 1.853 2.071 . 0 0 "[ . 1]" 2
89 1 171 LEU MD1 1 171 LEU MD2 2.500 . 3.000 1.950 1.869 2.025 . 0 0 "[ . 1]" 2
90 1 119 LEU MD2 1 171 LEU MD2 3.300 . 3.800 3.674 2.926 3.857 0.057 3 0 "[ . 1]" 2
91 1 181 ILE MD 1 223 LEU MD1 5.000 . 5.500 3.274 2.645 4.252 . 0 0 "[ . 1]" 2
92 1 182 VAL MG1 1 182 VAL MG2 2.500 . 3.000 2.037 1.967 2.059 . 0 0 "[ . 1]" 2
93 1 182 VAL MG2 1 223 LEU MD2 5.000 . 5.500 5.009 3.511 5.538 0.038 9 0 "[ . 1]" 2
94 1 188 VAL MG1 1 188 VAL MG2 2.500 . 3.000 2.060 2.049 2.074 . 0 0 "[ . 1]" 2
95 1 188 VAL MG1 1 224 LEU MD2 3.300 . 3.800 2.366 1.981 2.989 . 0 0 "[ . 1]" 2
96 1 188 VAL MG2 1 224 LEU MD2 . . 5.500 4.075 3.543 5.097 . 0 0 "[ . 1]" 2
97 1 188 VAL MG1 1 232 VAL MG2 3.300 . 3.800 3.454 3.028 3.746 . 0 0 "[ . 1]" 2
98 1 191 LEU MD1 1 191 LEU MD2 2.500 . 3.000 2.011 1.887 2.074 . 0 0 "[ . 1]" 2
99 1 191 LEU MD1 1 249 LEU MD1 5.000 . 5.500 4.004 2.095 5.143 . 0 0 "[ . 1]" 2
100 1 191 LEU MD1 1 249 LEU MD2 5.000 . 5.500 3.616 2.112 5.159 . 0 0 "[ . 1]" 2
101 1 194 VAL MG1 1 194 VAL MG2 2.500 . 3.000 2.052 2.015 2.080 . 0 0 "[ . 1]" 2
102 1 194 VAL MG1 1 251 VAL MG1 5.000 . 5.500 3.327 2.743 3.858 . 0 0 "[ . 1]" 2
103 1 213 LEU MD1 1 213 LEU MD2 2.500 . 3.000 1.993 1.904 2.079 . 0 0 "[ . 1]" 2
104 1 213 LEU MD2 1 215 LEU MD1 5.000 . 5.500 4.370 2.930 5.513 0.013 6 0 "[ . 1]" 2
105 1 215 LEU MD1 1 215 LEU MD2 2.500 . 3.000 1.980 1.874 2.086 . 0 0 "[ . 1]" 2
106 1 223 LEU MD1 1 223 LEU MD2 2.500 . 3.000 2.013 1.925 2.091 . 0 0 "[ . 1]" 2
107 1 224 LEU MD1 1 224 LEU MD2 2.500 . 3.000 2.028 1.804 2.079 . 0 0 "[ . 1]" 2
108 1 224 LEU MD2 1 228 LEU MD1 2.700 . 3.200 3.267 3.207 3.484 0.284 1 0 "[ . 1]" 2
109 1 224 LEU MD2 1 232 VAL MG1 3.300 . 3.800 3.539 2.679 3.834 0.034 2 0 "[ . 1]" 2
110 1 224 LEU MD2 1 232 VAL MG2 3.300 . 3.800 3.266 2.661 3.807 0.007 6 0 "[ . 1]" 2
111 1 228 LEU MD1 1 228 LEU MD2 2.500 . 3.000 2.021 1.896 2.075 . 0 0 "[ . 1]" 2
112 1 232 VAL MG1 1 232 VAL MG2 2.500 . 3.000 1.995 1.842 2.046 . 0 0 "[ . 1]" 2
113 1 232 VAL MG1 1 251 VAL MG1 2.700 . 3.200 2.258 1.917 3.058 . 0 0 "[ . 1]" 2
114 1 232 VAL MG2 1 251 VAL MG1 3.300 . 3.800 3.791 3.674 3.869 0.069 10 0 "[ . 1]" 2
115 1 237 LEU MD1 1 249 LEU MD1 5.000 . 5.500 4.143 2.417 5.490 . 0 0 "[ . 1]" 2
116 1 249 LEU MD1 1 249 LEU MD2 2.500 . 3.000 2.003 1.928 2.073 . 0 0 "[ . 1]" 2
117 1 257 LEU MD1 1 257 LEU MD2 2.500 . 3.000 2.004 1.880 2.083 . 0 0 "[ . 1]" 2
stop_
save_
save_distance_constraint_statistics_3
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 3
_Distance_constraint_stats_list.Constraint_count 130
_Distance_constraint_stats_list.Viol_count 162
_Distance_constraint_stats_list.Viol_total 83.042
_Distance_constraint_stats_list.Viol_max 0.231
_Distance_constraint_stats_list.Viol_rms 0.0223
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0064
_Distance_constraint_stats_list.Viol_average_violations_only 0.0513
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details .
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 9 ASN 0.000 0.000 . 0 "[ . 1]"
1 10 GLY 0.000 0.000 . 0 "[ . 1]"
1 11 ILE 0.000 0.000 . 0 "[ . 1]"
1 12 GLN 0.000 0.000 . 0 "[ . 1]"
1 13 THR 0.618 0.076 9 0 "[ . 1]"
1 15 VAL 0.000 0.000 . 0 "[ . 1]"
1 16 GLU 0.000 0.000 . 0 "[ . 1]"
1 18 GLY 0.000 0.000 . 0 "[ . 1]"
1 19 LEU 0.000 0.000 . 0 "[ . 1]"
1 20 LEU 0.000 0.000 . 0 "[ . 1]"
1 21 SER 0.000 0.000 . 0 "[ . 1]"
1 22 TRP 0.473 0.083 1 0 "[ . 1]"
1 25 ALA 3.249 0.231 6 0 "[ . 1]"
1 36 THR 0.000 0.000 . 0 "[ . 1]"
1 37 ARG 0.000 0.000 . 0 "[ . 1]"
1 38 ALA 0.000 0.000 . 0 "[ . 1]"
1 39 SER 0.005 0.005 8 0 "[ . 1]"
1 40 ALA 0.000 0.000 . 0 "[ . 1]"
1 44 ASP 0.000 0.000 . 0 "[ . 1]"
1 45 ASP 0.000 0.000 . 0 "[ . 1]"
1 47 ALA 0.067 0.051 5 0 "[ . 1]"
1 51 ASP 0.000 0.000 . 0 "[ . 1]"
1 52 GLY 1.161 0.178 10 0 "[ . 1]"
1 53 TYR 0.000 0.000 . 0 "[ . 1]"
1 54 PHE 0.000 0.000 . 0 "[ . 1]"
1 55 LEU 0.352 0.078 5 0 "[ . 1]"
1 56 TYR 0.000 0.000 . 0 "[ . 1]"
1 57 ALA 0.012 0.012 9 0 "[ . 1]"
1 58 CYS 0.287 0.077 7 0 "[ . 1]"
1 60 ALA 0.000 0.000 . 0 "[ . 1]"
1 61 GLU 0.000 0.000 . 0 "[ . 1]"
1 64 ALA 0.257 0.076 9 0 "[ . 1]"
1 65 GLN 0.169 0.057 2 0 "[ . 1]"
1 66 GLY 0.000 0.000 . 0 "[ . 1]"
1 70 LEU 0.000 0.000 . 0 "[ . 1]"
1 71 TYR 0.000 0.000 . 0 "[ . 1]"
1 72 SER 0.000 0.000 . 0 "[ . 1]"
1 75 GLN 0.239 0.077 7 0 "[ . 1]"
1 77 LYS 0.048 0.048 7 0 "[ . 1]"
1 78 ALA 1.759 0.130 6 0 "[ . 1]"
1 79 VAL 0.000 0.000 . 0 "[ . 1]"
1 80 ILE 0.000 0.000 . 0 "[ . 1]"
1 85 PHE 0.120 0.075 6 0 "[ . 1]"
1 87 THR 0.000 0.000 . 0 "[ . 1]"
1 93 ARG 0.000 0.000 . 0 "[ . 1]"
1 95 LEU 0.000 0.000 . 0 "[ . 1]"
1 96 GLN 0.000 0.000 . 0 "[ . 1]"
1 97 ALA 0.000 0.000 . 0 "[ . 1]"
1 98 ASP 0.000 0.000 . 0 "[ . 1]"
1 103 SER 0.000 0.000 . 0 "[ . 1]"
1 104 ILE 0.000 0.000 . 0 "[ . 1]"
1 106 THR 0.000 0.000 . 0 "[ . 1]"
1 107 LEU 0.000 0.000 . 0 "[ . 1]"
1 112 GLY 0.000 0.000 . 0 "[ . 1]"
1 113 GLN 0.000 0.000 . 0 "[ . 1]"
1 114 ASN 0.027 0.027 4 0 "[ . 1]"
1 136 GLN 0.000 0.000 . 0 "[ . 1]"
1 139 LYS 0.201 0.039 7 0 "[ . 1]"
1 141 ARG 0.073 0.026 5 0 "[ . 1]"
1 142 GLU 0.000 0.000 . 0 "[ . 1]"
1 156 LEU 0.898 0.084 10 0 "[ . 1]"
1 159 LYS 0.000 0.000 . 0 "[ . 1]"
1 160 ASN 0.000 0.000 . 0 "[ . 1]"
1 162 ARG 0.028 0.028 5 0 "[ . 1]"
1 166 GLN 0.668 0.180 10 0 "[ . 1]"
1 177 TRP 0.047 0.033 2 0 "[ . 1]"
1 178 MET 0.000 0.000 . 0 "[ . 1]"
1 181 ILE 0.000 0.000 . 0 "[ . 1]"
1 182 VAL 0.170 0.084 10 0 "[ . 1]"
1 183 GLY 0.356 0.073 9 0 "[ . 1]"
1 184 ASN 0.000 0.000 . 0 "[ . 1]"
1 185 MET 0.000 0.000 . 0 "[ . 1]"
1 186 GLY 0.092 0.045 1 0 "[ . 1]"
1 188 VAL 0.000 0.000 . 0 "[ . 1]"
1 189 ASP 0.000 0.000 . 0 "[ . 1]"
1 190 ALA 0.000 0.000 . 0 "[ . 1]"
1 192 ARG 0.000 0.000 . 0 "[ . 1]"
1 193 GLU 0.000 0.000 . 0 "[ . 1]"
1 194 VAL 0.222 0.066 5 0 "[ . 1]"
1 196 ARG 0.107 0.041 10 0 "[ . 1]"
1 198 GLY 0.000 0.000 . 0 "[ . 1]"
1 199 ASP 0.000 0.000 . 0 "[ . 1]"
1 201 TYR 0.000 0.000 . 0 "[ . 1]"
1 202 SER 0.000 0.000 . 0 "[ . 1]"
1 203 TRP 0.000 0.000 . 0 "[ . 1]"
1 204 TRP 0.141 0.054 1 0 "[ . 1]"
1 206 ASP 0.000 0.000 . 0 "[ . 1]"
1 207 ASN 0.081 0.025 10 0 "[ . 1]"
1 208 GLU 0.000 0.000 . 0 "[ . 1]"
1 212 MET 1.494 0.180 10 0 "[ . 1]"
1 213 LEU 0.000 0.000 . 0 "[ . 1]"
1 214 ASN 0.000 0.000 . 0 "[ . 1]"
1 215 LEU 0.000 0.000 . 0 "[ . 1]"
1 220 ASP 0.000 0.000 . 0 "[ . 1]"
1 235 ALA 0.587 0.091 3 0 "[ . 1]"
1 237 LEU 0.000 0.000 . 0 "[ . 1]"
1 239 ARG 0.053 0.026 8 0 "[ . 1]"
1 240 GLN 0.205 0.045 4 0 "[ . 1]"
1 242 ARG 0.081 0.035 10 0 "[ . 1]"
1 243 PHE 0.017 0.013 9 0 "[ . 1]"
1 244 SER 0.038 0.030 8 0 "[ . 1]"
1 246 HIS 0.000 0.000 . 0 "[ . 1]"
1 256 THR 2.207 0.231 6 0 "[ . 1]"
1 259 ILE 0.000 0.000 . 0 "[ . 1]"
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 36 THR H 1 58 CYS CB 12.000 . 14.000 9.479 8.204 10.483 . 0 0 "[ . 1]" 3
2 1 37 ARG H 1 58 CYS CB 12.000 . 14.000 10.370 9.678 11.116 . 0 0 "[ . 1]" 3
3 1 38 ALA H 1 58 CYS CB 12.000 . 14.000 10.445 9.505 11.394 . 0 0 "[ . 1]" 3
4 1 39 SER H 1 58 CYS CB 11.000 . 13.000 10.675 8.314 11.828 . 0 0 "[ . 1]" 3
5 1 40 ALA H 1 58 CYS CB 14.000 . 16.000 8.421 6.951 9.208 . 0 0 "[ . 1]" 3
6 1 44 ASP H 1 58 CYS CB 12.000 . 14.000 11.916 10.369 13.306 . 0 0 "[ . 1]" 3
7 1 45 ASP H 1 58 CYS CB 15.000 . 17.000 14.461 13.035 15.878 . 0 0 "[ . 1]" 3
8 1 54 PHE H 1 58 CYS CB 16.000 . 18.000 15.729 15.366 16.044 . 0 0 "[ . 1]" 3
9 1 55 LEU H 1 58 CYS CB 12.000 . 14.000 12.536 12.198 12.816 . 0 0 "[ . 1]" 3
10 1 56 TYR H 1 58 CYS CB 8.000 . 10.000 9.430 9.202 9.855 . 0 0 "[ . 1]" 3
11 1 57 ALA H 1 58 CYS CB 8.000 . 10.000 5.750 5.520 6.046 . 0 0 "[ . 1]" 3
12 1 58 CYS CB 1 60 ALA H 8.000 . 10.000 6.104 5.596 6.415 . 0 0 "[ . 1]" 3
13 1 58 CYS CB 1 61 GLU H 8.000 . 10.000 8.698 8.078 9.176 . 0 0 "[ . 1]" 3
14 1 58 CYS CB 1 64 ALA H 13.000 . 15.000 12.730 12.080 13.001 . 0 0 "[ . 1]" 3
15 1 58 CYS CB 1 65 GLN H 11.000 . 13.000 11.873 10.615 12.317 . 0 0 "[ . 1]" 3
16 1 58 CYS CB 1 66 GLY H 11.000 . 13.000 10.296 8.581 11.107 . 0 0 "[ . 1]" 3
17 1 58 CYS CB 1 70 LEU H 8.000 . 10.000 7.649 7.324 8.069 . 0 0 "[ . 1]" 3
18 1 58 CYS CB 1 71 TYR H 14.000 . 16.000 11.569 11.186 11.778 . 0 0 "[ . 1]" 3
19 1 58 CYS CB 1 72 SER H 13.000 . 15.000 12.987 12.750 13.391 . 0 0 "[ . 1]" 3
20 1 58 CYS CB 1 75 GLN H 15.000 . 17.000 16.972 16.740 17.077 0.077 7 0 "[ . 1]" 3
21 1 58 CYS CB 1 77 LYS H 13.000 . 15.000 14.213 13.327 15.048 0.048 7 0 "[ . 1]" 3
22 1 58 CYS CB 1 78 ALA H 12.000 . 14.000 13.167 12.355 13.937 . 0 0 "[ . 1]" 3
23 1 58 CYS CB 1 79 VAL H 12.000 . 14.000 10.202 9.221 10.919 . 0 0 "[ . 1]" 3
24 1 58 CYS CB 1 80 ILE H 8.000 . 10.000 7.827 7.395 8.197 . 0 0 "[ . 1]" 3
25 1 58 CYS CB 1 87 THR H 15.000 . 17.000 11.242 9.822 12.708 . 0 0 "[ . 1]" 3
26 1 58 CYS CB 1 93 ARG H 12.000 . 14.000 6.395 4.280 7.838 . 0 0 "[ . 1]" 3
27 1 58 CYS CB 1 95 LEU H 8.000 . 10.000 7.488 5.761 8.745 . 0 0 "[ . 1]" 3
28 1 58 CYS CB 1 96 GLN H 8.000 . 10.000 7.943 6.889 8.720 . 0 0 "[ . 1]" 3
29 1 58 CYS CB 1 97 ALA H 12.000 . 14.000 11.246 10.571 11.913 . 0 0 "[ . 1]" 3
30 1 58 CYS CB 1 98 ASP H 12.000 . 14.000 12.565 12.078 12.825 . 0 0 "[ . 1]" 3
31 1 58 CYS CB 1 104 ILE H 15.000 . 17.000 14.826 14.249 15.545 . 0 0 "[ . 1]" 3
32 1 58 CYS CB 1 106 THR H 12.000 . 14.000 10.164 8.773 11.106 . 0 0 "[ . 1]" 3
33 1 58 CYS CB 1 107 LEU H 14.000 . 16.000 12.288 10.876 13.286 . 0 0 "[ . 1]" 3
34 1 55 LEU H 1 78 ALA CB 13.000 . 15.000 14.930 14.476 15.078 0.078 5 0 "[ . 1]" 3
35 1 56 TYR H 1 78 ALA CB 15.000 . 17.000 12.577 12.063 13.903 . 0 0 "[ . 1]" 3
36 1 57 ALA H 1 78 ALA CB 11.000 4.800 13.000 11.547 11.052 13.012 0.012 9 0 "[ . 1]" 3
37 1 78 ALA CB 1 85 PHE H 14.000 . 16.000 14.829 13.657 16.075 0.075 6 0 "[ . 1]" 3
38 1 78 ALA CB 1 95 LEU H 15.000 . 17.000 11.222 10.905 11.673 . 0 0 "[ . 1]" 3
39 1 78 ALA CB 1 96 GLN H 8.000 . 10.000 7.422 6.896 7.735 . 0 0 "[ . 1]" 3
40 1 78 ALA CB 1 97 ALA H 8.000 . 10.000 6.364 6.188 6.589 . 0 0 "[ . 1]" 3
41 1 78 ALA CB 1 98 ASP H 8.000 . 10.000 2.903 2.627 3.151 . 0 0 "[ . 1]" 3
42 1 78 ALA CB 1 103 SER H 11.000 . 13.000 9.444 9.170 9.977 . 0 0 "[ . 1]" 3
43 1 78 ALA CB 1 104 ILE H 11.000 . 13.000 7.115 6.764 7.900 . 0 0 "[ . 1]" 3
44 1 78 ALA CB 1 136 GLN H 14.000 . 16.000 14.385 13.863 15.657 . 0 0 "[ . 1]" 3
45 1 78 ALA CB 1 139 LYS H 13.000 . 15.000 15.009 14.891 15.039 0.039 7 0 "[ . 1]" 3
46 1 78 ALA CB 1 141 ARG H 12.000 . 14.000 13.519 12.298 14.026 0.026 5 0 "[ . 1]" 3
47 1 78 ALA CB 1 142 GLU H 13.000 . 15.000 12.913 12.067 13.545 . 0 0 "[ . 1]" 3
48 1 78 ALA CB 1 256 THR H 13.000 . 16.000 16.100 16.074 16.130 0.130 6 0 "[ . 1]" 3
49 1 78 ALA CB 1 259 ILE H 15.000 . 18.000 11.928 11.008 12.731 . 0 0 "[ . 1]" 3
50 1 156 LEU CB 1 162 ARG H 12.000 . 14.000 12.754 11.425 13.590 . 0 0 "[ . 1]" 3
51 1 156 LEU CB 1 166 GLN H 13.000 . 15.000 13.785 12.892 15.011 0.011 5 0 "[ . 1]" 3
52 1 156 LEU CB 1 177 TRP H 14.000 . 16.000 15.597 15.051 16.033 0.033 2 0 "[ . 1]" 3
53 1 156 LEU CB 1 178 MET H 13.000 . 15.000 13.216 12.583 13.681 . 0 0 "[ . 1]" 3
54 1 156 LEU CB 1 181 ILE H 14.000 . 16.000 15.022 14.674 15.431 . 0 0 "[ . 1]" 3
55 1 156 LEU CB 1 182 VAL H 12.000 . 14.000 13.842 13.342 14.084 0.084 10 0 "[ . 1]" 3
56 1 156 LEU CB 1 183 GLY H 12.000 . 14.000 13.863 13.013 14.073 0.073 9 0 "[ . 1]" 3
57 1 156 LEU CB 1 184 ASN H 14.000 . 17.000 15.583 13.291 16.456 . 0 0 "[ . 1]" 3
58 1 156 LEU CB 1 185 MET H 15.000 . 17.000 15.141 11.278 16.394 . 0 0 "[ . 1]" 3
59 1 156 LEU CB 1 186 GLY H 15.000 . 17.000 15.846 11.334 17.045 0.045 1 0 "[ . 1]" 3
60 1 156 LEU CB 1 188 VAL H 15.000 . 17.000 13.720 12.244 15.500 . 0 0 "[ . 1]" 3
61 1 156 LEU CB 1 189 ASP H 13.000 . 15.000 10.724 9.808 12.282 . 0 0 "[ . 1]" 3
62 1 156 LEU CB 1 190 ALA H 12.000 . 14.000 11.275 9.617 12.128 . 0 0 "[ . 1]" 3
63 1 156 LEU CB 1 192 ARG H 11.000 . 13.000 6.910 5.584 8.071 . 0 0 "[ . 1]" 3
64 1 156 LEU CB 1 193 GLU H 8.000 . 10.000 8.736 8.147 9.415 . 0 0 "[ . 1]" 3
65 1 156 LEU CB 1 194 VAL H 8.000 . 10.000 9.994 9.780 10.066 0.066 5 0 "[ . 1]" 3
66 1 156 LEU CB 1 196 ARG H 11.000 . 13.000 8.677 6.803 10.146 . 0 0 "[ . 1]" 3
67 1 156 LEU CB 1 198 GLY H 8.000 . 10.000 5.629 5.056 6.144 . 0 0 "[ . 1]" 3
68 1 156 LEU CB 1 199 ASP H 12.000 . 14.000 7.447 6.468 8.228 . 0 0 "[ . 1]" 3
69 1 156 LEU CB 1 213 LEU H 14.000 . 16.000 14.188 13.202 14.890 . 0 0 "[ . 1]" 3
70 1 156 LEU CB 1 214 ASN H 15.000 . 17.000 11.808 10.834 12.850 . 0 0 "[ . 1]" 3
71 1 156 LEU CB 1 215 LEU H 15.000 . 17.000 11.018 10.452 11.678 . 0 0 "[ . 1]" 3
72 1 156 LEU CB 1 220 ASP H 15.000 . 17.000 9.884 7.317 12.666 . 0 0 "[ . 1]" 3
73 1 156 LEU CB 1 237 LEU H 14.000 . 16.000 12.449 10.950 14.009 . 0 0 "[ . 1]" 3
74 1 9 ASN H 1 13 THR CB 11.000 . 13.000 5.768 3.957 8.043 . 0 0 "[ . 1]" 3
75 1 10 GLY H 1 13 THR CB 8.000 . 10.000 5.391 4.712 6.140 . 0 0 "[ . 1]" 3
76 1 11 ILE H 1 13 THR CB 8.000 . 10.000 5.858 5.674 5.950 . 0 0 "[ . 1]" 3
77 1 12 GLN H 1 13 THR CB 8.000 . 10.000 4.961 4.838 5.084 . 0 0 "[ . 1]" 3
78 1 13 THR CB 1 15 VAL H 8.000 . 10.000 5.212 5.169 5.266 . 0 0 "[ . 1]" 3
79 1 13 THR CB 1 16 GLU H 8.000 . 10.000 4.811 4.734 4.887 . 0 0 "[ . 1]" 3
80 1 13 THR CB 1 18 GLY H 8.000 . 10.000 7.750 7.623 7.892 . 0 0 "[ . 1]" 3
81 1 13 THR CB 1 20 LEU H 13.000 . 15.000 9.532 9.194 10.019 . 0 0 "[ . 1]" 3
82 1 13 THR CB 1 21 SER H 15.000 . 17.000 11.828 11.513 12.362 . 0 0 "[ . 1]" 3
83 1 13 THR CB 1 22 TRP H 15.000 . 17.000 12.816 12.618 13.039 . 0 0 "[ . 1]" 3
84 1 13 THR CB 1 36 THR H 14.000 . 16.000 10.885 9.811 12.389 . 0 0 "[ . 1]" 3
85 1 13 THR CB 1 37 ARG H 12.000 . 14.000 10.211 9.590 10.837 . 0 0 "[ . 1]" 3
86 1 13 THR CB 1 38 ALA H 15.000 . 17.000 10.300 9.416 11.353 . 0 0 "[ . 1]" 3
87 1 13 THR CB 1 39 SER H 12.000 . 14.000 13.413 12.284 14.005 0.005 8 0 "[ . 1]" 3
88 1 13 THR CB 1 47 ALA H 15.000 . 17.000 16.452 14.689 17.051 0.051 5 0 "[ . 1]" 3
89 1 13 THR CB 1 64 ALA H 12.000 . 14.000 13.889 12.808 14.076 0.076 9 0 "[ . 1]" 3
90 1 13 THR CB 1 65 GLN H 12.000 . 14.000 13.701 13.053 14.057 0.057 2 0 "[ . 1]" 3
91 1 13 THR CB 1 66 GLY H 13.000 . 15.000 13.746 12.875 14.740 . 0 0 "[ . 1]" 3
92 1 13 THR CB 1 207 ASN H 13.000 . 15.000 14.729 12.854 15.025 0.025 10 0 "[ . 1]" 3
93 1 13 THR CB 1 208 GLU H 14.000 . 16.000 13.035 12.067 14.781 . 0 0 "[ . 1]" 3
94 1 13 THR CB 1 243 PHE H 11.000 . 13.000 12.350 10.734 13.013 0.013 9 0 "[ . 1]" 3
95 1 13 THR CB 1 244 SER H 11.000 . 13.000 11.958 9.837 13.030 0.030 8 0 "[ . 1]" 3
96 1 13 THR CB 1 246 HIS H 14.000 . 16.000 14.165 11.487 15.507 . 0 0 "[ . 1]" 3
97 1 19 LEU H 1 212 MET CB 15.000 . 17.000 13.554 12.962 14.241 . 0 0 "[ . 1]" 3
98 1 22 TRP H 1 212 MET CB 14.000 . 16.000 16.046 15.989 16.083 0.083 1 0 "[ . 1]" 3
99 1 112 GLY H 1 212 MET CB 15.000 . 17.000 12.917 11.059 14.239 . 0 0 "[ . 1]" 3
100 1 113 GLN H 1 212 MET CB 12.000 . 14.000 12.521 10.558 13.572 . 0 0 "[ . 1]" 3
101 1 114 ASN H 1 212 MET CB 14.000 . 16.000 14.847 12.978 16.027 0.027 4 0 "[ . 1]" 3
102 1 159 LYS H 1 212 MET CB 15.000 . 17.000 12.295 9.843 13.695 . 0 0 "[ . 1]" 3
103 1 160 ASN H 1 212 MET CB 14.000 . 16.000 10.855 9.759 12.042 . 0 0 "[ . 1]" 3
104 1 162 ARG H 1 212 MET CB 12.000 . 14.000 13.199 12.303 14.028 0.028 5 0 "[ . 1]" 3
105 1 166 GLN H 1 212 MET CB 12.000 . 14.000 14.066 14.026 14.180 0.180 10 0 "[ . 1]" 3
106 1 196 ARG H 1 212 MET CB 14.000 . 16.000 15.298 13.459 16.041 0.041 10 0 "[ . 1]" 3
107 1 198 GLY H 1 212 MET CB 15.000 . 17.000 14.946 13.188 16.726 . 0 0 "[ . 1]" 3
108 1 201 TYR H 1 212 MET CB 13.000 . 15.000 13.288 9.385 14.999 . 0 0 "[ . 1]" 3
109 1 202 SER H 1 212 MET CB 13.000 . 15.000 12.184 10.555 13.406 . 0 0 "[ . 1]" 3
110 1 203 TRP H 1 212 MET CB 14.000 . 16.000 11.990 9.764 14.249 . 0 0 "[ . 1]" 3
111 1 204 TRP H 1 212 MET CB 11.000 . 13.000 12.239 10.135 13.054 0.054 1 0 "[ . 1]" 3
112 1 206 ASP H 1 212 MET CB 13.000 . 15.000 10.672 8.778 12.124 . 0 0 "[ . 1]" 3
113 1 207 ASN H 1 212 MET CB 8.000 . 10.000 9.628 9.036 10.012 0.012 8 0 "[ . 1]" 3
114 1 208 GLU H 1 212 MET CB 12.000 . 14.000 9.372 8.760 9.909 . 0 0 "[ . 1]" 3
115 1 212 MET CB 1 239 ARG H 8.000 . 10.000 8.517 7.241 10.002 0.002 9 0 "[ . 1]" 3
116 1 212 MET CB 1 240 GLN H 8.000 . 10.000 8.688 6.746 10.043 0.043 10 0 "[ . 1]" 3
117 1 212 MET CB 1 242 ARG H 14.000 . 16.000 7.922 5.335 10.541 . 0 0 "[ . 1]" 3
118 1 212 MET CB 1 243 PHE H 14.000 . 16.000 11.218 9.138 12.887 . 0 0 "[ . 1]" 3
119 1 212 MET CB 1 244 SER H 13.000 . 15.000 13.442 11.844 14.717 . 0 0 "[ . 1]" 3
120 1 18 GLY H 1 25 ALA CB 12.000 . 14.000 11.669 11.053 12.578 . 0 0 "[ . 1]" 3
121 1 20 LEU H 1 25 ALA CB 11.000 . 13.000 9.504 9.134 10.065 . 0 0 "[ . 1]" 3
122 1 22 TRP H 1 25 ALA CB 8.000 . 10.000 5.825 5.406 6.391 . 0 0 "[ . 1]" 3
123 1 25 ALA CB 1 51 ASP H 8.000 . 10.000 8.605 8.321 9.647 . 0 0 "[ . 1]" 3
124 1 25 ALA CB 1 52 GLY H 8.000 . 10.000 10.116 10.053 10.178 0.178 10 0 "[ . 1]" 3
125 1 25 ALA CB 1 53 TYR H 13.000 . 15.000 12.614 12.149 12.991 . 0 0 "[ . 1]" 3
126 1 25 ALA CB 1 235 ALA H 13.000 . 15.000 15.059 15.028 15.091 0.091 3 0 "[ . 1]" 3
127 1 25 ALA CB 1 239 ARG H 14.000 . 16.000 14.908 14.153 16.026 0.026 8 0 "[ . 1]" 3
128 1 25 ALA CB 1 240 GLN H 13.000 . 15.000 15.001 14.924 15.045 0.045 4 0 "[ . 1]" 3
129 1 25 ALA CB 1 242 ARG H 14.000 . 16.000 15.290 13.803 16.035 0.035 10 0 "[ . 1]" 3
130 1 25 ALA CB 1 256 THR H 12.000 . 14.000 14.121 14.055 14.231 0.231 6 0 "[ . 1]" 3
stop_
save_
save_distance_constraint_statistics_4
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 4
_Distance_constraint_stats_list.Constraint_count 158
_Distance_constraint_stats_list.Viol_count 497
_Distance_constraint_stats_list.Viol_total 248.540
_Distance_constraint_stats_list.Viol_max 0.404
_Distance_constraint_stats_list.Viol_rms 0.0351
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0157
_Distance_constraint_stats_list.Viol_average_violations_only 0.0500
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details .
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 2 ARG 0.478 0.105 5 0 "[ . 1]"
1 3 ILE 0.847 0.145 6 0 "[ . 1]"
1 4 ILE 0.194 0.057 8 0 "[ . 1]"
1 5 SER 0.232 0.044 1 0 "[ . 1]"
1 6 VAL 0.349 0.045 4 0 "[ . 1]"
1 8 VAL 0.336 0.108 9 0 "[ . 1]"
1 11 ILE 0.083 0.068 5 0 "[ . 1]"
1 12 GLN 0.070 0.054 5 0 "[ . 1]"
1 13 THR 0.200 0.056 5 0 "[ . 1]"
1 14 ALA 0.260 0.052 6 0 "[ . 1]"
1 15 VAL 0.083 0.068 5 0 "[ . 1]"
1 16 GLU 0.070 0.054 5 0 "[ . 1]"
1 17 ARG 0.200 0.056 5 0 "[ . 1]"
1 18 GLY 0.458 0.074 3 0 "[ . 1]"
1 19 LEU 0.534 0.176 9 0 "[ . 1]"
1 20 LEU 0.099 0.044 10 0 "[ . 1]"
1 21 SER 1.306 0.167 9 0 "[ . 1]"
1 22 TRP 0.365 0.083 1 0 "[ . 1]"
1 23 LEU 0.534 0.176 9 0 "[ . 1]"
1 24 GLN 0.099 0.044 10 0 "[ . 1]"
1 25 ALA 1.306 0.167 9 0 "[ . 1]"
1 26 GLN 0.167 0.083 1 0 "[ . 1]"
1 30 VAL 0.637 0.105 5 0 "[ . 1]"
1 31 ILE 0.936 0.158 2 0 "[ . 1]"
1 32 CYS 0.259 0.045 4 0 "[ . 1]"
1 33 LEU 0.785 0.138 1 0 "[ . 1]"
1 34 GLN 0.460 0.108 9 0 "[ . 1]"
1 54 PHE 0.281 0.109 9 0 "[ . 1]"
1 56 TYR 0.880 0.166 10 0 "[ . 1]"
1 58 CYS 0.794 0.121 4 0 "[ . 1]"
1 68 VAL 0.794 0.121 4 0 "[ . 1]"
1 69 ALA 0.785 0.138 1 0 "[ . 1]"
1 70 LEU 0.880 0.166 10 0 "[ . 1]"
1 71 TYR 0.936 0.158 2 0 "[ . 1]"
1 72 SER 0.281 0.109 9 0 "[ . 1]"
1 78 ALA 0.280 0.076 2 0 "[ . 1]"
1 80 ILE 2.124 0.191 4 0 "[ . 1]"
1 87 THR 0.131 0.050 5 0 "[ . 1]"
1 91 TYR 0.131 0.050 5 0 "[ . 1]"
1 93 ARG 3.442 0.404 9 0 "[ . 1]"
1 95 LEU 0.550 0.113 8 0 "[ . 1]"
1 96 GLN 2.124 0.191 4 0 "[ . 1]"
1 97 ALA 0.112 0.048 9 0 "[ . 1]"
1 98 ASP 0.280 0.076 2 0 "[ . 1]"
1 103 SER 0.013 0.013 3 0 "[ . 1]"
1 104 ILE 0.112 0.048 9 0 "[ . 1]"
1 105 ALA 0.070 0.028 5 0 "[ . 1]"
1 106 THR 0.550 0.113 8 0 "[ . 1]"
1 107 LEU 0.409 0.077 7 0 "[ . 1]"
1 108 LEU 3.442 0.404 9 0 "[ . 1]"
1 109 LEU 0.595 0.094 8 0 "[ . 1]"
1 116 ASP 0.079 0.022 10 0 "[ . 1]"
1 117 GLU 0.340 0.075 2 0 "[ . 1]"
1 118 ASP 0.391 0.092 2 0 "[ . 1]"
1 119 LEU 0.408 0.089 1 0 "[ . 1]"
1 120 ASN 0.389 0.124 2 0 "[ . 1]"
1 121 GLN 0.734 0.095 4 0 "[ . 1]"
1 122 LYS 0.923 0.092 2 0 "[ . 1]"
1 123 PHE 0.478 0.089 1 0 "[ . 1]"
1 124 LYS 0.596 0.124 2 0 "[ . 1]"
1 125 LEU 0.398 0.095 4 0 "[ . 1]"
1 126 MET 0.929 0.075 8 0 "[ . 1]"
1 127 ASP 0.070 0.031 9 0 "[ . 1]"
1 128 ASP 0.286 0.073 1 0 "[ . 1]"
1 129 PHE 0.882 0.093 3 0 "[ . 1]"
1 130 ALA 0.000 0.000 . 0 "[ . 1]"
1 131 ARG 0.131 0.052 1 0 "[ . 1]"
1 132 TYR 0.770 0.114 3 0 "[ . 1]"
1 133 LEU 0.593 0.093 3 0 "[ . 1]"
1 134 ASP 0.582 0.080 1 0 "[ . 1]"
1 135 LYS 0.131 0.052 1 0 "[ . 1]"
1 136 GLN 0.770 0.114 3 0 "[ . 1]"
1 137 ARG 0.113 0.065 5 0 "[ . 1]"
1 138 ARG 0.582 0.080 1 0 "[ . 1]"
1 144 ILE 0.073 0.028 5 0 "[ . 1]"
1 145 TYR 0.079 0.026 7 0 "[ . 1]"
1 146 CYS 0.355 0.077 7 0 "[ . 1]"
1 147 GLY 0.689 0.177 4 0 "[ . 1]"
1 148 SER 0.658 0.094 8 0 "[ . 1]"
1 174 GLU 0.040 0.040 5 0 "[ . 1]"
1 175 ARG 0.040 0.024 5 0 "[ . 1]"
1 176 ALA 0.144 0.051 7 0 "[ . 1]"
1 177 TRP 0.677 0.138 2 0 "[ . 1]"
1 178 MET 0.554 0.144 4 0 "[ . 1]"
1 179 ASP 0.285 0.133 10 0 "[ . 1]"
1 180 GLU 0.144 0.051 7 0 "[ . 1]"
1 181 ILE 0.677 0.138 2 0 "[ . 1]"
1 182 VAL 0.513 0.144 4 0 "[ . 1]"
1 183 GLY 0.245 0.133 10 0 "[ . 1]"
1 209 GLN 0.062 0.035 10 0 "[ . 1]"
1 213 LEU 0.062 0.035 10 0 "[ . 1]"
1 221 TYR 0.689 0.177 4 0 "[ . 1]"
1 223 LEU 0.079 0.026 7 0 "[ . 1]"
1 234 SER 0.306 0.091 9 0 "[ . 1]"
1 236 ARG 0.014 0.014 6 0 "[ . 1]"
1 249 LEU 0.232 0.044 1 0 "[ . 1]"
1 250 ILE 0.014 0.014 6 0 "[ . 1]"
1 251 VAL 0.847 0.145 6 0 "[ . 1]"
1 252 ASP 0.306 0.091 9 0 "[ . 1]"
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 11 ILE O 1 15 VAL H 2.150 . 2.500 1.937 1.732 2.105 0.068 5 0 "[ . 1]" 4
2 1 11 ILE O 1 15 VAL N 2.900 2.500 3.300 2.854 2.674 3.038 . 0 0 "[ . 1]" 4
3 1 12 GLN O 1 16 GLU H 2.150 . 2.500 2.318 2.202 2.496 . 0 0 "[ . 1]" 4
4 1 12 GLN O 1 16 GLU N 2.900 2.500 3.300 3.169 3.037 3.354 0.054 5 0 "[ . 1]" 4
5 1 13 THR O 1 17 ARG H 2.150 . 2.500 2.497 2.421 2.556 0.056 5 0 "[ . 1]" 4
6 1 13 THR O 1 17 ARG N 2.900 2.500 3.300 3.023 2.883 3.181 . 0 0 "[ . 1]" 4
7 1 14 ALA O 1 18 GLY H 2.150 . 2.500 2.452 2.115 2.552 0.052 6 0 "[ . 1]" 4
8 1 14 ALA O 1 18 GLY N 2.900 2.500 3.300 3.158 2.922 3.317 0.017 3 0 "[ . 1]" 4
9 1 18 GLY O 1 22 TRP H 2.150 . 2.500 2.366 1.810 2.574 0.074 3 0 "[ . 1]" 4
10 1 18 GLY O 1 22 TRP N 2.900 2.500 3.300 3.136 2.716 3.326 0.026 9 0 "[ . 1]" 4
11 1 19 LEU O 1 23 LEU H 2.150 . 2.500 1.908 1.624 2.388 0.176 9 0 "[ . 1]" 4
12 1 19 LEU O 1 23 LEU N 2.900 2.500 3.300 2.736 2.439 3.131 0.061 7 0 "[ . 1]" 4
13 1 20 LEU O 1 24 GLN H 2.150 . 2.500 2.327 1.928 2.544 0.044 10 0 "[ . 1]" 4
14 1 20 LEU O 1 24 GLN N 2.900 2.500 3.300 3.155 2.744 3.319 0.019 7 0 "[ . 1]" 4
15 1 21 SER O 1 25 ALA H 2.150 . 2.500 2.551 2.486 2.628 0.128 8 0 "[ . 1]" 4
16 1 21 SER O 1 25 ALA N 2.900 2.500 3.300 3.347 3.138 3.467 0.167 9 0 "[ . 1]" 4
17 1 22 TRP O 1 26 GLN H 2.150 . 2.500 2.310 1.777 2.510 0.023 7 0 "[ . 1]" 4
18 1 22 TRP O 1 26 GLN N 2.900 2.500 3.300 3.044 2.492 3.383 0.083 1 0 "[ . 1]" 4
19 1 87 THR O 1 91 TYR H 2.150 . 2.500 2.152 1.789 2.530 0.030 2 0 "[ . 1]" 4
20 1 87 THR O 1 91 TYR N 2.900 2.500 3.300 2.643 2.450 2.867 0.050 5 0 "[ . 1]" 4
21 1 116 ASP O 1 120 ASN H 2.150 . 2.500 2.381 2.062 2.502 0.002 1 0 "[ . 1]" 4
22 1 116 ASP O 1 120 ASN N 2.900 2.500 3.300 3.201 2.910 3.322 0.022 10 0 "[ . 1]" 4
23 1 117 GLU O 1 121 GLN H 2.150 . 2.500 2.386 2.214 2.442 . 0 0 "[ . 1]" 4
24 1 117 GLU O 1 121 GLN N 2.900 2.500 3.300 3.322 3.185 3.375 0.075 2 0 "[ . 1]" 4
25 1 118 ASP O 1 122 LYS H 2.150 . 2.500 1.777 1.708 1.920 0.092 2 0 "[ . 1]" 4
26 1 118 ASP O 1 122 LYS N 2.900 2.500 3.300 2.643 2.529 2.793 . 0 0 "[ . 1]" 4
27 1 119 LEU O 1 123 PHE H 2.150 . 2.500 1.944 1.741 2.589 0.089 1 0 "[ . 1]" 4
28 1 119 LEU O 1 123 PHE N 2.900 2.500 3.300 2.663 2.471 3.296 0.029 6 0 "[ . 1]" 4
29 1 120 ASN O 1 124 LYS H 2.150 . 2.500 2.373 2.213 2.477 . 0 0 "[ . 1]" 4
30 1 120 ASN O 1 124 LYS N 2.900 2.500 3.300 3.299 3.164 3.424 0.124 2 0 "[ . 1]" 4
31 1 121 GLN O 1 125 LEU H 2.150 . 2.500 2.384 2.317 2.440 . 0 0 "[ . 1]" 4
32 1 121 GLN O 1 125 LEU N 2.900 2.500 3.300 3.339 3.296 3.395 0.095 4 0 "[ . 1]" 4
33 1 122 LYS O 1 126 MET H 2.150 . 2.500 1.752 1.725 1.780 0.075 8 0 "[ . 1]" 4
34 1 122 LYS O 1 126 MET N 2.900 2.500 3.300 2.583 2.447 2.626 0.053 1 0 "[ . 1]" 4
35 1 123 PHE O 1 127 ASP H 2.150 . 2.500 1.908 1.769 2.305 0.031 9 0 "[ . 1]" 4
36 1 123 PHE O 1 127 ASP N 2.900 2.500 3.300 2.825 2.678 3.215 . 0 0 "[ . 1]" 4
37 1 124 LYS O 1 128 ASP H 2.150 . 2.500 2.376 2.335 2.403 . 0 0 "[ . 1]" 4
38 1 124 LYS O 1 128 ASP N 2.900 2.500 3.300 3.326 3.278 3.373 0.073 1 0 "[ . 1]" 4
39 1 125 LEU O 1 129 PHE H 2.150 . 2.500 1.931 1.795 2.086 0.005 1 0 "[ . 1]" 4
40 1 125 LEU O 1 129 PHE N 2.900 2.500 3.300 2.834 2.658 2.989 . 0 0 "[ . 1]" 4
41 1 126 MET O 1 129 PHE H 2.150 . 2.500 2.540 2.505 2.571 0.071 6 0 "[ . 1]" 4
42 1 126 MET O 1 129 PHE N 2.900 2.500 3.300 2.977 2.919 3.019 . 0 0 "[ . 1]" 4
43 1 127 ASP O 1 131 ARG H 2.150 . 2.500 2.190 2.067 2.298 . 0 0 "[ . 1]" 4
44 1 127 ASP O 1 131 ARG N 2.900 2.500 3.300 3.061 2.962 3.145 . 0 0 "[ . 1]" 4
45 1 128 ASP O 1 132 TYR H 2.150 . 2.500 2.034 1.849 2.199 . 0 0 "[ . 1]" 4
46 1 128 ASP O 1 132 TYR N 2.900 2.500 3.300 2.694 2.535 2.871 . 0 0 "[ . 1]" 4
47 1 129 PHE O 1 133 LEU H 2.150 . 2.500 1.768 1.707 1.958 0.093 3 0 "[ . 1]" 4
48 1 129 PHE O 1 133 LEU N 2.900 2.500 3.300 2.734 2.675 2.924 . 0 0 "[ . 1]" 4
49 1 130 ALA O 1 134 ASP H 2.150 . 2.500 2.092 1.916 2.329 . 0 0 "[ . 1]" 4
50 1 130 ALA O 1 134 ASP N 2.900 2.500 3.300 2.962 2.798 3.235 . 0 0 "[ . 1]" 4
51 1 131 ARG O 1 135 LYS H 2.150 . 2.500 1.790 1.748 1.830 0.052 1 0 "[ . 1]" 4
52 1 131 ARG O 1 135 LYS N 2.900 2.500 3.300 2.588 2.527 2.620 . 0 0 "[ . 1]" 4
53 1 132 TYR O 1 136 GLN H 2.150 . 2.500 1.723 1.686 1.743 0.114 3 0 "[ . 1]" 4
54 1 133 LEU O 1 136 GLN N 2.900 2.500 3.300 3.157 3.123 3.264 . 0 0 "[ . 1]" 4
55 1 133 LEU O 1 137 ARG H 2.150 . 2.500 1.917 1.735 2.340 0.065 5 0 "[ . 1]" 4
56 1 133 LEU O 1 137 ARG N 2.900 2.500 3.300 2.626 2.476 3.109 0.024 7 0 "[ . 1]" 4
57 1 134 ASP O 1 138 ARG H 2.150 . 2.500 2.499 2.443 2.542 0.042 2 0 "[ . 1]" 4
58 1 134 ASP O 1 138 ARG N 2.900 2.500 3.300 3.343 3.326 3.380 0.080 1 0 "[ . 1]" 4
59 1 174 GLU O 1 178 MET H 2.150 . 2.500 1.956 1.760 2.128 0.040 5 0 "[ . 1]" 4
60 1 174 GLU O 1 178 MET N 2.900 2.500 3.300 2.906 2.700 3.068 . 0 0 "[ . 1]" 4
61 1 175 ARG O 1 179 ASP H 2.150 . 2.500 2.000 1.776 2.210 0.024 5 0 "[ . 1]" 4
62 1 175 ARG O 1 179 ASP N 2.900 2.500 3.300 2.871 2.635 3.086 . 0 0 "[ . 1]" 4
63 1 176 ALA O 1 180 GLU H 2.150 . 2.500 1.931 1.749 2.357 0.051 7 0 "[ . 1]" 4
64 1 176 ALA O 1 180 GLU N 2.900 2.500 3.300 2.817 2.638 3.216 . 0 0 "[ . 1]" 4
65 1 177 TRP O 1 181 ILE H 2.150 . 2.500 2.567 2.494 2.638 0.138 2 0 "[ . 1]" 4
66 1 177 TRP O 1 181 ILE N 2.900 2.500 3.300 3.199 3.139 3.256 . 0 0 "[ . 1]" 4
67 1 178 MET O 1 182 VAL H 2.150 . 2.500 2.024 1.720 2.554 0.080 8 0 "[ . 1]" 4
68 1 178 MET O 1 182 VAL N 2.900 2.500 3.300 2.888 2.583 3.444 0.144 4 0 "[ . 1]" 4
69 1 179 ASP O 1 183 GLY H 2.150 . 2.500 2.180 1.866 2.633 0.133 10 0 "[ . 1]" 4
70 1 179 ASP O 1 183 GLY N 2.900 2.500 3.300 2.668 2.499 2.970 0.001 9 0 "[ . 1]" 4
71 1 209 GLN O 1 213 LEU H 2.150 . 2.500 2.131 1.785 2.436 0.015 3 0 "[ . 1]" 4
72 1 209 GLN O 1 213 LEU N 2.900 2.500 3.300 2.954 2.559 3.335 0.035 10 0 "[ . 1]" 4
73 1 2 ARG O 1 30 VAL H 2.150 . 2.500 2.451 2.349 2.532 0.032 1 0 "[ . 1]" 4
74 1 2 ARG O 1 30 VAL N 2.900 2.500 3.300 3.336 3.241 3.405 0.105 5 0 "[ . 1]" 4
75 1 4 ILE H 1 30 VAL O 2.150 . 2.500 2.270 1.811 2.510 0.010 1 0 "[ . 1]" 4
76 1 4 ILE N 1 30 VAL O 2.900 2.500 3.300 3.183 2.693 3.357 0.057 8 0 "[ . 1]" 4
77 1 4 ILE O 1 32 CYS H 2.150 . 2.500 2.009 1.778 2.432 0.022 9 0 "[ . 1]" 4
78 1 4 ILE O 1 32 CYS N 2.900 2.500 3.300 2.921 2.675 3.222 . 0 0 "[ . 1]" 4
79 1 6 VAL H 1 32 CYS O 2.150 . 2.500 2.442 2.340 2.520 0.020 6 0 "[ . 1]" 4
80 1 6 VAL N 1 32 CYS O 2.900 2.500 3.300 3.299 3.120 3.345 0.045 4 0 "[ . 1]" 4
81 1 6 VAL O 1 34 GLN H 2.150 . 2.500 2.241 1.837 2.469 . 0 0 "[ . 1]" 4
82 1 6 VAL O 1 34 GLN N 2.900 2.500 3.300 3.134 2.463 3.345 0.045 10 0 "[ . 1]" 4
83 1 8 VAL H 1 34 GLN O 2.150 . 2.500 2.445 2.338 2.510 0.010 10 0 "[ . 1]" 4
84 1 8 VAL N 1 34 GLN O 2.900 2.500 3.300 3.333 3.306 3.408 0.108 9 0 "[ . 1]" 4
85 1 31 ILE O 1 71 TYR H 2.150 . 2.500 2.425 2.118 2.558 0.058 2 0 "[ . 1]" 4
86 1 31 ILE O 1 71 TYR N 2.900 2.500 3.300 3.323 3.034 3.458 0.158 2 0 "[ . 1]" 4
87 1 31 ILE H 1 71 TYR O 2.150 . 2.500 2.342 1.787 2.545 0.045 10 0 "[ . 1]" 4
88 1 31 ILE N 1 71 TYR O 2.900 2.500 3.300 3.169 2.691 3.378 0.078 3 0 "[ . 1]" 4
89 1 33 LEU O 1 69 ALA H 2.150 . 2.500 2.433 2.351 2.514 0.014 7 0 "[ . 1]" 4
90 1 33 LEU O 1 69 ALA N 2.900 2.500 3.300 3.345 3.182 3.422 0.122 4 0 "[ . 1]" 4
91 1 33 LEU H 1 69 ALA O 2.150 . 2.500 2.316 1.930 2.638 0.138 1 0 "[ . 1]" 4
92 1 33 LEU N 1 69 ALA O 2.900 2.500 3.300 3.172 2.750 3.344 0.044 3 0 "[ . 1]" 4
93 1 3 ILE O 1 251 VAL H 2.150 . 2.500 2.190 1.903 2.525 0.025 6 0 "[ . 1]" 4
94 1 3 ILE O 1 251 VAL N 2.900 2.500 3.300 2.987 2.817 3.242 . 0 0 "[ . 1]" 4
95 1 3 ILE H 1 251 VAL O 2.150 . 2.500 2.449 2.302 2.564 0.064 4 0 "[ . 1]" 4
96 1 3 ILE N 1 251 VAL O 2.900 2.500 3.300 3.358 3.209 3.445 0.145 6 0 "[ . 1]" 4
97 1 5 SER O 1 249 LEU H 2.150 . 2.500 2.394 1.945 2.538 0.038 1 0 "[ . 1]" 4
98 1 5 SER O 1 249 LEU N 2.900 2.500 3.300 3.195 2.665 3.344 0.044 1 0 "[ . 1]" 4
99 1 5 SER H 1 249 LEU O 2.150 . 2.500 2.014 1.769 2.436 0.031 3 0 "[ . 1]" 4
100 1 5 SER N 1 249 LEU O 2.900 2.500 3.300 2.857 2.599 3.228 . 0 0 "[ . 1]" 4
101 1 93 ARG O 1 108 LEU N 4.250 3.850 4.650 3.714 3.543 3.790 0.307 8 0 "[ . 1]" 4
102 1 93 ARG N 1 108 LEU O 4.250 3.850 4.650 4.858 4.766 5.054 0.404 9 0 "[ . 1]" 4
103 1 95 LEU O 1 106 THR H 2.150 . 2.500 2.094 1.848 2.378 . 0 0 "[ . 1]" 4
104 1 95 LEU O 1 106 THR N 2.900 2.500 3.300 3.041 2.832 3.319 0.019 9 0 "[ . 1]" 4
105 1 95 LEU H 1 106 THR O 2.150 . 2.500 2.375 2.122 2.484 . 0 0 "[ . 1]" 4
106 1 95 LEU N 1 106 THR O 2.900 2.500 3.300 3.325 3.075 3.413 0.113 8 0 "[ . 1]" 4
107 1 97 ALA O 1 104 ILE H 2.150 . 2.500 2.039 1.778 2.417 0.022 4 0 "[ . 1]" 4
108 1 97 ALA O 1 104 ILE N 2.900 2.500 3.300 2.953 2.688 3.348 0.048 9 0 "[ . 1]" 4
109 1 97 ALA H 1 104 ILE O 2.150 . 2.500 1.987 1.787 2.361 0.013 3 0 "[ . 1]" 4
110 1 97 ALA N 1 104 ILE O 2.900 2.500 3.300 2.807 2.531 3.044 . 0 0 "[ . 1]" 4
111 1 78 ALA O 1 98 ASP H 2.150 . 2.500 2.444 2.263 2.514 0.014 4 0 "[ . 1]" 4
112 1 78 ALA O 1 98 ASP N 2.900 2.500 3.300 3.275 3.097 3.327 0.027 7 0 "[ . 1]" 4
113 1 78 ALA H 1 98 ASP O 2.150 . 2.500 2.149 1.759 2.576 0.076 2 0 "[ . 1]" 4
114 1 78 ALA N 1 98 ASP O 2.900 2.500 3.300 2.911 2.579 3.159 . 0 0 "[ . 1]" 4
115 1 80 ILE O 1 96 GLN H 2.150 . 2.500 2.557 2.260 2.691 0.191 4 0 "[ . 1]" 4
116 1 80 ILE O 1 96 GLN N 2.900 2.500 3.300 3.326 3.132 3.432 0.132 2 0 "[ . 1]" 4
117 1 80 ILE H 1 96 GLN O 2.150 . 2.500 2.367 2.145 2.462 . 0 0 "[ . 1]" 4
118 1 80 ILE N 1 96 GLN O 2.900 2.500 3.300 3.331 3.099 3.415 0.115 6 0 "[ . 1]" 4
119 1 58 CYS O 1 68 VAL H 2.150 . 2.500 2.257 2.010 2.523 0.023 6 0 "[ . 1]" 4
120 1 58 CYS O 1 68 VAL N 2.900 2.500 3.300 3.063 2.969 3.384 0.084 10 0 "[ . 1]" 4
121 1 58 CYS H 1 68 VAL O 2.150 . 2.500 2.541 2.294 2.621 0.121 4 0 "[ . 1]" 4
122 1 58 CYS N 1 68 VAL O 2.900 2.500 3.300 3.240 3.088 3.328 0.028 2 0 "[ . 1]" 4
123 1 56 TYR O 1 70 LEU H 2.150 . 2.500 2.519 1.912 2.666 0.166 10 0 "[ . 1]" 4
124 1 56 TYR O 1 70 LEU N 2.900 2.500 3.300 3.187 2.763 3.354 0.054 2 0 "[ . 1]" 4
125 1 56 TYR H 1 70 LEU O 2.150 . 2.500 2.257 1.965 2.507 0.007 9 0 "[ . 1]" 4
126 1 56 TYR N 1 70 LEU O 2.900 2.500 3.300 3.072 2.850 3.337 0.037 2 0 "[ . 1]" 4
127 1 54 PHE O 1 72 SER H 2.150 . 2.500 2.370 2.182 2.609 0.109 9 0 "[ . 1]" 4
128 1 54 PHE O 1 72 SER N 2.900 2.500 3.300 3.214 3.029 3.335 0.035 9 0 "[ . 1]" 4
129 1 54 PHE H 1 72 SER O 2.150 . 2.500 2.123 1.794 2.479 0.006 9 0 "[ . 1]" 4
130 1 54 PHE N 1 72 SER O 2.900 2.500 3.300 2.965 2.463 3.288 0.037 9 0 "[ . 1]" 4
131 1 147 GLY O 1 221 TYR H 2.150 . 2.500 2.144 1.796 2.677 0.177 4 0 "[ . 1]" 4
132 1 147 GLY O 1 221 TYR N 2.900 2.500 3.300 2.913 2.480 3.354 0.054 10 0 "[ . 1]" 4
133 1 147 GLY H 1 221 TYR O 2.150 . 2.500 2.327 1.765 2.567 0.067 3 0 "[ . 1]" 4
134 1 147 GLY N 1 221 TYR O 2.900 2.500 3.300 3.166 2.460 3.357 0.057 3 0 "[ . 1]" 4
135 1 145 TYR O 1 223 LEU H 2.150 . 2.500 2.006 1.787 2.273 0.013 4 0 "[ . 1]" 4
136 1 145 TYR O 1 223 LEU N 2.900 2.500 3.300 2.906 2.668 3.168 . 0 0 "[ . 1]" 4
137 1 145 TYR H 1 223 LEU O 2.150 . 2.500 1.913 1.774 2.256 0.026 7 0 "[ . 1]" 4
138 1 145 TYR N 1 223 LEU O 2.900 2.500 3.300 2.758 2.604 3.053 . 0 0 "[ . 1]" 4
139 1 236 ARG O 1 250 ILE H 2.150 . 2.500 2.174 1.971 2.346 . 0 0 "[ . 1]" 4
140 1 236 ARG O 1 250 ILE N 2.900 2.500 3.300 3.095 2.873 3.314 0.014 6 0 "[ . 1]" 4
141 1 236 ARG H 1 250 ILE O 2.150 . 2.500 2.045 1.822 2.371 . 0 0 "[ . 1]" 4
142 1 236 ARG N 1 250 ILE O 2.900 2.500 3.300 2.886 2.789 3.160 . 0 0 "[ . 1]" 4
143 1 234 SER O 1 252 ASP H 2.500 2.150 2.850 2.252 2.090 2.714 0.060 3 0 "[ . 1]" 4
144 1 234 SER O 1 252 ASP N 3.250 2.850 3.650 3.099 2.957 3.427 . 0 0 "[ . 1]" 4
145 1 234 SER H 1 252 ASP O 2.500 2.150 2.850 2.368 2.123 2.849 0.027 1 0 "[ . 1]" 4
146 1 234 SER N 1 252 ASP O 3.250 2.850 3.650 3.241 2.981 3.741 0.091 9 0 "[ . 1]" 4
147 1 103 SER O 1 144 ILE H 2.150 . 2.500 2.023 1.787 2.259 0.013 3 0 "[ . 1]" 4
148 1 103 SER O 1 144 ILE N 2.900 2.500 3.300 2.894 2.675 3.068 . 0 0 "[ . 1]" 4
149 1 105 ALA H 1 144 ILE O 2.150 . 2.500 2.036 1.772 2.335 0.028 5 0 "[ . 1]" 4
150 1 105 ALA N 1 144 ILE O 2.900 2.500 3.300 2.952 2.709 3.248 . 0 0 "[ . 1]" 4
151 1 105 ALA O 1 146 CYS H 2.150 . 2.500 2.077 1.791 2.308 0.009 4 0 "[ . 1]" 4
152 1 105 ALA O 1 146 CYS N 2.900 2.500 3.300 3.030 2.769 3.214 . 0 0 "[ . 1]" 4
153 1 107 LEU H 1 146 CYS O 2.150 . 2.500 2.479 2.336 2.577 0.077 7 0 "[ . 1]" 4
154 1 107 LEU N 1 146 CYS O 2.900 2.500 3.300 3.297 3.189 3.340 0.040 1 0 "[ . 1]" 4
155 1 107 LEU O 1 148 SER H 2.150 . 2.500 2.062 1.772 2.436 0.028 8 0 "[ . 1]" 4
156 1 107 LEU O 1 148 SER N 2.900 2.500 3.300 2.911 2.695 3.315 0.015 2 0 "[ . 1]" 4
157 1 109 LEU H 1 148 SER O 2.150 . 2.500 2.477 2.414 2.544 0.044 3 0 "[ . 1]" 4
158 1 109 LEU N 1 148 SER O 2.900 2.500 3.300 3.339 3.255 3.394 0.094 8 0 "[ . 1]" 4
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