NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
523171 |
2l6x   |
17327 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_2l6x
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 227
_Distance_constraint_stats_list.Viol_count 546
_Distance_constraint_stats_list.Viol_total 722.533
_Distance_constraint_stats_list.Viol_max 0.600
_Distance_constraint_stats_list.Viol_rms 0.0316
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0080
_Distance_constraint_stats_list.Viol_average_violations_only 0.0662
_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 9 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 10 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 11 TYR 0.124 0.039 6 0 "[ . 1 . 2]"
1 12 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 13 GLY 0.124 0.039 6 0 "[ . 1 . 2]"
1 14 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 15 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 16 PHE 0.386 0.057 13 0 "[ . 1 . 2]"
1 17 TRP 0.655 0.111 6 0 "[ . 1 . 2]"
1 18 LEU 0.386 0.057 13 0 "[ . 1 . 2]"
1 19 VAL 0.655 0.111 6 0 "[ . 1 . 2]"
1 20 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 21 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 22 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 23 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 24 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 25 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 26 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 27 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 28 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 29 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 30 PHE 0.467 0.056 5 0 "[ . 1 . 2]"
1 31 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 32 VAL 0.619 0.066 8 0 "[ . 1 . 2]"
1 33 GLU 1.759 0.160 13 0 "[ . 1 . 2]"
1 34 ARG 2.364 0.171 20 0 "[ . 1 . 2]"
1 35 ASP 1.759 0.160 13 0 "[ . 1 . 2]"
1 36 ARG 2.220 0.171 20 0 "[ . 1 . 2]"
1 37 VAL 2.685 0.212 20 0 "[ . 1 . 2]"
1 38 SER 2.677 0.212 20 0 "[ . 1 . 2]"
1 39 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 40 LYS 0.346 0.075 11 0 "[ . 1 . 2]"
1 41 TRP 0.000 0.000 . 0 "[ . 1 . 2]"
1 42 LYS 0.346 0.075 11 0 "[ . 1 . 2]"
1 43 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 44 SER 0.030 0.022 11 0 "[ . 1 . 2]"
1 45 LEU 0.224 0.055 14 0 "[ . 1 . 2]"
1 46 THR 0.030 0.022 11 0 "[ . 1 . 2]"
1 47 VAL 0.224 0.055 14 0 "[ . 1 . 2]"
1 48 SER 0.079 0.047 11 0 "[ . 1 . 2]"
1 49 GLY 1.845 0.151 5 0 "[ . 1 . 2]"
1 50 LEU 0.361 0.100 11 0 "[ . 1 . 2]"
1 51 VAL 1.845 0.151 5 0 "[ . 1 . 2]"
1 52 THR 0.282 0.100 11 0 "[ . 1 . 2]"
1 53 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 54 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 55 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 56 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 57 TRP 0.000 0.000 . 0 "[ . 1 . 2]"
1 58 HIS 0.000 0.000 . 0 "[ . 1 . 2]"
1 64 GLY 0.100 0.059 19 0 "[ . 1 . 2]"
1 65 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 66 TRP 0.111 0.059 19 0 "[ . 1 . 2]"
1 67 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 68 GLU 0.011 0.011 16 0 "[ . 1 . 2]"
1 70 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 71 ASP 1.375 0.178 18 0 "[ . 1 . 2]"
1 72 SER 1.375 0.178 18 0 "[ . 1 . 2]"
1 74 THR 0.958 0.163 3 0 "[ . 1 . 2]"
1 75 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 76 PHE 0.962 0.163 3 0 "[ . 1 . 2]"
1 78 TYR 0.004 0.004 3 0 "[ . 1 . 2]"
1 79 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 80 ASP 0.175 0.105 17 0 "[ . 1 . 2]"
1 82 LEU 0.175 0.105 17 0 "[ . 1 . 2]"
1 83 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 84 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 85 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 87 LEU 0.428 0.147 8 0 "[ . 1 . 2]"
1 88 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 89 ILE 0.428 0.147 8 0 "[ . 1 . 2]"
1 94 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 95 ILE 0.153 0.046 14 0 "[ . 1 . 2]"
1 97 ALA 0.153 0.046 14 0 "[ . 1 . 2]"
1 98 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 99 ALA 1.258 0.295 15 0 "[ . 1 . 2]"
1 100 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 101 ASN 1.258 0.295 15 0 "[ . 1 . 2]"
1 102 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 103 ALA 0.109 0.069 17 0 "[ . 1 . 2]"
1 104 GLY 0.433 0.085 17 0 "[ . 1 . 2]"
1 105 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 106 LEU 0.323 0.085 17 0 "[ . 1 . 2]"
1 107 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 108 LYS 0.339 0.084 20 0 "[ . 1 . 2]"
1 109 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 110 LEU 0.339 0.084 20 0 "[ . 1 . 2]"
1 111 LEU 0.116 0.033 9 0 "[ . 1 . 2]"
1 112 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 113 GLY 0.204 0.038 20 0 "[ . 1 . 2]"
1 114 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 115 LEU 0.088 0.038 20 0 "[ . 1 . 2]"
1 116 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 117 MET 0.000 0.000 . 0 "[ . 1 . 2]"
1 118 LEU 0.052 0.024 19 0 "[ . 1 . 2]"
1 120 PHE 0.052 0.024 19 0 "[ . 1 . 2]"
1 121 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 122 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
1 123 MET 0.000 0.000 . 0 "[ . 1 . 2]"
1 124 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 125 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 126 ALA 0.204 0.070 18 0 "[ . 1 . 2]"
1 127 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 128 ILE 0.204 0.070 18 0 "[ . 1 . 2]"
1 129 MET 0.019 0.019 13 0 "[ . 1 . 2]"
1 130 ALA 2.180 0.600 12 3 "[ . -1 + *. 2]"
1 131 ALA 2.161 0.600 12 3 "[ . -1 + *. 2]"
1 132 TRP 0.000 0.000 . 0 "[ . 1 . 2]"
1 134 ALA 0.110 0.110 11 0 "[ . 1 . 2]"
1 135 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 136 ILE 0.110 0.110 11 0 "[ . 1 . 2]"
1 138 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 139 CYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 140 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 141 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 142 TRP 0.000 0.000 . 0 "[ . 1 . 2]"
1 147 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
1 148 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 149 LEU 0.304 0.060 8 0 "[ . 1 . 2]"
1 150 TRP 0.000 0.000 . 0 "[ . 1 . 2]"
1 151 ALA 0.304 0.060 8 0 "[ . 1 . 2]"
1 152 GLY 2.527 0.263 1 0 "[ . 1 . 2]"
1 153 GLU 1.685 0.263 1 0 "[ . 1 . 2]"
1 154 GLY 0.872 0.164 4 0 "[ . 1 . 2]"
1 155 LYS 0.468 0.235 19 0 "[ . 1 . 2]"
1 156 SER 0.030 0.018 8 0 "[ . 1 . 2]"
1 157 ALA 0.468 0.235 19 0 "[ . 1 . 2]"
1 159 ASN 1.468 0.175 9 0 "[ . 1 . 2]"
1 160 THR 0.823 0.126 18 0 "[ . 1 . 2]"
1 161 ALA 0.644 0.175 9 0 "[ . 1 . 2]"
1 162 SER 0.687 0.123 2 0 "[ . 1 . 2]"
1 164 ALA 0.427 0.075 10 0 "[ . 1 . 2]"
1 165 VAL 1.222 0.123 13 0 "[ . 1 . 2]"
1 166 GLN 3.377 0.163 13 0 "[ . 1 . 2]"
1 167 SER 1.935 0.123 13 0 "[ . 1 . 2]"
1 168 ALA 2.262 0.163 13 0 "[ . 1 . 2]"
1 169 TYR 0.713 0.070 18 0 "[ . 1 . 2]"
1 170 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 171 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 172 MET 2.366 0.238 20 0 "[ . 1 . 2]"
1 173 MET 0.000 0.000 . 0 "[ . 1 . 2]"
1 174 TYR 2.366 0.238 20 0 "[ . 1 . 2]"
1 175 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 178 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 179 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 180 TRP 0.000 0.000 . 0 "[ . 1 . 2]"
1 181 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 182 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 185 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 186 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 187 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
1 188 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 189 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 190 GLY 0.336 0.170 19 0 "[ . 1 . 2]"
1 191 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
1 192 LEU 0.336 0.170 19 0 "[ . 1 . 2]"
1 193 MET 0.159 0.063 4 0 "[ . 1 . 2]"
1 194 GLY 0.207 0.063 4 0 "[ . 1 . 2]"
1 195 ASP 0.096 0.061 8 0 "[ . 1 . 2]"
1 196 GLY 0.048 0.040 8 0 "[ . 1 . 2]"
1 197 GLY 0.096 0.061 8 0 "[ . 1 . 2]"
1 198 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 199 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 200 LEU 0.335 0.090 12 0 "[ . 1 . 2]"
1 202 LEU 0.499 0.090 12 0 "[ . 1 . 2]"
1 204 LEU 0.866 0.092 15 0 "[ . 1 . 2]"
1 205 ILE 0.152 0.035 9 0 "[ . 1 . 2]"
1 206 TYR 0.702 0.092 15 0 "[ . 1 . 2]"
1 207 ASN 0.152 0.035 9 0 "[ . 1 . 2]"
1 208 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 209 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 210 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 211 PHE 0.006 0.006 18 0 "[ . 1 . 2]"
1 213 ASN 0.006 0.006 18 0 "[ . 1 . 2]"
1 214 . 0.000 0.000 . 0 "[ . 1 . 2]"
1 215 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 216 LEU 0.780 0.096 18 0 "[ . 1 . 2]"
1 217 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 218 GLY 1.220 0.110 8 0 "[ . 1 . 2]"
1 219 LEU 1.175 0.118 17 0 "[ . 1 . 2]"
1 220 ILE 0.440 0.110 8 0 "[ . 1 . 2]"
1 221 ILE 1.175 0.118 17 0 "[ . 1 . 2]"
1 222 TRP 0.000 0.000 . 0 "[ . 1 . 2]"
1 223 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 224 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 225 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 226 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 227 LYS 0.030 0.016 10 0 "[ . 1 . 2]"
1 228 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 229 SER 0.030 0.016 10 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 187 TYR H 1 188 PHE H . . 3.950 2.782 2.613 2.960 . 0 0 "[ . 1 . 2]" 1
2 1 129 MET H 1 130 ALA H . . 4.500 4.365 4.140 4.519 0.019 13 0 "[ . 1 . 2]" 1
3 1 84 THR H 1 85 VAL H . . 4.310 2.145 1.999 2.444 . 0 0 "[ . 1 . 2]" 1
4 1 44 SER H 1 45 LEU H . . 3.860 2.785 2.658 2.862 . 0 0 "[ . 1 . 2]" 1
5 1 48 SER H 1 50 LEU H . . 4.270 4.112 3.990 4.317 0.047 11 0 "[ . 1 . 2]" 1
6 1 50 LEU H 1 52 THR H . . 4.280 4.159 4.038 4.380 0.100 11 0 "[ . 1 . 2]" 1
7 1 64 GLY H 1 66 TRP H . . 4.450 4.178 3.865 4.509 0.059 19 0 "[ . 1 . 2]" 1
8 1 65 VAL H 1 66 TRP H . . 3.810 2.655 2.535 2.885 . 0 0 "[ . 1 . 2]" 1
9 1 66 TRP H 1 68 GLU H . . 4.000 3.800 3.650 4.011 0.011 16 0 "[ . 1 . 2]" 1
10 1 13 GLY H 1 14 VAL H . . 4.560 2.733 2.689 2.782 . 0 0 "[ . 1 . 2]" 1
11 1 223 ASN H 1 225 ALA H . . 4.520 4.073 3.888 4.391 . 0 0 "[ . 1 . 2]" 1
12 1 113 GLY H 1 115 LEU H . . 4.510 4.280 4.026 4.548 0.038 20 0 "[ . 1 . 2]" 1
13 1 22 ALA H 1 23 LEU H . . 4.220 2.789 2.564 2.858 . 0 0 "[ . 1 . 2]" 1
14 1 23 LEU H 1 24 LEU H . . 4.700 2.794 2.630 2.941 . 0 0 "[ . 1 . 2]" 1
15 1 54 ILE H 1 55 ALA H . . 4.250 2.684 2.548 2.903 . 0 0 "[ . 1 . 2]" 1
16 1 17 TRP H 1 19 VAL H . . 4.070 4.100 4.014 4.181 0.111 6 0 "[ . 1 . 2]" 1
17 1 125 GLU H 1 126 ALA H . . 3.620 2.920 2.711 3.195 . 0 0 "[ . 1 . 2]" 1
18 1 40 LYS H 1 42 LYS H . . 4.130 4.046 3.716 4.205 0.075 11 0 "[ . 1 . 2]" 1
19 1 42 LYS H 1 43 THR H . . 4.290 2.901 2.760 2.948 . 0 0 "[ . 1 . 2]" 1
20 1 121 GLY H 1 122 TYR H . . 4.230 2.699 2.556 2.817 . 0 0 "[ . 1 . 2]" 1
21 1 209 ALA H 1 210 ASP H . . 4.770 2.825 2.732 2.909 . 0 0 "[ . 1 . 2]" 1
22 1 104 GLY H 1 106 LEU H . . 4.720 4.633 4.133 4.805 0.085 17 0 "[ . 1 . 2]" 1
23 1 97 ALA H 1 98 ALA H . . 3.820 2.494 2.424 2.670 . 0 0 "[ . 1 . 2]" 1
24 1 95 ILE H 1 97 ALA H . . 4.420 4.237 3.789 4.466 0.046 14 0 "[ . 1 . 2]" 1
25 1 211 PHE H 1 213 ASN H . . 4.160 3.774 3.610 4.166 0.006 18 0 "[ . 1 . 2]" 1
26 1 209 ALA H 1 211 PHE H . . 4.630 3.957 3.770 4.188 . 0 0 "[ . 1 . 2]" 1
27 1 218 GLY H 1 220 ILE H . . 4.380 4.328 4.159 4.490 0.110 8 0 "[ . 1 . 2]" 1
28 1 220 ILE H 1 221 ILE H . . 3.960 2.651 2.560 2.723 . 0 0 "[ . 1 . 2]" 1
29 1 20 THR H 1 21 ALA H . . 3.910 2.753 2.686 2.853 . 0 0 "[ . 1 . 2]" 1
30 1 219 LEU H 1 220 ILE H . . 3.640 2.719 2.577 2.902 . 0 0 "[ . 1 . 2]" 1
31 1 126 ALA H 1 128 ILE H . . 4.040 3.947 3.501 4.110 0.070 18 0 "[ . 1 . 2]" 1
32 1 128 ILE H 1 129 MET H . . 3.320 2.350 2.103 2.835 . 0 0 "[ . 1 . 2]" 1
33 1 127 GLY H 1 128 ILE H . . 3.570 2.689 2.174 2.934 . 0 0 "[ . 1 . 2]" 1
34 1 87 LEU H 1 88 LEU H . . 3.690 2.658 2.556 2.827 . 0 0 "[ . 1 . 2]" 1
35 1 11 TYR H 1 12 THR H . . 3.540 2.779 2.724 2.936 . 0 0 "[ . 1 . 2]" 1
36 1 188 PHE H 1 189 THR H . . 3.810 2.740 2.542 2.958 . 0 0 "[ . 1 . 2]" 1
37 1 55 ALA H 1 56 PHE H . . 4.400 2.673 2.544 2.790 . 0 0 "[ . 1 . 2]" 1
38 1 82 LEU H 1 83 LEU H . . 3.960 2.486 2.428 2.581 . 0 0 "[ . 1 . 2]" 1
39 1 11 TYR H 1 13 GLY H . . 4.310 4.283 4.041 4.349 0.039 6 0 "[ . 1 . 2]" 1
40 1 46 THR H 1 47 VAL H . . 3.380 2.692 2.625 2.773 . 0 0 "[ . 1 . 2]" 1
41 1 200 LEU H 1 202 LEU H . . 4.000 3.974 3.765 4.090 0.090 12 0 "[ . 1 . 2]" 1
42 1 208 LEU H 1 209 ALA H . . 4.050 2.750 2.684 2.822 . 0 0 "[ . 1 . 2]" 1
43 1 199 ALA H 1 200 LEU H . . 3.970 2.686 2.546 2.810 . 0 0 "[ . 1 . 2]" 1
44 1 99 ALA H 1 101 ASN H . . 4.500 4.386 3.678 4.795 0.295 15 0 "[ . 1 . 2]" 1
45 1 111 LEU H 1 113 GLY H . . 4.200 4.089 3.797 4.233 0.033 9 0 "[ . 1 . 2]" 1
46 1 79 ILE H 1 80 ASP H . . 4.630 2.761 2.601 3.028 . 0 0 "[ . 1 . 2]" 1
47 1 147 TYR H 1 148 GLU H . . 4.180 2.822 2.600 2.937 . 0 0 "[ . 1 . 2]" 1
48 1 204 LEU H 1 206 TYR H . . 4.150 4.183 4.112 4.242 0.092 15 0 "[ . 1 . 2]" 1
49 1 164 ALA H 1 166 GLN H . . 4.050 4.048 3.935 4.125 0.075 10 0 "[ . 1 . 2]" 1
50 1 167 SER H 1 169 TYR H . . 3.990 4.024 3.952 4.060 0.070 18 0 "[ . 1 . 2]" 1
51 1 221 ILE H 1 222 TRP H . . 4.090 2.762 2.609 2.975 . 0 0 "[ . 1 . 2]" 1
52 1 32 VAL H 1 34 ARG H . . 3.890 3.831 3.683 3.956 0.066 8 0 "[ . 1 . 2]" 1
53 1 31 PHE H 1 32 VAL H . . 3.610 2.645 2.551 2.882 . 0 0 "[ . 1 . 2]" 1
54 1 30 PHE H 1 32 VAL H . . 4.400 4.406 4.280 4.456 0.056 5 0 "[ . 1 . 2]" 1
55 1 166 GLN H 1 168 ALA H . . 4.210 4.323 4.272 4.373 0.163 13 0 "[ . 1 . 2]" 1
56 1 207 ASN H 1 209 ALA H . . 4.640 4.336 4.088 4.476 . 0 0 "[ . 1 . 2]" 1
57 1 12 THR H 1 13 GLY H . . 4.290 2.828 2.651 2.916 . 0 0 "[ . 1 . 2]" 1
58 1 205 ILE H 1 207 ASN H . . 4.460 4.357 4.061 4.495 0.035 9 0 "[ . 1 . 2]" 1
59 1 206 TYR H 1 207 ASN H . . 3.630 2.773 2.641 2.872 . 0 0 "[ . 1 . 2]" 1
60 1 165 VAL H 1 166 GLN H . . 3.440 2.668 2.571 2.768 . 0 0 "[ . 1 . 2]" 1
61 1 164 ALA H 1 165 VAL H . . 3.620 2.531 2.484 2.618 . 0 0 "[ . 1 . 2]" 1
62 1 98 ALA H 1 99 ALA H . . 3.470 2.698 2.584 2.759 . 0 0 "[ . 1 . 2]" 1
63 1 135 PHE H 1 136 ILE H . . 3.770 2.598 2.419 2.807 . 0 0 "[ . 1 . 2]" 1
64 1 21 ALA H 1 22 ALA H . . 3.680 2.756 2.632 2.827 . 0 0 "[ . 1 . 2]" 1
65 1 25 ALA H 1 26 SER H . . 4.020 2.733 2.606 2.889 . 0 0 "[ . 1 . 2]" 1
66 1 25 ALA H 1 27 THR H . . 4.680 4.216 3.969 4.576 . 0 0 "[ . 1 . 2]" 1
67 1 115 LEU H 1 116 VAL H . . 4.380 2.780 2.619 2.922 . 0 0 "[ . 1 . 2]" 1
68 1 33 GLU H 1 34 ARG H . . 3.470 2.478 2.389 2.560 . 0 0 "[ . 1 . 2]" 1
69 1 34 ARG H 1 35 ASP H . . 3.570 2.685 2.467 2.812 . 0 0 "[ . 1 . 2]" 1
70 1 227 LYS H 1 228 GLU H . . 3.260 2.675 2.485 2.942 . 0 0 "[ . 1 . 2]" 1
71 1 29 PHE H 1 30 PHE H . . 3.560 2.693 2.626 2.858 . 0 0 "[ . 1 . 2]" 1
72 1 126 ALA H 1 127 GLY H . . 3.640 2.012 1.888 2.381 . 0 0 "[ . 1 . 2]" 1
73 1 192 LEU H 1 193 MET H . . 3.520 2.399 1.872 3.080 . 0 0 "[ . 1 . 2]" 1
74 1 193 MET H 1 194 GLY H . . 4.500 4.408 3.967 4.563 0.063 4 0 "[ . 1 . 2]" 1
75 1 27 THR H 1 28 VAL H . . 4.020 2.650 2.553 2.779 . 0 0 "[ . 1 . 2]" 1
76 1 34 ARG H 1 36 ARG H . . 3.760 3.871 3.792 3.931 0.171 20 0 "[ . 1 . 2]" 1
77 1 28 VAL H 1 29 PHE H . . 3.860 2.644 2.534 2.746 . 0 0 "[ . 1 . 2]" 1
78 1 112 VAL H 1 113 GLY H . . 3.870 2.814 2.690 2.916 . 0 0 "[ . 1 . 2]" 1
79 1 110 LEU H 1 112 VAL H . . 4.500 4.426 4.294 4.467 . 0 0 "[ . 1 . 2]" 1
80 1 94 LEU H 1 95 ILE H . . 3.560 2.901 2.739 3.037 . 0 0 "[ . 1 . 2]" 1
81 1 131 ALA H 1 132 TRP H . . 3.040 2.626 2.418 2.897 . 0 0 "[ . 1 . 2]" 1
82 1 180 TRP H 1 181 ALA H . . 4.090 2.736 2.624 2.785 . 0 0 "[ . 1 . 2]" 1
83 1 134 ALA H 1 135 PHE H . . 3.350 2.750 2.469 2.918 . 0 0 "[ . 1 . 2]" 1
84 1 18 LEU H 1 19 VAL H . . 4.010 2.694 2.642 2.736 . 0 0 "[ . 1 . 2]" 1
85 1 17 TRP H 1 18 LEU H . . 3.680 2.663 2.554 2.721 . 0 0 "[ . 1 . 2]" 1
86 1 16 PHE H 1 18 LEU H . . 4.290 4.297 4.202 4.347 0.057 13 0 "[ . 1 . 2]" 1
87 1 49 GLY H 1 51 VAL H . . 4.220 4.312 4.242 4.371 0.151 5 0 "[ . 1 . 2]" 1
88 1 148 GLU H 1 149 LEU H . . 3.630 2.554 2.453 2.702 . 0 0 "[ . 1 . 2]" 1
89 1 149 LEU H 1 150 TRP H . . 3.630 2.669 2.380 3.016 . 0 0 "[ . 1 . 2]" 1
90 1 114 SER H 1 115 LEU H . . 3.750 2.728 2.530 2.959 . 0 0 "[ . 1 . 2]" 1
91 1 113 GLY H 1 114 SER H . . 4.080 2.769 2.680 2.876 . 0 0 "[ . 1 . 2]" 1
92 1 225 ALA H 1 226 VAL H . . 3.430 2.678 2.506 2.865 . 0 0 "[ . 1 . 2]" 1
93 1 67 ILE H 1 68 GLU H . . 4.120 2.531 2.434 2.727 . 0 0 "[ . 1 . 2]" 1
94 1 36 ARG H 1 37 VAL H . . 3.030 2.813 2.371 3.037 0.007 11 0 "[ . 1 . 2]" 1
95 1 35 ASP H 1 36 ARG H . . 3.400 2.206 2.031 2.498 . 0 0 "[ . 1 . 2]" 1
96 1 223 ASN H 1 224 VAL H . . 3.530 2.766 2.582 2.941 . 0 0 "[ . 1 . 2]" 1
97 1 216 LEU H 1 218 GLY H . . 4.690 4.725 4.616 4.786 0.096 18 0 "[ . 1 . 2]" 1
98 1 214 . H 1 215 ILE H . . 4.400 2.123 1.839 2.362 . 0 0 "[ . 1 . 2]" 1
99 1 33 GLU H 1 35 ASP H . . 4.420 4.508 4.453 4.580 0.160 13 0 "[ . 1 . 2]" 1
100 1 31 PHE H 1 33 GLU H . . 4.050 3.843 3.728 3.989 . 0 0 "[ . 1 . 2]" 1
101 1 204 LEU H 1 205 ILE H . . 3.860 2.848 2.583 2.998 . 0 0 "[ . 1 . 2]" 1
102 1 205 ILE H 1 206 TYR H . . 3.780 2.789 2.675 2.859 . 0 0 "[ . 1 . 2]" 1
103 1 170 ASN H 1 171 THR H . . 3.670 2.837 2.690 2.942 . 0 0 "[ . 1 . 2]" 1
104 1 172 MET H 1 174 TYR H . . 3.860 3.978 3.876 4.098 0.238 20 0 "[ . 1 . 2]" 1
105 1 109 LYS H 1 110 LEU H . . 3.730 2.628 2.582 2.674 . 0 0 "[ . 1 . 2]" 1
106 1 19 VAL H 1 20 THR H . . 4.100 2.657 2.536 2.745 . 0 0 "[ . 1 . 2]" 1
107 1 13 GLY H 1 15 SER H . . 4.650 4.301 4.017 4.465 . 0 0 "[ . 1 . 2]" 1
108 1 15 SER H 1 16 PHE H . . 4.440 2.745 2.681 2.810 . 0 0 "[ . 1 . 2]" 1
109 1 110 LEU H 1 111 LEU H . . 3.540 2.701 2.618 2.792 . 0 0 "[ . 1 . 2]" 1
110 1 221 ILE H 1 223 ASN H . . 4.450 4.106 3.853 4.391 . 0 0 "[ . 1 . 2]" 1
111 1 107 PHE H 1 108 LYS H . . 4.290 2.682 2.501 2.883 . 0 0 "[ . 1 . 2]" 1
112 1 75 VAL H 1 76 PHE H . . 3.650 2.763 2.588 2.885 . 0 0 "[ . 1 . 2]" 1
113 1 76 PHE H 1 78 TYR H . . 4.520 4.146 3.811 4.524 0.004 3 0 "[ . 1 . 2]" 1
114 1 162 SER H 1 166 GLN H . . 4.220 4.017 3.403 4.343 0.123 2 0 "[ . 1 . 2]" 1
115 1 47 VAL H 1 48 SER H . . 3.510 2.687 2.566 2.835 . 0 0 "[ . 1 . 2]" 1
116 1 105 SER H 1 106 LEU H . . 4.130 2.786 2.719 2.843 . 0 0 "[ . 1 . 2]" 1
117 1 104 GLY H 1 105 SER H . . 4.470 2.574 2.459 2.727 . 0 0 "[ . 1 . 2]" 1
118 1 52 THR H 1 53 GLY H . . 4.250 2.594 2.518 2.662 . 0 0 "[ . 1 . 2]" 1
119 1 53 GLY H 1 55 ALA H . . 4.500 4.103 3.861 4.298 . 0 0 "[ . 1 . 2]" 1
120 1 122 TYR H 1 123 MET H . . 3.600 2.841 2.696 2.974 . 0 0 "[ . 1 . 2]" 1
121 1 227 LYS H 1 229 SER H . . 4.230 4.041 3.860 4.246 0.016 10 0 "[ . 1 . 2]" 1
122 1 228 GLU H 1 229 SER H . . 3.540 2.542 2.425 2.738 . 0 0 "[ . 1 . 2]" 1
123 1 37 VAL H 1 38 SER H . . 4.320 4.454 4.370 4.532 0.212 20 0 "[ . 1 . 2]" 1
124 1 87 LEU H 1 89 ILE H . . 4.120 4.000 3.749 4.267 0.147 8 0 "[ . 1 . 2]" 1
125 1 57 TRP H 1 58 HIS H . . 4.570 2.802 2.646 2.890 . 0 0 "[ . 1 . 2]" 1
126 1 117 MET H 1 118 LEU H . . 4.250 2.602 2.502 2.694 . 0 0 "[ . 1 . 2]" 1
127 1 71 ASP H 1 72 SER H . . 4.310 4.343 4.130 4.488 0.178 18 0 "[ . 1 . 2]" 1
128 1 213 ASN H 1 214 . H . . 4.270 2.575 2.392 2.690 . 0 0 "[ . 1 . 2]" 1
129 1 9 SER H 1 10 ASP H . . 3.130 2.763 2.704 2.894 . 0 0 "[ . 1 . 2]" 1
130 1 154 GLY H 1 156 SER H . . 4.610 4.130 3.622 4.628 0.018 8 0 "[ . 1 . 2]" 1
131 1 198 SER H 1 199 ALA H . . 4.760 4.524 4.333 4.631 . 0 0 "[ . 1 . 2]" 1
132 1 165 VAL H 1 167 SER H . . 3.960 4.019 3.931 4.083 0.123 13 0 "[ . 1 . 2]" 1
133 1 191 TYR H 1 192 LEU H . . 3.910 2.502 2.082 2.857 . 0 0 "[ . 1 . 2]" 1
134 1 190 GLY H 1 191 TYR H . . 4.230 2.023 1.868 2.306 . 0 0 "[ . 1 . 2]" 1
135 1 99 ALA H 1 100 THR H . . 3.490 2.593 2.226 2.913 . 0 0 "[ . 1 . 2]" 1
136 1 70 GLY H 1 71 ASP H . . 4.450 2.462 1.867 3.668 . 0 0 "[ . 1 . 2]" 1
137 1 178 PHE H 1 179 GLY H . . 4.580 2.954 2.845 3.016 . 0 0 "[ . 1 . 2]" 1
138 1 189 THR H 1 191 TYR H . . 4.740 4.086 3.819 4.644 . 0 0 "[ . 1 . 2]" 1
139 1 26 SER H 1 27 THR H . . 4.280 2.577 2.526 2.698 . 0 0 "[ . 1 . 2]" 1
140 1 185 VAL H 1 186 GLY H . . 3.950 2.629 2.474 3.047 . 0 0 "[ . 1 . 2]" 1
141 1 159 ASN H 1 160 THR H . . 3.480 2.733 1.848 3.606 0.126 18 0 "[ . 1 . 2]" 1
142 1 194 GLY H 1 195 ASP H . . 3.540 2.568 1.955 3.225 . 0 0 "[ . 1 . 2]" 1
143 1 83 LEU H 1 84 THR H . . 4.440 2.212 2.092 2.428 . 0 0 "[ . 1 . 2]" 1
144 1 83 LEU H 1 85 VAL H . . 4.560 3.767 3.541 4.142 . 0 0 "[ . 1 . 2]" 1
145 1 103 ALA H 1 104 GLY H . . 4.420 4.147 3.898 4.489 0.069 17 0 "[ . 1 . 2]" 1
146 1 190 GLY H 1 192 LEU H . . 4.310 4.119 3.237 4.480 0.170 19 0 "[ . 1 . 2]" 1
147 1 152 GLY H 1 154 GLY H . . 5.000 4.494 3.681 5.164 0.164 4 0 "[ . 1 . 2]" 1
148 1 151 ALA H 1 152 GLY H . . 3.470 2.497 2.305 2.648 . 0 0 "[ . 1 . 2]" 1
149 1 51 VAL H 1 52 THR H . . 3.990 2.713 2.605 2.878 . 0 0 "[ . 1 . 2]" 1
150 1 124 GLY H 1 125 GLU H . . 3.690 2.614 2.481 2.773 . 0 0 "[ . 1 . 2]" 1
151 1 153 GLU H 1 154 GLY H . . 4.010 2.540 2.365 2.688 . 0 0 "[ . 1 . 2]" 1
152 1 121 GLY H 1 123 MET H . . 4.570 4.325 4.160 4.438 . 0 0 "[ . 1 . 2]" 1
153 1 48 SER H 1 49 GLY H . . 3.990 2.606 2.547 2.703 . 0 0 "[ . 1 . 2]" 1
154 1 49 GLY H 1 50 LEU H . . 3.690 2.607 2.538 2.752 . 0 0 "[ . 1 . 2]" 1
155 1 125 GLU H 1 127 GLY H . . 4.420 3.970 3.780 4.155 . 0 0 "[ . 1 . 2]" 1
156 1 179 GLY H 1 181 ALA H . . 4.510 3.994 3.927 4.101 . 0 0 "[ . 1 . 2]" 1
157 1 64 GLY H 1 65 VAL H . . 4.170 2.822 2.643 2.957 . 0 0 "[ . 1 . 2]" 1
158 1 217 PHE H 1 218 GLY H . . 4.300 2.922 2.818 2.998 . 0 0 "[ . 1 . 2]" 1
159 1 16 PHE H 1 17 TRP H . . 3.850 2.821 2.745 2.875 . 0 0 "[ . 1 . 2]" 1
160 1 18 LEU H 1 20 THR H . . 4.830 4.244 3.943 4.448 . 0 0 "[ . 1 . 2]" 1
161 1 21 ALA H 1 23 LEU H . . 4.510 4.334 3.821 4.493 . 0 0 "[ . 1 . 2]" 1
162 1 26 SER H 1 28 VAL H . . 4.540 4.196 3.846 4.447 . 0 0 "[ . 1 . 2]" 1
163 1 28 VAL H 1 30 PHE H . . 4.570 4.287 4.040 4.501 . 0 0 "[ . 1 . 2]" 1
164 1 30 PHE H 1 31 PHE H . . 3.560 2.616 2.516 2.718 . 0 0 "[ . 1 . 2]" 1
165 1 32 VAL H 1 33 GLU H . . 3.370 2.563 2.475 2.712 . 0 0 "[ . 1 . 2]" 1
166 1 40 LYS H 1 41 TRP H . . 3.390 2.635 2.398 2.685 . 0 0 "[ . 1 . 2]" 1
167 1 41 TRP H 1 42 LYS H . . 3.080 2.451 2.269 2.583 . 0 0 "[ . 1 . 2]" 1
168 1 43 THR H 1 44 SER H . . 4.560 2.503 2.423 2.780 . 0 0 "[ . 1 . 2]" 1
169 1 44 SER H 1 46 THR H . . 4.180 4.033 3.872 4.202 0.022 11 0 "[ . 1 . 2]" 1
170 1 45 LEU H 1 46 THR H . . 3.840 2.552 2.427 2.609 . 0 0 "[ . 1 . 2]" 1
171 1 51 VAL H 1 53 GLY H . . 4.380 3.949 3.744 4.053 . 0 0 "[ . 1 . 2]" 1
172 1 50 LEU H 1 51 VAL H . . 3.490 2.661 2.617 2.763 . 0 0 "[ . 1 . 2]" 1
173 1 53 GLY H 1 54 ILE H . . 4.080 2.743 2.557 3.009 . 0 0 "[ . 1 . 2]" 1
174 1 56 PHE H 1 57 TRP H . . 4.280 2.818 2.747 2.932 . 0 0 "[ . 1 . 2]" 1
175 1 66 TRP H 1 67 ILE H . . 3.810 2.754 2.527 2.965 . 0 0 "[ . 1 . 2]" 1
176 1 174 TYR H 1 175 ILE H . . 3.960 2.723 2.549 2.788 . 0 0 "[ . 1 . 2]" 1
177 1 74 THR H 1 76 PHE H . . 4.400 4.407 4.183 4.563 0.163 3 0 "[ . 1 . 2]" 1
178 1 101 ASN H 1 102 VAL H . . 3.650 2.826 1.893 3.510 . 0 0 "[ . 1 . 2]" 1
179 1 108 LYS H 1 110 LEU H . . 3.990 3.992 3.876 4.074 0.084 20 0 "[ . 1 . 2]" 1
180 1 130 ALA H 1 131 ALA H . . 3.810 2.598 1.607 4.410 0.600 12 3 "[ . -1 + *. 2]" 1
181 1 132 TRP H 1 134 ALA H . . 4.280 3.716 3.543 3.962 . 0 0 "[ . 1 . 2]" 1
182 1 138 GLY H 1 139 CYS H . . 4.280 2.739 2.620 2.885 . 0 0 "[ . 1 . 2]" 1
183 1 140 LEU H 1 141 ALA H . . 4.740 2.822 2.748 2.880 . 0 0 "[ . 1 . 2]" 1
184 1 139 CYS H 1 140 LEU H . . 4.320 2.788 2.704 2.892 . 0 0 "[ . 1 . 2]" 1
185 1 141 ALA H 1 142 TRP H . . 4.360 2.645 2.561 2.744 . 0 0 "[ . 1 . 2]" 1
186 1 150 TRP H 1 152 GLY H . . 4.600 4.186 4.014 4.317 . 0 0 "[ . 1 . 2]" 1
187 1 152 GLY H 1 153 GLU H . . 4.380 4.202 2.070 4.643 0.263 1 0 "[ . 1 . 2]" 1
188 1 154 GLY H 1 155 LYS H . . 4.340 2.808 2.426 3.227 . 0 0 "[ . 1 . 2]" 1
189 1 167 SER H 1 168 ALA H . . 3.550 2.638 2.606 2.693 . 0 0 "[ . 1 . 2]" 1
190 1 168 ALA H 1 169 TYR H . . 3.500 2.679 2.601 2.732 . 0 0 "[ . 1 . 2]" 1
191 1 169 TYR H 1 170 ASN H . . 3.520 2.705 2.625 2.798 . 0 0 "[ . 1 . 2]" 1
192 1 168 ALA H 1 170 ASN H . . 4.500 4.353 4.212 4.433 . 0 0 "[ . 1 . 2]" 1
193 1 188 PHE H 1 190 GLY H . . 4.550 4.232 3.726 4.467 . 0 0 "[ . 1 . 2]" 1
194 1 189 THR H 1 190 GLY H . . 4.290 2.728 2.519 2.828 . 0 0 "[ . 1 . 2]" 1
195 1 195 ASP H 1 196 GLY H . . 3.440 2.436 1.873 3.115 . 0 0 "[ . 1 . 2]" 1
196 1 194 GLY H 1 196 GLY H . . 4.520 4.080 2.880 4.560 0.040 8 0 "[ . 1 . 2]" 1
197 1 196 GLY H 1 197 GLY H . . 3.370 2.397 1.897 3.341 . 0 0 "[ . 1 . 2]" 1
198 1 195 ASP H 1 197 GLY H . . 4.020 3.841 2.430 4.081 0.061 8 0 "[ . 1 . 2]" 1
199 1 217 PHE H 1 219 LEU H . . 4.340 4.050 3.925 4.184 . 0 0 "[ . 1 . 2]" 1
200 1 218 GLY H 1 219 LEU H . . 3.850 2.648 2.554 2.766 . 0 0 "[ . 1 . 2]" 1
201 1 219 LEU H 1 221 ILE H . . 4.190 4.222 4.050 4.308 0.118 17 0 "[ . 1 . 2]" 1
202 1 222 TRP H 1 223 ASN H . . 3.550 2.532 2.472 2.758 . 0 0 "[ . 1 . 2]" 1
203 1 226 VAL H 1 227 LYS H . . 3.300 2.563 2.428 2.792 . 0 0 "[ . 1 . 2]" 1
204 1 225 ALA H 1 227 LYS H . . 4.500 4.035 3.785 4.229 . 0 0 "[ . 1 . 2]" 1
205 1 210 ASP H 1 211 PHE H . . 3.750 2.652 2.574 2.769 . 0 0 "[ . 1 . 2]" 1
206 1 179 GLY H 1 180 TRP H . . 4.510 2.893 2.721 2.992 . 0 0 "[ . 1 . 2]" 1
207 1 181 ALA H 1 182 ILE H . . 3.770 2.413 2.375 2.481 . 0 0 "[ . 1 . 2]" 1
208 1 173 MET H 1 174 TYR H . . 3.660 2.611 2.482 2.767 . 0 0 "[ . 1 . 2]" 1
209 1 78 TYR H 1 79 ILE H . . 3.700 2.787 2.613 2.887 . 0 0 "[ . 1 . 2]" 1
210 1 80 ASP H 1 82 LEU H . . 4.780 4.141 3.654 4.885 0.105 17 0 "[ . 1 . 2]" 1
211 1 149 LEU H 1 151 ALA H . . 4.350 4.153 3.800 4.410 0.060 8 0 "[ . 1 . 2]" 1
212 1 54 ILE H 1 56 PHE H . . 4.690 4.176 3.940 4.611 . 0 0 "[ . 1 . 2]" 1
213 1 15 SER H 1 17 TRP H . . 4.420 4.223 4.099 4.329 . 0 0 "[ . 1 . 2]" 1
214 1 10 ASP H 1 11 TYR H . . 3.650 2.973 2.871 3.130 . 0 0 "[ . 1 . 2]" 1
215 1 155 LYS H 1 157 ALA H . . 4.750 4.100 3.615 4.985 0.235 19 0 "[ . 1 . 2]" 1
216 1 45 LEU H 1 47 VAL H . . 4.500 4.484 4.319 4.555 0.055 14 0 "[ . 1 . 2]" 1
217 1 27 THR H 1 29 PHE H . . 4.420 4.070 3.898 4.370 . 0 0 "[ . 1 . 2]" 1
218 1 159 ASN H 1 161 ALA H . . 3.480 3.239 2.275 3.655 0.175 9 0 "[ . 1 . 2]" 1
219 1 42 LYS H 1 44 SER H . . 4.420 4.052 3.897 4.386 . 0 0 "[ . 1 . 2]" 1
220 1 134 ALA H 1 136 ILE H . . 4.500 4.101 3.764 4.610 0.110 11 0 "[ . 1 . 2]" 1
221 1 214 . H 1 216 LEU H . . 4.680 3.497 3.254 4.264 . 0 0 "[ . 1 . 2]" 1
222 1 39 ALA H 1 41 TRP H . . 4.390 3.831 3.712 4.240 . 0 0 "[ . 1 . 2]" 1
223 1 108 LYS H 1 109 LYS H . . 3.420 2.796 2.618 2.923 . 0 0 "[ . 1 . 2]" 1
224 1 120 PHE H 1 121 GLY H . . 4.060 2.715 2.561 2.839 . 0 0 "[ . 1 . 2]" 1
225 1 118 LEU H 1 120 PHE H . . 4.300 4.173 3.903 4.324 0.024 19 0 "[ . 1 . 2]" 1
226 1 215 ILE H 1 217 PHE H . . 4.650 3.860 3.460 4.097 . 0 0 "[ . 1 . 2]" 1
227 1 202 LEU H 1 204 LEU H . . 4.240 4.102 3.846 4.296 0.056 15 0 "[ . 1 . 2]" 1
stop_
save_
save_distance_constraint_statistics_2
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 2
_Distance_constraint_stats_list.Constraint_count 421
_Distance_constraint_stats_list.Viol_count 954
_Distance_constraint_stats_list.Viol_total 4575.909
_Distance_constraint_stats_list.Viol_max 7.444
_Distance_constraint_stats_list.Viol_rms 0.3220
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0272
_Distance_constraint_stats_list.Viol_average_violations_only 0.2398
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details .
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 6 LEU 0.102 0.049 4 0 "[ . 1 . 2]"
1 8 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 9 SER 0.053 0.053 2 0 "[ . 1 . 2]"
1 13 GLY 0.156 0.079 1 0 "[ . 1 . 2]"
1 14 VAL 0.001 0.001 12 0 "[ . 1 . 2]"
1 15 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 16 PHE 0.083 0.017 11 0 "[ . 1 . 2]"
1 18 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 21 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 22 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 23 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 24 LEU 1.909 0.166 6 0 "[ . 1 . 2]"
1 25 ALA 0.410 0.199 16 0 "[ . 1 . 2]"
1 26 SER 0.185 0.040 20 0 "[ . 1 . 2]"
1 27 THR 0.067 0.034 7 0 "[ . 1 . 2]"
1 28 VAL 0.459 0.199 16 0 "[ . 1 . 2]"
1 29 PHE 0.318 0.056 19 0 "[ . 1 . 2]"
1 30 PHE 1.143 0.126 11 0 "[ . 1 . 2]"
1 31 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 37 VAL 6.291 0.218 20 0 "[ . 1 . 2]"
1 38 SER 0.813 0.120 19 0 "[ . 1 . 2]"
1 39 ALA 0.326 0.071 13 0 "[ . 1 . 2]"
1 41 TRP 2.168 0.186 8 0 "[ . 1 . 2]"
1 44 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 45 LEU 1.067 0.255 13 0 "[ . 1 . 2]"
1 46 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 48 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 49 GLY 1.390 0.165 11 0 "[ . 1 . 2]"
1 50 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 51 VAL 0.159 0.055 6 0 "[ . 1 . 2]"
1 53 GLY 2.341 0.200 1 0 "[ . 1 . 2]"
1 54 ILE 0.825 0.197 8 0 "[ . 1 . 2]"
1 55 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 56 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 58 HIS 1.194 0.138 9 0 "[ . 1 . 2]"
1 64 GLY 0.423 0.107 20 0 "[ . 1 . 2]"
1 65 VAL 2.655 0.143 8 0 "[ . 1 . 2]"
1 66 TRP 0.250 0.098 14 0 "[ . 1 . 2]"
1 67 ILE 0.250 0.098 14 0 "[ . 1 . 2]"
1 69 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 70 GLY 0.418 0.089 19 0 "[ . 1 . 2]"
1 72 SER 0.637 0.111 4 0 "[ . 1 . 2]"
1 74 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 75 VAL 0.019 0.019 17 0 "[ . 1 . 2]"
1 76 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 78 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
1 79 ILE 0.045 0.026 6 0 "[ . 1 . 2]"
1 80 ASP 4.341 0.256 19 0 "[ . 1 . 2]"
1 82 LEU 0.197 0.100 5 0 "[ . 1 . 2]"
1 83 LEU 1.475 0.148 11 0 "[ . 1 . 2]"
1 84 THR 0.711 0.197 8 0 "[ . 1 . 2]"
1 85 VAL 1.284 0.154 5 0 "[ . 1 . 2]"
1 87 LEU 0.981 0.142 18 0 "[ . 1 . 2]"
1 88 LEU 0.881 0.119 8 0 "[ . 1 . 2]"
1 92 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 94 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 96 LEU 0.243 0.058 15 0 "[ . 1 . 2]"
1 97 ALA 1.679 0.120 19 0 "[ . 1 . 2]"
1 98 ALA 0.077 0.064 19 0 "[ . 1 . 2]"
1 99 ALA 1.183 0.172 18 0 "[ . 1 . 2]"
1 100 THR 0.770 0.127 17 0 "[ . 1 . 2]"
1 102 VAL 0.588 0.127 17 0 "[ . 1 . 2]"
1 103 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 104 GLY 5.065 0.200 1 0 "[ . 1 . 2]"
1 106 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 107 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 110 LEU 119.361 7.444 15 20 [*************-+*****]
1 111 LEU 0.162 0.067 3 0 "[ . 1 . 2]"
1 113 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 114 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 115 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 116 VAL 0.041 0.025 13 0 "[ . 1 . 2]"
1 118 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 119 VAL 0.314 0.080 20 0 "[ . 1 . 2]"
1 120 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 121 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 122 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
1 123 MET 0.087 0.060 8 0 "[ . 1 . 2]"
1 124 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 126 ALA 2.574 0.205 12 0 "[ . 1 . 2]"
1 127 GLY 0.093 0.042 18 0 "[ . 1 . 2]"
1 128 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 129 MET 4.882 1.007 9 1 "[ . +1 . 2]"
1 130 ALA 1.736 1.007 9 1 "[ . +1 . 2]"
1 131 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 132 TRP 7.563 0.504 13 1 "[ . 1 + . 2]"
1 134 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 135 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 136 ILE 6.769 0.504 13 1 "[ . 1 + . 2]"
1 137 ILE 124.104 7.444 15 20 [*************-+*****]
1 138 GLY 1.320 0.227 18 0 "[ . 1 . 2]"
1 140 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 141 ALA 0.041 0.025 13 0 "[ . 1 . 2]"
1 142 TRP 1.949 0.155 3 0 "[ . 1 . 2]"
1 143 VAL 0.953 0.174 15 0 "[ . 1 . 2]"
1 146 ILE 5.929 0.328 1 0 "[ . 1 . 2]"
1 149 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 150 TRP 6.312 0.328 1 0 "[ . 1 . 2]"
1 151 ALA 1.030 0.123 13 0 "[ . 1 . 2]"
1 152 GLY 3.571 0.227 18 0 "[ . 1 . 2]"
1 154 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 156 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 157 ALA 0.861 0.113 6 0 "[ . 1 . 2]"
1 161 ALA 0.069 0.032 9 0 "[ . 1 . 2]"
1 162 SER 1.397 0.119 19 0 "[ . 1 . 2]"
1 164 ALA 0.483 0.092 6 0 "[ . 1 . 2]"
1 165 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 167 SER 0.819 0.102 3 0 "[ . 1 . 2]"
1 168 ALA 1.553 0.128 18 0 "[ . 1 . 2]"
1 171 THR 0.000 0.000 . 0 "[ . 1 . 2]"
1 172 MET 0.078 0.020 11 0 "[ . 1 . 2]"
1 173 MET 0.696 0.091 14 0 "[ . 1 . 2]"
1 175 ILE 0.058 0.018 10 0 "[ . 1 . 2]"
1 176 ILE 0.103 0.025 4 0 "[ . 1 . 2]"
1 177 ILE 1.562 0.263 5 0 "[ . 1 . 2]"
1 178 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 179 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 180 TRP 2.230 0.154 5 0 "[ . 1 . 2]"
1 181 ALA 0.215 0.090 19 0 "[ . 1 . 2]"
1 182 ILE 0.142 0.091 17 0 "[ . 1 . 2]"
1 183 TYR 43.316 4.130 16 15 "[****** * * * *+*-**]"
1 185 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 186 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 187 TYR 0.000 0.000 . 0 "[ . 1 . 2]"
1 189 THR 1.371 0.205 12 0 "[ . 1 . 2]"
1 190 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
1 192 LEU 2.411 0.252 1 0 "[ . 1 . 2]"
1 193 MET 0.397 0.079 1 0 "[ . 1 . 2]"
1 194 GLY 0.053 0.053 2 0 "[ . 1 . 2]"
1 196 GLY 0.032 0.032 5 0 "[ . 1 . 2]"
1 197 GLY 0.120 0.030 8 0 "[ . 1 . 2]"
1 198 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 199 ALA 0.002 0.002 10 0 "[ . 1 . 2]"
1 200 LEU 0.029 0.014 1 0 "[ . 1 . 2]"
1 202 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 204 LEU 2.716 0.154 6 0 "[ . 1 . 2]"
1 205 ILE 0.154 0.043 1 0 "[ . 1 . 2]"
1 208 LEU 0.041 0.027 3 0 "[ . 1 . 2]"
1 209 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 210 ASP 1.301 0.655 18 1 "[ . 1 . + 2]"
1 212 VAL 0.177 0.091 17 0 "[ . 1 . 2]"
1 214 . 47.515 4.130 16 15 "[****** * * * *+*-**]"
1 215 ILE 0.080 0.059 18 0 "[ . 1 . 2]"
1 216 LEU 0.115 0.059 18 0 "[ . 1 . 2]"
1 217 PHE 0.889 0.143 8 0 "[ . 1 . 2]"
1 218 GLY 0.199 0.140 8 0 "[ . 1 . 2]"
1 219 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 220 ILE 1.734 0.153 17 0 "[ . 1 . 2]"
1 221 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 222 TRP 2.212 0.339 17 0 "[ . 1 . 2]"
1 224 VAL 2.829 0.186 8 0 "[ . 1 . 2]"
1 225 ALA 1.481 0.255 13 0 "[ . 1 . 2]"
1 226 VAL 3.674 0.339 17 0 "[ . 1 . 2]"
1 229 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 230 SER 0.032 0.016 9 0 "[ . 1 . 2]"
1 232 ALA 0.018 0.018 7 0 "[ . 1 . 2]"
1 235 GLY 0.000 0.000 . 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 6 LEU MD1 1 14 VAL MG1 . . 5.000 4.425 2.737 5.000 0.000 20 0 "[ . 1 . 2]" 2
2 1 6 LEU MD1 1 14 VAL MG2 . . 5.000 3.848 2.390 4.999 . 0 0 "[ . 1 . 2]" 2
3 1 6 LEU MD2 1 14 VAL MG1 . . 5.000 4.401 3.096 5.001 0.001 12 0 "[ . 1 . 2]" 2
4 1 6 LEU MD2 1 14 VAL MG2 . . 5.000 3.527 2.712 4.472 . 0 0 "[ . 1 . 2]" 2
5 1 24 LEU MD1 1 27 THR HG1 . . 5.000 4.417 2.786 5.034 0.034 7 0 "[ . 1 . 2]" 2
6 1 24 LEU MD2 1 25 ALA MB . . 5.000 4.241 3.452 4.951 . 0 0 "[ . 1 . 2]" 2
7 1 25 ALA MB 1 28 VAL MG2 . . 5.000 3.769 3.160 5.199 0.199 16 0 "[ . 1 . 2]" 2
8 1 24 LEU MD1 1 28 VAL MG1 . . 5.000 3.543 2.248 5.002 0.002 12 0 "[ . 1 . 2]" 2
9 1 24 LEU MD2 1 28 VAL MG1 . . 5.000 3.860 2.778 5.042 0.042 7 0 "[ . 1 . 2]" 2
10 1 37 VAL MG1 1 45 LEU MD1 . . 5.000 3.018 1.727 4.294 . 0 0 "[ . 1 . 2]" 2
11 1 37 VAL MG1 1 45 LEU MD2 . . 5.000 2.355 1.721 3.368 . 0 0 "[ . 1 . 2]" 2
12 1 37 VAL MG2 1 45 LEU MD1 . . 5.000 2.816 1.713 4.006 . 0 0 "[ . 1 . 2]" 2
13 1 37 VAL MG2 1 45 LEU MD2 . . 5.000 2.267 1.753 3.253 . 0 0 "[ . 1 . 2]" 2
14 1 37 VAL MG1 1 225 ALA MB . . 5.000 4.431 3.735 4.871 . 0 0 "[ . 1 . 2]" 2
15 1 37 VAL MG2 1 225 ALA MB . . 5.000 3.491 2.230 4.932 . 0 0 "[ . 1 . 2]" 2
16 1 37 VAL MG2 1 45 LEU HG . . 5.000 3.556 2.349 5.005 0.005 16 0 "[ . 1 . 2]" 2
17 1 37 VAL MG1 1 226 VAL MG2 . . 5.000 3.055 1.883 4.056 . 0 0 "[ . 1 . 2]" 2
18 1 37 VAL MG1 1 226 VAL MG1 . . 5.000 4.393 2.990 5.218 0.218 20 0 "[ . 1 . 2]" 2
19 1 37 VAL MG2 1 41 TRP HD1 . . 5.000 4.868 4.303 5.180 0.180 13 0 "[ . 1 . 2]" 2
20 1 37 VAL MG1 1 222 TRP HD1 . . 5.000 4.078 1.910 5.060 0.060 15 0 "[ . 1 . 2]" 2
21 1 45 LEU MD1 1 225 ALA MB . . 5.000 4.129 2.701 5.025 0.025 15 0 "[ . 1 . 2]" 2
22 1 45 LEU MD1 1 226 VAL MG2 . . 5.000 4.249 3.228 5.053 0.053 8 0 "[ . 1 . 2]" 2
23 1 45 LEU MD2 1 225 ALA MB . . 5.000 4.160 3.028 5.255 0.255 13 0 "[ . 1 . 2]" 2
24 1 45 LEU MD1 1 222 TRP HD1 . . 5.000 3.554 2.003 5.210 0.210 13 0 "[ . 1 . 2]" 2
25 1 45 LEU MD2 1 222 TRP HD1 . . 5.000 3.409 1.909 4.912 . 0 0 "[ . 1 . 2]" 2
26 1 46 THR MG 1 50 LEU MD1 . . 5.000 3.093 1.964 4.825 . 0 0 "[ . 1 . 2]" 2
27 1 51 VAL MG2 1 87 LEU MD1 . . 5.000 2.885 1.780 4.372 . 0 0 "[ . 1 . 2]" 2
28 1 51 VAL MG2 1 87 LEU MD2 . . 5.000 3.404 1.944 4.674 . 0 0 "[ . 1 . 2]" 2
29 1 51 VAL MG1 1 88 LEU MD1 . . 5.000 4.173 3.412 5.019 0.019 4 0 "[ . 1 . 2]" 2
30 1 51 VAL MG1 1 84 THR MG . . 5.000 3.882 1.731 5.055 0.055 6 0 "[ . 1 . 2]" 2
31 1 51 VAL MG2 1 83 LEU MD2 . . 5.000 4.459 3.581 5.037 0.037 18 0 "[ . 1 . 2]" 2
32 1 54 ILE MD 1 84 THR MG . . 5.000 4.719 3.073 5.126 0.126 5 0 "[ . 1 . 2]" 2
33 1 54 ILE MG 1 84 THR MG . . 5.000 4.058 2.833 5.197 0.197 8 0 "[ . 1 . 2]" 2
34 1 65 VAL MG1 1 69 THR MG . . 5.000 4.133 3.270 4.874 . 0 0 "[ . 1 . 2]" 2
35 1 66 TRP HD1 1 67 ILE MD . . 5.000 4.576 3.207 5.098 0.098 14 0 "[ . 1 . 2]" 2
36 1 75 VAL MG2 1 79 ILE MD . . 5.000 3.578 1.787 5.019 0.019 17 0 "[ . 1 . 2]" 2
37 1 79 ILE MG 1 83 LEU MD1 . . 5.000 2.936 2.453 5.026 0.026 6 0 "[ . 1 . 2]" 2
38 1 75 VAL MG1 1 79 ILE MD . . 5.000 3.236 1.778 4.285 . 0 0 "[ . 1 . 2]" 2
39 1 54 ILE MD 1 83 LEU MD2 . . 5.000 4.233 2.013 5.064 0.064 18 0 "[ . 1 . 2]" 2
40 1 85 VAL MG1 1 180 TRP HZ2 . . 5.000 5.014 4.212 5.154 0.154 5 0 "[ . 1 . 2]" 2
41 1 51 VAL MG1 1 88 LEU MD2 . . 5.000 3.507 2.623 4.859 . 0 0 "[ . 1 . 2]" 2
42 1 88 LEU MD1 1 180 TRP HZ2 . . 5.000 5.042 4.987 5.119 0.119 8 0 "[ . 1 . 2]" 2
43 1 96 LEU MD1 1 100 THR MG . . 5.000 4.631 2.436 5.058 0.058 15 0 "[ . 1 . 2]" 2
44 1 97 ALA MB 1 102 VAL MG1 . . 5.000 3.741 2.533 5.062 0.062 6 0 "[ . 1 . 2]" 2
45 1 97 ALA MB 1 102 VAL MG2 . . 5.000 4.178 3.328 4.788 . 0 0 "[ . 1 . 2]" 2
46 1 99 ALA MB 1 100 THR MG . . 5.000 3.004 2.133 4.709 . 0 0 "[ . 1 . 2]" 2
47 1 100 THR MG 1 102 VAL MG2 . . 5.000 4.647 1.952 5.127 0.127 17 0 "[ . 1 . 2]" 2
48 1 102 VAL MG2 1 103 ALA MB . . 5.000 4.371 3.158 4.939 . 0 0 "[ . 1 . 2]" 2
49 1 115 LEU QD 1 119 VAL MG2 . . 5.000 2.729 2.149 3.815 . 0 0 "[ . 1 . 2]" 2
50 1 116 VAL MG2 1 141 ALA MB . . 5.000 3.529 1.926 5.025 0.025 13 0 "[ . 1 . 2]" 2
51 1 119 VAL MG1 1 123 MET ME . . 5.000 2.925 1.766 5.027 0.027 20 0 "[ . 1 . 2]" 2
52 1 119 VAL MG2 1 123 MET ME . . 5.000 4.088 3.358 4.864 . 0 0 "[ . 1 . 2]" 2
53 1 119 VAL MG1 1 129 MET ME . . 5.000 4.314 2.993 5.080 0.080 20 0 "[ . 1 . 2]" 2
54 1 123 MET ME 1 129 MET ME . . 5.000 2.870 1.792 5.060 0.060 8 0 "[ . 1 . 2]" 2
55 1 123 MET ME 1 137 ILE MD . . 5.000 3.651 1.896 4.967 . 0 0 "[ . 1 . 2]" 2
56 1 126 ALA MB 1 128 ILE MD . . 5.000 3.059 1.801 4.778 . 0 0 "[ . 1 . 2]" 2
57 1 131 ALA MB 1 192 LEU MD2 . . 5.000 3.832 2.338 4.986 . 0 0 "[ . 1 . 2]" 2
58 1 136 ILE MG 1 140 LEU MD2 . . 5.000 3.425 2.013 4.985 . 0 0 "[ . 1 . 2]" 2
59 1 136 ILE MD 1 137 ILE MD . . 5.000 5.026 4.238 5.273 0.273 18 0 "[ . 1 . 2]" 2
60 1 132 TRP HE3 1 136 ILE MD . . 5.000 5.005 2.646 5.504 0.504 13 1 "[ . 1 + . 2]" 2
61 1 132 TRP HD1 1 136 ILE MD . . 5.000 5.015 4.568 5.360 0.360 7 0 "[ . 1 . 2]" 2
62 1 129 MET ME 1 137 ILE MD . . 5.000 3.917 1.848 5.140 0.140 18 0 "[ . 1 . 2]" 2
63 1 129 MET ME 1 137 ILE MG . . 5.000 5.082 4.307 5.425 0.425 8 0 "[ . 1 . 2]" 2
64 1 140 LEU MD2 1 143 VAL MG2 . . 5.000 4.171 3.699 4.720 . 0 0 "[ . 1 . 2]" 2
65 1 143 VAL MG1 1 146 ILE MD . . 5.000 4.833 4.171 5.102 0.102 12 0 "[ . 1 . 2]" 2
66 1 143 VAL MG2 1 146 ILE MD . . 5.000 4.602 3.853 5.174 0.174 15 0 "[ . 1 . 2]" 2
67 1 142 TRP HE3 1 143 VAL MG2 . . 5.000 2.943 2.392 4.537 . 0 0 "[ . 1 . 2]" 2
68 1 146 ILE MG 1 173 MET ME . . 5.000 2.437 1.744 3.125 . 0 0 "[ . 1 . 2]" 2
69 1 142 TRP HD1 1 146 ILE MD . . 5.000 2.148 1.865 3.099 . 0 0 "[ . 1 . 2]" 2
70 1 142 TRP HD1 1 146 ILE MG . . 5.000 5.079 5.029 5.155 0.155 3 0 "[ . 1 . 2]" 2
71 1 142 TRP HZ2 1 146 ILE MD . . 5.000 4.437 3.423 5.045 0.045 4 0 "[ . 1 . 2]" 2
72 1 146 ILE MG 1 150 TRP HD1 . . 5.000 5.161 5.025 5.328 0.328 1 0 "[ . 1 . 2]" 2
73 1 146 ILE MD 1 177 ILE MG . . 5.000 3.194 1.835 4.372 . 0 0 "[ . 1 . 2]" 2
74 1 146 ILE MG 1 177 ILE MD . . 5.000 2.588 1.874 4.241 . 0 0 "[ . 1 . 2]" 2
75 1 146 ILE MG 1 177 ILE MG . . 5.000 4.250 3.664 5.028 0.028 3 0 "[ . 1 . 2]" 2
76 1 150 TRP HD1 1 151 ALA MB . . 5.000 5.001 4.649 5.123 0.123 13 0 "[ . 1 . 2]" 2
77 1 99 ALA MB 1 157 ALA MB . . 5.000 4.938 3.304 5.113 0.113 6 0 "[ . 1 . 2]" 2
78 1 41 TRP HD1 1 164 ALA MB . . 5.000 4.948 4.558 5.092 0.092 6 0 "[ . 1 . 2]" 2
79 1 41 TRP HZ2 1 164 ALA MB . . 5.000 3.923 3.201 5.018 0.018 5 0 "[ . 1 . 2]" 2
80 1 99 ALA MB 1 165 VAL QG . . 5.000 2.217 1.608 3.247 . 0 0 "[ . 1 . 2]" 2
81 1 161 ALA MB 1 165 VAL QG . . 5.000 3.085 2.615 3.934 . 0 0 "[ . 1 . 2]" 2
82 1 41 TRP HZ2 1 165 VAL QG . . 5.000 4.148 3.110 4.740 . 0 0 "[ . 1 . 2]" 2
83 1 168 ALA MB 1 224 VAL MG2 . . 5.000 3.137 2.228 3.863 . 0 0 "[ . 1 . 2]" 2
84 1 172 MET ME 1 175 ILE MG . . 5.000 3.931 1.953 5.018 0.018 10 0 "[ . 1 . 2]" 2
85 1 173 MET ME 1 177 ILE MD . . 5.000 2.515 1.831 4.510 . 0 0 "[ . 1 . 2]" 2
86 1 150 TRP HD1 1 173 MET ME . . 5.000 4.711 3.515 5.091 0.091 14 0 "[ . 1 . 2]" 2
87 1 150 TRP HE3 1 173 MET ME . . 5.000 3.408 1.960 4.818 . 0 0 "[ . 1 . 2]" 2
88 1 150 TRP HZ2 1 173 MET ME . . 5.000 4.179 2.424 5.020 0.020 14 0 "[ . 1 . 2]" 2
89 1 150 TRP HZ3 1 173 MET ME . . 5.000 3.811 2.604 5.026 0.026 7 0 "[ . 1 . 2]" 2
90 1 172 MET ME 1 175 ILE MD . . 5.000 4.292 1.903 5.006 0.006 7 0 "[ . 1 . 2]" 2
91 1 172 MET ME 1 176 ILE MD . . 5.000 3.001 1.885 5.020 0.020 11 0 "[ . 1 . 2]" 2
92 1 176 ILE MD 1 180 TRP HZ2 . . 5.000 4.231 2.691 5.025 0.025 4 0 "[ . 1 . 2]" 2
93 1 150 TRP HE3 1 177 ILE MD . . 5.000 4.964 4.079 5.263 0.263 5 0 "[ . 1 . 2]" 2
94 1 173 MET ME 1 177 ILE MG . . 5.000 4.625 4.011 5.041 0.041 3 0 "[ . 1 . 2]" 2
95 1 146 ILE MD 1 177 ILE MD . . 5.000 2.647 1.846 4.084 . 0 0 "[ . 1 . 2]" 2
96 1 142 TRP HH2 1 181 ALA MB . . 5.000 4.170 2.864 5.090 0.090 19 0 "[ . 1 . 2]" 2
97 1 142 TRP HZ2 1 181 ALA MB . . 5.000 3.902 2.415 4.813 . 0 0 "[ . 1 . 2]" 2
98 1 182 ILE MD 1 212 VAL MG2 . . 5.000 4.231 2.707 5.091 0.091 17 0 "[ . 1 . 2]" 2
99 1 181 ALA MB 1 185 VAL MG2 . . 5.000 3.458 3.031 3.913 . 0 0 "[ . 1 . 2]" 2
100 1 189 THR HG1 1 193 MET ME . . 5.000 4.620 2.907 5.047 0.047 4 0 "[ . 1 . 2]" 2
101 1 189 THR HG1 1 205 ILE MD . . 5.000 4.631 3.338 5.043 0.043 1 0 "[ . 1 . 2]" 2
102 1 132 TRP HE3 1 192 LEU MD1 . . 5.000 3.821 2.143 5.096 0.096 18 0 "[ . 1 . 2]" 2
103 1 132 TRP HZ2 1 192 LEU MD1 . . 5.000 4.238 2.089 5.128 0.128 5 0 "[ . 1 . 2]" 2
104 1 132 TRP HD1 1 192 LEU MD1 . . 5.000 4.468 2.152 5.252 0.252 1 0 "[ . 1 . 2]" 2
105 1 132 TRP HE3 1 192 LEU MD2 . . 5.000 4.645 2.386 5.228 0.228 12 0 "[ . 1 . 2]" 2
106 1 189 THR MG 1 204 LEU MD1 . . 5.000 4.978 4.555 5.077 0.077 11 0 "[ . 1 . 2]" 2
107 1 208 LEU MD1 1 212 VAL MG2 . . 5.000 3.597 1.997 4.863 . 0 0 "[ . 1 . 2]" 2
108 1 212 VAL MG1 1 216 LEU MD1 . . 5.000 3.178 1.820 4.714 . 0 0 "[ . 1 . 2]" 2
109 1 212 VAL MG2 1 216 LEU MD1 . . 5.000 3.956 1.986 5.024 0.024 17 0 "[ . 1 . 2]" 2
110 1 215 ILE MG 1 216 LEU MD2 . . 5.000 4.072 2.760 5.059 0.059 18 0 "[ . 1 . 2]" 2
111 1 220 ILE MD 1 224 VAL MG2 . . 5.000 5.054 4.337 5.153 0.153 17 0 "[ . 1 . 2]" 2
112 1 171 THR MG 1 220 ILE MG . . 5.000 2.336 1.697 3.224 . 0 0 "[ . 1 . 2]" 2
113 1 220 ILE MG 1 224 VAL MG2 . . 5.000 4.245 2.652 4.803 . 0 0 "[ . 1 . 2]" 2
114 1 41 TRP HE3 1 221 ILE MG . . 5.000 3.302 2.563 4.883 . 0 0 "[ . 1 . 2]" 2
115 1 41 TRP HZ3 1 221 ILE MG . . 5.000 2.293 1.891 4.705 . 0 0 "[ . 1 . 2]" 2
116 1 168 ALA MB 1 224 VAL MG1 . . 5.000 2.605 2.147 3.308 . 0 0 "[ . 1 . 2]" 2
117 1 41 TRP HZ2 1 224 VAL MG1 . . 5.000 4.347 3.721 4.867 . 0 0 "[ . 1 . 2]" 2
118 1 41 TRP HZ2 1 224 VAL MG2 . . 5.000 5.038 4.720 5.186 0.186 8 0 "[ . 1 . 2]" 2
119 1 225 ALA MB 1 226 VAL MG1 . . 5.000 4.876 4.725 4.959 . 0 0 "[ . 1 . 2]" 2
120 1 225 ALA MB 1 226 VAL MG2 . . 5.000 2.971 2.753 3.167 . 0 0 "[ . 1 . 2]" 2
121 1 37 VAL MG2 1 226 VAL MG1 . . 5.000 4.374 3.449 5.161 0.161 19 0 "[ . 1 . 2]" 2
122 1 37 VAL MG2 1 226 VAL MG2 . . 5.000 2.654 1.766 3.909 . 0 0 "[ . 1 . 2]" 2
123 1 45 LEU MD2 1 226 VAL MG2 . . 5.000 4.030 3.467 4.695 . 0 0 "[ . 1 . 2]" 2
124 1 222 TRP HD1 1 226 VAL MG2 . . 5.000 3.675 2.800 5.265 0.265 15 0 "[ . 1 . 2]" 2
125 1 222 TRP HZ3 1 226 VAL MG2 . . 5.000 4.711 3.682 5.339 0.339 17 0 "[ . 1 . 2]" 2
126 1 129 MET ME 1 130 ALA MB . . 5.000 3.271 1.721 6.007 1.007 9 1 "[ . +1 . 2]" 2
127 1 110 LEU QD 1 137 ILE MG . . 5.000 10.968 9.197 12.444 7.444 15 20 [*************-+*****] 2
128 1 124 GLY H 1 126 ALA CB . . 13.000 7.042 6.532 7.698 . 0 0 "[ . 1 . 2]" 2
129 1 126 ALA CB 1 127 GLY H . . 13.000 3.323 3.245 3.837 . 0 0 "[ . 1 . 2]" 2
130 1 72 SER H 1 126 ALA CB . . 13.000 12.760 11.671 13.111 0.111 4 0 "[ . 1 . 2]" 2
131 1 38 SER H 1 168 ALA CB . . 13.000 10.182 9.648 10.587 . 0 0 "[ . 1 . 2]" 2
132 1 39 ALA H 1 168 ALA CB . . 13.000 12.510 12.120 13.000 . 0 0 "[ . 1 . 2]" 2
133 1 44 SER H 1 168 ALA CB . . 13.000 11.032 10.406 11.749 . 0 0 "[ . 1 . 2]" 2
134 1 162 SER H 1 168 ALA CB . . 13.000 9.400 9.055 9.694 . 0 0 "[ . 1 . 2]" 2
135 1 168 ALA CB 1 218 GLY H . . 13.000 12.093 11.646 12.545 . 0 0 "[ . 1 . 2]" 2
136 1 168 ALA CB 1 219 LEU H . . 13.000 12.022 11.644 12.471 . 0 0 "[ . 1 . 2]" 2
137 1 168 ALA CB 1 225 ALA H . . 13.000 5.733 5.355 6.392 . 0 0 "[ . 1 . 2]" 2
138 1 168 ALA CB 1 230 SER H . . 13.000 11.632 10.865 12.457 . 0 0 "[ . 1 . 2]" 2
139 1 39 ALA H 1 225 ALA CB . . 13.000 8.123 7.073 8.746 . 0 0 "[ . 1 . 2]" 2
140 1 49 GLY H 1 225 ALA CB . . 13.000 10.960 9.971 11.801 . 0 0 "[ . 1 . 2]" 2
141 1 99 ALA H 1 225 ALA CB . . 13.000 12.314 11.360 13.010 0.010 16 0 "[ . 1 . 2]" 2
142 1 162 SER H 1 225 ALA CB . . 13.000 13.038 12.973 13.119 0.119 19 0 "[ . 1 . 2]" 2
143 1 167 SER H 1 225 ALA CB . . 13.000 9.297 8.920 9.879 . 0 0 "[ . 1 . 2]" 2
144 1 218 GLY H 1 225 ALA CB . . 13.000 11.203 10.823 11.622 . 0 0 "[ . 1 . 2]" 2
145 1 225 ALA CB 1 229 SER H . . 13.000 5.259 5.111 5.479 . 0 0 "[ . 1 . 2]" 2
146 1 225 ALA CB 1 230 SER H . . 13.000 7.636 6.972 8.127 . 0 0 "[ . 1 . 2]" 2
147 1 225 ALA CB 1 232 ALA H . . 13.000 12.082 9.894 12.931 . 0 0 "[ . 1 . 2]" 2
148 1 6 LEU H 1 9 SER CB . . 13.000 10.901 9.991 11.775 . 0 0 "[ . 1 . 2]" 2
149 1 8 ALA H 1 9 SER CB . . 13.000 5.339 5.087 5.593 . 0 0 "[ . 1 . 2]" 2
150 1 9 SER CB 1 13 GLY H . . 13.000 5.040 4.721 5.301 . 0 0 "[ . 1 . 2]" 2
151 1 75 VAL CB 1 76 PHE H . . 13.000 3.067 2.900 3.219 . 0 0 "[ . 1 . 2]" 2
152 1 75 VAL CB 1 82 LEU H . . 13.000 9.881 9.533 10.155 . 0 0 "[ . 1 . 2]" 2
153 1 75 VAL CB 1 83 LEU H . . 13.000 10.949 10.594 11.211 . 0 0 "[ . 1 . 2]" 2
154 1 74 THR H 1 126 ALA CB . . 13.000 11.735 9.388 12.600 . 0 0 "[ . 1 . 2]" 2
155 1 122 TYR H 1 126 ALA CB . . 13.000 9.456 8.840 10.392 . 0 0 "[ . 1 . 2]" 2
156 1 126 ALA CB 1 129 MET H . . 13.000 5.055 4.157 6.927 . 0 0 "[ . 1 . 2]" 2
157 1 103 ALA H 1 104 GLY HA3 . . 13.000 5.686 5.383 6.218 . 0 0 "[ . 1 . 2]" 2
158 1 104 GLY HA3 1 106 LEU H . . 13.000 4.426 4.194 4.653 . 0 0 "[ . 1 . 2]" 2
159 1 104 GLY HA3 1 107 PHE H . . 13.000 4.392 4.160 4.707 . 0 0 "[ . 1 . 2]" 2
160 1 104 GLY HA3 1 110 LEU H . . 13.000 8.609 8.335 9.142 . 0 0 "[ . 1 . 2]" 2
161 1 104 GLY HA3 1 111 LEU H . . 13.000 9.726 9.392 10.411 . 0 0 "[ . 1 . 2]" 2
162 1 104 GLY HA3 1 154 GLY H . . 13.000 7.732 5.133 12.231 . 0 0 "[ . 1 . 2]" 2
163 1 104 GLY HA3 1 156 SER H . . 13.000 10.031 7.078 12.135 . 0 0 "[ . 1 . 2]" 2
164 1 104 GLY HA3 1 157 ALA H . . 13.000 10.315 7.713 12.816 . 0 0 "[ . 1 . 2]" 2
165 1 29 PHE H 1 37 VAL CB . . 13.000 12.980 12.699 13.056 0.056 19 0 "[ . 1 . 2]" 2
166 1 30 PHE H 1 37 VAL CB . . 13.000 10.802 10.493 10.951 . 0 0 "[ . 1 . 2]" 2
167 1 31 PHE H 1 37 VAL CB . . 13.000 10.491 10.289 10.730 . 0 0 "[ . 1 . 2]" 2
168 1 37 VAL CB 1 38 SER H . . 13.000 2.786 2.524 3.102 . 0 0 "[ . 1 . 2]" 2
169 1 37 VAL CB 1 39 ALA H . . 13.000 6.475 6.385 6.583 . 0 0 "[ . 1 . 2]" 2
170 1 37 VAL CB 1 44 SER H . . 13.000 8.128 7.526 8.854 . 0 0 "[ . 1 . 2]" 2
171 1 37 VAL CB 1 45 LEU H . . 13.000 6.499 5.925 7.053 . 0 0 "[ . 1 . 2]" 2
172 1 37 VAL CB 1 49 GLY H . . 13.000 10.061 9.600 10.634 . 0 0 "[ . 1 . 2]" 2
173 1 37 VAL CB 1 168 ALA H . . 13.000 13.066 13.001 13.128 0.128 18 0 "[ . 1 . 2]" 2
174 1 37 VAL CB 1 218 GLY H . . 13.000 12.656 12.329 13.024 0.024 17 0 "[ . 1 . 2]" 2
175 1 37 VAL CB 1 229 SER H . . 13.000 7.949 7.262 8.343 . 0 0 "[ . 1 . 2]" 2
176 1 37 VAL CB 1 230 SER H . . 13.000 8.594 7.739 9.175 . 0 0 "[ . 1 . 2]" 2
177 1 37 VAL CB 1 232 ALA H . . 13.000 10.669 7.715 13.018 0.018 7 0 "[ . 1 . 2]" 2
178 1 98 ALA H 1 152 GLY HA3 . . 13.500 13.086 12.296 13.564 0.064 19 0 "[ . 1 . 2]" 2
179 1 99 ALA H 1 152 GLY HA3 . . 13.500 13.100 11.523 13.672 0.172 18 0 "[ . 1 . 2]" 2
180 1 103 ALA H 1 152 GLY HA3 . . 13.000 10.137 4.774 12.597 . 0 0 "[ . 1 . 2]" 2
181 1 104 GLY H 1 152 GLY HA3 . . 13.000 6.683 4.116 8.919 . 0 0 "[ . 1 . 2]" 2
182 1 106 LEU H 1 152 GLY HA3 . . 13.000 8.863 6.134 11.864 . 0 0 "[ . 1 . 2]" 2
183 1 107 PHE H 1 152 GLY HA3 . . 13.000 9.444 7.617 11.245 . 0 0 "[ . 1 . 2]" 2
184 1 111 LEU H 1 152 GLY HA3 . . 13.000 12.521 11.463 13.067 0.067 3 0 "[ . 1 . 2]" 2
185 1 152 GLY HA3 1 154 GLY H . . 13.000 3.321 2.944 5.284 . 0 0 "[ . 1 . 2]" 2
186 1 152 GLY HA3 1 156 SER H . . 13.000 6.025 4.803 6.904 . 0 0 "[ . 1 . 2]" 2
187 1 152 GLY HA3 1 161 ALA H . . 13.000 11.989 9.930 12.986 . 0 0 "[ . 1 . 2]" 2
188 1 152 GLY HA3 1 162 SER H . . 13.000 12.470 11.130 13.105 0.105 6 0 "[ . 1 . 2]" 2
189 1 152 GLY HA3 1 167 SER H . . 13.000 13.016 12.494 13.102 0.102 3 0 "[ . 1 . 2]" 2
190 1 39 ALA H 1 230 SER CB . . 13.000 8.871 7.335 10.073 . 0 0 "[ . 1 . 2]" 2
191 1 229 SER H 1 230 SER CB . . 13.000 5.525 5.219 5.936 . 0 0 "[ . 1 . 2]" 2
192 1 230 SER CB 1 232 ALA H . . 13.000 6.222 4.815 7.386 . 0 0 "[ . 1 . 2]" 2
193 1 44 SER H 1 97 ALA CB . . 13.000 11.766 11.114 12.401 . 0 0 "[ . 1 . 2]" 2
194 1 92 PHE H 1 97 ALA CB . . 13.000 9.542 9.328 9.916 . 0 0 "[ . 1 . 2]" 2
195 1 97 ALA CB 1 99 ALA H . . 13.000 4.698 4.618 4.782 . 0 0 "[ . 1 . 2]" 2
196 1 97 ALA CB 1 103 ALA H . . 13.000 4.200 2.773 6.873 . 0 0 "[ . 1 . 2]" 2
197 1 97 ALA CB 1 104 GLY H . . 13.000 5.950 4.446 7.881 . 0 0 "[ . 1 . 2]" 2
198 1 97 ALA CB 1 107 PHE H . . 13.000 9.864 9.042 10.398 . 0 0 "[ . 1 . 2]" 2
199 1 97 ALA CB 1 152 GLY H . . 13.000 12.599 11.914 13.075 0.075 14 0 "[ . 1 . 2]" 2
200 1 97 ALA CB 1 154 GLY H . . 13.000 9.375 7.306 12.462 . 0 0 "[ . 1 . 2]" 2
201 1 97 ALA CB 1 156 SER H . . 13.000 11.008 8.943 12.958 . 0 0 "[ . 1 . 2]" 2
202 1 97 ALA CB 1 161 ALA H . . 13.000 12.263 10.772 13.032 0.032 9 0 "[ . 1 . 2]" 2
203 1 97 ALA CB 1 168 ALA H . . 13.000 12.406 11.502 13.045 0.045 9 0 "[ . 1 . 2]" 2
204 1 6 LEU H 1 204 LEU CB . . 13.000 10.715 9.205 12.952 . 0 0 "[ . 1 . 2]" 2
205 1 8 ALA H 1 204 LEU CB . . 13.000 12.095 11.331 12.850 . 0 0 "[ . 1 . 2]" 2
206 1 9 SER H 1 204 LEU CB . . 13.000 12.292 11.658 12.995 . 0 0 "[ . 1 . 2]" 2
207 1 13 GLY H 1 204 LEU CB . . 13.000 9.564 8.857 10.791 . 0 0 "[ . 1 . 2]" 2
208 1 15 SER H 1 204 LEU CB . . 13.000 6.838 6.055 8.110 . 0 0 "[ . 1 . 2]" 2
209 1 16 PHE H 1 204 LEU CB . . 13.000 7.864 7.098 8.867 . 0 0 "[ . 1 . 2]" 2
210 1 18 LEU H 1 204 LEU CB . . 13.000 9.774 8.972 10.686 . 0 0 "[ . 1 . 2]" 2
211 1 190 GLY H 1 204 LEU CB . . 13.000 10.317 9.035 11.381 . 0 0 "[ . 1 . 2]" 2
212 1 197 GLY H 1 204 LEU CB . . 13.000 12.484 10.675 13.030 0.030 8 0 "[ . 1 . 2]" 2
213 1 198 SER H 1 204 LEU CB . . 13.000 9.565 8.602 10.800 . 0 0 "[ . 1 . 2]" 2
214 1 199 ALA H 1 204 LEU CB . . 13.000 9.913 9.452 10.390 . 0 0 "[ . 1 . 2]" 2
215 1 204 LEU CB 1 209 ALA H . . 13.000 7.379 7.007 7.616 . 0 0 "[ . 1 . 2]" 2
216 1 6 LEU H 1 193 MET CB . . 13.000 12.459 9.291 13.049 0.049 4 0 "[ . 1 . 2]" 2
217 1 190 GLY H 1 193 MET CB . . 13.000 6.028 5.096 7.053 . 0 0 "[ . 1 . 2]" 2
218 1 192 LEU H 1 193 MET CB . . 13.000 4.688 4.270 5.295 . 0 0 "[ . 1 . 2]" 2
219 1 193 MET CB 1 194 GLY H . . 13.000 2.850 2.526 3.957 . 0 0 "[ . 1 . 2]" 2
220 1 193 MET CB 1 196 GLY H . . 13.000 4.564 3.448 6.127 . 0 0 "[ . 1 . 2]" 2
221 1 193 MET CB 1 197 GLY H . . 13.000 5.161 3.602 7.185 . 0 0 "[ . 1 . 2]" 2
222 1 193 MET CB 1 198 SER H . . 13.000 7.352 4.931 8.879 . 0 0 "[ . 1 . 2]" 2
223 1 193 MET CB 1 199 ALA H . . 13.000 11.386 8.752 13.002 0.002 10 0 "[ . 1 . 2]" 2
224 1 193 MET CB 1 200 LEU H . . 13.000 11.921 9.178 13.014 0.014 1 0 "[ . 1 . 2]" 2
225 1 16 PHE H 1 65 VAL CB . . 13.000 12.879 11.826 13.017 0.017 11 0 "[ . 1 . 2]" 2
226 1 64 GLY H 1 65 VAL CB . . 13.000 5.338 5.149 5.455 . 0 0 "[ . 1 . 2]" 2
227 1 65 VAL CB 1 70 GLY H . . 13.000 7.040 6.010 8.387 . 0 0 "[ . 1 . 2]" 2
228 1 65 VAL CB 1 72 SER H . . 13.000 8.423 6.395 10.750 . 0 0 "[ . 1 . 2]" 2
229 1 65 VAL CB 1 76 PHE H . . 13.000 10.854 9.650 12.606 . 0 0 "[ . 1 . 2]" 2
230 1 65 VAL CB 1 204 LEU H . . 13.000 13.000 12.528 13.081 0.081 7 0 "[ . 1 . 2]" 2
231 1 70 GLY H 1 126 ALA CB . . 17.200 17.091 16.718 17.289 0.089 19 0 "[ . 1 . 2]" 2
232 1 82 LEU H 1 126 ALA CB . . 18.600 18.117 17.390 18.700 0.100 5 0 "[ . 1 . 2]" 2
233 1 126 ALA CB 1 131 ALA H . . 17.000 10.407 8.833 13.659 . 0 0 "[ . 1 . 2]" 2
234 1 49 GLY H 1 168 ALA CB . . 17.700 13.151 12.412 14.207 . 0 0 "[ . 1 . 2]" 2
235 1 50 LEU H 1 168 ALA CB . . 18.300 15.648 15.121 16.619 . 0 0 "[ . 1 . 2]" 2
236 1 53 GLY H 1 168 ALA CB . . 18.400 16.970 16.445 17.994 . 0 0 "[ . 1 . 2]" 2
237 1 87 LEU H 1 168 ALA CB . . 18.900 18.160 17.322 18.991 0.091 5 0 "[ . 1 . 2]" 2
238 1 161 ALA H 1 168 ALA CB . . 17.900 13.157 12.275 13.744 . 0 0 "[ . 1 . 2]" 2
239 1 168 ALA CB 1 216 LEU H . . 17.100 15.496 15.043 16.082 . 0 0 "[ . 1 . 2]" 2
240 1 168 ALA CB 1 217 PHE H . . 17.300 13.177 12.783 13.715 . 0 0 "[ . 1 . 2]" 2
241 1 50 LEU H 1 225 ALA CB . . 17.100 13.528 12.619 14.356 . 0 0 "[ . 1 . 2]" 2
242 1 97 ALA H 1 225 ALA CB . . 17.600 12.369 11.988 12.886 . 0 0 "[ . 1 . 2]" 2
243 1 225 ALA CB 1 235 GLY H . . 17.700 16.115 12.894 17.620 . 0 0 "[ . 1 . 2]" 2
244 1 9 SER CB 1 200 LEU H . . 17.900 10.980 10.228 12.196 . 0 0 "[ . 1 . 2]" 2
245 1 9 SER CB 1 204 LEU H . . 17.600 13.096 12.620 14.204 . 0 0 "[ . 1 . 2]" 2
246 1 64 GLY H 1 75 VAL CB . . 17.000 14.755 13.469 15.707 . 0 0 "[ . 1 . 2]" 2
247 1 70 GLY H 1 75 VAL CB . . 18.900 15.214 14.639 15.845 . 0 0 "[ . 1 . 2]" 2
248 1 72 SER H 1 75 VAL CB . . 17.300 9.899 9.256 10.836 . 0 0 "[ . 1 . 2]" 2
249 1 75 VAL CB 1 118 LEU H . . 18.400 14.587 13.482 15.685 . 0 0 "[ . 1 . 2]" 2
250 1 75 VAL CB 1 120 PHE H . . 18.800 14.293 13.615 15.204 . 0 0 "[ . 1 . 2]" 2
251 1 75 VAL CB 1 121 GLY H . . 18.700 11.896 11.222 12.765 . 0 0 "[ . 1 . 2]" 2
252 1 75 VAL CB 1 124 GLY H . . 18.600 12.352 11.212 13.682 . 0 0 "[ . 1 . 2]" 2
253 1 75 VAL CB 1 127 GLY H . . 18.100 13.556 12.443 14.769 . 0 0 "[ . 1 . 2]" 2
254 1 78 TYR H 1 126 ALA CB . . 18.200 14.160 12.937 15.064 . 0 0 "[ . 1 . 2]" 2
255 1 119 VAL H 1 126 ALA CB . . 18.900 13.554 12.794 14.633 . 0 0 "[ . 1 . 2]" 2
256 1 87 LEU H 1 104 GLY HA3 . . 17.100 15.445 14.906 16.045 . 0 0 "[ . 1 . 2]" 2
257 1 104 GLY HA3 1 113 GLY H . . 17.400 12.559 11.944 13.400 . 0 0 "[ . 1 . 2]" 2
258 1 104 GLY HA3 1 114 SER H . . 17.000 14.086 13.633 14.816 . 0 0 "[ . 1 . 2]" 2
259 1 104 GLY HA3 1 115 LEU H . . 17.000 15.651 15.216 16.448 . 0 0 "[ . 1 . 2]" 2
260 1 104 GLY HA3 1 152 GLY H . . 18.600 8.973 6.866 10.622 . 0 0 "[ . 1 . 2]" 2
261 1 104 GLY HA3 1 162 SER H . . 17.200 15.297 13.096 16.124 . 0 0 "[ . 1 . 2]" 2
262 1 26 SER H 1 37 VAL CB . . 18.700 16.238 16.094 16.444 . 0 0 "[ . 1 . 2]" 2
263 1 37 VAL CB 1 48 SER H . . 17.900 10.746 10.417 11.122 . 0 0 "[ . 1 . 2]" 2
264 1 37 VAL CB 1 50 LEU H . . 17.400 12.124 11.479 12.990 . 0 0 "[ . 1 . 2]" 2
265 1 37 VAL CB 1 98 ALA H . . 18.700 15.435 14.946 15.887 . 0 0 "[ . 1 . 2]" 2
266 1 37 VAL CB 1 225 ALA H . . 17.500 7.491 6.931 8.046 . 0 0 "[ . 1 . 2]" 2
267 1 37 VAL CB 1 235 GLY H . . 18.000 13.578 10.773 17.465 . 0 0 "[ . 1 . 2]" 2
268 1 38 SER H 1 230 SER CB . . 17.100 8.946 7.792 10.230 . 0 0 "[ . 1 . 2]" 2
269 1 164 ALA H 1 230 SER CB . . 18.800 11.140 9.830 12.721 . 0 0 "[ . 1 . 2]" 2
270 1 168 ALA H 1 230 SER CB . . 17.600 13.349 12.353 14.464 . 0 0 "[ . 1 . 2]" 2
271 1 225 ALA H 1 230 SER CB . . 17.300 10.904 9.927 11.331 . 0 0 "[ . 1 . 2]" 2
272 1 230 SER CB 1 235 GLY H . . 18.700 13.291 10.935 16.450 . 0 0 "[ . 1 . 2]" 2
273 1 38 SER H 1 97 ALA CB . . 17.000 17.038 16.978 17.120 0.120 19 0 "[ . 1 . 2]" 2
274 1 48 SER H 1 97 ALA CB . . 18.000 12.944 11.686 13.613 . 0 0 "[ . 1 . 2]" 2
275 1 87 LEU H 1 97 ALA CB . . 18.200 15.398 15.106 15.956 . 0 0 "[ . 1 . 2]" 2
276 1 97 ALA CB 1 110 LEU H . . 18.500 13.110 12.495 14.017 . 0 0 "[ . 1 . 2]" 2
277 1 97 ALA CB 1 111 LEU H . . 17.900 15.215 14.514 15.901 . 0 0 "[ . 1 . 2]" 2
278 1 97 ALA CB 1 149 LEU H . . 18.200 15.324 13.793 16.352 . 0 0 "[ . 1 . 2]" 2
279 1 97 ALA CB 1 162 SER H . . 18.000 10.776 10.019 12.151 . 0 0 "[ . 1 . 2]" 2
280 1 97 ALA CB 1 164 ALA H . . 18.200 13.498 12.760 14.651 . 0 0 "[ . 1 . 2]" 2
281 1 21 ALA H 1 204 LEU CB . . 17.200 13.489 13.035 14.040 . 0 0 "[ . 1 . 2]" 2
282 1 22 ALA H 1 204 LEU CB . . 18.300 13.283 12.836 13.652 . 0 0 "[ . 1 . 2]" 2
283 1 64 GLY H 1 204 LEU CB . . 18.200 11.139 10.385 11.915 . 0 0 "[ . 1 . 2]" 2
284 1 186 GLY H 1 193 MET CB . . 18.200 12.787 11.308 14.253 . 0 0 "[ . 1 . 2]" 2
285 1 193 MET CB 1 204 LEU H . . 17.000 13.777 11.242 14.946 . 0 0 "[ . 1 . 2]" 2
286 1 193 MET CB 1 208 LEU H . . 18.100 17.110 14.794 18.127 0.027 3 0 "[ . 1 . 2]" 2
287 1 65 VAL CB 1 82 LEU H . . 18.800 16.955 15.692 17.874 . 0 0 "[ . 1 . 2]" 2
288 1 65 VAL CB 1 209 ALA H . . 18.100 15.893 15.065 16.559 . 0 0 "[ . 1 . 2]" 2
289 1 37 VAL CB 1 216 LEU H . . 17.000 16.411 16.077 16.743 . 0 0 "[ . 1 . 2]" 2
290 1 39 ALA H 1 97 ALA CB . . 17.000 16.969 16.718 17.071 0.071 13 0 "[ . 1 . 2]" 2
291 1 120 PHE H 1 126 ALA CB . . 19.800 12.333 11.740 13.178 . 0 0 "[ . 1 . 2]" 2
292 1 121 GLY H 1 126 ALA CB . . 19.200 11.073 10.537 11.758 . 0 0 "[ . 1 . 2]" 2
293 1 126 ALA CB 1 134 ALA H . . 19.500 13.186 11.654 14.728 . 0 0 "[ . 1 . 2]" 2
294 1 126 ALA CB 1 200 LEU H . . 20.400 18.782 15.798 20.396 . 0 0 "[ . 1 . 2]" 2
295 1 104 GLY H 1 168 ALA CB . . 19.300 14.300 12.505 15.401 . 0 0 "[ . 1 . 2]" 2
296 1 168 ALA CB 1 178 PHE H . . 19.000 14.509 14.105 14.803 . 0 0 "[ . 1 . 2]" 2
297 1 38 SER H 1 225 ALA CB . . 19.500 4.573 3.635 5.338 . 0 0 "[ . 1 . 2]" 2
298 1 98 ALA H 1 225 ALA CB . . 19.900 12.523 11.986 13.212 . 0 0 "[ . 1 . 2]" 2
299 1 104 GLY H 1 225 ALA CB . . 20.300 18.873 17.263 19.654 . 0 0 "[ . 1 . 2]" 2
300 1 154 GLY H 1 225 ALA CB . . 20.600 17.574 15.981 19.102 . 0 0 "[ . 1 . 2]" 2
301 1 9 SER CB 1 199 ALA H . . 20.900 12.795 11.847 13.834 . 0 0 "[ . 1 . 2]" 2
302 1 9 SER CB 1 202 LEU H . . 20.000 14.101 13.509 15.304 . 0 0 "[ . 1 . 2]" 2
303 1 55 ALA H 1 75 VAL CB . . 19.500 16.760 16.111 17.853 . 0 0 "[ . 1 . 2]" 2
304 1 75 VAL CB 1 87 LEU H . . 19.900 17.035 16.531 17.343 . 0 0 "[ . 1 . 2]" 2
305 1 75 VAL CB 1 115 LEU H . . 20.500 18.439 17.501 19.510 . 0 0 "[ . 1 . 2]" 2
306 1 126 ALA CB 1 189 THR H . . 20.900 20.652 19.357 21.105 0.205 12 0 "[ . 1 . 2]" 2
307 1 49 GLY H 1 104 GLY HA3 . . 20.300 20.324 19.762 20.465 0.165 11 0 "[ . 1 . 2]" 2
308 1 83 LEU H 1 104 GLY HA3 . . 20.500 20.528 20.208 20.648 0.148 11 0 "[ . 1 . 2]" 2
309 1 104 GLY HA3 1 149 LEU H . . 20.900 10.499 8.305 12.292 . 0 0 "[ . 1 . 2]" 2
310 1 104 GLY HA3 1 164 ALA H . . 20.600 18.856 17.004 19.881 . 0 0 "[ . 1 . 2]" 2
311 1 104 GLY HA3 1 167 SER H . . 20.900 17.210 15.307 18.138 . 0 0 "[ . 1 . 2]" 2
312 1 104 GLY HA3 1 168 ALA H . . 20.400 16.714 14.971 17.538 . 0 0 "[ . 1 . 2]" 2
313 1 24 LEU H 1 37 VAL CB . . 19.700 19.790 19.718 19.866 0.166 6 0 "[ . 1 . 2]" 2
314 1 37 VAL CB 1 99 ALA H . . 20.300 15.587 14.741 16.053 . 0 0 "[ . 1 . 2]" 2
315 1 37 VAL CB 1 217 PHE H . . 19.000 15.236 14.884 15.677 . 0 0 "[ . 1 . 2]" 2
316 1 87 LEU H 1 152 GLY HA3 . . 20.400 18.361 17.248 19.444 . 0 0 "[ . 1 . 2]" 2
317 1 113 GLY H 1 152 GLY HA3 . . 20.000 13.983 12.932 14.898 . 0 0 "[ . 1 . 2]" 2
318 1 114 SER H 1 152 GLY HA3 . . 20.200 16.238 15.225 17.046 . 0 0 "[ . 1 . 2]" 2
319 1 44 SER H 1 230 SER CB . . 19.300 16.386 15.203 17.267 . 0 0 "[ . 1 . 2]" 2
320 1 45 LEU H 1 230 SER CB . . 19.100 16.145 14.740 17.260 . 0 0 "[ . 1 . 2]" 2
321 1 97 ALA H 1 230 SER CB . . 20.800 20.365 19.705 20.816 0.016 9 0 "[ . 1 . 2]" 2
322 1 99 ALA H 1 230 SER CB . . 19.100 18.308 17.495 19.085 . 0 0 "[ . 1 . 2]" 2
323 1 162 SER H 1 230 SER CB . . 19.900 15.880 14.430 17.582 . 0 0 "[ . 1 . 2]" 2
324 1 167 SER H 1 230 SER CB . . 20.700 13.439 12.650 14.986 . 0 0 "[ . 1 . 2]" 2
325 1 49 GLY H 1 97 ALA CB . . 20.600 15.379 14.290 16.110 . 0 0 "[ . 1 . 2]" 2
326 1 50 LEU H 1 97 ALA CB . . 19.300 16.855 15.693 17.484 . 0 0 "[ . 1 . 2]" 2
327 1 53 GLY H 1 97 ALA CB . . 20.900 19.410 18.463 20.169 . 0 0 "[ . 1 . 2]" 2
328 1 97 ALA CB 1 225 ALA H . . 19.100 15.994 15.197 16.546 . 0 0 "[ . 1 . 2]" 2
329 1 23 LEU H 1 204 LEU CB . . 20.800 13.727 13.262 14.381 . 0 0 "[ . 1 . 2]" 2
330 1 26 SER H 1 204 LEU CB . . 20.100 17.917 17.660 18.145 . 0 0 "[ . 1 . 2]" 2
331 1 70 GLY H 1 204 LEU CB . . 20.900 13.326 11.772 14.444 . 0 0 "[ . 1 . 2]" 2
332 1 72 SER H 1 204 LEU CB . . 20.400 15.865 12.798 17.967 . 0 0 "[ . 1 . 2]" 2
333 1 181 ALA H 1 204 LEU CB . . 19.900 16.815 15.750 18.422 . 0 0 "[ . 1 . 2]" 2
334 1 196 GLY H 1 204 LEU CB . . 19.200 14.258 12.523 15.740 . 0 0 "[ . 1 . 2]" 2
335 1 204 LEU CB 1 216 LEU H . . 19.900 15.377 14.937 16.073 . 0 0 "[ . 1 . 2]" 2
336 1 8 ALA H 1 193 MET CB . . 20.600 16.289 13.531 18.404 . 0 0 "[ . 1 . 2]" 2
337 1 193 MET CB 1 209 ALA H . . 19.200 17.307 15.079 18.752 . 0 0 "[ . 1 . 2]" 2
338 1 15 SER H 1 65 VAL CB . . 19.000 15.012 13.753 15.554 . 0 0 "[ . 1 . 2]" 2
339 1 18 LEU H 1 65 VAL CB . . 20.200 15.993 15.172 16.412 . 0 0 "[ . 1 . 2]" 2
340 1 22 ALA H 1 65 VAL CB . . 20.300 17.537 16.127 18.377 . 0 0 "[ . 1 . 2]" 2
341 1 24 LEU H 1 65 VAL CB . . 19.300 17.137 15.644 18.027 . 0 0 "[ . 1 . 2]" 2
342 1 26 SER H 1 65 VAL CB . . 20.500 20.105 18.683 20.540 0.040 20 0 "[ . 1 . 2]" 2
343 1 55 ALA H 1 65 VAL CB . . 20.400 16.091 15.742 16.424 . 0 0 "[ . 1 . 2]" 2
344 1 65 VAL CB 1 83 LEU H . . 19.400 17.652 16.162 18.339 . 0 0 "[ . 1 . 2]" 2
345 1 65 VAL CB 1 127 GLY H . . 20.300 18.973 17.349 20.342 0.042 18 0 "[ . 1 . 2]" 2
346 1 65 VAL CB 1 200 LEU H . . 19.100 14.558 13.511 15.228 . 0 0 "[ . 1 . 2]" 2
347 1 64 GLY H 1 126 ALA CB . . 21.300 20.897 19.982 21.407 0.107 20 0 "[ . 1 . 2]" 2
348 1 83 LEU H 1 126 ALA CB . . 21.400 20.449 19.742 21.227 . 0 0 "[ . 1 . 2]" 2
349 1 118 LEU H 1 126 ALA CB . . 22.400 15.249 14.530 16.136 . 0 0 "[ . 1 . 2]" 2
350 1 126 ALA CB 1 135 PHE H . . 21.300 15.658 14.011 17.013 . 0 0 "[ . 1 . 2]" 2
351 1 126 ALA CB 1 186 GLY H . . 22.300 21.639 20.494 22.269 . 0 0 "[ . 1 . 2]" 2
352 1 126 ALA CB 1 196 GLY H . . 22.400 18.798 14.315 22.432 0.032 5 0 "[ . 1 . 2]" 2
353 1 126 ALA CB 1 197 GLY H . . 21.500 17.715 13.950 20.852 . 0 0 "[ . 1 . 2]" 2
354 1 126 ALA CB 1 198 SER H . . 22.100 18.073 14.925 21.070 . 0 0 "[ . 1 . 2]" 2
355 1 126 ALA CB 1 202 LEU H . . 22.000 17.343 14.915 19.018 . 0 0 "[ . 1 . 2]" 2
356 1 149 LEU H 1 168 ALA CB . . 22.600 16.028 15.071 17.682 . 0 0 "[ . 1 . 2]" 2
357 1 152 GLY H 1 168 ALA CB . . 22.800 13.914 13.063 14.408 . 0 0 "[ . 1 . 2]" 2
358 1 168 ALA CB 1 235 GLY H . . 22.600 20.443 16.645 22.542 . 0 0 "[ . 1 . 2]" 2
359 1 152 GLY H 1 225 ALA CB . . 22.600 19.753 18.536 20.510 . 0 0 "[ . 1 . 2]" 2
360 1 156 SER H 1 225 ALA CB . . 21.300 19.165 17.758 21.287 . 0 0 "[ . 1 . 2]" 2
361 1 178 PHE H 1 225 ALA CB . . 21.600 17.871 17.388 18.589 . 0 0 "[ . 1 . 2]" 2
362 1 179 GLY H 1 225 ALA CB . . 22.200 18.085 17.619 18.674 . 0 0 "[ . 1 . 2]" 2
363 1 9 SER CB 1 190 GLY H . . 22.200 20.605 19.135 22.039 . 0 0 "[ . 1 . 2]" 2
364 1 9 SER CB 1 194 GLY H . . 22.400 20.768 18.744 22.453 0.053 2 0 "[ . 1 . 2]" 2
365 1 9 SER CB 1 197 GLY H . . 22.500 17.751 15.624 18.920 . 0 0 "[ . 1 . 2]" 2
366 1 9 SER CB 1 198 SER H . . 21.900 14.802 13.776 16.415 . 0 0 "[ . 1 . 2]" 2
367 1 53 GLY H 1 75 VAL CB . . 21.700 20.826 20.192 21.487 . 0 0 "[ . 1 . 2]" 2
368 1 56 PHE H 1 75 VAL CB . . 22.700 17.301 16.907 17.794 . 0 0 "[ . 1 . 2]" 2
369 1 75 VAL CB 1 130 ALA H . . 21.500 20.458 19.760 21.495 . 0 0 "[ . 1 . 2]" 2
370 1 75 VAL CB 1 208 LEU H . . 21.800 20.588 20.052 21.112 . 0 0 "[ . 1 . 2]" 2
371 1 75 VAL CB 1 209 ALA H . . 22.800 20.510 20.015 21.220 . 0 0 "[ . 1 . 2]" 2
372 1 116 VAL H 1 126 ALA CB . . 22.200 18.211 17.578 19.054 . 0 0 "[ . 1 . 2]" 2
373 1 126 ALA CB 1 132 TRP H . . 22.000 12.296 11.373 15.022 . 0 0 "[ . 1 . 2]" 2
374 1 126 ALA CB 1 183 TYR H . . 22.300 21.929 20.656 22.373 0.073 19 0 "[ . 1 . 2]" 2
375 1 126 ALA CB 1 187 TYR H . . 22.400 19.423 18.278 19.919 . 0 0 "[ . 1 . 2]" 2
376 1 126 ALA CB 1 193 MET H . . 22.300 17.986 16.107 20.078 . 0 0 "[ . 1 . 2]" 2
377 1 53 GLY H 1 104 GLY HA3 . . 22.700 22.813 22.655 22.900 0.200 1 0 "[ . 1 . 2]" 2
378 1 82 LEU H 1 104 GLY HA3 . . 22.200 21.329 20.953 21.654 . 0 0 "[ . 1 . 2]" 2
379 1 104 GLY HA3 1 118 LEU H . . 21.200 19.915 19.461 20.696 . 0 0 "[ . 1 . 2]" 2
380 1 104 GLY HA3 1 218 GLY H . . 22.200 21.835 20.320 22.340 0.140 8 0 "[ . 1 . 2]" 2
381 1 25 ALA H 1 37 VAL CB . . 21.700 18.453 18.273 18.617 . 0 0 "[ . 1 . 2]" 2
382 1 37 VAL CB 1 53 GLY H . . 22.200 14.430 14.169 14.988 . 0 0 "[ . 1 . 2]" 2
383 1 37 VAL CB 1 56 PHE H . . 22.600 18.344 17.764 18.882 . 0 0 "[ . 1 . 2]" 2
384 1 37 VAL CB 1 94 LEU H . . 21.800 16.332 15.750 16.952 . 0 0 "[ . 1 . 2]" 2
385 1 37 VAL CB 1 97 ALA H . . 22.600 15.858 15.541 16.152 . 0 0 "[ . 1 . 2]" 2
386 1 37 VAL CB 1 164 ALA H . . 22.500 14.436 14.366 14.530 . 0 0 "[ . 1 . 2]" 2
387 1 138 GLY H 1 152 GLY HA3 . . 22.100 22.108 21.467 22.327 0.227 18 0 "[ . 1 . 2]" 2
388 1 152 GLY HA3 1 225 ALA H . . 21.700 18.727 18.266 19.394 . 0 0 "[ . 1 . 2]" 2
389 1 30 PHE H 1 230 SER CB . . 22.000 19.389 18.180 20.394 . 0 0 "[ . 1 . 2]" 2
390 1 31 PHE H 1 230 SER CB . . 22.400 19.806 18.369 20.810 . 0 0 "[ . 1 . 2]" 2
391 1 218 GLY H 1 230 SER CB . . 22.100 20.644 19.551 21.213 . 0 0 "[ . 1 . 2]" 2
392 1 219 LEU H 1 230 SER CB . . 21.600 18.997 17.688 19.711 . 0 0 "[ . 1 . 2]" 2
393 1 97 ALA CB 1 113 GLY H . . 21.700 16.865 15.730 18.532 . 0 0 "[ . 1 . 2]" 2
394 1 97 ALA CB 1 114 SER H . . 22.600 18.540 17.926 19.354 . 0 0 "[ . 1 . 2]" 2
395 1 97 ALA CB 1 229 SER H . . 21.600 17.664 16.727 18.715 . 0 0 "[ . 1 . 2]" 2
396 1 24 LEU H 1 204 LEU CB . . 21.900 16.249 15.554 16.971 . 0 0 "[ . 1 . 2]" 2
397 1 25 ALA H 1 204 LEU CB . . 21.900 17.857 17.483 18.275 . 0 0 "[ . 1 . 2]" 2
398 1 30 PHE H 1 204 LEU CB . . 22.800 22.857 22.797 22.926 0.126 11 0 "[ . 1 . 2]" 2
399 1 53 GLY H 1 204 LEU CB . . 22.900 22.340 21.055 22.935 0.035 8 0 "[ . 1 . 2]" 2
400 1 130 ALA H 1 204 LEU CB . . 21.500 19.674 16.870 21.654 0.154 6 0 "[ . 1 . 2]" 2
401 1 178 PHE H 1 204 LEU CB . . 21.600 19.616 18.280 21.335 . 0 0 "[ . 1 . 2]" 2
402 1 204 LEU CB 1 218 GLY H . . 22.800 19.668 19.235 20.291 . 0 0 "[ . 1 . 2]" 2
403 1 204 LEU CB 1 219 LEU H . . 22.700 20.081 19.728 20.582 . 0 0 "[ . 1 . 2]" 2
404 1 9 SER H 1 193 MET CB . . 21.700 18.658 15.976 20.654 . 0 0 "[ . 1 . 2]" 2
405 1 13 GLY H 1 193 MET CB . . 21.000 20.055 17.297 21.079 0.079 1 0 "[ . 1 . 2]" 2
406 1 15 SER H 1 193 MET CB . . 21.500 19.079 16.495 20.131 . 0 0 "[ . 1 . 2]" 2
407 1 135 PHE H 1 193 MET CB . . 22.500 14.526 14.349 15.468 . 0 0 "[ . 1 . 2]" 2
408 1 181 ALA H 1 193 MET CB . . 22.900 20.653 19.310 21.931 . 0 0 "[ . 1 . 2]" 2
409 1 21 ALA H 1 65 VAL CB . . 22.900 16.492 15.108 17.299 . 0 0 "[ . 1 . 2]" 2
410 1 23 LEU H 1 65 VAL CB . . 21.700 16.210 14.671 17.043 . 0 0 "[ . 1 . 2]" 2
411 1 53 GLY H 1 65 VAL CB . . 21.700 19.175 18.506 19.585 . 0 0 "[ . 1 . 2]" 2
412 1 65 VAL CB 1 87 LEU H . . 22.300 22.266 20.949 22.442 0.142 18 0 "[ . 1 . 2]" 2
413 1 65 VAL CB 1 121 GLY H . . 21.800 20.007 18.138 21.729 . 0 0 "[ . 1 . 2]" 2
414 1 65 VAL CB 1 124 GLY H . . 21.100 19.221 17.469 20.858 . 0 0 "[ . 1 . 2]" 2
415 1 65 VAL CB 1 208 LEU H . . 22.500 14.200 13.582 14.730 . 0 0 "[ . 1 . 2]" 2
416 1 65 VAL CB 1 216 LEU H . . 21.100 20.229 19.606 20.539 . 0 0 "[ . 1 . 2]" 2
417 1 65 VAL CB 1 217 PHE H . . 21.500 21.495 20.788 21.643 0.143 8 0 "[ . 1 . 2]" 2
418 1 183 TYR CZ 1 214 . C3 . . 7.000 9.012 6.249 11.130 4.130 16 15 "[****** * * * *+*-**]" 2
419 1 80 ASP OD1 1 214 . NZ . . 5.000 5.157 5.050 5.256 0.256 19 0 "[ . 1 . 2]" 2
420 1 210 ASP OD1 1 214 . NZ . . 5.000 3.992 2.794 5.655 0.655 18 1 "[ . 1 . + 2]" 2
421 1 58 HIS ND1 1 80 ASP OD1 . . 3.500 3.560 3.506 3.638 0.138 9 0 "[ . 1 . 2]" 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 265
_Distance_constraint_stats_list.Viol_count 2207
_Distance_constraint_stats_list.Viol_total 2245.138
_Distance_constraint_stats_list.Viol_max 0.259
_Distance_constraint_stats_list.Viol_rms 0.0373
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0212
_Distance_constraint_stats_list.Viol_average_violations_only 0.0509
_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 8 ALA 0.024 0.010 16 0 "[ . 1 . 2]"
1 9 SER 0.099 0.088 19 0 "[ . 1 . 2]"
1 10 ASP 0.031 0.022 6 0 "[ . 1 . 2]"
1 11 TYR 0.115 0.080 19 0 "[ . 1 . 2]"
1 12 THR 0.891 0.071 6 0 "[ . 1 . 2]"
1 13 GLY 0.372 0.088 19 0 "[ . 1 . 2]"
1 14 VAL 0.375 0.050 19 0 "[ . 1 . 2]"
1 15 SER 0.115 0.080 19 0 "[ . 1 . 2]"
1 16 PHE 1.508 0.080 4 0 "[ . 1 . 2]"
1 17 TRP 0.525 0.060 19 0 "[ . 1 . 2]"
1 18 LEU 0.922 0.075 6 0 "[ . 1 . 2]"
1 19 VAL 0.060 0.020 16 0 "[ . 1 . 2]"
1 20 THR 1.152 0.080 4 0 "[ . 1 . 2]"
1 21 ALA 0.812 0.074 16 0 "[ . 1 . 2]"
1 22 ALA 0.847 0.151 16 0 "[ . 1 . 2]"
1 23 LEU 0.378 0.068 16 0 "[ . 1 . 2]"
1 24 LEU 0.585 0.077 12 0 "[ . 1 . 2]"
1 25 ALA 1.678 0.109 15 0 "[ . 1 . 2]"
1 26 SER 0.379 0.151 16 0 "[ . 1 . 2]"
1 27 THR 0.889 0.071 7 0 "[ . 1 . 2]"
1 28 VAL 0.327 0.053 15 0 "[ . 1 . 2]"
1 29 PHE 1.131 0.109 15 0 "[ . 1 . 2]"
1 30 PHE 0.109 0.034 15 0 "[ . 1 . 2]"
1 31 PHE 0.570 0.071 7 0 "[ . 1 . 2]"
1 32 VAL 0.254 0.047 5 0 "[ . 1 . 2]"
1 33 GLU 0.013 0.013 15 0 "[ . 1 . 2]"
1 43 THR 0.857 0.096 17 0 "[ . 1 . 2]"
1 44 SER 0.352 0.151 13 0 "[ . 1 . 2]"
1 45 LEU 0.315 0.049 14 0 "[ . 1 . 2]"
1 46 THR 1.168 0.162 13 0 "[ . 1 . 2]"
1 47 VAL 4.516 0.216 17 0 "[ . 1 . 2]"
1 48 SER 1.033 0.151 13 0 "[ . 1 . 2]"
1 49 GLY 0.668 0.108 2 0 "[ . 1 . 2]"
1 50 LEU 2.763 0.162 13 0 "[ . 1 . 2]"
1 51 VAL 6.866 0.228 8 0 "[ . 1 . 2]"
1 52 THR 1.195 0.092 9 0 "[ . 1 . 2]"
1 53 GLY 4.240 0.183 17 0 "[ . 1 . 2]"
1 54 ILE 3.061 0.141 8 0 "[ . 1 . 2]"
1 55 ALA 3.312 0.228 8 0 "[ . 1 . 2]"
1 56 PHE 0.729 0.092 9 0 "[ . 1 . 2]"
1 57 TRP 5.606 0.183 17 0 "[ . 1 . 2]"
1 58 HIS 1.879 0.141 8 0 "[ . 1 . 2]"
1 59 TYR 0.234 0.060 11 0 "[ . 1 . 2]"
1 60 MET 2.166 0.189 7 0 "[ . 1 . 2]"
1 61 TYR 2.174 0.122 7 0 "[ . 1 . 2]"
1 62 MET 0.623 0.086 11 0 "[ . 1 . 2]"
1 63 ARG 1.479 0.097 11 0 "[ . 1 . 2]"
1 64 GLY 2.825 0.189 7 0 "[ . 1 . 2]"
1 65 VAL 0.455 0.062 8 0 "[ . 1 . 2]"
1 66 TRP 0.210 0.086 11 0 "[ . 1 . 2]"
1 67 ILE 1.351 0.097 11 0 "[ . 1 . 2]"
1 68 GLU 0.873 0.109 7 0 "[ . 1 . 2]"
1 74 THR 0.204 0.146 18 0 "[ . 1 . 2]"
1 75 VAL 2.465 0.216 19 0 "[ . 1 . 2]"
1 76 PHE 0.113 0.031 5 0 "[ . 1 . 2]"
1 77 ARG 0.587 0.064 2 0 "[ . 1 . 2]"
1 78 TYR 0.806 0.146 18 0 "[ . 1 . 2]"
1 79 ILE 3.562 0.216 19 0 "[ . 1 . 2]"
1 80 ASP 0.970 0.089 6 0 "[ . 1 . 2]"
1 81 TRP 0.712 0.068 13 0 "[ . 1 . 2]"
1 82 LEU 0.602 0.126 18 0 "[ . 1 . 2]"
1 83 LEU 1.097 0.134 4 0 "[ . 1 . 2]"
1 84 THR 0.857 0.089 6 0 "[ . 1 . 2]"
1 85 VAL 3.572 0.180 17 0 "[ . 1 . 2]"
1 87 LEU 0.894 0.105 11 0 "[ . 1 . 2]"
1 88 LEU 0.831 0.091 11 0 "[ . 1 . 2]"
1 89 ILE 5.003 0.180 17 0 "[ . 1 . 2]"
1 90 CYS 0.183 0.081 11 0 "[ . 1 . 2]"
1 91 GLU 2.519 0.128 6 0 "[ . 1 . 2]"
1 92 PHE 2.479 0.189 15 0 "[ . 1 . 2]"
1 93 TYR 1.657 0.150 4 0 "[ . 1 . 2]"
1 94 LEU 1.906 0.163 6 0 "[ . 1 . 2]"
1 95 ILE 1.626 0.128 6 0 "[ . 1 . 2]"
1 96 LEU 1.648 0.189 15 0 "[ . 1 . 2]"
1 97 ALA 0.101 0.053 4 0 "[ . 1 . 2]"
1 98 ALA 1.722 0.163 6 0 "[ . 1 . 2]"
1 105 SER 0.161 0.062 11 0 "[ . 1 . 2]"
1 106 LEU 1.671 0.210 18 0 "[ . 1 . 2]"
1 107 PHE 0.272 0.040 11 0 "[ . 1 . 2]"
1 108 LYS 0.371 0.074 1 0 "[ . 1 . 2]"
1 109 LYS 0.195 0.062 11 0 "[ . 1 . 2]"
1 110 LEU 2.651 0.210 18 0 "[ . 1 . 2]"
1 111 LEU 1.274 0.108 10 0 "[ . 1 . 2]"
1 112 VAL 0.933 0.083 18 0 "[ . 1 . 2]"
1 113 GLY 0.798 0.125 10 0 "[ . 1 . 2]"
1 114 SER 1.426 0.142 10 0 "[ . 1 . 2]"
1 115 LEU 1.995 0.111 5 0 "[ . 1 . 2]"
1 116 VAL 1.520 0.133 14 0 "[ . 1 . 2]"
1 117 MET 0.896 0.125 10 0 "[ . 1 . 2]"
1 118 LEU 0.741 0.142 10 0 "[ . 1 . 2]"
1 119 VAL 1.170 0.111 5 0 "[ . 1 . 2]"
1 120 PHE 1.936 0.133 14 0 "[ . 1 . 2]"
1 121 GLY 0.659 0.119 13 0 "[ . 1 . 2]"
1 122 TYR 0.295 0.050 17 0 "[ . 1 . 2]"
1 123 MET 0.178 0.056 13 0 "[ . 1 . 2]"
1 124 GLY 0.978 0.122 14 0 "[ . 1 . 2]"
1 125 GLU 0.528 0.119 13 0 "[ . 1 . 2]"
1 134 ALA 0.963 0.217 10 0 "[ . 1 . 2]"
1 135 PHE 0.236 0.131 11 0 "[ . 1 . 2]"
1 136 ILE 1.699 0.155 2 0 "[ . 1 . 2]"
1 137 ILE 2.893 0.259 18 0 "[ . 1 . 2]"
1 138 GLY 1.015 0.217 10 0 "[ . 1 . 2]"
1 139 CYS 0.400 0.131 11 0 "[ . 1 . 2]"
1 140 LEU 2.753 0.155 2 0 "[ . 1 . 2]"
1 141 ALA 3.021 0.259 18 0 "[ . 1 . 2]"
1 142 TRP 3.055 0.173 19 0 "[ . 1 . 2]"
1 143 VAL 0.277 0.056 11 0 "[ . 1 . 2]"
1 144 TYR 2.398 0.086 7 0 "[ . 1 . 2]"
1 145 MET 0.753 0.092 9 0 "[ . 1 . 2]"
1 146 ILE 3.474 0.173 19 0 "[ . 1 . 2]"
1 147 TYR 0.113 0.024 11 0 "[ . 1 . 2]"
1 148 GLU 1.343 0.086 7 0 "[ . 1 . 2]"
1 149 LEU 0.625 0.092 9 0 "[ . 1 . 2]"
1 150 TRP 0.470 0.095 10 0 "[ . 1 . 2]"
1 164 ALA 1.164 0.097 5 0 "[ . 1 . 2]"
1 165 VAL 0.491 0.060 13 0 "[ . 1 . 2]"
1 166 GLN 1.260 0.083 5 0 "[ . 1 . 2]"
1 167 SER 0.972 0.076 2 0 "[ . 1 . 2]"
1 168 ALA 2.089 0.097 5 0 "[ . 1 . 2]"
1 169 TYR 1.011 0.090 14 0 "[ . 1 . 2]"
1 170 ASN 2.719 0.165 2 0 "[ . 1 . 2]"
1 171 THR 2.174 0.100 20 0 "[ . 1 . 2]"
1 172 MET 2.087 0.109 12 0 "[ . 1 . 2]"
1 173 MET 1.544 0.219 20 0 "[ . 1 . 2]"
1 174 TYR 3.200 0.165 2 0 "[ . 1 . 2]"
1 175 ILE 2.152 0.149 14 0 "[ . 1 . 2]"
1 176 ILE 2.192 0.123 14 0 "[ . 1 . 2]"
1 177 ILE 1.023 0.219 20 0 "[ . 1 . 2]"
1 178 PHE 3.768 0.198 20 0 "[ . 1 . 2]"
1 179 GLY 3.400 0.196 17 0 "[ . 1 . 2]"
1 180 TRP 1.030 0.123 14 0 "[ . 1 . 2]"
1 181 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 182 ILE 2.218 0.198 20 0 "[ . 1 . 2]"
1 183 TYR 5.734 0.258 3 0 "[ . 1 . 2]"
1 186 GLY 0.191 0.058 4 0 "[ . 1 . 2]"
1 187 TYR 4.970 0.258 3 0 "[ . 1 . 2]"
1 191 TYR 1.687 0.177 19 0 "[ . 1 . 2]"
1 199 ALA 0.216 0.049 2 0 "[ . 1 . 2]"
1 200 LEU 0.407 0.039 12 0 "[ . 1 . 2]"
1 201 ASN 0.329 0.073 12 0 "[ . 1 . 2]"
1 202 LEU 0.392 0.119 12 0 "[ . 1 . 2]"
1 203 ASN 0.263 0.049 2 0 "[ . 1 . 2]"
1 204 LEU 0.465 0.039 12 0 "[ . 1 . 2]"
1 205 ILE 1.043 0.090 15 0 "[ . 1 . 2]"
1 206 TYR 1.377 0.119 12 0 "[ . 1 . 2]"
1 207 ASN 0.049 0.031 15 0 "[ . 1 . 2]"
1 208 LEU 0.294 0.057 6 0 "[ . 1 . 2]"
1 209 ALA 1.306 0.090 15 0 "[ . 1 . 2]"
1 210 ASP 0.985 0.061 3 0 "[ . 1 . 2]"
1 211 PHE 0.002 0.002 5 0 "[ . 1 . 2]"
1 212 VAL 0.237 0.057 6 0 "[ . 1 . 2]"
1 213 ASN 0.592 0.088 13 0 "[ . 1 . 2]"
1 215 ILE 0.671 0.084 20 0 "[ . 1 . 2]"
1 216 LEU 0.050 0.020 5 0 "[ . 1 . 2]"
1 217 PHE 2.347 0.145 13 0 "[ . 1 . 2]"
1 218 GLY 0.985 0.134 15 0 "[ . 1 . 2]"
1 219 LEU 1.186 0.106 15 0 "[ . 1 . 2]"
1 220 ILE 0.716 0.165 8 0 "[ . 1 . 2]"
1 221 ILE 5.296 0.172 11 0 "[ . 1 . 2]"
1 222 TRP 0.985 0.134 15 0 "[ . 1 . 2]"
1 223 ASN 1.833 0.181 5 0 "[ . 1 . 2]"
1 224 VAL 1.097 0.165 8 0 "[ . 1 . 2]"
1 225 ALA 4.075 0.172 11 0 "[ . 1 . 2]"
1 226 VAL 0.000 0.000 . 0 "[ . 1 . 2]"
1 227 LYS 1.318 0.181 5 0 "[ . 1 . 2]"
1 228 GLU 0.430 0.087 19 0 "[ . 1 . 2]"
1 229 SER 1.126 0.154 18 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 8 ALA O 1 12 THR H . . 2.000 1.940 1.816 2.010 0.010 16 0 "[ . 1 . 2]" 3
2 1 8 ALA O 1 12 THR N . . 3.000 2.894 2.759 2.982 . 0 0 "[ . 1 . 2]" 3
3 1 9 SER O 1 13 GLY H . . 2.000 1.953 1.826 2.088 0.088 19 0 "[ . 1 . 2]" 3
4 1 9 SER O 1 13 GLY N . . 3.000 2.844 2.748 2.966 . 0 0 "[ . 1 . 2]" 3
5 1 10 ASP O 1 14 VAL H . . 2.000 1.962 1.805 2.022 0.022 6 0 "[ . 1 . 2]" 3
6 1 10 ASP O 1 14 VAL N . . 3.000 2.935 2.780 2.995 . 0 0 "[ . 1 . 2]" 3
7 1 11 TYR O 1 15 SER H . . 2.000 1.905 1.803 2.080 0.080 19 0 "[ . 1 . 2]" 3
8 1 11 TYR O 1 15 SER N . . 3.000 2.860 2.749 3.035 0.035 19 0 "[ . 1 . 2]" 3
9 1 12 THR O 1 16 PHE H . . 2.000 2.043 2.017 2.071 0.071 6 0 "[ . 1 . 2]" 3
10 1 12 THR O 1 16 PHE N . . 3.000 2.951 2.925 3.001 0.001 6 0 "[ . 1 . 2]" 3
11 1 13 GLY O 1 17 TRP H . . 2.000 1.945 1.791 2.050 0.050 8 0 "[ . 1 . 2]" 3
12 1 13 GLY O 1 17 TRP N . . 3.000 2.885 2.756 3.008 0.008 8 0 "[ . 1 . 2]" 3
13 1 14 VAL O 1 18 LEU H . . 2.000 2.015 1.968 2.050 0.050 19 0 "[ . 1 . 2]" 3
14 1 14 VAL O 1 18 LEU N . . 3.000 2.959 2.917 3.005 0.005 19 0 "[ . 1 . 2]" 3
15 1 15 SER O 1 19 VAL H . . 2.000 1.816 1.779 1.897 . 0 0 "[ . 1 . 2]" 3
16 1 15 SER O 1 19 VAL N . . 3.000 2.759 2.723 2.834 . 0 0 "[ . 1 . 2]" 3
17 1 16 PHE O 1 20 THR H . . 2.000 2.032 2.009 2.080 0.080 4 0 "[ . 1 . 2]" 3
18 1 16 PHE O 1 20 THR N . . 3.000 2.956 2.897 3.001 0.001 14 0 "[ . 1 . 2]" 3
19 1 17 TRP O 1 21 ALA H . . 2.000 1.937 1.831 2.060 0.060 19 0 "[ . 1 . 2]" 3
20 1 17 TRP O 1 21 ALA N . . 3.000 2.897 2.784 3.022 0.022 8 0 "[ . 1 . 2]" 3
21 1 18 LEU O 1 22 ALA H . . 2.000 2.014 1.859 2.075 0.075 6 0 "[ . 1 . 2]" 3
22 1 18 LEU O 1 22 ALA N . . 3.000 2.940 2.777 3.026 0.026 19 0 "[ . 1 . 2]" 3
23 1 19 VAL O 1 23 LEU H . . 2.000 1.875 1.790 2.020 0.020 16 0 "[ . 1 . 2]" 3
24 1 19 VAL O 1 23 LEU N . . 3.000 2.798 2.726 2.932 . 0 0 "[ . 1 . 2]" 3
25 1 20 THR O 1 24 LEU H . . 2.000 2.026 2.002 2.077 0.077 12 0 "[ . 1 . 2]" 3
26 1 20 THR O 1 24 LEU N . . 3.000 2.934 2.816 2.991 . 0 0 "[ . 1 . 2]" 3
27 1 21 ALA O 1 25 ALA H . . 2.000 2.007 1.832 2.074 0.074 16 0 "[ . 1 . 2]" 3
28 1 21 ALA O 1 25 ALA N . . 3.000 2.978 2.808 3.028 0.028 19 0 "[ . 1 . 2]" 3
29 1 22 ALA O 1 26 SER H . . 2.000 1.942 1.788 2.151 0.151 16 0 "[ . 1 . 2]" 3
30 1 22 ALA O 1 26 SER N . . 3.000 2.847 2.722 2.967 . 0 0 "[ . 1 . 2]" 3
31 1 23 LEU O 1 27 THR H . . 2.000 1.969 1.811 2.068 0.068 16 0 "[ . 1 . 2]" 3
32 1 23 LEU O 1 27 THR N . . 3.000 2.842 2.735 3.010 0.010 7 0 "[ . 1 . 2]" 3
33 1 24 LEU O 1 28 VAL H . . 2.000 1.911 1.788 2.053 0.053 15 0 "[ . 1 . 2]" 3
34 1 24 LEU O 1 28 VAL N . . 3.000 2.875 2.764 3.006 0.006 15 0 "[ . 1 . 2]" 3
35 1 25 ALA O 1 29 PHE H . . 2.000 2.055 2.002 2.109 0.109 15 0 "[ . 1 . 2]" 3
36 1 25 ALA O 1 29 PHE N . . 3.000 2.959 2.853 3.020 0.020 20 0 "[ . 1 . 2]" 3
37 1 26 SER O 1 30 PHE H . . 2.000 1.935 1.792 2.034 0.034 15 0 "[ . 1 . 2]" 3
38 1 26 SER O 1 30 PHE N . . 3.000 2.862 2.737 2.991 . 0 0 "[ . 1 . 2]" 3
39 1 27 THR O 1 31 PHE H . . 2.000 2.028 1.989 2.071 0.071 7 0 "[ . 1 . 2]" 3
40 1 27 THR O 1 31 PHE N . . 3.000 2.834 2.785 2.935 . 0 0 "[ . 1 . 2]" 3
41 1 28 VAL O 1 32 VAL H . . 2.000 1.972 1.785 2.047 0.047 5 0 "[ . 1 . 2]" 3
42 1 28 VAL O 1 32 VAL N . . 3.000 2.926 2.748 3.005 0.005 5 0 "[ . 1 . 2]" 3
43 1 29 PHE O 1 33 GLU H . . 2.000 1.858 1.765 2.013 0.013 15 0 "[ . 1 . 2]" 3
44 1 29 PHE O 1 33 GLU N . . 3.000 2.745 2.714 2.871 . 0 0 "[ . 1 . 2]" 3
45 1 43 THR O 1 47 VAL H . . 2.000 1.992 1.809 2.096 0.096 17 0 "[ . 1 . 2]" 3
46 1 43 THR O 1 47 VAL N . . 3.000 2.958 2.780 3.063 0.063 17 0 "[ . 1 . 2]" 3
47 1 44 SER O 1 48 SER H . . 2.000 1.948 1.845 2.151 0.151 13 0 "[ . 1 . 2]" 3
48 1 44 SER O 1 48 SER N . . 3.000 2.838 2.725 3.039 0.039 13 0 "[ . 1 . 2]" 3
49 1 45 LEU O 1 49 GLY H . . 2.000 1.997 1.909 2.049 0.049 14 0 "[ . 1 . 2]" 3
50 1 45 LEU O 1 49 GLY N . . 3.000 2.715 2.679 2.743 . 0 0 "[ . 1 . 2]" 3
51 1 46 THR O 1 50 LEU H . . 2.000 2.013 1.800 2.162 0.162 13 0 "[ . 1 . 2]" 3
52 1 46 THR O 1 50 LEU N . . 3.000 2.867 2.684 3.061 0.061 13 0 "[ . 1 . 2]" 3
53 1 47 VAL O 1 51 VAL H . . 2.000 2.110 2.060 2.216 0.216 17 0 "[ . 1 . 2]" 3
54 1 47 VAL O 1 51 VAL N . . 3.000 3.073 3.013 3.182 0.182 17 0 "[ . 1 . 2]" 3
55 1 48 SER O 1 52 THR H . . 2.000 2.022 1.896 2.077 0.077 13 0 "[ . 1 . 2]" 3
56 1 48 SER O 1 52 THR N . . 3.000 2.937 2.771 3.002 0.002 11 0 "[ . 1 . 2]" 3
57 1 49 GLY O 1 53 GLY H . . 2.000 1.972 1.852 2.108 0.108 2 0 "[ . 1 . 2]" 3
58 1 49 GLY O 1 53 GLY N . . 3.000 2.762 2.693 2.928 . 0 0 "[ . 1 . 2]" 3
59 1 50 LEU O 1 54 ILE H . . 2.000 2.054 1.939 2.136 0.136 2 0 "[ . 1 . 2]" 3
60 1 50 LEU O 1 54 ILE N . . 3.000 2.989 2.816 3.091 0.091 11 0 "[ . 1 . 2]" 3
61 1 51 VAL O 1 55 ALA H . . 2.000 2.117 2.035 2.228 0.228 8 0 "[ . 1 . 2]" 3
62 1 51 VAL O 1 55 ALA N . . 3.000 3.042 2.987 3.163 0.163 8 0 "[ . 1 . 2]" 3
63 1 52 THR O 1 56 PHE H . . 2.000 2.013 1.853 2.092 0.092 9 0 "[ . 1 . 2]" 3
64 1 52 THR O 1 56 PHE N . . 3.000 2.901 2.763 2.995 . 0 0 "[ . 1 . 2]" 3
65 1 53 GLY O 1 57 TRP H . . 2.000 2.102 1.790 2.183 0.183 17 0 "[ . 1 . 2]" 3
66 1 53 GLY O 1 57 TRP N . . 3.000 3.070 2.766 3.160 0.160 7 0 "[ . 1 . 2]" 3
67 1 54 ILE O 1 58 HIS H . . 2.000 2.035 1.838 2.141 0.141 8 0 "[ . 1 . 2]" 3
68 1 54 ILE O 1 58 HIS N . . 3.000 2.974 2.766 3.070 0.070 13 0 "[ . 1 . 2]" 3
69 1 55 ALA O 1 59 TYR H . . 2.000 1.893 1.782 2.047 0.047 11 0 "[ . 1 . 2]" 3
70 1 55 ALA O 1 59 TYR N . . 3.000 2.823 2.705 3.023 0.023 11 0 "[ . 1 . 2]" 3
71 1 56 PHE O 1 60 MET H . . 2.000 1.921 1.789 2.069 0.069 18 0 "[ . 1 . 2]" 3
72 1 56 PHE O 1 60 MET N . . 3.000 2.850 2.721 3.009 0.009 8 0 "[ . 1 . 2]" 3
73 1 57 TRP O 1 61 TYR H . . 2.000 2.052 1.943 2.122 0.122 7 0 "[ . 1 . 2]" 3
74 1 57 TRP O 1 61 TYR N . . 3.000 2.966 2.738 3.094 0.094 7 0 "[ . 1 . 2]" 3
75 1 58 HIS O 1 62 MET H . . 2.000 1.981 1.849 2.074 0.074 10 0 "[ . 1 . 2]" 3
76 1 58 HIS O 1 62 MET N . . 3.000 2.903 2.745 3.032 0.032 18 0 "[ . 1 . 2]" 3
77 1 59 TYR O 1 63 ARG H . . 2.000 1.868 1.761 2.060 0.060 11 0 "[ . 1 . 2]" 3
78 1 59 TYR O 1 63 ARG N . . 3.000 2.767 2.664 3.034 0.034 11 0 "[ . 1 . 2]" 3
79 1 60 MET O 1 64 GLY H . . 2.000 2.074 2.026 2.189 0.189 7 0 "[ . 1 . 2]" 3
80 1 60 MET O 1 64 GLY N . . 3.000 2.946 2.742 3.083 0.083 7 0 "[ . 1 . 2]" 3
81 1 61 TYR O 1 65 VAL H . . 2.000 1.961 1.776 2.062 0.062 8 0 "[ . 1 . 2]" 3
82 1 61 TYR O 1 65 VAL N . . 3.000 2.889 2.709 3.000 . 17 0 "[ . 1 . 2]" 3
83 1 62 MET O 1 66 TRP H . . 2.000 1.920 1.756 2.086 0.086 11 0 "[ . 1 . 2]" 3
84 1 62 MET O 1 66 TRP N . . 3.000 2.820 2.699 3.041 0.041 11 0 "[ . 1 . 2]" 3
85 1 63 ARG O 1 67 ILE H . . 2.000 2.009 1.768 2.097 0.097 11 0 "[ . 1 . 2]" 3
86 1 63 ARG O 1 67 ILE N . . 3.000 2.961 2.706 3.069 0.069 11 0 "[ . 1 . 2]" 3
87 1 64 GLY O 1 68 GLU H . . 2.000 2.030 1.891 2.109 0.109 7 0 "[ . 1 . 2]" 3
88 1 64 GLY O 1 68 GLU N . . 3.000 2.810 2.696 2.888 . 0 0 "[ . 1 . 2]" 3
89 1 74 THR O 1 78 TYR H . . 2.000 1.869 1.774 2.146 0.146 18 0 "[ . 1 . 2]" 3
90 1 74 THR O 1 78 TYR N . . 3.000 2.790 2.680 2.946 . 0 0 "[ . 1 . 2]" 3
91 1 75 VAL O 1 79 ILE H . . 2.000 2.091 1.977 2.216 0.216 19 0 "[ . 1 . 2]" 3
92 1 75 VAL O 1 79 ILE N . . 3.000 3.019 2.925 3.101 0.101 9 0 "[ . 1 . 2]" 3
93 1 76 PHE O 1 80 ASP H . . 2.000 1.907 1.785 2.031 0.031 5 0 "[ . 1 . 2]" 3
94 1 76 PHE O 1 80 ASP N . . 3.000 2.817 2.707 3.016 0.016 17 0 "[ . 1 . 2]" 3
95 1 77 ARG O 1 81 TRP H . . 2.000 1.983 1.819 2.064 0.064 2 0 "[ . 1 . 2]" 3
96 1 77 ARG O 1 81 TRP N . . 3.000 2.886 2.699 3.036 0.036 9 0 "[ . 1 . 2]" 3
97 1 78 TYR O 1 82 LEU H . . 2.000 1.956 1.755 2.126 0.126 18 0 "[ . 1 . 2]" 3
98 1 78 TYR O 1 82 LEU N . . 3.000 2.865 2.685 3.035 0.035 6 0 "[ . 1 . 2]" 3
99 1 79 ILE O 1 83 LEU H . . 2.000 2.053 1.976 2.134 0.134 4 0 "[ . 1 . 2]" 3
100 1 79 ILE O 1 83 LEU N . . 3.000 2.708 2.657 2.825 . 0 0 "[ . 1 . 2]" 3
101 1 80 ASP O 1 84 THR H . . 2.000 2.024 1.854 2.089 0.089 6 0 "[ . 1 . 2]" 3
102 1 80 ASP O 1 84 THR N . . 3.000 2.700 2.630 2.807 . 0 0 "[ . 1 . 2]" 3
103 1 81 TRP O 1 85 VAL H . . 2.000 1.882 1.775 2.068 0.068 13 0 "[ . 1 . 2]" 3
104 1 81 TRP O 1 85 VAL N . . 3.000 2.777 2.697 2.906 . 0 0 "[ . 1 . 2]" 3
105 1 84 THR O 1 88 LEU H . . 2.000 1.769 1.728 1.859 . 0 0 "[ . 1 . 2]" 3
106 1 84 THR O 1 88 LEU N . . 3.000 2.730 2.676 2.809 . 0 0 "[ . 1 . 2]" 3
107 1 85 VAL O 1 89 ILE H . . 2.000 2.120 2.018 2.180 0.180 17 0 "[ . 1 . 2]" 3
108 1 85 VAL O 1 89 ILE N . . 3.000 3.042 2.907 3.118 0.118 8 0 "[ . 1 . 2]" 3
109 1 87 LEU O 1 91 GLU H . . 2.000 2.014 1.840 2.105 0.105 11 0 "[ . 1 . 2]" 3
110 1 87 LEU O 1 91 GLU N . . 3.000 2.921 2.708 3.067 0.067 11 0 "[ . 1 . 2]" 3
111 1 88 LEU O 1 92 PHE H . . 2.000 2.005 1.773 2.091 0.091 11 0 "[ . 1 . 2]" 3
112 1 88 LEU O 1 92 PHE N . . 3.000 2.944 2.729 3.056 0.056 17 0 "[ . 1 . 2]" 3
113 1 89 ILE O 1 93 TYR H . . 2.000 2.034 1.778 2.150 0.150 4 0 "[ . 1 . 2]" 3
114 1 89 ILE O 1 93 TYR N . . 3.000 2.974 2.710 3.098 0.098 4 0 "[ . 1 . 2]" 3
115 1 90 CYS O 1 94 LEU H . . 2.000 1.920 1.795 2.081 0.081 11 0 "[ . 1 . 2]" 3
116 1 90 CYS O 1 94 LEU N . . 3.000 2.760 2.655 2.999 . 0 0 "[ . 1 . 2]" 3
117 1 91 GLU O 1 95 ILE H . . 2.000 2.051 1.826 2.128 0.128 6 0 "[ . 1 . 2]" 3
118 1 91 GLU O 1 95 ILE N . . 3.000 3.000 2.791 3.072 0.072 9 0 "[ . 1 . 2]" 3
119 1 92 PHE O 1 96 LEU H . . 2.000 2.042 1.786 2.189 0.189 15 0 "[ . 1 . 2]" 3
120 1 92 PHE O 1 96 LEU N . . 3.000 2.961 2.697 3.063 0.063 4 0 "[ . 1 . 2]" 3
121 1 93 TYR O 1 97 ALA H . . 2.000 1.906 1.778 2.053 0.053 4 0 "[ . 1 . 2]" 3
122 1 93 TYR O 1 97 ALA N . . 3.000 2.749 2.694 2.843 . 0 0 "[ . 1 . 2]" 3
123 1 94 LEU O 1 98 ALA H . . 2.000 2.086 2.012 2.163 0.163 6 0 "[ . 1 . 2]" 3
124 1 94 LEU O 1 98 ALA N . . 3.000 2.806 2.697 2.989 . 0 0 "[ . 1 . 2]" 3
125 1 105 SER O 1 109 LYS H . . 2.000 1.838 1.710 2.062 0.062 11 0 "[ . 1 . 2]" 3
126 1 105 SER O 1 109 LYS N . . 3.000 2.809 2.676 3.032 0.032 11 0 "[ . 1 . 2]" 3
127 1 106 LEU O 1 110 LEU H . . 2.000 2.046 1.847 2.210 0.210 18 0 "[ . 1 . 2]" 3
128 1 106 LEU O 1 110 LEU N . . 3.000 2.872 2.700 3.022 0.022 8 0 "[ . 1 . 2]" 3
129 1 107 PHE O 1 111 LEU H . . 2.000 1.957 1.784 2.040 0.040 11 0 "[ . 1 . 2]" 3
130 1 107 PHE O 1 111 LEU N . . 3.000 2.911 2.747 2.994 . 0 0 "[ . 1 . 2]" 3
131 1 108 LYS O 1 112 VAL H . . 2.000 1.993 1.854 2.074 0.074 1 0 "[ . 1 . 2]" 3
132 1 108 LYS O 1 112 VAL N . . 3.000 2.926 2.732 3.022 0.022 1 0 "[ . 1 . 2]" 3
133 1 109 LYS O 1 113 GLY H . . 2.000 1.935 1.808 2.011 0.011 2 0 "[ . 1 . 2]" 3
134 1 109 LYS O 1 113 GLY N . . 3.000 2.765 2.685 2.895 . 0 0 "[ . 1 . 2]" 3
135 1 110 LEU O 1 114 SER H . . 2.000 2.042 1.928 2.115 0.115 6 0 "[ . 1 . 2]" 3
136 1 110 LEU O 1 114 SER N . . 3.000 2.942 2.820 3.009 0.009 8 0 "[ . 1 . 2]" 3
137 1 111 LEU O 1 115 LEU H . . 2.000 2.035 1.913 2.108 0.108 10 0 "[ . 1 . 2]" 3
138 1 111 LEU O 1 115 LEU N . . 3.000 2.981 2.844 3.041 0.041 1 0 "[ . 1 . 2]" 3
139 1 112 VAL O 1 116 VAL H . . 2.000 2.006 1.786 2.083 0.083 18 0 "[ . 1 . 2]" 3
140 1 112 VAL O 1 116 VAL N . . 3.000 2.971 2.760 3.052 0.052 18 0 "[ . 1 . 2]" 3
141 1 113 GLY O 1 117 MET H . . 2.000 2.021 1.796 2.125 0.125 10 0 "[ . 1 . 2]" 3
142 1 113 GLY O 1 117 MET N . . 3.000 2.954 2.741 3.030 0.030 10 0 "[ . 1 . 2]" 3
143 1 114 SER O 1 118 LEU H . . 2.000 1.970 1.788 2.142 0.142 10 0 "[ . 1 . 2]" 3
144 1 114 SER O 1 118 LEU N . . 3.000 2.824 2.735 2.931 . 0 0 "[ . 1 . 2]" 3
145 1 115 LEU O 1 119 VAL H . . 2.000 2.020 1.810 2.111 0.111 5 0 "[ . 1 . 2]" 3
146 1 115 LEU O 1 119 VAL N . . 3.000 2.986 2.779 3.080 0.080 5 0 "[ . 1 . 2]" 3
147 1 116 VAL O 1 120 PHE H . . 2.000 2.040 1.966 2.133 0.133 14 0 "[ . 1 . 2]" 3
148 1 116 VAL O 1 120 PHE N . . 3.000 2.977 2.906 3.037 0.037 14 0 "[ . 1 . 2]" 3
149 1 117 MET O 1 121 GLY H . . 2.000 1.941 1.799 2.041 0.041 19 0 "[ . 1 . 2]" 3
150 1 117 MET O 1 121 GLY N . . 3.000 2.819 2.725 2.971 . 0 0 "[ . 1 . 2]" 3
151 1 118 LEU O 1 122 TYR H . . 2.000 1.957 1.789 2.050 0.050 17 0 "[ . 1 . 2]" 3
152 1 118 LEU O 1 122 TYR N . . 3.000 2.919 2.766 3.026 0.026 17 0 "[ . 1 . 2]" 3
153 1 119 VAL O 1 123 MET H . . 2.000 1.937 1.812 2.056 0.056 13 0 "[ . 1 . 2]" 3
154 1 119 VAL O 1 123 MET N . . 3.000 2.862 2.734 3.001 0.001 13 0 "[ . 1 . 2]" 3
155 1 120 PHE O 1 124 GLY H . . 2.000 2.046 1.973 2.122 0.122 14 0 "[ . 1 . 2]" 3
156 1 120 PHE O 1 124 GLY N . . 3.000 2.793 2.711 2.934 . 0 0 "[ . 1 . 2]" 3
157 1 121 GLY O 1 125 GLU H . . 2.000 2.008 1.902 2.119 0.119 13 0 "[ . 1 . 2]" 3
158 1 121 GLY O 1 125 GLU N . . 3.000 2.812 2.737 2.919 . 0 0 "[ . 1 . 2]" 3
159 1 134 ALA O 1 138 GLY N . . 3.000 2.957 2.731 3.217 0.217 10 0 "[ . 1 . 2]" 3
160 1 135 PHE O 1 139 CYS H . . 2.000 1.874 1.785 2.131 0.131 11 0 "[ . 1 . 2]" 3
161 1 135 PHE O 1 139 CYS N . . 3.000 2.782 2.705 3.063 0.063 11 0 "[ . 1 . 2]" 3
162 1 136 ILE O 1 140 LEU H . . 2.000 2.019 1.809 2.155 0.155 2 0 "[ . 1 . 2]" 3
163 1 136 ILE O 1 140 LEU N . . 3.000 2.982 2.739 3.126 0.126 2 0 "[ . 1 . 2]" 3
164 1 137 ILE O 1 141 ALA H . . 2.000 2.093 1.921 2.259 0.259 18 0 "[ . 1 . 2]" 3
165 1 137 ILE O 1 141 ALA N . . 3.000 3.041 2.891 3.181 0.181 18 0 "[ . 1 . 2]" 3
166 1 138 GLY O 1 142 TRP H . . 2.000 1.938 1.809 2.024 0.024 19 0 "[ . 1 . 2]" 3
167 1 138 GLY O 1 142 TRP N . . 3.000 2.805 2.727 2.912 . 0 0 "[ . 1 . 2]" 3
168 1 139 CYS O 1 143 VAL H . . 2.000 1.915 1.796 2.056 0.056 11 0 "[ . 1 . 2]" 3
169 1 139 CYS O 1 143 VAL N . . 3.000 2.892 2.770 3.033 0.033 11 0 "[ . 1 . 2]" 3
170 1 140 LEU O 1 144 TYR H . . 2.000 2.044 1.979 2.076 0.076 18 0 "[ . 1 . 2]" 3
171 1 140 LEU O 1 144 TYR N . . 3.000 2.994 2.924 3.040 0.040 18 0 "[ . 1 . 2]" 3
172 1 141 ALA O 1 145 MET H . . 2.000 1.938 1.826 2.045 0.045 10 0 "[ . 1 . 2]" 3
173 1 141 ALA O 1 145 MET N . . 3.000 2.824 2.722 2.955 . 0 0 "[ . 1 . 2]" 3
174 1 142 TRP O 1 146 ILE H . . 2.000 2.088 2.019 2.173 0.173 19 0 "[ . 1 . 2]" 3
175 1 142 TRP O 1 146 ILE N . . 3.000 3.062 2.995 3.150 0.150 19 0 "[ . 1 . 2]" 3
176 1 143 VAL O 1 147 TYR H . . 2.000 1.940 1.851 2.024 0.024 11 0 "[ . 1 . 2]" 3
177 1 143 VAL O 1 147 TYR N . . 3.000 2.827 2.682 2.966 . 0 0 "[ . 1 . 2]" 3
178 1 144 TYR O 1 148 GLU H . . 2.000 2.048 1.890 2.086 0.086 7 0 "[ . 1 . 2]" 3
179 1 144 TYR O 1 148 GLU N . . 3.000 2.979 2.763 3.060 0.060 1 0 "[ . 1 . 2]" 3
180 1 145 MET O 1 149 LEU H . . 2.000 1.979 1.816 2.092 0.092 9 0 "[ . 1 . 2]" 3
181 1 145 MET O 1 149 LEU N . . 3.000 2.908 2.741 3.023 0.023 5 0 "[ . 1 . 2]" 3
182 1 146 ILE O 1 150 TRP H . . 2.000 1.913 1.762 2.095 0.095 10 0 "[ . 1 . 2]" 3
183 1 146 ILE O 1 150 TRP N . . 3.000 2.664 2.583 2.749 . 0 0 "[ . 1 . 2]" 3
184 1 164 ALA O 1 168 ALA H . . 2.000 2.049 2.010 2.097 0.097 5 0 "[ . 1 . 2]" 3
185 1 164 ALA O 1 168 ALA N . . 3.000 3.000 2.963 3.036 0.036 13 0 "[ . 1 . 2]" 3
186 1 165 VAL O 1 169 TYR H . . 2.000 2.020 1.965 2.060 0.060 13 0 "[ . 1 . 2]" 3
187 1 165 VAL O 1 169 TYR N . . 3.000 2.948 2.883 2.990 . 0 0 "[ . 1 . 2]" 3
188 1 166 GLN O 1 170 ASN H . . 2.000 2.052 2.014 2.083 0.083 5 0 "[ . 1 . 2]" 3
189 1 166 GLN O 1 170 ASN N . . 3.000 2.996 2.921 3.045 0.045 13 0 "[ . 1 . 2]" 3
190 1 167 SER O 1 171 THR H . . 2.000 2.039 1.995 2.076 0.076 2 0 "[ . 1 . 2]" 3
191 1 167 SER O 1 171 THR N . . 3.000 2.993 2.917 3.051 0.051 17 0 "[ . 1 . 2]" 3
192 1 168 ALA O 1 172 MET H . . 2.000 2.046 2.011 2.078 0.078 3 0 "[ . 1 . 2]" 3
193 1 168 ALA O 1 172 MET N . . 3.000 2.911 2.841 2.984 . 0 0 "[ . 1 . 2]" 3
194 1 169 TYR O 1 173 MET H . . 2.000 1.991 1.829 2.090 0.090 14 0 "[ . 1 . 2]" 3
195 1 169 TYR O 1 173 MET N . . 3.000 2.952 2.804 3.026 0.026 10 0 "[ . 1 . 2]" 3
196 1 170 ASN O 1 174 TYR H . . 2.000 2.071 2.012 2.165 0.165 2 0 "[ . 1 . 2]" 3
197 1 170 ASN O 1 174 TYR N . . 3.000 2.950 2.890 3.020 0.020 2 0 "[ . 1 . 2]" 3
198 1 171 THR O 1 175 ILE H . . 2.000 2.040 1.809 2.100 0.100 20 0 "[ . 1 . 2]" 3
199 1 171 THR O 1 175 ILE N . . 3.000 2.985 2.747 3.057 0.057 17 0 "[ . 1 . 2]" 3
200 1 172 MET O 1 176 ILE H . . 2.000 2.029 1.788 2.109 0.109 12 0 "[ . 1 . 2]" 3
201 1 172 MET O 1 176 ILE N . . 3.000 2.959 2.734 3.055 0.055 6 0 "[ . 1 . 2]" 3
202 1 173 MET O 1 177 ILE H . . 2.000 2.005 1.839 2.219 0.219 20 0 "[ . 1 . 2]" 3
203 1 173 MET O 1 177 ILE N . . 3.000 2.947 2.799 3.162 0.162 20 0 "[ . 1 . 2]" 3
204 1 174 TYR O 1 178 PHE H . . 2.000 2.065 1.883 2.137 0.137 20 0 "[ . 1 . 2]" 3
205 1 174 TYR O 1 178 PHE N . . 3.000 2.999 2.805 3.078 0.078 17 0 "[ . 1 . 2]" 3
206 1 175 ILE O 1 179 GLY H . . 2.000 2.002 1.796 2.149 0.149 14 0 "[ . 1 . 2]" 3
207 1 175 ILE O 1 179 GLY N . . 3.000 2.965 2.752 3.113 0.113 14 0 "[ . 1 . 2]" 3
208 1 176 ILE O 1 180 TRP H . . 2.000 2.044 1.976 2.123 0.123 14 0 "[ . 1 . 2]" 3
209 1 176 ILE O 1 180 TRP N . . 3.000 2.965 2.877 3.042 0.042 20 0 "[ . 1 . 2]" 3
210 1 177 ILE O 1 181 ALA H . . 2.000 1.875 1.792 1.933 . 0 0 "[ . 1 . 2]" 3
211 1 177 ILE O 1 181 ALA N . . 3.000 2.699 2.626 2.777 . 0 0 "[ . 1 . 2]" 3
212 1 178 PHE O 1 182 ILE H . . 2.000 2.091 1.798 2.198 0.198 20 0 "[ . 1 . 2]" 3
213 1 178 PHE O 1 182 ILE N . . 3.000 2.817 2.704 2.934 . 0 0 "[ . 1 . 2]" 3
214 1 179 GLY O 1 183 TYR H . . 2.000 2.088 1.852 2.196 0.196 17 0 "[ . 1 . 2]" 3
215 1 179 GLY O 1 183 TYR N . . 3.000 2.959 2.718 3.082 0.082 17 0 "[ . 1 . 2]" 3
216 1 182 ILE O 1 186 GLY H . . 2.000 1.957 1.771 2.058 0.058 4 0 "[ . 1 . 2]" 3
217 1 182 ILE O 1 186 GLY N . . 3.000 2.870 2.687 2.982 . 0 0 "[ . 1 . 2]" 3
218 1 183 TYR O 1 187 TYR H . . 2.000 2.115 2.011 2.258 0.258 3 0 "[ . 1 . 2]" 3
219 1 183 TYR O 1 187 TYR N . . 3.000 3.041 2.945 3.216 0.216 17 0 "[ . 1 . 2]" 3
220 1 187 TYR O 1 191 TYR H . . 2.000 2.072 1.796 2.177 0.177 19 0 "[ . 1 . 2]" 3
221 1 187 TYR O 1 191 TYR N . . 3.000 2.750 2.640 3.028 0.028 17 0 "[ . 1 . 2]" 3
222 1 199 ALA O 1 203 ASN H . . 2.000 1.992 1.892 2.049 0.049 2 0 "[ . 1 . 2]" 3
223 1 199 ALA O 1 203 ASN N . . 3.000 2.941 2.748 3.003 0.003 2 0 "[ . 1 . 2]" 3
224 1 200 LEU O 1 204 LEU H . . 2.000 2.015 1.946 2.039 0.039 12 0 "[ . 1 . 2]" 3
225 1 200 LEU O 1 204 LEU N . . 3.000 2.963 2.908 3.011 0.011 14 0 "[ . 1 . 2]" 3
226 1 201 ASN O 1 205 ILE H . . 2.000 1.933 1.790 2.073 0.073 12 0 "[ . 1 . 2]" 3
227 1 201 ASN O 1 205 ILE N . . 3.000 2.890 2.747 3.047 0.047 12 0 "[ . 1 . 2]" 3
228 1 202 LEU O 1 206 TYR H . . 2.000 1.963 1.797 2.119 0.119 12 0 "[ . 1 . 2]" 3
229 1 202 LEU O 1 206 TYR N . . 3.000 2.904 2.738 3.017 0.017 20 0 "[ . 1 . 2]" 3
230 1 203 ASN O 1 207 ASN H . . 2.000 1.840 1.772 2.031 0.031 15 0 "[ . 1 . 2]" 3
231 1 203 ASN O 1 207 ASN N . . 3.000 2.763 2.716 2.980 . 0 0 "[ . 1 . 2]" 3
232 1 204 LEU O 1 208 LEU H . . 2.000 1.861 1.785 2.033 0.033 15 0 "[ . 1 . 2]" 3
233 1 204 LEU O 1 208 LEU N . . 3.000 2.780 2.713 2.988 . 0 0 "[ . 1 . 2]" 3
234 1 205 ILE O 1 209 ALA H . . 2.000 1.991 1.833 2.090 0.090 15 0 "[ . 1 . 2]" 3
235 1 205 ILE O 1 209 ALA N . . 3.000 2.939 2.739 3.041 0.041 15 0 "[ . 1 . 2]" 3
236 1 206 TYR O 1 210 ASP H . . 2.000 2.028 1.882 2.061 0.061 3 0 "[ . 1 . 2]" 3
237 1 206 TYR O 1 210 ASP N . . 3.000 2.995 2.857 3.040 0.040 3 0 "[ . 1 . 2]" 3
238 1 207 ASN O 1 211 PHE H . . 2.000 1.905 1.796 2.002 0.002 5 0 "[ . 1 . 2]" 3
239 1 207 ASN O 1 211 PHE N . . 3.000 2.729 2.698 2.796 . 0 0 "[ . 1 . 2]" 3
240 1 208 LEU O 1 212 VAL H . . 2.000 1.960 1.795 2.057 0.057 6 0 "[ . 1 . 2]" 3
241 1 208 LEU O 1 212 VAL N . . 3.000 2.912 2.759 3.031 0.031 6 0 "[ . 1 . 2]" 3
242 1 209 ALA O 1 213 ASN H . . 2.000 2.016 1.884 2.088 0.088 13 0 "[ . 1 . 2]" 3
243 1 209 ALA O 1 213 ASN N . . 3.000 2.821 2.744 3.002 0.002 18 0 "[ . 1 . 2]" 3
244 1 215 ILE O 1 219 LEU H . . 2.000 2.007 1.806 2.084 0.084 20 0 "[ . 1 . 2]" 3
245 1 215 ILE O 1 219 LEU N . . 3.000 2.962 2.745 3.027 0.027 2 0 "[ . 1 . 2]" 3
246 1 216 LEU O 1 220 ILE H . . 2.000 1.880 1.798 2.020 0.020 5 0 "[ . 1 . 2]" 3
247 1 216 LEU O 1 220 ILE N . . 3.000 2.816 2.724 2.984 . 0 0 "[ . 1 . 2]" 3
248 1 217 PHE O 1 221 ILE H . . 2.000 2.083 2.014 2.145 0.145 13 0 "[ . 1 . 2]" 3
249 1 217 PHE O 1 221 ILE N . . 3.000 3.032 2.979 3.117 0.117 13 0 "[ . 1 . 2]" 3
250 1 218 GLY O 1 222 TRP H . . 2.000 1.998 1.799 2.134 0.134 15 0 "[ . 1 . 2]" 3
251 1 218 GLY O 1 222 TRP N . . 3.000 2.897 2.734 3.101 0.101 15 0 "[ . 1 . 2]" 3
252 1 219 LEU O 1 223 ASN H . . 2.000 1.962 1.830 2.106 0.106 15 0 "[ . 1 . 2]" 3
253 1 219 LEU O 1 223 ASN N . . 3.000 2.829 2.738 2.984 . 0 0 "[ . 1 . 2]" 3
254 1 220 ILE O 1 224 VAL H . . 2.000 1.990 1.810 2.165 0.165 8 0 "[ . 1 . 2]" 3
255 1 220 ILE O 1 224 VAL N . . 3.000 2.944 2.742 3.078 0.078 8 0 "[ . 1 . 2]" 3
256 1 221 ILE O 1 225 ALA H . . 2.000 2.131 2.025 2.172 0.172 11 0 "[ . 1 . 2]" 3
257 1 221 ILE O 1 225 ALA N . . 3.000 2.998 2.916 3.111 0.111 8 0 "[ . 1 . 2]" 3
258 1 222 TRP O 1 226 VAL H . . 2.000 1.790 1.728 1.939 . 0 0 "[ . 1 . 2]" 3
259 1 222 TRP O 1 226 VAL N . . 3.000 2.706 2.618 2.902 . 0 0 "[ . 1 . 2]" 3
260 1 223 ASN O 1 227 LYS H . . 2.000 2.041 1.859 2.181 0.181 5 0 "[ . 1 . 2]" 3
261 1 223 ASN O 1 227 LYS N . . 3.000 2.905 2.713 3.036 0.036 5 0 "[ . 1 . 2]" 3
262 1 224 VAL O 1 228 GLU H . . 2.000 1.991 1.808 2.087 0.087 19 0 "[ . 1 . 2]" 3
263 1 224 VAL O 1 228 GLU N . . 3.000 2.893 2.739 3.006 0.006 8 0 "[ . 1 . 2]" 3
264 1 225 ALA O 1 229 SER H . . 2.000 2.051 1.947 2.154 0.154 18 0 "[ . 1 . 2]" 3
265 1 225 ALA O 1 229 SER N . . 3.000 2.916 2.767 3.033 0.033 18 0 "[ . 1 . 2]" 3
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