NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
383838 |
1k42   |
5181 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1k42
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 1521
_Distance_constraint_stats_list.Viol_count 3244
_Distance_constraint_stats_list.Viol_total 2065.010
_Distance_constraint_stats_list.Viol_max 0.397
_Distance_constraint_stats_list.Viol_rms 0.0343
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0094
_Distance_constraint_stats_list.Viol_average_violations_only 0.0530
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 1 MET 0.001 0.001 10 0 "[ . 1 ]"
1 3 VAL 0.464 0.037 4 0 "[ . 1 ]"
1 4 ALA 0.556 0.037 4 0 "[ . 1 ]"
1 5 ASN 0.276 0.033 2 0 "[ . 1 ]"
1 6 ILE 0.186 0.018 2 0 "[ . 1 ]"
1 7 ASN 0.542 0.049 6 0 "[ . 1 ]"
1 8 GLY 0.453 0.101 6 0 "[ . 1 ]"
1 9 GLY 0.056 0.022 6 0 "[ . 1 ]"
1 10 PHE 0.272 0.069 12 0 "[ . 1 ]"
1 11 GLU 0.348 0.080 12 0 "[ . 1 ]"
1 12 SER 0.073 0.028 10 0 "[ . 1 ]"
1 13 THR 1.145 0.069 2 0 "[ . 1 ]"
1 14 PRO 2.553 0.205 12 0 "[ . 1 ]"
1 15 ALA 2.322 0.205 12 0 "[ . 1 ]"
1 16 GLY 1.123 0.145 3 0 "[ . 1 ]"
1 17 VAL 2.814 0.145 3 0 "[ . 1 ]"
1 18 VAL 4.496 0.136 5 0 "[ . 1 ]"
1 19 THR 1.962 0.136 5 0 "[ . 1 ]"
1 20 ASP 0.258 0.042 7 0 "[ . 1 ]"
1 21 LEU 8.482 0.259 9 0 "[ . 1 ]"
1 22 ALA 2.665 0.259 9 0 "[ . 1 ]"
1 23 GLU 0.280 0.030 10 0 "[ . 1 ]"
1 24 GLY 0.171 0.026 8 0 "[ . 1 ]"
1 25 VAL 0.209 0.029 12 0 "[ . 1 ]"
1 26 GLU 0.346 0.039 3 0 "[ . 1 ]"
1 27 GLY 0.174 0.039 3 0 "[ . 1 ]"
1 28 TRP 7.575 0.265 11 0 "[ . 1 ]"
1 29 ASP 2.875 0.199 8 0 "[ . 1 ]"
1 30 LEU 4.876 0.139 11 0 "[ . 1 ]"
1 31 ASN 1.561 0.103 1 0 "[ . 1 ]"
1 32 VAL 3.092 0.121 9 0 "[ . 1 ]"
1 33 GLY 0.298 0.028 10 0 "[ . 1 ]"
1 34 SER 0.000 0.000 . 0 "[ . 1 ]"
1 35 SER 0.050 0.017 7 0 "[ . 1 ]"
1 36 VAL 5.740 0.387 2 0 "[ . 1 ]"
1 37 THR 2.769 0.155 4 0 "[ . 1 ]"
1 38 ASN 2.914 0.155 4 0 "[ . 1 ]"
1 39 PRO 0.484 0.035 3 0 "[ . 1 ]"
1 40 PRO 0.683 0.048 7 0 "[ . 1 ]"
1 41 VAL 3.136 0.133 12 0 "[ . 1 ]"
1 42 PHE 6.726 0.361 1 0 "[ . 1 ]"
1 43 GLU 2.258 0.133 12 0 "[ . 1 ]"
1 44 VAL 1.772 0.106 7 0 "[ . 1 ]"
1 45 LEU 4.279 0.217 12 0 "[ . 1 ]"
1 46 GLU 4.861 0.217 12 0 "[ . 1 ]"
1 47 THR 1.322 0.155 3 0 "[ . 1 ]"
1 48 SER 0.008 0.005 1 0 "[ . 1 ]"
1 49 ASP 0.003 0.003 7 0 "[ . 1 ]"
1 50 ALA 0.204 0.024 10 0 "[ . 1 ]"
1 51 PRO 0.000 0.000 . 0 "[ . 1 ]"
1 52 GLU 0.040 0.010 11 0 "[ . 1 ]"
1 53 GLY 0.000 0.000 . 0 "[ . 1 ]"
1 54 ASN 0.172 0.051 12 0 "[ . 1 ]"
1 55 LYS 0.283 0.062 12 0 "[ . 1 ]"
1 56 VAL 1.011 0.073 7 0 "[ . 1 ]"
1 57 LEU 5.052 0.156 12 0 "[ . 1 ]"
1 58 ALA 1.507 0.096 4 0 "[ . 1 ]"
1 59 VAL 10.404 0.397 3 0 "[ . 1 ]"
1 60 THR 5.161 0.216 5 0 "[ . 1 ]"
1 61 VAL 0.193 0.025 10 0 "[ . 1 ]"
1 62 ASN 1.659 0.110 10 0 "[ . 1 ]"
1 63 GLY 0.293 0.019 7 0 "[ . 1 ]"
1 64 VAL 2.007 0.059 12 0 "[ . 1 ]"
1 65 GLY 0.486 0.046 4 0 "[ . 1 ]"
1 66 ASN 0.053 0.017 7 0 "[ . 1 ]"
1 67 ASN 0.503 0.049 1 0 "[ . 1 ]"
1 68 PRO 0.417 0.049 1 0 "[ . 1 ]"
1 69 TRP 0.021 0.009 1 0 "[ . 1 ]"
1 70 ASP 0.471 0.043 10 0 "[ . 1 ]"
1 71 ILE 0.842 0.067 11 0 "[ . 1 ]"
1 72 GLU 0.366 0.049 5 0 "[ . 1 ]"
1 73 ALA 3.590 0.156 12 0 "[ . 1 ]"
1 74 THR 1.994 0.090 9 0 "[ . 1 ]"
1 75 ALA 3.297 0.146 3 0 "[ . 1 ]"
1 76 PHE 2.537 0.146 3 0 "[ . 1 ]"
1 77 PRO 0.501 0.076 12 0 "[ . 1 ]"
1 78 VAL 0.373 0.059 7 0 "[ . 1 ]"
1 79 ASN 0.218 0.059 7 0 "[ . 1 ]"
1 80 VAL 1.297 0.073 12 0 "[ . 1 ]"
1 81 ARG 0.939 0.073 12 0 "[ . 1 ]"
1 82 PRO 0.428 0.037 10 0 "[ . 1 ]"
1 83 GLY 0.100 0.014 4 0 "[ . 1 ]"
1 84 VAL 7.781 0.287 11 0 "[ . 1 ]"
1 85 THR 3.956 0.264 10 0 "[ . 1 ]"
1 86 TYR 0.154 0.029 11 0 "[ . 1 ]"
1 87 THR 0.058 0.029 11 0 "[ . 1 ]"
1 88 TYR 0.311 0.052 2 0 "[ . 1 ]"
1 89 THR 2.330 0.122 8 0 "[ . 1 ]"
1 90 ILE 1.687 0.083 8 0 "[ . 1 ]"
1 91 TRP 1.382 0.103 8 0 "[ . 1 ]"
1 92 ALA 0.479 0.040 4 0 "[ . 1 ]"
1 93 ARG 2.474 0.119 10 0 "[ . 1 ]"
1 94 ALA 1.595 0.136 10 0 "[ . 1 ]"
1 95 GLU 1.048 0.088 8 0 "[ . 1 ]"
1 96 GLN 0.132 0.022 4 0 "[ . 1 ]"
1 97 ASP 1.214 0.088 11 0 "[ . 1 ]"
1 98 GLY 0.006 0.006 4 0 "[ . 1 ]"
1 99 ALA 2.425 0.150 4 0 "[ . 1 ]"
1 100 VAL 3.436 0.150 4 0 "[ . 1 ]"
1 101 VAL 5.013 0.165 12 0 "[ . 1 ]"
1 102 SER 1.100 0.069 1 0 "[ . 1 ]"
1 103 PHE 1.016 0.113 4 0 "[ . 1 ]"
1 104 THR 4.012 0.266 8 0 "[ . 1 ]"
1 105 VAL 14.490 0.344 11 0 "[ . 1 ]"
1 106 GLY 0.000 0.000 . 0 "[ . 1 ]"
1 107 ASN 1.470 0.364 8 0 "[ . 1 ]"
1 108 GLN 0.742 0.364 8 0 "[ . 1 ]"
1 109 SER 1.746 0.162 1 0 "[ . 1 ]"
1 110 PHE 0.512 0.085 8 0 "[ . 1 ]"
1 111 GLN 0.538 0.074 9 0 "[ . 1 ]"
1 112 GLU 1.318 0.182 3 0 "[ . 1 ]"
1 113 TYR 1.830 0.190 12 0 "[ . 1 ]"
1 114 GLY 3.566 0.285 12 0 "[ . 1 ]"
1 115 ARG 0.035 0.016 6 0 "[ . 1 ]"
1 116 LEU 1.353 0.113 4 0 "[ . 1 ]"
1 117 HIS 0.381 0.072 4 0 "[ . 1 ]"
1 118 GLU 0.072 0.072 4 0 "[ . 1 ]"
1 119 GLN 0.082 0.030 10 0 "[ . 1 ]"
1 120 GLN 0.000 0.000 . 0 "[ . 1 ]"
1 121 ILE 2.686 0.135 11 0 "[ . 1 ]"
1 122 THR 5.635 0.206 11 0 "[ . 1 ]"
1 123 THR 2.608 0.176 11 0 "[ . 1 ]"
1 124 GLU 0.014 0.014 12 0 "[ . 1 ]"
1 125 TRP 0.045 0.014 12 0 "[ . 1 ]"
1 126 GLN 0.505 0.044 11 0 "[ . 1 ]"
1 127 PRO 0.505 0.044 11 0 "[ . 1 ]"
1 128 PHE 3.361 0.140 8 0 "[ . 1 ]"
1 129 THR 5.269 0.294 11 0 "[ . 1 ]"
1 130 PHE 6.278 0.294 11 0 "[ . 1 ]"
1 131 GLU 0.188 0.025 1 0 "[ . 1 ]"
1 132 PHE 0.000 0.000 . 0 "[ . 1 ]"
1 133 THR 0.653 0.067 8 0 "[ . 1 ]"
1 134 VAL 3.422 0.178 8 0 "[ . 1 ]"
1 135 SER 0.548 0.105 10 0 "[ . 1 ]"
1 136 ASP 2.831 0.174 12 0 "[ . 1 ]"
1 137 GLN 2.267 0.174 12 0 "[ . 1 ]"
1 138 GLU 2.853 0.178 8 0 "[ . 1 ]"
1 139 THR 0.245 0.018 12 0 "[ . 1 ]"
1 140 VAL 1.403 0.083 3 0 "[ . 1 ]"
1 141 ILE 2.018 0.071 6 0 "[ . 1 ]"
1 142 ARG 1.827 0.085 8 0 "[ . 1 ]"
1 143 ALA 3.189 0.238 6 0 "[ . 1 ]"
1 144 PRO 0.128 0.022 5 0 "[ . 1 ]"
1 145 ILE 4.895 0.265 11 0 "[ . 1 ]"
1 146 HIS 1.447 0.110 9 0 "[ . 1 ]"
1 147 PHE 0.905 0.081 6 0 "[ . 1 ]"
1 148 GLY 1.477 0.104 11 0 "[ . 1 ]"
1 149 TYR 2.695 0.208 4 0 "[ . 1 ]"
1 150 ALA 3.158 0.208 4 0 "[ . 1 ]"
1 151 ALA 2.758 0.220 6 0 "[ . 1 ]"
1 152 ASN 0.628 0.046 10 0 "[ . 1 ]"
1 153 VAL 6.215 0.265 4 0 "[ . 1 ]"
1 154 GLY 0.298 0.024 8 0 "[ . 1 ]"
1 155 ASN 0.201 0.022 7 0 "[ . 1 ]"
1 156 THR 0.096 0.024 4 0 "[ . 1 ]"
1 157 ILE 3.892 0.139 10 0 "[ . 1 ]"
1 158 TYR 3.278 0.136 10 0 "[ . 1 ]"
1 159 ILE 3.892 0.154 9 0 "[ . 1 ]"
1 160 ASP 1.140 0.103 8 0 "[ . 1 ]"
1 161 GLY 0.134 0.022 6 0 "[ . 1 ]"
1 162 LEU 2.822 0.155 9 0 "[ . 1 ]"
1 163 ALA 1.399 0.086 10 0 "[ . 1 ]"
1 164 ILE 0.357 0.065 10 0 "[ . 1 ]"
1 165 ALA 0.193 0.033 2 0 "[ . 1 ]"
1 166 SER 0.187 0.033 2 0 "[ . 1 ]"
1 167 GLN 0.003 0.003 12 0 "[ . 1 ]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 1 MET ME 1 165 ALA MB 3.300 . 3.300 3.117 2.706 3.301 0.001 10 0 "[ . 1 ]" 1
2 1 3 VAL MG2 1 4 ALA H 3.800 . 3.800 1.874 1.863 1.886 0.037 4 0 "[ . 1 ]" 1
3 1 3 VAL MG1 1 4 ALA H 2.800 . 2.800 2.758 2.220 2.814 0.014 5 0 "[ . 1 ]" 1
4 1 3 VAL H 1 4 ALA H 5.500 . 5.500 4.524 4.382 4.704 . 0 0 "[ . 1 ]" 1
5 1 3 VAL MG2 1 5 ASN H 3.300 . 3.300 2.606 2.187 3.301 0.001 2 0 "[ . 1 ]" 1
6 1 3 VAL MG1 1 5 ASN H 2.800 . 2.800 2.243 1.893 2.582 0.007 12 0 "[ . 1 ]" 1
7 1 3 VAL MG2 1 164 ILE H 4.200 . 4.200 2.608 2.346 3.029 . 0 0 "[ . 1 ]" 1
8 1 3 VAL MG1 1 164 ILE H 3.300 . 3.300 3.241 2.906 3.316 0.016 12 0 "[ . 1 ]" 1
9 1 3 VAL MG1 1 165 ALA HA 5.500 . 5.500 5.098 4.415 5.437 . 0 0 "[ . 1 ]" 1
10 1 4 ALA H 1 4 ALA MB 2.800 . 2.800 2.214 2.084 2.270 . 0 0 "[ . 1 ]" 1
11 1 4 ALA HA 1 5 ASN H 3.800 . 3.800 3.575 3.519 3.591 . 0 0 "[ . 1 ]" 1
12 1 4 ALA H 1 5 ASN H 2.800 . 2.800 2.705 2.449 2.826 0.026 4 0 "[ . 1 ]" 1
13 1 4 ALA HA 1 78 VAL MG1 5.500 . 5.500 3.664 3.257 3.983 . 0 0 "[ . 1 ]" 1
14 1 4 ALA MB 1 78 VAL HA 4.200 . 4.200 3.648 3.190 4.211 0.011 12 0 "[ . 1 ]" 1
15 1 4 ALA H 1 78 VAL MG1 5.500 . 5.500 4.573 4.280 4.929 . 0 0 "[ . 1 ]" 1
16 1 4 ALA HA 1 79 ASN QB 5.500 . 5.500 2.155 1.893 2.638 0.007 10 0 "[ . 1 ]" 1
17 1 4 ALA HA 1 79 ASN H 3.300 . 3.300 2.644 2.063 3.281 . 0 0 "[ . 1 ]" 1
18 1 4 ALA MB 1 80 VAL MG1 2.800 . 2.800 2.769 2.575 2.813 0.013 11 0 "[ . 1 ]" 1
19 1 4 ALA MB 1 86 TYR QD 4.200 . 4.200 2.816 2.634 3.016 . 0 0 "[ . 1 ]" 1
20 1 4 ALA H 1 164 ILE HB 4.200 . 4.200 4.085 3.875 4.219 0.019 6 0 "[ . 1 ]" 1
21 1 4 ALA H 1 164 ILE MG 5.500 . 5.500 4.410 3.906 5.054 . 0 0 "[ . 1 ]" 1
22 1 4 ALA H 1 164 ILE H 5.500 . 5.500 3.985 3.763 4.313 . 0 0 "[ . 1 ]" 1
23 1 4 ALA H 1 165 ALA HA 4.200 . 4.200 3.264 2.606 3.844 . 0 0 "[ . 1 ]" 1
24 1 4 ALA H 1 165 ALA MB 4.200 . 4.200 3.455 3.139 3.846 . 0 0 "[ . 1 ]" 1
25 1 5 ASN HA 1 5 ASN QB 3.800 . 3.800 2.345 2.196 2.487 . 0 0 "[ . 1 ]" 1
26 1 5 ASN QB 1 5 ASN QD 5.500 . 5.500 2.271 2.182 2.411 . 0 0 "[ . 1 ]" 1
27 1 5 ASN H 1 5 ASN QB 4.200 . 4.200 2.337 2.144 2.836 . 0 0 "[ . 1 ]" 1
28 1 5 ASN HA 1 6 ILE H 3.300 . 3.300 2.251 2.182 2.577 . 0 0 "[ . 1 ]" 1
29 1 5 ASN QB 1 6 ILE H 3.800 . 3.800 3.534 2.303 3.811 0.011 5 0 "[ . 1 ]" 1
30 1 5 ASN QD 1 8 GLY QA 5.500 . 5.500 1.966 1.867 2.095 0.033 2 0 "[ . 1 ]" 1
31 1 5 ASN QD 1 8 GLY H 3.800 . 3.800 3.135 2.322 3.816 0.016 10 0 "[ . 1 ]" 1
32 1 5 ASN QD 1 9 GLY H 5.500 . 5.500 4.675 4.220 5.289 . 0 0 "[ . 1 ]" 1
33 1 5 ASN QD 1 75 ALA MB 5.500 . 5.500 2.371 1.884 3.277 0.016 10 0 "[ . 1 ]" 1
34 1 5 ASN HA 1 78 VAL MG2 3.800 . 3.800 2.401 1.940 3.382 . 0 0 "[ . 1 ]" 1
35 1 5 ASN HA 1 78 VAL MG1 3.800 . 3.800 3.031 2.351 3.506 . 0 0 "[ . 1 ]" 1
36 1 5 ASN HA 1 78 VAL HA 4.200 . 4.200 2.659 1.883 3.176 0.017 2 0 "[ . 1 ]" 1
37 1 5 ASN QB 1 78 VAL MG2 3.800 . 3.800 2.680 1.873 3.307 0.027 7 0 "[ . 1 ]" 1
38 1 5 ASN H 1 78 VAL MG2 5.500 . 5.500 4.178 3.688 4.932 . 0 0 "[ . 1 ]" 1
39 1 5 ASN H 1 78 VAL MG1 5.500 . 5.500 3.288 2.776 3.841 . 0 0 "[ . 1 ]" 1
40 1 5 ASN HA 1 79 ASN H 5.500 . 5.500 3.886 3.278 4.279 . 0 0 "[ . 1 ]" 1
41 1 5 ASN QD 1 162 LEU H 5.500 . 5.500 4.961 4.642 5.483 . 0 0 "[ . 1 ]" 1
42 1 5 ASN QD 1 162 LEU MD2 4.200 . 4.200 3.584 2.945 4.232 0.032 2 0 "[ . 1 ]" 1
43 1 5 ASN QB 1 164 ILE MD 5.500 . 5.500 2.310 1.894 3.039 0.006 1 0 "[ . 1 ]" 1
44 1 5 ASN H 1 164 ILE HB 3.300 . 3.300 2.810 2.423 3.147 . 0 0 "[ . 1 ]" 1
45 1 5 ASN H 1 164 ILE H 5.500 . 5.500 2.475 2.268 3.038 . 0 0 "[ . 1 ]" 1
46 1 6 ILE HA 1 6 ILE QG 3.800 . 3.800 2.330 2.146 3.111 . 0 0 "[ . 1 ]" 1
47 1 6 ILE HA 1 6 ILE MG 2.800 . 2.800 2.399 2.278 2.443 . 0 0 "[ . 1 ]" 1
48 1 6 ILE HA 1 6 ILE MD 3.800 . 3.800 3.481 2.060 3.813 0.013 12 0 "[ . 1 ]" 1
49 1 6 ILE H 1 6 ILE HB 2.800 . 2.800 2.537 2.387 2.746 . 0 0 "[ . 1 ]" 1
50 1 6 ILE H 1 6 ILE MD 4.200 . 4.200 3.007 2.236 3.905 . 0 0 "[ . 1 ]" 1
51 1 6 ILE H 1 6 ILE QG 3.800 . 3.800 3.083 2.338 3.476 . 0 0 "[ . 1 ]" 1
52 1 6 ILE H 1 6 ILE MG 5.500 . 5.500 3.800 3.735 3.902 . 0 0 "[ . 1 ]" 1
53 1 6 ILE MG 1 7 ASN QD 5.500 . 5.500 4.084 1.892 4.817 0.008 2 0 "[ . 1 ]" 1
54 1 6 ILE MG 1 7 ASN HA 3.800 . 3.800 3.685 3.420 3.818 0.018 2 0 "[ . 1 ]" 1
55 1 6 ILE MG 1 7 ASN QB 4.200 . 4.200 2.672 2.368 3.423 . 0 0 "[ . 1 ]" 1
56 1 6 ILE HA 1 8 GLY H 5.500 . 5.500 3.556 3.286 4.176 . 0 0 "[ . 1 ]" 1
57 1 6 ILE MG 1 26 GLU QG 3.300 . 3.300 3.180 2.758 3.314 0.014 7 0 "[ . 1 ]" 1
58 1 6 ILE HB 1 27 GLY QA 4.200 . 4.200 3.650 1.894 4.212 0.012 7 0 "[ . 1 ]" 1
59 1 6 ILE MG 1 27 GLY QA 3.800 . 3.800 3.529 2.775 3.814 0.014 6 0 "[ . 1 ]" 1
60 1 6 ILE H 1 27 GLY QA 5.500 . 5.500 3.997 3.358 4.345 . 0 0 "[ . 1 ]" 1
61 1 6 ILE MD 1 77 PRO QD 4.200 . 4.200 3.664 1.907 4.176 . 0 0 "[ . 1 ]" 1
62 1 6 ILE H 1 78 VAL MG2 5.500 . 5.500 3.695 3.274 4.637 . 0 0 "[ . 1 ]" 1
63 1 6 ILE MD 1 79 ASN QD 4.200 . 4.200 3.129 2.200 4.195 . 0 0 "[ . 1 ]" 1
64 1 7 ASN HA 1 7 ASN QB 3.300 . 3.300 2.482 2.219 2.544 . 0 0 "[ . 1 ]" 1
65 1 7 ASN QB 1 7 ASN QD 3.800 . 3.800 2.327 2.167 2.838 . 0 0 "[ . 1 ]" 1
66 1 7 ASN H 1 7 ASN QB 4.200 . 4.200 3.139 2.992 3.401 . 0 0 "[ . 1 ]" 1
67 1 7 ASN H 1 7 ASN QD 5.500 . 5.500 4.478 2.916 5.118 . 0 0 "[ . 1 ]" 1
68 1 7 ASN HA 1 8 GLY H 3.300 . 3.300 3.008 2.642 3.193 . 0 0 "[ . 1 ]" 1
69 1 7 ASN QB 1 8 GLY H 5.500 . 5.500 3.722 3.554 3.932 . 0 0 "[ . 1 ]" 1
70 1 7 ASN H 1 8 GLY H 3.300 . 3.300 2.652 2.484 3.106 . 0 0 "[ . 1 ]" 1
71 1 7 ASN QD 1 10 PHE HA 5.500 . 5.500 2.613 1.851 4.885 0.049 6 0 "[ . 1 ]" 1
72 1 7 ASN QD 1 12 SER H 3.800 . 3.800 2.673 2.171 3.828 0.028 10 0 "[ . 1 ]" 1
73 1 7 ASN QD 1 12 SER QB 5.500 . 5.500 2.492 1.893 3.969 0.007 3 0 "[ . 1 ]" 1
74 1 7 ASN QD 1 13 THR HG1 4.200 . 4.200 2.681 1.948 3.772 . 0 0 "[ . 1 ]" 1
75 1 7 ASN QD 1 13 THR MG 5.500 . 5.500 3.945 3.590 5.056 . 0 0 "[ . 1 ]" 1
76 1 7 ASN QD 1 13 THR H 5.500 . 5.500 2.248 1.868 4.019 0.032 11 0 "[ . 1 ]" 1
77 1 7 ASN QD 1 25 VAL MG1 3.800 . 3.800 2.167 1.887 3.381 0.013 9 0 "[ . 1 ]" 1
78 1 7 ASN QD 1 26 GLU H 5.500 . 5.500 3.502 2.924 4.260 . 0 0 "[ . 1 ]" 1
79 1 7 ASN QD 1 28 TRP HD1 5.500 . 5.500 5.357 4.431 5.540 0.040 4 0 "[ . 1 ]" 1
80 1 8 GLY H 1 9 GLY H 3.300 . 3.300 2.705 2.575 2.855 . 0 0 "[ . 1 ]" 1
81 1 8 GLY H 1 10 PHE H 5.500 . 5.500 4.270 3.667 4.781 . 0 0 "[ . 1 ]" 1
82 1 8 GLY QA 1 28 TRP HE1 2.800 . 2.800 2.830 2.805 2.901 0.101 6 0 "[ . 1 ]" 1
83 1 9 GLY QA 1 10 PHE H 5.500 . 5.500 2.763 2.528 2.893 . 0 0 "[ . 1 ]" 1
84 1 9 GLY H 1 10 PHE H 2.800 . 2.800 2.667 2.344 2.809 0.009 2 0 "[ . 1 ]" 1
85 1 9 GLY QA 1 11 GLU H 5.500 . 5.500 4.109 3.870 4.402 . 0 0 "[ . 1 ]" 1
86 1 9 GLY QA 1 161 GLY H 3.300 . 3.300 2.193 1.878 3.069 0.022 6 0 "[ . 1 ]" 1
87 1 10 PHE HA 1 10 PHE QB 3.300 . 3.300 2.303 2.182 2.398 . 0 0 "[ . 1 ]" 1
88 1 10 PHE H 1 10 PHE HA 2.800 . 2.800 2.365 2.342 2.504 . 0 0 "[ . 1 ]" 1
89 1 10 PHE HA 1 11 GLU H 3.300 . 3.300 2.773 2.664 3.314 0.014 12 0 "[ . 1 ]" 1
90 1 10 PHE H 1 11 GLU H 3.300 . 3.300 2.867 2.163 3.072 . 0 0 "[ . 1 ]" 1
91 1 10 PHE HA 1 25 VAL MG1 5.500 . 5.500 2.563 2.010 3.200 . 0 0 "[ . 1 ]" 1
92 1 10 PHE H 1 28 TRP HE1 5.500 . 5.500 5.353 4.849 5.569 0.069 12 0 "[ . 1 ]" 1
93 1 11 GLU HA 1 11 GLU QB 3.300 . 3.300 2.350 2.293 2.409 . 0 0 "[ . 1 ]" 1
94 1 11 GLU HA 1 11 GLU QG 5.500 . 5.500 2.667 2.264 3.094 . 0 0 "[ . 1 ]" 1
95 1 11 GLU H 1 11 GLU QB 2.800 . 2.800 2.495 2.356 2.626 . 0 0 "[ . 1 ]" 1
96 1 11 GLU H 1 11 GLU QG 2.800 . 2.800 2.276 1.932 2.811 0.011 10 0 "[ . 1 ]" 1
97 1 11 GLU HA 1 12 SER H 5.500 . 5.500 3.541 3.503 3.591 . 0 0 "[ . 1 ]" 1
98 1 11 GLU H 1 12 SER H 2.800 . 2.800 2.453 2.350 2.823 0.023 12 0 "[ . 1 ]" 1
99 1 11 GLU HA 1 13 THR H 5.500 . 5.500 4.461 3.864 5.084 . 0 0 "[ . 1 ]" 1
100 1 11 GLU HA 1 44 VAL QG 5.500 . 5.500 5.470 5.234 5.580 0.080 12 0 "[ . 1 ]" 1
101 1 11 GLU HA 1 55 LYS QD 3.800 . 3.800 3.000 1.902 3.857 0.057 12 0 "[ . 1 ]" 1
102 1 11 GLU HA 1 55 LYS QE 5.500 . 5.500 4.846 3.765 5.291 . 0 0 "[ . 1 ]" 1
103 1 11 GLU HA 1 55 LYS QG 5.500 . 5.500 4.240 3.203 5.527 0.027 12 0 "[ . 1 ]" 1
104 1 12 SER H 1 12 SER QB 2.800 . 2.800 2.409 2.088 2.803 0.003 10 0 "[ . 1 ]" 1
105 1 12 SER QB 1 13 THR H 3.800 . 3.800 2.912 2.547 3.362 . 0 0 "[ . 1 ]" 1
106 1 12 SER H 1 13 THR H 2.800 . 2.800 2.410 2.216 2.631 . 0 0 "[ . 1 ]" 1
107 1 13 THR HA 1 13 THR MG 2.800 . 2.800 2.160 2.021 2.354 . 0 0 "[ . 1 ]" 1
108 1 13 THR H 1 13 THR HB 2.800 . 2.800 2.786 2.515 2.869 0.069 2 0 "[ . 1 ]" 1
109 1 13 THR HG1 1 13 THR MG 2.800 . 2.800 2.193 1.909 2.545 . 0 0 "[ . 1 ]" 1
110 1 13 THR H 1 13 THR MG 4.200 . 4.200 3.746 3.661 3.925 . 0 0 "[ . 1 ]" 1
111 1 13 THR HA 1 14 PRO QD 2.800 . 2.800 1.866 1.858 1.876 0.042 9 0 "[ . 1 ]" 1
112 1 13 THR HG1 1 14 PRO QD 5.500 . 5.500 3.980 3.571 4.265 . 0 0 "[ . 1 ]" 1
113 1 13 THR MG 1 14 PRO QD 2.800 . 2.800 2.039 1.879 2.437 0.021 9 0 "[ . 1 ]" 1
114 1 13 THR MG 1 25 VAL MG1 2.800 . 2.800 2.601 2.309 2.809 0.009 10 0 "[ . 1 ]" 1
115 1 13 THR HG1 1 26 GLU H 3.300 . 3.300 2.455 1.909 3.006 . 0 0 "[ . 1 ]" 1
116 1 13 THR MG 1 26 GLU H 3.300 . 3.300 3.316 3.305 3.335 0.035 2 0 "[ . 1 ]" 1
117 1 14 PRO HA 1 14 PRO QG 3.800 . 3.800 3.564 3.562 3.566 . 0 0 "[ . 1 ]" 1
118 1 14 PRO QB 1 14 PRO QD 5.500 . 5.500 2.969 2.966 2.973 . 0 0 "[ . 1 ]" 1
119 1 14 PRO QD 1 14 PRO QG 3.300 . 3.300 1.969 1.968 1.970 . 0 0 "[ . 1 ]" 1
120 1 14 PRO HA 1 15 ALA MB 3.800 . 3.800 3.974 3.958 4.005 0.205 12 0 "[ . 1 ]" 1
121 1 14 PRO HA 1 15 ALA H 2.800 . 2.800 2.208 2.189 2.240 . 0 0 "[ . 1 ]" 1
122 1 14 PRO QB 1 15 ALA H 4.200 . 4.200 3.111 2.966 3.216 . 0 0 "[ . 1 ]" 1
123 1 14 PRO HA 1 55 LYS QE 5.500 . 5.500 2.429 1.897 3.489 0.003 3 0 "[ . 1 ]" 1
124 1 15 ALA H 1 15 ALA MB 2.800 . 2.800 2.021 2.003 2.033 . 0 0 "[ . 1 ]" 1
125 1 15 ALA HA 1 16 GLY H 2.800 . 2.800 2.418 2.336 2.504 . 0 0 "[ . 1 ]" 1
126 1 15 ALA MB 1 16 GLY QA 5.500 . 5.500 3.501 3.454 3.545 . 0 0 "[ . 1 ]" 1
127 1 15 ALA MB 1 16 GLY H 2.800 . 2.800 2.674 2.520 2.807 0.007 11 0 "[ . 1 ]" 1
128 1 15 ALA H 1 16 GLY H 5.500 . 5.500 4.697 4.683 4.712 . 0 0 "[ . 1 ]" 1
129 1 15 ALA HA 1 44 VAL HB 3.300 . 3.300 2.028 1.885 2.331 0.015 3 0 "[ . 1 ]" 1
130 1 15 ALA HA 1 44 VAL H 4.200 . 4.200 4.178 4.045 4.250 0.050 4 0 "[ . 1 ]" 1
131 1 15 ALA MB 1 44 VAL H 5.500 . 5.500 4.973 4.757 5.109 . 0 0 "[ . 1 ]" 1
132 1 15 ALA MB 1 44 VAL HB 5.500 . 5.500 3.651 3.409 3.974 . 0 0 "[ . 1 ]" 1
133 1 15 ALA MB 1 46 GLU HA 5.500 . 5.500 4.011 3.480 4.536 . 0 0 "[ . 1 ]" 1
134 1 15 ALA MB 1 46 GLU H 3.300 . 3.300 2.794 2.169 3.311 0.011 12 0 "[ . 1 ]" 1
135 1 15 ALA MB 1 46 GLU QG 3.800 . 3.800 2.431 1.884 3.637 0.016 3 0 "[ . 1 ]" 1
136 1 15 ALA MB 1 55 LYS QE 3.800 . 3.800 3.556 2.972 3.813 0.013 2 0 "[ . 1 ]" 1
137 1 15 ALA H 1 55 LYS QE 4.200 . 4.200 2.715 2.327 3.205 . 0 0 "[ . 1 ]" 1
138 1 16 GLY QA 1 17 VAL H 2.800 . 2.800 2.169 2.164 2.173 . 0 0 "[ . 1 ]" 1
139 1 16 GLY H 1 17 VAL H 3.800 . 3.800 3.888 3.861 3.945 0.145 3 0 "[ . 1 ]" 1
140 1 16 GLY H 1 43 GLU QG 3.300 . 3.300 3.153 3.003 3.311 0.011 12 0 "[ . 1 ]" 1
141 1 16 GLY H 1 44 VAL HB 2.800 . 2.800 2.703 2.475 2.819 0.019 11 0 "[ . 1 ]" 1
142 1 16 GLY H 1 44 VAL H 3.300 . 3.300 3.174 3.095 3.300 0.000 12 0 "[ . 1 ]" 1
143 1 17 VAL HA 1 18 VAL H 2.800 . 2.800 2.218 2.190 2.243 . 0 0 "[ . 1 ]" 1
144 1 17 VAL HA 1 18 VAL MG2 3.300 . 3.300 3.372 3.356 3.395 0.095 5 0 "[ . 1 ]" 1
145 1 17 VAL MG1 1 18 VAL H 2.800 . 2.800 2.835 2.822 2.864 0.064 6 0 "[ . 1 ]" 1
146 1 17 VAL MG2 1 18 VAL H 2.800 . 2.800 2.753 2.583 2.809 0.009 9 0 "[ . 1 ]" 1
147 1 17 VAL MG1 1 19 THR H 4.200 . 4.200 4.237 4.209 4.255 0.055 3 0 "[ . 1 ]" 1
148 1 17 VAL HA 1 43 GLU HA 2.800 . 2.800 2.428 2.290 2.620 . 0 0 "[ . 1 ]" 1
149 1 17 VAL HA 1 43 GLU QB 4.200 . 4.200 2.139 1.890 2.298 0.010 3 0 "[ . 1 ]" 1
150 1 17 VAL HA 1 43 GLU H 5.500 . 5.500 4.978 4.861 5.147 . 0 0 "[ . 1 ]" 1
151 1 17 VAL MG2 1 43 GLU HA 3.800 . 3.800 3.375 3.189 3.575 . 0 0 "[ . 1 ]" 1
152 1 17 VAL HA 1 44 VAL H 4.200 . 4.200 3.136 2.981 3.261 . 0 0 "[ . 1 ]" 1
153 1 17 VAL MG2 1 44 VAL H 5.500 . 5.500 4.466 4.277 4.594 . 0 0 "[ . 1 ]" 1
154 1 18 VAL H 1 18 VAL HB 2.800 . 2.800 2.508 2.482 2.531 . 0 0 "[ . 1 ]" 1
155 1 18 VAL H 1 18 VAL MG2 2.800 . 2.800 2.186 2.134 2.253 . 0 0 "[ . 1 ]" 1
156 1 18 VAL H 1 18 VAL MG1 3.800 . 3.800 3.788 3.778 3.800 . 0 0 "[ . 1 ]" 1
157 1 18 VAL HA 1 19 THR MG 4.200 . 4.200 3.428 3.078 3.825 . 0 0 "[ . 1 ]" 1
158 1 18 VAL HA 1 19 THR H 2.800 . 2.800 2.221 2.210 2.237 . 0 0 "[ . 1 ]" 1
159 1 18 VAL MG2 1 19 THR H 3.800 . 3.800 3.927 3.907 3.936 0.136 5 0 "[ . 1 ]" 1
160 1 18 VAL MG1 1 19 THR H 3.300 . 3.300 2.209 1.915 2.342 . 0 0 "[ . 1 ]" 1
161 1 18 VAL H 1 19 THR H 5.500 . 5.500 4.592 4.585 4.599 . 0 0 "[ . 1 ]" 1
162 1 18 VAL HA 1 20 ASP H 3.800 . 3.800 3.814 3.753 3.842 0.042 7 0 "[ . 1 ]" 1
163 1 18 VAL MG1 1 20 ASP H 2.800 . 2.800 1.985 1.884 2.269 0.016 7 0 "[ . 1 ]" 1
164 1 18 VAL MG2 1 42 PHE HB3 3.300 . 3.300 3.284 3.086 3.342 0.042 5 0 "[ . 1 ]" 1
165 1 18 VAL MG2 1 42 PHE HB2 3.800 . 3.800 3.592 3.192 3.834 0.034 1 0 "[ . 1 ]" 1
166 1 18 VAL MG1 1 42 PHE HB3 4.200 . 4.200 3.755 3.521 3.934 . 0 0 "[ . 1 ]" 1
167 1 18 VAL MG1 1 42 PHE HB2 5.500 . 5.500 3.462 3.099 3.762 . 0 0 "[ . 1 ]" 1
168 1 18 VAL H 1 42 PHE HB2 4.200 . 4.200 4.173 3.882 4.260 0.060 7 0 "[ . 1 ]" 1
169 1 18 VAL MG2 1 43 GLU HA 3.300 . 3.300 2.066 1.876 2.312 0.024 5 0 "[ . 1 ]" 1
170 1 18 VAL MG2 1 43 GLU H 5.500 . 5.500 3.854 3.578 4.143 . 0 0 "[ . 1 ]" 1
171 1 18 VAL H 1 43 GLU HA 3.800 . 3.800 2.100 2.008 2.212 . 0 0 "[ . 1 ]" 1
172 1 18 VAL H 1 43 GLU QB 3.800 . 3.800 2.828 2.625 3.037 . 0 0 "[ . 1 ]" 1
173 1 18 VAL MG2 1 44 VAL H 3.300 . 3.300 2.932 2.780 3.129 . 0 0 "[ . 1 ]" 1
174 1 18 VAL H 1 44 VAL H 3.800 . 3.800 3.871 3.853 3.906 0.106 7 0 "[ . 1 ]" 1
175 1 19 THR H 1 19 THR HB 4.200 . 4.200 3.416 2.840 3.785 . 0 0 "[ . 1 ]" 1
176 1 19 THR H 1 19 THR MG 3.300 . 3.300 2.077 1.900 2.303 . 0 0 "[ . 1 ]" 1
177 1 19 THR MG 1 20 ASP H 3.800 . 3.800 2.950 1.913 3.753 . 0 0 "[ . 1 ]" 1
178 1 19 THR H 1 20 ASP H 2.800 . 2.800 2.054 1.918 2.152 . 0 0 "[ . 1 ]" 1
179 1 20 ASP H 1 20 ASP QB 2.800 . 2.800 2.613 2.519 2.694 . 0 0 "[ . 1 ]" 1
180 1 20 ASP HA 1 21 LEU H 2.800 . 2.800 2.277 2.216 2.409 . 0 0 "[ . 1 ]" 1
181 1 20 ASP HA 1 21 LEU MD2 5.500 . 5.500 4.760 4.574 4.947 . 0 0 "[ . 1 ]" 1
182 1 20 ASP QB 1 21 LEU H 5.500 . 5.500 3.742 3.241 3.951 . 0 0 "[ . 1 ]" 1
183 1 20 ASP H 1 21 LEU H 4.200 . 4.200 3.806 3.466 4.220 0.020 12 0 "[ . 1 ]" 1
184 1 20 ASP QB 1 24 GLY QA 5.500 . 5.500 4.099 3.248 4.765 . 0 0 "[ . 1 ]" 1
185 1 20 ASP QB 1 24 GLY H 5.500 . 5.500 4.220 3.709 4.553 . 0 0 "[ . 1 ]" 1
186 1 20 ASP H 1 24 GLY QA 4.200 . 4.200 3.667 2.949 4.141 . 0 0 "[ . 1 ]" 1
187 1 21 LEU HA 1 21 LEU QB 3.300 . 3.300 2.175 2.169 2.179 . 0 0 "[ . 1 ]" 1
188 1 21 LEU HA 1 21 LEU MD1 3.800 . 3.800 3.500 3.441 3.577 . 0 0 "[ . 1 ]" 1
189 1 21 LEU QB 1 21 LEU MD2 2.800 . 2.800 2.138 1.981 2.226 . 0 0 "[ . 1 ]" 1
190 1 21 LEU H 1 21 LEU MD2 3.300 . 3.300 3.447 3.366 3.503 0.203 9 0 "[ . 1 ]" 1
191 1 21 LEU H 1 21 LEU MD1 2.800 . 2.800 2.217 1.761 2.862 0.139 11 0 "[ . 1 ]" 1
192 1 21 LEU HA 1 22 ALA H 3.800 . 3.800 3.485 3.451 3.543 . 0 0 "[ . 1 ]" 1
193 1 21 LEU QB 1 22 ALA H 3.300 . 3.300 3.458 3.330 3.559 0.259 9 0 "[ . 1 ]" 1
194 1 21 LEU H 1 22 ALA H 2.800 . 2.800 2.796 2.393 2.872 0.072 4 0 "[ . 1 ]" 1
195 1 21 LEU HA 1 30 LEU QB 5.500 . 5.500 3.880 3.704 4.149 . 0 0 "[ . 1 ]" 1
196 1 21 LEU HA 1 30 LEU MD2 5.500 . 5.500 4.773 4.414 5.056 . 0 0 "[ . 1 ]" 1
197 1 21 LEU HA 1 30 LEU MD1 3.300 . 3.300 2.715 2.256 3.318 0.018 4 0 "[ . 1 ]" 1
198 1 21 LEU QB 1 30 LEU MD1 5.500 . 5.500 1.936 1.822 2.293 0.078 6 0 "[ . 1 ]" 1
199 1 21 LEU QB 1 30 LEU H 3.800 . 3.800 3.039 1.896 3.863 0.063 6 0 "[ . 1 ]" 1
200 1 21 LEU MD2 1 30 LEU QB 3.300 . 3.300 1.844 1.823 1.869 0.077 9 0 "[ . 1 ]" 1
201 1 21 LEU MD2 1 30 LEU MD1 2.800 . 2.800 2.764 2.146 2.883 0.083 11 0 "[ . 1 ]" 1
202 1 21 LEU MD2 1 30 LEU H 3.800 . 3.800 3.247 2.682 3.888 0.088 2 0 "[ . 1 ]" 1
203 1 21 LEU MD1 1 30 LEU H 5.500 . 5.500 4.225 2.479 5.332 . 0 0 "[ . 1 ]" 1
204 1 21 LEU MD1 1 31 ASN H 5.500 . 5.500 4.678 3.662 5.239 . 0 0 "[ . 1 ]" 1
205 1 21 LEU MD2 1 32 VAL MG2 3.300 . 3.300 2.511 2.052 3.036 . 0 0 "[ . 1 ]" 1
206 1 21 LEU MD1 1 32 VAL H 3.300 . 3.300 3.397 3.379 3.421 0.121 9 0 "[ . 1 ]" 1
207 1 21 LEU MD2 1 42 PHE HB3 5.500 . 5.500 4.805 3.949 5.400 . 0 0 "[ . 1 ]" 1
208 1 21 LEU MD2 1 42 PHE HB2 5.500 . 5.500 4.945 3.800 5.531 0.031 10 0 "[ . 1 ]" 1
209 1 22 ALA MB 1 23 GLU QG 2.800 . 2.800 2.734 2.492 2.817 0.017 10 0 "[ . 1 ]" 1
210 1 22 ALA MB 1 23 GLU H 2.800 . 2.800 2.396 2.187 2.819 0.019 12 0 "[ . 1 ]" 1
211 1 22 ALA MB 1 24 GLY H 5.500 . 5.500 4.375 4.183 4.614 . 0 0 "[ . 1 ]" 1
212 1 22 ALA HA 1 29 ASP HA 3.800 . 3.800 3.809 3.792 3.825 0.025 8 0 "[ . 1 ]" 1
213 1 22 ALA HA 1 30 LEU H 3.300 . 3.300 3.135 2.749 3.357 0.057 1 0 "[ . 1 ]" 1
214 1 23 GLU H 1 23 GLU QB 3.800 . 3.800 3.047 2.956 3.204 . 0 0 "[ . 1 ]" 1
215 1 23 GLU H 1 23 GLU QG 2.800 . 2.800 1.946 1.870 2.154 0.030 10 0 "[ . 1 ]" 1
216 1 23 GLU HA 1 24 GLY H 5.500 . 5.500 2.888 2.742 2.957 . 0 0 "[ . 1 ]" 1
217 1 23 GLU QG 1 24 GLY H 3.800 . 3.800 3.685 3.561 3.810 0.010 4 0 "[ . 1 ]" 1
218 1 23 GLU H 1 24 GLY QA 5.500 . 5.500 4.074 3.807 4.206 . 0 0 "[ . 1 ]" 1
219 1 23 GLU H 1 24 GLY H 2.800 . 2.800 2.761 2.404 2.826 0.026 8 0 "[ . 1 ]" 1
220 1 23 GLU HA 1 25 VAL H 5.500 . 5.500 4.358 3.285 5.272 . 0 0 "[ . 1 ]" 1
221 1 23 GLU H 1 25 VAL H 5.500 . 5.500 5.347 4.830 5.514 0.014 3 0 "[ . 1 ]" 1
222 1 24 GLY QA 1 25 VAL H 3.800 . 3.800 2.582 2.378 2.919 . 0 0 "[ . 1 ]" 1
223 1 24 GLY H 1 25 VAL H 2.800 . 2.800 2.684 2.219 2.819 0.019 12 0 "[ . 1 ]" 1
224 1 25 VAL H 1 25 VAL HB 2.800 . 2.800 2.747 2.518 2.829 0.029 12 0 "[ . 1 ]" 1
225 1 25 VAL HA 1 26 GLU H 2.800 . 2.800 2.220 2.181 2.273 . 0 0 "[ . 1 ]" 1
226 1 25 VAL MG1 1 26 GLU H 3.300 . 3.300 2.360 1.940 2.924 . 0 0 "[ . 1 ]" 1
227 1 25 VAL HB 1 28 TRP H 4.200 . 4.200 2.773 2.004 4.204 0.004 4 0 "[ . 1 ]" 1
228 1 25 VAL MG1 1 28 TRP H 5.500 . 5.500 2.705 1.896 3.373 0.004 10 0 "[ . 1 ]" 1
229 1 26 GLU HA 1 26 GLU QB 3.800 . 3.800 2.315 2.286 2.409 . 0 0 "[ . 1 ]" 1
230 1 26 GLU HA 1 26 GLU QG 3.300 . 3.300 2.568 2.203 3.108 . 0 0 "[ . 1 ]" 1
231 1 26 GLU H 1 26 GLU QB 3.300 . 3.300 2.246 2.225 2.273 . 0 0 "[ . 1 ]" 1
232 1 26 GLU HA 1 27 GLY QA 5.500 . 5.500 4.296 3.991 4.474 . 0 0 "[ . 1 ]" 1
233 1 26 GLU QG 1 27 GLY H 3.300 . 3.300 3.073 2.407 3.339 0.039 3 0 "[ . 1 ]" 1
234 1 26 GLU HA 1 28 TRP H 5.500 . 5.500 3.878 3.423 4.340 . 0 0 "[ . 1 ]" 1
235 1 27 GLY QA 1 28 TRP H 5.500 . 5.500 2.898 2.786 2.947 . 0 0 "[ . 1 ]" 1
236 1 27 GLY H 1 28 TRP H 2.800 . 2.800 2.526 2.272 2.788 . 0 0 "[ . 1 ]" 1
237 1 28 TRP HA 1 29 ASP H 2.800 . 2.800 2.175 2.166 2.197 . 0 0 "[ . 1 ]" 1
238 1 28 TRP QB 1 29 ASP H 3.300 . 3.300 3.452 3.387 3.499 0.199 8 0 "[ . 1 ]" 1
239 1 28 TRP H 1 29 ASP H 5.500 . 5.500 4.191 4.125 4.305 . 0 0 "[ . 1 ]" 1
240 1 28 TRP QB 1 30 LEU MD2 3.800 . 3.800 3.304 2.601 3.814 0.014 8 0 "[ . 1 ]" 1
241 1 28 TRP HZ2 1 57 LEU MD2 5.500 . 5.500 5.304 4.881 5.507 0.007 7 0 "[ . 1 ]" 1
242 1 28 TRP HA 1 75 ALA HA 3.800 . 3.800 2.112 1.980 2.210 . 0 0 "[ . 1 ]" 1
243 1 28 TRP HA 1 75 ALA MB 5.500 . 5.500 3.439 3.281 3.544 . 0 0 "[ . 1 ]" 1
244 1 28 TRP HA 1 76 PHE H 3.300 . 3.300 3.335 3.307 3.362 0.062 11 0 "[ . 1 ]" 1
245 1 28 TRP HZ2 1 145 ILE MG 3.300 . 3.300 3.454 3.396 3.565 0.265 11 0 "[ . 1 ]" 1
246 1 28 TRP HZ2 1 159 ILE MG 3.300 . 3.300 2.956 2.586 3.295 . 0 0 "[ . 1 ]" 1
247 1 28 TRP HZ2 1 162 LEU H 4.200 . 4.200 4.316 4.297 4.355 0.155 9 0 "[ . 1 ]" 1
248 1 29 ASP HA 1 29 ASP QB 3.800 . 3.800 2.406 2.287 2.522 . 0 0 "[ . 1 ]" 1
249 1 29 ASP H 1 29 ASP QB 3.300 . 3.300 2.549 2.334 2.789 . 0 0 "[ . 1 ]" 1
250 1 29 ASP HA 1 30 LEU MD1 5.500 . 5.500 4.369 3.914 4.827 . 0 0 "[ . 1 ]" 1
251 1 29 ASP HA 1 30 LEU H 2.800 . 2.800 2.248 2.196 2.319 . 0 0 "[ . 1 ]" 1
252 1 29 ASP QB 1 30 LEU H 5.500 . 5.500 3.252 2.979 3.627 . 0 0 "[ . 1 ]" 1
253 1 29 ASP H 1 30 LEU MD2 5.500 . 5.500 4.262 3.371 5.073 . 0 0 "[ . 1 ]" 1
254 1 29 ASP H 1 30 LEU H 5.500 . 5.500 4.360 4.164 4.516 . 0 0 "[ . 1 ]" 1
255 1 29 ASP H 1 73 ALA HA 5.500 . 5.500 4.887 4.595 5.217 . 0 0 "[ . 1 ]" 1
256 1 29 ASP QB 1 74 THR H 5.500 . 5.500 4.162 3.914 4.400 . 0 0 "[ . 1 ]" 1
257 1 29 ASP H 1 74 THR HB 3.800 . 3.800 3.649 3.264 3.870 0.070 2 0 "[ . 1 ]" 1
258 1 29 ASP H 1 74 THR MG 5.500 . 5.500 4.064 3.449 4.447 . 0 0 "[ . 1 ]" 1
259 1 29 ASP H 1 74 THR H 3.800 . 3.800 3.357 3.107 3.591 . 0 0 "[ . 1 ]" 1
260 1 29 ASP H 1 75 ALA HA 5.500 . 5.500 3.227 3.116 3.325 . 0 0 "[ . 1 ]" 1
261 1 29 ASP H 1 75 ALA MB 5.500 . 5.500 4.645 4.538 4.757 . 0 0 "[ . 1 ]" 1
262 1 29 ASP H 1 76 PHE H 4.200 . 4.200 4.253 4.221 4.289 0.089 12 0 "[ . 1 ]" 1
263 1 30 LEU H 1 30 LEU QB 3.300 . 3.300 2.768 2.676 2.884 . 0 0 "[ . 1 ]" 1
264 1 30 LEU H 1 30 LEU MD2 3.800 . 3.800 3.418 2.816 3.831 0.031 5 0 "[ . 1 ]" 1
265 1 30 LEU H 1 30 LEU MD1 3.800 . 3.800 3.147 2.472 3.811 0.011 2 0 "[ . 1 ]" 1
266 1 30 LEU QB 1 31 ASN H 3.300 . 3.300 2.440 2.320 2.597 . 0 0 "[ . 1 ]" 1
267 1 30 LEU MD2 1 31 ASN H 3.800 . 3.800 3.875 3.842 3.903 0.103 1 0 "[ . 1 ]" 1
268 1 30 LEU HA 1 73 ALA HA 3.300 . 3.300 2.228 1.925 2.512 . 0 0 "[ . 1 ]" 1
269 1 30 LEU MD2 1 73 ALA HA 2.800 . 2.800 1.879 1.857 1.911 0.043 12 0 "[ . 1 ]" 1
270 1 30 LEU MD2 1 73 ALA MB 2.800 . 2.800 1.811 1.761 1.870 0.139 11 0 "[ . 1 ]" 1
271 1 30 LEU MD1 1 73 ALA HA 5.500 . 5.500 4.263 4.145 4.426 . 0 0 "[ . 1 ]" 1
272 1 30 LEU MD2 1 74 THR H 3.300 . 3.300 3.312 3.144 3.353 0.053 7 0 "[ . 1 ]" 1
273 1 31 ASN QB 1 31 ASN QD 3.300 . 3.300 2.299 2.185 2.610 . 0 0 "[ . 1 ]" 1
274 1 31 ASN H 1 31 ASN QB 2.800 . 2.800 2.821 2.801 2.833 0.033 5 0 "[ . 1 ]" 1
275 1 31 ASN H 1 31 ASN QD 5.500 . 5.500 4.390 3.732 4.947 . 0 0 "[ . 1 ]" 1
276 1 31 ASN QB 1 32 VAL H 3.300 . 3.300 3.333 3.285 3.357 0.057 11 0 "[ . 1 ]" 1
277 1 31 ASN H 1 32 VAL MG2 5.500 . 5.500 4.297 4.170 4.453 . 0 0 "[ . 1 ]" 1
278 1 31 ASN H 1 32 VAL H 5.500 . 5.500 4.071 4.036 4.148 . 0 0 "[ . 1 ]" 1
279 1 31 ASN QB 1 72 GLU H 5.500 . 5.500 4.235 4.044 4.435 . 0 0 "[ . 1 ]" 1
280 1 31 ASN H 1 72 GLU QB 4.200 . 4.200 3.063 1.899 3.629 0.001 9 0 "[ . 1 ]" 1
281 1 31 ASN H 1 72 GLU H 3.300 . 3.300 2.857 2.710 3.061 . 0 0 "[ . 1 ]" 1
282 1 31 ASN H 1 73 ALA HA 5.500 . 5.500 3.927 3.638 4.134 . 0 0 "[ . 1 ]" 1
283 1 31 ASN H 1 74 THR H 5.500 . 5.500 5.049 4.794 5.396 . 0 0 "[ . 1 ]" 1
284 1 32 VAL HA 1 32 VAL MG1 3.300 . 3.300 2.099 1.935 2.152 . 0 0 "[ . 1 ]" 1
285 1 32 VAL HA 1 32 VAL MG2 3.300 . 3.300 3.082 3.071 3.094 . 0 0 "[ . 1 ]" 1
286 1 32 VAL H 1 32 VAL MG1 3.800 . 3.800 3.406 3.345 3.492 . 0 0 "[ . 1 ]" 1
287 1 32 VAL H 1 32 VAL MG2 2.800 . 2.800 1.870 1.838 1.939 0.062 6 0 "[ . 1 ]" 1
288 1 32 VAL HA 1 33 GLY H 2.800 . 2.800 2.211 2.196 2.222 . 0 0 "[ . 1 ]" 1
289 1 32 VAL HA 1 33 GLY QA 5.500 . 5.500 3.946 3.943 3.951 . 0 0 "[ . 1 ]" 1
290 1 32 VAL MG1 1 33 GLY H 3.300 . 3.300 3.306 3.262 3.328 0.028 9 0 "[ . 1 ]" 1
291 1 32 VAL MG2 1 33 GLY H 5.500 . 5.500 4.319 4.295 4.358 . 0 0 "[ . 1 ]" 1
292 1 32 VAL H 1 33 GLY H 5.500 . 5.500 4.497 4.408 4.530 . 0 0 "[ . 1 ]" 1
293 1 32 VAL MG1 1 36 VAL MG1 3.300 . 3.300 2.333 1.898 2.694 0.002 2 0 "[ . 1 ]" 1
294 1 32 VAL MG1 1 36 VAL H 4.200 . 4.200 4.274 4.246 4.304 0.104 9 0 "[ . 1 ]" 1
295 1 32 VAL MG1 1 40 PRO QD 3.800 . 3.800 2.684 2.435 2.990 . 0 0 "[ . 1 ]" 1
296 1 32 VAL MG2 1 40 PRO QD 3.800 . 3.800 3.795 3.617 3.822 0.022 9 0 "[ . 1 ]" 1
297 1 32 VAL HA 1 72 GLU H 5.500 . 5.500 3.580 3.321 3.810 . 0 0 "[ . 1 ]" 1
298 1 32 VAL MG2 1 72 GLU H 5.500 . 5.500 4.795 4.462 5.030 . 0 0 "[ . 1 ]" 1
299 1 33 GLY QA 1 34 SER H 5.500 . 5.500 2.319 2.306 2.328 . 0 0 "[ . 1 ]" 1
300 1 33 GLY H 1 34 SER H 5.500 . 5.500 4.518 4.436 4.611 . 0 0 "[ . 1 ]" 1
301 1 33 GLY QA 1 36 VAL MG2 5.500 . 5.500 4.425 3.724 4.665 . 0 0 "[ . 1 ]" 1
302 1 33 GLY QA 1 36 VAL H 5.500 . 5.500 3.968 3.800 4.088 . 0 0 "[ . 1 ]" 1
303 1 33 GLY H 1 36 VAL MG1 5.500 . 5.500 4.787 4.509 4.912 . 0 0 "[ . 1 ]" 1
304 1 33 GLY H 1 36 VAL MG2 3.300 . 3.300 2.909 2.196 3.134 . 0 0 "[ . 1 ]" 1
305 1 33 GLY H 1 70 ASP HA 3.300 . 3.300 3.305 3.176 3.328 0.028 10 0 "[ . 1 ]" 1
306 1 33 GLY H 1 70 ASP QB 5.500 . 5.500 4.561 4.155 4.901 . 0 0 "[ . 1 ]" 1
307 1 34 SER HA 1 35 SER H 5.500 . 5.500 3.433 3.341 3.522 . 0 0 "[ . 1 ]" 1
308 1 34 SER HA 1 36 VAL H 5.500 . 5.500 4.070 3.935 4.458 . 0 0 "[ . 1 ]" 1
309 1 35 SER HA 1 36 VAL H 3.800 . 3.800 3.559 3.532 3.596 . 0 0 "[ . 1 ]" 1
310 1 35 SER H 1 36 VAL H 3.300 . 3.300 2.727 2.522 3.035 . 0 0 "[ . 1 ]" 1
311 1 35 SER QB 1 66 ASN H 3.800 . 3.800 3.648 2.947 3.817 0.017 7 0 "[ . 1 ]" 1
312 1 36 VAL HA 1 36 VAL MG1 2.800 . 2.800 2.579 2.228 2.652 . 0 0 "[ . 1 ]" 1
313 1 36 VAL H 1 36 VAL HA 2.800 . 2.800 2.829 2.750 2.863 0.063 12 0 "[ . 1 ]" 1
314 1 36 VAL H 1 36 VAL HB 2.800 . 2.800 2.200 2.106 2.631 . 0 0 "[ . 1 ]" 1
315 1 36 VAL H 1 36 VAL MG1 3.300 . 3.300 3.588 3.561 3.687 0.387 2 0 "[ . 1 ]" 1
316 1 36 VAL H 1 36 VAL MG2 2.800 . 2.800 2.644 1.882 2.820 0.020 10 0 "[ . 1 ]" 1
317 1 36 VAL HA 1 37 THR HA 5.500 . 5.500 4.560 4.493 4.587 . 0 0 "[ . 1 ]" 1
318 1 36 VAL HA 1 37 THR MG 5.500 . 5.500 5.533 5.519 5.559 0.059 7 0 "[ . 1 ]" 1
319 1 36 VAL HA 1 37 THR H 2.800 . 2.800 2.304 2.220 2.340 . 0 0 "[ . 1 ]" 1
320 1 36 VAL MG1 1 37 THR H 3.800 . 3.800 3.453 3.055 3.560 . 0 0 "[ . 1 ]" 1
321 1 36 VAL MG1 1 37 THR HA 4.200 . 4.200 4.076 3.956 4.256 0.056 9 0 "[ . 1 ]" 1
322 1 36 VAL HA 1 38 ASN H 3.300 . 3.300 3.321 3.284 3.372 0.072 9 0 "[ . 1 ]" 1
323 1 36 VAL MG1 1 38 ASN HA 5.500 . 5.500 3.863 3.559 4.156 . 0 0 "[ . 1 ]" 1
324 1 36 VAL MG1 1 39 PRO HA 3.300 . 3.300 2.524 1.896 3.078 0.004 10 0 "[ . 1 ]" 1
325 1 36 VAL MG1 1 40 PRO QD 4.200 . 4.200 2.053 1.861 2.740 0.039 9 0 "[ . 1 ]" 1
326 1 36 VAL HA 1 65 GLY QA 5.500 . 5.500 3.876 3.574 4.298 . 0 0 "[ . 1 ]" 1
327 1 36 VAL HA 1 65 GLY H 5.500 . 5.500 4.758 4.064 5.277 . 0 0 "[ . 1 ]" 1
328 1 36 VAL MG1 1 71 ILE QG 5.500 . 5.500 3.261 2.868 3.677 . 0 0 "[ . 1 ]" 1
329 1 37 THR HA 1 37 THR MG 2.800 . 2.800 2.359 2.061 2.483 . 0 0 "[ . 1 ]" 1
330 1 37 THR H 1 37 THR HB 3.300 . 3.300 2.484 2.360 2.840 . 0 0 "[ . 1 ]" 1
331 1 37 THR HA 1 38 ASN H 3.300 . 3.300 3.449 3.437 3.455 0.155 4 0 "[ . 1 ]" 1
332 1 37 THR HB 1 38 ASN H 2.800 . 2.800 2.842 2.832 2.868 0.068 9 0 "[ . 1 ]" 1
333 1 37 THR MG 1 38 ASN H 4.200 . 4.200 3.627 3.452 3.984 . 0 0 "[ . 1 ]" 1
334 1 37 THR H 1 38 ASN H 2.800 . 2.800 2.464 2.284 2.587 . 0 0 "[ . 1 ]" 1
335 1 38 ASN HA 1 38 ASN QB 3.300 . 3.300 2.471 2.181 2.546 . 0 0 "[ . 1 ]" 1
336 1 38 ASN HA 1 38 ASN QD 5.500 . 5.500 3.424 2.293 4.070 . 0 0 "[ . 1 ]" 1
337 1 38 ASN QB 1 38 ASN QD 4.200 . 4.200 2.360 2.182 2.643 . 0 0 "[ . 1 ]" 1
338 1 38 ASN H 1 38 ASN QB 3.300 . 3.300 2.482 2.370 2.628 . 0 0 "[ . 1 ]" 1
339 1 38 ASN HA 1 39 PRO QD 2.800 . 2.800 1.875 1.865 1.892 0.035 3 0 "[ . 1 ]" 1
340 1 38 ASN QD 1 62 ASN QB 5.500 . 5.500 4.671 3.718 5.498 . 0 0 "[ . 1 ]" 1
341 1 38 ASN QB 1 63 GLY QA 5.500 . 5.500 2.079 1.886 2.687 0.014 5 0 "[ . 1 ]" 1
342 1 38 ASN QB 1 63 GLY H 5.500 . 5.500 4.346 3.646 5.223 . 0 0 "[ . 1 ]" 1
343 1 39 PRO HA 1 39 PRO QG 3.800 . 3.800 3.558 3.556 3.560 . 0 0 "[ . 1 ]" 1
344 1 39 PRO HA 1 40 PRO QD 2.800 . 2.800 1.885 1.870 1.897 0.030 12 0 "[ . 1 ]" 1
345 1 39 PRO HA 1 40 PRO QG 5.500 . 5.500 3.828 3.813 3.859 . 0 0 "[ . 1 ]" 1
346 1 39 PRO QB 1 40 PRO QD 5.500 . 5.500 3.114 2.481 3.306 . 0 0 "[ . 1 ]" 1
347 1 40 PRO HA 1 41 VAL MG2 3.800 . 3.800 3.557 3.477 3.667 . 0 0 "[ . 1 ]" 1
348 1 40 PRO HA 1 41 VAL H 2.800 . 2.800 2.634 2.422 2.788 . 0 0 "[ . 1 ]" 1
349 1 40 PRO QB 1 41 VAL H 4.200 . 4.200 2.309 1.975 2.772 . 0 0 "[ . 1 ]" 1
350 1 40 PRO QB 1 59 VAL MG1 5.500 . 5.500 2.597 1.958 2.954 . 0 0 "[ . 1 ]" 1
351 1 40 PRO HA 1 61 VAL HA 5.500 . 5.500 3.629 3.322 3.842 . 0 0 "[ . 1 ]" 1
352 1 40 PRO QB 1 61 VAL HA 5.500 . 5.500 2.633 1.883 3.215 0.017 10 0 "[ . 1 ]" 1
353 1 40 PRO HA 1 62 ASN QD 4.200 . 4.200 3.176 2.764 3.623 . 0 0 "[ . 1 ]" 1
354 1 40 PRO HA 1 62 ASN H 3.800 . 3.800 3.816 3.763 3.848 0.048 7 0 "[ . 1 ]" 1
355 1 40 PRO QB 1 71 ILE MD 4.200 . 4.200 2.562 2.075 3.647 . 0 0 "[ . 1 ]" 1
356 1 40 PRO QD 1 71 ILE MG 5.500 . 5.500 4.136 2.589 5.012 . 0 0 "[ . 1 ]" 1
357 1 41 VAL H 1 41 VAL HB 2.800 . 2.800 2.502 2.452 2.539 . 0 0 "[ . 1 ]" 1
358 1 41 VAL H 1 41 VAL MG2 2.800 . 2.800 2.822 2.808 2.834 0.034 3 0 "[ . 1 ]" 1
359 1 41 VAL HA 1 42 PHE HA 5.500 . 5.500 4.446 4.443 4.449 . 0 0 "[ . 1 ]" 1
360 1 41 VAL HA 1 42 PHE QD 5.500 . 5.500 4.126 3.648 4.599 . 0 0 "[ . 1 ]" 1
361 1 41 VAL HA 1 42 PHE H 2.800 . 2.800 2.198 2.191 2.208 . 0 0 "[ . 1 ]" 1
362 1 41 VAL MG2 1 42 PHE HA 5.500 . 5.500 5.543 5.527 5.560 0.060 10 0 "[ . 1 ]" 1
363 1 41 VAL MG1 1 42 PHE HA 5.500 . 5.500 3.566 3.507 3.642 . 0 0 "[ . 1 ]" 1
364 1 41 VAL MG1 1 42 PHE H 2.800 . 2.800 2.852 2.832 2.882 0.082 10 0 "[ . 1 ]" 1
365 1 41 VAL H 1 42 PHE H 5.500 . 5.500 4.360 4.322 4.408 . 0 0 "[ . 1 ]" 1
366 1 41 VAL MG1 1 43 GLU H 3.300 . 3.300 3.412 3.393 3.433 0.133 12 0 "[ . 1 ]" 1
367 1 41 VAL H 1 59 VAL MG1 5.500 . 5.500 3.003 2.778 3.092 . 0 0 "[ . 1 ]" 1
368 1 41 VAL MG2 1 60 THR H 3.800 . 3.800 3.820 3.806 3.844 0.044 10 0 "[ . 1 ]" 1
369 1 41 VAL H 1 60 THR HB 3.300 . 3.300 2.366 2.055 2.700 . 0 0 "[ . 1 ]" 1
370 1 41 VAL H 1 60 THR H 3.300 . 3.300 2.198 1.885 2.491 0.015 10 0 "[ . 1 ]" 1
371 1 41 VAL MG2 1 62 ASN QD 3.300 . 3.300 3.305 3.223 3.335 0.035 12 0 "[ . 1 ]" 1
372 1 41 VAL H 1 62 ASN QD 5.500 . 5.500 4.044 3.864 4.472 . 0 0 "[ . 1 ]" 1
373 1 42 PHE HA 1 42 PHE QD 3.800 . 3.800 2.569 2.049 3.012 . 0 0 "[ . 1 ]" 1
374 1 42 PHE H 1 42 PHE HB3 3.300 . 3.300 3.650 3.629 3.661 0.361 1 0 "[ . 1 ]" 1
375 1 42 PHE H 1 42 PHE HB2 2.800 . 2.800 2.595 2.429 2.756 . 0 0 "[ . 1 ]" 1
376 1 42 PHE HA 1 43 GLU H 2.800 . 2.800 2.223 2.217 2.228 . 0 0 "[ . 1 ]" 1
377 1 42 PHE HB3 1 43 GLU H 3.800 . 3.800 3.736 3.692 3.787 . 0 0 "[ . 1 ]" 1
378 1 42 PHE HB2 1 43 GLU H 5.500 . 5.500 4.292 4.187 4.407 . 0 0 "[ . 1 ]" 1
379 1 42 PHE H 1 43 GLU H 5.500 . 5.500 4.252 4.222 4.295 . 0 0 "[ . 1 ]" 1
380 1 42 PHE HA 1 57 LEU MD1 5.500 . 5.500 3.008 2.928 3.143 . 0 0 "[ . 1 ]" 1
381 1 42 PHE HB3 1 57 LEU MD1 3.300 . 3.300 2.901 2.818 3.042 . 0 0 "[ . 1 ]" 1
382 1 42 PHE HB3 1 57 LEU MD2 5.500 . 5.500 4.588 4.442 4.656 . 0 0 "[ . 1 ]" 1
383 1 42 PHE HB2 1 57 LEU MD1 4.200 . 4.200 4.247 4.216 4.264 0.064 8 0 "[ . 1 ]" 1
384 1 42 PHE HA 1 58 ALA MB 5.500 . 5.500 5.510 5.477 5.537 0.037 7 0 "[ . 1 ]" 1
385 1 42 PHE HA 1 59 VAL HA 3.800 . 3.800 3.187 3.059 3.275 . 0 0 "[ . 1 ]" 1
386 1 42 PHE HA 1 59 VAL MG1 5.500 . 5.500 3.796 3.556 3.947 . 0 0 "[ . 1 ]" 1
387 1 42 PHE HA 1 59 VAL MG2 5.500 . 5.500 2.620 2.344 2.806 . 0 0 "[ . 1 ]" 1
388 1 42 PHE QD 1 59 VAL MG1 3.800 . 3.800 3.426 2.872 3.768 . 0 0 "[ . 1 ]" 1
389 1 42 PHE QE 1 59 VAL MG1 5.500 . 5.500 3.364 2.494 3.986 . 0 0 "[ . 1 ]" 1
390 1 42 PHE HA 1 60 THR H 5.500 . 5.500 4.411 4.286 4.482 . 0 0 "[ . 1 ]" 1
391 1 43 GLU H 1 43 GLU QB 5.500 . 5.500 2.720 2.691 2.767 . 0 0 "[ . 1 ]" 1
392 1 43 GLU H 1 43 GLU QG 5.500 . 5.500 4.129 3.954 4.278 . 0 0 "[ . 1 ]" 1
393 1 43 GLU HA 1 44 VAL H 2.800 . 2.800 2.303 2.220 2.386 . 0 0 "[ . 1 ]" 1
394 1 43 GLU QB 1 44 VAL H 5.500 . 5.500 3.490 3.368 3.630 . 0 0 "[ . 1 ]" 1
395 1 43 GLU QG 1 44 VAL H 3.800 . 3.800 1.957 1.889 2.261 0.011 4 0 "[ . 1 ]" 1
396 1 43 GLU H 1 44 VAL H 5.500 . 5.500 4.370 4.289 4.416 . 0 0 "[ . 1 ]" 1
397 1 43 GLU QG 1 45 LEU H 5.500 . 5.500 4.762 4.172 5.171 . 0 0 "[ . 1 ]" 1
398 1 43 GLU H 1 57 LEU MD1 2.800 . 2.800 2.869 2.852 2.887 0.087 7 0 "[ . 1 ]" 1
399 1 43 GLU H 1 59 VAL MG2 5.500 . 5.500 3.508 3.294 3.660 . 0 0 "[ . 1 ]" 1
400 1 43 GLU H 1 60 THR H 5.500 . 5.500 5.223 5.079 5.297 . 0 0 "[ . 1 ]" 1
401 1 44 VAL H 1 44 VAL HB 2.800 . 2.800 2.572 2.462 2.804 0.004 4 0 "[ . 1 ]" 1
402 1 44 VAL H 1 45 LEU H 5.500 . 5.500 4.585 4.509 4.618 . 0 0 "[ . 1 ]" 1
403 1 44 VAL QG 1 55 LYS HA 5.500 . 5.500 3.626 3.242 4.466 . 0 0 "[ . 1 ]" 1
404 1 44 VAL H 1 57 LEU MD1 5.500 . 5.500 4.860 4.494 5.103 . 0 0 "[ . 1 ]" 1
405 1 44 VAL QG 1 58 ALA H 3.800 . 3.800 3.838 3.822 3.866 0.066 5 0 "[ . 1 ]" 1
406 1 45 LEU H 1 45 LEU QB 3.800 . 3.800 2.613 2.287 2.971 . 0 0 "[ . 1 ]" 1
407 1 45 LEU H 1 45 LEU MD2 3.800 . 3.800 3.597 2.996 3.894 0.094 6 0 "[ . 1 ]" 1
408 1 45 LEU HA 1 46 GLU H 2.800 . 2.800 2.271 2.135 2.425 . 0 0 "[ . 1 ]" 1
409 1 45 LEU QB 1 46 GLU H 4.200 . 4.200 3.251 2.672 3.537 . 0 0 "[ . 1 ]" 1
410 1 45 LEU MD2 1 46 GLU H 3.300 . 3.300 2.883 1.886 3.409 0.109 7 0 "[ . 1 ]" 1
411 1 45 LEU MD1 1 46 GLU H 3.300 . 3.300 3.366 3.090 3.517 0.217 12 0 "[ . 1 ]" 1
412 1 45 LEU H 1 46 GLU H 4.200 . 4.200 4.340 4.268 4.387 0.187 9 0 "[ . 1 ]" 1
413 1 45 LEU H 1 55 LYS HA 5.500 . 5.500 4.295 4.069 4.612 . 0 0 "[ . 1 ]" 1
414 1 45 LEU H 1 56 VAL H 2.800 . 2.800 2.713 2.420 2.813 0.013 2 0 "[ . 1 ]" 1
415 1 45 LEU H 1 56 VAL MG2 3.800 . 3.800 3.017 2.340 3.768 . 0 0 "[ . 1 ]" 1
416 1 45 LEU MD1 1 58 ALA H 5.500 . 5.500 4.620 3.033 5.417 . 0 0 "[ . 1 ]" 1
417 1 45 LEU H 1 58 ALA H 5.500 . 5.500 3.428 2.885 3.733 . 0 0 "[ . 1 ]" 1
418 1 45 LEU MD2 1 158 TYR QD 4.200 . 4.200 3.880 3.105 4.253 0.053 3 0 "[ . 1 ]" 1
419 1 45 LEU MD1 1 158 TYR QE 2.800 . 2.800 2.811 2.705 2.842 0.042 2 0 "[ . 1 ]" 1
420 1 46 GLU HA 1 46 GLU QB 3.800 . 3.800 2.429 2.191 2.538 . 0 0 "[ . 1 ]" 1
421 1 46 GLU H 1 46 GLU QB 2.800 . 2.800 2.411 2.099 2.833 0.033 11 0 "[ . 1 ]" 1
422 1 46 GLU H 1 46 GLU QG 3.300 . 3.300 3.055 2.229 3.332 0.032 3 0 "[ . 1 ]" 1
423 1 46 GLU HA 1 47 THR MG 4.200 . 4.200 4.094 3.310 4.209 0.009 11 0 "[ . 1 ]" 1
424 1 46 GLU HA 1 47 THR H 2.800 . 2.800 2.175 2.162 2.187 . 0 0 "[ . 1 ]" 1
425 1 46 GLU QG 1 47 THR H 3.800 . 3.800 3.815 3.741 3.857 0.057 4 0 "[ . 1 ]" 1
426 1 46 GLU H 1 47 THR H 4.200 . 4.200 4.279 4.238 4.355 0.155 3 0 "[ . 1 ]" 1
427 1 46 GLU HA 1 55 LYS HA 3.300 . 3.300 2.388 1.866 2.804 0.034 12 0 "[ . 1 ]" 1
428 1 46 GLU HA 1 55 LYS QG 5.500 . 5.500 2.994 2.615 3.518 . 0 0 "[ . 1 ]" 1
429 1 47 THR H 1 47 THR HB 3.800 . 3.800 3.759 3.670 3.816 0.016 8 0 "[ . 1 ]" 1
430 1 47 THR HA 1 48 SER H 3.800 . 3.800 2.484 2.204 2.659 . 0 0 "[ . 1 ]" 1
431 1 47 THR HB 1 48 SER H 5.500 . 5.500 2.444 2.030 3.319 . 0 0 "[ . 1 ]" 1
432 1 47 THR HB 1 49 ASP H 4.200 . 4.200 2.475 2.259 3.048 . 0 0 "[ . 1 ]" 1
433 1 47 THR HB 1 50 ALA H 5.500 . 5.500 3.779 3.052 4.275 . 0 0 "[ . 1 ]" 1
434 1 47 THR H 1 54 ASN HA 3.800 . 3.800 3.741 3.595 3.851 0.051 12 0 "[ . 1 ]" 1
435 1 47 THR H 1 54 ASN QB 5.500 . 5.500 3.485 2.903 4.635 . 0 0 "[ . 1 ]" 1
436 1 47 THR H 1 55 LYS HA 4.200 . 4.200 3.420 2.042 3.952 . 0 0 "[ . 1 ]" 1
437 1 48 SER HA 1 48 SER QB 2.800 . 2.800 2.349 2.185 2.545 . 0 0 "[ . 1 ]" 1
438 1 48 SER HA 1 49 ASP H 3.800 . 3.800 3.196 2.975 3.401 . 0 0 "[ . 1 ]" 1
439 1 48 SER QB 1 49 ASP H 5.500 . 5.500 3.640 3.200 3.998 . 0 0 "[ . 1 ]" 1
440 1 48 SER HA 1 50 ALA H 3.800 . 3.800 3.771 3.665 3.805 0.005 1 0 "[ . 1 ]" 1
441 1 49 ASP H 1 49 ASP QB 2.800 . 2.800 2.457 2.244 2.766 . 0 0 "[ . 1 ]" 1
442 1 49 ASP H 1 50 ALA MB 5.500 . 5.500 3.812 3.613 4.092 . 0 0 "[ . 1 ]" 1
443 1 49 ASP H 1 50 ALA H 2.800 . 2.800 2.112 1.897 2.422 0.003 7 0 "[ . 1 ]" 1
444 1 49 ASP QB 1 125 TRP HE1 3.800 . 3.800 2.416 1.907 3.089 . 0 0 "[ . 1 ]" 1
445 1 50 ALA H 1 50 ALA MB 2.800 . 2.800 2.146 2.050 2.255 . 0 0 "[ . 1 ]" 1
446 1 50 ALA MB 1 51 PRO QD 3.800 . 3.800 2.236 2.006 2.418 . 0 0 "[ . 1 ]" 1
447 1 50 ALA H 1 51 PRO QD 5.500 . 5.500 4.247 4.232 4.263 . 0 0 "[ . 1 ]" 1
448 1 50 ALA HA 1 52 GLU H 4.200 . 4.200 4.191 4.087 4.210 0.010 11 0 "[ . 1 ]" 1
449 1 50 ALA MB 1 54 ASN HA 2.800 . 2.800 1.908 1.881 2.005 0.019 6 0 "[ . 1 ]" 1
450 1 50 ALA MB 1 54 ASN H 5.500 . 5.500 3.478 3.220 3.785 . 0 0 "[ . 1 ]" 1
451 1 50 ALA H 1 54 ASN HA 5.500 . 5.500 3.449 3.142 3.818 . 0 0 "[ . 1 ]" 1
452 1 50 ALA MB 1 55 LYS H 5.500 . 5.500 2.715 2.334 3.080 . 0 0 "[ . 1 ]" 1
453 1 50 ALA HA 1 56 VAL MG1 2.800 . 2.800 2.808 2.798 2.824 0.024 10 0 "[ . 1 ]" 1
454 1 50 ALA HA 1 125 TRP HE1 5.500 . 5.500 3.113 2.551 3.347 . 0 0 "[ . 1 ]" 1
455 1 51 PRO HA 1 51 PRO QG 3.800 . 3.800 3.564 3.563 3.565 . 0 0 "[ . 1 ]" 1
456 1 51 PRO QB 1 51 PRO QD 5.500 . 5.500 2.974 2.972 2.978 . 0 0 "[ . 1 ]" 1
457 1 51 PRO QD 1 51 PRO QG 4.200 . 4.200 1.969 1.968 1.970 . 0 0 "[ . 1 ]" 1
458 1 51 PRO QB 1 52 GLU H 5.500 . 5.500 3.045 2.987 3.176 . 0 0 "[ . 1 ]" 1
459 1 51 PRO QD 1 52 GLU H 5.500 . 5.500 2.283 2.261 2.295 . 0 0 "[ . 1 ]" 1
460 1 51 PRO QB 1 56 VAL MG1 5.500 . 5.500 4.905 4.540 5.265 . 0 0 "[ . 1 ]" 1
461 1 51 PRO QD 1 56 VAL MG1 3.800 . 3.800 2.296 1.940 2.572 . 0 0 "[ . 1 ]" 1
462 1 51 PRO QD 1 125 TRP HZ2 5.500 . 5.500 3.323 3.078 3.606 . 0 0 "[ . 1 ]" 1
463 1 51 PRO QD 1 125 TRP HE1 4.200 . 4.200 3.447 3.017 3.715 . 0 0 "[ . 1 ]" 1
464 1 51 PRO QG 1 125 TRP HE1 5.500 . 5.500 5.017 4.635 5.350 . 0 0 "[ . 1 ]" 1
465 1 51 PRO QD 1 160 ASP QB 5.500 . 5.500 2.643 2.235 3.380 . 0 0 "[ . 1 ]" 1
466 1 52 GLU HA 1 52 GLU QB 3.800 . 3.800 2.501 2.401 2.547 . 0 0 "[ . 1 ]" 1
467 1 52 GLU HA 1 52 GLU QG 4.200 . 4.200 2.256 1.931 2.670 . 0 0 "[ . 1 ]" 1
468 1 52 GLU H 1 52 GLU QB 5.500 . 5.500 2.474 2.307 2.680 . 0 0 "[ . 1 ]" 1
469 1 52 GLU HA 1 53 GLY H 3.300 . 3.300 2.278 2.190 2.420 . 0 0 "[ . 1 ]" 1
470 1 52 GLU QG 1 53 GLY H 5.500 . 5.500 3.709 2.634 4.684 . 0 0 "[ . 1 ]" 1
471 1 52 GLU H 1 53 GLY H 5.500 . 5.500 3.964 3.418 4.306 . 0 0 "[ . 1 ]" 1
472 1 52 GLU H 1 56 VAL MG1 4.200 . 4.200 3.925 3.604 4.200 0.000 10 0 "[ . 1 ]" 1
473 1 53 GLY QA 1 54 ASN QB 5.500 . 5.500 3.959 3.609 4.250 . 0 0 "[ . 1 ]" 1
474 1 53 GLY QA 1 54 ASN H 2.800 . 2.800 2.161 2.156 2.190 . 0 0 "[ . 1 ]" 1
475 1 53 GLY H 1 54 ASN H 5.500 . 5.500 4.481 4.384 4.560 . 0 0 "[ . 1 ]" 1
476 1 53 GLY QA 1 55 LYS H 4.200 . 4.200 3.623 3.433 3.798 . 0 0 "[ . 1 ]" 1
477 1 54 ASN HA 1 54 ASN QB 2.800 . 2.800 2.320 2.196 2.507 . 0 0 "[ . 1 ]" 1
478 1 54 ASN H 1 54 ASN QB 3.300 . 3.300 3.004 2.659 3.309 0.009 7 0 "[ . 1 ]" 1
479 1 54 ASN HA 1 55 LYS H 3.800 . 3.800 2.972 2.870 3.118 . 0 0 "[ . 1 ]" 1
480 1 54 ASN QB 1 55 LYS H 4.200 . 4.200 3.865 3.672 4.056 . 0 0 "[ . 1 ]" 1
481 1 54 ASN H 1 55 LYS H 2.800 . 2.800 2.088 1.888 2.384 0.012 11 0 "[ . 1 ]" 1
482 1 55 LYS HA 1 55 LYS QB 5.500 . 5.500 2.405 2.176 2.496 . 0 0 "[ . 1 ]" 1
483 1 55 LYS HA 1 55 LYS QD 4.200 . 4.200 3.909 3.317 4.255 0.055 12 0 "[ . 1 ]" 1
484 1 55 LYS HA 1 55 LYS QG 4.200 . 4.200 2.361 2.133 3.237 . 0 0 "[ . 1 ]" 1
485 1 55 LYS H 1 55 LYS QB 3.300 . 3.300 2.708 2.527 3.362 0.062 12 0 "[ . 1 ]" 1
486 1 55 LYS H 1 55 LYS QG 4.200 . 4.200 3.168 2.145 3.654 . 0 0 "[ . 1 ]" 1
487 1 55 LYS HA 1 56 VAL H 2.800 . 2.800 2.249 2.194 2.357 . 0 0 "[ . 1 ]" 1
488 1 55 LYS HA 1 56 VAL MG1 5.500 . 5.500 3.420 3.240 3.733 . 0 0 "[ . 1 ]" 1
489 1 55 LYS QB 1 56 VAL H 3.300 . 3.300 2.994 2.629 3.184 . 0 0 "[ . 1 ]" 1
490 1 55 LYS H 1 56 VAL H 5.500 . 5.500 4.359 4.248 4.438 . 0 0 "[ . 1 ]" 1
491 1 56 VAL H 1 56 VAL MG1 3.300 . 3.300 2.908 2.775 3.293 . 0 0 "[ . 1 ]" 1
492 1 56 VAL HA 1 57 LEU H 2.800 . 2.800 2.561 2.544 2.575 . 0 0 "[ . 1 ]" 1
493 1 56 VAL HB 1 57 LEU H 2.800 . 2.800 2.349 2.279 2.373 . 0 0 "[ . 1 ]" 1
494 1 56 VAL MG2 1 57 LEU H 5.500 . 5.500 3.014 2.867 3.419 . 0 0 "[ . 1 ]" 1
495 1 56 VAL MG1 1 57 LEU H 3.800 . 3.800 3.833 3.620 3.873 0.073 7 0 "[ . 1 ]" 1
496 1 56 VAL MG2 1 58 ALA H 5.500 . 5.500 3.360 3.104 3.661 . 0 0 "[ . 1 ]" 1
497 1 56 VAL HB 1 125 TRP HH2 5.500 . 5.500 2.561 2.093 2.993 . 0 0 "[ . 1 ]" 1
498 1 56 VAL MG2 1 125 TRP HZ2 5.500 . 5.500 2.788 2.014 3.255 . 0 0 "[ . 1 ]" 1
499 1 56 VAL MG1 1 125 TRP HE1 5.500 . 5.500 4.574 3.881 4.980 . 0 0 "[ . 1 ]" 1
500 1 56 VAL MG1 1 125 TRP HH2 5.500 . 5.500 2.484 2.021 3.126 . 0 0 "[ . 1 ]" 1
501 1 56 VAL MG1 1 125 TRP HZ2 3.300 . 3.300 2.778 2.055 2.992 . 0 0 "[ . 1 ]" 1
502 1 56 VAL MG2 1 158 TYR HA 5.500 . 5.500 3.652 3.412 3.830 . 0 0 "[ . 1 ]" 1
503 1 56 VAL MG2 1 158 TYR QD 3.300 . 3.300 2.176 1.857 2.474 0.043 12 0 "[ . 1 ]" 1
504 1 56 VAL HB 1 159 ILE H 5.500 . 5.500 3.353 2.890 3.582 . 0 0 "[ . 1 ]" 1
505 1 56 VAL MG2 1 159 ILE H 3.800 . 3.800 3.641 3.406 3.815 0.015 12 0 "[ . 1 ]" 1
506 1 56 VAL MG1 1 160 ASP HA 5.500 . 5.500 4.085 3.930 4.362 . 0 0 "[ . 1 ]" 1
507 1 56 VAL MG1 1 160 ASP QB 3.300 . 3.300 1.879 1.859 1.897 0.041 7 0 "[ . 1 ]" 1
508 1 57 LEU H 1 57 LEU QB 4.200 . 4.200 2.322 2.267 2.362 . 0 0 "[ . 1 ]" 1
509 1 57 LEU QB 1 57 LEU MD1 3.300 . 3.300 1.895 1.881 1.904 0.019 10 0 "[ . 1 ]" 1
510 1 57 LEU QB 1 57 LEU MD2 3.300 . 3.300 2.060 2.034 2.077 . 0 0 "[ . 1 ]" 1
511 1 57 LEU H 1 57 LEU MD1 5.500 . 5.500 4.555 4.484 4.603 . 0 0 "[ . 1 ]" 1
512 1 57 LEU H 1 57 LEU MD2 5.500 . 5.500 3.924 3.852 3.984 . 0 0 "[ . 1 ]" 1
513 1 57 LEU QB 1 58 ALA H 5.500 . 5.500 3.987 3.972 4.003 . 0 0 "[ . 1 ]" 1
514 1 57 LEU MD2 1 58 ALA H 5.500 . 5.500 4.568 4.473 4.643 . 0 0 "[ . 1 ]" 1
515 1 57 LEU MD2 1 73 ALA MB 2.800 . 2.800 2.902 2.860 2.956 0.156 12 0 "[ . 1 ]" 1
516 1 57 LEU MD2 1 158 TYR HA 3.800 . 3.800 3.887 3.871 3.903 0.103 12 0 "[ . 1 ]" 1
517 1 57 LEU QB 1 159 ILE MD 5.500 . 5.500 3.582 3.382 3.785 . 0 0 "[ . 1 ]" 1
518 1 57 LEU MD2 1 159 ILE HB 5.500 . 5.500 3.170 2.782 3.327 . 0 0 "[ . 1 ]" 1
519 1 57 LEU MD2 1 159 ILE MD 2.800 . 2.800 2.220 1.910 2.499 . 0 0 "[ . 1 ]" 1
520 1 57 LEU MD2 1 159 ILE QG 4.200 . 4.200 2.320 2.114 2.525 . 0 0 "[ . 1 ]" 1
521 1 57 LEU H 1 159 ILE MD 5.500 . 5.500 5.091 4.894 5.297 . 0 0 "[ . 1 ]" 1
522 1 57 LEU H 1 159 ILE QG 4.200 . 4.200 4.260 4.236 4.288 0.088 12 0 "[ . 1 ]" 1
523 1 57 LEU H 1 159 ILE H 3.800 . 3.800 2.662 2.419 2.787 . 0 0 "[ . 1 ]" 1
524 1 57 LEU H 1 160 ASP HA 5.500 . 5.500 4.310 4.247 4.368 . 0 0 "[ . 1 ]" 1
525 1 58 ALA MB 1 156 THR MG 2.800 . 2.800 2.525 2.348 2.717 . 0 0 "[ . 1 ]" 1
526 1 58 ALA HA 1 158 TYR HA 3.300 . 3.300 2.155 2.098 2.203 . 0 0 "[ . 1 ]" 1
527 1 58 ALA HA 1 158 TYR QD 5.500 . 5.500 2.849 2.548 3.069 . 0 0 "[ . 1 ]" 1
528 1 58 ALA HA 1 159 ILE H 3.800 . 3.800 3.875 3.844 3.896 0.096 4 0 "[ . 1 ]" 1
529 1 59 VAL H 1 59 VAL HB 2.800 . 2.800 2.396 2.375 2.421 . 0 0 "[ . 1 ]" 1
530 1 59 VAL H 1 59 VAL MG1 3.300 . 3.300 3.680 3.670 3.697 0.397 3 0 "[ . 1 ]" 1
531 1 59 VAL H 1 59 VAL MG2 2.800 . 2.800 2.826 2.807 2.839 0.039 1 0 "[ . 1 ]" 1
532 1 59 VAL HB 1 60 THR H 3.800 . 3.800 4.010 4.001 4.016 0.216 5 0 "[ . 1 ]" 1
533 1 59 VAL MG1 1 60 THR H 3.300 . 3.300 2.212 1.895 2.282 0.005 3 0 "[ . 1 ]" 1
534 1 59 VAL MG2 1 60 THR H 3.800 . 3.800 3.702 3.682 3.738 . 0 0 "[ . 1 ]" 1
535 1 59 VAL H 1 60 THR H 4.200 . 4.200 4.398 4.387 4.407 0.207 6 0 "[ . 1 ]" 1
536 1 59 VAL MG1 1 61 VAL HA 5.500 . 5.500 3.505 3.442 3.640 . 0 0 "[ . 1 ]" 1
537 1 59 VAL MG1 1 61 VAL H 5.500 . 5.500 2.977 2.834 3.302 . 0 0 "[ . 1 ]" 1
538 1 59 VAL MG1 1 61 VAL MG2 2.800 . 2.800 1.903 1.875 1.991 0.025 10 0 "[ . 1 ]" 1
539 1 59 VAL MG1 1 71 ILE MD 5.500 . 5.500 3.931 3.285 4.535 . 0 0 "[ . 1 ]" 1
540 1 59 VAL MG1 1 71 ILE MG 3.300 . 3.300 2.898 2.650 3.230 . 0 0 "[ . 1 ]" 1
541 1 59 VAL MG2 1 71 ILE MG 4.200 . 4.200 3.716 3.391 4.133 . 0 0 "[ . 1 ]" 1
542 1 59 VAL MG1 1 73 ALA MB 5.500 . 5.500 4.916 4.678 5.030 . 0 0 "[ . 1 ]" 1
543 1 59 VAL MG2 1 73 ALA MB 3.800 . 3.800 3.787 3.621 3.833 0.033 8 0 "[ . 1 ]" 1
544 1 59 VAL H 1 156 THR MG 3.300 . 3.300 2.623 2.531 2.751 . 0 0 "[ . 1 ]" 1
545 1 59 VAL MG1 1 157 ILE HB 3.800 . 3.800 3.732 3.593 3.811 0.011 1 0 "[ . 1 ]" 1
546 1 59 VAL MG1 1 157 ILE MD 3.800 . 3.800 2.594 2.333 2.760 . 0 0 "[ . 1 ]" 1
547 1 59 VAL MG1 1 157 ILE H 4.200 . 4.200 3.315 3.222 3.456 . 0 0 "[ . 1 ]" 1
548 1 59 VAL MG2 1 157 ILE MD 5.500 . 5.500 4.036 3.899 4.236 . 0 0 "[ . 1 ]" 1
549 1 59 VAL H 1 157 ILE HB 4.200 . 4.200 4.130 4.084 4.179 . 0 0 "[ . 1 ]" 1
550 1 59 VAL H 1 157 ILE MD 5.500 . 5.500 4.639 4.452 4.849 . 0 0 "[ . 1 ]" 1
551 1 59 VAL H 1 157 ILE H 3.300 . 3.300 3.331 3.312 3.345 0.045 8 0 "[ . 1 ]" 1
552 1 59 VAL H 1 158 TYR HA 3.800 . 3.800 2.909 2.845 2.962 . 0 0 "[ . 1 ]" 1
553 1 59 VAL H 1 158 TYR H 5.500 . 5.500 4.406 4.324 4.523 . 0 0 "[ . 1 ]" 1
554 1 60 THR H 1 60 THR HB 2.800 . 2.800 2.656 2.567 2.725 . 0 0 "[ . 1 ]" 1
555 1 60 THR HA 1 61 VAL H 2.800 . 2.800 2.301 2.279 2.328 . 0 0 "[ . 1 ]" 1
556 1 60 THR H 1 61 VAL H 5.500 . 5.500 3.958 3.892 4.022 . 0 0 "[ . 1 ]" 1
557 1 61 VAL HA 1 61 VAL MG2 2.800 . 2.800 2.260 2.236 2.284 . 0 0 "[ . 1 ]" 1
558 1 61 VAL H 1 61 VAL HB 2.800 . 2.800 2.386 2.353 2.424 . 0 0 "[ . 1 ]" 1
559 1 61 VAL H 1 61 VAL MG2 2.800 . 2.800 2.557 2.438 2.603 . 0 0 "[ . 1 ]" 1
560 1 61 VAL HA 1 62 ASN H 2.800 . 2.800 2.180 2.171 2.190 . 0 0 "[ . 1 ]" 1
561 1 61 VAL MG2 1 62 ASN H 5.500 . 5.500 3.953 3.858 4.040 . 0 0 "[ . 1 ]" 1
562 1 61 VAL H 1 62 ASN H 5.500 . 5.500 4.470 4.375 4.536 . 0 0 "[ . 1 ]" 1
563 1 61 VAL HA 1 63 GLY H 5.500 . 5.500 4.401 4.272 4.525 . 0 0 "[ . 1 ]" 1
564 1 61 VAL MG2 1 152 ASN QB 3.800 . 3.800 2.829 2.662 3.150 . 0 0 "[ . 1 ]" 1
565 1 61 VAL HB 1 153 VAL HA 5.500 . 5.500 3.543 3.403 3.776 . 0 0 "[ . 1 ]" 1
566 1 61 VAL MG1 1 153 VAL HA 2.800 . 2.800 1.954 1.880 2.275 0.020 10 0 "[ . 1 ]" 1
567 1 61 VAL H 1 153 VAL HA 5.500 . 5.500 5.225 4.965 5.398 . 0 0 "[ . 1 ]" 1
568 1 61 VAL HB 1 154 GLY H 5.500 . 5.500 4.951 4.738 5.159 . 0 0 "[ . 1 ]" 1
569 1 61 VAL H 1 155 ASN H 5.500 . 5.500 4.064 3.931 4.181 . 0 0 "[ . 1 ]" 1
570 1 61 VAL H 1 156 THR HA 3.300 . 3.300 2.515 2.421 2.579 . 0 0 "[ . 1 ]" 1
571 1 61 VAL H 1 157 ILE H 5.500 . 5.500 3.167 3.070 3.238 . 0 0 "[ . 1 ]" 1
572 1 62 ASN QB 1 62 ASN QD 3.800 . 3.800 2.244 2.187 2.346 . 0 0 "[ . 1 ]" 1
573 1 62 ASN H 1 62 ASN QB 3.800 . 3.800 3.306 3.269 3.356 . 0 0 "[ . 1 ]" 1
574 1 62 ASN HA 1 63 GLY H 4.200 . 4.200 2.625 2.594 2.668 . 0 0 "[ . 1 ]" 1
575 1 62 ASN QB 1 63 GLY H 5.500 . 5.500 4.012 3.988 4.023 . 0 0 "[ . 1 ]" 1
576 1 62 ASN H 1 63 GLY H 2.800 . 2.800 2.791 2.659 2.819 0.019 7 0 "[ . 1 ]" 1
577 1 62 ASN HA 1 153 VAL MG1 3.800 . 3.800 2.427 2.162 2.681 . 0 0 "[ . 1 ]" 1
578 1 62 ASN HA 1 154 GLY H 3.800 . 3.800 1.887 1.876 1.897 0.024 8 0 "[ . 1 ]" 1
579 1 62 ASN H 1 157 ILE MD 5.500 . 5.500 5.585 5.565 5.610 0.110 10 0 "[ . 1 ]" 1
580 1 63 GLY QA 1 64 VAL MG1 5.500 . 5.500 4.220 4.139 4.288 . 0 0 "[ . 1 ]" 1
581 1 63 GLY QA 1 64 VAL H 3.300 . 3.300 2.282 2.202 2.325 . 0 0 "[ . 1 ]" 1
582 1 63 GLY H 1 64 VAL MG1 4.200 . 4.200 3.587 3.507 3.769 . 0 0 "[ . 1 ]" 1
583 1 63 GLY H 1 64 VAL H 5.500 . 5.500 3.098 2.958 3.366 . 0 0 "[ . 1 ]" 1
584 1 63 GLY H 1 71 ILE MD 5.500 . 5.500 4.706 4.398 5.471 . 0 0 "[ . 1 ]" 1
585 1 63 GLY QA 1 153 VAL MG2 3.800 . 3.800 3.128 2.814 3.282 . 0 0 "[ . 1 ]" 1
586 1 63 GLY QA 1 153 VAL MG1 3.800 . 3.800 3.734 3.374 3.819 0.019 8 0 "[ . 1 ]" 1
587 1 63 GLY H 1 153 VAL MG2 3.800 . 3.800 1.899 1.884 1.950 0.016 8 0 "[ . 1 ]" 1
588 1 64 VAL H 1 64 VAL HB 3.800 . 3.800 3.593 3.588 3.597 . 0 0 "[ . 1 ]" 1
589 1 64 VAL H 1 64 VAL MG2 2.800 . 2.800 1.867 1.856 1.877 0.044 12 0 "[ . 1 ]" 1
590 1 64 VAL H 1 64 VAL MG1 2.800 . 2.800 2.811 2.778 2.838 0.038 12 0 "[ . 1 ]" 1
591 1 64 VAL HB 1 65 GLY H 2.800 . 2.800 1.991 1.895 2.188 0.005 4 0 "[ . 1 ]" 1
592 1 64 VAL MG1 1 65 GLY H 3.300 . 3.300 3.337 3.329 3.346 0.046 4 0 "[ . 1 ]" 1
593 1 64 VAL MG1 1 148 GLY H 5.500 . 5.500 4.071 3.779 4.264 . 0 0 "[ . 1 ]" 1
594 1 64 VAL MG2 1 149 TYR HA 5.500 . 5.500 4.019 3.848 4.166 . 0 0 "[ . 1 ]" 1
595 1 64 VAL MG1 1 149 TYR HA 5.500 . 5.500 2.065 1.876 2.486 0.024 8 0 "[ . 1 ]" 1
596 1 64 VAL MG1 1 149 TYR H 2.800 . 2.800 2.811 2.664 2.847 0.047 8 0 "[ . 1 ]" 1
597 1 64 VAL MG2 1 150 ALA MB 2.800 . 2.800 2.838 2.819 2.859 0.059 12 0 "[ . 1 ]" 1
598 1 64 VAL MG2 1 150 ALA H 5.500 . 5.500 3.543 3.415 3.651 . 0 0 "[ . 1 ]" 1
599 1 64 VAL MG2 1 150 ALA HA 2.800 . 2.800 2.706 2.467 2.810 0.010 10 0 "[ . 1 ]" 1
600 1 64 VAL MG1 1 150 ALA HA 2.800 . 2.800 2.450 2.013 2.816 0.016 8 0 "[ . 1 ]" 1
601 1 64 VAL MG1 1 150 ALA H 4.200 . 4.200 2.858 2.638 3.037 . 0 0 "[ . 1 ]" 1
602 1 64 VAL MG1 1 153 VAL HA 5.500 . 5.500 4.145 4.008 4.346 . 0 0 "[ . 1 ]" 1
603 1 64 VAL MG1 1 153 VAL MG2 2.800 . 2.800 1.900 1.865 2.095 0.035 12 0 "[ . 1 ]" 1
604 1 64 VAL H 1 153 VAL MG2 3.300 . 3.300 2.494 2.348 2.545 . 0 0 "[ . 1 ]" 1
605 1 65 GLY QA 1 66 ASN H 3.800 . 3.800 2.273 2.224 2.323 . 0 0 "[ . 1 ]" 1
606 1 65 GLY H 1 71 ILE MD 5.500 . 5.500 5.393 4.963 5.511 0.011 11 0 "[ . 1 ]" 1
607 1 66 ASN QB 1 66 ASN QD 3.300 . 3.300 2.309 2.204 2.614 . 0 0 "[ . 1 ]" 1
608 1 66 ASN H 1 66 ASN QD 5.500 . 5.500 4.354 3.179 4.820 . 0 0 "[ . 1 ]" 1
609 1 66 ASN QB 1 67 ASN QD 3.800 . 3.800 3.345 2.823 3.804 0.004 6 0 "[ . 1 ]" 1
610 1 66 ASN H 1 67 ASN H 2.800 . 2.800 2.479 2.234 2.739 . 0 0 "[ . 1 ]" 1
611 1 67 ASN QB 1 67 ASN QD 5.500 . 5.500 2.320 2.183 2.583 . 0 0 "[ . 1 ]" 1
612 1 67 ASN HA 1 68 PRO QD 3.300 . 3.300 1.865 1.851 1.883 0.049 1 0 "[ . 1 ]" 1
613 1 67 ASN QB 1 68 PRO QD 5.500 . 5.500 2.255 2.061 2.469 . 0 0 "[ . 1 ]" 1
614 1 67 ASN QB 1 69 TRP HE1 5.500 . 5.500 2.370 2.223 2.599 . 0 0 "[ . 1 ]" 1
615 1 67 ASN QB 1 69 TRP H 5.500 . 5.500 2.408 2.224 2.703 . 0 0 "[ . 1 ]" 1
616 1 67 ASN QD 1 69 TRP HZ2 5.500 . 5.500 3.594 2.418 5.097 . 0 0 "[ . 1 ]" 1
617 1 67 ASN QD 1 69 TRP HE1 4.200 . 4.200 3.230 2.063 4.104 . 0 0 "[ . 1 ]" 1
618 1 67 ASN QB 1 70 ASP H 5.500 . 5.500 4.319 4.133 4.427 . 0 0 "[ . 1 ]" 1
619 1 67 ASN H 1 70 ASP H 5.500 . 5.500 5.503 5.462 5.518 0.018 10 0 "[ . 1 ]" 1
620 1 68 PRO HA 1 69 TRP H 5.500 . 5.500 3.205 2.948 3.236 . 0 0 "[ . 1 ]" 1
621 1 68 PRO QB 1 69 TRP H 5.500 . 5.500 3.858 3.833 4.008 . 0 0 "[ . 1 ]" 1
622 1 68 PRO QD 1 69 TRP H 5.500 . 5.500 2.984 2.914 3.545 . 0 0 "[ . 1 ]" 1
623 1 68 PRO QG 1 69 TRP H 5.500 . 5.500 3.832 3.761 4.334 . 0 0 "[ . 1 ]" 1
624 1 69 TRP HA 1 69 TRP QB 3.300 . 3.300 2.188 2.180 2.192 . 0 0 "[ . 1 ]" 1
625 1 69 TRP H 1 69 TRP QB 4.200 . 4.200 3.205 3.167 3.347 . 0 0 "[ . 1 ]" 1
626 1 69 TRP HA 1 70 ASP H 5.500 . 5.500 2.678 2.618 2.730 . 0 0 "[ . 1 ]" 1
627 1 69 TRP H 1 70 ASP H 3.300 . 3.300 2.917 2.490 3.044 . 0 0 "[ . 1 ]" 1
628 1 69 TRP HA 1 146 HIS HD2 5.500 . 5.500 4.197 3.017 4.662 . 0 0 "[ . 1 ]" 1
629 1 69 TRP HA 1 147 PHE H 5.500 . 5.500 4.158 3.714 4.941 . 0 0 "[ . 1 ]" 1
630 1 70 ASP H 1 70 ASP QB 2.800 . 2.800 2.607 2.170 2.773 . 0 0 "[ . 1 ]" 1
631 1 70 ASP H 1 71 ILE H 2.800 . 2.800 2.773 2.483 2.843 0.043 10 0 "[ . 1 ]" 1
632 1 71 ILE H 1 71 ILE MD 5.500 . 5.500 2.701 1.891 3.395 0.009 4 0 "[ . 1 ]" 1
633 1 71 ILE H 1 71 ILE QG 5.500 . 5.500 2.774 1.893 3.373 0.007 9 0 "[ . 1 ]" 1
634 1 71 ILE H 1 71 ILE MG 5.500 . 5.500 3.811 3.748 3.896 . 0 0 "[ . 1 ]" 1
635 1 71 ILE MD 1 72 GLU H 5.500 . 5.500 5.083 3.952 5.370 . 0 0 "[ . 1 ]" 1
636 1 71 ILE QG 1 72 GLU H 5.500 . 5.500 4.276 4.066 4.670 . 0 0 "[ . 1 ]" 1
637 1 71 ILE MG 1 72 GLU H 3.300 . 3.300 2.666 2.234 2.935 . 0 0 "[ . 1 ]" 1
638 1 71 ILE MG 1 72 GLU HA 5.500 . 5.500 3.784 3.364 4.107 . 0 0 "[ . 1 ]" 1
639 1 71 ILE H 1 72 GLU H 5.500 . 5.500 4.457 4.364 4.608 . 0 0 "[ . 1 ]" 1
640 1 71 ILE HB 1 147 PHE H 5.500 . 5.500 4.144 2.544 4.545 . 0 0 "[ . 1 ]" 1
641 1 71 ILE MG 1 147 PHE QD 5.500 . 5.500 3.363 2.230 4.061 . 0 0 "[ . 1 ]" 1
642 1 71 ILE MG 1 147 PHE H 5.500 . 5.500 4.494 3.631 5.093 . 0 0 "[ . 1 ]" 1
643 1 71 ILE HB 1 148 GLY QA 5.500 . 5.500 3.156 2.855 3.841 . 0 0 "[ . 1 ]" 1
644 1 71 ILE HB 1 148 GLY H 3.800 . 3.800 3.583 3.337 3.833 0.033 9 0 "[ . 1 ]" 1
645 1 71 ILE MD 1 148 GLY QA 3.800 . 3.800 2.172 1.892 3.816 0.016 9 0 "[ . 1 ]" 1
646 1 71 ILE H 1 148 GLY H 4.200 . 4.200 4.242 4.227 4.267 0.067 11 0 "[ . 1 ]" 1
647 1 71 ILE H 1 148 GLY QA 5.500 . 5.500 2.175 2.047 2.585 . 0 0 "[ . 1 ]" 1
648 1 72 GLU HA 1 72 GLU QB 3.800 . 3.800 2.395 2.252 2.543 . 0 0 "[ . 1 ]" 1
649 1 72 GLU HA 1 72 GLU QG 3.800 . 3.800 2.305 1.974 2.639 . 0 0 "[ . 1 ]" 1
650 1 72 GLU H 1 72 GLU QB 3.300 . 3.300 2.577 2.416 2.850 . 0 0 "[ . 1 ]" 1
651 1 72 GLU HA 1 73 ALA MB 5.500 . 5.500 3.960 3.752 4.058 . 0 0 "[ . 1 ]" 1
652 1 72 GLU HA 1 73 ALA H 2.800 . 2.800 2.198 2.158 2.334 . 0 0 "[ . 1 ]" 1
653 1 72 GLU HA 1 73 ALA HA 5.500 . 5.500 4.470 4.453 4.588 . 0 0 "[ . 1 ]" 1
654 1 72 GLU HA 1 145 ILE H 5.500 . 5.500 5.452 5.250 5.549 0.049 5 0 "[ . 1 ]" 1
655 1 72 GLU HA 1 146 HIS HA 5.500 . 5.500 2.646 1.948 3.063 . 0 0 "[ . 1 ]" 1
656 1 72 GLU QB 1 146 HIS HD2 5.500 . 5.500 5.243 4.265 5.540 0.040 9 0 "[ . 1 ]" 1
657 1 72 GLU QG 1 146 HIS HD2 5.500 . 5.500 4.332 3.500 5.501 0.001 6 0 "[ . 1 ]" 1
658 1 72 GLU HA 1 147 PHE QD 3.300 . 3.300 2.827 1.884 3.329 0.029 7 0 "[ . 1 ]" 1
659 1 72 GLU HA 1 147 PHE H 4.200 . 4.200 2.906 2.702 3.453 . 0 0 "[ . 1 ]" 1
660 1 73 ALA H 1 73 ALA MB 3.300 . 3.300 2.482 2.289 2.734 . 0 0 "[ . 1 ]" 1
661 1 73 ALA HA 1 74 THR H 2.800 . 2.800 2.240 2.197 2.330 . 0 0 "[ . 1 ]" 1
662 1 73 ALA MB 1 74 THR H 3.800 . 3.800 3.377 2.955 3.504 . 0 0 "[ . 1 ]" 1
663 1 73 ALA MB 1 145 ILE HB 3.800 . 3.800 2.462 2.044 2.942 . 0 0 "[ . 1 ]" 1
664 1 73 ALA MB 1 145 ILE QG 5.500 . 5.500 3.590 3.023 4.683 . 0 0 "[ . 1 ]" 1
665 1 73 ALA MB 1 145 ILE MG 3.800 . 3.800 3.353 2.881 3.681 . 0 0 "[ . 1 ]" 1
666 1 73 ALA H 1 145 ILE MG 5.500 . 5.500 4.283 4.045 4.655 . 0 0 "[ . 1 ]" 1
667 1 73 ALA H 1 145 ILE H 3.800 . 3.800 3.840 3.572 3.903 0.103 5 0 "[ . 1 ]" 1
668 1 73 ALA MB 1 147 PHE QE 4.200 . 4.200 2.272 1.819 3.474 0.081 6 0 "[ . 1 ]" 1
669 1 74 THR HA 1 74 THR MG 3.800 . 3.800 2.405 2.317 2.496 . 0 0 "[ . 1 ]" 1
670 1 74 THR H 1 74 THR HB 2.800 . 2.800 2.540 2.447 2.739 . 0 0 "[ . 1 ]" 1
671 1 74 THR H 1 74 THR MG 3.800 . 3.800 3.809 3.775 3.841 0.041 5 0 "[ . 1 ]" 1
672 1 74 THR HA 1 75 ALA MB 5.500 . 5.500 3.981 3.939 4.015 . 0 0 "[ . 1 ]" 1
673 1 74 THR HA 1 75 ALA H 2.800 . 2.800 2.430 2.387 2.459 . 0 0 "[ . 1 ]" 1
674 1 74 THR MG 1 75 ALA H 3.300 . 3.300 1.858 1.810 1.879 0.090 9 0 "[ . 1 ]" 1
675 1 74 THR MG 1 76 PHE QB 4.200 . 4.200 2.863 2.761 3.113 . 0 0 "[ . 1 ]" 1
676 1 74 THR MG 1 142 ARG HA 3.800 . 3.800 3.813 3.706 3.870 0.070 5 0 "[ . 1 ]" 1
677 1 74 THR MG 1 142 ARG HE 4.200 . 4.200 3.128 2.622 4.195 . 0 0 "[ . 1 ]" 1
678 1 74 THR HA 1 143 ALA MB 5.500 . 5.500 4.413 4.339 4.513 . 0 0 "[ . 1 ]" 1
679 1 74 THR HA 1 143 ALA H 5.500 . 5.500 5.112 5.010 5.218 . 0 0 "[ . 1 ]" 1
680 1 74 THR MG 1 143 ALA HA 5.500 . 5.500 3.945 3.695 4.341 . 0 0 "[ . 1 ]" 1
681 1 74 THR HA 1 144 PRO HA 3.300 . 3.300 2.565 1.952 3.253 . 0 0 "[ . 1 ]" 1
682 1 74 THR MG 1 144 PRO HA 4.200 . 4.200 2.207 1.895 2.702 0.005 3 0 "[ . 1 ]" 1
683 1 74 THR HA 1 145 ILE H 4.200 . 4.200 2.080 1.863 2.375 0.037 3 0 "[ . 1 ]" 1
684 1 74 THR MG 1 145 ILE H 5.500 . 5.500 3.502 3.375 3.677 . 0 0 "[ . 1 ]" 1
685 1 74 THR H 1 145 ILE MD 5.500 . 5.500 4.911 3.330 5.568 0.068 1 0 "[ . 1 ]" 1
686 1 75 ALA H 1 75 ALA MB 2.800 . 2.800 2.489 2.444 2.545 . 0 0 "[ . 1 ]" 1
687 1 75 ALA HA 1 76 PHE H 2.800 . 2.800 2.208 2.192 2.228 . 0 0 "[ . 1 ]" 1
688 1 75 ALA MB 1 76 PHE H 2.800 . 2.800 2.924 2.891 2.946 0.146 3 0 "[ . 1 ]" 1
689 1 75 ALA H 1 76 PHE H 5.500 . 5.500 4.417 4.387 4.439 . 0 0 "[ . 1 ]" 1
690 1 75 ALA MB 1 142 ARG HA 5.500 . 5.500 4.258 4.070 4.557 . 0 0 "[ . 1 ]" 1
691 1 75 ALA MB 1 143 ALA MB 2.800 . 2.800 2.740 2.590 2.823 0.023 9 0 "[ . 1 ]" 1
692 1 75 ALA MB 1 143 ALA H 3.800 . 3.800 3.010 2.825 3.215 . 0 0 "[ . 1 ]" 1
693 1 75 ALA H 1 143 ALA H 3.300 . 3.300 3.078 2.948 3.154 . 0 0 "[ . 1 ]" 1
694 1 75 ALA H 1 143 ALA MB 3.300 . 3.300 3.343 3.248 3.387 0.087 3 0 "[ . 1 ]" 1
695 1 75 ALA H 1 144 PRO HA 4.200 . 4.200 3.762 3.417 4.205 0.005 5 0 "[ . 1 ]" 1
696 1 75 ALA H 1 145 ILE H 4.200 . 4.200 4.132 3.971 4.298 0.098 8 0 "[ . 1 ]" 1
697 1 75 ALA MB 1 162 LEU MD2 2.800 . 2.800 1.925 1.837 2.583 0.063 2 0 "[ . 1 ]" 1
698 1 76 PHE HA 1 76 PHE QD 3.800 . 3.800 3.585 3.526 3.667 . 0 0 "[ . 1 ]" 1
699 1 76 PHE H 1 76 PHE QB 3.800 . 3.800 3.237 3.182 3.353 . 0 0 "[ . 1 ]" 1
700 1 76 PHE HA 1 77 PRO HA 3.300 . 3.300 2.315 2.273 2.364 . 0 0 "[ . 1 ]" 1
701 1 76 PHE QD 1 77 PRO HA 3.800 . 3.800 2.619 2.168 3.431 . 0 0 "[ . 1 ]" 1
702 1 76 PHE HA 1 78 VAL H 3.800 . 3.800 3.476 3.383 3.608 . 0 0 "[ . 1 ]" 1
703 1 76 PHE HA 1 142 ARG HA 5.500 . 5.500 3.454 3.327 3.525 . 0 0 "[ . 1 ]" 1
704 1 76 PHE QB 1 142 ARG HA 5.500 . 5.500 2.887 2.619 3.063 . 0 0 "[ . 1 ]" 1
705 1 77 PRO QB 1 77 PRO QD 5.500 . 5.500 2.989 2.981 2.998 . 0 0 "[ . 1 ]" 1
706 1 77 PRO QD 1 77 PRO QG 3.300 . 3.300 1.967 1.966 1.968 . 0 0 "[ . 1 ]" 1
707 1 77 PRO HA 1 78 VAL MG2 5.500 . 5.500 3.537 3.417 3.796 . 0 0 "[ . 1 ]" 1
708 1 77 PRO QB 1 78 VAL H 3.800 . 3.800 2.609 2.535 2.697 . 0 0 "[ . 1 ]" 1
709 1 77 PRO HA 1 140 VAL MG1 3.300 . 3.300 3.342 3.324 3.376 0.076 12 0 "[ . 1 ]" 1
710 1 78 VAL HA 1 78 VAL MG2 3.300 . 3.300 2.290 2.118 2.384 . 0 0 "[ . 1 ]" 1
711 1 78 VAL HA 1 78 VAL MG1 3.300 . 3.300 2.351 2.279 2.471 . 0 0 "[ . 1 ]" 1
712 1 78 VAL H 1 78 VAL HB 2.800 . 2.800 2.632 2.526 2.699 . 0 0 "[ . 1 ]" 1
713 1 78 VAL H 1 78 VAL MG2 3.300 . 3.300 2.927 2.856 3.091 . 0 0 "[ . 1 ]" 1
714 1 78 VAL H 1 78 VAL MG1 5.500 . 5.500 3.846 3.770 3.878 . 0 0 "[ . 1 ]" 1
715 1 78 VAL HA 1 79 ASN QB 5.500 . 5.500 4.403 4.132 4.637 . 0 0 "[ . 1 ]" 1
716 1 78 VAL HA 1 79 ASN H 2.800 . 2.800 2.355 2.217 2.394 . 0 0 "[ . 1 ]" 1
717 1 78 VAL MG2 1 79 ASN H 3.800 . 3.800 3.815 3.786 3.859 0.059 7 0 "[ . 1 ]" 1
718 1 78 VAL MG1 1 79 ASN H 3.300 . 3.300 1.979 1.895 2.365 0.005 7 0 "[ . 1 ]" 1
719 1 78 VAL H 1 79 ASN H 5.500 . 5.500 4.482 4.397 4.512 . 0 0 "[ . 1 ]" 1
720 1 78 VAL MG2 1 80 VAL MG1 5.500 . 5.500 4.562 4.166 4.750 . 0 0 "[ . 1 ]" 1
721 1 78 VAL MG1 1 80 VAL MG1 2.800 . 2.800 2.321 1.900 2.552 . 0 0 "[ . 1 ]" 1
722 1 78 VAL H 1 140 VAL MG1 2.800 . 2.800 2.283 2.162 2.420 . 0 0 "[ . 1 ]" 1
723 1 78 VAL HB 1 141 ILE MD 3.800 . 3.800 2.599 2.349 2.754 . 0 0 "[ . 1 ]" 1
724 1 78 VAL HB 1 141 ILE H 3.800 . 3.800 2.294 2.115 2.433 . 0 0 "[ . 1 ]" 1
725 1 78 VAL MG2 1 141 ILE H 5.500 . 5.500 3.870 3.660 3.987 . 0 0 "[ . 1 ]" 1
726 1 78 VAL MG1 1 141 ILE H 5.500 . 5.500 3.394 3.279 3.539 . 0 0 "[ . 1 ]" 1
727 1 78 VAL MG1 1 141 ILE MD 3.300 . 3.300 1.891 1.882 1.900 0.018 12 0 "[ . 1 ]" 1
728 1 78 VAL H 1 141 ILE H 3.800 . 3.800 2.676 2.520 2.824 . 0 0 "[ . 1 ]" 1
729 1 78 VAL MG2 1 142 ARG HA 3.800 . 3.800 2.569 2.087 2.953 . 0 0 "[ . 1 ]" 1
730 1 78 VAL H 1 142 ARG HA 5.500 . 5.500 4.364 4.257 4.417 . 0 0 "[ . 1 ]" 1
731 1 78 VAL MG2 1 143 ALA H 3.800 . 3.800 3.234 3.015 3.413 . 0 0 "[ . 1 ]" 1
732 1 79 ASN HA 1 79 ASN QB 3.800 . 3.800 2.385 2.266 2.493 . 0 0 "[ . 1 ]" 1
733 1 79 ASN QB 1 79 ASN QD 3.800 . 3.800 2.299 2.179 2.422 . 0 0 "[ . 1 ]" 1
734 1 79 ASN H 1 79 ASN QB 2.800 . 2.800 2.554 2.351 2.802 0.002 8 0 "[ . 1 ]" 1
735 1 79 ASN HA 1 80 VAL MG2 3.800 . 3.800 3.503 3.261 3.631 . 0 0 "[ . 1 ]" 1
736 1 79 ASN HA 1 80 VAL MG1 5.500 . 5.500 4.063 3.898 4.276 . 0 0 "[ . 1 ]" 1
737 1 79 ASN HA 1 80 VAL H 2.800 . 2.800 2.217 2.184 2.278 . 0 0 "[ . 1 ]" 1
738 1 79 ASN H 1 80 VAL MG1 5.500 . 5.500 3.878 3.712 4.198 . 0 0 "[ . 1 ]" 1
739 1 79 ASN HA 1 140 VAL HA 3.800 . 3.800 2.908 2.628 3.378 . 0 0 "[ . 1 ]" 1
740 1 79 ASN HA 1 140 VAL MG1 5.500 . 5.500 4.334 4.093 4.610 . 0 0 "[ . 1 ]" 1
741 1 79 ASN HA 1 140 VAL MG2 3.800 . 3.800 3.045 2.845 3.287 . 0 0 "[ . 1 ]" 1
742 1 79 ASN HA 1 141 ILE H 5.500 . 5.500 4.209 3.886 4.717 . 0 0 "[ . 1 ]" 1
743 1 80 VAL HA 1 80 VAL HB 2.800 . 2.800 2.588 2.565 2.623 . 0 0 "[ . 1 ]" 1
744 1 80 VAL HA 1 80 VAL MG2 3.300 . 3.300 3.168 3.161 3.173 . 0 0 "[ . 1 ]" 1
745 1 80 VAL HA 1 80 VAL MG1 2.800 . 2.800 2.256 2.046 2.290 . 0 0 "[ . 1 ]" 1
746 1 80 VAL H 1 80 VAL MG2 2.800 . 2.800 1.964 1.893 2.227 0.007 6 0 "[ . 1 ]" 1
747 1 80 VAL HA 1 81 ARG H 2.800 . 2.800 2.671 2.648 2.685 . 0 0 "[ . 1 ]" 1
748 1 80 VAL MG2 1 81 ARG HA 5.500 . 5.500 4.055 3.988 4.122 . 0 0 "[ . 1 ]" 1
749 1 80 VAL MG2 1 81 ARG H 3.800 . 3.800 3.345 3.268 3.434 . 0 0 "[ . 1 ]" 1
750 1 80 VAL MG1 1 81 ARG H 3.300 . 3.300 3.341 3.311 3.373 0.073 12 0 "[ . 1 ]" 1
751 1 80 VAL MG2 1 86 TYR QE 5.500 . 5.500 4.627 4.521 4.727 . 0 0 "[ . 1 ]" 1
752 1 80 VAL MG1 1 86 TYR QD 5.500 . 5.500 2.748 2.356 2.895 . 0 0 "[ . 1 ]" 1
753 1 80 VAL MG1 1 86 TYR QE 3.300 . 3.300 3.220 2.968 3.311 0.011 4 0 "[ . 1 ]" 1
754 1 80 VAL MG2 1 134 VAL MG1 2.800 . 2.800 2.837 2.814 2.862 0.062 11 0 "[ . 1 ]" 1
755 1 80 VAL MG1 1 134 VAL MG1 5.500 . 5.500 4.493 4.152 4.694 . 0 0 "[ . 1 ]" 1
756 1 80 VAL MG2 1 139 THR HB 5.500 . 5.500 4.140 3.847 4.284 . 0 0 "[ . 1 ]" 1
757 1 80 VAL MG2 1 139 THR MG 3.800 . 3.800 3.794 3.738 3.817 0.017 4 0 "[ . 1 ]" 1
758 1 80 VAL H 1 140 VAL HA 3.800 . 3.800 3.579 3.252 3.699 . 0 0 "[ . 1 ]" 1
759 1 80 VAL H 1 140 VAL MG1 5.500 . 5.500 5.440 5.151 5.514 0.014 12 0 "[ . 1 ]" 1
760 1 80 VAL MG2 1 141 ILE H 5.500 . 5.500 3.597 3.220 3.943 . 0 0 "[ . 1 ]" 1
761 1 80 VAL MG2 1 141 ILE MG 2.800 . 2.800 2.767 2.603 2.827 0.027 6 0 "[ . 1 ]" 1
762 1 80 VAL MG1 1 141 ILE QG 3.800 . 3.800 2.326 1.899 2.601 0.001 3 0 "[ . 1 ]" 1
763 1 80 VAL MG1 1 141 ILE H 5.500 . 5.500 4.403 4.048 4.768 . 0 0 "[ . 1 ]" 1
764 1 80 VAL MG1 1 141 ILE MD 2.800 . 2.800 2.594 2.481 2.804 0.004 8 0 "[ . 1 ]" 1
765 1 80 VAL MG1 1 141 ILE MG 4.200 . 4.200 3.575 3.288 3.842 . 0 0 "[ . 1 ]" 1
766 1 80 VAL MG1 1 164 ILE MG 3.800 . 3.800 2.493 2.348 2.684 . 0 0 "[ . 1 ]" 1
767 1 81 ARG H 1 81 ARG QB 3.300 . 3.300 2.575 2.468 2.669 . 0 0 "[ . 1 ]" 1
768 1 81 ARG HA 1 82 PRO QD 2.800 . 2.800 1.869 1.863 1.877 0.037 10 0 "[ . 1 ]" 1
769 1 81 ARG HA 1 139 THR MG 3.300 . 3.300 3.270 3.065 3.318 0.018 12 0 "[ . 1 ]" 1
770 1 82 PRO QB 1 82 PRO QD 5.500 . 5.500 2.966 2.961 2.970 . 0 0 "[ . 1 ]" 1
771 1 82 PRO HA 1 83 GLY H 2.800 . 2.800 2.232 2.215 2.258 . 0 0 "[ . 1 ]" 1
772 1 82 PRO QB 1 83 GLY H 4.200 . 4.200 3.577 3.395 3.684 . 0 0 "[ . 1 ]" 1
773 1 82 PRO HA 1 84 VAL H 5.500 . 5.500 3.837 3.621 3.978 . 0 0 "[ . 1 ]" 1
774 1 82 PRO HA 1 134 VAL HB 3.800 . 3.800 2.587 2.264 3.206 . 0 0 "[ . 1 ]" 1
775 1 82 PRO HA 1 134 VAL MG2 5.500 . 5.500 2.536 2.041 3.055 . 0 0 "[ . 1 ]" 1
776 1 82 PRO HA 1 134 VAL MG1 2.800 . 2.800 2.794 2.739 2.816 0.016 7 0 "[ . 1 ]" 1
777 1 82 PRO HA 1 134 VAL H 5.500 . 5.500 4.669 4.075 5.137 . 0 0 "[ . 1 ]" 1
778 1 82 PRO QB 1 134 VAL MG1 4.200 . 4.200 3.251 2.813 3.604 . 0 0 "[ . 1 ]" 1
779 1 82 PRO QD 1 139 THR MG 3.300 . 3.300 2.481 2.009 2.613 . 0 0 "[ . 1 ]" 1
780 1 83 GLY H 1 83 GLY QA 2.800 . 2.800 2.347 2.306 2.376 . 0 0 "[ . 1 ]" 1
781 1 83 GLY QA 1 84 VAL H 4.200 . 4.200 2.827 2.788 2.874 . 0 0 "[ . 1 ]" 1
782 1 83 GLY H 1 84 VAL H 2.800 . 2.800 2.753 2.665 2.808 0.008 11 0 "[ . 1 ]" 1
783 1 83 GLY H 1 134 VAL HB 2.800 . 2.800 2.748 2.519 2.814 0.014 4 0 "[ . 1 ]" 1
784 1 83 GLY H 1 134 VAL H 5.500 . 5.500 3.966 3.566 4.197 . 0 0 "[ . 1 ]" 1
785 1 84 VAL HA 1 84 VAL MG1 2.800 . 2.800 2.630 2.621 2.637 . 0 0 "[ . 1 ]" 1
786 1 84 VAL HA 1 84 VAL MG2 2.800 . 2.800 2.157 2.152 2.160 . 0 0 "[ . 1 ]" 1
787 1 84 VAL H 1 84 VAL HB 2.800 . 2.800 2.191 2.187 2.202 . 0 0 "[ . 1 ]" 1
788 1 84 VAL H 1 84 VAL MG1 3.300 . 3.300 3.583 3.582 3.587 0.287 11 0 "[ . 1 ]" 1
789 1 84 VAL H 1 84 VAL MG2 2.800 . 2.800 2.833 2.829 2.844 0.044 11 0 "[ . 1 ]" 1
790 1 84 VAL HA 1 85 THR H 2.800 . 2.800 2.237 2.235 2.239 . 0 0 "[ . 1 ]" 1
791 1 84 VAL HB 1 85 THR H 3.800 . 3.800 4.061 4.056 4.064 0.264 10 0 "[ . 1 ]" 1
792 1 84 VAL MG1 1 85 THR H 2.800 . 2.800 2.173 2.168 2.182 . 0 0 "[ . 1 ]" 1
793 1 84 VAL MG2 1 85 THR H 3.300 . 3.300 3.366 3.358 3.377 0.077 11 0 "[ . 1 ]" 1
794 1 84 VAL H 1 85 THR H 5.500 . 5.500 4.558 4.551 4.561 . 0 0 "[ . 1 ]" 1
795 1 84 VAL MG2 1 86 TYR QE 3.800 . 3.800 3.705 3.575 3.819 0.019 11 0 "[ . 1 ]" 1
796 1 84 VAL H 1 133 THR MG 5.500 . 5.500 5.096 4.672 5.467 . 0 0 "[ . 1 ]" 1
797 1 84 VAL MG1 1 166 SER HA 5.500 . 5.500 4.069 3.046 4.979 . 0 0 "[ . 1 ]" 1
798 1 84 VAL MG1 1 166 SER QB 2.800 . 2.800 2.548 1.965 2.809 0.009 2 0 "[ . 1 ]" 1
799 1 84 VAL MG2 1 166 SER QB 5.500 . 5.500 4.309 3.500 4.707 . 0 0 "[ . 1 ]" 1
800 1 85 THR H 1 85 THR HB 2.800 . 2.800 2.601 2.401 2.729 . 0 0 "[ . 1 ]" 1
801 1 85 THR MG 1 131 GLU HA 5.500 . 5.500 4.464 3.947 5.517 0.017 11 0 "[ . 1 ]" 1
802 1 85 THR MG 1 167 GLN QE 5.500 . 5.500 4.310 2.760 5.498 . 0 0 "[ . 1 ]" 1
803 1 86 TYR HA 1 86 TYR QD 4.200 . 4.200 2.924 2.607 3.028 . 0 0 "[ . 1 ]" 1
804 1 86 TYR H 1 86 TYR QB 3.800 . 3.800 2.391 2.254 2.461 . 0 0 "[ . 1 ]" 1
805 1 86 TYR H 1 86 TYR QD 2.800 . 2.800 2.756 2.594 2.805 0.005 10 0 "[ . 1 ]" 1
806 1 86 TYR HA 1 87 THR H 2.800 . 2.800 2.418 2.297 2.505 . 0 0 "[ . 1 ]" 1
807 1 86 TYR QB 1 87 THR H 3.300 . 3.300 2.522 2.315 2.835 . 0 0 "[ . 1 ]" 1
808 1 86 TYR QD 1 87 THR H 3.800 . 3.800 3.682 3.464 3.829 0.029 11 0 "[ . 1 ]" 1
809 1 86 TYR QB 1 164 ILE MG 3.300 . 3.300 2.099 1.969 2.432 . 0 0 "[ . 1 ]" 1
810 1 86 TYR QD 1 164 ILE MG 2.800 . 2.800 1.990 1.886 2.307 0.014 4 0 "[ . 1 ]" 1
811 1 86 TYR QB 1 165 ALA H 5.500 . 5.500 3.843 3.353 4.354 . 0 0 "[ . 1 ]" 1
812 1 86 TYR QD 1 165 ALA HA 5.500 . 5.500 3.127 2.742 3.470 . 0 0 "[ . 1 ]" 1
813 1 86 TYR QE 1 165 ALA MB 5.500 . 5.500 4.915 4.491 5.503 0.003 1 0 "[ . 1 ]" 1
814 1 86 TYR QD 1 166 SER HA 5.500 . 5.500 4.117 2.944 4.981 . 0 0 "[ . 1 ]" 1
815 1 86 TYR QD 1 166 SER H 4.200 . 4.200 3.934 3.711 4.122 . 0 0 "[ . 1 ]" 1
816 1 86 TYR QE 1 166 SER H 5.500 . 5.500 3.988 3.337 4.476 . 0 0 "[ . 1 ]" 1
817 1 87 THR H 1 87 THR HB 2.800 . 2.800 2.698 2.574 2.804 0.004 4 0 "[ . 1 ]" 1
818 1 87 THR HA 1 131 GLU HA 3.300 . 3.300 2.541 2.227 2.948 . 0 0 "[ . 1 ]" 1
819 1 87 THR MG 1 131 GLU HA 5.500 . 5.500 3.371 3.009 4.275 . 0 0 "[ . 1 ]" 1
820 1 87 THR H 1 164 ILE MG 5.500 . 5.500 3.236 2.804 3.810 . 0 0 "[ . 1 ]" 1
821 1 87 THR HB 1 165 ALA MB 4.200 . 4.200 3.864 3.086 4.212 0.012 9 0 "[ . 1 ]" 1
822 1 87 THR HB 1 165 ALA H 5.500 . 5.500 3.154 2.663 3.682 . 0 0 "[ . 1 ]" 1
823 1 87 THR H 1 165 ALA MB 5.500 . 5.500 4.109 3.339 4.288 . 0 0 "[ . 1 ]" 1
824 1 87 THR H 1 166 SER HA 3.800 . 3.800 3.211 2.643 3.748 . 0 0 "[ . 1 ]" 1
825 1 87 THR H 1 167 GLN H 5.500 . 5.500 5.038 3.303 5.503 0.003 12 0 "[ . 1 ]" 1
826 1 88 TYR H 1 88 TYR QB 3.300 . 3.300 2.693 2.505 2.995 . 0 0 "[ . 1 ]" 1
827 1 88 TYR HA 1 89 THR H 2.800 . 2.800 2.198 2.186 2.214 . 0 0 "[ . 1 ]" 1
828 1 88 TYR QD 1 105 VAL MG1 5.500 . 5.500 2.765 2.374 4.065 . 0 0 "[ . 1 ]" 1
829 1 88 TYR QE 1 105 VAL MG1 5.500 . 5.500 2.876 2.474 4.274 . 0 0 "[ . 1 ]" 1
830 1 88 TYR QB 1 130 PHE H 3.800 . 3.800 3.362 3.098 3.671 . 0 0 "[ . 1 ]" 1
831 1 88 TYR QD 1 130 PHE H 3.300 . 3.300 3.324 3.298 3.352 0.052 2 0 "[ . 1 ]" 1
832 1 88 TYR H 1 131 GLU HA 3.800 . 3.800 3.449 3.299 3.564 . 0 0 "[ . 1 ]" 1
833 1 88 TYR H 1 131 GLU QG 4.200 . 4.200 4.081 3.202 4.212 0.012 4 0 "[ . 1 ]" 1
834 1 88 TYR HA 1 164 ILE HA 3.800 . 3.800 2.710 2.364 2.969 . 0 0 "[ . 1 ]" 1
835 1 89 THR HA 1 89 THR MG 2.800 . 2.800 2.420 2.349 2.478 . 0 0 "[ . 1 ]" 1
836 1 89 THR H 1 89 THR MG 3.800 . 3.800 3.820 3.809 3.842 0.042 1 0 "[ . 1 ]" 1
837 1 89 THR HA 1 90 ILE H 2.800 . 2.800 2.335 2.316 2.378 . 0 0 "[ . 1 ]" 1
838 1 89 THR HA 1 90 ILE MG 5.500 . 5.500 3.868 3.734 3.958 . 0 0 "[ . 1 ]" 1
839 1 89 THR HB 1 90 ILE H 5.500 . 5.500 4.057 3.965 4.127 . 0 0 "[ . 1 ]" 1
840 1 89 THR MG 1 90 ILE H 2.800 . 2.800 2.134 1.950 2.339 . 0 0 "[ . 1 ]" 1
841 1 89 THR MG 1 91 TRP HE1 2.800 . 2.800 2.120 1.900 2.783 . 0 0 "[ . 1 ]" 1
842 1 89 THR HA 1 128 PHE H 5.500 . 5.500 4.617 4.577 4.677 . 0 0 "[ . 1 ]" 1
843 1 89 THR MG 1 128 PHE H 3.800 . 3.800 3.534 3.319 3.743 . 0 0 "[ . 1 ]" 1
844 1 89 THR HA 1 129 THR HA 3.800 . 3.800 2.311 2.156 2.424 . 0 0 "[ . 1 ]" 1
845 1 89 THR MG 1 129 THR HA 5.500 . 5.500 3.958 3.750 4.056 . 0 0 "[ . 1 ]" 1
846 1 89 THR HA 1 130 PHE H 3.800 . 3.800 3.901 3.881 3.922 0.122 8 0 "[ . 1 ]" 1
847 1 89 THR H 1 162 LEU MD1 3.800 . 3.800 3.806 3.706 3.856 0.056 4 0 "[ . 1 ]" 1
848 1 89 THR HB 1 163 ALA MB 3.300 . 3.300 3.356 3.314 3.386 0.086 10 0 "[ . 1 ]" 1
849 1 89 THR HB 1 163 ALA H 5.500 . 5.500 4.080 3.970 4.191 . 0 0 "[ . 1 ]" 1
850 1 89 THR MG 1 163 ALA H 5.500 . 5.500 4.527 4.414 4.675 . 0 0 "[ . 1 ]" 1
851 1 89 THR H 1 163 ALA H 3.300 . 3.300 2.905 2.787 3.039 . 0 0 "[ . 1 ]" 1
852 1 89 THR H 1 164 ILE HA 5.500 . 5.500 3.943 3.672 4.162 . 0 0 "[ . 1 ]" 1
853 1 90 ILE H 1 90 ILE HB 3.800 . 3.800 3.317 3.269 3.365 . 0 0 "[ . 1 ]" 1
854 1 90 ILE MD 1 90 ILE MG 2.800 . 2.800 2.216 2.028 2.595 . 0 0 "[ . 1 ]" 1
855 1 90 ILE H 1 90 ILE MD 5.500 . 5.500 4.794 4.766 4.812 . 0 0 "[ . 1 ]" 1
856 1 90 ILE H 1 90 ILE MG 2.800 . 2.800 2.391 2.210 2.494 . 0 0 "[ . 1 ]" 1
857 1 90 ILE MD 1 91 TRP H 3.800 . 3.800 3.625 3.603 3.644 . 0 0 "[ . 1 ]" 1
858 1 90 ILE QG 1 91 TRP H 2.800 . 2.800 1.896 1.859 1.931 0.041 4 0 "[ . 1 ]" 1
859 1 90 ILE MG 1 91 TRP H 3.800 . 3.800 3.388 3.322 3.474 . 0 0 "[ . 1 ]" 1
860 1 90 ILE MG 1 92 ALA MB 3.800 . 3.800 3.752 3.641 3.812 0.012 11 0 "[ . 1 ]" 1
861 1 90 ILE MG 1 103 PHE QD 5.500 . 5.500 2.911 2.506 3.188 . 0 0 "[ . 1 ]" 1
862 1 90 ILE MG 1 103 PHE QE 3.300 . 3.300 3.303 3.179 3.330 0.030 2 0 "[ . 1 ]" 1
863 1 90 ILE MG 1 128 PHE HB2 3.300 . 3.300 2.677 2.467 2.854 . 0 0 "[ . 1 ]" 1
864 1 90 ILE MG 1 128 PHE H 3.800 . 3.800 2.771 2.582 2.932 . 0 0 "[ . 1 ]" 1
865 1 90 ILE H 1 128 PHE H 2.800 . 2.800 2.863 2.823 2.883 0.083 8 0 "[ . 1 ]" 1
866 1 90 ILE H 1 129 THR HA 4.200 . 4.200 3.776 3.734 3.809 . 0 0 "[ . 1 ]" 1
867 1 90 ILE MG 1 159 ILE MG 4.200 . 4.200 4.011 3.818 4.207 0.007 10 0 "[ . 1 ]" 1
868 1 90 ILE MD 1 160 ASP H 5.500 . 5.500 3.980 3.704 4.142 . 0 0 "[ . 1 ]" 1
869 1 90 ILE HB 1 162 LEU MD1 3.800 . 3.800 2.596 1.899 3.443 0.001 6 0 "[ . 1 ]" 1
870 1 90 ILE MD 1 162 LEU MD1 2.800 . 2.800 2.453 2.071 2.841 0.041 4 0 "[ . 1 ]" 1
871 1 90 ILE MG 1 162 LEU MD1 5.500 . 5.500 3.626 3.037 4.557 . 0 0 "[ . 1 ]" 1
872 1 90 ILE HB 1 163 ALA H 3.800 . 3.800 3.848 3.817 3.868 0.068 11 0 "[ . 1 ]" 1
873 1 90 ILE MD 1 163 ALA H 5.500 . 5.500 4.684 3.896 4.964 . 0 0 "[ . 1 ]" 1
874 1 91 TRP H 1 91 TRP HB2 3.300 . 3.300 2.718 2.634 2.761 . 0 0 "[ . 1 ]" 1
875 1 91 TRP H 1 91 TRP HD1 3.300 . 3.300 2.512 2.419 2.750 . 0 0 "[ . 1 ]" 1
876 1 91 TRP HA 1 92 ALA MB 5.500 . 5.500 3.999 3.961 4.032 . 0 0 "[ . 1 ]" 1
877 1 91 TRP HA 1 92 ALA H 2.800 . 2.800 2.192 2.180 2.228 . 0 0 "[ . 1 ]" 1
878 1 91 TRP HB2 1 92 ALA H 4.200 . 4.200 4.220 4.147 4.237 0.037 4 0 "[ . 1 ]" 1
879 1 91 TRP HB3 1 92 ALA H 3.800 . 3.800 3.368 3.187 3.416 . 0 0 "[ . 1 ]" 1
880 1 91 TRP H 1 92 ALA H 5.500 . 5.500 4.294 4.247 4.395 . 0 0 "[ . 1 ]" 1
881 1 91 TRP HA 1 126 GLN H 5.500 . 5.500 3.711 3.342 4.242 . 0 0 "[ . 1 ]" 1
882 1 91 TRP HA 1 128 PHE H 3.800 . 3.800 3.484 3.427 3.535 . 0 0 "[ . 1 ]" 1
883 1 91 TRP H 1 160 ASP H 3.300 . 3.300 3.373 3.352 3.403 0.103 8 0 "[ . 1 ]" 1
884 1 91 TRP HD1 1 161 GLY QA 5.500 . 5.500 1.892 1.879 1.898 0.021 8 0 "[ . 1 ]" 1
885 1 92 ALA H 1 92 ALA MB 2.800 . 2.800 2.418 2.334 2.507 . 0 0 "[ . 1 ]" 1
886 1 92 ALA HA 1 93 ARG H 2.800 . 2.800 2.299 2.275 2.324 . 0 0 "[ . 1 ]" 1
887 1 92 ALA MB 1 93 ARG H 2.800 . 2.800 2.796 2.753 2.840 0.040 4 0 "[ . 1 ]" 1
888 1 92 ALA H 1 93 ARG H 5.500 . 5.500 4.516 4.466 4.535 . 0 0 "[ . 1 ]" 1
889 1 92 ALA MB 1 101 VAL MG1 5.500 . 5.500 3.766 3.298 4.186 . 0 0 "[ . 1 ]" 1
890 1 92 ALA HA 1 125 TRP HZ3 5.500 . 5.500 2.645 1.986 3.164 . 0 0 "[ . 1 ]" 1
891 1 92 ALA H 1 126 GLN H 3.300 . 3.300 2.431 2.146 2.730 . 0 0 "[ . 1 ]" 1
892 1 92 ALA MB 1 128 PHE QE 5.500 . 5.500 5.438 5.239 5.509 0.009 6 0 "[ . 1 ]" 1
893 1 92 ALA MB 1 158 TYR H 5.500 . 5.500 5.042 4.927 5.262 . 0 0 "[ . 1 ]" 1
894 1 92 ALA HA 1 159 ILE HA 3.800 . 3.800 2.546 2.498 2.596 . 0 0 "[ . 1 ]" 1
895 1 92 ALA HA 1 159 ILE MG 5.500 . 5.500 2.906 2.851 2.970 . 0 0 "[ . 1 ]" 1
896 1 92 ALA MB 1 159 ILE MG 2.800 . 2.800 2.773 2.679 2.812 0.012 1 0 "[ . 1 ]" 1
897 1 92 ALA HA 1 160 ASP H 3.800 . 3.800 3.371 3.260 3.447 . 0 0 "[ . 1 ]" 1
898 1 93 ARG HA 1 93 ARG QB 3.300 . 3.300 2.323 2.202 2.363 . 0 0 "[ . 1 ]" 1
899 1 93 ARG HA 1 93 ARG QG 5.500 . 5.500 2.540 2.421 3.303 . 0 0 "[ . 1 ]" 1
900 1 93 ARG QB 1 93 ARG HE 5.500 . 5.500 3.399 2.219 4.254 . 0 0 "[ . 1 ]" 1
901 1 93 ARG HE 1 93 ARG QG 5.500 . 5.500 2.793 2.120 3.193 . 0 0 "[ . 1 ]" 1
902 1 93 ARG H 1 93 ARG QG 5.500 . 5.500 3.975 2.550 4.164 . 0 0 "[ . 1 ]" 1
903 1 93 ARG HA 1 94 ALA H 2.800 . 2.800 2.225 2.183 2.620 . 0 0 "[ . 1 ]" 1
904 1 93 ARG QB 1 94 ALA H 3.800 . 3.800 3.722 2.221 3.874 0.074 6 0 "[ . 1 ]" 1
905 1 93 ARG QG 1 94 ALA H 4.200 . 4.200 2.897 2.657 3.216 . 0 0 "[ . 1 ]" 1
906 1 93 ARG H 1 94 ALA H 5.500 . 5.500 4.018 3.951 4.388 . 0 0 "[ . 1 ]" 1
907 1 93 ARG H 1 121 ILE MG 3.800 . 3.800 3.247 2.900 3.700 . 0 0 "[ . 1 ]" 1
908 1 93 ARG QB 1 125 TRP H 5.500 . 5.500 3.528 3.280 3.649 . 0 0 "[ . 1 ]" 1
909 1 93 ARG QD 1 125 TRP H 4.200 . 4.200 3.373 2.796 4.211 0.011 8 0 "[ . 1 ]" 1
910 1 93 ARG QD 1 125 TRP HE1 3.800 . 3.800 2.604 2.226 3.068 . 0 0 "[ . 1 ]" 1
911 1 93 ARG HE 1 125 TRP HE1 3.800 . 3.800 3.084 2.191 3.805 0.005 8 0 "[ . 1 ]" 1
912 1 93 ARG HE 1 125 TRP HZ2 5.500 . 5.500 3.468 2.098 5.450 . 0 0 "[ . 1 ]" 1
913 1 93 ARG QG 1 125 TRP HE1 5.500 . 5.500 4.552 4.058 4.759 . 0 0 "[ . 1 ]" 1
914 1 93 ARG H 1 125 TRP HZ3 5.500 . 5.500 3.070 2.449 3.551 . 0 0 "[ . 1 ]" 1
915 1 93 ARG QB 1 126 GLN H 5.500 . 5.500 3.717 3.504 3.894 . 0 0 "[ . 1 ]" 1
916 1 93 ARG H 1 157 ILE HA 5.500 . 5.500 4.751 4.590 4.843 . 0 0 "[ . 1 ]" 1
917 1 93 ARG QG 1 158 TYR QD 5.500 . 5.500 4.095 3.327 4.684 . 0 0 "[ . 1 ]" 1
918 1 93 ARG H 1 158 TYR HB2 3.800 . 3.800 3.436 3.185 3.777 . 0 0 "[ . 1 ]" 1
919 1 93 ARG H 1 158 TYR HB3 5.500 . 5.500 4.726 4.530 4.955 . 0 0 "[ . 1 ]" 1
920 1 93 ARG H 1 158 TYR H 3.300 . 3.300 3.369 3.340 3.419 0.119 10 0 "[ . 1 ]" 1
921 1 93 ARG H 1 159 ILE MG 4.200 . 4.200 4.273 4.248 4.311 0.111 8 0 "[ . 1 ]" 1
922 1 94 ALA H 1 94 ALA MB 2.800 . 2.800 2.285 2.234 2.685 . 0 0 "[ . 1 ]" 1
923 1 94 ALA HA 1 95 GLU H 2.800 . 2.800 2.415 2.298 2.486 . 0 0 "[ . 1 ]" 1
924 1 94 ALA HA 1 95 GLU HA 5.500 . 5.500 4.360 4.353 4.373 . 0 0 "[ . 1 ]" 1
925 1 94 ALA MB 1 95 GLU H 2.800 . 2.800 2.473 2.327 2.739 . 0 0 "[ . 1 ]" 1
926 1 94 ALA HA 1 96 GLN H 5.500 . 5.500 4.597 4.193 4.909 . 0 0 "[ . 1 ]" 1
927 1 94 ALA MB 1 96 GLN H 3.300 . 3.300 2.759 2.530 3.034 . 0 0 "[ . 1 ]" 1
928 1 94 ALA H 1 123 THR HA 2.800 . 2.800 2.834 2.729 2.861 0.061 1 0 "[ . 1 ]" 1
929 1 94 ALA MB 1 155 ASN QD 4.200 . 4.200 3.241 3.000 3.591 . 0 0 "[ . 1 ]" 1
930 1 94 ALA HA 1 158 TYR QD 5.500 . 5.500 2.012 1.863 2.232 0.037 3 0 "[ . 1 ]" 1
931 1 94 ALA HA 1 158 TYR QE 5.500 . 5.500 3.439 3.105 3.739 . 0 0 "[ . 1 ]" 1
932 1 94 ALA HA 1 158 TYR H 3.300 . 3.300 2.295 2.257 2.348 . 0 0 "[ . 1 ]" 1
933 1 94 ALA MB 1 158 TYR H 3.300 . 3.300 3.331 3.302 3.436 0.136 10 0 "[ . 1 ]" 1
934 1 95 GLU H 1 95 GLU QB 3.300 . 3.300 2.122 2.068 2.231 . 0 0 "[ . 1 ]" 1
935 1 95 GLU H 1 95 GLU QG 4.200 . 4.200 3.569 2.697 3.994 . 0 0 "[ . 1 ]" 1
936 1 95 GLU HA 1 96 GLN H 4.200 . 4.200 3.573 3.547 3.587 . 0 0 "[ . 1 ]" 1
937 1 95 GLU QB 1 96 GLN H 4.200 . 4.200 2.439 2.232 2.734 . 0 0 "[ . 1 ]" 1
938 1 95 GLU H 1 96 GLN H 2.800 . 2.800 2.808 2.792 2.822 0.022 4 0 "[ . 1 ]" 1
939 1 95 GLU HA 1 156 THR H 5.500 . 5.500 5.394 5.286 5.467 . 0 0 "[ . 1 ]" 1
940 1 95 GLU QB 1 156 THR H 2.800 . 2.800 2.778 2.611 2.824 0.024 4 0 "[ . 1 ]" 1
941 1 95 GLU H 1 156 THR HB 3.800 . 3.800 2.877 2.578 3.065 . 0 0 "[ . 1 ]" 1
942 1 95 GLU H 1 156 THR MG 5.500 . 5.500 3.782 3.543 3.914 . 0 0 "[ . 1 ]" 1
943 1 95 GLU H 1 157 ILE HA 3.800 . 3.800 3.871 3.856 3.888 0.088 8 0 "[ . 1 ]" 1
944 1 95 GLU HA 1 158 TYR QE 4.200 . 4.200 3.669 3.274 4.113 . 0 0 "[ . 1 ]" 1
945 1 95 GLU QB 1 158 TYR QE 3.800 . 3.800 2.581 2.187 3.503 . 0 0 "[ . 1 ]" 1
946 1 95 GLU QG 1 158 TYR QE 3.800 . 3.800 3.164 2.019 3.802 0.002 3 0 "[ . 1 ]" 1
947 1 95 GLU H 1 158 TYR H 5.500 . 5.500 4.353 4.135 4.460 . 0 0 "[ . 1 ]" 1
948 1 95 GLU H 1 158 TYR QE 4.200 . 4.200 2.476 1.893 2.939 0.007 5 0 "[ . 1 ]" 1
949 1 96 GLN H 1 96 GLN QB 2.800 . 2.800 2.398 2.233 2.743 . 0 0 "[ . 1 ]" 1
950 1 96 GLN QE 1 96 GLN QG 4.200 . 4.200 2.414 2.233 2.630 . 0 0 "[ . 1 ]" 1
951 1 96 GLN QB 1 97 ASP H 3.300 . 3.300 3.119 2.843 3.303 0.003 12 0 "[ . 1 ]" 1
952 1 96 GLN H 1 123 THR MG 4.200 . 4.200 3.766 3.591 4.204 0.004 11 0 "[ . 1 ]" 1
953 1 96 GLN QB 1 155 ASN QD 5.500 . 5.500 2.006 1.892 2.865 0.008 6 0 "[ . 1 ]" 1
954 1 96 GLN QE 1 155 ASN HA 5.500 . 5.500 4.651 3.310 5.439 . 0 0 "[ . 1 ]" 1
955 1 96 GLN H 1 155 ASN QD 3.800 . 3.800 3.291 2.792 3.778 . 0 0 "[ . 1 ]" 1
956 1 97 ASP HA 1 97 ASP QB 3.300 . 3.300 2.220 2.185 2.357 . 0 0 "[ . 1 ]" 1
957 1 97 ASP H 1 97 ASP HA 2.800 . 2.800 2.853 2.828 2.888 0.088 11 0 "[ . 1 ]" 1
958 1 97 ASP H 1 97 ASP QB 2.800 . 2.800 2.655 2.244 2.747 . 0 0 "[ . 1 ]" 1
959 1 97 ASP HA 1 98 GLY QA 5.500 . 5.500 4.043 4.027 4.107 . 0 0 "[ . 1 ]" 1
960 1 97 ASP HA 1 98 GLY H 2.800 . 2.800 2.299 2.271 2.427 . 0 0 "[ . 1 ]" 1
961 1 97 ASP HA 1 99 ALA H 3.800 . 3.800 3.764 3.649 3.821 0.021 1 0 "[ . 1 ]" 1
962 1 97 ASP QB 1 99 ALA MB 5.500 . 5.500 5.519 5.491 5.535 0.035 4 0 "[ . 1 ]" 1
963 1 97 ASP HA 1 122 THR HA 2.800 . 2.800 2.801 2.721 2.823 0.023 5 0 "[ . 1 ]" 1
964 1 97 ASP QB 1 122 THR HA 5.500 . 5.500 2.780 2.622 3.000 . 0 0 "[ . 1 ]" 1
965 1 97 ASP H 1 122 THR HA 5.500 . 5.500 5.160 4.934 5.280 . 0 0 "[ . 1 ]" 1
966 1 97 ASP HA 1 123 THR MG 3.800 . 3.800 2.384 2.159 2.985 . 0 0 "[ . 1 ]" 1
967 1 97 ASP HA 1 123 THR H 5.500 . 5.500 3.326 3.177 3.596 . 0 0 "[ . 1 ]" 1
968 1 97 ASP HA 1 123 THR HA 5.500 . 5.500 3.731 3.606 4.016 . 0 0 "[ . 1 ]" 1
969 1 97 ASP H 1 123 THR MG 2.800 . 2.800 1.890 1.871 1.969 0.029 4 0 "[ . 1 ]" 1
970 1 98 GLY H 1 98 GLY QA 2.800 . 2.800 2.361 2.308 2.392 . 0 0 "[ . 1 ]" 1
971 1 98 GLY QA 1 99 ALA H 4.200 . 4.200 2.777 2.749 2.824 . 0 0 "[ . 1 ]" 1
972 1 98 GLY H 1 99 ALA H 2.800 . 2.800 2.081 1.942 2.286 . 0 0 "[ . 1 ]" 1
973 1 98 GLY H 1 122 THR HA 3.800 . 3.800 3.334 3.175 3.718 . 0 0 "[ . 1 ]" 1
974 1 98 GLY H 1 122 THR MG 5.500 . 5.500 4.437 4.223 4.835 . 0 0 "[ . 1 ]" 1
975 1 98 GLY H 1 123 THR H 5.500 . 5.500 5.105 4.933 5.506 0.006 4 0 "[ . 1 ]" 1
976 1 99 ALA H 1 99 ALA MB 2.800 . 2.800 2.421 2.349 2.460 . 0 0 "[ . 1 ]" 1
977 1 99 ALA MB 1 100 VAL H 2.800 . 2.800 2.908 2.880 2.950 0.150 4 0 "[ . 1 ]" 1
978 1 99 ALA H 1 100 VAL MG2 4.200 . 4.200 4.237 4.216 4.264 0.064 1 0 "[ . 1 ]" 1
979 1 99 ALA MB 1 121 ILE HB 2.800 . 2.800 2.523 2.391 2.619 . 0 0 "[ . 1 ]" 1
980 1 99 ALA H 1 121 ILE HB 3.300 . 3.300 3.335 3.327 3.347 0.047 7 0 "[ . 1 ]" 1
981 1 99 ALA H 1 121 ILE H 4.200 . 4.200 2.854 2.525 3.208 . 0 0 "[ . 1 ]" 1
982 1 99 ALA H 1 121 ILE MD 5.500 . 5.500 5.436 5.367 5.498 . 0 0 "[ . 1 ]" 1
983 1 99 ALA H 1 122 THR HA 5.500 . 5.500 4.619 4.465 4.917 . 0 0 "[ . 1 ]" 1
984 1 99 ALA MB 1 155 ASN QD 3.300 . 3.300 2.477 2.245 3.005 . 0 0 "[ . 1 ]" 1
985 1 99 ALA H 1 155 ASN QD 4.200 . 4.200 3.699 3.280 4.140 . 0 0 "[ . 1 ]" 1
986 1 100 VAL H 1 100 VAL MG1 3.800 . 3.800 3.786 3.773 3.819 0.019 9 0 "[ . 1 ]" 1
987 1 100 VAL H 1 100 VAL MG2 2.800 . 2.800 2.844 2.813 2.865 0.065 10 0 "[ . 1 ]" 1
988 1 100 VAL HA 1 101 VAL H 2.800 . 2.800 2.298 2.250 2.350 . 0 0 "[ . 1 ]" 1
989 1 100 VAL MG1 1 101 VAL H 2.800 . 2.800 2.050 1.896 2.239 0.004 3 0 "[ . 1 ]" 1
990 1 100 VAL MG1 1 101 VAL HA 5.500 . 5.500 3.152 3.065 3.380 . 0 0 "[ . 1 ]" 1
991 1 100 VAL MG1 1 101 VAL MG2 3.800 . 3.800 3.841 3.823 3.871 0.071 3 0 "[ . 1 ]" 1
992 1 100 VAL H 1 101 VAL H 5.500 . 5.500 4.539 4.522 4.554 . 0 0 "[ . 1 ]" 1
993 1 100 VAL H 1 101 VAL MG2 5.500 . 5.500 3.791 3.722 3.904 . 0 0 "[ . 1 ]" 1
994 1 100 VAL MG1 1 118 GLU HA 3.300 . 3.300 2.365 2.055 3.005 . 0 0 "[ . 1 ]" 1
995 1 100 VAL MG1 1 118 GLU QG 5.500 . 5.500 3.258 2.841 4.822 . 0 0 "[ . 1 ]" 1
996 1 100 VAL MG1 1 118 GLU H 5.500 . 5.500 3.410 3.118 3.954 . 0 0 "[ . 1 ]" 1
997 1 100 VAL MG1 1 118 GLU QB 5.500 . 5.500 3.970 3.447 4.164 . 0 0 "[ . 1 ]" 1
998 1 100 VAL MG1 1 119 GLN H 3.300 . 3.300 2.441 2.122 2.958 . 0 0 "[ . 1 ]" 1
999 1 100 VAL MG2 1 120 GLN QE 5.500 . 5.500 3.892 2.074 4.900 . 0 0 "[ . 1 ]" 1
1000 1 100 VAL MG1 1 121 ILE H 5.500 . 5.500 5.147 4.986 5.334 . 0 0 "[ . 1 ]" 1
1001 1 100 VAL MG1 1 121 ILE MD 5.500 . 5.500 4.266 4.069 4.436 . 0 0 "[ . 1 ]" 1
1002 1 100 VAL MG1 1 147 PHE HA 5.500 . 5.500 5.475 5.158 5.550 0.050 11 0 "[ . 1 ]" 1
1003 1 100 VAL MG1 1 149 TYR QB 5.500 . 5.500 3.673 3.423 3.908 . 0 0 "[ . 1 ]" 1
1004 1 100 VAL MG1 1 149 TYR QD 5.500 . 5.500 3.016 2.636 3.561 . 0 0 "[ . 1 ]" 1
1005 1 100 VAL MG1 1 149 TYR QE 4.200 . 4.200 4.003 3.788 4.200 0.000 4 0 "[ . 1 ]" 1
1006 1 100 VAL MG2 1 149 TYR QB 5.500 . 5.500 4.408 4.103 4.643 . 0 0 "[ . 1 ]" 1
1007 1 100 VAL MG1 1 151 ALA MB 3.300 . 3.300 3.065 2.959 3.170 . 0 0 "[ . 1 ]" 1
1008 1 100 VAL MG2 1 151 ALA MB 2.800 . 2.800 1.874 1.843 1.888 0.057 4 0 "[ . 1 ]" 1
1009 1 100 VAL MG2 1 151 ALA HA 5.500 . 5.500 3.987 3.879 4.054 . 0 0 "[ . 1 ]" 1
1010 1 100 VAL H 1 151 ALA MB 3.800 . 3.800 2.996 2.716 3.244 . 0 0 "[ . 1 ]" 1
1011 1 100 VAL HB 1 152 ASN QD 5.500 . 5.500 4.108 3.198 5.038 . 0 0 "[ . 1 ]" 1
1012 1 100 VAL H 1 152 ASN QD 4.200 . 4.200 3.835 3.592 4.046 . 0 0 "[ . 1 ]" 1
1013 1 100 VAL H 1 157 ILE MD 5.500 . 5.500 4.655 4.429 4.937 . 0 0 "[ . 1 ]" 1
1014 1 101 VAL HA 1 101 VAL MG1 3.300 . 3.300 2.332 2.282 2.378 . 0 0 "[ . 1 ]" 1
1015 1 101 VAL HA 1 101 VAL MG2 3.300 . 3.300 2.361 2.235 2.442 . 0 0 "[ . 1 ]" 1
1016 1 101 VAL H 1 101 VAL HB 3.300 . 3.300 2.925 2.863 2.963 . 0 0 "[ . 1 ]" 1
1017 1 101 VAL H 1 101 VAL MG1 5.500 . 5.500 3.982 3.971 4.001 . 0 0 "[ . 1 ]" 1
1018 1 101 VAL H 1 101 VAL MG2 3.300 . 3.300 2.990 2.826 3.183 . 0 0 "[ . 1 ]" 1
1019 1 101 VAL HA 1 102 SER H 2.800 . 2.800 2.441 2.311 2.478 . 0 0 "[ . 1 ]" 1
1020 1 101 VAL HB 1 102 SER H 5.500 . 5.500 3.618 3.535 3.921 . 0 0 "[ . 1 ]" 1
1021 1 101 VAL MG1 1 102 SER HA 5.500 . 5.500 3.686 3.587 3.776 . 0 0 "[ . 1 ]" 1
1022 1 101 VAL MG1 1 102 SER H 2.800 . 2.800 1.888 1.842 2.175 0.058 11 0 "[ . 1 ]" 1
1023 1 101 VAL MG2 1 102 SER H 3.800 . 3.800 3.829 3.806 3.869 0.069 1 0 "[ . 1 ]" 1
1024 1 101 VAL H 1 102 SER H 5.500 . 5.500 4.416 4.359 4.445 . 0 0 "[ . 1 ]" 1
1025 1 101 VAL MG1 1 103 PHE H 5.500 . 5.500 4.340 4.213 4.598 . 0 0 "[ . 1 ]" 1
1026 1 101 VAL H 1 118 GLU HA 5.500 . 5.500 4.278 3.823 4.678 . 0 0 "[ . 1 ]" 1
1027 1 101 VAL H 1 119 GLN H 3.300 . 3.300 2.882 2.501 3.310 0.010 4 0 "[ . 1 ]" 1
1028 1 101 VAL MG1 1 121 ILE MD 5.500 . 5.500 4.321 3.961 4.543 . 0 0 "[ . 1 ]" 1
1029 1 101 VAL H 1 121 ILE QG 4.200 . 4.200 3.146 2.774 3.302 . 0 0 "[ . 1 ]" 1
1030 1 101 VAL H 1 121 ILE H 5.500 . 5.500 5.418 5.154 5.511 0.011 5 0 "[ . 1 ]" 1
1031 1 101 VAL H 1 121 ILE MD 5.500 . 5.500 3.361 2.941 3.635 . 0 0 "[ . 1 ]" 1
1032 1 101 VAL MG1 1 145 ILE MD 5.500 . 5.500 4.442 4.103 4.951 . 0 0 "[ . 1 ]" 1
1033 1 101 VAL MG1 1 145 ILE MG 2.800 . 2.800 2.201 2.089 2.316 . 0 0 "[ . 1 ]" 1
1034 1 101 VAL MG2 1 145 ILE MG 4.200 . 4.200 4.246 4.144 4.291 0.091 10 0 "[ . 1 ]" 1
1035 1 101 VAL MG1 1 146 HIS H 4.200 . 4.200 3.722 3.342 4.175 . 0 0 "[ . 1 ]" 1
1036 1 101 VAL HA 1 147 PHE HA 5.500 . 5.500 3.731 3.226 3.868 . 0 0 "[ . 1 ]" 1
1037 1 101 VAL MG1 1 147 PHE HA 5.500 . 5.500 3.821 3.470 4.100 . 0 0 "[ . 1 ]" 1
1038 1 101 VAL MG2 1 147 PHE HA 4.200 . 4.200 4.202 3.983 4.256 0.056 9 0 "[ . 1 ]" 1
1039 1 101 VAL HA 1 149 TYR QD 4.200 . 4.200 3.745 3.348 4.177 . 0 0 "[ . 1 ]" 1
1040 1 101 VAL HA 1 149 TYR QE 4.200 . 4.200 4.021 3.219 4.213 0.013 4 0 "[ . 1 ]" 1
1041 1 101 VAL MG1 1 152 ASN QD 5.500 . 5.500 3.859 3.389 4.297 . 0 0 "[ . 1 ]" 1
1042 1 101 VAL MG2 1 152 ASN QD 5.500 . 5.500 2.593 1.854 3.524 0.046 10 0 "[ . 1 ]" 1
1043 1 101 VAL MG1 1 157 ILE MD 4.200 . 4.200 4.302 4.276 4.339 0.139 10 0 "[ . 1 ]" 1
1044 1 101 VAL MG1 1 157 ILE MG 4.200 . 4.200 3.324 3.092 3.448 . 0 0 "[ . 1 ]" 1
1045 1 101 VAL MG1 1 159 ILE MG 5.500 . 5.500 2.990 2.820 3.174 . 0 0 "[ . 1 ]" 1
1046 1 101 VAL MG1 1 159 ILE MD 5.500 . 5.500 2.740 2.391 3.166 . 0 0 "[ . 1 ]" 1
1047 1 102 SER HA 1 102 SER QB 5.500 . 5.500 2.336 2.268 2.412 . 0 0 "[ . 1 ]" 1
1048 1 102 SER H 1 102 SER QB 3.800 . 3.800 2.604 2.447 2.739 . 0 0 "[ . 1 ]" 1
1049 1 102 SER HA 1 103 PHE QD 5.500 . 5.500 3.060 2.723 4.262 . 0 0 "[ . 1 ]" 1
1050 1 102 SER HA 1 103 PHE H 2.800 . 2.800 2.225 2.198 2.280 . 0 0 "[ . 1 ]" 1
1051 1 102 SER QB 1 103 PHE H 5.500 . 5.500 3.387 3.040 3.839 . 0 0 "[ . 1 ]" 1
1052 1 102 SER H 1 103 PHE H 5.500 . 5.500 4.381 4.298 4.465 . 0 0 "[ . 1 ]" 1
1053 1 102 SER HA 1 104 THR MG 5.500 . 5.500 4.522 4.320 4.901 . 0 0 "[ . 1 ]" 1
1054 1 102 SER QB 1 104 THR MG 5.500 . 5.500 3.596 3.070 4.249 . 0 0 "[ . 1 ]" 1
1055 1 102 SER HA 1 117 HIS HA 5.500 . 5.500 2.119 1.851 4.579 0.049 9 0 "[ . 1 ]" 1
1056 1 102 SER HA 1 118 GLU H 5.500 . 5.500 2.529 2.105 2.979 . 0 0 "[ . 1 ]" 1
1057 1 102 SER HA 1 119 GLN H 5.500 . 5.500 3.987 3.455 4.470 . 0 0 "[ . 1 ]" 1
1058 1 102 SER H 1 145 ILE MG 5.500 . 5.500 3.093 2.930 3.345 . 0 0 "[ . 1 ]" 1
1059 1 102 SER QB 1 146 HIS H 5.500 . 5.500 2.270 1.880 2.895 0.020 8 0 "[ . 1 ]" 1
1060 1 102 SER H 1 146 HIS H 3.800 . 3.800 3.084 2.608 3.781 . 0 0 "[ . 1 ]" 1
1061 1 103 PHE H 1 103 PHE HB2 3.300 . 3.300 2.863 2.630 3.045 . 0 0 "[ . 1 ]" 1
1062 1 103 PHE H 1 103 PHE HB3 4.200 . 4.200 3.837 3.779 3.914 . 0 0 "[ . 1 ]" 1
1063 1 103 PHE HB3 1 104 THR H 5.500 . 5.500 3.896 3.866 3.931 . 0 0 "[ . 1 ]" 1
1064 1 103 PHE H 1 104 THR MG 4.200 . 4.200 3.479 3.237 3.640 . 0 0 "[ . 1 ]" 1
1065 1 103 PHE HB2 1 116 LEU MD2 5.500 . 5.500 4.067 3.234 4.507 . 0 0 "[ . 1 ]" 1
1066 1 103 PHE HB2 1 116 LEU MD1 4.200 . 4.200 2.033 1.881 2.305 0.019 4 0 "[ . 1 ]" 1
1067 1 103 PHE HB2 1 116 LEU H 4.200 . 4.200 4.208 4.104 4.263 0.063 8 0 "[ . 1 ]" 1
1068 1 103 PHE H 1 116 LEU QB 4.200 . 4.200 4.095 2.654 4.313 0.113 4 0 "[ . 1 ]" 1
1069 1 103 PHE H 1 116 LEU MD1 3.800 . 3.800 3.770 3.503 3.863 0.063 4 0 "[ . 1 ]" 1
1070 1 103 PHE QE 1 121 ILE MD 3.300 . 3.300 3.002 2.576 3.307 0.007 1 0 "[ . 1 ]" 1
1071 1 103 PHE HZ 1 121 ILE MD 3.300 . 3.300 2.897 2.160 3.336 0.036 4 0 "[ . 1 ]" 1
1072 1 103 PHE QD 1 145 ILE MG 5.500 . 5.500 2.415 1.895 2.894 0.005 2 0 "[ . 1 ]" 1
1073 1 103 PHE QE 1 145 ILE MG 3.800 . 3.800 3.056 2.284 3.707 . 0 0 "[ . 1 ]" 1
1074 1 104 THR HA 1 104 THR MG 3.300 . 3.300 2.259 2.227 2.321 . 0 0 "[ . 1 ]" 1
1075 1 104 THR H 1 104 THR MG 2.800 . 2.800 2.941 2.888 2.972 0.172 5 0 "[ . 1 ]" 1
1076 1 104 THR HA 1 105 VAL MG2 5.500 . 5.500 3.024 2.977 3.116 . 0 0 "[ . 1 ]" 1
1077 1 104 THR HA 1 105 VAL H 2.800 . 2.800 2.446 2.389 2.524 . 0 0 "[ . 1 ]" 1
1078 1 104 THR HB 1 105 VAL H 2.800 . 2.800 2.354 2.192 2.472 . 0 0 "[ . 1 ]" 1
1079 1 104 THR MG 1 105 VAL H 3.300 . 3.300 3.489 3.436 3.566 0.266 8 0 "[ . 1 ]" 1
1080 1 104 THR HA 1 115 ARG HA 3.300 . 3.300 2.421 1.884 3.303 0.016 6 0 "[ . 1 ]" 1
1081 1 104 THR HA 1 115 ARG QB 5.500 . 5.500 4.125 3.423 5.144 . 0 0 "[ . 1 ]" 1
1082 1 104 THR MG 1 115 ARG QD 5.500 . 5.500 3.570 1.901 4.701 . 0 0 "[ . 1 ]" 1
1083 1 104 THR MG 1 115 ARG HE 4.200 . 4.200 3.551 1.944 4.193 . 0 0 "[ . 1 ]" 1
1084 1 104 THR HA 1 116 LEU H 5.500 . 5.500 2.925 2.536 3.151 . 0 0 "[ . 1 ]" 1
1085 1 104 THR MG 1 116 LEU H 4.200 . 4.200 2.350 1.887 2.699 0.013 8 0 "[ . 1 ]" 1
1086 1 104 THR HA 1 130 PHE QE 5.500 . 5.500 4.806 4.331 5.215 . 0 0 "[ . 1 ]" 1
1087 1 104 THR HA 1 130 PHE HZ 5.500 . 5.500 4.864 4.307 5.486 . 0 0 "[ . 1 ]" 1
1088 1 105 VAL H 1 105 VAL HB 3.300 . 3.300 3.442 3.401 3.514 0.214 8 0 "[ . 1 ]" 1
1089 1 105 VAL H 1 105 VAL MG2 2.800 . 2.800 1.875 1.827 1.922 0.073 4 0 "[ . 1 ]" 1
1090 1 105 VAL H 1 105 VAL MG1 3.300 . 3.300 3.606 3.540 3.644 0.344 11 0 "[ . 1 ]" 1
1091 1 105 VAL MG2 1 113 TYR QD 3.300 . 3.300 3.350 3.283 3.490 0.190 12 0 "[ . 1 ]" 1
1092 1 105 VAL MG2 1 113 TYR H 5.500 . 5.500 3.241 2.891 3.927 . 0 0 "[ . 1 ]" 1
1093 1 105 VAL MG1 1 113 TYR QD 3.300 . 3.300 3.318 3.276 3.333 0.033 2 0 "[ . 1 ]" 1
1094 1 105 VAL MG1 1 113 TYR QB 5.500 . 5.500 3.949 3.259 4.213 . 0 0 "[ . 1 ]" 1
1095 1 105 VAL HB 1 114 GLY H 5.500 . 5.500 2.924 2.798 3.223 . 0 0 "[ . 1 ]" 1
1096 1 105 VAL MG2 1 114 GLY H 3.300 . 3.300 1.788 1.711 1.832 0.189 4 0 "[ . 1 ]" 1
1097 1 105 VAL MG1 1 114 GLY H 3.800 . 3.800 3.943 3.893 4.085 0.285 12 0 "[ . 1 ]" 1
1098 1 105 VAL H 1 114 GLY H 3.800 . 3.800 3.580 2.469 3.819 0.019 10 0 "[ . 1 ]" 1
1099 1 105 VAL MG2 1 130 PHE QE 5.500 . 5.500 2.466 1.890 2.920 0.010 11 0 "[ . 1 ]" 1
1100 1 105 VAL MG2 1 130 PHE HZ 5.500 . 5.500 2.089 1.877 2.700 0.023 8 0 "[ . 1 ]" 1
1101 1 105 VAL MG1 1 130 PHE QE 5.500 . 5.500 3.764 3.220 4.267 . 0 0 "[ . 1 ]" 1
1102 1 105 VAL MG1 1 130 PHE HZ 3.800 . 3.800 3.165 2.660 3.716 . 0 0 "[ . 1 ]" 1
1103 1 105 VAL H 1 130 PHE QE 5.500 . 5.500 5.084 4.589 5.406 . 0 0 "[ . 1 ]" 1
1104 1 105 VAL HB 1 143 ALA HA 5.500 . 5.500 4.204 3.965 4.448 . 0 0 "[ . 1 ]" 1
1105 1 105 VAL MG2 1 143 ALA HA 5.500 . 5.500 4.246 4.168 4.410 . 0 0 "[ . 1 ]" 1
1106 1 105 VAL MG1 1 143 ALA HA 4.200 . 4.200 2.355 2.015 2.664 . 0 0 "[ . 1 ]" 1
1107 1 105 VAL MG1 1 143 ALA H 3.300 . 3.300 3.505 3.471 3.538 0.238 6 0 "[ . 1 ]" 1
1108 1 105 VAL MG1 1 144 PRO QD 5.500 . 5.500 3.444 3.135 3.737 . 0 0 "[ . 1 ]" 1
1109 1 106 GLY QA 1 107 ASN H 4.200 . 4.200 2.270 2.188 2.323 . 0 0 "[ . 1 ]" 1
1110 1 106 GLY QA 1 113 TYR H 5.500 . 5.500 3.125 2.652 3.827 . 0 0 "[ . 1 ]" 1
1111 1 106 GLY H 1 141 ILE MD 5.500 . 5.500 4.039 3.406 5.055 . 0 0 "[ . 1 ]" 1
1112 1 106 GLY H 1 143 ALA HA 4.200 . 4.200 2.711 1.935 3.110 . 0 0 "[ . 1 ]" 1
1113 1 107 ASN HA 1 107 ASN QB 3.800 . 3.800 2.219 2.181 2.342 . 0 0 "[ . 1 ]" 1
1114 1 107 ASN H 1 107 ASN QB 3.800 . 3.800 2.522 2.255 2.879 . 0 0 "[ . 1 ]" 1
1115 1 107 ASN QB 1 107 ASN QD 5.500 . 5.500 2.128 2.045 2.402 . 0 0 "[ . 1 ]" 1
1116 1 107 ASN HA 1 108 GLN H 3.300 . 3.300 2.713 2.538 2.761 . 0 0 "[ . 1 ]" 1
1117 1 107 ASN QB 1 108 GLN H 3.300 . 3.300 2.534 2.171 3.267 . 0 0 "[ . 1 ]" 1
1118 1 107 ASN QD 1 108 GLN HA 5.500 . 5.500 5.331 4.581 5.864 0.364 8 0 "[ . 1 ]" 1
1119 1 107 ASN H 1 108 GLN H 5.500 . 5.500 4.457 4.380 4.518 . 0 0 "[ . 1 ]" 1
1120 1 107 ASN HA 1 109 SER H 5.500 . 5.500 4.272 4.136 4.697 . 0 0 "[ . 1 ]" 1
1121 1 107 ASN H 1 110 PHE H 5.500 . 5.500 4.022 3.512 4.619 . 0 0 "[ . 1 ]" 1
1122 1 107 ASN QD 1 111 GLN QG . . 3.300 2.683 2.021 3.218 . 0 0 "[ . 1 ]" 1
1123 1 107 ASN QD 1 111 GLN H 3.800 . 3.800 2.687 1.896 3.025 0.004 6 0 "[ . 1 ]" 1
1124 1 107 ASN QD 1 111 GLN QB . . 2.800 1.930 1.846 2.226 0.054 6 0 "[ . 1 ]" 1
1125 1 107 ASN H 1 111 GLN H 3.300 . 3.300 3.244 2.987 3.331 0.031 10 0 "[ . 1 ]" 1
1126 1 107 ASN H 1 112 GLU H 5.500 . 5.500 5.104 4.834 5.548 0.048 8 0 "[ . 1 ]" 1
1127 1 107 ASN HA 1 113 TYR QE 5.500 . 5.500 3.972 3.075 5.513 0.013 8 0 "[ . 1 ]" 1
1128 1 107 ASN H 1 113 TYR H 5.500 . 5.500 5.120 4.004 5.523 0.023 6 0 "[ . 1 ]" 1
1129 1 107 ASN QD 1 138 GLU QG 5.500 . 5.500 2.588 1.893 3.709 0.007 10 0 "[ . 1 ]" 1
1130 1 107 ASN HA 1 141 ILE HB 3.800 . 3.800 3.195 2.976 3.513 . 0 0 "[ . 1 ]" 1
1131 1 107 ASN QB 1 141 ILE MG 5.500 . 5.500 1.998 1.844 2.599 0.056 8 0 "[ . 1 ]" 1
1132 1 107 ASN HA 1 142 ARG H 4.200 . 4.200 2.805 2.568 3.027 . 0 0 "[ . 1 ]" 1
1133 1 108 GLN HA 1 108 GLN QB 3.300 . 3.300 2.350 2.276 2.457 . 0 0 "[ . 1 ]" 1
1134 1 108 GLN HA 1 108 GLN QG 3.800 . 3.800 2.392 2.275 2.516 . 0 0 "[ . 1 ]" 1
1135 1 108 GLN H 1 108 GLN QB 3.800 . 3.800 2.511 2.287 2.678 . 0 0 "[ . 1 ]" 1
1136 1 108 GLN QE 1 108 GLN QG 3.300 . 3.300 2.275 2.183 2.315 . 0 0 "[ . 1 ]" 1
1137 1 108 GLN H 1 108 GLN QG 5.500 . 5.500 2.336 2.080 2.824 . 0 0 "[ . 1 ]" 1
1138 1 108 GLN HA 1 109 SER H 3.800 . 3.800 3.305 3.132 3.575 . 0 0 "[ . 1 ]" 1
1139 1 108 GLN QB 1 109 SER H 5.500 . 5.500 3.296 2.364 3.663 . 0 0 "[ . 1 ]" 1
1140 1 108 GLN QG 1 109 SER H 5.500 . 5.500 4.314 3.781 4.472 . 0 0 "[ . 1 ]" 1
1141 1 108 GLN H 1 109 SER H 3.800 . 3.800 2.792 2.398 2.901 . 0 0 "[ . 1 ]" 1
1142 1 108 GLN QE 1 140 VAL MG2 3.800 . 3.800 3.679 3.270 3.801 0.001 5 0 "[ . 1 ]" 1
1143 1 108 GLN QE 1 140 VAL MG1 3.300 . 3.300 2.344 2.081 3.145 . 0 0 "[ . 1 ]" 1
1144 1 108 GLN QE 1 140 VAL H 5.500 . 5.500 3.884 3.100 4.404 . 0 0 "[ . 1 ]" 1
1145 1 108 GLN QE 1 140 VAL HB 3.800 . 3.800 2.372 1.907 2.667 . 0 0 "[ . 1 ]" 1
1146 1 108 GLN QE 1 141 ILE HA 5.500 . 5.500 3.971 3.071 4.980 . 0 0 "[ . 1 ]" 1
1147 1 108 GLN QG 1 141 ILE HA 5.500 . 5.500 3.870 3.033 4.486 . 0 0 "[ . 1 ]" 1
1148 1 108 GLN H 1 141 ILE MG 5.500 . 5.500 3.712 2.965 4.432 . 0 0 "[ . 1 ]" 1
1149 1 108 GLN H 1 141 ILE HA 5.500 . 5.500 3.792 3.243 4.033 . 0 0 "[ . 1 ]" 1
1150 1 108 GLN HA 1 142 ARG QD 5.500 . 5.500 3.334 2.998 3.799 . 0 0 "[ . 1 ]" 1
1151 1 108 GLN HA 1 142 ARG QG 5.500 . 5.500 4.958 4.599 5.523 0.023 12 0 "[ . 1 ]" 1
1152 1 109 SER HA 1 109 SER QB 3.300 . 3.300 2.385 2.244 2.525 . 0 0 "[ . 1 ]" 1
1153 1 109 SER H 1 109 SER HA 2.800 . 2.800 2.945 2.914 2.962 0.162 1 0 "[ . 1 ]" 1
1154 1 109 SER H 1 109 SER QB 2.800 . 2.800 2.493 2.155 2.804 0.004 11 0 "[ . 1 ]" 1
1155 1 109 SER HA 1 110 PHE QD 5.500 . 5.500 4.081 3.837 4.457 . 0 0 "[ . 1 ]" 1
1156 1 109 SER HA 1 110 PHE H 3.300 . 3.300 3.160 3.092 3.222 . 0 0 "[ . 1 ]" 1
1157 1 110 PHE HA 1 110 PHE QB 3.800 . 3.800 2.310 2.278 2.372 . 0 0 "[ . 1 ]" 1
1158 1 110 PHE HA 1 110 PHE QD 3.800 . 3.800 2.017 1.879 2.116 0.021 12 0 "[ . 1 ]" 1
1159 1 110 PHE HA 1 110 PHE QE 5.500 . 5.500 4.393 4.253 4.486 . 0 0 "[ . 1 ]" 1
1160 1 110 PHE H 1 110 PHE QB 3.800 . 3.800 3.460 3.369 3.506 . 0 0 "[ . 1 ]" 1
1161 1 110 PHE HA 1 111 GLN H 3.300 . 3.300 3.183 3.012 3.280 . 0 0 "[ . 1 ]" 1
1162 1 110 PHE QB 1 111 GLN H 5.500 . 5.500 3.571 3.446 3.720 . 0 0 "[ . 1 ]" 1
1163 1 111 GLN H 1 111 GLN QB 3.800 . 3.800 2.452 2.209 2.738 . 0 0 "[ . 1 ]" 1
1164 1 111 GLN H 1 111 GLN QG 3.800 . 3.800 2.586 1.874 3.874 0.074 9 0 "[ . 1 ]" 1
1165 1 111 GLN HA 1 112 GLU H 2.800 . 2.800 2.363 2.208 2.450 . 0 0 "[ . 1 ]" 1
1166 1 111 GLN H 1 112 GLU H 5.500 . 5.500 4.545 4.135 4.674 . 0 0 "[ . 1 ]" 1
1167 1 112 GLU H 1 112 GLU QG 3.800 . 3.800 3.886 3.841 3.982 0.182 3 0 "[ . 1 ]" 1
1168 1 112 GLU QG 1 113 TYR H 5.500 . 5.500 2.390 2.074 3.118 . 0 0 "[ . 1 ]" 1
1169 1 112 GLU QB 1 114 GLY H 5.500 . 5.500 5.348 5.284 5.404 . 0 0 "[ . 1 ]" 1
1170 1 112 GLU QG 1 114 GLY H 3.300 . 3.300 3.312 3.267 3.350 0.050 12 0 "[ . 1 ]" 1
1171 1 113 TYR HA 1 113 TYR QB . . 3.300 2.322 2.266 2.510 . 0 0 "[ . 1 ]" 1
1172 1 113 TYR HA 1 113 TYR QD 2.800 . 2.800 2.608 1.869 2.815 0.031 12 0 "[ . 1 ]" 1
1173 1 113 TYR H 1 113 TYR QB 3.800 . 3.800 2.587 2.090 2.754 . 0 0 "[ . 1 ]" 1
1174 1 113 TYR HA 1 114 GLY H 4.200 . 4.200 3.577 3.557 3.583 . 0 0 "[ . 1 ]" 1
1175 1 113 TYR QB 1 114 GLY H 3.300 . 3.300 1.939 1.858 2.219 0.042 5 0 "[ . 1 ]" 1
1176 1 113 TYR H 1 114 GLY H 2.800 . 2.800 2.660 2.500 2.849 0.049 12 0 "[ . 1 ]" 1
1177 1 113 TYR QD 1 134 VAL HA 4.200 . 4.200 3.754 3.237 4.211 0.011 4 0 "[ . 1 ]" 1
1178 1 113 TYR QE 1 134 VAL HA 5.500 . 5.500 3.153 2.774 3.495 . 0 0 "[ . 1 ]" 1
1179 1 113 TYR QD 1 135 SER H 2.800 . 2.800 2.479 1.888 2.860 0.060 12 0 "[ . 1 ]" 1
1180 1 113 TYR QE 1 135 SER H 2.800 . 2.800 1.974 1.862 2.392 0.038 8 0 "[ . 1 ]" 1
1181 1 113 TYR QE 1 136 ASP H 2.800 . 2.800 2.823 2.790 2.842 0.042 6 0 "[ . 1 ]" 1
1182 1 113 TYR QD 1 141 ILE MD 3.800 . 3.800 3.221 2.212 3.588 . 0 0 "[ . 1 ]" 1
1183 1 113 TYR QD 1 141 ILE MG 5.500 . 5.500 3.708 3.122 3.961 . 0 0 "[ . 1 ]" 1
1184 1 113 TYR QE 1 141 ILE MD 3.300 . 3.300 3.087 2.786 3.307 0.007 4 0 "[ . 1 ]" 1
1185 1 113 TYR QE 1 141 ILE MG 2.800 . 2.800 1.969 1.884 2.144 0.016 1 0 "[ . 1 ]" 1
1186 1 114 GLY QA 1 115 ARG H 3.300 . 3.300 2.325 2.280 2.347 . 0 0 "[ . 1 ]" 1
1187 1 115 ARG QB 1 115 ARG HE 5.500 . 5.500 2.888 1.899 4.219 0.001 9 0 "[ . 1 ]" 1
1188 1 115 ARG H 1 115 ARG QD 5.500 . 5.500 4.614 4.115 5.178 . 0 0 "[ . 1 ]" 1
1189 1 115 ARG HE 1 115 ARG QG 3.800 . 3.800 2.685 2.074 3.183 . 0 0 "[ . 1 ]" 1
1190 1 115 ARG H 1 115 ARG QG 5.500 . 5.500 3.302 2.199 4.267 . 0 0 "[ . 1 ]" 1
1191 1 115 ARG HA 1 116 LEU H 2.800 . 2.800 2.223 2.171 2.478 . 0 0 "[ . 1 ]" 1
1192 1 115 ARG QB 1 116 LEU H 5.500 . 5.500 3.597 2.974 3.999 . 0 0 "[ . 1 ]" 1
1193 1 115 ARG H 1 116 LEU H 5.500 . 5.500 3.879 3.189 4.362 . 0 0 "[ . 1 ]" 1
1194 1 116 LEU H 1 116 LEU QB 3.300 . 3.300 3.277 3.095 3.334 0.034 12 0 "[ . 1 ]" 1
1195 1 116 LEU QB 1 119 GLN QE 5.500 . 5.500 3.688 2.352 5.498 . 0 0 "[ . 1 ]" 1
1196 1 116 LEU MD1 1 128 PHE HB2 3.800 . 3.800 3.819 3.705 3.870 0.070 8 0 "[ . 1 ]" 1
1197 1 116 LEU MD1 1 128 PHE H 5.500 . 5.500 5.225 4.965 5.309 . 0 0 "[ . 1 ]" 1
1198 1 116 LEU MD2 1 130 PHE QB 3.800 . 3.800 2.627 2.287 2.998 . 0 0 "[ . 1 ]" 1
1199 1 116 LEU MD2 1 130 PHE QD 3.800 . 3.800 2.049 1.889 2.611 0.011 7 0 "[ . 1 ]" 1
1200 1 116 LEU MD1 1 130 PHE QB 5.500 . 5.500 3.909 3.344 4.247 . 0 0 "[ . 1 ]" 1
1201 1 116 LEU MD1 1 130 PHE QD 2.800 . 2.800 2.510 1.969 2.773 . 0 0 "[ . 1 ]" 1
1202 1 116 LEU HG 1 130 PHE QD 5.500 . 5.500 4.386 4.009 4.905 . 0 0 "[ . 1 ]" 1
1203 1 116 LEU MD2 1 131 GLU H 5.500 . 5.500 5.442 5.207 5.525 0.025 1 0 "[ . 1 ]" 1
1204 1 117 HIS HA 1 118 GLU H 2.800 . 2.800 2.398 2.234 2.872 0.072 4 0 "[ . 1 ]" 1
1205 1 118 GLU HA 1 118 GLU QB 4.200 . 4.200 2.466 2.269 2.543 . 0 0 "[ . 1 ]" 1
1206 1 118 GLU H 1 119 GLN H 3.800 . 3.800 2.613 2.081 3.019 . 0 0 "[ . 1 ]" 1
1207 1 119 GLN HA 1 119 GLN QB 4.200 . 4.200 2.304 2.195 2.367 . 0 0 "[ . 1 ]" 1
1208 1 119 GLN HA 1 119 GLN QE 4.200 . 4.200 3.245 1.966 4.209 0.009 4 0 "[ . 1 ]" 1
1209 1 119 GLN H 1 119 GLN QB 2.800 . 2.800 2.715 2.614 2.830 0.030 10 0 "[ . 1 ]" 1
1210 1 119 GLN QE 1 119 GLN QG 3.800 . 3.800 2.451 2.219 2.738 . 0 0 "[ . 1 ]" 1
1211 1 119 GLN H 1 119 GLN QG 2.800 . 2.800 2.510 1.991 2.816 0.016 4 0 "[ . 1 ]" 1
1212 1 119 GLN QB 1 121 ILE MD 5.500 . 5.500 2.733 2.180 3.986 . 0 0 "[ . 1 ]" 1
1213 1 120 GLN QG 1 121 ILE H 5.500 . 5.500 4.014 3.609 4.442 . 0 0 "[ . 1 ]" 1
1214 1 121 ILE HA 1 121 ILE MD 3.300 . 3.300 2.064 1.892 2.263 0.008 10 0 "[ . 1 ]" 1
1215 1 121 ILE H 1 121 ILE HB 2.800 . 2.800 2.867 2.818 2.886 0.086 8 0 "[ . 1 ]" 1
1216 1 121 ILE H 1 121 ILE QG 2.800 . 2.800 2.472 2.291 2.601 . 0 0 "[ . 1 ]" 1
1217 1 121 ILE HA 1 122 THR H 2.800 . 2.800 2.196 2.164 2.237 . 0 0 "[ . 1 ]" 1
1218 1 121 ILE HB 1 122 THR H 3.800 . 3.800 3.909 3.888 3.935 0.135 11 0 "[ . 1 ]" 1
1219 1 121 ILE MD 1 122 THR H 4.200 . 4.200 3.815 3.688 3.964 . 0 0 "[ . 1 ]" 1
1220 1 121 ILE MD 1 128 PHE QE 5.500 . 5.500 3.670 3.403 4.028 . 0 0 "[ . 1 ]" 1
1221 1 121 ILE MD 1 128 PHE HZ 5.500 . 5.500 5.448 5.092 5.516 0.016 10 0 "[ . 1 ]" 1
1222 1 122 THR HA 1 122 THR HB 2.800 . 2.800 2.696 2.686 2.702 . 0 0 "[ . 1 ]" 1
1223 1 122 THR HA 1 122 THR MG 2.800 . 2.800 2.140 2.138 2.141 . 0 0 "[ . 1 ]" 1
1224 1 122 THR H 1 122 THR MG 2.800 . 2.800 2.991 2.966 3.006 0.206 11 0 "[ . 1 ]" 1
1225 1 122 THR HA 1 123 THR H 2.800 . 2.800 2.581 2.571 2.585 . 0 0 "[ . 1 ]" 1
1226 1 122 THR HB 1 123 THR H 2.800 . 2.800 2.117 2.098 2.130 . 0 0 "[ . 1 ]" 1
1227 1 122 THR MG 1 123 THR H 2.800 . 2.800 2.961 2.943 2.976 0.176 11 0 "[ . 1 ]" 1
1228 1 122 THR H 1 123 THR H 5.500 . 5.500 4.521 4.504 4.538 . 0 0 "[ . 1 ]" 1
1229 1 122 THR HA 1 124 GLU H 5.500 . 5.500 4.012 3.986 4.078 . 0 0 "[ . 1 ]" 1
1230 1 122 THR HB 1 124 GLU H 3.300 . 3.300 2.201 2.135 2.255 . 0 0 "[ . 1 ]" 1
1231 1 122 THR MG 1 124 GLU H 4.200 . 4.200 3.908 3.865 3.938 . 0 0 "[ . 1 ]" 1
1232 1 122 THR MG 1 126 GLN QE 3.300 . 3.300 2.938 2.526 3.292 . 0 0 "[ . 1 ]" 1
1233 1 122 THR H 1 126 GLN QE 5.500 . 5.500 3.207 2.157 4.040 . 0 0 "[ . 1 ]" 1
1234 1 123 THR HA 1 123 THR HB 2.800 . 2.800 2.470 2.375 2.669 . 0 0 "[ . 1 ]" 1
1235 1 123 THR HA 1 123 THR MG 2.800 . 2.800 2.387 2.205 2.502 . 0 0 "[ . 1 ]" 1
1236 1 123 THR H 1 123 THR MG 2.800 . 2.800 2.247 2.015 2.805 0.005 10 0 "[ . 1 ]" 1
1237 1 123 THR HA 1 124 GLU H 3.800 . 3.800 3.320 3.289 3.419 . 0 0 "[ . 1 ]" 1
1238 1 124 GLU H 1 124 GLU QB 2.800 . 2.800 2.543 2.265 2.767 . 0 0 "[ . 1 ]" 1
1239 1 124 GLU HA 1 125 TRP H 5.500 . 5.500 2.724 2.562 2.754 . 0 0 "[ . 1 ]" 1
1240 1 124 GLU QB 1 125 TRP H 2.800 . 2.800 2.033 1.886 2.208 0.014 12 0 "[ . 1 ]" 1
1241 1 124 GLU H 1 125 TRP H 5.500 . 5.500 4.426 4.394 4.513 . 0 0 "[ . 1 ]" 1
1242 1 125 TRP H 1 125 TRP QB 2.800 . 2.800 2.398 2.347 2.454 . 0 0 "[ . 1 ]" 1
1243 1 125 TRP H 1 125 TRP HD1 3.300 . 3.300 2.974 2.604 3.298 . 0 0 "[ . 1 ]" 1
1244 1 125 TRP QB 1 126 GLN H 3.800 . 3.800 3.328 3.093 3.478 . 0 0 "[ . 1 ]" 1
1245 1 125 TRP HH2 1 158 TYR HB3 5.500 . 5.500 2.200 1.891 2.541 0.009 12 0 "[ . 1 ]" 1
1246 1 125 TRP HZ2 1 158 TYR HB3 5.500 . 5.500 3.711 3.071 4.311 . 0 0 "[ . 1 ]" 1
1247 1 125 TRP HH2 1 159 ILE HA 5.500 . 5.500 4.135 3.528 4.711 . 0 0 "[ . 1 ]" 1
1248 1 125 TRP HZ3 1 159 ILE HA 3.800 . 3.800 2.611 2.110 2.856 . 0 0 "[ . 1 ]" 1
1249 1 125 TRP HZ3 1 160 ASP H 5.500 . 5.500 2.925 2.404 3.179 . 0 0 "[ . 1 ]" 1
1250 1 126 GLN HA 1 126 GLN QB 4.200 . 4.200 2.478 2.336 2.543 . 0 0 "[ . 1 ]" 1
1251 1 126 GLN HA 1 126 GLN QG 4.200 . 4.200 2.194 1.929 2.512 . 0 0 "[ . 1 ]" 1
1252 1 126 GLN QB 1 126 GLN QE 5.500 . 5.500 3.288 2.608 3.601 . 0 0 "[ . 1 ]" 1
1253 1 126 GLN H 1 126 GLN QB 3.300 . 3.300 2.373 2.262 2.565 . 0 0 "[ . 1 ]" 1
1254 1 126 GLN QE 1 126 GLN QG 4.200 . 4.200 2.269 2.181 2.373 . 0 0 "[ . 1 ]" 1
1255 1 126 GLN HA 1 127 PRO QD 3.300 . 3.300 1.858 1.856 1.860 0.044 11 0 "[ . 1 ]" 1
1256 1 126 GLN HA 1 127 PRO QG 5.500 . 5.500 3.803 3.802 3.805 . 0 0 "[ . 1 ]" 1
1257 1 126 GLN QB 1 127 PRO QD 3.800 . 3.800 3.285 2.963 3.529 . 0 0 "[ . 1 ]" 1
1258 1 127 PRO QD 1 127 PRO QG 3.800 . 3.800 1.967 1.966 1.967 . 0 0 "[ . 1 ]" 1
1259 1 127 PRO QB 1 128 PHE H 5.500 . 5.500 3.664 3.538 3.751 . 0 0 "[ . 1 ]" 1
1260 1 128 PHE H 1 128 PHE HB2 2.800 . 2.800 2.361 2.280 2.443 . 0 0 "[ . 1 ]" 1
1261 1 128 PHE H 1 128 PHE HB3 3.300 . 3.300 3.413 3.388 3.440 0.140 8 0 "[ . 1 ]" 1
1262 1 128 PHE HA 1 129 THR H 2.800 . 2.800 2.252 2.225 2.280 . 0 0 "[ . 1 ]" 1
1263 1 128 PHE HB3 1 129 THR H 3.300 . 3.300 3.369 3.339 3.404 0.104 6 0 "[ . 1 ]" 1
1264 1 128 PHE H 1 129 THR H 5.500 . 5.500 4.443 4.386 4.494 . 0 0 "[ . 1 ]" 1
1265 1 129 THR HA 1 129 THR MG 3.300 . 3.300 3.183 3.181 3.185 . 0 0 "[ . 1 ]" 1
1266 1 129 THR H 1 129 THR HB 3.300 . 3.300 3.271 3.220 3.295 . 0 0 "[ . 1 ]" 1
1267 1 129 THR H 1 129 THR MG 2.800 . 2.800 2.340 2.276 2.378 . 0 0 "[ . 1 ]" 1
1268 1 129 THR HA 1 130 PHE H 2.800 . 2.800 2.454 2.435 2.475 . 0 0 "[ . 1 ]" 1
1269 1 129 THR HB 1 130 PHE H 3.300 . 3.300 3.590 3.587 3.594 0.294 11 0 "[ . 1 ]" 1
1270 1 129 THR MG 1 130 PHE HA 5.500 . 5.500 3.118 3.086 3.169 . 0 0 "[ . 1 ]" 1
1271 1 129 THR MG 1 130 PHE H 2.800 . 2.800 2.880 2.863 2.901 0.101 2 0 "[ . 1 ]" 1
1272 1 129 THR H 1 130 PHE H 5.500 . 5.500 4.378 4.372 4.394 . 0 0 "[ . 1 ]" 1
1273 1 130 PHE HA 1 130 PHE QB 3.300 . 3.300 2.194 2.187 2.200 . 0 0 "[ . 1 ]" 1
1274 1 130 PHE HA 1 130 PHE QD 5.500 . 5.500 3.666 3.612 3.694 . 0 0 "[ . 1 ]" 1
1275 1 130 PHE H 1 130 PHE QD 3.300 . 3.300 3.093 2.724 3.354 0.054 2 0 "[ . 1 ]" 1
1276 1 130 PHE HA 1 131 GLU QG 5.500 . 5.500 3.245 3.028 3.717 . 0 0 "[ . 1 ]" 1
1277 1 130 PHE HA 1 131 GLU H 2.800 . 2.800 2.566 2.329 2.749 . 0 0 "[ . 1 ]" 1
1278 1 130 PHE QB 1 131 GLU H 2.800 . 2.800 2.311 1.896 2.802 0.004 9 0 "[ . 1 ]" 1
1279 1 130 PHE QD 1 131 GLU H 5.500 . 5.500 2.898 2.147 3.731 . 0 0 "[ . 1 ]" 1
1280 1 130 PHE H 1 131 GLU H 5.500 . 5.500 4.370 4.291 4.402 . 0 0 "[ . 1 ]" 1
1281 1 131 GLU HA 1 131 GLU QG 3.300 . 3.300 2.441 2.209 2.549 . 0 0 "[ . 1 ]" 1
1282 1 131 GLU H 1 131 GLU QB 2.800 . 2.800 2.669 2.409 2.815 0.015 11 0 "[ . 1 ]" 1
1283 1 131 GLU H 1 131 GLU QG 2.800 . 2.800 2.682 2.268 2.806 0.006 5 0 "[ . 1 ]" 1
1284 1 131 GLU HA 1 132 PHE QD 5.500 . 5.500 4.113 2.720 5.295 . 0 0 "[ . 1 ]" 1
1285 1 131 GLU HA 1 132 PHE H 2.800 . 2.800 2.289 2.226 2.356 . 0 0 "[ . 1 ]" 1
1286 1 132 PHE HA 1 132 PHE QD 4.200 . 4.200 3.187 2.749 3.679 . 0 0 "[ . 1 ]" 1
1287 1 132 PHE HA 1 132 PHE QB 3.800 . 3.800 2.398 2.191 2.545 . 0 0 "[ . 1 ]" 1
1288 1 132 PHE HA 1 133 THR HB 5.500 . 5.500 4.058 3.958 4.183 . 0 0 "[ . 1 ]" 1
1289 1 132 PHE HA 1 133 THR H 2.800 . 2.800 2.398 2.228 2.489 . 0 0 "[ . 1 ]" 1
1290 1 133 THR H 1 133 THR HB 2.800 . 2.800 2.550 2.222 2.810 0.010 2 0 "[ . 1 ]" 1
1291 1 133 THR H 1 133 THR MG 3.300 . 3.300 3.157 2.834 3.367 0.067 8 0 "[ . 1 ]" 1
1292 1 133 THR HB 1 134 VAL H 5.500 . 5.500 4.306 4.286 4.344 . 0 0 "[ . 1 ]" 1
1293 1 133 THR MG 1 134 VAL HA 5.500 . 5.500 4.005 3.887 4.065 . 0 0 "[ . 1 ]" 1
1294 1 133 THR MG 1 134 VAL H 2.800 . 2.800 2.671 2.453 2.863 0.063 7 0 "[ . 1 ]" 1
1295 1 133 THR MG 1 135 SER H 5.500 . 5.500 4.172 3.910 4.279 . 0 0 "[ . 1 ]" 1
1296 1 134 VAL HA 1 134 VAL MG1 3.300 . 3.300 2.257 2.211 2.298 . 0 0 "[ . 1 ]" 1
1297 1 134 VAL HA 1 134 VAL MG2 3.300 . 3.300 2.450 2.419 2.510 . 0 0 "[ . 1 ]" 1
1298 1 134 VAL H 1 134 VAL HB 2.800 . 2.800 2.840 2.827 2.855 0.055 8 0 "[ . 1 ]" 1
1299 1 134 VAL HA 1 135 SER H 2.800 . 2.800 2.207 2.181 2.223 . 0 0 "[ . 1 ]" 1
1300 1 134 VAL MG1 1 135 SER H 3.800 . 3.800 2.984 2.922 3.017 . 0 0 "[ . 1 ]" 1
1301 1 134 VAL HB 1 136 ASP H 5.500 . 5.500 4.606 3.844 4.921 . 0 0 "[ . 1 ]" 1
1302 1 134 VAL MG1 1 136 ASP H 2.800 . 2.800 2.649 2.217 2.866 0.066 10 0 "[ . 1 ]" 1
1303 1 134 VAL HA 1 138 GLU H 4.200 . 4.200 4.309 4.282 4.378 0.178 8 0 "[ . 1 ]" 1
1304 1 134 VAL MG1 1 138 GLU H 3.300 . 3.300 1.846 1.817 1.857 0.083 10 0 "[ . 1 ]" 1
1305 1 135 SER H 1 135 SER QB 3.800 . 3.800 2.230 2.073 2.431 . 0 0 "[ . 1 ]" 1
1306 1 135 SER H 1 136 ASP H 2.800 . 2.800 2.745 2.376 2.825 0.025 11 0 "[ . 1 ]" 1
1307 1 135 SER QB 1 138 GLU H 5.500 . 5.500 5.490 5.388 5.605 0.105 10 0 "[ . 1 ]" 1
1308 1 136 ASP HA 1 136 ASP QB 3.300 . 3.300 2.466 2.411 2.501 . 0 0 "[ . 1 ]" 1
1309 1 136 ASP HA 1 137 GLN H 3.300 . 3.300 3.455 3.383 3.474 0.174 12 0 "[ . 1 ]" 1
1310 1 136 ASP QB 1 137 GLN H 2.800 . 2.800 2.072 1.881 2.970 0.170 3 0 "[ . 1 ]" 1
1311 1 136 ASP QB 1 138 GLU H 5.500 . 5.500 3.694 2.780 3.957 . 0 0 "[ . 1 ]" 1
1312 1 136 ASP H 1 138 GLU H 3.800 . 3.800 3.696 3.465 3.806 0.006 9 0 "[ . 1 ]" 1
1313 1 137 GLN H 1 137 GLN QB 4.200 . 4.200 3.203 2.797 3.532 . 0 0 "[ . 1 ]" 1
1314 1 137 GLN H 1 138 GLU H 2.800 . 2.800 2.530 2.208 2.686 . 0 0 "[ . 1 ]" 1
1315 1 138 GLU HA 1 138 GLU QG 5.500 . 5.500 2.801 2.171 3.078 . 0 0 "[ . 1 ]" 1
1316 1 138 GLU H 1 138 GLU QG 2.800 . 2.800 2.256 1.887 2.806 0.013 6 0 "[ . 1 ]" 1
1317 1 138 GLU HA 1 139 THR MG 4.200 . 4.200 4.190 4.087 4.215 0.015 2 0 "[ . 1 ]" 1
1318 1 138 GLU HA 1 139 THR H 2.800 . 2.800 2.189 2.177 2.199 . 0 0 "[ . 1 ]" 1
1319 1 138 GLU H 1 139 THR H 5.500 . 5.500 4.402 4.351 4.541 . 0 0 "[ . 1 ]" 1
1320 1 138 GLU HA 1 140 VAL H 3.300 . 3.300 3.347 3.328 3.383 0.083 3 0 "[ . 1 ]" 1
1321 1 139 THR H 1 139 THR MG 3.300 . 3.300 2.676 2.637 2.697 . 0 0 "[ . 1 ]" 1
1322 1 139 THR H 1 140 VAL H 2.800 . 2.800 2.394 2.350 2.488 . 0 0 "[ . 1 ]" 1
1323 1 140 VAL H 1 140 VAL MG1 3.800 . 3.800 3.804 3.791 3.819 0.019 3 0 "[ . 1 ]" 1
1324 1 140 VAL HA 1 141 ILE H 2.800 . 2.800 2.222 2.202 2.247 . 0 0 "[ . 1 ]" 1
1325 1 140 VAL HB 1 141 ILE H 5.500 . 5.500 4.258 4.184 4.327 . 0 0 "[ . 1 ]" 1
1326 1 140 VAL MG2 1 141 ILE H 3.800 . 3.800 3.819 3.800 3.829 0.029 9 0 "[ . 1 ]" 1
1327 1 140 VAL MG1 1 141 ILE H 3.300 . 3.300 2.563 2.448 2.670 . 0 0 "[ . 1 ]" 1
1328 1 140 VAL H 1 141 ILE MG 5.500 . 5.500 3.520 3.430 3.571 . 0 0 "[ . 1 ]" 1
1329 1 141 ILE HB 1 141 ILE MD 3.300 . 3.300 1.996 1.930 2.071 . 0 0 "[ . 1 ]" 1
1330 1 141 ILE H 1 141 ILE MD 5.500 . 5.500 3.590 3.563 3.621 . 0 0 "[ . 1 ]" 1
1331 1 141 ILE MD 1 141 ILE MG 2.800 . 2.800 2.797 2.754 2.826 0.026 7 0 "[ . 1 ]" 1
1332 1 141 ILE H 1 141 ILE QG 5.500 . 5.500 1.884 1.876 1.896 0.024 2 0 "[ . 1 ]" 1
1333 1 141 ILE H 1 141 ILE MG 3.800 . 3.800 3.283 3.236 3.343 . 0 0 "[ . 1 ]" 1
1334 1 141 ILE HA 1 142 ARG H 3.300 . 3.300 2.488 2.466 2.500 . 0 0 "[ . 1 ]" 1
1335 1 141 ILE HB 1 142 ARG H 2.800 . 2.800 2.253 2.227 2.280 . 0 0 "[ . 1 ]" 1
1336 1 141 ILE MD 1 142 ARG H 3.300 . 3.300 3.325 3.318 3.333 0.033 7 0 "[ . 1 ]" 1
1337 1 141 ILE MG 1 142 ARG H 3.300 . 3.300 3.359 3.333 3.371 0.071 6 0 "[ . 1 ]" 1
1338 1 142 ARG HA 1 142 ARG QB 3.800 . 3.800 2.201 2.198 2.207 . 0 0 "[ . 1 ]" 1
1339 1 142 ARG HA 1 142 ARG QG 4.200 . 4.200 3.295 3.288 3.319 . 0 0 "[ . 1 ]" 1
1340 1 142 ARG H 1 142 ARG QB 5.500 . 5.500 3.059 3.026 3.133 . 0 0 "[ . 1 ]" 1
1341 1 142 ARG HE 1 142 ARG QG 5.500 . 5.500 2.539 2.240 3.314 . 0 0 "[ . 1 ]" 1
1342 1 142 ARG H 1 142 ARG QG 3.300 . 3.300 2.227 2.067 2.313 . 0 0 "[ . 1 ]" 1
1343 1 142 ARG HA 1 143 ALA MB 5.500 . 5.500 4.021 3.999 4.053 . 0 0 "[ . 1 ]" 1
1344 1 142 ARG HA 1 143 ALA H 2.800 . 2.800 2.222 2.213 2.240 . 0 0 "[ . 1 ]" 1
1345 1 142 ARG QB 1 143 ALA H 3.800 . 3.800 3.198 3.179 3.211 . 0 0 "[ . 1 ]" 1
1346 1 143 ALA H 1 143 ALA MB 2.800 . 2.800 2.314 2.236 2.345 . 0 0 "[ . 1 ]" 1
1347 1 143 ALA HA 1 144 PRO QD 4.200 . 4.200 1.891 1.878 1.897 0.022 5 0 "[ . 1 ]" 1
1348 1 144 PRO HA 1 145 ILE H 2.800 . 2.800 2.210 2.188 2.222 . 0 0 "[ . 1 ]" 1
1349 1 144 PRO QB 1 145 ILE H 4.200 . 4.200 3.601 3.576 3.620 . 0 0 "[ . 1 ]" 1
1350 1 145 ILE H 1 145 ILE HB 2.800 . 2.800 2.780 2.521 2.878 0.078 7 0 "[ . 1 ]" 1
1351 1 145 ILE MD 1 145 ILE MG 2.800 . 2.800 2.125 1.865 2.811 0.035 8 0 "[ . 1 ]" 1
1352 1 145 ILE H 1 145 ILE MD 5.500 . 5.500 2.883 2.372 3.672 . 0 0 "[ . 1 ]" 1
1353 1 145 ILE QG 1 145 ILE MG 3.800 . 3.800 2.186 2.026 2.366 . 0 0 "[ . 1 ]" 1
1354 1 145 ILE H 1 145 ILE QG 5.500 . 5.500 2.106 1.844 3.157 0.056 5 0 "[ . 1 ]" 1
1355 1 145 ILE H 1 145 ILE MG 4.200 . 4.200 3.806 3.784 3.835 . 0 0 "[ . 1 ]" 1
1356 1 145 ILE HB 1 146 HIS H 5.500 . 5.500 3.964 3.782 4.474 . 0 0 "[ . 1 ]" 1
1357 1 145 ILE MG 1 146 HIS HE1 5.500 . 5.500 5.538 5.503 5.610 0.110 9 0 "[ . 1 ]" 1
1358 1 145 ILE MG 1 146 HIS H 3.300 . 3.300 2.838 2.597 3.171 . 0 0 "[ . 1 ]" 1
1359 1 145 ILE MG 1 157 ILE MG 5.500 . 5.500 5.320 5.112 5.466 . 0 0 "[ . 1 ]" 1
1360 1 145 ILE MG 1 159 ILE MD 4.200 . 4.200 2.982 2.706 3.292 . 0 0 "[ . 1 ]" 1
1361 1 145 ILE MG 1 159 ILE MG 3.300 . 3.300 2.885 2.666 3.123 . 0 0 "[ . 1 ]" 1
1362 1 145 ILE MG 1 162 LEU MD2 5.500 . 5.500 3.824 3.506 4.146 . 0 0 "[ . 1 ]" 1
1363 1 146 HIS H 1 146 HIS QB 3.300 . 3.300 2.666 2.545 3.159 . 0 0 "[ . 1 ]" 1
1364 1 146 HIS HA 1 147 PHE H 2.800 . 2.800 2.283 2.216 2.331 . 0 0 "[ . 1 ]" 1
1365 1 146 HIS QB 1 147 PHE H 5.500 . 5.500 2.565 2.450 2.716 . 0 0 "[ . 1 ]" 1
1366 1 146 HIS HD2 1 147 PHE H 5.500 . 5.500 4.892 4.812 5.125 . 0 0 "[ . 1 ]" 1
1367 1 146 HIS H 1 147 PHE H 5.500 . 5.500 4.575 4.514 4.621 . 0 0 "[ . 1 ]" 1
1368 1 146 HIS QB 1 148 GLY H 5.500 . 5.500 5.574 5.537 5.604 0.104 11 0 "[ . 1 ]" 1
1369 1 147 PHE HA 1 147 PHE QB 3.800 . 3.800 2.398 2.238 2.500 . 0 0 "[ . 1 ]" 1
1370 1 147 PHE HA 1 147 PHE QD 3.800 . 3.800 2.948 2.739 3.285 . 0 0 "[ . 1 ]" 1
1371 1 147 PHE H 1 147 PHE QB 3.800 . 3.800 2.858 2.735 3.002 . 0 0 "[ . 1 ]" 1
1372 1 147 PHE HA 1 148 GLY H 5.500 . 5.500 2.435 2.367 2.757 . 0 0 "[ . 1 ]" 1
1373 1 147 PHE HA 1 149 TYR QD 4.200 . 4.200 3.723 2.939 4.116 . 0 0 "[ . 1 ]" 1
1374 1 147 PHE HA 1 152 ASN QD 5.500 . 5.500 2.857 2.440 3.659 . 0 0 "[ . 1 ]" 1
1375 1 148 GLY H 1 148 GLY QA 2.800 . 2.800 2.372 2.347 2.441 . 0 0 "[ . 1 ]" 1
1376 1 148 GLY QA 1 149 TYR H 3.800 . 3.800 2.687 2.611 2.797 . 0 0 "[ . 1 ]" 1
1377 1 148 GLY H 1 149 TYR H 5.500 . 5.500 2.133 1.878 2.303 0.022 9 0 "[ . 1 ]" 1
1378 1 149 TYR HA 1 149 TYR QB 3.800 . 3.800 2.358 2.304 2.397 . 0 0 "[ . 1 ]" 1
1379 1 149 TYR HA 1 149 TYR QD 3.800 . 3.800 2.117 1.892 2.815 0.008 11 0 "[ . 1 ]" 1
1380 1 149 TYR H 1 149 TYR QB 2.800 . 2.800 2.607 2.542 2.706 . 0 0 "[ . 1 ]" 1
1381 1 149 TYR H 1 149 TYR QD 5.500 . 5.500 3.404 2.649 3.652 . 0 0 "[ . 1 ]" 1
1382 1 149 TYR HA 1 150 ALA MB 3.800 . 3.800 3.991 3.969 4.008 0.208 4 0 "[ . 1 ]" 1
1383 1 149 TYR HA 1 150 ALA H 3.300 . 3.300 2.341 2.306 2.380 . 0 0 "[ . 1 ]" 1
1384 1 149 TYR QB 1 150 ALA H 4.200 . 4.200 2.551 2.461 2.667 . 0 0 "[ . 1 ]" 1
1385 1 149 TYR HA 1 151 ALA H 5.500 . 5.500 4.073 4.005 4.121 . 0 0 "[ . 1 ]" 1
1386 1 149 TYR QB 1 151 ALA MB 5.500 . 5.500 2.965 2.836 3.128 . 0 0 "[ . 1 ]" 1
1387 1 149 TYR QB 1 152 ASN QD 5.500 . 5.500 3.401 2.104 4.835 . 0 0 "[ . 1 ]" 1
1388 1 149 TYR QB 1 152 ASN H 3.800 . 3.800 2.887 2.759 3.072 . 0 0 "[ . 1 ]" 1
1389 1 149 TYR QD 1 152 ASN QD 5.500 . 5.500 3.049 1.880 4.568 0.020 4 0 "[ . 1 ]" 1
1390 1 149 TYR H 1 152 ASN QD 4.200 . 4.200 3.211 2.253 4.207 0.007 6 0 "[ . 1 ]" 1
1391 1 150 ALA H 1 150 ALA MB 2.800 . 2.800 2.016 1.991 2.031 . 0 0 "[ . 1 ]" 1
1392 1 150 ALA HA 1 151 ALA H 5.500 . 5.500 3.496 3.483 3.509 . 0 0 "[ . 1 ]" 1
1393 1 150 ALA MB 1 151 ALA H 2.800 . 2.800 2.829 2.804 2.855 0.055 9 0 "[ . 1 ]" 1
1394 1 150 ALA H 1 151 ALA H 5.500 . 5.500 2.565 2.548 2.588 . 0 0 "[ . 1 ]" 1
1395 1 150 ALA HA 1 152 ASN H 5.500 . 5.500 3.623 3.476 3.748 . 0 0 "[ . 1 ]" 1
1396 1 150 ALA MB 1 152 ASN H 5.500 . 5.500 4.224 4.170 4.306 . 0 0 "[ . 1 ]" 1
1397 1 150 ALA HA 1 153 VAL MG2 2.800 . 2.800 2.174 2.005 2.433 . 0 0 "[ . 1 ]" 1
1398 1 150 ALA HA 1 153 VAL H 5.500 . 5.500 3.344 3.200 3.568 . 0 0 "[ . 1 ]" 1
1399 1 150 ALA MB 1 153 VAL H 5.500 . 5.500 4.355 4.256 4.495 . 0 0 "[ . 1 ]" 1
1400 1 151 ALA H 1 151 ALA MB 2.800 . 2.800 2.177 2.041 2.253 . 0 0 "[ . 1 ]" 1
1401 1 151 ALA HA 1 152 ASN H 4.200 . 4.200 3.390 3.354 3.441 . 0 0 "[ . 1 ]" 1
1402 1 151 ALA MB 1 152 ASN H 3.300 . 3.300 3.056 2.968 3.141 . 0 0 "[ . 1 ]" 1
1403 1 151 ALA H 1 152 ASN H 3.300 . 3.300 2.515 2.451 2.582 . 0 0 "[ . 1 ]" 1
1404 1 151 ALA MB 1 153 VAL H 4.200 . 4.200 4.375 4.332 4.420 0.220 6 0 "[ . 1 ]" 1
1405 1 152 ASN QB 1 152 ASN QD 3.800 . 3.800 2.284 2.270 2.309 . 0 0 "[ . 1 ]" 1
1406 1 152 ASN H 1 152 ASN QB 2.800 . 2.800 2.595 2.341 2.829 0.029 8 0 "[ . 1 ]" 1
1407 1 152 ASN H 1 152 ASN QD 5.500 . 5.500 4.320 3.635 4.930 . 0 0 "[ . 1 ]" 1
1408 1 152 ASN QB 1 153 VAL H 5.500 . 5.500 3.572 3.530 3.622 . 0 0 "[ . 1 ]" 1
1409 1 152 ASN H 1 153 VAL H 2.800 . 2.800 2.228 2.110 2.281 . 0 0 "[ . 1 ]" 1
1410 1 152 ASN H 1 153 VAL MG2 3.800 . 3.800 3.588 3.499 3.672 . 0 0 "[ . 1 ]" 1
1411 1 152 ASN QB 1 157 ILE MD 3.800 . 3.800 2.250 1.884 2.755 0.016 8 0 "[ . 1 ]" 1
1412 1 152 ASN QD 1 157 ILE MD 4.200 . 4.200 2.507 1.857 3.304 0.043 10 0 "[ . 1 ]" 1
1413 1 153 VAL HA 1 153 VAL MG1 2.800 . 2.800 2.662 2.640 2.678 . 0 0 "[ . 1 ]" 1
1414 1 153 VAL HA 1 153 VAL MG2 2.800 . 2.800 2.193 2.131 2.210 . 0 0 "[ . 1 ]" 1
1415 1 153 VAL H 1 153 VAL HB 2.800 . 2.800 2.145 2.127 2.165 . 0 0 "[ . 1 ]" 1
1416 1 153 VAL H 1 153 VAL MG1 3.300 . 3.300 3.551 3.540 3.565 0.265 4 0 "[ . 1 ]" 1
1417 1 153 VAL H 1 153 VAL MG2 2.800 . 2.800 2.853 2.830 2.869 0.069 1 0 "[ . 1 ]" 1
1418 1 153 VAL HA 1 154 GLY QA 5.500 . 5.500 4.111 4.097 4.122 . 0 0 "[ . 1 ]" 1
1419 1 153 VAL HA 1 154 GLY H 2.800 . 2.800 2.411 2.380 2.432 . 0 0 "[ . 1 ]" 1
1420 1 153 VAL HB 1 154 GLY H 5.500 . 5.500 3.968 3.926 4.020 . 0 0 "[ . 1 ]" 1
1421 1 153 VAL MG1 1 154 GLY H 2.800 . 2.800 1.923 1.887 2.028 0.013 1 0 "[ . 1 ]" 1
1422 1 153 VAL MG2 1 154 GLY H 3.800 . 3.800 3.315 3.281 3.381 . 0 0 "[ . 1 ]" 1
1423 1 153 VAL H 1 154 GLY H 5.500 . 5.500 4.612 4.598 4.624 . 0 0 "[ . 1 ]" 1
1424 1 153 VAL HA 1 155 ASN H 5.500 . 5.500 3.418 3.280 3.516 . 0 0 "[ . 1 ]" 1
1425 1 153 VAL MG1 1 155 ASN H 4.200 . 4.200 4.132 4.036 4.211 0.011 9 0 "[ . 1 ]" 1
1426 1 154 GLY QA 1 155 ASN H 5.500 . 5.500 2.803 2.769 2.857 . 0 0 "[ . 1 ]" 1
1427 1 154 GLY H 1 155 ASN H 2.800 . 2.800 2.805 2.750 2.820 0.020 9 0 "[ . 1 ]" 1
1428 1 155 ASN H 1 155 ASN QB 2.800 . 2.800 2.798 2.787 2.822 0.022 7 0 "[ . 1 ]" 1
1429 1 155 ASN H 1 155 ASN QD 5.500 . 5.500 5.113 4.992 5.167 . 0 0 "[ . 1 ]" 1
1430 1 155 ASN H 1 157 ILE MD 5.500 . 5.500 4.923 4.835 5.055 . 0 0 "[ . 1 ]" 1
1431 1 156 THR H 1 156 THR HB 2.800 . 2.800 2.458 2.412 2.547 . 0 0 "[ . 1 ]" 1
1432 1 156 THR HA 1 157 ILE H 2.800 . 2.800 2.223 2.215 2.232 . 0 0 "[ . 1 ]" 1
1433 1 156 THR HB 1 157 ILE H 5.500 . 5.500 4.307 4.175 4.349 . 0 0 "[ . 1 ]" 1
1434 1 156 THR MG 1 157 ILE H 2.800 . 2.800 2.747 2.606 2.801 0.001 11 0 "[ . 1 ]" 1
1435 1 156 THR HB 1 158 TYR QE 5.500 . 5.500 2.183 1.893 2.447 0.007 7 0 "[ . 1 ]" 1
1436 1 156 THR MG 1 158 TYR QD 5.500 . 5.500 3.074 2.895 3.306 . 0 0 "[ . 1 ]" 1
1437 1 156 THR MG 1 158 TYR QE 3.800 . 3.800 2.216 1.937 2.543 . 0 0 "[ . 1 ]" 1
1438 1 157 ILE H 1 157 ILE HB 2.800 . 2.800 2.808 2.782 2.829 0.029 1 0 "[ . 1 ]" 1
1439 1 157 ILE H 1 157 ILE MD 2.800 . 2.800 2.582 2.258 2.809 0.009 11 0 "[ . 1 ]" 1
1440 1 157 ILE H 1 157 ILE QG 3.300 . 3.300 2.216 2.123 2.334 . 0 0 "[ . 1 ]" 1
1441 1 157 ILE HA 1 158 TYR H 2.800 . 2.800 2.178 2.170 2.183 . 0 0 "[ . 1 ]" 1
1442 1 157 ILE HB 1 158 TYR H 5.500 . 5.500 4.112 4.081 4.140 . 0 0 "[ . 1 ]" 1
1443 1 157 ILE MD 1 158 TYR H 5.500 . 5.500 5.303 5.239 5.349 . 0 0 "[ . 1 ]" 1
1444 1 157 ILE MG 1 158 TYR H 2.800 . 2.800 2.774 2.730 2.800 0.000 7 0 "[ . 1 ]" 1
1445 1 157 ILE H 1 158 TYR H 5.500 . 5.500 4.390 4.358 4.412 . 0 0 "[ . 1 ]" 1
1446 1 158 TYR HA 1 158 TYR QD 5.500 . 5.500 3.180 3.139 3.220 . 0 0 "[ . 1 ]" 1
1447 1 158 TYR H 1 158 TYR HB2 3.300 . 3.300 2.546 2.482 2.630 . 0 0 "[ . 1 ]" 1
1448 1 158 TYR H 1 158 TYR HB3 3.800 . 3.800 3.707 3.683 3.738 . 0 0 "[ . 1 ]" 1
1449 1 158 TYR H 1 158 TYR QD 4.200 . 4.200 1.869 1.855 1.894 0.045 7 0 "[ . 1 ]" 1
1450 1 158 TYR HA 1 159 ILE H 2.800 . 2.800 2.266 2.225 2.313 . 0 0 "[ . 1 ]" 1
1451 1 158 TYR HB3 1 159 ILE H 3.800 . 3.800 3.182 3.014 3.351 . 0 0 "[ . 1 ]" 1
1452 1 159 ILE HA 1 159 ILE MG 2.800 . 2.800 2.018 1.990 2.043 . 0 0 "[ . 1 ]" 1
1453 1 159 ILE HB 1 159 ILE MD 3.300 . 3.300 2.291 2.203 2.380 . 0 0 "[ . 1 ]" 1
1454 1 159 ILE H 1 159 ILE HB 3.800 . 3.800 3.049 2.987 3.117 . 0 0 "[ . 1 ]" 1
1455 1 159 ILE H 1 159 ILE MD 4.200 . 4.200 3.792 3.625 3.926 . 0 0 "[ . 1 ]" 1
1456 1 159 ILE H 1 159 ILE QG 3.300 . 3.300 2.167 2.033 2.306 . 0 0 "[ . 1 ]" 1
1457 1 159 ILE H 1 159 ILE MG 3.800 . 3.800 3.911 3.873 3.954 0.154 9 0 "[ . 1 ]" 1
1458 1 159 ILE HA 1 160 ASP H 2.800 . 2.800 2.236 2.206 2.261 . 0 0 "[ . 1 ]" 1
1459 1 159 ILE HB 1 160 ASP H 3.800 . 3.800 3.683 3.626 3.751 . 0 0 "[ . 1 ]" 1
1460 1 159 ILE MD 1 160 ASP H 5.500 . 5.500 5.061 5.006 5.113 . 0 0 "[ . 1 ]" 1
1461 1 159 ILE MG 1 160 ASP HA 5.500 . 5.500 3.961 3.923 3.986 . 0 0 "[ . 1 ]" 1
1462 1 159 ILE MG 1 160 ASP H 3.300 . 3.300 2.599 2.543 2.671 . 0 0 "[ . 1 ]" 1
1463 1 160 ASP HA 1 160 ASP QB 4.200 . 4.200 2.315 2.294 2.362 . 0 0 "[ . 1 ]" 1
1464 1 160 ASP H 1 160 ASP QB 3.300 . 3.300 2.920 2.905 2.931 . 0 0 "[ . 1 ]" 1
1465 1 160 ASP HA 1 161 GLY QA 5.500 . 5.500 3.997 3.991 4.001 . 0 0 "[ . 1 ]" 1
1466 1 160 ASP HA 1 161 GLY H 3.300 . 3.300 2.239 2.231 2.249 . 0 0 "[ . 1 ]" 1
1467 1 160 ASP QB 1 161 GLY H 5.500 . 5.500 3.704 3.697 3.717 . 0 0 "[ . 1 ]" 1
1468 1 160 ASP HA 1 162 LEU H 5.500 . 5.500 3.438 3.389 3.513 . 0 0 "[ . 1 ]" 1
1469 1 161 GLY QA 1 162 LEU H 4.200 . 4.200 2.964 2.955 2.986 . 0 0 "[ . 1 ]" 1
1470 1 161 GLY H 1 162 LEU H 3.800 . 3.800 2.119 1.984 2.246 . 0 0 "[ . 1 ]" 1
1471 1 162 LEU HA 1 162 LEU MD1 3.300 . 3.300 1.874 1.854 1.899 0.046 10 0 "[ . 1 ]" 1
1472 1 162 LEU H 1 162 LEU QB 2.800 . 2.800 2.266 2.224 2.292 . 0 0 "[ . 1 ]" 1
1473 1 162 LEU QB 1 162 LEU MD1 5.500 . 5.500 2.463 2.377 2.575 . 0 0 "[ . 1 ]" 1
1474 1 162 LEU QB 1 162 LEU MD2 3.800 . 3.800 2.064 2.025 2.081 . 0 0 "[ . 1 ]" 1
1475 1 162 LEU H 1 162 LEU MD1 4.200 . 4.200 3.972 3.850 4.069 . 0 0 "[ . 1 ]" 1
1476 1 162 LEU H 1 162 LEU MD2 4.200 . 4.200 4.207 3.819 4.271 0.071 8 0 "[ . 1 ]" 1
1477 1 162 LEU HA 1 163 ALA H 2.800 . 2.800 2.231 2.186 2.267 . 0 0 "[ . 1 ]" 1
1478 1 162 LEU QB 1 163 ALA H 4.200 . 4.200 3.985 3.919 4.022 . 0 0 "[ . 1 ]" 1
1479 1 162 LEU MD1 1 163 ALA H 2.800 . 2.800 2.462 2.215 2.764 . 0 0 "[ . 1 ]" 1
1480 1 162 LEU MD2 1 163 ALA H 5.500 . 5.500 4.888 4.104 5.090 . 0 0 "[ . 1 ]" 1
1481 1 162 LEU H 1 163 ALA H 5.500 . 5.500 4.278 4.168 4.419 . 0 0 "[ . 1 ]" 1
1482 1 162 LEU MD1 1 164 ILE H 5.500 . 5.500 4.790 4.094 5.281 . 0 0 "[ . 1 ]" 1
1483 1 163 ALA H 1 163 ALA MB 2.800 . 2.800 2.512 2.395 2.564 . 0 0 "[ . 1 ]" 1
1484 1 163 ALA MB 1 164 ILE H 2.800 . 2.800 2.813 2.806 2.822 0.022 10 0 "[ . 1 ]" 1
1485 1 164 ILE HA 1 164 ILE MG 3.300 . 3.300 2.314 2.063 2.468 . 0 0 "[ . 1 ]" 1
1486 1 164 ILE H 1 164 ILE HB 2.800 . 2.800 2.710 2.609 2.865 0.065 10 0 "[ . 1 ]" 1
1487 1 164 ILE HA 1 165 ALA MB 5.500 . 5.500 4.062 3.961 4.141 . 0 0 "[ . 1 ]" 1
1488 1 164 ILE HA 1 165 ALA H 2.800 . 2.800 2.210 2.199 2.219 . 0 0 "[ . 1 ]" 1
1489 1 164 ILE HB 1 165 ALA H 5.500 . 5.500 4.330 4.177 4.453 . 0 0 "[ . 1 ]" 1
1490 1 164 ILE MG 1 165 ALA HA 5.500 . 5.500 3.647 3.253 4.183 . 0 0 "[ . 1 ]" 1
1491 1 164 ILE MG 1 165 ALA H 3.300 . 3.300 2.870 2.443 3.166 . 0 0 "[ . 1 ]" 1
1492 1 164 ILE MG 1 165 ALA MB 5.500 . 5.500 4.288 4.020 4.615 . 0 0 "[ . 1 ]" 1
1493 1 164 ILE H 1 165 ALA MB 5.500 . 5.500 4.175 3.908 4.490 . 0 0 "[ . 1 ]" 1
1494 1 164 ILE H 1 165 ALA H 5.500 . 5.500 4.176 4.072 4.371 . 0 0 "[ . 1 ]" 1
1495 1 165 ALA H 1 165 ALA MB 2.800 . 2.800 2.638 2.356 2.785 . 0 0 "[ . 1 ]" 1
1496 1 165 ALA HA 1 166 SER H 2.800 . 2.800 2.326 2.263 2.510 . 0 0 "[ . 1 ]" 1
1497 1 165 ALA MB 1 166 SER H 2.800 . 2.800 2.742 2.291 2.833 0.033 2 0 "[ . 1 ]" 1
1498 1 166 SER HA 1 166 SER QB 3.300 . 3.300 2.227 2.180 2.431 . 0 0 "[ . 1 ]" 1
1499 1 166 SER H 1 166 SER QB 3.300 . 3.300 2.591 2.202 2.994 . 0 0 "[ . 1 ]" 1
1500 1 42 PHE QE 1 59 VAL MG2 5.500 . 5.500 3.581 2.757 4.377 . 0 0 "[ . 1 ]" 1
1501 1 42 PHE QE 1 57 LEU MD2 5.500 . 5.500 4.675 3.627 5.505 0.005 12 0 "[ . 1 ]" 1
1502 1 30 LEU MD1 1 42 PHE QE 5.500 . 5.500 3.442 2.939 4.208 . 0 0 "[ . 1 ]" 1
1503 1 21 LEU MD1 1 42 PHE QE 5.500 . 5.500 3.965 3.113 5.252 . 0 0 "[ . 1 ]" 1
1504 1 42 PHE QE 1 71 ILE MG 5.500 . 5.500 2.099 1.885 2.750 0.015 2 0 "[ . 1 ]" 1
1505 1 21 LEU MD2 1 42 PHE QE 5.500 . 5.500 3.556 2.132 4.532 . 0 0 "[ . 1 ]" 1
1506 1 32 VAL MG2 1 42 PHE QE 5.500 . 5.500 3.051 2.497 3.760 . 0 0 "[ . 1 ]" 1
1507 1 110 PHE QD 1 142 ARG HD3 5.500 . 5.500 5.540 5.524 5.585 0.085 8 0 "[ . 1 ]" 1
1508 1 110 PHE QD 1 111 GLN H 5.500 . 5.500 4.300 4.238 4.396 . 0 0 "[ . 1 ]" 1
1509 1 108 GLN HA 1 110 PHE QE 5.500 . 5.500 4.284 3.696 4.876 . 0 0 "[ . 1 ]" 1
1510 1 109 SER HA 1 110 PHE QE 5.500 . 5.500 4.493 4.019 5.279 . 0 0 "[ . 1 ]" 1
1511 1 69 TRP HD1 1 70 ASP H 5.500 . 5.500 4.448 4.278 4.597 . 0 0 "[ . 1 ]" 1
1512 1 11 GLU CD 1 160 ASP CG 6.000 2.400 6.000 5.730 4.424 6.010 0.010 10 0 "[ . 1 ]" 1
1513 1 28 TRP HZ2 1 73 ALA MB 5.500 . 5.500 4.301 3.724 4.780 . 0 0 "[ . 1 ]" 1
1514 1 28 TRP HZ2 1 162 LEU QB 5.500 . 5.500 2.762 2.600 2.929 . 0 0 "[ . 1 ]" 1
1515 1 28 TRP HZ2 1 101 VAL MG1 5.500 . 5.500 5.612 5.572 5.665 0.165 12 0 "[ . 1 ]" 1
1516 1 28 TRP HZ2 1 162 LEU MD2 5.500 . 5.500 2.672 2.422 2.977 . 0 0 "[ . 1 ]" 1
1517 1 68 PRO HD3 1 69 TRP HE3 5.500 . 5.500 4.962 4.563 5.155 . 0 0 "[ . 1 ]" 1
1518 1 69 TRP HA 1 69 TRP HE3 5.500 . 5.500 4.383 4.228 4.468 . 0 0 "[ . 1 ]" 1
1519 1 69 TRP H 1 69 TRP HE3 4.200 . 4.200 4.117 3.917 4.209 0.009 1 0 "[ . 1 ]" 1
1520 1 69 TRP HA 1 69 TRP HD1 5.500 . 5.500 4.248 4.182 4.335 . 0 0 "[ . 1 ]" 1
1521 1 68 PRO HG2 1 69 TRP HE3 5.500 . 5.500 2.491 2.211 2.724 . 0 0 "[ . 1 ]" 1
stop_
save_
save_distance_constraint_statistics_2
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 2
_Distance_constraint_stats_list.Constraint_count 11
_Distance_constraint_stats_list.Viol_count 41
_Distance_constraint_stats_list.Viol_total 69.240
_Distance_constraint_stats_list.Viol_max 0.399
_Distance_constraint_stats_list.Viol_rms 0.1129
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0437
_Distance_constraint_stats_list.Viol_average_violations_only 0.1407
_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 ILE 0.000 0.000 . 0 "[ . 1 ]"
1 7 ASN 0.463 0.063 5 0 "[ . 1 ]"
1 10 PHE 0.000 0.000 . 0 "[ . 1 ]"
1 11 GLU 0.463 0.063 5 0 "[ . 1 ]"
1 13 THR 0.485 0.072 1 0 "[ . 1 ]"
1 21 LEU 0.000 0.000 . 0 "[ . 1 ]"
1 25 VAL 0.485 0.072 1 0 "[ . 1 ]"
1 27 GLY 0.463 0.063 5 0 "[ . 1 ]"
1 32 VAL 0.000 0.000 . 0 "[ . 1 ]"
1 36 VAL 0.000 0.000 . 0 "[ . 1 ]"
1 41 VAL 0.000 0.000 . 0 "[ . 1 ]"
1 44 VAL 0.485 0.072 1 0 "[ . 1 ]"
1 57 LEU 0.000 0.000 . 0 "[ . 1 ]"
1 59 VAL 0.000 0.000 . 0 "[ . 1 ]"
1 64 VAL 0.000 0.000 . 0 "[ . 1 ]"
1 69 TRP 0.084 0.032 12 0 "[ . 1 ]"
1 71 ILE 0.084 0.032 12 0 "[ . 1 ]"
1 97 ASP 4.738 0.399 6 0 "[ . 1 ]"
1 101 VAL 0.000 0.000 . 0 "[ . 1 ]"
1 107 ASN 0.000 0.000 . 0 "[ . 1 ]"
1 113 TYR 0.000 0.000 . 0 "[ . 1 ]"
1 148 GLY 0.084 0.032 12 0 "[ . 1 ]"
1 152 ASN 0.000 0.000 . 0 "[ . 1 ]"
1 155 ASN 4.738 0.399 6 0 "[ . 1 ]"
1 157 ILE 0.000 0.000 . 0 "[ . 1 ]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 6 ILE MD 1 10 PHE H 5.500 . 5.500 4.990 4.189 5.313 . 0 0 "[ . 1 ]" 2
2 1 7 ASN H 1 11 GLU H 4.200 . 4.200 4.239 4.220 4.263 0.063 5 0 "[ . 1 ]" 2
3 1 13 THR H 1 25 VAL MG1 3.300 . 3.300 3.340 3.308 3.372 0.072 1 0 "[ . 1 ]" 2
4 1 21 LEU MD1 1 32 VAL H 5.500 . 5.500 3.354 3.315 3.377 . 0 0 "[ . 1 ]" 2
5 1 41 VAL H 1 59 VAL HA 5.500 . 5.500 4.011 3.772 4.242 . 0 0 "[ . 1 ]" 2
6 1 44 VAL QG 1 57 LEU H 5.500 . 5.500 4.333 4.131 4.541 . 0 0 "[ . 1 ]" 2
7 1 69 TRP HA 1 71 ILE H 3.300 . 3.300 3.229 2.911 3.332 0.032 12 0 "[ . 1 ]" 2
8 1 107 ASN HB3 1 107 ASN QD 2.800 . 2.800 2.220 2.073 2.784 . 0 0 "[ . 1 ]" 2
9 1 64 VAL MG2 1 152 ASN HD21 4.200 . 4.200 3.272 2.465 3.909 . 0 0 "[ . 1 ]" 2
10 1 97 ASP HB2 1 155 ASN HD21 2.800 . 2.800 2.287 2.223 2.312 . 0 0 "[ . 1 ]" 2
11 1 97 ASP HB2 1 155 ASN HD22 2.800 . 2.800 3.195 3.190 3.199 0.399 6 0 "[ . 1 ]" 2
stop_
save_
save_distance_constraint_statistics_3
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 3
_Distance_constraint_stats_list.Constraint_count 130
_Distance_constraint_stats_list.Viol_count 235
_Distance_constraint_stats_list.Viol_total 82.033
_Distance_constraint_stats_list.Viol_max 0.128
_Distance_constraint_stats_list.Viol_rms 0.0141
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0044
_Distance_constraint_stats_list.Viol_average_violations_only 0.0291
_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 4 ALA 0.013 0.006 8 0 "[ . 1 ]"
1 16 GLY 0.138 0.034 5 0 "[ . 1 ]"
1 18 VAL 0.000 0.000 . 0 "[ . 1 ]"
1 25 VAL 0.112 0.024 11 0 "[ . 1 ]"
1 27 GLY 0.000 0.000 . 0 "[ . 1 ]"
1 28 TRP 0.112 0.024 11 0 "[ . 1 ]"
1 29 ASP 0.012 0.007 5 0 "[ . 1 ]"
1 31 ASN 0.315 0.080 9 0 "[ . 1 ]"
1 33 GLY 0.275 0.039 12 0 "[ . 1 ]"
1 36 VAL 0.000 0.000 . 0 "[ . 1 ]"
1 41 VAL 0.453 0.048 8 0 "[ . 1 ]"
1 42 PHE 0.000 0.000 . 0 "[ . 1 ]"
1 43 GLU 0.161 0.052 10 0 "[ . 1 ]"
1 44 VAL 0.138 0.034 5 0 "[ . 1 ]"
1 45 LEU 0.008 0.005 2 0 "[ . 1 ]"
1 47 THR 0.070 0.022 11 0 "[ . 1 ]"
1 54 ASN 0.070 0.022 11 0 "[ . 1 ]"
1 56 VAL 0.008 0.005 2 0 "[ . 1 ]"
1 57 LEU 0.000 0.000 . 0 "[ . 1 ]"
1 58 ALA 0.161 0.052 10 0 "[ . 1 ]"
1 59 VAL 0.000 0.000 . 0 "[ . 1 ]"
1 60 THR 0.453 0.048 8 0 "[ . 1 ]"
1 61 VAL 0.391 0.039 5 0 "[ . 1 ]"
1 67 ASN 0.249 0.031 3 0 "[ . 1 ]"
1 69 TRP 0.249 0.031 3 0 "[ . 1 ]"
1 70 ASP 0.275 0.039 12 0 "[ . 1 ]"
1 71 ILE 0.023 0.023 9 0 "[ . 1 ]"
1 72 GLU 0.315 0.080 9 0 "[ . 1 ]"
1 73 ALA 0.000 0.000 . 0 "[ . 1 ]"
1 74 THR 0.012 0.007 5 0 "[ . 1 ]"
1 75 ALA 0.275 0.040 1 0 "[ . 1 ]"
1 76 PHE 0.000 0.000 . 0 "[ . 1 ]"
1 78 VAL 0.246 0.024 4 0 "[ . 1 ]"
1 79 ASN 0.010 0.006 8 0 "[ . 1 ]"
1 86 TYR 0.006 0.006 8 0 "[ . 1 ]"
1 87 THR 0.028 0.016 12 0 "[ . 1 ]"
1 88 TYR 0.000 0.000 . 0 "[ . 1 ]"
1 89 THR 0.000 0.000 . 0 "[ . 1 ]"
1 90 ILE 0.000 0.000 . 0 "[ . 1 ]"
1 91 TRP 0.000 0.000 . 0 "[ . 1 ]"
1 92 ALA 0.241 0.035 11 0 "[ . 1 ]"
1 93 ARG 0.000 0.000 . 0 "[ . 1 ]"
1 94 ALA 0.031 0.031 10 0 "[ . 1 ]"
1 95 GLU 0.000 0.000 . 0 "[ . 1 ]"
1 98 GLY 0.035 0.018 11 0 "[ . 1 ]"
1 100 VAL 1.118 0.103 6 0 "[ . 1 ]"
1 101 VAL 1.355 0.128 4 0 "[ . 1 ]"
1 102 SER 0.540 0.083 11 0 "[ . 1 ]"
1 103 PHE 0.028 0.011 1 0 "[ . 1 ]"
1 104 THR 0.249 0.065 8 0 "[ . 1 ]"
1 105 VAL 0.174 0.025 8 0 "[ . 1 ]"
1 106 GLY 0.059 0.023 7 0 "[ . 1 ]"
1 107 ASN 0.233 0.087 8 0 "[ . 1 ]"
1 111 GLN 0.233 0.087 8 0 "[ . 1 ]"
1 113 TYR 0.101 0.019 9 0 "[ . 1 ]"
1 114 GLY 0.073 0.025 8 0 "[ . 1 ]"
1 116 LEU 0.028 0.011 1 0 "[ . 1 ]"
1 118 GLU 0.619 0.091 11 0 "[ . 1 ]"
1 119 GLN 0.736 0.128 4 0 "[ . 1 ]"
1 121 ILE 0.035 0.018 11 0 "[ . 1 ]"
1 122 THR 0.031 0.031 10 0 "[ . 1 ]"
1 126 GLN 0.241 0.035 11 0 "[ . 1 ]"
1 128 PHE 0.000 0.000 . 0 "[ . 1 ]"
1 130 PHE 0.000 0.000 . 0 "[ . 1 ]"
1 132 PHE 0.006 0.006 8 0 "[ . 1 ]"
1 141 ILE 0.246 0.024 4 0 "[ . 1 ]"
1 142 ARG 0.059 0.023 7 0 "[ . 1 ]"
1 143 ALA 0.275 0.040 1 0 "[ . 1 ]"
1 144 PRO 0.249 0.065 8 0 "[ . 1 ]"
1 145 ILE 0.000 0.000 . 0 "[ . 1 ]"
1 146 HIS 0.540 0.083 11 0 "[ . 1 ]"
1 147 PHE 0.023 0.023 9 0 "[ . 1 ]"
1 151 ALA 1.118 0.103 6 0 "[ . 1 ]"
1 155 ASN 0.391 0.039 5 0 "[ . 1 ]"
1 156 THR 0.000 0.000 . 0 "[ . 1 ]"
1 157 ILE 0.000 0.000 . 0 "[ . 1 ]"
1 158 TYR 0.000 0.000 . 0 "[ . 1 ]"
1 159 ILE 0.000 0.000 . 0 "[ . 1 ]"
1 160 ASP 0.000 0.000 . 0 "[ . 1 ]"
1 163 ALA 0.000 0.000 . 0 "[ . 1 ]"
1 164 ILE 0.003 0.003 2 0 "[ . 1 ]"
1 165 ALA 0.028 0.016 12 0 "[ . 1 ]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 16 GLY H 1 44 VAL O 2.300 . 2.500 2.370 2.097 2.534 0.034 5 0 "[ . 1 ]" 3
2 1 16 GLY N 1 44 VAL O 3.300 2.500 3.500 3.340 3.066 3.502 0.002 3 0 "[ . 1 ]" 3
3 1 25 VAL O 1 28 TRP H 2.300 . 2.500 2.410 2.100 2.524 0.024 11 0 "[ . 1 ]" 3
4 1 25 VAL O 1 28 TRP N 3.300 2.500 3.500 3.236 2.931 3.458 . 0 0 "[ . 1 ]" 3
5 1 29 ASP H 1 74 THR O 2.300 . 2.500 2.041 2.021 2.052 . 0 0 "[ . 1 ]" 3
6 1 29 ASP N 1 74 THR O 3.300 2.500 3.500 2.900 2.793 2.971 . 0 0 "[ . 1 ]" 3
7 1 31 ASN H 1 72 GLU O 2.300 . 2.500 2.166 2.079 2.513 0.013 9 0 "[ . 1 ]" 3
8 1 31 ASN N 1 72 GLU O 3.300 2.500 3.500 3.003 2.880 3.427 . 0 0 "[ . 1 ]" 3
9 1 41 VAL H 1 60 THR O 2.300 . 2.500 2.538 2.529 2.548 0.048 8 0 "[ . 1 ]" 3
10 1 41 VAL N 1 60 THR O 3.300 2.500 3.500 3.356 3.292 3.424 . 0 0 "[ . 1 ]" 3
11 1 43 GLU H 1 58 ALA O 2.300 . 2.500 2.492 2.393 2.552 0.052 10 0 "[ . 1 ]" 3
12 1 43 GLU N 1 58 ALA O 3.300 2.500 3.500 3.340 3.236 3.399 . 0 0 "[ . 1 ]" 3
13 1 16 GLY O 1 44 VAL H 2.300 . 2.500 2.422 2.336 2.511 0.011 8 0 "[ . 1 ]" 3
14 1 16 GLY O 1 44 VAL N 3.300 2.500 3.500 3.395 3.310 3.491 . 0 0 "[ . 1 ]" 3
15 1 45 LEU H 1 56 VAL O 2.300 . 2.500 2.134 2.050 2.293 . 0 0 "[ . 1 ]" 3
16 1 45 LEU N 1 56 VAL O 3.300 2.500 3.500 3.055 2.923 3.224 . 0 0 "[ . 1 ]" 3
17 1 47 THR H 1 54 ASN O 2.300 . 2.500 2.461 2.094 2.522 0.022 11 0 "[ . 1 ]" 3
18 1 47 THR N 1 54 ASN O 3.300 2.500 3.500 3.163 2.608 3.322 . 0 0 "[ . 1 ]" 3
19 1 45 LEU O 1 56 VAL H 2.300 . 2.500 2.274 2.081 2.505 0.005 2 0 "[ . 1 ]" 3
20 1 45 LEU O 1 56 VAL N 3.300 2.500 3.500 3.147 2.907 3.408 . 0 0 "[ . 1 ]" 3
21 1 57 LEU H 1 159 ILE O 2.300 . 2.500 2.080 2.029 2.118 . 0 0 "[ . 1 ]" 3
22 1 57 LEU N 1 159 ILE O 3.300 2.500 3.500 3.050 2.968 3.089 . 0 0 "[ . 1 ]" 3
23 1 43 GLU O 1 58 ALA H 2.300 . 2.500 2.109 2.076 2.177 . 0 0 "[ . 1 ]" 3
24 1 43 GLU O 1 58 ALA N 3.300 2.500 3.500 2.806 2.724 2.904 . 0 0 "[ . 1 ]" 3
25 1 59 VAL H 1 157 ILE O 2.300 . 2.500 2.073 2.061 2.093 . 0 0 "[ . 1 ]" 3
26 1 59 VAL N 1 157 ILE O 3.300 2.500 3.500 2.945 2.910 2.981 . 0 0 "[ . 1 ]" 3
27 1 41 VAL O 1 60 THR H 2.300 . 2.500 2.303 2.176 2.437 . 0 0 "[ . 1 ]" 3
28 1 41 VAL O 1 60 THR N 3.300 2.500 3.500 3.167 3.067 3.262 . 0 0 "[ . 1 ]" 3
29 1 61 VAL H 1 155 ASN O 2.300 . 2.500 2.533 2.525 2.539 0.039 5 0 "[ . 1 ]" 3
30 1 61 VAL N 1 155 ASN O 3.300 2.500 3.500 3.341 3.289 3.377 . 0 0 "[ . 1 ]" 3
31 1 71 ILE H 1 147 PHE O 2.300 . 2.500 2.237 2.098 2.523 0.023 9 0 "[ . 1 ]" 3
32 1 71 ILE N 1 147 PHE O 3.300 2.500 3.500 2.957 2.800 3.305 . 0 0 "[ . 1 ]" 3
33 1 31 ASN O 1 72 GLU H 2.300 . 2.500 2.519 2.427 2.580 0.080 9 0 "[ . 1 ]" 3
34 1 31 ASN O 1 72 GLU N 3.300 2.500 3.500 3.289 2.893 3.428 . 0 0 "[ . 1 ]" 3
35 1 73 ALA H 1 145 ILE O 2.300 . 2.500 2.067 2.034 2.104 . 0 0 "[ . 1 ]" 3
36 1 73 ALA N 1 145 ILE O 3.300 2.500 3.500 2.875 2.546 2.992 . 0 0 "[ . 1 ]" 3
37 1 29 ASP O 1 74 THR H 2.300 . 2.500 2.181 2.058 2.507 0.007 5 0 "[ . 1 ]" 3
38 1 29 ASP O 1 74 THR N 3.300 2.500 3.500 3.016 2.829 3.229 . 0 0 "[ . 1 ]" 3
39 1 75 ALA H 1 143 ALA O 2.300 . 2.500 2.191 2.054 2.382 . 0 0 "[ . 1 ]" 3
40 1 75 ALA N 1 143 ALA O 3.300 2.500 3.500 3.071 2.904 3.296 . 0 0 "[ . 1 ]" 3
41 1 27 GLY O 1 76 PHE H 2.300 . 2.500 2.091 2.074 2.101 . 0 0 "[ . 1 ]" 3
42 1 27 GLY O 1 76 PHE N 3.300 2.500 3.500 2.973 2.899 3.016 . 0 0 "[ . 1 ]" 3
43 1 78 VAL H 1 141 ILE O 2.300 . 2.500 2.501 2.391 2.524 0.024 4 0 "[ . 1 ]" 3
44 1 78 VAL N 1 141 ILE O 3.300 2.500 3.500 3.037 2.929 3.124 . 0 0 "[ . 1 ]" 3
45 1 86 TYR H 1 132 PHE O 2.300 . 2.500 2.223 2.094 2.506 0.006 8 0 "[ . 1 ]" 3
46 1 86 TYR N 1 132 PHE O 3.300 2.500 3.500 3.133 2.979 3.383 . 0 0 "[ . 1 ]" 3
47 1 87 THR H 1 165 ALA O 2.300 . 2.500 2.093 2.085 2.104 . 0 0 "[ . 1 ]" 3
48 1 87 THR N 1 165 ALA O 3.300 2.500 3.500 2.870 2.717 3.017 . 0 0 "[ . 1 ]" 3
49 1 88 TYR H 1 130 PHE O 2.300 . 2.500 2.175 2.095 2.359 . 0 0 "[ . 1 ]" 3
50 1 88 TYR N 1 130 PHE O 3.300 2.500 3.500 3.102 3.036 3.311 . 0 0 "[ . 1 ]" 3
51 1 89 THR H 1 163 ALA O 2.300 . 2.500 2.286 2.111 2.443 . 0 0 "[ . 1 ]" 3
52 1 89 THR N 1 163 ALA O 3.300 2.500 3.500 3.211 3.053 3.342 . 0 0 "[ . 1 ]" 3
53 1 90 ILE H 1 128 PHE O 2.300 . 2.500 2.052 2.031 2.070 . 0 0 "[ . 1 ]" 3
54 1 90 ILE N 1 128 PHE O 3.300 2.500 3.500 2.914 2.879 2.945 . 0 0 "[ . 1 ]" 3
55 1 92 ALA H 1 126 GLN O 2.300 . 2.500 2.518 2.475 2.535 0.035 11 0 "[ . 1 ]" 3
56 1 92 ALA N 1 126 GLN O 3.300 2.500 3.500 3.420 3.383 3.448 . 0 0 "[ . 1 ]" 3
57 1 93 ARG H 1 158 TYR O 2.300 . 2.500 2.101 2.076 2.181 . 0 0 "[ . 1 ]" 3
58 1 93 ARG N 1 158 TYR O 3.300 2.500 3.500 3.048 2.997 3.150 . 0 0 "[ . 1 ]" 3
59 1 94 ALA H 1 122 THR O 2.300 . 2.500 2.384 2.296 2.531 0.031 10 0 "[ . 1 ]" 3
60 1 94 ALA N 1 122 THR O 3.300 2.500 3.500 3.330 3.256 3.427 . 0 0 "[ . 1 ]" 3
61 1 95 GLU H 1 156 THR O 2.300 . 2.500 2.082 2.063 2.098 . 0 0 "[ . 1 ]" 3
62 1 95 GLU N 1 156 THR O 3.300 2.500 3.500 2.970 2.912 2.996 . 0 0 "[ . 1 ]" 3
63 1 100 VAL H 1 151 ALA O 2.300 . 2.500 2.593 2.581 2.603 0.103 6 0 "[ . 1 ]" 3
64 1 100 VAL N 1 151 ALA O 3.300 2.500 3.500 3.274 3.206 3.306 . 0 0 "[ . 1 ]" 3
65 1 101 VAL H 1 119 GLN O 2.300 . 2.500 2.561 2.526 2.628 0.128 4 0 "[ . 1 ]" 3
66 1 101 VAL N 1 119 GLN O 3.300 2.500 3.500 3.451 3.428 3.478 . 0 0 "[ . 1 ]" 3
67 1 102 SER H 1 146 HIS O 2.300 . 2.500 2.539 2.469 2.583 0.083 11 0 "[ . 1 ]" 3
68 1 102 SER N 1 146 HIS O 3.300 2.500 3.500 3.455 3.215 3.511 0.011 4 0 "[ . 1 ]" 3
69 1 103 PHE H 1 116 LEU O 2.300 . 2.500 2.336 2.100 2.511 0.011 1 0 "[ . 1 ]" 3
70 1 103 PHE N 1 116 LEU O 3.300 2.500 3.500 3.281 3.009 3.492 . 0 0 "[ . 1 ]" 3
71 1 104 THR H 1 144 PRO O 2.300 . 2.500 2.475 2.147 2.565 0.065 8 0 "[ . 1 ]" 3
72 1 104 THR N 1 144 PRO O 3.300 2.500 3.500 3.381 3.072 3.466 . 0 0 "[ . 1 ]" 3
73 1 105 VAL H 1 114 GLY O 2.300 . 2.500 2.469 2.325 2.525 0.025 8 0 "[ . 1 ]" 3
74 1 105 VAL N 1 114 GLY O 3.300 2.500 3.500 3.402 3.236 3.492 . 0 0 "[ . 1 ]" 3
75 1 106 GLY H 1 142 ARG O 2.300 . 2.500 2.299 2.065 2.523 0.023 7 0 "[ . 1 ]" 3
76 1 106 GLY N 1 142 ARG O 3.300 2.500 3.500 3.090 2.871 3.275 . 0 0 "[ . 1 ]" 3
77 1 103 PHE O 1 116 LEU H 2.300 . 2.500 2.348 2.210 2.506 0.006 4 0 "[ . 1 ]" 3
78 1 103 PHE O 1 116 LEU N 3.300 2.500 3.500 3.189 2.975 3.296 . 0 0 "[ . 1 ]" 3
79 1 101 VAL O 1 118 GLU H 2.300 . 2.500 2.517 2.086 2.591 0.091 11 0 "[ . 1 ]" 3
80 1 101 VAL O 1 118 GLU N 3.300 2.500 3.500 3.273 2.864 3.343 . 0 0 "[ . 1 ]" 3
81 1 92 ALA O 1 126 GLN H 2.300 . 2.500 2.092 2.081 2.108 . 0 0 "[ . 1 ]" 3
82 1 92 ALA O 1 126 GLN N 3.300 2.500 3.500 2.987 2.916 3.033 . 0 0 "[ . 1 ]" 3
83 1 90 ILE O 1 128 PHE H 2.300 . 2.500 2.081 2.066 2.101 . 0 0 "[ . 1 ]" 3
84 1 90 ILE O 1 128 PHE N 3.300 2.500 3.500 3.025 2.959 3.062 . 0 0 "[ . 1 ]" 3
85 1 88 TYR O 1 130 PHE H 2.300 . 2.500 2.208 2.119 2.427 . 0 0 "[ . 1 ]" 3
86 1 88 TYR O 1 130 PHE N 3.300 2.500 3.500 3.023 2.932 3.217 . 0 0 "[ . 1 ]" 3
87 1 78 VAL O 1 141 ILE H 2.300 . 2.500 2.486 2.337 2.522 0.022 7 0 "[ . 1 ]" 3
88 1 78 VAL O 1 141 ILE N 3.300 2.500 3.500 3.343 3.203 3.382 . 0 0 "[ . 1 ]" 3
89 1 106 GLY O 1 142 ARG H 2.300 . 2.500 2.176 2.073 2.509 0.009 10 0 "[ . 1 ]" 3
90 1 106 GLY O 1 142 ARG N 3.300 2.500 3.500 3.102 2.987 3.412 . 0 0 "[ . 1 ]" 3
91 1 75 ALA O 1 143 ALA H 2.300 . 2.500 2.508 2.326 2.540 0.040 1 0 "[ . 1 ]" 3
92 1 75 ALA O 1 143 ALA N 3.300 2.500 3.500 3.254 3.195 3.300 . 0 0 "[ . 1 ]" 3
93 1 73 ALA O 1 145 ILE H 2.300 . 2.500 2.054 1.967 2.106 . 0 0 "[ . 1 ]" 3
94 1 73 ALA O 1 145 ILE N 3.300 2.500 3.500 2.799 2.683 2.874 . 0 0 "[ . 1 ]" 3
95 1 102 SER O 1 146 HIS H 2.300 . 2.500 2.127 2.069 2.521 0.021 9 0 "[ . 1 ]" 3
96 1 102 SER O 1 146 HIS N 3.300 2.500 3.500 2.930 2.791 3.031 . 0 0 "[ . 1 ]" 3
97 1 71 ILE O 1 147 PHE H 2.300 . 2.500 2.165 2.063 2.330 . 0 0 "[ . 1 ]" 3
98 1 71 ILE O 1 147 PHE N 3.300 2.500 3.500 2.665 2.556 2.839 . 0 0 "[ . 1 ]" 3
99 1 61 VAL O 1 155 ASN H 2.300 . 2.500 2.361 2.318 2.444 . 0 0 "[ . 1 ]" 3
100 1 61 VAL O 1 155 ASN N 3.300 2.500 3.500 3.319 3.269 3.417 . 0 0 "[ . 1 ]" 3
101 1 59 VAL O 1 157 ILE H 2.300 . 2.500 2.087 2.061 2.145 . 0 0 "[ . 1 ]" 3
102 1 59 VAL O 1 157 ILE N 3.300 2.500 3.500 2.731 2.692 2.792 . 0 0 "[ . 1 ]" 3
103 1 93 ARG O 1 158 TYR H 2.300 . 2.500 2.050 1.987 2.069 . 0 0 "[ . 1 ]" 3
104 1 93 ARG O 1 158 TYR N 3.300 2.500 3.500 2.886 2.801 2.906 . 0 0 "[ . 1 ]" 3
105 1 57 LEU O 1 159 ILE H 2.300 . 2.500 2.247 2.135 2.367 . 0 0 "[ . 1 ]" 3
106 1 57 LEU O 1 159 ILE N 3.300 2.500 3.500 3.127 2.955 3.225 . 0 0 "[ . 1 ]" 3
107 1 91 TRP O 1 160 ASP H 2.300 . 2.500 2.105 2.082 2.150 . 0 0 "[ . 1 ]" 3
108 1 91 TRP O 1 160 ASP N 3.300 2.500 3.500 3.016 2.968 3.058 . 0 0 "[ . 1 ]" 3
109 1 89 THR O 1 163 ALA H 2.300 . 2.500 2.052 2.009 2.081 . 0 0 "[ . 1 ]" 3
110 1 89 THR O 1 163 ALA N 3.300 2.500 3.500 2.978 2.917 3.028 . 0 0 "[ . 1 ]" 3
111 1 4 ALA H 1 164 ILE O 2.300 . 2.500 2.249 2.095 2.503 0.003 2 0 "[ . 1 ]" 3
112 1 4 ALA N 1 164 ILE O 3.300 2.500 3.500 3.047 2.845 3.337 . 0 0 "[ . 1 ]" 3
113 1 18 VAL H 1 42 PHE O 2.300 . 2.500 2.106 2.058 2.266 . 0 0 "[ . 1 ]" 3
114 1 18 VAL N 1 42 PHE O 3.300 2.500 3.500 2.987 2.935 3.130 . 0 0 "[ . 1 ]" 3
115 1 33 GLY H 1 70 ASP O 2.300 . 2.500 2.512 2.369 2.539 0.039 12 0 "[ . 1 ]" 3
116 1 33 GLY N 1 70 ASP O 3.300 2.500 3.500 3.427 3.300 3.467 . 0 0 "[ . 1 ]" 3
117 1 33 GLY O 1 36 VAL H 2.300 . 2.500 2.162 2.101 2.417 . 0 0 "[ . 1 ]" 3
118 1 33 GLY O 1 36 VAL N 3.300 2.500 3.500 2.995 2.794 3.298 . 0 0 "[ . 1 ]" 3
119 1 67 ASN O 1 69 TRP H 2.300 . 2.500 2.488 2.104 2.531 0.031 3 0 "[ . 1 ]" 3
120 1 67 ASN O 1 69 TRP N 3.300 2.500 3.500 3.072 2.917 3.090 . 0 0 "[ . 1 ]" 3
121 1 4 ALA O 1 79 ASN H 2.300 . 2.500 2.388 2.279 2.506 0.006 8 0 "[ . 1 ]" 3
122 1 4 ALA O 1 79 ASN N 3.300 2.500 3.500 3.174 2.973 3.301 . 0 0 "[ . 1 ]" 3
123 1 98 GLY H 1 121 ILE O 2.300 . 2.500 2.428 2.320 2.518 0.018 11 0 "[ . 1 ]" 3
124 1 98 GLY N 1 121 ILE O 3.300 2.500 3.500 3.374 3.286 3.480 . 0 0 "[ . 1 ]" 3
125 1 107 ASN H 1 111 GLN O 2.300 . 2.500 2.489 2.324 2.587 0.087 8 0 "[ . 1 ]" 3
126 1 107 ASN N 1 111 GLN O 3.300 2.500 3.500 3.155 2.614 3.528 0.028 12 0 "[ . 1 ]" 3
127 1 105 VAL O 1 113 TYR H 2.300 . 2.500 2.446 2.080 2.519 0.019 9 0 "[ . 1 ]" 3
128 1 105 VAL O 1 113 TYR N 3.300 2.500 3.500 3.235 2.831 3.391 . 0 0 "[ . 1 ]" 3
129 1 87 THR O 1 165 ALA H 2.300 . 2.500 2.344 2.096 2.516 0.016 12 0 "[ . 1 ]" 3
130 1 87 THR O 1 165 ALA N 3.300 2.500 3.500 3.167 2.863 3.357 . 0 0 "[ . 1 ]" 3
stop_
save_
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