NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
377146 |
1g1e   |
4635 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1g1e
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 1469
_Distance_constraint_stats_list.Viol_count 838
_Distance_constraint_stats_list.Viol_total 1098.397
_Distance_constraint_stats_list.Viol_max 0.378
_Distance_constraint_stats_list.Viol_rms 0.0227
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0033
_Distance_constraint_stats_list.Viol_average_violations_only 0.0874
_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 ARG 0.000 0.000 . 0 "[ . 1 .]"
1 2 MET 0.032 0.032 14 0 "[ . 1 .]"
1 3 ASN 0.167 0.071 12 0 "[ . 1 .]"
1 4 ILE 5.740 0.281 11 0 "[ . 1 .]"
1 5 GLN 0.000 0.000 . 0 "[ . 1 .]"
1 6 MET 0.516 0.089 9 0 "[ . 1 .]"
1 7 LEU 5.009 0.341 15 0 "[ . 1 .]"
1 8 LEU 3.835 0.288 15 0 "[ . 1 .]"
1 9 GLU 0.000 0.000 . 0 "[ . 1 .]"
1 10 ALA 4.178 0.263 4 0 "[ . 1 .]"
1 11 ALA 1.202 0.199 5 0 "[ . 1 .]"
1 12 ASP 0.000 0.000 . 0 "[ . 1 .]"
1 13 TYR 1.516 0.138 3 0 "[ . 1 .]"
1 14 LEU 4.146 0.299 1 0 "[ . 1 .]"
1 15 GLU 2.135 0.138 3 0 "[ . 1 .]"
1 16 ARG 0.000 0.000 . 0 "[ . 1 .]"
2 1 SER 0.000 0.000 . 0 "[ . 1 .]"
2 2 LEU 0.000 0.000 . 0 "[ . 1 .]"
2 3 GLN 0.299 0.105 13 0 "[ . 1 .]"
2 4 ASN 0.000 0.000 . 0 "[ . 1 .]"
2 5 ASN 0.348 0.279 15 0 "[ . 1 .]"
2 6 GLN 0.345 0.279 15 0 "[ . 1 .]"
2 7 PRO 0.010 0.006 12 0 "[ . 1 .]"
2 8 VAL 0.000 0.000 . 0 "[ . 1 .]"
2 9 GLU 0.000 0.000 . 0 "[ . 1 .]"
2 10 PHE 0.442 0.089 9 0 "[ . 1 .]"
2 11 ASN 0.000 0.000 14 0 "[ . 1 .]"
2 12 HIS 0.534 0.063 14 0 "[ . 1 .]"
2 13 ALA 0.166 0.085 12 0 "[ . 1 .]"
2 14 ILE 4.523 0.263 4 0 "[ . 1 .]"
2 15 ASN 0.409 0.063 14 0 "[ . 1 .]"
2 16 TYR 0.846 0.230 15 0 "[ . 1 .]"
2 17 VAL 7.857 0.341 15 0 "[ . 1 .]"
2 18 ASN 0.075 0.021 9 0 "[ . 1 .]"
2 19 LYS 7.839 0.273 3 0 "[ . 1 .]"
2 20 ILE 4.993 0.274 1 0 "[ . 1 .]"
2 21 LYS 0.374 0.061 3 0 "[ . 1 .]"
2 22 ASN 0.750 0.053 11 0 "[ . 1 .]"
2 23 ARG 0.008 0.008 15 0 "[ . 1 .]"
2 24 PHE 5.160 0.274 1 0 "[ . 1 .]"
2 25 GLN 0.079 0.024 8 0 "[ . 1 .]"
2 26 GLY 0.000 0.000 . 0 "[ . 1 .]"
2 27 GLN 1.087 0.268 3 0 "[ . 1 .]"
2 28 PRO 0.263 0.039 2 0 "[ . 1 .]"
2 29 ASP 0.033 0.027 8 0 "[ . 1 .]"
2 30 ILE 3.877 0.269 5 0 "[ . 1 .]"
2 31 TYR 0.803 0.147 9 0 "[ . 1 .]"
2 32 LYS 0.044 0.027 8 0 "[ . 1 .]"
2 33 ALA 0.310 0.255 9 0 "[ . 1 .]"
2 34 PHE 1.594 0.177 6 0 "[ . 1 .]"
2 35 LEU 1.314 0.199 5 0 "[ . 1 .]"
2 36 GLU 0.308 0.029 5 0 "[ . 1 .]"
2 37 ILE 1.890 0.141 7 0 "[ . 1 .]"
2 38 LEU 4.788 0.288 15 0 "[ . 1 .]"
2 39 HIS 0.863 0.132 5 0 "[ . 1 .]"
2 40 THR 4.274 0.357 1 0 "[ . 1 .]"
2 41 TYR 3.465 0.281 11 0 "[ . 1 .]"
2 42 GLN 2.339 0.264 11 0 "[ . 1 .]"
2 43 LYS 0.000 0.000 . 0 "[ . 1 .]"
2 44 GLU 0.622 0.067 11 0 "[ . 1 .]"
2 45 GLN 0.038 0.023 1 0 "[ . 1 .]"
2 46 ARG 0.000 0.000 . 0 "[ . 1 .]"
2 47 ASN 0.673 0.067 11 0 "[ . 1 .]"
2 48 ALA 0.607 0.145 11 0 "[ . 1 .]"
2 49 LYS 0.000 0.000 . 0 "[ . 1 .]"
2 50 GLU 0.051 0.017 10 0 "[ . 1 .]"
2 51 ALA 0.000 0.000 . 0 "[ . 1 .]"
2 52 GLY 0.020 0.020 4 0 "[ . 1 .]"
2 53 GLY 0.049 0.026 5 0 "[ . 1 .]"
2 54 ASN 0.086 0.038 10 0 "[ . 1 .]"
2 55 TYR 0.795 0.169 13 0 "[ . 1 .]"
2 56 THR 0.570 0.110 13 0 "[ . 1 .]"
2 57 PRO 0.570 0.110 13 0 "[ . 1 .]"
2 58 ALA 0.000 0.000 . 0 "[ . 1 .]"
2 59 LEU 5.556 0.357 1 0 "[ . 1 .]"
2 60 THR 0.330 0.051 14 0 "[ . 1 .]"
2 61 GLU 0.068 0.036 13 0 "[ . 1 .]"
2 62 GLN 0.399 0.063 13 0 "[ . 1 .]"
2 63 GLU 1.347 0.250 9 0 "[ . 1 .]"
2 64 VAL 3.578 0.207 12 0 "[ . 1 .]"
2 65 TYR 0.251 0.095 7 0 "[ . 1 .]"
2 66 ALA 0.027 0.014 5 0 "[ . 1 .]"
2 67 GLN 0.802 0.131 3 0 "[ . 1 .]"
2 68 VAL 2.080 0.177 6 0 "[ . 1 .]"
2 69 ALA 1.371 0.193 6 0 "[ . 1 .]"
2 70 ARG 0.280 0.055 9 0 "[ . 1 .]"
2 71 LEU 2.318 0.255 9 0 "[ . 1 .]"
2 72 PHE 3.441 0.191 12 0 "[ . 1 .]"
2 73 LYS 0.101 0.060 5 0 "[ . 1 .]"
2 74 ASN 0.000 0.000 . 0 "[ . 1 .]"
2 75 GLN 0.361 0.162 15 0 "[ . 1 .]"
2 76 GLU 0.157 0.039 5 0 "[ . 1 .]"
2 77 ASP 0.000 0.000 . 0 "[ . 1 .]"
2 78 LEU 8.380 0.273 3 0 "[ . 1 .]"
2 79 LEU 4.025 0.193 6 0 "[ . 1 .]"
2 80 SER 0.000 0.000 . 0 "[ . 1 .]"
2 81 GLU 0.110 0.076 15 0 "[ . 1 .]"
2 82 PHE 1.891 0.182 4 0 "[ . 1 .]"
2 83 GLY 0.087 0.087 4 0 "[ . 1 .]"
2 84 GLN 0.235 0.075 2 0 "[ . 1 .]"
2 85 PHE 0.686 0.094 15 0 "[ . 1 .]"
2 86 LEU 4.187 0.242 11 0 "[ . 1 .]"
2 87 PRO 1.486 0.378 15 0 "[ . 1 .]"
2 88 ASP 1.604 0.378 15 0 "[ . 1 .]"
2 89 ALA 0.256 0.145 15 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 ARG HA 1 1 ARG QD 3.400 . 5.000 3.404 1.997 4.272 . 0 0 "[ . 1 .]" 1
2 1 1 ARG HA 1 1 ARG QG 2.900 . 4.000 2.643 2.393 3.355 . 0 0 "[ . 1 .]" 1
3 1 1 ARG HA 1 2 MET H 2.900 . 4.000 2.823 2.148 3.575 . 0 0 "[ . 1 .]" 1
4 1 2 MET H 1 2 MET QG 2.900 . 4.000 2.625 1.929 3.070 . 0 0 "[ . 1 .]" 1
5 1 2 MET HA 1 2 MET ME 3.400 . 5.000 3.725 2.045 4.221 . 0 0 "[ . 1 .]" 1
6 1 2 MET HA 1 2 MET QG 2.900 . 4.000 2.731 2.422 3.357 . 0 0 "[ . 1 .]" 1
7 1 2 MET HA 1 3 ASN H 2.900 . 4.000 2.453 2.132 3.568 . 0 0 "[ . 1 .]" 1
8 1 2 MET HA 1 5 GLN QB 3.400 . 5.000 3.919 3.130 4.470 . 0 0 "[ . 1 .]" 1
9 1 2 MET HA 1 6 MET QB 3.900 . 6.000 4.299 3.041 5.178 . 0 0 "[ . 1 .]" 1
10 1 2 MET QB 1 3 ASN H 2.900 . 4.000 3.104 1.768 3.646 0.032 14 0 "[ . 1 .]" 1
11 1 3 ASN H 1 3 ASN HA 2.900 . 4.000 2.856 2.489 2.949 . 0 0 "[ . 1 .]" 1
12 1 3 ASN H 1 4 ILE H 2.900 . 4.000 3.080 2.056 4.071 0.071 12 0 "[ . 1 .]" 1
13 1 3 ASN HA 1 4 ILE H 2.900 . 4.000 3.393 2.142 3.588 . 0 0 "[ . 1 .]" 1
14 1 3 ASN HA 1 6 MET QB 3.400 . 5.000 3.310 2.484 4.280 . 0 0 "[ . 1 .]" 1
15 1 3 ASN QB 1 3 ASN QD 2.900 . 4.000 2.797 2.739 2.823 . 0 0 "[ . 1 .]" 1
16 1 3 ASN QB 1 4 ILE H 2.900 . 4.000 2.261 1.864 3.586 . 0 0 "[ . 1 .]" 1
17 1 3 ASN QD 1 6 MET QB 3.400 . 5.000 3.955 3.656 4.067 . 0 0 "[ . 1 .]" 1
18 1 4 ILE H 1 4 ILE HA 2.900 . 4.000 2.768 2.221 2.903 . 0 0 "[ . 1 .]" 1
19 1 4 ILE H 1 4 ILE HB 2.900 . 4.000 3.650 3.570 4.053 0.053 12 0 "[ . 1 .]" 1
20 1 4 ILE H 1 4 ILE MD 3.900 . 6.000 3.602 1.894 4.772 . 0 0 "[ . 1 .]" 1
21 1 4 ILE H 1 4 ILE QG 2.900 . 4.000 1.972 1.794 2.612 0.006 13 0 "[ . 1 .]" 1
22 1 4 ILE H 1 4 ILE MG 3.400 . 5.000 2.653 2.333 3.002 . 0 0 "[ . 1 .]" 1
23 1 4 ILE HA 1 4 ILE HB 2.900 . 4.000 2.530 2.361 2.635 . 0 0 "[ . 1 .]" 1
24 1 4 ILE HA 1 4 ILE MD 3.400 . 5.000 4.123 3.647 4.175 . 0 0 "[ . 1 .]" 1
25 1 4 ILE HA 1 4 ILE QG 2.900 . 4.000 2.101 1.987 2.285 . 0 0 "[ . 1 .]" 1
26 1 4 ILE HA 1 4 ILE MG 3.400 . 5.000 2.125 2.003 2.319 . 0 0 "[ . 1 .]" 1
27 1 4 ILE HA 1 5 GLN H 2.900 . 4.000 3.549 3.505 3.583 . 0 0 "[ . 1 .]" 1
28 1 4 ILE HA 1 6 MET H 3.900 . 6.000 4.208 3.891 4.761 . 0 0 "[ . 1 .]" 1
29 1 4 ILE HA 1 7 LEU H 2.900 . 4.000 3.436 3.082 3.933 . 0 0 "[ . 1 .]" 1
30 1 4 ILE HA 1 7 LEU QB 2.900 . 4.000 3.104 2.532 3.582 . 0 0 "[ . 1 .]" 1
31 1 4 ILE HA 1 7 LEU QD 3.400 . 5.000 2.726 1.784 3.495 0.016 14 0 "[ . 1 .]" 1
32 1 4 ILE HA 1 7 LEU HG 3.400 . 5.000 4.440 3.772 5.004 0.004 15 0 "[ . 1 .]" 1
33 1 4 ILE HA 1 8 LEU H 3.400 . 5.000 3.949 3.643 4.358 . 0 0 "[ . 1 .]" 1
34 1 4 ILE HB 1 4 ILE MD 3.400 . 5.000 2.446 2.277 3.231 . 0 0 "[ . 1 .]" 1
35 1 4 ILE HB 1 5 GLN H 2.900 . 4.000 3.334 2.887 3.937 . 0 0 "[ . 1 .]" 1
36 1 4 ILE MD 1 4 ILE MG 3.400 . 5.000 1.973 1.607 2.126 0.193 9 0 "[ . 1 .]" 1
37 1 4 ILE MD 2 39 HIS HA 3.150 . 4.500 3.696 3.318 3.805 . 0 0 "[ . 1 .]" 1
38 1 4 ILE MD 2 41 TYR QD 3.600 . 5.400 1.685 1.519 2.111 0.281 11 0 "[ . 1 .]" 1
39 1 4 ILE MD 2 41 TYR QE 3.150 . 4.500 3.166 2.683 3.365 . 0 0 "[ . 1 .]" 1
40 1 4 ILE MD 2 42 GLN H 3.900 . 6.000 2.317 2.026 2.517 . 0 0 "[ . 1 .]" 1
41 1 4 ILE MD 2 42 GLN QB 3.150 . 4.500 2.725 1.636 3.257 0.164 1 0 "[ . 1 .]" 1
42 1 4 ILE MD 2 42 GLN QG 3.150 . 4.500 1.877 1.536 2.903 0.264 11 0 "[ . 1 .]" 1
43 1 4 ILE QG 2 86 LEU QD 3.150 . 4.500 2.576 2.558 2.593 . 0 0 "[ . 1 .]" 1
44 1 4 ILE MG 1 5 GLN H 3.400 . 5.000 3.954 3.800 4.044 . 0 0 "[ . 1 .]" 1
45 1 4 ILE MG 1 5 GLN HA 3.900 . 6.000 5.175 5.102 5.244 . 0 0 "[ . 1 .]" 1
46 1 4 ILE MG 1 8 LEU H 3.900 . 6.000 5.054 5.003 5.108 . 0 0 "[ . 1 .]" 1
47 1 4 ILE MG 1 8 LEU QD 3.900 . 6.000 3.622 3.403 3.763 . 0 0 "[ . 1 .]" 1
48 1 4 ILE MG 2 38 LEU HB2 3.600 . 5.400 3.795 3.460 4.041 . 0 0 "[ . 1 .]" 1
49 1 4 ILE MG 2 38 LEU HB3 3.600 . 5.400 2.313 1.965 2.614 . 0 0 "[ . 1 .]" 1
50 1 4 ILE MG 2 38 LEU QD 3.150 . 4.500 1.819 1.660 2.365 0.140 2 0 "[ . 1 .]" 1
51 1 4 ILE MG 2 41 TYR QD 3.600 . 5.400 3.487 3.172 3.728 . 0 0 "[ . 1 .]" 1
52 1 4 ILE MG 2 41 TYR QE 3.600 . 5.400 4.047 4.016 4.088 . 0 0 "[ . 1 .]" 1
53 1 4 ILE MG 2 42 GLN H 3.900 . 6.000 4.783 4.117 5.030 . 0 0 "[ . 1 .]" 1
54 1 5 GLN H 1 5 GLN HA 2.900 . 4.000 2.739 2.690 2.789 . 0 0 "[ . 1 .]" 1
55 1 5 GLN H 1 5 GLN QB 2.400 . 3.000 2.305 2.243 2.567 . 0 0 "[ . 1 .]" 1
56 1 5 GLN H 1 5 GLN QG 3.400 . 5.000 3.609 1.973 4.048 . 0 0 "[ . 1 .]" 1
57 1 5 GLN HA 1 5 GLN QG 3.400 . 5.000 2.636 2.434 3.023 . 0 0 "[ . 1 .]" 1
58 1 5 GLN HA 1 6 MET H 2.900 . 4.000 3.505 3.436 3.564 . 0 0 "[ . 1 .]" 1
59 1 5 GLN HA 1 8 LEU QD 3.400 . 5.000 2.319 1.808 3.011 . 0 0 "[ . 1 .]" 1
60 1 5 GLN QB 1 6 MET H 2.900 . 4.000 2.692 2.442 2.827 . 0 0 "[ . 1 .]" 1
61 1 6 MET H 1 6 MET HA 2.900 . 4.000 2.787 2.724 2.837 . 0 0 "[ . 1 .]" 1
62 1 6 MET H 1 6 MET QB 2.900 . 4.000 2.225 2.131 2.426 . 0 0 "[ . 1 .]" 1
63 1 6 MET H 1 7 LEU H 2.900 . 4.000 2.747 2.547 2.979 . 0 0 "[ . 1 .]" 1
64 1 6 MET HA 1 6 MET QG 2.900 . 4.000 2.474 2.326 2.638 . 0 0 "[ . 1 .]" 1
65 1 6 MET HA 1 7 LEU H 3.400 . 5.000 3.546 3.509 3.581 . 0 0 "[ . 1 .]" 1
66 1 6 MET HA 1 9 GLU H 3.400 . 5.000 4.190 3.968 4.446 . 0 0 "[ . 1 .]" 1
67 1 6 MET HA 1 9 GLU QB 2.900 . 4.000 3.482 3.184 3.624 . 0 0 "[ . 1 .]" 1
68 1 6 MET QB 1 7 LEU H 2.900 . 4.000 2.517 2.346 2.687 . 0 0 "[ . 1 .]" 1
69 1 6 MET QB 2 10 PHE QD 3.600 . 5.400 3.857 2.761 4.321 . 0 0 "[ . 1 .]" 1
70 1 6 MET ME 2 9 GLU H 3.900 . 6.000 4.738 4.196 5.013 . 0 0 "[ . 1 .]" 1
71 1 6 MET ME 2 10 PHE H 3.400 . 5.000 3.477 2.866 3.936 . 0 0 "[ . 1 .]" 1
72 1 6 MET ME 2 10 PHE QD 3.600 . 5.400 3.588 2.751 4.026 . 0 0 "[ . 1 .]" 1
73 1 6 MET ME 2 13 ALA MB 3.600 . 5.400 2.540 1.715 3.395 0.085 12 0 "[ . 1 .]" 1
74 1 6 MET ME 2 85 PHE QE 3.600 . 5.400 3.462 1.825 4.015 . 0 0 "[ . 1 .]" 1
75 1 6 MET QG 2 10 PHE QD 3.600 . 5.400 2.014 1.711 2.864 0.089 9 0 "[ . 1 .]" 1
76 1 6 MET QG 2 13 ALA MB 3.600 . 5.400 3.192 2.007 4.022 . 0 0 "[ . 1 .]" 1
77 1 7 LEU H 1 7 LEU HA 2.900 . 4.000 2.870 2.833 2.894 . 0 0 "[ . 1 .]" 1
78 1 7 LEU H 1 7 LEU QB 2.900 . 4.000 2.229 1.910 2.556 . 0 0 "[ . 1 .]" 1
79 1 7 LEU H 1 7 LEU QD 3.900 . 6.000 3.232 1.909 3.704 . 0 0 "[ . 1 .]" 1
80 1 7 LEU H 1 7 LEU HG 2.900 . 4.000 3.464 2.335 4.250 0.250 8 0 "[ . 1 .]" 1
81 1 7 LEU H 1 8 LEU H 2.900 . 4.000 2.526 2.439 2.737 . 0 0 "[ . 1 .]" 1
82 1 7 LEU HA 1 7 LEU QD 3.400 . 5.000 2.671 2.424 3.130 . 0 0 "[ . 1 .]" 1
83 1 7 LEU HA 1 10 ALA H 2.900 . 4.000 3.507 3.266 3.655 . 0 0 "[ . 1 .]" 1
84 1 7 LEU HA 1 10 ALA MB 3.400 . 5.000 2.522 2.179 2.888 . 0 0 "[ . 1 .]" 1
85 1 7 LEU HA 2 17 VAL MG2 3.150 . 4.500 3.110 2.280 3.679 . 0 0 "[ . 1 .]" 1
86 1 7 LEU QB 1 8 LEU H 2.900 . 4.000 2.605 2.147 3.394 . 0 0 "[ . 1 .]" 1
87 1 7 LEU QB 2 14 ILE MD 3.600 . 5.400 4.090 4.064 4.107 . 0 0 "[ . 1 .]" 1
88 1 7 LEU QB 2 38 LEU QD 3.600 . 5.400 3.144 2.490 3.618 . 0 0 "[ . 1 .]" 1
89 1 7 LEU QD 2 13 ALA HA 3.150 . 4.500 2.683 2.339 3.391 . 0 0 "[ . 1 .]" 1
90 1 7 LEU QD 2 13 ALA MB 3.600 . 5.400 1.979 1.820 2.799 . 0 0 "[ . 1 .]" 1
91 1 7 LEU QD 2 16 TYR QD 3.150 . 4.500 2.055 1.661 2.849 0.139 11 0 "[ . 1 .]" 1
92 1 7 LEU QD 2 16 TYR QE 3.600 . 5.400 2.635 2.065 3.495 . 0 0 "[ . 1 .]" 1
93 1 7 LEU QD 2 17 VAL MG1 3.600 . 5.400 3.342 3.056 3.410 . 0 0 "[ . 1 .]" 1
94 1 7 LEU QD 2 17 VAL MG2 3.150 . 4.500 1.539 1.459 1.779 0.341 15 0 "[ . 1 .]" 1
95 1 7 LEU QD 2 34 PHE QE 3.600 . 5.400 2.641 1.649 3.390 0.151 8 0 "[ . 1 .]" 1
96 1 7 LEU QD 2 34 PHE HZ 3.600 . 5.400 2.500 1.956 3.256 . 0 0 "[ . 1 .]" 1
97 1 7 LEU QD 2 38 LEU QD 3.150 . 4.500 2.227 1.831 2.498 . 0 0 "[ . 1 .]" 1
98 1 7 LEU QD 2 82 PHE QD 3.600 . 5.400 2.904 2.305 3.342 . 0 0 "[ . 1 .]" 1
99 1 7 LEU QD 2 82 PHE QE 3.600 . 5.400 2.769 2.318 3.576 . 0 0 "[ . 1 .]" 1
100 1 7 LEU QD 2 85 PHE QD 3.600 . 5.400 3.046 2.474 3.577 . 0 0 "[ . 1 .]" 1
101 1 7 LEU QD 2 85 PHE QE 3.600 . 5.400 3.050 2.186 3.558 . 0 0 "[ . 1 .]" 1
102 1 7 LEU QD 2 85 PHE HZ 3.600 . 5.400 3.725 2.822 4.017 . 0 0 "[ . 1 .]" 1
103 1 8 LEU H 1 8 LEU QB 2.900 . 4.000 2.392 2.049 2.599 . 0 0 "[ . 1 .]" 1
104 1 8 LEU H 1 8 LEU QD 3.400 . 5.000 3.181 2.895 3.682 . 0 0 "[ . 1 .]" 1
105 1 8 LEU H 1 8 LEU HG 2.900 . 4.000 2.549 2.019 4.165 0.165 2 0 "[ . 1 .]" 1
106 1 8 LEU H 1 9 GLU H 2.900 . 4.000 2.939 2.601 3.174 . 0 0 "[ . 1 .]" 1
107 1 8 LEU H 1 10 ALA H 3.400 . 5.000 4.100 3.828 4.248 . 0 0 "[ . 1 .]" 1
108 1 8 LEU HA 1 8 LEU QD 2.900 . 4.000 2.186 1.967 3.105 . 0 0 "[ . 1 .]" 1
109 1 8 LEU HA 1 8 LEU HG 2.900 . 4.000 2.991 2.524 3.751 . 0 0 "[ . 1 .]" 1
110 1 8 LEU HA 1 9 GLU H 2.900 . 4.000 3.578 3.526 3.598 . 0 0 "[ . 1 .]" 1
111 1 8 LEU HA 1 11 ALA H 2.900 . 4.000 3.587 3.432 3.792 . 0 0 "[ . 1 .]" 1
112 1 8 LEU HA 1 11 ALA MB 2.900 . 4.000 3.104 2.597 3.400 . 0 0 "[ . 1 .]" 1
113 1 8 LEU HA 2 17 VAL MG1 3.600 . 5.400 4.565 4.511 4.594 . 0 0 "[ . 1 .]" 1
114 1 8 LEU HA 2 35 LEU QD 3.600 . 5.400 2.233 1.782 2.969 0.018 3 0 "[ . 1 .]" 1
115 1 8 LEU HA 2 38 LEU QD 3.600 . 5.400 3.186 2.434 3.677 . 0 0 "[ . 1 .]" 1
116 1 8 LEU QB 1 9 GLU H 2.900 . 4.000 2.375 2.169 3.528 . 0 0 "[ . 1 .]" 1
117 1 8 LEU QD 1 9 GLU H 3.900 . 6.000 3.734 2.436 3.958 . 0 0 "[ . 1 .]" 1
118 1 8 LEU QD 2 35 LEU HA 3.150 . 4.500 1.988 1.710 3.360 0.090 12 0 "[ . 1 .]" 1
119 1 8 LEU QD 2 38 LEU HB2 3.600 . 5.400 1.656 1.512 1.843 0.288 15 0 "[ . 1 .]" 1
120 1 8 LEU QD 2 38 LEU HB3 3.600 . 5.400 2.283 2.022 2.491 . 0 0 "[ . 1 .]" 1
121 1 8 LEU QD 2 38 LEU QD 3.150 . 4.500 1.816 1.651 2.342 0.149 3 0 "[ . 1 .]" 1
122 1 8 LEU QD 2 39 HIS H 3.900 . 6.000 2.430 2.187 2.902 . 0 0 "[ . 1 .]" 1
123 1 8 LEU QD 2 39 HIS HA 3.150 . 4.500 2.621 2.244 3.018 . 0 0 "[ . 1 .]" 1
124 1 8 LEU QD 2 39 HIS HD2 3.600 . 5.400 2.635 1.668 3.435 0.132 5 0 "[ . 1 .]" 1
125 1 9 GLU H 1 9 GLU HA 2.900 . 4.000 2.773 2.733 2.835 . 0 0 "[ . 1 .]" 1
126 1 9 GLU H 1 9 GLU QB 2.900 . 4.000 2.432 2.076 2.524 . 0 0 "[ . 1 .]" 1
127 1 9 GLU H 1 9 GLU QG 2.900 . 4.000 2.301 2.093 3.630 . 0 0 "[ . 1 .]" 1
128 1 9 GLU H 1 10 ALA H 2.900 . 4.000 2.742 2.521 2.874 . 0 0 "[ . 1 .]" 1
129 1 9 GLU HA 1 9 GLU QG 2.900 . 4.000 2.663 2.191 3.342 . 0 0 "[ . 1 .]" 1
130 1 9 GLU HA 1 10 ALA H 3.400 . 5.000 3.510 3.475 3.535 . 0 0 "[ . 1 .]" 1
131 1 9 GLU HA 1 12 ASP H 2.900 . 4.000 3.755 3.354 3.999 . 0 0 "[ . 1 .]" 1
132 1 9 GLU HA 1 12 ASP QB 2.900 . 4.000 3.317 2.913 3.577 . 0 0 "[ . 1 .]" 1
133 1 9 GLU QB 1 10 ALA H 2.900 . 4.000 2.750 2.536 3.567 . 0 0 "[ . 1 .]" 1
134 1 9 GLU QB 2 10 PHE QE 3.600 . 5.400 3.188 2.002 4.135 . 0 0 "[ . 1 .]" 1
135 1 9 GLU QB 2 10 PHE HZ 3.600 . 5.400 3.798 2.754 4.796 . 0 0 "[ . 1 .]" 1
136 1 10 ALA H 1 10 ALA HA 2.900 . 4.000 2.792 2.756 2.852 . 0 0 "[ . 1 .]" 1
137 1 10 ALA H 1 10 ALA MB 2.900 . 4.000 2.107 2.032 2.203 . 0 0 "[ . 1 .]" 1
138 1 10 ALA H 1 11 ALA H 2.900 . 4.000 2.872 2.693 3.045 . 0 0 "[ . 1 .]" 1
139 1 10 ALA HA 1 13 TYR QB 2.900 . 4.000 2.976 2.547 3.722 . 0 0 "[ . 1 .]" 1
140 1 10 ALA HA 2 10 PHE HZ 3.150 . 4.500 3.521 2.914 4.221 . 0 0 "[ . 1 .]" 1
141 1 10 ALA HA 2 14 ILE MD 3.600 . 5.400 2.988 2.265 3.625 . 0 0 "[ . 1 .]" 1
142 1 10 ALA HA 2 14 ILE QG 3.150 . 4.500 2.927 2.596 3.253 . 0 0 "[ . 1 .]" 1
143 1 10 ALA HA 2 14 ILE MG 3.600 . 5.400 4.481 4.258 4.583 . 0 0 "[ . 1 .]" 1
144 1 10 ALA MB 1 11 ALA H 2.900 . 4.000 2.247 1.994 2.539 . 0 0 "[ . 1 .]" 1
145 1 10 ALA MB 1 11 ALA HA 3.900 . 6.000 3.602 3.505 3.698 . 0 0 "[ . 1 .]" 1
146 1 10 ALA MB 1 14 LEU H 3.400 . 5.000 4.130 3.969 4.197 . 0 0 "[ . 1 .]" 1
147 1 10 ALA MB 2 10 PHE QE 3.600 . 5.400 3.491 3.080 4.029 . 0 0 "[ . 1 .]" 1
148 1 10 ALA MB 2 14 ILE H 3.400 . 5.000 3.801 3.337 4.109 . 0 0 "[ . 1 .]" 1
149 1 10 ALA MB 2 14 ILE HA 2.700 . 3.600 2.070 1.661 2.473 0.139 10 0 "[ . 1 .]" 1
150 1 10 ALA MB 2 14 ILE MD 3.600 . 5.400 1.605 1.537 1.767 0.263 4 0 "[ . 1 .]" 1
151 1 10 ALA MB 2 14 ILE QG 3.150 . 4.500 1.788 1.597 2.011 0.203 4 0 "[ . 1 .]" 1
152 1 10 ALA MB 2 14 ILE MG 3.600 . 5.400 3.005 2.784 3.277 . 0 0 "[ . 1 .]" 1
153 1 10 ALA MB 2 17 VAL HB 3.150 . 4.500 3.227 2.784 3.753 . 0 0 "[ . 1 .]" 1
154 1 11 ALA H 1 11 ALA HA 2.900 . 4.000 2.694 2.655 2.746 . 0 0 "[ . 1 .]" 1
155 1 11 ALA H 1 11 ALA MB 2.900 . 4.000 2.236 2.168 2.290 . 0 0 "[ . 1 .]" 1
156 1 11 ALA H 1 12 ASP H 2.900 . 4.000 3.043 2.873 3.156 . 0 0 "[ . 1 .]" 1
157 1 11 ALA HA 1 12 ASP H 2.900 . 4.000 3.571 3.535 3.581 . 0 0 "[ . 1 .]" 1
158 1 11 ALA HA 1 14 LEU QB 3.900 . 6.000 2.526 2.105 4.148 . 0 0 "[ . 1 .]" 1
159 1 11 ALA HA 1 14 LEU QD 3.400 . 5.000 2.071 1.759 2.474 0.041 11 0 "[ . 1 .]" 1
160 1 11 ALA HA 2 17 VAL MG1 2.700 . 3.600 2.398 2.136 2.589 . 0 0 "[ . 1 .]" 1
161 1 11 ALA HA 2 17 VAL MG2 3.150 . 4.500 3.817 3.768 3.844 . 0 0 "[ . 1 .]" 1
162 1 11 ALA HA 2 31 TYR QE 3.600 . 5.400 3.693 3.440 3.888 . 0 0 "[ . 1 .]" 1
163 1 11 ALA HA 2 35 LEU QD 3.600 . 5.400 3.852 3.628 4.016 . 0 0 "[ . 1 .]" 1
164 1 11 ALA MB 1 12 ASP H 2.900 . 4.000 2.449 2.381 2.660 . 0 0 "[ . 1 .]" 1
165 1 11 ALA MB 1 12 ASP HA 3.900 . 6.000 3.727 3.681 3.849 . 0 0 "[ . 1 .]" 1
166 1 11 ALA MB 1 15 GLU H 3.400 . 5.000 4.251 4.210 4.284 . 0 0 "[ . 1 .]" 1
167 1 11 ALA MB 2 17 VAL MG1 3.150 . 4.500 1.975 1.677 2.302 0.123 10 0 "[ . 1 .]" 1
168 1 11 ALA MB 2 17 VAL MG2 3.600 . 5.400 3.246 3.052 3.366 . 0 0 "[ . 1 .]" 1
169 1 11 ALA MB 2 31 TYR QD 3.600 . 5.400 3.958 3.763 4.080 . 0 0 "[ . 1 .]" 1
170 1 11 ALA MB 2 31 TYR QE 3.150 . 4.500 2.648 2.350 2.947 . 0 0 "[ . 1 .]" 1
171 1 11 ALA MB 2 35 LEU QD 3.150 . 4.500 1.764 1.601 1.934 0.199 5 0 "[ . 1 .]" 1
172 1 12 ASP H 1 12 ASP HA 2.900 . 4.000 2.752 2.721 2.798 . 0 0 "[ . 1 .]" 1
173 1 12 ASP H 1 12 ASP QB 2.400 . 3.000 2.455 2.236 2.576 . 0 0 "[ . 1 .]" 1
174 1 12 ASP HA 1 13 TYR H 3.400 . 5.000 3.541 3.507 3.587 . 0 0 "[ . 1 .]" 1
175 1 12 ASP HA 1 15 GLU H 3.400 . 5.000 3.778 3.446 4.337 . 0 0 "[ . 1 .]" 1
176 1 12 ASP HA 1 15 GLU QB 2.900 . 4.000 3.002 2.566 3.428 . 0 0 "[ . 1 .]" 1
177 1 12 ASP QB 1 13 TYR H 2.900 . 4.000 2.543 2.361 2.732 . 0 0 "[ . 1 .]" 1
178 1 13 TYR H 1 13 TYR QB 2.400 . 3.000 2.293 2.219 2.827 . 0 0 "[ . 1 .]" 1
179 1 13 TYR HA 1 13 TYR QD 3.400 . 5.000 3.153 2.617 3.265 . 0 0 "[ . 1 .]" 1
180 1 13 TYR HA 1 15 GLU H 2.900 . 4.000 4.101 4.066 4.138 0.138 3 0 "[ . 1 .]" 1
181 1 13 TYR QB 2 10 PHE HZ 3.600 . 5.400 4.649 4.082 4.857 . 0 0 "[ . 1 .]" 1
182 1 13 TYR QD 1 14 LEU HA 3.400 . 5.000 2.940 2.544 4.612 . 0 0 "[ . 1 .]" 1
183 1 13 TYR QD 1 14 LEU QB 3.900 . 6.000 4.303 3.649 4.780 . 0 0 "[ . 1 .]" 1
184 1 13 TYR QD 1 14 LEU QD 3.900 . 6.000 2.565 2.148 3.002 . 0 0 "[ . 1 .]" 1
185 1 13 TYR QE 1 14 LEU QD 3.900 . 6.000 3.812 3.615 4.016 . 0 0 "[ . 1 .]" 1
186 1 14 LEU H 1 14 LEU QB 2.900 . 4.000 2.635 2.498 2.946 . 0 0 "[ . 1 .]" 1
187 1 14 LEU H 1 14 LEU QD 3.400 . 5.000 2.770 2.277 2.912 . 0 0 "[ . 1 .]" 1
188 1 14 LEU H 1 14 LEU HG 2.900 . 4.000 1.969 1.850 2.367 . 0 0 "[ . 1 .]" 1
189 1 14 LEU H 1 15 GLU H 2.900 . 4.000 2.645 2.521 2.854 . 0 0 "[ . 1 .]" 1
190 1 14 LEU H 1 16 ARG H 3.400 . 5.000 4.428 4.123 4.846 . 0 0 "[ . 1 .]" 1
191 1 14 LEU HA 1 14 LEU QD 3.400 . 5.000 2.258 1.997 3.401 . 0 0 "[ . 1 .]" 1
192 1 14 LEU HA 1 14 LEU HG 2.900 . 4.000 3.291 3.090 3.648 . 0 0 "[ . 1 .]" 1
193 1 14 LEU HA 1 15 GLU H 3.400 . 5.000 3.515 3.485 3.525 . 0 0 "[ . 1 .]" 1
194 1 14 LEU HA 1 16 ARG H 3.400 . 5.000 4.294 3.761 4.763 . 0 0 "[ . 1 .]" 1
195 1 14 LEU QB 1 15 GLU H 3.400 . 5.000 2.764 2.553 3.724 . 0 0 "[ . 1 .]" 1
196 1 14 LEU QB 2 17 VAL MG1 3.600 . 5.400 3.328 3.007 4.040 . 0 0 "[ . 1 .]" 1
197 1 14 LEU QD 1 15 GLU H 3.900 . 6.000 3.946 3.205 4.057 . 0 0 "[ . 1 .]" 1
198 1 14 LEU QD 2 14 ILE MD 3.600 . 5.400 3.375 3.317 3.397 . 0 0 "[ . 1 .]" 1
199 1 14 LEU QD 2 17 VAL HB 3.150 . 4.500 1.604 1.501 1.728 0.299 1 0 "[ . 1 .]" 1
200 1 14 LEU QD 2 17 VAL MG1 3.600 . 5.400 1.813 1.595 2.032 0.205 2 0 "[ . 1 .]" 1
201 1 14 LEU QD 2 18 ASN HA 3.150 . 4.500 2.864 2.422 3.117 . 0 0 "[ . 1 .]" 1
202 1 14 LEU QD 2 18 ASN HB2 3.150 . 4.500 2.710 2.429 2.943 . 0 0 "[ . 1 .]" 1
203 1 14 LEU QD 2 18 ASN HB3 3.600 . 5.400 3.904 3.634 4.023 . 0 0 "[ . 1 .]" 1
204 1 14 LEU QD 2 21 LYS QD 3.600 . 5.400 3.058 2.334 3.398 . 0 0 "[ . 1 .]" 1
205 1 14 LEU QD 2 31 TYR QE 3.600 . 5.400 3.596 3.319 3.633 . 0 0 "[ . 1 .]" 1
206 1 14 LEU HG 1 15 GLU H 2.900 . 4.000 3.894 2.581 4.074 0.074 13 0 "[ . 1 .]" 1
207 1 15 GLU H 1 15 GLU HA 2.900 . 4.000 2.791 2.685 2.855 . 0 0 "[ . 1 .]" 1
208 1 15 GLU H 1 15 GLU QB 2.900 . 4.000 2.344 2.080 2.506 . 0 0 "[ . 1 .]" 1
209 1 15 GLU H 1 15 GLU QG 2.900 . 4.000 2.503 2.195 3.608 . 0 0 "[ . 1 .]" 1
210 1 15 GLU H 1 16 ARG H 2.900 . 4.000 2.821 2.613 3.184 . 0 0 "[ . 1 .]" 1
211 1 15 GLU HA 1 15 GLU QG 2.900 . 4.000 2.475 2.236 2.809 . 0 0 "[ . 1 .]" 1
212 1 15 GLU HA 1 16 ARG H 2.900 . 4.000 3.544 3.444 3.577 . 0 0 "[ . 1 .]" 1
213 1 15 GLU QB 1 16 ARG H 2.900 . 4.000 2.592 2.200 3.062 . 0 0 "[ . 1 .]" 1
214 1 15 GLU QG 2 31 TYR QE 3.150 . 4.500 2.112 1.678 2.768 0.122 5 0 "[ . 1 .]" 1
215 1 16 ARG H 1 16 ARG QB 2.900 . 4.000 2.353 2.237 2.599 . 0 0 "[ . 1 .]" 1
216 2 1 SER HA 2 1 SER QB 2.250 . 2.700 2.326 2.193 2.406 . 0 0 "[ . 1 .]" 1
217 2 2 LEU HA 2 2 LEU QD 3.150 . 4.500 2.572 1.888 3.337 . 0 0 "[ . 1 .]" 1
218 2 2 LEU HA 2 2 LEU HG 3.150 . 4.500 3.076 2.450 3.767 . 0 0 "[ . 1 .]" 1
219 2 2 LEU HA 2 3 GLN H 2.900 . 4.000 2.622 2.144 3.579 . 0 0 "[ . 1 .]" 1
220 2 2 LEU QB 2 2 LEU QD 2.700 . 3.600 1.919 1.852 2.021 . 0 0 "[ . 1 .]" 1
221 2 2 LEU QB 2 3 GLN H 3.400 . 5.000 3.092 1.954 4.009 . 0 0 "[ . 1 .]" 1
222 2 3 GLN H 2 3 GLN HA 2.900 . 4.000 2.703 2.256 2.874 . 0 0 "[ . 1 .]" 1
223 2 3 GLN H 2 3 GLN HB2 2.900 . 4.000 2.956 2.463 3.704 . 0 0 "[ . 1 .]" 1
224 2 3 GLN H 2 3 GLN HB3 2.900 . 4.000 3.842 3.603 4.105 0.105 13 0 "[ . 1 .]" 1
225 2 3 GLN HA 2 3 GLN HB2 2.700 . 3.600 3.020 2.969 3.031 . 0 0 "[ . 1 .]" 1
226 2 3 GLN HA 2 3 GLN QG 3.150 . 4.500 2.593 2.255 3.005 . 0 0 "[ . 1 .]" 1
227 2 3 GLN HA 2 4 ASN H 2.900 . 4.000 2.869 2.146 3.581 . 0 0 "[ . 1 .]" 1
228 2 3 GLN HB3 2 4 ASN H 2.900 . 4.000 3.199 1.883 3.958 . 0 0 "[ . 1 .]" 1
229 2 4 ASN H 2 4 ASN QB 3.400 . 5.000 2.878 2.375 3.422 . 0 0 "[ . 1 .]" 1
230 2 4 ASN HA 2 4 ASN HB2 2.700 . 3.600 3.027 3.023 3.030 . 0 0 "[ . 1 .]" 1
231 2 4 ASN HA 2 4 ASN HB3 2.700 . 3.600 2.487 2.447 2.520 . 0 0 "[ . 1 .]" 1
232 2 4 ASN HA 2 5 ASN H 3.400 . 5.000 2.731 2.166 3.571 . 0 0 "[ . 1 .]" 1
233 2 5 ASN H 2 5 ASN HB2 2.900 . 4.000 3.852 3.608 4.003 0.003 11 0 "[ . 1 .]" 1
234 2 5 ASN HA 2 5 ASN HB2 2.700 . 3.600 2.489 2.447 2.576 . 0 0 "[ . 1 .]" 1
235 2 5 ASN HA 2 5 ASN HB3 2.700 . 3.600 2.411 2.229 2.450 . 0 0 "[ . 1 .]" 1
236 2 5 ASN HB2 2 6 GLN H 3.400 . 5.000 2.610 1.830 4.037 . 0 0 "[ . 1 .]" 1
237 2 5 ASN HB3 2 6 GLN H 2.900 . 4.000 3.745 3.338 4.279 0.279 15 0 "[ . 1 .]" 1
238 2 6 GLN H 2 6 GLN QB 2.900 . 4.000 3.005 2.424 3.399 . 0 0 "[ . 1 .]" 1
239 2 6 GLN H 2 6 GLN QG 2.900 . 4.000 2.745 2.255 3.446 . 0 0 "[ . 1 .]" 1
240 2 6 GLN H 2 7 PRO QD 3.400 . 5.000 3.547 2.336 4.402 . 0 0 "[ . 1 .]" 1
241 2 6 GLN HA 2 6 GLN QG 2.700 . 3.600 2.660 2.363 3.299 . 0 0 "[ . 1 .]" 1
242 2 6 GLN HA 2 7 PRO QD 2.250 . 2.700 2.031 1.806 2.310 . 0 0 "[ . 1 .]" 1
243 2 6 GLN QB 2 6 GLN QG 2.250 . 2.700 2.046 1.989 2.088 . 0 0 "[ . 1 .]" 1
244 2 7 PRO HA 2 7 PRO QB 2.250 . 2.700 2.185 2.174 2.209 . 0 0 "[ . 1 .]" 1
245 2 7 PRO HA 2 7 PRO QG 3.150 . 4.500 3.438 2.987 3.544 . 0 0 "[ . 1 .]" 1
246 2 7 PRO HA 2 8 VAL H 2.900 . 4.000 3.033 2.164 3.513 . 0 0 "[ . 1 .]" 1
247 2 7 PRO HA 2 9 GLU H 3.900 . 6.000 3.977 3.506 5.025 . 0 0 "[ . 1 .]" 1
248 2 7 PRO HA 2 10 PHE HB3 3.150 . 4.500 3.566 1.909 4.506 0.006 12 0 "[ . 1 .]" 1
249 2 7 PRO QB 2 7 PRO QD 3.150 . 4.500 2.831 2.740 2.982 . 0 0 "[ . 1 .]" 1
250 2 7 PRO QB 2 8 VAL H 3.400 . 5.000 3.645 2.930 4.022 . 0 0 "[ . 1 .]" 1
251 2 7 PRO QD 2 8 VAL H 3.900 . 6.000 3.272 2.457 4.779 . 0 0 "[ . 1 .]" 1
252 2 8 VAL H 2 8 VAL HA 2.900 . 4.000 2.814 2.803 2.835 . 0 0 "[ . 1 .]" 1
253 2 8 VAL H 2 8 VAL MG1 3.400 . 5.000 3.774 3.768 3.783 . 0 0 "[ . 1 .]" 1
254 2 8 VAL H 2 8 VAL MG2 2.900 . 4.000 2.111 1.970 2.245 . 0 0 "[ . 1 .]" 1
255 2 8 VAL H 2 9 GLU H 2.900 . 4.000 2.726 2.585 3.002 . 0 0 "[ . 1 .]" 1
256 2 8 VAL HA 2 8 VAL HB 2.700 . 3.600 3.025 3.024 3.028 . 0 0 "[ . 1 .]" 1
257 2 8 VAL HA 2 8 VAL MG1 3.150 . 4.500 2.341 2.292 2.409 . 0 0 "[ . 1 .]" 1
258 2 8 VAL HA 2 8 VAL MG2 2.700 . 3.600 2.385 2.324 2.474 . 0 0 "[ . 1 .]" 1
259 2 8 VAL HA 2 9 GLU H 2.900 . 4.000 3.541 3.480 3.580 . 0 0 "[ . 1 .]" 1
260 2 8 VAL HA 2 11 ASN H 3.400 . 5.000 3.716 3.384 4.245 . 0 0 "[ . 1 .]" 1
261 2 8 VAL HA 2 11 ASN QB 3.150 . 4.500 3.125 2.281 4.064 . 0 0 "[ . 1 .]" 1
262 2 8 VAL MG1 2 9 GLU H 3.400 . 5.000 3.528 2.942 3.857 . 0 0 "[ . 1 .]" 1
263 2 8 VAL MG2 2 9 GLU H 3.900 . 6.000 3.809 3.586 4.016 . 0 0 "[ . 1 .]" 1
264 2 9 GLU H 2 9 GLU HA 2.900 . 4.000 2.821 2.808 2.842 . 0 0 "[ . 1 .]" 1
265 2 9 GLU H 2 9 GLU QG 2.900 . 4.000 2.394 2.168 3.144 . 0 0 "[ . 1 .]" 1
266 2 9 GLU H 2 10 PHE H 2.900 . 4.000 2.664 2.535 2.852 . 0 0 "[ . 1 .]" 1
267 2 9 GLU HA 2 9 GLU QG 2.250 . 2.700 2.411 2.373 2.432 . 0 0 "[ . 1 .]" 1
268 2 9 GLU HA 2 10 PHE H 2.900 . 4.000 3.530 3.477 3.578 . 0 0 "[ . 1 .]" 1
269 2 9 GLU QB 2 10 PHE H 3.400 . 5.000 2.609 2.238 2.989 . 0 0 "[ . 1 .]" 1
270 2 9 GLU QB 2 11 ASN H 3.900 . 6.000 4.913 4.591 5.221 . 0 0 "[ . 1 .]" 1
271 2 10 PHE H 2 10 PHE HB2 2.900 . 4.000 2.529 2.364 2.681 . 0 0 "[ . 1 .]" 1
272 2 10 PHE H 2 10 PHE HB3 2.900 . 4.000 2.517 2.380 2.632 . 0 0 "[ . 1 .]" 1
273 2 10 PHE H 2 10 PHE QD 3.900 . 6.000 4.178 4.141 4.198 . 0 0 "[ . 1 .]" 1
274 2 10 PHE H 2 11 ASN H 2.900 . 4.000 2.791 2.660 2.966 . 0 0 "[ . 1 .]" 1
275 2 10 PHE HA 2 10 PHE HB2 2.700 . 3.600 2.460 2.397 2.524 . 0 0 "[ . 1 .]" 1
276 2 10 PHE HA 2 10 PHE HB3 2.700 . 3.600 3.028 3.021 3.032 . 0 0 "[ . 1 .]" 1
277 2 10 PHE HA 2 10 PHE QD 3.150 . 4.500 2.574 1.935 3.195 . 0 0 "[ . 1 .]" 1
278 2 10 PHE HA 2 13 ALA H 3.400 . 5.000 3.832 3.643 3.993 . 0 0 "[ . 1 .]" 1
279 2 10 PHE HA 2 13 ALA MB 3.150 . 4.500 3.451 3.020 3.752 . 0 0 "[ . 1 .]" 1
280 2 10 PHE HB2 2 10 PHE QD 3.150 . 4.500 2.535 2.279 2.744 . 0 0 "[ . 1 .]" 1
281 2 10 PHE HB2 2 11 ASN H 3.400 . 5.000 3.758 3.609 3.917 . 0 0 "[ . 1 .]" 1
282 2 10 PHE HB3 2 10 PHE QD 3.150 . 4.500 2.355 2.261 2.550 . 0 0 "[ . 1 .]" 1
283 2 10 PHE HB3 2 11 ASN H 2.900 . 4.000 2.368 2.164 2.587 . 0 0 "[ . 1 .]" 1
284 2 10 PHE QD 2 11 ASN H 3.900 . 6.000 3.392 2.699 4.269 . 0 0 "[ . 1 .]" 1
285 2 10 PHE QD 2 14 ILE MD 3.600 . 5.400 2.869 1.989 3.308 . 0 0 "[ . 1 .]" 1
286 2 10 PHE QE 2 14 ILE MD 3.600 . 5.400 2.574 1.834 3.236 . 0 0 "[ . 1 .]" 1
287 2 11 ASN H 2 11 ASN HA 2.900 . 4.000 2.790 2.777 2.813 . 0 0 "[ . 1 .]" 1
288 2 11 ASN H 2 11 ASN QB 2.900 . 4.000 2.326 2.236 2.495 . 0 0 "[ . 1 .]" 1
289 2 11 ASN H 2 12 HIS H 3.400 . 5.000 2.748 2.689 2.794 . 0 0 "[ . 1 .]" 1
290 2 11 ASN HA 2 11 ASN QB 2.250 . 2.700 2.360 2.178 2.418 . 0 0 "[ . 1 .]" 1
291 2 11 ASN HA 2 14 ILE H 2.900 . 4.000 3.447 3.243 3.601 . 0 0 "[ . 1 .]" 1
292 2 11 ASN HA 2 14 ILE HB 2.700 . 3.600 1.972 1.800 2.333 . 14 0 "[ . 1 .]" 1
293 2 11 ASN HA 2 14 ILE MD 3.150 . 4.500 3.596 3.188 3.798 . 0 0 "[ . 1 .]" 1
294 2 11 ASN HA 2 14 ILE QG 3.150 . 4.500 2.632 2.405 2.925 . 0 0 "[ . 1 .]" 1
295 2 11 ASN HA 2 14 ILE MG 3.600 . 5.400 2.960 2.689 3.369 . 0 0 "[ . 1 .]" 1
296 2 11 ASN HA 2 15 ASN H 3.400 . 5.000 3.565 3.130 4.000 . 0 0 "[ . 1 .]" 1
297 2 11 ASN QB 2 12 HIS H 3.400 . 5.000 2.854 2.680 3.631 . 0 0 "[ . 1 .]" 1
298 2 12 HIS H 2 12 HIS HB2 2.900 . 4.000 2.431 2.337 2.542 . 0 0 "[ . 1 .]" 1
299 2 12 HIS H 2 12 HIS HB3 2.900 . 4.000 2.641 2.513 2.789 . 0 0 "[ . 1 .]" 1
300 2 12 HIS H 2 13 ALA H 2.900 . 4.000 2.888 2.796 3.029 . 0 0 "[ . 1 .]" 1
301 2 12 HIS HA 2 12 HIS HB2 2.700 . 3.600 2.506 2.436 2.585 . 0 0 "[ . 1 .]" 1
302 2 12 HIS HA 2 12 HIS HB3 2.700 . 3.600 3.025 3.016 3.031 . 0 0 "[ . 1 .]" 1
303 2 12 HIS HA 2 12 HIS HD2 3.150 . 4.500 3.526 2.271 4.551 0.051 11 0 "[ . 1 .]" 1
304 2 12 HIS HA 2 13 ALA H 3.400 . 5.000 3.583 3.572 3.593 . 0 0 "[ . 1 .]" 1
305 2 12 HIS HA 2 15 ASN H 2.900 . 4.000 4.023 3.955 4.063 0.063 14 0 "[ . 1 .]" 1
306 2 12 HIS HA 2 15 ASN QB 3.150 . 4.500 3.415 3.283 3.575 . 0 0 "[ . 1 .]" 1
307 2 12 HIS HB2 2 12 HIS HD2 3.600 . 5.400 3.211 2.683 3.696 . 0 0 "[ . 1 .]" 1
308 2 12 HIS HB2 2 13 ALA H 2.900 . 4.000 3.676 3.550 3.740 . 0 0 "[ . 1 .]" 1
309 2 12 HIS HB3 2 12 HIS HD2 3.600 . 5.400 3.524 2.678 3.775 . 0 0 "[ . 1 .]" 1
310 2 12 HIS HB3 2 13 ALA H 2.900 . 4.000 2.301 2.207 2.434 . 0 0 "[ . 1 .]" 1
311 2 13 ALA H 2 13 ALA HA 2.900 . 4.000 2.832 2.822 2.847 . 0 0 "[ . 1 .]" 1
312 2 13 ALA H 2 13 ALA MB 2.900 . 4.000 2.082 2.049 2.118 . 0 0 "[ . 1 .]" 1
313 2 13 ALA H 2 14 ILE H 2.900 . 4.000 2.592 2.530 2.645 . 0 0 "[ . 1 .]" 1
314 2 13 ALA HA 2 14 ILE H 3.400 . 5.000 3.516 3.494 3.528 . 0 0 "[ . 1 .]" 1
315 2 13 ALA HA 2 16 TYR H 3.400 . 5.000 3.438 3.354 3.706 . 0 0 "[ . 1 .]" 1
316 2 13 ALA HA 2 16 TYR HB2 3.150 . 4.500 3.208 2.842 3.638 . 0 0 "[ . 1 .]" 1
317 2 13 ALA HA 2 16 TYR HB3 2.700 . 3.600 2.141 1.965 2.549 . 0 0 "[ . 1 .]" 1
318 2 13 ALA HA 2 17 VAL H 3.400 . 5.000 4.058 3.932 4.140 . 0 0 "[ . 1 .]" 1
319 2 13 ALA HA 2 85 PHE HZ 3.150 . 4.500 2.188 1.825 2.684 . 0 0 "[ . 1 .]" 1
320 2 13 ALA MB 2 14 ILE H 2.900 . 4.000 2.633 2.516 2.785 . 0 0 "[ . 1 .]" 1
321 2 13 ALA MB 2 17 VAL MG2 3.150 . 4.500 3.150 3.128 3.174 . 0 0 "[ . 1 .]" 1
322 2 13 ALA MB 2 85 PHE QE 3.600 . 5.400 2.495 1.719 2.958 0.081 10 0 "[ . 1 .]" 1
323 2 14 ILE H 2 14 ILE HA 2.900 . 4.000 2.753 2.741 2.766 . 0 0 "[ . 1 .]" 1
324 2 14 ILE H 2 14 ILE HB 2.400 . 3.000 2.175 2.126 2.229 . 0 0 "[ . 1 .]" 1
325 2 14 ILE H 2 14 ILE MD 3.400 . 5.000 2.103 1.949 2.302 . 0 0 "[ . 1 .]" 1
326 2 14 ILE H 2 14 ILE QG 2.900 . 4.000 3.076 3.020 3.105 . 0 0 "[ . 1 .]" 1
327 2 14 ILE H 2 14 ILE MG 3.400 . 5.000 3.597 3.555 3.642 . 0 0 "[ . 1 .]" 1
328 2 14 ILE H 2 15 ASN H 2.900 . 4.000 3.025 2.976 3.055 . 0 0 "[ . 1 .]" 1
329 2 14 ILE HA 2 14 ILE MD 3.150 . 4.500 1.843 1.648 2.073 0.152 4 0 "[ . 1 .]" 1
330 2 14 ILE HA 2 14 ILE QG 2.700 . 3.600 2.334 2.251 2.391 . 0 0 "[ . 1 .]" 1
331 2 14 ILE HA 2 14 ILE MG 3.150 . 4.500 2.680 2.641 2.714 . 0 0 "[ . 1 .]" 1
332 2 14 ILE HA 2 15 ASN H 3.400 . 5.000 3.568 3.559 3.575 . 0 0 "[ . 1 .]" 1
333 2 14 ILE HA 2 17 VAL H 2.900 . 4.000 3.490 3.383 3.560 . 0 0 "[ . 1 .]" 1
334 2 14 ILE HA 2 17 VAL HB 3.150 . 4.500 3.332 3.192 3.434 . 0 0 "[ . 1 .]" 1
335 2 14 ILE HA 2 17 VAL MG1 3.600 . 5.400 4.498 4.400 4.527 . 0 0 "[ . 1 .]" 1
336 2 14 ILE HA 2 17 VAL MG2 3.150 . 4.500 2.479 2.232 2.826 . 0 0 "[ . 1 .]" 1
337 2 14 ILE HA 2 18 ASN H 3.400 . 5.000 4.551 4.347 4.746 . 0 0 "[ . 1 .]" 1
338 2 14 ILE HB 2 14 ILE MD 3.150 . 4.500 2.636 2.528 2.741 . 0 0 "[ . 1 .]" 1
339 2 14 ILE HB 2 15 ASN H 2.900 . 4.000 2.451 2.355 2.516 . 0 0 "[ . 1 .]" 1
340 2 14 ILE MD 2 14 ILE MG 3.150 . 4.500 3.193 3.150 3.234 . 0 0 "[ . 1 .]" 1
341 2 14 ILE MG 2 15 ASN H 3.400 . 5.000 2.184 2.117 2.262 . 0 0 "[ . 1 .]" 1
342 2 14 ILE MG 2 15 ASN HA 3.150 . 4.500 2.813 2.775 2.851 . 0 0 "[ . 1 .]" 1
343 2 14 ILE MG 2 15 ASN QB 3.150 . 4.500 3.436 3.415 3.469 . 0 0 "[ . 1 .]" 1
344 2 15 ASN H 2 15 ASN HA 2.900 . 4.000 2.801 2.784 2.807 . 0 0 "[ . 1 .]" 1
345 2 15 ASN H 2 15 ASN QB 2.900 . 4.000 2.125 2.081 2.170 . 0 0 "[ . 1 .]" 1
346 2 15 ASN H 2 16 TYR H 2.900 . 4.000 2.652 2.619 2.738 . 0 0 "[ . 1 .]" 1
347 2 15 ASN H 2 17 VAL H 3.400 . 5.000 4.293 4.184 4.404 . 0 0 "[ . 1 .]" 1
348 2 15 ASN HA 2 18 ASN H 3.400 . 5.000 3.202 3.013 3.308 . 0 0 "[ . 1 .]" 1
349 2 15 ASN QB 2 16 TYR H 2.900 . 4.000 2.935 2.899 2.980 . 0 0 "[ . 1 .]" 1
350 2 16 TYR H 2 16 TYR HB2 2.900 . 4.000 2.832 2.638 2.970 . 0 0 "[ . 1 .]" 1
351 2 16 TYR H 2 16 TYR HB3 2.400 . 3.000 2.314 2.211 2.407 . 0 0 "[ . 1 .]" 1
352 2 16 TYR H 2 16 TYR QD 3.400 . 5.000 4.140 4.015 4.197 . 0 0 "[ . 1 .]" 1
353 2 16 TYR H 2 17 VAL H 2.900 . 4.000 2.602 2.544 2.646 . 0 0 "[ . 1 .]" 1
354 2 16 TYR HA 2 16 TYR HB2 2.700 . 3.600 2.362 2.319 2.431 . 0 0 "[ . 1 .]" 1
355 2 16 TYR HA 2 16 TYR HB3 2.700 . 3.600 3.013 2.997 3.031 . 0 0 "[ . 1 .]" 1
356 2 16 TYR HA 2 16 TYR QD 2.700 . 3.600 2.480 2.150 3.230 . 0 0 "[ . 1 .]" 1
357 2 16 TYR HA 2 16 TYR QE 3.600 . 5.400 4.669 4.489 4.869 . 0 0 "[ . 1 .]" 1
358 2 16 TYR HA 2 17 VAL H 2.900 . 4.000 3.562 3.553 3.581 . 0 0 "[ . 1 .]" 1
359 2 16 TYR HA 2 19 LYS H 2.900 . 4.000 3.377 3.173 3.605 . 0 0 "[ . 1 .]" 1
360 2 16 TYR HA 2 19 LYS QB 2.700 . 3.600 3.188 3.033 3.261 . 0 0 "[ . 1 .]" 1
361 2 16 TYR HB2 2 16 TYR QD 3.150 . 4.500 2.661 2.285 2.768 . 0 0 "[ . 1 .]" 1
362 2 16 TYR HB3 2 16 TYR QD 2.700 . 3.600 2.334 2.269 2.691 . 0 0 "[ . 1 .]" 1
363 2 16 TYR HB3 2 17 VAL H 2.900 . 4.000 2.670 2.453 2.808 . 0 0 "[ . 1 .]" 1
364 2 16 TYR QD 2 17 VAL H 3.400 . 5.000 3.624 2.888 3.979 . 0 0 "[ . 1 .]" 1
365 2 16 TYR QD 2 17 VAL MG2 3.600 . 5.400 3.420 2.681 4.006 . 0 0 "[ . 1 .]" 1
366 2 16 TYR QD 2 19 LYS QB 3.150 . 4.500 3.058 2.594 3.650 . 0 0 "[ . 1 .]" 1
367 2 16 TYR QD 2 19 LYS QD 3.150 . 4.500 2.485 2.094 3.577 . 0 0 "[ . 1 .]" 1
368 2 16 TYR QD 2 20 ILE MD 3.600 . 5.400 3.360 2.740 3.647 . 0 0 "[ . 1 .]" 1
369 2 16 TYR QD 2 78 LEU QD 3.600 . 5.400 3.005 2.314 3.492 . 0 0 "[ . 1 .]" 1
370 2 16 TYR QD 2 81 GLU HB2 3.150 . 4.500 3.820 3.515 4.034 . 0 0 "[ . 1 .]" 1
371 2 16 TYR QD 2 81 GLU QG 3.600 . 5.400 2.403 1.766 2.861 0.034 15 0 "[ . 1 .]" 1
372 2 16 TYR QE 2 20 ILE MD 3.600 . 5.400 2.578 1.570 2.855 0.230 15 0 "[ . 1 .]" 1
373 2 16 TYR QE 2 78 LEU HA 2.700 . 3.600 2.593 1.982 3.231 . 0 0 "[ . 1 .]" 1
374 2 16 TYR QE 2 78 LEU HB2 3.600 . 5.400 4.124 3.530 4.780 . 0 0 "[ . 1 .]" 1
375 2 16 TYR QE 2 78 LEU HB3 3.600 . 5.400 2.633 2.014 3.405 . 0 0 "[ . 1 .]" 1
376 2 16 TYR QE 2 78 LEU QD 3.600 . 5.400 2.484 1.851 2.978 . 0 0 "[ . 1 .]" 1
377 2 16 TYR QE 2 81 GLU H 3.400 . 5.000 4.222 3.722 4.482 . 0 0 "[ . 1 .]" 1
378 2 16 TYR QE 2 81 GLU HB2 3.150 . 4.500 3.787 3.109 4.033 . 0 0 "[ . 1 .]" 1
379 2 16 TYR QE 2 81 GLU HB3 3.150 . 4.500 2.568 1.724 2.864 0.076 15 0 "[ . 1 .]" 1
380 2 16 TYR QE 2 81 GLU QG 3.150 . 4.500 3.351 2.684 3.598 . 0 0 "[ . 1 .]" 1
381 2 16 TYR QE 2 82 PHE H 3.400 . 5.000 3.454 2.332 3.706 . 0 0 "[ . 1 .]" 1
382 2 16 TYR QE 2 82 PHE QD 3.150 . 4.500 2.492 1.662 3.581 0.138 3 0 "[ . 1 .]" 1
383 2 17 VAL H 2 17 VAL HB 2.900 . 4.000 2.690 2.567 2.761 . 0 0 "[ . 1 .]" 1
384 2 17 VAL H 2 17 VAL MG1 3.400 . 5.000 3.783 3.770 3.791 . 0 0 "[ . 1 .]" 1
385 2 17 VAL H 2 17 VAL MG2 2.900 . 4.000 2.127 2.008 2.240 . 0 0 "[ . 1 .]" 1
386 2 17 VAL HA 2 17 VAL HB 2.700 . 3.600 3.020 3.010 3.029 . 0 0 "[ . 1 .]" 1
387 2 17 VAL HA 2 17 VAL MG1 2.700 . 3.600 2.281 2.227 2.366 . 0 0 "[ . 1 .]" 1
388 2 17 VAL HA 2 17 VAL MG2 2.700 . 3.600 2.443 2.363 2.508 . 0 0 "[ . 1 .]" 1
389 2 17 VAL HA 2 18 ASN H 3.400 . 5.000 3.528 3.520 3.540 . 0 0 "[ . 1 .]" 1
390 2 17 VAL HA 2 19 LYS H 3.400 . 5.000 4.294 3.980 4.587 . 0 0 "[ . 1 .]" 1
391 2 17 VAL HA 2 20 ILE H 2.900 . 4.000 3.393 3.300 3.495 . 0 0 "[ . 1 .]" 1
392 2 17 VAL HA 2 20 ILE HB 2.700 . 3.600 2.760 2.349 3.186 . 0 0 "[ . 1 .]" 1
393 2 17 VAL HA 2 20 ILE MD 2.700 . 3.600 2.658 2.356 2.848 . 0 0 "[ . 1 .]" 1
394 2 17 VAL HA 2 21 LYS H 3.400 . 5.000 3.831 3.727 3.991 . 0 0 "[ . 1 .]" 1
395 2 17 VAL HB 2 18 ASN H 2.900 . 4.000 2.691 2.563 2.795 . 0 0 "[ . 1 .]" 1
396 2 17 VAL MG1 2 18 ASN H 3.400 . 5.000 3.693 3.511 3.788 . 0 0 "[ . 1 .]" 1
397 2 17 VAL MG1 2 18 ASN HA 3.600 . 5.400 3.762 3.542 3.887 . 0 0 "[ . 1 .]" 1
398 2 17 VAL MG1 2 20 ILE MD 3.600 . 5.400 3.490 3.229 3.728 . 0 0 "[ . 1 .]" 1
399 2 17 VAL MG1 2 21 LYS HB2 2.700 . 3.600 2.751 2.635 2.838 . 0 0 "[ . 1 .]" 1
400 2 17 VAL MG1 2 21 LYS HB3 3.150 . 4.500 3.770 3.633 3.797 . 0 0 "[ . 1 .]" 1
401 2 17 VAL MG1 2 21 LYS QD 3.150 . 4.500 3.375 3.362 3.397 . 0 0 "[ . 1 .]" 1
402 2 17 VAL MG1 2 31 TYR QD 3.600 . 5.400 3.738 3.563 4.044 . 0 0 "[ . 1 .]" 1
403 2 17 VAL MG1 2 31 TYR QE 3.150 . 4.500 1.893 1.653 2.246 0.147 9 0 "[ . 1 .]" 1
404 2 17 VAL MG1 2 35 LEU QD 3.600 . 5.400 3.049 2.781 3.279 . 0 0 "[ . 1 .]" 1
405 2 17 VAL MG2 2 18 ASN H 3.900 . 6.000 3.744 3.634 3.863 . 0 0 "[ . 1 .]" 1
406 2 17 VAL MG2 2 20 ILE MD 3.600 . 5.400 3.644 3.272 3.774 . 0 0 "[ . 1 .]" 1
407 2 18 ASN H 2 18 ASN HA 2.900 . 4.000 2.786 2.768 2.807 . 0 0 "[ . 1 .]" 1
408 2 18 ASN H 2 18 ASN HB2 2.400 . 3.000 2.470 2.335 2.563 . 0 0 "[ . 1 .]" 1
409 2 18 ASN H 2 18 ASN HB3 2.900 . 4.000 2.591 2.499 2.699 . 0 0 "[ . 1 .]" 1
410 2 18 ASN H 2 19 LYS H 2.900 . 4.000 2.764 2.669 2.833 . 0 0 "[ . 1 .]" 1
411 2 18 ASN HA 2 18 ASN HB2 2.250 . 2.700 2.484 2.433 2.539 . 0 0 "[ . 1 .]" 1
412 2 18 ASN HA 2 21 LYS H 2.900 . 4.000 3.546 3.441 3.686 . 0 0 "[ . 1 .]" 1
413 2 18 ASN HA 2 21 LYS HB2 2.700 . 3.600 3.510 3.255 3.621 0.021 9 0 "[ . 1 .]" 1
414 2 18 ASN HA 2 21 LYS HB3 2.700 . 3.600 2.464 2.207 2.630 . 0 0 "[ . 1 .]" 1
415 2 18 ASN HB2 2 19 LYS H 2.900 . 4.000 3.849 3.744 3.984 . 0 0 "[ . 1 .]" 1
416 2 18 ASN HB3 2 19 LYS H 2.900 . 4.000 2.574 2.365 2.808 . 0 0 "[ . 1 .]" 1
417 2 19 LYS H 2 19 LYS QB 2.400 . 3.000 2.385 2.209 2.526 . 0 0 "[ . 1 .]" 1
418 2 19 LYS H 2 19 LYS QG 2.900 . 4.000 2.386 2.053 2.811 . 0 0 "[ . 1 .]" 1
419 2 19 LYS H 2 21 LYS H 3.400 . 5.000 4.345 4.176 4.455 . 0 0 "[ . 1 .]" 1
420 2 19 LYS HA 2 19 LYS QG 2.700 . 3.600 2.419 2.320 2.507 . 0 0 "[ . 1 .]" 1
421 2 19 LYS HA 2 20 ILE H 3.400 . 5.000 3.531 3.499 3.551 . 0 0 "[ . 1 .]" 1
422 2 19 LYS HA 2 21 LYS H 3.900 . 6.000 4.967 4.846 5.091 . 0 0 "[ . 1 .]" 1
423 2 19 LYS HA 2 22 ASN H 2.900 . 4.000 3.969 3.903 4.023 0.023 4 0 "[ . 1 .]" 1
424 2 19 LYS HA 2 22 ASN HB2 2.700 . 3.600 3.050 2.946 3.196 . 0 0 "[ . 1 .]" 1
425 2 19 LYS HA 2 22 ASN HB3 3.150 . 4.500 4.541 4.522 4.553 0.053 11 0 "[ . 1 .]" 1
426 2 19 LYS QB 2 19 LYS QD 2.700 . 3.600 2.213 2.090 2.313 . 0 0 "[ . 1 .]" 1
427 2 19 LYS QB 2 20 ILE H 2.900 . 4.000 2.294 2.218 2.378 . 0 0 "[ . 1 .]" 1
428 2 19 LYS QB 2 20 ILE MD 3.600 . 5.400 4.045 4.023 4.069 . 0 0 "[ . 1 .]" 1
429 2 19 LYS QB 2 78 LEU QD 3.150 . 4.500 1.610 1.527 1.710 0.273 3 0 "[ . 1 .]" 1
430 2 19 LYS HB2 2 78 LEU QD 3.600 . 5.400 2.250 1.956 2.647 . 0 0 "[ . 1 .]" 1
431 2 19 LYS HB3 2 19 LYS QE 3.150 . 4.500 2.376 2.050 3.803 . 0 0 "[ . 1 .]" 1
432 2 19 LYS HB3 2 78 LEU QD 3.600 . 5.400 1.658 1.537 1.750 0.263 3 0 "[ . 1 .]" 1
433 2 19 LYS QD 2 19 LYS QG 2.250 . 2.700 2.026 2.011 2.085 . 0 0 "[ . 1 .]" 1
434 2 19 LYS QD 2 78 LEU QD 3.150 . 4.500 2.559 1.723 2.998 0.077 7 0 "[ . 1 .]" 1
435 2 19 LYS QE 2 19 LYS QG 2.700 . 3.600 2.435 2.238 2.750 . 0 0 "[ . 1 .]" 1
436 2 19 LYS QE 2 78 LEU QD 3.150 . 4.500 1.820 1.566 3.018 0.234 2 0 "[ . 1 .]" 1
437 2 19 LYS QG 2 20 ILE H 3.400 . 5.000 4.048 3.834 4.217 . 0 0 "[ . 1 .]" 1
438 2 19 LYS QG 2 78 LEU QD 3.150 . 4.500 3.036 2.983 3.062 . 0 0 "[ . 1 .]" 1
439 2 20 ILE H 2 20 ILE HA 2.900 . 4.000 2.806 2.792 2.824 . 0 0 "[ . 1 .]" 1
440 2 20 ILE H 2 20 ILE HB 2.400 . 3.000 2.418 2.284 2.533 . 0 0 "[ . 1 .]" 1
441 2 20 ILE H 2 20 ILE MD 3.400 . 5.000 3.386 3.256 3.501 . 0 0 "[ . 1 .]" 1
442 2 20 ILE H 2 20 ILE QG 2.400 . 3.000 2.051 1.858 2.174 . 0 0 "[ . 1 .]" 1
443 2 20 ILE H 2 20 ILE MG 3.400 . 5.000 3.720 3.675 3.754 . 0 0 "[ . 1 .]" 1
444 2 20 ILE H 2 21 LYS H 2.900 . 4.000 2.804 2.729 2.846 . 0 0 "[ . 1 .]" 1
445 2 20 ILE HA 2 20 ILE MD 3.600 . 5.400 3.818 3.747 3.874 . 0 0 "[ . 1 .]" 1
446 2 20 ILE HA 2 20 ILE QG 2.700 . 3.600 2.159 2.118 2.191 . 0 0 "[ . 1 .]" 1
447 2 20 ILE HA 2 20 ILE MG 2.700 . 3.600 2.499 2.403 2.580 . 0 0 "[ . 1 .]" 1
448 2 20 ILE HA 2 23 ARG H 3.400 . 5.000 3.674 3.372 4.050 . 0 0 "[ . 1 .]" 1
449 2 20 ILE HA 2 24 PHE QD 3.600 . 5.400 3.031 1.994 4.222 . 0 0 "[ . 1 .]" 1
450 2 20 ILE HA 2 78 LEU QD 3.150 . 4.500 2.314 1.691 2.642 0.109 2 0 "[ . 1 .]" 1
451 2 20 ILE HB 2 20 ILE MD 3.150 . 4.500 2.372 2.257 2.443 . 0 0 "[ . 1 .]" 1
452 2 20 ILE HB 2 21 LYS H 2.900 . 4.000 2.306 2.184 2.394 . 0 0 "[ . 1 .]" 1
453 2 20 ILE HB 2 31 TYR QD 3.600 . 5.400 3.743 3.042 4.306 . 0 0 "[ . 1 .]" 1
454 2 20 ILE HB 2 31 TYR QE 3.600 . 5.400 3.161 2.795 3.697 . 0 0 "[ . 1 .]" 1
455 2 20 ILE MD 2 20 ILE MG 3.150 . 4.500 2.128 1.989 2.265 . 0 0 "[ . 1 .]" 1
456 2 20 ILE MD 2 21 LYS H 3.900 . 6.000 4.293 4.132 4.419 . 0 0 "[ . 1 .]" 1
457 2 20 ILE MD 2 24 PHE HZ 3.600 . 5.400 4.551 4.501 4.593 . 0 0 "[ . 1 .]" 1
458 2 20 ILE MD 2 34 PHE QE 3.150 . 4.500 2.467 1.692 3.275 0.108 14 0 "[ . 1 .]" 1
459 2 20 ILE MD 2 72 PHE QE 3.600 . 5.400 2.054 1.609 2.596 0.191 12 0 "[ . 1 .]" 1
460 2 20 ILE MD 2 72 PHE HZ 3.600 . 5.400 1.902 1.674 2.253 0.126 15 0 "[ . 1 .]" 1
461 2 20 ILE MD 2 78 LEU QD 3.600 . 5.400 3.056 2.556 3.345 . 0 0 "[ . 1 .]" 1
462 2 20 ILE QG 2 21 LYS H 3.400 . 5.000 3.005 2.882 3.176 . 0 0 "[ . 1 .]" 1
463 2 20 ILE QG 2 24 PHE QE 3.600 . 5.400 1.897 1.526 2.608 0.274 1 0 "[ . 1 .]" 1
464 2 20 ILE QG 2 78 LEU QD 3.150 . 4.500 1.858 1.603 2.049 0.197 8 0 "[ . 1 .]" 1
465 2 20 ILE MG 2 21 LYS H 3.400 . 5.000 3.119 2.954 3.352 . 0 0 "[ . 1 .]" 1
466 2 20 ILE MG 2 24 PHE H 3.900 . 6.000 3.812 3.451 4.167 . 0 0 "[ . 1 .]" 1
467 2 20 ILE MG 2 24 PHE QD 3.150 . 4.500 2.198 1.577 2.866 0.223 1 0 "[ . 1 .]" 1
468 2 20 ILE MG 2 24 PHE QE 3.600 . 5.400 2.066 1.544 3.142 0.256 14 0 "[ . 1 .]" 1
469 2 20 ILE MG 2 31 TYR QD 3.150 . 4.500 2.270 1.942 2.590 . 0 0 "[ . 1 .]" 1
470 2 20 ILE MG 2 31 TYR QE 3.150 . 4.500 3.171 2.740 3.358 . 0 0 "[ . 1 .]" 1
471 2 20 ILE MG 2 72 PHE QE 3.150 . 4.500 2.621 1.845 3.020 . 0 0 "[ . 1 .]" 1
472 2 20 ILE MG 2 72 PHE HZ 3.600 . 5.400 2.112 1.677 2.560 0.123 14 0 "[ . 1 .]" 1
473 2 20 ILE MG 2 78 LEU QD 3.600 . 5.400 3.290 2.814 3.372 . 0 0 "[ . 1 .]" 1
474 2 21 LYS H 2 21 LYS HB2 2.900 . 4.000 2.412 2.353 2.500 . 0 0 "[ . 1 .]" 1
475 2 21 LYS H 2 21 LYS HB3 2.900 . 4.000 2.561 2.500 2.613 . 0 0 "[ . 1 .]" 1
476 2 21 LYS H 2 21 LYS QD 3.400 . 5.000 4.395 4.259 4.503 . 0 0 "[ . 1 .]" 1
477 2 21 LYS H 2 21 LYS QG 3.400 . 5.000 3.944 3.925 3.971 . 0 0 "[ . 1 .]" 1
478 2 21 LYS H 2 22 ASN H 2.900 . 4.000 2.880 2.805 2.957 . 0 0 "[ . 1 .]" 1
479 2 21 LYS H 2 31 TYR QE 3.400 . 5.000 2.959 2.672 3.730 . 0 0 "[ . 1 .]" 1
480 2 21 LYS HA 2 21 LYS HB2 2.700 . 3.600 2.463 2.438 2.492 . 0 0 "[ . 1 .]" 1
481 2 21 LYS HA 2 21 LYS HB3 2.700 . 3.600 3.023 3.018 3.026 . 0 0 "[ . 1 .]" 1
482 2 21 LYS HA 2 21 LYS QG 2.700 . 3.600 2.452 2.400 2.514 . 0 0 "[ . 1 .]" 1
483 2 21 LYS HA 2 22 ASN H 2.900 . 4.000 3.558 3.541 3.581 . 0 0 "[ . 1 .]" 1
484 2 21 LYS HA 2 24 PHE H 2.900 . 4.000 3.969 3.599 4.061 0.061 3 0 "[ . 1 .]" 1
485 2 21 LYS HA 2 31 TYR QD 3.150 . 4.500 3.085 2.740 3.487 . 0 0 "[ . 1 .]" 1
486 2 21 LYS HA 2 31 TYR QE 3.600 . 5.400 3.391 3.075 3.764 . 0 0 "[ . 1 .]" 1
487 2 21 LYS HB2 2 21 LYS QE 3.150 . 4.500 3.571 2.905 4.094 . 0 0 "[ . 1 .]" 1
488 2 21 LYS HB2 2 22 ASN H 2.900 . 4.000 3.773 3.682 3.852 . 0 0 "[ . 1 .]" 1
489 2 21 LYS HB2 2 31 TYR QE 3.150 . 4.500 2.361 2.087 2.933 . 0 0 "[ . 1 .]" 1
490 2 21 LYS HB3 2 21 LYS QD 2.700 . 3.600 2.607 2.285 2.841 . 0 0 "[ . 1 .]" 1
491 2 21 LYS HB3 2 21 LYS QE 3.150 . 4.500 3.085 1.937 4.106 . 0 0 "[ . 1 .]" 1
492 2 21 LYS HB3 2 22 ASN H 2.900 . 4.000 2.430 2.281 2.521 . 0 0 "[ . 1 .]" 1
493 2 21 LYS QD 2 31 TYR QD 3.600 . 5.400 4.240 3.880 4.310 . 0 0 "[ . 1 .]" 1
494 2 21 LYS QD 2 31 TYR QE 3.600 . 5.400 2.772 2.293 2.957 . 0 0 "[ . 1 .]" 1
495 2 21 LYS QE 2 21 LYS QG 3.150 . 4.500 2.442 2.233 2.747 . 0 0 "[ . 1 .]" 1
496 2 21 LYS QE 2 31 TYR QE 3.600 . 5.400 3.995 2.749 4.324 . 0 0 "[ . 1 .]" 1
497 2 21 LYS QG 2 22 ASN H 3.400 . 5.000 3.516 3.384 3.686 . 0 0 "[ . 1 .]" 1
498 2 21 LYS QG 2 31 TYR QD 3.600 . 5.400 3.556 3.035 4.047 . 0 0 "[ . 1 .]" 1
499 2 22 ASN H 2 22 ASN HA 2.900 . 4.000 2.841 2.820 2.855 . 0 0 "[ . 1 .]" 1
500 2 22 ASN H 2 22 ASN HB2 2.400 . 3.000 2.307 2.216 2.389 . 0 0 "[ . 1 .]" 1
501 2 22 ASN H 2 22 ASN HB3 2.900 . 4.000 3.554 3.517 3.580 . 0 0 "[ . 1 .]" 1
502 2 22 ASN H 2 24 PHE H 3.900 . 6.000 4.168 3.963 4.411 . 0 0 "[ . 1 .]" 1
503 2 22 ASN HA 2 22 ASN HB3 2.700 . 3.600 2.582 2.527 2.643 . 0 0 "[ . 1 .]" 1
504 2 22 ASN HA 2 23 ARG H 3.400 . 5.000 3.565 3.543 3.581 . 0 0 "[ . 1 .]" 1
505 2 22 ASN HA 2 24 PHE H 3.400 . 5.000 4.521 4.165 4.816 . 0 0 "[ . 1 .]" 1
506 2 22 ASN HA 2 25 GLN H 2.900 . 4.000 3.918 3.709 4.024 0.024 8 0 "[ . 1 .]" 1
507 2 22 ASN HA 2 25 GLN QB 3.150 . 4.500 3.667 2.644 4.032 . 0 0 "[ . 1 .]" 1
508 2 22 ASN HA 2 25 GLN QG 3.150 . 4.500 2.436 1.785 4.050 0.015 12 0 "[ . 1 .]" 1
509 2 22 ASN HB2 2 23 ARG H 2.900 . 4.000 2.517 2.306 2.667 . 0 0 "[ . 1 .]" 1
510 2 22 ASN HB3 2 23 ARG H 2.900 . 4.000 3.277 3.105 3.431 . 0 0 "[ . 1 .]" 1
511 2 23 ARG H 2 23 ARG HA 2.900 . 4.000 2.781 2.773 2.796 . 0 0 "[ . 1 .]" 1
512 2 23 ARG H 2 23 ARG HB2 2.900 . 4.000 2.438 2.214 2.537 . 0 0 "[ . 1 .]" 1
513 2 23 ARG H 2 23 ARG HB3 2.900 . 4.000 2.624 2.466 2.884 . 0 0 "[ . 1 .]" 1
514 2 23 ARG H 2 23 ARG QG 3.400 . 5.000 4.020 3.843 4.066 . 0 0 "[ . 1 .]" 1
515 2 23 ARG H 2 24 PHE H 2.900 . 4.000 2.830 2.675 2.921 . 0 0 "[ . 1 .]" 1
516 2 23 ARG HA 2 23 ARG HB2 2.700 . 3.600 2.489 2.416 2.648 . 0 0 "[ . 1 .]" 1
517 2 23 ARG HA 2 23 ARG HB3 2.700 . 3.600 3.021 3.000 3.027 . 0 0 "[ . 1 .]" 1
518 2 23 ARG HA 2 23 ARG QD 2.700 . 3.600 2.315 1.944 3.147 . 0 0 "[ . 1 .]" 1
519 2 23 ARG HA 2 23 ARG QG 3.150 . 4.500 2.837 2.284 3.012 . 0 0 "[ . 1 .]" 1
520 2 23 ARG HA 2 24 PHE H 2.900 . 4.000 3.567 3.535 3.597 . 0 0 "[ . 1 .]" 1
521 2 23 ARG HB2 2 24 PHE H 2.900 . 4.000 3.843 3.623 4.008 0.008 15 0 "[ . 1 .]" 1
522 2 23 ARG HB3 2 24 PHE H 2.900 . 4.000 2.585 2.349 2.757 . 0 0 "[ . 1 .]" 1
523 2 23 ARG QG 2 24 PHE QE 3.600 . 5.400 3.012 1.914 3.856 . 0 0 "[ . 1 .]" 1
524 2 23 ARG QG 2 78 LEU QD 3.150 . 4.500 2.513 1.945 2.990 . 0 0 "[ . 1 .]" 1
525 2 24 PHE H 2 24 PHE HA 2.900 . 4.000 2.933 2.926 2.939 . 0 0 "[ . 1 .]" 1
526 2 24 PHE H 2 24 PHE HB2 2.900 . 4.000 2.808 2.620 2.960 . 0 0 "[ . 1 .]" 1
527 2 24 PHE H 2 24 PHE HB3 2.900 . 4.000 3.720 3.699 3.761 . 0 0 "[ . 1 .]" 1
528 2 24 PHE H 2 25 GLN H 2.900 . 4.000 2.961 2.754 3.157 . 0 0 "[ . 1 .]" 1
529 2 24 PHE HA 2 24 PHE HB2 2.700 . 3.600 3.008 2.978 3.025 . 0 0 "[ . 1 .]" 1
530 2 24 PHE HA 2 24 PHE HB3 2.700 . 3.600 2.343 2.284 2.409 . 0 0 "[ . 1 .]" 1
531 2 24 PHE HA 2 24 PHE QD 2.700 . 3.600 2.832 2.202 3.276 . 0 0 "[ . 1 .]" 1
532 2 24 PHE HA 2 25 GLN H 2.900 . 4.000 2.871 2.734 3.026 . 0 0 "[ . 1 .]" 1
533 2 24 PHE HB2 2 24 PHE QD 2.700 . 3.600 2.433 2.241 2.740 . 0 0 "[ . 1 .]" 1
534 2 24 PHE HB2 2 30 ILE H 3.400 . 5.000 5.056 4.957 5.141 0.141 15 0 "[ . 1 .]" 1
535 2 24 PHE HB2 2 31 TYR H 3.400 . 5.000 3.928 3.505 4.178 . 0 0 "[ . 1 .]" 1
536 2 24 PHE HB3 2 24 PHE QD 2.700 . 3.600 2.499 2.246 2.744 . 0 0 "[ . 1 .]" 1
537 2 24 PHE HB3 2 25 GLN H 3.400 . 5.000 4.557 4.522 4.588 . 0 0 "[ . 1 .]" 1
538 2 24 PHE HB3 2 30 ILE HB 3.150 . 4.500 2.796 2.163 3.465 . 0 0 "[ . 1 .]" 1
539 2 24 PHE HB3 2 31 TYR H 3.400 . 5.000 4.354 3.331 5.023 0.023 11 0 "[ . 1 .]" 1
540 2 24 PHE QD 2 27 GLN H 3.900 . 6.000 5.090 4.452 5.401 . 0 0 "[ . 1 .]" 1
541 2 24 PHE QD 2 27 GLN HB2 3.150 . 4.500 3.266 2.973 3.504 . 0 0 "[ . 1 .]" 1
542 2 24 PHE QD 2 27 GLN HB3 3.150 . 4.500 4.016 3.757 4.067 . 0 0 "[ . 1 .]" 1
543 2 24 PHE QD 2 30 ILE QG 3.600 . 5.400 2.125 1.531 2.955 0.269 5 0 "[ . 1 .]" 1
544 2 24 PHE QD 2 30 ILE MG 3.600 . 5.400 2.271 1.837 3.052 . 0 0 "[ . 1 .]" 1
545 2 24 PHE QE 2 30 ILE QG 3.600 . 5.400 2.488 1.895 3.206 . 0 0 "[ . 1 .]" 1
546 2 24 PHE QE 2 30 ILE MG 3.150 . 4.500 2.517 1.897 3.246 . 0 0 "[ . 1 .]" 1
547 2 24 PHE QE 2 78 LEU QD 3.600 . 5.400 2.395 1.712 3.334 0.088 5 0 "[ . 1 .]" 1
548 2 24 PHE HZ 2 72 PHE HA 2.700 . 3.600 3.316 2.940 3.645 0.045 14 0 "[ . 1 .]" 1
549 2 24 PHE HZ 2 75 GLN QG 3.150 . 4.500 2.289 1.638 3.772 0.162 15 0 "[ . 1 .]" 1
550 2 25 GLN H 2 25 GLN HA 2.900 . 4.000 2.751 2.725 2.768 . 0 0 "[ . 1 .]" 1
551 2 25 GLN H 2 25 GLN QB 2.400 . 3.000 2.317 2.052 2.681 . 0 0 "[ . 1 .]" 1
552 2 25 GLN H 2 25 GLN QG 2.900 . 4.000 2.613 1.857 3.640 . 0 0 "[ . 1 .]" 1
553 2 25 GLN H 2 26 GLY H 2.900 . 4.000 2.860 2.799 2.998 . 0 0 "[ . 1 .]" 1
554 2 25 GLN HA 2 25 GLN QG 2.700 . 3.600 2.618 2.281 3.299 . 0 0 "[ . 1 .]" 1
555 2 25 GLN HA 2 26 GLY H 2.900 . 4.000 3.532 3.504 3.580 . 0 0 "[ . 1 .]" 1
556 2 25 GLN HA 2 27 GLN H 3.400 . 5.000 3.901 3.587 4.165 . 0 0 "[ . 1 .]" 1
557 2 25 GLN QB 2 25 GLN QG 2.250 . 2.700 2.042 1.985 2.086 . 0 0 "[ . 1 .]" 1
558 2 25 GLN QB 2 26 GLY H 2.900 . 4.000 2.893 2.313 3.530 . 0 0 "[ . 1 .]" 1
559 2 26 GLY H 2 27 GLN H 2.900 . 4.000 2.578 2.380 2.894 . 0 0 "[ . 1 .]" 1
560 2 26 GLY H 2 27 GLN QG 2.900 . 4.000 3.597 3.569 3.647 . 0 0 "[ . 1 .]" 1
561 2 26 GLY QA 2 27 GLN H 2.900 . 4.000 2.865 2.759 2.948 . 0 0 "[ . 1 .]" 1
562 2 27 GLN H 2 27 GLN HA 2.900 . 4.000 2.936 2.928 2.948 . 0 0 "[ . 1 .]" 1
563 2 27 GLN H 2 27 GLN HB2 2.900 . 4.000 2.643 2.504 2.890 . 0 0 "[ . 1 .]" 1
564 2 27 GLN H 2 27 GLN HB3 2.900 . 4.000 3.731 3.693 3.883 . 0 0 "[ . 1 .]" 1
565 2 27 GLN H 2 27 GLN QG 3.400 . 5.000 2.775 2.227 3.232 . 0 0 "[ . 1 .]" 1
566 2 27 GLN H 2 28 PRO HA 3.400 . 5.000 4.666 4.285 4.896 . 0 0 "[ . 1 .]" 1
567 2 27 GLN H 2 28 PRO QD 2.900 . 4.000 3.286 2.654 3.579 . 0 0 "[ . 1 .]" 1
568 2 27 GLN HA 2 27 GLN HB2 2.700 . 3.600 3.006 2.996 3.014 . 0 0 "[ . 1 .]" 1
569 2 27 GLN HA 2 27 GLN HB3 2.700 . 3.600 2.453 2.326 2.568 . 0 0 "[ . 1 .]" 1
570 2 27 GLN HA 2 27 GLN QG 2.700 . 3.600 2.958 2.370 3.205 . 0 0 "[ . 1 .]" 1
571 2 27 GLN HA 2 28 PRO QD 2.700 . 3.600 2.089 2.015 2.230 . 0 0 "[ . 1 .]" 1
572 2 27 GLN HA 2 29 ASP H 2.900 . 4.000 3.210 3.118 3.337 . 0 0 "[ . 1 .]" 1
573 2 27 GLN HA 2 30 ILE H 3.900 . 6.000 3.913 3.736 4.004 . 0 0 "[ . 1 .]" 1
574 2 27 GLN HB2 2 27 GLN QG 2.250 . 2.700 2.183 2.133 2.452 . 0 0 "[ . 1 .]" 1
575 2 27 GLN HB2 2 30 ILE H 2.900 . 4.000 3.600 3.004 4.055 0.055 14 0 "[ . 1 .]" 1
576 2 27 GLN HB2 2 30 ILE HB 3.150 . 4.500 2.824 2.547 3.156 . 0 0 "[ . 1 .]" 1
577 2 27 GLN HB2 2 30 ILE MD 3.150 . 4.500 2.642 1.894 3.681 . 0 0 "[ . 1 .]" 1
578 2 27 GLN HB2 2 31 TYR H 3.400 . 5.000 4.145 4.007 4.442 . 0 0 "[ . 1 .]" 1
579 2 27 GLN HB3 2 27 GLN QG 2.250 . 2.700 2.294 2.158 2.324 . 0 0 "[ . 1 .]" 1
580 2 27 GLN HB3 2 29 ASP H 3.400 . 5.000 3.766 3.558 4.044 . 0 0 "[ . 1 .]" 1
581 2 27 GLN HB3 2 30 ILE H 2.900 . 4.000 2.718 2.563 2.937 . 0 0 "[ . 1 .]" 1
582 2 27 GLN HB3 2 30 ILE HB 3.150 . 4.500 2.945 2.227 3.714 . 0 0 "[ . 1 .]" 1
583 2 27 GLN HB3 2 30 ILE MD 3.150 . 4.500 2.352 2.033 2.902 . 0 0 "[ . 1 .]" 1
584 2 27 GLN HB3 2 30 ILE QG 3.150 . 4.500 1.770 1.532 2.054 0.268 3 0 "[ . 1 .]" 1
585 2 27 GLN QG 2 30 ILE HB 3.150 . 4.500 4.066 4.020 4.151 . 0 0 "[ . 1 .]" 1
586 2 27 GLN QG 2 30 ILE MD 3.150 . 4.500 2.313 1.752 3.392 0.048 15 0 "[ . 1 .]" 1
587 2 27 GLN QG 2 30 ILE QG 3.150 . 4.500 2.913 2.389 3.127 . 0 0 "[ . 1 .]" 1
588 2 28 PRO HA 2 29 ASP H 2.900 . 4.000 3.495 3.476 3.514 . 0 0 "[ . 1 .]" 1
589 2 28 PRO HA 2 30 ILE H 3.400 . 5.000 4.182 4.064 4.328 . 0 0 "[ . 1 .]" 1
590 2 28 PRO HA 2 31 TYR H 2.900 . 4.000 3.628 3.521 3.697 . 0 0 "[ . 1 .]" 1
591 2 28 PRO HA 2 31 TYR HB2 2.700 . 3.600 3.612 3.519 3.639 0.039 2 0 "[ . 1 .]" 1
592 2 28 PRO QB 2 28 PRO QD 3.150 . 4.500 2.781 2.757 2.864 . 0 0 "[ . 1 .]" 1
593 2 28 PRO QB 2 29 ASP H 3.400 . 5.000 3.296 3.022 3.392 . 0 0 "[ . 1 .]" 1
594 2 28 PRO QD 2 28 PRO QG 2.250 . 2.700 1.967 1.957 1.972 . 0 0 "[ . 1 .]" 1
595 2 28 PRO QD 2 29 ASP H 2.900 . 4.000 2.675 2.207 2.958 . 0 0 "[ . 1 .]" 1
596 2 28 PRO QG 2 29 ASP H 2.900 . 4.000 2.779 2.564 3.598 . 0 0 "[ . 1 .]" 1
597 2 29 ASP H 2 29 ASP HA 2.900 . 4.000 2.839 2.834 2.849 . 0 0 "[ . 1 .]" 1
598 2 29 ASP H 2 29 ASP HB2 2.900 . 4.000 2.479 2.452 2.512 . 0 0 "[ . 1 .]" 1
599 2 29 ASP H 2 29 ASP HB3 2.900 . 4.000 3.591 3.584 3.600 . 0 0 "[ . 1 .]" 1
600 2 29 ASP H 2 30 ILE H 2.900 . 4.000 2.555 2.455 2.600 . 0 0 "[ . 1 .]" 1
601 2 29 ASP H 2 30 ILE QG 3.400 . 5.000 3.879 3.857 3.915 . 0 0 "[ . 1 .]" 1
602 2 29 ASP H 2 32 LYS H 3.400 . 5.000 4.820 4.708 4.935 . 0 0 "[ . 1 .]" 1
603 2 29 ASP HA 2 29 ASP HB2 2.700 . 3.600 3.028 3.025 3.031 . 0 0 "[ . 1 .]" 1
604 2 29 ASP HA 2 29 ASP HB3 2.250 . 2.700 2.475 2.463 2.499 . 0 0 "[ . 1 .]" 1
605 2 29 ASP HA 2 30 ILE H 2.900 . 4.000 3.525 3.499 3.547 . 0 0 "[ . 1 .]" 1
606 2 29 ASP HA 2 32 LYS H 2.900 . 4.000 3.862 3.678 4.027 0.027 8 0 "[ . 1 .]" 1
607 2 29 ASP HA 2 32 LYS QB 2.700 . 3.600 2.853 2.473 3.059 . 0 0 "[ . 1 .]" 1
608 2 29 ASP HA 2 32 LYS QG 3.150 . 4.500 3.854 3.434 4.046 . 0 0 "[ . 1 .]" 1
609 2 29 ASP HA 2 33 ALA H 3.400 . 5.000 3.588 3.479 3.684 . 0 0 "[ . 1 .]" 1
610 2 29 ASP HB2 2 30 ILE H 2.900 . 4.000 2.812 2.695 2.902 . 0 0 "[ . 1 .]" 1
611 2 29 ASP HB3 2 30 ILE H 3.400 . 5.000 3.829 3.722 3.908 . 0 0 "[ . 1 .]" 1
612 2 30 ILE H 2 30 ILE HA 2.900 . 4.000 2.845 2.835 2.857 . 0 0 "[ . 1 .]" 1
613 2 30 ILE H 2 30 ILE HB 2.400 . 3.000 2.533 2.393 2.625 . 0 0 "[ . 1 .]" 1
614 2 30 ILE H 2 30 ILE MD 3.400 . 5.000 3.376 2.739 3.673 . 0 0 "[ . 1 .]" 1
615 2 30 ILE H 2 30 ILE QG 2.400 . 3.000 2.089 2.019 2.228 . 0 0 "[ . 1 .]" 1
616 2 30 ILE H 2 30 ILE MG 3.400 . 5.000 3.763 3.728 3.786 . 0 0 "[ . 1 .]" 1
617 2 30 ILE H 2 31 TYR H 2.900 . 4.000 2.616 2.550 2.688 . 0 0 "[ . 1 .]" 1
618 2 30 ILE H 2 32 LYS H 3.400 . 5.000 4.120 3.914 4.228 . 0 0 "[ . 1 .]" 1
619 2 30 ILE H 2 32 LYS QB 3.900 . 6.000 4.939 4.649 5.125 . 0 0 "[ . 1 .]" 1
620 2 30 ILE HA 2 30 ILE HB 2.700 . 3.600 3.015 3.006 3.026 . 0 0 "[ . 1 .]" 1
621 2 30 ILE HA 2 30 ILE MD 3.150 . 4.500 3.279 1.863 3.800 . 0 0 "[ . 1 .]" 1
622 2 30 ILE HA 2 30 ILE QG 2.700 . 3.600 2.108 2.060 2.217 . 0 0 "[ . 1 .]" 1
623 2 30 ILE HA 2 30 ILE MG 2.700 . 3.600 2.279 2.208 2.420 . 0 0 "[ . 1 .]" 1
624 2 30 ILE HA 2 31 TYR H 2.900 . 4.000 3.529 3.497 3.560 . 0 0 "[ . 1 .]" 1
625 2 30 ILE HA 2 33 ALA MB 2.700 . 3.600 2.576 2.468 2.639 . 0 0 "[ . 1 .]" 1
626 2 30 ILE HA 2 34 PHE H 3.900 . 6.000 3.632 3.457 3.904 . 0 0 "[ . 1 .]" 1
627 2 30 ILE HB 2 30 ILE MD 3.150 . 4.500 2.559 2.310 3.192 . 0 0 "[ . 1 .]" 1
628 2 30 ILE HB 2 30 ILE QG 2.250 . 2.700 1.953 1.895 1.978 . 0 0 "[ . 1 .]" 1
629 2 30 ILE HB 2 31 TYR H 2.900 . 4.000 2.271 2.202 2.340 . 0 0 "[ . 1 .]" 1
630 2 30 ILE MD 2 30 ILE MG 3.150 . 4.500 2.028 1.880 2.309 . 0 0 "[ . 1 .]" 1
631 2 30 ILE MD 2 31 TYR H 3.400 . 5.000 4.263 4.226 4.319 . 0 0 "[ . 1 .]" 1
632 2 30 ILE MD 2 71 LEU HA 3.600 . 5.400 3.538 2.356 4.521 . 0 0 "[ . 1 .]" 1
633 2 30 ILE QG 2 31 TYR H 3.400 . 5.000 3.048 2.863 3.147 . 0 0 "[ . 1 .]" 1
634 2 30 ILE MG 2 31 TYR H 3.400 . 5.000 3.221 2.947 3.412 . 0 0 "[ . 1 .]" 1
635 2 30 ILE MG 2 31 TYR QD 3.600 . 5.400 4.068 4.033 4.094 . 0 0 "[ . 1 .]" 1
636 2 30 ILE MG 2 33 ALA MB 3.600 . 5.400 3.760 3.748 3.781 . 0 0 "[ . 1 .]" 1
637 2 30 ILE MG 2 71 LEU HA 3.600 . 5.400 3.647 3.263 4.182 . 0 0 "[ . 1 .]" 1
638 2 30 ILE MG 2 71 LEU HB2 3.600 . 5.400 3.098 2.699 3.927 . 0 0 "[ . 1 .]" 1
639 2 30 ILE MG 2 71 LEU HB3 3.600 . 5.400 1.851 1.645 2.515 0.155 10 0 "[ . 1 .]" 1
640 2 30 ILE MG 2 71 LEU QD 3.600 . 5.400 1.900 1.662 2.512 0.138 3 0 "[ . 1 .]" 1
641 2 30 ILE MG 2 71 LEU HG 3.150 . 4.500 3.588 2.762 3.814 . 0 0 "[ . 1 .]" 1
642 2 30 ILE MG 2 72 PHE QD 3.600 . 5.400 3.160 2.644 4.007 . 0 0 "[ . 1 .]" 1
643 2 30 ILE MG 2 72 PHE HZ 3.150 . 4.500 3.787 3.767 3.829 . 0 0 "[ . 1 .]" 1
644 2 31 TYR H 2 31 TYR HA 2.900 . 4.000 2.803 2.790 2.818 . 0 0 "[ . 1 .]" 1
645 2 31 TYR H 2 31 TYR QB 2.900 . 4.000 2.164 2.135 2.204 . 0 0 "[ . 1 .]" 1
646 2 31 TYR H 2 32 LYS H 2.900 . 4.000 2.791 2.709 2.840 . 0 0 "[ . 1 .]" 1
647 2 31 TYR HA 2 31 TYR HB2 2.700 . 3.600 2.629 2.582 2.665 . 0 0 "[ . 1 .]" 1
648 2 31 TYR HA 2 31 TYR HB3 2.700 . 3.600 2.998 2.983 3.013 . 0 0 "[ . 1 .]" 1
649 2 31 TYR HA 2 31 TYR QD 2.700 . 3.600 2.111 1.731 2.373 0.069 4 0 "[ . 1 .]" 1
650 2 31 TYR HA 2 32 LYS H 3.400 . 5.000 3.574 3.557 3.584 . 0 0 "[ . 1 .]" 1
651 2 31 TYR HA 2 34 PHE H 2.900 . 4.000 3.816 3.659 4.032 0.032 9 0 "[ . 1 .]" 1
652 2 31 TYR HA 2 34 PHE HB3 3.150 . 4.500 2.941 2.647 3.213 . 0 0 "[ . 1 .]" 1
653 2 31 TYR HA 2 35 LEU H 3.400 . 5.000 4.163 3.913 4.467 . 0 0 "[ . 1 .]" 1
654 2 31 TYR QB 2 31 TYR QD 2.700 . 3.600 2.181 2.149 2.274 . 0 0 "[ . 1 .]" 1
655 2 31 TYR QB 2 32 LYS H 2.900 . 4.000 2.408 2.342 2.477 . 0 0 "[ . 1 .]" 1
656 2 31 TYR HB2 2 31 TYR QD 2.700 . 3.600 2.696 2.642 2.768 . 0 0 "[ . 1 .]" 1
657 2 31 TYR HB3 2 31 TYR QD 2.700 . 3.600 2.304 2.269 2.421 . 0 0 "[ . 1 .]" 1
658 2 31 TYR QD 2 34 PHE HB3 3.600 . 5.400 4.106 3.299 4.544 . 0 0 "[ . 1 .]" 1
659 2 31 TYR QD 2 35 LEU QD 3.600 . 5.400 3.345 2.782 3.573 . 0 0 "[ . 1 .]" 1
660 2 31 TYR QD 2 35 LEU HG 3.600 . 5.400 4.194 3.778 4.612 . 0 0 "[ . 1 .]" 1
661 2 32 LYS H 2 32 LYS HA 2.900 . 4.000 2.816 2.790 2.823 . 0 0 "[ . 1 .]" 1
662 2 32 LYS H 2 32 LYS QB 2.900 . 4.000 2.319 2.032 2.500 . 0 0 "[ . 1 .]" 1
663 2 32 LYS H 2 32 LYS QG 2.900 . 4.000 2.668 2.177 3.771 . 0 0 "[ . 1 .]" 1
664 2 32 LYS HA 2 32 LYS QG 2.700 . 3.600 2.722 2.398 3.099 . 0 0 "[ . 1 .]" 1
665 2 32 LYS HA 2 34 PHE H 3.400 . 5.000 4.782 4.631 5.011 0.011 9 0 "[ . 1 .]" 1
666 2 32 LYS HA 2 35 LEU H 2.900 . 4.000 3.798 3.616 3.952 . 0 0 "[ . 1 .]" 1
667 2 32 LYS HA 2 35 LEU HB2 3.150 . 4.500 3.144 2.971 3.513 . 0 0 "[ . 1 .]" 1
668 2 32 LYS HA 2 35 LEU QD 3.150 . 4.500 3.082 2.823 3.323 . 0 0 "[ . 1 .]" 1
669 2 32 LYS HA 2 35 LEU HG 3.150 . 4.500 3.651 3.175 4.024 . 0 0 "[ . 1 .]" 1
670 2 32 LYS HA 2 36 GLU H 3.400 . 5.000 4.154 3.862 4.434 . 0 0 "[ . 1 .]" 1
671 2 32 LYS QB 2 32 LYS QD 2.700 . 3.600 2.326 2.113 2.794 . 0 0 "[ . 1 .]" 1
672 2 32 LYS QB 2 32 LYS QG 2.250 . 2.700 2.044 1.980 2.088 . 0 0 "[ . 1 .]" 1
673 2 32 LYS QB 2 33 ALA H 2.900 . 4.000 2.505 2.352 2.792 . 0 0 "[ . 1 .]" 1
674 2 32 LYS QE 2 32 LYS QG 3.150 . 4.500 2.380 2.148 2.802 . 0 0 "[ . 1 .]" 1
675 2 33 ALA H 2 33 ALA HA 2.400 . 3.000 2.791 2.776 2.799 . 0 0 "[ . 1 .]" 1
676 2 33 ALA H 2 33 ALA MB 2.400 . 3.000 2.236 2.204 2.247 . 0 0 "[ . 1 .]" 1
677 2 33 ALA H 2 34 PHE H 2.900 . 4.000 2.857 2.789 2.940 . 0 0 "[ . 1 .]" 1
678 2 33 ALA H 2 71 LEU QD 3.900 . 6.000 3.731 3.256 4.082 . 0 0 "[ . 1 .]" 1
679 2 33 ALA HA 2 34 PHE H 3.400 . 5.000 3.568 3.555 3.582 . 0 0 "[ . 1 .]" 1
680 2 33 ALA HA 2 35 LEU H 3.400 . 5.000 4.582 4.431 4.749 . 0 0 "[ . 1 .]" 1
681 2 33 ALA HA 2 36 GLU QB 2.700 . 3.600 2.632 2.479 2.879 . 0 0 "[ . 1 .]" 1
682 2 33 ALA MB 2 34 PHE H 2.900 . 4.000 2.339 2.247 2.432 . 0 0 "[ . 1 .]" 1
683 2 33 ALA MB 2 34 PHE HA 3.600 . 5.400 3.766 3.725 3.801 . 0 0 "[ . 1 .]" 1
684 2 33 ALA MB 2 37 ILE MD 3.600 . 5.400 2.785 2.463 2.981 . 0 0 "[ . 1 .]" 1
685 2 33 ALA MB 2 71 LEU QD 3.150 . 4.500 1.885 1.545 2.072 0.255 9 0 "[ . 1 .]" 1
686 2 34 PHE H 2 34 PHE HA 2.900 . 4.000 2.758 2.748 2.766 . 0 0 "[ . 1 .]" 1
687 2 34 PHE H 2 34 PHE HB2 2.900 . 4.000 2.474 2.398 2.521 . 0 0 "[ . 1 .]" 1
688 2 34 PHE H 2 34 PHE HB3 2.400 . 3.000 2.557 2.506 2.614 . 0 0 "[ . 1 .]" 1
689 2 34 PHE H 2 34 PHE QD 3.400 . 5.000 4.175 4.159 4.190 . 0 0 "[ . 1 .]" 1
690 2 34 PHE H 2 35 LEU H 2.900 . 4.000 2.915 2.865 2.983 . 0 0 "[ . 1 .]" 1
691 2 34 PHE H 2 71 LEU QD 3.400 . 5.000 2.326 2.206 2.391 . 0 0 "[ . 1 .]" 1
692 2 34 PHE HA 2 34 PHE HB2 2.700 . 3.600 2.456 2.429 2.487 . 0 0 "[ . 1 .]" 1
693 2 34 PHE HA 2 34 PHE HB3 2.700 . 3.600 3.031 3.027 3.034 . 0 0 "[ . 1 .]" 1
694 2 34 PHE HA 2 34 PHE QD 3.150 . 4.500 2.665 2.056 3.213 . 0 0 "[ . 1 .]" 1
695 2 34 PHE HA 2 35 LEU H 3.400 . 5.000 3.569 3.551 3.585 . 0 0 "[ . 1 .]" 1
696 2 34 PHE HA 2 37 ILE H 3.400 . 5.000 3.537 3.425 3.620 . 0 0 "[ . 1 .]" 1
697 2 34 PHE HA 2 37 ILE HB 3.150 . 4.500 2.661 2.588 2.700 . 0 0 "[ . 1 .]" 1
698 2 34 PHE HA 2 37 ILE MD 2.700 . 3.600 1.773 1.659 1.882 0.141 7 0 "[ . 1 .]" 1
699 2 34 PHE HA 2 37 ILE MG 3.150 . 4.500 3.777 3.758 3.793 . 0 0 "[ . 1 .]" 1
700 2 34 PHE HA 2 71 LEU QD 3.150 . 4.500 2.458 2.283 2.864 . 0 0 "[ . 1 .]" 1
701 2 34 PHE HB2 2 34 PHE QD 3.150 . 4.500 2.489 2.261 2.735 . 0 0 "[ . 1 .]" 1
702 2 34 PHE HB2 2 35 LEU H 2.900 . 4.000 3.805 3.743 3.894 . 0 0 "[ . 1 .]" 1
703 2 34 PHE HB2 2 71 LEU QD 3.150 . 4.500 2.170 2.016 2.921 . 0 0 "[ . 1 .]" 1
704 2 34 PHE HB3 2 34 PHE QD 3.150 . 4.500 2.461 2.274 2.583 . 0 0 "[ . 1 .]" 1
705 2 34 PHE HB3 2 37 ILE MD 3.600 . 5.400 4.418 4.274 4.520 . 0 0 "[ . 1 .]" 1
706 2 34 PHE QD 2 35 LEU H 3.400 . 5.000 3.468 2.855 4.018 . 0 0 "[ . 1 .]" 1
707 2 34 PHE QD 2 35 LEU QD 3.600 . 5.400 2.889 2.278 3.582 . 0 0 "[ . 1 .]" 1
708 2 34 PHE QD 2 35 LEU HG 3.600 . 5.400 3.837 3.148 4.735 . 0 0 "[ . 1 .]" 1
709 2 34 PHE QD 2 68 VAL MG1 3.600 . 5.400 2.464 1.729 3.311 0.071 9 0 "[ . 1 .]" 1
710 2 34 PHE QD 2 68 VAL MG2 3.600 . 5.400 2.304 1.623 3.138 0.177 6 0 "[ . 1 .]" 1
711 2 34 PHE QD 2 71 LEU QD 3.600 . 5.400 3.054 2.576 3.573 . 0 0 "[ . 1 .]" 1
712 2 34 PHE QE 2 38 LEU QD 3.600 . 5.400 2.000 1.737 2.871 0.063 1 0 "[ . 1 .]" 1
713 2 34 PHE QE 2 68 VAL MG1 3.600 . 5.400 2.302 1.677 3.258 0.123 5 0 "[ . 1 .]" 1
714 2 34 PHE QE 2 68 VAL MG2 3.600 . 5.400 2.521 1.919 3.154 . 0 0 "[ . 1 .]" 1
715 2 34 PHE HZ 2 68 VAL MG1 3.150 . 4.500 3.679 3.432 3.772 . 0 0 "[ . 1 .]" 1
716 2 35 LEU H 2 35 LEU HB2 2.900 . 4.000 2.527 2.452 2.598 . 0 0 "[ . 1 .]" 1
717 2 35 LEU H 2 35 LEU HB3 2.900 . 4.000 3.605 3.593 3.617 . 0 0 "[ . 1 .]" 1
718 2 35 LEU H 2 35 LEU QD 3.400 . 5.000 2.991 2.859 3.133 . 0 0 "[ . 1 .]" 1
719 2 35 LEU H 2 35 LEU HG 2.400 . 3.000 2.275 2.168 2.432 . 0 0 "[ . 1 .]" 1
720 2 35 LEU H 2 36 GLU H 2.900 . 4.000 2.796 2.743 2.863 . 0 0 "[ . 1 .]" 1
721 2 35 LEU H 2 71 LEU QD 3.900 . 6.000 4.452 4.361 4.506 . 0 0 "[ . 1 .]" 1
722 2 35 LEU HA 2 35 LEU HB2 2.700 . 3.600 3.018 3.010 3.021 . 0 0 "[ . 1 .]" 1
723 2 35 LEU HA 2 35 LEU HB3 2.700 . 3.600 2.474 2.434 2.520 . 0 0 "[ . 1 .]" 1
724 2 35 LEU HA 2 35 LEU QD 2.700 . 3.600 1.840 1.755 1.981 0.045 10 0 "[ . 1 .]" 1
725 2 35 LEU HA 2 35 LEU HG 2.700 . 3.600 3.175 3.064 3.288 . 0 0 "[ . 1 .]" 1
726 2 35 LEU HA 2 36 GLU H 2.900 . 4.000 3.571 3.554 3.583 . 0 0 "[ . 1 .]" 1
727 2 35 LEU HA 2 37 ILE H 3.900 . 6.000 4.188 4.079 4.238 . 0 0 "[ . 1 .]" 1
728 2 35 LEU HA 2 38 LEU H 3.400 . 5.000 3.564 3.453 3.662 . 0 0 "[ . 1 .]" 1
729 2 35 LEU HA 2 38 LEU HB2 3.150 . 4.500 3.395 3.208 3.562 . 0 0 "[ . 1 .]" 1
730 2 35 LEU HA 2 38 LEU QD 3.150 . 4.500 2.498 2.207 2.665 . 0 0 "[ . 1 .]" 1
731 2 35 LEU HA 2 39 HIS H 3.400 . 5.000 4.061 3.873 4.215 . 0 0 "[ . 1 .]" 1
732 2 35 LEU HA 2 39 HIS HD2 3.600 . 5.400 3.953 3.709 4.721 . 0 0 "[ . 1 .]" 1
733 2 35 LEU HB2 2 35 LEU HG 2.700 . 3.600 2.429 2.392 2.463 . 0 0 "[ . 1 .]" 1
734 2 35 LEU HB2 2 36 GLU H 2.900 . 4.000 2.446 2.315 2.533 . 0 0 "[ . 1 .]" 1
735 2 35 LEU HB3 2 35 LEU QD 2.700 . 3.600 2.138 2.071 2.172 . 0 0 "[ . 1 .]" 1
736 2 35 LEU HB3 2 35 LEU HG 2.700 . 3.600 3.018 3.012 3.022 . 0 0 "[ . 1 .]" 1
737 2 35 LEU HB3 2 36 GLU H 2.900 . 4.000 3.491 3.325 3.663 . 0 0 "[ . 1 .]" 1
738 2 35 LEU HB3 2 39 HIS HD2 3.600 . 5.400 2.842 2.374 4.380 . 0 0 "[ . 1 .]" 1
739 2 35 LEU QD 2 36 GLU H 3.900 . 6.000 3.998 3.911 4.048 . 0 0 "[ . 1 .]" 1
740 2 35 LEU QD 2 38 LEU QD 3.150 . 4.500 2.484 2.475 2.494 . 0 0 "[ . 1 .]" 1
741 2 35 LEU HG 2 36 GLU H 3.900 . 6.000 4.279 4.145 4.423 . 0 0 "[ . 1 .]" 1
742 2 36 GLU H 2 36 GLU QB 2.900 . 4.000 2.444 2.395 2.495 . 0 0 "[ . 1 .]" 1
743 2 36 GLU H 2 36 GLU QG 2.900 . 4.000 2.208 2.114 2.338 . 0 0 "[ . 1 .]" 1
744 2 36 GLU H 2 37 ILE H 2.900 . 4.000 2.696 2.636 2.745 . 0 0 "[ . 1 .]" 1
745 2 36 GLU HA 2 36 GLU QG 2.700 . 3.600 2.594 2.359 2.967 . 0 0 "[ . 1 .]" 1
746 2 36 GLU HA 2 37 ILE H 2.900 . 4.000 3.514 3.499 3.520 . 0 0 "[ . 1 .]" 1
747 2 36 GLU HA 2 39 HIS H 2.900 . 4.000 3.355 3.136 3.479 . 0 0 "[ . 1 .]" 1
748 2 36 GLU HA 2 39 HIS HB2 2.700 . 3.600 2.082 1.918 2.224 . 0 0 "[ . 1 .]" 1
749 2 36 GLU HA 2 39 HIS HB3 2.700 . 3.600 3.604 3.388 3.627 0.027 6 0 "[ . 1 .]" 1
750 2 36 GLU HA 2 39 HIS HD2 3.150 . 4.500 2.732 2.144 4.529 0.029 5 0 "[ . 1 .]" 1
751 2 36 GLU HA 2 40 THR H 3.400 . 5.000 3.909 3.707 4.133 . 0 0 "[ . 1 .]" 1
752 2 36 GLU QB 2 37 ILE H 2.900 . 4.000 2.748 2.661 2.801 . 0 0 "[ . 1 .]" 1
753 2 36 GLU QG 2 37 ILE H 3.900 . 6.000 4.167 4.116 4.237 . 0 0 "[ . 1 .]" 1
754 2 37 ILE H 2 37 ILE HA 2.900 . 4.000 2.801 2.794 2.807 . 0 0 "[ . 1 .]" 1
755 2 37 ILE H 2 37 ILE MD 3.400 . 5.000 3.459 3.325 3.610 . 0 0 "[ . 1 .]" 1
756 2 37 ILE H 2 37 ILE QG 2.900 . 4.000 2.255 2.184 2.386 . 0 0 "[ . 1 .]" 1
757 2 37 ILE H 2 37 ILE MG 3.400 . 5.000 3.729 3.712 3.743 . 0 0 "[ . 1 .]" 1
758 2 37 ILE H 2 38 LEU H 2.900 . 4.000 2.731 2.696 2.779 . 0 0 "[ . 1 .]" 1
759 2 37 ILE H 2 38 LEU QD 3.900 . 6.000 4.419 4.085 4.483 . 0 0 "[ . 1 .]" 1
760 2 37 ILE HA 2 37 ILE HB 2.700 . 3.600 3.012 3.007 3.019 . 0 0 "[ . 1 .]" 1
761 2 37 ILE HA 2 37 ILE MD 3.150 . 4.500 3.805 3.793 3.820 . 0 0 "[ . 1 .]" 1
762 2 37 ILE HA 2 37 ILE QG 2.700 . 3.600 2.157 2.138 2.175 . 0 0 "[ . 1 .]" 1
763 2 37 ILE HA 2 37 ILE MG 2.700 . 3.600 2.522 2.457 2.591 . 0 0 "[ . 1 .]" 1
764 2 37 ILE HA 2 38 LEU H 3.400 . 5.000 3.542 3.530 3.557 . 0 0 "[ . 1 .]" 1
765 2 37 ILE HA 2 40 THR H 3.400 . 5.000 3.784 3.637 3.920 . 0 0 "[ . 1 .]" 1
766 2 37 ILE HA 2 40 THR HB 2.700 . 3.600 3.426 3.150 3.626 0.026 4 0 "[ . 1 .]" 1
767 2 37 ILE HA 2 41 TYR H 3.400 . 5.000 4.764 4.513 5.014 0.014 13 0 "[ . 1 .]" 1
768 2 37 ILE HB 2 37 ILE MD 2.700 . 3.600 2.305 2.163 2.403 . 0 0 "[ . 1 .]" 1
769 2 37 ILE HB 2 38 LEU H 2.900 . 4.000 2.392 2.359 2.435 . 0 0 "[ . 1 .]" 1
770 2 37 ILE HB 2 68 VAL MG2 3.600 . 5.400 2.911 2.660 3.134 . 0 0 "[ . 1 .]" 1
771 2 37 ILE MD 2 67 GLN H 3.400 . 5.000 3.940 3.661 4.172 . 0 0 "[ . 1 .]" 1
772 2 37 ILE MD 2 67 GLN HA 3.600 . 5.400 3.564 3.425 3.819 . 0 0 "[ . 1 .]" 1
773 2 37 ILE MD 2 67 GLN QB 3.150 . 4.500 1.778 1.669 1.963 0.131 3 0 "[ . 1 .]" 1
774 2 37 ILE MD 2 68 VAL H 3.400 . 5.000 2.668 2.382 2.966 . 0 0 "[ . 1 .]" 1
775 2 37 ILE MD 2 68 VAL HA 3.150 . 4.500 2.526 2.173 2.748 . 0 0 "[ . 1 .]" 1
776 2 37 ILE MD 2 68 VAL MG1 3.600 . 5.400 3.653 3.298 3.755 . 0 0 "[ . 1 .]" 1
777 2 37 ILE MD 2 68 VAL MG2 3.150 . 4.500 1.966 1.819 2.318 . 0 0 "[ . 1 .]" 1
778 2 37 ILE MD 2 71 LEU HG 3.150 . 4.500 3.177 2.864 3.775 . 0 0 "[ . 1 .]" 1
779 2 37 ILE MG 2 38 LEU H 3.400 . 5.000 3.018 2.906 3.193 . 0 0 "[ . 1 .]" 1
780 2 37 ILE MG 2 64 VAL HA 3.150 . 4.500 1.834 1.706 2.119 0.094 2 0 "[ . 1 .]" 1
781 2 37 ILE MG 2 67 GLN QB 3.150 . 4.500 2.046 1.766 2.617 0.034 14 0 "[ . 1 .]" 1
782 2 37 ILE MG 2 68 VAL H 3.400 . 5.000 2.825 2.498 3.301 . 0 0 "[ . 1 .]" 1
783 2 37 ILE MG 2 68 VAL MG2 3.150 . 4.500 1.868 1.736 2.156 0.064 9 0 "[ . 1 .]" 1
784 2 38 LEU H 2 38 LEU HA 2.900 . 4.000 2.823 2.817 2.829 . 0 0 "[ . 1 .]" 1
785 2 38 LEU H 2 38 LEU HB2 2.900 . 4.000 2.701 2.621 2.861 . 0 0 "[ . 1 .]" 1
786 2 38 LEU H 2 38 LEU HB3 2.900 . 4.000 3.560 3.546 3.580 . 0 0 "[ . 1 .]" 1
787 2 38 LEU H 2 38 LEU QD 3.400 . 5.000 2.728 2.262 2.909 . 0 0 "[ . 1 .]" 1
788 2 38 LEU H 2 38 LEU HG 2.400 . 3.000 1.922 1.822 2.020 . 0 0 "[ . 1 .]" 1
789 2 38 LEU H 2 39 HIS H 2.900 . 4.000 2.632 2.548 2.679 . 0 0 "[ . 1 .]" 1
790 2 38 LEU HA 2 38 LEU HB3 2.700 . 3.600 2.371 2.321 2.393 . 0 0 "[ . 1 .]" 1
791 2 38 LEU HA 2 38 LEU QD 2.700 . 3.600 2.031 1.859 2.210 . 0 0 "[ . 1 .]" 1
792 2 38 LEU HA 2 38 LEU HG 3.150 . 4.500 3.329 3.164 3.562 . 0 0 "[ . 1 .]" 1
793 2 38 LEU HA 2 39 HIS H 3.400 . 5.000 3.527 3.500 3.554 . 0 0 "[ . 1 .]" 1
794 2 38 LEU HA 2 41 TYR H 2.900 . 4.000 3.560 3.467 3.696 . 0 0 "[ . 1 .]" 1
795 2 38 LEU HA 2 41 TYR HB3 2.700 . 3.600 2.968 2.521 3.393 . 0 0 "[ . 1 .]" 1
796 2 38 LEU HB2 2 38 LEU HG 2.700 . 3.600 2.454 2.379 2.547 . 0 0 "[ . 1 .]" 1
797 2 38 LEU HB2 2 39 HIS H 2.900 . 4.000 2.326 2.228 2.596 . 0 0 "[ . 1 .]" 1
798 2 38 LEU HB3 2 38 LEU HG 2.700 . 3.600 3.010 3.001 3.016 . 0 0 "[ . 1 .]" 1
799 2 38 LEU HB3 2 39 HIS H 2.900 . 4.000 3.637 3.530 3.897 . 0 0 "[ . 1 .]" 1
800 2 38 LEU QD 2 39 HIS H 3.400 . 5.000 3.801 3.738 3.832 . 0 0 "[ . 1 .]" 1
801 2 38 LEU QD 2 64 VAL MG1 3.600 . 5.400 1.800 1.643 2.091 0.157 3 0 "[ . 1 .]" 1
802 2 38 LEU QD 2 64 VAL MG2 3.600 . 5.400 3.241 2.909 3.342 . 0 0 "[ . 1 .]" 1
803 2 38 LEU QD 2 82 PHE QE 3.600 . 5.400 2.129 1.761 2.623 0.039 8 0 "[ . 1 .]" 1
804 2 38 LEU QD 2 82 PHE HZ 3.600 . 5.400 2.114 1.743 3.299 0.057 12 0 "[ . 1 .]" 1
805 2 38 LEU HG 2 39 HIS H 3.400 . 5.000 3.769 3.588 3.890 . 0 0 "[ . 1 .]" 1
806 2 39 HIS H 2 39 HIS HA 2.900 . 4.000 2.762 2.733 2.785 . 0 0 "[ . 1 .]" 1
807 2 39 HIS H 2 39 HIS HB2 2.900 . 4.000 2.403 2.356 2.495 . 0 0 "[ . 1 .]" 1
808 2 39 HIS H 2 39 HIS HB3 2.900 . 4.000 3.593 3.580 3.612 . 0 0 "[ . 1 .]" 1
809 2 39 HIS H 2 39 HIS HD2 2.900 . 4.000 3.347 2.899 3.458 . 0 0 "[ . 1 .]" 1
810 2 39 HIS H 2 40 THR H 2.900 . 4.000 2.912 2.839 2.980 . 0 0 "[ . 1 .]" 1
811 2 39 HIS HA 2 39 HIS HB2 2.700 . 3.600 3.009 3.001 3.023 . 0 0 "[ . 1 .]" 1
812 2 39 HIS HA 2 39 HIS HB3 2.700 . 3.600 2.577 2.532 2.604 . 0 0 "[ . 1 .]" 1
813 2 39 HIS HA 2 39 HIS HD2 3.150 . 4.500 4.239 2.361 4.541 0.041 14 0 "[ . 1 .]" 1
814 2 39 HIS HA 2 40 THR H 3.400 . 5.000 3.567 3.548 3.589 . 0 0 "[ . 1 .]" 1
815 2 39 HIS HA 2 42 GLN H 2.900 . 4.000 3.635 3.227 3.818 . 0 0 "[ . 1 .]" 1
816 2 39 HIS HA 2 42 GLN QB 2.700 . 3.600 3.047 2.695 3.312 . 0 0 "[ . 1 .]" 1
817 2 39 HIS HA 2 43 LYS H 3.400 . 5.000 4.173 3.689 4.400 . 0 0 "[ . 1 .]" 1
818 2 39 HIS HB2 2 39 HIS HD2 3.600 . 5.400 2.826 2.675 3.762 . 0 0 "[ . 1 .]" 1
819 2 39 HIS HB2 2 40 THR H 2.900 . 4.000 2.746 2.466 2.969 . 0 0 "[ . 1 .]" 1
820 2 39 HIS HB3 2 39 HIS HD2 3.600 . 5.400 3.662 3.626 3.687 . 0 0 "[ . 1 .]" 1
821 2 39 HIS HB3 2 40 THR H 2.900 . 4.000 3.503 3.371 3.649 . 0 0 "[ . 1 .]" 1
822 2 40 THR H 2 40 THR HA 2.900 . 4.000 2.816 2.808 2.827 . 0 0 "[ . 1 .]" 1
823 2 40 THR H 2 40 THR HB 2.900 . 4.000 2.497 2.423 2.580 . 0 0 "[ . 1 .]" 1
824 2 40 THR H 2 40 THR MG 3.400 . 5.000 3.772 3.757 3.782 . 0 0 "[ . 1 .]" 1
825 2 40 THR H 2 41 TYR H 2.900 . 4.000 2.662 2.604 2.726 . 0 0 "[ . 1 .]" 1
826 2 40 THR HA 2 40 THR MG 2.700 . 3.600 2.474 2.372 2.581 . 0 0 "[ . 1 .]" 1
827 2 40 THR HA 2 41 TYR H 3.400 . 5.000 3.525 3.515 3.555 . 0 0 "[ . 1 .]" 1
828 2 40 THR HA 2 43 LYS QB 2.700 . 3.600 2.867 2.563 3.198 . 0 0 "[ . 1 .]" 1
829 2 40 THR HB 2 41 TYR H 2.900 . 4.000 2.588 2.473 2.690 . 0 0 "[ . 1 .]" 1
830 2 40 THR HB 2 59 LEU QD 3.150 . 4.500 1.936 1.736 2.554 0.064 3 0 "[ . 1 .]" 1
831 2 40 THR MG 2 41 TYR H 3.400 . 5.000 3.483 3.340 3.637 . 0 0 "[ . 1 .]" 1
832 2 40 THR MG 2 43 LYS QE 3.600 . 5.400 3.480 2.877 4.017 . 0 0 "[ . 1 .]" 1
833 2 40 THR MG 2 44 GLU QG 3.600 . 5.400 3.009 2.425 4.024 . 0 0 "[ . 1 .]" 1
834 2 40 THR MG 2 59 LEU QB 3.150 . 4.500 2.438 1.679 3.051 0.121 4 0 "[ . 1 .]" 1
835 2 40 THR MG 2 59 LEU QD 3.150 . 4.500 1.539 1.443 1.705 0.357 1 0 "[ . 1 .]" 1
836 2 40 THR MG 2 63 GLU QG 3.600 . 5.400 4.102 4.083 4.118 . 0 0 "[ . 1 .]" 1
837 2 41 TYR H 2 41 TYR HA 2.900 . 4.000 2.786 2.765 2.800 . 0 0 "[ . 1 .]" 1
838 2 41 TYR H 2 41 TYR HB2 2.900 . 4.000 2.501 2.417 2.587 . 0 0 "[ . 1 .]" 1
839 2 41 TYR H 2 41 TYR HB3 2.900 . 4.000 2.441 2.358 2.512 . 0 0 "[ . 1 .]" 1
840 2 41 TYR H 2 41 TYR QD 3.400 . 5.000 4.161 4.132 4.198 . 0 0 "[ . 1 .]" 1
841 2 41 TYR H 2 42 GLN H 2.900 . 4.000 2.962 2.852 3.059 . 0 0 "[ . 1 .]" 1
842 2 41 TYR H 2 59 LEU QD 3.900 . 6.000 2.506 2.275 2.848 . 0 0 "[ . 1 .]" 1
843 2 41 TYR H 2 64 VAL MG2 3.900 . 6.000 3.499 3.149 3.802 . 0 0 "[ . 1 .]" 1
844 2 41 TYR HA 2 41 TYR HB2 2.700 . 3.600 2.424 2.371 2.468 . 0 0 "[ . 1 .]" 1
845 2 41 TYR HA 2 41 TYR HB3 2.700 . 3.600 3.020 3.010 3.032 . 0 0 "[ . 1 .]" 1
846 2 41 TYR HA 2 41 TYR QD 3.150 . 4.500 2.964 2.604 3.255 . 0 0 "[ . 1 .]" 1
847 2 41 TYR HA 2 41 TYR QE 3.600 . 5.400 4.775 4.625 4.878 . 0 0 "[ . 1 .]" 1
848 2 41 TYR HA 2 42 GLN H 3.400 . 5.000 3.594 3.568 3.618 . 0 0 "[ . 1 .]" 1
849 2 41 TYR HA 2 44 GLU QB 3.150 . 4.500 3.453 2.879 4.039 . 0 0 "[ . 1 .]" 1
850 2 41 TYR HA 2 59 LEU QB 3.150 . 4.500 2.284 1.664 3.961 0.136 9 0 "[ . 1 .]" 1
851 2 41 TYR HA 2 59 LEU QD 3.150 . 4.500 2.584 2.113 3.030 . 0 0 "[ . 1 .]" 1
852 2 41 TYR HB2 2 41 TYR QD 2.700 . 3.600 2.400 2.242 2.590 . 0 0 "[ . 1 .]" 1
853 2 41 TYR HB2 2 42 GLN H 2.900 . 4.000 3.727 3.632 3.845 . 0 0 "[ . 1 .]" 1
854 2 41 TYR HB2 2 59 LEU QD 3.600 . 5.400 2.553 2.129 2.843 . 0 0 "[ . 1 .]" 1
855 2 41 TYR HB2 2 64 VAL MG2 3.150 . 4.500 1.802 1.593 2.125 0.207 12 0 "[ . 1 .]" 1
856 2 41 TYR HB3 2 41 TYR QD 2.700 . 3.600 2.426 2.258 2.683 . 0 0 "[ . 1 .]" 1
857 2 41 TYR HB3 2 42 GLN H 2.900 . 4.000 2.264 2.152 2.420 . 0 0 "[ . 1 .]" 1
858 2 41 TYR HB3 2 59 LEU QD 3.600 . 5.400 3.731 3.391 4.026 . 0 0 "[ . 1 .]" 1
859 2 41 TYR HB3 2 64 VAL MG2 3.150 . 4.500 2.692 2.404 3.050 . 0 0 "[ . 1 .]" 1
860 2 41 TYR QD 2 42 GLN H 3.400 . 5.000 2.802 2.414 3.126 . 0 0 "[ . 1 .]" 1
861 2 41 TYR QD 2 42 GLN HA 3.150 . 4.500 2.963 2.414 3.687 . 0 0 "[ . 1 .]" 1
862 2 41 TYR QD 2 42 GLN QB 3.600 . 5.400 3.936 3.082 4.303 . 0 0 "[ . 1 .]" 1
863 2 41 TYR QD 2 42 GLN QG 3.600 . 5.400 3.232 2.523 4.311 . 0 0 "[ . 1 .]" 1
864 2 41 TYR QD 2 45 GLN QG 3.600 . 5.400 3.260 2.275 3.707 . 0 0 "[ . 1 .]" 1
865 2 41 TYR QD 2 59 LEU QB 3.150 . 4.500 3.150 2.618 3.650 . 0 0 "[ . 1 .]" 1
866 2 41 TYR QD 2 59 LEU QD 3.600 . 5.400 3.417 2.824 3.594 . 0 0 "[ . 1 .]" 1
867 2 41 TYR QE 2 45 GLN QG 3.150 . 4.500 3.109 2.163 3.593 . 0 0 "[ . 1 .]" 1
868 2 41 TYR QE 2 60 THR HA 3.150 . 4.500 2.532 1.929 3.114 . 0 0 "[ . 1 .]" 1
869 2 41 TYR QE 2 61 GLU HA 3.600 . 5.400 2.891 2.375 3.336 . 0 0 "[ . 1 .]" 1
870 2 41 TYR QE 2 61 GLU HB2 3.150 . 4.500 4.028 3.861 4.093 . 0 0 "[ . 1 .]" 1
871 2 42 GLN H 2 42 GLN HA 2.900 . 4.000 2.760 2.717 2.792 . 0 0 "[ . 1 .]" 1
872 2 42 GLN H 2 42 GLN QB 2.900 . 4.000 2.302 2.044 2.494 . 0 0 "[ . 1 .]" 1
873 2 42 GLN H 2 42 GLN QG 2.900 . 4.000 2.726 2.170 3.740 . 0 0 "[ . 1 .]" 1
874 2 42 GLN H 2 43 LYS H 2.900 . 4.000 2.897 2.802 2.999 . 0 0 "[ . 1 .]" 1
875 2 42 GLN HA 2 42 GLN QG 2.700 . 3.600 2.655 2.203 3.364 . 0 0 "[ . 1 .]" 1
876 2 42 GLN HA 2 43 LYS H 2.900 . 4.000 3.555 3.527 3.582 . 0 0 "[ . 1 .]" 1
877 2 42 GLN HA 2 45 GLN HB2 2.700 . 3.600 3.203 2.782 3.623 0.023 1 0 "[ . 1 .]" 1
878 2 42 GLN QB 2 43 LYS H 2.900 . 4.000 2.662 2.313 3.468 . 0 0 "[ . 1 .]" 1
879 2 42 GLN QG 2 43 LYS H 3.400 . 5.000 4.103 2.116 4.428 . 0 0 "[ . 1 .]" 1
880 2 43 LYS H 2 43 LYS HA 2.900 . 4.000 2.792 2.781 2.812 . 0 0 "[ . 1 .]" 1
881 2 43 LYS H 2 43 LYS QB 2.900 . 4.000 2.408 2.283 2.500 . 0 0 "[ . 1 .]" 1
882 2 43 LYS H 2 43 LYS QD 3.900 . 6.000 4.110 3.460 4.308 . 0 0 "[ . 1 .]" 1
883 2 43 LYS H 2 43 LYS QG 2.900 . 4.000 2.308 2.162 2.479 . 0 0 "[ . 1 .]" 1
884 2 43 LYS H 2 44 GLU H 2.900 . 4.000 2.847 2.792 2.889 . 0 0 "[ . 1 .]" 1
885 2 43 LYS HA 2 43 LYS QB 2.250 . 2.700 2.400 2.373 2.430 . 0 0 "[ . 1 .]" 1
886 2 43 LYS HA 2 43 LYS QD 3.150 . 4.500 4.017 3.845 4.108 . 0 0 "[ . 1 .]" 1
887 2 43 LYS HA 2 43 LYS QG 2.700 . 3.600 2.375 2.317 2.421 . 0 0 "[ . 1 .]" 1
888 2 43 LYS HA 2 46 ARG H 2.900 . 4.000 3.723 3.254 3.923 . 0 0 "[ . 1 .]" 1
889 2 43 LYS HA 2 46 ARG QB 2.700 . 3.600 3.107 2.785 3.249 . 0 0 "[ . 1 .]" 1
890 2 43 LYS HA 2 46 ARG QD 3.150 . 4.500 3.548 2.851 4.067 . 0 0 "[ . 1 .]" 1
891 2 43 LYS HA 2 47 ASN H 3.400 . 5.000 4.044 3.792 4.262 . 0 0 "[ . 1 .]" 1
892 2 43 LYS QB 2 43 LYS QD 2.700 . 3.600 2.310 2.256 2.354 . 0 0 "[ . 1 .]" 1
893 2 43 LYS HB2 2 43 LYS QG 2.250 . 2.700 2.341 2.252 2.416 . 0 0 "[ . 1 .]" 1
894 2 43 LYS HB3 2 43 LYS QG 2.250 . 2.700 2.344 2.259 2.424 . 0 0 "[ . 1 .]" 1
895 2 43 LYS QD 2 43 LYS QG 2.250 . 2.700 2.004 1.981 2.015 . 0 0 "[ . 1 .]" 1
896 2 44 GLU H 2 44 GLU HA 2.400 . 3.000 2.796 2.716 2.857 . 0 0 "[ . 1 .]" 1
897 2 44 GLU H 2 44 GLU QB 2.900 . 4.000 2.478 2.095 2.681 . 0 0 "[ . 1 .]" 1
898 2 44 GLU H 2 44 GLU QG 2.900 . 4.000 2.346 1.901 3.805 . 0 0 "[ . 1 .]" 1
899 2 44 GLU HA 2 44 GLU QG 3.150 . 4.500 2.958 2.350 3.490 . 0 0 "[ . 1 .]" 1
900 2 44 GLU HA 2 47 ASN H 2.900 . 4.000 3.331 3.056 3.543 . 0 0 "[ . 1 .]" 1
901 2 44 GLU HA 2 47 ASN HB2 2.700 . 3.600 2.151 2.096 2.219 . 0 0 "[ . 1 .]" 1
902 2 44 GLU HA 2 47 ASN HB3 2.700 . 3.600 3.641 3.619 3.667 0.067 11 0 "[ . 1 .]" 1
903 2 44 GLU HA 2 55 TYR QE 3.150 . 4.500 3.370 2.748 3.852 . 0 0 "[ . 1 .]" 1
904 2 44 GLU QB 2 57 PRO HA 3.150 . 4.500 2.555 1.946 4.040 . 0 0 "[ . 1 .]" 1
905 2 44 GLU QB 2 58 ALA MB 3.600 . 5.400 3.597 2.669 4.013 . 0 0 "[ . 1 .]" 1
906 2 44 GLU QB 2 59 LEU H 3.400 . 5.000 2.708 2.377 3.319 . 0 0 "[ . 1 .]" 1
907 2 44 GLU QG 2 58 ALA MB 3.600 . 5.400 2.920 1.981 3.744 . 0 0 "[ . 1 .]" 1
908 2 45 GLN H 2 45 GLN QB 2.400 . 3.000 2.635 2.559 2.681 . 0 0 "[ . 1 .]" 1
909 2 45 GLN H 2 45 GLN QG 2.900 . 4.000 1.990 1.895 2.084 . 0 0 "[ . 1 .]" 1
910 2 45 GLN HA 2 45 GLN HB3 2.250 . 2.700 2.404 2.386 2.435 . 0 0 "[ . 1 .]" 1
911 2 45 GLN HA 2 45 GLN QG 2.700 . 3.600 2.988 2.525 3.148 . 0 0 "[ . 1 .]" 1
912 2 45 GLN HA 2 48 ALA MB 3.150 . 4.500 3.248 2.918 3.544 . 0 0 "[ . 1 .]" 1
913 2 45 GLN QB 2 46 ARG H 2.400 . 3.000 2.234 2.069 2.390 . 0 0 "[ . 1 .]" 1
914 2 45 GLN QG 2 46 ARG H 2.900 . 4.000 3.629 3.599 3.660 . 0 0 "[ . 1 .]" 1
915 2 46 ARG H 2 46 ARG HA 2.900 . 4.000 2.825 2.809 2.837 . 0 0 "[ . 1 .]" 1
916 2 46 ARG H 2 46 ARG QD 3.900 . 6.000 3.615 1.842 4.125 . 0 0 "[ . 1 .]" 1
917 2 46 ARG H 2 46 ARG QG 2.900 . 4.000 2.451 1.878 3.280 . 0 0 "[ . 1 .]" 1
918 2 46 ARG H 2 47 ASN H 2.900 . 4.000 2.654 2.605 2.703 . 0 0 "[ . 1 .]" 1
919 2 46 ARG HA 2 46 ARG QD 3.150 . 4.500 3.833 2.848 4.134 . 0 0 "[ . 1 .]" 1
920 2 46 ARG HA 2 46 ARG QG 2.700 . 3.600 2.479 2.252 3.263 . 0 0 "[ . 1 .]" 1
921 2 46 ARG HA 2 47 ASN H 2.900 . 4.000 3.535 3.519 3.549 . 0 0 "[ . 1 .]" 1
922 2 46 ARG HA 2 49 LYS H 2.900 . 4.000 3.512 3.366 3.689 . 0 0 "[ . 1 .]" 1
923 2 46 ARG HA 2 49 LYS QB 2.700 . 3.600 2.809 2.448 3.212 . 0 0 "[ . 1 .]" 1
924 2 46 ARG HA 2 50 GLU H 3.400 . 5.000 4.140 3.853 4.639 . 0 0 "[ . 1 .]" 1
925 2 46 ARG QB 2 46 ARG QD 2.700 . 3.600 2.214 2.069 2.618 . 0 0 "[ . 1 .]" 1
926 2 46 ARG QB 2 46 ARG QG 2.250 . 2.700 2.070 2.002 2.088 . 0 0 "[ . 1 .]" 1
927 2 46 ARG QB 2 47 ASN H 2.900 . 4.000 2.683 2.406 3.410 . 0 0 "[ . 1 .]" 1
928 2 46 ARG QD 2 47 ASN H 3.900 . 6.000 4.740 3.917 5.274 . 0 0 "[ . 1 .]" 1
929 2 46 ARG QG 2 47 ASN H 3.400 . 5.000 4.041 2.272 4.502 . 0 0 "[ . 1 .]" 1
930 2 47 ASN H 2 47 ASN HA 2.900 . 4.000 2.785 2.775 2.817 . 0 0 "[ . 1 .]" 1
931 2 47 ASN H 2 47 ASN HB2 2.400 . 3.000 2.322 2.230 2.429 . 0 0 "[ . 1 .]" 1
932 2 47 ASN H 2 47 ASN HB3 2.900 . 4.000 3.557 3.524 3.592 . 0 0 "[ . 1 .]" 1
933 2 47 ASN H 2 48 ALA H 2.900 . 4.000 2.865 2.754 2.939 . 0 0 "[ . 1 .]" 1
934 2 47 ASN H 2 49 LYS H 3.400 . 5.000 4.207 4.023 4.437 . 0 0 "[ . 1 .]" 1
935 2 47 ASN HA 2 47 ASN HB2 2.700 . 3.600 3.004 2.978 3.021 . 0 0 "[ . 1 .]" 1
936 2 47 ASN HA 2 47 ASN HB3 2.700 . 3.600 2.605 2.550 2.671 . 0 0 "[ . 1 .]" 1
937 2 47 ASN HA 2 48 ALA H 2.900 . 4.000 3.570 3.535 3.583 . 0 0 "[ . 1 .]" 1
938 2 47 ASN HA 2 49 LYS H 3.900 . 6.000 4.378 4.243 4.638 . 0 0 "[ . 1 .]" 1
939 2 47 ASN HA 2 50 GLU H 2.900 . 4.000 3.509 3.315 3.751 . 0 0 "[ . 1 .]" 1
940 2 47 ASN HA 2 50 GLU HB2 2.700 . 3.600 2.808 2.474 3.123 . 0 0 "[ . 1 .]" 1
941 2 47 ASN HA 2 50 GLU HB3 3.150 . 4.500 4.345 4.046 4.517 0.017 10 0 "[ . 1 .]" 1
942 2 47 ASN HB2 2 48 ALA H 2.900 . 4.000 2.566 2.394 2.865 . 0 0 "[ . 1 .]" 1
943 2 47 ASN HB2 2 55 TYR QE 3.150 . 4.500 2.803 2.163 3.231 . 0 0 "[ . 1 .]" 1
944 2 47 ASN HB3 2 48 ALA H 2.900 . 4.000 3.247 3.055 3.488 . 0 0 "[ . 1 .]" 1
945 2 47 ASN HB3 2 55 TYR QE 3.150 . 4.500 2.806 2.325 3.139 . 0 0 "[ . 1 .]" 1
946 2 48 ALA H 2 48 ALA HA 2.900 . 4.000 2.783 2.776 2.790 . 0 0 "[ . 1 .]" 1
947 2 48 ALA H 2 48 ALA MB 2.900 . 4.000 2.164 2.039 2.238 . 0 0 "[ . 1 .]" 1
948 2 48 ALA H 2 49 LYS H 2.900 . 4.000 2.793 2.740 2.862 . 0 0 "[ . 1 .]" 1
949 2 48 ALA HA 2 49 LYS H 2.900 . 4.000 3.542 3.518 3.565 . 0 0 "[ . 1 .]" 1
950 2 48 ALA HA 2 51 ALA MB 3.150 . 4.500 3.067 2.266 3.718 . 0 0 "[ . 1 .]" 1
951 2 48 ALA HA 2 55 TYR H 3.400 . 5.000 4.750 4.303 5.035 0.035 7 0 "[ . 1 .]" 1
952 2 48 ALA HA 2 55 TYR HB2 3.150 . 4.500 4.021 3.090 4.475 . 0 0 "[ . 1 .]" 1
953 2 48 ALA HA 2 55 TYR HB3 2.700 . 3.600 2.585 1.904 2.852 . 0 0 "[ . 1 .]" 1
954 2 48 ALA HA 2 55 TYR QD 3.150 . 4.500 1.854 1.655 2.173 0.145 11 0 "[ . 1 .]" 1
955 2 48 ALA HA 2 55 TYR QE 3.600 . 5.400 3.506 3.195 3.859 . 0 0 "[ . 1 .]" 1
956 2 48 ALA MB 2 49 LYS H 2.900 . 4.000 2.627 2.543 2.730 . 0 0 "[ . 1 .]" 1
957 2 48 ALA MB 2 55 TYR QD 3.150 . 4.500 2.328 1.903 2.663 . 0 0 "[ . 1 .]" 1
958 2 48 ALA MB 2 55 TYR QE 3.150 . 4.500 3.081 2.607 3.352 . 0 0 "[ . 1 .]" 1
959 2 48 ALA MB 2 57 PRO QD 3.150 . 4.500 2.715 1.902 3.340 . 0 0 "[ . 1 .]" 1
960 2 49 LYS H 2 49 LYS HA 2.900 . 4.000 2.834 2.817 2.850 . 0 0 "[ . 1 .]" 1
961 2 49 LYS H 2 49 LYS QB 2.400 . 3.000 2.296 2.198 2.651 . 0 0 "[ . 1 .]" 1
962 2 49 LYS H 2 49 LYS QD 3.400 . 5.000 4.261 2.929 4.511 . 0 0 "[ . 1 .]" 1
963 2 49 LYS H 2 49 LYS QG 3.400 . 5.000 3.709 1.894 4.038 . 0 0 "[ . 1 .]" 1
964 2 49 LYS H 2 50 GLU H 2.900 . 4.000 2.661 2.608 2.787 . 0 0 "[ . 1 .]" 1
965 2 49 LYS HA 2 49 LYS QB 2.250 . 2.700 2.344 2.296 2.367 . 0 0 "[ . 1 .]" 1
966 2 49 LYS HA 2 49 LYS QD 3.150 . 4.500 3.371 2.034 4.114 . 0 0 "[ . 1 .]" 1
967 2 49 LYS HA 2 49 LYS QG 2.700 . 3.600 2.650 2.408 3.122 . 0 0 "[ . 1 .]" 1
968 2 49 LYS QG 2 50 GLU H 2.900 . 4.000 3.568 3.486 3.616 . 0 0 "[ . 1 .]" 1
969 2 50 GLU H 2 50 GLU HB3 2.900 . 4.000 3.586 3.531 3.611 . 0 0 "[ . 1 .]" 1
970 2 50 GLU H 2 50 GLU QG 2.900 . 4.000 2.374 2.120 3.542 . 0 0 "[ . 1 .]" 1
971 2 50 GLU HA 2 50 GLU HB2 2.700 . 3.600 3.017 2.984 3.025 . 0 0 "[ . 1 .]" 1
972 2 50 GLU HA 2 50 GLU HB3 2.250 . 2.700 2.524 2.482 2.643 . 0 0 "[ . 1 .]" 1
973 2 50 GLU HA 2 50 GLU QG 2.700 . 3.600 2.548 2.376 2.954 . 0 0 "[ . 1 .]" 1
974 2 50 GLU HB2 2 50 GLU QG 2.250 . 2.700 2.310 2.160 2.394 . 0 0 "[ . 1 .]" 1
975 2 50 GLU HB3 2 51 ALA H 2.900 . 4.000 3.600 3.135 3.889 . 0 0 "[ . 1 .]" 1
976 2 51 ALA H 2 51 ALA HA 2.900 . 4.000 2.841 2.815 2.888 . 0 0 "[ . 1 .]" 1
977 2 51 ALA H 2 51 ALA MB 2.900 . 4.000 2.133 2.039 2.280 . 0 0 "[ . 1 .]" 1
978 2 51 ALA H 2 52 GLY H 2.900 . 4.000 2.623 2.458 2.721 . 0 0 "[ . 1 .]" 1
979 2 51 ALA HA 2 52 GLY H 2.900 . 4.000 3.546 3.435 3.560 . 0 0 "[ . 1 .]" 1
980 2 51 ALA MB 2 52 GLY H 3.400 . 5.000 2.656 2.493 3.112 . 0 0 "[ . 1 .]" 1
981 2 51 ALA MB 2 53 GLY H 3.400 . 5.000 2.917 2.484 3.907 . 0 0 "[ . 1 .]" 1
982 2 51 ALA MB 2 54 ASN H 3.900 . 6.000 3.759 2.623 4.892 . 0 0 "[ . 1 .]" 1
983 2 51 ALA MB 2 55 TYR H 3.400 . 5.000 3.490 2.026 4.151 . 0 0 "[ . 1 .]" 1
984 2 51 ALA MB 2 55 TYR HB2 3.150 . 4.500 2.304 1.858 3.109 . 0 0 "[ . 1 .]" 1
985 2 51 ALA MB 2 55 TYR HB3 3.150 . 4.500 2.315 1.916 3.032 . 0 0 "[ . 1 .]" 1
986 2 51 ALA MB 2 55 TYR QD 3.600 . 5.400 3.203 2.458 3.688 . 0 0 "[ . 1 .]" 1
987 2 52 GLY H 2 52 GLY QA 2.400 . 3.000 2.242 2.187 2.416 . 0 0 "[ . 1 .]" 1
988 2 52 GLY H 2 53 GLY H 2.900 . 4.000 2.973 2.286 4.020 0.020 4 0 "[ . 1 .]" 1
989 2 53 GLY H 2 54 ASN H 2.900 . 4.000 3.044 2.101 4.026 0.026 5 0 "[ . 1 .]" 1
990 2 53 GLY QA 2 54 ASN H 2.900 . 4.000 2.442 2.102 2.907 . 0 0 "[ . 1 .]" 1
991 2 54 ASN H 2 54 ASN HB2 2.900 . 4.000 2.692 2.425 3.499 . 0 0 "[ . 1 .]" 1
992 2 54 ASN H 2 54 ASN HB3 2.900 . 4.000 3.756 3.612 4.038 0.038 10 0 "[ . 1 .]" 1
993 2 54 ASN H 2 55 TYR H 2.900 . 4.000 3.237 2.041 4.019 0.019 12 0 "[ . 1 .]" 1
994 2 54 ASN HA 2 54 ASN HB2 2.700 . 3.600 3.027 3.024 3.032 . 0 0 "[ . 1 .]" 1
995 2 54 ASN HA 2 54 ASN HB3 2.700 . 3.600 2.488 2.454 2.531 . 0 0 "[ . 1 .]" 1
996 2 55 TYR H 2 55 TYR HA 2.900 . 4.000 2.837 2.281 2.891 . 0 0 "[ . 1 .]" 1
997 2 55 TYR H 2 55 TYR HB2 2.900 . 4.000 3.155 2.660 3.643 . 0 0 "[ . 1 .]" 1
998 2 55 TYR H 2 55 TYR HB3 2.400 . 3.000 2.694 2.277 3.169 0.169 13 0 "[ . 1 .]" 1
999 2 55 TYR H 2 55 TYR QD 3.400 . 5.000 4.195 4.046 4.337 . 0 0 "[ . 1 .]" 1
1000 2 55 TYR HA 2 55 TYR HB2 2.700 . 3.600 2.391 2.332 2.474 . 0 0 "[ . 1 .]" 1
1001 2 55 TYR HA 2 55 TYR HB3 2.700 . 3.600 3.018 2.987 3.032 . 0 0 "[ . 1 .]" 1
1002 2 55 TYR HA 2 55 TYR QD 2.700 . 3.600 3.009 2.720 3.240 . 0 0 "[ . 1 .]" 1
1003 2 55 TYR HB2 2 55 TYR QD 2.700 . 3.600 2.402 2.291 2.533 . 0 0 "[ . 1 .]" 1
1004 2 55 TYR HB2 2 56 THR H 3.400 . 5.000 4.007 3.588 4.343 . 0 0 "[ . 1 .]" 1
1005 2 55 TYR HB3 2 55 TYR QD 2.700 . 3.600 2.426 2.308 2.585 . 0 0 "[ . 1 .]" 1
1006 2 55 TYR HB3 2 56 THR H 3.400 . 5.000 3.475 2.092 4.381 . 0 0 "[ . 1 .]" 1
1007 2 55 TYR QD 2 56 THR H 3.400 . 5.000 3.144 2.280 3.818 . 0 0 "[ . 1 .]" 1
1008 2 55 TYR QD 2 57 PRO HA 3.150 . 4.500 3.850 3.625 4.036 . 0 0 "[ . 1 .]" 1
1009 2 55 TYR QD 2 57 PRO QD 3.600 . 5.400 3.733 3.485 4.071 . 0 0 "[ . 1 .]" 1
1010 2 55 TYR QE 2 56 THR HA 3.600 . 5.400 4.716 4.484 4.824 . 0 0 "[ . 1 .]" 1
1011 2 55 TYR QE 2 57 PRO HA 2.700 . 3.600 2.175 1.902 2.365 . 0 0 "[ . 1 .]" 1
1012 2 55 TYR QE 2 57 PRO QB 3.150 . 4.500 3.511 3.105 3.588 . 0 0 "[ . 1 .]" 1
1013 2 55 TYR QE 2 57 PRO QG 3.150 . 4.500 3.591 3.578 3.604 . 0 0 "[ . 1 .]" 1
1014 2 55 TYR QE 2 58 ALA H 3.400 . 5.000 3.780 3.046 4.201 . 0 0 "[ . 1 .]" 1
1015 2 56 THR H 2 56 THR HB 2.900 . 4.000 2.835 2.501 3.285 . 0 0 "[ . 1 .]" 1
1016 2 56 THR H 2 56 THR MG 3.900 . 6.000 2.975 2.321 3.794 . 0 0 "[ . 1 .]" 1
1017 2 56 THR HA 2 56 THR HB 2.700 . 3.600 2.632 2.586 2.679 . 0 0 "[ . 1 .]" 1
1018 2 56 THR HA 2 56 THR MG 2.700 . 3.600 3.129 3.112 3.147 . 0 0 "[ . 1 .]" 1
1019 2 56 THR HA 2 57 PRO QD 2.250 . 2.700 1.762 1.690 1.803 0.110 13 0 "[ . 1 .]" 1
1020 2 56 THR MG 2 57 PRO QD 3.150 . 4.500 3.372 3.365 3.381 . 0 0 "[ . 1 .]" 1
1021 2 57 PRO HA 2 57 PRO QB 2.250 . 2.700 2.199 2.180 2.214 . 0 0 "[ . 1 .]" 1
1022 2 57 PRO HA 2 57 PRO QG 3.150 . 4.500 3.022 2.874 3.228 . 0 0 "[ . 1 .]" 1
1023 2 57 PRO HA 2 58 ALA H 2.400 . 3.000 2.222 2.123 2.414 . 0 0 "[ . 1 .]" 1
1024 2 57 PRO HA 2 59 LEU H 3.400 . 5.000 3.999 3.336 4.944 . 0 0 "[ . 1 .]" 1
1025 2 57 PRO QB 2 57 PRO QD 2.700 . 3.600 2.731 2.691 2.822 . 0 0 "[ . 1 .]" 1
1026 2 57 PRO QB 2 58 ALA H 2.900 . 4.000 3.059 2.595 3.427 . 0 0 "[ . 1 .]" 1
1027 2 57 PRO QB 2 59 LEU H 2.900 . 4.000 2.994 2.461 3.602 . 0 0 "[ . 1 .]" 1
1028 2 58 ALA H 2 58 ALA HA 2.900 . 4.000 2.886 2.819 2.921 . 0 0 "[ . 1 .]" 1
1029 2 58 ALA H 2 58 ALA MB 2.900 . 4.000 2.216 2.057 2.317 . 0 0 "[ . 1 .]" 1
1030 2 58 ALA H 2 59 LEU H 2.900 . 4.000 2.591 2.306 2.807 . 0 0 "[ . 1 .]" 1
1031 2 58 ALA HA 2 59 LEU H 2.900 . 4.000 3.386 3.051 3.584 . 0 0 "[ . 1 .]" 1
1032 2 58 ALA MB 2 59 LEU H 3.400 . 5.000 2.964 2.054 3.602 . 0 0 "[ . 1 .]" 1
1033 2 59 LEU H 2 59 LEU HA 2.900 . 4.000 2.886 2.875 2.895 . 0 0 "[ . 1 .]" 1
1034 2 59 LEU H 2 59 LEU QB 2.900 . 4.000 2.562 2.149 3.266 . 0 0 "[ . 1 .]" 1
1035 2 59 LEU H 2 59 LEU QD 3.900 . 6.000 3.198 1.952 3.624 . 0 0 "[ . 1 .]" 1
1036 2 59 LEU H 2 60 THR H 3.900 . 6.000 4.400 4.256 4.541 . 0 0 "[ . 1 .]" 1
1037 2 59 LEU H 2 63 GLU QG 3.400 . 5.000 4.440 4.242 4.525 . 0 0 "[ . 1 .]" 1
1038 2 59 LEU HA 2 59 LEU QD 3.150 . 4.500 2.457 1.699 3.310 0.101 13 0 "[ . 1 .]" 1
1039 2 59 LEU HA 2 59 LEU HG 3.150 . 4.500 2.629 2.294 3.772 . 0 0 "[ . 1 .]" 1
1040 2 59 LEU HA 2 60 THR H 2.400 . 3.000 2.306 2.176 2.543 . 0 0 "[ . 1 .]" 1
1041 2 59 LEU QB 2 60 THR H 3.400 . 5.000 2.472 1.825 2.753 . 0 0 "[ . 1 .]" 1
1042 2 59 LEU QB 2 63 GLU H 3.400 . 5.000 4.508 3.378 4.673 . 0 0 "[ . 1 .]" 1
1043 2 59 LEU QB 2 64 VAL H 3.900 . 6.000 4.574 4.016 4.834 . 0 0 "[ . 1 .]" 1
1044 2 59 LEU QD 2 60 THR H 3.900 . 6.000 3.173 2.036 3.416 . 0 0 "[ . 1 .]" 1
1045 2 59 LEU QD 2 63 GLU H 3.900 . 6.000 4.013 2.895 4.375 . 0 0 "[ . 1 .]" 1
1046 2 59 LEU QD 2 63 GLU HB2 3.600 . 5.400 2.252 1.550 2.775 0.250 9 0 "[ . 1 .]" 1
1047 2 59 LEU QD 2 63 GLU HB3 3.150 . 4.500 2.366 1.691 2.531 0.109 13 0 "[ . 1 .]" 1
1048 2 59 LEU QD 2 63 GLU QG 3.600 . 5.400 1.946 1.571 2.833 0.229 9 0 "[ . 1 .]" 1
1049 2 59 LEU QD 2 64 VAL H 3.900 . 6.000 3.401 2.469 3.743 . 0 0 "[ . 1 .]" 1
1050 2 59 LEU QD 2 64 VAL HA 3.600 . 5.400 3.491 2.843 3.916 . 0 0 "[ . 1 .]" 1
1051 2 59 LEU HG 2 64 VAL H 3.900 . 6.000 4.382 4.073 5.601 . 0 0 "[ . 1 .]" 1
1052 2 59 LEU HG 2 64 VAL MG2 3.150 . 4.500 3.799 3.771 3.838 . 0 0 "[ . 1 .]" 1
1053 2 60 THR H 2 60 THR HB 2.900 . 4.000 3.930 3.887 3.975 . 0 0 "[ . 1 .]" 1
1054 2 60 THR H 2 60 THR MG 2.900 . 4.000 3.266 3.173 3.351 . 0 0 "[ . 1 .]" 1
1055 2 60 THR H 2 61 GLU H 3.400 . 5.000 4.320 4.295 4.335 . 0 0 "[ . 1 .]" 1
1056 2 60 THR H 2 63 GLU H 3.400 . 5.000 2.557 2.310 2.659 . 0 0 "[ . 1 .]" 1
1057 2 60 THR H 2 63 GLU HB2 2.900 . 4.000 2.369 1.800 2.519 . 3 0 "[ . 1 .]" 1
1058 2 60 THR H 2 63 GLU HB3 2.900 . 4.000 3.967 3.476 4.051 0.051 14 0 "[ . 1 .]" 1
1059 2 60 THR H 2 64 VAL H 2.900 . 4.000 3.706 3.406 4.000 0.000 7 0 "[ . 1 .]" 1
1060 2 60 THR HA 2 60 THR MG 2.700 . 3.600 2.381 2.284 2.474 . 0 0 "[ . 1 .]" 1
1061 2 60 THR HB 2 61 GLU H 2.400 . 3.000 2.104 1.997 2.208 . 0 0 "[ . 1 .]" 1
1062 2 60 THR HB 2 62 GLN H 2.900 . 4.000 2.852 2.713 3.013 . 0 0 "[ . 1 .]" 1
1063 2 60 THR MG 2 61 GLU H 3.400 . 5.000 3.631 3.566 3.763 . 0 0 "[ . 1 .]" 1
1064 2 60 THR MG 2 62 GLN H 3.900 . 6.000 4.105 4.025 4.193 . 0 0 "[ . 1 .]" 1
1065 2 60 THR MG 2 63 GLU H 3.900 . 6.000 4.570 4.342 4.793 . 0 0 "[ . 1 .]" 1
1066 2 61 GLU H 2 61 GLU HA 2.900 . 4.000 2.798 2.783 2.807 . 0 0 "[ . 1 .]" 1
1067 2 61 GLU H 2 61 GLU HB2 2.900 . 4.000 2.527 2.280 2.679 . 0 0 "[ . 1 .]" 1
1068 2 61 GLU H 2 61 GLU HB3 2.900 . 4.000 3.601 3.545 3.624 . 0 0 "[ . 1 .]" 1
1069 2 61 GLU H 2 61 GLU QG 2.900 . 4.000 2.548 1.961 2.929 . 0 0 "[ . 1 .]" 1
1070 2 61 GLU H 2 62 GLN H 2.900 . 4.000 2.624 2.567 2.682 . 0 0 "[ . 1 .]" 1
1071 2 61 GLU H 2 63 GLU H 3.400 . 5.000 4.512 4.384 4.647 . 0 0 "[ . 1 .]" 1
1072 2 61 GLU HA 2 61 GLU HB2 2.700 . 3.600 3.021 2.988 3.033 . 0 0 "[ . 1 .]" 1
1073 2 61 GLU HA 2 61 GLU HB3 2.700 . 3.600 2.491 2.431 2.610 . 0 0 "[ . 1 .]" 1
1074 2 61 GLU HA 2 61 GLU QG 2.700 . 3.600 2.512 2.339 2.989 . 0 0 "[ . 1 .]" 1
1075 2 61 GLU HA 2 62 GLN H 2.900 . 4.000 3.454 3.435 3.474 . 0 0 "[ . 1 .]" 1
1076 2 61 GLU HA 2 63 GLU H 3.400 . 5.000 4.388 4.239 4.616 . 0 0 "[ . 1 .]" 1
1077 2 61 GLU HA 2 64 VAL H 2.900 . 4.000 3.390 3.226 3.544 . 0 0 "[ . 1 .]" 1
1078 2 61 GLU HA 2 64 VAL HB 2.700 . 3.600 2.531 2.415 2.611 . 0 0 "[ . 1 .]" 1
1079 2 61 GLU HA 2 64 VAL MG1 3.150 . 4.500 3.755 3.677 3.788 . 0 0 "[ . 1 .]" 1
1080 2 61 GLU HA 2 64 VAL MG2 3.150 . 4.500 2.289 1.809 3.089 . 0 0 "[ . 1 .]" 1
1081 2 61 GLU HA 2 65 TYR H 3.900 . 6.000 3.707 3.440 3.866 . 0 0 "[ . 1 .]" 1
1082 2 61 GLU HB2 2 86 LEU QD 3.600 . 5.400 3.795 3.150 4.037 . 0 0 "[ . 1 .]" 1
1083 2 61 GLU HB3 2 61 GLU QG 2.250 . 2.700 2.231 2.135 2.391 . 0 0 "[ . 1 .]" 1
1084 2 61 GLU HB3 2 62 GLN H 2.900 . 4.000 3.943 3.684 4.036 0.036 13 0 "[ . 1 .]" 1
1085 2 61 GLU HB3 2 86 LEU QD 3.600 . 5.400 2.409 1.826 2.783 . 0 0 "[ . 1 .]" 1
1086 2 61 GLU QG 2 62 GLN H 3.400 . 5.000 4.354 4.041 4.500 . 0 0 "[ . 1 .]" 1
1087 2 61 GLU QG 2 86 LEU QD 3.600 . 5.400 2.967 2.416 3.577 . 0 0 "[ . 1 .]" 1
1088 2 62 GLN H 2 62 GLN HA 2.900 . 4.000 2.806 2.798 2.817 . 0 0 "[ . 1 .]" 1
1089 2 62 GLN H 2 62 GLN QG 2.900 . 4.000 2.229 2.024 3.281 . 0 0 "[ . 1 .]" 1
1090 2 62 GLN H 2 63 GLU H 2.900 . 4.000 2.776 2.680 2.896 . 0 0 "[ . 1 .]" 1
1091 2 62 GLN H 2 64 VAL H 2.900 . 4.000 4.021 3.991 4.063 0.063 13 0 "[ . 1 .]" 1
1092 2 62 GLN HA 2 62 GLN HB2 2.700 . 3.600 3.022 3.014 3.026 . 0 0 "[ . 1 .]" 1
1093 2 62 GLN HA 2 62 GLN HB3 2.250 . 2.700 2.479 2.435 2.546 . 0 0 "[ . 1 .]" 1
1094 2 62 GLN HA 2 62 GLN QG 2.700 . 3.600 2.534 2.410 2.928 . 0 0 "[ . 1 .]" 1
1095 2 62 GLN HA 2 63 GLU H 2.900 . 4.000 3.609 3.563 3.659 . 0 0 "[ . 1 .]" 1
1096 2 62 GLN HA 2 65 TYR H 3.400 . 5.000 4.035 3.839 4.241 . 0 0 "[ . 1 .]" 1
1097 2 62 GLN HA 2 65 TYR HB3 3.150 . 4.500 3.487 3.085 3.791 . 0 0 "[ . 1 .]" 1
1098 2 62 GLN QG 2 63 GLU H 3.400 . 5.000 4.109 4.001 4.474 . 0 0 "[ . 1 .]" 1
1099 2 63 GLU H 2 63 GLU HA 2.900 . 4.000 2.864 2.858 2.875 . 0 0 "[ . 1 .]" 1
1100 2 63 GLU H 2 63 GLU HB2 2.400 . 3.000 2.431 2.217 2.623 . 0 0 "[ . 1 .]" 1
1101 2 63 GLU H 2 64 VAL H 2.900 . 4.000 2.478 2.444 2.505 . 0 0 "[ . 1 .]" 1
1102 2 63 GLU HA 2 63 GLU HB2 2.700 . 3.600 3.014 2.996 3.025 . 0 0 "[ . 1 .]" 1
1103 2 63 GLU HA 2 63 GLU HB3 2.700 . 3.600 2.508 2.411 2.636 . 0 0 "[ . 1 .]" 1
1104 2 63 GLU HA 2 63 GLU QG 2.700 . 3.600 2.962 2.491 3.105 . 0 0 "[ . 1 .]" 1
1105 2 63 GLU HA 2 64 VAL H 3.400 . 5.000 3.502 3.488 3.514 . 0 0 "[ . 1 .]" 1
1106 2 63 GLU HA 2 66 ALA H 2.900 . 4.000 3.699 3.564 3.820 . 0 0 "[ . 1 .]" 1
1107 2 63 GLU HA 2 66 ALA MB 2.700 . 3.600 2.356 2.206 2.472 . 0 0 "[ . 1 .]" 1
1108 2 63 GLU HA 2 67 GLN H 3.400 . 5.000 3.782 3.516 4.019 . 0 0 "[ . 1 .]" 1
1109 2 63 GLU HB2 2 64 VAL H 2.900 . 4.000 2.621 2.550 2.886 . 0 0 "[ . 1 .]" 1
1110 2 63 GLU HB3 2 64 VAL H 2.900 . 4.000 3.605 3.227 3.779 . 0 0 "[ . 1 .]" 1
1111 2 64 VAL H 2 64 VAL HA 2.900 . 4.000 2.801 2.783 2.818 . 0 0 "[ . 1 .]" 1
1112 2 64 VAL H 2 64 VAL HB 2.400 . 3.000 2.558 2.446 2.633 . 0 0 "[ . 1 .]" 1
1113 2 64 VAL H 2 64 VAL MG1 3.400 . 5.000 3.731 3.724 3.738 . 0 0 "[ . 1 .]" 1
1114 2 64 VAL H 2 64 VAL MG2 2.900 . 4.000 1.965 1.883 2.146 . 0 0 "[ . 1 .]" 1
1115 2 64 VAL HA 2 64 VAL HB 2.700 . 3.600 3.019 3.014 3.022 . 0 0 "[ . 1 .]" 1
1116 2 64 VAL HA 2 64 VAL MG1 2.700 . 3.600 2.404 2.329 2.454 . 0 0 "[ . 1 .]" 1
1117 2 64 VAL HA 2 64 VAL MG2 2.700 . 3.600 2.412 2.292 2.453 . 0 0 "[ . 1 .]" 1
1118 2 64 VAL HA 2 65 TYR H 3.400 . 5.000 3.576 3.566 3.585 . 0 0 "[ . 1 .]" 1
1119 2 64 VAL HA 2 67 GLN H 3.400 . 5.000 3.963 3.724 4.092 . 0 0 "[ . 1 .]" 1
1120 2 64 VAL HA 2 67 GLN QB 3.150 . 4.500 3.568 3.323 3.782 . 0 0 "[ . 1 .]" 1
1121 2 64 VAL HA 2 68 VAL MG2 3.600 . 5.400 3.489 3.298 3.667 . 0 0 "[ . 1 .]" 1
1122 2 64 VAL HB 2 65 TYR H 2.900 . 4.000 2.131 2.076 2.250 . 0 0 "[ . 1 .]" 1
1123 2 64 VAL HB 2 66 ALA H 3.900 . 6.000 4.549 4.508 4.610 . 0 0 "[ . 1 .]" 1
1124 2 64 VAL MG1 2 65 TYR H 3.400 . 5.000 3.176 2.957 3.264 . 0 0 "[ . 1 .]" 1
1125 2 64 VAL MG1 2 65 TYR HA 3.150 . 4.500 3.517 3.236 3.630 . 0 0 "[ . 1 .]" 1
1126 2 64 VAL MG1 2 68 VAL MG2 3.150 . 4.500 2.555 2.162 2.854 . 0 0 "[ . 1 .]" 1
1127 2 64 VAL MG1 2 82 PHE QE 3.600 . 5.400 2.545 2.237 3.090 . 0 0 "[ . 1 .]" 1
1128 2 64 VAL MG1 2 82 PHE HZ 3.150 . 4.500 1.771 1.618 2.458 0.182 4 0 "[ . 1 .]" 1
1129 2 64 VAL MG1 2 86 LEU HB2 3.600 . 5.400 4.464 3.967 4.553 . 0 0 "[ . 1 .]" 1
1130 2 64 VAL MG1 2 86 LEU HB3 3.600 . 5.400 4.214 3.399 4.453 . 0 0 "[ . 1 .]" 1
1131 2 64 VAL MG2 2 65 TYR H 3.400 . 5.000 3.600 3.538 3.685 . 0 0 "[ . 1 .]" 1
1132 2 64 VAL MG2 2 66 ALA H 3.900 . 6.000 5.055 5.032 5.076 . 0 0 "[ . 1 .]" 1
1133 2 65 TYR H 2 65 TYR HA 2.900 . 4.000 2.804 2.797 2.814 . 0 0 "[ . 1 .]" 1
1134 2 65 TYR H 2 65 TYR HB2 2.900 . 4.000 2.495 2.461 2.544 . 0 0 "[ . 1 .]" 1
1135 2 65 TYR H 2 65 TYR HB3 2.400 . 3.000 2.568 2.508 2.619 . 0 0 "[ . 1 .]" 1
1136 2 65 TYR H 2 65 TYR QD 3.400 . 5.000 4.202 4.188 4.211 . 0 0 "[ . 1 .]" 1
1137 2 65 TYR H 2 66 ALA H 2.900 . 4.000 2.674 2.653 2.690 . 0 0 "[ . 1 .]" 1
1138 2 65 TYR HA 2 65 TYR HB2 2.700 . 3.600 2.473 2.447 2.499 . 0 0 "[ . 1 .]" 1
1139 2 65 TYR HA 2 65 TYR HB3 2.700 . 3.600 3.026 3.021 3.028 . 0 0 "[ . 1 .]" 1
1140 2 65 TYR HA 2 65 TYR QD 2.700 . 3.600 3.012 2.535 3.204 . 0 0 "[ . 1 .]" 1
1141 2 65 TYR HA 2 66 ALA H 3.400 . 5.000 3.521 3.503 3.536 . 0 0 "[ . 1 .]" 1
1142 2 65 TYR HA 2 68 VAL H 2.900 . 4.000 3.743 3.608 3.889 . 0 0 "[ . 1 .]" 1
1143 2 65 TYR HA 2 68 VAL HB 2.700 . 3.600 2.762 2.468 3.032 . 0 0 "[ . 1 .]" 1
1144 2 65 TYR HA 2 68 VAL MG2 3.150 . 4.500 3.292 2.996 3.596 . 0 0 "[ . 1 .]" 1
1145 2 65 TYR HA 2 82 PHE QE 3.150 . 4.500 2.030 1.705 2.957 0.095 7 0 "[ . 1 .]" 1
1146 2 65 TYR HB2 2 65 TYR QD 3.150 . 4.500 2.363 2.269 2.566 . 0 0 "[ . 1 .]" 1
1147 2 65 TYR HB2 2 66 ALA H 2.900 . 4.000 3.947 3.867 4.014 0.014 5 0 "[ . 1 .]" 1
1148 2 65 TYR HB3 2 65 TYR QD 3.150 . 4.500 2.490 2.288 2.607 . 0 0 "[ . 1 .]" 1
1149 2 65 TYR HB3 2 66 ALA H 2.900 . 4.000 2.752 2.600 2.866 . 0 0 "[ . 1 .]" 1
1150 2 65 TYR HB3 2 86 LEU QD 3.600 . 5.400 3.665 3.173 4.038 . 0 0 "[ . 1 .]" 1
1151 2 65 TYR QD 2 66 ALA H 3.900 . 6.000 3.609 3.494 3.761 . 0 0 "[ . 1 .]" 1
1152 2 65 TYR QD 2 66 ALA HA 3.150 . 4.500 3.128 2.870 3.720 . 0 0 "[ . 1 .]" 1
1153 2 65 TYR QD 2 66 ALA MB 3.600 . 5.400 4.008 3.980 4.022 . 0 0 "[ . 1 .]" 1
1154 2 65 TYR QD 2 68 VAL HB 3.600 . 5.400 4.659 4.278 4.836 . 0 0 "[ . 1 .]" 1
1155 2 65 TYR QD 2 69 ALA MB 3.600 . 5.400 3.129 2.554 3.950 . 0 0 "[ . 1 .]" 1
1156 2 65 TYR QD 2 82 PHE QD 3.150 . 4.500 3.016 1.887 3.580 . 0 0 "[ . 1 .]" 1
1157 2 65 TYR QD 2 83 GLY QA 3.600 . 5.400 3.149 2.675 3.625 . 0 0 "[ . 1 .]" 1
1158 2 65 TYR QD 2 86 LEU QD 3.150 . 4.500 2.636 1.995 2.982 . 0 0 "[ . 1 .]" 1
1159 2 65 TYR QE 2 69 ALA MB 3.600 . 5.400 2.872 2.308 3.777 . 0 0 "[ . 1 .]" 1
1160 2 65 TYR QE 2 79 LEU QD 3.600 . 5.400 3.416 3.153 3.577 . 0 0 "[ . 1 .]" 1
1161 2 65 TYR QE 2 82 PHE HB3 3.600 . 5.400 4.174 3.348 4.798 . 0 0 "[ . 1 .]" 1
1162 2 65 TYR QE 2 82 PHE QD 3.600 . 5.400 3.914 3.215 4.295 . 0 0 "[ . 1 .]" 1
1163 2 65 TYR QE 2 83 GLY QA 3.600 . 5.400 3.103 2.461 3.625 . 0 0 "[ . 1 .]" 1
1164 2 66 ALA H 2 66 ALA HA 2.900 . 4.000 2.808 2.789 2.818 . 0 0 "[ . 1 .]" 1
1165 2 66 ALA H 2 66 ALA MB 2.900 . 4.000 2.228 2.195 2.252 . 0 0 "[ . 1 .]" 1
1166 2 66 ALA H 2 67 GLN H 2.900 . 4.000 2.889 2.839 2.982 . 0 0 "[ . 1 .]" 1
1167 2 66 ALA H 2 67 GLN QB 3.900 . 6.000 4.855 4.796 4.930 . 0 0 "[ . 1 .]" 1
1168 2 66 ALA H 2 69 ALA MB 3.900 . 6.000 4.571 4.450 4.891 . 0 0 "[ . 1 .]" 1
1169 2 66 ALA HA 2 67 GLN H 3.400 . 5.000 3.580 3.566 3.591 . 0 0 "[ . 1 .]" 1
1170 2 66 ALA HA 2 69 ALA H 2.900 . 4.000 3.745 3.622 3.857 . 0 0 "[ . 1 .]" 1
1171 2 66 ALA HA 2 69 ALA MB 2.700 . 3.600 2.776 2.543 3.002 . 0 0 "[ . 1 .]" 1
1172 2 66 ALA MB 2 67 GLN H 2.900 . 4.000 2.357 2.253 2.418 . 0 0 "[ . 1 .]" 1
1173 2 67 GLN H 2 67 GLN HA 2.900 . 4.000 2.823 2.820 2.826 . 0 0 "[ . 1 .]" 1
1174 2 67 GLN H 2 67 GLN QB 2.900 . 4.000 2.417 2.285 2.486 . 0 0 "[ . 1 .]" 1
1175 2 67 GLN H 2 67 GLN QG 2.900 . 4.000 2.393 2.141 3.437 . 0 0 "[ . 1 .]" 1
1176 2 67 GLN H 2 68 VAL H 2.900 . 4.000 2.691 2.658 2.725 . 0 0 "[ . 1 .]" 1
1177 2 67 GLN HA 2 67 GLN QG 2.700 . 3.600 2.516 2.376 2.956 . 0 0 "[ . 1 .]" 1
1178 2 67 GLN HA 2 68 VAL H 3.400 . 5.000 3.547 3.530 3.568 . 0 0 "[ . 1 .]" 1
1179 2 67 GLN HA 2 70 ARG H 2.900 . 4.000 3.586 3.482 3.672 . 0 0 "[ . 1 .]" 1
1180 2 67 GLN HA 2 70 ARG QB 2.700 . 3.600 3.145 2.766 3.217 . 0 0 "[ . 1 .]" 1
1181 2 67 GLN HA 2 70 ARG QD 3.600 . 5.400 3.399 2.320 4.819 . 0 0 "[ . 1 .]" 1
1182 2 67 GLN QB 2 67 GLN QG 2.250 . 2.700 2.057 1.992 2.088 . 0 0 "[ . 1 .]" 1
1183 2 67 GLN QB 2 68 VAL H 2.900 . 4.000 2.644 2.536 2.760 . 0 0 "[ . 1 .]" 1
1184 2 67 GLN QB 2 68 VAL MG2 3.600 . 5.400 3.194 3.021 3.384 . 0 0 "[ . 1 .]" 1
1185 2 67 GLN QG 2 68 VAL H 3.900 . 6.000 4.186 4.059 4.616 . 0 0 "[ . 1 .]" 1
1186 2 68 VAL H 2 68 VAL HA 2.900 . 4.000 2.836 2.825 2.847 . 0 0 "[ . 1 .]" 1
1187 2 68 VAL H 2 68 VAL HB 2.400 . 3.000 2.529 2.444 2.619 . 0 0 "[ . 1 .]" 1
1188 2 68 VAL H 2 68 VAL MG1 3.400 . 5.000 3.775 3.751 3.787 . 0 0 "[ . 1 .]" 1
1189 2 68 VAL H 2 68 VAL MG2 2.900 . 4.000 2.208 1.974 2.424 . 0 0 "[ . 1 .]" 1
1190 2 68 VAL H 2 69 ALA H 2.900 . 4.000 2.634 2.575 2.692 . 0 0 "[ . 1 .]" 1
1191 2 68 VAL HA 2 68 VAL HB 2.700 . 3.600 3.026 3.013 3.031 . 0 0 "[ . 1 .]" 1
1192 2 68 VAL HA 2 68 VAL MG1 2.700 . 3.600 2.404 2.336 2.474 . 0 0 "[ . 1 .]" 1
1193 2 68 VAL HA 2 68 VAL MG2 2.700 . 3.600 2.368 2.263 2.484 . 0 0 "[ . 1 .]" 1
1194 2 68 VAL HA 2 69 ALA H 3.400 . 5.000 3.547 3.531 3.564 . 0 0 "[ . 1 .]" 1
1195 2 68 VAL HA 2 70 ARG H 3.900 . 6.000 4.069 3.945 4.189 . 0 0 "[ . 1 .]" 1
1196 2 68 VAL HA 2 71 LEU H 2.900 . 4.000 3.231 3.084 3.332 . 0 0 "[ . 1 .]" 1
1197 2 68 VAL HA 2 71 LEU HB2 3.150 . 4.500 2.881 2.336 3.093 . 0 0 "[ . 1 .]" 1
1198 2 68 VAL HA 2 71 LEU HB3 3.150 . 4.500 4.367 3.929 4.527 0.027 8 0 "[ . 1 .]" 1
1199 2 68 VAL HA 2 71 LEU QD 3.150 . 4.500 2.260 1.697 2.574 0.103 9 0 "[ . 1 .]" 1
1200 2 68 VAL HA 2 71 LEU HG 3.150 . 4.500 3.074 2.409 4.553 0.053 14 0 "[ . 1 .]" 1
1201 2 68 VAL HB 2 69 ALA H 2.900 . 4.000 2.653 2.545 2.810 . 0 0 "[ . 1 .]" 1
1202 2 68 VAL HB 2 70 ARG H 3.400 . 5.000 4.997 4.865 5.055 0.055 9 0 "[ . 1 .]" 1
1203 2 68 VAL HB 2 79 LEU QD 3.150 . 4.500 3.117 2.796 3.334 . 0 0 "[ . 1 .]" 1
1204 2 68 VAL MG1 2 69 ALA H 3.400 . 5.000 3.490 3.249 3.661 . 0 0 "[ . 1 .]" 1
1205 2 68 VAL MG1 2 72 PHE QD 3.600 . 5.400 2.976 1.953 3.429 . 0 0 "[ . 1 .]" 1
1206 2 68 VAL MG1 2 72 PHE HZ 3.600 . 5.400 3.394 2.951 4.057 . 0 0 "[ . 1 .]" 1
1207 2 68 VAL MG1 2 79 LEU HA 3.600 . 5.400 3.674 3.536 3.929 . 0 0 "[ . 1 .]" 1
1208 2 68 VAL MG1 2 79 LEU QD 3.600 . 5.400 1.848 1.640 2.207 0.160 9 0 "[ . 1 .]" 1
1209 2 68 VAL MG1 2 82 PHE QD 3.600 . 5.400 2.834 2.125 3.393 . 0 0 "[ . 1 .]" 1
1210 2 68 VAL MG2 2 69 ALA H 3.900 . 6.000 3.859 3.761 4.004 . 0 0 "[ . 1 .]" 1
1211 2 68 VAL MG2 2 71 LEU QD 3.600 . 5.400 3.059 2.924 3.272 . 0 0 "[ . 1 .]" 1
1212 2 68 VAL MG2 2 82 PHE QE 3.150 . 4.500 2.406 1.737 3.070 0.063 12 0 "[ . 1 .]" 1
1213 2 68 VAL MG2 2 82 PHE HZ 3.600 . 5.400 2.659 2.261 2.980 . 0 0 "[ . 1 .]" 1
1214 2 69 ALA H 2 69 ALA HA 2.900 . 4.000 2.781 2.773 2.786 . 0 0 "[ . 1 .]" 1
1215 2 69 ALA H 2 69 ALA MB 2.900 . 4.000 2.153 2.048 2.242 . 0 0 "[ . 1 .]" 1
1216 2 69 ALA H 2 70 ARG H 2.900 . 4.000 2.749 2.721 2.776 . 0 0 "[ . 1 .]" 1
1217 2 69 ALA H 2 79 LEU QD 3.400 . 5.000 3.165 2.939 3.469 . 0 0 "[ . 1 .]" 1
1218 2 69 ALA HA 2 70 ARG H 2.900 . 4.000 3.521 3.507 3.532 . 0 0 "[ . 1 .]" 1
1219 2 69 ALA HA 2 71 LEU H 3.400 . 5.000 4.335 4.228 4.494 . 0 0 "[ . 1 .]" 1
1220 2 69 ALA HA 2 72 PHE H 2.900 . 4.000 3.595 3.482 3.771 . 0 0 "[ . 1 .]" 1
1221 2 69 ALA HA 2 79 LEU QD 2.700 . 3.600 1.710 1.607 1.825 0.193 6 0 "[ . 1 .]" 1
1222 2 69 ALA MB 2 70 ARG H 2.900 . 4.000 2.759 2.618 2.837 . 0 0 "[ . 1 .]" 1
1223 2 69 ALA MB 2 70 ARG HA 3.600 . 5.400 3.847 3.754 3.912 . 0 0 "[ . 1 .]" 1
1224 2 69 ALA MB 2 79 LEU QD 3.150 . 4.500 2.408 2.119 2.786 . 0 0 "[ . 1 .]" 1
1225 2 70 ARG H 2 70 ARG HA 2.900 . 4.000 2.848 2.835 2.859 . 0 0 "[ . 1 .]" 1
1226 2 70 ARG H 2 70 ARG QB 2.400 . 3.000 2.333 2.063 2.529 . 0 0 "[ . 1 .]" 1
1227 2 70 ARG H 2 70 ARG QD 3.900 . 6.000 3.841 3.328 4.469 . 0 0 "[ . 1 .]" 1
1228 2 70 ARG H 2 70 ARG QG 2.900 . 4.000 2.572 2.056 3.703 . 0 0 "[ . 1 .]" 1
1229 2 70 ARG H 2 71 LEU H 2.900 . 4.000 2.542 2.473 2.582 . 0 0 "[ . 1 .]" 1
1230 2 70 ARG H 2 71 LEU QD 3.900 . 6.000 4.226 3.337 4.506 . 0 0 "[ . 1 .]" 1
1231 2 70 ARG H 2 72 PHE H 3.400 . 5.000 4.240 4.062 4.406 . 0 0 "[ . 1 .]" 1
1232 2 70 ARG HA 2 70 ARG QD 3.150 . 4.500 3.611 1.994 4.025 . 0 0 "[ . 1 .]" 1
1233 2 70 ARG HA 2 70 ARG QG 2.700 . 3.600 2.513 2.214 3.011 . 0 0 "[ . 1 .]" 1
1234 2 70 ARG HA 2 73 LYS QD 3.150 . 4.500 3.108 2.117 4.033 . 0 0 "[ . 1 .]" 1
1235 2 70 ARG QB 2 70 ARG QD 3.150 . 4.500 2.180 2.109 2.356 . 0 0 "[ . 1 .]" 1
1236 2 70 ARG QB 2 70 ARG QG 2.250 . 2.700 2.067 1.994 2.088 . 0 0 "[ . 1 .]" 1
1237 2 70 ARG QB 2 71 LEU H 2.900 . 4.000 2.700 2.527 2.873 . 0 0 "[ . 1 .]" 1
1238 2 71 LEU H 2 71 LEU HB2 2.900 . 4.000 2.479 2.225 2.600 . 0 0 "[ . 1 .]" 1
1239 2 71 LEU H 2 71 LEU HB3 2.900 . 4.000 3.576 3.512 3.612 . 0 0 "[ . 1 .]" 1
1240 2 71 LEU H 2 71 LEU QD 3.400 . 5.000 2.713 1.976 3.038 . 0 0 "[ . 1 .]" 1
1241 2 71 LEU H 2 71 LEU HG 2.900 . 4.000 2.654 2.126 3.960 . 0 0 "[ . 1 .]" 1
1242 2 71 LEU H 2 72 PHE H 2.900 . 4.000 2.692 2.639 2.777 . 0 0 "[ . 1 .]" 1
1243 2 71 LEU HA 2 71 LEU HB2 2.700 . 3.600 3.014 2.989 3.026 . 0 0 "[ . 1 .]" 1
1244 2 71 LEU HA 2 71 LEU HB3 2.700 . 3.600 2.490 2.433 2.639 . 0 0 "[ . 1 .]" 1
1245 2 71 LEU HA 2 71 LEU QD 2.700 . 3.600 2.133 1.881 2.484 . 0 0 "[ . 1 .]" 1
1246 2 71 LEU HA 2 71 LEU HG 2.700 . 3.600 3.119 2.498 3.698 0.098 9 0 "[ . 1 .]" 1
1247 2 71 LEU HA 2 72 PHE H 2.900 . 4.000 3.558 3.541 3.570 . 0 0 "[ . 1 .]" 1
1248 2 71 LEU HB2 2 71 LEU QD 2.700 . 3.600 2.264 2.100 2.337 . 0 0 "[ . 1 .]" 1
1249 2 71 LEU HB2 2 72 PHE H 2.900 . 4.000 2.462 2.281 2.599 . 0 0 "[ . 1 .]" 1
1250 2 71 LEU HB2 2 72 PHE QD 3.600 . 5.400 2.413 1.699 3.588 0.101 1 0 "[ . 1 .]" 1
1251 2 71 LEU HB3 2 71 LEU QD 2.700 . 3.600 2.136 2.047 2.348 . 0 0 "[ . 1 .]" 1
1252 2 71 LEU HB3 2 71 LEU HG 2.700 . 3.600 2.854 2.394 3.012 . 0 0 "[ . 1 .]" 1
1253 2 71 LEU HB3 2 72 PHE H 2.900 . 4.000 3.469 3.129 3.701 . 0 0 "[ . 1 .]" 1
1254 2 71 LEU HB3 2 72 PHE QD 3.600 . 5.400 2.712 2.186 4.050 . 0 0 "[ . 1 .]" 1
1255 2 71 LEU QD 2 72 PHE QE 3.600 . 5.400 2.909 2.503 3.591 . 0 0 "[ . 1 .]" 1
1256 2 71 LEU HG 2 72 PHE H 3.400 . 5.000 4.366 4.076 5.013 0.013 11 0 "[ . 1 .]" 1
1257 2 72 PHE H 2 72 PHE HA 2.900 . 4.000 2.894 2.889 2.901 . 0 0 "[ . 1 .]" 1
1258 2 72 PHE H 2 72 PHE HB2 2.900 . 4.000 2.414 2.344 2.470 . 0 0 "[ . 1 .]" 1
1259 2 72 PHE H 2 72 PHE HB3 2.900 . 4.000 3.590 3.564 3.616 . 0 0 "[ . 1 .]" 1
1260 2 72 PHE H 2 72 PHE QD 3.400 . 5.000 2.317 1.757 3.086 0.043 9 0 "[ . 1 .]" 1
1261 2 72 PHE H 2 73 LYS H 2.900 . 4.000 3.343 2.809 4.060 0.060 5 0 "[ . 1 .]" 1
1262 2 72 PHE H 2 79 LEU QD 3.400 . 5.000 3.017 2.743 3.196 . 0 0 "[ . 1 .]" 1
1263 2 72 PHE H 2 79 LEU HG 2.900 . 4.000 4.066 4.006 4.113 0.113 4 0 "[ . 1 .]" 1
1264 2 72 PHE HA 2 72 PHE HB3 2.700 . 3.600 2.470 2.438 2.499 . 0 0 "[ . 1 .]" 1
1265 2 72 PHE HA 2 72 PHE QD 2.700 . 3.600 2.477 2.023 3.138 . 0 0 "[ . 1 .]" 1
1266 2 72 PHE HA 2 73 LYS H 2.900 . 4.000 2.836 2.627 3.170 . 0 0 "[ . 1 .]" 1
1267 2 72 PHE HA 2 75 GLN H 3.400 . 5.000 3.775 3.433 4.326 . 0 0 "[ . 1 .]" 1
1268 2 72 PHE HB2 2 72 PHE QD 3.150 . 4.500 2.631 2.278 2.735 . 0 0 "[ . 1 .]" 1
1269 2 72 PHE HB2 2 73 LYS H 3.400 . 5.000 4.135 2.440 4.404 . 0 0 "[ . 1 .]" 1
1270 2 72 PHE HB2 2 79 LEU QB 3.150 . 4.500 3.773 3.635 3.862 . 0 0 "[ . 1 .]" 1
1271 2 72 PHE HB2 2 79 LEU QD 3.600 . 5.400 1.920 1.801 2.045 . 0 0 "[ . 1 .]" 1
1272 2 72 PHE HB2 2 79 LEU HG 3.150 . 4.500 1.759 1.709 1.871 0.091 4 0 "[ . 1 .]" 1
1273 2 72 PHE HB3 2 72 PHE QD 3.150 . 4.500 2.497 2.265 2.699 . 0 0 "[ . 1 .]" 1
1274 2 72 PHE HB3 2 73 LYS H 3.400 . 5.000 4.291 1.795 4.525 0.005 5 0 "[ . 1 .]" 1
1275 2 72 PHE HB3 2 75 GLN H 3.400 . 5.000 3.614 3.205 3.985 . 0 0 "[ . 1 .]" 1
1276 2 72 PHE HB3 2 79 LEU QB 3.150 . 4.500 3.950 3.681 4.036 . 0 0 "[ . 1 .]" 1
1277 2 72 PHE HB3 2 79 LEU QD 3.150 . 4.500 2.913 2.679 3.068 . 0 0 "[ . 1 .]" 1
1278 2 72 PHE HB3 2 79 LEU HG 3.150 . 4.500 2.296 2.011 2.506 . 0 0 "[ . 1 .]" 1
1279 2 72 PHE QD 2 73 LYS H 3.900 . 6.000 4.285 3.819 4.624 . 0 0 "[ . 1 .]" 1
1280 2 72 PHE QD 2 78 LEU HB2 3.600 . 5.400 2.557 1.622 3.629 0.178 9 0 "[ . 1 .]" 1
1281 2 72 PHE QD 2 78 LEU HB3 3.600 . 5.400 2.875 1.948 4.023 . 0 0 "[ . 1 .]" 1
1282 2 72 PHE QD 2 79 LEU HA 3.150 . 4.500 3.044 2.281 3.993 . 0 0 "[ . 1 .]" 1
1283 2 72 PHE QD 2 79 LEU QB 3.600 . 5.400 3.787 3.431 4.218 . 0 0 "[ . 1 .]" 1
1284 2 72 PHE QD 2 79 LEU QD 3.600 . 5.400 2.569 1.793 3.006 0.007 8 0 "[ . 1 .]" 1
1285 2 72 PHE QD 2 79 LEU HG 3.600 . 5.400 2.376 1.773 2.914 0.027 12 0 "[ . 1 .]" 1
1286 2 72 PHE HZ 2 78 LEU QD 3.600 . 5.400 3.978 3.729 4.045 . 0 0 "[ . 1 .]" 1
1287 2 73 LYS H 2 73 LYS HB2 2.900 . 4.000 2.566 2.372 3.668 . 0 0 "[ . 1 .]" 1
1288 2 73 LYS H 2 73 LYS QD 3.400 . 5.000 3.746 3.155 4.358 . 0 0 "[ . 1 .]" 1
1289 2 73 LYS H 2 73 LYS QG 2.900 . 4.000 2.358 2.130 3.549 . 0 0 "[ . 1 .]" 1
1290 2 73 LYS H 2 74 ASN H 3.400 . 5.000 3.123 2.879 3.331 . 0 0 "[ . 1 .]" 1
1291 2 73 LYS H 2 79 LEU QD 3.900 . 6.000 4.228 2.698 4.463 . 0 0 "[ . 1 .]" 1
1292 2 73 LYS HA 2 73 LYS HB3 2.250 . 2.700 2.527 2.485 2.588 . 0 0 "[ . 1 .]" 1
1293 2 73 LYS HA 2 73 LYS QG 2.700 . 3.600 2.620 2.338 2.980 . 0 0 "[ . 1 .]" 1
1294 2 73 LYS HA 2 74 ASN H 2.900 . 4.000 3.575 3.528 3.598 . 0 0 "[ . 1 .]" 1
1295 2 73 LYS HA 2 75 GLN H 2.900 . 4.000 3.934 3.822 4.019 0.019 14 0 "[ . 1 .]" 1
1296 2 73 LYS HA 2 79 LEU QD 3.600 . 5.400 3.803 3.158 4.025 . 0 0 "[ . 1 .]" 1
1297 2 73 LYS HB2 2 74 ASN H 3.400 . 5.000 2.262 2.004 2.870 . 0 0 "[ . 1 .]" 1
1298 2 73 LYS HB3 2 74 ASN H 3.400 . 5.000 3.081 2.592 3.675 . 0 0 "[ . 1 .]" 1
1299 2 73 LYS QE 2 73 LYS QG 3.150 . 4.500 2.443 2.233 2.813 . 0 0 "[ . 1 .]" 1
1300 2 73 LYS QG 2 74 ASN H 3.400 . 5.000 4.002 3.823 4.291 . 0 0 "[ . 1 .]" 1
1301 2 74 ASN H 2 74 ASN HA 2.900 . 4.000 2.891 2.883 2.895 . 0 0 "[ . 1 .]" 1
1302 2 74 ASN H 2 74 ASN QB 3.400 . 5.000 2.685 2.637 2.754 . 0 0 "[ . 1 .]" 1
1303 2 74 ASN H 2 75 GLN H 2.900 . 4.000 2.918 2.506 3.245 . 0 0 "[ . 1 .]" 1
1304 2 74 ASN HA 2 74 ASN HB2 2.700 . 3.600 2.467 2.441 2.511 . 0 0 "[ . 1 .]" 1
1305 2 74 ASN HA 2 74 ASN HB3 2.700 . 3.600 2.420 2.380 2.443 . 0 0 "[ . 1 .]" 1
1306 2 74 ASN HA 2 75 GLN H 2.900 . 4.000 3.061 2.826 3.312 . 0 0 "[ . 1 .]" 1
1307 2 74 ASN QB 2 75 GLN H 3.400 . 5.000 4.025 3.851 4.074 . 0 0 "[ . 1 .]" 1
1308 2 75 GLN H 2 75 GLN HA 2.900 . 4.000 2.909 2.893 2.917 . 0 0 "[ . 1 .]" 1
1309 2 75 GLN H 2 75 GLN HB3 2.900 . 4.000 3.548 3.339 3.598 . 0 0 "[ . 1 .]" 1
1310 2 75 GLN H 2 75 GLN QG 2.900 . 4.000 2.356 2.180 3.047 . 0 0 "[ . 1 .]" 1
1311 2 75 GLN H 2 76 GLU H 2.900 . 4.000 2.794 2.588 3.340 . 0 0 "[ . 1 .]" 1
1312 2 75 GLN HA 2 75 GLN HB2 2.700 . 3.600 2.572 2.454 2.607 . 0 0 "[ . 1 .]" 1
1313 2 75 GLN HA 2 75 GLN HB3 2.700 . 3.600 2.336 2.309 2.440 . 0 0 "[ . 1 .]" 1
1314 2 75 GLN HA 2 76 GLU H 2.400 . 3.000 2.575 2.309 2.670 . 0 0 "[ . 1 .]" 1
1315 2 75 GLN HA 2 77 ASP H 3.400 . 5.000 3.164 3.100 3.314 . 0 0 "[ . 1 .]" 1
1316 2 75 GLN HB2 2 76 GLU H 3.400 . 5.000 4.342 4.147 4.413 . 0 0 "[ . 1 .]" 1
1317 2 75 GLN HB2 2 78 LEU QD 3.150 . 4.500 2.479 2.154 2.607 . 0 0 "[ . 1 .]" 1
1318 2 75 GLN HB3 2 78 LEU QD 3.150 . 4.500 3.353 3.342 3.365 . 0 0 "[ . 1 .]" 1
1319 2 75 GLN QG 2 78 LEU QD 3.600 . 5.400 2.755 1.808 3.575 . 0 0 "[ . 1 .]" 1
1320 2 76 GLU H 2 76 GLU HA 2.400 . 3.000 2.756 2.745 2.765 . 0 0 "[ . 1 .]" 1
1321 2 76 GLU H 2 76 GLU QB 2.900 . 4.000 2.487 2.449 2.509 . 0 0 "[ . 1 .]" 1
1322 2 76 GLU H 2 76 GLU QG 2.900 . 4.000 2.075 1.990 2.126 . 0 0 "[ . 1 .]" 1
1323 2 76 GLU H 2 77 ASP H 2.900 . 4.000 2.841 2.811 2.869 . 0 0 "[ . 1 .]" 1
1324 2 76 GLU H 2 78 LEU H 3.400 . 5.000 4.897 4.717 5.003 0.003 13 0 "[ . 1 .]" 1
1325 2 76 GLU HA 2 76 GLU QG 2.700 . 3.600 2.687 2.394 3.305 . 0 0 "[ . 1 .]" 1
1326 2 76 GLU HA 2 77 ASP H 2.900 . 4.000 3.467 3.451 3.480 . 0 0 "[ . 1 .]" 1
1327 2 76 GLU HA 2 78 LEU H 3.900 . 6.000 4.658 4.546 4.762 . 0 0 "[ . 1 .]" 1
1328 2 76 GLU HA 2 79 LEU H 2.900 . 4.000 3.380 3.223 3.493 . 0 0 "[ . 1 .]" 1
1329 2 76 GLU HA 2 79 LEU QB 2.700 . 3.600 2.418 2.145 2.649 . 0 0 "[ . 1 .]" 1
1330 2 76 GLU HA 2 79 LEU QD 3.600 . 5.400 2.441 1.943 2.844 . 0 0 "[ . 1 .]" 1
1331 2 76 GLU HA 2 79 LEU HG 2.700 . 3.600 3.555 3.265 3.639 0.039 5 0 "[ . 1 .]" 1
1332 2 76 GLU QB 2 77 ASP H 2.900 . 4.000 3.181 2.949 3.622 . 0 0 "[ . 1 .]" 1
1333 2 76 GLU QG 2 77 ASP H 3.400 . 5.000 3.783 2.421 4.295 . 0 0 "[ . 1 .]" 1
1334 2 77 ASP H 2 77 ASP HA 2.900 . 4.000 2.816 2.807 2.826 . 0 0 "[ . 1 .]" 1
1335 2 77 ASP H 2 77 ASP QB 2.900 . 4.000 2.426 2.244 2.642 . 0 0 "[ . 1 .]" 1
1336 2 77 ASP H 2 78 LEU H 2.900 . 4.000 2.800 2.712 2.865 . 0 0 "[ . 1 .]" 1
1337 2 77 ASP H 2 79 LEU H 3.400 . 5.000 3.935 3.698 4.027 . 0 0 "[ . 1 .]" 1
1338 2 77 ASP H 2 80 SER QB 3.900 . 6.000 5.234 4.714 5.388 . 0 0 "[ . 1 .]" 1
1339 2 77 ASP HA 2 77 ASP QB 2.250 . 2.700 2.362 2.167 2.388 . 0 0 "[ . 1 .]" 1
1340 2 77 ASP HA 2 80 SER QB 2.700 . 3.600 2.974 2.595 3.196 . 0 0 "[ . 1 .]" 1
1341 2 77 ASP QB 2 78 LEU H 3.400 . 5.000 2.342 2.227 3.072 . 0 0 "[ . 1 .]" 1
1342 2 77 ASP QB 2 79 LEU H 3.400 . 5.000 4.474 4.443 4.585 . 0 0 "[ . 1 .]" 1
1343 2 78 LEU H 2 78 LEU HB3 2.900 . 4.000 3.574 3.497 3.604 . 0 0 "[ . 1 .]" 1
1344 2 78 LEU H 2 78 LEU QD 3.400 . 5.000 2.874 2.056 3.224 . 0 0 "[ . 1 .]" 1
1345 2 78 LEU H 2 79 LEU H 2.900 . 4.000 2.751 2.649 2.801 . 0 0 "[ . 1 .]" 1
1346 2 78 LEU HA 2 78 LEU HB2 2.700 . 3.600 3.006 2.964 3.020 . 0 0 "[ . 1 .]" 1
1347 2 78 LEU HA 2 78 LEU HB3 2.700 . 3.600 2.565 2.475 2.677 . 0 0 "[ . 1 .]" 1
1348 2 78 LEU HA 2 78 LEU QD 2.700 . 3.600 1.987 1.868 2.070 . 0 0 "[ . 1 .]" 1
1349 2 78 LEU HA 2 81 GLU HB2 3.150 . 4.500 3.671 3.069 4.180 . 0 0 "[ . 1 .]" 1
1350 2 78 LEU HA 2 81 GLU HB3 3.150 . 4.500 3.413 2.853 4.206 . 0 0 "[ . 1 .]" 1
1351 2 78 LEU HB3 2 78 LEU HG 2.700 . 3.600 2.872 2.369 3.023 . 0 0 "[ . 1 .]" 1
1352 2 78 LEU HB3 2 79 LEU H 2.900 . 4.000 3.609 3.357 3.840 . 0 0 "[ . 1 .]" 1
1353 2 78 LEU QD 2 79 LEU H 3.900 . 6.000 4.120 3.878 4.267 . 0 0 "[ . 1 .]" 1
1354 2 79 LEU H 2 79 LEU QB 2.400 . 3.000 2.234 2.128 2.299 . 0 0 "[ . 1 .]" 1
1355 2 79 LEU H 2 79 LEU QD 3.900 . 6.000 3.357 3.277 3.513 . 0 0 "[ . 1 .]" 1
1356 2 79 LEU H 2 79 LEU HG 2.900 . 4.000 2.809 2.660 3.181 . 0 0 "[ . 1 .]" 1
1357 2 79 LEU H 2 80 SER H 2.900 . 4.000 2.672 2.561 2.730 . 0 0 "[ . 1 .]" 1
1358 2 79 LEU HA 2 79 LEU QD 2.700 . 3.600 1.851 1.744 2.106 0.056 3 0 "[ . 1 .]" 1
1359 2 79 LEU HA 2 79 LEU HG 2.700 . 3.600 2.850 2.762 2.948 . 0 0 "[ . 1 .]" 1
1360 2 79 LEU HA 2 82 PHE H 2.900 . 4.000 3.221 3.090 3.341 . 0 0 "[ . 1 .]" 1
1361 2 79 LEU HA 2 82 PHE HB3 2.700 . 3.600 2.798 2.394 3.272 . 0 0 "[ . 1 .]" 1
1362 2 79 LEU QB 2 79 LEU QD 2.700 . 3.600 1.942 1.896 1.962 . 0 0 "[ . 1 .]" 1
1363 2 79 LEU QB 2 79 LEU HG 2.250 . 2.700 2.357 2.323 2.373 . 0 0 "[ . 1 .]" 1
1364 2 79 LEU QB 2 80 SER H 2.900 . 4.000 2.679 2.608 2.912 . 0 0 "[ . 1 .]" 1
1365 2 79 LEU QD 2 82 PHE HB2 3.150 . 4.500 3.294 2.800 3.347 . 0 0 "[ . 1 .]" 1
1366 2 79 LEU QD 2 83 GLY H 3.900 . 6.000 4.468 4.461 4.484 . 0 0 "[ . 1 .]" 1
1367 2 79 LEU HG 2 80 SER H 3.400 . 5.000 4.744 4.604 4.905 . 0 0 "[ . 1 .]" 1
1368 2 80 SER H 2 80 SER HA 2.900 . 4.000 2.781 2.754 2.801 . 0 0 "[ . 1 .]" 1
1369 2 80 SER H 2 80 SER QB 2.900 . 4.000 2.368 2.264 2.528 . 0 0 "[ . 1 .]" 1
1370 2 80 SER H 2 81 GLU H 2.900 . 4.000 2.770 2.678 2.849 . 0 0 "[ . 1 .]" 1
1371 2 80 SER HA 2 80 SER QB 2.250 . 2.700 2.335 2.189 2.406 . 0 0 "[ . 1 .]" 1
1372 2 81 GLU H 2 81 GLU HB2 2.400 . 3.000 2.424 2.191 2.600 . 0 0 "[ . 1 .]" 1
1373 2 81 GLU H 2 81 GLU HB3 2.400 . 3.000 2.610 2.453 2.868 . 0 0 "[ . 1 .]" 1
1374 2 81 GLU H 2 81 GLU QG 3.400 . 5.000 3.998 3.844 4.049 . 0 0 "[ . 1 .]" 1
1375 2 81 GLU HA 2 81 GLU HB2 2.250 . 2.700 2.520 2.434 2.667 . 0 0 "[ . 1 .]" 1
1376 2 81 GLU HA 2 81 GLU HB3 2.700 . 3.600 3.018 2.988 3.028 . 0 0 "[ . 1 .]" 1
1377 2 81 GLU HA 2 81 GLU QG 2.700 . 3.600 2.785 2.299 3.057 . 0 0 "[ . 1 .]" 1
1378 2 81 GLU HA 2 84 GLN QG 3.150 . 4.500 2.505 1.844 2.922 . 0 0 "[ . 1 .]" 1
1379 2 81 GLU HB2 2 81 GLU QG 2.250 . 2.700 2.341 2.156 2.433 . 0 0 "[ . 1 .]" 1
1380 2 81 GLU HB2 2 82 PHE H 2.900 . 4.000 3.788 3.442 3.988 . 0 0 "[ . 1 .]" 1
1381 2 81 GLU HB3 2 81 GLU QG 2.250 . 2.700 2.184 2.143 2.345 . 0 0 "[ . 1 .]" 1
1382 2 81 GLU HB3 2 82 PHE H 2.900 . 4.000 2.595 2.440 2.795 . 0 0 "[ . 1 .]" 1
1383 2 81 GLU QG 2 82 PHE H 3.400 . 5.000 3.823 3.481 4.454 . 0 0 "[ . 1 .]" 1
1384 2 82 PHE H 2 82 PHE HA 2.900 . 4.000 2.765 2.752 2.775 . 0 0 "[ . 1 .]" 1
1385 2 82 PHE H 2 82 PHE HB2 2.400 . 3.000 2.434 2.362 2.531 . 0 0 "[ . 1 .]" 1
1386 2 82 PHE H 2 82 PHE HB3 2.900 . 4.000 2.633 2.480 2.769 . 0 0 "[ . 1 .]" 1
1387 2 82 PHE H 2 82 PHE QD 3.400 . 5.000 4.138 4.080 4.171 . 0 0 "[ . 1 .]" 1
1388 2 82 PHE HA 2 82 PHE HB2 2.700 . 3.600 2.486 2.418 2.548 . 0 0 "[ . 1 .]" 1
1389 2 82 PHE HA 2 82 PHE HB3 2.700 . 3.600 3.024 3.018 3.029 . 0 0 "[ . 1 .]" 1
1390 2 82 PHE HA 2 82 PHE QD 2.700 . 3.600 2.208 1.889 3.131 . 0 0 "[ . 1 .]" 1
1391 2 82 PHE HA 2 83 GLY H 2.900 . 4.000 3.571 3.559 3.580 . 0 0 "[ . 1 .]" 1
1392 2 82 PHE HA 2 84 GLN H 3.900 . 6.000 3.909 3.756 4.060 . 0 0 "[ . 1 .]" 1
1393 2 82 PHE HA 2 85 PHE H 3.400 . 5.000 4.031 3.727 4.440 . 0 0 "[ . 1 .]" 1
1394 2 82 PHE HA 2 85 PHE QD 3.150 . 4.500 2.650 1.917 3.324 . 0 0 "[ . 1 .]" 1
1395 2 82 PHE HA 2 85 PHE QE 3.150 . 4.500 3.127 2.225 4.012 . 0 0 "[ . 1 .]" 1
1396 2 82 PHE HB2 2 82 PHE QD 3.150 . 4.500 2.657 2.313 2.757 . 0 0 "[ . 1 .]" 1
1397 2 82 PHE HB3 2 82 PHE QD 3.150 . 4.500 2.317 2.259 2.469 . 0 0 "[ . 1 .]" 1
1398 2 82 PHE HB3 2 83 GLY H 2.900 . 4.000 2.311 2.090 2.467 . 0 0 "[ . 1 .]" 1
1399 2 82 PHE QD 2 83 GLY H 3.400 . 5.000 3.679 2.708 4.114 . 0 0 "[ . 1 .]" 1
1400 2 82 PHE QE 2 86 LEU QD 3.600 . 5.400 2.412 1.937 2.623 . 0 0 "[ . 1 .]" 1
1401 2 82 PHE HZ 2 86 LEU HB3 3.600 . 5.400 5.264 4.773 5.415 0.015 2 0 "[ . 1 .]" 1
1402 2 83 GLY H 2 84 GLN H 2.900 . 4.000 2.873 2.761 2.962 . 0 0 "[ . 1 .]" 1
1403 2 83 GLY QA 2 84 GLN H 2.900 . 4.000 2.908 2.829 2.963 . 0 0 "[ . 1 .]" 1
1404 2 83 GLY QA 2 85 PHE H 3.400 . 5.000 3.597 3.370 3.839 . 0 0 "[ . 1 .]" 1
1405 2 83 GLY QA 2 86 LEU H 3.400 . 5.000 3.313 2.941 3.612 . 0 0 "[ . 1 .]" 1
1406 2 83 GLY QA 2 86 LEU QD 3.150 . 4.500 2.519 1.713 3.013 0.087 4 0 "[ . 1 .]" 1
1407 2 83 GLY QA 2 86 LEU HG 3.150 . 4.500 3.201 2.106 4.050 . 0 0 "[ . 1 .]" 1
1408 2 84 GLN H 2 84 GLN HA 2.900 . 4.000 2.837 2.818 2.847 . 0 0 "[ . 1 .]" 1
1409 2 84 GLN H 2 84 GLN QB 2.900 . 4.000 2.456 2.349 2.538 . 0 0 "[ . 1 .]" 1
1410 2 84 GLN H 2 84 GLN QG 2.900 . 4.000 2.236 2.073 2.465 . 0 0 "[ . 1 .]" 1
1411 2 84 GLN H 2 85 PHE H 2.900 . 4.000 2.649 2.568 2.726 . 0 0 "[ . 1 .]" 1
1412 2 84 GLN H 2 85 PHE QD 3.900 . 6.000 4.000 3.171 4.565 . 0 0 "[ . 1 .]" 1
1413 2 84 GLN H 2 86 LEU H 3.400 . 5.000 4.352 3.960 4.729 . 0 0 "[ . 1 .]" 1
1414 2 84 GLN HA 2 84 GLN QG 2.700 . 3.600 2.629 2.307 3.041 . 0 0 "[ . 1 .]" 1
1415 2 84 GLN HA 2 85 PHE H 3.400 . 5.000 3.456 3.406 3.530 . 0 0 "[ . 1 .]" 1
1416 2 84 GLN HA 2 86 LEU H 3.400 . 5.000 4.780 4.231 5.075 0.075 2 0 "[ . 1 .]" 1
1417 2 84 GLN QB 2 85 PHE H 3.400 . 5.000 3.056 2.741 3.293 . 0 0 "[ . 1 .]" 1
1418 2 84 GLN QG 2 85 PHE H 3.400 . 5.000 4.258 4.071 4.456 . 0 0 "[ . 1 .]" 1
1419 2 85 PHE H 2 85 PHE HA 2.900 . 4.000 2.920 2.908 2.933 . 0 0 "[ . 1 .]" 1
1420 2 85 PHE H 2 85 PHE HB2 2.900 . 4.000 2.565 2.488 2.658 . 0 0 "[ . 1 .]" 1
1421 2 85 PHE H 2 85 PHE HB3 2.900 . 4.000 3.662 3.630 3.700 . 0 0 "[ . 1 .]" 1
1422 2 85 PHE H 2 85 PHE QD 2.900 . 4.000 2.647 2.008 3.090 . 0 0 "[ . 1 .]" 1
1423 2 85 PHE H 2 85 PHE QE 3.400 . 5.000 4.378 4.130 4.486 . 0 0 "[ . 1 .]" 1
1424 2 85 PHE H 2 86 LEU H 2.900 . 4.000 2.314 2.221 2.500 . 0 0 "[ . 1 .]" 1
1425 2 85 PHE H 2 86 LEU HB3 3.400 . 5.000 5.024 4.918 5.094 0.094 15 0 "[ . 1 .]" 1
1426 2 85 PHE HA 2 85 PHE HB2 2.700 . 3.600 3.026 3.022 3.032 . 0 0 "[ . 1 .]" 1
1427 2 85 PHE HA 2 85 PHE HB3 2.700 . 3.600 2.431 2.386 2.476 . 0 0 "[ . 1 .]" 1
1428 2 85 PHE HA 2 85 PHE QD 3.150 . 4.500 2.712 2.382 3.196 . 0 0 "[ . 1 .]" 1
1429 2 85 PHE HA 2 86 LEU H 2.900 . 4.000 3.527 3.471 3.572 . 0 0 "[ . 1 .]" 1
1430 2 85 PHE HB2 2 85 PHE QD 3.150 . 4.500 2.345 2.253 2.570 . 0 0 "[ . 1 .]" 1
1431 2 85 PHE HB2 2 86 LEU H 3.400 . 5.000 2.521 2.153 3.031 . 0 0 "[ . 1 .]" 1
1432 2 85 PHE HB3 2 85 PHE QD 3.150 . 4.500 2.490 2.261 2.643 . 0 0 "[ . 1 .]" 1
1433 2 85 PHE HB3 2 86 LEU H 3.400 . 5.000 3.678 3.380 4.045 . 0 0 "[ . 1 .]" 1
1434 2 85 PHE QD 2 86 LEU H 3.400 . 5.000 3.878 3.518 4.333 . 0 0 "[ . 1 .]" 1
1435 2 86 LEU H 2 86 LEU HA 2.900 . 4.000 2.909 2.892 2.923 . 0 0 "[ . 1 .]" 1
1436 2 86 LEU H 2 86 LEU HB2 2.900 . 4.000 3.746 3.608 3.935 . 0 0 "[ . 1 .]" 1
1437 2 86 LEU H 2 86 LEU HB3 2.400 . 3.000 2.919 2.611 3.143 0.143 7 0 "[ . 1 .]" 1
1438 2 86 LEU H 2 87 PRO QD 3.400 . 5.000 4.009 2.471 4.402 . 0 0 "[ . 1 .]" 1
1439 2 86 LEU HA 2 86 LEU HB2 2.700 . 3.600 2.400 2.336 2.462 . 0 0 "[ . 1 .]" 1
1440 2 86 LEU HA 2 86 LEU HB3 2.700 . 3.600 2.455 2.381 2.527 . 0 0 "[ . 1 .]" 1
1441 2 86 LEU HA 2 86 LEU QD 3.150 . 4.500 3.310 3.153 3.376 . 0 0 "[ . 1 .]" 1
1442 2 86 LEU HA 2 86 LEU HG 3.150 . 4.500 3.732 3.641 4.287 . 0 0 "[ . 1 .]" 1
1443 2 86 LEU HA 2 87 PRO QD 2.700 . 3.600 1.974 1.744 2.250 0.056 14 0 "[ . 1 .]" 1
1444 2 86 LEU HB2 2 86 LEU QD 2.700 . 3.600 2.097 1.949 2.342 . 0 0 "[ . 1 .]" 1
1445 2 86 LEU HB2 2 86 LEU HG 2.250 . 2.700 2.772 2.359 2.942 0.242 11 0 "[ . 1 .]" 1
1446 2 86 LEU HB2 2 87 PRO QD 3.150 . 4.500 2.773 1.832 4.062 . 0 0 "[ . 1 .]" 1
1447 2 86 LEU HB3 2 87 PRO QD 3.150 . 4.500 3.639 3.118 4.054 . 0 0 "[ . 1 .]" 1
1448 2 86 LEU QD 2 87 PRO QD 3.600 . 5.400 3.216 2.231 3.656 . 0 0 "[ . 1 .]" 1
1449 2 86 LEU QD 2 89 ALA MB 3.600 . 5.400 2.932 1.655 3.369 0.145 15 0 "[ . 1 .]" 1
1450 2 87 PRO HA 2 87 PRO QB 2.250 . 2.700 2.193 2.120 2.226 . 0 0 "[ . 1 .]" 1
1451 2 87 PRO HA 2 87 PRO QD 3.150 . 4.500 3.400 2.782 3.516 . 0 0 "[ . 1 .]" 1
1452 2 87 PRO HA 2 87 PRO QG 3.150 . 4.500 3.175 2.844 3.532 . 0 0 "[ . 1 .]" 1
1453 2 87 PRO HA 2 88 ASP H 2.400 . 3.000 2.926 2.144 3.378 0.378 15 0 "[ . 1 .]" 1
1454 2 87 PRO QB 2 87 PRO QD 3.150 . 4.500 2.798 2.691 3.006 . 0 0 "[ . 1 .]" 1
1455 2 87 PRO QB 2 88 ASP H 2.900 . 4.000 2.585 1.692 3.654 0.108 9 0 "[ . 1 .]" 1
1456 2 87 PRO QB 2 89 ALA H 3.400 . 5.000 4.070 2.871 4.594 . 0 0 "[ . 1 .]" 1
1457 2 87 PRO QD 2 88 ASP H 3.400 . 5.000 3.856 2.087 4.635 . 0 0 "[ . 1 .]" 1
1458 2 87 PRO QG 2 88 ASP H 3.400 . 5.000 3.827 1.920 4.533 . 0 0 "[ . 1 .]" 1
1459 2 88 ASP H 2 88 ASP HA 2.900 . 4.000 2.764 2.243 2.906 . 0 0 "[ . 1 .]" 1
1460 2 88 ASP H 2 88 ASP HB2 2.900 . 4.000 2.671 2.428 3.558 . 0 0 "[ . 1 .]" 1
1461 2 88 ASP H 2 88 ASP HB3 2.900 . 4.000 3.713 3.606 4.058 0.058 5 0 "[ . 1 .]" 1
1462 2 88 ASP H 2 89 ALA H 2.900 . 4.000 3.313 2.405 4.065 0.065 8 0 "[ . 1 .]" 1
1463 2 88 ASP HA 2 88 ASP HB2 2.700 . 3.600 3.025 3.021 3.029 . 0 0 "[ . 1 .]" 1
1464 2 88 ASP HA 2 88 ASP HB3 2.700 . 3.600 2.492 2.456 2.511 . 0 0 "[ . 1 .]" 1
1465 2 88 ASP HA 2 89 ALA H 2.900 . 4.000 2.841 2.204 3.575 . 0 0 "[ . 1 .]" 1
1466 2 88 ASP HB2 2 89 ALA H 3.400 . 5.000 3.747 1.987 4.506 . 0 0 "[ . 1 .]" 1
1467 2 88 ASP HB3 2 89 ALA H 3.400 . 5.000 3.967 2.831 4.474 . 0 0 "[ . 1 .]" 1
1468 2 89 ALA H 2 89 ALA HA 2.900 . 4.000 2.713 2.264 2.882 . 0 0 "[ . 1 .]" 1
1469 2 89 ALA H 2 89 ALA MB 2.900 . 4.000 2.574 2.137 2.947 . 0 0 "[ . 1 .]" 1
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