NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
391460 |
1pa4   |
5796 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1pa4
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 1267
_Distance_constraint_stats_list.Viol_count 1531
_Distance_constraint_stats_list.Viol_total 4155.148
_Distance_constraint_stats_list.Viol_max 0.952
_Distance_constraint_stats_list.Viol_rms 0.0674
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0128
_Distance_constraint_stats_list.Viol_average_violations_only 0.1696
_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 6 LYS 1.405 0.691 7 1 "[ . + 1 . ]"
1 7 GLU 7.765 0.691 7 3 "[ *. +- 1 . ]"
1 8 ARG 17.271 0.787 6 9 "[* * .+ *1*- ***]"
1 9 LEU 8.337 0.786 10 5 "[ **. + - *. ]"
1 10 GLU 2.575 0.300 13 0 "[ . 1 . ]"
1 11 ASN 2.742 0.629 2 2 "[ + . 1 - . ]"
1 12 ASP 5.797 0.595 10 1 "[ . + . ]"
1 13 ILE 3.352 0.786 10 2 "[ -. + . ]"
1 14 ILE 7.021 0.510 7 1 "[ . + 1 . ]"
1 15 ARG 11.710 0.482 16 0 "[ . 1 . ]"
1 16 LEU 1.766 0.311 7 0 "[ . 1 . ]"
1 17 ILE 11.164 0.576 4 5 "[ - +. ** 1 * . ]"
1 18 ASN 2.383 0.248 3 0 "[ . 1 . ]"
1 19 ARG 9.379 0.816 4 4 "[ +. *1 - .*]"
1 20 THR 2.690 0.853 5 2 "[ + 1 - . ]"
1 21 VAL 1.560 0.341 3 0 "[ . 1 . ]"
1 22 ILE 3.574 0.816 4 1 "[ +. 1 . ]"
1 23 HIS 0.859 0.220 10 0 "[ . 1 . ]"
1 24 GLU 11.230 0.870 11 4 "[ *- 1+ * . ]"
1 25 ILE 3.491 0.870 11 2 "[ .- 1+ . ]"
1 26 TYR 0.133 0.073 12 0 "[ . 1 . ]"
1 27 ASN 0.379 0.195 15 0 "[ . 1 . ]"
1 28 GLU 10.613 0.952 4 9 "[ *+. *-*** * .*]"
1 29 THR 2.655 0.333 13 0 "[ . 1 . ]"
1 30 VAL 0.678 0.333 13 0 "[ . 1 . ]"
1 31 LYS 5.084 0.952 4 5 "[ +. **** . ]"
1 32 THR 1.211 0.509 4 1 "[ +. 1 . ]"
1 33 GLY 3.897 0.563 4 2 "[ +. 1 - . ]"
1 34 HIS 7.248 0.523 13 3 "[* . 1 + - ]"
1 35 VAL 0.408 0.254 7 0 "[ . 1 . ]"
1 36 THR 2.373 0.465 8 0 "[ . 1 . ]"
1 37 HIS 1.284 0.161 5 0 "[ . 1 . ]"
1 38 VAL 7.553 0.634 6 5 "[* .+ * 1* .-]"
1 39 LYS 9.993 0.853 13 5 "[ * * * 1 +-. ]"
1 40 LEU 3.740 0.734 8 2 "[ . + 1 -. ]"
1 41 SER 3.166 0.436 6 0 "[ . 1 . ]"
1 42 ASP 1.504 0.433 8 0 "[ . 1 . ]"
1 43 ASP 3.732 0.669 3 2 "[- + . 1 . ]"
1 44 LEU 3.594 0.573 1 1 "[+ . 1 . ]"
1 45 LEU 0.889 0.188 15 0 "[ . 1 . ]"
1 46 HIS 2.478 0.528 13 1 "[ . 1 + . ]"
1 47 VAL 1.571 0.340 12 0 "[ . 1 . ]"
1 48 THR 2.965 0.853 13 3 "[- * 1 + . ]"
1 49 VAL 11.357 0.634 6 4 "[ .+ * 1* .-]"
1 50 TYR 2.431 0.161 5 0 "[ . 1 . ]"
1 51 LEU 8.363 0.876 4 4 "[- *+. * 1 . ]"
1 52 ASP 7.126 0.876 4 4 "[ *+. * 1 - ]"
1 53 CYS 5.386 0.563 4 1 "[ +. 1 . ]"
1 54 TYR 3.900 0.636 14 1 "[ . 1 +. ]"
1 55 ASN 4.460 0.631 5 1 "[ + 1 . ]"
1 56 ARG 2.686 0.387 9 0 "[ . 1 . ]"
1 57 GLU 5.307 0.631 5 1 "[ + 1 . ]"
1 58 GLN 7.919 0.891 16 1 "[ . 1 .+]"
1 59 ILE 2.043 0.251 5 0 "[ . 1 . ]"
1 60 ASP 7.807 0.843 7 2 "[ - . + 1 . ]"
1 61 ARG 13.962 0.843 7 5 "[ * . + - **]"
1 62 VAL 2.077 0.597 7 1 "[ . + 1 . ]"
1 63 VAL 0.351 0.195 11 0 "[ . 1 . ]"
1 64 GLY 0.674 0.389 7 0 "[ . 1 . ]"
1 65 ALA 4.788 0.629 3 1 "[ + . 1 . ]"
1 66 PHE 1.215 0.175 14 0 "[ . 1 . ]"
1 67 ASN 0.168 0.048 9 0 "[ . 1 . ]"
1 68 GLN 3.374 0.629 3 1 "[ + . 1 . ]"
1 69 ALA 0.436 0.070 16 0 "[ . 1 . ]"
1 70 LYS 1.970 0.620 8 2 "[ . + 1 - . ]"
1 71 GLY 6.663 0.912 3 5 "[ *+ -* 1 *. ]"
1 72 VAL 4.270 0.495 10 0 "[ . 1 . ]"
1 73 PHE 9.784 0.576 4 5 "[ - +. ** 1 * . ]"
1 74 SER 3.676 0.640 15 3 "[- . * 1 + ]"
1 75 ARG 17.800 0.912 3 8 "[ *+ -* **1* *. ]"
1 76 VAL 0.081 0.031 12 0 "[ . 1 . ]"
1 77 LEU 0.341 0.087 2 0 "[ . 1 . ]"
1 78 ALA 0.963 0.325 12 0 "[ . 1 . ]"
1 79 HIS 0.601 0.196 2 0 "[ . 1 . ]"
1 80 ASN 2.404 0.337 12 0 "[ . 1 . ]"
1 81 LEU 3.586 0.542 8 1 "[ . + 1 . ]"
1 82 TYR 4.818 0.559 9 2 "[ . -+1 . ]"
1 83 LEU 5.015 0.680 10 3 "[ . - + .*]"
1 84 ALA 0.544 0.369 11 0 "[ . 1 . ]"
1 85 LYS 5.454 0.537 5 1 "[ + 1 . ]"
1 86 ALA 0.786 0.353 11 0 "[ . 1 . ]"
1 87 VAL 1.409 0.353 11 0 "[ . 1 . ]"
1 88 GLN 3.461 0.748 7 2 "[ . + 1 - ]"
1 89 ILE 2.293 0.692 15 1 "[ . 1 + ]"
1 90 HIS 1.591 0.528 13 1 "[ . 1 + . ]"
1 91 PHE 6.721 0.330 4 0 "[ . 1 . ]"
1 92 VAL 4.764 0.428 13 0 "[ . 1 . ]"
1 93 LYS 15.273 0.773 9 6 "[* * +*- *. ]"
1 94 ASP 5.792 0.764 10 3 "[* . *+ . ]"
1 95 LYS 1.361 0.230 4 0 "[ . 1 . ]"
1 96 ALA 1.678 0.230 4 0 "[ . 1 . ]"
1 97 ILE 1.157 0.194 5 0 "[ . 1 . ]"
1 98 ASP 1.038 0.268 14 0 "[ . 1 . ]"
1 99 ASN 1.644 0.443 11 0 "[ . 1 . ]"
1 100 ALA 0.642 0.194 5 0 "[ . 1 . ]"
1 101 MET 2.054 0.541 9 2 "[ . +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 48 THR HB 1 49 VAL H . . 5.000 4.606 4.510 4.689 . 0 0 "[ . 1 . ]" 1
2 1 39 LYS H 1 49 VAL H . . 5.000 4.866 4.594 5.336 0.336 13 0 "[ . 1 . ]" 1
3 1 48 THR HA 1 49 VAL H . . 3.300 2.224 2.155 2.314 . 0 0 "[ . 1 . ]" 1
4 1 49 VAL H 1 90 HIS HD2 . . 5.500 4.963 4.199 5.569 0.069 10 0 "[ . 1 . ]" 1
5 1 49 VAL H 1 90 HIS H . . 5.000 3.703 3.291 4.017 . 0 0 "[ . 1 . ]" 1
6 1 49 VAL H 1 91 PHE HA . . 3.300 3.248 2.716 3.450 0.150 4 0 "[ . 1 . ]" 1
7 1 49 VAL H 1 91 PHE HB2 . . 5.500 5.635 5.014 5.830 0.330 4 0 "[ . 1 . ]" 1
8 1 48 THR MG 1 49 VAL H . . 5.000 3.446 3.255 3.629 . 0 0 "[ . 1 . ]" 1
9 1 49 VAL H 1 49 VAL MG1 . . 3.300 2.471 2.220 2.697 . 0 0 "[ . 1 . ]" 1
10 1 49 VAL H 1 92 VAL HB . . 5.000 3.946 3.229 4.655 . 0 0 "[ . 1 . ]" 1
11 1 87 VAL HA 1 88 GLN H . . 3.300 2.372 2.194 2.739 . 0 0 "[ . 1 . ]" 1
12 1 88 GLN H 1 88 GLN QB . . 3.300 3.014 2.443 3.506 0.206 3 0 "[ . 1 . ]" 1
13 1 88 GLN H 1 88 GLN HA . . 2.900 2.732 2.611 2.916 0.016 15 0 "[ . 1 . ]" 1
14 1 50 TYR H 1 92 VAL HB . . 5.500 4.267 3.434 5.110 . 0 0 "[ . 1 . ]" 1
15 1 38 VAL HA 1 50 TYR H . . 3.300 3.168 2.932 3.388 0.088 14 0 "[ . 1 . ]" 1
16 1 45 LEU HA 1 88 GLN H . . 5.000 4.223 3.257 5.078 0.078 15 0 "[ . 1 . ]" 1
17 1 87 VAL HB 1 88 GLN H . . 5.000 3.375 2.020 4.677 . 0 0 "[ . 1 . ]" 1
18 1 88 GLN H 1 88 GLN HG2 . . 5.000 4.413 2.706 4.962 . 0 0 "[ . 1 . ]" 1
19 1 88 GLN H 1 89 ILE HG13 . . 5.500 4.295 3.258 5.383 . 0 0 "[ . 1 . ]" 1
20 1 87 VAL MG1 1 88 GLN H . . 5.500 3.930 2.529 4.331 . 0 0 "[ . 1 . ]" 1
21 1 87 VAL MG2 1 88 GLN H . . 5.000 2.974 1.882 3.946 . 0 0 "[ . 1 . ]" 1
22 1 87 VAL H 1 88 GLN H . . 5.000 4.266 3.583 4.630 . 0 0 "[ . 1 . ]" 1
23 1 47 VAL H 1 88 GLN H . . 5.500 4.634 3.668 5.335 . 0 0 "[ . 1 . ]" 1
24 1 49 VAL HA 1 50 TYR H . . 2.900 2.198 2.181 2.237 . 0 0 "[ . 1 . ]" 1
25 1 49 VAL HB 1 50 TYR H . . 5.000 3.506 3.145 3.959 . 0 0 "[ . 1 . ]" 1
26 1 37 HIS QB 1 50 TYR H . . 5.500 4.099 2.489 5.636 0.136 9 0 "[ . 1 . ]" 1
27 1 88 GLN H 1 88 GLN HG3 . . 5.000 4.375 2.629 4.861 . 0 0 "[ . 1 . ]" 1
28 1 49 VAL MG1 1 50 TYR H . . 5.000 4.106 3.890 4.300 . 0 0 "[ . 1 . ]" 1
29 1 50 TYR H 1 50 TYR HB2 . . 2.900 2.166 2.068 2.290 . 0 0 "[ . 1 . ]" 1
30 1 50 TYR H 1 50 TYR HD1 . . 5.000 2.054 1.845 2.477 . 0 0 "[ . 1 . ]" 1
31 1 47 VAL QG 1 48 THR H . . 5.000 3.171 3.004 3.346 . 0 0 "[ . 1 . ]" 1
32 1 39 LYS HB3 1 48 THR H . . 5.000 3.750 2.768 4.961 . 0 0 "[ . 1 . ]" 1
33 1 47 VAL HB 1 48 THR H . . 5.000 4.557 4.433 4.650 . 0 0 "[ . 1 . ]" 1
34 1 38 VAL MG1 1 48 THR H . . 5.500 4.928 4.041 6.084 0.584 1 1 "[+ . 1 . ]" 1
35 1 47 VAL HA 1 48 THR H . . 3.300 2.225 2.182 2.267 . 0 0 "[ . 1 . ]" 1
36 1 40 LEU HA 1 48 THR H . . 5.000 3.737 2.974 4.372 . 0 0 "[ . 1 . ]" 1
37 1 48 THR H 1 90 HIS HB3 . . 5.500 4.560 3.441 5.722 0.222 13 0 "[ . 1 . ]" 1
38 1 65 ALA H 1 67 ASN QB . . 5.500 4.747 4.604 4.871 . 0 0 "[ . 1 . ]" 1
39 1 63 VAL MG1 1 65 ALA H . . 5.000 4.911 4.712 5.195 0.195 11 0 "[ . 1 . ]" 1
40 1 62 VAL HB 1 65 ALA H . . 5.500 5.142 5.031 5.259 . 0 0 "[ . 1 . ]" 1
41 1 61 ARG HB2 1 65 ALA H . . 5.500 5.568 5.092 5.726 0.226 6 0 "[ . 1 . ]" 1
42 1 63 VAL H 1 65 ALA H . . 5.000 4.155 4.025 4.318 . 0 0 "[ . 1 . ]" 1
43 1 30 VAL MG1 1 65 ALA H . . 5.500 3.393 3.197 3.562 . 0 0 "[ . 1 . ]" 1
44 1 65 ALA H 1 66 PHE HB2 . . 5.500 4.065 4.021 4.129 . 0 0 "[ . 1 . ]" 1
45 1 65 ALA H 1 66 PHE QD . . 5.000 4.119 3.881 4.353 . 0 0 "[ . 1 . ]" 1
46 1 29 THR MG 1 65 ALA H . . 5.000 3.232 3.067 3.363 . 0 0 "[ . 1 . ]" 1
47 1 64 GLY HA2 1 65 ALA H . . 5.000 3.597 3.566 3.622 . 0 0 "[ . 1 . ]" 1
48 1 63 VAL HA 1 65 ALA H . . 5.000 4.196 4.034 4.343 . 0 0 "[ . 1 . ]" 1
49 1 62 VAL HA 1 65 ALA H . . 5.000 3.291 3.159 3.393 . 0 0 "[ . 1 . ]" 1
50 1 65 ALA H 1 66 PHE HA . . 5.000 5.010 4.986 5.040 0.040 9 0 "[ . 1 . ]" 1
51 1 65 ALA H 1 66 PHE H . . 2.900 2.442 2.421 2.471 . 0 0 "[ . 1 . ]" 1
52 1 65 ALA H 1 65 ALA MB . . 2.900 2.078 1.997 2.195 . 0 0 "[ . 1 . ]" 1
53 1 65 ALA H 1 65 ALA HA . . 2.900 2.861 2.851 2.862 . 0 0 "[ . 1 . ]" 1
54 1 61 ARG HA 1 65 ALA H . . 5.000 4.191 3.936 4.435 . 0 0 "[ . 1 . ]" 1
55 1 95 LYS H 1 97 ILE H . . 5.500 4.867 4.006 5.491 . 0 0 "[ . 1 . ]" 1
56 1 89 ILE MG 1 90 HIS H . . 5.000 2.579 1.928 3.049 . 0 0 "[ . 1 . ]" 1
57 1 92 VAL HA 1 95 LYS H . . 5.500 4.214 2.417 5.022 . 0 0 "[ . 1 . ]" 1
58 1 90 HIS H 1 90 HIS HB3 . . 3.300 2.675 2.481 2.898 . 0 0 "[ . 1 . ]" 1
59 1 90 HIS H 1 90 HIS HD2 . . 5.000 4.988 4.867 5.089 0.089 13 0 "[ . 1 . ]" 1
60 1 47 VAL H 1 90 HIS H . . 5.000 2.948 2.069 3.850 . 0 0 "[ . 1 . ]" 1
61 1 89 ILE HG12 1 90 HIS H . . 5.000 4.007 3.287 4.504 . 0 0 "[ . 1 . ]" 1
62 1 89 ILE HB 1 90 HIS H . . 5.000 4.374 3.974 4.570 . 0 0 "[ . 1 . ]" 1
63 1 46 HIS HA 1 90 HIS H . . 5.500 4.573 3.559 5.474 . 0 0 "[ . 1 . ]" 1
64 1 89 ILE HA 1 90 HIS H . . 3.300 2.221 2.176 2.312 . 0 0 "[ . 1 . ]" 1
65 1 94 ASP QB 1 95 LYS H . . 5.000 3.674 2.607 4.049 . 0 0 "[ . 1 . ]" 1
66 1 48 THR HA 1 90 HIS H . . 5.000 3.528 2.625 4.093 . 0 0 "[ . 1 . ]" 1
67 1 49 VAL MG2 1 90 HIS H . . 5.000 3.853 3.568 4.005 . 0 0 "[ . 1 . ]" 1
68 1 90 HIS H 1 91 PHE H . . 5.000 4.467 4.337 4.563 . 0 0 "[ . 1 . ]" 1
69 1 49 VAL MG1 1 90 HIS H . . 5.000 3.785 3.311 4.027 . 0 0 "[ . 1 . ]" 1
70 1 47 VAL QG 1 90 HIS H . . 5.000 3.370 2.135 3.909 . 0 0 "[ . 1 . ]" 1
71 1 92 VAL MG2 1 95 LYS H . . 5.000 4.048 3.919 4.162 . 0 0 "[ . 1 . ]" 1
72 1 92 VAL HB 1 95 LYS H . . 5.500 5.026 3.945 5.518 0.018 16 0 "[ . 1 . ]" 1
73 1 95 LYS H 1 96 ALA H . . 3.300 2.992 2.431 3.530 0.230 4 0 "[ . 1 . ]" 1
74 1 94 ASP H 1 95 LYS H . . 5.000 2.278 1.841 2.802 . 0 0 "[ . 1 . ]" 1
75 1 95 LYS H 1 95 LYS HA . . 2.900 2.503 2.207 2.901 0.001 2 0 "[ . 1 . ]" 1
76 1 95 LYS H 1 95 LYS QG . . 5.000 3.738 2.191 4.315 . 0 0 "[ . 1 . ]" 1
77 1 91 PHE H 1 91 PHE HA . . 2.900 2.895 2.841 2.932 0.032 6 0 "[ . 1 . ]" 1
78 1 27 ASN HA 1 28 GLU H . . 3.300 2.703 2.252 3.495 0.195 15 0 "[ . 1 . ]" 1
79 1 35 VAL H 1 35 VAL HA . . 2.900 2.557 2.209 2.847 . 0 0 "[ . 1 . ]" 1
80 1 34 HIS HB3 1 35 VAL H . . 5.000 3.988 2.982 4.597 . 0 0 "[ . 1 . ]" 1
81 1 34 HIS HA 1 35 VAL H . . 3.300 2.647 2.187 3.554 0.254 7 0 "[ . 1 . ]" 1
82 1 35 VAL H 1 35 VAL MG2 . . 3.300 2.216 1.836 2.692 . 0 0 "[ . 1 . ]" 1
83 1 47 VAL H 1 89 ILE HG13 . . 5.500 4.670 3.905 5.766 0.266 12 0 "[ . 1 . ]" 1
84 1 56 ARG H 1 56 ARG HA . . 2.900 2.422 2.161 2.754 . 0 0 "[ . 1 . ]" 1
85 1 91 PHE H 1 91 PHE HB2 . . 3.300 3.385 2.388 3.587 0.287 6 0 "[ . 1 . ]" 1
86 1 91 PHE H 1 91 PHE HD1 . . 5.000 4.328 3.599 4.661 . 0 0 "[ . 1 . ]" 1
87 1 56 ARG H 1 56 ARG QD . . 5.000 3.969 3.105 4.460 . 0 0 "[ . 1 . ]" 1
88 1 91 PHE H 1 92 VAL MG2 . . 5.500 4.294 3.864 4.589 . 0 0 "[ . 1 . ]" 1
89 1 49 VAL MG2 1 91 PHE H . . 5.000 3.962 3.590 4.144 . 0 0 "[ . 1 . ]" 1
90 1 56 ARG H 1 56 ARG QG . . 5.000 3.208 2.439 4.451 . 0 0 "[ . 1 . ]" 1
91 1 16 LEU HA 1 17 ILE H . . 5.000 3.638 3.631 3.640 . 0 0 "[ . 1 . ]" 1
92 1 56 ARG H 1 57 GLU H . . 2.900 2.315 1.800 2.862 . 0 0 "[ . 1 . ]" 1
93 1 90 HIS HA 1 91 PHE H . . 3.300 2.254 2.195 2.369 . 0 0 "[ . 1 . ]" 1
94 1 56 ARG H 1 57 GLU QG . . 5.000 3.626 2.436 4.552 . 0 0 "[ . 1 . ]" 1
95 1 47 VAL H 1 47 VAL HB . . 3.300 2.455 2.169 2.828 . 0 0 "[ . 1 . ]" 1
96 1 91 PHE H 1 92 VAL HA . . 5.500 5.243 5.011 5.476 . 0 0 "[ . 1 . ]" 1
97 1 89 ILE MG 1 91 PHE H . . 5.500 4.308 3.868 4.503 . 0 0 "[ . 1 . ]" 1
98 1 13 ILE HA 1 17 ILE H . . 5.000 4.327 4.164 4.454 . 0 0 "[ . 1 . ]" 1
99 1 56 ARG H 1 59 ILE H . . 5.000 4.021 3.305 4.920 . 0 0 "[ . 1 . ]" 1
100 1 17 ILE H 1 17 ILE HG12 . . 2.900 2.733 2.553 2.954 0.054 7 0 "[ . 1 . ]" 1
101 1 17 ILE H 1 89 ILE MD . . 5.500 4.526 4.435 4.616 . 0 0 "[ . 1 . ]" 1
102 1 16 LEU H 1 17 ILE H . . 3.300 2.879 2.742 3.071 . 0 0 "[ . 1 . ]" 1
103 1 46 HIS HB2 1 47 VAL H . . 5.000 4.509 4.156 4.696 . 0 0 "[ . 1 . ]" 1
104 1 47 VAL H 1 47 VAL QG . . 3.300 2.701 2.181 3.006 . 0 0 "[ . 1 . ]" 1
105 1 17 ILE H 1 17 ILE HG13 . . 5.000 3.863 3.728 4.027 . 0 0 "[ . 1 . ]" 1
106 1 47 VAL H 1 89 ILE HA . . 3.300 2.785 1.883 3.421 0.121 12 0 "[ . 1 . ]" 1
107 1 46 HIS HA 1 47 VAL H . . 2.900 2.220 2.186 2.308 . 0 0 "[ . 1 . ]" 1
108 1 17 ILE H 1 17 ILE HA . . 2.900 2.753 2.716 2.776 . 0 0 "[ . 1 . ]" 1
109 1 16 LEU HG 1 17 ILE H . . 5.500 4.606 4.118 4.952 . 0 0 "[ . 1 . ]" 1
110 1 16 LEU HB2 1 17 ILE H . . 5.000 3.003 2.678 3.340 . 0 0 "[ . 1 . ]" 1
111 1 90 HIS HD2 1 91 PHE H . . 5.000 2.702 1.923 4.168 . 0 0 "[ . 1 . ]" 1
112 1 100 ALA H 1 100 ALA MB . . 3.300 2.666 2.164 2.969 . 0 0 "[ . 1 . ]" 1
113 1 99 ASN HA 1 100 ALA H . . 5.000 3.080 2.436 3.650 . 0 0 "[ . 1 . ]" 1
114 1 99 ASN HB2 1 100 ALA H . . 5.000 3.978 2.310 4.702 . 0 0 "[ . 1 . ]" 1
115 1 6 LYS H 1 6 LYS QB . . 3.300 2.627 2.148 3.025 . 0 0 "[ . 1 . ]" 1
116 1 6 LYS H 1 6 LYS HA . . 2.900 2.862 2.737 2.936 0.036 6 0 "[ . 1 . ]" 1
117 1 77 LEU MD2 1 89 ILE H . . 5.500 4.260 3.342 4.474 . 0 0 "[ . 1 . ]" 1
118 1 61 ARG HG2 1 62 VAL H . . 5.000 4.088 2.593 4.903 . 0 0 "[ . 1 . ]" 1
119 1 61 ARG HG3 1 62 VAL H . . 5.000 4.399 2.574 4.697 . 0 0 "[ . 1 . ]" 1
120 1 88 GLN H 1 89 ILE H . . 5.000 3.016 1.722 4.338 . 0 0 "[ . 1 . ]" 1
121 1 88 GLN QB 1 89 ILE H . . 5.000 3.484 2.999 4.059 . 0 0 "[ . 1 . ]" 1
122 1 89 ILE H 1 89 ILE HG12 . . 5.000 3.981 3.156 4.372 . 0 0 "[ . 1 . ]" 1
123 1 88 GLN HA 1 89 ILE H . . 5.000 2.746 2.204 3.525 . 0 0 "[ . 1 . ]" 1
124 1 60 ASP HA 1 62 VAL H . . 5.000 4.776 4.376 5.003 0.003 4 0 "[ . 1 . ]" 1
125 1 89 ILE H 1 89 ILE MD . . 5.500 3.873 3.167 4.537 . 0 0 "[ . 1 . ]" 1
126 1 61 ARG QD 1 62 VAL H . . 5.000 4.898 4.422 5.048 0.048 5 0 "[ . 1 . ]" 1
127 1 59 ILE HA 1 62 VAL H . . 3.300 2.853 2.715 2.974 . 0 0 "[ . 1 . ]" 1
128 1 89 ILE H 1 89 ILE HB . . 3.300 2.698 2.139 3.365 0.065 9 0 "[ . 1 . ]" 1
129 1 62 VAL H 1 62 VAL HB . . 3.300 2.563 2.457 2.664 . 0 0 "[ . 1 . ]" 1
130 1 62 VAL H 1 63 VAL H . . 2.900 2.879 2.778 2.928 0.028 4 0 "[ . 1 . ]" 1
131 1 88 GLN HG2 1 89 ILE H . . 5.000 3.931 2.242 5.692 0.692 15 1 "[ . 1 + ]" 1
132 1 62 VAL H 1 62 VAL HA . . 2.900 2.806 2.786 2.832 . 0 0 "[ . 1 . ]" 1
133 1 61 ARG HA 1 62 VAL H . . 5.000 3.614 3.548 3.638 . 0 0 "[ . 1 . ]" 1
134 1 93 LYS HA 1 94 ASP H . . 5.000 3.560 2.882 3.636 . 0 0 "[ . 1 . ]" 1
135 1 59 ILE H 1 62 VAL H . . 5.000 4.478 4.361 4.596 . 0 0 "[ . 1 . ]" 1
136 1 32 THR MG 1 62 VAL H . . 5.000 4.197 3.853 4.328 . 0 0 "[ . 1 . ]" 1
137 1 29 THR MG 1 62 VAL H . . 5.000 3.260 2.955 3.680 . 0 0 "[ . 1 . ]" 1
138 1 62 VAL H 1 62 VAL QG . . 3.300 1.971 1.855 2.085 . 0 0 "[ . 1 . ]" 1
139 1 61 ARG H 1 62 VAL H . . 2.900 2.454 2.388 2.540 . 0 0 "[ . 1 . ]" 1
140 1 61 ARG HB2 1 62 VAL H . . 5.000 2.626 2.333 4.161 . 0 0 "[ . 1 . ]" 1
141 1 96 ALA H 1 97 ILE HA . . 5.000 4.633 3.870 5.136 0.136 9 0 "[ . 1 . ]" 1
142 1 97 ILE HB 1 100 ALA H . . 5.000 4.309 2.892 5.194 0.194 5 0 "[ . 1 . ]" 1
143 1 60 ASP H 1 62 VAL H . . 5.000 4.297 3.945 4.516 . 0 0 "[ . 1 . ]" 1
144 1 95 LYS HA 1 96 ALA H . . 5.000 3.130 2.654 3.629 . 0 0 "[ . 1 . ]" 1
145 1 94 ASP QB 1 96 ALA H . . 5.500 3.566 2.323 4.692 . 0 0 "[ . 1 . ]" 1
146 1 95 LYS QD 1 96 ALA H . . 5.500 5.100 3.091 5.698 0.198 11 0 "[ . 1 . ]" 1
147 1 93 LYS H 1 94 ASP H . . 3.300 2.222 1.845 3.225 . 0 0 "[ . 1 . ]" 1
148 1 95 LYS HB3 1 96 ALA H . . 5.000 3.888 2.567 4.701 . 0 0 "[ . 1 . ]" 1
149 1 96 ALA H 1 96 ALA MB . . 3.300 2.534 1.996 2.991 . 0 0 "[ . 1 . ]" 1
150 1 93 LYS QG 1 94 ASP H . . 3.300 2.706 1.931 3.853 0.553 10 1 "[ . + . ]" 1
151 1 93 LYS HD3 1 94 ASP H . . 5.500 4.786 2.479 6.264 0.764 10 3 "[- . *+ . ]" 1
152 1 95 LYS QG 1 96 ALA H . . 5.000 4.353 3.649 4.753 . 0 0 "[ . 1 . ]" 1
153 1 96 ALA H 1 97 ILE H . . 3.300 2.703 1.900 3.410 0.110 10 0 "[ . 1 . ]" 1
154 1 60 ASP HB3 1 62 VAL H . . 5.500 5.345 4.925 6.097 0.597 7 1 "[ . + 1 . ]" 1
155 1 84 ALA H 1 84 ALA MB . . 3.300 2.241 1.946 2.979 . 0 0 "[ . 1 . ]" 1
156 1 83 LEU HG 1 84 ALA H . . 5.000 2.865 1.724 4.294 . 0 0 "[ . 1 . ]" 1
157 1 83 LEU HB3 1 84 ALA H . . 5.000 3.504 1.826 4.332 . 0 0 "[ . 1 . ]" 1
158 1 39 LYS H 1 50 TYR HD1 . . 5.500 3.679 3.165 4.097 . 0 0 "[ . 1 . ]" 1
159 1 100 ALA H 1 101 MET HA . . 5.000 4.562 3.822 5.129 0.129 14 0 "[ . 1 . ]" 1
160 1 83 LEU MD2 1 84 ALA H . . 3.300 2.108 1.740 2.816 . 0 0 "[ . 1 . ]" 1
161 1 83 LEU MD1 1 84 ALA H . . 5.000 3.839 3.212 4.267 . 0 0 "[ . 1 . ]" 1
162 1 83 LEU HA 1 84 ALA H . . 5.000 2.726 2.236 3.635 . 0 0 "[ . 1 . ]" 1
163 1 70 LYS HA 1 72 VAL H . . 5.000 4.700 4.282 4.974 . 0 0 "[ . 1 . ]" 1
164 1 72 VAL H 1 75 ARG H . . 5.000 4.611 4.509 4.759 . 0 0 "[ . 1 . ]" 1
165 1 71 GLY HA2 1 72 VAL H . . 5.000 3.643 3.636 3.645 . 0 0 "[ . 1 . ]" 1
166 1 72 VAL H 1 72 VAL MG1 . . 3.300 2.432 2.172 2.739 . 0 0 "[ . 1 . ]" 1
167 1 72 VAL H 1 72 VAL MG2 . . 2.900 1.870 1.749 2.061 . 0 0 "[ . 1 . ]" 1
168 1 69 ALA HA 1 72 VAL H . . 5.000 3.399 3.087 3.795 . 0 0 "[ . 1 . ]" 1
169 1 72 VAL H 1 72 VAL HA . . 2.900 2.802 2.767 2.877 . 0 0 "[ . 1 . ]" 1
170 1 72 VAL H 1 73 PHE H . . 2.900 2.675 2.372 2.984 0.084 13 0 "[ . 1 . ]" 1
171 1 69 ALA MB 1 72 VAL H . . 5.000 4.038 3.811 4.241 . 0 0 "[ . 1 . ]" 1
172 1 71 GLY H 1 72 VAL H . . 3.300 2.936 2.645 3.420 0.120 8 0 "[ . 1 . ]" 1
173 1 39 LYS H 1 39 LYS HA . . 2.900 2.923 2.872 2.939 0.039 14 0 "[ . 1 . ]" 1
174 1 72 VAL H 1 73 PHE HA . . 5.500 5.208 4.992 5.427 . 0 0 "[ . 1 . ]" 1
175 1 39 LYS H 1 49 VAL HA . . 5.000 3.900 3.496 4.213 . 0 0 "[ . 1 . ]" 1
176 1 39 LYS H 1 48 THR HB . . 3.300 2.812 2.257 3.286 . 0 0 "[ . 1 . ]" 1
177 1 38 VAL MG1 1 39 LYS H . . 5.000 3.393 2.630 4.321 . 0 0 "[ . 1 . ]" 1
178 1 38 VAL HA 1 39 LYS H . . 2.900 2.230 2.182 2.337 . 0 0 "[ . 1 . ]" 1
179 1 39 LYS H 1 47 VAL QG . . 5.000 3.908 2.983 4.641 . 0 0 "[ . 1 . ]" 1
180 1 39 LYS H 1 39 LYS HB3 . . 3.300 2.811 2.214 3.386 0.086 15 0 "[ . 1 . ]" 1
181 1 39 LYS H 1 48 THR HA . . 5.000 4.477 4.194 4.967 . 0 0 "[ . 1 . ]" 1
182 1 39 LYS H 1 50 TYR HE1 . . 3.300 3.194 2.194 3.401 0.101 13 0 "[ . 1 . ]" 1
183 1 98 ASP H 1 99 ASN H . . 3.300 2.764 1.860 3.324 0.024 2 0 "[ . 1 . ]" 1
184 1 97 ILE HG13 1 98 ASP H . . 5.500 4.239 2.027 5.001 . 0 0 "[ . 1 . ]" 1
185 1 97 ILE HA 1 98 ASP H . . 5.000 3.040 2.471 3.631 . 0 0 "[ . 1 . ]" 1
186 1 97 ILE HB 1 98 ASP H . . 5.000 4.254 3.347 4.672 . 0 0 "[ . 1 . ]" 1
187 1 97 ILE MG 1 98 ASP H . . 5.500 3.777 1.811 4.472 . 0 0 "[ . 1 . ]" 1
188 1 96 ALA H 1 98 ASP H . . 5.000 3.679 2.166 5.135 0.135 10 0 "[ . 1 . ]" 1
189 1 95 LYS HA 1 98 ASP H . . 5.500 4.920 2.633 5.633 0.133 5 0 "[ . 1 . ]" 1
190 1 98 ASP H 1 98 ASP HA . . 2.900 2.414 2.173 2.847 . 0 0 "[ . 1 . ]" 1
191 1 97 ILE H 1 98 ASP H . . 3.300 2.577 1.818 3.370 0.070 2 0 "[ . 1 . ]" 1
192 1 11 ASN H 1 12 ASP H . . 2.900 2.764 2.643 2.863 . 0 0 "[ . 1 . ]" 1
193 1 60 ASP H 1 60 ASP HB3 . . 3.300 3.206 2.580 3.582 0.282 13 0 "[ . 1 . ]" 1
194 1 59 ILE MG 1 60 ASP H . . 3.300 1.885 1.847 1.952 . 0 0 "[ . 1 . ]" 1
195 1 12 ASP H 1 12 ASP HB2 . . 2.900 2.065 2.021 2.103 . 0 0 "[ . 1 . ]" 1
196 1 59 ILE HB 1 60 ASP H . . 3.300 3.353 3.244 3.455 0.155 5 0 "[ . 1 . ]" 1
197 1 59 ILE H 1 60 ASP H . . 3.300 2.957 2.797 3.115 . 0 0 "[ . 1 . ]" 1
198 1 72 VAL HA 1 75 ARG H . . 3.300 3.324 3.097 3.438 0.138 3 0 "[ . 1 . ]" 1
199 1 75 ARG H 1 75 ARG QG . . 3.300 3.751 3.642 3.876 0.576 3 5 "[ *+ . **1- . ]" 1
200 1 18 ASN HA 1 21 VAL H . . 5.000 3.396 3.025 3.926 . 0 0 "[ . 1 . ]" 1
201 1 60 ASP H 1 61 ARG H . . 2.900 2.936 2.887 2.983 0.083 14 0 "[ . 1 . ]" 1
202 1 75 ARG H 1 75 ARG HA . . 2.900 2.782 2.723 2.825 . 0 0 "[ . 1 . ]" 1
203 1 74 SER HB3 1 75 ARG H . . 5.000 3.634 2.746 4.199 . 0 0 "[ . 1 . ]" 1
204 1 60 ASP HB3 1 61 ARG H . . 3.300 3.114 2.629 4.143 0.843 7 2 "[ - . + 1 . ]" 1
205 1 74 SER H 1 75 ARG H . . 2.900 2.500 1.777 2.756 . 0 0 "[ . 1 . ]" 1
206 1 61 ARG H 1 61 ARG HB2 . . 3.300 2.612 2.477 3.563 0.263 16 0 "[ . 1 . ]" 1
207 1 75 ARG H 1 75 ARG HB3 . . 2.900 2.912 2.227 3.101 0.201 5 0 "[ . 1 . ]" 1
208 1 61 ARG H 1 62 VAL HB . . 5.000 4.725 4.583 4.846 . 0 0 "[ . 1 . ]" 1
209 1 61 ARG H 1 61 ARG HA . . 2.900 2.836 2.824 2.847 . 0 0 "[ . 1 . ]" 1
210 1 75 ARG H 1 75 ARG QD . . 5.000 4.096 3.623 4.787 . 0 0 "[ . 1 . ]" 1
211 1 61 ARG H 1 61 ARG HG3 . . 3.300 3.156 2.034 3.372 0.072 16 0 "[ . 1 . ]" 1
212 1 74 SER HA 1 75 ARG H . . 5.000 3.559 3.512 3.596 . 0 0 "[ . 1 . ]" 1
213 1 75 ARG H 1 76 VAL H . . 2.900 2.570 2.423 2.795 . 0 0 "[ . 1 . ]" 1
214 1 75 ARG H 1 76 VAL MG2 . . 5.000 3.851 3.700 4.004 . 0 0 "[ . 1 . ]" 1
215 1 61 ARG H 1 62 VAL HA . . 5.500 5.042 4.978 5.114 . 0 0 "[ . 1 . ]" 1
216 1 73 PHE HA 1 75 ARG H . . 5.000 4.223 3.919 4.654 . 0 0 "[ . 1 . ]" 1
217 1 61 ARG H 1 61 ARG QD . . 3.300 3.733 3.569 3.988 0.688 16 3 "[ . - *+]" 1
218 1 75 ARG H 1 77 LEU H . . 5.000 4.671 4.362 4.925 . 0 0 "[ . 1 . ]" 1
219 1 59 ILE HA 1 61 ARG H . . 5.000 3.953 3.878 4.178 . 0 0 "[ . 1 . ]" 1
220 1 61 ARG H 1 61 ARG HG2 . . 3.300 2.233 1.916 3.227 . 0 0 "[ . 1 . ]" 1
221 1 59 ILE H 1 61 ARG H . . 5.000 4.198 4.066 4.437 . 0 0 "[ . 1 . ]" 1
222 1 59 ILE MG 1 61 ARG H . . 5.000 4.151 4.102 4.302 . 0 0 "[ . 1 . ]" 1
223 1 61 ARG H 1 62 VAL QG . . 5.000 3.609 3.336 3.694 . 0 0 "[ . 1 . ]" 1
224 1 73 PHE H 1 75 ARG H . . 5.000 4.005 3.781 4.372 . 0 0 "[ . 1 . ]" 1
225 1 93 LYS H 1 95 LYS H . . 5.000 3.182 2.133 4.797 . 0 0 "[ . 1 . ]" 1
226 1 75 ARG H 1 78 ALA MB . . 5.000 4.020 3.903 4.115 . 0 0 "[ . 1 . ]" 1
227 1 58 GLN HA 1 61 ARG H . . 3.300 3.357 3.264 3.442 0.142 5 0 "[ . 1 . ]" 1
228 1 75 ARG H 1 76 VAL HB . . 5.000 4.722 4.522 4.966 . 0 0 "[ . 1 . ]" 1
229 1 61 ARG H 1 63 VAL H . . 5.000 4.374 4.292 4.520 . 0 0 "[ . 1 . ]" 1
230 1 60 ASP HA 1 61 ARG H . . 5.000 3.603 3.591 3.629 . 0 0 "[ . 1 . ]" 1
231 1 59 ILE HA 1 60 ASP H . . 5.000 3.629 3.619 3.633 . 0 0 "[ . 1 . ]" 1
232 1 93 LYS H 1 93 LYS HA . . 2.900 2.838 2.237 2.939 0.039 1 0 "[ . 1 . ]" 1
233 1 9 LEU HA 1 12 ASP H . . 3.300 3.233 3.069 3.339 0.039 10 0 "[ . 1 . ]" 1
234 1 20 THR H 1 21 VAL H . . 3.300 2.648 2.433 2.930 . 0 0 "[ . 1 . ]" 1
235 1 21 VAL H 1 21 VAL HB . . 2.900 2.497 2.314 2.718 . 0 0 "[ . 1 . ]" 1
236 1 20 THR HA 1 21 VAL H . . 5.000 3.609 3.548 3.633 . 0 0 "[ . 1 . ]" 1
237 1 92 VAL HA 1 93 LYS H . . 3.300 2.520 2.198 3.622 0.322 9 0 "[ . 1 . ]" 1
238 1 21 VAL H 1 21 VAL MG2 . . 3.300 2.047 1.800 2.387 . 0 0 "[ . 1 . ]" 1
239 1 21 VAL H 1 22 ILE H . . 2.900 2.745 2.465 3.103 0.203 14 0 "[ . 1 . ]" 1
240 1 25 ILE MG 1 30 VAL H . . 5.000 2.937 2.108 4.487 . 0 0 "[ . 1 . ]" 1
241 1 29 THR HA 1 30 VAL H . . 5.000 3.548 2.424 3.632 . 0 0 "[ . 1 . ]" 1
242 1 30 VAL H 1 32 THR H . . 5.500 4.269 3.214 4.863 . 0 0 "[ . 1 . ]" 1
243 1 92 VAL MG2 1 93 LYS H . . 5.000 3.751 3.468 4.381 . 0 0 "[ . 1 . ]" 1
244 1 30 VAL H 1 65 ALA MB . . 5.000 2.727 2.426 3.402 . 0 0 "[ . 1 . ]" 1
245 1 92 VAL HB 1 93 LYS H . . 5.000 3.912 2.389 4.594 . 0 0 "[ . 1 . ]" 1
246 1 93 LYS H 1 93 LYS QG . . 2.900 2.222 1.786 2.857 . 0 0 "[ . 1 . ]" 1
247 1 29 THR HB 1 30 VAL H . . 3.300 2.843 2.397 3.633 0.333 13 0 "[ . 1 . ]" 1
248 1 30 VAL H 1 30 VAL MG1 . . 3.300 1.918 1.831 2.555 . 0 0 "[ . 1 . ]" 1
249 1 30 VAL H 1 31 LYS H . . 2.900 2.801 2.654 2.940 0.040 13 0 "[ . 1 . ]" 1
250 1 41 SER HA 1 42 ASP H . . 3.300 2.342 2.216 2.693 . 0 0 "[ . 1 . ]" 1
251 1 42 ASP H 1 42 ASP HB2 . . 3.300 3.281 2.836 3.733 0.433 8 0 "[ . 1 . ]" 1
252 1 93 LYS H 1 93 LYS HB3 . . 3.300 3.571 2.713 4.073 0.773 9 4 "[ * +1- *. ]" 1
253 1 67 ASN QB 1 69 ALA H . . 5.000 4.435 3.959 5.048 0.048 9 0 "[ . 1 . ]" 1
254 1 68 GLN QG 1 69 ALA H . . 5.000 3.097 2.086 4.402 . 0 0 "[ . 1 . ]" 1
255 1 66 PHE HA 1 69 ALA H . . 3.300 3.059 2.785 3.321 0.021 14 0 "[ . 1 . ]" 1
256 1 68 GLN HA 1 69 ALA H . . 5.000 3.451 3.292 3.550 . 0 0 "[ . 1 . ]" 1
257 1 65 ALA HA 1 69 ALA H . . 5.000 4.575 4.012 4.961 . 0 0 "[ . 1 . ]" 1
258 1 68 GLN H 1 69 ALA H . . 2.900 2.272 1.727 2.615 . 0 0 "[ . 1 . ]" 1
259 1 69 ALA H 1 70 LYS H . . 2.900 2.451 2.010 2.903 0.003 16 0 "[ . 1 . ]" 1
260 1 68 GLN HB3 1 69 ALA H . . 5.000 4.206 3.910 4.402 . 0 0 "[ . 1 . ]" 1
261 1 69 ALA H 1 69 ALA MB . . 2.900 2.145 2.045 2.276 . 0 0 "[ . 1 . ]" 1
262 1 69 ALA H 1 70 LYS HA . . 5.000 4.781 4.328 5.070 0.070 16 0 "[ . 1 . ]" 1
263 1 69 ALA H 1 69 ALA HA . . 2.900 2.879 2.857 2.941 0.041 10 0 "[ . 1 . ]" 1
264 1 12 ASP HA 1 13 ILE H . . 5.000 3.627 3.592 3.655 . 0 0 "[ . 1 . ]" 1
265 1 11 ASN HA 1 13 ILE H . . 5.000 4.414 3.983 4.928 . 0 0 "[ . 1 . ]" 1
266 1 12 ASP HB2 1 13 ILE H . . 3.300 3.290 3.159 3.371 0.071 15 0 "[ . 1 . ]" 1
267 1 13 ILE H 1 14 ILE H . . 3.300 2.689 2.524 2.850 . 0 0 "[ . 1 . ]" 1
268 1 13 ILE H 1 14 ILE MD . . 5.000 3.658 3.408 3.915 . 0 0 "[ . 1 . ]" 1
269 1 13 ILE H 1 14 ILE HB . . 5.000 4.504 4.357 4.713 . 0 0 "[ . 1 . ]" 1
270 1 13 ILE H 1 13 ILE HB . . 2.900 2.423 2.353 2.508 . 0 0 "[ . 1 . ]" 1
271 1 12 ASP HB3 1 13 ILE H . . 3.300 2.557 2.038 2.932 . 0 0 "[ . 1 . ]" 1
272 1 67 ASN HA 1 68 GLN H . . 5.000 3.391 2.826 3.655 . 0 0 "[ . 1 . ]" 1
273 1 68 GLN H 1 70 LYS H . . 5.000 3.727 2.354 5.135 0.135 13 0 "[ . 1 . ]" 1
274 1 9 LEU H 1 12 ASP HB2 . . 5.500 4.550 4.327 5.192 . 0 0 "[ . 1 . ]" 1
275 1 66 PHE HA 1 68 GLN H . . 5.000 4.204 3.319 4.858 . 0 0 "[ . 1 . ]" 1
276 1 9 LEU H 1 10 GLU HB2 . . 5.000 4.646 4.339 4.929 . 0 0 "[ . 1 . ]" 1
277 1 68 GLN H 1 68 GLN QG . . 2.900 2.494 1.925 2.845 . 0 0 "[ . 1 . ]" 1
278 1 68 GLN H 1 68 GLN HA . . 2.900 2.800 2.722 2.835 . 0 0 "[ . 1 . ]" 1
279 1 9 LEU H 1 9 LEU QB . . 3.300 2.100 2.058 2.180 . 0 0 "[ . 1 . ]" 1
280 1 9 LEU H 1 9 LEU HA . . 2.900 2.738 2.691 2.828 . 0 0 "[ . 1 . ]" 1
281 1 8 ARG H 1 9 LEU H . . 5.000 4.084 2.767 4.669 . 0 0 "[ . 1 . ]" 1
282 1 66 PHE H 1 68 GLN H . . 5.000 4.722 4.323 4.939 . 0 0 "[ . 1 . ]" 1
283 1 67 ASN QB 1 68 GLN H . . 5.000 2.835 1.997 3.958 . 0 0 "[ . 1 . ]" 1
284 1 9 LEU H 1 10 GLU H . . 3.300 2.831 2.523 2.975 . 0 0 "[ . 1 . ]" 1
285 1 8 ARG HD3 1 9 LEU H . . 5.000 4.268 2.746 4.957 . 0 0 "[ . 1 . ]" 1
286 1 8 ARG HD2 1 9 LEU H . . 5.000 4.225 2.010 5.038 0.038 6 0 "[ . 1 . ]" 1
287 1 9 LEU H 1 9 LEU MD2 . . 5.000 2.434 1.968 4.029 . 0 0 "[ . 1 . ]" 1
288 1 8 ARG HB3 1 9 LEU H . . 3.300 2.251 1.591 3.395 0.095 8 0 "[ . 1 . ]" 1
289 1 9 LEU H 1 10 GLU HA . . 5.500 5.279 5.006 5.404 . 0 0 "[ . 1 . ]" 1
290 1 8 ARG HA 1 9 LEU H . . 5.000 3.236 2.780 3.650 . 0 0 "[ . 1 . ]" 1
291 1 65 ALA HA 1 66 PHE H . . 5.000 3.602 3.588 3.615 . 0 0 "[ . 1 . ]" 1
292 1 30 VAL MG1 1 66 PHE H . . 5.000 2.572 2.406 2.694 . 0 0 "[ . 1 . ]" 1
293 1 64 GLY HA2 1 66 PHE H . . 5.000 4.589 4.499 4.650 . 0 0 "[ . 1 . ]" 1
294 1 63 VAL H 1 64 GLY HA2 . . 5.500 5.388 5.281 5.473 . 0 0 "[ . 1 . ]" 1
295 1 62 VAL HA 1 66 PHE H . . 5.000 3.978 3.822 4.149 . 0 0 "[ . 1 . ]" 1
296 1 66 PHE H 1 67 ASN QB . . 5.000 4.418 4.343 4.583 . 0 0 "[ . 1 . ]" 1
297 1 60 ASP HA 1 63 VAL H . . 5.000 4.301 4.106 4.436 . 0 0 "[ . 1 . ]" 1
298 1 59 ILE HA 1 63 VAL H . . 3.300 2.918 2.714 3.138 . 0 0 "[ . 1 . ]" 1
299 1 63 VAL HA 1 66 PHE H . . 3.300 3.218 3.125 3.349 0.049 16 0 "[ . 1 . ]" 1
300 1 66 PHE H 1 66 PHE HB2 . . 3.300 1.981 1.936 2.049 . 0 0 "[ . 1 . ]" 1
301 1 61 ARG HA 1 63 VAL H . . 5.500 5.175 5.036 5.297 . 0 0 "[ . 1 . ]" 1
302 1 29 THR MG 1 66 PHE H . . 5.500 4.238 4.097 4.362 . 0 0 "[ . 1 . ]" 1
303 1 63 VAL H 1 63 VAL MG2 . . 3.300 2.071 1.852 2.389 . 0 0 "[ . 1 . ]" 1
304 1 63 VAL H 1 63 VAL HA . . 2.900 2.728 2.689 2.763 . 0 0 "[ . 1 . ]" 1
305 1 78 ALA H 1 79 HIS HB2 . . 5.500 4.779 4.374 5.483 . 0 0 "[ . 1 . ]" 1
306 1 76 VAL H 1 78 ALA H . . 5.000 3.727 3.492 3.931 . 0 0 "[ . 1 . ]" 1
307 1 78 ALA H 1 79 HIS HA . . 5.500 5.274 5.084 5.394 . 0 0 "[ . 1 . ]" 1
308 1 66 PHE H 1 66 PHE HA . . 2.900 2.756 2.753 2.768 . 0 0 "[ . 1 . ]" 1
309 1 62 VAL QG 1 63 VAL H . . 5.000 3.052 2.986 3.102 . 0 0 "[ . 1 . ]" 1
310 1 62 VAL HB 1 63 VAL H . . 3.300 2.134 2.072 2.201 . 0 0 "[ . 1 . ]" 1
311 1 65 ALA MB 1 66 PHE H . . 3.300 2.673 2.532 2.749 . 0 0 "[ . 1 . ]" 1
312 1 51 LEU MD1 1 63 VAL H . . 5.000 3.442 2.886 3.821 . 0 0 "[ . 1 . ]" 1
313 1 77 LEU H 1 89 ILE MD . . 5.500 3.969 3.630 4.116 . 0 0 "[ . 1 . ]" 1
314 1 78 ALA H 1 78 ALA HA . . 2.900 2.758 2.696 2.823 . 0 0 "[ . 1 . ]" 1
315 1 75 ARG HA 1 78 ALA H . . 3.300 3.167 2.974 3.450 0.150 15 0 "[ . 1 . ]" 1
316 1 66 PHE H 1 66 PHE QD . . 2.900 2.521 2.284 2.736 . 0 0 "[ . 1 . ]" 1
317 1 63 VAL MG1 1 66 PHE H . . 5.500 4.557 4.420 4.745 . 0 0 "[ . 1 . ]" 1
318 1 85 LYS QB 1 86 ALA H . . 5.000 3.122 1.811 4.079 . 0 0 "[ . 1 . ]" 1
319 1 63 VAL H 1 63 VAL HB . . 2.900 2.426 2.291 2.700 . 0 0 "[ . 1 . ]" 1
320 1 76 VAL HB 1 77 LEU H . . 3.300 2.300 2.114 2.530 . 0 0 "[ . 1 . ]" 1
321 1 75 ARG QG 1 78 ALA H . . 5.500 4.622 4.280 5.067 . 0 0 "[ . 1 . ]" 1
322 1 78 ALA H 1 79 HIS H . . 2.900 2.789 2.569 2.939 0.039 11 0 "[ . 1 . ]" 1
323 1 77 LEU H 1 77 LEU HA . . 2.900 2.806 2.751 2.840 . 0 0 "[ . 1 . ]" 1
324 1 50 TYR H 1 51 LEU H . . 5.000 2.894 2.239 3.624 . 0 0 "[ . 1 . ]" 1
325 1 85 LYS HA 1 86 ALA H . . 5.000 2.970 2.444 3.623 . 0 0 "[ . 1 . ]" 1
326 1 76 VAL MG1 1 77 LEU H . . 5.000 3.127 2.893 3.564 . 0 0 "[ . 1 . ]" 1
327 1 77 LEU HA 1 78 ALA H . . 5.000 3.538 3.485 3.604 . 0 0 "[ . 1 . ]" 1
328 1 77 LEU H 1 78 ALA H . . 3.300 2.582 2.477 2.726 . 0 0 "[ . 1 . ]" 1
329 1 51 LEU H 1 93 LYS HA . . 5.500 5.233 3.764 5.598 0.098 15 0 "[ . 1 . ]" 1
330 1 85 LYS QB 1 87 VAL H . . 5.500 4.853 2.911 5.783 0.283 8 0 "[ . 1 . ]" 1
331 1 85 LYS QG 1 86 ALA H . . 5.000 3.989 1.924 4.822 . 0 0 "[ . 1 . ]" 1
332 1 78 ALA H 1 78 ALA MB . . 2.900 2.075 1.944 2.159 . 0 0 "[ . 1 . ]" 1
333 1 76 VAL HA 1 77 LEU H . . 5.000 3.637 3.622 3.641 . 0 0 "[ . 1 . ]" 1
334 1 77 LEU MD1 1 78 ALA H . . 5.000 3.470 3.012 4.002 . 0 0 "[ . 1 . ]" 1
335 1 50 TYR HA 1 51 LEU H . . 5.000 3.145 2.544 3.599 . 0 0 "[ . 1 . ]" 1
336 1 62 VAL HA 1 63 VAL H . . 5.000 3.640 3.639 3.641 . 0 0 "[ . 1 . ]" 1
337 1 77 LEU H 1 77 LEU HG . . 2.900 2.091 1.883 2.403 . 0 0 "[ . 1 . ]" 1
338 1 76 VAL MG2 1 77 LEU H . . 5.000 3.784 3.689 3.896 . 0 0 "[ . 1 . ]" 1
339 1 51 LEU MD1 1 66 PHE H . . 5.000 4.201 4.027 4.261 . 0 0 "[ . 1 . ]" 1
340 1 77 LEU H 1 77 LEU MD1 . . 3.300 2.180 1.844 2.769 . 0 0 "[ . 1 . ]" 1
341 1 51 LEU H 1 51 LEU HB2 . . 3.300 3.176 2.440 3.832 0.532 3 1 "[ + . 1 . ]" 1
342 1 75 ARG HB3 1 78 ALA H . . 5.500 5.088 4.745 5.572 0.072 15 0 "[ . 1 . ]" 1
343 1 51 LEU H 1 51 LEU MD2 . . 5.000 2.769 1.858 3.845 . 0 0 "[ . 1 . ]" 1
344 1 51 LEU H 1 51 LEU MD1 . . 5.500 4.119 3.526 4.637 . 0 0 "[ . 1 . ]" 1
345 1 86 ALA H 1 86 ALA HA . . 2.900 2.667 2.212 2.908 0.008 11 0 "[ . 1 . ]" 1
346 1 56 ARG HA 1 57 GLU H . . 5.000 3.261 2.632 3.587 . 0 0 "[ . 1 . ]" 1
347 1 74 SER H 1 77 LEU H . . 5.500 5.221 4.275 5.537 0.037 1 0 "[ . 1 . ]" 1
348 1 75 ARG HA 1 77 LEU H . . 5.500 4.740 4.355 5.099 . 0 0 "[ . 1 . ]" 1
349 1 55 ASN QB 1 57 GLU H . . 3.300 3.032 2.506 3.931 0.631 5 1 "[ + 1 . ]" 1
350 1 86 ALA H 1 87 VAL H . . 3.300 2.664 1.871 3.653 0.353 11 0 "[ . 1 . ]" 1
351 1 56 ARG QB 1 57 GLU H . . 5.000 3.597 2.802 4.122 . 0 0 "[ . 1 . ]" 1
352 1 56 ARG QG 1 57 GLU H . . 5.500 3.730 1.924 4.840 . 0 0 "[ . 1 . ]" 1
353 1 76 VAL H 1 77 LEU H . . 3.300 2.939 2.760 3.056 . 0 0 "[ . 1 . ]" 1
354 1 57 GLU H 1 57 GLU QB . . 2.900 2.511 2.323 3.160 0.260 5 0 "[ . 1 . ]" 1
355 1 57 GLU H 1 57 GLU HA . . 2.900 2.831 2.767 2.861 . 0 0 "[ . 1 . ]" 1
356 1 57 GLU H 1 58 GLN HA . . 5.500 4.990 4.288 5.178 . 0 0 "[ . 1 . ]" 1
357 1 57 GLU H 1 57 GLU QG . . 3.300 2.260 1.893 2.554 . 0 0 "[ . 1 . ]" 1
358 1 57 GLU H 1 58 GLN H . . 2.900 2.455 1.717 2.793 . 0 0 "[ . 1 . ]" 1
359 1 55 ASN HA 1 57 GLU H . . 5.500 4.682 4.058 5.648 0.148 5 0 "[ . 1 . ]" 1
360 1 56 ARG QD 1 57 GLU H . . 5.500 4.750 2.690 5.503 0.003 15 0 "[ . 1 . ]" 1
361 1 14 ILE H 1 14 ILE MD . . 3.300 1.919 1.858 2.186 . 0 0 "[ . 1 . ]" 1
362 1 13 ILE MG 1 14 ILE H . . 5.000 3.448 3.101 3.678 . 0 0 "[ . 1 . ]" 1
363 1 14 ILE H 1 15 ARG HA . . 5.500 5.281 5.147 5.419 . 0 0 "[ . 1 . ]" 1
364 1 13 ILE HB 1 14 ILE H . . 3.300 2.633 2.413 2.888 . 0 0 "[ . 1 . ]" 1
365 1 14 ILE H 1 14 ILE HB . . 2.900 2.144 2.082 2.204 . 0 0 "[ . 1 . ]" 1
366 1 13 ILE HA 1 14 ILE H . . 5.000 3.610 3.571 3.638 . 0 0 "[ . 1 . ]" 1
367 1 10 GLU HA 1 14 ILE H . . 5.000 4.294 4.001 4.497 . 0 0 "[ . 1 . ]" 1
368 1 10 GLU QG 1 14 ILE H . . 5.500 4.788 3.639 5.547 0.047 7 0 "[ . 1 . ]" 1
369 1 14 ILE H 1 15 ARG H . . 5.000 2.800 2.623 3.001 . 0 0 "[ . 1 . ]" 1
370 1 11 ASN HA 1 14 ILE H . . 5.000 3.293 3.061 3.567 . 0 0 "[ . 1 . ]" 1
371 1 12 ASP HA 1 14 ILE H . . 5.000 4.607 4.191 5.001 0.001 16 0 "[ . 1 . ]" 1
372 1 87 VAL H 1 87 VAL HA . . 2.900 2.721 2.213 2.941 0.041 6 0 "[ . 1 . ]" 1
373 1 70 LYS H 1 72 VAL MG2 . . 5.500 4.322 3.227 4.627 . 0 0 "[ . 1 . ]" 1
374 1 69 ALA MB 1 70 LYS H . . 5.000 2.928 1.923 3.512 . 0 0 "[ . 1 . ]" 1
375 1 86 ALA MB 1 87 VAL H . . 5.000 2.868 1.794 3.724 . 0 0 "[ . 1 . ]" 1
376 1 66 PHE HA 1 70 LYS H . . 5.000 4.005 3.517 4.478 . 0 0 "[ . 1 . ]" 1
377 1 69 ALA HA 1 70 LYS H . . 5.000 3.465 3.204 3.631 . 0 0 "[ . 1 . ]" 1
378 1 70 LYS H 1 70 LYS HB3 . . 3.300 3.007 2.183 3.920 0.620 8 2 "[ . + 1 - . ]" 1
379 1 66 PHE HB3 1 70 LYS H . . 5.500 5.018 4.685 5.322 . 0 0 "[ . 1 . ]" 1
380 1 8 ARG H 1 8 ARG QG . . 5.000 2.901 1.829 3.992 . 0 0 "[ . 1 . ]" 1
381 1 7 GLU QB 1 8 ARG H . . 5.000 3.279 1.837 3.995 . 0 0 "[ . 1 . ]" 1
382 1 8 ARG H 1 8 ARG HA . . 2.900 2.403 2.160 2.825 . 0 0 "[ . 1 . ]" 1
383 1 52 ASP H 1 52 ASP QB . . 3.300 2.674 2.304 3.123 . 0 0 "[ . 1 . ]" 1
384 1 59 ILE H 1 59 ILE HG13 . . 5.000 4.199 4.059 4.356 . 0 0 "[ . 1 . ]" 1
385 1 53 CYS QB 1 59 ILE H . . 5.000 3.413 2.339 4.423 . 0 0 "[ . 1 . ]" 1
386 1 15 ARG H 1 16 LEU H . . 3.300 2.591 2.534 2.680 . 0 0 "[ . 1 . ]" 1
387 1 58 GLN H 1 59 ILE H . . 2.900 1.919 1.616 2.053 . 0 0 "[ . 1 . ]" 1
388 1 59 ILE H 1 59 ILE MD . . 5.000 3.023 2.759 3.269 . 0 0 "[ . 1 . ]" 1
389 1 58 GLN HA 1 59 ILE H . . 5.000 3.384 3.231 3.590 . 0 0 "[ . 1 . ]" 1
390 1 56 ARG QB 1 59 ILE H . . 5.500 4.332 3.349 5.172 . 0 0 "[ . 1 . ]" 1
391 1 58 GLN HB3 1 59 ILE H . . 5.000 3.675 2.815 4.250 . 0 0 "[ . 1 . ]" 1
392 1 57 GLU QG 1 59 ILE H . . 5.500 4.873 4.213 5.322 . 0 0 "[ . 1 . ]" 1
393 1 59 ILE H 1 59 ILE HA . . 2.900 2.715 2.626 2.785 . 0 0 "[ . 1 . ]" 1
394 1 59 ILE H 1 59 ILE HB . . 2.900 2.005 1.985 2.034 . 0 0 "[ . 1 . ]" 1
395 1 56 ARG HA 1 59 ILE H . . 3.300 2.886 2.574 3.551 0.251 5 0 "[ . 1 . ]" 1
396 1 7 GLU H 1 8 ARG H . . 5.000 3.008 2.323 4.132 . 0 0 "[ . 1 . ]" 1
397 1 19 ARG H 1 19 ARG HB3 . . 3.300 3.154 2.635 3.493 0.193 2 0 "[ . 1 . ]" 1
398 1 52 ASP H 1 52 ASP HA . . 2.900 2.634 2.171 2.917 0.017 10 0 "[ . 1 . ]" 1
399 1 36 THR MG 1 52 ASP H . . 5.500 4.034 3.180 4.613 . 0 0 "[ . 1 . ]" 1
400 1 16 LEU H 1 16 LEU QD . . 3.300 3.018 2.356 3.611 0.311 7 0 "[ . 1 . ]" 1
401 1 83 LEU H 1 83 LEU MD2 . . 5.500 3.729 1.744 4.531 . 0 0 "[ . 1 . ]" 1
402 1 82 TYR HB3 1 83 LEU H . . 5.000 3.222 1.941 4.716 . 0 0 "[ . 1 . ]" 1
403 1 51 LEU MD2 1 52 ASP H . . 5.000 3.619 2.395 4.359 . 0 0 "[ . 1 . ]" 1
404 1 13 ILE HA 1 16 LEU H . . 3.300 3.197 3.063 3.322 0.022 7 0 "[ . 1 . ]" 1
405 1 83 LEU H 1 84 ALA HA . . 5.500 5.190 4.621 5.869 0.369 11 0 "[ . 1 . ]" 1
406 1 51 LEU HA 1 52 ASP H . . 5.000 2.728 2.176 3.629 . 0 0 "[ . 1 . ]" 1
407 1 82 TYR H 1 83 LEU H . . 5.000 3.787 2.392 4.651 . 0 0 "[ . 1 . ]" 1
408 1 83 LEU H 1 84 ALA H . . 5.500 4.094 2.499 4.649 . 0 0 "[ . 1 . ]" 1
409 1 82 TYR HA 1 83 LEU H . . 5.000 2.791 2.194 3.641 . 0 0 "[ . 1 . ]" 1
410 1 34 HIS H 1 52 ASP H . . 5.500 4.624 2.155 6.010 0.510 15 1 "[ . 1 + ]" 1
411 1 35 VAL HA 1 52 ASP H . . 5.000 3.651 2.376 5.058 0.058 12 0 "[ . 1 . ]" 1
412 1 51 LEU HB3 1 52 ASP H . . 3.300 3.356 1.924 4.176 0.876 4 3 "[ -+. * 1 . ]" 1
413 1 52 ASP H 1 59 ILE MD . . 5.000 3.130 2.235 3.932 . 0 0 "[ . 1 . ]" 1
414 1 51 LEU HB2 1 52 ASP H . . 5.000 3.581 1.774 4.634 . 0 0 "[ . 1 . ]" 1
415 1 16 LEU H 1 16 LEU HG . . 5.000 4.218 3.207 4.484 . 0 0 "[ . 1 . ]" 1
416 1 81 LEU QB 1 83 LEU H . . 5.500 4.849 2.827 5.983 0.483 8 0 "[ . 1 . ]" 1
417 1 83 LEU H 1 83 LEU HB3 . . 3.300 3.158 2.232 3.980 0.680 10 3 "[ . - + .*]" 1
418 1 12 ASP HA 1 16 LEU H . . 5.000 4.412 4.189 4.574 . 0 0 "[ . 1 . ]" 1
419 1 40 LEU HB2 1 41 SER H . . 5.000 4.431 4.083 4.703 . 0 0 "[ . 1 . ]" 1
420 1 41 SER H 1 41 SER QB . . 3.300 2.630 2.089 3.361 0.061 9 0 "[ . 1 . ]" 1
421 1 41 SER H 1 46 HIS HB2 . . 5.000 3.835 2.906 4.424 . 0 0 "[ . 1 . ]" 1
422 1 15 ARG HG2 1 16 LEU H . . 5.000 4.045 3.790 4.220 . 0 0 "[ . 1 . ]" 1
423 1 40 LEU HA 1 41 SER H . . 2.900 2.260 2.177 2.428 . 0 0 "[ . 1 . ]" 1
424 1 41 SER H 1 46 HIS H . . 5.000 3.343 2.740 3.708 . 0 0 "[ . 1 . ]" 1
425 1 40 LEU MD2 1 41 SER H . . 5.000 3.479 1.820 4.237 . 0 0 "[ . 1 . ]" 1
426 1 40 LEU MD1 1 41 SER H . . 5.000 2.879 2.039 4.075 . 0 0 "[ . 1 . ]" 1
427 1 73 PHE HA 1 76 VAL H . . 5.000 3.544 3.248 4.267 . 0 0 "[ . 1 . ]" 1
428 1 41 SER H 1 41 SER HA . . 2.900 2.859 2.822 2.870 . 0 0 "[ . 1 . ]" 1
429 1 40 LEU HB3 1 41 SER H . . 5.000 3.711 2.781 4.464 . 0 0 "[ . 1 . ]" 1
430 1 41 SER H 1 47 VAL HA . . 5.000 3.525 2.765 4.304 . 0 0 "[ . 1 . ]" 1
431 1 14 ILE MG 1 16 LEU H . . 5.500 4.436 4.188 4.523 . 0 0 "[ . 1 . ]" 1
432 1 75 ARG QG 1 76 VAL H . . 5.000 4.323 3.660 4.504 . 0 0 "[ . 1 . ]" 1
433 1 19 ARG H 1 19 ARG HA . . 2.900 2.709 2.638 2.781 . 0 0 "[ . 1 . ]" 1
434 1 16 LEU H 1 16 LEU HA . . 2.900 2.806 2.771 2.827 . 0 0 "[ . 1 . ]" 1
435 1 16 LEU HA 1 19 ARG H . . 5.000 3.389 3.228 3.840 . 0 0 "[ . 1 . ]" 1
436 1 75 ARG HA 1 76 VAL H . . 5.000 3.558 3.491 3.618 . 0 0 "[ . 1 . ]" 1
437 1 17 ILE HA 1 19 ARG H . . 5.500 4.555 4.195 5.184 . 0 0 "[ . 1 . ]" 1
438 1 15 ARG HB3 1 16 LEU H . . 3.300 3.147 2.969 3.305 0.005 7 0 "[ . 1 . ]" 1
439 1 75 ARG HB3 1 76 VAL H . . 3.300 3.006 2.679 3.208 . 0 0 "[ . 1 . ]" 1
440 1 76 VAL H 1 77 LEU HA . . 5.500 5.404 5.274 5.490 . 0 0 "[ . 1 . ]" 1
441 1 76 VAL H 1 77 LEU HB2 . . 5.500 5.370 5.118 5.525 0.025 4 0 "[ . 1 . ]" 1
442 1 75 ARG QD 1 76 VAL H . . 5.500 5.228 4.541 5.498 . 0 0 "[ . 1 . ]" 1
443 1 98 ASP HA 1 99 ASN H . . 3.300 3.001 2.549 3.568 0.268 14 0 "[ . 1 . ]" 1
444 1 99 ASN H 1 99 ASN HB2 . . 3.300 3.121 2.519 3.743 0.443 11 0 "[ . 1 . ]" 1
445 1 17 ILE MD 1 76 VAL H . . 5.500 4.211 3.865 4.451 . 0 0 "[ . 1 . ]" 1
446 1 91 PHE HB2 1 92 VAL H . . 5.000 3.290 2.463 4.531 . 0 0 "[ . 1 . ]" 1
447 1 98 ASP HB3 1 99 ASN H . . 5.000 4.145 3.485 4.501 . 0 0 "[ . 1 . ]" 1
448 1 76 VAL H 1 89 ILE MD . . 5.500 4.375 3.966 4.565 . 0 0 "[ . 1 . ]" 1
449 1 72 VAL HA 1 76 VAL H . . 5.000 4.363 3.652 4.720 . 0 0 "[ . 1 . ]" 1
450 1 51 LEU HB2 1 92 VAL H . . 5.000 4.675 3.876 5.426 0.426 4 0 "[ . 1 . ]" 1
451 1 48 THR HA 1 92 VAL H . . 5.500 5.056 4.511 5.555 0.055 15 0 "[ . 1 . ]" 1
452 1 76 VAL H 1 76 VAL HA . . 2.900 2.761 2.725 2.825 . 0 0 "[ . 1 . ]" 1
453 1 49 VAL HB 1 92 VAL H . . 5.500 4.901 4.412 5.504 0.004 9 0 "[ . 1 . ]" 1
454 1 99 ASN H 1 100 ALA HA . . 5.500 4.633 3.738 5.536 0.036 6 0 "[ . 1 . ]" 1
455 1 76 VAL H 1 76 VAL HB . . 3.300 2.421 2.347 2.551 . 0 0 "[ . 1 . ]" 1
456 1 92 VAL H 1 93 LYS HA . . 5.500 4.602 4.029 4.960 . 0 0 "[ . 1 . ]" 1
457 1 92 VAL H 1 93 LYS H . . 5.000 4.055 1.773 4.488 . 0 0 "[ . 1 . ]" 1
458 1 19 ARG H 1 20 THR H . . 3.300 2.765 2.569 2.901 . 0 0 "[ . 1 . ]" 1
459 1 76 VAL H 1 76 VAL MG2 . . 2.900 2.122 1.915 2.315 . 0 0 "[ . 1 . ]" 1
460 1 49 VAL HA 1 92 VAL H . . 5.500 5.091 4.837 5.557 0.057 9 0 "[ . 1 . ]" 1
461 1 91 PHE HB3 1 92 VAL H . . 5.000 4.261 3.856 4.469 . 0 0 "[ . 1 . ]" 1
462 1 91 PHE HA 1 92 VAL H . . 3.300 2.291 2.194 2.525 . 0 0 "[ . 1 . ]" 1
463 1 50 TYR HA 1 92 VAL H . . 5.000 3.376 2.608 4.068 . 0 0 "[ . 1 . ]" 1
464 1 51 LEU HG 1 92 VAL H . . 5.000 3.870 2.545 5.051 0.051 6 0 "[ . 1 . ]" 1
465 1 91 PHE HD1 1 92 VAL H . . 3.300 3.044 1.924 3.343 0.043 6 0 "[ . 1 . ]" 1
466 1 51 LEU MD1 1 92 VAL H . . 5.500 4.118 3.155 4.536 . 0 0 "[ . 1 . ]" 1
467 1 48 THR MG 1 92 VAL H . . 5.500 4.298 3.644 4.449 . 0 0 "[ . 1 . ]" 1
468 1 41 SER QB 1 46 HIS H . . 5.000 3.615 1.833 5.314 0.314 7 0 "[ . 1 . ]" 1
469 1 18 ASN HB3 1 19 ARG H . . 3.300 2.592 2.050 3.417 0.117 3 0 "[ . 1 . ]" 1
470 1 19 ARG H 1 19 ARG HD2 . . 5.000 4.877 2.640 5.592 0.592 12 1 "[ . 1 + . ]" 1
471 1 46 HIS H 1 47 VAL H . . 5.000 4.087 3.528 4.445 . 0 0 "[ . 1 . ]" 1
472 1 45 LEU HB3 1 46 HIS H . . 5.000 3.386 2.572 4.081 . 0 0 "[ . 1 . ]" 1
473 1 44 LEU HA 1 46 HIS H . . 5.000 3.770 2.853 4.610 . 0 0 "[ . 1 . ]" 1
474 1 45 LEU H 1 46 HIS H . . 5.000 2.548 1.940 2.990 . 0 0 "[ . 1 . ]" 1
475 1 46 HIS H 1 46 HIS HD2 . . 5.000 3.454 2.914 4.219 . 0 0 "[ . 1 . ]" 1
476 1 53 CYS HA 1 54 TYR H . . 3.300 3.116 2.401 3.534 0.234 15 0 "[ . 1 . ]" 1
477 1 40 LEU HA 1 46 HIS H . . 5.500 4.969 4.354 5.601 0.101 12 0 "[ . 1 . ]" 1
478 1 41 SER HA 1 46 HIS H . . 5.500 5.040 4.460 5.365 . 0 0 "[ . 1 . ]" 1
479 1 45 LEU HA 1 46 HIS H . . 5.000 3.570 3.420 3.640 . 0 0 "[ . 1 . ]" 1
480 1 54 TYR H 1 54 TYR HB2 . . 3.300 2.373 1.854 3.936 0.636 14 1 "[ . 1 +. ]" 1
481 1 53 CYS QB 1 54 TYR H . . 5.000 2.215 1.760 3.952 . 0 0 "[ . 1 . ]" 1
482 1 83 LEU MD1 1 85 LYS H . . 5.000 4.030 2.309 4.370 . 0 0 "[ . 1 . ]" 1
483 1 83 LEU MD2 1 85 LYS H . . 3.300 1.986 1.714 2.358 . 0 0 "[ . 1 . ]" 1
484 1 36 THR H 1 52 ASP QB . . 5.500 4.413 3.054 5.603 0.103 14 0 "[ . 1 . ]" 1
485 1 36 THR H 1 51 LEU HA . . 5.500 5.057 3.677 5.671 0.171 11 0 "[ . 1 . ]" 1
486 1 35 VAL HA 1 36 THR H . . 5.000 3.080 2.198 3.641 . 0 0 "[ . 1 . ]" 1
487 1 36 THR H 1 37 HIS H . . 3.300 2.506 1.875 3.350 0.050 6 0 "[ . 1 . ]" 1
488 1 35 VAL MG1 1 36 THR H . . 5.000 2.778 1.855 3.748 . 0 0 "[ . 1 . ]" 1
489 1 36 THR H 1 36 THR MG . . 3.300 2.817 1.949 3.765 0.465 8 0 "[ . 1 . ]" 1
490 1 101 MET H 1 101 MET HA . . 2.900 2.659 2.212 2.822 . 0 0 "[ . 1 . ]" 1
491 1 83 LEU HA 1 85 LYS H . . 5.500 4.864 3.965 5.444 . 0 0 "[ . 1 . ]" 1
492 1 100 ALA MB 1 101 MET H . . 3.300 2.308 1.876 2.673 . 0 0 "[ . 1 . ]" 1
493 1 100 ALA HA 1 101 MET H . . 5.000 3.000 2.415 3.641 . 0 0 "[ . 1 . ]" 1
494 1 85 LYS H 1 85 LYS QD . . 3.300 3.265 1.936 3.837 0.537 5 1 "[ + 1 . ]" 1
495 1 85 LYS H 1 85 LYS HA . . 2.900 2.763 2.256 2.883 . 0 0 "[ . 1 . ]" 1
496 1 84 ALA MB 1 85 LYS H . . 3.300 2.353 1.822 3.098 . 0 0 "[ . 1 . ]" 1
497 1 24 GLU HG2 1 25 ILE H . . 5.000 4.379 2.578 5.870 0.870 11 2 "[ .- 1+ . ]" 1
498 1 25 ILE H 1 25 ILE MD . . 5.000 3.363 2.393 4.176 . 0 0 "[ . 1 . ]" 1
499 1 21 VAL HA 1 25 ILE H . . 5.000 3.685 1.791 4.508 . 0 0 "[ . 1 . ]" 1
500 1 24 GLU H 1 25 ILE H . . 5.000 3.332 1.797 4.462 . 0 0 "[ . 1 . ]" 1
501 1 25 ILE H 1 26 TYR H . . 5.000 3.007 2.153 3.715 . 0 0 "[ . 1 . ]" 1
502 1 25 ILE H 1 25 ILE HG12 . . 3.300 2.618 1.976 3.242 . 0 0 "[ . 1 . ]" 1
503 1 24 GLU HA 1 25 ILE H . . 5.000 3.052 2.662 3.646 . 0 0 "[ . 1 . ]" 1
504 1 15 ARG HG3 1 18 ASN H . . 5.000 5.024 4.999 5.052 0.052 7 0 "[ . 1 . ]" 1
505 1 15 ARG HA 1 18 ASN H . . 3.300 3.322 3.234 3.408 0.108 8 0 "[ . 1 . ]" 1
506 1 17 ILE MG 1 18 ASN H . . 5.000 3.122 2.727 3.432 . 0 0 "[ . 1 . ]" 1
507 1 17 ILE HB 1 18 ASN H . . 3.300 3.156 2.991 3.316 0.016 8 0 "[ . 1 . ]" 1
508 1 17 ILE HG13 1 18 ASN H . . 5.500 5.434 5.257 5.567 0.067 8 0 "[ . 1 . ]" 1
509 1 17 ILE H 1 18 ASN H . . 5.000 2.737 2.663 2.840 . 0 0 "[ . 1 . ]" 1
510 1 25 ILE H 1 25 ILE HA . . 2.900 2.558 2.206 2.935 0.035 9 0 "[ . 1 . ]" 1
511 1 18 ASN H 1 20 THR H . . 5.000 3.900 3.662 4.202 . 0 0 "[ . 1 . ]" 1
512 1 14 ILE HA 1 18 ASN H . . 5.000 4.547 4.343 4.652 . 0 0 "[ . 1 . ]" 1
513 1 18 ASN H 1 18 ASN HB3 . . 3.300 2.950 2.315 3.548 0.248 3 0 "[ . 1 . ]" 1
514 1 18 ASN H 1 18 ASN HA . . 2.900 2.772 2.705 2.812 . 0 0 "[ . 1 . ]" 1
515 1 15 ARG HG2 1 18 ASN H . . 5.000 5.023 4.967 5.057 0.057 7 0 "[ . 1 . ]" 1
516 1 17 ILE HA 1 18 ASN H . . 5.000 3.551 3.492 3.599 . 0 0 "[ . 1 . ]" 1
517 1 6 LYS HA 1 7 GLU H . . 2.900 2.655 2.237 3.591 0.691 7 1 "[ . + 1 . ]" 1
518 1 10 GLU H 1 12 ASP HB2 . . 5.500 4.764 4.529 5.350 . 0 0 "[ . 1 . ]" 1
519 1 7 GLU HA 1 10 GLU H . . 5.500 4.884 3.585 5.595 0.095 15 0 "[ . 1 . ]" 1
520 1 8 ARG HA 1 10 GLU H . . 5.000 4.684 4.234 5.161 0.161 10 0 "[ . 1 . ]" 1
521 1 9 LEU QB 1 10 GLU H . . 5.000 3.338 2.444 3.668 . 0 0 "[ . 1 . ]" 1
522 1 7 GLU H 1 7 GLU QG . . 3.300 3.605 2.720 3.931 0.631 4 2 "[ +. - 1 . ]" 1
523 1 7 GLU H 1 7 GLU HA . . 2.900 2.691 2.223 2.808 . 0 0 "[ . 1 . ]" 1
524 1 7 GLU H 1 7 GLU QB . . 3.300 2.870 2.174 3.160 . 0 0 "[ . 1 . ]" 1
525 1 10 GLU H 1 10 GLU HB3 . . 3.300 3.123 2.777 3.457 0.157 2 0 "[ . 1 . ]" 1
526 1 10 GLU H 1 11 ASN H . . 3.300 3.133 2.799 3.299 . 0 0 "[ . 1 . ]" 1
527 1 10 GLU H 1 10 GLU HB2 . . 2.900 2.087 2.026 2.230 . 0 0 "[ . 1 . ]" 1
528 1 10 GLU H 1 13 ILE MD . . 5.000 3.304 3.145 3.516 . 0 0 "[ . 1 . ]" 1
529 1 10 GLU H 1 10 GLU QG . . 5.000 3.617 3.111 3.934 . 0 0 "[ . 1 . ]" 1
530 1 20 THR H 1 20 THR HB . . 3.300 2.010 1.977 2.088 . 0 0 "[ . 1 . ]" 1
531 1 16 LEU HA 1 20 THR H . . 5.000 4.675 4.513 4.776 . 0 0 "[ . 1 . ]" 1
532 1 20 THR H 1 21 VAL MG2 . . 5.000 3.967 3.795 4.080 . 0 0 "[ . 1 . ]" 1
533 1 17 ILE MD 1 20 THR H . . 5.500 4.421 4.331 4.544 . 0 0 "[ . 1 . ]" 1
534 1 19 ARG HB3 1 20 THR H . . 5.000 3.213 2.837 3.660 . 0 0 "[ . 1 . ]" 1
535 1 19 ARG HB2 1 20 THR H . . 5.000 3.473 2.897 4.053 . 0 0 "[ . 1 . ]" 1
536 1 20 THR H 1 21 VAL HB . . 5.000 4.675 4.500 4.968 . 0 0 "[ . 1 . ]" 1
537 1 20 THR H 1 20 THR HA . . 2.900 2.866 2.844 2.879 . 0 0 "[ . 1 . ]" 1
538 1 15 ARG H 1 15 ARG HB3 . . 2.900 2.371 2.242 2.487 . 0 0 "[ . 1 . ]" 1
539 1 97 ILE H 1 97 ILE HA . . 2.900 2.584 2.207 2.890 . 0 0 "[ . 1 . ]" 1
540 1 97 ILE H 1 97 ILE HG13 . . 5.000 3.330 2.360 4.836 . 0 0 "[ . 1 . ]" 1
541 1 96 ALA MB 1 97 ILE H . . 5.000 3.073 1.923 3.792 . 0 0 "[ . 1 . ]" 1
542 1 97 ILE H 1 99 ASN H . . 5.000 4.202 2.396 5.124 0.124 2 0 "[ . 1 . ]" 1
543 1 95 LYS HA 1 97 ILE H . . 5.500 4.427 3.176 5.508 0.008 5 0 "[ . 1 . ]" 1
544 1 97 ILE H 1 97 ILE HG12 . . 5.500 3.959 2.050 5.321 . 0 0 "[ . 1 . ]" 1
545 1 94 ASP QB 1 97 ILE H . . 5.500 3.885 2.042 5.029 . 0 0 "[ . 1 . ]" 1
546 1 97 ILE H 1 98 ASP HA . . 5.500 4.556 3.702 5.308 . 0 0 "[ . 1 . ]" 1
547 1 14 ILE MD 1 15 ARG H . . 5.000 4.094 4.019 4.163 . 0 0 "[ . 1 . ]" 1
548 1 78 ALA HA 1 81 LEU H . . 5.000 3.691 2.988 4.142 . 0 0 "[ . 1 . ]" 1
549 1 14 ILE MG 1 15 ARG H . . 5.000 2.800 2.426 3.097 . 0 0 "[ . 1 . ]" 1
550 1 14 ILE HA 1 15 ARG H . . 5.000 3.620 3.593 3.638 . 0 0 "[ . 1 . ]" 1
551 1 81 LEU H 1 81 LEU QB . . 3.300 2.232 2.013 2.554 . 0 0 "[ . 1 . ]" 1
552 1 81 LEU H 1 81 LEU QD . . 3.300 2.839 2.088 3.576 0.276 14 0 "[ . 1 . ]" 1
553 1 77 LEU HA 1 81 LEU H . . 5.000 4.245 3.420 4.638 . 0 0 "[ . 1 . ]" 1
554 1 15 ARG H 1 15 ARG HB2 . . 3.300 2.600 2.466 2.759 . 0 0 "[ . 1 . ]" 1
555 1 80 ASN H 1 81 LEU H . . 3.300 2.657 2.413 2.915 . 0 0 "[ . 1 . ]" 1
556 1 80 ASN QB 1 81 LEU H . . 2.900 2.019 1.887 2.421 . 0 0 "[ . 1 . ]" 1
557 1 12 ASP HA 1 15 ARG H . . 5.000 3.579 3.196 3.921 . 0 0 "[ . 1 . ]" 1
558 1 12 ASP HB2 1 15 ARG H . . 5.500 5.744 5.409 5.982 0.482 16 0 "[ . 1 . ]" 1
559 1 29 THR H 1 65 ALA MB . . 5.000 3.899 3.132 4.274 . 0 0 "[ . 1 . ]" 1
560 1 29 THR H 1 30 VAL HA . . 5.500 4.868 4.396 5.744 0.244 13 0 "[ . 1 . ]" 1
561 1 29 THR H 1 31 LYS H . . 3.300 2.886 2.274 3.510 0.210 13 0 "[ . 1 . ]" 1
562 1 29 THR H 1 30 VAL MG1 . . 5.000 3.705 3.085 4.115 . 0 0 "[ . 1 . ]" 1
563 1 28 GLU HG2 1 29 THR H . . 5.000 4.318 2.638 4.995 . 0 0 "[ . 1 . ]" 1
564 1 28 GLU HB2 1 29 THR H . . 5.000 4.007 2.196 4.702 . 0 0 "[ . 1 . ]" 1
565 1 25 ILE HB 1 29 THR H . . 5.000 4.253 3.380 5.126 0.126 7 0 "[ . 1 . ]" 1
566 1 29 THR H 1 29 THR HA . . 2.900 2.877 2.785 2.908 0.008 5 0 "[ . 1 . ]" 1
567 1 21 VAL MG1 1 29 THR H . . 5.500 4.118 3.610 4.659 . 0 0 "[ . 1 . ]" 1
568 1 29 THR H 1 29 THR HB . . 2.900 2.591 2.058 3.104 0.204 9 0 "[ . 1 . ]" 1
569 1 25 ILE MG 1 29 THR H . . 5.000 2.733 1.898 3.250 . 0 0 "[ . 1 . ]" 1
570 1 28 GLU H 1 29 THR H . . 5.000 3.529 2.557 4.515 . 0 0 "[ . 1 . ]" 1
571 1 28 GLU HA 1 29 THR H . . 5.000 2.834 2.207 3.639 . 0 0 "[ . 1 . ]" 1
572 1 37 HIS QB 1 38 VAL H . . 5.000 2.548 1.789 4.091 . 0 0 "[ . 1 . ]" 1
573 1 37 HIS HA 1 38 VAL H . . 5.000 3.325 2.307 3.642 . 0 0 "[ . 1 . ]" 1
574 1 38 VAL H 1 38 VAL HB . . 3.300 2.915 2.064 3.174 . 0 0 "[ . 1 . ]" 1
575 1 38 VAL H 1 38 VAL HA . . 2.900 2.371 2.208 2.851 . 0 0 "[ . 1 . ]" 1
576 1 82 TYR H 1 86 ALA MB . . 5.500 3.760 2.200 4.863 . 0 0 "[ . 1 . ]" 1
577 1 37 HIS H 1 38 VAL HB . . 5.500 3.580 3.134 4.513 . 0 0 "[ . 1 . ]" 1
578 1 35 VAL HA 1 37 HIS H . . 5.000 3.870 3.485 4.238 . 0 0 "[ . 1 . ]" 1
579 1 36 THR HA 1 37 HIS H . . 5.000 3.223 2.736 3.593 . 0 0 "[ . 1 . ]" 1
580 1 37 HIS H 1 50 TYR HB2 . . 5.000 3.719 2.713 4.578 . 0 0 "[ . 1 . ]" 1
581 1 35 VAL MG1 1 37 HIS H . . 3.300 2.015 1.673 2.662 . 0 0 "[ . 1 . ]" 1
582 1 81 LEU QD 1 82 TYR H . . 5.000 3.203 2.259 3.836 . 0 0 "[ . 1 . ]" 1
583 1 35 VAL HB 1 37 HIS H . . 5.000 3.279 2.390 4.312 . 0 0 "[ . 1 . ]" 1
584 1 37 HIS H 1 38 VAL HA . . 5.000 4.329 3.870 4.812 . 0 0 "[ . 1 . ]" 1
585 1 36 THR HB 1 37 HIS H . . 5.000 4.431 3.734 4.700 . 0 0 "[ . 1 . ]" 1
586 1 37 HIS H 1 37 HIS HA . . 2.900 2.823 2.288 2.900 . 0 0 "[ . 1 . ]" 1
587 1 37 HIS H 1 49 VAL HA . . 5.500 5.211 4.827 5.620 0.120 8 0 "[ . 1 . ]" 1
588 1 36 THR MG 1 37 HIS H . . 5.000 3.582 1.889 4.218 . 0 0 "[ . 1 . ]" 1
589 1 37 HIS H 1 50 TYR HD1 . . 5.000 5.021 4.469 5.161 0.161 5 0 "[ . 1 . ]" 1
590 1 34 HIS H 1 35 VAL MG2 . . 5.500 3.886 3.219 4.584 . 0 0 "[ . 1 . ]" 1
591 1 34 HIS H 1 53 CYS QB . . 5.500 5.241 3.475 5.858 0.358 16 0 "[ . 1 . ]" 1
592 1 34 HIS H 1 51 LEU MD2 . . 5.000 3.355 2.331 4.027 . 0 0 "[ . 1 . ]" 1
593 1 34 HIS H 1 35 VAL HA . . 5.500 4.530 3.788 5.015 . 0 0 "[ . 1 . ]" 1
594 1 34 HIS H 1 66 PHE QE . . 5.500 4.653 3.341 5.603 0.103 13 0 "[ . 1 . ]" 1
595 1 33 GLY HA3 1 34 HIS H . . 2.900 2.631 2.224 3.423 0.523 13 1 "[ . 1 + . ]" 1
596 1 34 HIS H 1 52 ASP QB . . 5.500 5.225 3.738 5.841 0.341 11 0 "[ . 1 . ]" 1
597 1 34 HIS H 1 53 CYS HA . . 5.000 4.212 2.144 5.192 0.192 3 0 "[ . 1 . ]" 1
598 1 37 HIS H 1 50 TYR H . . 5.000 4.177 3.449 5.030 0.030 8 0 "[ . 1 . ]" 1
599 1 34 HIS H 1 51 LEU HB3 . . 5.500 4.707 2.942 6.013 0.513 1 1 "[+ . 1 . ]" 1
600 1 33 GLY H 1 34 HIS H . . 5.000 3.949 3.313 4.671 . 0 0 "[ . 1 . ]" 1
601 1 33 GLY HA2 1 34 HIS H . . 5.000 3.082 2.214 3.624 . 0 0 "[ . 1 . ]" 1
602 1 58 GLN H 1 61 ARG H . . 5.500 5.116 4.884 5.259 . 0 0 "[ . 1 . ]" 1
603 1 55 ASN H 1 59 ILE MD . . 5.500 4.414 3.542 4.757 . 0 0 "[ . 1 . ]" 1
604 1 53 CYS QB 1 58 GLN H . . 5.000 3.634 2.445 4.500 . 0 0 "[ . 1 . ]" 1
605 1 55 ASN H 1 56 ARG QB . . 5.000 4.820 4.349 5.314 0.314 3 0 "[ . 1 . ]" 1
606 1 53 CYS HA 1 55 ASN H . . 5.500 5.075 4.118 5.573 0.073 10 0 "[ . 1 . ]" 1
607 1 10 GLU QG 1 11 ASN H . . 5.000 4.054 3.512 4.416 . 0 0 "[ . 1 . ]" 1
608 1 55 ASN H 1 57 GLU QG . . 5.500 4.498 2.765 5.925 0.425 16 0 "[ . 1 . ]" 1
609 1 54 TYR HB2 1 55 ASN H . . 5.000 3.727 2.414 4.626 . 0 0 "[ . 1 . ]" 1
610 1 54 TYR HA 1 55 ASN H . . 5.000 3.055 2.428 3.642 . 0 0 "[ . 1 . ]" 1
611 1 21 VAL HA 1 24 GLU H . . 3.300 3.218 2.683 3.641 0.341 3 0 "[ . 1 . ]" 1
612 1 58 GLN H 1 59 ILE MD . . 5.500 4.027 3.573 4.435 . 0 0 "[ . 1 . ]" 1
613 1 55 ASN H 1 55 ASN HA . . 2.900 2.522 2.172 2.910 0.010 6 0 "[ . 1 . ]" 1
614 1 54 TYR H 1 55 ASN H . . 3.300 3.072 2.225 3.416 0.116 10 0 "[ . 1 . ]" 1
615 1 22 ILE HA 1 24 GLU H . . 5.000 4.343 3.519 4.936 . 0 0 "[ . 1 . ]" 1
616 1 22 ILE HB 1 24 GLU H . . 5.500 4.647 3.575 5.455 . 0 0 "[ . 1 . ]" 1
617 1 23 HIS QB 1 24 GLU H . . 5.000 3.797 3.206 4.001 . 0 0 "[ . 1 . ]" 1
618 1 58 GLN H 1 59 ILE MG . . 5.500 4.440 3.858 4.615 . 0 0 "[ . 1 . ]" 1
619 1 55 ASN H 1 55 ASN QB . . 3.300 2.978 2.465 3.214 . 0 0 "[ . 1 . ]" 1
620 1 11 ASN H 1 13 ILE MD . . 5.500 4.445 4.349 4.596 . 0 0 "[ . 1 . ]" 1
621 1 10 GLU HB3 1 11 ASN H . . 5.000 2.337 1.981 2.832 . 0 0 "[ . 1 . ]" 1
622 1 20 THR HA 1 24 GLU H . . 5.500 4.684 3.810 5.250 . 0 0 "[ . 1 . ]" 1
623 1 24 GLU H 1 25 ILE HG12 . . 5.000 3.728 3.031 4.265 . 0 0 "[ . 1 . ]" 1
624 1 20 THR MG 1 24 GLU H . . 5.500 4.309 4.079 4.509 . 0 0 "[ . 1 . ]" 1
625 1 11 ASN H 1 12 ASP HB2 . . 5.500 4.564 4.370 4.705 . 0 0 "[ . 1 . ]" 1
626 1 9 LEU HG 1 11 ASN H . . 5.500 5.204 4.912 5.486 . 0 0 "[ . 1 . ]" 1
627 1 24 GLU H 1 24 GLU HA . . 2.900 2.893 2.860 2.918 0.018 1 0 "[ . 1 . ]" 1
628 1 23 HIS HA 1 24 GLU H . . 3.300 3.040 2.757 3.452 0.152 14 0 "[ . 1 . ]" 1
629 1 21 VAL MG1 1 24 GLU H . . 5.500 4.275 3.831 4.501 . 0 0 "[ . 1 . ]" 1
630 1 11 ASN H 1 11 ASN HA . . 2.900 2.711 2.664 2.775 . 0 0 "[ . 1 . ]" 1
631 1 10 GLU HA 1 11 ASN H . . 5.000 3.639 3.589 3.646 . 0 0 "[ . 1 . ]" 1
632 1 11 ASN H 1 14 ILE MD . . 5.500 4.155 3.731 4.444 . 0 0 "[ . 1 . ]" 1
633 1 22 ILE H 1 24 GLU H . . 5.000 3.868 3.377 4.288 . 0 0 "[ . 1 . ]" 1
634 1 23 HIS H 1 24 GLU H . . 3.300 2.388 1.882 3.196 . 0 0 "[ . 1 . ]" 1
635 1 22 ILE MG 1 24 GLU H . . 5.500 4.425 3.802 4.833 . 0 0 "[ . 1 . ]" 1
636 1 24 GLU H 1 24 GLU HG2 . . 5.000 4.434 2.352 5.142 0.142 13 0 "[ . 1 . ]" 1
637 1 11 ASN H 1 11 ASN HB3 . . 2.900 2.822 2.380 3.529 0.629 2 2 "[ + . 1 - . ]" 1
638 1 10 GLU HB2 1 11 ASN H . . 5.000 3.186 2.638 3.794 . 0 0 "[ . 1 . ]" 1
639 1 8 ARG HA 1 11 ASN H . . 5.000 4.581 3.843 5.106 0.106 8 0 "[ . 1 . ]" 1
640 1 58 GLN H 1 60 ASP H . . 5.500 4.356 3.643 4.657 . 0 0 "[ . 1 . ]" 1
641 1 56 ARG H 1 58 GLN H . . 5.000 3.335 2.448 4.198 . 0 0 "[ . 1 . ]" 1
642 1 58 GLN H 1 58 GLN HA . . 2.900 2.913 2.891 2.919 0.019 1 0 "[ . 1 . ]" 1
643 1 56 ARG HA 1 58 GLN H . . 5.000 3.388 3.084 3.599 . 0 0 "[ . 1 . ]" 1
644 1 7 GLU HA 1 11 ASN H . . 5.000 3.813 3.019 4.821 . 0 0 "[ . 1 . ]" 1
645 1 55 ASN QB 1 58 GLN H . . 5.000 4.796 3.480 5.384 0.384 5 0 "[ . 1 . ]" 1
646 1 57 GLU HA 1 58 GLN H . . 5.000 3.400 3.118 3.511 . 0 0 "[ . 1 . ]" 1
647 1 58 GLN H 1 58 GLN HB2 . . 3.300 2.681 2.343 3.369 0.069 16 0 "[ . 1 . ]" 1
648 1 58 GLN H 1 58 GLN HG3 . . 5.000 4.327 3.377 4.576 . 0 0 "[ . 1 . ]" 1
649 1 58 GLN H 1 58 GLN HB3 . . 3.300 3.113 2.707 3.675 0.375 5 0 "[ . 1 . ]" 1
650 1 56 ARG QB 1 58 GLN H . . 5.500 4.636 4.316 4.983 . 0 0 "[ . 1 . ]" 1
651 1 73 PHE H 1 73 PHE HB3 . . 3.300 3.469 3.460 3.487 0.187 9 0 "[ . 1 . ]" 1
652 1 69 ALA HA 1 73 PHE H . . 5.000 4.474 3.893 4.840 . 0 0 "[ . 1 . ]" 1
653 1 73 PHE H 1 89 ILE MD . . 5.500 4.491 4.305 4.573 . 0 0 "[ . 1 . ]" 1
654 1 72 VAL MG2 1 73 PHE H . . 3.300 1.856 1.716 1.960 . 0 0 "[ . 1 . ]" 1
655 1 72 VAL HB 1 73 PHE H . . 5.000 3.555 3.068 3.805 . 0 0 "[ . 1 . ]" 1
656 1 71 GLY H 1 73 PHE H . . 5.000 4.096 3.833 4.942 . 0 0 "[ . 1 . ]" 1
657 1 17 ILE MD 1 73 PHE H . . 5.000 3.718 3.546 3.925 . 0 0 "[ . 1 . ]" 1
658 1 71 GLY HA2 1 73 PHE H . . 5.000 4.742 4.375 5.183 0.183 13 0 "[ . 1 . ]" 1
659 1 25 ILE MD 1 73 PHE H . . 5.000 4.056 3.825 4.195 . 0 0 "[ . 1 . ]" 1
660 1 72 VAL MG1 1 73 PHE H . . 5.000 4.027 3.877 4.147 . 0 0 "[ . 1 . ]" 1
661 1 73 PHE H 1 73 PHE QE . . 5.000 4.172 3.869 4.318 . 0 0 "[ . 1 . ]" 1
662 1 70 LYS HA 1 73 PHE H . . 5.000 3.465 2.943 3.953 . 0 0 "[ . 1 . ]" 1
663 1 69 ALA MB 1 73 PHE H . . 5.000 3.689 2.926 4.027 . 0 0 "[ . 1 . ]" 1
664 1 72 VAL HA 1 73 PHE H . . 5.000 3.610 3.586 3.641 . 0 0 "[ . 1 . ]" 1
665 1 43 ASP H 1 44 LEU H . . 3.300 2.675 2.068 3.349 0.049 12 0 "[ . 1 . ]" 1
666 1 43 ASP H 1 44 LEU HG . . 5.000 4.673 4.285 5.025 0.025 12 0 "[ . 1 . ]" 1
667 1 43 ASP H 1 45 LEU H . . 5.000 3.462 1.969 4.866 . 0 0 "[ . 1 . ]" 1
668 1 43 ASP H 1 44 LEU QD . . 5.500 4.700 4.202 5.137 . 0 0 "[ . 1 . ]" 1
669 1 42 ASP H 1 43 ASP H . . 5.000 3.303 2.342 4.189 . 0 0 "[ . 1 . ]" 1
670 1 43 ASP H 1 44 LEU HA . . 5.000 4.535 3.799 5.171 0.171 10 0 "[ . 1 . ]" 1
671 1 42 ASP HA 1 43 ASP H . . 5.000 3.228 2.258 3.653 . 0 0 "[ . 1 . ]" 1
672 1 43 ASP H 1 43 ASP HB2 . . 3.300 3.226 2.832 3.969 0.669 3 1 "[ + . 1 . ]" 1
673 1 43 ASP H 1 43 ASP HA . . 2.900 2.463 2.168 2.814 . 0 0 "[ . 1 . ]" 1
674 1 41 SER HA 1 43 ASP H . . 5.500 4.197 2.933 5.687 0.187 14 0 "[ . 1 . ]" 1
675 1 53 CYS H 1 54 TYR H . . 5.000 4.314 3.638 4.646 . 0 0 "[ . 1 . ]" 1
676 1 53 CYS H 1 53 CYS QB . . 3.300 2.659 2.229 3.052 . 0 0 "[ . 1 . ]" 1
677 1 52 ASP HA 1 53 CYS H . . 3.300 3.022 2.308 3.492 0.192 5 0 "[ . 1 . ]" 1
678 1 33 GLY HA2 1 53 CYS H . . 3.300 2.906 1.961 3.863 0.563 4 1 "[ +. 1 . ]" 1
679 1 53 CYS H 1 62 VAL QG . . 5.500 3.708 3.358 3.981 . 0 0 "[ . 1 . ]" 1
680 1 52 ASP H 1 53 CYS H . . 5.000 2.494 1.725 3.484 . 0 0 "[ . 1 . ]" 1
681 1 41 SER QB 1 43 ASP H . . 5.500 4.692 4.293 5.877 0.377 14 0 "[ . 1 . ]" 1
682 1 53 CYS H 1 59 ILE MD . . 3.300 2.289 1.871 2.871 . 0 0 "[ . 1 . ]" 1
683 1 52 ASP QB 1 53 CYS H . . 5.000 3.633 3.117 4.110 . 0 0 "[ . 1 . ]" 1
684 1 53 CYS H 1 59 ILE HB . . 5.500 5.207 4.383 5.690 0.190 10 0 "[ . 1 . ]" 1
685 1 66 PHE HA 1 67 ASN H . . 5.000 3.524 3.503 3.544 . 0 0 "[ . 1 . ]" 1
686 1 66 PHE HB2 1 67 ASN H . . 5.000 3.131 3.050 3.188 . 0 0 "[ . 1 . ]" 1
687 1 64 GLY HA2 1 67 ASN H . . 5.000 3.705 3.601 3.770 . 0 0 "[ . 1 . ]" 1
688 1 67 ASN H 1 68 GLN QG . . 5.000 4.058 3.366 4.847 . 0 0 "[ . 1 . ]" 1
689 1 30 VAL MG1 1 67 ASN H . . 5.500 4.588 4.464 4.690 . 0 0 "[ . 1 . ]" 1
690 1 65 ALA HA 1 67 ASN H . . 5.000 3.763 3.691 3.866 . 0 0 "[ . 1 . ]" 1
691 1 66 PHE QD 1 67 ASN H . . 5.000 4.688 4.591 4.744 . 0 0 "[ . 1 . ]" 1
692 1 65 ALA H 1 67 ASN H . . 5.000 3.856 3.777 3.946 . 0 0 "[ . 1 . ]" 1
693 1 65 ALA MB 1 67 ASN H . . 5.000 4.285 4.239 4.342 . 0 0 "[ . 1 . ]" 1
694 1 66 PHE H 1 67 ASN H . . 3.300 2.736 2.706 2.742 . 0 0 "[ . 1 . ]" 1
695 1 22 ILE H 1 23 HIS QB . . 5.500 5.053 4.164 5.720 0.220 10 0 "[ . 1 . ]" 1
696 1 67 ASN H 1 67 ASN QB . . 3.300 2.103 2.002 2.226 . 0 0 "[ . 1 . ]" 1
697 1 63 VAL MG1 1 67 ASN H . . 5.000 4.394 4.238 4.528 . 0 0 "[ . 1 . ]" 1
698 1 74 SER H 1 76 VAL H . . 5.000 3.855 2.418 4.373 . 0 0 "[ . 1 . ]" 1
699 1 67 ASN H 1 69 ALA H . . 5.000 3.726 3.489 4.090 . 0 0 "[ . 1 . ]" 1
700 1 72 VAL HA 1 74 SER H . . 5.000 4.470 3.456 4.946 . 0 0 "[ . 1 . ]" 1
701 1 70 LYS HA 1 74 SER H . . 5.000 3.782 3.040 4.872 . 0 0 "[ . 1 . ]" 1
702 1 74 SER H 1 89 ILE MD . . 5.000 3.901 3.753 4.047 . 0 0 "[ . 1 . ]" 1
703 1 63 VAL HA 1 67 ASN H . . 5.000 4.464 4.345 4.565 . 0 0 "[ . 1 . ]" 1
704 1 73 PHE HB3 1 74 SER H . . 5.000 3.605 3.184 4.591 . 0 0 "[ . 1 . ]" 1
705 1 74 SER H 1 76 VAL HB . . 5.500 5.050 3.722 5.531 0.031 12 0 "[ . 1 . ]" 1
706 1 74 SER H 1 77 LEU MD1 . . 5.500 3.990 3.543 4.526 . 0 0 "[ . 1 . ]" 1
707 1 22 ILE H 1 22 ILE HA . . 2.900 2.727 2.403 2.870 . 0 0 "[ . 1 . ]" 1
708 1 74 SER H 1 74 SER HA . . 2.900 2.767 2.720 2.822 . 0 0 "[ . 1 . ]" 1
709 1 73 PHE HA 1 74 SER H . . 5.000 3.492 2.855 3.644 . 0 0 "[ . 1 . ]" 1
710 1 73 PHE H 1 74 SER H . . 3.300 2.962 2.755 3.270 . 0 0 "[ . 1 . ]" 1
711 1 74 SER H 1 75 ARG HB3 . . 5.500 5.206 4.218 5.702 0.202 5 0 "[ . 1 . ]" 1
712 1 21 VAL MG1 1 22 ILE H . . 5.000 3.868 3.415 4.123 . 0 0 "[ . 1 . ]" 1
713 1 18 ASN HA 1 22 ILE H . . 5.000 4.399 4.060 4.622 . 0 0 "[ . 1 . ]" 1
714 1 22 ILE H 1 22 ILE HG13 . . 5.000 3.293 2.187 4.106 . 0 0 "[ . 1 . ]" 1
715 1 19 ARG HA 1 22 ILE H . . 5.000 3.695 3.305 4.016 . 0 0 "[ . 1 . ]" 1
716 1 22 ILE H 1 22 ILE HG12 . . 3.300 2.897 1.945 3.745 0.445 7 0 "[ . 1 . ]" 1
717 1 20 THR HA 1 22 ILE H . . 5.000 3.810 3.386 4.422 . 0 0 "[ . 1 . ]" 1
718 1 21 VAL HB 1 22 ILE H . . 5.000 3.104 2.516 3.562 . 0 0 "[ . 1 . ]" 1
719 1 20 THR H 1 22 ILE H . . 5.000 3.714 3.442 4.107 . 0 0 "[ . 1 . ]" 1
720 1 21 VAL HA 1 22 ILE H . . 5.000 3.492 3.345 3.625 . 0 0 "[ . 1 . ]" 1
721 1 44 LEU H 1 45 LEU H . . 3.300 2.419 1.755 3.177 . 0 0 "[ . 1 . ]" 1
722 1 44 LEU QD 1 45 LEU H . . 5.000 3.783 2.289 4.421 . 0 0 "[ . 1 . ]" 1
723 1 43 ASP HB2 1 45 LEU H . . 5.000 4.474 3.362 5.030 0.030 3 0 "[ . 1 . ]" 1
724 1 45 LEU H 1 45 LEU MD2 . . 5.000 3.949 2.831 4.206 . 0 0 "[ . 1 . ]" 1
725 1 42 ASP HA 1 45 LEU H . . 5.500 5.200 4.571 5.688 0.188 15 0 "[ . 1 . ]" 1
726 1 43 ASP HB3 1 45 LEU H . . 5.000 4.061 3.078 5.187 0.187 3 0 "[ . 1 . ]" 1
727 1 45 LEU H 1 46 HIS HB2 . . 5.500 4.881 4.176 5.318 . 0 0 "[ . 1 . ]" 1
728 1 44 LEU HA 1 45 LEU H . . 5.000 3.196 2.606 3.594 . 0 0 "[ . 1 . ]" 1
729 1 45 LEU H 1 45 LEU HB2 . . 3.300 2.234 2.012 2.577 . 0 0 "[ . 1 . ]" 1
730 1 45 LEU H 1 46 HIS HA . . 5.500 5.069 4.542 5.426 . 0 0 "[ . 1 . ]" 1
731 1 45 LEU H 1 46 HIS HD2 . . 5.000 4.717 3.841 5.030 0.030 14 0 "[ . 1 . ]" 1
732 1 44 LEU HB3 1 45 LEU H . . 5.000 4.487 4.001 4.730 . 0 0 "[ . 1 . ]" 1
733 1 22 ILE H 1 23 HIS H . . 5.000 3.188 2.359 4.406 . 0 0 "[ . 1 . ]" 1
734 1 22 ILE MG 1 23 HIS H . . 5.000 2.787 2.119 4.303 . 0 0 "[ . 1 . ]" 1
735 1 23 HIS H 1 23 HIS QB . . 3.300 2.651 2.145 3.133 . 0 0 "[ . 1 . ]" 1
736 1 22 ILE HB 1 23 HIS H . . 5.000 2.959 1.968 4.558 . 0 0 "[ . 1 . ]" 1
737 1 75 ARG HB3 1 79 HIS H . . 5.500 5.228 4.854 5.696 0.196 2 0 "[ . 1 . ]" 1
738 1 23 HIS H 1 24 GLU HB2 . . 5.000 3.839 3.131 5.135 0.135 1 0 "[ . 1 . ]" 1
739 1 42 ASP HA 1 44 LEU H . . 5.500 5.073 4.039 5.590 0.090 6 0 "[ . 1 . ]" 1
740 1 77 LEU HA 1 79 HIS H . . 5.000 4.189 3.787 4.721 . 0 0 "[ . 1 . ]" 1
741 1 41 SER H 1 44 LEU H . . 5.500 4.292 2.874 5.647 0.147 1 0 "[ . 1 . ]" 1
742 1 78 ALA HA 1 79 HIS H . . 5.000 3.613 3.582 3.640 . 0 0 "[ . 1 . ]" 1
743 1 79 HIS H 1 79 HIS HB2 . . 2.900 2.210 2.016 2.828 . 0 0 "[ . 1 . ]" 1
744 1 44 LEU H 1 44 LEU HG . . 2.900 2.723 2.398 2.984 0.084 15 0 "[ . 1 . ]" 1
745 1 79 HIS H 1 80 ASN H . . 3.300 2.826 2.603 2.926 . 0 0 "[ . 1 . ]" 1
746 1 78 ALA MB 1 79 HIS H . . 3.300 2.553 2.289 2.717 . 0 0 "[ . 1 . ]" 1
747 1 79 HIS H 1 79 HIS HA . . 2.900 2.702 2.654 2.832 . 0 0 "[ . 1 . ]" 1
748 1 43 ASP HA 1 44 LEU H . . 5.000 3.087 2.486 3.651 . 0 0 "[ . 1 . ]" 1
749 1 76 VAL HA 1 79 HIS H . . 5.000 3.722 3.445 4.049 . 0 0 "[ . 1 . ]" 1
750 1 43 ASP HB2 1 44 LEU H . . 5.000 4.039 2.833 4.707 . 0 0 "[ . 1 . ]" 1
751 1 44 LEU H 1 44 LEU QD . . 5.000 3.361 2.608 3.572 . 0 0 "[ . 1 . ]" 1
752 1 22 ILE MD 1 23 HIS H . . 5.500 4.179 2.938 4.583 . 0 0 "[ . 1 . ]" 1
753 1 31 LYS H 1 32 THR HA . . 5.500 5.283 5.138 5.423 . 0 0 "[ . 1 . ]" 1
754 1 44 LEU H 1 44 LEU HA . . 2.900 2.491 2.226 2.888 . 0 0 "[ . 1 . ]" 1
755 1 29 THR HB 1 31 LYS H . . 5.000 4.692 4.339 5.154 0.154 8 0 "[ . 1 . ]" 1
756 1 29 THR MG 1 31 LYS H . . 5.000 4.104 4.043 4.199 . 0 0 "[ . 1 . ]" 1
757 1 30 VAL MG2 1 31 LYS H . . 5.000 2.398 2.026 2.727 . 0 0 "[ . 1 . ]" 1
758 1 31 LYS H 1 31 LYS HA . . 2.900 2.752 2.684 2.822 . 0 0 "[ . 1 . ]" 1
759 1 25 ILE MG 1 31 LYS H . . 5.000 3.592 2.974 3.903 . 0 0 "[ . 1 . ]" 1
760 1 31 LYS H 1 32 THR H . . 5.000 2.786 2.657 3.327 . 0 0 "[ . 1 . ]" 1
761 1 30 VAL HA 1 31 LYS H . . 5.000 3.496 3.423 3.545 . 0 0 "[ . 1 . ]" 1
762 1 30 VAL MG1 1 31 LYS H . . 5.000 3.871 3.582 4.002 . 0 0 "[ . 1 . ]" 1
763 1 21 VAL MG1 1 31 LYS H . . 3.300 2.789 2.637 2.895 . 0 0 "[ . 1 . ]" 1
764 1 25 ILE HB 1 31 LYS H . . 5.500 4.651 4.035 5.354 . 0 0 "[ . 1 . ]" 1
765 1 31 LYS H 1 31 LYS HB3 . . 3.300 2.568 2.236 2.842 . 0 0 "[ . 1 . ]" 1
766 1 30 VAL HB 1 31 LYS H . . 5.000 4.247 4.087 4.402 . 0 0 "[ . 1 . ]" 1
767 1 78 ALA HA 1 80 ASN H . . 5.000 3.615 3.460 3.730 . 0 0 "[ . 1 . ]" 1
768 1 80 ASN H 1 80 ASN HA . . 2.900 2.887 2.825 2.917 0.017 15 0 "[ . 1 . ]" 1
769 1 80 ASN H 1 81 LEU QD . . 5.500 4.706 3.772 5.285 . 0 0 "[ . 1 . ]" 1
770 1 79 HIS HA 1 80 ASN H . . 5.000 3.512 3.339 3.551 . 0 0 "[ . 1 . ]" 1
771 1 77 LEU HA 1 80 ASN H . . 5.000 3.498 3.226 3.740 . 0 0 "[ . 1 . ]" 1
772 1 80 ASN H 1 80 ASN QB . . 3.300 2.244 2.030 2.413 . 0 0 "[ . 1 . ]" 1
773 1 80 ASN H 1 81 LEU HA . . 5.000 4.951 4.729 5.036 0.036 2 0 "[ . 1 . ]" 1
774 1 79 HIS HB2 1 80 ASN H . . 5.000 3.859 3.168 4.362 . 0 0 "[ . 1 . ]" 1
775 1 78 ALA H 1 80 ASN H . . 5.000 4.031 3.492 4.288 . 0 0 "[ . 1 . ]" 1
776 1 80 ASN H 1 81 LEU QB . . 5.500 4.551 3.770 4.979 . 0 0 "[ . 1 . ]" 1
777 1 78 ALA MB 1 80 ASN H . . 5.000 4.172 3.946 4.235 . 0 0 "[ . 1 . ]" 1
778 1 77 LEU H 1 80 ASN H . . 5.500 5.283 4.782 5.572 0.072 12 0 "[ . 1 . ]" 1
779 1 30 VAL HB 1 33 GLY H . . 5.500 4.262 3.822 4.774 . 0 0 "[ . 1 . ]" 1
780 1 33 GLY H 1 53 CYS QB . . 5.000 3.967 3.402 4.694 . 0 0 "[ . 1 . ]" 1
781 1 30 VAL MG2 1 33 GLY H . . 5.500 4.509 4.203 4.737 . 0 0 "[ . 1 . ]" 1
782 1 33 GLY H 1 53 CYS HA . . 5.500 3.980 3.489 4.618 . 0 0 "[ . 1 . ]" 1
783 1 33 GLY H 1 33 GLY HA2 . . 2.900 2.709 2.616 2.856 . 0 0 "[ . 1 . ]" 1
784 1 32 THR MG 1 33 GLY H . . 5.000 1.970 1.783 2.233 . 0 0 "[ . 1 . ]" 1
785 1 32 THR HA 1 33 GLY H . . 5.000 3.571 3.515 3.628 . 0 0 "[ . 1 . ]" 1
786 1 32 THR H 1 33 GLY H . . 3.300 2.277 1.728 2.648 . 0 0 "[ . 1 . ]" 1
787 1 31 LYS HA 1 33 GLY H . . 5.000 4.407 4.193 4.845 . 0 0 "[ . 1 . ]" 1
788 1 33 GLY H 1 66 PHE HZ . . 5.500 5.509 5.129 5.675 0.175 14 0 "[ . 1 . ]" 1
789 1 31 LYS H 1 33 GLY H . . 5.500 4.314 4.056 4.688 . 0 0 "[ . 1 . ]" 1
790 1 33 GLY H 1 66 PHE QE . . 5.000 3.926 3.447 4.137 . 0 0 "[ . 1 . ]" 1
791 1 33 GLY H 1 62 VAL QG . . 3.300 2.163 1.873 2.376 . 0 0 "[ . 1 . ]" 1
792 1 30 VAL HA 1 33 GLY H . . 5.000 2.782 2.557 3.042 . 0 0 "[ . 1 . ]" 1
793 1 29 THR MG 1 32 THR H . . 5.500 4.216 3.697 4.569 . 0 0 "[ . 1 . ]" 1
794 1 31 LYS HB2 1 32 THR H . . 5.000 4.234 4.035 4.603 . 0 0 "[ . 1 . ]" 1
795 1 30 VAL HA 1 32 THR H . . 5.000 3.284 3.054 3.654 . 0 0 "[ . 1 . ]" 1
796 1 31 LYS HG2 1 32 THR H . . 5.000 4.755 4.364 5.509 0.509 4 1 "[ +. 1 . ]" 1
797 1 30 VAL MG2 1 32 THR H . . 5.500 4.215 4.007 4.329 . 0 0 "[ . 1 . ]" 1
798 1 30 VAL HB 1 32 THR H . . 5.500 4.943 4.457 5.418 . 0 0 "[ . 1 . ]" 1
799 1 21 VAL MG1 1 32 THR H . . 5.500 4.512 4.321 4.636 . 0 0 "[ . 1 . ]" 1
800 1 32 THR H 1 32 THR HA . . 2.900 2.901 2.860 2.944 0.044 4 0 "[ . 1 . ]" 1
801 1 31 LYS HA 1 32 THR H . . 5.000 3.430 2.830 3.533 . 0 0 "[ . 1 . ]" 1
802 1 32 THR H 1 33 GLY HA2 . . 5.000 4.839 4.304 5.192 0.192 12 0 "[ . 1 . ]" 1
803 1 60 ASP HB3 1 64 GLY H . . 5.500 5.357 5.140 5.889 0.389 7 0 "[ . 1 . ]" 1
804 1 62 VAL HA 1 64 GLY H . . 5.000 4.409 4.244 4.501 . 0 0 "[ . 1 . ]" 1
805 1 63 VAL MG1 1 64 GLY H . . 5.000 3.434 3.164 3.812 . 0 0 "[ . 1 . ]" 1
806 1 63 VAL MG2 1 64 GLY H . . 5.000 3.933 3.679 4.069 . 0 0 "[ . 1 . ]" 1
807 1 60 ASP HA 1 64 GLY H . . 5.000 3.757 3.491 3.941 . 0 0 "[ . 1 . ]" 1
808 1 61 ARG HA 1 64 GLY H . . 5.000 3.702 3.573 3.848 . 0 0 "[ . 1 . ]" 1
809 1 63 VAL HA 1 64 GLY H . . 5.000 3.607 3.583 3.617 . 0 0 "[ . 1 . ]" 1
810 1 63 VAL H 1 64 GLY H . . 3.300 2.850 2.725 2.959 . 0 0 "[ . 1 . ]" 1
811 1 64 GLY H 1 65 ALA MB . . 5.500 4.289 4.163 4.387 . 0 0 "[ . 1 . ]" 1
812 1 63 VAL HB 1 64 GLY H . . 3.300 2.676 2.584 2.824 . 0 0 "[ . 1 . ]" 1
813 1 64 GLY H 1 64 GLY HA2 . . 2.900 2.794 2.766 2.828 . 0 0 "[ . 1 . ]" 1
814 1 29 THR MG 1 64 GLY H . . 5.500 4.656 4.609 4.756 . 0 0 "[ . 1 . ]" 1
815 1 18 ASN HA 1 19 ARG H . . 3.600 3.632 3.597 3.654 0.054 4 0 "[ . 1 . ]" 1
816 1 18 ASN HA 1 20 THR H . . 5.000 3.969 3.707 4.317 . 0 0 "[ . 1 . ]" 1
817 1 17 ILE HA 1 20 THR H . . 5.000 3.390 3.252 3.586 . 0 0 "[ . 1 . ]" 1
818 1 40 LEU HA 1 47 VAL HA . . 3.300 2.819 1.950 3.367 0.067 14 0 "[ . 1 . ]" 1
819 1 29 THR MG 1 62 VAL HB . . 5.500 4.206 3.966 4.554 . 0 0 "[ . 1 . ]" 1
820 1 35 VAL HB 1 35 VAL MG2 . . 2.500 2.118 2.095 2.141 . 0 0 "[ . 1 . ]" 1
821 1 59 ILE HA 1 62 VAL HB . . 3.300 2.185 1.936 2.465 . 0 0 "[ . 1 . ]" 1
822 1 96 ALA HA 1 96 ALA MB . . 2.500 2.125 2.107 2.152 . 0 0 "[ . 1 . ]" 1
823 1 84 ALA HA 1 84 ALA MB . . 2.500 2.129 2.109 2.152 . 0 0 "[ . 1 . ]" 1
824 1 21 VAL HB 1 25 ILE HB . . 5.500 4.914 3.729 5.612 0.112 5 0 "[ . 1 . ]" 1
825 1 59 ILE HB 1 62 VAL HB . . 5.000 4.810 4.498 5.087 0.087 4 0 "[ . 1 . ]" 1
826 1 101 MET HA 1 101 MET HG3 . . 3.300 3.003 2.152 3.841 0.541 9 2 "[ . +1 .-]" 1
827 1 59 ILE MD 1 62 VAL HB . . 5.000 3.379 2.587 3.878 . 0 0 "[ . 1 . ]" 1
828 1 72 VAL HB 1 75 ARG HB3 . . 5.500 4.805 4.005 5.574 0.074 9 0 "[ . 1 . ]" 1
829 1 86 ALA HA 1 86 ALA MB . . 2.500 2.138 2.110 2.152 . 0 0 "[ . 1 . ]" 1
830 1 25 ILE MG 1 30 VAL HB . . 5.000 3.986 3.806 4.112 . 0 0 "[ . 1 . ]" 1
831 1 60 ASP HA 1 63 VAL HB . . 5.000 3.260 3.082 3.407 . 0 0 "[ . 1 . ]" 1
832 1 76 VAL HA 1 79 HIS HB2 . . 5.000 3.681 3.148 4.438 . 0 0 "[ . 1 . ]" 1
833 1 53 CYS QB 1 62 VAL QG . . 3.300 2.001 1.708 2.514 . 0 0 "[ . 1 . ]" 1
834 1 61 ARG HB2 1 62 VAL QG . . 5.000 2.968 2.721 4.430 . 0 0 "[ . 1 . ]" 1
835 1 8 ARG HA 1 8 ARG HB2 . . 2.500 2.851 2.585 3.059 0.559 12 7 "[ - .* *1*+ ** ]" 1
836 1 72 VAL HA 1 75 ARG HB3 . . 3.300 3.103 1.998 3.333 0.033 6 0 "[ . 1 . ]" 1
837 1 83 LEU MD2 1 85 LYS QD . . 5.000 3.536 1.872 4.453 . 0 0 "[ . 1 . ]" 1
838 1 39 LYS HD2 1 39 LYS HE3 . . 2.500 2.560 2.283 3.013 0.513 3 1 "[ + . 1 . ]" 1
839 1 54 TYR HA 1 54 TYR HD1 . . 3.300 2.906 2.363 3.514 0.214 14 0 "[ . 1 . ]" 1
840 1 28 GLU HB2 1 28 GLU HG3 . . 2.500 2.584 2.265 3.046 0.546 10 1 "[ . + . ]" 1
841 1 7 GLU QB 1 7 GLU QG . . 2.500 2.104 2.066 2.135 . 0 0 "[ . 1 . ]" 1
842 1 17 ILE HG12 1 89 ILE MD . . 3.300 2.240 2.093 2.426 . 0 0 "[ . 1 . ]" 1
843 1 17 ILE HG13 1 89 ILE MD . . 3.300 2.155 1.928 2.383 . 0 0 "[ . 1 . ]" 1
844 1 22 ILE HG13 1 22 ILE MG . . 3.300 2.599 2.283 3.240 . 0 0 "[ . 1 . ]" 1
845 1 85 LYS HA 1 85 LYS QD . . 5.000 3.468 2.020 4.165 . 0 0 "[ . 1 . ]" 1
846 1 65 ALA HA 1 68 GLN HB3 . . 5.000 4.923 3.895 5.629 0.629 3 1 "[ + . 1 . ]" 1
847 1 22 ILE MD 1 22 ILE HG13 . . 2.500 2.128 2.120 2.160 . 0 0 "[ . 1 . ]" 1
848 1 21 VAL HA 1 25 ILE HG12 . . 3.300 2.090 1.907 2.774 . 0 0 "[ . 1 . ]" 1
849 1 95 LYS QD 1 95 LYS QG . . 2.500 2.102 2.059 2.134 . 0 0 "[ . 1 . ]" 1
850 1 83 LEU MD2 1 83 LEU HG . . 2.500 2.108 2.084 2.132 . 0 0 "[ . 1 . ]" 1
851 1 47 VAL QG 1 89 ILE HG12 . . 3.300 2.192 1.756 2.655 . 0 0 "[ . 1 . ]" 1
852 1 47 VAL QG 1 89 ILE HG13 . . 3.300 3.032 2.422 3.640 0.340 12 0 "[ . 1 . ]" 1
853 1 9 LEU QB 1 13 ILE HG13 . . 5.000 4.324 3.963 4.855 . 0 0 "[ . 1 . ]" 1
854 1 97 ILE HG12 1 97 ILE MG . . 3.300 2.232 2.047 2.433 . 0 0 "[ . 1 . ]" 1
855 1 25 ILE HA 1 25 ILE HG12 . . 3.300 2.993 2.769 3.252 . 0 0 "[ . 1 . ]" 1
856 1 19 ARG HA 1 19 ARG HG3 . . 3.300 3.214 2.095 3.582 0.282 1 0 "[ . 1 . ]" 1
857 1 67 ASN QB 1 68 GLN HB3 . . 5.500 4.266 3.582 5.240 . 0 0 "[ . 1 . ]" 1
858 1 61 ARG HA 1 61 ARG HG2 . . 3.300 2.924 2.569 3.870 0.570 16 1 "[ . 1 .+]" 1
859 1 89 ILE MD 1 89 ILE HG13 . . 2.500 2.150 2.120 2.163 . 0 0 "[ . 1 . ]" 1
860 1 39 LYS HB3 1 48 THR HB . . 3.300 2.381 1.949 4.153 0.853 13 2 "[ - 1 + . ]" 1
861 1 97 ILE MD 1 97 ILE HG13 . . 2.500 2.141 2.121 2.163 . 0 0 "[ . 1 . ]" 1
862 1 25 ILE MD 1 25 ILE HG12 . . 2.500 2.148 2.121 2.163 . 0 0 "[ . 1 . ]" 1
863 1 51 LEU HB2 1 51 LEU MD1 . . 3.300 2.388 2.184 2.599 . 0 0 "[ . 1 . ]" 1
864 1 51 LEU MD1 1 51 LEU HG . . 2.500 2.109 2.087 2.131 . 0 0 "[ . 1 . ]" 1
865 1 51 LEU MD1 1 63 VAL HA . . 3.300 2.652 2.487 2.878 . 0 0 "[ . 1 . ]" 1
866 1 36 THR HB 1 36 THR MG . . 2.500 2.155 2.137 2.178 . 0 0 "[ . 1 . ]" 1
867 1 21 VAL MG2 1 73 PHE HZ . . 5.000 3.011 2.211 3.724 . 0 0 "[ . 1 . ]" 1
868 1 51 LEU MD1 1 63 VAL MG1 . . 5.500 3.595 3.334 3.850 . 0 0 "[ . 1 . ]" 1
869 1 9 LEU QB 1 13 ILE HG12 . . 5.000 5.153 4.873 5.786 0.786 10 2 "[ -. + . ]" 1
870 1 40 LEU HB3 1 40 LEU MD2 . . 3.300 3.178 2.750 3.221 . 0 0 "[ . 1 . ]" 1
871 1 29 THR HB 1 29 THR MG . . 2.500 2.172 2.161 2.178 . 0 0 "[ . 1 . ]" 1
872 1 51 LEU HB2 1 51 LEU MD2 . . 3.300 3.207 3.173 3.221 . 0 0 "[ . 1 . ]" 1
873 1 83 LEU HB3 1 83 LEU MD1 . . 3.300 2.469 2.045 2.915 . 0 0 "[ . 1 . ]" 1
874 1 40 LEU MD2 1 47 VAL QG . . 3.300 2.064 1.577 2.538 . 0 0 "[ . 1 . ]" 1
875 1 39 LYS HE3 1 40 LEU MD2 . . 5.500 5.111 4.473 5.594 0.094 14 0 "[ . 1 . ]" 1
876 1 29 THR HB 1 65 ALA MB . . 3.300 2.611 1.839 2.898 . 0 0 "[ . 1 . ]" 1
877 1 14 ILE HA 1 14 ILE MG . . 3.300 2.661 2.594 2.707 . 0 0 "[ . 1 . ]" 1
878 1 44 LEU HA 1 44 LEU QD . . 3.300 3.090 2.324 3.449 0.149 3 0 "[ . 1 . ]" 1
879 1 40 LEU HA 1 40 LEU MD2 . . 3.300 2.074 1.787 2.547 . 0 0 "[ . 1 . ]" 1
880 1 95 LYS HB3 1 95 LYS QD . . 3.300 2.805 2.027 3.319 0.019 14 0 "[ . 1 . ]" 1
881 1 14 ILE HA 1 15 ARG HB3 . . 5.500 5.827 5.730 5.890 0.390 16 0 "[ . 1 . ]" 1
882 1 21 VAL HA 1 25 ILE HG13 . . 3.300 2.162 1.922 2.970 . 0 0 "[ . 1 . ]" 1
883 1 40 LEU HB2 1 40 LEU MD1 . . 3.300 3.157 2.671 3.218 . 0 0 "[ . 1 . ]" 1
884 1 21 VAL HA 1 21 VAL MG2 . . 3.300 2.375 2.223 2.454 . 0 0 "[ . 1 . ]" 1
885 1 62 VAL HA 1 62 VAL QG . . 3.300 2.084 2.052 2.134 . 0 0 "[ . 1 . ]" 1
886 1 71 GLY HA2 1 72 VAL MG2 . . 5.000 4.888 4.703 4.993 . 0 0 "[ . 1 . ]" 1
887 1 21 VAL HA 1 21 VAL MG1 . . 3.300 2.389 2.207 2.530 . 0 0 "[ . 1 . ]" 1
888 1 44 LEU QD 1 80 ASN QB . . 5.000 3.699 2.207 4.462 . 0 0 "[ . 1 . ]" 1
889 1 77 LEU MD1 1 87 VAL HA . . 5.500 4.189 3.575 4.636 . 0 0 "[ . 1 . ]" 1
890 1 77 LEU HB2 1 77 LEU MD1 . . 3.300 2.041 1.943 2.183 . 0 0 "[ . 1 . ]" 1
891 1 62 VAL HA 1 65 ALA MB . . 5.000 2.544 2.372 2.792 . 0 0 "[ . 1 . ]" 1
892 1 44 LEU QD 1 77 LEU HA . . 5.500 4.625 3.660 5.294 . 0 0 "[ . 1 . ]" 1
893 1 17 ILE HA 1 17 ILE MG . . 3.300 2.718 2.650 2.795 . 0 0 "[ . 1 . ]" 1
894 1 20 THR HA 1 24 GLU HG2 . . 5.000 4.767 3.232 5.853 0.853 5 2 "[ + 1 - . ]" 1
895 1 77 LEU MD1 1 89 ILE MD . . 5.000 2.131 1.798 2.979 . 0 0 "[ . 1 . ]" 1
896 1 17 ILE HA 1 89 ILE MD . . 5.000 4.128 4.021 4.243 . 0 0 "[ . 1 . ]" 1
897 1 36 THR MG 1 52 ASP QB . . 3.300 1.945 1.604 2.239 . 0 0 "[ . 1 . ]" 1
898 1 13 ILE HA 1 16 LEU QD . . 5.500 2.476 1.970 3.154 . 0 0 "[ . 1 . ]" 1
899 1 76 VAL HA 1 76 VAL MG2 . . 3.300 2.317 2.214 2.394 . 0 0 "[ . 1 . ]" 1
900 1 45 LEU HB2 1 45 LEU MD1 . . 3.300 2.306 2.061 3.145 . 0 0 "[ . 1 . ]" 1
901 1 76 VAL HA 1 76 VAL MG1 . . 3.300 2.411 2.322 2.515 . 0 0 "[ . 1 . ]" 1
902 1 29 THR HA 1 32 THR MG . . 5.000 3.455 2.917 4.009 . 0 0 "[ . 1 . ]" 1
903 1 39 LYS HE3 1 39 LYS HG3 . . 3.300 3.197 2.075 3.768 0.468 1 0 "[ . 1 . ]" 1
904 1 95 LYS HA 1 95 LYS QG . . 3.300 2.304 1.916 3.333 0.033 7 0 "[ . 1 . ]" 1
905 1 72 VAL HA 1 75 ARG HB2 . . 3.300 2.671 2.190 3.460 0.160 9 0 "[ . 1 . ]" 1
906 1 72 VAL HA 1 72 VAL MG1 . . 3.300 2.205 2.065 2.351 . 0 0 "[ . 1 . ]" 1
907 1 77 LEU MD2 1 89 ILE MD . . 5.500 3.271 2.750 3.610 . 0 0 "[ . 1 . ]" 1
908 1 51 LEU MD2 1 51 LEU HG . . 2.500 2.112 2.086 2.131 . 0 0 "[ . 1 . ]" 1
909 1 83 LEU MD2 1 85 LYS QG . . 5.000 3.282 2.181 4.312 . 0 0 "[ . 1 . ]" 1
910 1 29 THR MG 1 62 VAL HA . . 3.300 1.895 1.795 2.103 . 0 0 "[ . 1 . ]" 1
911 1 30 VAL HA 1 33 GLY HA3 . . 5.500 3.761 3.253 4.223 . 0 0 "[ . 1 . ]" 1
912 1 30 VAL HA 1 30 VAL MG1 . . 3.300 2.433 2.338 2.628 . 0 0 "[ . 1 . ]" 1
913 1 35 VAL MG2 1 51 LEU MD2 . . 5.500 2.247 1.771 3.172 . 0 0 "[ . 1 . ]" 1
914 1 21 VAL MG2 1 30 VAL MG2 . . 3.300 1.870 1.727 2.009 . 0 0 "[ . 1 . ]" 1
915 1 80 ASN QB 1 81 LEU QD . . 3.300 2.736 1.895 3.560 0.260 14 0 "[ . 1 . ]" 1
916 1 33 GLY HA3 1 62 VAL QG . . 5.000 2.245 1.810 2.777 . 0 0 "[ . 1 . ]" 1
917 1 39 LYS HE3 1 40 LEU HB2 . . 5.000 4.694 3.645 5.734 0.734 8 2 "[ . + 1 -. ]" 1
918 1 35 VAL HA 1 35 VAL MG1 . . 3.300 2.310 2.101 2.519 . 0 0 "[ . 1 . ]" 1
919 1 35 VAL HA 1 51 LEU MD2 . . 5.000 3.248 1.979 3.999 . 0 0 "[ . 1 . ]" 1
920 1 45 LEU MD2 1 87 VAL HA . . 5.000 2.932 2.189 3.866 . 0 0 "[ . 1 . ]" 1
921 1 29 THR MG 1 65 ALA MB . . 3.300 1.829 1.728 1.932 . 0 0 "[ . 1 . ]" 1
922 1 44 LEU HB2 1 77 LEU MD2 . . 5.000 3.056 2.454 3.507 . 0 0 "[ . 1 . ]" 1
923 1 44 LEU HB3 1 77 LEU MD2 . . 5.000 3.292 1.991 4.276 . 0 0 "[ . 1 . ]" 1
924 1 21 VAL MG2 1 25 ILE MG . . 5.500 3.364 2.594 3.591 . 0 0 "[ . 1 . ]" 1
925 1 17 ILE MG 1 21 VAL MG2 . . 5.000 2.380 1.953 2.826 . 0 0 "[ . 1 . ]" 1
926 1 16 LEU HA 1 16 LEU QD . . 3.300 2.081 1.869 2.815 . 0 0 "[ . 1 . ]" 1
927 1 44 LEU HA 1 77 LEU MD2 . . 5.500 3.848 2.728 4.673 . 0 0 "[ . 1 . ]" 1
928 1 45 LEU HA 1 45 LEU MD2 . . 3.300 2.236 1.949 2.727 . 0 0 "[ . 1 . ]" 1
929 1 17 ILE MD 1 20 THR MG . . 5.500 2.677 2.364 3.003 . 0 0 "[ . 1 . ]" 1
930 1 51 LEU HA 1 51 LEU MD2 . . 3.300 2.057 1.885 2.397 . 0 0 "[ . 1 . ]" 1
931 1 56 ARG QB 1 56 ARG QD . . 3.300 2.066 1.937 2.376 . 0 0 "[ . 1 . ]" 1
932 1 29 THR MG 1 61 ARG HB2 . . 3.300 2.865 2.432 3.273 . 0 0 "[ . 1 . ]" 1
933 1 29 THR MG 1 61 ARG HG2 . . 5.000 4.736 3.158 5.111 0.111 13 0 "[ . 1 . ]" 1
934 1 29 THR MG 1 30 VAL MG1 . . 5.000 2.203 1.926 2.652 . 0 0 "[ . 1 . ]" 1
935 1 45 LEU HB2 1 45 LEU MD2 . . 3.300 3.121 2.035 3.221 . 0 0 "[ . 1 . ]" 1
936 1 59 ILE HA 1 62 VAL QG . . 3.300 2.264 1.955 2.515 . 0 0 "[ . 1 . ]" 1
937 1 12 ASP HB3 1 16 LEU QD . . 5.500 3.526 3.001 4.217 . 0 0 "[ . 1 . ]" 1
938 1 45 LEU MD2 1 86 ALA MB . . 5.000 2.823 1.730 3.742 . 0 0 "[ . 1 . ]" 1
939 1 30 VAL MG1 1 69 ALA MB . . 5.000 2.911 2.651 3.233 . 0 0 "[ . 1 . ]" 1
940 1 30 VAL MG1 1 65 ALA MB . . 3.300 1.673 1.624 1.730 . 0 0 "[ . 1 . ]" 1
941 1 56 ARG HA 1 56 ARG QD . . 5.000 3.521 1.968 4.176 . 0 0 "[ . 1 . ]" 1
942 1 25 ILE MG 1 30 VAL MG1 . . 5.000 2.253 1.863 3.187 . 0 0 "[ . 1 . ]" 1
943 1 81 LEU QD 1 82 TYR HA . . 5.500 4.960 4.405 5.383 . 0 0 "[ . 1 . ]" 1
944 1 61 ARG HA 1 61 ARG QD . . 5.000 2.740 2.190 4.263 . 0 0 "[ . 1 . ]" 1
945 1 81 LEU HA 1 81 LEU QD . . 3.300 2.341 1.905 2.952 . 0 0 "[ . 1 . ]" 1
946 1 45 LEU HB3 1 45 LEU MD1 . . 3.300 2.484 2.292 2.736 . 0 0 "[ . 1 . ]" 1
947 1 83 LEU HB3 1 83 LEU MD2 . . 3.300 2.388 1.933 3.207 . 0 0 "[ . 1 . ]" 1
948 1 21 VAL MG1 1 30 VAL MG2 . . 5.000 1.987 1.757 2.366 . 0 0 "[ . 1 . ]" 1
949 1 81 LEU QB 1 87 VAL MG2 . . 5.000 3.476 1.923 4.347 . 0 0 "[ . 1 . ]" 1
950 1 73 PHE HA 1 76 VAL MG2 . . 5.000 2.294 1.967 3.388 . 0 0 "[ . 1 . ]" 1
951 1 20 THR MG 1 72 VAL MG1 . . 5.000 3.200 2.384 3.398 . 0 0 "[ . 1 . ]" 1
952 1 77 LEU HA 1 81 LEU QB . . 5.500 5.128 3.854 5.587 0.087 2 0 "[ . 1 . ]" 1
953 1 22 ILE HA 1 22 ILE MG . . 3.300 2.624 2.454 2.890 . 0 0 "[ . 1 . ]" 1
954 1 21 VAL MG1 1 31 LYS HA . . 3.300 2.000 1.741 2.400 . 0 0 "[ . 1 . ]" 1
955 1 24 GLU HG2 1 72 VAL MG2 . . 5.000 4.505 2.845 5.495 0.495 10 0 "[ . 1 . ]" 1
956 1 58 GLN HA 1 62 VAL QG . . 5.500 4.147 3.885 4.426 . 0 0 "[ . 1 . ]" 1
957 1 8 ARG HB3 1 8 ARG HD3 . . 3.300 2.870 1.994 3.631 0.331 10 0 "[ . 1 . ]" 1
958 1 62 VAL QG 1 66 PHE QD . . 3.300 2.004 1.889 2.219 . 0 0 "[ . 1 . ]" 1
959 1 25 ILE HG12 1 72 VAL MG2 . . 5.000 2.981 2.511 3.596 . 0 0 "[ . 1 . ]" 1
960 1 25 ILE HG13 1 72 VAL MG2 . . 5.000 3.556 2.619 3.964 . 0 0 "[ . 1 . ]" 1
961 1 21 VAL MG1 1 25 ILE HG12 . . 5.000 3.493 3.042 3.848 . 0 0 "[ . 1 . ]" 1
962 1 21 VAL MG1 1 25 ILE HG13 . . 3.300 2.539 1.943 3.368 0.068 9 0 "[ . 1 . ]" 1
963 1 51 LEU MD1 1 63 VAL MG2 . . 5.000 2.168 1.828 2.653 . 0 0 "[ . 1 . ]" 1
964 1 63 VAL HA 1 63 VAL MG2 . . 3.300 2.339 2.180 2.433 . 0 0 "[ . 1 . ]" 1
965 1 16 LEU QD 1 76 VAL MG1 . . 5.000 1.783 1.592 1.931 . 0 0 "[ . 1 . ]" 1
966 1 30 VAL HA 1 62 VAL QG . . 3.300 1.745 1.710 1.768 . 0 0 "[ . 1 . ]" 1
967 1 30 VAL MG2 1 66 PHE HA . . 5.500 4.160 3.888 4.406 . 0 0 "[ . 1 . ]" 1
968 1 47 VAL QG 1 49 VAL MG1 . . 3.300 1.937 1.696 2.231 . 0 0 "[ . 1 . ]" 1
969 1 92 VAL MG1 1 92 VAL MG2 . . 2.500 2.047 1.977 2.094 . 0 0 "[ . 1 . ]" 1
970 1 72 VAL MG1 1 72 VAL MG2 . . 2.500 2.047 1.925 2.105 . 0 0 "[ . 1 . ]" 1
971 1 30 VAL MG2 1 69 ALA MB . . 5.500 3.181 2.801 3.635 . 0 0 "[ . 1 . ]" 1
972 1 13 ILE MG 1 47 VAL QG . . 3.300 2.460 1.901 2.904 . 0 0 "[ . 1 . ]" 1
973 1 66 PHE HA 1 69 ALA MB . . 2.900 2.009 1.781 2.222 . 0 0 "[ . 1 . ]" 1
974 1 35 VAL MG2 1 38 VAL HA . . 5.500 4.299 3.678 4.544 . 0 0 "[ . 1 . ]" 1
975 1 47 VAL QG 1 89 ILE HA . . 5.000 2.911 2.344 3.442 . 0 0 "[ . 1 . ]" 1
976 1 47 VAL HA 1 47 VAL QG . . 3.300 2.101 2.005 2.189 . 0 0 "[ . 1 . ]" 1
977 1 60 ASP HA 1 63 VAL MG2 . . 5.500 4.091 3.504 4.400 . 0 0 "[ . 1 . ]" 1
978 1 25 ILE MG 1 30 VAL MG2 . . 5.500 1.790 1.661 1.892 . 0 0 "[ . 1 . ]" 1
979 1 47 VAL QG 1 89 ILE MG . . 5.000 2.859 1.977 3.697 . 0 0 "[ . 1 . ]" 1
980 1 92 VAL HB 1 92 VAL MG1 . . 2.500 2.134 2.111 2.141 . 0 0 "[ . 1 . ]" 1
981 1 35 VAL MG2 1 38 VAL HB . . 5.500 3.586 2.809 4.540 . 0 0 "[ . 1 . ]" 1
982 1 14 ILE MD 1 47 VAL QG . . 5.500 3.983 3.359 4.290 . 0 0 "[ . 1 . ]" 1
983 1 45 LEU HA 1 87 VAL MG2 . . 5.500 4.013 2.123 4.765 . 0 0 "[ . 1 . ]" 1
984 1 74 SER HA 1 77 LEU HG . . 5.000 4.596 3.623 5.049 0.049 9 0 "[ . 1 . ]" 1
985 1 49 VAL HA 1 49 VAL MG1 . . 3.300 2.339 2.217 2.440 . 0 0 "[ . 1 . ]" 1
986 1 92 VAL HB 1 92 VAL MG2 . . 2.500 2.113 2.095 2.138 . 0 0 "[ . 1 . ]" 1
987 1 74 SER HA 1 89 ILE MD . . 5.500 3.515 3.216 3.929 . 0 0 "[ . 1 . ]" 1
988 1 49 VAL MG1 1 89 ILE MD . . 5.500 3.526 2.987 3.751 . 0 0 "[ . 1 . ]" 1
989 1 59 ILE HA 1 59 ILE MD . . 3.300 2.493 1.957 2.781 . 0 0 "[ . 1 . ]" 1
990 1 93 LYS HB3 1 93 LYS HE3 . . 5.000 4.025 2.786 5.103 0.103 6 0 "[ . 1 . ]" 1
991 1 40 LEU HA 1 47 VAL QG . . 5.000 3.024 2.199 3.646 . 0 0 "[ . 1 . ]" 1
992 1 49 VAL MG1 1 89 ILE MG . . 5.000 2.336 1.689 3.071 . 0 0 "[ . 1 . ]" 1
993 1 9 LEU HA 1 12 ASP HB2 . . 3.300 2.108 1.955 2.834 . 0 0 "[ . 1 . ]" 1
994 1 45 LEU HA 1 87 VAL HA . . 5.000 2.460 1.959 3.081 . 0 0 "[ . 1 . ]" 1
995 1 73 PHE HA 1 73 PHE QE . . 5.000 4.422 4.345 4.599 . 0 0 "[ . 1 . ]" 1
996 1 38 VAL HA 1 49 VAL HA . . 3.300 2.504 2.083 2.883 . 0 0 "[ . 1 . ]" 1
997 1 9 LEU HA 1 12 ASP HB3 . . 3.300 3.029 2.685 3.895 0.595 10 1 "[ . + . ]" 1
998 1 89 ILE HB 1 89 ILE MD . . 3.300 2.296 2.185 2.466 . 0 0 "[ . 1 . ]" 1
999 1 83 LEU MD2 1 84 ALA MB . . 5.000 2.519 1.849 3.248 . 0 0 "[ . 1 . ]" 1
1000 1 10 GLU HA 1 38 VAL MG1 . . 5.500 4.457 3.228 5.500 . 0 0 "[ . 1 . ]" 1
1001 1 30 VAL MG2 1 65 ALA MB . . 5.500 3.506 3.280 3.707 . 0 0 "[ . 1 . ]" 1
1002 1 10 GLU HA 1 14 ILE HB . . 5.500 5.474 5.025 5.593 0.093 16 0 "[ . 1 . ]" 1
1003 1 10 GLU HA 1 14 ILE MD . . 5.000 3.410 2.968 3.564 . 0 0 "[ . 1 . ]" 1
1004 1 84 ALA MB 1 85 LYS QB . . 5.000 3.836 3.404 4.236 . 0 0 "[ . 1 . ]" 1
1005 1 6 LYS QB 1 7 GLU HA . . 5.000 4.227 3.796 5.191 0.191 3 0 "[ . 1 . ]" 1
1006 1 69 ALA HA 1 69 ALA MB . . 2.500 2.140 2.121 2.152 . 0 0 "[ . 1 . ]" 1
1007 1 25 ILE HG13 1 69 ALA MB . . 5.000 3.730 3.538 3.864 . 0 0 "[ . 1 . ]" 1
1008 1 38 VAL HA 1 38 VAL MG1 . . 3.300 3.053 2.790 3.209 . 0 0 "[ . 1 . ]" 1
1009 1 56 ARG HA 1 59 ILE MG . . 5.000 3.531 2.597 4.194 . 0 0 "[ . 1 . ]" 1
1010 1 75 ARG HA 1 78 ALA MB . . 3.300 1.877 1.770 1.946 . 0 0 "[ . 1 . ]" 1
1011 1 78 ALA HA 1 78 ALA MB . . 2.500 2.136 2.107 2.152 . 0 0 "[ . 1 . ]" 1
1012 1 25 ILE MD 1 69 ALA MB . . 3.300 1.696 1.593 1.904 . 0 0 "[ . 1 . ]" 1
1013 1 28 GLU HA 1 31 LYS HB2 . . 5.500 4.258 2.512 6.452 0.952 4 5 "[ +. *-** . ]" 1
1014 1 90 HIS HD2 1 91 PHE HD1 . . 5.500 4.806 4.269 5.420 . 0 0 "[ . 1 . ]" 1
1015 1 25 ILE HG13 1 25 ILE MG . . 3.300 2.521 2.423 2.675 . 0 0 "[ . 1 . ]" 1
1016 1 49 VAL MG2 1 89 ILE MG . . 5.000 2.487 1.869 3.211 . 0 0 "[ . 1 . ]" 1
1017 1 25 ILE HA 1 25 ILE MG . . 3.300 2.280 2.077 2.418 . 0 0 "[ . 1 . ]" 1
1018 1 7 GLU HA 1 7 GLU QG . . 3.300 2.174 1.970 2.902 . 0 0 "[ . 1 . ]" 1
1019 1 89 ILE MD 1 89 ILE MG . . 3.300 2.006 1.838 2.305 . 0 0 "[ . 1 . ]" 1
1020 1 11 ASN HA 1 14 ILE HB . . 3.300 2.324 2.106 2.861 . 0 0 "[ . 1 . ]" 1
1021 1 28 GLU HA 1 28 GLU HG3 . . 3.300 2.920 2.053 3.925 0.625 13 1 "[ . 1 + . ]" 1
1022 1 54 TYR HB2 1 54 TYR HE1 . . 5.000 5.030 4.833 5.556 0.556 14 1 "[ . 1 +. ]" 1
1023 1 97 ILE HB 1 97 ILE MD . . 3.300 2.161 1.965 2.416 . 0 0 "[ . 1 . ]" 1
1024 1 25 ILE MD 1 25 ILE MG . . 3.300 1.861 1.795 2.026 . 0 0 "[ . 1 . ]" 1
1025 1 56 ARG QG 1 57 GLU HA . . 5.500 4.530 3.282 5.887 0.387 9 0 "[ . 1 . ]" 1
1026 1 56 ARG HA 1 56 ARG QG . . 3.300 2.778 2.023 3.377 0.077 3 0 "[ . 1 . ]" 1
1027 1 21 VAL HA 1 25 ILE HB . . 5.000 2.832 2.004 3.600 . 0 0 "[ . 1 . ]" 1
1028 1 68 GLN HA 1 68 GLN QG . . 3.300 2.923 2.144 3.344 0.044 4 0 "[ . 1 . ]" 1
1029 1 11 ASN HB2 1 12 ASP HA . . 5.500 5.274 4.355 5.549 0.049 14 0 "[ . 1 . ]" 1
1030 1 60 ASP HA 1 61 ARG HA . . 5.000 4.693 4.677 4.711 . 0 0 "[ . 1 . ]" 1
1031 1 17 ILE HB 1 89 ILE MD . . 5.000 4.003 3.819 4.164 . 0 0 "[ . 1 . ]" 1
1032 1 91 PHE HA 1 91 PHE HD1 . . 5.000 3.634 2.057 3.991 . 0 0 "[ . 1 . ]" 1
1033 1 48 THR HB 1 92 VAL HB . . 5.500 5.100 4.691 5.523 0.023 6 0 "[ . 1 . ]" 1
1034 1 92 VAL HB 1 93 LYS QG . . 5.000 5.115 4.286 5.428 0.428 13 0 "[ . 1 . ]" 1
1035 1 84 ALA MB 1 85 LYS HA . . 5.500 3.922 3.648 4.652 . 0 0 "[ . 1 . ]" 1
1036 1 24 GLU HA 1 24 GLU HG2 . . 3.300 3.152 2.502 3.688 0.388 11 0 "[ . 1 . ]" 1
1037 1 50 TYR HE1 1 92 VAL HB . . 5.000 4.408 3.885 4.930 . 0 0 "[ . 1 . ]" 1
1038 1 18 ASN HA 1 21 VAL HB . . 5.500 2.899 2.172 3.798 . 0 0 "[ . 1 . ]" 1
1039 1 38 VAL HB 1 47 VAL QG . . 5.500 4.424 3.720 4.864 . 0 0 "[ . 1 . ]" 1
1040 1 11 ASN HB3 1 12 ASP HA . . 5.000 3.965 3.640 4.313 . 0 0 "[ . 1 . ]" 1
1041 1 13 ILE HB 1 14 ILE MD . . 3.300 2.558 2.383 2.664 . 0 0 "[ . 1 . ]" 1
1042 1 46 HIS HA 1 90 HIS HB3 . . 5.500 4.971 4.140 6.028 0.528 13 1 "[ . 1 + . ]" 1
1043 1 46 HIS HA 1 88 GLN QB . . 5.500 5.076 3.869 5.965 0.465 7 0 "[ . 1 . ]" 1
1044 1 46 HIS HA 1 47 VAL QG . . 5.500 3.820 3.013 4.255 . 0 0 "[ . 1 . ]" 1
1045 1 50 TYR HE1 1 92 VAL MG1 . . 5.500 3.879 3.401 4.297 . 0 0 "[ . 1 . ]" 1
1046 1 50 TYR HE1 1 92 VAL MG2 . . 5.500 4.217 3.532 4.575 . 0 0 "[ . 1 . ]" 1
1047 1 17 ILE MG 1 89 ILE MD . . 5.500 3.641 3.430 3.766 . 0 0 "[ . 1 . ]" 1
1048 1 39 LYS HB3 1 50 TYR HE1 . . 5.000 2.997 2.217 4.273 . 0 0 "[ . 1 . ]" 1
1049 1 97 ILE MD 1 101 MET HA . . 5.000 3.460 1.954 4.141 . 0 0 "[ . 1 . ]" 1
1050 1 83 LEU MD2 1 85 LYS QB . . 5.500 3.294 2.087 4.630 . 0 0 "[ . 1 . ]" 1
1051 1 47 VAL HB 1 89 ILE HB . . 5.500 4.646 3.834 5.549 0.049 7 0 "[ . 1 . ]" 1
1052 1 65 ALA HA 1 65 ALA MB . . 2.500 2.134 2.117 2.151 . 0 0 "[ . 1 . ]" 1
1053 1 88 GLN HA 1 88 GLN HG2 . . 3.300 2.844 1.978 4.048 0.748 7 1 "[ . + 1 . ]" 1
1054 1 58 GLN HA 1 58 GLN HG3 . . 3.300 2.584 2.001 4.191 0.891 16 1 "[ . 1 .+]" 1
1055 1 49 VAL HB 1 49 VAL MG1 . . 2.500 2.113 2.095 2.141 . 0 0 "[ . 1 . ]" 1
1056 1 25 ILE HA 1 25 ILE MD . . 3.300 2.281 2.000 2.498 . 0 0 "[ . 1 . ]" 1
1057 1 28 GLU H 1 28 GLU HA . . 2.900 2.571 2.179 2.918 0.018 4 0 "[ . 1 . ]" 1
1058 1 28 GLU H 1 28 GLU HB2 . . 3.300 2.762 2.029 3.933 0.633 11 3 "[ * . 1+ .-]" 1
1059 1 25 ILE HA 1 26 TYR H . . 3.300 2.669 2.241 3.271 . 0 0 "[ . 1 . ]" 1
1060 1 28 GLU H 1 28 GLU HG3 . . 5.000 3.895 2.187 4.460 . 0 0 "[ . 1 . ]" 1
1061 1 24 GLU HA 1 26 TYR H . . 5.000 4.144 2.801 5.073 0.073 12 0 "[ . 1 . ]" 1
1062 1 35 VAL H 1 51 LEU MD2 . . 5.000 3.286 2.299 3.948 . 0 0 "[ . 1 . ]" 1
1063 1 14 ILE HA 1 17 ILE H . . 5.500 3.843 3.687 4.030 . 0 0 "[ . 1 . ]" 1
1064 1 16 LEU HB3 1 17 ILE H . . 5.000 2.438 2.124 2.918 . 0 0 "[ . 1 . ]" 1
1065 1 58 GLN HA 1 62 VAL H . . 5.000 4.589 4.332 4.787 . 0 0 "[ . 1 . ]" 1
1066 1 47 VAL H 1 90 HIS HB3 . . 5.000 4.157 3.465 5.150 0.150 15 0 "[ . 1 . ]" 1
1067 1 62 VAL H 1 63 VAL HB . . 5.000 4.769 4.612 4.982 . 0 0 "[ . 1 . ]" 1
1068 1 89 ILE H 1 89 ILE HG13 . . 5.000 2.821 2.154 3.331 . 0 0 "[ . 1 . ]" 1
1069 1 47 VAL QG 1 89 ILE H . . 5.000 4.348 3.483 4.925 . 0 0 "[ . 1 . ]" 1
1070 1 93 LYS HB3 1 94 ASP H . . 5.000 4.121 3.817 4.696 . 0 0 "[ . 1 . ]" 1
1071 1 89 ILE H 1 90 HIS HA . . 5.500 5.258 5.047 5.385 . 0 0 "[ . 1 . ]" 1
1072 1 96 ALA H 1 96 ALA HA . . 2.900 2.699 2.216 2.876 . 0 0 "[ . 1 . ]" 1
1073 1 10 GLU HB3 1 12 ASP H . . 5.000 4.716 4.379 5.300 0.300 13 0 "[ . 1 . ]" 1
1074 1 12 ASP H 1 12 ASP HB3 . . 3.300 3.028 2.897 3.250 . 0 0 "[ . 1 . ]" 1
1075 1 11 ASN HB3 1 12 ASP H . . 3.300 2.825 2.204 3.460 0.160 2 0 "[ . 1 . ]" 1
1076 1 12 ASP H 1 14 ILE HB . . 5.500 4.900 4.634 5.196 . 0 0 "[ . 1 . ]" 1
1077 1 92 VAL MG1 1 93 LYS H . . 5.000 2.239 1.800 4.010 . 0 0 "[ . 1 . ]" 1
1078 1 57 GLU HA 1 60 ASP H . . 5.500 4.972 4.239 5.569 0.069 3 0 "[ . 1 . ]" 1
1079 1 60 ASP H 1 60 ASP HA . . 2.900 2.628 2.614 2.646 . 0 0 "[ . 1 . ]" 1
1080 1 10 GLU HB3 1 13 ILE H . . 5.500 5.293 5.114 5.701 0.201 8 0 "[ . 1 . ]" 1
1081 1 30 VAL H 1 62 VAL QG . . 5.500 3.498 2.586 3.596 . 0 0 "[ . 1 . ]" 1
1082 1 13 ILE H 1 15 ARG HB3 . . 5.500 5.235 5.054 5.429 . 0 0 "[ . 1 . ]" 1
1083 1 8 ARG HB2 1 9 LEU H . . 3.300 2.675 1.856 3.443 0.143 1 0 "[ . 1 . ]" 1
1084 1 8 ARG QG 1 9 LEU H . . 3.300 3.223 1.869 3.883 0.583 3 3 "[ + . 1 - *. ]" 1
1085 1 13 ILE H 1 16 LEU QD . . 5.500 4.120 3.521 4.541 . 0 0 "[ . 1 . ]" 1
1086 1 67 ASN HA 1 69 ALA H . . 5.000 4.112 3.708 4.501 . 0 0 "[ . 1 . ]" 1
1087 1 65 ALA HA 1 68 GLN H . . 5.000 3.946 3.159 5.227 0.227 7 0 "[ . 1 . ]" 1
1088 1 45 LEU MD2 1 87 VAL H . . 5.000 3.108 1.846 3.878 . 0 0 "[ . 1 . ]" 1
1089 1 77 LEU H 1 77 LEU HB2 . . 3.300 2.754 2.620 2.937 . 0 0 "[ . 1 . ]" 1
1090 1 77 LEU HB3 1 78 ALA H . . 5.000 4.207 4.020 4.390 . 0 0 "[ . 1 . ]" 1
1091 1 77 LEU H 1 78 ALA MB . . 5.500 4.142 4.067 4.238 . 0 0 "[ . 1 . ]" 1
1092 1 86 ALA HA 1 87 VAL H . . 5.000 3.259 2.207 3.640 . 0 0 "[ . 1 . ]" 1
1093 1 14 ILE H 1 15 ARG HB3 . . 5.500 4.868 4.617 5.101 . 0 0 "[ . 1 . ]" 1
1094 1 10 GLU HB3 1 14 ILE H . . 5.500 5.260 4.898 5.771 0.271 8 0 "[ . 1 . ]" 1
1095 1 77 LEU H 1 77 LEU MD2 . . 5.000 3.665 3.538 3.808 . 0 0 "[ . 1 . ]" 1
1096 1 70 LYS H 1 70 LYS HA . . 2.900 2.634 2.259 2.832 . 0 0 "[ . 1 . ]" 1
1097 1 77 LEU HB2 1 78 ALA H . . 3.300 3.061 2.731 3.301 0.001 2 0 "[ . 1 . ]" 1
1098 1 67 ASN HA 1 70 LYS H . . 5.000 4.067 3.569 4.484 . 0 0 "[ . 1 . ]" 1
1099 1 8 ARG H 1 8 ARG HB3 . . 3.300 3.518 2.744 4.087 0.787 6 6 "[* .+ -1 ***]" 1
1100 1 58 GLN HB2 1 59 ILE H . . 5.000 3.908 3.171 4.341 . 0 0 "[ . 1 . ]" 1
1101 1 83 LEU H 1 83 LEU HG . . 5.500 4.318 3.430 5.273 . 0 0 "[ . 1 . ]" 1
1102 1 78 ALA HA 1 83 LEU H . . 5.500 5.111 4.232 5.825 0.325 12 0 "[ . 1 . ]" 1
1103 1 40 LEU MD1 1 46 HIS H . . 5.500 4.172 2.737 4.530 . 0 0 "[ . 1 . ]" 1
1104 1 46 HIS H 1 46 HIS HB2 . . 3.300 2.587 2.306 3.138 . 0 0 "[ . 1 . ]" 1
1105 1 25 ILE H 1 25 ILE HG13 . . 5.000 4.001 3.139 4.416 . 0 0 "[ . 1 . ]" 1
1106 1 85 LYS H 1 85 LYS QG . . 2.900 2.548 1.889 3.355 0.455 3 0 "[ . 1 . ]" 1
1107 1 35 VAL MG2 1 36 THR H . . 5.500 3.761 3.458 4.099 . 0 0 "[ . 1 . ]" 1
1108 1 19 ARG H 1 22 ILE QG . . 5.000 4.287 3.956 4.604 . 0 0 "[ . 1 . ]" 1
1109 1 6 LYS QB 1 7 GLU H . . 5.000 2.929 1.761 4.081 . 0 0 "[ . 1 . ]" 1
1110 1 9 LEU HG 1 10 GLU H . . 3.300 2.640 2.356 3.391 0.091 4 0 "[ . 1 . ]" 1
1111 1 9 LEU MD2 1 10 GLU H . . 3.300 2.191 1.861 3.227 . 0 0 "[ . 1 . ]" 1
1112 1 10 GLU H 1 13 ILE HB . . 5.500 5.463 5.084 5.567 0.067 15 0 "[ . 1 . ]" 1
1113 1 9 LEU HA 1 10 GLU H . . 5.000 3.597 3.509 3.639 . 0 0 "[ . 1 . ]" 1
1114 1 84 ALA HA 1 85 LYS H . . 5.000 3.610 3.486 3.642 . 0 0 "[ . 1 . ]" 1
1115 1 15 ARG H 1 15 ARG HG3 . . 5.000 4.449 4.387 4.493 . 0 0 "[ . 1 . ]" 1
1116 1 44 LEU QD 1 81 LEU H . . 5.500 4.680 3.519 5.187 . 0 0 "[ . 1 . ]" 1
1117 1 15 ARG H 1 16 LEU HA . . 5.000 5.074 5.006 5.144 0.144 16 0 "[ . 1 . ]" 1
1118 1 97 ILE H 1 97 ILE MD . . 5.000 3.946 3.587 4.156 . 0 0 "[ . 1 . ]" 1
1119 1 80 ASN HA 1 81 LEU H . . 5.000 3.640 3.609 3.655 . 0 0 "[ . 1 . ]" 1
1120 1 81 LEU QB 1 82 TYR H . . 2.900 2.288 1.778 3.442 0.542 8 1 "[ . + 1 . ]" 1
1121 1 35 VAL MG2 1 38 VAL H . . 5.500 4.529 4.246 4.742 . 0 0 "[ . 1 . ]" 1
1122 1 82 TYR H 1 82 TYR HA . . 2.900 2.712 2.217 2.943 0.043 8 0 "[ . 1 . ]" 1
1123 1 82 TYR H 1 82 TYR HB3 . . 3.300 3.218 2.679 3.859 0.559 9 1 "[ . +1 . ]" 1
1124 1 28 GLU HG3 1 29 THR H . . 5.000 4.210 2.928 4.973 . 0 0 "[ . 1 . ]" 1
1125 1 81 LEU HA 1 82 TYR H . . 5.000 2.950 2.177 3.639 . 0 0 "[ . 1 . ]" 1
1126 1 37 HIS H 1 37 HIS QB . . 3.300 2.826 2.269 3.281 . 0 0 "[ . 1 . ]" 1
1127 1 80 ASN QB 1 82 TYR H . . 5.500 5.308 4.058 5.837 0.337 12 0 "[ . 1 . ]" 1
1128 1 7 GLU QB 1 11 ASN H . . 5.000 2.864 1.935 4.412 . 0 0 "[ . 1 . ]" 1
1129 1 57 GLU QG 1 58 GLN H . . 5.000 3.470 2.423 4.312 . 0 0 "[ . 1 . ]" 1
1130 1 73 PHE H 1 74 SER HA . . 5.500 5.357 5.255 5.435 . 0 0 "[ . 1 . ]" 1
1131 1 42 ASP HB2 1 43 ASP H . . 5.000 3.595 2.218 4.735 . 0 0 "[ . 1 . ]" 1
1132 1 71 GLY HA2 1 74 SER H . . 5.000 4.022 3.544 4.987 . 0 0 "[ . 1 . ]" 1
1133 1 45 LEU H 1 45 LEU MD1 . . 5.000 3.778 3.106 4.212 . 0 0 "[ . 1 . ]" 1
1134 1 21 VAL MG2 1 22 ILE H . . 5.000 3.976 3.649 4.183 . 0 0 "[ . 1 . ]" 1
1135 1 74 SER H 1 74 SER HB3 . . 2.900 2.818 2.260 3.540 0.640 15 3 "[- . * 1 + ]" 1
1136 1 74 SER HA 1 88 GLN H . . 5.500 4.696 3.672 5.579 0.079 12 0 "[ . 1 . ]" 1
1137 1 22 ILE H 1 22 ILE HB . . 3.300 2.523 2.012 3.539 0.239 13 0 "[ . 1 . ]" 1
1138 1 22 ILE H 1 22 ILE MD . . 5.000 3.692 3.250 4.038 . 0 0 "[ . 1 . ]" 1
1139 1 40 LEU MD1 1 44 LEU H . . 5.000 2.988 1.730 4.086 . 0 0 "[ . 1 . ]" 1
1140 1 22 ILE HA 1 23 HIS H . . 5.000 3.436 2.190 3.640 . 0 0 "[ . 1 . ]" 1
1141 1 31 LYS H 1 32 THR MG . . 5.000 3.993 3.876 4.095 . 0 0 "[ . 1 . ]" 1
1142 1 31 LYS H 1 31 LYS HB2 . . 2.900 2.379 2.155 2.718 . 0 0 "[ . 1 . ]" 1
1143 1 30 VAL MG2 1 73 PHE QE . . 5.000 3.011 2.570 3.217 . 0 0 "[ . 1 . ]" 1
1144 1 25 ILE MD 1 73 PHE QE . . 3.300 2.186 1.951 2.587 . 0 0 "[ . 1 . ]" 1
1145 1 17 ILE MG 1 73 PHE QE . . 5.000 3.090 2.310 3.702 . 0 0 "[ . 1 . ]" 1
1146 1 25 ILE MG 1 73 PHE QE . . 5.500 3.923 3.252 4.290 . 0 0 "[ . 1 . ]" 1
1147 1 17 ILE MD 1 73 PHE QE . . 5.000 3.029 2.549 3.231 . 0 0 "[ . 1 . ]" 1
1148 1 45 LEU MD2 1 46 HIS HD2 . . 5.500 3.564 1.961 4.551 . 0 0 "[ . 1 . ]" 1
1149 1 45 LEU MD1 1 46 HIS HD2 . . 5.500 3.730 2.491 4.481 . 0 0 "[ . 1 . ]" 1
1150 1 25 ILE HG13 1 73 PHE QE . . 3.300 2.873 1.964 3.574 0.274 5 0 "[ . 1 . ]" 1
1151 1 25 ILE HG12 1 73 PHE QE . . 5.000 3.650 2.886 4.237 . 0 0 "[ . 1 . ]" 1
1152 1 69 ALA MB 1 73 PHE QE . . 5.000 2.341 1.909 2.732 . 0 0 "[ . 1 . ]" 1
1153 1 21 VAL MG2 1 73 PHE QE . . 3.300 2.185 1.836 2.714 . 0 0 "[ . 1 . ]" 1
1154 1 51 LEU MD1 1 66 PHE HZ . . 5.000 3.266 2.947 3.612 . 0 0 "[ . 1 . ]" 1
1155 1 51 LEU MD2 1 66 PHE HZ . . 5.000 2.153 1.937 2.507 . 0 0 "[ . 1 . ]" 1
1156 1 30 VAL MG2 1 66 PHE HZ . . 5.000 4.033 3.708 4.225 . 0 0 "[ . 1 . ]" 1
1157 1 91 PHE HD1 1 92 VAL MG2 . . 5.500 4.209 3.912 4.589 . 0 0 "[ . 1 . ]" 1
1158 1 51 LEU MD1 1 66 PHE QE . . 3.300 2.360 2.259 2.492 . 0 0 "[ . 1 . ]" 1
1159 1 30 VAL MG2 1 66 PHE QE . . 5.000 3.544 3.393 3.649 . 0 0 "[ . 1 . ]" 1
1160 1 62 VAL QG 1 66 PHE HZ . . 5.000 3.803 3.674 4.116 . 0 0 "[ . 1 . ]" 1
1161 1 35 VAL MG2 1 66 PHE HZ . . 5.000 3.595 3.099 3.923 . 0 0 "[ . 1 . ]" 1
1162 1 45 LEU HB2 1 46 HIS HD2 . . 5.000 3.422 2.023 4.361 . 0 0 "[ . 1 . ]" 1
1163 1 32 THR MG 1 54 TYR HD1 . . 5.500 3.931 3.465 4.347 . 0 0 "[ . 1 . ]" 1
1164 1 45 LEU HB3 1 46 HIS HD2 . . 3.300 2.437 2.144 2.827 . 0 0 "[ . 1 . ]" 1
1165 1 51 LEU MD1 1 66 PHE QD . . 3.300 2.379 2.119 2.550 . 0 0 "[ . 1 . ]" 1
1166 1 17 ILE HG12 1 73 PHE QE . . 5.500 5.857 5.442 6.076 0.576 4 5 "[ - +. ** 1 * . ]" 1
1167 1 30 VAL MG2 1 73 PHE HZ . . 3.300 2.091 1.877 2.501 . 0 0 "[ . 1 . ]" 1
1168 1 30 VAL MG2 1 66 PHE QD . . 5.000 4.092 3.928 4.218 . 0 0 "[ . 1 . ]" 1
1169 1 50 TYR HD1 1 92 VAL MG2 . . 5.500 4.480 3.917 4.592 . 0 0 "[ . 1 . ]" 1
1170 1 25 ILE MD 1 73 PHE HZ . . 3.300 2.479 2.165 2.685 . 0 0 "[ . 1 . ]" 1
1171 1 30 VAL MG1 1 66 PHE QD . . 5.000 2.143 1.912 2.895 . 0 0 "[ . 1 . ]" 1
1172 1 48 THR MG 1 50 TYR HE1 . . 5.000 2.144 1.826 2.550 . 0 0 "[ . 1 . ]" 1
1173 1 50 TYR HD1 1 92 VAL MG1 . . 5.000 3.838 3.099 4.101 . 0 0 "[ . 1 . ]" 1
1174 1 48 THR MG 1 50 TYR HD1 . . 5.000 3.060 2.288 3.561 . 0 0 "[ . 1 . ]" 1
1175 1 63 VAL MG1 1 66 PHE QD . . 5.500 4.756 4.559 4.976 . 0 0 "[ . 1 . ]" 1
1176 1 35 VAL MG1 1 50 TYR HD1 . . 5.000 3.256 2.850 3.712 . 0 0 "[ . 1 . ]" 1
1177 1 72 VAL MG2 1 73 PHE HZ . . 5.000 3.889 3.196 4.125 . 0 0 "[ . 1 . ]" 1
1178 1 25 ILE MG 1 73 PHE HZ . . 5.000 3.338 2.110 3.894 . 0 0 "[ . 1 . ]" 1
1179 1 17 ILE MD 1 73 PHE HZ . . 5.500 4.399 4.148 4.556 . 0 0 "[ . 1 . ]" 1
1180 1 30 VAL MG1 1 66 PHE QE . . 5.000 3.072 2.626 3.793 . 0 0 "[ . 1 . ]" 1
1181 1 73 PHE HD1 1 89 ILE MD . . 5.000 3.831 3.430 4.052 . 0 0 "[ . 1 . ]" 1
1182 1 62 VAL QG 1 66 PHE QE . . 5.500 1.921 1.789 2.169 . 0 0 "[ . 1 . ]" 1
1183 1 21 VAL MG2 1 73 PHE HD1 . . 5.500 3.963 3.455 4.411 . 0 0 "[ . 1 . ]" 1
1184 1 69 ALA MB 1 73 PHE HD1 . . 5.500 3.955 3.099 4.322 . 0 0 "[ . 1 . ]" 1
1185 1 30 VAL HB 1 66 PHE QD . . 3.300 2.944 2.616 3.297 . 0 0 "[ . 1 . ]" 1
1186 1 65 ALA MB 1 66 PHE QD . . 5.000 3.524 3.176 3.832 . 0 0 "[ . 1 . ]" 1
1187 1 69 ALA MB 1 73 PHE HZ . . 3.300 2.480 2.202 2.827 . 0 0 "[ . 1 . ]" 1
1188 1 39 LYS HG3 1 50 TYR HE1 . . 5.000 4.363 2.897 5.059 0.059 10 0 "[ . 1 . ]" 1
1189 1 39 LYS HG2 1 50 TYR HE1 . . 5.000 4.033 2.316 4.980 . 0 0 "[ . 1 . ]" 1
1190 1 63 VAL HA 1 66 PHE QD . . 3.300 3.067 2.847 3.283 . 0 0 "[ . 1 . ]" 1
1191 1 30 VAL HA 1 66 PHE QD . . 5.000 3.591 2.959 3.893 . 0 0 "[ . 1 . ]" 1
1192 1 62 VAL HA 1 66 PHE QD . . 5.000 3.439 3.200 3.582 . 0 0 "[ . 1 . ]" 1
1193 1 30 VAL HA 1 66 PHE QE . . 5.000 2.874 2.378 3.385 . 0 0 "[ . 1 . ]" 1
1194 1 62 VAL HA 1 66 PHE QE . . 5.000 4.414 4.231 4.606 . 0 0 "[ . 1 . ]" 1
1195 1 17 ILE HA 1 73 PHE QE . . 5.500 4.699 4.048 5.137 . 0 0 "[ . 1 . ]" 1
1196 1 48 THR HB 1 50 TYR HE1 . . 3.300 2.962 1.987 3.407 0.107 13 0 "[ . 1 . ]" 1
1197 1 91 PHE HD1 1 92 VAL HA . . 5.000 2.964 2.568 3.912 . 0 0 "[ . 1 . ]" 1
1198 1 82 TYR QD 1 83 LEU HA . . 5.000 4.051 3.211 4.879 . 0 0 "[ . 1 . ]" 1
1199 1 38 VAL HA 1 50 TYR HD1 . . 3.300 2.915 2.063 3.347 0.047 13 0 "[ . 1 . ]" 1
1200 1 38 VAL HA 1 50 TYR HE1 . . 5.000 3.951 3.201 4.552 . 0 0 "[ . 1 . ]" 1
1201 1 49 VAL HA 1 50 TYR HD1 . . 3.300 3.011 2.676 3.376 0.076 2 0 "[ . 1 . ]" 1
1202 1 30 VAL HA 1 66 PHE HZ . . 5.500 5.037 4.479 5.494 . 0 0 "[ . 1 . ]" 1
1203 1 20 THR MG 1 73 PHE QE . . 3.300 2.280 1.761 2.754 . 0 0 "[ . 1 . ]" 1
1204 1 32 THR HA 1 54 TYR HE1 . . 5.500 4.465 3.477 5.551 0.051 16 0 "[ . 1 . ]" 1
1205 1 30 VAL MG1 1 73 PHE HZ . . 5.000 2.934 2.434 3.511 . 0 0 "[ . 1 . ]" 1
1206 1 73 PHE HA 1 73 PHE HD1 . . 3.300 2.036 1.942 2.215 . 0 0 "[ . 1 . ]" 1
1207 1 14 ILE HA 1 17 ILE HG13 . . 5.500 5.359 4.888 6.010 0.510 7 1 "[ . + 1 . ]" 1
1208 1 17 ILE HA 1 17 ILE HG13 . . 3.300 3.557 3.522 3.578 0.278 12 0 "[ . 1 . ]" 1
1209 1 17 ILE HA 1 76 VAL MG1 . . 5.000 3.541 3.011 3.984 . 0 0 "[ . 1 . ]" 1
1210 1 82 TYR HA 1 87 VAL MG1 . . 5.500 4.408 4.157 4.658 . 0 0 "[ . 1 . ]" 1
1211 1 86 ALA HA 1 87 VAL MG1 . . 5.500 4.005 3.132 4.615 . 0 0 "[ . 1 . ]" 1
1212 1 45 LEU MD2 1 86 ALA HA . . 5.000 2.396 1.832 4.180 . 0 0 "[ . 1 . ]" 1
1213 1 77 LEU HA 1 87 VAL MG2 . . 5.500 3.989 3.151 4.581 . 0 0 "[ . 1 . ]" 1
1214 1 77 LEU HA 1 87 VAL MG1 . . 5.500 4.228 3.808 4.517 . 0 0 "[ . 1 . ]" 1
1215 1 76 VAL MG1 1 77 LEU HA . . 5.000 3.440 3.272 3.762 . 0 0 "[ . 1 . ]" 1
1216 1 100 ALA MB 1 101 MET HA . . 5.500 3.932 3.623 4.344 . 0 0 "[ . 1 . ]" 1
1217 1 60 ASP HA 1 63 VAL MG1 . . 5.000 4.336 4.097 4.570 . 0 0 "[ . 1 . ]" 1
1218 1 20 THR MG 1 21 VAL HB . . 5.000 3.997 3.851 4.102 . 0 0 "[ . 1 . ]" 1
1219 1 24 GLU HB2 1 72 VAL MG1 . . 5.000 3.568 2.856 3.887 . 0 0 "[ . 1 . ]" 1
1220 1 72 VAL MG1 1 75 ARG HB2 . . 5.000 4.256 3.775 4.732 . 0 0 "[ . 1 . ]" 1
1221 1 24 GLU HB3 1 72 VAL MG1 . . 3.300 2.608 2.007 3.792 0.492 4 0 "[ . 1 . ]" 1
1222 1 91 PHE HA 1 92 VAL HB . . 5.500 4.258 4.000 4.384 . 0 0 "[ . 1 . ]" 1
1223 1 40 LEU HB2 1 41 SER HA . . 5.500 5.474 5.010 5.936 0.436 6 0 "[ . 1 . ]" 1
1224 1 21 VAL MG2 1 31 LYS HA . . 5.500 3.521 3.016 3.927 . 0 0 "[ . 1 . ]" 1
1225 1 16 LEU HA 1 76 VAL MG1 . . 5.500 3.697 3.317 4.430 . 0 0 "[ . 1 . ]" 1
1226 1 19 ARG HA 1 22 ILE HG12 . . 3.300 2.789 1.986 4.116 0.816 4 1 "[ +. 1 . ]" 1
1227 1 19 ARG HA 1 22 ILE HB . . 5.000 3.582 2.238 4.859 . 0 0 "[ . 1 . ]" 1
1228 1 71 GLY HA2 1 75 ARG QG . . 5.500 5.862 5.313 6.412 0.912 3 5 "[ *+ -* 1 *. ]" 1
1229 1 45 LEU HB3 1 87 VAL HA . . 5.500 4.373 2.860 5.291 . 0 0 "[ . 1 . ]" 1
1230 1 47 VAL QG 1 49 VAL HA . . 5.500 3.831 3.560 4.217 . 0 0 "[ . 1 . ]" 1
1231 1 10 GLU HB2 1 11 ASN HA . . 5.500 5.231 4.821 5.486 . 0 0 "[ . 1 . ]" 1
1232 1 12 ASP HA 1 15 ARG HB3 . . 3.300 2.811 2.579 3.052 . 0 0 "[ . 1 . ]" 1
1233 1 56 ARG HA 1 59 ILE HB . . 3.300 2.158 1.797 3.140 . 0 0 "[ . 1 . ]" 1
1234 1 57 GLU QG 1 58 GLN HA . . 5.500 4.831 3.520 5.843 0.343 9 0 "[ . 1 . ]" 1
1235 1 77 LEU HA 1 80 ASN QB . . 5.000 3.187 1.947 4.007 . 0 0 "[ . 1 . ]" 1
1236 1 53 CYS QB 1 59 ILE HA . . 5.000 2.920 2.454 3.787 . 0 0 "[ . 1 . ]" 1
1237 1 43 ASP HA 1 44 LEU HB3 . . 5.500 5.292 4.743 6.073 0.573 1 1 "[+ . 1 . ]" 1
1238 1 7 GLU QB 1 11 ASN HA . . 5.000 4.001 2.942 5.169 0.169 8 0 "[ . 1 . ]" 1
1239 1 67 ASN QB 1 68 GLN HA . . 5.000 4.071 3.631 4.931 . 0 0 "[ . 1 . ]" 1
1240 1 7 GLU HA 1 11 ASN HB2 . . 5.500 3.857 2.019 5.405 . 0 0 "[ . 1 . ]" 1
1241 1 19 ARG HA 1 19 ARG HD3 . . 3.300 3.411 2.615 4.104 0.804 16 2 "[ . -1 .+]" 1
1242 1 32 THR HA 1 33 GLY HA3 . . 5.500 5.283 5.187 5.363 . 0 0 "[ . 1 . ]" 1
1243 1 21 VAL HA 1 25 ILE HA . . 5.500 4.669 3.945 5.279 . 0 0 "[ . 1 . ]" 1
1244 1 45 LEU HA 1 46 HIS HA . . 5.000 4.503 4.458 4.535 . 0 0 "[ . 1 . ]" 1
1245 1 35 VAL HA 1 50 TYR HB2 . . 5.000 3.794 2.962 4.451 . 0 0 "[ . 1 . ]" 1
1246 1 13 ILE HA 1 16 LEU HB3 . . 5.000 3.317 2.882 3.780 . 0 0 "[ . 1 . ]" 1
1247 1 9 LEU HG 1 13 ILE HB . . 5.000 4.775 4.640 4.923 . 0 0 "[ . 1 . ]" 1
1248 1 25 ILE MD 1 72 VAL MG1 . . 5.000 3.064 2.364 3.242 . 0 0 "[ . 1 . ]" 1
1249 1 30 VAL MG2 1 62 VAL QG . . 5.500 3.666 3.354 3.878 . 0 0 "[ . 1 . ]" 1
1250 1 38 VAL HA 1 49 VAL H . . 5.000 4.706 4.138 5.115 0.115 4 0 "[ . 1 . ]" 1
1251 1 46 HIS HA 1 88 GLN H . . 5.500 4.360 3.374 5.500 0.000 8 0 "[ . 1 . ]" 1
1252 1 35 VAL HB 1 50 TYR H . . 5.000 4.605 4.059 5.012 0.012 5 0 "[ . 1 . ]" 1
1253 1 90 HIS H 1 91 PHE HA . . 5.500 4.911 4.668 5.121 . 0 0 "[ . 1 . ]" 1
1254 1 53 CYS QB 1 56 ARG H . . 5.000 4.120 2.954 5.084 0.084 3 0 "[ . 1 . ]" 1
1255 1 13 ILE MG 1 17 ILE H . . 5.500 3.921 3.695 4.296 . 0 0 "[ . 1 . ]" 1
1256 1 39 LYS H 1 47 VAL HA . . 5.000 4.461 3.531 5.039 0.039 9 0 "[ . 1 . ]" 1
1257 1 45 LEU MD2 1 86 ALA H . . 5.500 3.644 1.999 4.559 . 0 0 "[ . 1 . ]" 1
1258 1 11 ASN H 1 12 ASP HA . . 5.500 5.230 5.120 5.312 . 0 0 "[ . 1 . ]" 1
1259 1 44 LEU HG 1 45 LEU H . . 5.000 4.085 2.692 4.769 . 0 0 "[ . 1 . ]" 1
1260 1 32 THR H 1 62 VAL QG . . 5.000 3.308 3.105 3.430 . 0 0 "[ . 1 . ]" 1
1261 1 59 ILE MG 1 64 GLY H . . 5.500 4.690 4.445 4.905 . 0 0 "[ . 1 . ]" 1
1262 1 49 VAL MG2 1 51 LEU MD1 . . 5.000 3.040 2.449 3.424 . 0 0 "[ . 1 . ]" 1
1263 1 35 VAL HA 1 36 THR MG . . 5.000 3.545 3.009 4.124 . 0 0 "[ . 1 . ]" 1
1264 1 38 VAL MG1 1 49 VAL MG2 . . 5.500 5.903 5.526 6.134 0.634 6 4 "[ .+ * 1* .-]" 1
1265 1 72 VAL MG2 1 73 PHE HA . . 5.000 3.470 3.218 3.748 . 0 0 "[ . 1 . ]" 1
1266 1 38 VAL MG1 1 49 VAL HA . . 5.500 4.450 4.011 4.664 . 0 0 "[ . 1 . ]" 1
1267 1 53 CYS QB 1 54 TYR HD1 . . 5.500 3.886 2.557 4.654 . 0 0 "[ . 1 . ]" 1
stop_
save_
save_distance_constraint_statistics_2
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 2
_Distance_constraint_stats_list.Constraint_count 60
_Distance_constraint_stats_list.Viol_count 377
_Distance_constraint_stats_list.Viol_total 380.273
_Distance_constraint_stats_list.Viol_max 0.523
_Distance_constraint_stats_list.Viol_rms 0.0509
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0248
_Distance_constraint_stats_list.Viol_average_violations_only 0.0630
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details .
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 7 GLU 0.468 0.101 10 0 "[ . 1 . ]"
1 8 ARG 0.509 0.086 9 0 "[ . 1 . ]"
1 9 LEU 0.689 0.091 12 0 "[ . 1 . ]"
1 10 GLU 0.079 0.033 7 0 "[ . 1 . ]"
1 11 ASN 1.403 0.138 16 0 "[ . 1 . ]"
1 12 ASP 0.700 0.086 9 0 "[ . 1 . ]"
1 13 ILE 0.854 0.091 12 0 "[ . 1 . ]"
1 14 ILE 0.594 0.066 9 0 "[ . 1 . ]"
1 15 ARG 1.454 0.138 16 0 "[ . 1 . ]"
1 16 LEU 0.957 0.121 8 0 "[ . 1 . ]"
1 17 ILE 0.328 0.055 12 0 "[ . 1 . ]"
1 18 ASN 1.098 0.149 13 0 "[ . 1 . ]"
1 19 ARG 0.519 0.066 7 0 "[ . 1 . ]"
1 20 THR 0.766 0.121 8 0 "[ . 1 . ]"
1 21 VAL 0.163 0.055 12 0 "[ . 1 . ]"
1 22 ILE 0.584 0.149 13 0 "[ . 1 . ]"
1 39 LYS 0.604 0.079 6 0 "[ . 1 . ]"
1 41 SER 2.878 0.360 14 0 "[ . 1 . ]"
1 46 HIS 2.878 0.360 14 0 "[ . 1 . ]"
1 47 VAL 0.808 0.193 7 0 "[ . 1 . ]"
1 48 THR 0.604 0.079 6 0 "[ . 1 . ]"
1 49 VAL 1.059 0.218 15 0 "[ . 1 . ]"
1 58 GLN 0.263 0.082 14 0 "[ . 1 . ]"
1 59 ILE 4.228 0.239 8 0 "[ . 1 . ]"
1 60 ASP 0.535 0.105 14 0 "[ . 1 . ]"
1 62 VAL 0.263 0.082 14 0 "[ . 1 . ]"
1 63 VAL 5.305 0.239 8 0 "[ . 1 . ]"
1 64 GLY 0.535 0.105 14 0 "[ . 1 . ]"
1 66 PHE 2.288 0.210 4 0 "[ . 1 . ]"
1 67 ASN 1.077 0.137 8 0 "[ . 1 . ]"
1 70 LYS 4.791 0.523 9 3 "[ . *+1- . ]"
1 71 GLY 0.503 0.114 13 0 "[ . 1 . ]"
1 72 VAL 0.529 0.103 8 0 "[ . 1 . ]"
1 74 SER 2.740 0.523 9 3 "[ . *+1- . ]"
1 75 ARG 0.853 0.114 13 0 "[ . 1 . ]"
1 76 VAL 0.529 0.103 8 0 "[ . 1 . ]"
1 77 LEU 0.322 0.075 15 0 "[ . 1 . ]"
1 78 ALA 0.237 0.081 15 0 "[ . 1 . ]"
1 79 HIS 0.350 0.106 12 0 "[ . 1 . ]"
1 81 LEU 0.322 0.075 15 0 "[ . 1 . ]"
1 90 HIS 0.905 0.193 7 0 "[ . 1 . ]"
1 92 VAL 0.962 0.218 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 7 GLU O 1 11 ASN H . . 2.300 2.085 1.710 2.401 0.101 10 0 "[ . 1 . ]" 2
2 1 7 GLU O 1 11 ASN N . 2.800 3.300 3.018 2.705 3.308 0.095 15 0 "[ . 1 . ]" 2
3 1 8 ARG O 1 12 ASP H . . 2.300 2.265 1.960 2.386 0.086 9 0 "[ . 1 . ]" 2
4 1 8 ARG O 1 12 ASP N . 2.800 3.300 3.167 2.730 3.313 0.070 4 0 "[ . 1 . ]" 2
5 1 9 LEU O 1 13 ILE H . . 2.300 1.887 1.787 2.042 0.013 6 0 "[ . 1 . ]" 2
6 1 9 LEU O 1 13 ILE N . 2.800 3.300 2.770 2.709 2.932 0.091 12 0 "[ . 1 . ]" 2
7 1 10 GLU O 1 14 ILE H . . 2.300 1.968 1.784 2.125 0.016 7 0 "[ . 1 . ]" 2
8 1 10 GLU O 1 14 ILE N . 2.800 3.300 2.927 2.767 3.109 0.033 7 0 "[ . 1 . ]" 2
9 1 11 ASN O 1 15 ARG H . . 2.300 1.830 1.732 2.076 0.068 11 0 "[ . 1 . ]" 2
10 1 11 ASN O 1 15 ARG N . 2.800 3.300 2.772 2.662 3.072 0.138 16 0 "[ . 1 . ]" 2
11 1 12 ASP O 1 16 LEU H . . 2.300 2.182 2.043 2.304 0.004 3 0 "[ . 1 . ]" 2
12 1 12 ASP O 1 16 LEU N . 2.800 3.300 2.826 2.739 2.992 0.061 10 0 "[ . 1 . ]" 2
13 1 13 ILE O 1 17 ILE H . . 2.300 2.275 2.167 2.338 0.038 8 0 "[ . 1 . ]" 2
14 1 13 ILE O 1 17 ILE N . 2.800 3.300 3.181 3.071 3.279 . 0 0 "[ . 1 . ]" 2
15 1 14 ILE O 1 18 ASN H . . 2.300 2.331 2.311 2.366 0.066 9 0 "[ . 1 . ]" 2
16 1 14 ILE O 1 18 ASN N . 2.800 3.300 3.220 3.054 3.313 0.013 4 0 "[ . 1 . ]" 2
17 1 15 ARG O 1 19 ARG H . . 2.300 1.870 1.758 2.004 0.042 7 0 "[ . 1 . ]" 2
18 1 15 ARG O 1 19 ARG N . 2.800 3.300 2.779 2.734 2.940 0.066 7 0 "[ . 1 . ]" 2
19 1 16 LEU O 1 20 THR H . . 2.300 2.345 2.258 2.421 0.121 8 0 "[ . 1 . ]" 2
20 1 16 LEU O 1 20 THR N . 2.800 3.300 3.156 2.932 3.247 . 0 0 "[ . 1 . ]" 2
21 1 17 ILE O 1 21 VAL H . . 2.300 2.094 1.821 2.355 0.055 12 0 "[ . 1 . ]" 2
22 1 17 ILE O 1 21 VAL N . 2.800 3.300 3.027 2.754 3.311 0.046 11 0 "[ . 1 . ]" 2
23 1 18 ASN O 1 22 ILE H . . 2.300 2.193 1.724 2.369 0.076 13 0 "[ . 1 . ]" 2
24 1 18 ASN O 1 22 ILE N . 2.800 3.300 2.954 2.651 3.326 0.149 13 0 "[ . 1 . ]" 2
25 1 58 GLN O 1 62 VAL H . . 2.300 1.932 1.771 2.205 0.029 14 0 "[ . 1 . ]" 2
26 1 58 GLN O 1 62 VAL N . 2.800 3.300 2.858 2.718 3.111 0.082 14 0 "[ . 1 . ]" 2
27 1 59 ILE O 1 63 VAL H . . 2.300 1.712 1.617 1.766 0.183 16 0 "[ . 1 . ]" 2
28 1 59 ILE O 1 63 VAL N . . 2.300 2.476 2.433 2.539 0.239 8 0 "[ . 1 . ]" 2
29 1 60 ASP O 1 64 GLY H . . 2.300 2.327 2.204 2.405 0.105 14 0 "[ . 1 . ]" 2
30 1 60 ASP O 1 64 GLY N . 2.800 3.300 3.141 3.049 3.252 . 0 0 "[ . 1 . ]" 2
31 1 63 VAL O 1 67 ASN H . . 2.300 2.367 2.299 2.437 0.137 8 0 "[ . 1 . ]" 2
32 1 63 VAL O 1 67 ASN N . 2.800 3.300 3.095 3.008 3.174 . 0 0 "[ . 1 . ]" 2
33 1 66 PHE O 1 70 LYS H . . 2.300 2.387 2.197 2.483 0.183 9 0 "[ . 1 . ]" 2
34 1 66 PHE O 1 70 LYS N . 2.800 3.300 3.045 2.590 3.382 0.210 4 0 "[ . 1 . ]" 2
35 1 70 LYS O 1 74 SER H . . 2.300 2.103 1.720 2.823 0.523 9 3 "[ . *+1- . ]" 2
36 1 70 LYS O 1 74 SER N . 2.800 3.300 2.848 2.682 3.273 0.118 11 0 "[ . 1 . ]" 2
37 1 71 GLY O 1 75 ARG H . . 2.300 2.050 1.832 2.362 0.062 15 0 "[ . 1 . ]" 2
38 1 71 GLY O 1 75 ARG N . 2.800 3.300 2.878 2.686 3.142 0.114 13 0 "[ . 1 . ]" 2
39 1 72 VAL O 1 76 VAL H . . 2.300 2.252 1.889 2.403 0.103 8 0 "[ . 1 . ]" 2
40 1 72 VAL O 1 76 VAL N . 2.800 3.300 3.052 2.729 3.328 0.071 7 0 "[ . 1 . ]" 2
41 1 74 SER O 1 78 ALA H . . 2.300 2.154 1.804 2.336 0.036 6 0 "[ . 1 . ]" 2
42 1 74 SER O 1 78 ALA N . 2.800 3.300 2.982 2.719 3.171 0.081 15 0 "[ . 1 . ]" 2
43 1 75 ARG O 1 79 HIS H . . 2.300 2.089 1.869 2.406 0.106 12 0 "[ . 1 . ]" 2
44 1 75 ARG O 1 79 HIS N . 2.800 3.300 2.963 2.742 3.244 0.058 10 0 "[ . 1 . ]" 2
45 1 77 LEU O 1 81 LEU H . . 2.300 2.162 1.774 2.333 0.033 12 0 "[ . 1 . ]" 2
46 1 77 LEU O 1 81 LEU N . 2.800 3.300 2.930 2.725 3.184 0.075 15 0 "[ . 1 . ]" 2
47 1 39 LYS H 1 48 THR O . . 2.300 2.066 1.771 2.356 0.056 13 0 "[ . 1 . ]" 2
48 1 39 LYS N 1 48 THR O . 2.800 3.300 2.907 2.721 3.288 0.079 6 0 "[ . 1 . ]" 2
49 1 39 LYS O 1 48 THR H . . 2.300 2.122 1.786 2.356 0.056 13 0 "[ . 1 . ]" 2
50 1 39 LYS O 1 48 THR N . 2.800 3.300 3.070 2.780 3.303 0.020 7 0 "[ . 1 . ]" 2
51 1 41 SER H 1 46 HIS O . . 2.300 2.161 1.734 2.544 0.244 14 0 "[ . 1 . ]" 2
52 1 41 SER N 1 46 HIS O . 2.800 3.300 2.977 2.725 3.245 0.075 1 0 "[ . 1 . ]" 2
53 1 41 SER O 1 46 HIS H . . 2.300 2.294 1.936 2.660 0.360 14 0 "[ . 1 . ]" 2
54 1 41 SER O 1 46 HIS N . 2.800 3.300 3.202 2.764 3.422 0.122 11 0 "[ . 1 . ]" 2
55 1 47 VAL O 1 90 HIS H . . 2.300 1.891 1.743 2.070 0.057 15 0 "[ . 1 . ]" 2
56 1 47 VAL O 1 90 HIS N . 2.800 3.300 2.799 2.607 3.059 0.193 7 0 "[ . 1 . ]" 2
57 1 49 VAL O 1 92 VAL H . . 2.300 2.019 1.813 2.346 0.046 4 0 "[ . 1 . ]" 2
58 1 49 VAL O 1 92 VAL N . 2.800 3.300 2.776 2.582 3.161 0.218 15 0 "[ . 1 . ]" 2
59 1 49 VAL H 1 90 HIS O . . 2.300 1.953 1.803 2.233 . 0 0 "[ . 1 . ]" 2
60 1 49 VAL N 1 90 HIS O . 2.800 3.300 2.911 2.753 3.217 0.047 16 0 "[ . 1 . ]" 2
stop_
save_
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