NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
651173 |
6vga   |
30707 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_6vga
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 1272
_Distance_constraint_stats_list.Viol_count 705
_Distance_constraint_stats_list.Viol_total 2146.696
_Distance_constraint_stats_list.Viol_max 0.944
_Distance_constraint_stats_list.Viol_rms 0.0407
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0042
_Distance_constraint_stats_list.Viol_average_violations_only 0.1522
_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 21 MET 0.493 0.472 12 0 "[ . 1 . 2]"
1 22 ARG 0.683 0.356 19 0 "[ . 1 . 2]"
1 23 LEU 0.917 0.472 12 0 "[ . 1 . 2]"
1 24 VAL 2.748 0.521 3 1 "[ + . 1 . 2]"
1 25 VAL 0.106 0.050 16 0 "[ . 1 . 2]"
1 26 LEU 3.715 0.880 8 3 "[ -. + * . 2]"
1 27 ILE 2.604 0.186 3 0 "[ . 1 . 2]"
1 28 VAL 2.859 0.938 15 1 "[ . 1 + 2]"
1 29 SER 2.488 0.369 11 0 "[ . 1 . 2]"
1 30 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 31 ASP 3.525 0.944 8 3 "[ - . + 1 * . 2]"
1 32 LYS 5.685 0.783 18 5 "[* - 1* .* + 2]"
1 33 LYS 1.964 0.820 19 2 "[ . 1 - . +2]"
1 34 LEU 5.879 0.944 8 5 "[ - . + 1 ** . *2]"
1 35 ILE 2.572 0.369 11 0 "[ . 1 . 2]"
1 36 GLU 8.439 0.783 18 6 "[* * * 1* .* + 2]"
1 37 GLU 0.936 0.183 10 0 "[ . 1 . 2]"
1 38 ALA 1.227 0.208 4 0 "[ . 1 . 2]"
1 39 ARG 3.645 0.669 16 3 "[ . * 1 .+ - 2]"
1 40 LYS 1.913 0.524 14 1 "[ . 1 +. 2]"
1 41 MET 3.189 0.524 14 1 "[ . 1 +. 2]"
1 42 ALA 0.204 0.091 7 0 "[ . 1 . 2]"
1 43 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 44 LYS 1.023 0.309 11 0 "[ . 1 . 2]"
1 45 ALA 0.545 0.383 10 0 "[ . 1 . 2]"
1 46 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 47 LEU 0.736 0.084 17 0 "[ . 1 . 2]"
1 48 GLU 5.233 0.605 10 2 "[ -. + . 2]"
1 49 LEU 0.090 0.031 10 0 "[ . 1 . 2]"
1 50 ILE 1.403 0.109 1 0 "[ . 1 . 2]"
1 51 THR 0.393 0.095 10 0 "[ . 1 . 2]"
1 52 VAL 3.864 0.245 15 0 "[ . 1 . 2]"
1 53 PRO 5.474 0.394 15 0 "[ . 1 . 2]"
1 54 GLY 7.590 0.394 15 0 "[ . 1 . 2]"
1 55 SER 4.763 0.690 16 7 "[* * ** 1 * -+ 2]"
1 56 PRO 4.835 0.690 16 7 "[* * ** 1 * -+ 2]"
1 57 GLU 0.020 0.020 7 0 "[ . 1 . 2]"
1 58 GLU 0.050 0.034 14 0 "[ . 1 . 2]"
1 59 ALA 2.905 0.938 15 2 "[ . 1- + 2]"
1 60 ILE 1.527 0.726 11 1 "[ . 1+ . 2]"
1 61 ARG 3.707 0.926 12 4 "[* . 1 + *- 2]"
1 62 LEU 1.820 0.419 15 0 "[ . 1 . 2]"
1 63 ALA 1.455 0.200 15 0 "[ . 1 . 2]"
1 64 GLN 3.679 0.926 12 4 "[* . 1 + *- 2]"
1 65 GLU 7.481 0.403 15 0 "[ . 1 . 2]"
1 66 ILE 10.776 0.875 7 1 "[ . + 1 . 2]"
1 67 ALA 0.276 0.106 8 0 "[ . 1 . 2]"
1 68 GLU 0.021 0.021 8 0 "[ . 1 . 2]"
1 69 LYS 2.135 0.368 13 0 "[ . 1 . 2]"
1 70 ALA 1.973 0.140 14 0 "[ . 1 . 2]"
1 71 PRO 3.276 0.628 14 5 "[ * . * +- * 2]"
1 72 GLY 5.008 0.628 14 5 "[ * . * +- * 2]"
1 73 PRO 0.026 0.026 10 0 "[ . 1 . 2]"
1 74 VAL 0.060 0.034 5 0 "[ . 1 . 2]"
1 75 LYS 0.809 0.254 11 0 "[ . 1 . 2]"
1 76 VAL 5.625 0.875 7 2 "[ - . + 1 . 2]"
1 77 LEU 2.656 0.444 18 0 "[ . 1 . 2]"
1 78 VAL 1.704 0.880 8 1 "[ . + 1 . 2]"
1 79 LEU 1.265 0.613 14 1 "[ . 1 +. 2]"
1 80 ILE 0.426 0.246 7 0 "[ . 1 . 2]"
1 81 THR 1.682 0.319 2 0 "[ . 1 . 2]"
1 82 GLY 0.172 0.128 11 0 "[ . 1 . 2]"
1 83 SER 0.000 0.000 . 0 "[ . 1 . 2]"
1 84 ALA 0.058 0.037 2 0 "[ . 1 . 2]"
1 85 ASP 1.053 0.532 5 1 "[ + 1 . 2]"
1 86 PRO 0.012 0.010 2 0 "[ . 1 . 2]"
1 87 ASP 0.003 0.003 8 0 "[ . 1 . 2]"
1 88 GLU 1.262 0.532 5 1 "[ + 1 . 2]"
1 89 LYS 0.010 0.010 4 0 "[ . 1 . 2]"
1 90 THR 2.589 0.723 19 3 "[ * . - 1 . +2]"
1 91 LYS 0.296 0.153 5 0 "[ . 1 . 2]"
1 92 ALA 4.254 0.786 7 3 "[ * . + 1 . -2]"
1 93 LYS 5.826 0.786 7 3 "[ * . + 1 . *2]"
1 94 LYS 3.902 0.498 9 0 "[ . 1 . 2]"
1 95 ALA 6.875 0.691 1 3 "[+ .- 1* . 2]"
1 96 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 97 GLU 0.963 0.426 11 0 "[ . 1 . 2]"
1 98 GLU 3.180 0.691 1 3 "[+ .- 1* . 2]"
1 99 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 100 ARG 0.758 0.426 11 0 "[ . 1 . 2]"
1 101 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 102 TRP 0.000 0.000 . 0 "[ . 1 . 2]"
1 103 ASN 0.000 0.000 . 0 "[ . 1 . 2]"
1 104 VAL 0.028 0.028 1 0 "[ . 1 . 2]"
1 105 ARG 0.829 0.444 18 0 "[ . 1 . 2]"
1 106 VAL 0.474 0.072 20 0 "[ . 1 . 2]"
1 107 ARG 2.523 0.906 19 1 "[ . 1 . +2]"
1 108 THR 0.454 0.128 11 0 "[ . 1 . 2]"
1 109 VAL 0.668 0.154 11 0 "[ . 1 . 2]"
1 110 THR 0.327 0.066 13 0 "[ . 1 . 2]"
1 111 SER 0.283 0.134 14 0 "[ . 1 . 2]"
1 112 PRO 0.778 0.134 14 0 "[ . 1 . 2]"
1 113 ASP 0.491 0.256 11 0 "[ . 1 . 2]"
1 114 GLU 1.147 0.398 18 0 "[ . 1 . 2]"
1 115 ALA 0.023 0.016 20 0 "[ . 1 . 2]"
1 116 LYS 0.691 0.256 11 0 "[ . 1 . 2]"
1 117 ARG 2.455 0.762 7 1 "[ . + 1 . 2]"
1 118 TRP 2.683 0.906 19 1 "[ . 1 . +2]"
1 119 ILE 6.355 0.786 7 4 "[ . + 1 **-. 2]"
1 120 LYS 0.826 0.762 7 1 "[ . + 1 . 2]"
1 121 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 122 PHE 2.030 0.750 13 1 "[ . 1 + . 2]"
1 123 SER 2.320 0.786 7 2 "[ . + 1 - . 2]"
1 124 GLU 0.348 0.103 14 0 "[ . 1 . 2]"
1 125 GLU 0.069 0.069 7 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 90 THR H 1 90 THR HB 3.507 . 5.260 2.694 2.518 3.572 . 0 0 "[ . 1 . 2]" 1
2 1 89 LYS HB2 1 90 THR H 3.557 . 5.335 3.577 2.403 4.007 . 0 0 "[ . 1 . 2]" 1
3 1 90 THR H 1 90 THR MG 3.822 . 5.733 3.559 1.999 3.791 . 0 0 "[ . 1 . 2]" 1
4 1 78 VAL H 1 78 VAL HB 3.336 . 5.004 2.750 2.537 3.742 . 0 0 "[ . 1 . 2]" 1
5 1 78 VAL H 1 104 VAL QG 3.026 2.002 4.539 3.687 3.168 4.012 . 0 0 "[ . 1 . 2]" 1
6 1 77 LEU QD 1 78 VAL H 3.167 . 4.750 2.488 2.172 3.950 . 0 0 "[ . 1 . 2]" 1
7 1 78 VAL H 1 106 VAL HA 3.506 . 5.259 2.748 2.418 3.319 . 0 0 "[ . 1 . 2]" 1
8 1 77 LEU HA 1 78 VAL H 2.963 . 4.445 2.160 2.119 2.208 . 0 0 "[ . 1 . 2]" 1
9 1 27 ILE H 1 50 ILE HB 4.049 2.122 6.073 4.590 4.100 5.053 . 0 0 "[ . 1 . 2]" 1
10 1 27 ILE H 1 27 ILE HB 3.178 . 4.767 3.094 2.538 3.799 . 0 0 "[ . 1 . 2]" 1
11 1 26 LEU HB2 1 27 ILE H 3.573 2.140 5.359 4.347 4.030 4.533 . 0 0 "[ . 1 . 2]" 1
12 1 27 ILE H 1 50 ILE MG 2.973 . 4.460 4.518 4.399 4.569 0.109 1 0 "[ . 1 . 2]" 1
13 1 27 ILE H 1 49 LEU QD 3.284 . 4.926 3.459 2.857 3.779 . 0 0 "[ . 1 . 2]" 1
14 1 26 LEU HA 1 27 ILE H 2.821 . 4.231 2.142 2.103 2.215 . 0 0 "[ . 1 . 2]" 1
15 1 27 ILE H 1 50 ILE H 3.757 . 5.635 3.849 3.258 4.472 . 0 0 "[ . 1 . 2]" 1
16 1 24 VAL HB 1 76 VAL H 3.206 . 4.809 4.849 4.774 4.937 0.128 15 0 "[ . 1 . 2]" 1
17 1 75 LYS HB3 1 76 VAL H 3.663 . 5.494 3.880 3.053 4.433 . 0 0 "[ . 1 . 2]" 1
18 1 75 LYS HG3 1 76 VAL H 3.570 . 5.355 4.471 3.166 5.609 0.254 11 0 "[ . 1 . 2]" 1
19 1 76 VAL H 1 76 VAL MG1 3.035 . 4.552 3.516 1.995 3.906 . 0 0 "[ . 1 . 2]" 1
20 1 76 VAL H 1 104 VAL QG 3.386 2.108 5.079 3.465 3.006 3.967 . 0 0 "[ . 1 . 2]" 1
21 1 75 LYS HA 1 76 VAL H 2.808 . 4.197 2.179 2.128 2.231 . 0 0 "[ . 1 . 2]" 1
22 1 53 PRO HD2 1 54 GLY H 3.591 2.239 5.387 5.412 4.799 5.781 0.394 15 0 "[ . 1 . 2]" 1
23 1 53 PRO HB2 1 54 GLY H 3.522 2.089 5.283 3.300 2.751 4.160 . 0 0 "[ . 1 . 2]" 1
24 1 53 PRO HG2 1 54 GLY H 3.403 . 5.105 4.881 4.668 5.147 0.042 17 0 "[ . 1 . 2]" 1
25 1 52 VAL QG 1 54 GLY H 2.853 . 4.279 4.081 3.107 4.524 0.245 15 0 "[ . 1 . 2]" 1
26 1 54 GLY H 1 55 SER H 3.952 . 5.928 2.683 2.198 3.054 . 0 0 "[ . 1 . 2]" 1
27 1 81 THR H 1 81 THR HB 3.334 . 4.785 3.033 2.536 3.714 . 0 0 "[ . 1 . 2]" 1
28 1 28 VAL HB 1 81 THR H 3.519 2.038 5.278 3.100 1.944 5.345 0.094 7 0 "[ . 1 . 2]" 1
29 1 80 ILE HB 1 81 THR H 3.289 . 4.933 3.714 2.672 4.406 . 0 0 "[ . 1 . 2]" 1
30 1 81 THR H 1 81 THR MG 3.269 . 4.904 2.941 2.049 3.862 . 0 0 "[ . 1 . 2]" 1
31 1 80 ILE MG 1 81 THR H 3.101 . 4.652 3.363 2.235 4.175 . 0 0 "[ . 1 . 2]" 1
32 1 80 ILE HA 1 81 THR H 2.970 . 4.455 2.191 2.136 2.360 . 0 0 "[ . 1 . 2]" 1
33 1 100 ARG HA 1 104 VAL H 3.518 . 5.277 2.628 1.877 3.124 . 0 0 "[ . 1 . 2]" 1
34 1 104 VAL H 1 104 VAL HB 3.084 . 4.626 2.617 2.509 3.107 . 0 0 "[ . 1 . 2]" 1
35 1 99 ALA MB 1 104 VAL H 3.872 . 5.808 3.945 3.351 4.583 . 0 0 "[ . 1 . 2]" 1
36 1 104 VAL H 1 104 VAL QG 3.131 . 4.697 2.338 2.030 2.612 . 0 0 "[ . 1 . 2]" 1
37 1 103 ASN H 1 104 VAL H 3.472 . 5.194 2.669 2.545 3.034 . 0 0 "[ . 1 . 2]" 1
38 1 113 ASP H 1 113 ASP QB 3.651 . 5.476 2.393 2.258 2.630 . 0 0 "[ . 1 . 2]" 1
39 1 97 GLU HA 1 98 GLU H 3.689 . 5.117 3.506 3.420 3.563 . 0 0 "[ . 1 . 2]" 1
40 1 97 GLU HG3 1 98 GLU H 3.360 . 5.040 4.570 2.858 5.242 0.202 10 0 "[ . 1 . 2]" 1
41 1 98 GLU H 1 98 GLU HB2 2.708 . 4.062 2.527 2.304 2.657 . 0 0 "[ . 1 . 2]" 1
42 1 96 ALA MB 1 98 GLU H 3.881 . 5.821 4.492 4.206 4.819 . 0 0 "[ . 1 . 2]" 1
43 1 98 GLU H 1 99 ALA MB 4.005 2.044 6.008 4.216 4.037 4.399 . 0 0 "[ . 1 . 2]" 1
44 1 98 GLU HA 1 99 ALA H 3.383 . 5.075 3.524 3.405 3.560 . 0 0 "[ . 1 . 2]" 1
45 1 96 ALA HA 1 99 ALA H 3.602 . 5.403 3.414 3.030 3.799 . 0 0 "[ . 1 . 2]" 1
46 1 98 GLU HB2 1 99 ALA H 3.043 . 4.564 3.082 2.321 3.896 . 0 0 "[ . 1 . 2]" 1
47 1 96 ALA MB 1 99 ALA H 3.558 . 5.337 4.589 4.253 4.890 . 0 0 "[ . 1 . 2]" 1
48 1 99 ALA H 1 99 ALA MB 2.740 . 4.110 2.241 2.166 2.284 . 0 0 "[ . 1 . 2]" 1
49 1 60 ILE MG 1 99 ALA H 3.666 2.024 5.499 3.822 3.191 4.726 . 0 0 "[ . 1 . 2]" 1
50 1 99 ALA H 1 100 ARG H 3.295 . 4.895 2.537 2.304 2.737 . 0 0 "[ . 1 . 2]" 1
51 1 91 LYS HA 1 94 LYS H 3.137 . 4.705 3.686 3.087 4.130 . 0 0 "[ . 1 . 2]" 1
52 1 60 ILE HA 1 61 ARG H 3.985 . 5.815 3.526 3.491 3.555 . 0 0 "[ . 1 . 2]" 1
53 1 93 LYS HB2 1 94 LYS H 2.670 . 4.005 3.828 3.715 4.005 0.000 19 0 "[ . 1 . 2]" 1
54 1 61 ARG H 1 61 ARG HB2 2.723 . 4.084 2.405 2.285 2.528 . 0 0 "[ . 1 . 2]" 1
55 1 60 ILE HB 1 61 ARG H 2.927 . 4.391 2.656 2.337 2.949 . 0 0 "[ . 1 . 2]" 1
56 1 61 ARG H 1 61 ARG QG 3.359 . 5.038 2.768 2.162 4.044 . 0 0 "[ . 1 . 2]" 1
57 1 93 LYS QG 1 94 LYS H 3.372 . 5.058 3.280 2.182 3.961 . 0 0 "[ . 1 . 2]" 1
58 1 94 LYS H 1 95 ALA MB 3.341 . 5.012 4.333 4.170 4.572 . 0 0 "[ . 1 . 2]" 1
59 1 60 ILE MG 1 61 ARG H 3.427 2.038 5.140 3.631 3.463 3.889 . 0 0 "[ . 1 . 2]" 1
60 1 61 ARG HA 1 64 GLN H 3.614 . 5.421 3.327 3.009 3.640 . 0 0 "[ . 1 . 2]" 1
61 1 63 ALA HA 1 64 GLN H 3.924 . 5.793 3.533 3.497 3.558 . 0 0 "[ . 1 . 2]" 1
62 1 64 GLN H 1 65 GLU HB2 3.772 . 5.658 4.908 4.661 5.130 . 0 0 "[ . 1 . 2]" 1
63 1 64 GLN H 1 64 GLN HB2 2.859 . 4.289 2.500 2.107 2.767 . 0 0 "[ . 1 . 2]" 1
64 1 63 ALA MB 1 64 GLN H 3.020 . 4.530 2.465 2.307 2.728 . 0 0 "[ . 1 . 2]" 1
65 1 64 GLN H 1 104 VAL QG 3.444 2.015 5.166 3.659 3.210 4.192 . 0 0 "[ . 1 . 2]" 1
66 1 106 VAL H 1 106 VAL HB 3.044 . 4.566 3.218 2.580 3.829 . 0 0 "[ . 1 . 2]" 1
67 1 105 ARG HB3 1 106 VAL H 3.636 . 5.454 3.770 2.861 4.443 . 0 0 "[ . 1 . 2]" 1
68 1 105 ARG HG3 1 106 VAL H 3.734 . 5.601 4.178 2.821 5.393 . 0 0 "[ . 1 . 2]" 1
69 1 96 ALA MB 1 106 VAL H 3.582 . 5.373 3.707 2.710 4.286 . 0 0 "[ . 1 . 2]" 1
70 1 51 THR MG 1 52 VAL H 3.629 . 5.443 3.640 2.685 4.212 . 0 0 "[ . 1 . 2]" 1
71 1 50 ILE MG 1 52 VAL H 2.867 . 4.301 3.825 3.226 4.340 0.039 8 0 "[ . 1 . 2]" 1
72 1 106 VAL H 1 106 VAL QG 2.984 . 4.476 2.147 1.836 2.620 . 0 0 "[ . 1 . 2]" 1
73 1 104 VAL QG 1 106 VAL H 3.724 . 5.586 4.279 3.515 4.834 . 0 0 "[ . 1 . 2]" 1
74 1 51 THR HA 1 52 VAL H 2.970 . 4.401 2.174 2.103 2.272 . 0 0 "[ . 1 . 2]" 1
75 1 105 ARG H 1 105 ARG HB2 3.559 2.101 5.339 3.095 2.461 3.858 . 0 0 "[ . 1 . 2]" 1
76 1 105 ARG H 1 105 ARG HB3 3.629 . 5.444 3.153 2.458 3.809 . 0 0 "[ . 1 . 2]" 1
77 1 104 VAL QG 1 105 ARG H 3.547 . 4.869 2.743 2.301 3.158 . 0 0 "[ . 1 . 2]" 1
78 1 45 ALA H 1 46 ASN HA 3.636 . 5.454 4.565 4.176 4.750 . 0 0 "[ . 1 . 2]" 1
79 1 44 LYS HA 1 45 ALA H 3.396 . 5.094 3.505 3.356 3.587 . 0 0 "[ . 1 . 2]" 1
80 1 42 ALA HA 1 45 ALA H 3.660 . 5.382 3.554 3.227 3.772 . 0 0 "[ . 1 . 2]" 1
81 1 44 LYS HB2 1 45 ALA H 2.961 . 4.442 3.709 2.552 4.053 . 0 0 "[ . 1 . 2]" 1
82 1 45 ALA H 1 47 LEU HG 3.889 . 5.833 4.010 3.131 5.869 0.036 12 0 "[ . 1 . 2]" 1
83 1 42 ALA MB 1 45 ALA H 3.750 . 5.625 4.612 4.342 4.944 . 0 0 "[ . 1 . 2]" 1
84 1 45 ALA H 1 45 ALA MB 2.644 . 3.966 2.327 2.245 2.457 . 0 0 "[ . 1 . 2]" 1
85 1 45 ALA H 1 47 LEU QD 3.849 . 5.774 3.913 2.779 4.452 . 0 0 "[ . 1 . 2]" 1
86 1 45 ALA H 1 47 LEU H 3.718 . 5.577 3.649 3.274 4.201 . 0 0 "[ . 1 . 2]" 1
87 1 65 GLU HA 1 69 LYS H 3.873 . 5.810 4.224 3.877 4.597 . 0 0 "[ . 1 . 2]" 1
88 1 68 GLU HA 1 69 LYS H 3.789 . 5.280 3.497 3.416 3.547 . 0 0 "[ . 1 . 2]" 1
89 1 69 LYS H 1 69 LYS HB2 3.189 . 4.784 2.510 2.350 2.677 . 0 0 "[ . 1 . 2]" 1
90 1 69 LYS H 1 69 LYS HB3 2.981 . 4.472 3.639 3.590 3.721 . 0 0 "[ . 1 . 2]" 1
91 1 67 ALA MB 1 69 LYS H 3.076 . 4.614 4.457 4.275 4.644 0.030 1 0 "[ . 1 . 2]" 1
92 1 69 LYS H 1 70 ALA H 2.932 . 4.233 2.512 2.313 2.766 . 0 0 "[ . 1 . 2]" 1
93 1 68 GLU H 1 69 LYS H 3.165 . 4.708 2.525 2.255 2.792 . 0 0 "[ . 1 . 2]" 1
94 1 41 MET HA 1 44 LYS H 3.522 . 5.283 3.517 3.129 3.843 . 0 0 "[ . 1 . 2]" 1
95 1 44 LYS H 1 44 LYS HA 2.862 . 4.293 2.840 2.790 2.884 . 0 0 "[ . 1 . 2]" 1
96 1 115 ALA HA 1 117 ARG H 2.985 . 4.478 4.261 3.963 4.494 0.016 20 0 "[ . 1 . 2]" 1
97 1 116 LYS HA 1 117 ARG H 3.723 . 5.585 3.501 3.363 3.569 . 0 0 "[ . 1 . 2]" 1
98 1 114 GLU HA 1 117 ARG H 3.460 . 5.190 3.460 2.898 3.747 . 0 0 "[ . 1 . 2]" 1
99 1 43 GLU HG2 1 44 LYS H 3.830 . 5.745 4.212 3.021 5.127 . 0 0 "[ . 1 . 2]" 1
100 1 43 GLU HB3 1 44 LYS H 3.076 . 4.614 3.367 2.540 4.200 . 0 0 "[ . 1 . 2]" 1
101 1 44 LYS H 1 44 LYS HB2 2.545 . 3.817 2.493 2.238 2.731 . 0 0 "[ . 1 . 2]" 1
102 1 117 ARG H 1 117 ARG HB2 2.818 . 4.227 2.774 2.102 3.669 . 0 0 "[ . 1 . 2]" 1
103 1 117 ARG H 1 117 ARG HB3 2.778 . 4.167 2.529 2.338 3.203 . 0 0 "[ . 1 . 2]" 1
104 1 44 LYS H 1 45 ALA MB 3.527 . 5.291 4.363 4.155 4.620 . 0 0 "[ . 1 . 2]" 1
105 1 117 ARG H 1 117 ARG HG2 3.782 . 5.673 3.977 2.181 4.590 . 0 0 "[ . 1 . 2]" 1
106 1 43 GLU H 1 44 LYS H 2.990 . 4.485 2.602 2.500 2.764 . 0 0 "[ . 1 . 2]" 1
107 1 117 ARG H 1 118 TRP H 3.125 . 4.688 2.643 2.449 2.876 . 0 0 "[ . 1 . 2]" 1
108 1 116 LYS H 1 117 ARG H 3.146 . 4.719 2.677 2.496 2.828 . 0 0 "[ . 1 . 2]" 1
109 1 36 GLU HA 1 39 ARG H 3.450 . 5.057 3.594 3.264 3.903 . 0 0 "[ . 1 . 2]" 1
110 1 38 ALA HA 1 39 ARG H 3.036 . 4.554 3.536 3.499 3.562 . 0 0 "[ . 1 . 2]" 1
111 1 39 ARG H 1 39 ARG HB2 3.010 . 4.515 2.510 2.281 2.655 . 0 0 "[ . 1 . 2]" 1
112 1 39 ARG H 1 39 ARG HB3 2.952 . 4.428 2.631 2.378 3.594 . 0 0 "[ . 1 . 2]" 1
113 1 39 ARG H 1 39 ARG HG3 3.347 . 5.020 4.259 2.342 4.517 . 0 0 "[ . 1 . 2]" 1
114 1 39 ARG H 1 39 ARG HG2 3.836 . 5.754 4.383 3.544 4.555 . 0 0 "[ . 1 . 2]" 1
115 1 38 ALA MB 1 39 ARG H 3.041 . 4.561 2.510 2.404 2.685 . 0 0 "[ . 1 . 2]" 1
116 1 39 ARG H 1 49 LEU QD 3.336 . 5.004 3.485 3.027 4.005 . 0 0 "[ . 1 . 2]" 1
117 1 38 ALA H 1 39 ARG H 3.174 . 4.738 2.659 2.597 2.753 . 0 0 "[ . 1 . 2]" 1
118 1 39 ARG H 1 40 LYS H 3.184 . 4.717 2.634 2.441 2.848 . 0 0 "[ . 1 . 2]" 1
119 1 65 GLU HA 1 66 ILE H 3.803 . 5.634 3.562 3.510 3.582 . 0 0 "[ . 1 . 2]" 1
120 1 63 ALA HA 1 66 ILE H 3.761 . 5.551 3.445 2.906 3.724 . 0 0 "[ . 1 . 2]" 1
121 1 65 GLU HB2 1 66 ILE H 3.087 . 4.630 3.240 2.298 3.860 . 0 0 "[ . 1 . 2]" 1
122 1 66 ILE H 1 66 ILE HB 2.959 . 4.439 2.556 2.508 2.629 . 0 0 "[ . 1 . 2]" 1
123 1 66 ILE H 1 66 ILE HG12 3.084 2.014 4.626 3.205 1.988 3.548 0.026 15 0 "[ . 1 . 2]" 1
124 1 66 ILE H 1 67 ALA MB 3.759 . 5.639 4.385 4.201 4.601 . 0 0 "[ . 1 . 2]" 1
125 1 66 ILE H 1 66 ILE HG13 3.326 . 4.989 2.230 1.980 3.571 . 0 0 "[ . 1 . 2]" 1
126 1 62 LEU MD2 1 66 ILE H 3.469 . 5.204 5.178 4.729 5.623 0.419 15 0 "[ . 1 . 2]" 1
127 1 26 LEU QD 1 66 ILE H 3.027 2.065 4.541 4.345 4.070 4.525 . 0 0 "[ . 1 . 2]" 1
128 1 65 GLU H 1 66 ILE H 3.205 . 4.807 2.741 2.480 2.883 . 0 0 "[ . 1 . 2]" 1
129 1 66 ILE H 1 67 ALA H 3.255 . 4.852 2.710 2.504 2.979 . 0 0 "[ . 1 . 2]" 1
130 1 69 LYS HA 1 70 ALA H 3.370 . 5.055 3.221 3.017 3.477 . 0 0 "[ . 1 . 2]" 1
131 1 67 ALA HA 1 70 ALA H 3.728 . 5.592 3.744 3.384 4.047 . 0 0 "[ . 1 . 2]" 1
132 1 70 ALA H 1 71 PRO QD 3.695 . 5.543 4.214 3.986 4.432 . 0 0 "[ . 1 . 2]" 1
133 1 69 LYS HB2 1 70 ALA H 3.702 . 5.553 3.596 2.930 3.954 . 0 0 "[ . 1 . 2]" 1
134 1 69 LYS HB3 1 70 ALA H 3.499 . 5.249 4.294 3.872 4.493 . 0 0 "[ . 1 . 2]" 1
135 1 70 ALA H 1 70 ALA MB 2.522 . 3.783 2.300 2.239 2.351 . 0 0 "[ . 1 . 2]" 1
136 1 70 ALA H 1 74 VAL QG 3.952 . 5.928 3.746 3.371 4.080 . 0 0 "[ . 1 . 2]" 1
137 1 81 THR HB 1 82 GLY H 3.542 . 5.313 3.666 2.497 4.220 . 0 0 "[ . 1 . 2]" 1
138 1 81 THR MG 1 82 GLY H 3.606 2.066 5.409 3.262 2.584 4.015 . 0 0 "[ . 1 . 2]" 1
139 1 82 GLY H 1 108 THR MG 3.973 . 5.959 3.631 3.109 4.459 . 0 0 "[ . 1 . 2]" 1
140 1 81 THR HA 1 82 GLY H 3.185 . 4.305 2.204 2.123 2.361 . 0 0 "[ . 1 . 2]" 1
141 1 22 ARG HA 1 23 LEU H 2.708 . 3.979 2.176 2.125 2.244 . 0 0 "[ . 1 . 2]" 1
142 1 23 LEU H 1 23 LEU HB2 3.085 . 4.627 2.526 2.399 2.639 . 0 0 "[ . 1 . 2]" 1
143 1 23 LEU H 1 23 LEU HG 3.236 . 4.854 3.419 2.452 4.777 . 0 0 "[ . 1 . 2]" 1
144 1 23 LEU H 1 23 LEU HB3 3.553 2.153 5.330 3.588 2.726 3.760 . 0 0 "[ . 1 . 2]" 1
145 1 23 LEU H 1 47 LEU QD 3.600 . 5.400 3.862 2.604 4.985 . 0 0 "[ . 1 . 2]" 1
146 1 23 LEU H 1 23 LEU QD 3.740 2.086 5.610 2.941 2.074 3.845 0.012 9 0 "[ . 1 . 2]" 1
147 1 80 ILE H 1 80 ILE HB 3.279 . 4.919 3.097 2.494 3.716 . 0 0 "[ . 1 . 2]" 1
148 1 80 ILE H 1 80 ILE HG12 3.438 . 5.157 2.874 1.931 4.266 . 0 0 "[ . 1 . 2]" 1
149 1 80 ILE H 1 108 THR MG 3.526 . 5.289 4.434 3.853 4.862 . 0 0 "[ . 1 . 2]" 1
150 1 80 ILE H 1 109 VAL QG 3.897 . 5.846 3.524 2.710 4.109 . 0 0 "[ . 1 . 2]" 1
151 1 79 LEU QD 1 80 ILE H 2.909 . 4.363 3.620 3.119 3.852 . 0 0 "[ . 1 . 2]" 1
152 1 80 ILE H 1 80 ILE MD 3.326 2.011 4.989 3.645 2.102 4.424 . 0 0 "[ . 1 . 2]" 1
153 1 79 LEU HA 1 80 ILE H 2.820 . 4.230 2.171 2.130 2.252 . 0 0 "[ . 1 . 2]" 1
154 1 80 ILE H 1 108 THR HA 3.412 . 5.118 2.919 2.545 3.176 . 0 0 "[ . 1 . 2]" 1
155 1 80 ILE H 1 109 VAL H 3.669 . 5.503 3.750 3.116 4.253 . 0 0 "[ . 1 . 2]" 1
156 1 97 GLU HA 1 100 ARG H 3.744 . 4.974 3.606 3.259 3.997 . 0 0 "[ . 1 . 2]" 1
157 1 100 ARG H 1 100 ARG QB 2.925 . 4.387 2.290 2.196 2.522 . 0 0 "[ . 1 . 2]" 1
158 1 100 ARG H 1 100 ARG HG3 3.300 2.093 4.950 3.900 2.178 4.461 . 0 0 "[ . 1 . 2]" 1
159 1 100 ARG H 1 100 ARG HG2 3.582 . 5.373 4.088 2.301 4.596 . 0 0 "[ . 1 . 2]" 1
160 1 99 ALA MB 1 100 ARG H 3.305 2.005 4.958 3.035 2.785 3.111 . 0 0 "[ . 1 . 2]" 1
161 1 32 LYS HA 1 33 LYS H 3.702 . 4.682 3.499 3.424 3.590 . 0 0 "[ . 1 . 2]" 1
162 1 33 LYS H 1 33 LYS HB3 2.624 . 3.936 2.940 2.329 3.615 . 0 0 "[ . 1 . 2]" 1
163 1 33 LYS H 1 35 ILE HB 3.646 . 5.469 5.321 4.980 5.540 0.071 12 0 "[ . 1 . 2]" 1
164 1 33 LYS H 1 34 LEU HB3 3.759 . 5.638 4.815 4.510 5.133 . 0 0 "[ . 1 . 2]" 1
165 1 33 LYS H 1 34 LEU H 3.008 . 4.146 2.645 2.395 2.793 . 0 0 "[ . 1 . 2]" 1
166 1 32 LYS H 1 33 LYS H 3.834 . 5.751 2.747 2.502 3.206 . 0 0 "[ . 1 . 2]" 1
167 1 59 ALA HA 1 62 LEU H 3.281 . 4.689 3.557 3.113 3.916 . 0 0 "[ . 1 . 2]" 1
168 1 62 LEU H 1 62 LEU HB3 2.737 . 4.105 2.706 2.458 3.020 . 0 0 "[ . 1 . 2]" 1
169 1 61 ARG QG 1 62 LEU H 3.618 . 5.427 4.132 3.878 4.337 . 0 0 "[ . 1 . 2]" 1
170 1 62 LEU H 1 62 LEU HB2 2.943 . 4.414 2.360 2.121 2.678 . 0 0 "[ . 1 . 2]" 1
171 1 62 LEU H 1 62 LEU MD2 3.346 . 5.019 3.956 3.480 4.305 . 0 0 "[ . 1 . 2]" 1
172 1 26 LEU QD 1 62 LEU H 3.522 2.010 5.283 4.001 3.629 4.770 . 0 0 "[ . 1 . 2]" 1
173 1 74 VAL HB 1 75 LYS H 3.250 . 4.875 3.823 2.360 4.214 . 0 0 "[ . 1 . 2]" 1
174 1 75 LYS H 1 75 LYS HB3 3.397 . 5.096 3.352 2.582 3.840 . 0 0 "[ . 1 . 2]" 1
175 1 75 LYS H 1 75 LYS HG2 3.801 . 5.701 3.757 2.428 4.967 . 0 0 "[ . 1 . 2]" 1
176 1 75 LYS H 1 75 LYS HG3 3.912 . 5.868 3.797 2.805 4.794 . 0 0 "[ . 1 . 2]" 1
177 1 74 VAL QG 1 75 LYS H 3.748 . 4.455 2.548 2.277 3.319 . 0 0 "[ . 1 . 2]" 1
178 1 23 LEU QD 1 75 LYS H 3.711 . 5.566 3.384 2.522 4.434 . 0 0 "[ . 1 . 2]" 1
179 1 74 VAL HA 1 75 LYS H 2.755 . 4.045 2.192 2.099 2.365 . 0 0 "[ . 1 . 2]" 1
180 1 23 LEU HA 1 75 LYS H 3.582 . 5.373 2.957 2.339 3.624 . 0 0 "[ . 1 . 2]" 1
181 1 29 SER H 1 29 SER HB3 3.930 . 5.895 3.319 2.630 4.028 . 0 0 "[ . 1 . 2]" 1
182 1 29 SER H 1 29 SER HB2 3.676 . 5.514 3.104 2.380 4.024 . 0 0 "[ . 1 . 2]" 1
183 1 28 VAL MG1 1 29 SER H 3.013 . 4.520 3.038 1.997 4.268 . 0 0 "[ . 1 . 2]" 1
184 1 28 VAL MG2 1 29 SER H 3.407 2.041 5.111 4.041 3.177 4.346 . 0 0 "[ . 1 . 2]" 1
185 1 94 LYS HA 1 97 GLU H 3.231 . 4.846 3.662 3.351 4.278 . 0 0 "[ . 1 . 2]" 1
186 1 96 ALA HA 1 97 GLU H 3.464 . 5.196 3.524 3.477 3.569 . 0 0 "[ . 1 . 2]" 1
187 1 97 GLU H 1 97 GLU HG3 3.200 . 4.800 3.779 2.184 4.554 . 0 0 "[ . 1 . 2]" 1
188 1 97 GLU H 1 97 GLU HG2 3.268 . 4.902 3.820 1.889 4.621 . 0 0 "[ . 1 . 2]" 1
189 1 97 GLU H 1 97 GLU HB2 2.885 . 4.328 2.500 2.097 3.614 . 0 0 "[ . 1 . 2]" 1
190 1 97 GLU H 1 97 GLU HB3 2.892 . 4.338 2.979 2.454 3.633 . 0 0 "[ . 1 . 2]" 1
191 1 96 ALA MB 1 97 GLU H 2.866 . 4.299 2.586 2.295 2.783 . 0 0 "[ . 1 . 2]" 1
192 1 96 ALA H 1 97 GLU H 3.281 . 4.921 2.674 2.585 2.871 . 0 0 "[ . 1 . 2]" 1
193 1 86 PRO HA 1 87 ASP H 3.670 . 5.505 3.580 3.557 3.603 . 0 0 "[ . 1 . 2]" 1
194 1 86 PRO HD3 1 87 ASP H 3.861 . 5.791 4.409 4.239 4.581 . 0 0 "[ . 1 . 2]" 1
195 1 86 PRO HD2 1 87 ASP H 3.637 2.076 5.455 3.359 3.106 3.758 . 0 0 "[ . 1 . 2]" 1
196 1 87 ASP H 1 87 ASP HB3 2.979 . 4.469 3.229 2.397 3.627 . 0 0 "[ . 1 . 2]" 1
197 1 87 ASP H 1 87 ASP HB2 3.212 . 4.818 2.583 2.296 3.600 . 0 0 "[ . 1 . 2]" 1
198 1 86 PRO HB2 1 87 ASP H 3.926 2.216 5.889 2.342 2.213 2.650 0.003 8 0 "[ . 1 . 2]" 1
199 1 86 PRO HG2 1 87 ASP H 3.566 . 5.349 3.838 2.505 4.148 . 0 0 "[ . 1 . 2]" 1
200 1 86 PRO HB3 1 87 ASP H 3.373 . 5.060 3.747 3.646 3.916 . 0 0 "[ . 1 . 2]" 1
201 1 87 ASP H 1 88 GLU H 3.185 . 4.497 2.658 2.435 2.861 . 0 0 "[ . 1 . 2]" 1
202 1 84 ALA HA 1 85 ASP H 3.038 . 4.557 2.156 2.111 2.357 . 0 0 "[ . 1 . 2]" 1
203 1 85 ASP H 1 85 ASP HB3 3.186 . 4.779 3.367 2.414 3.630 . 0 0 "[ . 1 . 2]" 1
204 1 85 ASP H 1 85 ASP HB2 3.161 . 4.741 2.443 2.250 2.623 . 0 0 "[ . 1 . 2]" 1
205 1 85 ASP H 1 88 GLU HB3 3.830 . 5.745 4.093 3.358 4.740 . 0 0 "[ . 1 . 2]" 1
206 1 84 ALA MB 1 85 ASP H 3.326 . 4.989 3.119 2.619 3.351 . 0 0 "[ . 1 . 2]" 1
207 1 119 ILE HA 1 120 LYS H 3.903 . 5.855 3.538 3.498 3.576 . 0 0 "[ . 1 . 2]" 1
208 1 120 LYS H 1 120 LYS HB3 2.938 . 4.407 2.658 2.442 3.609 . 0 0 "[ . 1 . 2]" 1
209 1 120 LYS H 1 120 LYS HB2 2.935 . 4.402 2.550 2.245 3.615 . 0 0 "[ . 1 . 2]" 1
210 1 120 LYS H 1 120 LYS HG3 3.486 . 5.229 4.148 2.268 4.479 . 0 0 "[ . 1 . 2]" 1
211 1 119 ILE MG 1 120 LYS H 3.367 . 5.050 3.352 3.146 3.561 . 0 0 "[ . 1 . 2]" 1
212 1 110 THR H 1 110 THR MG 3.950 2.161 5.925 3.067 2.126 3.866 0.035 6 0 "[ . 1 . 2]" 1
213 1 110 THR H 1 111 SER H 3.875 . 5.316 2.066 1.903 2.452 0.035 16 0 "[ . 1 . 2]" 1
214 1 60 ILE H 1 61 ARG H 3.101 . 4.652 2.592 2.493 2.705 . 0 0 "[ . 1 . 2]" 1
215 1 24 VAL HB 1 77 LEU H 3.777 2.065 5.666 3.915 3.502 4.369 . 0 0 "[ . 1 . 2]" 1
216 1 25 VAL MG1 1 77 LEU H 3.234 . 4.851 4.152 3.678 4.578 . 0 0 "[ . 1 . 2]" 1
217 1 25 VAL MG2 1 77 LEU H 3.015 . 4.522 3.561 2.833 4.056 . 0 0 "[ . 1 . 2]" 1
218 1 77 LEU H 1 78 VAL MG2 3.669 . 5.503 4.585 4.149 5.703 0.200 4 0 "[ . 1 . 2]" 1
219 1 77 LEU H 1 77 LEU QD 3.732 2.135 5.598 3.765 1.814 4.003 0.321 5 0 "[ . 1 . 2]" 1
220 1 76 VAL HA 1 77 LEU H 2.973 . 4.402 2.148 2.107 2.222 . 0 0 "[ . 1 . 2]" 1
221 1 25 VAL HA 1 77 LEU H 3.594 . 5.391 2.715 2.449 3.022 . 0 0 "[ . 1 . 2]" 1
222 1 40 LYS H 1 40 LYS HA 2.832 . 4.244 2.797 2.743 2.824 . 0 0 "[ . 1 . 2]" 1
223 1 39 ARG HA 1 40 LYS H 3.562 . 5.343 3.531 3.497 3.569 . 0 0 "[ . 1 . 2]" 1
224 1 36 GLU QB 1 40 LYS H 3.564 . 5.346 4.651 4.201 4.903 . 0 0 "[ . 1 . 2]" 1
225 1 39 ARG HB2 1 40 LYS H 2.727 . 4.090 3.761 2.699 3.989 . 0 0 "[ . 1 . 2]" 1
226 1 40 LYS H 1 40 LYS HB3 2.826 . 4.239 3.594 3.562 3.610 . 0 0 "[ . 1 . 2]" 1
227 1 40 LYS H 1 40 LYS QG 2.870 . 4.305 2.242 2.078 2.421 . 0 0 "[ . 1 . 2]" 1
228 1 39 ARG HG2 1 40 LYS H 3.807 . 5.711 3.992 3.343 5.045 . 0 0 "[ . 1 . 2]" 1
229 1 62 LEU HA 1 63 ALA H 3.747 . 5.453 3.516 3.452 3.566 . 0 0 "[ . 1 . 2]" 1
230 1 59 ALA HA 1 63 ALA H 3.764 . 4.710 4.119 3.786 4.515 . 0 0 "[ . 1 . 2]" 1
231 1 60 ILE HA 1 63 ALA H 3.678 . 5.517 3.296 3.027 3.582 . 0 0 "[ . 1 . 2]" 1
232 1 62 LEU HB3 1 63 ALA H 3.181 . 4.772 2.636 2.309 2.894 . 0 0 "[ . 1 . 2]" 1
233 1 62 LEU HB2 1 63 ALA H 3.491 . 5.236 3.667 3.266 4.022 . 0 0 "[ . 1 . 2]" 1
234 1 62 LEU HG 1 63 ALA H 3.411 . 5.117 4.511 3.908 5.067 . 0 0 "[ . 1 . 2]" 1
235 1 63 ALA H 1 63 ALA MB 2.737 . 4.106 2.225 2.209 2.241 . 0 0 "[ . 1 . 2]" 1
236 1 62 LEU MD2 1 63 ALA H 3.381 . 5.071 4.613 4.366 4.709 . 0 0 "[ . 1 . 2]" 1
237 1 26 LEU QD 1 63 ALA H 2.991 . 4.486 2.800 2.382 3.457 . 0 0 "[ . 1 . 2]" 1
238 1 90 THR HB 1 91 LYS H 3.485 . 5.228 2.735 2.415 4.092 . 0 0 "[ . 1 . 2]" 1
239 1 91 LYS H 1 91 LYS HB2 3.300 . 4.950 2.418 2.033 2.679 . 0 0 "[ . 1 . 2]" 1
240 1 34 LEU HA 1 35 ILE H 3.433 . 5.150 3.536 3.487 3.573 . 0 0 "[ . 1 . 2]" 1
241 1 34 LEU HB2 1 35 ILE H 3.212 . 4.818 3.823 3.629 4.036 . 0 0 "[ . 1 . 2]" 1
242 1 35 ILE H 1 35 ILE HB 2.911 . 4.367 2.509 2.292 2.679 . 0 0 "[ . 1 . 2]" 1
243 1 35 ILE H 1 35 ILE HG12 3.029 . 4.544 3.376 2.097 4.178 . 0 0 "[ . 1 . 2]" 1
244 1 34 LEU HG 1 35 ILE H 3.900 . 5.850 3.971 3.273 5.255 . 0 0 "[ . 1 . 2]" 1
245 1 35 ILE H 1 35 ILE HG13 2.975 2.141 4.462 2.388 1.891 4.027 0.250 13 0 "[ . 1 . 2]" 1
246 1 35 ILE H 1 35 ILE MD 3.083 . 4.625 3.448 1.939 3.755 . 0 0 "[ . 1 . 2]" 1
247 1 34 LEU H 1 35 ILE H 3.270 . 4.905 2.647 2.357 2.869 . 0 0 "[ . 1 . 2]" 1
248 1 108 THR HB 1 109 VAL H 3.855 . 5.293 4.029 3.041 4.175 . 0 0 "[ . 1 . 2]" 1
249 1 109 VAL H 1 109 VAL HB 3.703 . 5.555 3.175 2.499 3.816 . 0 0 "[ . 1 . 2]" 1
250 1 108 THR MG 1 109 VAL H 3.203 . 4.804 2.670 2.397 3.512 . 0 0 "[ . 1 . 2]" 1
251 1 109 VAL H 1 109 VAL QG 3.527 . 4.644 2.309 1.856 2.807 0.012 17 0 "[ . 1 . 2]" 1
252 1 108 THR HA 1 109 VAL H 2.755 . 4.066 2.156 2.115 2.193 . 0 0 "[ . 1 . 2]" 1
253 1 92 ALA H 1 93 LYS HA 3.381 . 5.072 5.142 5.095 5.195 0.123 7 0 "[ . 1 . 2]" 1
254 1 91 LYS HB2 1 92 ALA H 3.336 . 5.004 2.846 2.343 3.824 . 0 0 "[ . 1 . 2]" 1
255 1 92 ALA H 1 92 ALA MB 2.768 . 4.152 2.242 2.222 2.253 . 0 0 "[ . 1 . 2]" 1
256 1 56 PRO HA 1 59 ALA H 3.618 . 5.427 3.726 3.144 4.449 . 0 0 "[ . 1 . 2]" 1
257 1 59 ALA H 1 59 ALA HA 2.953 . 4.429 2.814 2.786 2.857 . 0 0 "[ . 1 . 2]" 1
258 1 52 VAL HB 1 59 ALA H 3.306 . 4.959 4.781 4.251 5.033 0.074 18 0 "[ . 1 . 2]" 1
259 1 59 ALA H 1 60 ILE HG12 3.854 . 5.781 4.807 3.742 6.507 0.726 11 1 "[ . 1+ . 2]" 1
260 1 59 ALA H 1 59 ALA MB 2.665 . 3.998 2.232 2.202 2.257 . 0 0 "[ . 1 . 2]" 1
261 1 52 VAL QG 1 59 ALA H 3.212 . 4.818 3.221 2.496 4.390 . 0 0 "[ . 1 . 2]" 1
262 1 28 VAL MG2 1 59 ALA H 3.480 . 5.220 3.997 3.130 6.158 0.938 15 1 "[ . 1 + 2]" 1
263 1 59 ALA H 1 60 ILE H 3.163 . 4.356 2.691 2.526 2.865 . 0 0 "[ . 1 . 2]" 1
264 1 25 VAL HB 1 50 ILE H 3.980 . 5.970 3.902 3.517 4.320 . 0 0 "[ . 1 . 2]" 1
265 1 49 LEU HB2 1 50 ILE H 3.988 . 5.982 4.312 4.097 4.478 . 0 0 "[ . 1 . 2]" 1
266 1 50 ILE H 1 50 ILE HB 3.300 . 4.950 2.608 2.477 2.733 . 0 0 "[ . 1 . 2]" 1
267 1 42 ALA MB 1 50 ILE H 3.814 . 5.721 5.504 5.266 5.747 0.026 4 0 "[ . 1 . 2]" 1
268 1 49 LEU HG 1 50 ILE H 3.294 . 4.941 3.518 2.476 4.972 0.031 10 0 "[ . 1 . 2]" 1
269 1 49 LEU HB3 1 50 ILE H 3.703 . 5.555 4.124 4.005 4.251 . 0 0 "[ . 1 . 2]" 1
270 1 50 ILE H 1 50 ILE MG 3.365 . 5.047 3.806 3.707 3.880 . 0 0 "[ . 1 . 2]" 1
271 1 49 LEU QD 1 50 ILE H 2.981 . 4.471 2.683 2.203 3.059 . 0 0 "[ . 1 . 2]" 1
272 1 26 LEU HA 1 50 ILE H 3.354 . 4.720 2.793 2.447 3.293 . 0 0 "[ . 1 . 2]" 1
273 1 49 LEU HA 1 50 ILE H 2.831 . 4.247 2.120 2.086 2.166 . 0 0 "[ . 1 . 2]" 1
274 1 106 VAL HB 1 107 ARG H 3.728 . 5.592 3.601 2.885 4.201 . 0 0 "[ . 1 . 2]" 1
275 1 107 ARG H 1 107 ARG HB2 3.492 . 5.238 3.032 2.528 3.935 . 0 0 "[ . 1 . 2]" 1
276 1 107 ARG H 1 107 ARG HB3 3.541 . 5.312 3.521 2.670 3.868 . 0 0 "[ . 1 . 2]" 1
277 1 79 LEU QD 1 107 ARG H 3.113 . 4.670 3.276 2.613 3.688 . 0 0 "[ . 1 . 2]" 1
278 1 106 VAL QG 1 107 ARG H 2.848 . 4.272 3.037 2.498 3.536 . 0 0 "[ . 1 . 2]" 1
279 1 77 LEU QD 1 107 ARG H 3.734 2.080 5.601 3.492 2.965 4.437 . 0 0 "[ . 1 . 2]" 1
280 1 80 ILE H 1 107 ARG H 3.801 . 5.701 3.489 3.111 3.823 . 0 0 "[ . 1 . 2]" 1
281 1 79 LEU HA 1 107 ARG H 3.641 . 5.462 3.119 2.849 3.353 . 0 0 "[ . 1 . 2]" 1
282 1 106 VAL HA 1 107 ARG H 2.793 . 4.190 2.173 2.129 2.216 . 0 0 "[ . 1 . 2]" 1
283 1 101 LYS HA 1 102 TRP H 3.884 . 5.826 3.419 3.281 3.512 . 0 0 "[ . 1 . 2]" 1
284 1 102 TRP H 1 102 TRP HB2 3.881 . 5.822 2.516 2.408 2.652 . 0 0 "[ . 1 . 2]" 1
285 1 102 TRP H 1 102 TRP HB3 3.744 . 5.616 3.652 3.050 3.771 . 0 0 "[ . 1 . 2]" 1
286 1 102 TRP H 1 103 ASN H 3.834 . 5.100 2.447 2.150 2.661 . 0 0 "[ . 1 . 2]" 1
287 1 40 LYS HA 1 41 MET H 3.415 . 5.122 3.535 3.495 3.560 . 0 0 "[ . 1 . 2]" 1
288 1 38 ALA HA 1 41 MET H 3.397 . 5.096 3.582 3.332 3.909 . 0 0 "[ . 1 . 2]" 1
289 1 41 MET H 1 41 MET HG3 3.605 2.062 5.407 3.483 2.059 3.961 0.003 7 0 "[ . 1 . 2]" 1
290 1 41 MET H 1 41 MET HG2 3.457 . 5.186 2.520 1.974 3.450 0.008 4 0 "[ . 1 . 2]" 1
291 1 41 MET H 1 41 MET HB2 2.721 . 4.082 2.497 2.266 3.586 . 0 0 "[ . 1 . 2]" 1
292 1 40 LYS HB2 1 41 MET H 3.066 . 4.599 2.579 2.354 2.778 . 0 0 "[ . 1 . 2]" 1
293 1 40 LYS HB3 1 41 MET H 3.221 . 4.832 3.551 3.261 3.817 . 0 0 "[ . 1 . 2]" 1
294 1 40 LYS QG 1 41 MET H 3.574 . 5.361 4.079 3.926 4.199 . 0 0 "[ . 1 . 2]" 1
295 1 41 MET H 1 42 ALA MB 3.560 2.082 5.340 4.256 4.086 4.403 . 0 0 "[ . 1 . 2]" 1
296 1 41 MET H 1 119 ILE MG 3.884 . 5.826 4.794 4.403 5.537 . 0 0 "[ . 1 . 2]" 1
297 1 41 MET H 1 42 ALA H 2.987 . 4.480 2.579 2.384 2.776 . 0 0 "[ . 1 . 2]" 1
298 1 95 ALA HA 1 96 ALA H 3.759 . 5.638 3.532 3.497 3.564 . 0 0 "[ . 1 . 2]" 1
299 1 93 LYS HA 1 96 ALA H 3.717 . 5.576 3.653 3.296 4.019 . 0 0 "[ . 1 . 2]" 1
300 1 96 ALA H 1 96 ALA MB 2.711 . 4.067 2.239 2.226 2.256 . 0 0 "[ . 1 . 2]" 1
301 1 60 ILE MD 1 96 ALA H 3.484 2.158 5.226 3.849 2.573 5.146 . 0 0 "[ . 1 . 2]" 1
302 1 96 ALA H 1 106 VAL QG 3.500 . 5.250 3.896 3.546 4.263 . 0 0 "[ . 1 . 2]" 1
303 1 95 ALA H 1 96 ALA H 3.339 . 4.919 2.642 2.382 2.752 . 0 0 "[ . 1 . 2]" 1
304 1 28 VAL H 1 28 VAL HB 3.361 . 5.042 2.696 2.301 3.704 . 0 0 "[ . 1 . 2]" 1
305 1 27 ILE HB 1 28 VAL H 3.748 . 5.622 3.995 2.800 4.479 . 0 0 "[ . 1 . 2]" 1
306 1 27 ILE QG 1 28 VAL H 3.622 2.422 5.433 3.028 2.236 4.835 0.186 3 0 "[ . 1 . 2]" 1
307 1 28 VAL H 1 28 VAL MG1 3.118 . 4.677 3.598 2.074 3.859 . 0 0 "[ . 1 . 2]" 1
308 1 28 VAL H 1 28 VAL MG2 3.039 . 4.558 2.390 1.944 3.830 . 0 0 "[ . 1 . 2]" 1
309 1 27 ILE HA 1 28 VAL H 2.856 . 4.284 2.176 2.116 2.241 . 0 0 "[ . 1 . 2]" 1
310 1 28 VAL H 1 80 ILE HA 3.733 . 5.600 3.372 2.836 4.105 . 0 0 "[ . 1 . 2]" 1
311 1 72 GLY H 1 73 PRO HD2 3.883 . 5.824 5.156 4.586 5.414 . 0 0 "[ . 1 . 2]" 1
312 1 71 PRO HG2 1 72 GLY H 3.455 . 5.183 5.247 5.041 5.811 0.628 14 5 "[ * . * +- * 2]" 1
313 1 70 ALA MB 1 72 GLY H 2.888 . 4.332 4.431 4.399 4.472 0.140 14 0 "[ . 1 . 2]" 1
314 1 94 LYS HA 1 95 ALA H 3.584 . 5.376 3.541 3.507 3.566 . 0 0 "[ . 1 . 2]" 1
315 1 91 LYS HA 1 95 ALA H 3.799 . 5.698 4.056 3.157 4.532 . 0 0 "[ . 1 . 2]" 1
316 1 92 ALA HA 1 95 ALA H 3.495 . 5.243 3.613 3.264 4.276 . 0 0 "[ . 1 . 2]" 1
317 1 94 LYS HB2 1 95 ALA H 2.951 . 4.427 3.287 2.438 3.845 . 0 0 "[ . 1 . 2]" 1
318 1 95 ALA H 1 95 ALA MB 2.643 . 3.964 2.232 2.207 2.260 . 0 0 "[ . 1 . 2]" 1
319 1 112 PRO HA 1 115 ALA H 3.631 . 5.446 3.424 3.086 3.766 . 0 0 "[ . 1 . 2]" 1
320 1 114 GLU HA 1 115 ALA H 3.797 . 5.570 3.536 3.475 3.569 . 0 0 "[ . 1 . 2]" 1
321 1 114 GLU HB2 1 115 ALA H 3.382 . 5.073 2.741 2.234 3.879 . 0 0 "[ . 1 . 2]" 1
322 1 114 GLU HB3 1 115 ALA H 3.484 2.097 5.226 3.368 2.470 3.865 . 0 0 "[ . 1 . 2]" 1
323 1 115 ALA H 1 115 ALA MB 2.667 . 4.000 2.233 2.208 2.243 . 0 0 "[ . 1 . 2]" 1
324 1 109 VAL QG 1 115 ALA H 3.557 . 5.335 2.812 2.142 4.222 . 0 0 "[ . 1 . 2]" 1
325 1 34 LEU QD 1 115 ALA H 3.655 2.133 5.482 3.739 3.285 4.281 . 0 0 "[ . 1 . 2]" 1
326 1 115 ALA H 1 116 LYS H 3.112 . 4.668 2.773 2.595 2.916 . 0 0 "[ . 1 . 2]" 1
327 1 64 GLN HA 1 67 ALA H 3.701 . 5.552 3.633 3.380 3.916 . 0 0 "[ . 1 . 2]" 1
328 1 66 ILE HB 1 67 ALA H 3.104 . 4.656 2.625 2.176 2.793 . 0 0 "[ . 1 . 2]" 1
329 1 67 ALA H 1 70 ALA MB 3.785 . 5.678 4.557 4.179 4.868 . 0 0 "[ . 1 . 2]" 1
330 1 67 ALA H 1 67 ALA MB 2.736 . 4.104 2.234 2.202 2.253 . 0 0 "[ . 1 . 2]" 1
331 1 67 ALA H 1 74 VAL QG 3.840 2.067 5.760 4.087 3.714 4.818 . 0 0 "[ . 1 . 2]" 1
332 1 67 ALA H 1 76 VAL MG1 3.508 2.143 5.262 4.515 3.499 5.368 0.106 8 0 "[ . 1 . 2]" 1
333 1 66 ILE MG 1 67 ALA H 3.147 2.012 4.720 3.443 2.925 3.654 . 0 0 "[ . 1 . 2]" 1
334 1 67 ALA H 1 68 GLU H 3.203 . 4.742 2.655 2.528 2.828 . 0 0 "[ . 1 . 2]" 1
335 1 43 GLU H 1 43 GLU HA 2.979 . 4.270 2.825 2.796 2.857 . 0 0 "[ . 1 . 2]" 1
336 1 40 LYS HA 1 43 GLU H 3.464 . 5.196 3.704 3.254 4.206 . 0 0 "[ . 1 . 2]" 1
337 1 42 ALA HA 1 43 GLU H 3.666 . 4.951 3.555 3.513 3.583 . 0 0 "[ . 1 . 2]" 1
338 1 43 GLU H 1 43 GLU HG2 3.212 . 4.818 3.361 1.963 4.602 . 0 0 "[ . 1 . 2]" 1
339 1 43 GLU H 1 43 GLU HG3 3.369 . 5.054 3.811 2.179 4.506 . 0 0 "[ . 1 . 2]" 1
340 1 43 GLU H 1 43 GLU HB2 2.839 . 4.258 2.636 2.355 3.631 . 0 0 "[ . 1 . 2]" 1
341 1 43 GLU H 1 43 GLU HB3 2.852 . 4.278 2.989 2.459 3.608 . 0 0 "[ . 1 . 2]" 1
342 1 43 GLU H 1 44 LYS HB2 3.635 . 5.452 4.851 4.550 5.069 . 0 0 "[ . 1 . 2]" 1
343 1 42 ALA MB 1 43 GLU H 2.908 . 4.362 2.420 2.211 2.585 . 0 0 "[ . 1 . 2]" 1
344 1 42 ALA H 1 43 GLU H 3.136 . 4.704 2.718 2.562 2.844 . 0 0 "[ . 1 . 2]" 1
345 1 113 ASP HA 1 116 LYS H 3.697 . 5.364 3.671 3.456 3.868 . 0 0 "[ . 1 . 2]" 1
346 1 115 ALA HA 1 116 LYS H 3.660 . 5.490 3.544 3.508 3.578 . 0 0 "[ . 1 . 2]" 1
347 1 112 PRO HB2 1 116 LYS H 3.795 . 5.692 5.246 4.715 5.747 0.055 17 0 "[ . 1 . 2]" 1
348 1 116 LYS H 1 116 LYS HB3 2.810 . 4.215 2.685 2.318 3.607 . 0 0 "[ . 1 . 2]" 1
349 1 115 ALA MB 1 116 LYS H 2.927 . 4.391 2.400 2.163 2.576 . 0 0 "[ . 1 . 2]" 1
350 1 34 LEU QD 1 116 LYS H 3.810 2.101 5.715 4.374 2.817 5.315 . 0 0 "[ . 1 . 2]" 1
351 1 62 LEU HA 1 65 GLU H 3.529 . 4.800 3.284 3.030 3.705 . 0 0 "[ . 1 . 2]" 1
352 1 64 GLN HA 1 65 GLU H 3.836 . 5.517 3.526 3.488 3.548 . 0 0 "[ . 1 . 2]" 1
353 1 65 GLU H 1 65 GLU HB2 2.658 . 3.987 2.453 2.227 2.532 . 0 0 "[ . 1 . 2]" 1
354 1 64 GLN HB2 1 65 GLU H 3.106 2.130 4.659 3.552 2.540 4.023 . 0 0 "[ . 1 . 2]" 1
355 1 65 GLU H 1 66 ILE HG12 3.855 . 5.782 5.711 4.010 6.091 0.309 10 0 "[ . 1 . 2]" 1
356 1 25 VAL H 1 25 VAL HB 3.057 . 4.586 2.745 2.633 2.858 . 0 0 "[ . 1 . 2]" 1
357 1 25 VAL H 1 25 VAL MG1 3.177 . 4.766 3.894 3.835 3.937 . 0 0 "[ . 1 . 2]" 1
358 1 25 VAL H 1 25 VAL MG2 2.798 . 4.197 2.656 2.404 2.876 . 0 0 "[ . 1 . 2]" 1
359 1 25 VAL H 1 49 LEU QD 3.075 2.003 4.612 4.193 3.640 4.431 . 0 0 "[ . 1 . 2]" 1
360 1 25 VAL H 1 49 LEU HA 3.477 . 5.216 2.773 2.409 3.452 . 0 0 "[ . 1 . 2]" 1
361 1 113 ASP HA 1 114 GLU H 3.663 . 5.494 3.511 3.445 3.589 . 0 0 "[ . 1 . 2]" 1
362 1 111 SER HB2 1 114 GLU H 3.776 . 5.664 3.628 2.767 5.029 . 0 0 "[ . 1 . 2]" 1
363 1 113 ASP QB 1 114 GLU H 3.187 . 4.781 2.737 2.257 3.663 . 0 0 "[ . 1 . 2]" 1
364 1 114 GLU H 1 114 GLU HB2 3.003 . 4.504 2.479 2.299 2.683 . 0 0 "[ . 1 . 2]" 1
365 1 114 GLU H 1 114 GLU HG3 3.397 . 5.096 3.123 2.078 4.500 . 0 0 "[ . 1 . 2]" 1
366 1 114 GLU H 1 114 GLU HB3 3.247 . 4.871 3.399 2.488 3.630 . 0 0 "[ . 1 . 2]" 1
367 1 114 GLU H 1 115 ALA MB 3.846 . 5.769 4.281 4.148 4.400 . 0 0 "[ . 1 . 2]" 1
368 1 55 SER HB2 1 57 GLU H 3.778 . 5.667 3.422 2.698 4.250 . 0 0 "[ . 1 . 2]" 1
369 1 56 PRO HA 1 57 GLU H 3.817 . 5.726 3.529 3.478 3.598 . 0 0 "[ . 1 . 2]" 1
370 1 56 PRO HD3 1 57 GLU H 3.280 . 4.920 3.922 3.786 4.113 . 0 0 "[ . 1 . 2]" 1
371 1 56 PRO QB 1 57 GLU H 3.110 2.075 4.016 2.876 2.210 3.375 . 0 0 "[ . 1 . 2]" 1
372 1 57 GLU H 1 92 ALA MB 3.805 2.070 5.707 4.490 3.476 5.727 0.020 7 0 "[ . 1 . 2]" 1
373 1 57 GLU H 1 58 GLU H 3.337 . 5.006 2.669 2.497 2.953 . 0 0 "[ . 1 . 2]" 1
374 1 55 SER HA 1 57 GLU H 3.677 . 5.515 4.074 3.690 4.477 . 0 0 "[ . 1 . 2]" 1
375 1 103 ASN H 1 103 ASN HB2 3.775 . 5.663 3.334 3.073 3.577 . 0 0 "[ . 1 . 2]" 1
376 1 121 GLU HA 1 124 GLU H 3.445 . 5.167 3.800 3.124 4.568 . 0 0 "[ . 1 . 2]" 1
377 1 123 SER HA 1 124 GLU H 3.321 . 4.981 3.510 3.340 3.585 . 0 0 "[ . 1 . 2]" 1
378 1 124 GLU H 1 124 GLU HG2 3.221 . 4.831 3.960 2.017 4.934 0.103 14 0 "[ . 1 . 2]" 1
379 1 124 GLU H 1 124 GLU HB3 3.127 . 4.691 3.398 2.482 4.121 . 0 0 "[ . 1 . 2]" 1
380 1 124 GLU H 1 124 GLU HB2 2.974 . 4.461 2.920 2.435 3.673 . 0 0 "[ . 1 . 2]" 1
381 1 123 SER H 1 124 GLU H 3.215 . 4.823 2.564 2.262 3.112 . 0 0 "[ . 1 . 2]" 1
382 1 79 LEU H 1 79 LEU HB3 3.370 2.075 5.055 3.637 2.724 3.746 . 0 0 "[ . 1 . 2]" 1
383 1 79 LEU H 1 79 LEU HB2 3.581 2.082 5.371 2.512 2.423 2.656 . 0 0 "[ . 1 . 2]" 1
384 1 25 VAL MG1 1 79 LEU H 3.745 . 5.617 3.975 3.439 4.501 . 0 0 "[ . 1 . 2]" 1
385 1 78 VAL MG1 1 79 LEU H 3.166 . 4.749 2.950 2.516 3.940 . 0 0 "[ . 1 . 2]" 1
386 1 78 VAL MG2 1 79 LEU H 2.883 . 4.325 3.923 2.557 4.212 . 0 0 "[ . 1 . 2]" 1
387 1 79 LEU H 1 80 ILE H 3.765 . 5.647 4.179 4.037 4.377 . 0 0 "[ . 1 . 2]" 1
388 1 27 ILE HA 1 79 LEU H 3.524 . 5.286 2.558 2.241 2.994 . 0 0 "[ . 1 . 2]" 1
389 1 78 VAL HA 1 79 LEU H 2.916 . 4.374 2.133 2.080 2.168 . 0 0 "[ . 1 . 2]" 1
390 1 26 LEU H 1 79 LEU H 3.856 . 5.784 3.930 3.660 4.345 . 0 0 "[ . 1 . 2]" 1
391 1 108 THR H 1 108 THR HB 3.053 . 4.480 2.649 2.457 3.592 . 0 0 "[ . 1 . 2]" 1
392 1 107 ARG HB2 1 108 THR H 3.316 . 4.974 3.744 2.411 4.400 . 0 0 "[ . 1 . 2]" 1
393 1 107 ARG HB3 1 108 THR H 3.565 . 5.347 3.292 2.573 4.387 . 0 0 "[ . 1 . 2]" 1
394 1 107 ARG HG3 1 108 THR H 3.771 . 5.657 4.337 1.989 5.485 . 0 0 "[ . 1 . 2]" 1
395 1 31 ASP H 1 31 ASP HB3 3.276 2.055 4.914 2.782 2.532 3.745 . 0 0 "[ . 1 . 2]" 1
396 1 31 ASP H 1 31 ASP HB2 3.334 . 5.001 2.677 2.326 3.154 . 0 0 "[ . 1 . 2]" 1
397 1 31 ASP H 1 34 LEU QD 3.761 2.027 5.641 4.316 3.470 5.425 . 0 0 "[ . 1 . 2]" 1
398 1 122 PHE H 1 122 PHE HB2 3.407 . 5.111 2.428 2.169 2.675 . 0 0 "[ . 1 . 2]" 1
399 1 122 PHE H 1 122 PHE HB3 3.414 . 5.121 2.956 2.382 3.607 . 0 0 "[ . 1 . 2]" 1
400 1 121 GLU HB2 1 122 PHE H 3.702 2.024 5.553 3.602 2.456 3.986 . 0 0 "[ . 1 . 2]" 1
401 1 121 GLU H 1 122 PHE H 3.687 . 4.983 2.618 2.466 2.727 . 0 0 "[ . 1 . 2]" 1
402 1 123 SER H 1 123 SER HB3 3.279 . 4.919 2.984 2.374 3.629 . 0 0 "[ . 1 . 2]" 1
403 1 123 SER H 1 123 SER HA 2.856 . 4.284 2.854 2.787 2.910 . 0 0 "[ . 1 . 2]" 1
404 1 122 PHE HB2 1 123 SER H 3.589 . 5.383 3.605 2.900 4.089 . 0 0 "[ . 1 . 2]" 1
405 1 122 PHE HB3 1 123 SER H 3.409 . 5.114 3.228 2.469 3.985 . 0 0 "[ . 1 . 2]" 1
406 1 47 LEU QD 1 123 SER H 3.631 . 5.447 3.833 3.339 4.617 . 0 0 "[ . 1 . 2]" 1
407 1 21 MET HA 1 22 ARG H 2.736 . 3.992 2.194 2.122 2.330 . 0 0 "[ . 1 . 2]" 1
408 1 22 ARG H 1 73 PRO HB2 3.549 . 5.323 4.152 2.985 5.349 0.026 10 0 "[ . 1 . 2]" 1
409 1 22 ARG H 1 22 ARG HB2 3.151 . 4.727 2.625 2.389 2.943 . 0 0 "[ . 1 . 2]" 1
410 1 22 ARG H 1 22 ARG HB3 3.034 . 4.551 3.212 2.487 3.811 . 0 0 "[ . 1 . 2]" 1
411 1 22 ARG H 1 74 VAL QG 3.821 2.124 5.731 3.633 2.367 4.573 . 0 0 "[ . 1 . 2]" 1
412 1 22 ARG H 1 74 VAL HA 3.271 . 4.906 2.947 2.281 3.920 . 0 0 "[ . 1 . 2]" 1
413 1 22 ARG H 1 75 LYS H 3.992 . 5.988 4.292 3.625 5.379 . 0 0 "[ . 1 . 2]" 1
414 1 22 ARG H 1 23 LEU H 3.987 . 5.980 4.233 3.783 4.611 . 0 0 "[ . 1 . 2]" 1
415 1 32 LYS H 1 32 LYS HB2 3.117 . 4.675 2.762 2.325 3.598 . 0 0 "[ . 1 . 2]" 1
416 1 59 ALA HA 1 60 ILE H 3.654 . 5.481 3.539 3.502 3.584 . 0 0 "[ . 1 . 2]" 1
417 1 60 ILE H 1 60 ILE HB 2.975 . 4.463 2.654 2.468 2.826 . 0 0 "[ . 1 . 2]" 1
418 1 60 ILE H 1 95 ALA MB 3.708 . 5.562 4.559 4.186 4.940 . 0 0 "[ . 1 . 2]" 1
419 1 59 ALA MB 1 60 ILE H 3.162 . 4.743 2.511 2.231 2.768 . 0 0 "[ . 1 . 2]" 1
420 1 60 ILE H 1 60 ILE MD 2.900 . 4.350 3.117 1.835 3.682 . 0 0 "[ . 1 . 2]" 1
421 1 86 PRO HA 1 89 LYS H 3.869 . 5.148 3.783 3.473 3.957 . 0 0 "[ . 1 . 2]" 1
422 1 116 LYS HA 1 119 ILE H 3.732 . 5.228 3.740 3.171 4.186 . 0 0 "[ . 1 . 2]" 1
423 1 118 TRP HB2 1 119 ILE H 3.453 . 5.179 2.791 2.372 3.983 . 0 0 "[ . 1 . 2]" 1
424 1 119 ILE H 1 119 ILE HG12 3.063 . 4.594 3.372 2.084 3.535 . 0 0 "[ . 1 . 2]" 1
425 1 89 LYS H 1 89 LYS HB3 2.821 . 4.232 2.764 2.450 3.598 . 0 0 "[ . 1 . 2]" 1
426 1 89 LYS H 1 92 ALA MB 3.342 2.150 5.013 4.702 4.299 5.023 0.010 4 0 "[ . 1 . 2]" 1
427 1 118 TRP HA 1 119 ILE H 3.070 . 4.605 3.532 3.458 3.561 . 0 0 "[ . 1 . 2]" 1
428 1 73 PRO HB3 1 74 VAL H 3.382 . 5.073 3.799 3.509 4.135 . 0 0 "[ . 1 . 2]" 1
429 1 73 PRO HB2 1 74 VAL H 3.073 . 4.609 3.811 3.214 4.001 . 0 0 "[ . 1 . 2]" 1
430 1 74 VAL H 1 74 VAL QG 3.073 2.033 4.609 2.333 2.068 2.787 . 0 0 "[ . 1 . 2]" 1
431 1 124 GLU HA 1 125 GLU H 3.248 . 4.872 2.994 2.129 3.576 . 0 0 "[ . 1 . 2]" 1
432 1 124 GLU HB3 1 125 GLU H 3.708 . 5.562 3.284 1.785 4.449 0.069 7 0 "[ . 1 . 2]" 1
433 1 125 GLU H 1 125 GLU HB2 2.677 . 4.016 3.057 2.397 3.820 . 0 0 "[ . 1 . 2]" 1
434 1 51 THR HB 1 52 VAL H 3.747 . 5.620 3.773 2.996 4.413 . 0 0 "[ . 1 . 2]" 1
435 1 52 VAL H 1 52 VAL HB 3.240 . 4.860 2.736 2.372 3.789 . 0 0 "[ . 1 . 2]" 1
436 1 117 ARG HA 1 121 GLU H 3.567 . 5.351 4.190 3.871 4.621 . 0 0 "[ . 1 . 2]" 1
437 1 121 GLU H 1 121 GLU HB3 2.935 . 4.403 2.791 2.476 3.593 . 0 0 "[ . 1 . 2]" 1
438 1 120 LYS HB3 1 121 GLU H 3.153 2.030 4.729 2.757 2.328 3.980 . 0 0 "[ . 1 . 2]" 1
439 1 120 LYS HB2 1 121 GLU H 3.385 . 5.078 3.717 2.492 3.897 . 0 0 "[ . 1 . 2]" 1
440 1 120 LYS HG2 1 121 GLU H 3.882 . 5.823 4.215 2.866 5.005 . 0 0 "[ . 1 . 2]" 1
441 1 34 LEU HA 1 38 ALA H 3.126 2.039 4.689 3.970 3.409 4.374 . 0 0 "[ . 1 . 2]" 1
442 1 35 ILE HA 1 38 ALA H 3.844 . 5.575 3.811 3.406 4.169 . 0 0 "[ . 1 . 2]" 1
443 1 38 ALA H 1 39 ARG HB2 3.355 2.050 5.033 4.997 4.615 5.207 0.174 6 0 "[ . 1 . 2]" 1
444 1 38 ALA H 1 115 ALA MB 3.923 2.458 5.885 4.784 3.562 5.835 . 0 0 "[ . 1 . 2]" 1
445 1 38 ALA H 1 38 ALA MB 2.717 . 4.076 2.242 2.229 2.255 . 0 0 "[ . 1 . 2]" 1
446 1 34 LEU QD 1 38 ALA H 3.587 . 5.380 3.910 3.091 4.894 . 0 0 "[ . 1 . 2]" 1
447 1 37 GLU H 1 38 ALA H 3.091 . 4.520 2.707 2.627 2.810 . 0 0 "[ . 1 . 2]" 1
448 1 115 ALA HA 1 118 TRP H 3.326 . 4.989 3.542 3.171 4.195 . 0 0 "[ . 1 . 2]" 1
449 1 114 GLU HA 1 118 TRP H 3.878 . 5.817 4.131 3.797 4.544 . 0 0 "[ . 1 . 2]" 1
450 1 118 TRP H 1 118 TRP HB2 2.943 . 4.414 2.593 2.115 3.676 . 0 0 "[ . 1 . 2]" 1
451 1 118 TRP H 1 119 ILE HB 3.796 . 5.694 4.872 4.723 5.079 . 0 0 "[ . 1 . 2]" 1
452 1 117 ARG HB2 1 118 TRP H 3.387 . 5.080 3.796 3.072 4.134 . 0 0 "[ . 1 . 2]" 1
453 1 117 ARG HB3 1 118 TRP H 3.147 . 4.721 2.754 2.233 4.089 . 0 0 "[ . 1 . 2]" 1
454 1 117 ARG HG2 1 118 TRP H 3.942 . 5.913 3.669 2.659 4.934 . 0 0 "[ . 1 . 2]" 1
455 1 79 LEU QD 1 118 TRP H 3.681 . 5.522 4.648 4.060 5.371 . 0 0 "[ . 1 . 2]" 1
456 1 93 LYS H 1 93 LYS HB2 2.904 . 4.356 2.722 2.430 3.622 . 0 0 "[ . 1 . 2]" 1
457 1 93 LYS H 1 93 LYS QG 3.743 . 5.615 3.708 2.082 4.038 . 0 0 "[ . 1 . 2]" 1
458 1 92 ALA MB 1 93 LYS H 3.223 . 4.835 2.623 2.435 2.967 . 0 0 "[ . 1 . 2]" 1
459 1 36 GLU HA 1 37 GLU H 2.914 . 4.371 3.562 3.539 3.581 . 0 0 "[ . 1 . 2]" 1
460 1 34 LEU HA 1 37 GLU H 3.540 . 5.310 3.789 3.142 4.511 . 0 0 "[ . 1 . 2]" 1
461 1 37 GLU H 1 37 GLU HG2 3.074 . 4.599 3.551 2.119 4.618 0.019 2 0 "[ . 1 . 2]" 1
462 1 36 GLU QG 1 37 GLU H 3.102 . 4.653 3.910 2.183 4.182 . 0 0 "[ . 1 . 2]" 1
463 1 37 GLU H 1 37 GLU HB2 3.155 . 4.733 2.513 2.236 3.614 . 0 0 "[ . 1 . 2]" 1
464 1 36 GLU QB 1 37 GLU H 2.779 . 4.169 2.433 2.122 3.422 . 0 0 "[ . 1 . 2]" 1
465 1 37 GLU H 1 38 ALA MB 3.806 2.093 5.709 4.377 4.317 4.486 . 0 0 "[ . 1 . 2]" 1
466 1 48 GLU H 1 48 GLU HG2 3.439 . 4.388 4.193 1.843 4.773 0.385 13 0 "[ . 1 . 2]" 1
467 1 48 GLU H 1 48 GLU HB2 3.089 . 4.633 2.831 2.494 3.747 . 0 0 "[ . 1 . 2]" 1
468 1 48 GLU H 1 48 GLU HB3 2.995 . 4.492 2.593 2.369 3.635 . 0 0 "[ . 1 . 2]" 1
469 1 47 LEU HB3 1 48 GLU H 3.122 . 4.683 2.797 2.121 3.776 . 0 0 "[ . 1 . 2]" 1
470 1 47 LEU HA 1 48 GLU H 2.633 . 3.950 2.316 2.212 2.554 . 0 0 "[ . 1 . 2]" 1
471 1 47 LEU H 1 48 GLU H 3.703 . 5.554 4.525 4.432 4.567 . 0 0 "[ . 1 . 2]" 1
472 1 48 GLU HA 1 49 LEU H 2.553 . 3.752 2.183 2.109 2.243 . 0 0 "[ . 1 . 2]" 1
473 1 48 GLU HG2 1 49 LEU H 3.769 . 5.654 4.679 3.549 5.341 . 0 0 "[ . 1 . 2]" 1
474 1 48 GLU HB2 1 49 LEU H 3.469 2.104 5.203 4.415 3.752 4.550 . 0 0 "[ . 1 . 2]" 1
475 1 48 GLU HB3 1 49 LEU H 3.660 2.095 5.490 4.387 3.824 4.507 . 0 0 "[ . 1 . 2]" 1
476 1 49 LEU H 1 49 LEU HB2 3.072 . 4.608 2.738 2.451 3.044 . 0 0 "[ . 1 . 2]" 1
477 1 42 ALA MB 1 49 LEU H 3.735 . 5.602 3.420 2.558 3.909 . 0 0 "[ . 1 . 2]" 1
478 1 49 LEU H 1 49 LEU HG 3.828 . 5.742 4.603 4.381 4.708 . 0 0 "[ . 1 . 2]" 1
479 1 49 LEU H 1 49 LEU HB3 3.237 . 4.855 2.651 2.426 2.851 . 0 0 "[ . 1 . 2]" 1
480 1 49 LEU H 1 49 LEU QD 3.391 . 5.087 3.777 3.659 3.859 . 0 0 "[ . 1 . 2]" 1
481 1 87 ASP HB3 1 88 GLU H 3.149 . 4.724 3.294 2.272 3.947 . 0 0 "[ . 1 . 2]" 1
482 1 87 ASP HB2 1 88 GLU H 3.343 . 5.015 3.023 2.412 4.044 . 0 0 "[ . 1 . 2]" 1
483 1 88 GLU H 1 88 GLU HG3 3.393 . 5.089 2.875 1.989 3.975 . 0 0 "[ . 1 . 2]" 1
484 1 88 GLU H 1 88 GLU HG2 3.295 . 4.942 3.052 1.929 3.777 . 0 0 "[ . 1 . 2]" 1
485 1 88 GLU H 1 88 GLU HB3 2.916 . 4.374 3.582 3.527 3.617 . 0 0 "[ . 1 . 2]" 1
486 1 33 LYS HA 1 36 GLU H 3.297 . 4.945 3.714 3.315 4.143 . 0 0 "[ . 1 . 2]" 1
487 1 36 GLU H 1 36 GLU HA 2.934 . 4.401 2.811 2.759 2.858 . 0 0 "[ . 1 . 2]" 1
488 1 32 LYS HA 1 36 GLU H 3.601 . 5.401 4.057 3.640 4.509 . 0 0 "[ . 1 . 2]" 1
489 1 35 ILE HA 1 36 GLU H 3.772 . 5.658 3.550 3.496 3.588 . 0 0 "[ . 1 . 2]" 1
490 1 36 GLU H 1 36 GLU QG 3.055 . 4.582 2.322 1.963 4.031 . 0 0 "[ . 1 . 2]" 1
491 1 36 GLU H 1 36 GLU QB 2.819 . 4.228 2.442 2.216 2.734 . 0 0 "[ . 1 . 2]" 1
492 1 32 LYS HB2 1 36 GLU H 3.569 . 5.353 5.498 4.225 6.136 0.783 18 5 "[* - 1* .* + 2]" 1
493 1 35 ILE HB 1 36 GLU H 3.042 . 4.563 2.582 2.368 2.835 . 0 0 "[ . 1 . 2]" 1
494 1 35 ILE MG 1 36 GLU H 3.239 . 4.858 3.300 2.862 3.604 . 0 0 "[ . 1 . 2]" 1
495 1 35 ILE MD 1 36 GLU H 3.647 . 5.470 4.525 4.019 4.876 . 0 0 "[ . 1 . 2]" 1
496 1 55 SER H 1 55 SER HB2 3.572 . 5.358 2.955 2.508 3.656 . 0 0 "[ . 1 . 2]" 1
497 1 54 GLY QA 1 55 SER H 3.022 . 4.055 2.776 2.457 2.946 . 0 0 "[ . 1 . 2]" 1
498 1 55 SER H 1 59 ALA H 3.832 . 5.748 5.026 4.092 5.777 0.029 16 0 "[ . 1 . 2]" 1
499 1 25 VAL HB 1 26 LEU H 3.975 . 5.963 4.243 4.021 4.380 . 0 0 "[ . 1 . 2]" 1
500 1 26 LEU H 1 26 LEU HB3 3.208 . 4.812 3.638 3.377 3.771 . 0 0 "[ . 1 . 2]" 1
501 1 26 LEU H 1 26 LEU HB2 3.565 . 5.348 2.482 2.309 2.684 . 0 0 "[ . 1 . 2]" 1
502 1 25 VAL MG1 1 26 LEU H 3.401 . 5.102 2.925 2.558 3.210 . 0 0 "[ . 1 . 2]" 1
503 1 25 VAL MG2 1 26 LEU H 3.359 . 5.038 4.196 4.094 4.287 . 0 0 "[ . 1 . 2]" 1
504 1 26 LEU H 1 78 VAL MG2 2.915 . 4.372 3.703 3.175 5.252 0.880 8 1 "[ . + 1 . 2]" 1
505 1 26 LEU H 1 77 LEU H 3.990 . 5.985 3.756 3.555 4.123 . 0 0 "[ . 1 . 2]" 1
506 1 25 VAL HA 1 26 LEU H 2.835 . 4.248 2.155 2.125 2.203 . 0 0 "[ . 1 . 2]" 1
507 1 24 VAL H 1 24 VAL HB 3.241 . 4.862 2.647 2.580 2.749 . 0 0 "[ . 1 . 2]" 1
508 1 23 LEU HB2 1 24 VAL H 3.806 . 5.709 4.304 4.037 4.510 . 0 0 "[ . 1 . 2]" 1
509 1 23 LEU HG 1 24 VAL H 3.899 . 5.849 4.906 3.338 5.613 . 0 0 "[ . 1 . 2]" 1
510 1 23 LEU HB3 1 24 VAL H 3.825 . 5.738 3.536 2.952 4.167 . 0 0 "[ . 1 . 2]" 1
511 1 24 VAL H 1 76 VAL MG1 2.887 . 4.331 4.116 3.687 4.852 0.521 3 1 "[ + . 1 . 2]" 1
512 1 23 LEU QD 1 24 VAL H 3.630 . 5.445 3.639 2.243 4.360 . 0 0 "[ . 1 . 2]" 1
513 1 23 LEU HA 1 24 VAL H 2.801 . 4.202 2.141 2.101 2.181 . 0 0 "[ . 1 . 2]" 1
514 1 101 LYS H 1 101 LYS HB2 3.950 . 5.925 2.666 2.200 3.625 . 0 0 "[ . 1 . 2]" 1
515 1 101 LYS H 1 101 LYS HB3 3.900 . 5.850 3.220 2.321 3.616 . 0 0 "[ . 1 . 2]" 1
516 1 41 MET HA 1 42 ALA H 3.762 . 5.643 3.516 3.462 3.559 . 0 0 "[ . 1 . 2]" 1
517 1 38 ALA HA 1 42 ALA H 3.413 . 5.119 4.246 3.850 4.789 . 0 0 "[ . 1 . 2]" 1
518 1 41 MET HB2 1 42 ALA H 3.099 . 4.649 2.734 2.378 3.655 . 0 0 "[ . 1 . 2]" 1
519 1 42 ALA H 1 42 ALA MB 2.727 . 4.090 2.235 2.214 2.250 . 0 0 "[ . 1 . 2]" 1
520 1 42 ALA H 1 119 ILE MG 3.590 . 5.385 3.590 2.896 4.420 . 0 0 "[ . 1 . 2]" 1
521 1 42 ALA H 1 49 LEU QD 3.795 . 5.693 3.681 3.107 4.248 . 0 0 "[ . 1 . 2]" 1
522 1 33 LYS HA 1 34 LEU H 3.595 . 5.392 3.526 3.436 3.565 . 0 0 "[ . 1 . 2]" 1
523 1 31 ASP HB3 1 34 LEU H 3.773 . 5.660 3.247 2.668 4.082 . 0 0 "[ . 1 . 2]" 1
524 1 33 LYS HB3 1 34 LEU H 2.899 . 4.348 3.132 2.316 4.113 . 0 0 "[ . 1 . 2]" 1
525 1 34 LEU H 1 34 LEU HB2 2.918 . 4.377 2.558 2.360 2.811 . 0 0 "[ . 1 . 2]" 1
526 1 34 LEU H 1 34 LEU HB3 2.990 . 4.485 2.477 2.217 2.661 . 0 0 "[ . 1 . 2]" 1
527 1 34 LEU H 1 34 LEU HG 3.432 2.099 5.148 4.468 4.401 4.593 . 0 0 "[ . 1 . 2]" 1
528 1 34 LEU H 1 34 LEU QD 3.322 . 4.983 3.702 3.572 3.759 . 0 0 "[ . 1 . 2]" 1
529 1 46 ASN HA 1 47 LEU H 2.845 . 4.245 2.724 2.466 2.910 . 0 0 "[ . 1 . 2]" 1
530 1 42 ALA HA 1 47 LEU H 3.480 . 5.220 3.460 2.865 4.083 . 0 0 "[ . 1 . 2]" 1
531 1 46 ASN HB2 1 47 LEU H 3.899 2.026 5.849 4.407 4.181 4.651 . 0 0 "[ . 1 . 2]" 1
532 1 46 ASN HB3 1 47 LEU H 3.960 2.149 5.940 4.384 4.135 4.627 . 0 0 "[ . 1 . 2]" 1
533 1 47 LEU H 1 47 LEU HG 3.034 . 4.551 2.747 2.084 4.440 . 0 0 "[ . 1 . 2]" 1
534 1 47 LEU H 1 47 LEU HB2 3.084 . 4.626 2.670 2.453 3.759 . 0 0 "[ . 1 . 2]" 1
535 1 47 LEU H 1 47 LEU HB3 2.988 . 4.482 3.667 3.185 3.763 . 0 0 "[ . 1 . 2]" 1
536 1 45 ALA MB 1 47 LEU H 3.457 2.032 5.186 3.558 3.196 4.499 . 0 0 "[ . 1 . 2]" 1
537 1 47 LEU H 1 47 LEU QD 3.147 . 4.721 2.961 2.127 3.247 . 0 0 "[ . 1 . 2]" 1
538 1 46 ASN H 1 47 LEU H 3.034 . 4.502 2.740 2.578 3.064 . 0 0 "[ . 1 . 2]" 1
539 1 46 ASN H 1 46 ASN HA 2.570 . 3.855 2.260 2.247 2.268 . 0 0 "[ . 1 . 2]" 1
540 1 43 GLU HA 1 46 ASN H 3.528 . 5.034 3.546 3.018 4.042 . 0 0 "[ . 1 . 2]" 1
541 1 46 ASN H 1 46 ASN HB2 3.469 . 5.204 3.377 3.063 3.808 . 0 0 "[ . 1 . 2]" 1
542 1 46 ASN H 1 46 ASN HB3 3.344 . 5.016 3.882 2.813 4.118 . 0 0 "[ . 1 . 2]" 1
543 1 45 ALA MB 1 46 ASN H 3.317 . 4.975 3.414 3.269 3.538 . 0 0 "[ . 1 . 2]" 1
544 1 67 ALA HA 1 68 GLU H 3.832 . 5.748 3.527 3.468 3.577 . 0 0 "[ . 1 . 2]" 1
545 1 65 GLU HA 1 68 GLU H 3.600 . 4.839 3.712 3.182 4.693 . 0 0 "[ . 1 . 2]" 1
546 1 68 GLU H 1 68 GLU QG 3.344 . 5.016 3.688 1.928 4.047 0.021 8 0 "[ . 1 . 2]" 1
547 1 68 GLU H 1 68 GLU HB2 3.158 . 4.737 2.728 2.428 3.653 . 0 0 "[ . 1 . 2]" 1
548 1 67 ALA MB 1 68 GLU H 2.821 . 4.231 2.583 2.334 2.841 . 0 0 "[ . 1 . 2]" 1
549 1 110 THR HB 1 111 SER H 3.929 . 5.893 3.642 2.891 4.179 . 0 0 "[ . 1 . 2]" 1
550 1 111 SER H 1 111 SER HB2 3.589 . 5.384 3.255 2.601 3.925 . 0 0 "[ . 1 . 2]" 1
551 1 109 VAL HB 1 111 SER H 3.405 . 5.107 4.167 2.848 5.139 0.032 16 0 "[ . 1 . 2]" 1
552 1 111 SER H 1 114 GLU HB2 3.373 . 5.060 3.162 2.620 4.154 . 0 0 "[ . 1 . 2]" 1
553 1 110 THR MG 1 111 SER H 3.884 . 5.826 3.959 2.612 4.292 . 0 0 "[ . 1 . 2]" 1
554 1 109 VAL QG 1 111 SER H 3.506 2.040 5.259 3.181 2.055 4.230 . 0 0 "[ . 1 . 2]" 1
555 1 34 LEU QD 1 111 SER H 3.895 . 5.842 4.569 3.535 5.421 . 0 0 "[ . 1 . 2]" 1
556 1 50 ILE HA 1 51 THR H 2.661 . 3.992 2.168 2.116 2.211 . 0 0 "[ . 1 . 2]" 1
557 1 51 THR H 1 51 THR HB 3.401 . 4.272 3.313 2.590 3.671 . 0 0 "[ . 1 . 2]" 1
558 1 50 ILE HG13 1 51 THR H 3.899 . 5.848 4.951 4.060 5.526 . 0 0 "[ . 1 . 2]" 1
559 1 51 THR H 1 51 THR MG 3.432 . 4.907 3.062 2.526 3.877 . 0 0 "[ . 1 . 2]" 1
560 1 50 ILE HG12 1 51 THR H 3.902 . 5.853 4.568 3.944 5.236 . 0 0 "[ . 1 . 2]" 1
561 1 50 ILE MG 1 51 THR H 2.895 . 4.342 2.614 2.374 3.026 . 0 0 "[ . 1 . 2]" 1
562 1 87 ASP HA 1 88 GLU H 3.745 . 5.069 3.529 3.476 3.559 . 0 0 "[ . 1 . 2]" 1
563 1 109 VAL QG 1 118 TRP HE1 3.376 . 5.064 3.124 1.891 4.826 0.070 5 0 "[ . 1 . 2]" 1
564 1 114 GLU HG3 1 118 TRP HE1 3.968 . 5.952 4.746 2.170 5.977 0.025 5 0 "[ . 1 . 2]" 1
565 1 46 ASN HB2 1 46 ASN HD22 3.791 . 5.686 3.774 3.471 4.071 . 0 0 "[ . 1 . 2]" 1
566 1 46 ASN HB3 1 46 ASN HD22 3.799 . 5.699 3.741 3.469 4.081 . 0 0 "[ . 1 . 2]" 1
567 1 46 ASN HB2 1 46 ASN HD21 4.066 2.033 6.099 2.887 2.211 3.543 . 0 0 "[ . 1 . 2]" 1
568 1 46 ASN HB3 1 46 ASN HD21 4.042 2.021 6.063 2.804 2.196 3.530 . 0 0 "[ . 1 . 2]" 1
569 1 64 GLN HB2 1 64 GLN HE21 3.470 . 5.205 3.417 1.792 4.464 . 0 0 "[ . 1 . 2]" 1
570 1 64 GLN HB2 1 64 GLN HE22 3.567 . 5.350 4.297 3.418 5.087 . 0 0 "[ . 1 . 2]" 1
571 1 68 GLU HA 1 68 GLU HB2 2.935 . 4.402 2.459 2.389 2.504 . 0 0 "[ . 1 . 2]" 1
572 1 69 LYS HA 1 69 LYS HB3 2.894 . 4.341 2.453 2.368 2.529 . 0 0 "[ . 1 . 2]" 1
573 1 69 LYS HA 1 69 LYS HG2 3.089 . 4.633 2.958 2.574 3.349 . 0 0 "[ . 1 . 2]" 1
574 1 42 ALA MB 1 119 ILE MG 2.825 . 4.238 3.194 2.269 4.329 0.091 7 0 "[ . 1 . 2]" 1
575 1 23 LEU QD 1 75 LYS HG2 3.219 . 4.828 3.589 2.307 5.042 0.214 9 0 "[ . 1 . 2]" 1
576 1 38 ALA MB 1 119 ILE MG 3.070 . 4.605 4.452 4.117 4.678 0.073 20 0 "[ . 1 . 2]" 1
577 1 86 PRO HA 1 89 LYS HB2 3.126 . 4.335 3.502 2.505 3.999 . 0 0 "[ . 1 . 2]" 1
578 1 56 PRO QB 1 80 ILE MD 3.506 . 5.259 2.972 2.144 4.561 . 0 0 "[ . 1 . 2]" 1
579 1 37 GLU HA 1 40 LYS HB3 2.787 . 4.181 4.191 4.014 4.302 0.121 12 0 "[ . 1 . 2]" 1
580 1 110 THR HA 1 110 THR MG 3.200 . 4.800 2.360 2.213 3.223 . 0 0 "[ . 1 . 2]" 1
581 1 23 LEU HA 1 23 LEU QD 3.214 . 4.819 2.292 1.895 3.035 0.014 19 0 "[ . 1 . 2]" 1
582 1 40 LYS HB3 1 40 LYS HE2 3.342 . 5.013 4.075 2.111 4.797 . 0 0 "[ . 1 . 2]" 1
583 1 31 ASP HB2 1 34 LEU HB2 3.947 2.044 5.920 4.943 3.072 6.864 0.944 8 2 "[ . + 1 - . 2]" 1
584 1 112 PRO HB3 1 112 PRO HD3 3.442 . 5.163 3.714 2.937 4.057 . 0 0 "[ . 1 . 2]" 1
585 1 68 GLU HA 1 70 ALA H 3.883 . 5.824 3.905 3.652 4.389 . 0 0 "[ . 1 . 2]" 1
586 1 68 GLU HA 1 68 GLU HB3 2.861 . 4.292 2.933 2.390 3.028 . 0 0 "[ . 1 . 2]" 1
587 1 34 LEU HA 1 112 PRO HB3 4.021 2.010 4.829 3.006 2.005 4.121 0.005 16 0 "[ . 1 . 2]" 1
588 1 40 LYS HB3 1 41 MET HG2 3.839 . 5.026 4.569 3.737 5.550 0.524 14 1 "[ . 1 +. 2]" 1
589 1 77 LEU QD 1 79 LEU QD 2.713 . 4.069 2.026 1.729 2.738 . 0 0 "[ . 1 . 2]" 1
590 1 78 VAL HB 1 106 VAL HA 3.772 . 5.658 2.751 2.026 4.536 . 0 0 "[ . 1 . 2]" 1
591 1 79 LEU QD 1 115 ALA HA 3.836 . 5.754 3.030 2.162 4.587 . 0 0 "[ . 1 . 2]" 1
592 1 31 ASP HB2 1 34 LEU QD 4.150 2.075 5.779 4.766 3.076 6.341 0.562 2 1 "[ + . 1 . 2]" 1
593 1 22 ARG HB2 1 22 ARG HD3 4.190 2.095 5.415 3.290 2.416 4.229 . 0 0 "[ . 1 . 2]" 1
594 1 79 LEU QD 1 118 TRP HB2 3.525 . 5.287 2.924 2.368 3.991 . 0 0 "[ . 1 . 2]" 1
595 1 25 VAL MG1 1 49 LEU HA 3.779 2.103 5.669 3.808 3.558 4.030 . 0 0 "[ . 1 . 2]" 1
596 1 47 LEU HB3 1 47 LEU QD 3.100 . 4.650 2.164 2.099 2.436 . 0 0 "[ . 1 . 2]" 1
597 1 79 LEU H 1 79 LEU QD 3.787 . 5.681 2.689 2.097 3.687 . 0 0 "[ . 1 . 2]" 1
598 1 42 ALA HA 1 47 LEU HB3 3.925 . 5.888 4.093 3.572 4.732 . 0 0 "[ . 1 . 2]" 1
599 1 68 GLU HA 1 68 GLU QG 3.161 2.040 4.741 2.782 2.402 3.345 . 0 0 "[ . 1 . 2]" 1
600 1 22 ARG HG2 1 74 VAL QG 3.623 . 5.434 3.618 2.720 4.943 . 0 0 "[ . 1 . 2]" 1
601 1 35 ILE HA 1 51 THR MG 4.027 2.014 6.040 4.106 2.935 4.937 . 0 0 "[ . 1 . 2]" 1
602 1 23 LEU HB3 1 23 LEU QD 3.401 . 4.657 2.179 2.103 2.435 . 0 0 "[ . 1 . 2]" 1
603 1 79 LEU HA 1 79 LEU QD 3.219 . 4.383 2.008 1.911 2.115 . 0 0 "[ . 1 . 2]" 1
604 1 63 ALA HA 1 66 ILE HB 3.709 . 4.831 2.929 2.399 3.269 . 0 0 "[ . 1 . 2]" 1
605 1 56 PRO QB 1 80 ILE MG 3.362 . 5.043 2.624 2.002 3.799 . 0 0 "[ . 1 . 2]" 1
606 1 120 LYS HA 1 121 GLU H 3.777 . 5.665 3.533 3.484 3.579 . 0 0 "[ . 1 . 2]" 1
607 1 68 GLU HA 1 69 LYS HA 4.169 2.084 6.254 4.634 4.572 4.676 . 0 0 "[ . 1 . 2]" 1
608 1 85 ASP HA 1 86 PRO HD3 2.882 . 4.323 2.268 2.069 2.722 . 0 0 "[ . 1 . 2]" 1
609 1 25 VAL HB 1 49 LEU QD 2.922 . 3.996 2.249 1.915 3.145 . 0 0 "[ . 1 . 2]" 1
610 1 117 ARG HB2 1 117 ARG HD2 3.500 . 5.250 3.253 2.571 3.750 . 0 0 "[ . 1 . 2]" 1
611 1 27 ILE HA 1 28 VAL MG2 4.071 2.035 6.107 3.635 3.327 5.461 . 0 0 "[ . 1 . 2]" 1
612 1 35 ILE MG 1 51 THR MG 2.683 . 4.024 2.209 1.788 2.651 . 0 0 "[ . 1 . 2]" 1
613 1 42 ALA MB 1 49 LEU QD 2.620 . 3.930 2.102 1.847 2.342 . 0 0 "[ . 1 . 2]" 1
614 1 94 LYS HA 1 94 LYS HB2 2.309 . 3.463 2.696 2.438 3.023 . 0 0 "[ . 1 . 2]" 1
615 1 111 SER HB3 1 112 PRO HG2 4.123 2.061 6.185 5.233 3.533 6.319 0.134 14 0 "[ . 1 . 2]" 1
616 1 117 ARG HA 1 117 ARG HD2 4.281 2.141 6.414 4.482 2.727 5.527 . 0 0 "[ . 1 . 2]" 1
617 1 48 GLU HA 1 48 GLU HB2 2.797 . 4.195 2.498 2.425 3.024 . 0 0 "[ . 1 . 2]" 1
618 1 73 PRO HB2 1 73 PRO HD2 3.168 . 4.752 3.239 2.929 4.037 . 0 0 "[ . 1 . 2]" 1
619 1 113 ASP HA 1 113 ASP QB 2.671 . 4.006 2.344 2.180 2.481 . 0 0 "[ . 1 . 2]" 1
620 1 113 ASP HA 1 116 LYS HB3 3.021 . 4.532 3.530 2.235 4.788 0.256 11 0 "[ . 1 . 2]" 1
621 1 117 ARG HD2 1 118 TRP HA 3.753 . 5.629 5.196 3.932 5.817 0.188 20 0 "[ . 1 . 2]" 1
622 1 111 SER HB3 1 112 PRO HG3 4.287 2.143 6.431 5.689 4.467 6.364 . 0 0 "[ . 1 . 2]" 1
623 1 85 ASP HB3 1 86 PRO HD2 3.863 . 5.795 2.513 1.921 4.132 0.010 2 0 "[ . 1 . 2]" 1
624 1 28 VAL HB 1 80 ILE MG 2.937 . 4.405 3.499 2.033 4.651 0.246 7 0 "[ . 1 . 2]" 1
625 1 111 SER H 1 111 SER HB3 3.923 . 5.884 3.475 2.659 3.949 . 0 0 "[ . 1 . 2]" 1
626 1 66 ILE HA 1 66 ILE HG13 4.119 2.059 4.519 3.095 2.871 3.749 . 0 0 "[ . 1 . 2]" 1
627 1 73 PRO HB3 1 73 PRO HD2 3.930 2.035 5.895 3.882 3.868 3.899 . 0 0 "[ . 1 . 2]" 1
628 1 49 LEU QD 1 79 LEU HB2 4.128 2.064 6.192 4.996 4.594 5.295 . 0 0 "[ . 1 . 2]" 1
629 1 89 LYS HA 1 92 ALA MB 3.052 . 3.774 2.744 2.185 3.236 . 0 0 "[ . 1 . 2]" 1
630 1 78 VAL MG1 1 79 LEU HA 4.198 2.099 6.297 4.056 3.739 5.557 . 0 0 "[ . 1 . 2]" 1
631 1 50 ILE HA 1 50 ILE MG 3.191 . 4.245 2.473 2.395 2.589 . 0 0 "[ . 1 . 2]" 1
632 1 27 ILE MD 1 109 VAL QG 3.606 . 5.409 3.686 2.542 4.864 . 0 0 "[ . 1 . 2]" 1
633 1 80 ILE MG 1 108 THR HA 3.755 . 5.633 4.042 2.034 4.892 . 0 0 "[ . 1 . 2]" 1
634 1 39 ARG HB3 1 39 ARG HD3 3.649 . 5.474 2.834 2.429 3.673 . 0 0 "[ . 1 . 2]" 1
635 1 65 GLU HA 1 65 GLU HB2 2.520 . 3.780 2.696 2.445 3.025 . 0 0 "[ . 1 . 2]" 1
636 1 49 LEU HA 1 49 LEU QD 2.862 . 4.293 2.635 1.936 3.082 . 0 0 "[ . 1 . 2]" 1
637 1 117 ARG HA 1 117 ARG HB2 2.727 . 4.091 2.453 2.329 2.819 . 0 0 "[ . 1 . 2]" 1
638 1 32 LYS HA 1 32 LYS HB2 2.507 . 3.760 2.882 2.411 3.023 . 0 0 "[ . 1 . 2]" 1
639 1 26 LEU HB3 1 52 VAL QG 3.236 . 4.854 3.252 2.157 4.451 . 0 0 "[ . 1 . 2]" 1
640 1 26 LEU QD 1 62 LEU HA 4.166 2.083 5.350 4.235 3.958 4.688 . 0 0 "[ . 1 . 2]" 1
641 1 45 ALA MB 1 47 LEU QD 2.903 . 4.354 2.230 1.858 2.464 . 0 0 "[ . 1 . 2]" 1
642 1 109 VAL QG 1 114 GLU HB2 3.755 . 5.632 2.808 1.782 4.817 0.140 16 0 "[ . 1 . 2]" 1
643 1 117 ARG HA 1 117 ARG HG2 3.320 . 4.980 3.251 2.335 3.891 . 0 0 "[ . 1 . 2]" 1
644 1 52 VAL H 1 52 VAL QG 3.160 . 4.740 2.572 1.929 2.913 . 0 0 "[ . 1 . 2]" 1
645 1 79 LEU HB3 1 109 VAL QG 3.612 . 5.418 2.296 1.857 4.129 0.028 17 0 "[ . 1 . 2]" 1
646 1 45 ALA MB 1 123 SER HB2 3.276 . 4.914 3.214 2.123 4.909 . 0 0 "[ . 1 . 2]" 1
647 1 109 VAL QG 1 114 GLU HB3 3.759 2.088 5.639 2.859 1.992 4.089 0.096 18 0 "[ . 1 . 2]" 1
648 1 41 MET HB2 1 45 ALA MB 4.020 2.010 6.030 5.384 4.564 6.413 0.383 10 0 "[ . 1 . 2]" 1
649 1 96 ALA MB 1 106 VAL HB 3.366 . 5.049 3.451 2.050 4.361 . 0 0 "[ . 1 . 2]" 1
650 1 25 VAL HB 1 49 LEU HB3 4.136 2.137 6.204 4.382 3.922 5.171 . 0 0 "[ . 1 . 2]" 1
651 1 26 LEU QD 1 27 ILE H 3.969 . 5.953 3.692 2.926 4.437 . 0 0 "[ . 1 . 2]" 1
652 1 35 ILE MD 1 51 THR HB 4.181 2.091 4.908 3.941 2.946 4.965 0.057 10 0 "[ . 1 . 2]" 1
653 1 32 LYS HA 1 35 ILE MD 3.339 . 4.113 3.022 1.945 4.165 0.052 19 0 "[ . 1 . 2]" 1
654 1 52 VAL HB 1 53 PRO HD2 4.067 2.034 6.100 4.106 1.799 5.158 0.235 15 0 "[ . 1 . 2]" 1
655 1 77 LEU QD 1 122 PHE HB3 3.875 . 5.199 3.128 2.344 4.589 . 0 0 "[ . 1 . 2]" 1
656 1 26 LEU HA 1 26 LEU QD 3.349 . 4.496 2.434 1.850 3.107 . 0 0 "[ . 1 . 2]" 1
657 1 35 ILE HA 1 35 ILE MD 3.869 . 4.446 3.613 2.000 3.868 . 0 0 "[ . 1 . 2]" 1
658 1 22 ARG HA 1 74 VAL QG 4.068 2.034 6.102 4.305 3.886 4.999 . 0 0 "[ . 1 . 2]" 1
659 1 55 SER H 1 55 SER HB3 3.448 . 5.172 3.487 2.794 3.780 . 0 0 "[ . 1 . 2]" 1
660 1 95 ALA MB 1 96 ALA HA 3.001 . 4.502 3.837 3.720 3.909 . 0 0 "[ . 1 . 2]" 1
661 1 29 SER HB2 1 35 ILE MD 3.835 . 5.169 4.146 2.251 5.447 0.278 4 0 "[ . 1 . 2]" 1
662 1 28 VAL MG1 1 56 PRO HD3 3.574 . 5.361 3.918 3.083 5.407 0.046 10 0 "[ . 1 . 2]" 1
663 1 25 VAL HB 1 49 LEU HA 3.759 . 5.220 2.507 2.177 2.803 . 0 0 "[ . 1 . 2]" 1
664 1 95 ALA MB 1 98 GLU HB2 3.111 . 4.667 4.543 3.819 5.358 0.691 1 3 "[+ .- 1* . 2]" 1
665 1 24 VAL MG2 1 70 ALA MB 3.872 . 5.808 3.802 3.002 4.236 . 0 0 "[ . 1 . 2]" 1
666 1 95 ALA MB 1 96 ALA H 3.450 . 5.175 2.581 2.337 2.738 . 0 0 "[ . 1 . 2]" 1
667 1 67 ALA HA 1 74 VAL QG 3.111 . 4.412 2.065 1.797 2.591 . 0 0 "[ . 1 . 2]" 1
668 1 22 ARG HD2 1 74 VAL QG 3.930 . 5.357 4.499 3.296 5.089 . 0 0 "[ . 1 . 2]" 1
669 1 51 THR HA 1 52 VAL HB 3.970 . 5.955 4.773 4.228 5.703 . 0 0 "[ . 1 . 2]" 1
670 1 77 LEU QD 1 105 ARG HD3 3.852 . 5.220 4.038 2.403 5.664 0.444 18 0 "[ . 1 . 2]" 1
671 1 21 MET HG2 1 23 LEU HG 3.794 . 5.691 4.158 2.466 6.163 0.472 12 0 "[ . 1 . 2]" 1
672 1 48 GLU HA 1 48 GLU HB3 2.986 . 4.479 2.935 2.363 3.030 . 0 0 "[ . 1 . 2]" 1
673 1 22 ARG HB3 1 74 VAL QG 3.487 . 5.231 2.581 1.872 3.492 0.025 10 0 "[ . 1 . 2]" 1
674 1 27 ILE HB 1 27 ILE QG 3.874 . 5.062 2.327 2.161 2.472 . 0 0 "[ . 1 . 2]" 1
675 1 70 ALA MB 1 74 VAL QG 3.436 . 4.278 1.912 1.786 2.163 . 0 0 "[ . 1 . 2]" 1
676 1 67 ALA MB 1 74 VAL QG 3.402 . 4.894 2.576 2.145 3.251 . 0 0 "[ . 1 . 2]" 1
677 1 119 ILE MG 1 123 SER H 3.253 . 4.879 4.191 3.776 4.670 . 0 0 "[ . 1 . 2]" 1
678 1 67 ALA MB 1 76 VAL MG1 3.211 . 4.816 3.678 2.310 4.904 0.088 15 0 "[ . 1 . 2]" 1
679 1 26 LEU HA 1 27 ILE HB 4.290 2.145 6.435 4.658 4.118 5.741 . 0 0 "[ . 1 . 2]" 1
680 1 77 LEU QD 1 107 ARG HD3 4.000 . 5.981 3.519 2.176 4.625 . 0 0 "[ . 1 . 2]" 1
681 1 27 ILE HB 1 51 THR HA 4.035 2.017 6.053 4.660 2.588 5.500 . 0 0 "[ . 1 . 2]" 1
682 1 34 LEU HA 1 112 PRO HG2 4.130 2.065 6.195 4.887 3.476 6.238 0.043 7 0 "[ . 1 . 2]" 1
683 1 39 ARG HA 1 39 ARG HD2 3.801 . 5.701 4.367 2.405 4.841 . 0 0 "[ . 1 . 2]" 1
684 1 30 ASN HA 1 35 ILE MD 3.784 . 5.676 3.602 1.899 5.141 . 0 0 "[ . 1 . 2]" 1
685 1 93 LYS QG 1 94 LYS HA 3.134 . 4.090 3.512 2.839 3.992 . 0 0 "[ . 1 . 2]" 1
686 1 39 ARG HA 1 39 ARG HB2 2.942 . 4.413 2.521 2.399 3.019 . 0 0 "[ . 1 . 2]" 1
687 1 26 LEU HA 1 50 ILE MG 3.875 . 4.750 4.085 3.532 4.330 . 0 0 "[ . 1 . 2]" 1
688 1 90 THR HA 1 93 LYS HB2 2.891 . 4.337 3.599 2.608 5.060 0.723 19 3 "[ * . - 1 . +2]" 1
689 1 112 PRO HA 1 112 PRO HG2 3.619 . 5.428 3.904 3.845 3.977 . 0 0 "[ . 1 . 2]" 1
690 1 77 LEU QD 1 122 PHE HB2 3.764 . 5.559 2.528 1.970 3.888 . 0 0 "[ . 1 . 2]" 1
691 1 81 THR HB 1 81 THR MG 2.498 . 3.747 2.133 2.125 2.137 . 0 0 "[ . 1 . 2]" 1
692 1 77 LEU QD 1 105 ARG HB3 3.608 . 5.412 3.433 2.169 5.393 . 0 0 "[ . 1 . 2]" 1
693 1 90 THR HA 1 92 ALA MB 3.668 . 5.502 5.042 4.812 5.322 . 0 0 "[ . 1 . 2]" 1
694 1 35 ILE HA 1 35 ILE HG12 3.211 . 4.817 2.637 2.369 3.594 . 0 0 "[ . 1 . 2]" 1
695 1 77 LEU QD 1 105 ARG HG2 3.973 . 5.959 3.677 2.865 5.721 . 0 0 "[ . 1 . 2]" 1
696 1 26 LEU QD 1 59 ALA HA 3.493 . 5.240 2.958 2.289 4.776 . 0 0 "[ . 1 . 2]" 1
697 1 90 THR HA 1 90 THR MG 2.714 . 4.071 2.384 2.200 3.222 . 0 0 "[ . 1 . 2]" 1
698 1 27 ILE HB 1 51 THR MG 3.488 . 5.232 4.444 2.091 5.247 0.015 12 0 "[ . 1 . 2]" 1
699 1 90 THR HA 1 91 LYS H 3.344 . 5.016 3.535 3.455 3.565 . 0 0 "[ . 1 . 2]" 1
700 1 77 LEU HA 1 77 LEU QD 4.110 2.055 4.749 2.186 1.922 3.364 0.133 9 0 "[ . 1 . 2]" 1
701 1 119 ILE H 1 119 ILE HG13 4.275 2.138 6.412 2.257 2.080 3.585 0.058 14 0 "[ . 1 . 2]" 1
702 1 27 ILE HB 1 27 ILE MD 3.101 . 4.651 2.612 2.275 3.242 . 0 0 "[ . 1 . 2]" 1
703 1 27 ILE QG 1 35 ILE HA 4.001 . 5.934 4.224 2.630 5.052 . 0 0 "[ . 1 . 2]" 1
704 1 90 THR HA 1 94 LYS H 4.257 2.129 6.385 4.081 3.776 4.403 . 0 0 "[ . 1 . 2]" 1
705 1 52 VAL QG 1 53 PRO HG2 4.156 2.078 6.234 3.570 2.324 5.143 . 0 0 "[ . 1 . 2]" 1
706 1 86 PRO HD2 1 86 PRO HG3 2.805 . 4.208 2.917 2.670 2.971 . 0 0 "[ . 1 . 2]" 1
707 1 21 MET HG2 1 23 LEU QD 3.626 . 5.439 3.114 2.083 4.561 . 0 0 "[ . 1 . 2]" 1
708 1 81 THR HA 1 109 VAL HB 4.108 2.054 6.162 3.741 2.062 5.065 . 0 0 "[ . 1 . 2]" 1
709 1 21 MET HG2 1 22 ARG H 4.217 2.109 6.325 3.824 2.702 5.294 . 0 0 "[ . 1 . 2]" 1
710 1 72 GLY HA2 1 73 PRO HD3 3.162 . 4.743 2.558 2.221 3.352 . 0 0 "[ . 1 . 2]" 1
711 1 99 ALA HA 1 104 VAL QG 4.188 2.094 6.282 3.507 3.199 3.794 . 0 0 "[ . 1 . 2]" 1
712 1 50 ILE HA 1 50 ILE HG12 3.942 . 4.842 2.785 2.386 3.624 . 0 0 "[ . 1 . 2]" 1
713 1 77 LEU QD 1 107 ARG HG3 2.728 . 4.092 2.986 2.116 4.458 0.366 13 0 "[ . 1 . 2]" 1
714 1 39 ARG HA 1 49 LEU QD 2.657 . 3.986 2.374 1.864 3.185 . 0 0 "[ . 1 . 2]" 1
715 1 43 GLU HA 1 43 GLU HG2 3.118 . 4.677 3.213 2.462 3.791 . 0 0 "[ . 1 . 2]" 1
716 1 25 VAL MG1 1 42 ALA MB 3.823 . 5.089 3.870 2.885 4.753 . 0 0 "[ . 1 . 2]" 1
717 1 37 GLU HA 1 37 GLU HG2 3.072 . 4.373 3.280 2.425 3.774 . 0 0 "[ . 1 . 2]" 1
718 1 51 THR HA 1 51 THR MG 3.336 . 5.000 2.285 2.202 2.363 . 0 0 "[ . 1 . 2]" 1
719 1 43 GLU HA 1 43 GLU HG3 2.881 . 4.321 3.214 2.476 3.785 . 0 0 "[ . 1 . 2]" 1
720 1 47 LEU QD 1 123 SER HB2 3.275 . 4.740 2.881 1.829 3.780 . 0 0 "[ . 1 . 2]" 1
721 1 43 GLU HA 1 43 GLU HB3 2.626 . 3.939 2.721 2.407 3.026 . 0 0 "[ . 1 . 2]" 1
722 1 48 GLU HA 1 48 GLU HG2 3.179 . 4.769 3.544 3.087 3.856 . 0 0 "[ . 1 . 2]" 1
723 1 42 ALA MB 1 49 LEU HB3 3.524 . 5.021 2.899 2.060 3.664 . 0 0 "[ . 1 . 2]" 1
724 1 35 ILE HA 1 38 ALA MB 3.000 . 4.500 2.864 2.489 3.388 . 0 0 "[ . 1 . 2]" 1
725 1 75 LYS HA 1 75 LYS HG3 4.082 2.041 6.123 3.192 2.440 3.864 . 0 0 "[ . 1 . 2]" 1
726 1 47 LEU HB2 1 48 GLU H 3.794 . 5.691 3.644 2.583 4.070 . 0 0 "[ . 1 . 2]" 1
727 1 24 VAL HB 1 67 ALA MB 4.068 2.034 6.102 5.240 4.511 6.131 0.029 15 0 "[ . 1 . 2]" 1
728 1 64 GLN HA 1 64 GLN HB2 2.693 . 4.040 2.604 2.362 3.029 . 0 0 "[ . 1 . 2]" 1
729 1 64 GLN HA 1 67 ALA MB 2.993 . 4.490 2.783 2.439 3.337 . 0 0 "[ . 1 . 2]" 1
730 1 63 ALA MB 1 64 GLN HA 3.472 2.137 5.208 3.848 3.772 4.007 . 0 0 "[ . 1 . 2]" 1
731 1 64 GLN HA 1 104 VAL QG 3.102 . 4.653 3.158 2.172 4.086 . 0 0 "[ . 1 . 2]" 1
732 1 35 ILE HA 1 49 LEU QD 3.920 . 5.880 4.188 3.644 4.679 . 0 0 "[ . 1 . 2]" 1
733 1 64 GLN HA 1 65 GLU HA 3.518 . 5.277 4.806 4.739 4.859 . 0 0 "[ . 1 . 2]" 1
734 1 22 ARG HB2 1 74 VAL HA 3.512 . 5.268 3.459 2.082 5.224 . 0 0 "[ . 1 . 2]" 1
735 1 24 VAL HB 1 63 ALA MB 3.928 . 5.135 4.955 4.678 5.165 0.030 20 0 "[ . 1 . 2]" 1
736 1 22 ARG HB3 1 74 VAL HA 3.444 . 5.166 3.588 2.072 5.089 . 0 0 "[ . 1 . 2]" 1
737 1 34 LEU QD 1 81 THR HB 3.764 . 5.646 3.665 2.360 5.564 . 0 0 "[ . 1 . 2]" 1
738 1 22 ARG HA 1 22 ARG HG2 3.949 . 5.924 3.188 2.385 3.798 . 0 0 "[ . 1 . 2]" 1
739 1 74 VAL HA 1 74 VAL QG 3.478 . 4.428 2.248 2.121 2.351 . 0 0 "[ . 1 . 2]" 1
740 1 34 LEU QD 1 112 PRO HA 3.160 . 4.438 1.960 1.747 2.443 . 0 0 "[ . 1 . 2]" 1
741 1 59 ALA HA 1 62 LEU HB2 3.709 . 5.564 3.360 2.444 4.274 . 0 0 "[ . 1 . 2]" 1
742 1 34 LEU QD 1 112 PRO HD3 3.387 . 5.081 3.235 2.363 4.385 . 0 0 "[ . 1 . 2]" 1
743 1 24 VAL HB 1 76 VAL MG1 2.527 . 3.791 2.462 1.916 3.803 0.012 3 0 "[ . 1 . 2]" 1
744 1 34 LEU HA 1 34 LEU QD 2.965 . 4.393 2.287 1.889 3.160 . 0 0 "[ . 1 . 2]" 1
745 1 77 LEU QD 1 106 VAL HA 4.195 2.097 6.293 3.546 3.025 4.550 . 0 0 "[ . 1 . 2]" 1
746 1 80 ILE HA 1 80 ILE MG 3.245 . 4.614 2.381 2.250 3.160 . 0 0 "[ . 1 . 2]" 1
747 1 34 LEU QD 1 109 VAL HB 3.346 . 5.019 3.619 2.526 4.491 . 0 0 "[ . 1 . 2]" 1
748 1 35 ILE HA 1 35 ILE HG13 2.635 2.158 3.953 2.980 2.319 3.714 . 0 0 "[ . 1 . 2]" 1
749 1 34 LEU HB2 1 34 LEU QD 2.919 . 4.378 2.176 2.097 2.454 . 0 0 "[ . 1 . 2]" 1
750 1 34 LEU HB3 1 34 LEU QD 2.847 . 4.271 2.204 2.062 2.340 . 0 0 "[ . 1 . 2]" 1
751 1 77 LEU QD 1 107 ARG HG2 3.089 . 4.633 3.302 2.110 4.404 . 0 0 "[ . 1 . 2]" 1
752 1 72 GLY HA3 1 73 PRO HD3 3.216 . 4.824 2.507 2.058 3.123 . 0 0 "[ . 1 . 2]" 1
753 1 26 LEU HA 1 50 ILE HB 3.812 . 5.264 3.240 2.780 3.689 . 0 0 "[ . 1 . 2]" 1
754 1 53 PRO HB2 1 53 PRO HD3 3.321 . 4.981 3.931 3.767 4.077 . 0 0 "[ . 1 . 2]" 1
755 1 63 ALA MB 1 104 VAL QG 2.942 . 4.242 2.012 1.861 2.168 . 0 0 "[ . 1 . 2]" 1
756 1 49 LEU HA 1 50 ILE HB 4.261 2.130 5.787 4.506 4.364 4.670 . 0 0 "[ . 1 . 2]" 1
757 1 53 PRO HD3 1 53 PRO HG2 2.904 . 4.356 2.950 2.726 3.005 . 0 0 "[ . 1 . 2]" 1
758 1 60 ILE HA 1 60 ILE HG12 3.244 2.063 4.866 2.982 2.466 3.551 . 0 0 "[ . 1 . 2]" 1
759 1 52 VAL QG 1 53 PRO HD3 3.329 . 4.994 3.594 3.182 3.936 . 0 0 "[ . 1 . 2]" 1
760 1 53 PRO HD3 1 54 GLY H 4.323 2.162 6.484 5.370 5.264 5.518 . 0 0 "[ . 1 . 2]" 1
761 1 41 MET HA 1 41 MET HB2 2.699 . 4.048 2.992 2.506 3.026 . 0 0 "[ . 1 . 2]" 1
762 1 60 ILE HA 1 63 ALA MB 2.943 . 4.415 2.430 2.128 2.786 . 0 0 "[ . 1 . 2]" 1
763 1 112 PRO HA 1 115 ALA MB 2.790 . 4.185 2.726 1.977 3.506 . 0 0 "[ . 1 . 2]" 1
764 1 87 ASP HB2 1 88 GLU HG2 4.253 2.126 6.380 4.688 3.039 6.183 . 0 0 "[ . 1 . 2]" 1
765 1 60 ILE HA 1 60 ILE MG 2.690 . 4.035 2.321 2.227 2.467 . 0 0 "[ . 1 . 2]" 1
766 1 60 ILE HA 1 63 ALA HA 4.117 2.150 6.175 5.094 4.712 5.589 . 0 0 "[ . 1 . 2]" 1
767 1 100 ARG QB 1 100 ARG HD2 3.595 . 4.530 2.642 2.313 3.404 . 0 0 "[ . 1 . 2]" 1
768 1 27 ILE MD 1 35 ILE HA 3.238 2.099 4.857 3.218 2.289 4.889 0.032 16 0 "[ . 1 . 2]" 1
769 1 25 VAL MG1 1 47 LEU HB3 4.107 2.053 6.161 5.131 4.336 6.206 0.045 7 0 "[ . 1 . 2]" 1
770 1 86 PRO HA 1 86 PRO HG2 3.852 . 4.911 3.852 3.803 3.914 . 0 0 "[ . 1 . 2]" 1
771 1 97 GLU HA 1 100 ARG HD2 3.375 . 5.063 3.940 1.951 5.489 0.426 11 0 "[ . 1 . 2]" 1
772 1 97 GLU HA 1 97 GLU HG2 2.520 . 3.780 2.977 2.353 3.741 . 0 0 "[ . 1 . 2]" 1
773 1 109 VAL QG 1 112 PRO HA 4.280 2.140 6.420 3.875 2.816 5.080 . 0 0 "[ . 1 . 2]" 1
774 1 56 PRO QB 1 92 ALA MB 3.540 . 5.310 2.322 1.896 3.146 . 0 0 "[ . 1 . 2]" 1
775 1 39 ARG HB3 1 40 LYS H 3.380 . 5.070 2.715 2.292 3.642 . 0 0 "[ . 1 . 2]" 1
776 1 25 VAL HA 1 25 VAL MG1 3.346 . 4.581 2.346 2.284 2.415 . 0 0 "[ . 1 . 2]" 1
777 1 71 PRO QD 1 74 VAL QG 4.155 2.078 6.232 4.473 3.958 4.883 . 0 0 "[ . 1 . 2]" 1
778 1 81 THR HA 1 81 THR HB 2.862 . 4.293 2.707 2.449 3.024 . 0 0 "[ . 1 . 2]" 1
779 1 106 VAL HA 1 106 VAL QG 3.183 . 4.119 2.239 2.134 2.375 . 0 0 "[ . 1 . 2]" 1
780 1 71 PRO HB3 1 71 PRO QD 3.483 . 5.225 3.160 2.948 3.521 . 0 0 "[ . 1 . 2]" 1
781 1 26 LEU QD 1 63 ALA HA 3.326 . 4.009 2.277 1.899 2.651 . 0 0 "[ . 1 . 2]" 1
782 1 79 LEU HA 1 79 LEU HB3 4.201 2.100 6.302 2.517 2.410 2.995 . 0 0 "[ . 1 . 2]" 1
783 1 76 VAL HB 1 104 VAL QG 2.815 . 4.222 2.291 1.692 4.029 0.028 1 0 "[ . 1 . 2]" 1
784 1 121 GLU H 1 121 GLU HB2 3.612 . 5.418 2.547 2.102 3.612 . 0 0 "[ . 1 . 2]" 1
785 1 71 PRO QD 1 72 GLY H 4.009 2.062 6.013 4.717 4.664 4.784 . 0 0 "[ . 1 . 2]" 1
786 1 67 ALA MB 1 104 VAL QG 3.262 . 4.510 2.787 2.274 4.077 . 0 0 "[ . 1 . 2]" 1
787 1 49 LEU HB2 1 49 LEU QD 2.696 . 4.044 2.196 2.117 2.337 . 0 0 "[ . 1 . 2]" 1
788 1 67 ALA MB 1 68 GLU HA 3.501 . 5.251 3.855 3.759 3.977 . 0 0 "[ . 1 . 2]" 1
789 1 118 TRP HA 1 121 GLU HB2 3.967 . 5.951 3.389 2.271 5.184 . 0 0 "[ . 1 . 2]" 1
790 1 65 GLU HA 1 69 LYS HG3 2.949 . 4.423 4.287 3.229 4.544 0.121 17 0 "[ . 1 . 2]" 1
791 1 66 ILE HB 1 67 ALA MB 3.643 . 5.465 3.919 3.605 4.117 . 0 0 "[ . 1 . 2]" 1
792 1 24 VAL HB 1 76 VAL HA 3.371 . 5.057 2.567 2.314 2.979 . 0 0 "[ . 1 . 2]" 1
793 1 60 ILE MG 1 96 ALA HA 3.384 . 5.076 2.743 2.147 3.702 . 0 0 "[ . 1 . 2]" 1
794 1 66 ILE HA 1 66 ILE HG12 3.044 2.050 4.566 2.574 2.468 3.117 . 0 0 "[ . 1 . 2]" 1
795 1 60 ILE MG 1 63 ALA HA 4.154 2.077 6.231 5.845 5.508 6.264 0.033 3 0 "[ . 1 . 2]" 1
796 1 76 VAL HA 1 76 VAL MG1 2.803 . 4.205 2.492 2.285 3.207 . 0 0 "[ . 1 . 2]" 1
797 1 119 ILE HA 1 119 ILE HG12 3.987 . 4.923 2.521 2.400 3.088 . 0 0 "[ . 1 . 2]" 1
798 1 60 ILE MG 1 98 GLU HB2 4.281 2.140 6.422 5.174 4.208 6.267 . 0 0 "[ . 1 . 2]" 1
799 1 36 GLU HA 1 39 ARG HD2 3.463 . 5.195 4.761 3.030 5.864 0.669 16 3 "[ . * 1 .+ - 2]" 1
800 1 120 LYS HA 1 120 LYS HG3 3.832 . 5.748 2.839 2.368 3.695 . 0 0 "[ . 1 . 2]" 1
801 1 112 PRO HD3 1 112 PRO HG2 2.823 . 4.235 2.793 2.676 2.996 . 0 0 "[ . 1 . 2]" 1
802 1 37 GLU HB2 1 37 GLU HG3 2.278 . 3.417 2.606 2.372 3.012 . 0 0 "[ . 1 . 2]" 1
803 1 38 ALA MB 1 49 LEU QD 2.729 . 4.093 2.474 1.998 3.194 . 0 0 "[ . 1 . 2]" 1
804 1 112 PRO HB2 1 112 PRO HD3 3.212 . 4.818 3.880 3.860 3.900 . 0 0 "[ . 1 . 2]" 1
805 1 29 SER HB3 1 35 ILE HG12 4.008 2.004 6.012 4.608 1.944 6.107 0.095 17 0 "[ . 1 . 2]" 1
806 1 93 LYS HA 1 93 LYS HB2 2.314 . 3.471 2.444 2.308 2.527 . 0 0 "[ . 1 . 2]" 1
807 1 36 GLU HA 1 40 LYS QG 2.616 . 3.924 3.731 3.323 3.948 0.024 8 0 "[ . 1 . 2]" 1
808 1 117 ARG H 1 117 ARG HD2 4.324 2.162 6.486 4.998 4.445 5.856 . 0 0 "[ . 1 . 2]" 1
809 1 26 LEU QD 1 50 ILE HB 3.110 . 4.213 2.193 1.715 2.963 0.005 19 0 "[ . 1 . 2]" 1
810 1 40 LYS HA 1 40 LYS QG 2.750 . 4.125 2.593 2.318 3.000 . 0 0 "[ . 1 . 2]" 1
811 1 108 THR HB 1 110 THR MG 4.077 2.038 6.116 5.034 4.042 6.182 0.066 13 0 "[ . 1 . 2]" 1
812 1 124 GLU HA 1 124 GLU HG2 3.390 . 5.085 3.032 2.409 3.767 . 0 0 "[ . 1 . 2]" 1
813 1 49 LEU QD 1 51 THR MG 2.669 . 4.003 2.854 2.017 3.988 . 0 0 "[ . 1 . 2]" 1
814 1 29 SER HB3 1 81 THR MG 3.832 . 5.748 4.603 2.126 6.067 0.319 2 0 "[ . 1 . 2]" 1
815 1 111 SER HA 1 112 PRO HD3 2.952 . 3.788 2.155 1.865 2.587 . 0 0 "[ . 1 . 2]" 1
816 1 45 ALA MB 1 47 LEU HG 3.908 . 4.796 2.377 1.943 4.184 0.011 14 0 "[ . 1 . 2]" 1
817 1 63 ALA H 1 104 VAL QG 4.025 2.013 6.037 4.365 4.136 4.643 . 0 0 "[ . 1 . 2]" 1
818 1 86 PRO HA 1 86 PRO HG3 3.830 . 5.745 3.005 2.813 3.846 . 0 0 "[ . 1 . 2]" 1
819 1 65 GLU HB2 1 66 ILE MD 4.004 2.002 6.006 5.354 4.446 6.190 0.184 6 0 "[ . 1 . 2]" 1
820 1 40 LYS HA 1 44 LYS H 3.807 . 5.710 4.215 3.778 4.905 . 0 0 "[ . 1 . 2]" 1
821 1 21 MET HG3 1 23 LEU QD 3.568 2.037 5.352 3.432 2.016 4.805 0.021 9 0 "[ . 1 . 2]" 1
822 1 85 ASP HB2 1 86 PRO HD3 3.915 . 5.730 4.593 4.367 4.996 . 0 0 "[ . 1 . 2]" 1
823 1 85 ASP HB2 1 86 PRO HD2 3.904 . 5.591 3.728 3.522 4.083 . 0 0 "[ . 1 . 2]" 1
824 1 50 ILE HA 1 50 ILE MD 3.011 . 4.516 3.256 1.996 3.857 . 0 0 "[ . 1 . 2]" 1
825 1 62 LEU HA 1 62 LEU MD2 3.579 . 5.368 2.851 1.917 3.900 . 0 0 "[ . 1 . 2]" 1
826 1 120 LYS HA 1 120 LYS HB2 2.744 . 4.116 2.532 2.431 3.021 . 0 0 "[ . 1 . 2]" 1
827 1 119 ILE HA 1 123 SER HB2 4.022 2.067 6.033 5.506 4.456 6.819 0.786 7 2 "[ . + 1 - . 2]" 1
828 1 70 ALA MB 1 74 VAL HB 3.604 . 5.406 3.002 1.983 4.145 . 0 0 "[ . 1 . 2]" 1
829 1 62 LEU HA 1 65 GLU HB2 2.928 . 4.222 2.970 2.319 3.788 . 0 0 "[ . 1 . 2]" 1
830 1 40 LYS HB2 1 41 MET HA 2.902 . 4.353 4.354 4.170 4.473 0.120 1 0 "[ . 1 . 2]" 1
831 1 55 SER HA 1 55 SER HB3 2.827 . 4.240 2.410 2.322 2.538 . 0 0 "[ . 1 . 2]" 1
832 1 56 PRO HG3 1 80 ILE MG 3.138 . 4.707 3.834 2.684 4.754 0.047 14 0 "[ . 1 . 2]" 1
833 1 44 LYS HA 1 44 LYS HB2 2.810 . 4.215 2.588 2.416 3.024 . 0 0 "[ . 1 . 2]" 1
834 1 103 ASN HA 1 104 VAL H 3.144 . 4.716 2.797 2.378 2.956 . 0 0 "[ . 1 . 2]" 1
835 1 67 ALA HA 1 74 VAL HB 4.227 2.113 5.945 3.902 2.721 5.356 . 0 0 "[ . 1 . 2]" 1
836 1 27 ILE MD 1 79 LEU HB2 3.868 . 5.802 3.345 1.898 4.435 0.036 15 0 "[ . 1 . 2]" 1
837 1 107 ARG HB2 1 107 ARG HD3 3.732 . 5.598 3.154 2.466 3.727 . 0 0 "[ . 1 . 2]" 1
838 1 102 TRP HA 1 102 TRP HB2 3.305 2.148 4.958 3.009 2.711 3.031 . 0 0 "[ . 1 . 2]" 1
839 1 74 VAL H 1 74 VAL HB 3.792 . 5.688 3.190 2.600 3.847 . 0 0 "[ . 1 . 2]" 1
840 1 80 ILE HB 1 108 THR MG 3.837 . 5.755 3.544 2.292 4.848 . 0 0 "[ . 1 . 2]" 1
841 1 41 MET H 1 44 LYS HB2 3.596 . 5.394 5.237 4.733 5.703 0.309 11 0 "[ . 1 . 2]" 1
842 1 61 ARG HA 1 64 GLN HA 3.892 . 5.838 5.303 4.808 5.952 0.114 17 0 "[ . 1 . 2]" 1
843 1 80 ILE HB 1 80 ILE MD 3.140 . 4.710 2.469 2.315 3.238 . 0 0 "[ . 1 . 2]" 1
844 1 41 MET HG3 1 116 LYS HA 3.628 2.158 5.442 3.374 2.134 4.904 0.024 2 0 "[ . 1 . 2]" 1
845 1 41 MET HG2 1 116 LYS HA 3.826 2.110 5.739 4.536 3.564 5.687 . 0 0 "[ . 1 . 2]" 1
846 1 61 ARG HA 1 61 ARG HD2 3.324 . 4.844 4.588 3.022 4.872 0.028 5 0 "[ . 1 . 2]" 1
847 1 116 LYS HB3 1 117 ARG H 3.792 . 5.688 3.192 2.526 4.228 . 0 0 "[ . 1 . 2]" 1
848 1 60 ILE HB 1 60 ILE MD 3.310 . 4.965 2.870 2.314 3.241 . 0 0 "[ . 1 . 2]" 1
849 1 60 ILE MD 1 95 ALA MB 3.230 . 4.292 3.052 1.984 4.291 . 0 0 "[ . 1 . 2]" 1
850 1 87 ASP HA 1 87 ASP HB3 2.959 . 4.438 2.646 2.359 3.026 . 0 0 "[ . 1 . 2]" 1
851 1 60 ILE MD 1 63 ALA MB 3.168 . 4.752 4.202 3.150 4.894 0.142 6 0 "[ . 1 . 2]" 1
852 1 49 LEU QD 1 51 THR H 3.722 . 5.583 3.541 3.262 4.499 . 0 0 "[ . 1 . 2]" 1
853 1 119 ILE HA 1 122 PHE HB3 3.374 . 5.061 3.554 2.407 5.014 . 0 0 "[ . 1 . 2]" 1
854 1 85 ASP HB3 1 86 PRO HD3 3.877 . 5.816 3.675 3.052 4.886 . 0 0 "[ . 1 . 2]" 1
855 1 25 VAL MG1 1 119 ILE HA 3.621 2.105 5.431 4.387 3.896 4.974 . 0 0 "[ . 1 . 2]" 1
856 1 42 ALA HA 1 47 LEU HB2 3.795 . 4.508 2.616 1.897 4.561 0.053 7 0 "[ . 1 . 2]" 1
857 1 119 ILE HA 1 119 ILE MG 2.775 . 4.162 2.445 2.404 2.497 . 0 0 "[ . 1 . 2]" 1
858 1 77 LEU QD 1 119 ILE HA 3.225 . 4.838 3.080 2.192 4.354 . 0 0 "[ . 1 . 2]" 1
859 1 119 ILE HA 1 122 PHE H 3.812 . 5.718 3.582 3.219 3.938 . 0 0 "[ . 1 . 2]" 1
860 1 85 ASP HB2 1 88 GLU HB3 3.605 . 5.407 4.783 3.780 5.939 0.532 5 1 "[ + 1 . 2]" 1
861 1 109 VAL QG 1 115 ALA HA 3.392 . 4.435 2.460 1.909 3.176 . 0 0 "[ . 1 . 2]" 1
862 1 65 GLU HA 1 69 LYS HG2 3.671 . 4.223 3.759 3.233 4.591 0.368 13 0 "[ . 1 . 2]" 1
863 1 79 LEU HA 1 109 VAL QG 4.088 2.044 6.132 3.207 2.680 3.608 . 0 0 "[ . 1 . 2]" 1
864 1 85 ASP HB2 1 88 GLU HG2 4.184 2.092 6.276 3.851 2.114 5.603 . 0 0 "[ . 1 . 2]" 1
865 1 66 ILE HA 1 67 ALA H 3.724 . 5.586 3.538 3.507 3.569 . 0 0 "[ . 1 . 2]" 1
866 1 83 SER HA 1 83 SER HB2 2.850 . 4.275 2.745 2.443 3.031 . 0 0 "[ . 1 . 2]" 1
867 1 28 VAL MG2 1 56 PRO HA 3.710 . 4.300 2.682 1.998 4.298 . 0 0 "[ . 1 . 2]" 1
868 1 69 LYS HB2 1 69 LYS HG2 2.722 . 4.083 2.568 2.372 3.012 . 0 0 "[ . 1 . 2]" 1
869 1 109 VAL QG 1 118 TRP HB2 4.299 2.150 6.448 3.994 3.327 5.694 . 0 0 "[ . 1 . 2]" 1
870 1 28 VAL HB 1 80 ILE HA 3.438 . 4.686 2.760 1.849 4.620 . 0 0 "[ . 1 . 2]" 1
871 1 86 PRO HA 1 86 PRO HD3 3.391 . 5.086 3.362 3.022 3.517 . 0 0 "[ . 1 . 2]" 1
872 1 34 LEU HA 1 37 GLU HG2 4.002 2.001 6.003 4.661 2.620 6.186 0.183 10 0 "[ . 1 . 2]" 1
873 1 70 ALA MB 1 71 PRO QD 3.328 . 4.992 2.866 2.229 3.191 . 0 0 "[ . 1 . 2]" 1
874 1 36 GLU QB 1 37 GLU HA 2.814 . 4.221 3.791 3.669 4.157 . 0 0 "[ . 1 . 2]" 1
875 1 33 LYS HB3 1 34 LEU HA 3.225 . 4.837 4.445 4.053 5.657 0.820 19 2 "[ . 1 - . +2]" 1
876 1 29 SER HB2 1 35 ILE HG12 4.165 2.083 6.247 5.176 2.389 6.616 0.369 11 0 "[ . 1 . 2]" 1
877 1 29 SER HB2 1 81 THR MG 4.164 2.132 6.246 4.502 2.881 6.211 . 0 0 "[ . 1 . 2]" 1
878 1 34 LEU HA 1 34 LEU HG 3.079 . 4.618 3.128 2.560 3.730 . 0 0 "[ . 1 . 2]" 1
879 1 34 LEU HA 1 112 PRO HA 3.102 . 4.653 4.035 3.078 4.696 0.043 17 0 "[ . 1 . 2]" 1
880 1 117 ARG HA 1 117 ARG HG3 3.630 . 5.445 3.095 2.601 3.739 . 0 0 "[ . 1 . 2]" 1
881 1 25 VAL MG1 1 49 LEU QD 2.603 . 3.904 2.213 1.995 2.583 . 0 0 "[ . 1 . 2]" 1
882 1 85 ASP HA 1 86 PRO HG2 4.307 2.154 6.460 4.573 4.436 4.753 . 0 0 "[ . 1 . 2]" 1
883 1 67 ALA HA 1 68 GLU HA 4.124 2.062 6.186 4.741 4.589 4.856 . 0 0 "[ . 1 . 2]" 1
884 1 117 ARG HA 1 117 ARG HB3 2.754 . 4.131 2.909 2.466 3.025 . 0 0 "[ . 1 . 2]" 1
885 1 34 LEU HG 1 112 PRO HB3 4.046 2.023 6.069 4.583 2.925 5.039 . 0 0 "[ . 1 . 2]" 1
886 1 50 ILE HA 1 50 ILE HG13 3.277 . 4.916 3.052 2.321 3.758 . 0 0 "[ . 1 . 2]" 1
887 1 41 MET HB2 1 119 ILE MG 2.917 . 4.376 2.913 2.514 3.956 . 0 0 "[ . 1 . 2]" 1
888 1 32 LYS HA 1 35 ILE HB 2.706 . 4.059 2.988 2.293 3.463 . 0 0 "[ . 1 . 2]" 1
889 1 34 LEU HG 1 112 PRO HB2 4.201 2.100 6.302 6.077 4.623 6.358 0.056 16 0 "[ . 1 . 2]" 1
890 1 27 ILE HA 1 27 ILE QG 4.046 2.023 6.069 2.642 2.316 3.435 . 0 0 "[ . 1 . 2]" 1
891 1 45 ALA MB 1 123 SER HB3 3.630 . 5.137 3.123 2.121 4.405 . 0 0 "[ . 1 . 2]" 1
892 1 105 ARG HB2 1 105 ARG HD2 2.652 . 3.978 3.181 2.262 3.799 . 0 0 "[ . 1 . 2]" 1
893 1 23 LEU QD 1 123 SER HB2 4.252 2.126 6.378 4.253 2.218 5.683 . 0 0 "[ . 1 . 2]" 1
894 1 87 ASP HA 1 90 THR MG 3.615 2.103 5.423 4.177 2.521 4.849 . 0 0 "[ . 1 . 2]" 1
895 1 97 GLU HA 1 100 ARG QB 2.350 . 3.525 2.811 2.080 3.484 . 0 0 "[ . 1 . 2]" 1
896 1 26 LEU QD 1 50 ILE H 3.319 . 4.978 3.330 2.555 4.195 . 0 0 "[ . 1 . 2]" 1
897 1 105 ARG HA 1 105 ARG HD2 4.016 2.008 6.024 4.128 1.962 5.538 0.046 18 0 "[ . 1 . 2]" 1
898 1 61 ARG HA 1 61 ARG QG 3.737 . 4.066 2.393 2.305 2.725 . 0 0 "[ . 1 . 2]" 1
899 1 89 LYS HA 1 89 LYS HB2 2.761 . 4.141 2.596 2.439 3.023 . 0 0 "[ . 1 . 2]" 1
900 1 29 SER HB3 1 35 ILE MD 3.618 . 5.427 3.640 2.239 5.297 . 0 0 "[ . 1 . 2]" 1
901 1 108 THR HB 1 108 THR MG 2.496 . 3.744 2.136 2.129 2.142 . 0 0 "[ . 1 . 2]" 1
902 1 74 VAL QG 1 76 VAL HA 4.060 2.030 6.090 4.250 3.762 5.531 . 0 0 "[ . 1 . 2]" 1
903 1 39 ARG HB3 1 39 ARG HD2 3.811 . 4.191 3.199 2.438 3.822 . 0 0 "[ . 1 . 2]" 1
904 1 107 ARG HB2 1 107 ARG HD2 4.034 2.017 6.051 3.076 2.306 4.219 . 0 0 "[ . 1 . 2]" 1
905 1 80 ILE MD 1 108 THR HB 4.280 2.140 6.420 5.156 4.233 6.441 0.021 6 0 "[ . 1 . 2]" 1
906 1 42 ALA HA 1 47 LEU HG 3.108 . 4.662 3.011 2.196 3.619 . 0 0 "[ . 1 . 2]" 1
907 1 87 ASP HB2 1 88 GLU HA 3.896 . 5.844 4.702 4.186 5.693 . 0 0 "[ . 1 . 2]" 1
908 1 107 ARG HD3 1 118 TRP HA 3.752 . 5.628 5.042 4.040 6.534 0.906 19 1 "[ . 1 . +2]" 1
909 1 48 GLU HA 1 49 LEU HB2 4.276 2.138 6.414 4.549 4.379 4.716 . 0 0 "[ . 1 . 2]" 1
910 1 35 ILE MG 1 36 GLU QB 4.012 2.006 6.018 4.534 3.660 4.874 . 0 0 "[ . 1 . 2]" 1
911 1 88 GLU HA 1 88 GLU HG3 2.753 . 4.129 3.240 2.551 3.851 . 0 0 "[ . 1 . 2]" 1
912 1 88 GLU HA 1 92 ALA MB 3.072 . 4.608 4.531 4.249 4.670 0.062 16 0 "[ . 1 . 2]" 1
913 1 42 ALA MB 1 43 GLU HA 3.780 . 5.670 3.805 3.742 3.907 . 0 0 "[ . 1 . 2]" 1
914 1 88 GLU HA 1 89 LYS H 3.489 . 5.234 3.508 3.477 3.523 . 0 0 "[ . 1 . 2]" 1
915 1 105 ARG HB3 1 105 ARG HD3 3.279 2.038 4.918 3.241 2.457 4.212 . 0 0 "[ . 1 . 2]" 1
916 1 88 GLU HA 1 92 ALA H 3.903 . 5.854 3.952 3.594 4.276 . 0 0 "[ . 1 . 2]" 1
917 1 47 LEU HG 1 119 ILE MG 2.778 . 4.167 3.852 2.099 4.251 0.084 17 0 "[ . 1 . 2]" 1
918 1 23 LEU HB3 1 47 LEU QD 3.194 . 4.791 2.260 1.764 3.207 0.051 2 0 "[ . 1 . 2]" 1
919 1 27 ILE HB 1 49 LEU QD 3.086 . 4.629 3.105 2.210 3.991 . 0 0 "[ . 1 . 2]" 1
920 1 71 PRO HB2 1 72 GLY HA2 3.623 2.086 5.435 4.988 4.676 5.286 . 0 0 "[ . 1 . 2]" 1
921 1 117 ARG H 1 117 ARG HG3 4.167 2.083 6.251 4.267 3.189 4.672 . 0 0 "[ . 1 . 2]" 1
922 1 123 SER H 1 123 SER HB2 3.471 . 5.206 2.779 2.487 3.630 . 0 0 "[ . 1 . 2]" 1
923 1 109 VAL QG 1 115 ALA MB 3.105 . 4.657 2.090 1.729 3.174 . 0 0 "[ . 1 . 2]" 1
924 1 107 ARG HB3 1 107 ARG HD2 3.819 . 5.729 3.246 2.476 3.725 . 0 0 "[ . 1 . 2]" 1
925 1 107 ARG HD2 1 107 ARG HG2 3.753 2.140 5.630 2.660 2.353 3.015 . 0 0 "[ . 1 . 2]" 1
926 1 34 LEU QD 1 109 VAL QG 2.962 . 4.443 2.448 1.921 3.112 . 0 0 "[ . 1 . 2]" 1
927 1 77 LEU QD 1 107 ARG HD2 4.012 2.006 6.018 2.724 1.845 4.111 0.161 15 0 "[ . 1 . 2]" 1
928 1 24 VAL MG2 1 67 ALA HA 3.984 . 5.976 4.404 3.401 5.319 . 0 0 "[ . 1 . 2]" 1
929 1 38 ALA MB 1 109 VAL QG 3.866 . 5.799 4.625 4.036 5.167 . 0 0 "[ . 1 . 2]" 1
930 1 63 ALA HA 1 76 VAL MG1 3.926 . 5.889 2.815 2.184 3.646 . 0 0 "[ . 1 . 2]" 1
931 1 74 VAL QG 1 75 LYS HA 4.190 2.095 6.285 3.372 3.066 3.788 . 0 0 "[ . 1 . 2]" 1
932 1 23 LEU HB2 1 23 LEU QD 2.981 . 4.472 2.231 2.106 2.311 . 0 0 "[ . 1 . 2]" 1
933 1 31 ASP HA 1 32 LYS H 3.029 . 4.544 2.232 2.097 2.548 . 0 0 "[ . 1 . 2]" 1
934 1 70 ALA HA 1 71 PRO HG2 3.516 . 5.274 4.386 4.275 4.599 . 0 0 "[ . 1 . 2]" 1
935 1 70 ALA HA 1 71 PRO HG3 3.592 . 5.388 4.261 3.949 4.405 . 0 0 "[ . 1 . 2]" 1
936 1 33 LYS HA 1 36 GLU QG 2.919 . 4.379 3.465 2.308 4.263 . 0 0 "[ . 1 . 2]" 1
937 1 71 PRO HA 1 71 PRO HG2 3.399 . 5.098 3.926 3.876 4.035 . 0 0 "[ . 1 . 2]" 1
938 1 23 LEU QD 1 47 LEU HA 4.261 2.131 6.391 4.133 3.620 4.659 . 0 0 "[ . 1 . 2]" 1
939 1 70 ALA MB 1 71 PRO HA 4.125 2.063 6.187 4.423 4.357 4.511 . 0 0 "[ . 1 . 2]" 1
940 1 62 LEU HA 1 62 LEU MD1 2.679 . 4.019 2.283 2.005 2.742 . 0 0 "[ . 1 . 2]" 1
941 1 71 PRO HA 1 72 GLY H 3.466 . 5.199 2.190 2.174 2.204 . 0 0 "[ . 1 . 2]" 1
942 1 39 ARG HD2 1 39 ARG HG3 2.619 . 3.929 2.504 2.369 3.015 . 0 0 "[ . 1 . 2]" 1
943 1 39 ARG HD2 1 39 ARG HG2 2.749 . 4.123 2.812 2.394 3.015 . 0 0 "[ . 1 . 2]" 1
944 1 71 PRO HB3 1 72 GLY H 4.761 2.381 7.141 4.254 4.040 4.338 . 0 0 "[ . 1 . 2]" 1
945 1 22 ARG HG3 1 71 PRO QD 4.746 2.373 7.119 4.745 2.132 6.892 0.241 5 0 "[ . 1 . 2]" 1
946 1 35 ILE MD 1 51 THR MG 2.783 . 4.174 2.766 1.894 4.146 . 0 0 "[ . 1 . 2]" 1
947 1 72 GLY HA3 1 73 PRO HG2 4.052 2.026 6.078 4.589 4.202 4.883 . 0 0 "[ . 1 . 2]" 1
948 1 119 ILE MG 1 122 PHE HB3 4.261 2.130 5.370 4.576 3.372 6.120 0.750 13 1 "[ . 1 + . 2]" 1
949 1 73 PRO HA 1 74 VAL QG 3.707 . 5.561 3.532 3.328 3.727 . 0 0 "[ . 1 . 2]" 1
950 1 60 ILE MG 1 95 ALA MB 2.861 . 4.292 2.040 1.807 2.326 . 0 0 "[ . 1 . 2]" 1
951 1 52 VAL QG 1 59 ALA HA 2.445 . 3.668 2.488 1.741 3.565 . 0 0 "[ . 1 . 2]" 1
952 1 73 PRO HA 1 74 VAL HA 4.138 2.069 6.207 4.397 4.369 4.452 . 0 0 "[ . 1 . 2]" 1
953 1 52 VAL HB 1 59 ALA MB 3.401 . 5.101 3.154 2.387 4.302 . 0 0 "[ . 1 . 2]" 1
954 1 96 ALA HA 1 106 VAL QG 2.528 . 3.792 3.030 2.202 3.749 . 0 0 "[ . 1 . 2]" 1
955 1 63 ALA MB 1 76 VAL MG2 2.885 . 4.327 2.867 2.128 3.763 . 0 0 "[ . 1 . 2]" 1
956 1 27 ILE MG 1 51 THR MG 4.027 2.014 6.040 2.473 1.919 4.612 0.095 10 0 "[ . 1 . 2]" 1
957 1 83 SER HB3 1 84 ALA MB 4.115 2.057 6.173 5.384 4.937 5.884 . 0 0 "[ . 1 . 2]" 1
958 1 56 PRO QB 1 84 ALA HA 4.186 2.093 6.279 5.484 4.903 6.053 . 0 0 "[ . 1 . 2]" 1
959 1 53 PRO HA 1 53 PRO HB2 2.474 . 3.711 2.775 2.666 3.013 . 0 0 "[ . 1 . 2]" 1
960 1 124 GLU H 1 124 GLU HG3 4.058 2.029 6.087 3.903 2.563 5.095 . 0 0 "[ . 1 . 2]" 1
961 1 81 THR HA 1 109 VAL QG 4.001 . 6.002 2.924 2.046 4.107 . 0 0 "[ . 1 . 2]" 1
962 1 53 PRO HA 1 54 GLY H 3.137 . 4.705 2.353 2.200 2.407 . 0 0 "[ . 1 . 2]" 1
963 1 77 LEU QD 1 119 ILE HG12 4.192 2.096 6.225 3.411 2.113 5.187 . 0 0 "[ . 1 . 2]" 1
964 1 52 VAL HA 1 53 PRO HD3 2.921 . 3.982 2.703 2.337 2.989 . 0 0 "[ . 1 . 2]" 1
965 1 52 VAL HA 1 53 PRO HD2 2.860 . 4.290 2.164 1.871 2.442 . 0 0 "[ . 1 . 2]" 1
966 1 28 VAL MG1 1 56 PRO HA 3.518 . 4.287 3.051 2.223 4.202 . 0 0 "[ . 1 . 2]" 1
967 1 70 ALA HA 1 71 PRO HA 3.253 . 4.880 4.480 4.436 4.519 . 0 0 "[ . 1 . 2]" 1
968 1 63 ALA MB 1 66 ILE MD 2.826 . 4.239 4.196 3.870 4.439 0.200 15 0 "[ . 1 . 2]" 1
969 1 66 ILE HA 1 66 ILE MD 4.018 2.009 6.027 3.645 2.045 3.863 . 0 0 "[ . 1 . 2]" 1
970 1 109 VAL HB 1 114 GLU HB3 4.016 2.008 6.024 4.795 2.792 6.178 0.154 11 0 "[ . 1 . 2]" 1
971 1 68 GLU QG 1 69 LYS HA 2.991 . 4.486 3.625 3.127 4.033 . 0 0 "[ . 1 . 2]" 1
972 1 66 ILE HB 1 66 ILE MD 3.351 . 5.026 2.508 2.374 3.232 . 0 0 "[ . 1 . 2]" 1
973 1 39 ARG HB3 1 49 LEU QD 3.073 . 4.610 4.025 3.469 4.517 . 0 0 "[ . 1 . 2]" 1
974 1 105 ARG HB2 1 105 ARG HD3 3.979 . 5.968 3.078 2.414 4.233 . 0 0 "[ . 1 . 2]" 1
975 1 94 LYS HB2 1 95 ALA MB 3.226 . 4.839 4.665 3.744 5.337 0.498 9 0 "[ . 1 . 2]" 1
976 1 41 MET HG2 1 119 ILE HB 4.309 2.154 6.464 5.455 4.700 6.485 0.021 12 0 "[ . 1 . 2]" 1
977 1 72 GLY HA3 1 73 PRO HD2 3.175 . 4.763 2.511 2.017 2.783 . 0 0 "[ . 1 . 2]" 1
978 1 73 PRO HA 1 73 PRO HB3 2.872 . 4.308 2.282 2.256 2.305 . 0 0 "[ . 1 . 2]" 1
979 1 27 ILE HA 1 79 LEU HG 3.052 . 4.578 4.356 3.543 4.704 0.126 18 0 "[ . 1 . 2]" 1
980 1 101 LYS HA 1 101 LYS HB3 2.723 . 4.085 2.583 2.360 3.026 . 0 0 "[ . 1 . 2]" 1
981 1 56 PRO HA 1 59 ALA MB 2.971 . 4.456 3.236 2.274 4.396 . 0 0 "[ . 1 . 2]" 1
982 1 70 ALA HA 1 74 VAL QG 3.733 . 5.600 4.125 3.835 4.376 . 0 0 "[ . 1 . 2]" 1
983 1 119 ILE HB 1 120 LYS H 3.249 . 4.873 2.612 2.340 2.839 . 0 0 "[ . 1 . 2]" 1
984 1 39 ARG HA 1 42 ALA MB 3.110 . 4.257 2.484 2.134 2.897 . 0 0 "[ . 1 . 2]" 1
985 1 80 ILE MD 1 92 ALA MB 2.963 . 4.445 2.804 1.981 3.924 . 0 0 "[ . 1 . 2]" 1
986 1 56 PRO HA 1 60 ILE H 4.266 2.133 6.399 4.626 3.332 5.224 . 0 0 "[ . 1 . 2]" 1
987 1 45 ALA MB 1 119 ILE MG 2.706 . 4.059 3.542 2.667 4.150 0.091 10 0 "[ . 1 . 2]" 1
988 1 81 THR MG 1 109 VAL HB 4.018 2.027 6.027 4.051 2.235 6.079 0.052 6 0 "[ . 1 . 2]" 1
989 1 55 SER HA 1 55 SER HB2 2.937 . 4.406 2.864 2.528 3.035 . 0 0 "[ . 1 . 2]" 1
990 1 69 LYS H 1 70 ALA MB 4.296 2.148 6.444 4.001 3.686 4.234 . 0 0 "[ . 1 . 2]" 1
991 1 59 ALA HA 1 62 LEU MD1 3.844 . 5.766 5.119 4.476 5.728 . 0 0 "[ . 1 . 2]" 1
992 1 34 LEU QD 1 115 ALA MB 2.542 . 3.764 2.249 1.732 2.773 . 0 0 "[ . 1 . 2]" 1
993 1 62 LEU MD1 1 65 GLU HB2 3.265 . 4.898 3.353 1.998 4.560 . 0 0 "[ . 1 . 2]" 1
994 1 113 ASP HA 1 115 ALA MB 4.017 2.009 6.025 4.946 4.464 5.257 . 0 0 "[ . 1 . 2]" 1
995 1 92 ALA MB 1 106 VAL HB 3.059 . 4.589 4.533 3.905 4.661 0.072 20 0 "[ . 1 . 2]" 1
996 1 38 ALA HA 1 115 ALA MB 3.772 . 5.658 4.117 2.953 5.303 . 0 0 "[ . 1 . 2]" 1
997 1 62 LEU MD1 1 66 ILE H 4.047 2.024 6.070 3.562 3.237 3.883 . 0 0 "[ . 1 . 2]" 1
998 1 62 LEU H 1 62 LEU MD1 3.794 . 5.691 4.200 4.069 4.306 . 0 0 "[ . 1 . 2]" 1
999 1 111 SER H 1 115 ALA MB 3.924 . 5.886 5.047 4.271 5.647 . 0 0 "[ . 1 . 2]" 1
1000 1 66 ILE HA 1 66 ILE MG 3.419 . 4.032 2.395 2.340 2.484 . 0 0 "[ . 1 . 2]" 1
1001 1 22 ARG HA 1 22 ARG HB3 2.830 . 4.245 2.731 2.433 3.026 . 0 0 "[ . 1 . 2]" 1
1002 1 65 GLU HB2 1 66 ILE MG 4.260 2.130 6.390 6.186 5.301 6.793 0.403 15 0 "[ . 1 . 2]" 1
1003 1 61 ARG QG 1 95 ALA HA 4.127 2.063 6.191 5.459 4.560 6.008 . 0 0 "[ . 1 . 2]" 1
1004 1 25 VAL MG1 1 119 ILE HG12 3.810 . 5.715 2.862 2.263 4.165 . 0 0 "[ . 1 . 2]" 1
1005 1 120 LYS HA 1 120 LYS HG2 4.052 2.026 6.078 3.318 2.464 3.842 . 0 0 "[ . 1 . 2]" 1
1006 1 82 GLY HA2 1 110 THR MG 4.099 2.050 6.148 3.498 2.063 5.589 . 0 0 "[ . 1 . 2]" 1
1007 1 22 ARG HB3 1 22 ARG HD3 3.940 . 4.730 3.210 2.361 4.205 . 0 0 "[ . 1 . 2]" 1
1008 1 119 ILE MG 1 123 SER HB3 3.243 . 4.864 4.246 3.331 4.894 0.030 9 0 "[ . 1 . 2]" 1
1009 1 22 ARG HB3 1 22 ARG HD2 4.315 2.157 4.899 3.343 2.464 4.238 . 0 0 "[ . 1 . 2]" 1
1010 1 25 VAL MG1 1 79 LEU HB3 4.015 2.008 6.022 4.924 3.506 5.289 . 0 0 "[ . 1 . 2]" 1
1011 1 27 ILE QG 1 38 ALA MB 3.943 . 5.914 3.699 2.461 4.729 . 0 0 "[ . 1 . 2]" 1
1012 1 25 VAL MG1 1 49 LEU HB2 4.056 2.028 6.084 4.137 3.617 5.048 . 0 0 "[ . 1 . 2]" 1
1013 1 42 ALA HA 1 119 ILE MG 3.077 . 4.616 3.053 2.156 4.035 . 0 0 "[ . 1 . 2]" 1
1014 1 38 ALA MB 1 41 MET HB2 3.915 . 5.873 4.402 3.985 5.854 . 0 0 "[ . 1 . 2]" 1
1015 1 38 ALA MB 1 39 ARG HB2 3.951 . 5.926 4.031 3.759 4.610 . 0 0 "[ . 1 . 2]" 1
1016 1 81 THR HA 1 81 THR MG 3.396 . 4.194 2.543 2.259 3.218 . 0 0 "[ . 1 . 2]" 1
1017 1 80 ILE HG12 1 108 THR HA 4.148 2.074 6.222 4.036 2.439 5.568 . 0 0 "[ . 1 . 2]" 1
1018 1 23 LEU QD 1 123 SER HA 3.734 . 4.507 2.572 1.874 3.530 . 0 0 "[ . 1 . 2]" 1
1019 1 21 MET HA 1 21 MET HG3 3.873 . 5.809 2.820 2.493 3.835 . 0 0 "[ . 1 . 2]" 1
1020 1 93 LYS HA 1 93 LYS QG 3.279 . 4.919 2.715 2.321 3.354 . 0 0 "[ . 1 . 2]" 1
1021 1 26 LEU HB2 1 50 ILE HB 4.149 2.074 6.224 5.125 4.502 5.649 . 0 0 "[ . 1 . 2]" 1
1022 1 90 THR MG 1 91 LYS H 4.091 2.045 6.137 3.568 2.406 4.021 . 0 0 "[ . 1 . 2]" 1
1023 1 23 LEU QD 1 75 LYS HB2 3.321 . 4.982 3.154 1.836 4.751 . 0 0 "[ . 1 . 2]" 1
1024 1 69 LYS HA 1 69 LYS HE2 4.305 2.152 6.458 4.431 1.827 6.024 0.325 8 0 "[ . 1 . 2]" 1
1025 1 69 LYS HA 1 69 LYS HB2 2.783 . 4.175 3.021 3.013 3.027 . 0 0 "[ . 1 . 2]" 1
1026 1 49 LEU QD 1 51 THR HB 3.908 . 5.862 4.632 4.255 5.298 . 0 0 "[ . 1 . 2]" 1
1027 1 44 LYS HB2 1 45 ALA MB 3.571 . 5.356 4.822 3.582 5.274 . 0 0 "[ . 1 . 2]" 1
1028 1 39 ARG HA 1 39 ARG HG3 2.933 . 4.399 2.624 2.450 3.166 . 0 0 "[ . 1 . 2]" 1
1029 1 36 GLU HA 1 39 ARG HB2 3.291 . 4.937 3.624 2.396 4.487 . 0 0 "[ . 1 . 2]" 1
1030 1 39 ARG HA 1 39 ARG HG2 3.046 . 4.569 3.097 2.313 3.842 . 0 0 "[ . 1 . 2]" 1
1031 1 39 ARG HB2 1 39 ARG HD2 3.829 . 5.744 2.860 2.381 3.795 . 0 0 "[ . 1 . 2]" 1
1032 1 38 ALA MB 1 39 ARG HA 3.772 . 5.658 3.835 3.740 3.916 . 0 0 "[ . 1 . 2]" 1
1033 1 39 ARG H 1 39 ARG HD2 4.201 2.101 6.301 5.050 4.685 5.980 . 0 0 "[ . 1 . 2]" 1
1034 1 39 ARG HA 1 42 ALA H 3.630 . 5.445 3.320 3.038 3.733 . 0 0 "[ . 1 . 2]" 1
1035 1 119 ILE MG 1 122 PHE HB2 4.249 2.124 6.374 4.864 4.015 5.707 . 0 0 "[ . 1 . 2]" 1
1036 1 38 ALA H 1 39 ARG HA 4.161 2.080 6.242 5.272 5.217 5.349 . 0 0 "[ . 1 . 2]" 1
1037 1 117 ARG HA 1 117 ARG HD3 4.248 2.124 6.372 4.194 2.101 5.507 0.023 10 0 "[ . 1 . 2]" 1
1038 1 117 ARG HD3 1 118 TRP HA 3.758 . 5.637 5.089 2.598 5.722 0.085 14 0 "[ . 1 . 2]" 1
1039 1 39 ARG HA 1 41 MET H 4.242 2.121 6.363 4.354 4.064 4.772 . 0 0 "[ . 1 . 2]" 1
1040 1 26 LEU HG 1 52 VAL QG 3.033 . 4.549 4.005 2.528 4.555 0.006 17 0 "[ . 1 . 2]" 1
1041 1 72 GLY HA2 1 73 PRO HG2 3.926 . 5.889 5.078 4.839 5.537 . 0 0 "[ . 1 . 2]" 1
1042 1 36 GLU QB 1 38 ALA H 4.152 2.076 6.228 4.645 4.363 5.186 . 0 0 "[ . 1 . 2]" 1
1043 1 56 PRO QB 1 84 ALA MB 3.643 . 5.464 3.991 3.344 4.602 . 0 0 "[ . 1 . 2]" 1
1044 1 26 LEU QD 1 62 LEU HG 2.598 . 3.897 2.630 2.121 3.527 . 0 0 "[ . 1 . 2]" 1
1045 1 84 ALA MB 1 89 LYS H 4.308 2.154 6.462 3.296 2.955 3.494 . 0 0 "[ . 1 . 2]" 1
1046 1 28 VAL MG2 1 59 ALA HA 4.085 2.042 6.128 4.589 3.801 6.556 0.428 15 0 "[ . 1 . 2]" 1
1047 1 49 LEU HA 1 50 ILE HA 3.947 . 5.920 4.382 4.361 4.422 . 0 0 "[ . 1 . 2]" 1
1048 1 38 ALA HA 1 119 ILE MD 3.863 . 4.310 2.570 2.059 4.337 0.027 11 0 "[ . 1 . 2]" 1
1049 1 39 ARG HD2 1 49 LEU QD 3.749 . 5.623 3.778 2.623 5.035 . 0 0 "[ . 1 . 2]" 1
1050 1 25 VAL HB 1 42 ALA MB 3.913 . 5.022 3.647 3.058 4.309 . 0 0 "[ . 1 . 2]" 1
1051 1 26 LEU QD 1 63 ALA MB 2.653 . 3.979 2.077 1.859 2.513 . 0 0 "[ . 1 . 2]" 1
1052 1 42 ALA MB 1 49 LEU HA 3.692 . 5.538 3.958 3.539 4.254 . 0 0 "[ . 1 . 2]" 1
1053 1 49 LEU HA 1 49 LEU HG 3.281 . 4.922 2.863 2.360 3.760 . 0 0 "[ . 1 . 2]" 1
1054 1 62 LEU HB3 1 62 LEU MD2 2.976 . 4.464 2.809 2.293 3.205 . 0 0 "[ . 1 . 2]" 1
1055 1 27 ILE HB 1 109 VAL QG 4.064 2.032 6.096 5.220 4.278 5.946 . 0 0 "[ . 1 . 2]" 1
1056 1 116 LYS HA 1 119 ILE MD . 2.156 4.208 2.948 2.136 3.937 0.020 19 0 "[ . 1 . 2]" 1
1057 1 32 LYS HA 1 35 ILE MG 3.037 . 4.556 4.244 3.769 4.598 0.042 1 0 "[ . 1 . 2]" 1
1058 1 52 VAL HA 1 52 VAL QG 2.568 . 3.852 2.185 2.123 2.396 . 0 0 "[ . 1 . 2]" 1
1059 1 34 LEU QD 1 35 ILE HA 3.715 . 5.572 3.562 2.389 4.217 . 0 0 "[ . 1 . 2]" 1
1060 1 47 LEU HA 1 47 LEU QD 3.209 . 4.814 2.180 1.936 3.411 . 0 0 "[ . 1 . 2]" 1
1061 1 73 PRO HA 1 73 PRO HD2 3.758 . 5.637 3.960 3.894 4.096 . 0 0 "[ . 1 . 2]" 1
1062 1 86 PRO HB2 1 86 PRO HD3 3.759 . 5.638 3.874 3.857 3.909 . 0 0 "[ . 1 . 2]" 1
1063 1 77 LEU QD 1 105 ARG HB2 3.815 . 5.722 3.430 1.978 4.939 . 0 0 "[ . 1 . 2]" 1
1064 1 52 VAL QG 1 54 GLY QA 3.783 . 5.675 4.111 3.703 4.442 . 0 0 "[ . 1 . 2]" 1
1065 1 66 ILE MG 1 70 ALA MB 3.818 . 5.727 2.948 2.559 3.369 . 0 0 "[ . 1 . 2]" 1
1066 1 67 ALA HA 1 70 ALA MB 3.564 . 4.629 2.741 2.295 3.316 . 0 0 "[ . 1 . 2]" 1
1067 1 45 ALA HA 1 45 ALA MB 2.412 . 3.618 2.126 2.121 2.130 . 0 0 "[ . 1 . 2]" 1
1068 1 109 VAL HB 1 115 ALA MB 4.048 2.024 6.072 3.425 2.544 4.070 . 0 0 "[ . 1 . 2]" 1
1069 1 28 VAL MG2 1 59 ALA MB 2.734 . 4.101 2.400 1.835 4.199 0.098 15 0 "[ . 1 . 2]" 1
1070 1 114 GLU HA 1 114 GLU HG3 3.690 . 4.482 3.131 2.508 3.862 . 0 0 "[ . 1 . 2]" 1
1071 1 52 VAL QG 1 53 PRO HD2 3.355 . 4.856 2.707 1.956 3.691 . 0 0 "[ . 1 . 2]" 1
1072 1 86 PRO HB2 1 86 PRO HD2 3.874 . 5.811 3.213 3.001 4.023 . 0 0 "[ . 1 . 2]" 1
1073 1 41 MET HA 1 119 ILE MG 3.668 . 5.502 4.538 3.924 5.451 . 0 0 "[ . 1 . 2]" 1
1074 1 52 VAL QG 1 59 ALA MB 2.923 . 4.384 2.479 1.712 3.611 0.008 12 0 "[ . 1 . 2]" 1
1075 1 90 THR HA 1 93 LYS QG 3.782 . 5.673 4.028 2.057 5.266 . 0 0 "[ . 1 . 2]" 1
1076 1 49 LEU QD 1 50 ILE HA 3.752 . 5.628 3.197 2.906 4.144 . 0 0 "[ . 1 . 2]" 1
1077 1 24 VAL HB 1 26 LEU QD 3.397 . 5.096 3.782 3.096 4.145 . 0 0 "[ . 1 . 2]" 1
1078 1 83 SER HA 1 84 ALA MB 3.954 . 5.931 4.029 3.957 4.199 . 0 0 "[ . 1 . 2]" 1
1079 1 26 LEU QD 1 62 LEU HB3 3.285 . 4.928 2.261 1.755 3.043 . 0 0 "[ . 1 . 2]" 1
1080 1 66 ILE HB 1 76 VAL MG1 3.419 . 5.128 3.863 2.875 4.291 . 0 0 "[ . 1 . 2]" 1
1081 1 102 TRP HB2 1 104 VAL QG 3.718 . 5.577 2.429 1.942 3.766 . 0 0 "[ . 1 . 2]" 1
1082 1 41 MET HG3 1 119 ILE MG 3.854 . 5.668 4.172 2.875 5.107 . 0 0 "[ . 1 . 2]" 1
1083 1 41 MET HG2 1 119 ILE MG 3.691 . 5.536 4.792 4.369 5.404 . 0 0 "[ . 1 . 2]" 1
1084 1 102 TRP HB3 1 104 VAL QG 3.832 . 5.748 3.229 2.691 4.540 . 0 0 "[ . 1 . 2]" 1
1085 1 117 ARG HA 1 120 LYS H 3.167 . 4.750 3.656 3.180 4.071 . 0 0 "[ . 1 . 2]" 1
1086 1 34 LEU QD 1 38 ALA MB 2.805 . 4.207 3.019 2.396 3.851 . 0 0 "[ . 1 . 2]" 1
1087 1 56 PRO QB 1 92 ALA HA 3.122 . 4.683 3.789 3.077 4.502 . 0 0 "[ . 1 . 2]" 1
1088 1 34 LEU QD 1 35 ILE H 3.617 . 5.426 3.494 2.703 3.843 . 0 0 "[ . 1 . 2]" 1
1089 1 34 LEU QD 1 111 SER HA 4.107 2.054 6.160 4.002 3.177 5.092 . 0 0 "[ . 1 . 2]" 1
1090 1 50 ILE H 1 50 ILE HG13 3.728 . 5.592 3.458 2.841 4.338 . 0 0 "[ . 1 . 2]" 1
1091 1 64 GLN H 1 64 GLN HB3 3.790 . 5.685 2.793 2.384 3.592 . 0 0 "[ . 1 . 2]" 1
1092 1 26 LEU HB3 1 78 VAL HA 4.231 2.115 6.347 3.986 3.001 4.770 . 0 0 "[ . 1 . 2]" 1
1093 1 25 VAL MG1 1 77 LEU QD 2.939 . 4.408 2.888 2.437 3.458 . 0 0 "[ . 1 . 2]" 1
1094 1 38 ALA HA 1 41 MET HG3 4.208 2.104 6.312 3.770 2.819 5.263 . 0 0 "[ . 1 . 2]" 1
1095 1 42 ALA MB 1 48 GLU HA 4.149 2.075 6.223 4.438 3.586 5.025 . 0 0 "[ . 1 . 2]" 1
1096 1 38 ALA HA 1 41 MET HG2 4.166 2.083 6.249 3.823 2.081 5.207 0.002 4 0 "[ . 1 . 2]" 1
1097 1 38 ALA HA 1 41 MET HB2 3.061 . 4.591 3.121 2.640 4.799 0.208 4 0 "[ . 1 . 2]" 1
1098 1 114 GLU HA 1 114 GLU HG2 3.526 . 5.289 3.013 2.506 3.756 . 0 0 "[ . 1 . 2]" 1
1099 1 38 ALA HA 1 39 ARG HB2 3.904 . 5.856 5.804 5.691 5.935 0.079 19 0 "[ . 1 . 2]" 1
1100 1 114 GLU H 1 114 GLU HG2 3.600 . 5.400 3.383 1.971 4.605 . 0 0 "[ . 1 . 2]" 1
1101 1 60 ILE HA 1 104 VAL QG 3.971 . 5.957 3.369 2.908 3.830 . 0 0 "[ . 1 . 2]" 1
1102 1 63 ALA HA 1 76 VAL MG2 2.953 . 4.430 3.371 2.625 4.342 . 0 0 "[ . 1 . 2]" 1
1103 1 43 GLU HA 1 44 LYS H 3.234 . 4.851 3.488 3.425 3.546 . 0 0 "[ . 1 . 2]" 1
1104 1 41 MET HG3 1 119 ILE HB 3.712 . 5.568 4.322 3.109 5.750 0.182 14 0 "[ . 1 . 2]" 1
1105 1 77 LEU QD 1 79 LEU HG 3.428 . 5.142 3.713 3.012 4.452 . 0 0 "[ . 1 . 2]" 1
1106 1 79 LEU HG 1 118 TRP HB2 4.147 2.073 6.221 5.026 4.033 6.137 . 0 0 "[ . 1 . 2]" 1
1107 1 79 LEU HG 1 119 ILE HG12 3.803 . 5.705 4.754 3.600 6.318 0.613 14 1 "[ . 1 +. 2]" 1
1108 1 41 MET HA 1 41 MET HG3 3.826 . 5.739 3.632 3.084 3.791 . 0 0 "[ . 1 . 2]" 1
1109 1 107 ARG HA 1 108 THR H 3.000 . 4.500 2.258 2.126 2.429 . 0 0 "[ . 1 . 2]" 1
1110 1 79 LEU H 1 79 LEU HG 4.284 2.142 6.426 3.739 2.680 4.594 . 0 0 "[ . 1 . 2]" 1
1111 1 79 LEU HG 1 80 ILE H 4.111 2.056 6.166 5.401 3.443 5.834 . 0 0 "[ . 1 . 2]" 1
1112 1 79 LEU HA 1 79 LEU HG 4.189 2.095 6.283 3.524 2.882 3.809 . 0 0 "[ . 1 . 2]" 1
1113 1 100 ARG HD2 1 100 ARG HG2 2.788 . 4.182 2.703 2.407 3.015 . 0 0 "[ . 1 . 2]" 1
1114 1 100 ARG HA 1 100 ARG HD2 3.488 . 5.232 4.458 1.950 5.207 . 0 0 "[ . 1 . 2]" 1
1115 1 37 GLU HA 1 40 LYS HB2 2.377 . 3.566 2.664 2.531 2.843 . 0 0 "[ . 1 . 2]" 1
1116 1 113 ASP QB 1 114 GLU HG3 4.231 2.115 6.347 4.580 3.271 6.162 . 0 0 "[ . 1 . 2]" 1
1117 1 100 ARG H 1 100 ARG HD2 4.214 2.107 6.321 4.903 4.114 5.918 . 0 0 "[ . 1 . 2]" 1
1118 1 52 VAL HA 1 52 VAL HB 2.992 . 4.488 2.931 2.372 3.035 . 0 0 "[ . 1 . 2]" 1
1119 1 60 ILE HG12 1 60 ILE MG 3.363 . 5.045 2.822 2.166 3.206 . 0 0 "[ . 1 . 2]" 1
1120 1 60 ILE MG 1 99 ALA MB 2.954 . 4.431 2.301 1.823 3.083 . 0 0 "[ . 1 . 2]" 1
1121 1 60 ILE H 1 60 ILE MG 3.751 . 5.627 3.773 3.749 3.790 . 0 0 "[ . 1 . 2]" 1
1122 1 86 PRO HA 1 86 PRO HB2 2.574 . 3.861 2.976 2.837 3.002 . 0 0 "[ . 1 . 2]" 1
1123 1 81 THR HA 1 108 THR MG 2.864 . 4.296 3.777 3.059 4.332 0.036 5 0 "[ . 1 . 2]" 1
1124 1 62 LEU HA 1 62 LEU HG 4.149 2.074 6.224 3.453 3.097 3.755 . 0 0 "[ . 1 . 2]" 1
1125 1 56 PRO QB 1 80 ILE HB 3.719 . 5.578 4.289 2.809 5.414 . 0 0 "[ . 1 . 2]" 1
1126 1 85 ASP HA 1 86 PRO HA 3.983 . 5.974 4.379 4.328 4.462 . 0 0 "[ . 1 . 2]" 1
1127 1 27 ILE QG 1 79 LEU HB2 3.854 . 5.781 2.886 1.953 5.127 . 0 0 "[ . 1 . 2]" 1
1128 1 114 GLU HA 1 115 ALA HA 4.049 2.025 5.332 4.823 4.784 4.865 . 0 0 "[ . 1 . 2]" 1
1129 1 75 LYS HA 1 103 ASN HB2 3.972 . 5.958 3.703 2.189 5.618 . 0 0 "[ . 1 . 2]" 1
1130 1 105 ARG HB2 1 106 VAL H 4.227 2.114 6.340 3.786 2.672 4.495 . 0 0 "[ . 1 . 2]" 1
1131 1 115 ALA HA 1 115 ALA MB 2.478 . 3.717 2.128 2.123 2.131 . 0 0 "[ . 1 . 2]" 1
1132 1 99 ALA MB 1 104 VAL HB 3.122 . 4.683 2.259 1.818 3.997 . 0 0 "[ . 1 . 2]" 1
1133 1 46 ASN HA 1 46 ASN HB2 2.758 . 4.137 2.808 2.318 3.026 . 0 0 "[ . 1 . 2]" 1
1134 1 41 MET HA 1 41 MET HG2 3.966 . 5.949 2.979 2.465 3.737 . 0 0 "[ . 1 . 2]" 1
1135 1 31 ASP HB2 1 34 LEU HB3 4.097 2.048 6.146 4.641 2.049 6.269 0.123 9 0 "[ . 1 . 2]" 1
1136 1 25 VAL MG1 1 47 LEU HB2 4.015 2.007 6.023 5.253 4.540 6.073 0.050 16 0 "[ . 1 . 2]" 1
1137 1 37 GLU HA 1 37 GLU HG3 3.021 . 4.532 3.105 2.402 3.768 . 0 0 "[ . 1 . 2]" 1
1138 1 47 LEU HB2 1 47 LEU QD 3.104 . 4.656 2.277 2.088 2.354 . 0 0 "[ . 1 . 2]" 1
1139 1 100 ARG HA 1 100 ARG HG3 4.084 2.042 4.718 2.822 2.429 3.728 . 0 0 "[ . 1 . 2]" 1
1140 1 97 GLU HA 1 100 ARG HG3 4.063 2.031 6.095 4.515 2.549 5.761 . 0 0 "[ . 1 . 2]" 1
1141 1 80 ILE HB 1 108 THR HA 3.715 . 5.572 3.469 1.960 4.824 . 0 0 "[ . 1 . 2]" 1
1142 1 47 LEU QD 1 123 SER HA 3.153 . 4.730 2.831 1.903 4.053 . 0 0 "[ . 1 . 2]" 1
1143 1 27 ILE MD 1 34 LEU HG 3.095 . 4.643 3.355 1.912 4.673 0.030 15 0 "[ . 1 . 2]" 1
1144 1 72 GLY HA2 1 73 PRO HD2 3.198 . 4.797 3.490 2.922 3.887 . 0 0 "[ . 1 . 2]" 1
1145 1 47 LEU QD 1 123 SER HB3 3.311 . 4.966 2.934 1.821 4.230 . 0 0 "[ . 1 . 2]" 1
1146 1 61 ARG QG 1 64 GLN HB3 3.166 . 4.749 4.629 3.924 5.675 0.926 12 4 "[* . 1 + *- 2]" 1
1147 1 23 LEU QD 1 123 SER HB3 4.078 2.065 6.117 4.208 2.823 5.554 . 0 0 "[ . 1 . 2]" 1
1148 1 33 LYS HA 1 37 GLU H 2.971 . 4.456 4.042 3.514 4.545 0.089 13 0 "[ . 1 . 2]" 1
1149 1 73 PRO HB3 1 73 PRO HD3 4.072 2.036 6.108 3.789 3.001 4.061 . 0 0 "[ . 1 . 2]" 1
1150 1 73 PRO HB2 1 73 PRO HD3 3.182 . 4.773 3.916 3.876 3.986 . 0 0 "[ . 1 . 2]" 1
1151 1 28 VAL HA 1 28 VAL MG2 2.974 . 4.461 2.505 2.270 3.215 . 0 0 "[ . 1 . 2]" 1
1152 1 86 PRO HA 1 86 PRO HD2 3.578 . 5.367 3.919 3.868 4.004 . 0 0 "[ . 1 . 2]" 1
1153 1 53 PRO HB2 1 53 PRO HD2 3.246 . 4.869 3.917 2.852 4.057 . 0 0 "[ . 1 . 2]" 1
1154 1 85 ASP HA 1 86 PRO HD2 2.901 . 4.351 2.568 2.283 2.866 . 0 0 "[ . 1 . 2]" 1
1155 1 23 LEU MD1 1 23 LEU MD2 2.676 . 4.014 2.084 2.072 2.097 . 0 0 "[ . 1 . 2]" 1
1156 1 124 GLU HA 1 124 GLU HG3 3.367 . 5.051 3.089 2.408 3.774 . 0 0 "[ . 1 . 2]" 1
1157 1 113 ASP QB 1 114 GLU HA 4.277 2.138 6.034 4.062 3.804 4.571 . 0 0 "[ . 1 . 2]" 1
1158 1 116 LYS HA 1 119 ILE HB 3.704 . 4.002 3.001 2.408 3.497 . 0 0 "[ . 1 . 2]" 1
1159 1 61 ARG HB2 1 61 ARG HD2 2.767 . 4.150 3.079 2.311 3.726 . 0 0 "[ . 1 . 2]" 1
1160 1 60 ILE HB 1 106 VAL QG 3.926 . 5.889 4.763 4.032 5.656 . 0 0 "[ . 1 . 2]" 1
1161 1 78 VAL H 1 106 VAL QG 4.007 2.004 6.010 3.648 3.045 4.279 . 0 0 "[ . 1 . 2]" 1
1162 1 25 VAL HA 1 76 VAL HA 4.284 2.142 6.426 4.265 3.899 4.633 . 0 0 "[ . 1 . 2]" 1
1163 1 86 PRO HG3 1 87 ASP H 4.240 2.120 6.360 4.556 4.003 4.738 . 0 0 "[ . 1 . 2]" 1
1164 1 85 ASP HA 1 86 PRO HG3 4.180 2.090 6.270 4.417 4.249 4.689 . 0 0 "[ . 1 . 2]" 1
1165 1 100 ARG HA 1 100 ARG HG2 4.016 2.008 6.024 3.154 2.431 4.236 . 0 0 "[ . 1 . 2]" 1
1166 1 97 GLU HA 1 100 ARG HG2 3.894 . 5.841 4.716 2.544 6.026 0.185 1 0 "[ . 1 . 2]" 1
1167 1 85 ASP HB3 1 88 GLU HB2 3.814 . 5.721 4.208 2.290 5.082 . 0 0 "[ . 1 . 2]" 1
1168 1 118 TRP HA 1 121 GLU HB3 3.822 . 5.733 3.165 2.195 4.845 . 0 0 "[ . 1 . 2]" 1
1169 1 117 ARG HB2 1 117 ARG HD3 3.518 . 5.277 3.365 2.346 4.233 . 0 0 "[ . 1 . 2]" 1
1170 1 75 LYS HA 1 75 LYS HG2 4.017 2.009 6.025 3.135 2.563 3.779 . 0 0 "[ . 1 . 2]" 1
1171 1 28 VAL HB 1 59 ALA MB 4.054 2.027 6.081 4.495 3.457 5.338 . 0 0 "[ . 1 . 2]" 1
1172 1 33 LYS HA 1 33 LYS HB3 2.859 . 4.288 2.760 2.421 3.026 . 0 0 "[ . 1 . 2]" 1
1173 1 28 VAL HA 1 29 SER H 2.841 . 4.261 2.230 2.155 2.364 . 0 0 "[ . 1 . 2]" 1
1174 1 59 ALA MB 1 62 LEU HB3 4.198 2.099 6.297 4.322 3.694 4.860 . 0 0 "[ . 1 . 2]" 1
1175 1 84 ALA HA 1 84 ALA MB 2.399 . 3.598 2.131 2.127 2.135 . 0 0 "[ . 1 . 2]" 1
1176 1 61 ARG HA 1 61 ARG HB2 2.453 . 3.680 2.899 2.513 3.024 . 0 0 "[ . 1 . 2]" 1
1177 1 93 LYS HA 1 96 ALA MB 2.679 . 4.018 2.758 2.203 3.186 . 0 0 "[ . 1 . 2]" 1
1178 1 90 THR MG 1 91 LYS HA 3.419 . 5.129 3.836 3.366 5.282 0.153 5 0 "[ . 1 . 2]" 1
1179 1 61 ARG H 1 61 ARG HA 2.871 . 4.306 2.835 2.806 2.865 . 0 0 "[ . 1 . 2]" 1
1180 1 55 SER HB3 1 56 PRO QB 3.718 . 5.577 5.309 4.230 6.267 0.690 16 7 "[* * ** 1 * -+ 2]" 1
1181 1 34 LEU HA 1 112 PRO HG3 3.923 . 5.885 3.817 2.179 5.767 . 0 0 "[ . 1 . 2]" 1
1182 1 21 MET HB3 1 22 ARG H 4.187 2.094 6.280 4.114 2.579 4.491 . 0 0 "[ . 1 . 2]" 1
1183 1 22 ARG HB3 1 22 ARG HG3 2.861 . 4.292 2.593 2.370 3.014 . 0 0 "[ . 1 . 2]" 1
1184 1 23 LEU HB2 1 47 LEU QD 3.585 . 5.378 2.135 1.736 3.242 0.056 16 0 "[ . 1 . 2]" 1
1185 1 66 ILE MG 1 67 ALA HA 3.375 2.069 5.062 3.401 3.013 3.668 . 0 0 "[ . 1 . 2]" 1
1186 1 56 PRO HA 1 80 ILE MD 4.071 2.036 6.106 4.388 3.286 5.318 . 0 0 "[ . 1 . 2]" 1
1187 1 80 ILE HA 1 80 ILE MD 4.255 2.127 6.383 3.892 2.117 4.198 0.010 6 0 "[ . 1 . 2]" 1
1188 1 24 VAL MG1 1 49 LEU HA 3.533 . 5.300 4.102 3.509 4.999 . 0 0 "[ . 1 . 2]" 1
1189 1 27 ILE QG 1 79 LEU HG 3.441 . 5.161 4.250 3.061 5.048 . 0 0 "[ . 1 . 2]" 1
1190 1 34 LEU HG 1 112 PRO HA 3.911 . 5.866 4.093 2.288 5.002 . 0 0 "[ . 1 . 2]" 1
1191 1 60 ILE MD 1 96 ALA HA 3.555 . 5.332 3.515 2.518 4.773 . 0 0 "[ . 1 . 2]" 1
1192 1 60 ILE HA 1 60 ILE MD 3.713 . 5.569 2.882 2.039 3.870 . 0 0 "[ . 1 . 2]" 1
1193 1 56 PRO QB 1 60 ILE MD 3.770 . 5.655 3.779 2.508 4.597 . 0 0 "[ . 1 . 2]" 1
1194 1 22 ARG HG2 1 24 VAL MG2 3.755 . 5.633 4.314 2.241 5.989 0.356 19 0 "[ . 1 . 2]" 1
1195 1 50 ILE HA 1 51 THR MG 4.103 2.052 6.154 4.367 3.768 5.472 . 0 0 "[ . 1 . 2]" 1
1196 1 113 ASP HA 1 116 LYS HA 4.201 2.100 6.302 5.676 5.079 6.204 . 0 0 "[ . 1 . 2]" 1
1197 1 35 ILE HG12 1 51 THR MG 3.823 . 5.735 3.260 2.123 4.620 . 0 0 "[ . 1 . 2]" 1
1198 1 31 ASP HB3 1 34 LEU HB2 4.156 2.078 6.234 3.575 2.597 5.155 . 0 0 "[ . 1 . 2]" 1
1199 1 107 ARG HB3 1 107 ARG HD3 3.727 . 5.591 2.990 2.347 4.193 . 0 0 "[ . 1 . 2]" 1
1200 1 77 LEU HG 1 78 VAL HA 4.714 2.357 7.071 4.458 3.809 6.644 . 0 0 "[ . 1 . 2]" 1
1201 1 66 ILE HB 1 67 ALA HA 3.876 . 5.814 4.238 4.059 4.421 . 0 0 "[ . 1 . 2]" 1
1202 1 78 VAL HA 1 78 VAL MG2 3.201 . 4.801 2.478 2.288 3.214 . 0 0 "[ . 1 . 2]" 1
1203 1 37 GLU HA 1 37 GLU HB2 2.392 . 3.588 2.724 2.442 3.025 . 0 0 "[ . 1 . 2]" 1
1204 1 21 MET HA 1 21 MET HG2 3.114 . 4.671 3.299 2.560 3.823 . 0 0 "[ . 1 . 2]" 1
1205 1 103 ASN H 1 103 ASN HA 2.967 . 4.450 2.260 2.253 2.266 . 0 0 "[ . 1 . 2]" 1
1206 1 53 PRO HA 1 53 PRO HD2 3.484 . 5.226 4.008 3.841 4.053 . 0 0 "[ . 1 . 2]" 1
1207 1 117 ARG HA 1 120 LYS HB3 2.975 . 4.463 3.260 2.352 5.225 0.762 7 1 "[ . + 1 . 2]" 1
1208 1 56 PRO HD3 1 84 ALA MB 3.998 . 5.997 5.213 3.664 6.034 0.037 2 0 "[ . 1 . 2]" 1
1209 1 52 VAL H 1 53 PRO HD2 4.555 2.278 6.832 4.590 4.253 4.962 . 0 0 "[ . 1 . 2]" 1
1210 1 27 ILE MD 1 38 ALA MB 3.294 . 4.941 2.964 2.071 4.217 . 0 0 "[ . 1 . 2]" 1
1211 1 52 VAL HA 1 53 PRO HG2 3.875 . 5.813 4.316 4.003 4.610 . 0 0 "[ . 1 . 2]" 1
1212 1 88 GLU HB3 1 92 ALA MB 3.111 . 4.666 4.205 3.859 4.402 . 0 0 "[ . 1 . 2]" 1
1213 1 53 PRO HA 1 53 PRO HG2 3.718 . 5.577 3.888 3.689 3.937 . 0 0 "[ . 1 . 2]" 1
1214 1 53 PRO HG2 1 54 GLY QA 4.005 2.002 6.008 5.267 4.633 6.294 0.286 7 0 "[ . 1 . 2]" 1
1215 1 67 ALA MB 1 76 VAL MG2 3.555 . 5.333 2.668 1.856 4.753 . 0 0 "[ . 1 . 2]" 1
1216 1 55 SER HB3 1 58 GLU H 4.099 2.049 6.149 3.827 3.043 4.877 . 0 0 "[ . 1 . 2]" 1
1217 1 25 VAL HA 1 26 LEU HA 4.171 2.086 6.256 4.396 4.374 4.413 . 0 0 "[ . 1 . 2]" 1
1218 1 55 SER HB3 1 57 GLU H 4.056 2.028 6.084 3.562 2.536 5.223 . 0 0 "[ . 1 . 2]" 1
1219 1 55 SER HB2 1 58 GLU H 4.273 2.136 6.410 2.791 2.102 3.322 0.034 14 0 "[ . 1 . 2]" 1
1220 1 59 ALA HA 1 62 LEU HB3 2.944 . 4.416 3.045 2.355 3.681 . 0 0 "[ . 1 . 2]" 1
1221 1 104 VAL HA 1 105 ARG H 3.037 . 4.555 2.168 2.131 2.224 . 0 0 "[ . 1 . 2]" 1
1222 1 92 ALA MB 1 93 LYS HB2 2.918 . 4.377 4.288 3.935 5.163 0.786 7 3 "[ * . + 1 . -2]" 1
1223 1 45 ALA HA 1 46 ASN H 3.370 . 5.055 3.137 2.965 3.257 . 0 0 "[ . 1 . 2]" 1
1224 1 63 ALA HA 1 66 ILE MD 3.631 . 5.446 3.064 2.570 3.510 . 0 0 "[ . 1 . 2]" 1
1225 1 23 LEU HA 1 23 LEU HB3 4.254 2.127 6.381 2.538 2.444 3.005 . 0 0 "[ . 1 . 2]" 1
1226 1 38 ALA HA 1 40 LYS H 4.199 2.100 6.298 4.465 4.255 4.776 . 0 0 "[ . 1 . 2]" 1
1227 1 28 VAL MG2 1 56 PRO HD3 4.266 2.133 6.399 4.784 3.790 5.802 . 0 0 "[ . 1 . 2]" 1
1228 1 116 LYS HA 1 119 ILE MG 3.857 . 5.785 4.265 3.665 4.685 . 0 0 "[ . 1 . 2]" 1
1229 1 26 LEU HG 1 66 ILE MD 3.348 . 5.022 3.560 3.049 4.636 . 0 0 "[ . 1 . 2]" 1
1230 1 62 LEU HB3 1 62 LEU MD1 3.186 . 4.779 2.766 2.339 3.204 . 0 0 "[ . 1 . 2]" 1
1231 1 66 ILE H 1 66 ILE MD 3.950 . 5.925 3.524 2.999 3.711 . 0 0 "[ . 1 . 2]" 1
1232 1 55 SER HA 1 56 PRO HD3 2.953 . 4.429 2.217 1.860 2.788 . 0 0 "[ . 1 . 2]" 1
1233 1 71 PRO HB2 1 72 GLY H 4.297 2.149 6.445 3.992 3.922 4.178 . 0 0 "[ . 1 . 2]" 1
1234 1 51 THR HA 1 51 THR HB 2.925 . 4.388 2.697 2.522 3.026 . 0 0 "[ . 1 . 2]" 1
1235 1 26 LEU H 1 76 VAL MG2 4.211 2.106 6.316 5.287 2.838 6.005 . 0 0 "[ . 1 . 2]" 1
1236 1 55 SER HB2 1 56 PRO HD3 3.167 . 4.750 4.454 3.868 4.956 0.206 3 0 "[ . 1 . 2]" 1
1237 1 119 ILE HB 1 119 ILE MD 3.574 . 5.361 2.470 2.414 3.237 . 0 0 "[ . 1 . 2]" 1
1238 1 38 ALA MB 1 119 ILE MD 3.532 . 5.298 2.274 1.977 3.136 . 0 0 "[ . 1 . 2]" 1
1239 1 76 VAL MG2 1 77 LEU H 3.382 . 5.073 3.774 2.467 4.163 . 0 0 "[ . 1 . 2]" 1
1240 1 36 GLU HA 1 39 ARG HB3 3.736 . 5.604 2.969 2.257 4.343 . 0 0 "[ . 1 . 2]" 1
1241 1 27 ILE QG 1 35 ILE MG 3.445 . 5.168 4.521 3.283 5.013 . 0 0 "[ . 1 . 2]" 1
1242 1 51 THR HA 1 52 VAL QG 2.820 . 4.230 3.678 3.212 3.930 . 0 0 "[ . 1 . 2]" 1
1243 1 89 LYS H 1 89 LYS HB2 3.285 . 4.927 2.459 2.243 2.566 . 0 0 "[ . 1 . 2]" 1
1244 1 40 LYS H 1 40 LYS HB2 3.225 . 4.837 2.477 2.350 2.585 . 0 0 "[ . 1 . 2]" 1
1245 1 28 VAL HA 1 28 VAL MG1 2.760 . 4.140 2.426 2.247 3.213 . 0 0 "[ . 1 . 2]" 1
1246 1 23 LEU HA 1 23 LEU HG 3.958 . 5.937 3.052 2.414 3.743 . 0 0 "[ . 1 . 2]" 1
1247 1 25 VAL MG1 1 42 ALA HA 4.199 2.099 6.299 5.560 4.596 6.310 0.011 14 0 "[ . 1 . 2]" 1
1248 1 95 ALA HA 1 98 GLU HB2 2.993 . 4.489 3.231 2.422 4.008 . 0 0 "[ . 1 . 2]" 1
1249 1 66 ILE HG12 1 66 ILE MG 3.570 . 5.355 2.471 2.297 3.202 . 0 0 "[ . 1 . 2]" 1
1250 1 66 ILE MG 1 67 ALA MB 3.894 . 5.841 4.043 3.475 4.333 . 0 0 "[ . 1 . 2]" 1
1251 1 82 GLY HA2 1 108 THR MG 3.537 . 5.306 4.309 2.382 5.434 0.128 11 0 "[ . 1 . 2]" 1
1252 1 114 GLU HA 1 117 ARG HD2 4.184 2.092 6.276 4.246 2.906 6.674 0.398 18 0 "[ . 1 . 2]" 1
1253 1 63 ALA MB 1 66 ILE MG 4.058 2.029 6.087 5.024 4.013 5.405 . 0 0 "[ . 1 . 2]" 1
1254 1 95 ALA HA 1 97 GLU H 3.918 . 5.877 4.340 3.971 4.697 . 0 0 "[ . 1 . 2]" 1
1255 1 66 ILE HG12 1 76 VAL MG2 3.898 . 5.847 5.739 4.011 6.722 0.875 7 1 "[ . + 1 . 2]" 1
1256 1 66 ILE H 1 66 ILE MG 3.898 . 5.847 3.770 3.752 3.790 . 0 0 "[ . 1 . 2]" 1
1257 1 24 VAL MG1 1 50 ILE HB 4.302 2.151 6.453 4.003 3.466 4.872 . 0 0 "[ . 1 . 2]" 1
1258 1 62 LEU HB2 1 62 LEU MD2 3.013 . 4.520 2.360 2.242 2.422 . 0 0 "[ . 1 . 2]" 1
1259 1 95 ALA HA 1 98 GLU H 3.705 . 5.557 3.489 3.269 3.932 . 0 0 "[ . 1 . 2]" 1
1260 1 73 PRO HA 1 74 VAL H 2.507 . 3.760 2.155 2.134 2.213 . 0 0 "[ . 1 . 2]" 1
1261 1 114 GLU HA 1 117 ARG HB3 2.990 . 4.485 3.008 2.250 4.361 . 0 0 "[ . 1 . 2]" 1
1262 1 34 LEU HB3 1 35 ILE H 3.847 . 5.770 2.518 2.286 2.835 . 0 0 "[ . 1 . 2]" 1
1263 1 22 ARG HD3 1 74 VAL QG 3.595 . 5.393 4.428 2.307 5.427 0.034 5 0 "[ . 1 . 2]" 1
1264 1 25 VAL MG2 1 48 GLU H 4.272 2.136 6.408 3.935 3.427 4.330 . 0 0 "[ . 1 . 2]" 1
1265 1 26 LEU QD 1 48 GLU HG2 3.753 . 5.630 5.339 4.595 6.235 0.605 10 2 "[ -. + . 2]" 1
1266 1 24 VAL H 1 76 VAL MG2 4.218 2.109 6.327 3.519 3.235 3.859 . 0 0 "[ . 1 . 2]" 1
1267 1 76 VAL H 1 76 VAL MG2 4.091 2.045 6.137 2.751 2.357 3.887 . 0 0 "[ . 1 . 2]" 1
1268 1 76 VAL HA 1 76 VAL MG2 3.275 . 4.913 2.462 2.366 2.510 . 0 0 "[ . 1 . 2]" 1
1269 1 22 ARG HA 1 23 LEU QD 4.187 2.093 6.281 3.929 2.834 5.315 . 0 0 "[ . 1 . 2]" 1
1270 1 76 VAL MG2 1 77 LEU HA 4.144 2.072 6.216 5.146 3.373 5.598 . 0 0 "[ . 1 . 2]" 1
1271 1 22 ARG HB2 1 22 ARG HD2 3.723 . 5.585 3.334 2.374 4.216 . 0 0 "[ . 1 . 2]" 1
1272 1 39 ARG HB2 1 49 LEU QD 3.759 . 5.639 2.938 2.096 4.428 . 0 0 "[ . 1 . 2]" 1
stop_
save_
save_distance_constraint_statistics_2
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 2
_Distance_constraint_stats_list.Constraint_count 50
_Distance_constraint_stats_list.Viol_count 69
_Distance_constraint_stats_list.Viol_total 28.907
_Distance_constraint_stats_list.Viol_max 0.076
_Distance_constraint_stats_list.Viol_rms 0.0070
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0014
_Distance_constraint_stats_list.Viol_average_violations_only 0.0209
_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 23 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 24 VAL 0.177 0.054 12 0 "[ . 1 . 2]"
1 25 VAL 0.262 0.040 19 0 "[ . 1 . 2]"
1 26 LEU 0.020 0.009 5 0 "[ . 1 . 2]"
1 27 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 32 LYS 0.079 0.061 18 0 "[ . 1 . 2]"
1 33 LYS 0.007 0.007 19 0 "[ . 1 . 2]"
1 34 LEU 0.022 0.022 19 0 "[ . 1 . 2]"
1 35 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 36 GLU 0.195 0.065 20 0 "[ . 1 . 2]"
1 37 GLU 0.007 0.007 19 0 "[ . 1 . 2]"
1 38 ALA 0.022 0.022 19 0 "[ . 1 . 2]"
1 39 ARG 0.084 0.036 7 0 "[ . 1 . 2]"
1 40 LYS 0.129 0.065 20 0 "[ . 1 . 2]"
1 41 MET 0.000 0.000 . 0 "[ . 1 . 2]"
1 42 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 43 GLU 0.084 0.036 7 0 "[ . 1 . 2]"
1 44 LYS 0.013 0.008 7 0 "[ . 1 . 2]"
1 48 GLU 0.226 0.040 19 0 "[ . 1 . 2]"
1 50 ILE 0.037 0.020 13 0 "[ . 1 . 2]"
1 56 PRO 0.172 0.076 6 0 "[ . 1 . 2]"
1 57 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 58 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 59 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 60 ILE 0.172 0.076 6 0 "[ . 1 . 2]"
1 61 ARG 0.000 0.000 . 0 "[ . 1 . 2]"
1 62 LEU 0.000 0.000 . 0 "[ . 1 . 2]"
1 63 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 64 GLN 0.000 0.000 . 0 "[ . 1 . 2]"
1 65 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 66 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 67 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 68 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 75 LYS 0.077 0.054 12 0 "[ . 1 . 2]"
1 76 VAL 0.100 0.039 13 0 "[ . 1 . 2]"
1 77 LEU 0.109 0.038 6 0 "[ . 1 . 2]"
1 78 VAL 0.044 0.041 3 0 "[ . 1 . 2]"
1 79 LEU 0.010 0.009 5 0 "[ . 1 . 2]"
1 80 ILE 0.083 0.053 2 0 "[ . 1 . 2]"
1 86 PRO 0.016 0.016 6 0 "[ . 1 . 2]"
1 87 ASP 0.000 0.000 . 0 "[ . 1 . 2]"
1 88 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 89 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 90 THR 0.020 0.016 6 0 "[ . 1 . 2]"
1 91 LYS 0.000 0.000 . 0 "[ . 1 . 2]"
1 92 ALA 0.044 0.044 13 0 "[ . 1 . 2]"
1 93 LYS 0.016 0.016 3 0 "[ . 1 . 2]"
1 94 LYS 0.048 0.031 19 0 "[ . 1 . 2]"
1 95 ALA 0.005 0.005 20 0 "[ . 1 . 2]"
1 96 ALA 0.044 0.044 13 0 "[ . 1 . 2]"
1 97 GLU 0.016 0.016 3 0 "[ . 1 . 2]"
1 98 GLU 0.044 0.031 19 0 "[ . 1 . 2]"
1 99 ALA 0.005 0.005 20 0 "[ . 1 . 2]"
1 103 ASN 0.100 0.039 13 0 "[ . 1 . 2]"
1 105 ARG 0.041 0.041 3 0 "[ . 1 . 2]"
1 107 ARG 0.003 0.003 1 0 "[ . 1 . 2]"
1 109 VAL 0.083 0.053 2 0 "[ . 1 . 2]"
1 112 PRO 0.029 0.029 17 0 "[ . 1 . 2]"
1 113 ASP 0.056 0.042 17 0 "[ . 1 . 2]"
1 114 GLU 0.002 0.002 7 0 "[ . 1 . 2]"
1 115 ALA 0.000 0.000 . 0 "[ . 1 . 2]"
1 116 LYS 0.080 0.029 17 0 "[ . 1 . 2]"
1 117 ARG 0.056 0.042 17 0 "[ . 1 . 2]"
1 118 TRP 0.002 0.002 7 0 "[ . 1 . 2]"
1 119 ILE 0.000 0.000 . 0 "[ . 1 . 2]"
1 120 LYS 0.050 0.017 2 0 "[ . 1 . 2]"
1 121 GLU 0.000 0.000 . 0 "[ . 1 . 2]"
1 122 PHE 0.000 0.000 . 0 "[ . 1 . 2]"
1 123 SER 0.000 0.000 . 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 32 LYS O 1 36 GLU H 2.200 . 2.700 2.144 1.712 2.761 0.061 18 0 "[ . 1 . 2]" 2
2 1 33 LYS O 1 37 GLU H 2.200 . 2.700 2.164 1.760 2.707 0.007 19 0 "[ . 1 . 2]" 2
3 1 34 LEU O 1 38 ALA H 2.200 . 2.700 2.035 1.732 2.722 0.022 19 0 "[ . 1 . 2]" 2
4 1 35 ILE O 1 39 ARG H 2.200 . 2.700 2.024 1.756 2.575 . 0 0 "[ . 1 . 2]" 2
5 1 36 GLU O 1 40 LYS H 2.200 . 2.700 1.868 1.665 2.155 0.065 20 0 "[ . 1 . 2]" 2
6 1 37 GLU O 1 41 MET H 2.200 . 2.700 2.188 1.890 2.542 . 0 0 "[ . 1 . 2]" 2
7 1 38 ALA O 1 42 ALA H 2.200 . 2.700 2.080 1.870 2.534 . 0 0 "[ . 1 . 2]" 2
8 1 39 ARG O 1 43 GLU H 2.200 . 2.700 1.903 1.703 2.736 0.036 7 0 "[ . 1 . 2]" 2
9 1 40 LYS O 1 44 LYS H 2.200 . 2.700 2.243 1.870 2.708 0.008 7 0 "[ . 1 . 2]" 2
10 1 56 PRO O 1 60 ILE H 2.200 . 2.700 2.454 1.872 2.776 0.076 6 0 "[ . 1 . 2]" 2
11 1 57 GLU O 1 61 ARG H 2.200 . 2.700 2.073 1.777 2.662 . 0 0 "[ . 1 . 2]" 2
12 1 58 GLU O 1 62 LEU H 2.200 . 2.700 2.098 1.825 2.461 . 0 0 "[ . 1 . 2]" 2
13 1 59 ALA O 1 63 ALA H 2.200 . 2.700 1.983 1.743 2.278 . 0 0 "[ . 1 . 2]" 2
14 1 60 ILE O 1 64 GLN H 2.200 . 2.700 2.043 1.744 2.677 . 0 0 "[ . 1 . 2]" 2
15 1 61 ARG O 1 65 GLU H 2.200 . 2.700 2.295 1.914 2.688 . 0 0 "[ . 1 . 2]" 2
16 1 62 LEU O 1 66 ILE H 2.200 . 2.700 1.957 1.756 2.271 . 0 0 "[ . 1 . 2]" 2
17 1 63 ALA O 1 67 ALA H 2.200 . 2.700 1.947 1.732 2.186 . 0 0 "[ . 1 . 2]" 2
18 1 64 GLN O 1 68 GLU H 2.200 . 2.700 2.143 1.771 2.661 . 0 0 "[ . 1 . 2]" 2
19 1 86 PRO O 1 90 THR H 2.200 . 2.700 2.166 1.923 2.716 0.016 6 0 "[ . 1 . 2]" 2
20 1 87 ASP O 1 91 LYS H 2.200 . 2.700 2.067 1.781 2.660 . 0 0 "[ . 1 . 2]" 2
21 1 88 GLU O 1 92 ALA H 2.200 . 2.700 1.932 1.731 2.055 . 0 0 "[ . 1 . 2]" 2
22 1 89 LYS O 1 93 LYS H 2.200 . 2.700 2.069 1.818 2.500 . 0 0 "[ . 1 . 2]" 2
23 1 90 THR O 1 94 LYS H 2.200 . 2.700 2.099 1.868 2.704 0.004 3 0 "[ . 1 . 2]" 2
24 1 91 LYS O 1 95 ALA H 2.200 . 2.700 2.091 1.744 2.577 . 0 0 "[ . 1 . 2]" 2
25 1 92 ALA O 1 96 ALA H 2.200 . 2.700 1.966 1.731 2.744 0.044 13 0 "[ . 1 . 2]" 2
26 1 93 LYS O 1 97 GLU H 2.200 . 2.700 2.267 1.818 2.716 0.016 3 0 "[ . 1 . 2]" 2
27 1 94 LYS O 1 98 GLU H 2.200 . 2.700 2.359 2.099 2.731 0.031 19 0 "[ . 1 . 2]" 2
28 1 95 ALA O 1 99 ALA H 2.200 . 2.700 1.883 1.725 2.219 0.005 20 0 "[ . 1 . 2]" 2
29 1 112 PRO O 1 116 LYS H 2.200 . 2.700 2.118 1.828 2.729 0.029 17 0 "[ . 1 . 2]" 2
30 1 113 ASP O 1 117 ARG H 2.200 . 2.700 2.311 1.827 2.742 0.042 17 0 "[ . 1 . 2]" 2
31 1 114 GLU O 1 118 TRP H 2.200 . 2.700 1.968 1.728 2.515 0.002 7 0 "[ . 1 . 2]" 2
32 1 115 ALA O 1 119 ILE H 2.200 . 2.700 2.047 1.823 2.612 . 0 0 "[ . 1 . 2]" 2
33 1 116 LYS O 1 120 LYS H 2.200 . 2.700 2.333 2.008 2.717 0.017 2 0 "[ . 1 . 2]" 2
34 1 117 ARG O 1 121 GLU H 2.200 . 2.700 2.024 1.765 2.483 . 0 0 "[ . 1 . 2]" 2
35 1 118 TRP O 1 122 PHE H 2.200 . 2.700 2.017 1.741 2.270 . 0 0 "[ . 1 . 2]" 2
36 1 119 ILE O 1 123 SER H 2.200 . 2.700 2.158 1.852 2.642 . 0 0 "[ . 1 . 2]" 2
37 1 23 LEU O 1 48 GLU H 2.200 . 2.700 1.985 1.773 2.435 . 0 0 "[ . 1 . 2]" 2
38 1 25 VAL H 1 48 GLU O 2.200 . 2.700 1.772 1.690 1.943 0.040 19 0 "[ . 1 . 2]" 2
39 1 25 VAL O 1 50 ILE H 2.200 . 2.700 1.866 1.710 2.175 0.020 13 0 "[ . 1 . 2]" 2
40 1 27 ILE H 1 50 ILE O 2.200 . 2.700 2.141 1.862 2.572 . 0 0 "[ . 1 . 2]" 2
41 1 24 VAL H 1 75 LYS O 2.200 . 2.700 1.975 1.676 2.385 0.054 12 0 "[ . 1 . 2]" 2
42 1 24 VAL O 1 77 LEU H 2.200 . 2.700 1.814 1.692 2.270 0.038 6 0 "[ . 1 . 2]" 2
43 1 26 LEU H 1 77 LEU O 2.200 . 2.700 1.923 1.724 2.187 0.006 3 0 "[ . 1 . 2]" 2
44 1 26 LEU O 1 79 LEU H 2.200 . 2.700 1.845 1.721 2.371 0.009 5 0 "[ . 1 . 2]" 2
45 1 76 VAL H 1 103 ASN O 2.200 . 2.700 2.365 1.897 2.739 0.039 13 0 "[ . 1 . 2]" 2
46 1 76 VAL O 1 105 ARG H 2.200 . 2.700 1.949 1.771 2.337 . 0 0 "[ . 1 . 2]" 2
47 1 78 VAL H 1 105 ARG O 2.200 . 2.700 1.846 1.689 2.248 0.041 3 0 "[ . 1 . 2]" 2
48 1 78 VAL O 1 107 ARG H 2.200 . 2.700 1.891 1.727 2.135 0.003 1 0 "[ . 1 . 2]" 2
49 1 80 ILE H 1 107 ARG O 2.200 . 2.700 2.004 1.802 2.217 . 0 0 "[ . 1 . 2]" 2
50 1 80 ILE O 1 109 VAL H 2.200 . 2.700 1.799 1.677 2.046 0.053 2 0 "[ . 1 . 2]" 2
stop_
save_
Contact the webmaster for help, if required. Saturday, May 18, 2024 6:55:21 PM GMT (wattos1)